USER MOD reduce.3.24.130724 H: found=0, std=0, add=272, rem=0, adj=12 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 4 A O2' : rot -152:sc= 1.08 USER MOD Single : A 5 A O2' : rot -24:sc= -0.0967 USER MOD Single : A 6 A O2' : rot -143:sc= -1.63! USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 8 DT C7 :methyl -30:sc=-0.00198 (180deg=-1.34) USER MOD Single : A 9 DT C7 :methyl -30:sc= 0 (180deg=-0.0519) USER MOD Single : A 12 DG O3' : rot 180:sc= 0 USER MOD Single : B 16 A O2' : rot -125:sc= 0.57! USER MOD Single : B 17 A O2' : rot -18:sc= -0.219 USER MOD Single : B 18 A O2' : rot -143:sc= -1.32! USER MOD Single : B 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 20 DT C7 :methyl -30:sc= -0.0153 (180deg=-1.29) USER MOD Single : B 21 DT C7 :methyl -30:sc= 0 (180deg=-0.0452) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 DC A 1 2.813 10.476 11.563 1.00 0.14 O ATOM 2 P DC A 1 3.021 11.268 10.186 1.00 0.12 P ATOM 3 OP1 DC A 1 2.549 10.398 9.085 1.00 0.18 O ATOM 4 OP2 DC A 1 2.487 12.640 10.339 1.00 0.09 O ATOM 5 O5' DC A 1 4.624 11.337 10.130 1.00 0.19 O ATOM 6 C5' DC A 1 5.399 11.584 11.313 1.00 0.21 C ATOM 7 C4' DC A 1 6.115 10.319 11.769 1.00 0.24 C ATOM 8 O4' DC A 1 5.197 9.217 11.957 1.00 0.20 O ATOM 9 C3' DC A 1 7.141 9.909 10.720 1.00 0.26 C ATOM 10 O3' DC A 1 8.409 9.722 11.361 1.00 0.33 O ATOM 11 C2' DC A 1 6.570 8.486 10.251 1.00 0.22 C ATOM 12 C1' DC A 1 5.842 8.012 11.506 1.00 0.21 C ATOM 13 N1 DC A 1 4.820 6.956 11.280 1.00 0.18 N ATOM 14 C2 DC A 1 4.979 5.689 11.834 1.00 0.19 C ATOM 15 O2 DC A 1 5.974 5.373 12.478 1.00 0.21 O ATOM 16 N3 DC A 1 3.997 4.769 11.634 1.00 0.17 N ATOM 17 C4 DC A 1 2.905 5.063 10.923 1.00 0.15 C ATOM 18 N4 DC A 1 1.972 4.128 10.766 1.00 0.14 N ATOM 19 C5 DC A 1 2.739 6.361 10.347 1.00 0.15 C ATOM 20 C6 DC A 1 3.715 7.254 10.556 1.00 0.17 C ATOM 0 H5' DC A 1 4.749 11.946 12.110 1.00 0.21 H new ATOM 0 H5'' DC A 1 6.129 12.369 11.117 1.00 0.21 H new ATOM 0 H4' DC A 1 6.594 10.542 12.722 1.00 0.24 H new ATOM 0 H3' DC A 1 7.280 10.627 9.912 1.00 0.26 H new ATOM 0 H2' DC A 1 5.898 8.576 9.398 1.00 0.22 H new ATOM 0 H2'' DC A 1 7.367 7.802 9.958 1.00 0.22 H new ATOM 0 H1' DC A 1 6.539 7.549 12.205 1.00 0.21 H new ATOM 0 H41 DC A 1 1.131 4.332 10.227 1.00 0.14 H new ATOM 0 H42 DC A 1 2.098 3.207 11.185 1.00 0.14 H new ATOM 0 H5 DC A 1 1.863 6.611 9.767 1.00 0.15 H new ATOM 0 H6 DC A 1 3.618 8.243 10.134 1.00 0.17 H new ATOM 33 P DG A 2 9.779 9.832 10.516 1.00 0.39 P ATOM 34 OP1 DG A 2 10.898 9.966 11.477 1.00 0.48 O ATOM 35 OP2 DG A 2 9.597 10.856 9.461 1.00 0.47 O ATOM 36 O5' DG A 2 9.849 8.383 9.811 1.00 0.29 O ATOM 37 C5' DG A 2 10.579 7.291 10.386 1.00 0.20 C ATOM 38 C4' DG A 2 10.245 5.945 9.748 1.00 0.14 C ATOM 39 O4' DG A 2 8.909 5.468 10.030 1.00 0.15 O ATOM 40 C3' DG A 2 10.400 5.934 8.215 1.00 0.16 C ATOM 41 O3' DG A 2 11.490 5.065 7.856 1.00 0.17 O ATOM 42 C2' DG A 2 9.021 5.485 7.782 1.00 0.16 C ATOM 43 C1' DG A 2 8.533 4.634 8.923 1.00 0.12 C ATOM 44 N9 DG A 2 7.093 4.324 8.920 1.00 0.13 N ATOM 45 C8 DG A 2 6.027 5.115 8.635 1.00 0.17 C ATOM 46 N7 DG A 2 4.839 4.480 8.757 1.00 0.17 N ATOM 47 C5 DG A 2 5.191 3.223 9.136 1.00 0.14 C ATOM 48 C6 DG A 2 4.378 2.088 9.418 1.00 0.14 C ATOM 49 O6 DG A 2 3.159 1.959 9.397 1.00 0.15 O ATOM 50 N1 DG A 2 5.135 0.995 9.767 1.00 0.11 N ATOM 51 C2 DG A 2 6.503 0.970 9.844 1.00 0.09 C ATOM 52 N2 DG A 2 7.064 -0.178 10.179 1.00 0.08 N ATOM 53 N3 DG A 2 7.278 2.018 9.588 1.00 0.09 N ATOM 54 C4 DG A 2 6.556 3.107 9.240 1.00 0.12 C ATOM 0 H5' DG A 2 10.367 7.243 11.454 1.00 0.20 H new ATOM 0 H5'' DG A 2 11.647 7.481 10.281 1.00 0.20 H new ATOM 0 H4' DG A 2 10.978 5.284 10.211 1.00 0.14 H new ATOM 0 H3' DG A 2 10.668 6.874 7.732 1.00 0.16 H new ATOM 0 H2' DG A 2 8.361 6.335 7.609 1.00 0.16 H new ATOM 0 H2'' DG A 2 9.061 4.919 6.852 1.00 0.16 H new ATOM 0 H1' DG A 2 8.954 3.628 8.912 1.00 0.12 H new ATOM 0 H8 DG A 2 6.119 6.150 8.340 1.00 0.17 H new ATOM 0 H1 DG A 2 4.638 0.132 9.987 1.00 0.11 H new ATOM 0 H21 DG A 2 8.079 -0.248 10.250 1.00 0.08 H new ATOM 0 H22 DG A 2 6.482 -0.994 10.367 1.00 0.08 H new ATOM 66 P DC A 3 11.787 4.414 6.405 1.00 0.17 P ATOM 67 OP1 DC A 3 13.243 4.500 6.147 1.00 0.18 O ATOM 68 OP2 DC A 3 10.828 4.969 5.422 1.00 0.21 O ATOM 69 O5' DC A 3 11.398 2.865 6.659 1.00 0.20 O ATOM 70 C5' DC A 3 12.105 2.050 7.615 1.00 0.18 C ATOM 71 C4' DC A 3 11.794 0.552 7.494 1.00 0.16 C ATOM 72 O4' DC A 3 10.400 0.247 7.719 1.00 0.13 O ATOM 73 C3' DC A 3 12.175 0.021 6.117 1.00 0.18 C ATOM 74 O3' DC A 3 12.587 -1.355 6.158 1.00 0.19 O ATOM 75 C2' DC A 3 10.823 0.201 5.394 1.00 0.17 C ATOM 76 C1' DC A 3 9.782 -0.201 6.496 1.00 0.13 C ATOM 77 N1 DC A 3 8.411 0.405 6.481 1.00 0.11 N ATOM 78 C2 DC A 3 7.317 -0.448 6.654 1.00 0.09 C ATOM 79 O2 DC A 3 7.430 -1.661 6.810 1.00 0.09 O ATOM 80 N3 DC A 3 6.068 0.080 6.654 1.00 0.10 N ATOM 81 C4 DC A 3 5.871 1.387 6.491 1.00 0.12 C ATOM 82 N4 DC A 3 4.622 1.842 6.501 1.00 0.13 N ATOM 83 C5 DC A 3 6.968 2.284 6.312 1.00 0.14 C ATOM 84 C6 DC A 3 8.209 1.755 6.315 1.00 0.13 C ATOM 0 H5' DC A 3 11.854 2.385 8.621 1.00 0.18 H new ATOM 0 H5'' DC A 3 13.177 2.202 7.487 1.00 0.18 H new ATOM 0 H4' DC A 3 12.388 0.069 8.270 1.00 0.16 H new ATOM 0 H3' DC A 3 13.024 