USER MOD reduce.3.24.130724 H: found=0, std=0, add=281, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 285 hydrogens (14 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DC O5' : rot 180:sc= -0.467 USER MOD Single : A 3 DT C7 :methyl 150:sc= -0.0257 (180deg=-0.0257) USER MOD Single : A 10 DT C7 :methyl -30:sc= 0 (180deg=-0.00583) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 35:sc= -0.208 USER MOD Single : B 20 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -12.588 -14.168 -5.937 1.00 0.59 O ATOM 2 C5' DC A 1 -13.885 -13.565 -5.889 1.00 0.55 C ATOM 3 C4' DC A 1 -13.800 -12.145 -5.371 1.00 0.42 C ATOM 4 O4' DC A 1 -14.114 -12.175 -3.962 1.00 0.49 O ATOM 5 C3' DC A 1 -12.419 -11.492 -5.490 1.00 0.30 C ATOM 6 O3' DC A 1 -12.428 -10.502 -6.526 1.00 0.26 O ATOM 7 C2' DC A 1 -12.192 -10.829 -4.137 1.00 0.30 C ATOM 8 C1' DC A 1 -13.402 -11.159 -3.286 1.00 0.36 C ATOM 9 N1 DC A 1 -13.056 -11.666 -1.953 1.00 0.43 N ATOM 10 C2 DC A 1 -13.757 -11.206 -0.836 1.00 0.43 C ATOM 11 O2 DC A 1 -14.660 -10.371 -0.993 1.00 0.38 O ATOM 12 N3 DC A 1 -13.431 -11.682 0.388 1.00 0.50 N ATOM 13 C4 DC A 1 -12.451 -12.580 0.515 1.00 0.60 C ATOM 14 N4 DC A 1 -12.164 -13.023 1.739 1.00 0.69 N ATOM 15 C5 DC A 1 -11.721 -13.064 -0.610 1.00 0.61 C ATOM 16 C6 DC A 1 -12.055 -12.581 -1.813 1.00 0.51 C ATOM 0 H5' DC A 1 -14.540 -14.153 -5.246 1.00 0.55 H new ATOM 0 H5'' DC A 1 -14.329 -13.568 -6.884 1.00 0.55 H new ATOM 0 H4' DC A 1 -14.489 -11.561 -5.981 1.00 0.42 H new ATOM 0 H3' DC A 1 -11.639 -12.211 -5.739 1.00 0.30 H new ATOM 0 H2' DC A 1 -11.278 -11.200 -3.672 1.00 0.30 H new ATOM 0 H2'' DC A 1 -12.078 -9.751 -4.248 1.00 0.30 H new ATOM 0 HO5' DC A 1 -12.666 -15.085 -6.273 1.00 0.59 H new ATOM 0 H1' DC A 1 -13.975 -10.243 -3.144 1.00 0.36 H new ATOM 0 H41 DC A 1 -11.421 -13.709 1.872 1.00 0.69 H new ATOM 0 H42 DC A 1 -12.687 -12.676 2.543 1.00 0.69 H new ATOM 0 H5 DC A 1 -10.930 -13.791 -0.496 1.00 0.61 H new ATOM 0 H6 DC A 1 -11.522 -12.922 -2.688 1.00 0.51 H new ATOM 29 P DC A 2 -11.183 -9.491 -6.680 1.00 0.37 P ATOM 30 OP1 DC A 2 -11.068 -9.147 -8.120 1.00 0.60 O ATOM 31 OP2 DC A 2 -10.012 -10.063 -5.967 1.00 0.51 O ATOM 32 O5' DC A 2 -11.646 -8.182 -5.896 1.00 0.24 O ATOM 33 C5' DC A 2 -13.018 -7.787 -5.877 1.00 0.33 C ATOM 34 C4' DC A 2 -13.201 -6.539 -5.045 1.00 0.23 C ATOM 35 O4' DC A 2 -13.217 -6.918 -3.649 1.00 0.25 O ATOM 36 C3' DC A 2 -12.122 -5.465 -5.194 1.00 0.16 C ATOM 37 O3' DC A 2 -12.730 -4.167 -5.243 1.00 0.12 O ATOM 38 C2' DC A 2 -11.269 -5.622 -3.946 1.00 0.13 C ATOM 39 C1' DC A 2 -12.202 -6.248 -2.928 1.00 0.18 C ATOM 40 N1 DC A 2 -11.533 -7.235 -2.080 1.00 0.19 N ATOM 41 C2 DC A 2 -11.720 -7.202 -0.698 1.00 0.20 C ATOM 42 O2 DC A 2 -12.458 -6.333 -0.214 1.00 0.19 O ATOM 43 N3 DC A 2 -11.091 -8.117 0.075 1.00 0.21 N ATOM 44 C4 DC A 2 -10.299 -9.031 -0.490 1.00 0.22 C ATOM 45 N4 DC A 2 -9.695 -9.911 0.309 1.00 0.24 N ATOM 46 C5 DC A 2 -10.092 -9.083 -1.901 1.00 0.22 C ATOM 47 C6 DC A 2 -10.729 -8.178 -2.647 1.00 0.21 C ATOM 0 H5' DC A 2 -13.629 -8.594 -5.471 1.00 0.33 H new ATOM 0 H5'' DC A 2 -13.364 -7.606 -6.895 1.00 0.33 H new ATOM 0 H4' DC A 2 -14.131 -6.099 -5.406 1.00 0.23 H new ATOM 0 H3' DC A 2 -11.536 -5.568 -6.107 1.00 0.16 H new ATOM 0 H2' DC A 2 -10.403 -6.256 -4.134 1.00 0.13 H new ATOM 0 H2'' DC A 2 -10.891 -4.660 -3.600 1.00 0.13 H new ATOM 0 H1' DC A 2 -12.583 -5.458 -2.281 1.00 0.18 H new ATOM 0 H41 DC A 2 -9.083 -10.624 -0.088 1.00 0.24 H new ATOM 0 H42 DC A 2 -9.845 -9.871 1.317 1.00 0.24 H new ATOM 0 H5 DC A 2 -9.446 -9.825 -2.347 1.00 0.22 H new ATOM 0 H6 DC A 2 -10.605 -8.193 -3.720 1.00 0.21 H new ATOM 59 P DT A 3 -11.844 -2.854 -4.961 1.00 0.14 P ATOM 60 OP1 DT A 3 -12.581 -1.677 -5.487 1.00 0.19 O ATOM 61 OP2 DT A 3 -10.462 -3.125 -5.435 1.00 0.18 O ATOM 62 O5' DT A 3 -11.811 -2.752 -3.370 1.00 0.16 O ATOM 63 C5' DT A 3 -13.024 -2.675 -2.620 1.00 0.17 C ATOM 64 C4' DT A 3 -12.837 -1.806 -1.398 1.00 0.21 C ATOM 65 O4' DT A 3 -12.379 -2.628 -0.299 1.00 0.22 O ATOM 66 C3' DT A 3 -11.814 -0.679 -1.536 1.00 0.23 C ATOM 67 O3' DT A 3 -12.288 0.478 -0.827 1.00 0.27 O ATOM 68 C2' DT A 3 -10.561 -1.270 -0.915 1.00 0.22 C ATOM 69 C1' DT A 3 -11.118 -2.176 0.164 1.00 0.22 C ATOM 70 N1 DT A 3 -10.295 -3.355 0.433 1.00 0.21 N ATOM 71 C2 DT A 3 -10.087 -3.743 1.733 1.00 0.22 C ATOM 72 O2 DT A 3 -10.545 -3.143 2.690 1.00 0.24 O ATOM 73 N3 DT A 3 -9.316 -4.862 1.875 1.00 0.21 N ATOM 74 C4 DT A 3 -8.737 -5.607 0.873 1.00 0.19 C ATOM 75 O4 DT A 3 -8.071 -6.599 1.159 1.00 0.19 O ATOM 76 C5 DT A 3 -8.983 -5.132 -0.470 1.00 0.18 C ATOM 77 C7 DT A 3 -8.227 -5.759 -1.598 1.00 0.17 C ATOM 78 C6 DT A 3 -9.758 -4.047 -0.624 1.00 0.19 C ATOM 0 H5' DT A 3 -13.336 -3.675 -2.318 1.00 0.17 H new ATOM 0 H5'' DT A 3 -13.819 -2.268 -3.245 1.00 0.17 H new ATOM 0 H4' DT A 3 -13.813 -1.347 -1.240 1.00 0.21 H new ATOM 0 H3' DT A 3 -11.635 -0.347 -2.559 1.00 0.23 H new ATOM 0 H2' DT A 3 -9.971 -1.825 -1.644 1.00 0.22 H new ATOM 0 H2'' DT A 3 -9.912 -0.498 -0.500 1.00 0.22 H new ATOM 0 H1' DT A 3 -11.162 -1.605 1.091 1.00 0.22 H new ATOM 0 H3 DT A 3 -9.151 -5.181 2.830 1.00 0.21 H new ATOM 0 H71 DT A 3 -8.832 -5.726 -2.504 1.00 0.17 H new ATOM 0 H72 DT A 3 -7.298 -5.213 -1.762 1.00 0.17 H new ATOM 0 H73 DT A 3 -7.999 -6.796 -1.351 1.00 0.17 H new ATOM 0 H6 DT A 3 -9.969 -3.703 -1.626 1.00 0.19 H new ATOM 91 P DC A 4 -11.245 1.557 -0.242 1.00 0.44 P ATOM 92 OP1 DC A 4 -11.989 2.817 0.008 1.00 0.58 O ATOM 93 OP2 DC A 4 -10.053 1.576 -1.129 1.00 0.41 O ATOM 94 O5' DC A 4 -10.815 0.950 1.168 1.00 0.52 O ATOM 95 C5' DC A 4 -11.731 0.921 2.268 1.00 0.48 C ATOM 96 C4' DC A 4 -10.994 1.123 3.572 1.00 0.41 C ATOM 97 O4' DC A 4 -10.183 -0.046 3.845 1.00 0.38 O ATOM 98 C3' DC A 4 -10.018 2.297 3.599 1.00 0.34 C ATOM 99 O3' DC A 4 -9.902 2.792 4.942 1.00 0.30 O ATOM 100 C2' DC A 4 -8.733 1.651 3.114 1.00 0.28 C ATOM 101 C1' DC A 4 -8.805 0.304 3.821 1.00 0.28 C ATOM 102 N1 DC A 4 -8.077 -0.806 3.180 1.00 0.25 N ATOM 103 C2 DC A 4 -7.508 -1.796 3.991 1.00 0.25 C ATOM 104 O2 DC A 4 -7.593 -1.688 5.223 1.00 0.26 O ATOM 105 N3 DC A 4 -6.878 -2.842 3.412 1.00 0.23 N ATOM 106 C4 DC A 4 -6.797 -2.917 2.083 1.00 0.22 C ATOM 107 N4 DC A 4 -6.155 -3.957 1.555 1.00 0.21 N ATOM 108 C5 DC A 4 -7.362 -1.923 1.234 1.00 0.23 C ATOM 109 C6 DC A 4 -7.977 -0.890 1.820 1.00 0.25 C ATOM 0 H5' DC A 4 -12.259 -0.033 2.285 1.00 0.48 H new ATOM 0 H5'' DC A 4 -12.483 1.700 2.144 1.00 0.48 H new ATOM 0 H4' DC A 4 -11.783 1.313 4.300 1.00 0.41 H new ATOM 0 H3' DC A 4 -10.309 3.156 2.995 1.00 0.34 H new ATOM 0 H2' DC A 4 -8.707 1.547 2.029 1.00 0.28 H new ATOM 0 H2'' DC A 4 -7.850 2.222 3.401 1.00 0.28 H new ATOM 0 H1' DC A 4 -8.332 0.431 4.795 1.00 0.28 H new ATOM 0 H41 DC A 4 -6.074 -4.046 0.542 1.00 0.21 H new ATOM 0 H42 DC A 4 -5.744 -4.665 2.163 1.00 0.21 H new ATOM 0 H5 DC A 4 -7.296 -2.000 0.159 1.00 0.23 H new ATOM 0 H6 DC A 4 -8.402 -0.109 1.207 1.00 0.25 H new ATOM 121 P DA A 5 -8.685 3.766 5.344 1.00 0.20 P ATOM 122 OP1 DA A 5 -9.180 4.664 6.418 1.00 0.20 O ATOM 123 OP2 DA A 5 -8.103 4.353 4.110 1.00 0.24 O ATOM 124 O5' DA A 5 -7.608 2.785 5.991 1.00 0.21 O ATOM 125 C5' DA A 5 -7.964 1.895 7.053 1.00 0.18 C ATOM 126 C4' DA A 5 -6.725 1.422 7.781 1.00 0.14 C ATOM 127 O4' DA A 5 -6.264 0.209 7.144 1.00 0.12 O ATOM 128 C3' DA A 5 -5.537 2.393 7.797 1.00 0.12 C ATOM 129 O3' DA A 5 -5.168 2.664 9.158 1.00 0.11 O ATOM 130 C2' DA A 5 -4.420 1.662 7.063 1.00 0.11 C ATOM 131 C1' DA A 5 -4.858 0.214 7.015 1.00 0.11 C ATOM 132 N9 DA A 5 -4.531 -0.415 5.743 1.00 0.11 N ATOM 133 C8 DA A 5 -4.815 0.120 4.523 1.00 0.12 C ATOM 134 N7 DA A 5 -4.451 -0.634 3.514 1.00 0.11 N ATOM 135 C5 DA A 5 -3.872 -1.740 4.121 1.00 0.10 C ATOM 136 C6 DA A 5 -3.271 -2.902 3.605 1.00 0.10 C ATOM 137 N6 DA A 5 -3.148 -3.160 2.302 1.00 0.10 N ATOM 138 N1 DA A 5 -2.790 -3.803 4.488 1.00 0.09 N ATOM 139 C2 DA A 5 -2.907 -3.543 5.798 1.00 0.10 C ATOM 140 N3 DA A 5 -3.435 -2.485 6.401 1.00 0.10 N ATOM 141 C4 DA A 5 -3.909 -1.613 5.497 1.00 0.10 C ATOM 0 H5' DA A 5 -8.507 1.039 6.652 1.00 0.18 H new ATOM 0 H5'' DA A 5 -8.633 2.399 7.750 1.00 0.18 H new ATOM 0 H4' DA A 5 -7.037 1.301 8.818 1.00 0.14 H new ATOM 0 H3' DA A 5 -5.761 3.350 7.325 1.00 0.12 H new ATOM 0 H2' DA A 5 -4.279 2.064 6.060 1.00 0.11 H new ATOM 0 H2'' DA A 5 -3.470 1.769 7.586 1.00 0.11 H new ATOM 0 H1' DA A 5 -4.350 -0.336 7.807 1.00 0.11 H new ATOM 0 H8 DA A 5 -5.296 1.079 4.398 1.00 0.12 H new ATOM 0 H61 DA A 5 -2.701 -4.023 1.993 1.00 0.10 H new ATOM 0 H62 DA A 5 -3.501 -2.494 1.615 1.00 0.10 H new ATOM 0 H2 DA A 5 -2.515 -4.304 6.457 1.00 0.10 H new ATOM 153 P DG A 6 -3.706 3.244 9.498 1.00 0.08 P ATOM 154 OP1 DG A 6 -3.685 3.570 10.947 1.00 0.08 O ATOM 155 OP2 DG A 6 -3.374 4.298 8.505 1.00 0.08 O ATOM 156 O5' DG A 6 -2.734 2.005 9.249 1.00 0.08 O ATOM 157 C5' DG A 6 -2.643 0.934 10.192 1.00 0.08 C ATOM 158 C4' DG A 6 -1.378 0.141 9.957 1.00 0.06 C ATOM 159 O4' DG A 6 -1.429 -0.462 8.639 1.00 0.06 O ATOM 160 C3' DG A 6 -0.089 0.972 9.997 1.00 0.06 C ATOM 161 O3' DG A 6 0.830 0.418 10.945 1.00 0.06 O ATOM 162 C2' DG A 6 0.478 0.863 8.588 1.00 0.05 C ATOM 163 C1' DG A 6 -0.136 -0.420 8.075 1.00 0.05 C ATOM 164 N9 DG A 6 -0.266 -0.504 6.623 1.00 0.05 N ATOM 165 C8 DG A 6 -0.840 0.417 5.782 1.00 0.05 C ATOM 166 N7 DG A 6 -0.808 0.062 4.528 1.00 0.06 N ATOM 167 C5 DG A 6 -0.176 -1.174 4.541 1.00 0.05 C ATOM 168 C6 DG A 6 0.150 -2.045 3.475 1.00 0.05 C ATOM 169 O6 DG A 6 -0.076 -1.903 2.269 1.00 0.05 O ATOM 170 N1 DG A 6 0.807 -3.183 3.927 1.00 0.05 N ATOM 171 C2 DG A 6 1.106 -3.451 5.240 1.00 0.06 C ATOM 172 N2 DG A 6 1.739 -4.603 5.482 1.00 0.06 N ATOM 173 N3 DG A 6 0.806 -2.647 6.244 1.00 0.05 N ATOM 174 C4 DG A 6 0.171 -1.533 5.825 1.00 0.05 C ATOM 0 H5' DG A 6 -3.512 0.283 10.099 1.00 0.08 H new ATOM 0 H5'' DG A 6 -2.649 1.331 11.207 1.00 0.08 H new ATOM 0 H4' DG A 6 -1.342 -0.585 10.769 1.00 0.06 H new ATOM 0 H3' DG A 6 -0.269 2.005 10.296 1.00 0.06 H new ATOM 0 H2' DG A 6 0.199 1.719 7.973 1.00 0.05 H new ATOM 0 H2'' DG A 6 1.567 0.816 8.593 1.00 0.05 H new ATOM 0 H1' DG A 6 0.516 -1.248 8.353 1.00 0.05 H new ATOM 0 H8 DG A 6 -1.275 1.344 6.125 1.00 0.05 H new ATOM 0 H1 DG A 6 1.089 -3.872 3.230 1.00 0.05 H new ATOM 0 H21 DG A 6 1.988 -4.857 6.438 1.00 0.06 H new ATOM 0 H22 DG A 6 1.973 -5.228 4.711 1.00 0.06 H new ATOM 186 P DG A 7 2.254 1.126 11.184 1.00 0.06 P ATOM 187 OP1 DG A 7 3.079 0.233 12.036 1.00 0.08 O ATOM 188 OP2 DG A 7 1.989 2.520 11.624 1.00 0.07 O ATOM 189 O5' DG A 7 2.906 1.184 9.730 1.00 0.05 O