USER MOD reduce.3.24.130724 H: found=0, std=0, add=203, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 203 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 -48:sc= -0.012 USER MOD Single : A 2 DT C7 :methyl 150:sc= -0.183 (180deg=-0.183) USER MOD Single : A 18 DT C7 :methyl -30:sc= -0.684 (180deg=-3.57!) USER MOD Single : A 18 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 7.179 3.063 3.409 1.00 0.37 O ATOM 2 C5' DT A 1 6.688 3.602 4.638 1.00 0.35 C ATOM 3 C4' DT A 1 5.160 3.605 4.672 1.00 0.20 C ATOM 4 O4' DT A 1 4.676 2.263 4.542 1.00 0.26 O ATOM 5 C3' DT A 1 4.561 4.180 5.958 1.00 0.20 C ATOM 6 O3' DT A 1 3.462 5.032 5.629 1.00 0.20 O ATOM 7 C2' DT A 1 4.058 2.958 6.712 1.00 0.22 C ATOM 8 C1' DT A 1 3.711 2.024 5.567 1.00 0.26 C ATOM 9 N1 DT A 1 3.769 0.592 5.914 1.00 0.30 N ATOM 10 C2 DT A 1 2.606 -0.143 5.786 1.00 0.49 C ATOM 11 O2 DT A 1 1.552 0.362 5.404 1.00 0.67 O ATOM 12 N3 DT A 1 2.695 -1.483 6.114 1.00 0.54 N ATOM 13 C4 DT A 1 3.832 -2.140 6.553 1.00 0.49 C ATOM 14 O4 DT A 1 3.799 -3.340 6.818 1.00 0.59 O ATOM 15 C5 DT A 1 4.999 -1.292 6.656 1.00 0.45 C ATOM 16 C7 DT A 1 6.321 -1.888 7.125 1.00 0.66 C ATOM 17 C6 DT A 1 4.935 0.018 6.341 1.00 0.33 C ATOM 0 H5' DT A 1 7.059 4.619 4.765 1.00 0.35 H new ATOM 0 H5'' DT A 1 7.071 3.016 5.473 1.00 0.35 H new ATOM 0 H4' DT A 1 4.852 4.245 3.845 1.00 0.20 H new ATOM 0 H3' DT A 1 5.274 4.767 6.537 1.00 0.20 H new ATOM 0 H2' DT A 1 4.820 2.538 7.369 1.00 0.22 H new ATOM 0 H2'' DT A 1 3.192 3.186 7.333 1.00 0.22 H new ATOM 0 HO5' DT A 1 6.713 2.224 3.211 1.00 0.37 H new ATOM 0 H1' DT A 1 2.682 2.229 5.271 1.00 0.26 H new ATOM 0 H3 DT A 1 1.845 -2.039 6.024 1.00 0.54 H new ATOM 0 H71 DT A 1 7.148 -1.344 6.668 1.00 0.66 H new ATOM 0 H72 DT A 1 6.391 -1.810 8.210 1.00 0.66 H new ATOM 0 H73 DT A 1 6.371 -2.937 6.833 1.00 0.66 H new ATOM 0 H6 DT A 1 5.823 0.627 6.428 1.00 0.33 H new ATOM 31 P DT A 2 3.034 6.228 6.618 1.00 0.29 P ATOM 32 OP1 DT A 2 4.161 7.183 6.705 1.00 0.43 O ATOM 33 OP2 DT A 2 2.475 5.630 7.852 1.00 0.35 O ATOM 34 O5' DT A 2 1.835 6.934 5.811 1.00 0.25 O ATOM 35 C5' DT A 2 2.089 7.627 4.587 1.00 0.24 C ATOM 36 C4' DT A 2 0.793 8.166 3.977 1.00 0.20 C ATOM 37 O4' DT A 2 -0.155 7.098 3.842 1.00 0.17 O ATOM 38 C3' DT A 2 0.121 9.236 4.832 1.00 0.21 C ATOM 39 O3' DT A 2 -0.598 10.169 4.005 1.00 0.22 O ATOM 40 C2' DT A 2 -0.848 8.439 5.689 1.00 0.22 C ATOM 41 C1' DT A 2 -1.263 7.335 4.728 1.00 0.19 C ATOM 42 N1 DT A 2 -1.605 6.050 5.376 1.00 0.20 N ATOM 43 C2 DT A 2 -2.918 5.628 5.292 1.00 0.20 C ATOM 44 O2 DT A 2 -3.783 6.294 4.725 1.00 0.21 O ATOM 45 N3 DT A 2 -3.207 4.412 5.883 1.00 0.21 N ATOM 46 C4 DT A 2 -2.307 3.592 6.541 1.00 0.22 C ATOM 47 O4 DT A 2 -2.672 2.526 7.030 1.00 0.25 O ATOM 48 C5 DT A 2 -0.959 4.112 6.580 1.00 0.22 C ATOM 49 C7 DT A 2 0.139 3.302 7.261 1.00 0.25 C ATOM 50 C6 DT A 2 -0.652 5.297 6.014 1.00 0.22 C ATOM 0 H5' DT A 2 2.575 6.955 3.880 1.00 0.24 H new ATOM 0 H5'' DT A 2 2.779 8.451 4.769 1.00 0.24 H new ATOM 0 H4' DT A 2 1.075 8.604 3.019 1.00 0.20 H new ATOM 0 H3' DT A 2 0.831 9.824 5.414 1.00 0.21 H new ATOM 0 H2' DT A 2 -0.373 8.044 6.587 1.00 0.22 H new ATOM 0 