USER MOD reduce.3.24.130724 H: found=0, std=0, add=222, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 222 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 180:sc= 0 USER MOD Single : A 12 DT C7 :methyl -30:sc= -0.646 (180deg=-0.945) USER MOD Single : A 20 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 5.153 7.996 -8.164 1.00 0.42 O ATOM 2 C5' DA A 1 4.723 7.337 -6.971 1.00 0.30 C ATOM 3 C4' DA A 1 3.512 6.445 -7.234 1.00 0.23 C ATOM 4 O4' DA A 1 3.046 5.896 -5.998 1.00 0.21 O ATOM 5 C3' DA A 1 2.322 7.166 -7.885 1.00 0.28 C ATOM 6 O3' DA A 1 1.938 6.472 -9.079 1.00 0.30 O ATOM 7 C2' DA A 1 1.200 7.074 -6.853 1.00 0.27 C ATOM 8 C1' DA A 1 1.624 5.867 -6.034 1.00 0.22 C ATOM 9 N9 DA A 1 1.135 5.880 -4.646 1.00 0.24 N ATOM 10 C8 DA A 1 1.720 5.345 -3.534 1.00 0.23 C ATOM 11 N7 DA A 1 1.040 5.529 -2.440 1.00 0.28 N ATOM 12 C5 DA A 1 -0.080 6.238 -2.854 1.00 0.39 C ATOM 13 C6 DA A 1 -1.195 6.742 -2.162 1.00 0.55 C ATOM 14 N6 DA A 1 -1.367 6.606 -0.844 1.00 0.58 N ATOM 15 N1 DA A 1 -2.121 7.395 -2.886 1.00 0.71 N ATOM 16 C2 DA A 1 -1.943 7.531 -4.196 1.00 0.69 C ATOM 17 N3 DA A 1 -0.942 7.107 -4.953 1.00 0.54 N ATOM 18 C4 DA A 1 -0.031 6.456 -4.201 1.00 0.38 C ATOM 0 H5' DA A 1 4.472 8.079 -6.213 1.00 0.30 H new ATOM 0 H5'' DA A 1 5.540 6.736 -6.571 1.00 0.30 H new ATOM 0 H4' DA A 1 3.862 5.683 -7.931 1.00 0.23 H new ATOM 0 H3' DA A 1 2.554 8.196 -8.156 1.00 0.28 H new ATOM 0 H2' DA A 1 1.130 7.976 -6.245 1.00 0.27 H new ATOM 0 H2'' DA A 1 0.226 6.928 -7.321 1.00 0.27 H new ATOM 0 HO5' DA A 1 5.928 8.561 -7.964 1.00 0.42 H new ATOM 0 H1' DA A 1 1.204 4.975 -6.499 1.00 0.22 H new ATOM 0 H8 DA A 1 2.662 4.817 -3.560 1.00 0.23 H new ATOM 0 H61 DA A 1 -2.197 6.993 -0.395 1.00 0.58 H new ATOM 0 H62 DA A 1 -0.668 6.115 -0.286 1.00 0.58 H new ATOM 0 H2 DA A 1 -2.725 8.063 -4.717 1.00 0.69 H new ATOM 31 P DG A 2 1.698 4.879 -9.059 1.00 0.26 P ATOM 32 OP1 DG A 2 0.251 4.625 -8.879 1.00 0.33 O ATOM 33 OP2 DG A 2 2.671 4.282 -8.128 1.00 0.23 O ATOM 34 O5' DG A 2 2.103 4.438 -10.552 1.00 0.26 O ATOM 35 C5' DG A 2 3.411 4.714 -11.061 1.00 0.23 C ATOM 36 C4' DG A 2 4.442 3.681 -10.605 1.00 0.20 C ATOM 37 O4' DG A 2 4.594 3.721 -9.177 1.00 0.18 O ATOM 38 C3' DG A 2 4.092 2.232 -10.973 1.00 0.23 C ATOM 39 O3' DG A 2 5.230 1.632 -11.610 1.00 0.27 O ATOM 40 C2' DG A 2 3.819 1.561 -9.629 1.00 0.22 C ATOM 41 C1' DG A 2 4.714 2.376 -8.720 1.00 0.17 C ATOM 42 N9 DG A 2 4.376 2.336 -7.275 1.00 0.16 N ATOM 43 C8 DG A 2 5.242 2.353 -6.218 1.00 0.14 C ATOM 44 N7 DG A 2 4.665 2.317 -5.050 1.00 0.15 N ATOM 45 C5 DG A 2 3.308 2.273 -5.349 1.00 0.16 C ATOM 46 C6 DG A 2 2.186 2.225 -4.475 1.00 0.18 C ATOM 47 O6 DG A 2 2.175 2.211 -3.247 1.00 0.20 O ATOM 48 N1 DG A 2 0.993 2.196 -5.181 1.00 0.20 N ATOM 49 C2 DG A 2 0.885 2.209 -6.553 1.00 0.21 C ATOM 50 N2 DG A 2 -0.350 2.182 -7.049 1.00 0.26 N ATOM 51 N3 DG A 2 1.936 2.250 -7.375 1.00 0.19 N ATOM 52 C4 DG A 2 3.114 2.282 -6.709 1.00 0.16 C ATOM 0 H5' DG A 2 3.724 5.705 -10.733 1.00 0.23 H new ATOM 0 H5'' DG A 2 3.378 4.734 -12.150 1.00 0.23 H new ATOM 0 H4' DG A 2 5.357 3.957 -11.129 1.00 0.20 H new ATOM 0 H3' DG A 2 3.245 2.145 -11.653 1.00 0.23 H new ATOM 0 H2' DG A 2 2.770 1.624 -9.341 1.00 0.22 H new ATOM 0 H2'' DG A 2 4.086 0.504 -9.633 1.00 0.22 H new ATOM 0 H1' DG A 2 5.718 1.956 -8.778 1.00 0.17 H new ATOM 0 H8 DG A 2 6.314 2.393 -6.340 1.00 0.14 H new ATOM 0 H1 DG A 2 0.128 2.162 -4.642 1.00 0.20 H new ATOM 0 H21 DG A 2 -0.494 2.190 -8.059 1.00 0.26 H new ATOM 0 H22 DG A 2 -1.152 2.153 -6.419 1.00 0.26 H new ATOM 64 P DG A 3 5.275 0.058 -11.946 1.00 0.32 P ATOM 65 OP1 DG A 3 6.033 -0.126 -13.204 1.00 0.44 O ATOM 66 OP2 DG A 3 3.903 -0.484 -11.828 1.00 0.39 O ATOM 67 O5' DG A 3 6.161 -0.530 -10.737 1.00 0.26 O ATOM 68 C5' DG A 3 7.543 -0.178 -10.606 1.00 0.23 C ATOM 69 C4' DG A 3 8.171 -0.835 -9.382 1.00 0.18 C ATOM 70 O4' DG A 3 7.346 -0.584 -8.238 1.00 0.13 O ATOM 71 C3' DG A 3 8.331 -2.348 -9.510 1.00 0.15 C ATOM 72 O3' DG A 3 9.597 -2.743 -8.971 1.00 0.18 O ATOM 73 C2' DG A 3 7.204 -2.920 -8.664 1.00 0.15 C ATOM 74 C1' DG A 3 6.993 -1.828 -7.626 1.00 0.14 C ATOM 75 N9 DG A 3 5.597 -1.714 -7.161 1.00 0.13 N ATOM 76 C8 DG A 3 4.463 -1.521 -7.907 1.00 0.15 C ATOM 77 N7 DG A 3 3.369 -1.468 -7.203 1.00 0.16 N ATOM 78 C5 DG A 3 3.805 -1.639 -5.893 1.00 0.14 C ATOM 79 C6 DG A 3 3.058 -1.672 -4.683 1.00 0.15 C ATOM 80 O6 DG A 3 1.844 -1.554 -4.533 1.00 0.17 O ATOM 81 N1 DG A 3 3.881 -1.866 -3.583 1.00 0.16 N ATOM 82 C2 DG A 3 5.252 -2.011 -3.636 1.00 0.17 C ATOM 83 N2 DG A 3 5.872 -2.190 -2.469 1.00 0.20 N ATOM 84 N3 DG A 3 5.956 -1.979 -4.772 1.00 0.16 N ATOM 85 C4 DG A 3 5.169 -1.791 -5.856 1.00 0.14 C ATOM 0 H5' DG A 3 7.638 0.905 -10.529 1.00 0.23 H new ATOM 0 H5'' DG A 3 8.084 -0.482 -11.502 1.00 0.23 H new ATOM 0 H4' DG A 3 9.166 -0.401 -9.283 1.00 0.18 H new ATOM 0 H3' DG A 3 8.292 -2.693 -10.543 1.00 0.15 H new ATOM 0 H2' DG A 3 6.305 -3.101 -9.253 1.00 0.15 H new ATOM 0 H2'' DG A 3 7.481 -3.869 -8.205 1.00 0.15 H new ATOM 0 H1' DG A 3 7.604 -2.078 -6.759 1.00 0.14 H new ATOM 0 H8 DG A 3 4.476 -1.422 -8.982 1.00 0.15 H new ATOM 0 H1 DG A 3 3.439 -1.904 -2.665 1.00 0.16 H new ATOM 0 H21 DG A 3 6.885 -2.303 -2.442 1.00 0.20 H new ATOM 0 H22 DG A 3 5.333 -2.213 -1.603 1.00 0.20 H new ATOM 97 P DG A 4 10.075 -4.278 -9.054 1.00 0.19 P ATOM 98 OP1 DG A 4 11.521 -4.299 -9.370 1.00 0.25 O ATOM 99 OP2 DG A 4 9.122 -5.012 -9.915 1.00 0.19 O ATOM 100 O5' DG A 4 9.882 -4.787 -7.540 1.00 0.20 O ATOM 101 C5' DG A 4 10.729 -4.295 -6.499 1.00 0.21 C ATOM 102 C4' DG A 4 10.308 -4.834 -5.136 1.00 0.19 C ATOM 103 O4' DG A 4 8.962 -4.438 -4.860 1.00 0.23 O ATOM 104 C3' DG A 4 10.365 -6.361 -5.029 1.00 0.20 C ATOM 105 O3' DG A 4 11.056 -6.725 -3.828 1.00 0.19 O ATOM 106 C2' DG A 4 8.905 -6.790 -4.940 1.00 0.21 C ATOM 107 C1' DG A 4 8.264 -5.558 -4.327 1.00 0.17 C ATOM 108 N9 DG A 4 6.833 -5.392 -4.647 1.00 0.18 N ATOM 109 C8 DG A 4 6.245 -5.152 -5.861 1.00 0.26 C ATOM 110 N7 DG A 4 4.947 -5.040 -5.808 1.00 0.28 N ATOM 111 C5 DG A 4 4.651 -5.222 -4.461 1.00 0.19 C ATOM 112 C6 DG A 4 3.394 -5.211 -3.794 1.00 0.17 C ATOM 113 O6 DG A 4 2.278 -5.032 -4.275 1.00 0.22 O ATOM 114 N1 DG A 4 3.540 -5.435 -2.431 1.00 0.13 N ATOM 115 C2 DG A 4 4.743 -5.645 -1.788 1.00 0.11 C ATOM 116 N2 DG A 4 4.688 -5.845 -0.472 1.00 0.17 N ATOM 117 N3 DG A 4 5.923 -5.656 -2.414 1.00 0.11 N ATOM 118 C4 DG A 4 5.800 -5.439 -3.743 1.00 0.14 C ATOM 0 H5' DG A 4 10.697 -3.206 -6.487 1.00 0.21 H new ATOM 0 H5'' DG A 4 11.761 -4.581 -6.702 1.00 0.21 H new ATOM 0 H4' DG A 4 11.019 -4.419 -4.422 1.00 0.19 H new ATOM 0 H3' DG A 4 10.884 -6.828 -5.866 1.00 0.20 H new ATOM 0 H2' DG A 4 8.487 -7.026 -5.918 1.00 0.21 H new ATOM 0 H2'' DG A 4 8.775 -7.674 -4.316 1.00 0.21 H new ATOM 0 H1' DG A 4 8.326 -5.654 -3.243 1.00 0.17 H new ATOM 0 H8 DG A 4 6.806 -5.064 -6.779 1.00 0.26 H new ATOM 0 H1 DG A 4 2.694 -5.445 -1.862 1.00 0.13 H new ATOM 0 H21 DG A 4 5.546 -6.006 0.056 1.00 0.17 H new ATOM 0 H22 DG A 4 3.788 -5.838 0.008 1.00 0.17 H new ATOM 130 P DI A 5 11.221 -8.270 -3.407 1.00 0.21 P ATOM 131 OP1 DI A 5 12.267 -8.358 -2.365 1.00 0.24 O ATOM 132 OP2 DI A 5 11.338 -9.077 -4.642 1.00 0.25 O ATOM 133 O5' DI A 5 9.801 -8.599 -2.725 1.00 0.20 O ATOM 134 C5' DI A 5 9.348 -7.844 -1.598 1.00 0.15 C ATOM 135 C4' DI A 5 7.861 -8.067 -1.339 1.00 0.16 C ATOM 136 O4' DI A 5 7.129 -7.820 -2.540 1.00 0.18 O ATOM 137 C3' DI A 5 7.519 -9.485 -0.875 1.00 0.17 C ATOM 138 O3' DI A 5 6.772 -9.416 0.344 1.00 0.21 O ATOM 139 C2' DI A 5 6.648 -10.062 -1.988 1.00 0.16 C ATOM 140 C1' DI A 5 6.114 -8.810 -2.662 1.00 0.16 C ATOM 141 N9 DI A 5 5.822 -8.978 -4.098 1.00 0.14 N ATOM 142 C8 DI A 5 6.586 -9.584 -5.062 1.00 0.17 C ATOM 143 N7 DI A 5 6.051 -9.566 -6.250 1.00 0.20 N ATOM 144 C5 DI A 5 4.844 -8.900 -6.065 1.00 0.22 C ATOM 145 C6 DI A 5 3.830 -8.579 -7.006 1.00 0.33 C ATOM 146 O6 DI A 5 3.797 -8.825 -8.210 1.00 0.40 O ATOM 147 N1 DI A 5 2.781 -7.904 -6.403 1.00 0.36 N ATOM 148 C2 DI A 5 2.724 -7.583 -5.065 1.00 0.32 C ATOM 149 N3 DI A 5 3.658 -7.873 -4.175 1.00 0.24 N ATOM 150 C4 DI A 5 4.694 -8.535 -4.749 1.00 0.19 C ATOM 0 H5'' DI A 5 9.919 -8.128 -0.714 1.00 0.15 H new ATOM 0 H2'' DI A 5 7.224 -10.680 -2.676 1.00 0.16 H new ATOM 0 H8 DI A 5 7.554 -10.040 -4.853 1.00 0.17 H new ATOM 0 H5' DI A 5 9.534 -6.784 -1.770 1.00 0.15 H new ATOM 0 H4' DI A 5 7.591 -7.379 -0.538 1.00 0.16 H new ATOM 0 H3' DI A 5 8.405 -10.093 -0.691 1.00 0.17 H new ATOM 0 H2' DI A 5 5.846 -10.686 -1.595 1.00 0.16 H new ATOM 0 H2 DI A 5 1.841 -7.049 -4.713 1.00 0.32 H new ATOM 0 H1' DI A 5 5.173 -8.547 -2.180 1.00 0.16 H new ATOM 0 H1 DI A 5 1.996 -7.625 -6.991 1.00 0.36 H new ATOM 161 P DA A 6 6.058 -10.728 