0.519 5.648 1.00 0.18 H new ATOM 0 H2' DC A 3 10.679 1.227 5.057 1.00 0.17 H new ATOM 0 H2'' DC A 3 10.747 -0.438 4.514 1.00 0.17 H new ATOM 0 H1' DC A 3 9.588 -1.263 6.348 1.00 0.13 H new ATOM 0 H41 DC A 3 4.441 2.838 6.378 1.00 0.13 H new ATOM 0 H42 DC A 3 3.845 1.195 6.631 1.00 0.13 H new ATOM 0 H5 DC A 3 6.810 3.344 6.179 1.00 0.14 H new ATOM 0 H6 DC A 3 9.061 2.405 6.184 1.00 0.13 H new ATOM 96 P A A 4 13.156 -2.112 4.845 1.00 0.25 P ATOM 97 OP1 A A 4 13.970 -3.263 5.300 1.00 0.32 O ATOM 98 OP2 A A 4 13.760 -1.103 3.944 1.00 0.32 O ATOM 99 O5' A A 4 11.810 -2.670 4.144 1.00 0.19 O ATOM 100 C5' A A 4 11.196 -3.896 4.572 1.00 0.18 C ATOM 101 C4' A A 4 9.740 -4.038 4.131 1.00 0.12 C ATOM 102 O4' A A 4 8.895 -2.997 4.647 1.00 0.11 O ATOM 103 C3' A A 4 9.517 -3.944 2.625 1.00 0.11 C ATOM 104 O3' A A 4 10.011 -5.090 1.897 1.00 0.12 O ATOM 105 C2' A A 4 8.000 -3.788 2.604 1.00 0.09 C ATOM 106 O2' A A 4 7.299 -5.018 2.703 1.00 0.13 O ATOM 107 C1' A A 4 7.661 -3.171 3.933 1.00 0.09 C ATOM 108 N9 A A 4 6.782 -1.994 3.833 1.00 0.08 N ATOM 109 C8 A A 4 7.093 -0.687 3.654 1.00 0.08 C ATOM 110 N7 A A 4 6.015 0.127 3.632 1.00 0.10 N ATOM 111 C5 A A 4 4.975 -0.730 3.808 1.00 0.11 C ATOM 112 C6 A A 4 3.588 -0.535 3.882 1.00 0.13 C ATOM 113 N6 A A 4 3.004 0.655 3.793 1.00 0.15 N ATOM 114 N1 A A 4 2.823 -1.620 4.063 1.00 0.14 N ATOM 115 C2 A A 4 3.386 -2.819 4.166 1.00 0.14 C ATOM 116 N3 A A 4 4.669 -3.129 4.114 1.00 0.12 N ATOM 117 C4 A A 4 5.418 -2.020 3.930 1.00 0.10 C ATOM 0 H5' A A 4 11.245 -3.957 5.659 1.00 0.18 H new ATOM 0 H5'' A A 4 11.769 -4.736 4.180 1.00 0.18 H new ATOM 0 H4' A A 4 9.494 -5.029 4.514 1.00 0.12 H new ATOM 0 H3' A A 4 10.057 -3.141 2.124 1.00 0.11 H new ATOM 0 H2' A A 4 7.739 -3.259 1.688 1.00 0.09 H new ATOM 0 HO2' A A 4 6.431 -4.937 2.256 1.00 0.13 H new ATOM 0 H1' A A 4 7.028 -3.834 4.523 1.00 0.09 H new ATOM 0 H8 A A 4 8.106 -0.330 3.540 1.00 0.08 H new ATOM 0 H61 A A 4 1.989 0.731 3.854 1.00 0.15 H new ATOM 0 H62 A A 4 3.571 1.493 3.663 1.00 0.15 H new ATOM 0 H2 A A 4 2.707 -3.647 4.311 1.00 0.14 H new ATOM 129 P A A 5 9.808 -5.294 0.299 1.00 0.11 P ATOM 130 OP1 A A 5 10.935 -6.116 -0.201 1.00 0.14 O ATOM 131 OP2 A A 5 9.553 -3.966 -0.305 1.00 0.12 O ATOM 132 O5' A A 5 8.442 -6.162 0.162 1.00 0.11 O ATOM 133 C5' A A 5 8.392 -7.574 0.448 1.00 0.13 C ATOM 134 C4' A A 5 6.973 -8.116 0.674 1.00 0.13 C ATOM 135 O4' A A 5 6.334 -7.421 1.768 1.00 0.14 O ATOM 136 C3' A A 5 6.020 -7.983 -0.526 1.00 0.11 C ATOM 137 O3' A A 5 6.128 -9.035 -1.503 1.00 0.12 O ATOM 138 C2' A A 5 4.705 -8.069 0.248 1.00 0.12 C ATOM 139 O2' A A 5 4.506 -9.378 0.801 1.00 0.14 O ATOM 140 C1' A A 5 4.982 -7.092 1.393 1.00 0.13 C ATOM 141 N9 A A 5 4.892 -5.656 0.984 1.00 0.10 N ATOM 142 C8 A A 5 5.832 -4.827 0.396 1.00 0.08 C ATOM 143 N7 A A 5 5.382 -3.569 0.209 1.00 0.06 N ATOM 144 C5 A A 5 4.115 -3.602 0.690 1.00 0.08 C ATOM 145 C6 A A 5 3.122 -2.618 0.783 1.00 0.09 C ATOM 146 N6 A A 5 3.293 -1.364 0.381 1.00 0.09 N ATOM 147 N1 A A 5 1.946 -2.968 1.316 1.00 0.12 N ATOM 148 C2 A A 5 1.757 -4.213 1.738 1.00 0.13 C ATOM 149 N3 A A 5 2.611 -5.225 1.708 1.00 0.13 N ATOM 150 C4 A A 5 3.791 -4.848 1.162 1.00 0.10 C ATOM 0 H5' A A 5 8.992 -7.776 1.335 1.00 0.13 H new ATOM 0 H5'' A A 5 8.850 -8.118 -0.378 1.00 0.13 H new ATOM 0 H4' A A 5 7.132 -9.176 0.870 1.00 0.13 H new ATOM 0 H3' A A 5 6.188 -7.099 -1.141 1.00 0.11 H new ATOM 0 H2' A A 5 3.827 -7.857 -0.362 1.00 0.12 H new ATOM 0 HO2' A A 5 5.021 -10.033 0.285 1.00 0.14 H new ATOM 0 H1' A A 5 4.249 -7.190 2.194 1.00 0.13 H new ATOM 0 H8 A A 5 6.823 -5.153 0.116 1.00 0.08 H new ATOM 0 H61 A A 5 2.533 -0.690 0.474 1.00 0.09 H new ATOM 0 H62 A A 5 4.185 -1.074 -0.021 1.00 0.09 H new ATOM 0 H2 A A 5 0.785 -4.427 2.158 1.00 0.13 H new ATOM 162 P A A 6 5.565 -8.873 -3.017 1.00 0.11 P ATOM 163 OP1 A A 6 5.808 -10.145 -3.735 1.00 0.14 O ATOM 164 OP2 A A 6 6.109 -7.609 -3.565 1.00 0.13 O ATOM 165 O5' A A 6 3.969 -8.690 -2.855 1.00 0.11 O ATOM 166 C5' A A 6 3.114 -9.671 -2.236 1.00 0.14 C ATOM 167 C4' A A 6 1.797 -9.037 -1.786 1.00 0.15 C ATOM 168 O4' A A 6 2.142 -7.904 -0.963 1.00 0.15 O ATOM 169 C3' A A 6 0.983 -8.502 -2.968 1.00 0.15 C ATOM 170 O3' A A 6 0.048 -9.476 -3.474 1.00 0.20 O ATOM 171 C2' A A 6 0.279 -7.341 -2.280 1.00 0.16 C ATOM 172 O2' A A 6 -0.945 -7.675 -1.646 1.00 0.20 O ATOM 173 C1' A A 6 1.289 -6.805 -1.299 1.00 0.14 C ATOM 174 N9 A A 6 1.991 -5.619 -1.837 1.00 0.09 N ATOM 175 C8 A A 6 3.237 -5.483 -2.389 1.00 0.08 C ATOM 176 N7 A A 6 3.532 -4.210 -2.725 1.00 0.06 N ATOM 177 C5 A A 6 2.419 -3.524 -2.371 1.00 0.07 C ATOM 178 C6 A A 6 2.089 -2.172 -2.459 1.00 0.07 C ATOM 179 N6 A A 6 2.936 -1.275 -2.944 1.00 0.11 N ATOM 180 N1 A A 6 0.881 -1.790 -2.019 1.00 0.08 N ATOM 181 C2 A A 6 0.051 -2.702 -1.519 1.00 0.09 C ATOM 182 N3 A A 6 0.250 -4.000 -1.382 1.00 0.10 N ATOM 183 C4 A A 6 1.472 -4.351 -1.835 1.00 0.08 C ATOM 0 H5' A A 6 3.622 -10.113 -1.379 1.00 0.14 H new ATOM 0 H5'' A A 6 2.912 -10.479 -2.939 1.00 0.14 H new ATOM 0 H4' A A 6 1.202 -9.790 -1.268 1.00 0.15 H new ATOM 0 H3' A A 6 1.568 -8.237 -3.849 1.00 0.15 H new ATOM 0 H2' A A 6 -0.031 -6.604 -3.021 1.00 0.16 H new ATOM 0 HO2' A A 6 -1.583 -6.940 -1.759 1.00 0.20 H new ATOM 0 H1' A A 6 0.822 -6.429 -0.389 1.00 0.14 H new ATOM 0 H8 A A 6 3.914 -6.310 -2.540 1.00 0.08 H new ATOM 0 H61 A A 6 2.665 -0.293 -2.995 1.00 0.11 H new ATOM 0 H62 A A 6 3.859 -1.567 -3.266 1.00 0.11 H new ATOM 0 H2 A A 6 -0.907 -2.334 -1.183 1.00 0.09 H new ATOM 195 P DT A 7 -0.800 -9.304 -4.847 1.00 0.22 P ATOM 196 OP1 DT A 7 -1.551 -10.558 -5.080 1.00 0.28 O ATOM 197 OP2 DT A 7 0.127 -8.804 -5.888 1.00 0.21 O ATOM 198 O5' DT A 7 -1.869 -8.130 -4.544 1.00 0.22 O ATOM 199 C5' DT A 7 -2.907 -8.229 -3.553 1.00 0.24 C ATOM 200 C4' DT A 7 -3.533 -6.860 -3.270 1.00 0.20 C ATOM 201 O4' DT A 7 -2.466 -5.924 -2.992 1.00 0.17 O ATOM 202 C3' DT A 7 -4.320 -6.347 -4.481 1.00 0.20 C ATOM 203 O3' DT A 7 -5.711 -6.161 -4.177 1.00 0.20 O ATOM 204 C2' DT A 7 -3.676 -4.962 -4.755 1.00 0.15 C ATOM 205 C1' DT A 7 -2.763 -4.651 -3.590 1.00 0.14 C ATOM 206 N1 DT A 7 -1.546 -4.043 -4.187 1.00 0.12 N ATOM 207 C2 DT A 7 -1.398 -2.672 -4.159 1.00 0.09 C ATOM 208 O2 DT A 7 -2.239 -1.917 -3.688 1.00 0.10 O ATOM 209 N3 DT A 7 -0.236 -2.182 -4.703 1.00 0.07 N ATOM 210 C4 DT A 7 0.778 -2.924 -5.259 1.00 0.08 C ATOM 211 C5 DT A 7 0.547 -4.352 -5.251 1.00 0.12 C ATOM 212 C6 DT A 7 -0.592 -4.845 -4.729 1.00 0.12 C ATOM 213 O4 DT A 7 1.770 -2.347 -5.691 1.00 0.09 O ATOM 226 C7 DT A 7 1.613 -5.311 -5.807 1.00 0.12 C ATOM 0 H5' DT A 7 -2.496 -8.642 -2.632 1.00 0.24 H new ATOM 0 H5'' DT A 7 -3.677 -8.920 -3.896 1.00 0.24 H new ATOM 0 H4' DT A 7 -4.216 -6.955 -2.426 1.00 0.20 H new ATOM 0 H3' DT A 7 -4.279 -7.044 -5.318 1.00 0.20 H new ATOM 0 H2' DT A 7 -3.115 -4.977 -5.689 1.00 0.15 H new ATOM 0 H2'' DT A 7 -4.444 -4.195 -4.857 1.00 0.15 H new ATOM 0 H1' DT A 7 -3.180 -3.977 -2.842 1.00 0.14 H new ATOM 0 H3 DT A 7 -0.114 -1.169 -4.693 1.00 0.07 H new ATOM 0 H71 DT A 7 1.556 -6.263 -5.280 1.00 0.12 H new ATOM 0 H72 DT A 7 1.437 -5.474 -6.870 1.00 0.12 H new ATOM 0 H73 DT A 7 2.603 -4.877 -5.665 1.00 0.12 H new ATOM 0 H6 DT A 7 -0.753 -5.913 -4.741 1.00 0.12 H new ATOM 227 P DT A 8 -6.788 -5.705 -5.303 1.00 0.20 P ATOM 228 OP1 DT A 8 -8.145 -5.947 -4.760 1.00 0.22 O ATOM 229 OP2 DT A 8 -6.397 -6.324 -6.592 1.00 0.24 O ATOM 230 O5' DT A 8 -6.570 -4.110 -5.425 1.00 0.17 O ATOM 231 C5' DT A 8 -6.824 -3.220 -4.324 1.00 0.14 C ATOM 232 C4' DT A 8 -6.628 -1.751 -4.708 1.00 0.11 C ATOM 233 O4' DT A 8 -5.274 -1.527 -5.119 1.00 0.11 O ATOM 234 C3' DT A 8 -7.560 -1.283 -5.835 1.00 0.12 C ATOM 235 O3' DT A 8 -8.293 -0.126 -5.393 1.00 0.10 O ATOM 236 C2' DT A 8 -6.553 -0.968 -6.946 1.00 0.16 C ATOM 237 C1' DT A 8 -5.287 -0.617 -6.219 1.00 0.11 C ATOM 238 N1 DT A 8 -4.023 -0.846 -6.952 1.00 0.11 N ATOM 239 C2 DT A 8 -3.200 0.225 -7.234 1.00 0.11 C ATOM 240 O2 DT A 8 -3.471 1.388 -6.955 1.00 0.11 O ATOM 241 N3 DT A 8 -2.018 -0.081 -7.863 1.00 0.11 N ATOM 242 C4 DT A 8 -1.589 -1.336 -8.227 1.00 0.13 C ATOM 243 C5 DT A 8 -2.510 -2.403 -7.900 1.00 0.14 C ATOM 244 C6 DT A 8 -3.672 -2.115 -7.290 1.00 0.14 C ATOM 245 O4 DT A 8 -0.495 -1.462 -8.766 1.00 0.14 O ATOM 258 C7 DT A 8 -2.168 -3.867 -8.231 1.00 0.18 C ATOM 0 H5' DT A 8 -6.159 -3.469 -3.497 1.00 0.14 H new ATOM 0 H5'' DT A 8 -7.844 -3.367 -3.968 1.00 0.14 H new ATOM 0 H4' DT A 8 -6.871 -1.174 -3.816 1.00 0.11 H new ATOM 0 H3' DT A 8 -8.322 -1.994 -6.154 1.00 0.12 H new ATOM 0 H2' DT A 8 -6.408 -1.824 -7.604 1.00 0.16 H new ATOM 0 H2'' DT A 8 -6.895 -0.141 -7.569 1.00 0.16 H new ATOM 0 H1' DT A 8 -5.308 0.451 -6.001 1.00 0.11 H new ATOM 0 H3 DT A 8 -1.398 0.699 -8.082 1.00 0.11 H new ATOM 0 H71 DT A 8 -1.534 -3.901 -9.117 1.00 0.18 H new ATOM 0 H72 DT A 8 -1.641 -4.317 -7.390 1.00 0.18 H new ATOM 0 H73 DT A 8 -3.087 -4.421 -8.421 1.00 0.18 H new ATOM 0 H6 DT A 8 -4.352 -2.922 -7.060 1.00 0.14 H new ATOM 259 P DT A 9 -9.586 0.474 -6.159 1.00 0.10 P ATOM 260 OP1 DT A 9 -10.324 1.335 -5.205 1.00 0.11 O ATOM 261 OP2 DT A 9 -10.293 -0.642 -6.830 1.00 0.14 O ATOM 262 O5' DT A 9 -8.946 1.416 -7.306 1.00 0.12 O ATOM 263 C5' DT A 9 -8.279 2.660 -7.014 1.00 0.13 C ATOM 264 C4' DT A 9 -7.357 3.101 -8.156 1.00 0.12 C ATOM 265 O4' DT A 9 -6.368 2.098 -8.407 1.00 0.11 O ATOM 266 C3' DT A 9 -8.093 3.318 -9.481 1.00 0.11 C ATOM 267 O3' DT A 9 -8.332 4.721 -9.692 1.00 0.13 O ATOM 268 C2' DT A 9 -7.118 2.679 -10.489 1.00 0.12 C ATOM 269 C1' DT A 9 -5.857 2.417 -9.702 1.00 0.11 C ATOM 270 N1 DT A 9 -5.048 1.255 -10.132 1.00 0.10 N ATOM 271 C2 DT A 9 -3.717 1.452 -10.449 1.00 0.09 C ATOM 272 O2 DT A 9 -3.164 2.546 -10.434 1.00 0.10 O ATOM 273 N3 DT A 9 -3.011 0.329 -10.796 1.00 0.10 N ATOM 274 C4 DT A 9 -3.488 -0.954 -10.861 1.00 0.12 C ATOM 275 C5 DT A 9 -4.889 -1.080 -10.518 1.00 0.12 C ATOM 276 C6 DT A 9 -5.605 0.010 -10.176 1.00 0.10 C ATOM 277 O4 DT A 9 -2.717 -1.855 -11.179 1.00 0.12 O ATOM 290 C7 DT A 9 -5.572 -2.451 -10.517 1.00 0.13 C ATOM 0 H5' DT A 9 -7.696 2.553 -6.099 1.00 0.13 H new ATOM 0 H5'' DT A 9 -9.023 3.435 -6.829 1.00 0.13 H new ATOM 0 H4' DT A 9 -6.921 4.044 -7.827 1.00 0.12 H new ATOM 0 H3' DT A 9 -9.088 2.878 -9.549 1.00 0.11 H new ATOM 0 H2' DT A 9 -7.525 1.755 -10.901 1.00 0.12 H new ATOM 0 H2'' DT A 9 -6.927 3.346 -11.330 1.00 0.12 H new ATOM 0 H1' DT A 9 -5.192 3.275 -9.799 1.00 0.11 H new ATOM 0 H3 DT A 9 -2.027 0.463 -11.030 1.00 0.10 H new ATOM 0 H71 DT A 9 -5.095 -3.096 -11.255 1.00 0.13 H new ATOM 0 H72 DT