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 (180deg=0) USER MOD Single : A 1 DT O5' : rot 180:sc= 0 USER MOD Single : A 2 DT C7 :methyl -30:sc= -0.717 (180deg=-3.49!) USER MOD Single : A 7 DT C7 :methyl -30:sc= -6.42! (180deg=-9.99!) USER MOD Single : A 8 DT C7 :methyl -30:sc= -0.252 (180deg=-0.686) USER MOD Single : A 13 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 20 DT C7 :methyl -30:sc= -0.0391 (180deg=-0.25) USER MOD Single : A 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 11.335 8.048 1.562 1.00 0.88 O ATOM 2 C5' DT A 1 10.290 8.072 0.584 1.00 0.79 C ATOM 3 C4' DT A 1 8.880 7.975 1.208 1.00 0.70 C ATOM 4 O4' DT A 1 8.688 6.766 1.963 1.00 0.65 O ATOM 5 C3' DT A 1 8.562 9.143 2.165 1.00 0.67 C ATOM 6 O3' DT A 1 7.176 9.538 2.128 1.00 0.59 O ATOM 7 C2' DT A 1 8.876 8.484 3.521 1.00 0.64 C ATOM 8 C1' DT A 1 8.229 7.112 3.274 1.00 0.60 C ATOM 9 N1 DT A 1 8.671 6.149 4.284 1.00 0.61 N ATOM 10 C2 DT A 1 7.834 5.772 5.318 1.00 0.68 C ATOM 11 O2 DT A 1 6.692 6.201 5.460 1.00 0.75 O ATOM 12 N3 DT A 1 8.364 4.869 6.206 1.00 0.74 N ATOM 13 C4 DT A 1 9.628 4.321 6.153 1.00 0.76 C ATOM 14 O4 DT A 1 9.975 3.523 7.018 1.00 0.86 O ATOM 15 C5 DT A 1 10.426 4.779 5.030 1.00 0.69 C ATOM 16 C7 DT A 1 11.858 4.282 4.821 1.00 0.80 C ATOM 17 C6 DT A 1 9.912 5.662 4.157 1.00 0.63 C ATOM 0 H5' DT A 1 10.431 7.245 -0.112 1.00 0.79 H new ATOM 0 H5'' DT A 1 10.363 8.992 0.004 1.00 0.79 H new ATOM 0 H4' DT A 1 8.213 7.999 0.346 1.00 0.70 H new ATOM 0 H3' DT A 1 9.113 10.054 1.930 1.00 0.67 H new ATOM 0 H2' DT A 1 9.946 8.416 3.719 1.00 0.64 H new ATOM 0 H2'' DT A 1 8.429 9.015 4.361 1.00 0.64 H new ATOM 0 HO5' DT A 1 12.204 8.110 1.114 1.00 0.88 H new ATOM 0 H1' DT A 1 7.141 7.119 3.342 1.00 0.60 H new ATOM 0 H3 DT A 1 7.766 4.576 6.978 1.00 0.74 H new ATOM 0 H71 DT A 1 12.090 4.277 3.756 1.00 0.80 H new ATOM 0 H72 DT A 1 12.552 4.943 5.340 1.00 0.80 H new ATOM 0 H73 DT A 1 11.954 3.271 5.218 1.00 0.80 H new ATOM 0 H6 DT A 1 10.519 5.989 3.326 1.00 0.63 H new ATOM 31 P DT A 2 6.728 10.900 2.889 1.00 0.57 P ATOM 32 OP1 DT A 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6.181 1.00 0.58 H new ATOM 0 H4' DT A 2 3.208 10.134 5.493 1.00 0.53 H new ATOM 0 H3' DT A 2 5.246 8.047 5.573 1.00 0.50 H new ATOM 0 H2' DT A 2 4.875 7.461 3.299 1.00 0.48 H new ATOM 0 H2'' DT A 2 3.542 6.602 4.044 1.00 0.48 H new ATOM 0 H1' DT A 2 1.976 8.388 3.589 1.00 0.49 H new ATOM 0 H3 DT A 2 0.845 7.945 -0.705 1.00 0.47 H new ATOM 0 H71 DT A 2 5.280 7.563 -2.008 1.00 0.46 H new ATOM 0 H72 DT A 2 5.650 9.207 -1.438 1.00 0.46 H new ATOM 0 H73 DT A 2 6.218 7.796 -0.514 1.00 0.46 H new ATOM 0 H6 DT A 2 5.079 8.482 1.519 1.00 0.47 H new ATOM 63 P DG A 3 2.782 6.472 6.615 1.00 0.60 P ATOM 64 OP1 DG A 3 3.106 6.115 8.014 1.00 0.78 O ATOM 65 OP2 DG A 3 3.082 5.539 5.505 1.00 0.63 O ATOM 66 O5' DG A 3 1.232 6.813 6.513 1.00 0.71 O ATOM 67 C5' DG A 3 0.571 7.750 7.363 1.00 0.68 C ATOM 68 C4' DG A 3 -0.902 7.417 7.388 1.00 0.72 C ATOM 69 O4' DG A 3 -1.523 7.375 6.087 1.00 0.71 O ATOM 70 C3' DG A 3 -1.136 6.038 7.980 1.00 0.84 C ATOM 71 O3' DG A 3 -2.392 6.143 8.659 1.00 1.20 O ATOM 72 C2' DG A 3 -1.185 5.185 6.733 1.00 0.67 C ATOM 73 C1' DG A 3 -2.124 6.083 5.975 1.00 0.64 C ATOM 74 N9 DG A 3 -2.259 5.640 4.594 1.00 0.53 N ATOM 75 C8 DG A 3 -3.419 5.433 3.929 1.00 0.55 C ATOM 76 N7 DG A 3 -3.248 5.061 2.701 1.00 0.49 N ATOM 77 C5 DG A 3 -1.878 5.017 2.538 1.00 0.43 C ATOM 78 C6 DG A 3 -1.112 4.677 1.403 1.00 0.44 C ATOM 79 O6 DG A 3 -1.503 4.342 0.293 1.00 0.48 O ATOM 80 N1 DG A 3 0.227 4.758 1.655 1.00 0.45 N ATOM 81 C2 DG A 3 0.778 5.120 2.855 1.00 0.44 C ATOM 82 N2 DG A 3 2.089 5.119 2.928 1.00 0.49 N ATOM 83 N3 DG A 3 0.076 5.444 3.934 1.00 0.45 N ATOM 84 C4 DG A 3 -1.252 5.369 3.699 1.00 0.45 C ATOM 0 H5' DG A 3 0.724 8.766 6.998 1.00 0.68 H new ATOM 0 H5'' DG A 3 0.986 7.707 8.370 1.00 0.68 H new ATOM 0 H4' DG A 3 -1.340 8.220 7.981 1.00 0.72 H new ATOM 0 H3' DG A 3 -0.412 5.638 8.690 1.00 0.84 H new ATOM 0 H2' DG A 3 -0.215 5.063 6.251 1.00 0.67 H new ATOM 0 H2'' DG A 3 -1.583 4.185 6.905 1.00 0.67 H new ATOM 0 H1' DG A 3 -3.141 6.080 6.366 1.00 0.64 H new ATOM 0 H8 DG A 3 -4.392 5.565 4.379 1.00 0.55 H new ATOM 0 H1 DG A 3 0.865 4.532 0.892 1.00 0.45 H new ATOM 0 H21 DG A 3 2.552 5.381 3.799 1.00 0.49 H new ATOM 0 H22 DG A 3 2.645 4.857 2.114 1.00 0.49 H new ATOM 96 P DG A 4 -2.877 5.035 9.689 1.00 1.67 P ATOM 97 OP1 DG A 4 -3.818 5.647 10.642 1.00 2.45 O ATOM 98 OP2 DG A 4 -1.715 4.242 10.138 1.00 2.59 O ATOM 99 O5' DG A 4 -3.700 4.152 8.712 1.00 1.17 O ATOM 100 C5' DG A 4 -4.138 2.837 8.972 1.00 1.10 C ATOM 101 C4' DG A 4 -5.113 2.629 7.875 1.00 0.83 C ATOM 102 O4' DG A 4 -4.500 2.934 6.617 1.00 0.71 O ATOM 103 C3' DG A 4 -5.659 1.227 7.825 1.00 0.82 C ATOM 104 O3' DG A 4 -7.020 1.308 7.408 1.00 0.76 O ATOM 105 C2' DG A 4 -4.760 0.662 6.742 1.00 0.74 C ATOM 106 C1' DG A 4 -4.758 1.847 5.773 1.00 0.62 C ATOM 107 N9 DG A 4 -3.669 1.755 4.794 1.00 0.54 N ATOM 108 C8 DG A 4 -2.305 1.760 4.982 1.00 0.56 C ATOM 109 N7 DG A 4 -1.629 1.667 3.871 1.00 0.49 N ATOM 110 C5 DG A 4 -2.611 1.595 2.893 1.00 0.43 C ATOM 111 C6 DG A 4 -2.486 