USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 274 hydrogens (25 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 4 DT C7 :methyl -30:sc= 0 (180deg=-0.000111) USER MOD Single : A 4 DT O5' : rot -75:sc= 1.18 USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl -30:sc= 0 (180deg=-0.000151) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT C7 :methyl 150:sc=-0.00168 (180deg=-0.00168) USER MOD Single : A 25 DA O3' : rot -87:sc= 0.0329 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 4 6.029 -9.080 -12.745 1.00 0.70 O ATOM 2 C5' DT A 4 6.361 -10.141 -11.847 1.00 0.67 C ATOM 3 C4' DT A 4 7.851 -10.222 -11.608 1.00 0.56 C ATOM 4 O4' DT A 4 8.097 -11.003 -10.411 1.00 0.67 O ATOM 5 C3' DT A 4 8.646 -10.903 -12.726 1.00 0.52 C ATOM 6 O3' DT A 4 9.909 -10.251 -12.906 1.00 0.49 O ATOM 7 C2' DT A 4 8.843 -12.317 -12.211 1.00 0.70 C ATOM 8 C1' DT A 4 8.936 -12.108 -10.710 1.00 0.61 C ATOM 9 N1 DT A 4 8.482 -13.258 -9.903 1.00 0.80 N ATOM 10 C2 DT A 4 7.146 -13.593 -9.938 1.00 1.15 C ATOM 11 O2 DT A 4 6.322 -12.987 -10.604 1.00 1.30 O ATOM 12 N3 DT A 4 6.806 -14.670 -9.160 1.00 1.35 N ATOM 13 C4 DT A 4 7.648 -15.427 -8.370 1.00 1.22 C ATOM 14 O4 DT A 4 7.197 -16.369 -7.724 1.00 1.44 O ATOM 15 C5 DT A 4 9.035 -15.020 -8.380 1.00 0.86 C ATOM 16 C7 DT A 4 10.019 -15.784 -7.550 1.00 0.78 C ATOM 17 C6 DT A 4 9.383 -13.968 -9.136 1.00 0.69 C ATOM 0 H5' DT A 4 6.005 -11.088 -12.254 1.00 0.67 H new ATOM 0 H5'' DT A 4 5.847 -9.989 -10.898 1.00 0.67 H new ATOM 0 H4' DT A 4 8.182 -9.186 -11.538 1.00 0.56 H new ATOM 0 H3' DT A 4 8.142 -10.870 -13.692 1.00 0.52 H new ATOM 0 H2' DT A 4 8.010 -12.967 -12.480 1.00 0.70 H new ATOM 0 H2'' DT A 4 9.747 -12.774 -12.614 1.00 0.70 H new ATOM 0 HO5' DT A 4 6.097 -8.222 -12.277 1.00 0.70 H new ATOM 0 H1' DT A 4 9.985 -11.957 -10.457 1.00 0.61 H new ATOM 0 H3 DT A 4 5.823 -14.942 -9.166 1.00 1.35 H new ATOM 0 H71 DT A 4 9.516 -16.192 -6.673 1.00 0.78 H new ATOM 0 H72 DT A 4 10.437 -16.599 -8.140 1.00 0.78 H new ATOM 0 H73 DT A 4 10.821 -15.118 -7.232 1.00 0.78 H new ATOM 0 H6 DT A 4 10.419 -13.662 -9.145 1.00 0.69 H new ATOM 31 P DG A 5 10.591 -10.214 -14.361 1.00 0.47 P ATOM 32 OP1 DG A 5 9.572 -9.713 -15.318 1.00 0.56 O ATOM 33 OP2 DG A 5 11.242 -11.527 -14.604 1.00 0.64 O ATOM 34 O5' DG A 5 11.730 -9.108 -14.225 1.00 0.62 O ATOM 35 C5' DG A 5 11.415 -7.717 -14.285 1.00 0.45 C ATOM 36 C4' DG A 5 12.634 -6.892 -13.941 1.00 0.36 C ATOM 37 O4' DG A 5 13.136 -7.306 -12.645 1.00 0.40 O ATOM 38 C3' DG A 5 13.808 -7.044 -14.912 1.00 0.41 C ATOM 39 O3' DG A 5 14.509 -5.801 -15.046 1.00 0.48 O ATOM 40 C2' DG A 5 14.685 -8.081 -14.237 1.00 0.40 C ATOM 41 C1' DG A 5 14.468 -7.782 -12.764 1.00 0.37 C ATOM 42 N9 DG A 5 14.614 -8.942 -11.886 1.00 0.49 N ATOM 43 C8 DG A 5 13.641 -9.847 -11.539 1.00 0.69 C ATOM 44 N7 DG A 5 14.067 -10.781 -10.735 1.00 0.82 N ATOM 45 C5 DG A 5 15.407 -10.475 -10.537 1.00 0.69 C ATOM 46 C6 DG A 5 16.393 -11.132 -9.757 1.00 0.77 C ATOM 47 O6 DG A 5 16.272 -12.149 -9.064 1.00 0.96 O ATOM 48 N1 DG A 5 17.629 -10.491 -9.832 1.00 0.64 N ATOM 49 C2 DG A 5 17.872 -9.356 -10.571 1.00 0.48 C ATOM 50 N2 DG A 5 19.124 -8.879 -10.522 1.00 0.49 N ATOM 51 N3 DG A 5 16.961 -8.734 -11.302 1.00 0.41 N ATOM 52 C4 DG A 5 15.760 -9.343 -11.239 1.00 0.50 C ATOM 0 H5' DG A 5 10.605 -7.490 -13.592 1.00 0.45 H new ATOM 0 H5'' DG A 5 11.062 -7.459 -15.283 1.00 0.45 H new ATOM 0 H4' DG A 5 12.293 -5.857 -13.976 1.00 0.36 H new ATOM 0 H3' DG A 5 13.501 -7.332 -15.917 1.00 0.41 H new ATOM 0 H2' DG A 5 14.384 -9.097 -14.494 1.00 0.40 H new ATOM 0 H2'' DG A 5 15.732 -7.976 -14.523 1.00 0.40 H new ATOM 0 H1' DG A 5 15.228 -7.066 -12.452 1.00 0.37 H new ATOM 0 H8 DG A 5 12.624 -9.791 -11.897 1.00 0.69 H new ATOM 0 H1 DG A 5 18.405 -10.890 -9.304 1.00 0.64 H new ATOM 0 H21 DG A 5 19.371 -8.040 -11.047 1.00 0.49 H new ATOM 0 H22 DG A 5 19.829 -9.355 -9.960 1.00 0.49 H new ATOM 64 P DA A 6 14.134 -4.793 -16.242 1.00 0.64 P ATOM 65 OP1 DA A 6 13.809 -5.615 -17.435 1.00 0.74 O ATOM 66 OP2 DA A 6 15.198 -3.760 -16.331 1.00 0.78 O ATOM 67 O5' DA A 6 12.793 -4.088 -15.746 1.00 0.66 O ATOM 68 C5' DA A 6 12.808 -3.164 -14.658 1.00 0.67 C ATOM 69 C4' DA A 6 11.429 -2.581 -14.451 1.00 0.63 C ATOM 70 O4' DA A 6 10.481 -3.651 -14.261 1.00 0.43 O ATOM 71 C3' DA A 6 11.280 -1.705 -13.216 1.00 0.75 C ATOM 72 O3' DA A 6 11.617 -0.348 -13.525 1.00 1.09 O ATOM 73 C2' DA A 6 9.802 -1.832 -12.884 1.00 0.49 C ATOM 74 C1' DA A 6 9.433 -3.223 -13.398 1.00 0.40 C ATOM 75 N9 DA A 6 9.278 -4.232 -12.348 1.00 0.38 N ATOM 76 C8 DA A 6 10.217 -4.649 -11.436 1.00 0.44 C ATOM 77 N7 DA A 6 9.782 -5.572 -10.614 1.00 0.50 N ATOM 78 C5 DA A 6 8.468 -5.779 -11.010 1.00 0.50 C ATOM 79 C6 DA A 6 7.460 -6.637 -10.535 1.00 0.64 C ATOM 80 N6 DA A 6 7.627 -7.482 -9.514 1.00 0.74 N ATOM 81 N1 DA A 6 6.259 -6.597 -11.152 1.00 0.72 N ATOM 82 C2 DA A 6 6.091 -5.750 -12.175 1.00 0.66 C ATOM 83 N3 DA A 6 6.960 -4.897 -12.712 1.00 0.53 N ATOM 84 C4 DA A 6 8.143 -4.961 -12.077 1.00 0.44 C ATOM 0 H5' DA A 6 13.522 -2.365 -14.859 1.00 0.67 H new ATOM 0 H5'' DA A 6 13.139 -3.666 -13.749 1.00 0.67 H new ATOM 0 H4' DA A 6 11.256 -1.973 -15.339 1.00 0.63 H new ATOM 0 H3' DA A 6 11.931 -1.999 -12.392 1.00 0.75 H new ATOM 0 H2' DA A 6 9.623 -1.741 -11.813 1.00 0.49 H new ATOM 0 H2'' DA A 6 9.214 -1.055 -13.373 1.00 0.49 H new ATOM 0 H1' DA A 6 8.466 -3.135 -13.894 1.00 0.40 H new ATOM 0 H8 DA A 6 11.221 -4.253 -11.400 1.00 0.44 H new ATOM 0 H61 DA A 6 6.856 -8.080 -9.216 1.00 0.74 H new ATOM 0 H62 DA A 6 8.525 -7.529 -9.033 1.00 0.74 H new ATOM 0 H2 DA A 6 5.111 -5.760 -12.629 1.00 0.66 H new ATOM 96 P DG A 7 11.453 0.796 -12.406 1.00 1.32 P ATOM 97 OP1 DG A 7 12.480 1.833 -12.678 1.00 1.80 O ATOM 98 OP2 DG A 7 11.404 0.144 -11.073 1.00 2.18 O ATOM 99 O5' DG A 7 10.021 1.426 -12.708 1.00 0.69 O ATOM 100 C5' DG A 7 9.507 2.496 -11.915 1.00 0.73 C ATOM 101 C4' DG A 7 7.996 2.475 -11.930 1.00 0.69 C ATOM 102 O4' DG A 7 7.537 1.119 -11.700 1.00 0.66 O ATOM 103 C3' DG A 7 7.330 3.325 -10.847 1.00 0.78 C ATOM 104 O3' DG A 7 6.086 3.854 -11.322 1.00 0.89 O ATOM 105 C2' DG A 7 7.097 2.329 -9.728 1.00 0.69 C ATOM 106 C1' DG A 7 6.795 1.051 -10.490 1.00 0.64 C ATOM 107 N9 DG A 7 7.181 -0.171 -9.790 1.00 0.53 N ATOM 108 C8 DG A 7 8.456 -0.595 -9.507 1.00 0.50 C ATOM 109 N7 DG A 7 8.491 -1.729 -8.862 1.00 0.42 N ATOM 110 C5 DG A 7 7.154 -2.076 -8.711 1.00 0.39 C ATOM 111 C6 DG A 7 6.565 -3.206 -8.090 1.00 0.37 C ATOM 112 O6 DG A 7 7.128 -4.152 -7.529 1.00 0.34 O ATOM 113 N1 DG A 7 5.173 -3.171 -8.158 1.00 0.44 N ATOM 114 C2 DG A 7 4.450 -2.163 -8.755 1.00 0.53 C ATOM 115 N2 DG A 7 3.115 -2.291 -8.722 1.00 0.64 N ATOM 116 N3 DG A 7 4.989 -1.105 -9.337 1.00 0.56 N ATOM 117 C4 DG A 7 6.335 -1.126 -9.278 1.00 0.48 C ATOM 0 H5' DG A 7 9.869 3.450 -12.299 1.00 0.73 H new ATOM 0 H5'' DG A 7 9.869 2.407 -10.891 1.00 0.73 H new ATOM 0 H4' DG A 7 7.721 2.881 -12.903 1.00 0.69 H new ATOM 0 H3' DG A 7 7.927 4.184 -10.540 1.00 0.78 H new ATOM 0 H2' DG A 7 7.973 2.224 -9.088 1.00 0.69 H new ATOM 0 H2'' DG A 7 6.267 2.625 -9.086 1.00 0.69 H new ATOM 0 H1' DG A 7 5.716 0.993 -10.632 1.00 0.64 H new ATOM 0 H8 DG A 7 9.341 -0.045 -9.790 1.00 0.50 H new ATOM 0 H1 DG A 7 4.656 -3.943 -7.738 1.00 0.44 H new ATOM 0 H21 DG A 7 2.524 -1.577 -9.147 1.00 0.64 H new ATOM 0 H22 DG A 7 2.691 -3.102 -8.272 1.00 0.64 H new ATOM 129 P DG A 8 5.190 4.785 -10.363 1.00 1.06 P ATOM 130 OP1 DG A 8 4.580 5.840 -11.212 1.00 1.12 O ATOM 131 OP2 DG A 8 6.010 5.175 -9.188 1.00 1.22 O ATOM 132 O5' DG A 8 4.026 3.817 -9.862 1.00 1.04 O ATOM 133 C5' DG A 8 2.975 3.413 -10.741 1.00 1.08 C ATOM 134 C4' DG A 8 1.829 2.821 -9.953 1.00 0.90 C ATOM 135 O4' DG A 8 2.285 1.618 -9.281 1.00 0.96 O ATOM 136 C3' DG A 8 1.261 3.731 -8.856 1.00 0.64 C ATOM 137 O3' DG A 8 -0.169 3.647 -8.835 1.00 0.72 O ATOM 138 C2' DG A 8 1.850 3.161 -7.576 1.00 0.57 C ATOM 139 C1' DG A 8 1.964 1.686 -7.903 1.00 0.76 C ATOM 140 N9 DG A 8 3.005 0.978 -7.158 1.00 0.72 N ATOM 141 C8 DG A 8 4.355 1.223 -7.188 1.00 0.73 C ATOM 142 N7 DG A 8 5.042 0.425 -6.419 1.00 0.70 N ATOM 143 C5 DG A 8 4.086 -0.401 -5.845 1.00 0.66 C ATOM 144 C6 DG A 8 4.232 -1.466 -4.921 1.00 0.63 C ATOM 145 O6 DG A 8 5.272 -1.900 -4.414 1.00 0.62 O ATOM 146 N1 DG A 8 3.007 -2.043 -4.593 1.00 0.64 N ATOM 147 C2 DG A 8 1.795 -1.633 -5.100 1.00 0.68 C ATOM 148 N2 DG A 8 0.714 -2.299 -4.664 1.00 0.73 N ATOM 149 N3 DG A 8 1.646 -0.640 -5.963 1.00 0.69 N ATOM 150 C4 DG A 8 2.824 -0.073 -6.289 1.00 0.68 C ATOM 0 H5' DG A 8 3.351 2.680 -11.455 1.00 1.08 H new ATOM 0 H5'' DG A 8 2.625 4.269 -11.317 1.00 1.08 H new ATOM 0 H4' DG A 8 1.043 2.646 -10.688 1.00 0.90 H new ATOM 0 H3' DG A 8 1.507 4.783 -9.001 1.00 0.64 H new ATOM 0 H2' DG A 8 2.819 3.602 -7.342 1.00 0.57 H new ATOM 0 H2'' DG A 8 1.204 3.338 -6.716 1.00 0.57 H new ATOM 0 H1' DG A 8 1.024 1.205 -7.633 1.00 0.76 H new ATOM 0 H8 DG A 8 4.804 2.000 -7.789 1.00 0.73 H new ATOM 0 H1 DG A 8 3.009 -2.821 -3.933 1.00 0.64 H new ATOM 0 H21 DG A 8 -0.214 -2.043 -5.002 1.00 0.73 H new ATOM 0 H22 DG A 8 0.820 -3.061 -3.994 1.00 0.73 H new ATOM 162 P DG A 9 -1.011 4.522 -7.781 1.00 0.70 P ATOM 163 OP1 DG A 9 -2.231 5.004 -8.478 1.00 0.95 O ATOM 164 OP2 DG A 9 -0.094 5.503 -7.146 1.00 0.72 O ATOM 165 O5' DG A 9 -1.458 3.466 -6.674 1.00 1.00 O ATOM 166 C5' DG A 9 -2.150 2.271 -7.038 1.00 0.93 C ATOM 167 C4' DG A 9 -2.777 1.635 -5.818 1.00 0.75 C ATOM 168 O4' DG A 9 -1.784 0.816 -5.148 1.00 0.59 O ATOM 169 C3' DG A 9 -3.290 2.626 -4.765 1.00 0.80 C ATOM 170 O3' DG A 9 -4.544 2.182 -4.235 1.00 0.87 O ATOM 171 C2' DG A 9 -2.217 2.595 -3.691 1.00 0.70 C ATOM 172 C1' DG A 9 -1.715 1.167 -3.778 1.00 0.51 C ATOM 173 N9 DG A 9 -0.337 0.977 -3.328 1.00 0.43 N ATOM 174 C8 DG A 9 0.779 1.653 -3.760 1.00 0.44 C ATOM 175 N7 DG A 9 1.878 1.263 -3.173 1.00 0.39 N ATOM 176 C5 DG A 9 1.462 0.268 -2.298 1.00 0.33 C ATOM 177 C6 DG A 9 2.210 -0.525 -1.392 1.00 0.31 C ATOM 178 O6 DG A 9 3.427 -0.500 -1.178 1.00 0.34 O ATOM 179 N1 DG A 9 1.401 -1.418 -0.691 1.00 0.31 N ATOM 180 C2 DG A 9 0.038 -1.524 -0.854 1.00 0.35 C ATOM 181 N2 DG A 9 -0.581 -2.440 -0.093 1.00 0.41 N ATOM 182 N3 DG A 9 -0.669 -0.789 -1.697 1.00 0.39 