A 9 -5.481 -2.902 -9.529 1.00 0.13 H new ATOM 0 H73 DT A 9 -6.626 -2.332 -10.766 1.00 0.13 H new ATOM 0 H6 DT A 9 -6.650 -0.106 -9.930 1.00 0.10 H new ATOM 291 P DG A 10 -8.859 5.360 -11.081 1.00 0.12 P ATOM 292 OP1 DG A 10 -9.330 6.738 -10.812 1.00 0.16 O ATOM 293 OP2 DG A 10 -9.765 4.385 -11.733 1.00 0.14 O ATOM 294 O5' DG A 10 -7.493 5.436 -11.935 1.00 0.13 O ATOM 295 C5' DG A 10 -6.429 6.331 -11.571 1.00 0.13 C ATOM 296 C4' DG A 10 -5.209 6.187 -12.482 1.00 0.11 C ATOM 297 O4' DG A 10 -4.577 4.890 -12.396 1.00 0.12 O ATOM 298 C3' DG A 10 -5.578 6.411 -13.956 1.00 0.11 C ATOM 299 O3' DG A 10 -4.888 7.549 -14.498 1.00 0.09 O ATOM 300 C2' DG A 10 -5.120 5.092 -14.557 1.00 0.11 C ATOM 301 C1' DG A 10 -3.985 4.640 -13.678 1.00 0.11 C ATOM 302 N9 DG A 10 -3.676 3.209 -13.861 1.00 0.12 N ATOM 303 C8 DG A 10 -4.499 2.146 -13.682 1.00 0.12 C ATOM 304 N7 DG A 10 -3.905 0.952 -13.906 1.00 0.11 N ATOM 305 C5 DG A 10 -2.635 1.296 -14.248 1.00 0.13 C ATOM 306 C6 DG A 10 -1.529 0.472 -14.601 1.00 0.15 C ATOM 307 O6 DG A 10 -1.442 -0.751 -14.676 1.00 0.16 O ATOM 308 N1 DG A 10 -0.410 1.216 -14.887 1.00 0.16 N ATOM 309 C2 DG A 10 -0.335 2.585 -14.843 1.00 0.15 C ATOM 310 N2 DG A 10 0.831 3.128 -15.150 1.00 0.17 N ATOM 311 N3 DG A 10 -1.355 3.371 -14.513 1.00 0.14 N ATOM 312 C4 DG A 10 -2.472 2.664 -14.229 1.00 0.13 C ATOM 0 H5' DG A 10 -6.133 6.139 -10.539 1.00 0.13 H new ATOM 0 H5'' DG A 10 -6.791 7.358 -11.613 1.00 0.13 H new ATOM 0 H4' DG A 10 -4.513 6.948 -12.129 1.00 0.11 H new ATOM 0 H3' DG A 10 -6.627 6.638 -14.148 1.00 0.11 H new ATOM 0 H2' DG A 10 -5.928 4.360 -14.567 1.00 0.11 H new ATOM 0 H2'' DG A 10 -4.794 5.220 -15.589 1.00 0.11 H new ATOM 0 H1' DG A 10 -3.031 5.133 -13.863 1.00 0.11 H new ATOM 0 H8 DG A 10 -5.533 2.244 -13.388 1.00 0.12 H new ATOM 0 H1 DG A 10 0.434 0.709 -15.154 1.00 0.16 H new ATOM 0 H21 DG A 10 0.942 4.142 -15.133 1.00 0.17 H new ATOM 0 H22 DG A 10 1.620 2.533 -15.404 1.00 0.17 H new ATOM 324 P DC A 11 -5.170 8.149 -15.975 1.00 0.07 P ATOM 325 OP1 DC A 11 -4.743 9.567 -15.982 1.00 0.08 O ATOM 326 OP2 DC A 11 -6.556 7.802 -16.367 1.00 0.11 O ATOM 327 O5' DC A 11 -4.166 7.310 -16.913 1.00 0.10 O ATOM 328 C5' DC A 11 -2.741 7.469 -16.825 1.00 0.10 C ATOM 329 C4' DC A 11 -2.001 6.369 -17.580 1.00 0.13 C ATOM 330 O4' DC A 11 -2.343 5.071 -17.058 1.00 0.15 O ATOM 331 C3' DC A 11 -2.285 6.347 -19.094 1.00 0.15 C ATOM 332 O3' DC A 11 -1.036 6.419 -19.808 1.00 0.19 O ATOM 333 C2' DC A 11 -2.945 4.968 -19.237 1.00 0.17 C ATOM 334 C1' DC A 11 -2.245 4.181 -18.165 1.00 0.17 C ATOM 335 N1 DC A 11 -2.800 2.845 -17.840 1.00 0.17 N ATOM 336 C2 DC A 11 -1.923 1.777 -17.809 1.00 0.18 C ATOM 337 O2 DC A 11 -0.732 1.899 -18.078 1.00 0.20 O ATOM 338 N3 DC A 11 -2.398 0.554 -17.482 1.00 0.18 N ATOM 339 C4 DC A 11 -3.686 0.369 -17.192 1.00 0.18 C ATOM 340 N4 DC A 11 -4.079 -0.859 -16.878 1.00 0.17 N ATOM 341 C5 DC A 11 -4.613 1.455 -17.216 1.00 0.17 C ATOM 342 C6 DC A 11 -4.124 2.669 -17.549 1.00 0.16 C ATOM 0 H5' DC A 11 -2.438 7.458 -15.778 1.00 0.10 H new ATOM 0 H5'' DC A 11 -2.458 8.441 -17.229 1.00 0.10 H new ATOM 0 H4' DC A 11 -0.945 6.596 -17.434 1.00 0.13 H new ATOM 0 H3' DC A 11 -2.894 7.164 -19.480 1.00 0.15 H new ATOM 0 H2' DC A 11 -4.022 5.011 -19.075 1.00 0.17 H new ATOM 0 H2'' DC A 11 -2.788 4.540 -20.227 1.00 0.17 H new ATOM 0 H1' DC A 11 -1.238 3.907 -18.479 1.00 0.17 H new ATOM 0 H41 DC A 11 -5.057 -1.039 -16.650 1.00 0.17 H new ATOM 0 H42 DC A 11 -3.403 -1.623 -16.864 1.00 0.17 H new ATOM 0 H5 DC A 11 -5.657 1.312 -16.979 1.00 0.17 H new ATOM 0 H6 DC A 11 -4.792 3.517 -17.586 1.00 0.16 H new ATOM 354 P DG A 12 -0.857 6.168 -21.399 1.00 0.26 P ATOM 355 OP1 DG A 12 0.034 7.224 -21.932 1.00 0.25 O ATOM 356 OP2 DG A 12 -2.193 5.966 -22.005 1.00 0.34 O ATOM 357 O5' DG A 12 -0.066 4.755 -21.469 1.00 0.27 O ATOM 358 C5' DG A 12 1.345 4.653 -21.199 1.00 0.20 C ATOM 359 C4' DG A 12 2.004 3.391 -21.787 1.00 0.17 C ATOM 360 O4' DG A 12 1.491 2.175 -21.190 1.00 0.23 O ATOM 361 C3' DG A 12 1.798 3.254 -23.308 1.00 0.17 C ATOM 362 O3' DG A 12 2.880 2.532 -23.910 1.00 0.18 O ATOM 363 C2' DG A 12 0.577 2.366 -23.301 1.00 0.17 C ATOM 364 C1' DG A 12 0.942 1.349 -22.233 1.00 0.18 C ATOM 365 N9 DG A 12 -0.179 0.532 -21.729 1.00 0.17 N ATOM 366 C8 DG A 12 -1.369 0.936 -21.214 1.00 0.19 C ATOM 367 N7 DG A 12 -2.163 -0.079 -20.819 1.00 0.19 N ATOM 368 C5 DG A 12 -1.426 -1.181 -21.104 1.00 0.17 C ATOM 369 C6 DG A 12 -1.737 -2.552 -20.911 1.00 0.16 C ATOM 370 O6 DG A 12 -2.746 -3.063 -20.435 1.00 0.18 O ATOM 371 N1 DG A 12 -0.719 -3.370 -21.333 1.00 0.14 N ATOM 372 C2 DG A 12 0.462 -2.948 -21.880 1.00 0.13 C ATOM 373 N2 DG A 12 1.315 -3.893 -22.229 1.00 0.13 N ATOM 374 N3 DG A 12 0.777 -1.668 -22.070 1.00 0.14 N ATOM 375 C4 DG A 12 -0.214 -0.839 -21.660 1.00 0.15 C ATOM 0 H5' DG A 12 1.500 4.663 -20.120 1.00 0.20 H new ATOM 0 H5'' DG A 12 1.846 5.533 -21.601 1.00 0.20 H new ATOM 0 H4' DG A 12 3.063 3.517 -21.564 1.00 0.17 H new ATOM 0 H3' DG A 12 1.723 4.199 -23.846 1.00 0.17 H new ATOM 0 H2' DG A 12 -0.329 2.917 -23.049 1.00 0.17 H new ATOM 0 H2'' DG A 12 0.406 1.898 -24.270 1.00 0.17 H new ATOM 0 HO3' DG A 12 2.726 2.456 -24.875 1.00 0.18 H new ATOM 0 H1' DG A 12 1.619 0.593 -22.631 1.00 0.18 H new