USER MOD reduce.3.24.130724 H: found=0, std=0, add=274, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 274 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DT C7 :methyl 150:sc= -0.015 (180deg=-0.015) USER MOD Single : A 1 DT O5' : rot 180:sc= -0.112 USER MOD Single : A 2 DT C7 :methyl -30:sc= -3.56! (180deg=-4.21!) USER MOD Single : A 7 DT C7 :methyl -30:sc= -3.07 (180deg=-5.18!) USER MOD Single : A 8 DT C7 :methyl -30:sc= -0.202 (180deg=-1.2) USER MOD Single : A 13 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl -30:sc= -0.122 (180deg=-0.416) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 20 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 11.477 7.429 2.174 1.00 0.79 O ATOM 2 C5' DT A 1 10.639 7.453 1.012 1.00 0.74 C ATOM 3 C4' DT A 1 9.168 7.523 1.414 1.00 0.57 C ATOM 4 O4' DT A 1 8.766 6.409 2.224 1.00 0.60 O ATOM 5 C3' DT A 1 8.833 8.796 2.206 1.00 0.45 C ATOM 6 O3' DT A 1 7.503 9.156 1.817 1.00 0.51 O ATOM 7 C2' DT A 1 8.925 8.254 3.645 1.00 0.46 C ATOM 8 C1' DT A 1 8.202 6.908 3.437 1.00 0.51 C ATOM 9 N1 DT A 1 8.463 5.986 4.542 1.00 0.68 N ATOM 10 C2 DT A 1 7.504 5.769 5.510 1.00 0.84 C ATOM 11 O2 DT A 1 6.404 6.309 5.507 1.00 0.91 O ATOM 12 N3 DT A 1 7.857 4.889 6.503 1.00 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6.396 10.925 0.455 1.00 0.78 O ATOM 33 OP2 DT A 2 7.922 11.573 2.416 1.00 0.86 O ATOM 34 O5' DT A 2 5.655 10.544 2.755 1.00 0.93 O ATOM 35 C5' DT A 2 5.468 10.548 4.168 1.00 0.71 C ATOM 36 C4' DT A 2 4.045 9.997 4.416 1.00 0.60 C ATOM 37 O4' DT A 2 3.279 9.923 3.187 1.00 0.61 O ATOM 38 C3' DT A 2 3.993 8.533 4.913 1.00 0.50 C ATOM 39 O3' DT A 2 2.709 8.204 5.487 1.00 0.49 O ATOM 40 C2' DT A 2 4.165 7.836 3.603 1.00 0.45 C ATOM 41 C1' DT A 2 3.081 8.546 2.829 1.00 0.49 C ATOM 42 N1 DT A 2 3.157 8.373 1.360 1.00 0.46 N ATOM 43 C2 DT A 2 1.948 8.437 0.687 1.00 0.50 C ATOM 44 O2 DT A 2 0.863 8.601 1.236 1.00 0.59 O ATOM 45 N3 DT A 2 2.008 8.293 -0.666 1.00 0.50 N ATOM 46 C4 DT A 2 3.141 8.091 -1.422 1.00 0.47 C ATOM 47 O4 DT A 2 3.054 7.967 -2.637 1.00 0.50 O ATOM 48 C5 DT A 2 4.359 8.033 -0.659 1.00 0.44 C ATOM 49 C7 DT A 2 5.686 7.816 -1.381 1.00 0.46 C ATOM 50 C6 DT A 2 4.345 8.172 0.675 1.00 0.44 C ATOM 0 H5' DT A 2 5.571 11.555 4.572 1.00 0.71 H new ATOM 0 H5'' DT A 2 6.217 9.929 4.662 1.00 0.71 H new ATOM 0 H4' DT A 2 3.656 10.692 5.160 1.00 0.60 H new ATOM 0 H3' DT A 2 4.714 8.288 5.693 1.00 0.50 H new ATOM 0 H2' DT A 2 5.156 7.981 3.173 1.00 0.45 H new ATOM 0 H2'' DT A 2 4.001 6.761 3.671 1.00 0.45 H new ATOM 0 H1' DT A 2 2.099 8.144 3.078 1.00 0.49 H new ATOM 0 H3 DT A 2 1.123 8.340 -1.171 1.00 0.50 H new ATOM 0 H71 DT A 2 5.518 7.226 -2.282 1.00 0.46 H new ATOM 0 H72 DT A 2 6.114 8.781 -1.654 1.00 0.46 H new ATOM 0 H73 DT A 2 6.375 7.286 -0.724 1.00 0.46 H new ATOM 0 H6 DT A 2 5.274 8.127 1.224 1.00 0.44 H new ATOM 63 P DG A 3 1.834 9.178 6.448 1.00 0.50 P ATOM 64 OP1 DG A 3 0.460 9.253 5.913 1.00 0.70 O ATOM 65 OP2 DG A 3 2.589 10.437 6.666 1.00 0.68 O ATOM 66 O5' DG A 3 1.856 8.397 7.860 1.00 0.67 O ATOM 67 C5' DG A 3 1.369 7.071 8.105 1.00 0.67 C ATOM 68 C4' DG A 3 -0.156 7.021 8.232 1.00 0.61 C ATOM 69 O4' DG A 3 -0.803 7.251 6.964 1.00 0.59 O ATOM 70 C3' DG A 3 -0.631 5.631 8.685 1.00 0.62 C ATOM 71 O3' DG A 3 -1.725 5.623 9.632 1.00 0.66 O ATOM 72 C2' DG A 3 -0.874 4.995 7.329 1.00 0.51 C ATOM 73 C1' DG A 3 -1.608 6.118 6.652 1.00 0.48 C ATOM 74 N9 DG A 3 -1.774 5.832 5.217 1.00 0.40 N ATOM 75 C8 DG A 3 -2.945 5.796 4.520 1.00 0.42 C ATOM 76 N7 DG A 3 -2.815 5.489 3.265 1.00 0.41 N ATOM 77 C5 DG A 3 -1.446 5.309 3.119 1.00 0.35 C ATOM 78 C6 DG A 3 -0.704 4.963 1.970 1.00 0.35 C ATOM 79 O6 DG A 3 -1.116 4.735 0.843 1.00 0.40 O ATOM 80 N1 DG A 3 0.632 4.882 2.223 1.00 0.36 N ATOM 81 C2 DG A 3 1.207 5.105 3.445 1.00 0.38 C ATOM 82 N2 DG A 3 2.515 4.986 3.497 1.00 0.44 N ATOM 83 N3 DG A 3 0.537 5.432 4.546 1.00 0.38 N ATOM 84 C4 DG A 3 -0.793 5.516 4.305 1.00 0.35 C ATOM 0 H5' DG A 3 1.819 6.685 9.020 1.00 0.67 H new ATOM 0 H5'' DG A 3 1.685 6.416 7.293 1.00 0.67 H new ATOM 0 H4' DG A 3 -0.415 7.793 8.956 1.00 0.61 H new ATOM 0 H3' DG A 3 0.073 5.075 9.304 1.00 0.62 H new ATOM 0 H2' DG A 3 0.052 4.733 6.818 1.00 0.51 H new ATOM 0 H2'' DG A 3 -1.470 4.085 7.395 1.00 0.51 H new ATOM 0 H1' DG A 3 -2.634 6.277 6.984 1.00 0.48 H new ATOM 0 H8 DG A 3 -3.902 6.006 4.974 1.00 0.42 H new ATOM 0 H1 DG A 3 1.247 4.638 1.447 1.00 0.36 H new ATOM 0 H21 DG A 3 3.006 5.139 4.378 1.00 0.44 H new ATOM 0 H22 DG A 3 3.039 4.741 2.657 1.00 0.44 H new ATOM 96 P DG A 4 -3.225 6.229 9.546 1.00 0.63 P ATOM 97 OP1 DG A 4 -3.165 7.603 9.006 1.00 0.66 O ATOM 98 OP2 DG A 4 -3.887 5.982 10.848 1.00 0.76 O ATOM 99 O5' DG A 4 -3.919 5.288 8.445 1.00 0.61 O ATOM 100 C5' DG A 4 -4.204 3.906 8.684 1.00 0.52 C ATOM 101 C4' DG A 4 -5.031 3.363 7.535 1.00 0.39 C ATOM 102 O4' DG A 4 -4.323 3.461 6.279 1.00 0.37 O ATOM 103 C3' DG A 4 -5.408 1.901 7.719 1.00 0.35 C ATOM 104 O3' DG A 4 -6.780 1.713 7.353 1.00 0.35 O ATOM 105 C2' DG A 4 -4.474 1.228 6.737 1.00 0.40 C ATOM 106 C1' DG A 4 -4.517 2.234 5.576 1.00 0.35 C ATOM 107 N9 DG A 4 -3.435 2.000 4.583 1.00 0.32 N ATOM 108 C8 DG A 4 -2.067 2.005 4.755 