N ATOM 183 C4 DG A 9 0.101 0.080 -2.381 1.00 0.37 C ATOM 0 H5' DG A 9 -1.459 1.571 -7.507 1.00 0.93 H new ATOM 0 H5'' DG A 9 -2.921 2.499 -7.774 1.00 0.93 H new ATOM 0 H4' DG A 9 -3.631 1.074 -6.199 1.00 0.75 H new ATOM 0 H3' DG A 9 -3.459 3.626 -5.165 1.00 0.80 H new ATOM 0 H2' DG A 9 -1.425 3.317 -3.887 1.00 0.70 H new ATOM 0 H2'' DG A 9 -2.621 2.825 -2.705 1.00 0.70 H new ATOM 0 H1' DG A 9 -2.329 0.552 -3.121 1.00 0.51 H new ATOM 0 H8 DG A 9 0.750 2.429 -4.510 1.00 0.44 H new ATOM 0 H1 DG A 9 1.849 -2.034 -0.012 1.00 0.31 H new ATOM 0 H21 DG A 9 -1.590 -2.567 -0.167 1.00 0.41 H new ATOM 0 H22 DG A 9 -0.042 -3.009 0.560 1.00 0.41 H new ATOM 195 P DT A 10 -5.913 2.554 -4.994 1.00 0.90 P ATOM 196 OP1 DT A 10 -5.552 3.059 -6.344 1.00 1.21 O ATOM 197 OP2 DT A 10 -6.733 3.398 -4.090 1.00 1.18 O ATOM 198 O5' DT A 10 -6.647 1.151 -5.172 1.00 0.64 O ATOM 199 C5' DT A 10 -7.926 1.065 -5.801 1.00 0.29 C ATOM 200 C4' DT A 10 -8.107 -0.298 -6.428 1.00 0.33 C ATOM 201 O4' DT A 10 -9.523 -0.546 -6.623 1.00 0.76 O ATOM 202 C3' DT A 10 -7.458 -0.464 -7.805 1.00 0.68 C ATOM 203 O3' DT A 10 -6.935 -1.789 -7.952 1.00 0.62 O ATOM 204 C2' DT A 10 -8.610 -0.235 -8.765 1.00 1.06 C ATOM 205 C1' DT A 10 -9.792 -0.795 -7.994 1.00 1.03 C ATOM 206 N1 DT A 10 -11.089 -0.173 -8.328 1.00 1.51 N ATOM 207 C2 DT A 10 -11.718 -0.567 -9.488 1.00 1.89 C ATOM 208 O2 DT A 10 -11.255 -1.403 -10.247 1.00 1.88 O ATOM 209 N3 DT A 10 -12.917 0.055 -9.728 1.00 2.36 N ATOM 210 C4 DT A 10 -13.533 1.009 -8.943 1.00 2.48 C ATOM 211 O4 DT A 10 -14.613 1.480 -9.289 1.00 2.93 O ATOM 212 C5 DT A 10 -12.817 1.376 -7.742 1.00 2.10 C ATOM 213 C7 DT A 10 -13.413 2.404 -6.831 1.00 2.31 C ATOM 214 C6 DT A 10 -11.644 0.776 -7.493 1.00 1.64 C ATOM 0 H5' DT A 10 -8.018 1.839 -6.563 1.00 0.29 H new ATOM 0 H5'' DT A 10 -8.713 1.244 -5.068 1.00 0.29 H new ATOM 0 H4' DT A 10 -7.625 -0.992 -5.739 1.00 0.33 H new ATOM 0 H3' DT A 10 -6.623 0.216 -7.972 1.00 0.68 H new ATOM 0 H2' DT A 10 -8.741 0.822 -8.998 1.00 1.06 H new ATOM 0 H2'' DT A 10 -8.460 -0.754 -9.712 1.00 1.06 H new ATOM 0 H1' DT A 10 -9.890 -1.851 -8.248 1.00 1.03 H new ATOM 0 H3 DT A 10 -13.407 -0.217 -10.580 1.00 2.36 H new ATOM 0 H71 DT A 10 -13.103 2.204 -5.805 1.00 2.31 H new ATOM 0 H72 DT A 10 -13.070 3.395 -7.127 1.00 2.31 H new ATOM 0 H73 DT A 10 -14.500 2.362 -6.897 1.00 2.31 H new ATOM 0 H6 DT A 10 -11.108 1.048 -6.596 1.00 1.64 H new ATOM 227 P DG A 11 -5.524 -2.014 -8.688 1.00 0.75 P ATOM 228 OP1 DG A 11 -4.508 -1.213 -7.958 1.00 1.21 O ATOM 229 OP2 DG A 11 -5.718 -1.801 -10.144 1.00 1.03 O ATOM 230 O5' DG A 11 -5.206 -3.557 -8.446 1.00 0.66 O ATOM 231 C5' DG A 11 -3.899 -4.084 -8.678 1.00 0.78 C ATOM 232 C4' DG A 11 -3.770 -5.450 -8.044 1.00 0.64 C ATOM 233 O4' DG A 11 -2.418 -5.938 -8.242 1.00 0.61 O ATOM 234 C3' DG A 11 -4.010 -5.482 -6.532 1.00 0.49 C ATOM 235 O3' DG A 11 -4.681 -6.692 -6.162 1.00 0.54 O ATOM 236 C2' DG A 11 -2.609 -5.445 -5.952 1.00 0.48 C ATOM 237 C1' DG A 11 -1.806 -6.208 -6.990 1.00 0.51 C ATOM 238 N9 DG A 11 -0.402 -5.812 -7.079 1.00 0.49 N ATOM 239 C8 DG A 11 0.120 -4.762 -7.794 1.00 0.52 C ATOM 240 N7 DG A 11 1.415 -4.655 -7.684 1.00 0.53 N ATOM 241 C5 DG A 11 1.773 -5.700 -6.842 1.00 0.50 C ATOM 242 C6 DG A 11 3.047 -6.090 -6.360 1.00 0.51 C ATOM 243 O6 DG A 11 4.144 -5.571 -6.590 1.00 0.55 O ATOM 244 N1 DG A 11 2.969 -7.206 -5.528 1.00 0.49 N ATOM 245 C2 DG A 11 1.799 -7.857 -5.209 1.00 0.48 C ATOM 246 N2 DG A 11 1.915 -8.915 -4.391 1.00 0.50 N ATOM 247 N3 DG A 11 0.604 -7.502 -5.654 1.00 0.47 N ATOM 248 C4 DG A 11 0.665 -6.423 -6.460 1.00 0.48 C ATOM 0 H5' DG A 11 -3.148 -3.410 -8.265 1.00 0.78 H new ATOM 0 H5'' DG A 11 -3.711 -4.152 -9.749 1.00 0.78 H new ATOM 0 H4' DG A 11 -4.537 -6.058 -8.524 1.00 0.64 H new ATOM 0 H3' DG A 11 -4.636 -4.664 -6.177 1.00 0.49 H new ATOM 0 H2' DG A 11 -2.247 -4.424 -5.829 1.00 0.48 H new ATOM 0 H2'' DG A 11 -2.562 -5.920 -4.972 1.00 0.48 H new ATOM 0 H1' DG A 11 -1.807 -7.261 -6.707 1.00 0.51 H new ATOM 0 H8 DG A 11 -0.482 -4.091 -8.389 1.00 0.52 H new ATOM 0 H1 DG A 11 3.837 -7.564 -5.129 1.00 0.49 H new ATOM 0 H21 DG A 11 1.085 -9.441 -4.116 1.00 0.50 H new ATOM 0 H22 DG A 11 2.833 -9.193 -4.044 1.00 0.50 H new ATOM 260 P DG A 12 -5.431 -6.792 -4.742 1.00 0.48 P ATOM 261 OP1 DG A 12 -6.361 -7.947 -4.813 1.00 0.70 O ATOM 262 OP2 DG A 12 -5.956 -5.447 -4.394 1.00 0.48 O ATOM 263 O5' DG A 12 -4.266 -7.157 -3.718 1.00 0.61 O ATOM 264 C5' DG A 12 -4.405 -6.894 -2.322 1.00 0.74 C ATOM 265 C4' DG A 12 -3.517 -7.823 -1.528 1.00 0.72 C ATOM 266 O4' DG A 12 -2.160 -7.721 -2.028 1.00 0.67 O ATOM 267 C3' DG A 12 -3.441 -7.516 -0.030 1.00 0.71 C ATOM 268 O3' DG A 12 -3.393 -8.732 0.726 1.00 0.90 O ATOM 269 C2' DG A 12 -2.140 -6.746 0.114 1.00 0.64 C ATOM 270 C1' DG A 12 -1.278 -7.343 -0.984 1.00 0.63 C ATOM 271 N9 DG A 12 -0.290 -6.422 -1.542 1.00 0.55 N ATOM 272 C8 DG A 12 -0.522 -5.384 -2.411 1.00 0.53 C ATOM 273 N7 DG A 12 0.559 -4.730 -2.734 1.00 0.52 N ATOM 274 C5 DG A 12 1.570 -5.376 -2.034 1.00 0.49 C ATOM 275 C6 DG A 12 2.963 -5.115 -1.987 1.00 0.50 C ATOM 276 O6 DG A 12 