0.946 1.00 0.23 P ATOM 162 OP1 DA A 6 5.971 -10.575 2.416 1.00 0.31 O ATOM 163 OP2 DA A 6 6.714 -11.921 0.365 1.00 0.32 O ATOM 164 O5' DA A 6 4.571 -10.624 0.340 1.00 0.24 O ATOM 165 C5' DA A 6 3.709 -9.550 0.723 1.00 0.23 C ATOM 166 C4' DA A 6 2.490 -9.455 -0.188 1.00 0.31 C ATOM 167 O4' DA A 6 2.914 -9.410 -1.555 1.00 0.33 O ATOM 168 C3' DA A 6 1.529 -10.628 -0.063 1.00 0.34 C ATOM 169 O3' DA A 6 0.510 -10.305 0.890 1.00 0.43 O ATOM 170 C2' DA A 6 0.931 -10.741 -1.455 1.00 0.40 C ATOM 171 C1' DA A 6 2.085 -10.279 -2.340 1.00 0.33 C ATOM 172 N9 DA A 6 2.937 -11.375 -2.845 1.00 0.27 N ATOM 173 C8 DA A 6 3.633 -12.323 -2.140 1.00 0.27 C ATOM 174 N7 DA A 6 4.303 -13.154 -2.891 1.00 0.26 N ATOM 175 C5 DA A 6 4.032 -12.723 -4.186 1.00 0.22 C ATOM 176 C6 DA A 6 4.444 -13.188 -5.447 1.00 0.23 C ATOM 177 N6 DA A 6 5.253 -14.235 -5.610 1.00 0.28 N ATOM 178 N1 DA A 6 3.988 -12.529 -6.526 1.00 0.28 N ATOM 179 C2 DA A 6 3.182 -11.488 -6.355 1.00 0.34 C ATOM 180 N3 DA A 6 2.726 -10.959 -5.230 1.00 0.34 N ATOM 181 C4 DA A 6 3.200 -11.640 -4.167 1.00 0.26 C ATOM 0 H5' DA A 6 4.261 -8.611 0.692 1.00 0.23 H new ATOM 0 H5'' DA A 6 3.383 -9.694 1.753 1.00 0.23 H new ATOM 0 H4' DA A 6 1.967 -8.551 0.122 1.00 0.31 H new ATOM 0 H3' DA A 6 2.003 -11.551 0.270 1.00 0.34 H new ATOM 0 H2' DA A 6 0.625 -11.762 -1.685 1.00 0.40 H new ATOM 0 H2'' DA A 6 0.050 -10.110 -1.572 1.00 0.40 H new ATOM 0 H1' DA A 6 1.644 -9.793 -3.210 1.00 0.33 H new ATOM 0 H8 DA A 6 3.627 -12.377 -1.061 1.00 0.27 H new ATOM 0 H61 DA A 6 5.521 -14.531 -6.549 1.00 0.28 H new ATOM 0 H62 DA A 6 5.604 -14.740 -4.796 1.00 0.28 H new ATOM 0 H2 DA A 6 2.851 -11.004 -7.262 1.00 0.34 H new ATOM 193 P DG A 7 -1.008 -10.789 0.667 1.00 0.34 P ATOM 194 OP1 DG A 7 -1.730 -10.660 1.952 1.00 0.46 O ATOM 195 OP2 DG A 7 -0.982 -12.090 -0.038 1.00 0.44 O ATOM 196 O5' DG A 7 -1.583 -9.679 -0.346 1.00 0.29 O ATOM 197 C5' DG A 7 -1.832 -8.343 0.099 1.00 0.23 C ATOM 198 C4' DG A 7 -3.326 -8.046 0.150 1.00 0.23 C ATOM 199 O4' DG A 7 -3.915 -8.373 -1.102 1.00 0.23 O ATOM 200 C3' DG A 7 -4.088 -8.857 1.186 1.00 0.29 C ATOM 201 O3' DG A 7 -4.093 -8.186 2.458 1.00 0.30 O ATOM 202 C2' DG A 7 -5.504 -8.892 0.624 1.00 0.34 C ATOM 203 C1' DG A 7 -5.289 -8.713 -0.888 1.00 0.30 C ATOM 204 N9 DG A 7 -5.573 -9.923 -1.680 1.00 0.35 N ATOM 205 C8 DG A 7 -4.816 -11.059 -1.813 1.00 0.38 C ATOM 206 N7 DG A 7 -5.342 -11.956 -2.596 1.00 0.44 N ATOM 207 C5 DG A 7 -6.536 -11.377 -3.016 1.00 0.51 C ATOM 208 C6 DG A 7 -7.538 -11.885 -3.885 1.00 0.66 C ATOM 209 O6 DG A 7 -7.567 -12.968 -4.466 1.00 0.71 O ATOM 210 N1 DG A 7 -8.581 -10.981 -4.045 1.00 0.78 N ATOM 211 C2 DG A 7 -8.651 -9.742 -3.444 1.00 0.75 C ATOM 212 N2 DG A 7 -9.733 -9.013 -3.718 1.00 0.92 N ATOM 213 N3 DG A 7 -7.709 -9.262 -2.626 1.00 0.59 N ATOM 214 C4 DG A 7 -6.685 -10.131 -2.459 1.00 0.47 C ATOM 0 H5' DG A 7 -1.341 -7.637 -0.571 1.00 0.23 H new ATOM 0 H5'' DG A 7 -1.397 -8.200 1.088 1.00 0.23 H new ATOM 0 H4' DG A 7 -3.397 -6.989 0.407 1.00 0.23 H new ATOM 0 H3' DG A 7 -3.653 -9.842 1.353 1.00 0.29 H new ATOM 0 H2' DG A 7 -6.004 -9.834 0.851 1.00 0.34 H new ATOM 0 H2'' DG A 7 -6.122 -8.096 1.040 1.00 0.34 H new ATOM 0 H1' DG A 7 -5.983 -7.939 -1.216 1.00 0.30 H new ATOM 0 H8 DG A 7 -3.869 -11.197 -1.313 1.00 0.38 H new ATOM 0 H1 DG A 7 -9.353 -11.255 -4.653 1.00 0.78 H new ATOM 0 H21 DG A 7 -9.843 -8.087 -3.304 1.00 0.92 H new ATOM 0 H22 DG A 7 -10.451 -9.381 -4.342 1.00 0.92 H new ATOM 226 P DG A 8 -3.096 -6.958 2.773 1.00 0.27 P ATOM 227 OP1 DG A 8 -3.667 -5.736 2.168 1.00 0.27 O ATOM 228 OP2 DG A 8 -1.719 -7.375 2.435 1.00 0.25 O ATOM 229 O5' DG A 8 -3.206 -6.812 4.373 1.00 0.32 O ATOM 230 C5' DG A 8 -2.333 -7.540 5.240 1.00 0.30 C ATOM 231 C4' DG A 8 -0.955 -6.889 5.338 1.00 0.25 C ATOM 232 O4' DG A 8 -0.221 -7.107 4.126 1.00 0.24 O ATOM 233 C3' DG A 8 -0.997 -5.370 5.568 1.00 0.25 C ATOM 234 O3' DG A 8 -0.160 -5.032 6.678 1.00 0.27 O ATOM 235 C2' DG A 8 -0.414 -4.774 4.289 1.00 0.22 C ATOM 236 C1' DG A 8 0.484 -5.906 3.826 1.00 0.22 C ATOM 237 N9 DG A 8 0.815 -5.908 2.383 1.00 0.22 N ATOM 238 C8 DG A 8 2.023 -6.186 1.800 1.00 0.27 C ATOM 239 N7 DG A 8 2.017 -6.107 0.501 1.00 0.27 N ATOM 240 C5 DG A 8 0.712 -5.750 0.191 1.00 0.22 C ATOM 241 C6 DG A 8 0.117 -5.519 -1.077 1.00 0.21 C ATOM 242 O6 DG A 8 0.642 -5.579 -2.187 1.00 0.23 O ATOM 243 N1 DG A 8 -1.224 -5.181 -0.956 1.00 0.18 N ATOM 244 C2 DG A 8 -1.906 -5.073 0.234 1.00 0.18 C ATOM 245 N2 DG A 8 -3.190 -4.728 0.142 1.00 0.21 N ATOM 246 N3 DG A 8 -1.349 -5.290 1.431 1.00 0.17 N ATOM 247 C4 DG A 8 -0.039 -5.624 1.334 1.00 0.20 C ATOM 0 H5' DG A 8 -2.227 -8.561 4.874 1.00 0.30 H new ATOM 0 H5'' DG A 8 -2.777 -7.602 6.234 1.00 0.30 H new ATOM 0 H4' DG A 8 -0.480 -7.355 6.202 1.00 0.25 H new ATOM 0 H3' DG A 8 -2.001 -5.005 5.782 1.00 0.25 H new ATOM 0 H2' DG A 8 -1.185 -4.534 3.557 1.00 0.22 H new ATOM 0 H2'' DG A 8 0.143 -3.856 4.478 1.00 0.22 H new ATOM 0 H1' DG A 8 1.442 -5.797 4.335 1.00 0.22 H new ATOM 0 H8 DG A 8 2.903 -6.448 2.368 1.00 0.27 H new ATOM 0 H1 DG A 8 -1.743 -4.999 -1.815 1.00 0.18 H new ATOM 0 H21 DG A 8 -3.754 -4.630 0.987 1.00 0.21 H new ATOM 0 H22 DG A 8 -3.609 -4.562 -0.773 1.00 0.21 H new ATOM 259 P DG A 9 0.391 -3.529 6.855 1.00 0.25 P ATOM 260 OP1 DG A 9 0.773 -3.340 8.272 1.00 0.26 O ATOM 261 OP2 DG A 9 -0.575 -2.605 6.220 1.00 0.28 O ATOM 262 O5' DG A 9 1.737 -3.538 5.967 1.00 0.22 O ATOM 263 C5' DG A 9 2.885 -4.269 6.404 1.00 0.23 C ATOM 264 C4' DG A 9 4.177 -3.699 5.824 1.00 0.21 C ATOM 265 O4' DG A 9 4.220 -3.916 4.409 1.00 0.19 O ATOM 266 C3' DG A 9 4.348 -2.191 6.053 1.00 0.20 C ATOM 267 O3' DG A 9 5.591 -1.949 6.724 1.00 0.22 O ATOM 268 C2' DG A 9 4.392 -1.586 4.651 1.00 0.15 C ATOM 269 C1' DG A 9 4.824 -2.773 3.810 1.00 0.15 C ATOM 270 N9 DG A 9 4.395 -2.707 2.400 1.00 0.16 N ATOM 271 C8 DG A 9 5.168 -2.741 1.270 1.00 0.21 C ATOM 272 N7 DG A 9 4.492 -2.631 0.161 1.00 0.23 N ATOM 273 C5 DG A 9 3.173 -2.518 0.584 1.00 0.20 C ATOM 274 C6 DG A 9 1.983 -2.370 -0.179 1.00 0.24 C ATOM 275 O6 DG A 9 1.865 -2.307 -1.402 1.00 0.30 O ATOM 276 N1 DG A 9 0.862 -2.292 0.635 1.00 0.22 N ATOM 277 C2 DG A 9 0.878 -2.348 2.013 1.00 0.17 C ATOM 278 N2 DG A 9 -0.304 -2.257 2.622 1.00 0.20 N ATOM 279 N3 DG A 9 1.997 -2.485 2.733 1.00 0.13 N ATOM 280 C4 DG A 9 3.101 -2.563 1.955 1.00 0.15 C ATOM 0 H5' DG A 9 2.784 -5.313 6.109 1.00 0.23 H new ATOM 0 H5'' DG A 9 2.936 -4.249 7.493 1.00 0.23 H new ATOM 0 H4' DG A 9 4.979 -4.220 6.346 1.00 0.21 H new ATOM 0 H3' DG A 9 3.550 -1.766 6.662 1.00 0.20 H new ATOM 0 H2' DG A 9 3.421 -1.199 4.343 1.00 0.15 H new ATOM 0 H2'' DG A 9 5.100 -0.760 4.585 1.00 0.15 H new ATOM 0 H1' DG A 9 5.913 -2.800 3.789 1.00 0.15 H new ATOM 0 H8 DG A 9 6.242 -2.849 1.296 1.00 0.21 H new ATOM 0 H1 DG A 9 -0.044 -2.185 0.179 1.00 0.22 H new ATOM 0 H21 DG A 9 -0.357 -2.292 3.640 1.00 0.20 H new ATOM 0 H22 DG A 9 -1.155 -2.152 2.070 1.00 0.20 H new ATOM 292 P DG A 10 6.050 -0.445 7.074 1.00 0.21 P ATOM 293 OP1 DG A 10 7.092 -0.511 8.123 1.00 0.24 O ATOM 294 OP2 DG A 10 4.836 0.371 7.292 1.00 0.24 O ATOM 295 O5' DG A 10 6.744 0.041 5.705 1.00 0.20 O ATOM 296 C5' DG A 10 8.024 -0.468 5.318 1.00 0.21 C ATOM 297 C4' DG A 10 8.578 0.278 4.106 1.00 0.17 C ATOM 298 O4' DG A 10 7.679 0.127 3.002 1.00 0.18 O ATOM 299 C3' DG A 10 8.765 1.778 4.341 1.00 0.17 C ATOM 300 O3' DG A 10 10.005 2.205 3.770 1.00 0.18 O ATOM 301 C2' DG A 10 7.605 2.415 3.592 1.00 0.16 C ATOM 302 C1' DG A 10 7.386 1.417 2.467 1.00 0.15 C ATOM 303 N9 DG A 10 6.004 1.389 1.957 1.00 0.15 N ATOM 304 C8 DG A 10 4.834 1.321 2.667 1.00 0.17 C ATOM 305 N7 DG A 10 3.764 1.322 1.925 1.00 0.19 N ATOM 306 C5 DG A 10 4.256 1.398 0.627 1.00 0.16 C ATOM 307 C6 DG A 10 3.558 1.435 -0.608 1.00 0.16 C ATOM 308 O6 DG A 10 2.344 1.410 -0.799 1.00 0.19 O ATOM 309 N1 DG A 10 4.431 1.512 -1.683 1.00 0.14 N ATOM 310 C2 DG A 10 5.805 1.550 -1.587 1.00 0.14 C ATOM 311 N2 DG A 10 6.474 1.628 -2.738 1.00 0.16 N ATOM 312 N3 DG A 10 6.466 1.514 -0.425 1.00 0.14 N ATOM 313 C4 DG A 10 5.628 1.439 0.636 1.00 0.14 C ATOM 0 H5' DG A 10 7.940 -1.530 5.086 1.00 0.21 H new ATOM 0 H5'' DG A 10 8.720 -0.378 6.152 1.00 0.21 H new ATOM 0 H4' DG A 10 9.557 -0.158 3.907 1.00 0.17 H new ATOM 0 H3' DG A 10 8.783 2.044 5.398 1.00 0.17 H new ATOM 0 H2' DG A 10 6.721 2.525 4.221 1.00 0.16 H new ATOM 0 H2'' DG A 10 7.854 3.408 3.217 1.00 0.16 H new ATOM 0 H1' DG A 10 8.025 1.706 1.632 1.00 0.15 H new ATOM 0 H8 DG A 10 4.802 1.271 3.745 1.00 0.17 H new ATOM 0 H1 DG A 10 4.024 1.543 -2.618 1.00 0.14 H new ATOM 0 H21 DG A 10 7.494 1.660 -2.734 1.00 0.16 H new ATOM 0 H22 DG A 10 5.966 1.656 -3.622 1.00 0.16 H new ATOM 325 P DC A 11 10.872 3.366 4.475 1.00 0.23 P ATOM 326 OP1 DC A 11 