1.00 0.34 C ATOM 109 N7 DG A 4 -1.384 1.803 3.662 1.00 0.35 N ATOM 110 C5 DG A 4 -2.370 1.647 2.695 1.00 0.30 C ATOM 111 C6 DG A 4 -2.243 1.399 1.311 1.00 0.30 C ATOM 112 O6 DG A 4 -1.229 1.273 0.641 1.00 0.34 O ATOM 113 N1 DG A 4 -3.449 1.307 0.692 1.00 0.30 N ATOM 114 C2 DG A 4 -4.659 1.432 1.307 1.00 0.33 C ATOM 115 N2 DG A 4 -5.717 1.297 0.529 1.00 0.42 N ATOM 116 N3 DG A 4 -4.814 1.666 2.609 1.00 0.32 N ATOM 117 C4 DG A 4 -3.620 1.762 3.244 1.00 0.29 C ATOM 0 H5' DG A 4 -4.745 3.791 9.623 1.00 0.52 H new ATOM 0 H5'' DG A 4 -3.276 3.342 8.779 1.00 0.52 H new ATOM 0 H4' DG A 4 -5.932 3.976 7.524 1.00 0.39 H new ATOM 0 H3' DG A 4 -5.316 1.519 8.736 1.00 0.35 H new ATOM 0 H2' DG A 4 -3.469 1.103 7.140 1.00 0.40 H new ATOM 0 H2'' DG A 4 -4.825 0.239 6.442 1.00 0.40 H new ATOM 0 H1' DG A 4 -5.430 2.185 4.982 1.00 0.35 H new ATOM 0 H8 DG A 4 -1.599 2.163 5.716 1.00 0.34 H new ATOM 0 H1 DG A 4 -3.449 1.130 -0.313 1.00 0.30 H new ATOM 0 H21 DG A 4 -6.654 1.379 0.924 1.00 0.42 H new ATOM 0 H22 DG A 4 -5.597 1.111 -0.467 1.00 0.42 H new ATOM 129 P DG A 5 -7.628 0.466 7.915 1.00 0.49 P ATOM 130 OP1 DG A 5 -8.988 0.958 8.240 1.00 0.78 O ATOM 131 OP2 DG A 5 -6.831 -0.228 8.951 1.00 0.82 O ATOM 132 O5' DG A 5 -7.706 -0.501 6.627 1.00 0.48 O ATOM 133 C5' DG A 5 -8.905 -0.618 5.847 1.00 0.53 C ATOM 134 C4' DG A 5 -8.813 -1.725 4.795 1.00 0.56 C ATOM 135 O4' DG A 5 -7.822 -1.460 3.789 1.00 0.54 O ATOM 136 C3' DG A 5 -8.462 -3.139 5.354 1.00 0.65 C ATOM 137 O3' DG A 5 -8.980 -4.291 4.653 1.00 0.87 O ATOM 138 C2' DG A 5 -6.997 -3.072 5.154 1.00 0.61 C ATOM 139 C1' DG A 5 -6.992 -2.619 3.710 1.00 0.57 C ATOM 140 N9 DG A 5 -5.646 -2.272 3.241 1.00 0.52 N ATOM 141 C8 DG A 5 -4.573 -1.851 3.967 1.00 0.51 C ATOM 142 N7 DG A 5 -3.521 -1.601 3.245 1.00 0.51 N ATOM 143 C5 DG A 5 -3.921 -1.881 1.955 1.00 0.49 C ATOM 144 C6 DG A 5 -3.198 -1.797 0.743 1.00 0.52 C ATOM 145 O6 DG A 5 -2.036 -1.454 0.567 1.00 0.57 O ATOM 146 N1 DG A 5 -3.965 -2.168 -0.319 1.00 0.53 N ATOM 147 C2 DG A 5 -5.269 -2.571 -0.231 1.00 0.57 C ATOM 148 N2 DG A 5 -5.859 -2.918 -1.341 1.00 0.65 N ATOM 149 N3 DG A 5 -5.966 -2.655 0.887 1.00 0.58 N ATOM 150 C4 DG A 5 -5.222 -2.294 1.943 1.00 0.51 C ATOM 0 H5' DG A 5 -9.108 0.332 5.353 1.00 0.53 H new ATOM 0 H5'' DG A 5 -9.747 -0.819 6.509 1.00 0.53 H new ATOM 0 H4' DG A 5 -9.823 -1.727 4.386 1.00 0.56 H new ATOM 0 H3' DG A 5 -8.876 -3.296 6.350 1.00 0.65 H new ATOM 0 H2' DG A 5 -6.510 -2.362 5.822 1.00 0.61 H new ATOM 0 H2'' DG A 5 -6.505 -4.034 5.298 1.00 0.61 H new ATOM 0 H1' DG A 5 -7.331 -3.381 3.008 1.00 0.57 H new ATOM 0 H8 DG A 5 -4.594 -1.736 5.041 1.00 0.51 H new ATOM 0 H1 DG A 5 -3.537 -2.144 -1.245 1.00 0.53 H new ATOM 0 H21 DG A 5 -6.831 -3.226 -1.327 1.00 0.65 H new ATOM 0 H22 DG A 5 -5.348 -2.881 -2.223 1.00 0.65 H new ATOM 162 P DG A 6 -10.201 -4.299 3.597 1.00 0.77 P ATOM 163 OP1 DG A 6 -11.082 -3.142 3.863 1.00 0.98 O ATOM 164 OP2 DG A 6 -10.775 -5.666 3.575 1.00 1.00 O ATOM 165 O5' DG A 6 -9.437 -4.035 2.202 1.00 0.50 O ATOM 166 C5' DG A 6 -9.051 -5.102 1.330 1.00 0.45 C ATOM 167 C4' DG A 6 -7.571 -5.034 0.962 1.00 0.39 C ATOM 168 O4' DG A 6 -6.687 -5.216 2.098 1.00 0.43 O ATOM 169 C3' DG A 6 -7.248 -6.152 -0.048 1.00 0.37 C ATOM 170 O3' DG A 6 -7.078 -5.591 -1.365 1.00 0.45 O ATOM 171 C2' DG A 6 -5.901 -6.561 0.491 1.00 0.34 C ATOM 172 C1' DG A 6 -6.171 -6.537 1.988 1.00 0.38 C ATOM 173 N9 DG A 6 -7.205 -7.400 2.640 1.00 0.46 N ATOM 174 C8 DG A 6 -7.657 -7.306 3.941 1.00 0.58 C ATOM 175 N7 DG A 6 -8.581 -8.166 4.248 1.00 0.67 N ATOM 176 C5 DG A 6 -8.770 -8.888 3.077 1.00 0.60 C ATOM 177 C6 DG A 6 -9.658 -9.961 2.810 1.00 0.67 C ATOM 178 O6 DG A 6 -10.463 -10.502 3.552 1.00 0.79 O ATOM 179 N1 DG A 6 -9.541 -10.408 1.516 1.00 0.63 N ATOM 180 C2 DG A 6 -8.681 -9.897 0.587 1.00 0.54 C ATOM 181 N2 DG A 6 -8.700 -10.465 -0.605 1.00 0.59 N ATOM 182 N3 DG A 6 -7.839 -8.893 0.816 1.00 0.45 N ATOM 183 C4 DG A 6 -7.933 -8.431 2.085 1.00 0.48 C ATOM 0 H5' DG A 6 -9.652 -5.063 0.422 1.00 0.45 H new ATOM 0 H5'' DG A 6 -9.261 -6.057 1.811 1.00 0.45 H new ATOM 0 H4' DG A 6 -7.404 -4.038 0.552 1.00 0.39 H new ATOM 0 H3' DG A 6 -7.996 -6.939 -0.141 1.00 0.37 H new ATOM 0 H2' DG A 6 -5.599 -7.548 0.142 1.00 0.34 H new ATOM 0 H2'' DG A 6 -5.112 -5.866 0.202 1.00 0.34 H new ATOM 0 H1' DG A 6 -5.261 -6.886 2.477 1.00 0.38 H new ATOM 0 H8 DG A 6 -7.275 -6.580 4.643 1.00 0.58 H new ATOM 0 H1 DG A 6 -10.142 -11.180 1.228 1.00 0.63 H new ATOM 0 H21 DG A 6 -8.080 -10.127 -1.341 1.00 0.59 H new ATOM 0 H22 DG A 6 -9.335 -11.242 -0.790 1.00 0.59 H new ATOM 195 P DT A 7 -8.236 -5.532 -2.502 1.00 0.52 P ATOM 196 OP1 DT A 7 -8.037 -4.273 -3.257 1.00 0.75 O ATOM 197 OP2 DT A 7 -9.540 -5.800 -1.852 1.00 0.71 O ATOM 198 O5' DT A 7 -7.918 -6.767 -3.506 1.00 0.55 O ATOM 199 C5' DT A 7 -7.770 -8.138 -3.102 1.00 0.50 C ATOM 200 C4' DT A 7 -6.425 -8.385 -2.550 1.00 0.40 C ATOM 201 O4' DT A 7 -6.473 -9.760 -2.112 1.00 0.42 O ATOM 202 C3' DT A 7 -5.156 -8.198 -3.388 1.00 0.45 C ATOM 203 O3' DT A 7 -4.682 -6.866 -3.106 1.00 0.43 O ATOM 204 C2' DT A 7 -4.325 -9.148 -2.459 1.00 0.43 C ATOM 205 C1' DT A 7 -5.168 -10.350 -2.199 1.00 0.44 C ATOM 206 N1 DT A 7 -4.764 -10.992 -0.934 1.00 0.46 N ATOM 207 C2 DT A 7 -3.643 -11.800 -0.907 1.00 0.62 C ATOM 208 O2 DT A 7 -2.943 -12.013 -1.890 1.00 0.74 O ATOM 209 N3 DT A 7 -3.338 -12.364 0.305 1.00 0.71 N ATOM 210 C4 DT A 7 -4.037 -12.200 1.477 1.00 0.68 C ATOM 211 O4 DT A 7 -3.654 -12.766 2.494 1.00 0.83 O ATOM 212 C5 DT A 7 -5.196 -11.338 1.357 1.00 0.55 C ATOM 213 C7 DT A 7 -6.060 -11.065 2.590 1.00 0.62 C ATOM 214 C6 DT A 7 -5.506 -10.778 0.168 1.00 0.43 C ATOM 0 H5' DT A 7 -7.942 -8.793 -3.956 1.00 0.50 H new ATOM 0 H5'' DT A 7 -8.524 -8.384 -2.355 1.00 0.50 H new ATOM 0 H4' DT A 7 -6.285 -7.594 -1.813 1.00 0.40 H new ATOM 0 H3' DT A 7 -5.181 -8.356 -4.466 1.00 0.45 H new ATOM 0 H2' DT A 7 -3.387 -9.431 -2.937 1.00 0.43 H new ATOM 0 H2'' DT A 7 -4.069 -8.647 -1.525 1.00 0.43 H new ATOM 0 H1' DT A 7 -5.097 -11.138 -2.949 1.00 0.44 H new ATOM 0 H3 DT A 7 -2.513 -12.963 0.340 1.00 0.71 H new ATOM 0 H71 DT A 7 -6.023 -11.926 3.258 1.00 0.62 H new ATOM 0 H72 DT A 7 -5.683 -10.185 3.111 1.00 0.62 H new ATOM 0 H73 DT A 7 -7.090 -10.890 2.281 1.00 0.62 H new ATOM 0 H6 DT A 7 -6.375 -10.140 0.100 1.00 0.43 H new ATOM 227 P DT A 8 -3.352 -6.153 -3.712 1.00 0.43 P ATOM 228 OP1 DT A 8 -3.243 -4.813 -3.089 1.00 0.52 O ATOM 229 OP2 DT A 8 -3.390 -6.286 -5.185 1.00 0.56 O ATOM 230 O5' DT A 8 -2.120 -7.024 -3.124 1.00 0.38 O ATOM 231 C5' DT A 8 -1.352 -7.985 -3.867 1.00 0.37 C ATOM 232 C4' DT A 8 0.150 -7.846 -3.582 1.00 0.38 C ATOM 233 O4' DT A 8 0.619 -7.774 -2.200 1.00 0.41 O ATOM 234 C3' DT A 8 0.912 -9.009 -4.206 1.00 0.47 C ATOM 235 O3' DT A 8 2.212 -8.537 -4.570 1.00 0.59 O ATOM 236 C2' DT A 8 0.959 -9.935 -2.936 1.00 0.48 C ATOM 237 C1' DT A 8 1.450 -8.915 -1.847 1.00 0.46 C ATOM 238 N1 DT A 8 1.032 -9.479 -0.527 1.00 0.42 N ATOM 239 C2 DT A 8 1.889 -10.362 0.109 1.00 0.53 C ATOM 240 O2 DT A 8 2.981 -10.686 -0.341 1.00 0.67 O ATOM 241 N3 DT A 8 1.449 -10.880 1.305 1.00 0.54 N ATOM 242 C4 DT A 8 0.251 -10.608 1.926 1.00 0.46 C ATOM 243 O4 DT A 8 -0.016 -11.144 2.997 1.00 0.54 O ATOM 244 C5 DT A 8 -0.588 -9.678 1.203 1.00 0.37 C ATOM 245 C7 DT A 8 -1.976 -9.290 1.742 1.00 0.40 C ATOM 246 C6 DT A 8 -0.175 -9.157 0.034 1.00 0.35 C ATOM 0 H5' DT A 8 -1.535 -7.852 -4.933 1.00 0.37 H new ATOM 0 H5'' DT A 8 -1.681 -8.992 -3.610 1.00 0.37 H new ATOM 0 H4' DT A 8 0.343 -6.863 -4.011 1.00 0.38 H new ATOM 0 H3' DT A 8 0.504 -9.478 -5.101 1.00 0.47 H new ATOM 0 H2' DT A 8 -0.017 -10.358 -2.696 1.00 0.48 H new ATOM 0 H2'' DT A 8 1.647 -10.771 -3.059 1.00 0.48 H new ATOM 0 H1' DT A 8 2.516 -8.693 -1.798 1.00 0.46 H new ATOM 0 H3 DT A 8 2.074 -11.532 1.780 1.00 0.54 H new ATOM 0 H71 DT A 8 -2.390 -10.121 2.313 1.00 0.40 H new ATOM 0 H72 DT A 8 -1.884 -8.417 2.388 1.00 0.40 H new ATOM 0 H73 DT A 8 -2.638 -9.057 0.908 1.00 0.40 H new ATOM 0 H6 DT A 8 -0.819 -8.459 -0.481 1.00 0.35 H new ATOM 259 P DG A 9 3.038 -9.153 -5.806 1.00 0.70 P ATOM 260 OP1 DG A 9 2.995 -10.626 -5.684 1.00 0.83 O ATOM 261 OP2 DG A 9 4.348 -8.464 -5.833 1.00 0.89 O ATOM 262 O5' DG A 9 2.237 -8.759 -7.154 1.00 0.74 O ATOM 263 C5' DG A 9 2.314 -7.468 -7.781 1.00 0.71 C ATOM 264 C4' DG A 9 1.111 -6.613 -7.418 1.00 0.56 C ATOM 265 O4' DG A 9 1.059 -6.378 -6.019 1.00 0.52 O ATOM 266 C3' DG A 9 1.149 -5.244 -8.081 1.00 0.58 C ATOM 267 O3' DG A 9 -0.161 -4.731 -8.317 1.00 0.62 O ATOM 268 C2' DG A 9 1.906 -4.400 -7.039 1.00 0.57 C ATOM 269 C1' DG A 9 1.248 -4.992 -5.771 1.00 0.49 C ATOM 270 N9 DG A 9 1.930 -4.939 -4.473 1.00 0.49 N ATOM 271 C8 DG A 9 3.241 -5.090 -4.245 1.00 0.55 C ATOM 272 N7 DG A 9 3.607 -5.045 -2.999 1.00 0.59 N ATOM 273 C5 DG A 9 2.401 -4.844 -2.336 1.00 0.55 C ATOM 274 C6 DG A 9 2.136 -4.711 -0.949 1.00 0.59 C ATOM 275 O6 DG A 9 2.915 -4.733 -0.002 1.00 0.65 O ATOM 276 N1 DG A 9 0.797 -4.525 -0.710 1.00 0.57 N ATOM 277 C2 DG A 9 -0.174 -4.470 -1.678 1.00 0.51 C ATOM 278 N2 DG A 9 -1.407 -4.297 -1.253 1.00 0.53 N ATOM 279 N3 DG A 9 0.051 -4.590 -2.983 1.00 0.48 N ATOM 280 C4 DG A 9 1.366 -4.777 -3.236 1.00 0.49 C ATOM 0 H5' DG A 9 2.366 -7.588 -8.863 1.00 0.71 H new ATOM 0 H5'' DG A 9 3.230 -6.964 -7.472 1.00 0.71 H new ATOM 0 H4' DG A 9 0.242 -7.173 -7.764 1.00 0.56 H new ATOM 0 H3' DG A 9 1.618 -5.252 -9.065 1.00 0.58 H new ATOM 0 H2' DG A 9 2.985 -4.552 -7.070 1.00 0.57 H new ATOM 0 H2'' DG A 9 1.732 -3.330 -7.149 1.00 0.57 H new ATOM 0 H1' DG A 9 0.376 -4.351 -5.644 1.00 0.49 H new ATOM 0 H8 DG A 9 3.949 -5.240 -5.046 1.00 0.55 H new ATOM 0 H1 DG A 9 0.502 -4.420 0.261 1.00 0.57 H new ATOM 0 H21 DG A 9 -2.175 -4.247 -1.922 1.00 0.53 H new ATOM 0 H22 DG A 9 -1.595 -4.212 -0.254 1.00 0.53 H new ATOM 292 P DG A 10 -0.335 -3.599 -9.447 1.00 0.63 P ATOM 293 OP1 DG A 10 0.223 -4.105 -10.721 1.00 0.77 O ATOM 294 OP2 DG A 10 0.148 -2.311 -8.892 1.00 0.70 O ATOM 295 O5' DG A 10 -1.914 -3.524 -9.619 1.00 0.59 O ATOM 296 C5' DG A 10 -2.623 -2.289 -9.704 1.00 0.59 C ATOM 297 C4' DG A 10 -4.081 -2.586 -9.466 1.00 0.50 C ATOM 298 O4' DG A 10 -4.328 -3.141 -8.172 1.00 0.49 O ATOM 299 C3' DG A 10 -4.992 -1.387 -9.609 1.00 0.43 C ATOM 300 O3' DG A 10 -6.203 -1.971 -10.089 1.00 0.49 O ATOM 301 C2' DG A 10 -5.092 -0.893 -8.129 1.00 0.40 C ATOM 302 C1' DG A 10 -5.202 -2.276 -7.451 1.00 0.39 C