1.483 1.494 1.00 0.42 C ATOM 112 O6 DG A 4 -1.463 1.422 0.828 1.00 0.45 O ATOM 113 N1 DG A 4 -3.709 1.445 0.881 1.00 0.45 N ATOM 114 C2 DG A 4 -4.915 1.504 1.522 1.00 0.45 C ATOM 115 N2 DG A 4 -5.992 1.450 0.772 1.00 0.51 N ATOM 116 N3 DG A 4 -5.056 1.609 2.833 1.00 0.45 N ATOM 117 C4 DG A 4 -3.857 1.650 3.453 1.00 0.45 C ATOM 0 H5' DG A 4 -4.600 2.745 9.955 1.00 1.10 H new ATOM 0 H5'' DG A 4 -3.320 2.117 8.936 1.00 1.10 H new ATOM 0 H4' DG A 4 -5.950 3.298 8.074 1.00 0.83 H new ATOM 0 H3' DG A 4 -5.660 0.644 8.746 1.00 0.82 H new ATOM 0 H2' DG A 4 -3.763 0.419 7.109 1.00 0.74 H new ATOM 0 H2'' DG A 4 -5.164 -0.246 6.293 1.00 0.74 H new ATOM 0 H1' DG A 4 -5.685 1.908 5.203 1.00 0.62 H new ATOM 0 H8 DG A 4 -1.841 1.834 5.954 1.00 0.56 H new ATOM 0 H1 DG A 4 -3.722 1.366 -0.136 1.00 0.45 H new ATOM 0 H21 DG A 4 -6.916 1.490 1.203 1.00 0.51 H new ATOM 0 H22 DG A 4 -5.904 1.368 -0.241 1.00 0.51 H new ATOM 129 P DG A 5 -8.164 0.499 8.193 1.00 0.80 P ATOM 130 OP1 DG A 5 -9.401 1.308 8.179 1.00 1.06 O ATOM 131 OP2 DG A 5 -7.607 0.026 9.479 1.00 1.10 O ATOM 132 O5' DG A 5 -8.405 -0.771 7.257 1.00 0.73 O ATOM 133 C5' DG A 5 -7.694 -2.006 7.356 1.00 0.75 C ATOM 134 C4' DG A 5 -7.716 -2.619 5.990 1.00 0.84 C ATOM 135 O4' DG A 5 -6.893 -1.791 5.169 1.00 0.92 O ATOM 136 C3' DG A 5 -7.045 -3.971 5.988 1.00 1.12 C ATOM 137 O3' DG A 5 -8.061 -4.975 6.040 1.00 1.12 O ATOM 138 C2' DG A 5 -6.601 -4.070 4.579 1.00 1.51 C ATOM 139 C1' DG A 5 -6.422 -2.626 4.122 1.00 1.13 C ATOM 140 N9 DG A 5 -5.025 -2.378 3.745 1.00 0.86 N ATOM 141 C8 DG A 5 -3.859 -2.292 4.461 1.00 0.81 C ATOM 142 N7 DG A 5 -2.802 -2.062 3.718 1.00 0.68 N ATOM 143 C5 DG A 5 -3.324 -2.003 2.430 1.00 0.61 C ATOM 144 C6 DG A 5 -2.697 -1.785 1.178 1.00 0.62 C ATOM 145 O6 DG A 5 -1.517 -1.587 0.928 1.00 0.71 O ATOM 146 N1 DG A 5 -3.607 -1.809 0.154 1.00 0.69 N ATOM 147 C2 DG A 5 -4.953 -2.016 0.306 1.00 0.74 C ATOM 148 N2 DG A 5 -5.710 -2.034 -0.752 1.00 0.86 N ATOM 149 N3 DG A 5 -5.551 -2.216 1.453 1.00 0.79 N ATOM 150 C4 DG A 5 -4.672 -2.195 2.464 1.00 0.71 C ATOM 0 H5' DG A 5 -8.163 -2.666 8.085 1.00 0.75 H new ATOM 0 H5'' DG A 5 -6.670 -1.839 7.690 1.00 0.75 H new ATOM 0 H4' DG A 5 -8.749 -2.713 5.655 1.00 0.84 H new ATOM 0 H3' DG A 5 -6.304 -4.081 6.780 1.00 1.12 H new ATOM 0 H2' DG A 5 -5.669 -4.629 4.497 1.00 1.51 H new ATOM 0 H2'' DG A 5 -7.339 -4.589 3.968 1.00 1.51 H new ATOM 0 H1' DG A 5 -7.000 -2.408 3.224 1.00 1.13 H new ATOM 0 H8 DG A 5 -3.815 -2.403 5.534 1.00 0.81 H new ATOM 0 H1 DG A 5 -3.256 -1.662 -0.792 1.00 0.69 H new ATOM 0 H21 DG A 5 -6.714 -2.187 -0.658 1.00 0.86 H new ATOM 0 H22 DG A 5 -5.299 -1.895 -1.675 1.00 0.86 H new ATOM 162 P DG A 6 -7.958 -6.219 7.039 1.00 1.14 P ATOM 163 OP1 DG A 6 -9.236 -6.959 6.954 1.00 1.39 O ATOM 164 OP2 DG A 6 -7.463 -5.734 8.344 1.00 1.55 O ATOM 165 O5' DG A 6 -6.813 -7.128 6.390 1.00 0.83 O ATOM 166 C5' DG A 6 -7.012 -8.498 6.019 1.00 0.78 C ATOM 167 C4' DG A 6 -5.872 -9.037 5.165 1.00 0.83 C ATOM 168 O4' DG A 6 -5.711 -8.528 3.812 1.00 0.56 O ATOM 169 C3' DG A 6 -4.551 -8.762 5.701 1.00 1.39 C ATOM 170 O3' DG A 6 -3.583 -9.655 5.114 1.00 1.74 O ATOM 171 C2' DG A 6 -4.497 -7.424 5.013 1.00 1.48 C ATOM 172 C1' DG A 6 -4.483 -7.807 3.619 1.00 0.98 C ATOM 173 N9 DG A 6 -4.483 -6.740 2.621 1.00 1.15 N ATOM 174 C8 DG A 6 -4.040 -5.446 2.703 1.00 1.44 C ATOM 175 N7 DG A 6 -4.163 -4.785 1.600 1.00 1.67 N ATOM 176 C5 DG A 6 -4.727 -5.697 0.725 1.00 1.64 C ATOM 177 C6 DG A 6 -5.093 -5.546 -0.627 1.00 2.03 C ATOM 178 O6 DG A 6 -4.987 -4.562 -1.351 1.00 2.34 O ATOM 179 N1 DG A 6 -5.598 -6.714 -1.138 1.00 2.13 N ATOM 180 C2 DG A 6 -5.744 -7.886 -0.446 1.00 1.92 C ATOM 181 N2 DG A 6 -6.250 -8.907 -1.103 1.00 2.27 N ATOM 182 N3 DG A 6 -5.423 -8.043 0.825 1.00 1.50 N ATOM 183 C4 DG A 6 -4.917 -6.903 1.342 1.00 1.35 C ATOM 0 H5' DG A 6 -7.949 -8.591 5.470 1.00 0.78 H new ATOM 0 H5'' DG A 6 -7.108 -9.106 6.919 1.00 0.78 H new ATOM 0 H4' DG A 6 -6.190 -10.080 5.165 1.00 0.83 H new ATOM 0 H3' DG A 6 -4.375 -8.832 6.774 1.00 1.39 H new ATOM 0 H2' DG A 6 -5.359 -6.804 5.258 1.00 1.48 H new ATOM 0 H2'' DG A 6 -3.608 -6.858 5.290 1.00 1.48 H new ATOM 0 H1' DG A 6 -3.610 -8.306 3.199 1.00 0.98 H new ATOM 0 H8 DG A 6 -3.627 -5.019 3.605 1.00 1.44 H new ATOM 0 H1 DG A 6 -5.889 -6.709 -2.116 1.00 2.13 H new ATOM 0 H21 DG A 6 -6.379 -9.803 -0.633 1.00 2.27 H new ATOM 0 H22 DG A 6 -6.513 -8.803 -2.083 1.00 2.27 H new ATOM 195 P DT A 7 -3.193 -11.103 5.636 1.00 1.92 P ATOM 196 OP1 DT A 7 -3.933 -11.345 6.895 1.00 1.84 O ATOM 197 OP2 DT A 7 -1.721 -11.125 5.608 1.00 2.33 O ATOM 198 O5' DT A 7 -3.585 -12.222 4.574 1.00 2.18 O ATOM 199 C5' DT A 7 -4.868 -12.579 4.097 1.00 1.64 C ATOM 200 C4' DT A 7 -4.695 -13.070 2.697 1.00 1.35 C ATOM 201 O4' DT A 7 -6.039 -13.017 2.260 1.00 0.93 O ATOM 202 C3' DT A 7 -3.851 -12.053 1.834 1.00 1.51 C ATOM 203 O3' DT A 7 -3.696 -12.153 0.410 1.00 1.75 O ATOM 204 C2' DT A 7 -4.799 -10.941 1.533 1.00 1.22 C ATOM 205 C1' DT A 7 -6.090 -11.819 1.482 1.00 0.89 C ATOM 206 N1 DT A 7 -7.222 -10.917 1.541 1.00 1.29 N ATOM 207 C2 DT A 7 -8.119 -11.124 0.571 1.00 2.35 C ATOM 208 O2 DT A 7 -8.021 -12.055 -0.206 1.00 2.86 