12.050 3.645 3.625 1.00 0.32 O ATOM 327 OP2 DC A 11 11.058 3.002 5.898 1.00 0.33 O ATOM 328 O5' DC A 11 9.886 4.637 4.405 1.00 0.23 O ATOM 329 C5' DC A 11 9.971 5.678 5.384 1.00 0.39 C ATOM 330 C4' DC A 11 8.949 6.782 5.119 1.00 0.37 C ATOM 331 O4' DC A 11 9.250 7.437 3.900 1.00 0.50 O ATOM 332 C3' DC A 11 7.519 6.286 4.975 1.00 0.23 C ATOM 333 O3' DC A 11 6.875 6.304 6.254 1.00 0.24 O ATOM 334 C2' DC A 11 6.863 7.311 4.047 1.00 0.39 C ATOM 335 C1' DC A 11 8.053 8.060 3.433 1.00 0.47 C ATOM 336 N1 DC A 11 8.084 8.031 1.958 1.00 0.57 N ATOM 337 C2 DC A 11 7.666 9.169 1.288 1.00 0.70 C ATOM 338 O2 DC A 11 7.282 10.150 1.921 1.00 0.77 O ATOM 339 N3 DC A 11 7.692 9.162 -0.073 1.00 0.83 N ATOM 340 C4 DC A 11 8.113 8.084 -0.748 1.00 0.83 C ATOM 341 N4 DC A 11 8.128 8.110 -2.080 1.00 0.98 N ATOM 342 C5 DC A 11 8.547 6.907 -0.059 1.00 0.74 C ATOM 343 C6 DC A 11 8.516 6.925 1.288 1.00 0.63 C ATOM 0 H5' DC A 11 10.975 6.102 5.379 1.00 0.39 H new ATOM 0 H5'' DC A 11 9.806 5.259 6.377 1.00 0.39 H new ATOM 0 H4' DC A 11 9.015 7.435 5.989 1.00 0.37 H new ATOM 0 H3' DC A 11 7.456 5.268 4.590 1.00 0.23 H new ATOM 0 H2' DC A 11 6.256 6.827 3.281 1.00 0.39 H new ATOM 0 H2'' DC A 11 6.206 7.985 4.596 1.00 0.39 H new ATOM 0 H1' DC A 11 7.961 9.104 3.734 1.00 0.47 H new ATOM 0 H41 DC A 11 8.447 7.294 -2.602 1.00 0.98 H new ATOM 0 H42 DC A 11 7.821 8.946 -2.577 1.00 0.98 H new ATOM 0 H5 DC A 11 8.887 6.036 -0.599 1.00 0.74 H new ATOM 0 H6 DC A 11 8.836 6.055 1.842 1.00 0.63 H new ATOM 355 P DT A 12 6.146 4.983 6.814 1.00 0.26 P ATOM 356 OP1 DT A 12 5.868 5.181 8.254 1.00 0.38 O ATOM 357 OP2 DT A 12 6.920 3.802 6.369 1.00 0.32 O ATOM 358 O5' DT A 12 4.740 4.990 6.025 1.00 0.27 O ATOM 359 C5' DT A 12 3.592 5.623 6.595 1.00 0.27 C ATOM 360 C4' DT A 12 2.331 5.333 5.788 1.00 0.23 C ATOM 361 O4' DT A 12 2.432 5.931 4.501 1.00 0.24 O ATOM 362 C3' DT A 12 2.071 3.841 5.556 1.00 0.25 C ATOM 363 O3' DT A 12 0.948 3.425 6.340 1.00 0.26 O ATOM 364 C2' DT A 12 1.731 3.723 4.066 1.00 0.26 C ATOM 365 C1' DT A 12 1.610 5.176 3.623 1.00 0.25 C ATOM 366 N1 DT A 12 2.071 5.427 2.245 1.00 0.25 N ATOM 367 C2 DT A 12 1.169 5.991 1.360 1.00 0.28 C ATOM 368 O2 DT A 12 0.016 6.270 1.681 1.00 0.33 O ATOM 369 N3 DT A 12 1.636 6.209 0.081 1.00 0.28 N ATOM 370 C4 DT A 12 2.903 5.918 -0.388 1.00 0.26 C ATOM 371 O4 DT A 12 3.209 6.155 -1.554 1.00 0.29 O ATOM 372 C5 DT A 12 3.774 5.331 0.600 1.00 0.23 C ATOM 373 C7 DT A 12 5.195 4.949 0.205 1.00 0.22 C ATOM 374 C6 DT A 12 3.346 5.107 1.860 1.00 0.22 C ATOM 0 H5' DT A 12 3.755 6.700 6.641 1.00 0.27 H new ATOM 0 H5'' DT A 12 3.456 5.277 7.620 1.00 0.27 H new ATOM 0 H4' DT A 12 1.512 5.741 6.380 1.00 0.23 H new ATOM 0 H3' DT A 12 2.924 3.223 5.834 1.00 0.25 H new ATOM 0 H2' DT A 12 2.511 3.197 3.515 1.00 0.26 H new ATOM 0 H2'' DT A 12 0.803 3.174 3.907 1.00 0.26 H new ATOM 0 H1' DT A 12 0.555 5.449 3.651 1.00 0.25 H new ATOM 0 H3 DT A 12 0.983 6.625 -0.583 1.00 0.28 H new ATOM 0 H71 DT A 12 5.219 4.680 -0.851 1.00 0.22 H new ATOM 0 H72 DT A 12 5.861 5.794 0.379 1.00 0.22 H new ATOM 0 H73 DT A 12 5.523 4.099 0.804 1.00 0.22 H new ATOM 0 H6 DT A 12 4.022 4.667 2.579 1.00 0.22 H new ATOM 387 P DG A 13 0.468 1.888 6.318 1.00 0.22 P ATOM 388 OP1 DG A 13 0.377 1.410 7.716 1.00 0.31 O ATOM 389 OP2 DG A 13 1.304 1.155 5.342 1.00 0.26 O ATOM 390 O5' DG A 13 -1.025 1.992 5.725 1.00 0.29 O ATOM 391 C5' DG A 13 -2.092 2.505 6.527 1.00 0.35 C ATOM 392 C4' DG A 13 -3.447 1.997 6.046 1.00 0.31 C ATOM 393 O4' DG A 13 -3.693 2.459 4.710 1.00 0.29 O ATOM 394 C3' DG A 13 -3.557 0.469 6.014 1.00 0.30 C ATOM 395 O3' DG A 13 -4.864 0.080 6.462 1.00 0.30 O ATOM 396 C2' DG A 13 -3.389 0.139 4.540 1.00 0.27 C ATOM 397 C1' DG A 13 -4.084 1.335 3.921 1.00 0.27 C ATOM 398 N9 DG A 13 -3.722 1.604 2.515 1.00 0.24 N ATOM 399 C8 DG A 13 -4.554 1.852 1.455 1.00 0.25 C ATOM 400 N7 DG A 13 -3.932 2.038 0.325 1.00 0.24 N ATOM 401 C5 DG A 13 -2.588 1.904 0.658 1.00 0.22 C ATOM 402 C6 DG A 13 -1.435 2.004 -0.167 1.00 0.23 C ATOM 403 O6 DG A 13 -1.379 2.233 -1.373 1.00 0.24 O ATOM 404 N1 DG A 13 -0.271 1.804 0.561 1.00 0.24 N ATOM 405 C2 DG A 13 -0.219 1.540 1.914 1.00 0.24 C ATOM 406 N2 DG A 13 0.996 1.376 2.438 1.00 0.29 N ATOM 407 N3 DG A 13 -1.302 1.446 2.691 1.00 0.23 N ATOM 408 C4 DG A 13 -2.448 1.639 1.997 1.00 0.22 C ATOM 0 H5' DG A 13 -2.079 3.595 6.497 1.00 