3.596 -4.232 -2.575 1.00 0.56 O ATOM 277 N1 DG A 12 3.632 -6.009 -1.152 1.00 0.49 N ATOM 278 C2 DG A 12 3.021 -7.026 -0.455 1.00 0.52 C ATOM 279 N2 DG A 12 3.823 -7.796 0.297 1.00 0.55 N ATOM 280 N3 DG A 12 1.723 -7.278 -0.491 1.00 0.55 N ATOM 281 C4 DG A 12 1.063 -6.421 -1.295 1.00 0.52 C ATOM 0 H5' DG A 12 -5.444 -7.026 -2.021 1.00 0.74 H new ATOM 0 H5'' DG A 12 -4.141 -5.858 -2.111 1.00 0.74 H new ATOM 0 H4' DG A 12 -3.961 -8.811 -1.648 1.00 0.72 H new ATOM 0 H3' DG A 12 -4.304 -6.959 0.335 1.00 0.71 H new ATOM 0 H2' DG A 12 -2.286 -5.675 -0.023 1.00 0.64 H new ATOM 0 H2'' DG A 12 -1.694 -6.884 1.099 1.00 0.64 H new ATOM 0 H1' DG A 12 -0.716 -8.171 -0.552 1.00 0.63 H new ATOM 0 H8 DG A 12 -1.502 -5.134 -2.789 1.00 0.53 H new ATOM 0 H1 DG A 12 4.641 -5.902 -1.051 1.00 0.49 H new ATOM 0 H21 DG A 12 3.430 -8.567 0.838 1.00 0.55 H new ATOM 0 H22 DG A 12 4.826 -7.611 0.328 1.00 0.55 H new ATOM 293 P DG A 13 -3.989 -8.770 2.219 1.00 0.97 P ATOM 294 OP1 DG A 13 -3.586 -10.065 2.824 1.00 1.42 O ATOM 295 OP2 DG A 13 -5.427 -8.405 2.157 1.00 1.12 O ATOM 296 O5' DG A 13 -3.208 -7.606 2.976 1.00 0.69 O ATOM 297 C5' DG A 13 -3.309 -7.451 4.392 1.00 0.69 C ATOM 298 C4' DG A 13 -2.034 -7.912 5.060 1.00 0.48 C ATOM 299 O4' DG A 13 -0.914 -7.650 4.175 1.00 0.37 O ATOM 300 C3' DG A 13 -1.703 -7.201 6.374 1.00 0.56 C ATOM 301 O3' DG A 13 -1.075 -8.108 7.288 1.00 0.55 O ATOM 302 C2' DG A 13 -0.733 -6.115 5.950 1.00 0.60 C ATOM 303 C1' DG A 13 0.009 -6.768 4.797 1.00 0.37 C ATOM 304 N9 DG A 13 0.491 -5.832 3.783 1.00 0.33 N ATOM 305 C8 DG A 13 -0.262 -5.160 2.851 1.00 0.39 C ATOM 306 N7 DG A 13 0.446 -4.385 2.078 1.00 0.37 N ATOM 307 C5 DG A 13 1.749 -4.555 2.525 1.00 0.31 C ATOM 308 C6 DG A 13 2.957 -3.969 2.070 1.00 0.30 C ATOM 309 O6 DG A 13 3.113 -3.156 1.152 1.00 0.36 O ATOM 310 N1 DG A 13 4.058 -4.413 2.800 1.00 0.31 N ATOM 311 C2 DG A 13 3.990 -5.311 3.840 1.00 0.31 C ATOM 312 N2 DG A 13 5.155 -5.625 4.430 1.00 0.39 N ATOM 313 N3 DG A 13 2.868 -5.864 4.274 1.00 0.30 N ATOM 314 C4 DG A 13 1.795 -5.444 3.577 1.00 0.29 C ATOM 0 H5' DG A 13 -4.154 -8.027 4.769 1.00 0.69 H new ATOM 0 H5'' DG A 13 -3.500 -6.406 4.638 1.00 0.69 H new ATOM 0 H4' DG A 13 -2.195 -8.969 5.275 1.00 0.48 H new ATOM 0 H3' DG A 13 -2.583 -6.811 6.885 1.00 0.56 H new ATOM 0 H2' DG A 13 -1.251 -5.208 5.638 1.00 0.60 H new ATOM 0 H2'' DG A 13 -0.059 -5.835 6.759 1.00 0.60 H new ATOM 0 H1' DG A 13 0.893 -7.259 5.204 1.00 0.37 H new ATOM 0 H8 DG A 13 -1.334 -5.263 2.767 1.00 0.39 H new ATOM 0 H1 DG A 13 4.976 -4.048 2.546 1.00 0.31 H new ATOM 0 H21 DG A 13 5.171 -6.285 5.207 1.00 0.39 H new ATOM 0 H22 DG A 13 6.023 -5.203 4.101 1.00 0.39 H new ATOM 326 P DT A 14 -1.974 -9.005 8.276 1.00 0.82 P ATOM 327 OP1 DT A 14 -1.864 -10.414 7.820 1.00 0.89 O ATOM 328 OP2 DT A 14 -3.314 -8.375 8.392 1.00 1.23 O ATOM 329 O5' DT A 14 -1.240 -8.880 9.685 1.00 0.85 O ATOM 330 C5' DT A 14 0.064 -9.428 9.888 1.00 0.74 C ATOM 331 C4' DT A 14 1.120 -8.406 9.535 1.00 0.87 C ATOM 332 O4' DT A 14 0.828 -7.163 10.217 1.00 0.89 O ATOM 333 C3' DT A 14 2.537 -8.774 9.960 1.00 0.87 C ATOM 334 O3' DT A 14 3.204 -9.488 8.913 1.00 1.15 O ATOM 335 C2' DT A 14 3.183 -7.420 10.182 1.00 1.06 C ATOM 336 C1' DT A 14 2.029 -6.580 10.713 1.00 0.88 C ATOM 337 N1 DT A 14 1.938 -6.535 12.186 1.00 0.60 N ATOM 338 C2 DT A 14 2.696 -5.599 12.856 1.00 0.63 C ATOM 339 O2 DT A 14 3.435 -4.811 12.289 1.00 0.82 O ATOM 340 N3 DT A 14 2.558 -5.620 14.220 1.00 0.67 N ATOM 341 C4 DT A 14 1.756 -6.463 14.963 1.00 0.77 C ATOM 342 O4 DT A 14 1.735 -6.364 16.187 1.00 1.06 O ATOM 343 C5 DT A 14 0.988 -7.420 14.198 1.00 0.69 C ATOM 344 C7 DT A 14 0.091 -8.375 14.922 1.00 0.96 C ATOM 345 C6 DT A 14 1.113 -7.411 12.862 1.00 0.58 C ATOM 0 H5' DT A 14 0.191 -10.320 9.275 1.00 0.74 H new ATOM 0 H5'' DT A 14 0.179 -9.737 10.927 1.00 0.74 H new ATOM 0 H4' DT A 14 1.088 -8.341 8.447 1.00 0.87 H new ATOM 0 H3' DT A 14 2.575 -9.420 10.837 1.00 0.87 H new ATOM 0 H2' DT A 14 4.005 -7.476 10.896 1.00 1.06 H new ATOM 0 H2'' DT A 14 3.591 -7.010 9.258 1.00 1.06 H new ATOM 0 H1' DT A 14 2.191 -5.554 10.382 1.00 0.88 H new ATOM 0 H3 DT A 14 3.108 -4.938 14.743 1.00 0.67 H new ATOM 0 H71 DT A 14 0.504 -8.585 15.909 1.00 0.96 H new ATOM 0 H72 DT A 14 -0.900 -7.933 15.030 1.00 0.96 H new ATOM 0 H73 DT A 14 0.014 -9.303 14.355 1.00 0.96 H new ATOM 0 H6 DT A 14 0.540 -8.124 12.288 1.00 0.58 H new ATOM 358 P DA A 15 3.507 -11.058 9.083 1.00 0.92 P ATOM 359 OP1 DA A 15 2.284 -11.690 9.641 1.00 0.88 O ATOM 360 OP2 DA A 15 4.801 -11.208 9.795 1.00 1.35 O ATOM 361 O5' DA A 15 3.695 -11.578 7.588 1.00 0.97 O ATOM 362 C5' DA A 15 2.678 -11.377 6.606 1.00 0.73 C ATOM 363 C4' DA A 15 2.916 -12.281 5.419 1.00 0.54 C ATOM 364 O4' DA A 15 2.747 -13.661 5.833 1.00 0.72 O ATOM 365 C3' DA A 15 1.950 -12.078 4.251 1.00 0.80 C ATOM 366 O3' DA A 15 2.614 -12.328 3.008 1.00 0.91 O ATOM 367 C2' DA A 15 0.878 -13.120 4.505 1.00 1.01 C ATOM 368 C1' DA A 15 1.670 -14.259 5.126 1.00 0.89 C ATOM 369 N9 DA A 15 0.909 -15.079 6.071 1.00 1.38 N ATOM 370 C8 DA A 15 0.680 -14.834 7.403 1.00 1.56 C ATOM 