ATOM 190 C5' DG A 7 3.777 0.149 9.272 1.00 0.07 C ATOM 191 C4' DG A 7 4.642 0.652 8.140 1.00 0.08 C ATOM 192 O4' DG A 7 4.045 0.258 6.883 1.00 0.06 O ATOM 193 C3' DG A 7 4.811 2.175 8.070 1.00 0.08 C ATOM 194 O3' DG A 7 6.178 2.519 8.324 1.00 0.11 O ATOM 195 C2' DG A 7 4.413 2.550 6.646 1.00 0.07 C ATOM 196 C1' DG A 7 4.376 1.219 5.906 1.00 0.07 C ATOM 197 N9 DG A 7 3.413 1.091 4.811 1.00 0.06 N ATOM 198 C8 DG A 7 2.154 1.640 4.695 1.00 0.05 C ATOM 199 N7 DG A 7 1.560 1.333 3.573 1.00 0.06 N ATOM 200 C5 DG A 7 2.476 0.525 2.913 1.00 0.05 C ATOM 201 C6 DG A 7 2.391 -0.120 1.651 1.00 0.06 C ATOM 202 O6 DG A 7 1.464 -0.096 0.835 1.00 0.06 O ATOM 203 N1 DG A 7 3.542 -0.851 1.372 1.00 0.06 N ATOM 204 C2 DG A 7 4.635 -0.943 2.198 1.00 0.06 C ATOM 205 N2 DG A 7 5.653 -1.687 1.759 1.00 0.06 N ATOM 206 N3 DG A 7 4.726 -0.347 3.372 1.00 0.06 N ATOM 207 C4 DG A 7 3.620 0.364 3.665 1.00 0.05 C ATOM 0 H5' DG A 7 3.191 -0.707 8.938 1.00 0.07 H new ATOM 0 H5'' DG A 7 4.406 -0.196 10.093 1.00 0.07 H new ATOM 0 H4' DG A 7 5.624 0.217 8.326 1.00 0.08 H new ATOM 0 H3' DG A 7 4.205 2.701 8.808 1.00 0.08 H new ATOM 0 H2' DG A 7 3.443 3.047 6.621 1.00 0.07 H new ATOM 0 H2'' DG A 7 5.133 3.235 6.198 1.00 0.07 H new ATOM 0 H1' DG A 7 5.347 1.102 5.424 1.00 0.07 H new ATOM 0 H8 DG A 7 1.704 2.261 5.455 1.00 0.05 H new ATOM 0 H1 DG A 7 3.576 -1.357 0.487 1.00 0.06 H new ATOM 0 H21 DG A 7 6.492 -1.792 2.330 1.00 0.06 H new ATOM 0 H22 DG A 7 5.592 -2.151 0.853 1.00 0.06 H new ATOM 219 P DC A 8 6.615 4.064 8.426 1.00 0.14 P ATOM 220 OP1 DC A 8 6.891 4.376 9.851 1.00 0.17 O ATOM 221 OP2 DC A 8 5.623 4.878 7.677 1.00 0.14 O ATOM 222 O5' DC A 8 7.993 4.117 7.629 1.00 0.16 O ATOM 223 C5' DC A 8 9.080 3.262 7.992 1.00 0.19 C ATOM 224 C4' DC A 8 9.705 2.648 6.760 1.00 0.16 C ATOM 225 O4' DC A 8 8.661 2.342 5.803 1.00 0.15 O ATOM 226 C3' DC A 8 10.715 3.538 6.028 1.00 0.15 C ATOM 227 O3' DC A 8 11.912 2.793 5.774 1.00 0.14 O ATOM 228 C2' DC A 8 10.018 3.910 4.727 1.00 0.12 C ATOM 229 C1' DC A 8 9.052 2.763 4.510 1.00 0.11 C ATOM 230 N1 DC A 8 7.835 3.131 3.772 1.00 0.10 N ATOM 231 C2 DC A 8 7.576 2.538 2.530 1.00 0.10 C ATOM 232 O2 DC A 8 8.392 1.729 2.066 1.00 0.10 O ATOM 233 N3 DC A 8 6.442 2.864 1.869 1.00 0.10 N ATOM 234 C4 DC A 8 5.587 3.738 2.403 1.00 0.10 C ATOM 235 N4 DC A 8 4.479 4.022 1.721 1.00 0.09 N ATOM 236 C5 DC A 8 5.831 4.361 3.661 1.00 0.10 C ATOM 237 C6 DC A 8 6.961 4.036 4.299 1.00 0.10 C ATOM 0 H5' DC A 8 8.725 2.475 8.657 1.00 0.19 H new ATOM 0 H5'' DC A 8 9.830 3.831 8.542 1.00 0.19 H new ATOM 0 H4' DC A 8 10.241 1.772 7.125 1.00 0.16 H new ATOM 0 H3' DC A 8 11.005 4.420 6.599 1.00 0.15 H new ATOM 0 H2' DC A 8 9.498 4.864 4.808 1.00 0.12 H new ATOM 0 H2'' DC A 8 10.726 4.001 3.903 1.00 0.12 H new ATOM 0 H1' DC A 8 9.553 2.001 3.914 1.00 0.11 H new ATOM 0 H41 DC A 8 3.803 4.686 2.099 1.00 0.09 H new ATOM 0 H42 DC A 8 4.306 3.576 0.820 1.00 0.09 H new ATOM 0 H5 DC A 8 5.131 5.068 4.083 1.00 0.10 H new ATOM 0 H6 DC A 8 7.185 4.499 5.249 1.00 0.10 H new ATOM 249 P DC A 9 13.100 3.452 4.914 1.00 0.14 P ATOM 250 OP1 DC A 9 14.377 2.810 5.318 1.00 0.16 O ATOM 251 OP2 DC A 9 12.962 4.929 4.998 1.00 0.16 O ATOM 252 O5' DC A 9 12.772 3.012 3.418 1.00 0.12 O ATOM 253 C5' DC A 9 12.365 1.675 3.115 1.00 0.12 C ATOM 254 C4' DC A 9 12.400 1.446 1.623 1.00 0.12 C ATOM 255 O4' DC A 9 11.109 1.800 1.066 1.00 0.11 O ATOM 256 C3' DC A 9 13.439 2.289 0.879 1.00 0.12 C ATOM 257 O3' DC A 9 14.129 1.487 -0.084 1.00 0.15 O ATOM 258 C2' DC A 9 12.615 3.376 0.210 1.00 0.11 C ATOM 259 C1' DC A 9 11.270 2.707 -0.009 1.00 0.10 C ATOM 260 N1 DC A 9 10.105 3.613 -0.011 1.00 0.10 N ATOM 261 C2 DC A 9 9.216 3.570 -1.094 1.00 0.10 C ATOM 262 O2 DC A 9 9.440 2.786 -2.030 1.00 0.10 O ATOM 263 N3 DC A 9 8.135 4.383 -1.094 1.00 0.11 N ATOM 264 C4 DC A 9 7.925 5.213 -0.070 1.00 0.14 C ATOM 265 N4 DC A 9 6.847 5.995 -0.113 1.00 0.16 N ATOM 266 C5 DC A 9 8.813 5.279 1.043 1.00 0.14 C ATOM 267 C6 DC A 9 9.883 4.475 1.027 1.00 0.12 C ATOM 0 H5' DC A 9 11.358 1.499 3.494 1.00 0.12 H new ATOM 0 H5'' DC A 9 13.023 0.964 3.615 1.00 0.12 H new ATOM 0 H4' DC A 9 12.661 0.396 1.492 1.00 0.12 H new ATOM 0 H3' DC A 9 14.208 2.701 1.532 1.00 0.12 H new ATOM 0 H2' DC A 9 12.527 4.260 0.841 1.00 0.11 H new ATOM 0 H2'' DC A 9 13.062 3.699 -0.730 1.00 0.11 H new ATOM 0 H1' DC A 9 11.289 2.253 -1.000 1.00 0.10 H new ATOM 0 H41 DC A 9 6.655 6.642 0.652 1.00 0.16 H new ATOM 0 H42 DC A 9 6.214 5.947 -0.911 1.00 0.16 H new ATOM 0 H5 DC A 9 8.630 5.952 1.868 1.00 0.14 H new ATOM 0 H6 DC A 9 10.583 4.508 1.848 1.00 0.12 H new ATOM 279 P DT A 10 15.363 2.109 -0.906 1.00 0.19 P ATOM 280 OP1 DT A 10 16.409 1.064 -1.039 1.00 0.22 O ATOM 281 OP2 DT A 10 15.708 3.419 -0.295 1.00 0.19 O ATOM 282 O5' DT A 10 14.746 2.386 -2.348 1.00 0.21 O ATOM 283 C5' DT A 10 13.611 1.653 -2.809 1.00 0.19 C ATOM 284 C4' DT A 10 12.972 2.358 -3.982 1.00 0.20 C ATOM 285 O4' DT A 10 11.866 3.157 -3.513 1.00 0.14 O ATOM 286 C3' DT A 10 13.889 3.326 -4.738 1.00 0.24 C ATOM 287 O3' DT A 10 14.248 2.766 -6.008 1.00 0.30 O ATOM 288 C2' DT A 10 13.042 4.581 -4.920 1.00 0.20 C ATOM 289 C1' DT A 10 11.658 4.164 -4.473 1.00 0.15 C ATOM 290 N1 DT A 10 10.880 5.248 -3.858 1.00 0.13 N ATOM 291 C2 DT A 10 9.699 5.611 -4.456 1.00 