O ATOM 209 N3 DT A 7 -9.122 -10.230 0.503 1.00 2.90 N ATOM 210 C4 DT A 7 -9.305 -9.152 1.313 1.00 2.47 C ATOM 211 O4 DT A 7 -10.256 -8.415 1.119 1.00 3.10 O ATOM 212 C5 DT A 7 -8.346 -8.987 2.319 1.00 1.37 C ATOM 213 C7 DT A 7 -8.394 -7.772 3.265 1.00 1.00 C ATOM 214 C6 DT A 7 -7.370 -9.842 2.409 1.00 0.93 C ATOM 0 H5' DT A 7 -5.541 -11.722 4.124 1.00 1.64 H new ATOM 0 H5'' DT A 7 -5.311 -13.352 4.725 1.00 1.64 H new ATOM 0 H4' DT A 7 -4.189 -14.032 2.619 1.00 1.35 H new ATOM 0 H3' DT A 7 -2.920 -12.080 2.401 1.00 1.51 H new ATOM 0 H2' DT A 7 -4.827 -10.176 2.309 1.00 1.22 H new ATOM 0 H2'' DT A 7 -4.585 -10.433 0.593 1.00 1.22 H new ATOM 0 H1' DT A 7 -6.213 -12.349 0.538 1.00 0.89 H new ATOM 0 H3 DT A 7 -9.816 -10.375 -0.230 1.00 2.90 H new ATOM 0 H71 DT A 7 -8.836 -6.923 2.744 1.00 1.00 H new ATOM 0 H72 DT A 7 -8.997 -8.016 4.140 1.00 1.00 H new ATOM 0 H73 DT A 7 -7.383 -7.517 3.581 1.00 1.00 H new ATOM 0 H6 DT A 7 -6.641 -9.710 3.195 1.00 0.93 H new ATOM 227 P DT A 8 -2.584 -12.954 -0.350 1.00 1.99 P ATOM 228 OP1 DT A 8 -3.328 -13.821 -1.289 1.00 2.90 O ATOM 229 OP2 DT A 8 -1.644 -13.450 0.669 1.00 2.69 O ATOM 230 O5' DT A 8 -1.817 -11.858 -1.188 1.00 1.40 O ATOM 231 C5' DT A 8 -1.601 -12.025 -2.609 1.00 1.16 C ATOM 232 C4' DT A 8 -1.453 -10.649 -3.251 1.00 1.02 C ATOM 233 O4' DT A 8 -1.240 -9.524 -2.344 1.00 0.90 O ATOM 234 C3' DT A 8 -0.206 -10.651 -4.131 1.00 1.04 C ATOM 235 O3' DT A 8 -0.396 -9.522 -4.988 1.00 1.09 O ATOM 236 C2' DT A 8 0.855 -10.334 -3.003 1.00 0.96 C ATOM 237 C1' DT A 8 0.148 -9.113 -2.313 1.00 0.82 C ATOM 238 N1 DT A 8 0.538 -8.961 -0.889 1.00 0.76 N ATOM 239 C2 DT A 8 1.563 -8.092 -0.584 1.00 0.86 C ATOM 240 O2 DT A 8 2.179 -7.457 -1.434 1.00 0.97 O ATOM 241 N3 DT A 8 1.864 -7.969 0.751 1.00 1.01 N ATOM 242 C4 DT A 8 1.248 -8.623 1.801 1.00 0.99 C ATOM 243 O4 DT A 8 1.620 -8.408 2.950 1.00 1.20 O ATOM 244 C5 DT A 8 0.184 -9.519 1.395 1.00 0.87 C ATOM 245 C7 DT A 8 -0.623 -10.327 2.432 1.00 1.01 C ATOM 246 C6 DT A 8 -0.118 -9.647 0.092 1.00 0.81 C ATOM 0 H5' DT A 8 -2.437 -12.562 -3.057 1.00 1.16 H new ATOM 0 H5'' DT A 8 -0.707 -12.622 -2.787 1.00 1.16 H new ATOM 0 H4' DT A 8 -2.405 -10.503 -3.762 1.00 1.02 H new ATOM 0 H3' DT A 8 0.039 -11.522 -4.738 1.00 1.04 H new ATOM 0 H2' DT A 8 1.004 -11.171 -2.321 1.00 0.96 H new ATOM 0 H2'' DT A 8 1.833 -10.076 -3.409 1.00 0.96 H new ATOM 0 H1' DT A 8 0.390 -8.170 -2.803 1.00 0.82 H new ATOM 0 H3 DT A 8 2.620 -7.329 0.992 1.00 1.01 H new ATOM 0 H71 DT A 8 0.006 -10.542 3.296 1.00 1.01 H new ATOM 0 H72 DT A 8 -1.490 -9.748 2.750 1.00 1.01 H new ATOM 0 H73 DT A 8 -0.957 -11.263 1.984 1.00 1.01 H new ATOM 0 H6 DT A 8 -0.913 -10.321 -0.191 1.00 0.81 H new ATOM 259 P DG A 9 -0.584 -9.650 -6.566 1.00 0.89 P ATOM 260 OP1 DG A 9 -1.713 -8.782 -6.964 1.00 1.07 O ATOM 261 OP2 DG A 9 -0.585 -11.083 -6.940 1.00 0.96 O ATOM 262 O5' DG A 9 0.806 -8.999 -7.056 1.00 0.91 O ATOM 263 C5' DG A 9 0.951 -7.766 -7.783 1.00 0.91 C ATOM 264 C4' DG A 9 0.357 -6.552 -7.066 1.00 0.83 C ATOM 265 O4' DG A 9 0.906 -6.404 -5.757 1.00 0.86 O ATOM 266 C3' DG A 9 0.623 -5.235 -7.799 1.00 0.87 C ATOM 267 O3' DG A 9 -0.594 -4.499 -7.851 1.00 1.02 O ATOM 268 C2' DG A 9 1.602 -4.459 -6.902 1.00 0.75 C ATOM 269 C1' DG A 9 1.129 -5.017 -5.540 1.00 0.72 C ATOM 270 N9 DG A 9 2.001 -4.918 -4.369 1.00 0.68 N ATOM 271 C8 DG A 9 3.323 -5.117 -4.339 1.00 0.67 C ATOM 272 N7 DG A 9 3.888 -5.011 -3.175 1.00 0.73 N ATOM 273 C5 DG A 9 2.813 -4.708 -2.349 1.00 0.76 C ATOM 274 C6 DG A 9 2.780 -4.472 -0.954 1.00 0.87 C ATOM 275 O6 DG A 9 3.691 -4.478 -0.133 1.00 0.95 O ATOM 276 N1 DG A 9 1.507 -4.203 -0.526 1.00 0.95 N ATOM 277 C2 DG A 9 0.393 -4.162 -1.324 1.00 0.95 C ATOM 278 N2 DG A 9 -0.742 -3.882 -0.715 1.00 1.10 N ATOM 279 N3 DG A 9 0.399 -4.379 -2.634 1.00 0.86 N ATOM 280 C4 DG A 9 1.649 -4.647 -3.076 1.00 0.74 C ATOM 0 H5' DG A 9 0.473 -7.871 -8.757 1.00 0.91 H new ATOM 0 H5'' DG A 9 2.010 -7.586 -7.966 1.00 0.91 H new ATOM 0 H4' DG A 9 -0.715 -6.745 -7.032 1.00 0.83 H new ATOM 0 H3' DG A 9 1.008 -5.393 -8.806 1.00 0.87 H new ATOM 0 H2' DG A 9 2.647 -4.686 -7.116 1.00 0.75 H new ATOM 0 H2'' DG A 9 1.488 -3.378 -6.982 1.00 0.75 H new ATOM 0 H1' DG A 9 0.277 -4.391 -5.273 1.00 0.72 H new ATOM 0 H8 DG A 9 3.887 -5.352 -5.230 1.00 0.67 H new ATOM 0 H1 DG A 9 1.377 -4.018 0.469 1.00 0.95 H new ATOM 0 H21 DG A 9 -1.610 -3.835 -1.249 1.00 1.10 H new ATOM 0 H22 DG A 9 -0.753 -3.712 0.291 1.00 1.10 H new ATOM 292 P DG A 10 -1.452 -4.365 -9.203 1.00 1.11 P ATOM 293 OP1 DG A 10 -2.712 -5.118 -9.031 1.00 1.32 O ATOM 294 OP2 DG A 10 -0.573 -4.651 -10.362 1.00 1.24 O ATOM 295 O5' DG A 10 -1.694 -2.768 -9.150 1.00 1.17 O ATOM 296 C5' DG A 10 -2.895 -2.023 -9.403 1.00 1.00 C ATOM 297 C4' DG A 10 -4.202 -2.732 -9.001 1.00 0.95 C ATOM 298 O4' DG A 10 -4.233 -3.218 -7.655 1.00 0.97 O ATOM 299 C3' DG A 10 -5.417 -1.810 -9.128 1.00 0.90 C ATOM 300 O3' DG A 10 -6.573 -2.651 -9.296 1.00 0.98 O ATOM 301 C2' DG A 10 -5.368 -1.165 -7.714 1.00 0.88 C ATOM 302 C1' DG A 10 -5.188 -2.464 -6.905 1.00 0.95 C ATOM 303 N9 DG A 10 -4.628 -2.284 -5.569 1.00 0.89 N ATOM 304 C8 DG A 10 -5.280 -2.325 -4.375 1.00 0.97 C ATOM 