371 N7 DA A 15 -0.042 -15.756 7.992 1.00 2.07 N ATOM 372 C5 DA A 15 -0.308 -16.669 6.982 1.00 2.24 C ATOM 373 C6 DA A 15 -1.031 -17.875 6.962 1.00 2.76 C ATOM 374 N6 DA A 15 -1.643 -18.390 8.031 1.00 3.22 N ATOM 375 N1 DA A 15 -1.104 -18.544 5.791 1.00 2.82 N ATOM 376 C2 DA A 15 -0.490 -18.029 4.718 1.00 2.39 C ATOM 377 N3 DA A 15 0.218 -16.906 4.612 1.00 1.87 N ATOM 378 C4 DA A 15 0.271 -16.265 5.792 1.00 1.81 C ATOM 0 H5' DA A 15 2.673 -10.336 6.284 1.00 0.73 H new ATOM 0 H5'' DA A 15 1.699 -11.582 7.038 1.00 0.73 H new ATOM 0 H4' DA A 15 3.922 -12.036 5.078 1.00 0.54 H new ATOM 0 H3' DA A 15 1.554 -11.065 4.187 1.00 0.80 H new ATOM 0 H2' DA A 15 0.103 -12.750 5.177 1.00 1.01 H new ATOM 0 H2'' DA A 15 0.382 -13.425 3.584 1.00 1.01 H new ATOM 0 H1' DA A 15 1.979 -14.927 4.322 1.00 0.89 H new ATOM 0 H8 DA A 15 1.059 -13.963 7.917 1.00 1.56 H new ATOM 0 H61 DA A 15 -2.153 -19.270 7.952 1.00 3.22 H new ATOM 0 H62 DA A 15 -1.601 -17.903 8.926 1.00 3.22 H new ATOM 0 H2 DA A 15 -0.582 -18.606 3.810 1.00 2.39 H new ATOM 390 P DG A 16 2.049 -11.674 1.651 1.00 0.73 P ATOM 391 OP1 DG A 16 2.549 -10.277 1.590 1.00 0.84 O ATOM 392 OP2 DG A 16 0.588 -11.934 1.580 1.00 1.03 O ATOM 393 O5' DG A 16 2.762 -12.503 0.491 1.00 0.75 O ATOM 394 C5' DG A 16 3.222 -13.838 0.710 1.00 0.72 C ATOM 395 C4' DG A 16 4.731 -13.888 0.639 1.00 0.55 C ATOM 396 O4' DG A 16 5.161 -13.383 -0.650 1.00 0.55 O ATOM 397 C3' DG A 16 5.453 -13.034 1.685 1.00 0.43 C ATOM 398 O3' DG A 16 6.664 -13.674 2.101 1.00 0.38 O ATOM 399 C2' DG A 16 5.756 -11.749 0.938 1.00 0.47 C ATOM 400 C1' DG A 16 5.989 -12.242 -0.480 1.00 0.45 C ATOM 401 N9 DG A 16 5.643 -11.273 -1.518 1.00 0.46 N ATOM 402 C8 DG A 16 4.405 -11.056 -2.069 1.00 0.53 C ATOM 403 N7 DG A 16 4.402 -10.121 -2.979 1.00 0.54 N ATOM 404 C5 DG A 16 5.722 -9.694 -3.033 1.00 0.48 C ATOM 405 C6 DG A 16 6.330 -8.697 -3.837 1.00 0.49 C ATOM 406 O6 DG A 16 5.801 -7.970 -4.684 1.00 0.58 O ATOM 407 N1 DG A 16 7.695 -8.581 -3.577 1.00 0.46 N ATOM 408 C2 DG A 16 8.377 -9.338 -2.652 1.00 0.41 C ATOM 409 N2 DG A 16 9.690 -9.085 -2.531 1.00 0.42 N ATOM 410 N3 DG A 16 7.820 -10.270 -1.897 1.00 0.39 N ATOM 411 C4 DG A 16 6.500 -10.394 -2.138 1.00 0.42 C ATOM 0 H5' DG A 16 2.793 -14.505 -0.037 1.00 0.72 H new ATOM 0 H5'' DG A 16 2.885 -14.192 1.684 1.00 0.72 H new ATOM 0 H4' DG A 16 4.987 -14.933 0.816 1.00 0.55 H new ATOM 0 H3' DG A 16 4.866 -12.873 2.589 1.00 0.43 H new ATOM 0 H2' DG A 16 4.927 -11.043 0.991 1.00 0.47 H new ATOM 0 H2'' DG A 16 6.633 -11.242 1.341 1.00 0.47 H new ATOM 0 H1' DG A 16 7.054 -12.443 -0.593 1.00 0.45 H new ATOM 0 H8 DG A 16 3.521 -11.605 -1.778 1.00 0.53 H new ATOM 0 H1 DG A 16 8.223 -7.889 -4.108 1.00 0.46 H new ATOM 0 H21 DG A 16 10.252 -9.612 -1.862 1.00 0.42 H new ATOM 0 H22 DG A 16 10.126 -8.365 -3.108 1.00 0.42 H new ATOM 423 P DG A 17 7.359 -13.251 3.489 1.00 0.34 P ATOM 424 OP1 DG A 17 8.167 -14.409 3.952 1.00 0.40 O ATOM 425 OP2 DG A 17 6.316 -12.683 4.382 1.00 0.48 O ATOM 426 O5' DG A 17 8.360 -12.079 3.080 1.00 0.49 O ATOM 427 C5' DG A 17 9.662 -12.368 2.569 1.00 0.82 C ATOM 428 C4' DG A 17 10.551 -11.151 2.685 1.00 0.70 C ATOM 429 O4' DG A 17 10.160 -10.182 1.679 1.00 0.58 O ATOM 430 C3' DG A 17 10.474 -10.422 4.033 1.00 0.67 C ATOM 431 O3' DG A 17 11.784 -10.038 4.466 1.00 0.82 O ATOM 432 C2' DG A 17 9.629 -9.194 3.735 1.00 0.52 C ATOM 433 C1' DG A 17 9.963 -8.916 2.282 1.00 0.41 C ATOM 434 N9 DG A 17 8.913 -8.220 1.539 1.00 0.34 N ATOM 435 C8 DG A 17 7.573 -8.519 1.517 1.00 0.31 C ATOM 436 N7 DG A 17 6.877 -7.716 0.761 1.00 0.35 N ATOM 437 C5 DG A 17 7.815 -6.830 0.250 1.00 0.39 C ATOM 438 C6 DG A 17 7.653 -5.734 -0.633 1.00 0.49 C ATOM 439 O6 DG A 17 6.611 -5.319 -1.153 1.00 0.56 O ATOM 440 N1 DG A 17 8.863 -5.096 -0.899 1.00 0.54 N ATOM 441 C2 DG A 17 10.076 -5.479 -0.371 1.00 0.53 C ATOM 442 N2 DG A 17 11.140 -4.749 -0.740 1.00 0.63 N ATOM 443 N3 DG A 17 10.239 -6.500 0.454 1.00 0.47 N ATOM 444 C4 DG A 17 9.076 -7.126 0.720 1.00 0.38 C ATOM 0 H5' DG A 17 9.591 -12.677 1.526 1.00 0.82 H new ATOM 0 H5'' DG A 17 10.100 -13.201 3.119 1.00 0.82 H new ATOM 0 H4' DG A 17 11.566 -11.529 2.564 1.00 0.70 H new ATOM 0 H3' DG A 17 10.054 -11.040 4.827 1.00 0.67 H new ATOM 0 H2' DG A 17 8.566 -9.388 3.878 1.00 0.52 H new ATOM 0 H2'' DG A 17 9.890 -8.355 4.380 1.00 0.52 H new ATOM 0 H1' DG A 17 10.834 -8.261 2.256 1.00 0.41 H new ATOM 0 H8 DG A 17 7.138 -9.338 2.071 1.00 0.31 H new ATOM 0 H1 DG A 17 8.849 -4.292 -1.526 1.00 0.54 H new ATOM 0 H21 DG A 17 12.067 -4.982 -0.383 1.00 0.63 H new ATOM 0 H22 DG A 17 11.022 -3.961 -1.377 1.00 0.63 H new ATOM 456 P DG A 18 12.013 -9.525 5.974 1.00 1.01 P ATOM 457 OP1 DG A 18 13.326 -10.051 6.427 1.00 1.34 O ATOM 458 OP2 DG A 18 10.791 -9.827 6.763 1.00 1.09 O ATOM 459 O5' DG A 18 12.135 -7.942 5.828 1.00 0.85 O ATOM 460 C5' DG A 18 13.366 -7.333 5.438 1.00 0.92 C ATOM 461 C4' DG A 18 13.243 -5.828 5.484 1.00 0.61 C ATOM 462 O4' DG A 18 12.240 -5.410 4.532 1.00 0.52 O ATOM 463 C3' DG A 18 12.808 -5.258 6.844 1.00 0.60 C ATOM 464 O3' DG A 18 13.822 -4.387 7.373 1.00 0.55 O ATOM 