ATOM 303 N9 DG A 10 -4.666 -2.209 -6.086 1.00 0.37 N ATOM 304 C8 DG A 10 -5.369 -2.318 -4.922 1.00 0.41 C ATOM 305 N7 DG A 10 -4.625 -2.221 -3.869 1.00 0.40 N ATOM 306 C5 DG A 10 -3.346 -2.037 -4.347 1.00 0.36 C ATOM 307 C6 DG A 10 -2.143 -1.872 -3.634 1.00 0.40 C ATOM 308 O6 DG A 10 -1.973 -1.850 -2.420 1.00 0.45 O ATOM 309 N1 DG A 10 -1.080 -1.716 -4.467 1.00 0.46 N ATOM 310 C2 DG A 10 -1.137 -1.713 -5.827 1.00 0.48 C ATOM 311 N2 DG A 10 0.022 -1.550 -6.440 1.00 0.57 N ATOM 312 N3 DG A 10 -2.262 -1.865 -6.525 1.00 0.42 N ATOM 313 C4 DG A 10 -3.340 -2.025 -5.711 1.00 0.35 C ATOM 0 H5' DG A 10 -2.480 -1.831 -10.683 1.00 0.59 H new ATOM 0 H5'' DG A 10 -2.250 -1.581 -8.964 1.00 0.59 H new ATOM 0 H4' DG A 10 -4.312 -3.308 -10.249 1.00 0.50 H new ATOM 0 H3' DG A 10 -4.704 -0.564 -10.264 1.00 0.43 H new ATOM 0 H2' DG A 10 -4.216 -0.330 -7.808 1.00 0.40 H new ATOM 0 H2'' DG A 10 -5.961 -0.260 -7.949 1.00 0.40 H new ATOM 0 H1' DG A 10 -6.240 -2.607 -7.436 1.00 0.39 H new ATOM 0 H8 DG A 10 -6.438 -2.470 -4.884 1.00 0.41 H new ATOM 0 H1 DG A 10 -0.164 -1.591 -4.037 1.00 0.46 H new ATOM 0 H21 DG A 10 0.062 -1.536 -7.459 1.00 0.57 H new ATOM 0 H22 DG A 10 0.876 -1.438 -5.894 1.00 0.57 H new ATOM 325 P DG A 11 -7.408 -1.058 -10.592 1.00 0.56 P ATOM 326 OP1 DG A 11 -8.415 -1.937 -11.231 1.00 0.81 O ATOM 327 OP2 DG A 11 -6.858 0.100 -11.335 1.00 0.67 O ATOM 328 O5' DG A 11 -7.976 -0.542 -9.183 1.00 0.54 O ATOM 329 C5' DG A 11 -8.879 -1.318 -8.385 1.00 0.53 C ATOM 330 C4' DG A 11 -8.991 -0.734 -6.985 1.00 0.45 C ATOM 331 O4' DG A 11 -7.820 -0.877 -6.164 1.00 0.45 O ATOM 332 C3' DG A 11 -9.288 0.778 -7.046 1.00 0.43 C ATOM 333 O3' DG A 11 -10.550 1.081 -6.432 1.00 0.47 O ATOM 334 C2' DG A 11 -8.111 1.338 -6.268 1.00 0.44 C ATOM 335 C1' DG A 11 -7.929 0.241 -5.292 1.00 0.40 C ATOM 336 N9 DG A 11 -6.850 0.437 -4.315 1.00 0.37 N ATOM 337 C8 DG A 11 -6.965 0.296 -2.974 1.00 0.42 C ATOM 338 N7 DG A 11 -5.872 0.512 -2.299 1.00 0.40 N ATOM 339 C5 DG A 11 -4.958 0.825 -3.296 1.00 0.34 C ATOM 340 C6 DG A 11 -3.592 1.157 -3.190 1.00 0.33 C ATOM 341 O6 DG A 11 -2.913 1.244 -2.177 1.00 0.35 O ATOM 342 N1 DG A 11 -3.033 1.399 -4.416 1.00 0.34 N ATOM 343 C2 DG A 11 -3.704 1.333 -5.610 1.00 0.35 C ATOM 344 N2 DG A 11 -3.025 1.602 -6.700 1.00 0.42 N ATOM 345 N3 DG A 11 -4.986 1.025 -5.733 1.00 0.35 N ATOM 346 C4 DG A 11 -5.549 0.782 -4.534 1.00 0.34 C ATOM 0 H5' DG A 11 -8.529 -2.349 -8.328 1.00 0.53 H new ATOM 0 H5'' DG A 11 -9.862 -1.340 -8.856 1.00 0.53 H new ATOM 0 H4' DG A 11 -9.798 -1.311 -6.534 1.00 0.45 H new ATOM 0 H3' DG A 11 -9.379 1.189 -8.051 1.00 0.43 H new ATOM 0 H2' DG A 11 -7.231 1.495 -6.892 1.00 0.44 H new ATOM 0 H2'' DG A 11 -8.338 2.291 -5.791 1.00 0.44 H new ATOM 0 H1' DG A 11 -8.742 0.136 -4.574 1.00 0.40 H new ATOM 0 H8 DG A 11 -7.896 0.024 -2.498 1.00 0.42 H new ATOM 0 H1 DG A 11 -2.044 1.647 -4.443 1.00 0.34 H new ATOM 0 H21 DG A 11 -3.485 1.565 -7.610 1.00 0.42 H new ATOM 0 H22 DG A 11 -2.037 1.848 -6.638 1.00 0.42 H new ATOM 358 P DG A 12 -11.245 2.542 -6.512 1.00 0.44 P ATOM 359 OP1 DG A 12 -12.713 2.349 -6.511 1.00 0.54 O ATOM 360 OP2 DG A 12 -10.607 3.314 -7.605 1.00 0.52 O ATOM 361 O5' DG A 12 -10.819 3.222 -5.117 1.00 0.44 O ATOM 362 C5' DG A 12 -11.237 2.698 -3.846 1.00 0.43 C ATOM 363 C4' DG A 12 -10.409 3.322 -2.730 1.00 0.40 C ATOM 364 O4' DG A 12 -9.015 3.068 -2.914 1.00 0.38 O ATOM 365 C3' DG A 12 -10.571 4.851 -2.635 1.00 0.41 C ATOM 366 O3' DG A 12 -10.964 5.185 -1.294 1.00 0.56 O ATOM 367 C2' DG A 12 -9.157 5.333 -2.896 1.00 0.37 C ATOM 368 C1' DG A 12 -8.398 4.194 -2.313 1.00 0.34 C ATOM 369 N9 DG A 12 -6.976 4.286 -2.644 1.00 0.29 N ATOM 370 C8 DG A 12 -6.403 4.339 -3.878 1.00 0.29 C ATOM 371 N7 DG A 12 -5.105 4.414 -3.852 1.00 0.27 N ATOM 372 C5 DG A 12 -4.803 4.412 -2.498 1.00 0.26 C ATOM 373 C6 DG A 12 -3.552 4.477 -1.847 1.00 0.27 C ATOM 374 O6 DG A 12 -2.431 4.545 -2.328 1.00 0.30 O ATOM 375 N1 DG A 12 -3.696 4.450 -0.491 1.00 0.28 N ATOM 376 C2 DG A 12 -4.883 4.369 0.179 1.00 0.28 C ATOM 377 N2 DG A 12 -4.818 4.333 1.494 1.00 0.31 N ATOM 378 N3 DG A 12 -6.071 4.308 -0.408 1.00 0.29 N ATOM 379 C4 DG A 12 -5.949 4.334 -1.752 1.00 0.27 C ATOM 0 H5' DG A 12 -11.121 1.614 -3.834 1.00 0.43 H new ATOM 0 H5'' DG A 12 -12.295 2.908 -3.687 1.00 0.43 H new ATOM 0 H4' DG A 12 -10.782 2.859 -1.816 1.00 0.40 H new ATOM 0 H3' DG A 12 -11.310 5.279 -3.312 1.00 0.41 H new ATOM 0 H2' DG A 12 -8.952 5.474 -3.957 1.00 0.37 H new ATOM 0 H2'' DG A 12 -8.939 6.279 -2.401 1.00 0.37 H new ATOM 0 H1' DG A 12 -8.426 4.158 -1.224 1.00 0.34 H new ATOM 0 H8 DG A 12 -6.974 4.320 -4.794 1.00 0.29 H new ATOM 0 H1 DG A 12 -2.845 4.494 0.070 1.00 0.28 H new ATOM 0 H21 DG A 12 -5.674 4.273 2.045 1.00 0.31 H new ATOM 0 H22 DG A 12 -3.912 4.366 1.961 1.00 0.31 H new ATOM 391 P DT A 13 -11.991 6.382 -0.953 1.00 0.74 P ATOM 392 OP1 DT A 13 -12.726 6.004 0.273 1.00 0.98 O ATOM 393 OP2 DT A 13 -12.740 6.717 -2.188 1.00 1.04 O ATOM 394 O5' DT A 13 -11.023 7.617 -0.591 1.00 0.60 O ATOM 395 C5' DT A 13 -11.541 8.881 -0.134 1.00 0.67 C ATOM 396 C4' DT A 13 -10.430 9.778 0.425 1.00 0.64 C ATOM 397 O4' DT A 13 -9.757 9.190 1.551 1.00 0.63 O ATOM 398 C3' DT