305 N7 DG A 10 -4.488 -2.146 -3.363 1.00 0.93 N ATOM 306 C5 DG A 10 -3.237 -1.976 -3.914 1.00 0.82 C ATOM 307 C6 DG A 10 -1.996 -1.749 -3.287 1.00 0.76 C ATOM 308 O6 DG A 10 -1.761 -1.642 -2.090 1.00 0.77 O ATOM 309 N1 DG A 10 -0.988 -1.641 -4.211 1.00 0.72 N ATOM 310 C2 DG A 10 -1.153 -1.735 -5.564 1.00 0.72 C ATOM 311 N2 DG A 10 -0.094 -1.613 -6.323 1.00 0.75 N ATOM 312 N3 DG A 10 -2.309 -1.948 -6.162 1.00 0.76 N ATOM 313 C4 DG A 10 -3.311 -2.060 -5.272 1.00 0.80 C ATOM 0 H5' DG A 10 -2.940 -1.787 -10.466 1.00 1.00 H new ATOM 0 H5'' DG A 10 -2.835 -1.075 -8.868 1.00 1.00 H new ATOM 0 H4' DG A 10 -4.240 -3.572 -9.694 1.00 0.95 H new ATOM 0 H3' DG A 10 -5.438 -1.089 -9.946 1.00 0.90 H new ATOM 0 H2' DG A 10 -4.540 -0.467 -7.591 1.00 0.88 H new ATOM 0 H2'' DG A 10 -6.280 -0.626 -7.459 1.00 0.88 H new ATOM 0 H1' DG A 10 -6.166 -2.923 -6.764 1.00 0.95 H new ATOM 0 H8 DG A 10 -6.343 -2.489 -4.280 1.00 0.97 H new ATOM 0 H1 DG A 10 -0.044 -1.478 -3.862 1.00 0.72 H new ATOM 0 H21 DG A 10 -0.183 -1.678 -7.337 1.00 0.75 H new ATOM 0 H22 DG A 10 0.820 -1.453 -5.901 1.00 0.75 H new ATOM 325 P DG A 11 -7.936 -2.184 -10.027 1.00 1.15 P ATOM 326 OP1 DG A 11 -8.701 -3.400 -10.381 1.00 1.48 O ATOM 327 OP2 DG A 11 -7.577 -1.204 -11.077 1.00 1.40 O ATOM 328 O5' DG A 11 -8.742 -1.402 -8.874 1.00 1.33 O ATOM 329 C5' DG A 11 -8.782 -1.939 -7.546 1.00 1.38 C ATOM 330 C4' DG A 11 -9.202 -0.922 -6.515 1.00 1.25 C ATOM 331 O4' DG A 11 -8.203 -0.977 -5.483 1.00 1.04 O ATOM 332 C3' DG A 11 -9.178 0.551 -7.021 1.00 1.22 C ATOM 333 O3' DG A 11 -10.399 1.312 -6.864 1.00 1.54 O ATOM 334 C2' DG A 11 -8.036 1.151 -6.252 1.00 1.02 C ATOM 335 C1' DG A 11 -8.109 0.356 -5.016 1.00 0.96 C ATOM 336 N9 DG A 11 -7.005 0.588 -4.083 1.00 0.84 N ATOM 337 C8 DG A 11 -7.144 0.598 -2.746 1.00 0.86 C ATOM 338 N7 DG A 11 -6.050 0.814 -2.084 1.00 0.77 N ATOM 339 C5 DG A 11 -5.099 0.965 -3.083 1.00 0.69 C ATOM 340 C6 DG A 11 -3.717 1.220 -2.974 1.00 0.61 C ATOM 341 O6 DG A 11 -3.050 1.366 -1.959 1.00 0.61 O ATOM 342 N1 DG A 11 -3.116 1.301 -4.198 1.00 0.59 N ATOM 343 C2 DG A 11 -3.755 1.153 -5.398 1.00 0.63 C ATOM 344 N2 DG A 11 -3.008 1.262 -6.479 1.00 0.63 N ATOM 345 N3 DG A 11 -5.058 0.910 -5.525 1.00 0.70 N ATOM 346 C4 DG A 11 -5.669 0.829 -4.321 1.00 0.73 C ATOM 0 H5' DG A 11 -7.797 -2.327 -7.286 1.00 1.38 H new ATOM 0 H5'' DG A 11 -9.473 -2.782 -7.521 1.00 1.38 H new ATOM 0 H4' DG A 11 -10.222 -1.162 -6.215 1.00 1.25 H new ATOM 0 H3' DG A 11 -9.065 0.574 -8.105 1.00 1.22 H new ATOM 0 H2' DG A 11 -7.082 1.035 -6.766 1.00 1.02 H new ATOM 0 H2'' DG A 11 -8.172 2.217 -6.070 1.00 1.02 H new ATOM 0 H1' DG A 11 -8.963 0.637 -4.399 1.00 0.96 H new ATOM 0 H8 DG A 11 -8.095 0.438 -2.260 1.00 0.86 H new ATOM 0 H1 DG A 11 -2.113 1.486 -4.219 1.00 0.59 H new ATOM 0 H21 DG A 11 -3.429 1.161 -7.402 1.00 0.63 H new ATOM 0 H22 DG A 11 -2.009 1.447 -6.392 1.00 0.63 H new ATOM 358 P DG A 12 -11.720 0.980 -5.975 1.00 1.76 P ATOM 359 OP1 DG A 12 -11.728 -0.447 -5.588 1.00 1.95 O ATOM 360 OP2 DG A 12 -12.889 1.554 -6.678 1.00 2.19 O ATOM 361 O5' DG A 12 -11.471 1.840 -4.651 1.00 1.55 O ATOM 362 C5' DG A 12 -11.531 3.262 -4.732 1.00 1.53 C ATOM 363 C4' DG A 12 -10.681 3.854 -3.646 1.00 1.33 C ATOM 364 O4' DG A 12 -9.324 3.419 -3.718 1.00 1.23 O ATOM 365 C3' DG A 12 -10.649 5.379 -3.691 1.00 1.35 C ATOM 366 O3' DG A 12 -10.903 5.832 -2.366 1.00 1.28 O ATOM 367 C2' DG A 12 -9.194 5.664 -3.958 1.00 1.28 C ATOM 368 C1' DG A 12 -8.630 4.531 -3.189 1.00 1.13 C ATOM 369 N9 DG A 12 -7.198 4.459 -3.378 1.00 1.01 N ATOM 370 C8 DG A 12 -6.508 4.358 -4.540 1.00 1.05 C ATOM 371 N7 DG A 12 -5.227 4.310 -4.370 1.00 0.96 N ATOM 372 C5 DG A 12 -5.057 4.390 -3.009 1.00 0.83 C ATOM 373 C6 DG A 12 -3.873 4.388 -2.252 1.00 0.73 C ATOM 374 O6 DG A 12 -2.713 4.318 -2.636 1.00 0.72 O ATOM 375 N1 DG A 12 -4.151 4.485 -0.925 1.00 0.67 N ATOM 376 C2 DG A 12 -5.407 4.571 -0.392 1.00 0.74 C ATOM 377 N2 DG A 12 -5.483 4.651 0.903 1.00 0.77 N ATOM 378 N3 DG A 12 -6.534 4.576 -1.078 1.00 0.85 N ATOM 379 C4 DG A 12 -6.271 4.481 -2.390 1.00 0.87 C ATOM 0 H5' DG A 12 -12.562 3.601 -4.629 1.00 1.53 H new ATOM 0 H5'' DG A 12 -11.181 3.598 -5.708 1.00 1.53 H new ATOM 0 H4' DG A 12 -11.147 3.509 -2.723 1.00 1.33 H new ATOM 0 H3' DG A 12 -11.344 5.825 -4.402 1.00 1.35 H new ATOM 0 H2' DG A 12 -8.939 5.630 -5.017 1.00 1.28 H new ATOM 0 H2'' DG A 12 -8.873 6.636 -3.584 1.00 1.28 H new ATOM 0 H1' DG A 12 -8.755 4.606 -2.109 1.00 1.13 H new ATOM 0 H8 DG A 12 -6.980 4.321 -5.510 1.00 1.05 H new ATOM 0 H1 DG A 12 -3.363 4.494 -0.278 1.00 0.67 H new ATOM 0 H21 DG A 12 -6.394 4.717 1.357 1.00 0.77 H new ATOM 0 H22 DG A 12 -4.632 4.647 1.465 1.00 0.77 H new ATOM 391 P DT A 13 -12.032 6.903 -2.056 1.00 1.00 P ATOM 392 OP1 DT A 13 -13.187 6.186 -1.478 1.00 1.18 O ATOM 393 OP2 DT A 13 -12.205 7.780 -3.235 1.00 1.39 O ATOM 394 O5' DT A 13 -11.290 7.721 -0.899 1.00 1.07 O ATOM 395 C5' DT A 13 -11.719 9.032 -0.523 1.00 1.09 C ATOM 396 C4' DT A 13 -10.558 9.872 -0.003 1.00 1.00 C ATOM 397 O4' DT A 13 -9.952 9.291 1.156 1.00 0.94 O ATOM 398 C3' DT A 13 -9.421 10.118 -1.027 1.00 1.04 C ATOM 399 O3' DT A 13 -8.718 11.298 -0.615 