465 C2' DG A 18 11.521 -4.487 6.554 1.00 0.58 C ATOM 466 C1' DG A 18 11.549 -4.295 5.048 1.00 0.35 C ATOM 467 N9 DG A 18 10.231 -4.246 4.416 1.00 0.32 N ATOM 468 C8 DG A 18 9.144 -5.036 4.701 1.00 0.38 C ATOM 469 N7 DG A 18 8.097 -4.756 3.976 1.00 0.35 N ATOM 470 C5 DG A 18 8.518 -3.716 3.158 1.00 0.28 C ATOM 471 C6 DG A 18 7.816 -2.997 2.159 1.00 0.30 C ATOM 472 O6 DG A 18 6.643 -3.141 1.794 1.00 0.35 O ATOM 473 N1 DG A 18 8.611 -2.020 1.564 1.00 0.31 N ATOM 474 C2 DG A 18 9.923 -1.776 1.900 1.00 0.28 C ATOM 475 N2 DG A 18 10.536 -0.795 1.217 1.00 0.34 N ATOM 476 N3 DG A 18 10.589 -2.440 2.831 1.00 0.24 N ATOM 477 C4 DG A 18 9.830 -3.390 3.415 1.00 0.26 C ATOM 0 H5' DG A 18 13.635 -7.652 4.431 1.00 0.92 H new ATOM 0 H5'' DG A 18 14.167 -7.660 6.101 1.00 0.92 H new ATOM 0 H4' DG A 18 14.243 -5.453 5.266 1.00 0.61 H new ATOM 0 H3' DG A 18 12.654 -6.038 7.589 1.00 0.60 H new ATOM 0 H2' DG A 18 10.640 -5.045 6.870 1.00 0.58 H new ATOM 0 H2'' DG A 18 11.499 -3.532 7.079 1.00 0.58 H new ATOM 0 H1' DG A 18 12.016 -3.333 4.837 1.00 0.35 H new ATOM 0 H8 DG A 18 9.155 -5.812 5.452 1.00 0.38 H new ATOM 0 H1 DG A 18 8.193 -1.447 0.831 1.00 0.31 H new ATOM 0 H21 DG A 18 11.509 -0.565 1.418 1.00 0.34 H new ATOM 0 H22 DG A 18 10.028 -0.281 0.497 1.00 0.34 H new ATOM 489 P DT A 19 14.165 -2.982 6.659 1.00 0.39 P ATOM 490 OP1 DT A 19 15.418 -2.472 7.271 1.00 0.69 O ATOM 491 OP2 DT A 19 12.946 -2.134 6.677 1.00 0.85 O ATOM 492 O5' DT A 19 14.481 -3.377 5.148 1.00 0.45 O ATOM 493 C5' DT A 19 14.740 -2.375 4.164 1.00 0.77 C ATOM 494 C4' DT A 19 15.791 -2.858 3.191 1.00 0.86 C ATOM 495 O4' DT A 19 17.106 -2.583 3.739 1.00 0.72 O ATOM 496 C3' DT A 19 15.760 -4.363 2.905 1.00 0.96 C ATOM 497 O3' DT A 19 16.064 -4.614 1.529 1.00 1.27 O ATOM 498 C2' DT A 19 16.852 -4.916 3.802 1.00 1.11 C ATOM 499 C1' DT A 19 17.860 -3.782 3.821 1.00 0.71 C ATOM 500 N1 DT A 19 18.689 -3.722 5.042 1.00 0.36 N ATOM 501 C2 DT A 19 19.828 -4.495 5.093 1.00 0.68 C ATOM 502 O2 DT A 19 20.181 -5.224 4.180 1.00 1.31 O ATOM 503 N3 DT A 19 20.543 -4.384 6.258 1.00 0.60 N ATOM 504 C4 DT A 19 20.240 -3.596 7.350 1.00 1.00 C ATOM 505 O4 DT A 19 20.981 -3.600 8.330 1.00 1.39 O ATOM 506 C5 DT A 19 19.032 -2.811 7.229 1.00 1.23 C ATOM 507 C7 DT A 19 18.625 -1.926 8.366 1.00 2.08 C ATOM 508 C6 DT A 19 18.321 -2.909 6.095 1.00 0.76 C ATOM 0 H5' DT A 19 15.076 -1.458 4.648 1.00 0.77 H new ATOM 0 H5'' DT A 19 13.821 -2.135 3.629 1.00 0.77 H new ATOM 0 H4' DT A 19 15.578 -2.331 2.261 1.00 0.86 H new ATOM 0 H3' DT A 19 14.786 -4.815 3.093 1.00 0.96 H new ATOM 0 H2' DT A 19 16.480 -5.146 4.800 1.00 1.11 H new ATOM 0 H2'' DT A 19 17.281 -5.835 3.402 1.00 1.11 H new ATOM 0 H1' DT A 19 18.554 -3.933 2.994 1.00 0.71 H new ATOM 0 H3 DT A 19 21.392 -4.945 6.325 1.00 0.60 H new ATOM 0 H71 DT A 19 18.081 -1.064 7.980 1.00 2.08 H new ATOM 0 H72 DT A 19 17.984 -2.483 9.049 1.00 2.08 H new ATOM 0 H73 DT A 19 19.513 -1.586 8.898 1.00 2.08 H new ATOM 0 H6 DT A 19 17.418 -2.324 6.002 1.00 0.76 H new ATOM 521 P DG A 20 15.434 -5.896 0.792 1.00 0.97 P ATOM 522 OP1 DG A 20 14.090 -5.506 0.293 1.00 0.93 O ATOM 523 OP2 DG A 20 15.568 -7.067 1.696 1.00 1.16 O ATOM 524 O5' DG A 20 16.386 -6.123 -0.465 1.00 0.76 O ATOM 525 C5' DG A 20 15.919 -6.804 -1.630 1.00 0.61 C ATOM 526 C4' DG A 20 16.247 -6.004 -2.871 1.00 0.42 C ATOM 527 O4' DG A 20 15.336 -6.382 -3.932 1.00 0.32 O ATOM 528 C3' DG A 20 16.096 -4.491 -2.721 1.00 0.43 C ATOM 529 O3' DG A 20 17.025 -3.809 -3.572 1.00 0.49 O ATOM 530 C2' DG A 20 14.672 -4.245 -3.177 1.00 0.38 C ATOM 531 C1' DG A 20 14.483 -5.293 -4.262 1.00 0.29 C ATOM 532 N9 DG A 20 13.119 -5.805 -4.368 1.00 0.30 N ATOM 533 C8 DG A 20 12.606 -6.929 -3.768 1.00 0.38 C ATOM 534 N7 DG A 20 11.348 -7.134 -4.046 1.00 0.41 N ATOM 535 C5 DG A 20 11.008 -6.080 -4.882 1.00 0.36 C ATOM 536 C6 DG A 20 9.775 -5.768 -5.507 1.00 0.40 C ATOM 537 O6 DG A 20 8.704 -6.382 -5.437 1.00 0.48 O ATOM 538 N1 DG A 20 9.859 -4.608 -6.276 1.00 0.37 N ATOM 539 C2 DG A 20 10.999 -3.849 -6.415 1.00 0.33 C ATOM 540 N2 DG A 20 10.895 -2.759 -7.191 1.00 0.39 N ATOM 541 N3 DG A 20 12.155 -4.131 -5.836 1.00 0.29 N ATOM 542 C4 DG A 20 12.088 -5.251 -5.091 1.00 0.29 C ATOM 0 H5' DG A 20 14.842 -6.958 -1.562 1.00 0.61 H new ATOM 0 H5'' DG A 20 16.379 -7.790 -1.692 1.00 0.61 H new ATOM 0 H4' DG A 20 17.294 -6.226 -3.077 1.00 0.42 H new ATOM 0 H3' DG A 20 16.292 -4.133 -1.710 1.00 0.43 H new ATOM 0 H2' DG A 20 13.958 -4.372 -2.363 1.00 0.38 H new ATOM 0 H2'' DG A 20 14.539 -3.234 -3.563 1.00 0.38 H new ATOM 0 H1' DG A 20 14.713 -4.825 -5.219 1.00 0.29 H new ATOM 0 H8 DG A 20 13.186 -7.579 -3.130 1.00 0.38 H new ATOM 0 H1 DG A 20 9.020 -4.301 -6.768 1.00 0.37 H new ATOM 0 H21 DG A 20 11.705 -2.155 -7.334 1.00 0.39 H new ATOM 0 H22 DG A 20 10.006 -2.534 -7.638 1.00 0.39 H new ATOM 554 P DG A 21 17.465 -2.300 -3.232 1.00 0.69 P ATOM 555 OP1 DG A 21 18.657 -1.988 -4.061 1.00 0.89 O ATOM 556 OP2 DG A 21 17.543 -2.156 -1.756 1.00 0.78 O ATOM 557 O5' DG A 21 16.248 -1.414 -3.758 1.00 0.72 O ATOM 558 C5' DG A 21 16.175 -0.997 -5.122 1.00 0.83 C ATOM 559 