0.12 C ATOM 292 O2 DT A 10 9.255 5.049 -5.441 1.00 0.11 O ATOM 293 N3 DT A 10 9.055 6.660 -3.859 1.00 0.14 N ATOM 294 C4 DT A 10 9.464 7.365 -2.750 1.00 0.17 C ATOM 295 O4 DT A 10 8.776 8.291 -2.330 1.00 0.21 O ATOM 296 C5 DT A 10 10.713 6.928 -2.164 1.00 0.16 C ATOM 297 C7 DT A 10 11.297 7.731 -1.043 1.00 0.20 C ATOM 298 C6 DT A 10 11.347 5.887 -2.731 1.00 0.14 C ATOM 0 H5' DT A 10 12.886 1.546 -2.002 1.00 0.19 H new ATOM 0 H5'' DT A 10 13.913 0.647 -3.101 1.00 0.19 H new ATOM 0 H4' DT A 10 12.687 1.555 -4.662 1.00 0.20 H new ATOM 0 H3' DT A 10 14.820 3.531 -4.210 1.00 0.24 H new ATOM 0 H2' DT A 10 13.422 5.408 -4.320 1.00 0.20 H new ATOM 0 H2'' DT A 10 13.042 4.914 -5.958 1.00 0.20 H new ATOM 0 H1' DT A 10 11.083 3.843 -5.342 1.00 0.15 H new ATOM 0 H3 DT A 10 8.174 6.952 -4.283 1.00 0.14 H new ATOM 0 H71 DT A 10 11.013 8.777 -1.158 1.00 0.20 H new ATOM 0 H72 DT A 10 10.921 7.355 -0.092 1.00 0.20 H new ATOM 0 H73 DT A 10 12.384 7.646 -1.062 1.00 0.20 H new ATOM 0 H6 DT A 10 12.264 5.536 -2.282 1.00 0.14 H new ATOM 311 P DC A 11 14.922 3.698 -7.134 1.00 0.36 P ATOM 312 OP1 DC A 11 15.514 2.802 -8.160 1.00 0.44 O ATOM 313 OP2 DC A 11 15.778 4.707 -6.460 1.00 0.39 O ATOM 314 O5' DC A 11 13.685 4.457 -7.796 1.00 0.32 O ATOM 315 C5' DC A 11 12.627 3.731 -8.427 1.00 0.28 C ATOM 316 C4' DC A 11 11.878 4.627 -9.386 1.00 0.24 C ATOM 317 O4' DC A 11 11.005 5.492 -8.621 1.00 0.24 O ATOM 318 C3' DC A 11 12.763 5.543 -10.235 1.00 0.23 C ATOM 319 O3' DC A 11 12.284 5.593 -11.584 1.00 0.39 O ATOM 320 C2' DC A 11 12.618 6.908 -9.580 1.00 0.36 C ATOM 321 C1' DC A 11 11.250 6.851 -8.929 1.00 0.29 C ATOM 322 N1 DC A 11 11.150 7.620 -7.682 1.00 0.24 N ATOM 323 C2 DC A 11 10.043 8.446 -7.470 1.00 0.21 C ATOM 324 O2 DC A 11 9.162 8.505 -8.340 1.00 0.20 O ATOM 325 N3 DC A 11 9.961 9.157 -6.323 1.00 0.20 N ATOM 326 C4 DC A 11 10.929 9.061 -5.409 1.00 0.21 C ATOM 327 N4 DC A 11 10.804 9.779 -4.293 1.00 0.23 N ATOM 328 C5 DC A 11 12.067 8.224 -5.602 1.00 0.23 C ATOM 329 C6 DC A 11 12.133 7.530 -6.742 1.00 0.25 C ATOM 0 H5' DC A 11 11.943 3.341 -7.673 1.00 0.28 H new ATOM 0 H5'' DC A 11 13.034 2.873 -8.962 1.00 0.28 H new ATOM 0 H4' DC A 11 11.353 3.955 -10.064 1.00 0.24 H new ATOM 0 H3' DC A 11 13.797 5.200 -10.280 1.00 0.23 H new ATOM 0 H2' DC A 11 13.404 7.085 -8.846 1.00 0.36 H new ATOM 0 H2'' DC A 11 12.679 7.712 -10.313 1.00 0.36 H new ATOM 0 H1' DC A 11 10.530 7.286 -9.623 1.00 0.29 H new ATOM 0 H41 DC A 11 11.524 9.731 -3.572 1.00 0.23 H new ATOM 0 H42 DC A 11 9.988 10.377 -4.160 1.00 0.23 H new ATOM 0 H5 DC A 11 12.845 8.154 -4.856 1.00 0.23 H new ATOM 0 H6 DC A 11 12.981 6.886 -6.922 1.00 0.25 H new ATOM 341 P DC A 12 13.328 5.740 -12.800 1.00 0.17 P ATOM 342 OP1 DC A 12 12.854 4.878 -13.912 1.00 0.19 O ATOM 343 OP2 DC A 12 14.699 5.549 -12.260 1.00 0.20 O ATOM 344 O5' DC A 12 13.190 7.261 -13.253 1.00 0.33 O ATOM 345 C5' DC A 12 12.172 7.667 -14.170 1.00 0.24 C ATOM 346 C4' DC A 12 12.073 9.176 -14.208 1.00 0.29 C ATOM 347 O4' DC A 12 11.382 9.620 -13.022 1.00 0.24 O ATOM 348 C3' DC A 12 13.393 9.944 -14.201 1.00 0.40 C ATOM 349 O3' DC A 12 13.859 10.158 -15.537 1.00 0.51 O ATOM 350 C2' DC A 12 13.012 11.269 -13.560 1.00 0.40 C ATOM 351 C1' DC A 12 11.806 10.931 -12.678 1.00 0.27 C ATOM 352 N1 DC A 12 12.067 10.948 -11.229 1.00 0.19 N ATOM 353 C2 DC A 12 11.341 11.829 -10.426 1.00 0.17 C ATOM 354 O2 DC A 12 10.511 12.576 -10.960 1.00 0.27 O ATOM 355 N3 DC A 12 11.561 11.844 -9.091 1.00 0.19 N ATOM 356 C4 DC A 12 12.471 11.027 -8.558 1.00 0.30 C ATOM 357 N4 DC A 12 12.659 11.077 -7.239 1.00 0.42 N ATOM 358 C5 DC A 12 13.230 10.121 -9.354 1.00 0.35 C ATOM 359 C6 DC A 12 12.996 10.116 -10.672 1.00 0.26 C ATOM 0 H5' DC A 12 11.214 7.240 -13.873 1.00 0.24 H new ATOM 0 H5'' DC A 12 12.396 7.285 -15.166 1.00 0.24 H new ATOM 0 H4' DC A 12 11.572 9.384 -15.154 1.00 0.29 H new ATOM 0 H3' DC A 12 14.192 9.419 -13.678 1.00 0.40 H new ATOM 0 H2' DC A 12 13.834 11.677 -12.971 1.00 0.40 H new ATOM 0 H2'' DC A 12 12.758 12.016 -14.312 1.00 0.40 H new ATOM 0 HO3' DC A 12 14.705 10.653 -15.513 1.00 0.51 H new ATOM 0 H1' DC A 12 11.061 11.704 -12.864 1.00 0.27 H new ATOM 0 H41 DC A 12 13.347 10.466 -6.798 1.00 0.42 H new ATOM 0 H42 DC A 12 12.115 11.726 -6.671 1.00 0.42 H new ATOM 0 H5 DC A 12 13.965 9.465 -8.912 1.00 0.35 H new ATOM 0 H6 DC A 12 13.552 9.442 -11.307 1.00 0.26 H new TER 372 DC A 12 ATOM 373 O5' DG B 13 6.856 19.126 -2.391 1.00 1.25 O ATOM 374 C5' DG B 13 6.670 19.925 -3.564 1.00 1.15 C ATOM 375 C4' DG B 13 6.205 19.085 -4.731 1.00 0.77 C ATOM 376 O4' DG B 13 7.341 18.393 -5.290 1.00 0.47 O ATOM 377 C3' DG B 13 5.197 17.994 -4.379 1.00 0.58 C ATOM 378 O3' DG B 13 3.865 18.469 -4.602 1.00 0.39 O ATOM 379 C2' DG B 13 5.527 16.863 -5.342 1.00 0.66 C ATOM 380 C1' DG B 13 6.932 17.160 -5.857 1.00 0.47 C ATOM 381 N9 DG B 13 7.930 16.158 -5.502 1.00 0.29 N ATOM 382 C8 DG B 13 8.422 15.881 -4.251 1.00 0.25 C ATOM 383 N7 DG B 13 9.320 14.934 -4.249 1.00 0.25 N ATOM 384 C5 DG B 13 9.427 14.563 -5.583 1.00 0.17 C ATOM 385 C6 DG B 13 10.248 13.584 -6.206 1.00 0.18 C ATOM 386 O6 DG B 13 11.065 12.818 -5.683 1.00 0.33 O ATOM 387 N1 DG B 13 10.042 13.544 -7.581 1.00 0.10 N ATOM 388 C2 DG B 13 9.156 14.335 -8.268 1.00 0.23 C ATOM 389 N2 DG B 