1.00 1.17 O ATOM 400 C2' DT A 13 -8.580 8.869 -0.721 1.00 0.94 C ATOM 401 C1' DT A 13 -8.591 8.989 0.848 1.00 0.93 C ATOM 402 N1 DT A 13 -8.263 7.722 1.520 1.00 0.88 N ATOM 403 C2 DT A 13 -7.140 7.664 2.325 1.00 1.02 C ATOM 404 O2 DT A 13 -6.383 8.612 2.513 1.00 1.18 O ATOM 405 N3 DT A 13 -6.901 6.453 2.926 1.00 1.13 N ATOM 406 C4 DT A 13 -7.661 5.318 2.799 1.00 1.14 C ATOM 407 O4 DT A 13 -7.325 4.296 3.386 1.00 1.35 O ATOM 408 C5 DT A 13 -8.810 5.468 1.940 1.00 1.01 C ATOM 409 C7 DT A 13 -9.740 4.288 1.690 1.00 1.18 C ATOM 410 C6 DT A 13 -9.065 6.639 1.345 1.00 0.89 C ATOM 0 H5' DT A 13 -12.489 8.958 0.245 1.00 1.09 H new ATOM 0 H5'' DT A 13 -12.172 9.528 -1.381 1.00 1.09 H new ATOM 0 H4' DT A 13 -11.031 10.827 0.227 1.00 1.00 H new ATOM 0 H3' DT A 13 -9.698 10.254 -2.072 1.00 1.04 H new ATOM 0 H2' DT A 13 -9.037 7.948 -1.082 1.00 0.94 H new ATOM 0 H2'' DT A 13 -7.577 8.915 -1.146 1.00 0.94 H new ATOM 0 H1' DT A 13 -7.858 9.725 1.177 1.00 0.93 H new ATOM 0 H3 DT A 13 -6.078 6.391 3.525 1.00 1.13 H new ATOM 0 H71 DT A 13 -10.750 4.654 1.507 1.00 1.18 H new ATOM 0 H72 DT A 13 -9.393 3.729 0.821 1.00 1.18 H new ATOM 0 H73 DT A 13 -9.743 3.636 2.563 1.00 1.18 H new ATOM 0 H6 DT A 13 -9.933 6.726 0.708 1.00 0.89 H new ATOM 423 P DT A 14 -9.370 12.775 -0.669 1.00 1.26 P ATOM 424 OP1 DT A 14 -8.987 13.498 0.565 1.00 1.72 O ATOM 425 OP2 DT A 14 -10.794 12.661 -1.054 1.00 1.39 O ATOM 426 O5' DT A 14 -8.560 13.395 -1.897 1.00 0.95 O ATOM 427 C5' DT A 14 -7.134 13.384 -1.825 1.00 0.91 C ATOM 428 C4' DT A 14 -6.548 13.189 -3.193 1.00 0.75 C ATOM 429 O4' DT A 14 -5.128 13.088 -3.060 1.00 0.86 O ATOM 430 C3' DT A 14 -7.044 11.907 -3.892 1.00 0.64 C ATOM 431 O3' DT A 14 -7.118 12.122 -5.310 1.00 0.59 O ATOM 432 C2' DT A 14 -5.936 10.936 -3.518 1.00 0.56 C ATOM 433 C1' DT A 14 -4.735 11.889 -3.707 1.00 0.64 C ATOM 434 N1 DT A 14 -3.393 11.485 -3.226 1.00 0.69 N ATOM 435 C2 DT A 14 -2.293 11.793 -4.005 1.00 0.73 C ATOM 436 O2 DT A 14 -2.366 12.391 -5.072 1.00 0.77 O ATOM 437 N3 DT A 14 -1.073 11.395 -3.509 1.00 0.82 N ATOM 438 C4 DT A 14 -0.847 10.724 -2.324 1.00 0.86 C ATOM 439 O4 DT A 14 0.299 10.426 -1.997 1.00 0.98 O ATOM 440 C5 DT A 14 -2.054 10.447 -1.581 1.00 0.82 C ATOM 441 C7 DT A 14 -2.039 9.702 -0.241 1.00 0.90 C ATOM 442 C6 DT A 14 -3.243 10.832 -2.051 1.00 0.73 C ATOM 0 H5' DT A 14 -6.802 12.585 -1.162 1.00 0.91 H new ATOM 0 H5'' DT A 14 -6.777 14.321 -1.398 1.00 0.91 H new ATOM 0 H4' DT A 14 -6.858 14.040 -3.800 1.00 0.75 H new ATOM 0 H3' DT A 14 -8.039 11.566 -3.605 1.00 0.64 H new ATOM 0 H2' DT A 14 -6.025 10.563 -2.498 1.00 0.56 H new ATOM 0 H2'' DT A 14 -5.895 10.066 -4.173 1.00 0.56 H new ATOM 0 H1' DT A 14 -4.558 11.941 -4.781 1.00 0.64 H new ATOM 0 H3 DT A 14 -0.253 11.618 -4.074 1.00 0.82 H new ATOM 0 H71 DT A 14 -2.871 10.044 0.375 1.00 0.90 H new ATOM 0 H72 DT A 14 -2.135 8.631 -0.419 1.00 0.90 H new ATOM 0 H73 DT A 14 -1.100 9.901 0.275 1.00 0.90 H new ATOM 0 H6 DT A 14 -4.124 10.612 -1.467 1.00 0.73 H new ATOM 455 P DG A 15 -7.707 11.021 -6.337 1.00 0.67 P ATOM 456 OP1 DG A 15 -8.522 11.728 -7.352 1.00 0.85 O ATOM 457 OP2 DG A 15 -8.304 9.915 -5.555 1.00 0.80 O ATOM 458 O5' DG A 15 -6.374 10.464 -7.048 1.00 0.69 O ATOM 459 C5' DG A 15 -5.585 11.266 -7.947 1.00 0.69 C ATOM 460 C4' DG A 15 -4.323 10.517 -8.376 1.00 0.64 C ATOM 461 O4' DG A 15 -3.524 10.170 -7.245 1.00 0.70 O ATOM 462 C3' DG A 15 -4.634 9.187 -9.101 1.00 0.54 C ATOM 463 O3' DG A 15 -3.956 8.928 -10.351 1.00 0.54 O ATOM 464 C2' DG A 15 -4.271 8.152 -8.034 1.00 0.49 C ATOM 465 C1' DG A 15 -3.041 8.846 -7.435 1.00 0.52 C ATOM 466 N9 DG A 15 -2.723 8.395 -6.067 1.00 0.45 N ATOM 467 C8 DG A 15 -3.569 8.035 -5.050 1.00 0.47 C ATOM 468 N7 DG A 15 -2.964 7.743 -3.929 1.00 0.47 N ATOM 469 C5 DG A 15 -1.616 7.923 -4.234 1.00 0.40 C ATOM 470 C6 DG A 15 -0.454 7.763 -3.429 1.00 0.41 C ATOM 471 O6 DG A 15 -0.320 7.454 -2.243 1.00 0.44 O ATOM 472 N1 DG A 15 0.673 8.045 -4.160 1.00 0.49 N ATOM 473 C2 DG A 15 0.727 8.429 -5.466 1.00 0.59 C ATOM 474 N2 DG A 15 1.933 8.646 -5.957 1.00 0.78 N ATOM 475 N3 DG A 15 -0.338 8.588 -6.227 1.00 0.56 N ATOM 476 C4 DG A 15 -1.472 8.315 -5.543 1.00 0.44 C ATOM 0 H5' DG A 15 -5.310 12.202 -7.461 1.00 0.69 H new ATOM 0 H5'' DG A 15 -6.176 11.525 -8.825 1.00 0.69 H new ATOM 0 H4' DG A 15 -3.803 11.200 -9.048 1.00 0.64 H new ATOM 0 H3' DG A 15 -5.668 9.182 -9.445 1.00 0.54 H new ATOM 0 H2' DG A 15 -5.067 8.002 -7.305 1.00 0.49 H new ATOM 0 H2'' DG A 15 -4.039 7.175 -8.457 1.00 0.49 H new ATOM 0 H1' DG A 15 -2.168 8.683 -8.067 1.00 0.52 H new ATOM 0 H8 DG A 15 -4.642 7.996 -5.165 1.00 0.47 H new ATOM 0 H1 DG A 15 1.565 7.958 -3.674 1.00 0.49 H new ATOM 0 H21 DG A 15 2.043 8.936 -6.929 1.00 0.78 H new ATOM 0 H22 DG A 15 2.754 8.524 -5.365 1.00 0.78 H new ATOM 488 P DG A 16 -2.833 9.786 -11.160 1.00 0.60 P ATOM 489 OP1 DG A 16 -2.398 10.933 -10.334 1.00 0.72 O ATOM 490 OP2 DG A 16 -3.342 10.023 -12.530 1.00 0.72 O ATOM 491 O5' DG A 16 -1.598 8.763 -11.255 1.00 0.59 O ATOM 492 C5' DG A 16 -1.795 7.462 -11.820 1.00 0.49 C ATOM 493 C4' DG A 16 -0.679 6.513 -11.415 1.00 0.52 C ATOM 494 O4' DG A 16 -0.566 6.509 -10.010 1.00 