C4' DG A 21 15.224 0.169 -5.264 1.00 0.77 C ATOM 560 O4' DG A 21 13.861 -0.329 -5.269 1.00 0.74 O ATOM 561 C3' DG A 21 15.293 1.202 -4.132 1.00 0.74 C ATOM 562 O3' DG A 21 15.171 2.527 -4.660 1.00 0.74 O ATOM 563 C2' DG A 21 14.094 0.861 -3.266 1.00 0.71 C ATOM 564 C1' DG A 21 13.097 0.350 -4.288 1.00 0.70 C ATOM 565 N9 DG A 21 12.105 -0.584 -3.757 1.00 0.64 N ATOM 566 C8 DG A 21 12.316 -1.586 -2.842 1.00 0.61 C ATOM 567 N7 DG A 21 11.237 -2.260 -2.558 1.00 0.57 N ATOM 568 C5 DG A 21 10.250 -1.666 -3.333 1.00 0.58 C ATOM 569 C6 DG A 21 8.870 -1.969 -3.448 1.00 0.57 C ATOM 570 O6 DG A 21 8.230 -2.852 -2.866 1.00 0.54 O ATOM 571 N1 DG A 21 8.224 -1.122 -4.347 1.00 0.63 N ATOM 572 C2 DG A 21 8.845 -0.111 -5.044 1.00 0.67 C ATOM 573 N2 DG A 21 8.066 0.607 -5.868 1.00 0.75 N ATOM 574 N3 DG A 21 10.132 0.180 -4.945 1.00 0.67 N ATOM 575 C4 DG A 21 10.769 -0.631 -4.078 1.00 0.62 C ATOM 0 H5' DG A 21 15.840 -1.826 -5.745 1.00 0.83 H new ATOM 0 H5'' DG A 21 17.166 -0.712 -5.476 1.00 0.83 H new ATOM 0 H4' DG A 21 15.520 0.662 -6.190 1.00 0.77 H new ATOM 0 H3' DG A 21 16.234 1.174 -3.583 1.00 0.74 H new ATOM 0 H2' DG A 21 14.334 0.106 -2.518 1.00 0.71 H new ATOM 0 H2'' DG A 21 13.718 1.732 -2.730 1.00 0.71 H new ATOM 0 H1' DG A 21 12.531 1.202 -4.664 1.00 0.70 H new ATOM 0 H8 DG A 21 13.280 -1.795 -2.402 1.00 0.61 H new ATOM 0 H1 DG A 21 7.225 -1.261 -4.498 1.00 0.63 H new ATOM 0 H21 DG A 21 8.467 1.370 -6.413 1.00 0.75 H new ATOM 0 H22 DG A 21 7.073 0.389 -5.950 1.00 0.75 H new ATOM 587 P DG A 22 15.532 3.796 -3.739 1.00 0.58 P ATOM 588 OP1 DG A 22 16.669 4.502 -4.382 1.00 0.70 O ATOM 589 OP2 DG A 22 15.657 3.335 -2.332 1.00 0.67 O ATOM 590 O5' DG A 22 14.244 4.730 -3.850 1.00 0.73 O ATOM 591 C5' DG A 22 13.276 4.783 -2.801 1.00 0.41 C ATOM 592 C4' DG A 22 11.893 4.976 -3.380 1.00 0.29 C ATOM 593 O4' DG A 22 11.297 3.688 -3.638 1.00 0.30 O ATOM 594 C3' DG A 22 10.903 5.682 -2.464 1.00 0.33 C ATOM 595 O3' DG A 22 10.991 7.101 -2.634 1.00 0.36 O ATOM 596 C2' DG A 22 9.560 5.164 -2.953 1.00 0.43 C ATOM 597 C1' DG A 22 9.884 3.772 -3.494 1.00 0.37 C ATOM 598 N9 DG A 22 9.453 2.675 -2.628 1.00 0.35 N ATOM 599 C8 DG A 22 10.238 1.923 -1.788 1.00 0.37 C ATOM 600 N7 DG A 22 9.570 1.010 -1.137 1.00 0.39 N ATOM 601 C5 DG A 22 8.262 1.170 -1.574 1.00 0.38 C ATOM 602 C6 DG A 22 7.085 0.463 -1.219 1.00 0.41 C ATOM 603 O6 DG A 22 6.967 -0.474 -0.421 1.00 0.46 O ATOM 604 N1 DG A 22 5.965 0.942 -1.895 1.00 0.41 N ATOM 605 C2 DG A 22 5.988 1.978 -2.801 1.00 0.40 C ATOM 606 N2 DG A 22 4.811 2.305 -3.358 1.00 0.44 N ATOM 607 N3 DG A 22 7.080 2.645 -3.140 1.00 0.38 N ATOM 608 C4 DG A 22 8.172 2.191 -2.493 1.00 0.36 C ATOM 0 H5' DG A 22 13.511 5.601 -2.120 1.00 0.41 H new ATOM 0 H5'' DG A 22 13.309 3.863 -2.218 1.00 0.41 H new ATOM 0 H4' DG A 22 12.056 5.589 -4.267 1.00 0.29 H new ATOM 0 H3' DG A 22 11.077 5.492 -1.405 1.00 0.33 H new ATOM 0 H2' DG A 22 8.830 5.120 -2.145 1.00 0.43 H new ATOM 0 H2'' DG A 22 9.141 5.807 -3.727 1.00 0.43 H new ATOM 0 H1' DG A 22 9.343 3.659 -4.434 1.00 0.37 H new ATOM 0 H8 DG A 22 11.302 2.072 -1.677 1.00 0.37 H new ATOM 0 H1 DG A 22 5.068 0.495 -1.706 1.00 0.41 H new ATOM 0 H21 DG A 22 4.762 3.064 -4.037 1.00 0.44 H new ATOM 0 H22 DG A 22 3.966 1.794 -3.102 1.00 0.44 H new ATOM 620 P DT A 23 10.478 8.081 -1.467 1.00 0.48 P ATOM 621 OP1 DT A 23 10.688 9.475 -1.932 1.00 0.55 O ATOM 622 OP2 DT A 23 11.081 7.637 -0.184 1.00 0.65 O ATOM 623 O5' DT A 23 8.908 7.813 -1.401 1.00 0.50 O ATOM 624 C5' DT A 23 8.081 8.521 -0.477 1.00 0.57 C ATOM 625 C4' DT A 23 6.630 8.401 -0.883 1.00 0.48 C ATOM 626 O4' DT A 23 6.277 6.996 -0.968 1.00 0.42 O ATOM 627 C3' DT A 23 5.634 9.028 0.099 1.00 0.47 C ATOM 628 O3' DT A 23 4.560 9.652 -0.615 1.00 0.45 O ATOM 629 C2' DT A 23 5.129 7.839 0.896 1.00 0.48 C ATOM 630 C1' DT A 23 5.167 6.722 -0.129 1.00 0.43 C ATOM 631 N1 DT A 23 5.347 5.373 0.445 1.00 0.42 N ATOM 632 C2 DT A 23 4.228 4.592 0.636 1.00 0.44 C ATOM 633 O2 DT A 23 3.100 4.961 0.351 1.00 0.50 O ATOM 634 N3 DT A 23 4.478 3.357 1.176 1.00 0.46 N ATOM 635 C4 DT A 23 5.704 2.837 1.535 1.00 0.44 C ATOM 636 O4 DT A 23 5.769 1.708 2.012 1.00 0.47 O ATOM 637 C5 DT A 23 6.836 3.708 1.308 1.00 0.46 C ATOM 638 C7 DT A 23 8.206 3.227 1.671 1.00 0.53 C ATOM 639 C6 DT A 23 6.608 4.920 0.780 1.00 0.45 C ATOM 0 H5' DT A 23 8.373 9.571 -0.446 1.00 0.57 H new ATOM 0 H5'' DT A 23 8.220 8.122 0.528 1.00 0.57 H new ATOM 0 H4' DT A 23 6.555 8.935 -1.830 1.00 0.48 H new ATOM 0 H3' DT A 23 6.076 9.802 0.727 1.00 0.47 H new ATOM 0 H2' DT A 23 5.766 7.625 1.754 1.00 0.48 H new ATOM 0 H2'' DT A 23 4.122 8.005 1.280 1.00 0.48 H new ATOM 0 H1' DT A 23 4.207 6.704 -0.645 1.00 0.43 H new ATOM 0 H3 DT A 23 3.668 2.756 1.329 1.00 0.46 H new ATOM 0 H71 DT A 23 8.940 3.685 1.008 1.00 0.53 H new ATOM 0 H72 DT A 23 8.427 3.502 2.702 1.00 0.53 H new ATOM 0 H73 DT A 23 8.250 2.143 1.567 1.00 0.53 H new ATOM 0 H6 DT A 23 7.451 5.573 0.609 1.00 0.45 H new ATOM 652 P DA A 24 3.377 10.384 0.193 1.00 0.41 P ATOM 653 OP1 DA A 24 2.937 11.546 -0.620 1.00 0.67 O ATOM 654 OP2 DA A 24 3.827 10.596 1.593 