A 13 -9.340 10.118 -0.606 1.00 0.58 C ATOM 399 O3' DT A 13 -8.671 11.306 -0.157 1.00 0.64 O ATOM 400 C2' DT A 13 -8.477 8.861 -0.366 1.00 0.50 C ATOM 401 C1' DT A 13 -8.395 8.915 1.191 1.00 0.54 C ATOM 402 N1 DT A 13 -8.013 7.596 1.741 1.00 0.48 N ATOM 403 C2 DT A 13 -6.771 7.422 2.329 1.00 0.47 C ATOM 404 O2 DT A 13 -5.929 8.311 2.425 1.00 0.54 O ATOM 405 N3 DT A 13 -6.513 6.160 2.814 1.00 0.44 N ATOM 406 C4 DT A 13 -7.364 5.077 2.771 1.00 0.43 C ATOM 407 O4 DT A 13 -6.990 4.004 3.234 1.00 0.44 O ATOM 408 C5 DT A 13 -8.640 5.352 2.144 1.00 0.49 C ATOM 409 C7 DT A 13 -9.720 4.271 2.017 1.00 0.61 C ATOM 410 C6 DT A 13 -8.906 6.574 1.664 1.00 0.50 C ATOM 0 H5' DT A 13 -12.293 8.710 0.636 1.00 0.67 H new ATOM 0 H5'' DT A 13 -12.040 9.390 -0.959 1.00 0.67 H new ATOM 0 H4' DT A 13 -10.960 10.684 0.720 1.00 0.64 H new ATOM 0 H3' DT A 13 -9.628 10.307 -1.640 1.00 0.58 H new ATOM 0 H2' DT A 13 -8.950 7.949 -0.731 1.00 0.50 H new ATOM 0 H2'' DT A 13 -7.498 8.925 -0.842 1.00 0.50 H new ATOM 0 H1' DT A 13 -7.665 9.636 1.559 1.00 0.54 H new ATOM 0 H3 DT A 13 -5.602 6.012 3.248 1.00 0.44 H new ATOM 0 H71 DT A 13 -10.705 4.737 2.035 1.00 0.61 H new ATOM 0 H72 DT A 13 -9.589 3.735 1.077 1.00 0.61 H new ATOM 0 H73 DT A 13 -9.634 3.572 2.849 1.00 0.61 H new ATOM 0 H6 DT A 13 -9.864 6.754 1.199 1.00 0.50 H new ATOM 423 P DT A 14 -9.337 12.784 -0.163 1.00 0.68 P ATOM 424 OP1 DT A 14 -8.975 13.463 1.101 1.00 0.89 O ATOM 425 OP2 DT A 14 -10.759 12.678 -0.567 1.00 0.70 O ATOM 426 O5' DT A 14 -8.527 13.470 -1.365 1.00 0.65 O ATOM 427 C5' DT A 14 -7.096 13.430 -1.353 1.00 0.68 C ATOM 428 C4' DT A 14 -6.561 13.248 -2.752 1.00 0.62 C ATOM 429 O4' DT A 14 -5.132 13.121 -2.684 1.00 0.68 O ATOM 430 C3' DT A 14 -7.104 11.986 -3.454 1.00 0.50 C ATOM 431 O3' DT A 14 -7.249 12.218 -4.862 1.00 0.57 O ATOM 432 C2' DT A 14 -5.981 11.009 -3.160 1.00 0.47 C ATOM 433 C1' DT A 14 -4.782 11.945 -3.403 1.00 0.57 C ATOM 434 N1 DT A 14 -3.423 11.466 -3.039 1.00 0.58 N ATOM 435 C2 DT A 14 -2.380 11.667 -3.929 1.00 0.63 C ATOM 436 O2 DT A 14 -2.510 12.230 -5.009 1.00 0.70 O ATOM 437 N3 DT A 14 -1.148 11.195 -3.533 1.00 0.65 N ATOM 438 C4 DT A 14 -0.858 10.550 -2.351 1.00 0.63 C ATOM 439 O4 DT A 14 0.288 10.174 -2.116 1.00 0.70 O ATOM 440 C5 DT A 14 -2.006 10.387 -1.488 1.00 0.60 C ATOM 441 C7 DT A 14 -1.901 9.684 -0.135 1.00 0.66 C ATOM 442 C6 DT A 14 -3.208 10.842 -1.857 1.00 0.58 C ATOM 0 H5' DT A 14 -6.754 12.613 -0.717 1.00 0.68 H new ATOM 0 H5'' DT A 14 -6.704 14.352 -0.924 1.00 0.68 H new ATOM 0 H4' DT A 14 -6.880 14.117 -3.327 1.00 0.62 H new ATOM 0 H3' DT A 14 -8.088 11.653 -3.124 1.00 0.50 H new ATOM 0 H2' DT A 14 -6.014 10.622 -2.141 1.00 0.47 H new ATOM 0 H2'' DT A 14 -5.986 10.148 -3.828 1.00 0.47 H new ATOM 0 H1' DT A 14 -4.652 12.067 -4.478 1.00 0.57 H new ATOM 0 H3 DT A 14 -0.373 11.337 -4.180 1.00 0.65 H new ATOM 0 H71 DT A 14 -1.113 8.932 -0.176 1.00 0.66 H new ATOM 0 H72 DT A 14 -1.665 10.416 0.638 1.00 0.66 H new ATOM 0 H73 DT A 14 -2.850 9.202 0.099 1.00 0.66 H new ATOM 0 H6 DT A 14 -4.042 10.706 -1.184 1.00 0.58 H new ATOM 455 P DG A 15 -7.996 11.178 -5.851 1.00 0.60 P ATOM 456 OP1 DG A 15 -8.759 11.966 -6.848 1.00 0.77 O ATOM 457 OP2 DG A 15 -8.688 10.153 -5.036 1.00 0.68 O ATOM 458 O5' DG A 15 -6.757 10.468 -6.589 1.00 0.58 O ATOM 459 C5' DG A 15 -5.969 11.154 -7.572 1.00 0.61 C ATOM 460 C4' DG A 15 -4.778 10.308 -7.996 1.00 0.57 C ATOM 461 O4' DG A 15 -3.891 10.013 -6.910 1.00 0.56 O ATOM 462 C3' DG A 15 -5.177 8.965 -8.604 1.00 0.55 C ATOM 463 O3' DG A 15 -4.439 8.861 -9.827 1.00 0.67 O ATOM 464 C2' DG A 15 -4.760 7.990 -7.503 1.00 0.48 C ATOM 465 C1' DG A 15 -3.458 8.663 -7.056 1.00 0.46 C ATOM 466 N9 DG A 15 -2.968 8.239 -5.732 1.00 0.42 N ATOM 467 C8 DG A 15 -3.677 7.931 -4.598 1.00 0.42 C ATOM 468 N7 DG A 15 -2.934 7.642 -3.568 1.00 0.46 N ATOM 469 C5 DG A 15 -1.639 7.765 -4.058 1.00 0.46 C ATOM 470 C6 DG A 15 -0.400 7.574 -3.406 1.00 0.52 C ATOM 471 O6 DG A 15 -0.176 7.270 -2.238 1.00 0.59 O ATOM 472 N1 DG A 15 0.653 7.797 -4.259 1.00 0.58 N ATOM 473 C2 DG A 15 0.552 8.156 -5.574 1.00 0.61 C ATOM 474 N2 DG A 15 1.683 8.310 -6.236 1.00 0.75 N ATOM 475 N3 DG A 15 -0.599 8.341 -6.201 1.00 0.56 N ATOM 476 C4 DG A 15 -1.653 8.127 -5.378 1.00 0.46 C ATOM 0 H5' DG A 15 -5.620 12.104 -7.167 1.00 0.61 H new ATOM 0 H5'' DG A 15 -6.585 11.385 -8.441 1.00 0.61 H new ATOM 0 H4' DG A 15 -4.281 10.927 -8.743 1.00 0.57 H new ATOM 0 H3' DG A 15 -6.221 8.797 -8.867 1.00 0.55 H new ATOM 0 H2' DG A 15 -5.495 7.923 -6.701 1.00 0.48 H new ATOM 0 H2'' DG A 15 -4.603 6.978 -7.876 1.00 0.48 H new ATOM 0 H1' DG A 15 -2.649 8.446 -7.754 1.00 0.46 H new ATOM 0 H8 DG A 15 -4.756 7.928 -4.563 1.00 0.42 H new ATOM 0 H1 DG A 15 1.592 7.685 -3.878 1.00 0.58 H new ATOM 0 H21 DG A 15 1.666 8.577 -7.220 1.00 0.75 H new ATOM 0 H22 DG A 15 2.575 8.162 -5.763 1.00 0.75 H new ATOM 488 P DG A 16 -4.373 7.540 -10.736 1.00 0.73 P ATOM 489 OP1 DG A 16 -4.536 7.939 -12.152 1.00 0.97 O ATOM 490 OP2 DG A 16 -5.246 6.496 -10.148 1.00 1.04 O ATOM 491 O5' DG A 16 -2.854 7.109 -10.500 1.00 0.87 O ATOM 492 C5' DG A 16 -1.720 7.632 -11.216 1.00 0.68 C ATOM 493 C4' DG A 16 -0.616 6.602 -11.063 