ATOM 0 H8 DG A 12 -1.653 1.975 -21.129 1.00 0.19 H new ATOM 0 H1 DG A 12 -0.854 -4.376 -21.230 1.00 0.14 H new ATOM 0 H21 DG A 12 2.213 -3.642 -22.642 1.00 0.13 H new ATOM 0 H22 DG A 12 1.076 -4.874 -22.085 1.00 0.13 H new TER 388 DG A 12 ATOM 389 OP3 DC B 13 -1.459 -11.869 -19.371 1.00 0.27 O ATOM 390 P DC B 13 -0.524 -12.353 -18.162 1.00 0.23 P ATOM 391 OP1 DC B 13 -0.663 -11.378 -17.058 1.00 0.26 O ATOM 392 OP2 DC B 13 -0.763 -13.794 -17.924 1.00 0.27 O ATOM 393 O5' DC B 13 0.928 -12.169 -18.825 1.00 0.24 O ATOM 394 C5' DC B 13 1.161 -12.516 -20.198 1.00 0.24 C ATOM 395 C4' DC B 13 1.312 -11.272 -21.059 1.00 0.23 C ATOM 396 O4' DC B 13 0.190 -10.360 -20.940 1.00 0.23 O ATOM 397 C3' DC B 13 2.568 -10.512 -20.654 1.00 0.23 C ATOM 398 O3' DC B 13 3.212 -10.083 -21.860 1.00 0.24 O ATOM 399 C2' DC B 13 1.926 -9.232 -19.944 1.00 0.22 C ATOM 400 C1' DC B 13 0.727 -9.025 -20.847 1.00 0.20 C ATOM 401 N1 DC B 13 -0.257 -8.040 -20.352 1.00 0.19 N ATOM 402 C2 DC B 13 -0.437 -6.841 -21.032 1.00 0.18 C ATOM 403 O2 DC B 13 0.233 -6.537 -22.016 1.00 0.18 O ATOM 404 N3 DC B 13 -1.371 -5.974 -20.568 1.00 0.17 N ATOM 405 C4 DC B 13 -2.099 -6.262 -19.485 1.00 0.17 C ATOM 406 N4 DC B 13 -2.998 -5.380 -19.074 1.00 0.17 N ATOM 407 C5 DC B 13 -1.916 -7.490 -18.781 1.00 0.19 C ATOM 408 C6 DC B 13 -0.990 -8.331 -19.256 1.00 0.19 C ATOM 0 H5' DC B 13 0.333 -13.121 -20.569 1.00 0.24 H new ATOM 0 H5'' DC B 13 2.061 -13.126 -20.274 1.00 0.24 H new ATOM 0 H4' DC B 13 1.366 -11.621 -22.090 1.00 0.23 H new ATOM 0 H3' DC B 13 3.282 -11.065 -20.044 1.00 0.23 H new ATOM 0 H2' DC B 13 1.643 -9.424 -18.909 1.00 0.22 H new ATOM 0 H2'' DC B 13 2.599 -8.375 -19.937 1.00 0.22 H new ATOM 0 H1' DC B 13 1.001 -8.587 -21.807 1.00 0.20 H new ATOM 0 H41 DC B 13 -3.566 -5.577 -18.250 1.00 0.17 H new ATOM 0 H42 DC B 13 -3.122 -4.504 -19.582 1.00 0.17 H new ATOM 0 H5 DC B 13 -2.499 -7.730 -17.904 1.00 0.19 H new ATOM 0 H6 DC B 13 -0.824 -9.270 -18.748 1.00 0.19 H new ATOM 421 P DG B 14 4.654 -9.372 -21.847 1.00 0.24 P ATOM 422 OP1 DG B 14 5.094 -9.243 -23.255 1.00 0.27 O ATOM 423 OP2 DG B 14 5.515 -10.085 -20.876 1.00 0.31 O ATOM 424 O5' DG B 14 4.340 -7.905 -21.254 1.00 0.18 O ATOM 425 C5' DG B 14 4.744 -6.703 -21.922 1.00 0.16 C ATOM 426 C4' DG B 14 4.620 -5.476 -21.020 1.00 0.15 C ATOM 427 O4' DG B 14 3.256 -5.127 -20.699 1.00 0.17 O ATOM 428 C3' DG B 14 5.357 -5.641 -19.674 1.00 0.15 C ATOM 429 O3' DG B 14 6.433 -4.692 -19.585 1.00 0.15 O ATOM 430 C2' DG B 14 4.226 -5.442 -18.693 1.00 0.16 C ATOM 431 C1' DG B 14 3.283 -4.512 -19.405 1.00 0.16 C ATOM 432 N9 DG B 14 1.939 -4.413 -18.815 1.00 0.15 N ATOM 433 C8 DG B 14 1.113 -5.393 -18.366 1.00 0.16 C ATOM 434 N7 DG B 14 -0.066 -4.925 -17.901 1.00 0.16 N ATOM 435 C5 DG B 14 0.036 -3.581 -18.071 1.00 0.15 C ATOM 436 C6 DG B 14 -0.891 -2.546 -17.765 1.00 0.15 C ATOM 437 O6 DG B 14 -2.016 -2.614 -17.276 1.00 0.17 O ATOM 438 N1 DG B 14 -0.394 -1.306 -18.090 1.00 0.15 N ATOM 439 C2 DG B 14 0.838 -1.064 -18.642 1.00 0.14 C ATOM 440 N2 DG B 14 1.149 0.197 -18.873 1.00 0.14 N ATOM 441 N3 DG B 14 1.716 -2.016 -18.937 1.00 0.14 N ATOM 442 C4 DG B 14 1.249 -3.247 -18.625 1.00 0.14 C ATOM 0 H5' DG B 14 4.133 -6.561 -22.813 1.00 0.16 H new ATOM 0 H5'' DG B 14 5.776 -6.804 -22.257 1.00 0.16 H new ATOM 0 H4' DG B 14 5.076 -4.686 -21.616 1.00 0.15 H new ATOM 0 H3' DG B 14 5.862 -6.592 -19.504 1.00 0.15 H new ATOM 0 H2' DG B 14 3.743 -6.387 -18.445 1.00 0.16 H new ATOM 0 H2'' DG B 14 4.581 -5.010 -17.757 1.00 0.16 H new ATOM 0 H1' DG B 14 3.607 -3.472 -19.375 1.00 0.16 H new ATOM 0 H8 DG B 14 1.373 -6.441 -18.379 1.00 0.16 H new ATOM 0 H1 DG B 14 -0.991 -0.500 -17.905 1.00 0.15 H new ATOM 0 H21 DG B 14 2.053 0.433 -19.282 1.00 0.14 H new ATOM 0 H22 DG B 14 0.485 0.936 -18.642 1.00 0.14 H new ATOM 454 P DC B 15 7.233 -4.263 -18.245 1.00 0.19 P ATOM 455 OP1 DC B 15 8.681 -4.241 -18.553 1.00 0.28 O ATOM 456 OP2 DC B 15 6.732 -5.068 -17.106 1.00 0.19 O ATOM 457 O5' DC B 15 6.721 -2.744 -18.044 1.00 0.18 O ATOM 458 C5' DC B 15 6.971 -1.728 -19.034 1.00 0.21 C ATOM 459 C4' DC B 15 6.665 -0.310 -18.541 1.00 0.20 C ATOM 460 O4' DC B 15 5.278 -0.134 -18.177 1.00 0.21 O ATOM 461 C3' DC B 15 7.520 0.045 -17.334 1.00 0.17 C ATOM 462 O3' DC B 15 7.846 1.442 -17.302 1.00 0.18 O ATOM 463 C2' DC B 15 6.553 -0.365 -16.201 1.00 0.14 C ATOM 464 C1' DC B 15 5.150 0.061 -16.755 1.00 0.18 C ATOM 465 N1 DC B 15 3.932 -0.710 -16.339 1.00 0.16 N ATOM 466 C2 DC B 15 2.813 0.012 -15.909 1.00 0.17 C ATOM 467 O2 DC B 15 2.785 1.239 -15.858 1.00 0.19 O ATOM 468 N3 DC B 15 1.700 -0.667 -15.535 1.00 0.19 N ATOM 469 C4 DC B 15 1.656 -1.998 -15.573 1.00 0.16 C ATOM 470 N4 DC B 15 0.530 -2.591 -15.191 1.00 0.18 N ATOM 471 C5 DC B 15 2.780 -2.766 -16.010 1.00 0.16 C ATOM 472 C6 DC B 15 3.886 -2.085 -16.380 1.00 0.17 C ATOM 0 H5' DC B 15 6.367 -1.936 -19.918 1.00 0.21 H new ATOM 0 H5'' DC B 15 8.015 -1.780 -19.342 1.00 0.21 H new ATOM 0 H4' DC B 15 6.894 0.350 -19.378 1.00 0.20 H new ATOM 0 H3' DC B 15 8.497 -0.438 -17.296 1.00 0.17 H new ATOM 0 H2' DC B 15 6.599 -1.435 -16.001 1.00 0.14 H new ATOM 0 H2'' DC B 15 6.789 0.145 -15.267 1.00 0.14 H new ATOM 0 H1' DC B 15 4.963 1.063 -16.368 1.00 0.18 H new ATOM 0 H41 DC B 15 0.459 -3.608 -15.207 1.00 