1.00 0.55 O ATOM 655 O5' DA A 24 2.198 9.311 0.200 1.00 0.39 O ATOM 656 C5' DA A 24 1.329 9.173 1.326 1.00 0.42 C ATOM 657 C4' DA A 24 0.916 7.728 1.487 1.00 0.34 C ATOM 658 O4' DA A 24 2.031 6.974 2.028 1.00 0.44 O ATOM 659 C3' DA A 24 -0.247 7.493 2.451 1.00 0.33 C ATOM 660 O3' DA A 24 -1.032 6.377 2.016 1.00 0.33 O ATOM 661 C2' DA A 24 0.450 7.180 3.761 1.00 0.38 C ATOM 662 C1' DA A 24 1.692 6.438 3.299 1.00 0.40 C ATOM 663 N9 DA A 24 2.852 6.594 4.179 1.00 0.50 N ATOM 664 C8 DA A 24 3.819 7.568 4.133 1.00 0.60 C ATOM 665 N7 DA A 24 4.739 7.445 5.059 1.00 0.70 N ATOM 666 C5 DA A 24 4.353 6.312 5.763 1.00 0.69 C ATOM 667 C6 DA A 24 4.914 5.649 6.869 1.00 0.81 C ATOM 668 N6 DA A 24 6.029 6.049 7.485 1.00 0.95 N ATOM 669 N1 DA A 24 4.281 4.547 7.327 1.00 0.83 N ATOM 670 C2 DA A 24 3.162 4.146 6.709 1.00 0.73 C ATOM 671 N3 DA A 24 2.539 4.685 5.663 1.00 0.59 N ATOM 672 C4 DA A 24 3.193 5.778 5.232 1.00 0.57 C ATOM 0 H5' DA A 24 0.447 9.799 1.194 1.00 0.42 H new ATOM 0 H5'' DA A 24 1.833 9.519 2.229 1.00 0.42 H new ATOM 0 H4' DA A 24 0.604 7.414 0.491 1.00 0.34 H new ATOM 0 H3' DA A 24 -0.931 8.339 2.523 1.00 0.33 H new ATOM 0 H2' DA A 24 0.700 8.085 4.315 1.00 0.38 H new ATOM 0 H2'' DA A 24 -0.170 6.567 4.415 1.00 0.38 H new ATOM 0 H1' DA A 24 1.459 5.373 3.288 1.00 0.40 H new ATOM 0 H8 DA A 24 3.821 8.362 3.401 1.00 0.60 H new ATOM 0 H61 DA A 24 6.387 5.525 8.284 1.00 0.95 H new ATOM 0 H62 DA A 24 6.523 6.879 7.157 1.00 0.95 H new ATOM 0 H2 DA A 24 2.700 3.260 7.117 1.00 0.73 H new ATOM 684 P DA A 25 -2.552 6.218 2.514 1.00 0.47 P ATOM 685 OP1 DA A 25 -3.315 7.380 1.990 1.00 0.89 O ATOM 686 OP2 DA A 25 -2.541 5.946 3.974 1.00 0.83 O ATOM 687 O5' DA A 25 -3.069 4.909 1.766 1.00 0.49 O ATOM 688 C5' DA A 25 -2.151 3.953 1.233 1.00 0.53 C ATOM 689 C4' DA A 25 -2.415 2.587 1.823 1.00 0.58 C ATOM 690 O4' DA A 25 -1.485 1.634 1.264 1.00 0.58 O ATOM 691 C3' DA A 25 -2.213 2.486 3.328 1.00 0.65 C ATOM 692 O3' DA A 25 -3.404 2.853 4.031 1.00 0.82 O ATOM 693 C2' DA A 25 -1.903 1.012 3.521 1.00 0.71 C ATOM 694 C1' DA A 25 -1.175 0.634 2.231 1.00 0.61 C ATOM 695 N9 DA A 25 0.283 0.565 2.360 1.00 0.53 N ATOM 696 C8 DA A 25 1.227 1.269 1.651 1.00 0.51 C ATOM 697 N7 DA A 25 2.461 0.993 1.997 1.00 0.51 N ATOM 698 C5 DA A 25 2.324 0.044 3.000 1.00 0.51 C ATOM 699 C6 DA A 25 3.265 -0.652 3.780 1.00 0.56 C ATOM 700 N6 DA A 25 4.586 -0.486 3.675 1.00 0.61 N ATOM 701 N1 DA A 25 2.796 -1.531 4.692 1.00 0.63 N ATOM 702 C2 DA A 25 1.471 -1.691 4.807 1.00 0.66 C ATOM 703 N3 DA A 25 0.490 -1.096 4.133 1.00 0.63 N ATOM 704 C4 DA A 25 0.988 -0.230 3.234 1.00 0.54 C ATOM 0 H5' DA A 25 -1.128 4.260 1.452 1.00 0.53 H new ATOM 0 H5'' DA A 25 -2.246 3.913 0.148 1.00 0.53 H new ATOM 0 H4' DA A 25 -3.462 2.392 1.590 1.00 0.58 H new ATOM 0 H3' DA A 25 -1.435 3.148 3.707 1.00 0.65 H new ATOM 0 H2' DA A 25 -1.279 0.844 4.399 1.00 0.71 H new ATOM 0 H2'' DA A 25 -2.811 0.424 3.658 1.00 0.71 H new ATOM 0 HO3' DA A 25 -3.416 3.823 4.170 1.00 0.82 H new ATOM 0 H1' DA A 25 -1.509 -0.365 1.950 1.00 0.61 H new ATOM 0 H8 DA A 25 0.976 1.983 0.881 1.00 0.51 H new ATOM 0 H61 DA A 25 5.216 -1.022 4.271 1.00 0.61 H new ATOM 0 H62 DA A 25 4.964 0.177 2.999 1.00 0.61 H new ATOM 0 H2 DA A 25 1.154 -2.405 5.553 1.00 0.66 H new TER 717 DA A 25 HETATM 718 C17 BO6 A 101 13.538 -8.299 -6.964 1.00 0.46 C HETATM 719 C18 BO6 A 101 14.580 -7.414 -7.225 1.00 0.47 C HETATM 720 N19 BO6 A 101 14.348 -6.265 -7.980 1.00 0.42 N HETATM 721 C31 BO6 A 101 15.456 -5.323 -8.259 1.00 0.49 C HETATM 722 C20 BO6 A 101 13.070 -6.006 -8.473 1.00 0.38 C HETATM 723 C21 BO6 A 101 12.029 -6.892 -8.211 1.00 0.37 C HETATM 724 C16 BO6 A 101 12.249 -8.047 -7.456 1.00 0.38 C HETATM 725 C15 BO6 A 101 11.233 -8.952 -7.172 1.00 0.42 C HETATM 726 C14 BO6 A 101 11.460 -10.459 -7.009 1.00 0.44 C HETATM 727 C7 BO6 A 101 10.565 -11.303 -6.356 1.00 0.47 C HETATM 728 C6 BO6 A 101 9.232 -11.296 -6.741 1.00 0.47 C HETATM 729 C8 BO6 A 101 10.953 -12.148 -5.341 1.00 0.53 C HETATM 730 C9 BO6 A 101 10.012 -12.962 -4.737 1.00 0.57 C HETATM 731 C2 BO6 A 101 8.734 -12.926 -5.137 1.00 0.56 C HETATM 732 N1 BO6 A 101 7.664 -13.598 -4.721 1.00 0.61 N HETATM 733 C3 BO6 A 101 8.346 -12.100 -6.131 1.00 0.51 C HETATM 734 C4 BO6 A 101 7.038 -12.272 -6.317 1.00 0.53 C HETATM 735 C10 BO6 A 101 6.180 -11.697 -7.175 1.00 0.52 C HETATM 736 C5 BO6 A 101 6.615 -13.205 -5.439 1.00 0.60 C HETATM 737 C13 BO6 A 101 5.329 -13.577 -5.405 1.00 0.65 C HETATM 738 C12 BO6 A 101 4.416 -13.006 -6.274 1.00 0.63 C HETATM 739 C11 BO6 A 101 4.838 -12.056 -7.171 1.00 0.57 C HETATM 740 C22 BO6 A 101 3.964 -11.451 -8.066 1.00 0.56 C HETATM 741 C23 BO6 A 101 3.920 -9.937 -8.311 1.00 0.55 C HETATM 742 C24 BO6 A 101 2.842 -9.283 -8.900 1.00 0.54 C HETATM 743 C25 BO6 A 101 1.544 -9.743 -8.632 1.00 0.53 C HETATM 744 C26 BO6 A 101 0.440 -9.115 -9.201 1.00 0.54 C HETATM 745 N27 BO6 A 101 0.617 -8.020 -10.046 1.00 0.55 N HETATM 746 C30 BO6 A 101 -0.558 -7.353 -10.653 1.00 0.59 C HETATM 747 C28 BO6 A 101 1.903 -7.556 -10.318 1.00 0.58 C HETATM 748 C29 BO6 A 101 3.007 -8.184 -9.749 1.00 0.58 C