1.00 0.52 C ATOM 494 O4' DG A 16 -0.370 6.444 -9.695 1.00 0.51 O ATOM 495 C3' DG A 16 -0.997 5.244 -11.630 1.00 0.49 C ATOM 496 O3' DG A 16 -0.106 5.155 -12.744 1.00 0.51 O ATOM 497 C2' DG A 16 -0.687 4.347 -10.461 1.00 0.43 C ATOM 498 C1' DG A 16 0.292 5.209 -9.710 1.00 0.42 C ATOM 499 N9 DG A 16 0.554 4.987 -8.306 1.00 0.37 N ATOM 500 C8 DG A 16 1.764 4.859 -7.721 1.00 0.44 C ATOM 501 N7 DG A 16 1.710 4.724 -6.418 1.00 0.41 N ATOM 502 C5 DG A 16 0.338 4.766 -6.158 1.00 0.32 C ATOM 503 C6 DG A 16 -0.367 4.671 -4.942 1.00 0.30 C ATOM 504 O6 DG A 16 0.075 4.528 -3.815 1.00 0.35 O ATOM 505 N1 DG A 16 -1.722 4.758 -5.128 1.00 0.27 N ATOM 506 C2 DG A 16 -2.344 4.919 -6.334 1.00 0.27 C ATOM 507 N2 DG A 16 -3.659 4.985 -6.331 1.00 0.33 N ATOM 508 N3 DG A 16 -1.708 5.010 -7.484 1.00 0.27 N ATOM 509 C4 DG A 16 -0.370 4.925 -7.316 1.00 0.30 C ATOM 0 H5' DG A 16 -1.413 8.596 -10.810 1.00 0.68 H new ATOM 0 H5'' DG A 16 -1.962 7.791 -12.267 1.00 0.68 H new ATOM 0 H4' DG A 16 0.256 6.958 -11.611 1.00 0.52 H new ATOM 0 H3' DG A 16 -2.007 5.024 -11.976 1.00 0.49 H new ATOM 0 H2' DG A 16 -1.573 4.114 -9.870 1.00 0.43 H new ATOM 0 H2'' DG A 16 -0.251 3.397 -10.771 1.00 0.43 H new ATOM 0 H1' DG A 16 1.252 5.051 -10.202 1.00 0.42 H new ATOM 0 H8 DG A 16 2.691 4.867 -8.275 1.00 0.44 H new ATOM 0 H1 DG A 16 -2.314 4.698 -4.299 1.00 0.27 H new ATOM 0 H21 DG A 16 -4.166 5.105 -7.208 1.00 0.33 H new ATOM 0 H22 DG A 16 -4.171 4.916 -5.452 1.00 0.33 H new ATOM 521 P DG A 17 0.370 3.875 -13.577 1.00 0.57 P ATOM 522 OP1 DG A 17 0.705 4.317 -14.949 1.00 0.77 O ATOM 523 OP2 DG A 17 -0.606 2.778 -13.367 1.00 0.72 O ATOM 524 O5' DG A 17 1.745 3.528 -12.821 1.00 0.56 O ATOM 525 C5' DG A 17 2.002 2.257 -12.239 1.00 0.54 C ATOM 526 C4' DG A 17 2.900 2.362 -11.024 1.00 0.53 C ATOM 527 O4' DG A 17 2.195 2.813 -9.867 1.00 0.52 O ATOM 528 C3' DG A 17 3.367 0.954 -10.695 1.00 0.61 C ATOM 529 O3' DG A 17 4.776 0.835 -10.848 1.00 0.78 O ATOM 530 C2' DG A 17 2.908 0.753 -9.293 1.00 0.53 C ATOM 531 C1' DG A 17 2.810 2.132 -8.771 1.00 0.51 C ATOM 532 N9 DG A 17 1.866 1.999 -7.671 1.00 0.45 N ATOM 533 C8 DG A 17 0.529 1.972 -7.806 1.00 0.40 C ATOM 534 N7 DG A 17 -0.120 1.824 -6.694 1.00 0.38 N ATOM 535 C5 DG A 17 0.883 1.748 -5.743 1.00 0.39 C ATOM 536 C6 DG A 17 0.786 1.586 -4.348 1.00 0.40 C ATOM 537 O6 DG A 17 -0.221 1.480 -3.666 1.00 0.44 O ATOM 538 N1 DG A 17 2.023 1.560 -3.763 1.00 0.44 N ATOM 539 C2 DG A 17 3.213 1.675 -4.437 1.00 0.49 C ATOM 540 N2 DG A 17 4.323 1.624 -3.731 1.00 0.54 N ATOM 541 N3 DG A 17 3.324 1.828 -5.749 1.00 0.51 N ATOM 542 C4 DG A 17 2.113 1.856 -6.337 1.00 0.44 C ATOM 0 H5' DG A 17 2.468 1.607 -12.979 1.00 0.54 H new ATOM 0 H5'' DG A 17 1.059 1.791 -11.954 1.00 0.54 H new ATOM 0 H4' DG A 17 3.703 3.062 -11.255 1.00 0.53 H new ATOM 0 H3' DG A 17 2.963 0.191 -11.360 1.00 0.61 H new ATOM 0 H2' DG A 17 1.948 0.238 -9.253 1.00 0.53 H new ATOM 0 H2'' DG A 17 3.615 0.154 -8.719 1.00 0.53 H new ATOM 0 H1' DG A 17 3.724 2.627 -8.442 1.00 0.51 H new ATOM 0 H8 DG A 17 0.036 2.066 -8.762 1.00 0.40 H new ATOM 0 H1 DG A 17 2.064 1.447 -2.750 1.00 0.44 H new ATOM 0 H21 DG A 17 5.227 1.706 -4.196 1.00 0.54 H new ATOM 0 H22 DG A 17 4.279 1.503 -2.719 1.00 0.54 H new ATOM 554 P DG A 18 5.422 -0.633 -10.962 1.00 0.92 P ATOM 555 OP1 DG A 18 6.725 -0.522 -11.657 1.00 1.26 O ATOM 556 OP2 DG A 18 4.396 -1.577 -11.461 1.00 1.10 O ATOM 557 O5' DG A 18 5.684 -0.951 -9.413 1.00 0.77 O ATOM 558 C5' DG A 18 6.684 -0.176 -8.760 1.00 0.72 C ATOM 559 C4' DG A 18 7.079 -0.746 -7.426 1.00 0.59 C ATOM 560 O4' DG A 18 6.192 -0.417 -6.400 1.00 0.61 O ATOM 561 C3' DG A 18 7.384 -2.231 -7.398 1.00 0.54 C ATOM 562 O3' DG A 18 8.735 -2.414 -6.967 1.00 0.50 O ATOM 563 C2' DG A 18 6.393 -2.708 -6.365 1.00 0.54 C ATOM 564 C1' DG A 18 6.262 -1.484 -5.474 1.00 0.55 C ATOM 565 N9 DG A 18 4.889 -1.447 -4.995 1.00 0.54 N ATOM 566 C8 DG A 18 3.826 -1.215 -5.789 1.00 0.58 C ATOM 567 N7 DG A 18 2.667 -1.213 -5.175 1.00 0.57 N ATOM 568 C5 DG A 18 3.043 -1.471 -3.848 1.00 0.51 C ATOM 569 C6 DG A 18 2.260 -1.597 -2.672 1.00 0.48 C ATOM 570 O6 DG A 18 1.057 -1.502 -2.521 1.00 0.52 O ATOM 571 N1 DG A 18 3.031 -1.854 -1.574 1.00 0.45 N ATOM 572 C2 DG A 18 4.394 -1.978 -1.588 1.00 0.47 C ATOM 573 N2 DG A 18 4.999 -2.229 -0.452 1.00 0.50 N ATOM 574 N3 DG A 18 5.150 -1.865 -2.664 1.00 0.49 N ATOM 575 C4 DG A 18 4.405 -1.613 -3.752 1.00 0.49 C ATOM 0 H5' DG A 18 6.317 0.841 -8.622 1.00 0.72 H new ATOM 0 H5'' DG A 18 7.565 -0.113 -9.399 1.00 0.72 H new ATOM 0 H4' DG A 18 8.031 -0.248 -7.243 1.00 0.59 H new ATOM 0 H3' DG A 18 7.299 -2.757 -8.349 1.00 0.54 H new ATOM 0 H2' DG A 18 5.441 -2.992 -6.812 1.00 0.54 H new ATOM 0 H2'' DG A 18 6.759 -3.576 -5.817 1.00 0.54 H new ATOM 0 H1' DG A 18 7.031 -1.462 -4.701 1.00 0.55 H new ATOM 0 H8 DG A 18 3.921 -1.044 -6.851 1.00 0.58 H new ATOM 0 H1 DG A 18 2.556 -1.961 -0.678 1.00 0.45 H new ATOM 0 H21 DG A 18 6.014 -2.328 -0.426 1.00 0.50 H new ATOM 0 H22 DG A 18 4.455 -2.326 0.405 1.00 0.50 H new ATOM 587 P DT A 19 9.621 -3.618 -7.542 1.00 0.73 P ATOM 588 OP1 DT A 19 8.895 -4.887 -7.306 1.00 1.06 O ATOM 589 OP2 DT A 19 11.000 -3.446 -7.028 1.00 1.01 O ATOM 590 