0.52 O ATOM 495 C3' DG A 16 -0.977 5.087 -11.848 1.00 0.49 C ATOM 496 O3' DG A 16 -0.053 4.723 -12.881 1.00 0.59 O ATOM 497 C2' DG A 16 -0.676 4.368 -10.559 1.00 0.49 C ATOM 498 C1' DG A 16 0.216 5.353 -9.855 1.00 0.53 C ATOM 499 N9 DG A 16 0.483 5.185 -8.444 1.00 0.46 N ATOM 500 C8 DG A 16 1.680 5.074 -7.833 1.00 0.49 C ATOM 501 N7 DG A 16 1.606 4.950 -6.535 1.00 0.42 N ATOM 502 C5 DG A 16 0.235 4.982 -6.299 1.00 0.36 C ATOM 503 C6 DG A 16 -0.488 4.890 -5.094 1.00 0.35 C ATOM 504 O6 DG A 16 -0.053 4.759 -3.957 1.00 0.38 O ATOM 505 N1 DG A 16 -1.842 4.967 -5.325 1.00 0.38 N ATOM 506 C2 DG A 16 -2.420 5.116 -6.563 1.00 0.41 C ATOM 507 N2 DG A 16 -3.718 5.188 -6.659 1.00 0.51 N ATOM 508 N3 DG A 16 -1.762 5.201 -7.688 1.00 0.41 N ATOM 509 C4 DG A 16 -0.443 5.126 -7.474 1.00 0.39 C ATOM 0 H5' DG A 16 -1.836 7.537 -12.907 1.00 0.49 H new ATOM 0 H5'' DG A 16 -2.754 7.061 -11.492 1.00 0.49 H new ATOM 0 H4' DG A 16 0.238 6.855 -11.895 1.00 0.52 H new ATOM 0 H3' DG A 16 -1.971 4.889 -12.249 1.00 0.49 H new ATOM 0 H2' DG A 16 -1.580 4.156 -9.989 1.00 0.49 H new ATOM 0 H2'' DG A 16 -0.176 3.414 -10.730 1.00 0.49 H new ATOM 0 H1' DG A 16 1.223 5.299 -10.269 1.00 0.53 H new ATOM 0 H8 DG A 16 2.617 5.087 -8.370 1.00 0.49 H new ATOM 0 H1 DG A 16 -2.463 4.909 -4.518 1.00 0.38 H new ATOM 0 H21 DG A 16 -4.156 5.299 -7.573 1.00 0.51 H new ATOM 0 H22 DG A 16 -4.295 5.134 -5.820 1.00 0.51 H new ATOM 521 P DG A 17 0.163 3.223 -13.436 1.00 0.66 P ATOM 522 OP1 DG A 17 0.840 3.316 -14.750 1.00 0.84 O ATOM 523 OP2 DG A 17 -1.115 2.486 -13.313 1.00 0.71 O ATOM 524 O5' DG A 17 1.205 2.627 -12.352 1.00 0.62 O ATOM 525 C5' DG A 17 2.471 3.279 -12.161 1.00 0.60 C ATOM 526 C4' DG A 17 3.158 2.924 -10.845 1.00 0.54 C ATOM 527 O4' DG A 17 2.290 3.162 -9.736 1.00 0.47 O ATOM 528 C3' DG A 17 3.559 1.459 -10.707 1.00 0.58 C ATOM 529 O3' DG A 17 4.982 1.419 -10.747 1.00 0.74 O ATOM 530 C2' DG A 17 3.052 1.076 -9.326 1.00 0.51 C ATOM 531 C1' DG A 17 2.842 2.390 -8.672 1.00 0.47 C ATOM 532 N9 DG A 17 1.861 2.166 -7.612 1.00 0.42 N ATOM 533 C8 DG A 17 0.526 2.063 -7.772 1.00 0.42 C ATOM 534 N7 DG A 17 -0.142 1.856 -6.677 1.00 0.40 N ATOM 535 C5 DG A 17 0.854 1.821 -5.712 1.00 0.39 C ATOM 536 C6 DG A 17 0.752 1.631 -4.322 1.00 0.41 C ATOM 537 O6 DG A 17 -0.254 1.447 -3.651 1.00 0.47 O ATOM 538 N1 DG A 17 1.978 1.665 -3.724 1.00 0.42 N ATOM 539 C2 DG A 17 3.170 1.860 -4.366 1.00 0.41 C ATOM 540 N2 DG A 17 4.255 1.852 -3.613 1.00 0.44 N ATOM 541 N3 DG A 17 3.293 2.043 -5.674 1.00 0.41 N ATOM 542 C4 DG A 17 2.088 2.012 -6.280 1.00 0.39 C ATOM 0 H5' DG A 17 2.323 4.358 -12.202 1.00 0.60 H new ATOM 0 H5'' DG A 17 3.132 3.016 -12.987 1.00 0.60 H new ATOM 0 H4' DG A 17 4.048 3.553 -10.850 1.00 0.54 H new ATOM 0 H3' DG A 17 3.166 0.795 -11.477 1.00 0.58 H new ATOM 0 H2' DG A 17 2.128 0.500 -9.381 1.00 0.51 H new ATOM 0 H2'' DG A 17 3.776 0.467 -8.785 1.00 0.51 H new ATOM 0 H1' DG A 17 3.718 2.866 -8.231 1.00 0.47 H new ATOM 0 H8 DG A 17 0.048 2.146 -8.737 1.00 0.42 H new ATOM 0 H1 DG A 17 2.008 1.534 -2.713 1.00 0.42 H new ATOM 0 H21 DG A 17 5.172 1.992 -4.038 1.00 0.44 H new ATOM 0 H22 DG A 17 4.176 1.705 -2.607 1.00 0.44 H new ATOM 554 P DG A 18 5.778 0.058 -11.048 1.00 0.90 P ATOM 555 OP1 DG A 18 7.117 0.416 -11.567 1.00 1.12 O ATOM 556 OP2 DG A 18 4.902 -0.850 -11.821 1.00 1.05 O ATOM 557 O5' DG A 18 5.918 -0.517 -9.555 1.00 0.82 O ATOM 558 C5' DG A 18 6.812 0.151 -8.659 1.00 0.75 C ATOM 559 C4' DG A 18 6.991 -0.591 -7.369 1.00 0.61 C ATOM 560 O4' DG A 18 5.927 -0.348 -6.517 1.00 0.58 O ATOM 561 C3' DG A 18 7.223 -2.103 -7.464 1.00 0.60 C ATOM 562 O3' DG A 18 8.507 -2.489 -6.949 1.00 0.67 O ATOM 563 C2' DG A 18 6.137 -2.585 -6.517 1.00 0.56 C ATOM 564 C1' DG A 18 6.010 -1.405 -5.588 1.00 0.51 C ATOM 565 N9 DG A 18 4.687 -1.318 -5.040 1.00 0.46 N ATOM 566 C8 DG A 18 3.578 -1.076 -5.766 1.00 0.48 C ATOM 567 N7 DG A 18 2.484 -1.030 -5.046 1.00 0.49 N ATOM 568 C5 DG A 18 2.955 -1.263 -3.746 1.00 0.46 C ATOM 569 C6 DG A 18 2.275 -1.336 -2.505 1.00 0.47 C ATOM 570 O6 DG A 18 1.087 -1.201 -2.259 1.00 0.52 O ATOM 571 N1 DG A 18 3.129 -1.585 -1.466 1.00 0.47 N ATOM 572 C2 DG A 18 4.483 -1.747 -1.582 1.00 0.47 C ATOM 573 N2 DG A 18 5.164 -1.975 -0.480 1.00 0.51 N ATOM 574 N3 DG A 18 5.142 -1.683 -2.726 1.00 0.47 N ATOM 575 C4 DG A 18 4.311 -1.439 -3.756 1.00 0.45 C ATOM 0 H5' DG A 18 6.432 1.151 -8.450 1.00 0.75 H new ATOM 0 H5'' DG A 18 7.782 0.273 -9.142 1.00 0.75 H new ATOM 0 H4' DG A 18 7.926 -0.190 -6.979 1.00 0.61 H new ATOM 0 H3' DG A 18 7.196 -2.493 -8.481 1.00 0.60 H new ATOM 0 H2' DG A 18 5.204 -2.801 -7.037 1.00 0.56 H new ATOM 0 H2'' DG A 18 6.425 -3.494 -5.990 1.00 0.56 H new ATOM 0 H1' DG A 18 6.782 -1.429 -4.819 1.00 0.51 H new ATOM 0 H8 DG A 18 3.590 -0.934 -6.837 1.00 0.48 H new ATOM 0 H1 DG A 18 2.725 -1.655 -0.532 1.00 0.47 H new ATOM 0 H21 DG A 18 6.175 -2.102 -0.522 1.00 0.51 H new ATOM 0 H22 DG A 18 4.681 -2.025 0.417 1.00 0.51 H new ATOM 587 P DT A 19 9.367 -3.730 -7.528 1.00 0.71 P ATOM 588 OP1 DT A 19 8.680 -4.263 -8.730 1.00 0.88 O ATOM 589 OP2 DT A 19 9.684 -4.638 -6.404 1.00 1.00 O ATOM 590 O5' DT A 19 10.747 -3.019 -7.989 1.00 0.65 O