0.35 H new ATOM 0 H5'' DG A 13 -1.941 2.213 7.566 1.00 0.35 H new ATOM 0 H4' DG A 13 -4.173 2.382 6.762 1.00 0.31 H new ATOM 0 H3' DG A 13 -2.831 -0.039 6.649 1.00 0.30 H new ATOM 0 H2' DG A 13 -2.342 0.067 4.246 1.00 0.27 H new ATOM 0 H2'' DG A 13 -3.862 -0.805 4.268 1.00 0.27 H new ATOM 0 H1' DG A 13 -5.156 1.137 3.911 1.00 0.27 H new ATOM 0 H8 DG A 13 -5.629 1.890 1.548 1.00 0.25 H new ATOM 0 H1 DG A 13 0.614 1.856 0.057 1.00 0.24 H new ATOM 0 H21 DG A 13 1.100 1.178 3.433 1.00 0.29 H new ATOM 0 H22 DG A 13 1.822 1.448 1.844 1.00 0.29 H new ATOM 420 P DG A 14 -5.368 -1.446 6.329 1.00 0.31 P ATOM 421 OP1 DG A 14 -6.396 -1.689 7.365 1.00 0.36 O ATOM 422 OP2 DG A 14 -4.177 -2.322 6.253 1.00 0.35 O ATOM 423 O5' DG A 14 -6.092 -1.456 4.889 1.00 0.25 O ATOM 424 C5' DG A 14 -7.387 -0.869 4.718 1.00 0.27 C ATOM 425 C4' DG A 14 -7.938 -1.120 3.317 1.00 0.20 C ATOM 426 O4' DG A 14 -6.941 -0.784 2.342 1.00 0.21 O ATOM 427 C3' DG A 14 -8.335 -2.573 3.060 1.00 0.20 C ATOM 428 O3' DG A 14 -9.482 -2.606 2.201 1.00 0.18 O ATOM 429 C2' DG A 14 -7.129 -3.143 2.338 1.00 0.19 C ATOM 430 C1' DG A 14 -6.688 -1.935 1.529 1.00 0.16 C ATOM 431 N9 DG A 14 -5.258 -1.937 1.176 1.00 0.18 N ATOM 432 C8 DG A 14 -4.178 -2.180 1.982 1.00 0.20 C ATOM 433 N7 DG A 14 -3.031 -2.115 1.366 1.00 0.21 N ATOM 434 C5 DG A 14 -3.375 -1.809 0.052 1.00 0.20 C ATOM 435 C6 DG A 14 -2.546 -1.614 -1.086 1.00 0.22 C ATOM 436 O6 DG A 14 -1.320 -1.675 -1.155 1.00 0.25 O ATOM 437 N1 DG A 14 -3.296 -1.324 -2.218 1.00 0.22 N ATOM 438 C2 DG A 14 -4.671 -1.231 -2.254 1.00 0.21 C ATOM 439 N2 DG A 14 -5.213 -0.942 -3.437 1.00 0.24 N ATOM 440 N3 DG A 14 -5.452 -1.414 -1.185 1.00 0.19 N ATOM 441 C4 DG A 14 -4.737 -1.698 -0.072 1.00 0.18 C ATOM 0 H5' DG A 14 -7.327 0.204 4.899 1.00 0.27 H new ATOM 0 H5'' DG A 14 -8.074 -1.279 5.458 1.00 0.27 H new ATOM 0 H4' DG A 14 -8.831 -0.500 3.238 1.00 0.20 H new ATOM 0 H3' DG A 14 -8.589 -3.124 3.965 1.00 0.20 H new ATOM 0 H2' DG A 14 -6.357 -3.483 3.028 1.00 0.19 H new ATOM 0 H2'' DG A 14 -7.388 -3.992 1.706 1.00 0.19 H new ATOM 0 H1' DG A 14 -7.239 -1.943 0.588 1.00 0.16 H new ATOM 0 H8 DG A 14 -4.268 -2.405 3.034 1.00 0.20 H new ATOM 0 H1 DG A 14 -2.791 -1.168 -3.090 1.00 0.22 H new ATOM 0 H21 DG A 14 -6.226 -0.860 -3.528 1.00 0.24 H new ATOM 0 H22 DG A 14 -4.615 -0.803 -4.252 1.00 0.24 H new ATOM 453 P DG A 15 -10.041 -4.007 1.634 1.00 0.26 P ATOM 454 OP1 DG A 15 -11.492 -4.077 1.921 1.00 0.40 O ATOM 455 OP2 DG A 15 -9.144 -5.086 2.101 1.00 0.34 O ATOM 456 O5' DG A 15 -9.850 -3.845 0.042 1.00 0.21 O ATOM 457 C5' DG A 15 -10.756 -3.047 -0.728 1.00 0.22 C ATOM 458 C4' DG A 15 -10.498 -3.198 -2.225 1.00 0.22 C ATOM 459 O4' DG A 15 -9.120 -2.917 -2.505 1.00 0.20 O ATOM 460 C3' DG A 15 -10.789 -4.602 -2.763 1.00 0.26 C ATOM 461 O3' DG A 15 -11.462 -4.503 -4.023 1.00 0.28 O ATOM 462 C2' DG A 15 -9.411 -5.208 -2.968 1.00 0.27 C ATOM 463 C1' DG A 15 -8.601 -3.973 -3.312 1.00 0.24 C ATOM 464 N9 DG A 15 -7.158 -4.098 -3.033 1.00 0.23 N ATOM 465 C8 DG A 15 -6.533 -4.366 -1.844 1.00 0.24 C ATOM 466 N7 DG A 15 -5.233 -4.421 -1.929 1.00 0.23 N ATOM 467 C5 DG A 15 -4.975 -4.171 -3.274 1.00 0.21 C ATOM 468 C6 DG A 15 -3.736 -4.104 -3.967 1.00 0.22 C ATOM 469 O6 DG A 15 -2.602 -4.260 -3.517 1.00 0.25 O ATOM 470 N1 DG A 15 -3.920 -3.829 -5.315 1.00 0.24 N ATOM 471 C2 DG A 15 -5.144 -3.641 -5.923 1.00 0.24 C ATOM 472 N2 DG A 15 -5.121 -3.386 -7.232 1.00 0.27 N ATOM 473 N3 DG A 15 -6.309 -3.704 -5.274 1.00 0.23 N ATOM 474 C4 DG A 15 -6.148 -3.972 -3.957 1.00 0.22 C ATOM 0 H5' DG A 15 -10.653 -2.000 -0.443 1.00 0.22 H new ATOM 0 H5'' DG A 15 -11.782 -3.339 -0.503 1.00 0.22 H new ATOM 0 H4' DG A 15 -11.176 -2.498 -2.714 1.00 0.22 H new ATOM 0 H3' DG A 15 -11.419 -5.192 -2.097 1.00 0.26 H new ATOM 0 H2' DG A 15 -9.042 -5.707 -2.072 1.00 0.27 H new ATOM 0 H2'' DG A 15 -9.400 -5.945 -3.771 1.00 0.27 H new ATOM 0 H1' DG A 15 -8.689 -3.799 -4.384 1.00 0.24 H new ATOM 0 H8 DG A 15 -7.069 -4.518 -0.919 1.00 0.24 H new ATOM 0 H1 DG A 15 -3.087 -3.761 -5.900 1.00 0.24 H new ATOM 0 H21 DG A 15 -5.994 -3.238 -7.738 1.00 0.27 H new ATOM 0 H22 DG A 15 -4.230 -3.339 -7.727 1.00 0.27 H new ATOM 486 P DA A 16 -12.838 -3.679 -4.159 1.00 0.27 P ATOM 487 OP1 DA A 16 -13.613 -3.860 -2.911 1.00 0.38 O ATOM 488 OP2 DA A 16 -13.452 -4.015 -5.463 1.00 0.36 O ATOM 489 O5' DA A 16 -12.331 -2.152 -4.220 1.00 0.28 O ATOM 490 C5' DA A 16 -11.542 -1.690 -5.321 1.00 0.38 C ATOM 491 C4' DA A 16 -11.552 -0.167 -5.416 1.00 0.44 C ATOM 492 O4' DA A 16 -12.888 0.288 -5.660 1.00 0.50 O ATOM 493 C3' DA A 16 -11.060 0.538 -4.150 1.00 0.42 C ATOM 494 O3' DA A 16 -10.244 1.657 -4.515 1.00 0.47 O ATOM 495 C2' DA A 16 -12.339 1.023 -3.486 1.00 0.42 C ATOM 496 C1' DA A 16 -13.215 1.290 -4.697 1.00 0.51 C ATOM 497 N9 DA A 16 -14.662 1.202 -4.429 1.00 0.56 N ATOM 498 C8 DA A 16 -15.353 0.233 -3.749 1.00 0.64 C ATOM 499 N7 DA A 16 -16.639 0.443 -3.691 1.00 0.72 N ATOM 500 C5 DA A 16 -16.812 1.638 -4.383 1.00 0.72 C ATOM 501 C6 DA A 16 -17.950 2.406 -4.681 1.00 0.88 C ATOM 502 N6 DA A 16 -19.181 2.065 -4.301 1.00 0.94 N ATOM 503 N1 DA A 16 -17.763 3.536 -5.385 1.00 1.04 N ATOM 504 C2 DA A 16 -16.534 3.869 -5.760 1.00 1.06 C ATOM 505 N3 DA A 16 -15.393 3.234 -5.542 1.00 0.88 N ATOM 506 C4 DA A 16 -15.613 2.107 -4.835 1.00 0.69 C ATOM 0 H5' DA A 16 -11.925 -2.116 -6.248 1.00 0.38 H new ATOM 0 H5'' DA A 16 -10.517 -2.042 -5.208 1.00 0.38 H new ATOM 0 H4' DA A 16 -10.869 0.081 -6.228 1.00 0.44 H new ATOM 0 H3' DA A 16 -10.464 -0.105 -3.502 1.00 0.42 H new ATOM 0 H2' DA A 16 -12.770 0.272 -2.824 1.00 0.42 H new ATOM 0 H2'' DA A 16 -12.178 1.920 -2.888 1.00 0.42 H new ATOM 0 H1' DA A 16 -13.024 2.310 -5.029 1.00 0.51 H new ATOM 0 H8 DA A 16 -14.876 -0.626 -3.302 1.00 0.64 H new ATOM 0 H61 DA A 16 -19.973 2.660 -4.544 1.00 0.94 H new ATOM 0 H62 DA A 16 -19.331 1.209 -3.767 1.00 0.94 H new ATOM 0 H2 DA A 16 -16.454 4.788 -6.322 1.00 1.06 H new ATOM 518 P DG A 17 -9.721 2.694 -3.398 1.00 0.56 P ATOM 519 OP1 DG A 17 -8.914 1.946 -2.409 1.00 0.77 O ATOM 520 OP2 DG A 17 -10.871 3.509 -2.946 1.00 0.64 O ATOM 521 O5' DG A 17 -8.731 3.646 -4.238 1.00 0.42 O ATOM 522 C5' DG A 17 -9.230 4.436 -5.320 1.00 0.28 C ATOM 523 C4' DG A 17 -8.616 4.014 -6.652 1.00 0.22 C ATOM 524 O4' DG A 17 -7.203 4.253 -6.632 1.00 0.29 O ATOM 525 C3' DG A 17 -8.815 2.531 -6.983 1.00 0.25 C ATOM 526 O3' DG A 17 -9.203 2.397 -8.357 1.00 0.27 O ATOM 527 C2' DG A 17 -7.436 1.924 -6.774 1.00 0.26 C ATOM 528 C1' DG A 17 -6.556 3.097 -7.155 1.00 0.22 C ATOM 529 N9 DG A 17 -5.188 3.041 -6.604 1.00 0.22 N ATOM 530 C8 DG A 17 -3.995 3.148 -7.270 1.00 0.25 C ATOM 531 N7 DG A 17 -2.948 3.039 -6.502 1.00 0.25 N ATOM 532 C5 DG A 17 -3.482 2.846 -5.233 1.00 0.22 C ATOM 533 C6 DG A 17 -2.823 2.663 -3.988 1.00 0.22 C ATOM 534 O6 DG A 17 -1.615 2.634 -3.762 1.00 0.24 O ATOM 535 N1 DG A 17 -3.729 2.503 -2.949 1.00 0.22 N ATOM 536 C2 DG A 17 -5.102 2.517 -3.088 1.00 0.22 C ATOM 537 N2 DG A 17 -5.810 2.348 -1.972 1.00 0.26 N ATOM 538 N3 DG A 17 -5.725 2.688 -4.259 1.00 0.21 N ATOM 539 C4 DG A 17 -4.855 2.845 -5.284 1.00 0.21 C ATOM 0 H5' DG A 17 -9.012 5.488 -5.135 1.00 0.28 H new ATOM 0 H5'' DG A 17 -10.315 4.340 -5.372 1.00 0.28 H new ATOM 0 H4' DG A 17 -9.129 4.607 -7.410 1.00 0.22 H new ATOM 0 H3' DG A 17 -9.584 2.054 -6.376 1.00 0.25 H new ATOM 0 H2' DG A 17 -7.276 1.603 -5.745 1.00 0.26 H new ATOM 0 H2'' DG A 17 -7.265 1.055 -7.409 1.00 0.26 H new ATOM 0 H1' DG A 17 -6.438 3.098 -8.239 1.00 0.22 H new ATOM 0 H8 DG A 17 -3.929 3.308 -8.336 1.00 0.25 H new ATOM 0 H1 DG A 17 -3.352 2.365 -2.012 1.00 0.22 H new ATOM 0 H21 DG A 17 -6.829 2.349 -2.010 1.00 0.26 H new ATOM 0 H22 DG A 17 -5.333 2.218 -1.080 1.00 0.26 H new ATOM 551 P DG A 18 -9.316 0.944 -9.045 1.00 0.31 P ATOM 552 OP1 DG A 18 -10.174 1.064 -10.245 1.00 0.38 O ATOM 553 OP2 DG A 18 -9.651 -0.041 -7.994 1.00 0.33 O ATOM 554 O5' DG A 18 -7.805 0.664 -9.534 1.00 0.27 O ATOM 555 C5' DG A 18 -7.216 1.455 -10.570 1.00 0.25 C ATOM 556 C4' DG A 18 -5.818 0.958 -10.932 1.00 0.22 C ATOM 557 O4' DG A 18 -4.963 1.031 -9.782 1.00 0.21 O ATOM 558 C3' DG A 18 -5.783 -0.495 -11.423 1.00 0.18 C ATOM 559 O3' DG A 18 -4.892 -0.597 -12.543 1.00 0.20 O ATOM 560 C2' DG A 18 -5.210 -1.253 -10.239 1.00 0.16 C ATOM 561 C1' DG A 18 -4.271 -0.211 -9.673 1.00 0.16 C ATOM 562 N9 DG A 18 -3.904 -0.423 -8.261 1.00 0.17 N ATOM 563 C8 DG A 18 -4.720 -0.509 -7.163 1.00 0.22 C ATOM 564 N7 DG A 18 -4.082 -0.712 -6.045 1.00 0.27 N ATOM 565 C5 DG A 18 -2.746 -0.766 -6.427 1.00 0.24 C ATOM 566 C6 DG A 18 -1.581 -0.968 -5.637 1.00 0.27 C ATOM 567 O6 DG A 18 -1.502 -1.142 -4.424 1.00 0.33 O ATOM 568 N1 DG A 18 -0.430 -0.953 -6.416 1.00 0.23 N ATOM 569 C2 DG A 18 -0.402 -0.769 -7.782 1.00 0.17 C ATOM 570 N2 DG A 18 0.800 -0.788 -8.356 1.00 0.15 N ATOM 571 N3 DG A 18 -1.497 -0.578 -8.524 1.00 0.15 N ATOM 572 C4 DG A 18 -2.628 -0.589 -7.781 1.00 0.18 C ATOM 0 H5' DG A 18 -7.161 2.495 -10.248 1.00 0.25 H new ATOM 0 H5'' DG A 18 -7.852 1.429 -11.455 1.00 0.25 H new ATOM 0 H4' DG A 18 -5.483 1.603 -11.744 1.00 0.22 H new ATOM 0 H3' DG A 18 -6.755 -0.871 -11.741 1.00 0.18 H new ATOM 0 H2' DG A 18 -5.979 -1.550 -9.525 1.00 0.16 H new ATOM 0 H2'' DG A 18 -4.688 -2.161 -10.541 1.00 0.16 H new ATOM 0 H1' DG A 18 -3.334 -0.253 -10.228 1.00 0.16 H new ATOM 0 H8 DG A 18 -5.795 -0.417 -7.219 1.00 0.22 H new ATOM 0 H1 DG A 18 0.462 -1.088 -5.941 1.00 0.23 H new ATOM 0 H21 DG A 18 0.886 -0.658 -9.364 1.00 0.15 H new ATOM 0 H22 DG A 18 1.634 -0.933 -7.787 1.00 0.15 H new ATOM 584 P DG A 19 -5.006 -1.823 -13.584 1.00 0.23 P ATOM 585 OP1 DG A 19 -3.969 -1.646 -14.626 1.00 0.27 O ATOM 586 OP2 DG A 19 -6.426 -1.968 -13.974 1.00 0.48 O ATOM 587 O5' DG A 19 -4.600 -3.093 -12.682 1.00 0.40 O ATOM 588 C5' DG A 19 -3.710 -4.095 -13.179 1.00 0.29 C ATOM 589 C4' DG A 19 -2.289 -3.562 -13.350 1.00 0.25 C ATOM 590 O4' DG A 19 -1.878 -2.884 -12.161 1.00 0.42 O ATOM 591 C3' DG A 19 -1.262 -4.653 -13.610 1.00 0.23 C ATOM 592 O3' DG A 19 -0.189 -4.137 -14.404 1.00 0.27 O ATOM 593 C2' DG A 19 -0.755 -4.994 -12.220 1.00 0.29 C ATOM 594 C1' DG A 19 -0.857 -3.651 -11.506 1.00 0.34 C ATOM 595 N9 DG A 19 -1.237 -3.762 -10.089 1.00 0.33 N ATOM 596 C8 DG A 19 -2.491 -3.745 -9.543 1.00 0.38 C ATOM 597 N7 DG A 19 -2.505 -3.867 -8.245 1.00 0.38 N ATOM 598 C5 DG A 19 -1.161 -3.972 -7.904 1.00 0.32 C ATOM 599 C6 DG A 19 -0.556 -4.128 -6.628 1.00 0.31 C ATOM 600 O6 DG A 19 -1.102 -4.201 -5.530 1.00 0.35 O ATOM 601 N1 DG A 19 0.829 -4.195 -6.726 1.00 0.30 N ATOM 602 C2 DG A 19 1.543 -4.122 -7.904 1.00 0.31 C ATOM 603 N2 DG A 19 2.869 -4.210 -7.797 1.00 0.36 N ATOM 604 N3 DG A 19 0.975 -3.976 -9.105 1.00 0.31 N ATOM 605 C4 DG A 19 -0.375 -3.909 -9.028 1.00 0.31 C ATOM 0 H5' DG A 19 -4.077 -4.463 -14.137 1.00 0.29 H new ATOM 0 H5'' DG A 19 -3.700 -4.943 -12.494 1.00 0.29 H new ATOM 0 H4' DG A 19 -2.325 -2.900 -14.215 1.00 0.25 H new ATOM 0 H3' DG A 19 -1.672 -5.510 -14.144 1.00 0.23 H new ATOM 0 H2' DG A 19 -1.365 -5.759 -11.740 1.00 0.29 H new ATOM 0 H2'' DG A 19 0.268 -5.369 -12.240 1.00 0.29 H new ATOM 0 H1' DG A 19 0.130 -3.190 -11.548 1.00 0.34 H new ATOM 0 H8 DG A 19 -3.389 -3.640 -10.134 1.00 0.38 H new ATOM 0 H1 DG A 19 1.358 -4.307 -5.861 1.00 0.30 H new ATOM 0 H21 DG A 19 3.452 -4.163 -8.632 1.00 0.36 H new ATOM 0 H22 DG A 19 3.300 -4.325 -6.880 1.00 0.36 H new ATOM 617 P DC A 20 0.773 -5.136 -15.223 1.00 0.31 P ATOM 618 OP1 DC A 20 1.843 -4.334 -15.856 1.00 0.36 O ATOM 619 OP2 DC A 20 -0.077 -6.019 -16.054 1.00 0.34 O ATOM 620 O5' DC A 20 1.437 -6.029 -14.057 1.00 0.39 O ATOM 621 C5' DC A 20 2.688 -5.653 -13.474 1.00 0.45 C ATOM 622 C4' DC A 20 3.191 -6.709 -12.491 1.00 0.50 C ATOM 623 O4' DC A 20 2.309 -6.800 -11.378 1.00 0.52 O ATOM 624 C3' DC A 20 3.268 -8.108 -13.073 1.00 0.52 C ATOM 625 O3' DC A 20 4.500 -8.322 -13.772 1.00 0.58 O ATOM 626 C2' DC A 20 3.162 -8.998 -11.840 1.00 0.55 C ATOM 627 C1' DC A 20 2.369 -8.134 -10.854 1.00 0.53 C ATOM 628 N1 DC A 20 0.982 -8.587 -10.638 1.00 0.49 N ATOM 629 C2 DC A 20 0.552 -8.730 -9.327 1.00 0.60 C ATOM 630 O2 DC A 20 1.320 -8.489 -8.399 1.00 0.77 O ATOM 631 N3 DC A 20 -0.727 -9.141 -9.109 1.00 0.59 N ATOM 632 C4 DC A 20 -1.552 -9.399 -10.132 1.00 0.47 C ATOM 633 N4 DC A 20 -2.799 -9.798 -9.883 1.00 0.49 N ATOM 634 C5 DC A 20 -1.112 -9.252 -11.486 1.00 0.47 C ATOM 635 C6 DC A 20 0.154 -8.846 -11.693 1.00 0.48 C ATOM 0 H5' DC A 20 2.578 -4.699 -12.959 1.00 0.45 H new ATOM 0 H5'' DC A 20 3.427 -5.507 -14.261 1.00 0.45 H new ATOM 0 H4' DC A 20 4.194 -6.380 -12.218 1.00 0.50 H new ATOM 0 H3' DC A 20 2.492 -8.306 -13.812 1.00 0.52 H new ATOM 0 H2' DC A 20 2.647 -9.933 -12.061 1.00 0.55 H new ATOM 0 H2'' DC A 20 4.144 -9.260 -11.447 1.00 0.55 H new ATOM 0 HO3' DC A 20 4.518 -9.233 -14.133 1.00 0.58 H new ATOM 0 H1' DC A 20 2.885 -8.199 -9.896 1.00 0.53 H new ATOM 0 H41 DC A 20 -3.435 -9.997 -10.656 1.00 0.49 H new ATOM 0 H42 DC A 20 -3.118 -9.904 -8.920 1.00 0.49 H new ATOM 0 H5 DC A 20 -1.774 -9.460 -12.314 1.00 0.47 H new ATOM 0 H6 DC A 20 0.519 -8.724 -12.702 1.00 0.48 H new TER 648 DC A 20