O5' DT A 19 9.594 -3.320 -9.131 1.00 0.79 O ATOM 591 C5' DT A 19 10.746 -2.990 -9.913 1.00 0.83 C ATOM 592 C4' DT A 19 11.266 -1.564 -9.674 1.00 0.77 C ATOM 593 O4' DT A 19 12.363 -1.358 -10.568 1.00 0.92 O ATOM 594 C3' DT A 19 10.265 -0.446 -9.988 1.00 0.64 C ATOM 595 O3' DT A 19 10.637 0.746 -9.284 1.00 0.67 O ATOM 596 C2' DT A 19 10.438 -0.320 -11.489 1.00 0.75 C ATOM 597 C1' DT A 19 11.979 -0.365 -11.522 1.00 0.92 C ATOM 598 N1 DT A 19 12.494 -0.722 -12.858 1.00 1.07 N ATOM 599 C2 DT A 19 13.328 0.194 -13.460 1.00 1.44 C ATOM 600 O2 DT A 19 13.636 1.261 -12.943 1.00 1.65 O ATOM 601 N3 DT A 19 13.810 -0.143 -14.695 1.00 1.64 N ATOM 602 C4 DT A 19 13.542 -1.301 -15.388 1.00 1.49 C ATOM 603 O4 DT A 19 14.044 -1.476 -16.492 1.00 1.73 O ATOM 604 C5 DT A 19 12.661 -2.211 -14.690 1.00 1.13 C ATOM 605 C7 DT A 19 12.274 -3.542 -15.332 1.00 1.12 C ATOM 606 C6 DT A 19 12.173 -1.904 -13.474 1.00 0.97 C ATOM 0 H5' DT A 19 10.503 -3.107 -10.969 1.00 0.83 H new ATOM 0 H5'' DT A 19 11.542 -3.700 -9.689 1.00 0.83 H new ATOM 0 H4' DT A 19 11.507 -1.505 -8.613 1.00 0.77 H new ATOM 0 H3' DT A 19 9.233 -0.632 -9.692 1.00 0.64 H new ATOM 0 H2' DT A 19 9.975 -1.137 -12.042 1.00 0.75 H new ATOM 0 H2'' DT A 19 10.029 0.608 -11.889 1.00 0.75 H new ATOM 0 H1' DT A 19 12.392 0.616 -11.288 1.00 0.92 H new ATOM 0 H3 DT A 19 14.429 0.530 -15.147 1.00 1.64 H new ATOM 0 H71 DT A 19 12.092 -4.282 -14.553 1.00 1.12 H new ATOM 0 H72 DT A 19 11.369 -3.410 -15.926 1.00 1.12 H new ATOM 0 H73 DT A 19 13.084 -3.884 -15.976 1.00 1.12 H new ATOM 0 H6 DT A 19 11.517 -2.601 -12.974 1.00 0.97 H new ATOM 619 P DT A 20 10.014 2.211 -9.544 1.00 0.78 P ATOM 620 OP1 DT A 20 8.953 2.119 -10.579 1.00 0.96 O ATOM 621 OP2 DT A 20 11.144 3.150 -9.727 1.00 0.98 O ATOM 622 O5' DT A 20 9.336 2.521 -8.120 1.00 0.76 O ATOM 623 C5' DT A 20 7.950 2.831 -7.879 1.00 0.82 C ATOM 624 C4' DT A 20 7.830 3.881 -6.769 1.00 0.67 C ATOM 625 O4' DT A 20 8.463 3.431 -5.562 1.00 0.49 O ATOM 626 C3' DT A 20 8.584 5.178 -7.127 1.00 0.77 C ATOM 627 O3' DT A 20 8.211 6.361 -6.369 1.00 0.80 O ATOM 628 C2' DT A 20 9.987 4.730 -6.738 1.00 0.68 C ATOM 629 C1' DT A 20 9.645 4.230 -5.366 1.00 0.49 C ATOM 630 N1 DT A 20 10.779 3.437 -4.868 1.00 0.42 N ATOM 631 C2 DT A 20 11.660 3.950 -3.938 1.00 0.52 C ATOM 632 O2 DT A 20 11.586 5.081 -3.471 1.00 0.62 O ATOM 633 N3 DT A 20 12.668 3.101 -3.555 1.00 0.58 N ATOM 634 C4 DT A 20 12.871 1.814 -4.004 1.00 0.55 C ATOM 635 O4 DT A 20 13.819 1.172 -3.569 1.00 0.72 O ATOM 636 C5 DT A 20 11.897 1.357 -4.975 1.00 0.44 C ATOM 637 C7 DT A 20 11.994 -0.069 -5.557 1.00 0.55 C ATOM 638 C6 DT A 20 10.908 2.185 -5.359 1.00 0.40 C ATOM 0 H5' DT A 20 7.411 1.927 -7.595 1.00 0.82 H new ATOM 0 H5'' DT A 20 7.488 3.203 -8.794 1.00 0.82 H new ATOM 0 H4' DT A 20 6.760 4.048 -6.647 1.00 0.67 H new ATOM 0 H3' DT A 20 8.406 5.504 -8.152 1.00 0.77 H new ATOM 0 H2' DT A 20 10.387 3.954 -7.391 1.00 0.68 H new ATOM 0 H2'' DT A 20 10.711 5.544 -6.730 1.00 0.68 H new ATOM 0 H1' DT A 20 9.461 5.014 -4.632 1.00 0.49 H new ATOM 0 H3 DT A 20 13.333 3.458 -2.869 1.00 0.58 H new ATOM 0 H71 DT A 20 10.996 -0.428 -5.808 1.00 0.55 H new ATOM 0 H72 DT A 20 12.611 -0.054 -6.455 1.00 0.55 H new ATOM 0 H73 DT A 20 12.444 -0.733 -4.819 1.00 0.55 H new ATOM 0 H6 DT A 20 10.191 1.836 -6.087 1.00 0.40 H new ATOM 651 P DG A 21 7.207 6.499 -5.092 1.00 0.78 P ATOM 652 OP1 DG A 21 6.009 5.671 -5.352 1.00 0.84 O ATOM 653 OP2 DG A 21 7.041 7.949 -4.841 1.00 1.02 O ATOM 654 O5' DG A 21 7.969 5.868 -3.807 1.00 0.67 O ATOM 655 C5' DG A 21 8.862 6.538 -2.886 1.00 0.59 C ATOM 656 C4' DG A 21 8.919 5.733 -1.561 1.00 0.41 C ATOM 657 O4' DG A 21 7.699 5.877 -0.820 1.00 0.42 O ATOM 658 C3' DG A 21 9.198 4.207 -1.641 1.00 0.32 C ATOM 659 O3' DG A 21 10.045 3.867 -0.532 1.00 0.38 O ATOM 660 C2' DG A 21 7.789 3.697 -1.464 1.00 0.33 C ATOM 661 C1' DG A 21 7.313 4.587 -0.368 1.00 0.36 C ATOM 662 N9 DG A 21 5.869 4.518 -0.131 1.00 0.36 N ATOM 663 C8 DG A 21 5.264 4.418 1.081 1.00 0.38 C ATOM 664 N7 DG A 21 3.963 4.351 1.020 1.00 0.41 N ATOM 665 C5 DG A 21 3.697 4.416 -0.345 1.00 0.40 C ATOM 666 C6 DG A 21 2.460 4.389 -1.027 1.00 0.42 C ATOM 667 O6 DG A 21 1.338 4.309 -0.541 1.00 0.44 O ATOM 668 N1 DG A 21 2.625 4.473 -2.390 1.00 0.43 N ATOM 669 C2 DG A 21 3.825 4.579 -3.036 1.00 0.43 C ATOM 670 N2 DG A 21 3.803 4.681 -4.355 1.00 0.45 N ATOM 671 N3 DG A 21 4.998 4.605 -2.410 1.00 0.41 N ATOM 672 C4 DG A 21 4.858 4.518 -1.062 1.00 0.38 C ATOM 0 H5' DG A 21 8.513 7.553 -2.695 1.00 0.59 H new ATOM 0 H5'' DG A 21 9.859 6.620 -3.320 1.00 0.59 H new ATOM 0 H4' DG A 21 9.790 6.180 -1.082 1.00 0.41 H new ATOM 0 H3' DG A 21 9.694 3.821 -2.532 1.00 0.32 H new ATOM 0 H2' DG A 21 7.193 3.802 -2.371 1.00 0.33 H new ATOM 0 H2'' DG A 21 7.761 2.644 -1.184 1.00 0.33 H new ATOM 0 H1' DG A 21 7.739 4.302 0.594 1.00 0.36 H new ATOM 0 H8 DG A 21 5.811 4.396 2.012 1.00 0.38 H new ATOM 0 H1 DG A 21 1.783 4.455 -2.966 1.00 0.43 H new ATOM 0 H21 DG A 21 4.677 4.762 -4.875 1.00 0.45 H new ATOM 0 H22 DG A 21 2.912 4.679 -4.852 1.00 0.45 H new ATOM 684 P DG A 22 10.884 2.483 -0.457 1.00 0.42 P ATOM 685 OP1 DG A 22 12.234 2.779 0.077 1.00 0.55 O ATOM 686 OP2 DG