ATOM 591 C5' DT A 19 11.182 -2.882 -9.350 1.00 0.64 C ATOM 592 C4' DT A 19 11.512 -1.410 -9.684 1.00 0.52 C ATOM 593 O4' DT A 19 11.844 -1.102 -11.045 1.00 0.57 O ATOM 594 C3' DT A 19 10.339 -0.485 -9.561 1.00 0.53 C ATOM 595 O3' DT A 19 10.688 0.914 -9.533 1.00 0.59 O ATOM 596 C2' DT A 19 9.722 -0.654 -10.914 1.00 0.71 C ATOM 597 C1' DT A 19 10.692 -1.379 -11.864 1.00 0.72 C ATOM 598 N1 DT A 19 10.418 -0.477 -13.003 1.00 0.89 N ATOM 599 C2 DT A 19 9.475 -0.841 -13.943 1.00 1.15 C ATOM 600 O2 DT A 19 8.860 -1.903 -13.912 1.00 1.21 O ATOM 601 N3 DT A 19 9.251 0.069 -14.943 1.00 1.41 N ATOM 602 C4 DT A 19 9.875 1.287 -15.093 1.00 1.46 C ATOM 603 O4 DT A 19 9.586 2.006 -16.045 1.00 1.74 O ATOM 604 C5 DT A 19 10.844 1.589 -14.062 1.00 1.23 C ATOM 605 C7 DT A 19 11.622 2.908 -14.095 1.00 1.40 C ATOM 606 C6 DT A 19 11.068 0.707 -13.075 1.00 0.95 C ATOM 0 H5' DT A 19 10.404 -3.245 -10.022 1.00 0.64 H new ATOM 0 H5'' DT A 19 12.063 -3.502 -9.518 1.00 0.64 H new ATOM 0 H4' DT A 19 12.336 -1.280 -8.983 1.00 0.52 H new ATOM 0 H3' DT A 19 9.768 -0.709 -8.660 1.00 0.53 H new ATOM 0 H2' DT A 19 8.795 -1.222 -10.829 1.00 0.71 H new ATOM 0 H2'' DT A 19 9.462 0.321 -11.326 1.00 0.71 H new ATOM 0 H1' DT A 19 10.705 -2.415 -12.202 1.00 0.72 H new ATOM 0 H3 DT A 19 8.554 -0.180 -15.645 1.00 1.41 H new ATOM 0 H71 DT A 19 11.865 3.213 -13.077 1.00 1.40 H new ATOM 0 H72 DT A 19 12.542 2.773 -14.663 1.00 1.40 H new ATOM 0 H73 DT A 19 11.013 3.678 -14.568 1.00 1.40 H new ATOM 0 H6 DT A 19 11.792 0.951 -12.312 1.00 0.95 H new ATOM 619 P DT A 20 11.528 1.721 -8.415 1.00 0.69 P ATOM 620 OP1 DT A 20 11.733 3.091 -8.942 1.00 1.11 O ATOM 621 OP2 DT A 20 12.703 0.906 -8.037 1.00 1.08 O ATOM 622 O5' DT A 20 10.563 1.823 -7.113 1.00 0.53 O ATOM 623 C5' DT A 20 9.796 3.000 -6.774 1.00 0.61 C ATOM 624 C4' DT A 20 10.357 3.778 -5.556 1.00 0.57 C ATOM 625 O4' DT A 20 10.427 3.009 -4.341 1.00 0.58 O ATOM 626 C3' DT A 20 11.776 4.350 -5.765 1.00 0.51 C ATOM 627 O3' DT A 20 12.099 5.520 -4.993 1.00 0.58 O ATOM 628 C2' DT A 20 12.576 3.190 -5.217 1.00 0.48 C ATOM 629 C1' DT A 20 11.804 2.887 -3.932 1.00 0.51 C ATOM 630 N1 DT A 20 12.120 1.481 -3.631 1.00 0.55 N ATOM 631 C2 DT A 20 12.969 1.154 -2.592 1.00 0.62 C ATOM 632 O2 DT A 20 13.501 1.983 -1.862 1.00 0.66 O ATOM 633 N3 DT A 20 13.204 -0.190 -2.415 1.00 0.71 N ATOM 634 C4 DT A 20 12.676 -1.217 -3.170 1.00 0.74 C ATOM 635 O4 DT A 20 12.970 -2.378 -2.899 1.00 0.87 O ATOM 636 C5 DT A 20 11.797 -0.776 -4.238 1.00 0.63 C ATOM 637 C7 DT A 20 11.141 -1.788 -5.181 1.00 0.67 C ATOM 638 C6 DT A 20 11.561 0.534 -4.417 1.00 0.56 C ATOM 0 H5' DT A 20 8.768 2.705 -6.564 1.00 0.61 H new ATOM 0 H5'' DT A 20 9.767 3.665 -7.637 1.00 0.61 H new ATOM 0 H4' DT A 20 9.626 4.581 -5.463 1.00 0.57 H new ATOM 0 H3' DT A 20 11.940 4.672 -6.793 1.00 0.51 H new ATOM 0 H2' DT A 20 12.591 2.340 -5.899 1.00 0.48 H new ATOM 0 H2'' DT A 20 13.614 3.460 -5.021 1.00 0.48 H new ATOM 0 H1' DT A 20 12.025 3.517 -3.070 1.00 0.51 H new ATOM 0 H3 DT A 20 13.829 -0.452 -1.652 1.00 0.71 H new ATOM 0 H71 DT A 20 11.788 -2.659 -5.287 1.00 0.67 H new ATOM 0 H72 DT A 20 10.180 -2.097 -4.771 1.00 0.67 H new ATOM 0 H73 DT A 20 10.988 -1.329 -6.158 1.00 0.67 H new ATOM 0 H6 DT A 20 10.902 0.841 -5.216 1.00 0.56 H new ATOM 651 P DG A 21 11.234 6.880 -4.922 1.00 0.48 P ATOM 652 OP1 DG A 21 10.242 6.883 -6.023 1.00 0.62 O ATOM 653 OP2 DG A 21 12.174 8.015 -4.772 1.00 0.62 O ATOM 654 O5' DG A 21 10.471 6.646 -3.523 1.00 0.53 O ATOM 655 C5' DG A 21 9.055 6.543 -3.326 1.00 0.44 C ATOM 656 C4' DG A 21 8.813 5.836 -2.009 1.00 0.31 C ATOM 657 O4' DG A 21 7.544 6.071 -1.389 1.00 0.38 O ATOM 658 C3' DG A 21 9.083 4.324 -1.953 1.00 0.31 C ATOM 659 O3' DG A 21 9.985 4.073 -0.852 1.00 0.36 O ATOM 660 C2' DG A 21 7.692 3.847 -1.675 1.00 0.32 C ATOM 661 C1' DG A 21 7.216 4.866 -0.706 1.00 0.32 C ATOM 662 N9 DG A 21 5.782 4.784 -0.461 1.00 0.31 N ATOM 663 C8 DG A 21 5.151 4.684 0.738 1.00 0.35 C ATOM 664 N7 DG A 21 3.849 4.608 0.637 1.00 0.36 N ATOM 665 C5 DG A 21 3.623 4.665 -0.738 1.00 0.32 C ATOM 666 C6 DG A 21 2.414 4.630 -1.476 1.00 0.33 C ATOM 667 O6 DG A 21 1.270 4.538 -1.049 1.00 0.36 O ATOM 668 N1 DG A 21 2.640 4.713 -2.831 1.00 0.34 N ATOM 669 C2 DG A 21 3.871 4.822 -3.416 1.00 0.34 C ATOM 670 N2 DG A 21 3.913 4.895 -4.729 1.00 0.40 N ATOM 671 N3 DG A 21 5.010 4.857 -2.746 1.00 0.32 N ATOM 672 C4 DG A 21 4.807 4.775 -1.412 1.00 0.30 C ATOM 0 H5' DG A 21 8.596 5.989 -4.145 1.00 0.44 H new ATOM 0 H5'' DG A 21 8.599 7.533 -3.316 1.00 0.44 H new ATOM 0 H4' DG A 21 9.596 6.337 -1.440 1.00 0.31 H new ATOM 0 H3' DG A 21 9.542 3.855 -2.823 1.00 0.31 H new ATOM 0 H2' DG A 21 7.080 3.821 -2.576 1.00 0.32 H new ATOM 0 H2'' DG A 21 7.680 2.842 -1.252 1.00 0.32 H new ATOM 0 H1' DG A 21 7.660 4.759 0.284 1.00 0.32 H new ATOM 0 H8 DG A 21 5.674 4.669 1.683 1.00 0.35 H new ATOM 0 H1 DG A 21 1.827 4.692 -3.446 1.00 0.34 H new ATOM 0 H21 DG A 21 4.810 4.977 -5.207 1.00 0.40 H new ATOM 0 H22 DG A 21 3.048 4.869 -5.269 1.00 0.40 H new ATOM 684 P DG A 22 10.506 2.617 -0.355 1.00 0.41 P ATOM 685 OP1 DG A 22 11.837 2.783 0.273 1.00 0.52 O ATOM 686 OP2 DG A 22 10.316 1.636 -1.445 1.00 0.55 O ATOM 687 O5' DG A 22 9.454 2.247 0.803 1.00 0.48 O ATOM 688 C5' DG A 22 9.457 2.900 2.081 1.00 0.46 C ATOM 689 C4' DG A 22 8.294 2.411 2.929 1.00 0.46 C ATOM 690 O4' DG A 22 7.028 2.622 2.306 1.00 0.43 O ATOM 691 C3' DG A 22 8.387 0.922 3.255 1.00 0.52 C ATOM 692 O3' DG A 22 7.895 0.691 4.584 1.00 0.60 O ATOM 693 C2' DG A 22 7.482 0.368 2.203 1.00 0.47 C ATOM 694 C1' DG A 22 6.346 1.377 2.373 1.00 0.41 C ATOM 695 N9 DG A 22 5.349 1.356 1.307 1.00 0.33 N ATOM 696 C8 DG A 22 5.549 1.293 -0.043 1.00 0.35 C ATOM 697 N7 DG A 22 4.438 1.307 -0.732 1.00 0.34 N ATOM 698 C5 DG A 22 3.445 1.384 0.244 1.00 0.29 C ATOM 699 C6 DG A 22 2.038 1.435 0.118 1.00 0.30 C ATOM 700 O6 DG A 22 1.360 1.421 -0.895 1.00 0.36 O ATOM 701 N1 DG A 22 1.415 1.508 1.331 1.00 0.28 N ATOM 702 C2 DG A 22 2.048 1.533 2.543 1.00 0.30 C ATOM 703 N2 DG A 22 1.291 1.615 3.619 1.00 0.36 N ATOM 704 N3 DG A 22 3.366 1.486 2.689 1.00 0.30 N ATOM 705 C4 DG A 22 3.999 1.414 1.493 1.00 0.28 C ATOM 0 H5' DG A 22 9.388 3.979 1.945 1.00 0.46 H new ATOM 0 H5'' DG A 22 10.398 2.703 2.595 1.00 0.46 H new ATOM 0 H4' DG A 22 8.366 3.002 3.842 1.00 0.46 H new ATOM 0 H3' DG A 22 9.385 0.484 3.247 1.00 0.52 H new ATOM 0 H2' DG A 22 7.923 0.384 1.207 1.00 0.47 H new ATOM 0 H2'' DG A 22 7.175 -0.659 2.399 1.00 0.47 H new ATOM 0 H1' DG A 22 5.790 1.169 3.287 1.00 0.41 H new ATOM 0 H8 DG A 22 6.528 1.237 -0.496 1.00 0.35 H new ATOM 0 H1 DG A 22 0.396 1.547 1.333 1.00 0.28 H new ATOM 0 H21 DG A 22 1.720 1.637 4.544 1.00 0.36 H new ATOM 0 H22 DG A 22 0.276 1.657 3.526 1.00 0.36 H new ATOM 717 P DG A 23 8.869 0.344 5.823 1.00 0.58 P ATOM 718 OP1 DG A 23 8.182 0.738 7.074 1.00 0.65 O ATOM 719 OP2 DG A 23 10.216 0.879 5.525 1.00 0.77 O ATOM 720 O5' DG A 23 8.959 -1.275 5.744 1.00 0.59 O ATOM 721 C5' DG A 23 8.102 -2.250 6.377 1.00 0.46 C ATOM 722 C4' DG A 23 6.738 -1.724 6.853 1.00 0.36 C ATOM 723 O4' DG A 23 5.946 -1.206 5.772 1.00 0.36 O ATOM 724 C3' DG A 23 5.911 -2.845 7.490 1.00 0.39 C ATOM 725 O3' DG A 23 5.001 -2.316 8.471 1.00 0.54 O ATOM 726 C2' DG A 23 5.155 -3.305 6.253 1.00 0.32 C ATOM 727 C1' DG A 23 4.736 -1.956 5.762 1.00 0.30 C ATOM 728 N9 DG A 23 4.164 -2.063 4.420 1.00 0.32 N ATOM 729 C8 DG A 23 4.813 -2.375 3.267 1.00 0.36 C ATOM 730 N7 DG A 23 4.058 -2.357 2.208 1.00 0.42 N ATOM 731 C5 DG A 23 2.812 -2.010 2.713 1.00 0.40 C ATOM 732 C6 DG A 23 1.589 -1.836 2.042 1.00 0.48 C ATOM 733 O6 DG A 23 1.363 -1.939 0.844 1.00 0.55 O ATOM 734 N1 DG A 23 0.583 -1.498 2.906 1.00 0.48 N ATOM 735 C2 DG A 23 0.722 -1.340 4.257 1.00 0.44 C ATOM 736 N2 DG A 23 -0.368 -1.036 4.930 1.00 0.52 N ATOM 737 N3 DG A 23 1.866 -1.494 4.911 1.00 0.39 N ATOM 738 C4 DG A 23 2.868 -1.831 4.069 1.00 0.35 C ATOM 0 H5' DG A 23 8.629 -2.669 7.234 1.00 0.46 H new ATOM 0 H5'' DG A 23 7.932 -3.068 5.676 1.00 0.46 H new ATOM 0 H4' DG A 23 6.964 -0.934 7.569 1.00 0.36 H new ATOM 0 H3' DG A 23 6.478 -3.612 8.017 1.00 0.39 H new ATOM 0 H2' DG A 23 5.785 -3.841 5.543 1.00 0.32 H new ATOM 0 H2'' DG A 23 4.312 -3.955 6.485 1.00 0.32 H new ATOM 0 H1' DG A 23 3.963 -1.487 6.371 1.00 0.30 H new ATOM 0 H8 DG A 23 5.865 -2.617 3.233 1.00 0.36 H new ATOM 0 H1 DG A 23 -0.346 -1.352 2.510 1.00 0.48 H new ATOM 0 H21 DG A 23 -0.324 -0.906 5.941 1.00 0.52 H new ATOM 0 H22 DG A 23 -1.257 -0.930 4.441 1.00 0.52 H new ATOM 750 P DG A 24 4.018 -3.243 9.358 1.00 0.84 P ATOM 751 OP1 DG A 24 3.350 -2.370 10.349 1.00 1.09 O ATOM 752 OP2 DG A 24 4.785 -4.421 9.824 1.00 1.07 O ATOM 753 O5' DG A 24 2.901 -3.755 8.306 1.00 0.77 O ATOM 754 C5' DG A 24 1.871 -2.897 7.770 1.00 0.68 C ATOM 755 C4' DG A 24 0.744 -3.706 7.164 1.00 0.63 C ATOM 756 O4' DG A 24 1.225 -4.558 6.123 1.00 0.70 O ATOM 757 C3' DG A 24 0.062 -4.571 8.237 1.00 0.84 C ATOM 758 O3' DG A 24 -0.802 -3.746 9.017 1.00 1.14 O ATOM 759 C2' DG A 24 -0.596 -5.551 7.238 1.00 0.79 C ATOM 760 C1' DG A 24 0.598 -5.820 6.294 1.00 0.78 C ATOM 761 N9 DG A 24 1.495 -6.859 6.794 1.00 1.06 N ATOM 762 C8 DG A 24 2.844 -6.819 6.885 1.00 1.24 C ATOM 763 N7 DG A 24 3.398 -7.892 7.348 1.00 1.57 N ATOM 764 C5 DG A 24 2.311 -8.721 7.583 1.00 1.60 C ATOM 765 C6 DG A 24 2.277 -10.037 8.091 1.00 1.95 C ATOM 766 O6 DG A 24 3.204 -10.755 8.450 1.00 2.28 O ATOM 767 N1 DG A 24 0.989 -10.503 8.167 1.00 1.96 N ATOM 768 C2 DG A 24 -0.128 -9.798 7.805 1.00 1.68 C ATOM 769 N2 DG A 24 -1.281 -10.405 7.948 1.00 1.82 N ATOM 770 N3 DG A 24 -0.121 -8.564 7.321 1.00 1.34 N ATOM 771 C4 DG A 24 1.141 -8.092 7.244 1.00 1.31 C ATOM 0 H5' DG A 24 2.299 -2.241 7.012 1.00 0.68 H new ATOM 0 H5'' DG A 24 1.479 -2.258 8.561 1.00 0.68 H new ATOM 0 H4' DG A 24 0.024 -3.001 6.747 1.00 0.63 H new ATOM 0 H3' DG A 24 0.638 -5.068 9.018 1.00 0.84 H new ATOM 0 H2' DG A 24 -0.957 -6.459 7.722 1.00 0.79 H new ATOM 0 H2'' DG A 24 -1.446 -5.108 6.719 1.00 0.79 H new ATOM 0 HO3' DG A 24 -1.242 -4.290 9.703 1.00 1.14 H new ATOM 0 H1' DG A 24 0.272 -6.225 5.336 1.00 0.78 H new ATOM 0 H8 DG A 24 3.418 -5.952 6.592 1.00 1.24 H new ATOM 0 H1 DG A 24 0.852 -11.450 8.521 1.00 1.96 H new ATOM 0 H21 DG A 24 -2.145 -9.926 7.694 1.00 1.82 H new ATOM 0 H22 DG A 24 -1.314 -11.357 8.314 1.00 1.82 H new TER 784 DG A 24