0.18 H new ATOM 0 H42 DC B 15 -0.263 -2.029 -14.882 1.00 0.18 H new ATOM 0 H5 DC B 15 2.746 -3.845 -16.043 1.00 0.16 H new ATOM 0 H6 DC B 15 4.755 -2.632 -16.716 1.00 0.17 H new ATOM 484 P A B 16 8.838 2.070 -16.190 1.00 0.14 P ATOM 485 OP1 A B 16 9.416 3.314 -16.748 1.00 0.20 O ATOM 486 OP2 A B 16 9.738 1.001 -15.699 1.00 0.17 O ATOM 487 O5' A B 16 7.822 2.458 -14.998 1.00 0.12 O ATOM 488 C5' A B 16 6.985 3.619 -15.091 1.00 0.20 C ATOM 489 C4' A B 16 5.791 3.580 -14.146 1.00 0.21 C ATOM 490 O4' A B 16 4.921 2.462 -14.383 1.00 0.19 O ATOM 491 C3' A B 16 6.159 3.418 -12.675 1.00 0.22 C ATOM 492 O3' A B 16 6.785 4.599 -12.128 1.00 0.27 O ATOM 493 C2' A B 16 4.784 3.086 -12.104 1.00 0.24 C ATOM 494 O2' A B 16 3.977 4.224 -11.859 1.00 0.31 O ATOM 495 C1' A B 16 4.031 2.480 -13.258 1.00 0.20 C ATOM 496 N9 A B 16 3.330 1.223 -12.946 1.00 0.15 N ATOM 497 C8 A B 16 3.754 -0.061 -13.046 1.00 0.13 C ATOM 498 N7 A B 16 2.818 -0.969 -12.688 1.00 0.09 N ATOM 499 C5 A B 16 1.753 -0.197 -12.345 1.00 0.09 C ATOM 500 C6 A B 16 0.462 -0.507 -11.887 1.00 0.08 C ATOM 501 N6 A B 16 0.025 -1.749 -11.699 1.00 0.09 N ATOM 502 N1 A B 16 -0.366 0.515 -11.634 1.00 0.08 N ATOM 503 C2 A B 16 0.046 1.763 -11.821 1.00 0.11 C ATOM 504 N3 A B 16 1.227 2.183 -12.246 1.00 0.13 N ATOM 505 C4 A B 16 2.042 1.134 -12.492 1.00 0.12 C ATOM 0 H5' A B 16 6.625 3.718 -16.115 1.00 0.20 H new ATOM 0 H5'' A B 16 7.581 4.506 -14.876 1.00 0.20 H new ATOM 0 H4' A B 16 5.321 4.543 -14.347 1.00 0.21 H new ATOM 0 H3' A B 16 6.915 2.665 -12.450 1.00 0.22 H new ATOM 0 H2' A B 16 4.942 2.505 -11.195 1.00 0.24 H new ATOM 0 HO2' A B 16 3.677 4.217 -10.926 1.00 0.31 H new ATOM 0 H1' A B 16 3.171 3.098 -13.517 1.00 0.20 H new ATOM 0 H8 A B 16 4.745 -0.333 -13.380 1.00 0.13 H new ATOM 0 H61 A B 16 -0.925 -1.910 -11.364 1.00 0.09 H new ATOM 0 H62 A B 16 0.640 -2.540 -11.890 1.00 0.09 H new ATOM 0 H2 A B 16 -0.675 2.535 -11.598 1.00 0.11 H new ATOM 517 P A B 17 7.206 4.767 -10.569 1.00 0.29 P ATOM 518 OP1 A B 17 8.395 5.647 -10.510 1.00 0.36 O ATOM 519 OP2 A B 17 7.266 3.418 -9.959 1.00 0.28 O ATOM 520 O5' A B 17 5.954 5.552 -9.898 1.00 0.26 O ATOM 521 C5' A B 17 5.710 6.955 -10.124 1.00 0.26 C ATOM 522 C4' A B 17 4.275 7.392 -9.800 1.00 0.22 C ATOM 523 O4' A B 17 3.328 6.651 -10.601 1.00 0.21 O ATOM 524 C3' A B 17 3.859 7.195 -8.331 1.00 0.19 C ATOM 525 O3' A B 17 4.222 8.291 -7.465 1.00 0.18 O ATOM 526 C2' A B 17 2.350 7.179 -8.555 1.00 0.16 C ATOM 527 O2' A B 17 1.945 8.521 -8.844 1.00 0.17 O ATOM 528 C1' A B 17 2.224 6.254 -9.765 1.00 0.17 C ATOM 529 N9 A B 17 2.384 4.815 -9.387 1.00 0.16 N ATOM 530 C8 A B 17 3.530 4.057 -9.205 1.00 0.21 C ATOM 531 N7 A B 17 3.269 2.773 -8.892 1.00 0.21 N ATOM 532 C5 A B 17 1.915 2.713 -8.873 1.00 0.15 C ATOM 533 C6 A B 17 1.031 1.660 -8.613 1.00 0.13 C ATOM 534 N6 A B 17 1.432 0.426 -8.329 1.00 0.17 N ATOM 535 N1 A B 17 -0.281 1.919 -8.668 1.00 0.11 N ATOM 536 C2 A B 17 -0.701 3.145 -8.964 1.00 0.11 C ATOM 537 N3 A B 17 0.032 4.216 -9.229 1.00 0.11 N ATOM 538 C4 A B 17 1.353 3.929 -9.166 1.00 0.12 C ATOM 0 H5' A B 17 5.925 7.189 -11.167 1.00 0.26 H new ATOM 0 H5'' A B 17 6.403 7.538 -9.517 1.00 0.26 H new ATOM 0 H4' A B 17 4.264 8.460 -10.018 1.00 0.22 H new ATOM 0 H3' A B 17 4.317 6.336 -7.840 1.00 0.19 H new ATOM 0 H2' A B 17 1.735 6.841 -7.721 1.00 0.16 H new ATOM 0 HO2' A B 17 2.645 9.143 -8.555 1.00 0.17 H new ATOM 0 H1' A B 17 1.246 6.337 -10.240 1.00 0.17 H new ATOM 0 H8 A B 17 4.529 4.455 -9.304 1.00 0.21 H new ATOM 0 H61 A B 17 0.744 -0.305 -8.147 1.00 0.17 H new ATOM 0 H62 A B 17 2.428 0.209 -8.292 1.00 0.17 H new ATOM 0 H2 A B 17 -1.772 3.285 -8.992 1.00 0.11 H new ATOM 550 P A B 18 4.336 8.120 -5.852 1.00 0.18 P ATOM 551 OP1 A B 18 4.728 9.428 -5.281 1.00 0.21 O ATOM 552 OP2 A B 18 5.165 6.924 -5.582 1.00 0.25 O ATOM 553 O5' A B 18 2.829 7.798 -5.369 1.00 0.14 O ATOM 554 C5' A B 18 1.713 8.679 -5.602 1.00 0.11 C ATOM 555 C4' A B 18 0.393 7.908 -5.562 1.00 0.08 C ATOM 556 O4' A B 18 0.531 6.798 -6.471 1.00 0.09 O ATOM 557 C3' A B 18 0.116 7.315 -4.179 1.00 0.10 C ATOM 558 O3' A B 18 -0.653 8.212 -3.354 1.00 0.12 O ATOM 559 C2' A B 18 -0.687 6.088 -4.593 1.00 0.07 C ATOM 560 O2' A B 18 -2.080 6.312 -4.731 1.00 0.09 O ATOM 561 C1' A B 18 -0.066 5.634 -5.889 1.00 0.07 C ATOM 562 N9 A B 18 0.859 4.497 -5.685 1.00 0.08 N ATOM 563 C8 A B 18 2.228 4.448 -5.631 1.00 0.10 C ATOM 564 N7 A B 18 2.707 3.199 -5.467 1.00 0.11 N ATOM 565 C5 A B 18 1.589 2.436 -5.410 1.00 0.10 C ATOM 566 C6 A B 18 1.406 1.064 -5.252 1.00 0.11 C ATOM 567 N6 A B 18 2.434 0.233 -5.140 1.00 0.13 N ATOM 568 N1 A B 18 0.150 0.593 -5.231 1.00 0.09 N ATOM 569 C2 A B 18 -0.865 1.445 -5.361 1.00 0.07 C ATOM 570 N3 A B 18 -0.817 2.756 -5.521 1.00 0.06 N ATOM 571 C4 A B 18 0.459 3.194 -5.537 1.00 0.07 C ATOM 0 H5' A B 18 1.825 9.166 -6.570 1.00 0.11 H new ATOM 0 H5'' A B 18 1.702 9.466 -4.848 1.00 0.11 H new ATOM 0 H4' A B 18 -0.418 8.589 -5.820 1.00 0.08 H new ATOM 0 H3' A B 18 0.999 7.109 -3.574 1.00 0.10 H new ATOM 0 H2' A B 18 -0.637 5.332 -3.810 1.00 0.07 H new ATOM 0 HO2' A B 18 -2.571 5.523 -4.420 1.00 0.09 H new ATOM 0 H1' A B 18 -0.804 5.229 -6.582 1.00 0.07 H new ATOM 0 H8 A B 18 2.858 5.321 -5.712 1.00 0.10 H new ATOM 0 H61 A B 18 2.271 -0.767 -5.025 1.00 0.13 H new ATOM 0 H62 A B 18 3.387 0.594 -5.169 1.00 0.13 H new ATOM 0 H2 A B 18 -1.853 1.009 -5.332 1.00 0.07 H new ATOM 583 P DT B 19 -0.921 7.988 -1.772 1.00 0.17 P ATOM 584 OP1 DT B 19 -1.633 9.180 -1.259 1.00 0.23 O ATOM 585 OP2 DT B 19 0.360 7.580 -1.153 1.00 0.19 O ATOM 586 O5' DT B 19 -1.927 6.725 -1.688 1.00 0.15 O ATOM 587 C5' DT B 19 -3.262 6.735 -2.224 1.00 0.17 C ATOM 588 C4' DT B 19 -3.842 5.318 -2.290 1.00 0.13 C ATOM 589 O4' DT B 19 -2.881 4.473 -2.961 1.00 0.13 O ATOM 590 C3' DT B 19 -4.082 4.753 -0.885 1.00 0.15 C ATOM 591 O3' DT B 19 -5.470 4.468 -0.651 1.00 0.16 O ATOM 592 C2' DT B 19 -3.292 3.416 -0.912 1.00 0.11 C ATOM 593 C1' DT B 19 -2.843 3.179 -2.337 1.00 0.11 C ATOM 594 N1 DT B 19 -1.450 2.672 -2.247 1.00 0.10 N ATOM 595 C2 DT B 19 -1.220 1.318 -2.369 1.00 0.09 C ATOM 596 O2 DT B 19 -2.115 0.497 -2.520 1.00 0.10 O ATOM 597 N3 DT B 19 0.095 0.921 -2.306 1.00 0.10 N ATOM 598 C4 DT B 19 1.185 1.742 -2.142 1.00 0.11 C ATOM 599 C5 DT B 19 0.862 3.147 -2.020 1.00 0.11 C ATOM 600 C6 DT B 19 -0.425 3.548 -2.070 1.00 0.12 C ATOM 601 O4 DT B 19 2.306 1.245 -2.124 1.00 0.13 O ATOM 614 C7 DT B 19 1.985 4.187 -1.863 1.00 0.14 C ATOM 0 H5' DT B 19 -3.253 7.174 -3.222 1.00 0.17 H new ATOM 0 H5'' DT B 19 -3.901 7.364 -1.604 1.00 0.17 H new ATOM 0 H4' DT B 19 -4.793 5.349 -2.821 1.00 0.13 H new ATOM 0 H3' DT B 19 -3.777 5.451 -0.106 1.00 0.15 H new ATOM 0 H2' DT B 19 -2.433 3.465 -0.243 1.00 0.11 H new ATOM 0 H2'' DT B 19 -3.919 2.594 -0.566 1.00 0.11 H new ATOM 0 H1' DT B 19 -3.451 2.471 -2.899 1.00 0.11 H new ATOM 0 H3 DT B 19 0.279 -0.079 -2.389 1.00 0.10 H new ATOM 0 H71 DT B 19 1.669 5.133 -2.302 1.00 0.14 H new ATOM 0 H72 DT B 19 2.201 4.333 -0.805 1.00 0.14 H new ATOM 0 H73 DT B 19 2.882 3.833 -2.371 1.00 0.14 H new ATOM 0 H6 DT B 19 -0.649 4.599 -1.966 1.00 0.12 H new ATOM 615 P DT B 20 -6.021 3.967 0.793 1.00 0.12 P ATOM 616 OP1 DT B 20 -7.493 4.112 0.791 1.00 0.14 O ATOM 617 OP2 DT B 20 -5.223 4.635 1.848 1.00 0.15 O ATOM 618 O5' DT B 20 -5.669 2.392 0.822 1.00 0.13 O ATOM 619 C5' DT B 20 -6.257 1.464 -0.107 1.00 0.12 C ATOM 620 C4' DT B 20 -5.792 0.026 0.139 1.00 0.11 C ATOM 621 O4' DT B 20 -4.370 -0.061 -0.013 1.00 0.10 O ATOM 622 C3' DT B 20 -6.165 -0.513 1.528 1.00 0.11 C ATOM 623 O3' DT B 20 -6.896 -1.743 1.375 1.00 0.11 O ATOM 624 C2' DT B 20 -4.781 -0.714 2.153 1.00 0.08 C ATOM 625 C1' DT B 20 -3.871 -0.953 0.983 1.00 0.09 C ATOM 626 N1 DT B 20 -2.447 -0.605 1.173 1.00 0.09 N ATOM 627 C2 DT B 20 -1.491 -1.594 1.070 1.00 0.09 C ATOM 628 O2 DT B 20 -1.749 -2.779 0.880 1.00 0.10 O ATOM 629 N3 DT B 20 -0.187 -1.180 1.195 1.00 0.08 N ATOM 630 C4 DT B 20 0.242 0.108 1.408 1.00 0.09 C ATOM 631 C5 DT B 20 -0.821 1.084 1.510 1.00 0.09 C ATOM 632 C6 DT B 20 -2.101 0.692 1.393 1.00 0.08 C ATOM 633 O4 DT B 20 1.444 0.331 1.471 1.00 0.12 O ATOM 646 C7 DT B 20 -0.499 2.573 1.742 1.00 0.10 C ATOM 0 H5' DT B 20 -5.999 1.758 -1.124 1.00 0.12 H new ATOM 0 H5'' DT B 20 -7.343 1.512 -0.027 1.00 0.12 H new ATOM 0 H4' DT B 20 -6.309 -0.586 -0.600 1.00 0.11 H new ATOM 0 H3' DT B 20 -6.807 0.126 2.134 1.00 0.11 H new ATOM 0 H2' DT B 20 -4.472 0.162 2.724 1.00 0.08 H new ATOM 0 H2'' DT B 20 -4.775 -1.560 2.840 1.00 0.08 H new ATOM 0 H1' DT B 20 -3.879 -2.021 0.763 1.00 0.09 H new ATOM 0 H3 DT B 20 0.533 -1.899 1.123 1.00 0.08 H new ATOM 0 H71 DT B 20 0.427 2.661 2.311 1.00 0.10 H new ATOM 0 H72 DT B 20 -0.383 3.074 0.781 1.00 0.10 H new ATOM 0 H73 DT B 20 -1.312 3.039 2.298 1.00 0.10 H new ATOM 0 H6 DT B 20 -2.882 1.433 1.477 1.00 0.08 H new ATOM 647 P DT B 21 -7.741 -2.450 2.562 1.00 0.15 P ATOM 648 OP1 DT B 21 -8.708 -3.385 1.939 1.00 0.20 O ATOM 649 OP2 DT B 21 -8.236 -1.396 3.477 1.00 0.20 O ATOM 650 O5' DT B 21 -6.633 -3.317 3.357 1.00 0.13 O ATOM 651 C5' DT B 21 -6.017 -4.493 2.798 1.00 0.13 C ATOM 652 C4' DT B 21 -4.684 -4.826 3.481 1.00 0.11 C ATOM 653 O4' DT B 21 -3.777 -3.726 3.356 1.00 0.10 O ATOM 654 C3' DT B 21 -4.816 -5.112 4.982 1.00 0.09 C ATOM 655 O3' DT B 21 -4.742 -6.527 5.228 1.00 0.09 O ATOM 656 C2' DT B 21 -3.629 -4.317 5.558 1.00 0.10 C ATOM 657 C1' DT B 21 -2.789 -3.963 4.357 1.00 0.09 C ATOM 658 N1 DT B 21 -1.984 -2.726 4.460 1.00 0.08 N ATOM 659 C2 DT B 21 -0.625 -2.804 4.230 1.00 0.08 C ATOM 660 O2 DT B 21 -0.031 -3.847 3.980 1.00 0.10 O ATOM 661 N3 DT B 21 0.064 -1.622 4.296 1.00 0.08 N ATOM 662 C4 DT B 21 -0.457 -0.382 4.562 1.00 0.10 C ATOM 663 C5 DT B 21 -1.886 -0.381 4.796 1.00 0.11 C ATOM 664 C6 DT B 21 -2.586 -1.533 4.741 1.00 0.08 C ATOM 665 O4 DT B 21 0.299 0.584 4.570 1.00 0.12 O ATOM 678 C7 DT B 21 -2.628 0.926 5.091 1.00 0.13 C ATOM 0 H5' DT B 21 -5.850 -4.342 1.732 1.00 0.13 H new ATOM 0 H5'' DT B 21 -6.696 -5.340 2.897 1.00 0.13 H new ATOM 0 H4' DT B 21 -4.323 -5.724 2.980 1.00 0.11 H new ATOM 0 H3' DT B 21 -5.763 -4.819 5.434 1.00 0.09 H new ATOM 0 H2' DT B 21 -3.968 -3.423 6.082 1.00 0.10 H new ATOM 0 H2'' DT B 21 -3.064 -4.912 6.275 1.00 0.10 H new ATOM 0 H1' DT B 21 -2.060 -4.756 4.187 1.00 0.09 H new ATOM 0 H3 DT B 21 1.069 -1.669 4.130 1.00 0.08 H new ATOM 0 H71 DT B 21 -1.957 1.619 5.598 1.00 0.13 H new ATOM 0 H72 DT B 21 -2.969 1.370 4.156 1.00 0.13 H new ATOM 0 H73 DT B 21 -3.487 0.720 5.729 1.00 0.13 H new ATOM 0 H6 DT B 21 -3.650 -1.511 4.924 1.00 0.08 H new ATOM 679 P DG B 22 -4.643 -7.185 6.701 1.00 0.05 P ATOM 680 OP1 DG B 22 -4.975 -8.626 6.591 1.00 0.09 O ATOM 681 OP2 DG B 22 -5.389 -6.328 7.650 1.00 0.09 O ATOM 682 O5' DG B 22 -3.067 -7.037 7.019 1.00 0.08 O ATOM 683 C5' DG B 22 -2.078 -7.834 6.345 1.00 0.07 C ATOM 684 C4' DG B 22 -0.652 -7.492 6.783 1.00 0.06 C ATOM 685 O4' DG B 22 -0.230 -6.155 6.428 1.00 0.08 O ATOM 686 C3' DG B 22 -0.468 -7.625 8.301 1.00 0.08 C ATOM 687 O3' DG B 22 0.523 -8.623 8.596 1.00 0.08 O ATOM 688 C2' DG B 22 -0.024 -6.214 8.657 1.00 0.10 C ATOM 689 C1' DG B 22 0.711 -5.743 7.430 1.00 0.08 C ATOM 690 N9 DG B 22 0.910 -4.283 7.413 1.00 0.08 N ATOM 691 C8 DG B 22 -0.033 -3.311 7.471 1.00 0.08 C ATOM 692 N7 DG B 22 0.471 -2.059 7.402 1.00 0.10 N ATOM 693 C5 DG B 22 1.811 -2.270 7.298 1.00 0.09 C ATOM 694 C6 DG B 22 2.877 -1.333 7.192 1.00 0.11 C ATOM 695 O6 DG B 22 2.849 -0.106 7.155 1.00 0.14 O ATOM 696 N1 DG B 22 4.098 -1.955 7.109 1.00 0.11 N ATOM 697 C2 DG B 22 4.299 -3.312 7.124 1.00 0.11 C ATOM 698 N2 DG B 22 5.552 -3.726 7.036 1.00 0.12 N ATOM 699 N3 DG B 22 3.317 -4.204 7.221 1.00 0.10 N ATOM 700 C4 DG B 22 2.101 -3.615 7.304 1.00 0.09 C ATOM 0 H5' DG B 22 -2.169 -7.687 5.269 1.00 0.07 H new ATOM 0 H5'' DG B 22 -2.271 -8.889 6.540 1.00 0.07 H new ATOM 0 H4' DG B 22 -0.040 -8.215 6.245 1.00 0.06 H new ATOM 0 H3' DG B 22 -1.345 -7.950 8.861 1.00 0.08 H new ATOM 0 H2' DG B 22 -0.876 -5.573 8.883 1.00 0.10 H new ATOM 0 H2'' DG B 22 0.621 -6.208 9.536 1.00 0.10 H new ATOM 0 H1' DG B 22 1.723 -6.135 7.325 1.00 0.08 H new ATOM 0 H8 DG B 22 -1.089 -3.518 7.564 1.00 0.08 H new ATOM 0 H1 DG B 22 4.923 -1.360 7.030 1.00 0.11 H new ATOM 0 H21 DG B 22 5.761 -4.724 7.042 1.00 0.12 H new ATOM 0 H22 DG B 22 6.309 -3.047 6.962 1.00 0.12 H new ATOM 712 P DC B 23 0.927 -9.054 10.100 1.00 0.06 P ATOM 713 OP1 DC B 23 1.542 -10.400 10.042 1.00 0.08 O ATOM 714 OP2 DC B 23 -0.239 -8.819 10.983 1.00 0.09 O ATOM 715 O5' DC B 23 2.073 -7.987 10.484 1.00 0.08 O ATOM 716 C5' DC B 23 3.406 -8.061 9.946 1.00 0.08 C ATOM 717 C4' DC B 23 4.289 -6.926 10.470 1.00 0.08 C ATOM 718 O4' DC B 23 3.766 -5.649 10.086 1.00 0.08 O ATOM 719 C3' DC B 23 4.382 -6.934 12.000 1.00 0.07 C ATOM 720 O3' DC B 23 5.712 -7.274 12.421 1.00 0.08 O ATOM 721 C2' DC B 23 4.026 -5.470 12.338 1.00 0.09 C ATOM 722 C1' DC B 23 4.253 -4.714 11.047 1.00 0.08 C ATOM 723 N1 DC B 23 3.470 -3.467 10.849 1.00 0.09 N ATOM 724 C2 DC B 23 4.143 -2.296 10.536 1.00 0.10 C ATOM 725 O2 DC B 23 5.366 -2.239 10.468 1.00 0.11 O ATOM 726 N3 DC B 23 3.417 -1.173 10.305 1.00 0.11 N ATOM 727 C4 DC B 23 2.086 -1.182 10.376 1.00 0.11 C ATOM 728 N4 DC B 23 1.439 -0.049 10.128 1.00 0.12 N ATOM 729 C5 DC B 23 1.370 -2.376 10.702 1.00 0.08 C ATOM 730 C6 DC B 23 2.105 -3.485 10.931 1.00 0.07 C ATOM 0 H5' DC B 23 3.363 -8.016 8.858 1.00 0.08 H new ATOM 0 H5'' DC B 23 3.852 -9.020 10.208 1.00 0.08 H new ATOM 0 H4' DC B 23 5.276 -7.088 10.036 1.00 0.08 H new ATOM 0 H3' DC B 23 3.737 -7.661 12.493 1.00 0.07 H new ATOM 0 H2' DC B 23 2.993 -5.381 12.673 1.00 0.09 H new ATOM 0 H2'' DC B 23 4.656 -5.084 13.140 1.00 0.09 H new ATOM 0 H1' DC B 23 5.293 -4.392 11.000 1.00 0.08 H new ATOM 0 H41 DC B 23 0.420 -0.023 10.174 1.00 0.12 H new ATOM 0 H42 DC B 23 1.961 0.795 9.891 1.00 0.12 H new ATOM 0 H5 DC B 23 0.292 -2.390 10.762 1.00 0.08 H new ATOM 0 H6 DC B 23 1.604 -4.407 11.185 1.00 0.07 H new ATOM 742 P DG B 24 6.108 -7.442 13.980 1.00 0.08 P ATOM 743 OP1 DG B 24 7.345 -8.253 14.062 1.00 0.07 O ATOM 744 OP2 DG B 24 4.905 -7.862 14.735 1.00 0.12 O ATOM 745 O5' DG B 24 6.459 -5.921 14.400 1.00 0.11 O ATOM 746 C5' DG B 24 7.723 -5.331 14.061 1.00 0.11 C ATOM 747 C4' DG B 24 7.820 -3.850 14.426 1.00 0.13 C ATOM 748 O4' DG B 24 6.911 -3.027 13.652 1.00 0.14 O ATOM 749 C3' DG B 24 7.529 -3.570 15.916 1.00 0.15 C ATOM 750 O3' DG B 24 8.463 -2.608 16.424 1.00 0.16 O ATOM 751 C2' DG B 24 6.162 -2.932 15.795 1.00 0.13 C ATOM 752 C1' DG B 24 6.327 -2.083 14.558 1.00 0.13 C ATOM 753 N9 DG B 24 5.129 -1.398 14.045 1.00 0.13 N ATOM 754 C8 DG B 24 3.844 -1.823 13.934 1.00 0.13 C ATOM 755 N7 DG B 24 3.013 -0.901 13.403 1.00 0.14 N ATOM 756 C5 DG B 24 3.829 0.160 13.175 1.00 0.14 C ATOM 757 C6 DG B 24 3.536 1.436 12.628 1.00 0.15 C ATOM 758 O6 DG B 24 2.474 1.895 12.217 1.00 0.16 O ATOM 759 N1 DG B 24 4.653 2.233 12.569 1.00 0.16 N ATOM 760 C2 DG B 24 5.909 1.871 12.976 1.00 0.15 C ATOM 761 N2 DG B 24 6.860 2.778 12.840 1.00 0.17 N ATOM 762 N3 DG B 24 6.207 0.681 13.488 1.00 0.14 N ATOM 763 C4 DG B 24 5.119 -0.121 13.558 1.00 0.13 C ATOM 0 H5' DG B 24 7.893 -5.445 12.990 1.00 0.11 H new ATOM 0 H5'' DG B 24 8.518 -5.876 14.570 1.00 0.11 H new ATOM 0 H4' DG B 24 8.854 -3.591 14.199 1.00 0.13 H new ATOM 0 H3' DG B 24 7.589 -4.437 16.574 1.00 0.15 H new ATOM 0 H2' DG B 24 5.373 -3.675 15.679 1.00 0.13 H new ATOM 0 H2'' DG B 24 5.911 -2.334 16.671 1.00 0.13 H new ATOM 0 HO3' DG B 24 8.272 -2.434 17.369 1.00 0.16 H new ATOM 0 H1' DG B 24 6.932 -1.196 14.747 1.00 0.13 H new ATOM 0 H8 DG B 24 3.518 -2.806 14.241 1.00 0.13 H new ATOM 0 H1 DG B 24 4.537 3.173 12.190 1.00 0.16 H new ATOM 0 H21 DG B 24 7.815 2.563 13.127 1.00 0.17 H new ATOM 0 H22 DG B 24 6.639 3.693 12.448 1.00 0.17 H new TER 776 DG B 24