A 22 10.746 1.767 -1.747 1.00 0.54 O ATOM 687 O5' DG A 22 10.043 1.675 0.652 1.00 0.41 O ATOM 688 C5' DG A 22 9.920 2.169 1.994 1.00 0.34 C ATOM 689 C4' DG A 22 8.670 1.618 2.668 1.00 0.31 C ATOM 690 O4' DG A 22 7.499 2.005 1.946 1.00 0.33 O ATOM 691 C3' DG A 22 8.663 0.071 2.780 1.00 0.39 C ATOM 692 O3' DG A 22 8.531 -0.569 4.073 1.00 0.62 O ATOM 693 C2' DG A 22 7.479 -0.269 1.895 1.00 0.44 C ATOM 694 C1' DG A 22 6.584 0.939 2.132 1.00 0.38 C ATOM 695 N9 DG A 22 5.507 1.029 1.142 1.00 0.37 N ATOM 696 C8 DG A 22 5.624 1.051 -0.215 1.00 0.38 C ATOM 697 N7 DG A 22 4.493 1.137 -0.845 1.00 0.41 N ATOM 698 C5 DG A 22 3.558 1.176 0.175 1.00 0.39 C ATOM 699 C6 DG A 22 2.160 1.268 0.096 1.00 0.40 C ATOM 700 O6 DG A 22 1.464 1.331 -0.904 1.00 0.45 O ATOM 701 N1 DG A 22 1.587 1.278 1.333 1.00 0.40 N ATOM 702 C2 DG A 22 2.257 1.210 2.521 1.00 0.39 C ATOM 703 N2 DG A 22 1.508 1.226 3.608 1.00 0.42 N ATOM 704 N3 DG A 22 3.580 1.121 2.623 1.00 0.38 N ATOM 705 C4 DG A 22 4.166 1.110 1.401 1.00 0.38 C ATOM 0 H5' DG A 22 9.880 3.258 1.982 1.00 0.34 H new ATOM 0 H5'' DG A 22 10.802 1.889 2.570 1.00 0.34 H new ATOM 0 H4' DG A 22 8.674 2.037 3.674 1.00 0.31 H new ATOM 0 H3' DG A 22 9.650 -0.306 2.511 1.00 0.39 H new ATOM 0 H2' DG A 22 7.763 -0.373 0.848 1.00 0.44 H new ATOM 0 H2'' DG A 22 6.999 -1.202 2.189 1.00 0.44 H new ATOM 0 H1' DG A 22 6.082 0.919 3.100 1.00 0.38 H new ATOM 0 H8 DG A 22 6.576 1.001 -0.723 1.00 0.38 H new ATOM 0 H1 DG A 22 0.570 1.342 1.375 1.00 0.40 H new ATOM 0 H21 DG A 22 1.944 1.178 4.529 1.00 0.42 H new ATOM 0 H22 DG A 22 0.493 1.286 3.527 1.00 0.42 H new ATOM 717 P DG A 23 8.956 0.009 5.536 1.00 0.67 P ATOM 718 OP1 DG A 23 9.291 1.442 5.399 1.00 1.06 O ATOM 719 OP2 DG A 23 9.940 -0.929 6.127 1.00 1.40 O ATOM 720 O5' DG A 23 7.625 -0.089 6.426 1.00 0.68 O ATOM 721 C5' DG A 23 6.342 -0.150 5.828 1.00 0.70 C ATOM 722 C4' DG A 23 5.317 -0.709 6.796 1.00 0.72 C ATOM 723 O4' DG A 23 4.137 -0.815 6.023 1.00 0.72 O ATOM 724 C3' DG A 23 5.529 -2.122 7.375 1.00 0.71 C ATOM 725 O3' DG A 23 4.630 -2.241 8.489 1.00 0.79 O ATOM 726 C2' DG A 23 5.125 -2.955 6.170 1.00 0.64 C ATOM 727 C1' DG A 23 3.871 -2.196 5.767 1.00 0.67 C ATOM 728 N9 DG A 23 3.530 -2.239 4.333 1.00 0.59 N ATOM 729 C8 DG A 23 4.287 -2.460 3.204 1.00 0.56 C ATOM 730 N7 DG A 23 3.601 -2.401 2.101 1.00 0.52 N ATOM 731 C5 DG A 23 2.315 -2.128 2.516 1.00 0.52 C ATOM 732 C6 DG A 23 1.135 -1.952 1.759 1.00 0.50 C ATOM 733 O6 DG A 23 1.004 -1.992 0.539 1.00 0.48 O ATOM 734 N1 DG A 23 0.062 -1.695 2.574 1.00 0.55 N ATOM 735 C2 DG A 23 0.124 -1.620 3.945 1.00 0.59 C ATOM 736 N2 DG A 23 -0.975 -1.366 4.609 1.00 0.64 N ATOM 737 N3 DG A 23 1.215 -1.781 4.663 1.00 0.61 N ATOM 738 C4 DG A 23 2.270 -2.031 3.876 1.00 0.56 C ATOM 0 H5' DG A 23 6.382 -0.774 4.935 1.00 0.70 H new ATOM 0 H5'' DG A 23 6.039 0.847 5.507 1.00 0.70 H new ATOM 0 H4' DG A 23 5.339 -0.044 7.660 1.00 0.72 H new ATOM 0 H3' DG A 23 6.515 -2.395 7.751 1.00 0.71 H new ATOM 0 H2' DG A 23 5.884 -2.960 5.388 1.00 0.64 H new ATOM 0 H2'' DG A 23 4.924 -3.995 6.425 1.00 0.64 H new ATOM 0 H1' DG A 23 3.053 -2.655 6.321 1.00 0.67 H new ATOM 0 H8 DG A 23 5.347 -2.663 3.232 1.00 0.56 H new ATOM 0 H1 DG A 23 -0.845 -1.549 2.132 1.00 0.55 H new ATOM 0 H21 DG A 23 -0.953 -1.306 5.627 1.00 0.64 H new ATOM 0 H22 DG A 23 -1.853 -1.228 4.108 1.00 0.64 H new ATOM 750 P DG A 24 4.364 -3.556 9.383 1.00 0.87 P ATOM 751 OP1 DG A 24 3.819 -3.120 10.688 1.00 1.21 O ATOM 752 OP2 DG A 24 5.569 -4.419 9.339 1.00 1.05 O ATOM 753 O5' DG A 24 3.180 -4.298 8.575 1.00 0.67 O ATOM 754 C5' DG A 24 3.290 -5.632 8.061 1.00 0.59 C ATOM 755 C4' DG A 24 1.936 -6.323 8.156 1.00 0.50 C ATOM 756 O4' DG A 24 0.981 -5.691 7.282 1.00 0.55 O ATOM 757 C3' DG A 24 1.988 -7.801 7.739 1.00 0.68 C ATOM 758 O3' DG A 24 0.906 -8.557 8.295 1.00 0.88 O ATOM 759 C2' DG A 24 1.744 -7.641 6.232 1.00 0.68 C ATOM 760 C1' DG A 24 0.585 -6.637 6.287 1.00 0.58 C ATOM 761 N9 DG A 24 0.333 -5.977 4.997 1.00 0.49 N ATOM 762 C8 DG A 24 1.208 -5.489 4.062 1.00 0.50 C ATOM 763 N7 DG A 24 0.627 -4.976 3.010 1.00 0.53 N ATOM 764 C5 DG A 24 -0.729 -5.140 3.275 1.00 0.50 C ATOM 765 C6 DG A 24 -1.857 -4.781 2.503 1.00 0.57 C ATOM 766 O6 DG A 24 -1.890 -4.248 1.403 1.00 0.63 O ATOM 767 N1 DG A 24 -3.037 -5.121 3.134 1.00 0.69 N ATOM 768 C2 DG A 24 -3.124 -5.734 4.356 1.00 0.76 C ATOM 769 N2 DG A 24 -4.339 -5.982 4.806 1.00 0.98 N ATOM 770 N3 DG A 24 -2.078 -6.080 5.093 1.00 0.70 N ATOM 771 C4 DG A 24 -0.913 -5.750 4.488 1.00 0.53 C ATOM 0 H5' DG A 24 4.036 -6.191 8.626 1.00 0.59 H new ATOM 0 H5'' DG A 24 3.627 -5.608 7.025 1.00 0.59 H new ATOM 0 H4' DG A 24 1.646 -6.246 9.204 1.00 0.50 H new ATOM 0 H3' DG A 24 2.897 -8.317 8.048 1.00 0.68 H new ATOM 0 H2' DG A 24 2.614 -7.252 5.703 1.00 0.68 H new ATOM 0 H2'' DG A 24 1.468 -8.578 5.747 1.00 0.68 H new ATOM 0 HO3' DG A 24 0.976 -9.490 8.004 1.00 0.88 H new ATOM 0 H1' DG A 24 -0.355 -7.135 6.523 1.00 0.58 H new ATOM 0 H8 DG A 24 2.281 -5.525 4.184 1.00 0.50 H new ATOM 0 H1 DG A 24 -3.909 -4.899 2.654 1.00 0.69 H new ATOM 0 H21 DG A 24 -4.465 -6.437 5.710 1.00 0.98 H new ATOM 0 H22 DG A 24 -5.152 -5.719 4.250 1.00 0.98 H new TER 784 DG A 24