13 9.093 14.146 -9.589 1.00 0.34 N ATOM 390 N3 DG B 13 8.385 15.246 -7.702 1.00 0.31 N ATOM 391 C4 DG B 13 8.573 15.308 -6.368 1.00 0.22 C ATOM 0 H5' DG B 13 7.606 20.422 -3.821 1.00 1.15 H new ATOM 0 H5'' DG B 13 5.939 20.707 -3.362 1.00 1.15 H new ATOM 0 H4' DG B 13 5.725 19.790 -5.410 1.00 0.77 H new ATOM 0 H3' DG B 13 5.251 17.684 -3.336 1.00 0.58 H new ATOM 0 H2' DG B 13 5.490 15.897 -4.839 1.00 0.66 H new ATOM 0 H2'' DG B 13 4.809 16.824 -6.161 1.00 0.66 H new ATOM 0 HO5' DG B 13 7.184 18.239 -2.648 1.00 1.25 H new ATOM 0 H1' DG B 13 6.874 17.173 -6.945 1.00 0.47 H new ATOM 0 H8 DG B 13 8.099 16.395 -3.358 1.00 0.25 H new ATOM 0 H1 DG B 13 10.592 12.875 -8.120 1.00 0.10 H new ATOM 0 H21 DG B 13 8.453 14.704 -10.154 1.00 0.34 H new ATOM 0 H22 DG B 13 9.685 13.444 -10.032 1.00 0.34 H new ATOM 404 P DG B 14 2.614 17.682 -3.966 1.00 0.26 P ATOM 405 OP1 DG B 14 1.438 18.588 -3.989 1.00 0.27 O ATOM 406 OP2 DG B 14 3.060 17.092 -2.678 1.00 0.40 O ATOM 407 O5' DG B 14 2.342 16.489 -4.988 1.00 0.35 O ATOM 408 C5' DG B 14 2.275 16.724 -6.396 1.00 0.30 C ATOM 409 C4' DG B 14 2.324 15.413 -7.148 1.00 0.33 C ATOM 410 O4' DG B 14 3.636 14.815 -6.970 1.00 0.35 O ATOM 411 C3' DG B 14 1.338 14.337 -6.685 1.00 0.32 C ATOM 412 O3' DG B 14 0.979 13.507 -7.798 1.00 0.33 O ATOM 413 C2' DG B 14 2.155 13.579 -5.663 1.00 0.35 C ATOM 414 C1' DG B 14 3.474 13.525 -6.395 1.00 0.36 C ATOM 415 N9 DG B 14 4.616 13.252 -5.534 1.00 0.38 N ATOM 416 C8 DG B 14 4.860 13.803 -4.305 1.00 0.46 C ATOM 417 N7 DG B 14 5.959 13.365 -3.752 1.00 0.45 N ATOM 418 C5 DG B 14 6.468 12.465 -4.679 1.00 0.37 C ATOM 419 C6 DG B 14 7.642 11.667 -4.642 1.00 0.33 C ATOM 420 O6 DG B 14 8.499 11.594 -3.753 1.00 0.35 O ATOM 421 N1 DG B 14 7.771 10.896 -5.792 1.00 0.26 N ATOM 422 C2 DG B 14 6.889 10.894 -6.844 1.00 0.23 C ATOM 423 N2 DG B 14 7.181 10.084 -7.865 1.00 0.19 N ATOM 424 N3 DG B 14 5.797 11.632 -6.892 1.00 0.26 N ATOM 425 C4 DG B 14 5.650 12.387 -5.785 1.00 0.33 C ATOM 0 H5' DG B 14 3.104 17.360 -6.706 1.00 0.30 H new ATOM 0 H5'' DG B 14 1.356 17.257 -6.640 1.00 0.30 H new ATOM 0 H4' DG B 14 2.072 15.688 -8.172 1.00 0.33 H new ATOM 0 H3' DG B 14 0.400 14.716 -6.280 1.00 0.32 H new ATOM 0 H2' DG B 14 2.225 14.103 -4.710 1.00 0.35 H new ATOM 0 H2'' DG B 14 1.751 12.589 -5.453 1.00 0.35 H new ATOM 0 H1' DG B 14 3.448 12.711 -7.119 1.00 0.36 H new ATOM 0 H8 DG B 14 4.209 14.528 -3.839 1.00 0.46 H new ATOM 0 H1 DG B 14 8.584 10.284 -5.859 1.00 0.26 H new ATOM 0 H21 DG B 14 6.562 10.040 -8.675 1.00 0.19 H new ATOM 0 H22 DG B 14 8.023 9.509 -7.835 1.00 0.19 H new ATOM 437 P DA B 15 -0.067 12.301 -7.602 1.00 0.33 P ATOM 438 OP1 DA B 15 -1.192 12.513 -8.549 1.00 0.35 O ATOM 439 OP2 DA B 15 -0.351 12.155 -6.152 1.00 0.34 O ATOM 440 O5' DA B 15 0.742 11.013 -8.079 1.00 0.34 O ATOM 441 C5' DA B 15 1.550 11.044 -9.260 1.00 0.32 C ATOM 442 C4' DA B 15 1.744 9.643 -9.800 1.00 0.27 C ATOM 443 O4' DA B 15 2.985 9.111 -9.281 1.00 0.24 O ATOM 444 C3' DA B 15 0.684 8.623 -9.392 1.00 0.27 C ATOM 445 O3' DA B 15 0.628 7.558 -10.350 1.00 0.24 O ATOM 446 C2' DA B 15 1.210 8.120 -8.060 1.00 0.25 C ATOM 447 C1' DA B 15 2.722 8.156 -8.256 1.00 0.22 C ATOM 448 N9 DA B 15 3.464 8.571 -7.066 1.00 0.23 N ATOM 449 C8 DA B 15 3.161 9.628 -6.250 1.00 0.28 C ATOM 450 N7 DA B 15 4.013 9.801 -5.269 1.00 0.28 N ATOM 451 C5 DA B 15 4.936 8.779 -5.445 1.00 0.23 C ATOM 452 C6 DA B 15 6.096 8.416 -4.736 1.00 0.21 C ATOM 453 N6 DA B 15 6.558 9.081 -3.677 1.00 0.23 N ATOM 454 N1 DA B 15 6.784 7.340 -5.168 1.00 0.16 N ATOM 455 C2 DA B 15 6.335 6.680 -6.242 1.00 0.14 C ATOM 456 N3 DA B 15 5.272 6.933 -7.004 1.00 0.16 N ATOM 457 C4 DA B 15 4.605 8.007 -6.545 1.00 0.20 C ATOM 0 H5' DA B 15 2.518 11.492 -9.035 1.00 0.32 H new ATOM 0 H5'' DA B 15 1.077 11.670 -10.016 1.00 0.32 H new ATOM 0 H4' DA B 15 1.705 9.765 -10.882 1.00 0.27 H new ATOM 0 H3' DA B 15 -0.325 9.032 -9.334 1.00 0.27 H new ATOM 0 H2' DA B 15 0.894 8.757 -7.234 1.00 0.25 H new ATOM 0 H2'' DA B 15 0.855 7.113 -7.839 1.00 0.25 H new ATOM 0 H1' DA B 15 3.048 7.145 -8.499 1.00 0.22 H new ATOM 0 H8 DA B 15 2.299 10.261 -6.401 1.00 0.28 H new ATOM 0 H61 DA B 15 7.406 8.765 -3.207 1.00 0.23 H new ATOM 0 H62 DA B 15 6.063 9.906 -3.337 1.00 0.23 H new ATOM 0 H2 DA B 15 6.918 5.819 -6.533 1.00 0.14 H new ATOM 469 P DG B 16 -0.221 6.229 -10.026 1.00 0.24 P ATOM 470 OP1 DG B 16 -0.755 5.704 -11.309 1.00 0.23 O ATOM 471 OP2 DG B 16 -1.160 6.543 -8.917 1.00 0.27 O ATOM 472 O5' DG B 16 0.865 5.198 -9.480 1.00 0.20 O ATOM 473 C5' DG B 16 1.693 4.462 -10.381 1.00 0.15 C ATOM 474 C4' DG B 16 2.612 3.535 -9.619 1.00 0.14 C ATOM 475 O4' DG B 16 3.220 4.262 -8.524 1.00 0.15 O ATOM 476 C3' DG B 16 1.937 2.307 -8.992 1.00 0.15 C ATOM 477 O3' DG B 16 2.552 1.111 -9.495 1.00 0.15 O ATOM 478 C2' DG B 16 2.196 2.459 -7.495 1.00 0.14 C ATOM 479 C1' DG B 16 3.409 3.360 -7.459 1.00 0.15 C ATOM 480 N9 DG B 16 3.573 4.127 -6.229 1.00 0.15 N ATOM 481 C8 DG B 16 2.716 5.065 -5.708 1.00 0.18 C ATOM 482 N7 DG B 16 3.142 5.589 -4.592 1.00 0.18 N ATOM 483 C5 DG B 16 4.351 4.950 -4.356 1.00 0.15 C ATOM 484 C6 DG B 16 5.270 5.094 -3.291 1.00 0.14 C ATOM 485 O6 DG B 16 5.202 5.845 -2.313 1.00 0.16 O ATOM 486 N1 DG B 16 6.364 4.249 -3.441 1.00 0.12 N ATOM 487 C2 DG B 16 6.548 3.375 -4.482 1.00 0.11 C ATOM 488 N2 DG B 16 7.663 2.638 -4.444 1.00 0.11 N ATOM 489 N3 DG B 16 5.701 3.233 -5.485 1.00 0.12 N ATOM 490 C4 DG B 16 4.630 4.044 -5.357 1.00 0.14 C ATOM 0 H5' DG B 16 2.282 5.150 -10.987 1.00 0.15 H new ATOM 0 H5'' DG B 16 1.072 3.885 -11.066 1.00 0.15 H new ATOM 0 H4' DG B 16 3.322 3.178 -10.366 1.00 0.14 H new ATOM 0 H3' DG B 16 0.873 2.239 -9.219 1.00 0.15 H new ATOM 0 H2' DG B 16 1.345 2.904 -6.980 1.00 0.14 H new ATOM 0 H2'' DG B 16 2.390 1.498 -7.018 1.00 0.14 H new ATOM 0 H1' DG B 16 4.304 2.741 -7.528 1.00 0.15 H new ATOM 0 H8 DG B 16 1.782 5.341 -6.176 1.00 0.18 H new ATOM 0 H1 DG B 16 7.086 4.282 -2.721 1.00 0.12 H new ATOM 0 H21 DG B 16 7.858 1.969 -5.189 1.00 0.11 H new ATOM 0 H22 DG B 16 8.319 2.745 -3.670 1.00 0.11 H new ATOM 502 P DG B 17 2.313 -0.296 -8.749 1.00 0.16 P ATOM 503 OP1 DG B 17 2.538 -1.367 -9.753 1.00 0.18 O ATOM 504 OP2 DG B 17 1.022 -0.239 -8.015 1.00 0.17 O ATOM 505 O5' DG B 17 3.494 -0.367 -7.680 1.00 0.15 O ATOM 506 C5' DG B 17 4.817 0.056 -8.020 1.00 0.15 C ATOM 507 C4' DG B 17 5.842 -0.866 -7.401 1.00 0.13 C ATOM 508 O4' DG B 17 6.328 -0.271 -6.175 1.00 0.12 O ATOM 509 C3' DG B 17 5.329 -2.256 -7.029 1.00 0.13 C ATOM 510 O3' DG B 17 6.338 -3.240 -7.280 1.00 0.12 O ATOM 511 C2' DG B 17 5.042 -2.162 -5.538 1.00 0.11 C ATOM 512 C1' DG B 17 5.901 -1.003 -5.038 1.00 0.11 C ATOM 513 N9 DG B 17 5.211 -0.071 -4.149 1.00 0.11 N ATOM 514 C8 DG B 17 3.972 0.490 -4.340 1.00 0.11 C ATOM 515 N7 DG B 17 3.617 1.295 -3.376 1.00 0.11 N ATOM 516 C5 DG B 17 4.687 1.264 -2.492 1.00 0.11 C ATOM 517 C6 DG B 17 4.874 1.934 -1.255 1.00 0.10 C ATOM 518 O6 DG B 17 4.107 2.711 -0.678 1.00 0.10 O ATOM 519 N1 DG B 17 6.103 1.620 -0.683 1.00 0.10 N ATOM 520 C2 DG B 17 7.034 0.773 -1.233 1.00 0.10 C ATOM 521 N2 DG B 17 8.174 0.613 -0.544 1.00 0.10 N ATOM 522 N3 DG B 17 6.866 0.132 -2.379 1.00 0.11 N ATOM 523 C4 DG B 17 5.679 0.424 -2.952 1.00 0.11 C ATOM 0 H5' DG B 17 4.980 1.076 -7.672 1.00 0.15 H new ATOM 0 H5'' DG B 17 4.935 0.066 -9.104 1.00 0.15 H new ATOM 0 H4' DG B 17 6.606 -0.992 -8.168 1.00 0.13 H new ATOM 0 H3' DG B 17 4.452 -2.549 -7.607 1.00 0.13 H new ATOM 0 H2' DG B 17 3.984 -1.977 -5.351 1.00 0.11 H new ATOM 0 H2'' DG B 17 5.298 -3.091 -5.028 1.00 0.11 H new ATOM 0 H1' DG B 17 6.715 -1.441 -4.460 1.00 0.11 H new ATOM 0 H8 DG B 17 3.354 0.286 -5.201 1.00 0.11 H new ATOM 0 H1 DG B 17 6.330 2.052 0.213 1.00 0.10 H new ATOM 0 H21 DG B 17 8.904 -0.004 -0.901 1.00 0.10 H new ATOM 0 H22 DG B 17 8.311 1.108 0.337 1.00 0.10 H new ATOM 535 P DC B 18 5.912 -4.755 -7.613 1.00 0.13 P ATOM 536 OP1 DC B 18 6.897 -5.279 -8.594 1.00 0.14 O ATOM 537 OP2 DC B 18 4.463 -4.792 -7.939 1.00 0.14 O ATOM 538 O5' DC B 18 6.133 -5.527 -6.237 1.00 0.11 O ATOM 539 C5' DC B 18 7.383 -5.459 -5.551 1.00 0.12 C ATOM 540 C4' DC B 18 7.167 -5.534 -4.058 1.00 0.11 C ATOM 541 O4' DC B 18 6.424 -4.374 -3.638 1.00 0.10 O ATOM 542 C3' DC B 18 6.349 -6.734 -3.576 1.00 0.10 C ATOM 543 O3' DC B 18 7.217 -7.756 -3.072 1.00 0.10 O ATOM 544 C2' DC B 18 5.486 -6.173 -2.452 1.00 0.08 C ATOM 545 C1' DC B 18 5.796 -4.682 -2.413 1.00 0.09 C ATOM 546 N1 DC B 18 4.613 -3.819 -2.278 1.00 0.08 N ATOM 547 C2 DC B 18 4.479 -3.040 -1.130 1.00 0.08 C ATOM 548 O2 DC B 18 5.366 -3.089 -0.270 1.00 0.07 O ATOM 549 N3 DC B 18 3.389 -2.253 -0.985 1.00 0.07 N ATOM 550 C4 DC B 18 2.454 -2.230 -1.937 1.00 0.08 C ATOM 551 N4 DC B 18 1.394 -1.441 -1.751 1.00 0.08 N ATOM 552 C5 DC B 18 2.566 -3.013 -3.123 1.00 0.09 C ATOM 553 C6 DC B 18 3.654 -3.783 -3.252 1.00 0.09 C ATOM 0 H5' DC B 18 7.895 -4.531 -5.805 1.00 0.12 H new ATOM 0 H5'' DC B 18 8.027 -6.277 -5.874 1.00 0.12 H new ATOM 0 H4' DC B 18 8.169 -5.612 -3.636 1.00 0.11 H new ATOM 0 H3' DC B 18 5.758 -7.186 -4.373 1.00 0.10 H new ATOM 0 H2' DC B 18 4.428 -6.350 -2.643 1.00 0.08 H new ATOM 0 H2'' DC B 18 5.722 -6.649 -1.500 1.00 0.08 H new ATOM 0 H1' DC B 18 6.412 -4.492 -1.534 1.00 0.09 H new ATOM 0 H41 DC B 18 0.660 -1.398 -2.458 1.00 0.08 H new ATOM 0 H42 DC B 18 1.318 -0.881 -0.902 1.00 0.08 H new ATOM 0 H5 DC B 18 1.803 -2.986 -3.887 1.00 0.09 H new ATOM 0 H6 DC B 18 3.776 -4.385 -4.140 1.00 0.09 H new ATOM 565 P DC B 19 6.595 -9.136 -2.526 1.00 0.10 P ATOM 566 OP1 DC B 19 7.716 -10.101 -2.384 1.00 0.11 O ATOM 567 OP2 DC B 19 5.425 -9.492 -3.370 1.00 0.11 O ATOM 568 O5' DC B 19 6.062 -8.771 -1.069 1.00 0.09 O ATOM 569 C5' DC B 19 6.966 -8.613 0.028 1.00 0.08 C ATOM 570 C4' DC B 19 6.201 -8.531 1.330 1.00 0.08 C ATOM 571 O4' DC B 19 5.412 -7.318 1.346 1.00 0.07 O ATOM 572 C3' DC B 19 5.224 -9.684 1.583 1.00 0.09 C ATOM 573 O3' DC B 19 5.550 -10.318 2.826 1.00 0.11 O ATOM 574 C2' DC B 19 3.857 -9.019 1.651 1.00 0.08 C ATOM 575 C1' DC B 19 4.173 -7.575 1.971 1.00 0.07 C ATOM 576 N1 DC B 19 3.204 -6.587 1.469 1.00 0.06 N ATOM 577 C2 DC B 19 2.604 -5.713 2.379 1.00 0.06 C ATOM 578 O2 DC B 19 2.877 -5.820 3.582 1.00 0.07 O ATOM 579 N3 DC B 19 1.742 -4.775 1.926 1.00 0.05 N ATOM 580 C4 DC B 19 1.465 -4.698 0.623 1.00 0.06 C ATOM 581 N4 DC B 19 0.603 -3.761 0.226 1.00 0.06 N ATOM 582 C5 DC B 19 2.057 -5.580 -0.327 1.00 0.06 C ATOM 583 C6 DC B 19 2.907 -6.506 0.137 1.00 0.06 C ATOM 0 H5' DC B 19 7.561 -7.710 -0.109 1.00 0.08 H new ATOM 0 H5'' DC B 19 7.661 -9.452 0.059 1.00 0.08 H new ATOM 0 H4' DC B 19 6.967 -8.567 2.105 1.00 0.08 H new ATOM 0 H3' DC B 19 5.258 -10.454 0.813 1.00 0.09 H new ATOM 0 H2' DC B 19 3.320 -9.111 0.707 1.00 0.08 H new ATOM 0 H2'' DC B 19 3.230 -9.471 2.420 1.00 0.08 H new ATOM 0 H1' DC B 19 4.161 -7.464 3.055 1.00 0.07 H new ATOM 0 H41 DC B 19 0.366 -3.671 -0.762 1.00 0.06 H new ATOM 0 H42 DC B 19 0.180 -3.134 0.911 1.00 0.06 H new ATOM 0 H5 DC B 19 1.829 -5.505 -1.380 1.00 0.06 H new ATOM 0 H6 DC B 19 3.365 -7.200 -0.553 1.00 0.06 H new ATOM 595 P DT B 20 4.572 -11.439 3.436 1.00 0.12 P ATOM 596 OP1 DT B 20 5.326 -12.156 4.495 1.00 0.15 O ATOM 597 OP2 DT B 20 3.978 -12.206 2.311 1.00 0.12 O ATOM 598 O5' DT B 20 3.412 -10.597 4.132 1.00 0.11 O ATOM 599 C5' DT B 20 3.687 -9.729 5.236 1.00 0.11 C ATOM 600 C4' DT B 20 2.411 -9.429 5.991 1.00 0.11 C ATOM 601 O4' DT B 20 1.689 -8.365 5.316 1.00 0.10 O ATOM 602 C3' DT B 20 1.407 -10.587 6.115 1.00 0.13 C ATOM 603 O3' DT B 20 0.894 -10.615 7.456 1.00 0.15 O ATOM 604 C2' DT B 20 0.327 -10.218 5.113 1.00 0.13 C ATOM 605 C1' DT B 20 0.318 -8.717 5.278 1.00 0.11 C ATOM 606 N1 DT B 20 -0.338 -7.923 4.210 1.00 0.10 N ATOM 607 C2 DT B 20 -0.972 -6.765 4.605 1.00 0.09 C ATOM 608 O2 DT B 20 -1.023 -6.404 5.767 1.00 0.10 O ATOM 609 N3 DT B 20 -1.542 -6.044 3.588 1.00 0.09 N ATOM 610 C4 DT B 20 -1.538 -6.352 2.247 1.00 0.09 C ATOM 611 O4 DT B 20 -2.074 -5.591 1.446 1.00 0.09 O ATOM 612 C5 DT B 20 -0.864 -7.583 1.897 1.00 0.09 C ATOM 613 C7 DT B 20 -0.846 -8.016 0.465 1.00 0.10 C ATOM 614 C6 DT B 20 -0.310 -8.308 2.882 1.00 0.10 C ATOM 0 H5' DT B 20 4.133 -8.801 4.877 1.00 0.11 H new ATOM 0 H5'' DT B 20 4.413 -10.195 5.903 1.00 0.11 H new ATOM 0 H4' DT B 20 2.759 -9.181 6.994 1.00 0.11 H new ATOM 0 H3' DT B 20 1.827 -11.574 5.920 1.00 0.13 H new ATOM 0 H2' DT B 20 0.579 -10.524 4.098 1.00 0.13 H new ATOM 0 H2'' DT B 20 -0.636 -10.669 5.353 1.00 0.13 H new ATOM 0 H1' DT B 20 -0.271 -8.484 6.165 1.00 0.11 H new ATOM 0 H3 DT B 20 -2.022 -5.184 3.855 1.00 0.09 H new ATOM 0 H71 DT B 20 0.063 -8.584 0.268 1.00 0.10 H new ATOM 0 H72 DT B 20 -1.716 -8.641 0.263 1.00 0.10 H new ATOM 0 H73 DT B 20 -0.872 -7.138 -0.181 1.00 0.10 H new ATOM 0 H6 DT B 20 0.180 -9.235 2.625 1.00 0.10 H new ATOM 627 P DG B 21 -0.230 -11.689 7.874 1.00 0.19 P ATOM 628 OP1 DG B 21 0.322 -12.469 9.010 1.00 0.24 O ATOM 629 OP2 DG B 21 -0.714 -12.402 6.665 1.00 0.19 O ATOM 630 O5' DG B 21 -1.418 -10.785 8.436 1.00 0.20 O ATOM 631 C5' DG B 21 -1.227 -9.952 9.583 1.00 0.21 C ATOM 632 C4' DG B 21 -2.434 -9.067 9.802 1.00 0.21 C ATOM 633 O4' DG B 21 -2.711 -8.300 8.600 1.00 0.19 O ATOM 634 C3' DG B 21 -3.734 -9.810 10.133 1.00 0.23 C ATOM 635 O3' DG B 21 -4.345 -9.205 11.279 1.00 0.21 O ATOM 636 C2' DG B 21 -4.594 -9.623 8.892 1.00 0.23 C ATOM 637 C1' DG B 21 -4.109 -8.293 8.369 1.00 0.21 C ATOM 638 N9 DG B 21 -4.333 -8.057 6.945 1.00 0.20 N ATOM 639 C8 DG B 21 -4.062 -8.915 5.908 1.00 0.21 C ATOM 640 N7 DG B 21 -4.300 -8.398 4.735 1.00 0.21 N ATOM 641 C5 DG B 21 -4.797 -7.133 5.014 1.00 0.21 C ATOM 642 C6 DG B 21 -5.252 -6.118 4.142 1.00 0.21 C ATOM 643 O6 DG B 21 -5.292 -6.128 2.909 1.00 0.21 O ATOM 644 N1 DG B 21 -5.693 -5.000 4.841 1.00 0.20 N ATOM 645 C2 DG B 21 -5.697 -4.878 6.207 1.00 0.20 C ATOM 646 N2 DG B 21 -6.171 -3.725 6.694 1.00 0.20 N ATOM 647 N3 DG B 21 -5.273 -5.817 7.035 1.00 0.20 N ATOM 648 C4 DG B 21 -4.839 -6.912 6.374 1.00 0.20 C ATOM 0 H5' DG B 21 -0.337 -9.337 9.449 1.00 0.21 H new ATOM 0 H5'' DG B 21 -1.057 -10.570 10.465 1.00 0.21 H new ATOM 0 H4' DG B 21 -2.161 -8.453 10.660 1.00 0.21 H new ATOM 0 H3' DG B 21 -3.587 -10.864 10.370 1.00 0.23 H new ATOM 0 H2' DG B 21 -4.445 -10.424 8.168 1.00 0.23 H new ATOM 0 H2'' DG B 21 -5.657 -9.604 9.132 1.00 0.23 H new ATOM 0 H1' DG B 21 -4.666 -7.505 8.875 1.00 0.21 H new ATOM 0 H8 DG B 21 -3.689 -9.918 6.050 1.00 0.21 H new ATOM 0 H1 DG B 21 -6.040 -4.210 4.296 1.00 0.20 H new ATOM 0 H21 DG B 21 -6.201 -3.571 7.702 1.00 0.20 H new ATOM 0 H22 DG B 21 -6.502 -3.000 6.057 1.00 0.20 H new ATOM 660 P DA B 22 -5.713 -9.805 11.872 1.00 0.34 P ATOM 661 OP1 DA B 22 -5.528 -10.007 13.331 1.00 0.38 O ATOM 662 OP2 DA B 22 -6.130 -10.949 11.021 1.00 0.41 O ATOM 663 O5' DA B 22 -6.762 -8.624 11.666 1.00 0.35 O ATOM 664 C5' DA B 22 -6.351 -7.256 11.729 1.00 0.29 C ATOM 665 C4' DA B 22 -7.529 -6.343 11.478 1.00 0.34 C ATOM 666 O4' DA B 22 -7.562 -5.996 10.071 1.00 0.37 O ATOM 667 C3' DA B 22 -8.895 -6.955 11.782 1.00 0.41 C ATOM 668 O3' DA B 22 -9.802 -5.942 12.232 1.00 0.48 O ATOM 669 C2' DA B 22 -9.318 -7.514 10.437 1.00 0.40 C ATOM 670 C1' DA B 22 -8.758 -6.483 9.479 1.00 0.36 C ATOM 671 N9 DA B 22 -8.425 -7.010 8.158 1.00 0.32 N ATOM 672 C8 DA B 22 -7.780 -8.185 7.876 1.00 0.31 C ATOM 673 N7 DA B 22 -7.596 -8.395 6.596 1.00 0.27 N ATOM 674 C5 DA B 22 -8.169 -7.284 5.992 1.00 0.25 C ATOM 675 C6 DA B 22 -8.315 -6.907 4.646 1.00 0.22 C ATOM 676 N6 DA B 22 -7.881 -7.640 3.620 1.00 0.20 N ATOM 677 N1 DA B 22 -8.936 -5.737 4.386 1.00 0.21 N ATOM 678 C2 DA B 22 -9.383 -5.006 5.414 1.00 0.24 C ATOM 679 N3 DA B 22 -9.319 -5.260 6.718 1.00 0.28 N ATOM 680 C4 DA B 22 -8.689 -6.426 6.943 1.00 0.28 C ATOM 0 H5' DA B 22 -5.573 -7.068 10.989 1.00 0.29 H new ATOM 0 H5'' DA B 22 -5.919 -7.043 12.707 1.00 0.29 H new ATOM 0 H4' DA B 22 -7.377 -5.497 12.148 1.00 0.34 H new ATOM 0 H3' DA B 22 -8.877 -7.709 12.569 1.00 0.41 H new ATOM 0 H2' DA B 22 -8.902 -8.506 10.258 1.00 0.40 H new ATOM 0 H2'' DA B 22 -10.401 -7.603 10.354 1.00 0.40 H new ATOM 0 H1' DA B 22 -9.521 -5.721 9.321 1.00 0.36 H new ATOM 0 H8 DA B 22 -7.453 -8.875 8.639 1.00 0.31 H new ATOM 0 H61 DA B 22 -8.018 -7.311 2.664 1.00 0.20 H new ATOM 0 H62 DA B 22 -7.413 -8.530 3.791 1.00 0.20 H new ATOM 0 H2 DA B 22 -9.865 -4.077 5.147 1.00 0.24 H new ATOM 692 P DG B 23 -11.306 -6.338 12.639 1.00 0.57 P ATOM 693 OP1 DG B 23 -11.873 -5.199 13.405 1.00 0.65 O ATOM 694 OP2 DG B 23 -11.289 -7.693 13.247 1.00 0.64 O ATOM 695 O5' DG B 23 -12.070 -6.429 11.244 1.00 0.48 O ATOM 696 C5' DG B 23 -12.226 -5.276 10.413 1.00 0.41 C ATOM 697 C4' DG B 23 -13.236 -5.551 9.323 1.00 0.34 C ATOM 698 O4' DG B 23 -12.531 -5.992 8.138 1.00 0.31 O ATOM 699 C3' DG B 23 -14.254 -6.651 9.651 1.00 0.38 C ATOM 700 O3' DG B 23 -15.588 -6.139 9.555 1.00 0.38 O ATOM 701 C2' DG B 23 -14.020 -7.713 8.588 1.00 0.37 C ATOM 702 C1' DG B 23 -13.322 -6.955 7.483 1.00 0.31 C ATOM 703 N9 DG B 23 -12.452 -7.776 6.648 1.00 0.30 N ATOM 704 C8 DG B 23 -11.676 -8.829 7.058 1.00 0.32 C ATOM 705 N7 DG B 23 -11.015 -9.393 6.085 1.00 0.30 N ATOM 706 C5 DG B 23 -11.379 -8.666 4.959 1.00 0.27 C ATOM 707 C6 DG B 23 -10.991 -8.817 3.603 1.00 0.25 C ATOM 708 O6 DG B 23 -10.218 -9.645 3.110 1.00 0.25 O ATOM 709 N1 DG B 23 -11.604 -7.872 2.788 1.00 0.22 N ATOM 710 C2 DG B 23 -12.471 -6.900 3.223 1.00 0.22 C ATOM 711 N2 DG B 23 -12.954 -6.075 2.288 1.00 0.20 N ATOM 712 N3 DG B 23 -12.839 -6.746 4.483 1.00 0.24 N ATOM 713 C4 DG B 23 -12.261 -7.660 5.291 1.00 0.27 C ATOM 0 H5' DG B 23 -11.267 -5.005 9.971 1.00 0.41 H new ATOM 0 H5'' DG B 23 -12.551 -4.427 11.014 1.00 0.41 H new ATOM 0 H4' DG B 23 -13.783 -4.617 9.193 1.00 0.34 H new ATOM 0 H3' DG B 23 -14.136 -7.039 10.663 1.00 0.38 H new ATOM 0 H2' DG B 23 -13.405 -8.530 8.965 1.00 0.37 H new ATOM 0 H2'' DG B 23 -14.957 -8.151 8.245 1.00 0.37 H new ATOM 0 H1' DG B 23 -14.074 -6.544 6.809 1.00 0.31 H new ATOM 0 H8 DG B 23 -11.618 -9.159 8.085 1.00 0.32 H new ATOM 0 H1 DG B 23 -11.394 -7.903 1.790 1.00 0.22 H new ATOM 0 H21 DG B 23 -13.603 -5.332 2.549 1.00 0.20 H new ATOM 0 H22 DG B 23 -12.674 -6.188 1.314 1.00 0.20 H new ATOM 725 P DG B 24 -16.812 -6.975 10.180 1.00 0.37 P ATOM 726 OP1 DG B 24 -17.468 -6.107 11.192 1.00 0.36 O ATOM 727 OP2 DG B 24 -16.321 -8.320 10.576 1.00 0.57 O ATOM 728 O5' DG B 24 -17.820 -7.157 8.959 1.00 0.36 O ATOM 729 C5' DG B 24 -18.361 -6.024 8.277 1.00 0.31 C ATOM 730 C4' DG B 24 -18.803 -6.412 6.885 1.00 0.42 C ATOM 731 O4' DG B 24 -17.705 -7.078 6.216 1.00 0.42 O ATOM 732 C3' DG B 24 -19.992 -7.378 6.826 1.00 0.63 C ATOM 733 O3' DG B 24 -20.988 -6.886 5.927 1.00 0.71 O ATOM 734 C2' DG B 24 -19.400 -8.673 6.288 1.00 0.65 C ATOM 735 C1' DG B 24 -18.199 -8.191 5.504 1.00 0.53 C ATOM 736 N9 DG B 24 -17.112 -9.158 5.369 1.00 0.55 N ATOM 737 C8 DG B 24 -16.504 -9.877 6.371 1.00 0.62 C ATOM 738 N7 DG B 24 -15.556 -10.662 5.939 1.00 0.66 N ATOM 739 C5 DG B 24 -15.535 -10.450 4.567 1.00 0.60 C ATOM 740 C6 DG B 24 -14.716 -11.024 3.561 1.00 0.62 C ATOM 741 O6 DG B 24 -13.816 -11.862 3.686 1.00 0.70 O ATOM 742 N1 DG B 24 -15.030 -10.527 2.301 1.00 0.54 N ATOM 743 C2 DG B 24 -16.005 -9.598 2.041 1.00 0.49 C ATOM 744 N2 DG B 24 -16.153 -9.239 0.760 1.00 0.46 N ATOM 745 N3 DG B 24 -16.778 -9.057 2.967 1.00 0.49 N ATOM 746 C4 DG B 24 -16.490 -9.525 4.200 1.00 0.54 C ATOM 0 H5' DG B 24 -17.613 -5.233 8.221 1.00 0.31 H new ATOM 0 H5'' DG B 24 -19.207 -5.624 8.836 1.00 0.31 H new ATOM 0 H4' DG B 24 -19.111 -5.479 6.414 1.00 0.42 H new ATOM 0 H3' DG B 24 -20.472 -7.505 7.796 1.00 0.63 H new ATOM 0 H2' DG B 24 -19.113 -9.351 7.092 1.00 0.65 H new ATOM 0 H2'' DG B 24 -20.107 -9.209 5.656 1.00 0.65 H new ATOM 0 HO3' DG B 24 -21.741 -7.513 5.898 1.00 0.71 H new ATOM 0 H1' DG B 24 -18.528 -7.982 4.486 1.00 0.53 H new ATOM 0 H8 DG B 24 -16.783 -9.800 7.411 1.00 0.62 H new ATOM 0 H1 DG B 24 -14.494 -10.881 1.509 1.00 0.54 H new ATOM 0 H21 DG B 24 -16.861 -8.552 0.501 1.00 0.46 H new ATOM 0 H22 DG B 24 -15.558 -9.652 0.042 1.00 0.46 H new TER 759 DG B 24 HETATM 760 PT 1PT A 77 -0.406 1.483 3.168 1.00 0.06 PT HETATM 761 N1 1PT A 77 -2.370 1.700 2.727 1.00 0.08 N HETATM 762 N2 1PT A 77 -0.094 2.941 1.796 1.00 0.09 N HETATM 763 C1 1PT A 77 -2.547 3.060 2.027 1.00 0.11 C HETATM 764 C2 1PT A 77 -1.411 3.188 1.028 1.00 0.12 C HETATM 765 C3 1PT A 77 -1.440 4.524 0.345 1.00 0.16 C HETATM 766 C4 1PT A 77 -2.760 4.735 -0.361 1.00 0.19 C HETATM 767 C5 1PT A 77 -3.999 4.606 0.657 1.00 0.18 C HETATM 768 C6 1PT A 77 -3.872 3.202 1.355 1.00 0.14 C HETATM 0 H62 1PT A 77 -3.996 2.411 0.615 1.00 0.14 H new HETATM 0 H61 1PT A 77 -4.670 3.082 2.087 1.00 0.14 H new HETATM 0 H52 1PT A 77 -3.977 5.408 1.395 1.00 0.18 H new HETATM 0 H51 1PT A 77 -4.947 4.688 0.125 1.00 0.18 H new HETATM 0 H42 1PT A 77 -2.771 5.720 -0.827 1.00 0.19 H new HETATM 0 H41 1PT A 77 -2.867 4.003 -1.161 1.00 0.19 H new HETATM 0 H32 1PT A 77 -1.283 5.316 1.077 1.00 0.16 H new HETATM 0 H31 1PT A 77 -0.623 4.588 -0.374 1.00 0.16 H new HETATM 0 H2 1PT A 77 -1.508 2.452 0.230 1.00 0.12 H new HETATM 0 H1 1PT A 77 -2.519 3.858 2.769 1.00 0.11 H new