H2'' DT A 2 -1.697 9.040 6.015 1.00 0.22 H new ATOM 0 H1' DT A 2 -2.166 7.677 4.223 1.00 0.19 H new ATOM 0 H3 DT A 2 -4.173 4.089 5.829 1.00 0.21 H new ATOM 0 H71 DT A 2 1.095 3.510 6.781 1.00 0.25 H new ATOM 0 H72 DT A 2 0.194 3.577 8.314 1.00 0.25 H new ATOM 0 H73 DT A 2 -0.087 2.239 7.175 1.00 0.25 H new ATOM 0 H6 DT A 2 0.364 5.660 6.064 1.00 0.22 H new ATOM 63 P DG A 3 -1.068 9.801 2.503 1.00 0.23 P ATOM 64 OP1 DG A 3 -1.779 10.972 1.940 1.00 0.27 O ATOM 65 OP2 DG A 3 -1.734 8.480 2.532 1.00 0.24 O ATOM 66 O5' DG A 3 0.333 9.644 1.722 1.00 0.21 O ATOM 67 C5' DG A 3 1.306 10.694 1.747 1.00 0.23 C ATOM 68 C4' DG A 3 2.582 10.298 1.004 1.00 0.18 C ATOM 69 O4' DG A 3 2.978 8.982 1.402 1.00 0.17 O ATOM 70 C3' DG A 3 2.439 10.271 -0.512 1.00 0.19 C ATOM 71 O3' DG A 3 3.695 10.591 -1.119 1.00 0.19 O ATOM 72 C2' DG A 3 2.074 8.828 -0.811 1.00 0.20 C ATOM 73 C1' DG A 3 2.802 8.077 0.301 1.00 0.17 C ATOM 74 N9 DG A 3 2.065 6.904 0.806 1.00 0.17 N ATOM 75 C8 DG A 3 0.728 6.785 1.073 1.00 0.19 C ATOM 76 N7 DG A 3 0.379 5.613 1.522 1.00 0.21 N ATOM 77 C5 DG A 3 1.571 4.900 1.555 1.00 0.19 C ATOM 78 C6 DG A 3 1.819 3.559 1.957 1.00 0.22 C ATOM 79 O6 DG A 3 1.016 2.727 2.372 1.00 0.25 O ATOM 80 N1 DG A 3 3.160 3.230 1.834 1.00 0.21 N ATOM 81 C2 DG A 3 4.146 4.083 1.380 1.00 0.19 C ATOM 82 N2 DG A 3 5.381 3.586 1.329 1.00 0.21 N ATOM 83 N3 DG A 3 3.916 5.345 1.003 1.00 0.18 N ATOM 84 C4 DG A 3 2.611 5.682 1.116 1.00 0.17 C ATOM 0 H5' DG A 3 1.548 10.942 2.781 1.00 0.23 H new ATOM 0 H5'' DG A 3 0.885 11.592 1.295 1.00 0.23 H new ATOM 0 H4' DG A 3 3.315 11.061 1.264 1.00 0.18 H new ATOM 0 H3' DG A 3 1.705 10.983 -0.888 1.00 0.19 H new ATOM 0 H2' DG A 3 0.997 8.664 -0.776 1.00 0.20 H new ATOM 0 H2'' DG A 3 2.411 8.519 -1.800 1.00 0.20 H new ATOM 0 H1' DG A 3 3.742 7.718 -0.118 1.00 0.17 H new ATOM 0 H8 DG A 3 0.025 7.591 0.925 1.00 0.19 H new ATOM 0 H1 DG A 3 3.440 2.286 2.099 1.00 0.21 H new ATOM 0 H21 DG A 3 6.152 4.168 1.002 1.00 0.21 H new ATOM 0 H22 DG A 3 5.556 2.623 1.617 1.00 0.21 H new ATOM 96 P DG A 4 3.936 10.321 -2.689 1.00 0.22 P ATOM 97 OP1 DG A 4 4.990 11.246 -3.163 1.00 0.27 O ATOM 98 OP2 DG A 4 2.618 10.299 -3.361 1.00 0.27 O ATOM 99 O5' DG A 4 4.533 8.825 -2.704 1.00 0.21 O ATOM 100 C5' DG A 4 5.884 8.579 -2.301 1.00 0.18 C ATOM 101 C4' DG A 4 6.297 7.134 -2.568 1.00 0.18 C ATOM 102 O4' DG A 4 5.476 6.248 -1.805 1.00 0.18 O ATOM 103 C3' DG A 4 6.173 6.712 -4.038 1.00 0.17 C ATOM 104 O3' DG A 4 7.443 6.248 -4.509 1.00 0.22 O ATOM 105 C2' DG A 4 5.170 5.560 -4.031 1.00 0.17 C ATOM 106 C1' DG A 4 5.242 5.085 -2.589 1.00 0.16 C ATOM 107 N9 DG A 4 4.004 4.449 -2.098 1.00 0.16 N ATOM 108 C8 DG A 4 2.779 5.018 -1.878 1.00 0.19 C ATOM 109 N7 DG A 4 1.880 4.186 -1.434 1.00 0.20 N ATOM 110 C5 DG A 4 2.557 2.975 -1.350 1.00 0.18 C ATOM 111 C6 DG A 4 2.089 1.701 -0.929 1.00 0.19 C ATOM 112 O6 DG A 4 0.965 1.394 -0.538 1.00 0.24 O ATOM 113 N1 DG A 4 3.093 0.743 -0.997 1.00 0.16 N ATOM 114 C2 DG A 4 4.385 0.980 -1.418 1.00 0.14 C ATOM 115 N2 DG A 4 5.209 -0.069 -1.416 1.00 0.15 N ATOM 116 N3 DG A 4 4.826 2.179 -1.816 1.00 0.14 N ATOM 117 C4 DG A 4 3.860 3.125 -1.756 1.00 0.15 C ATOM 0 H5' DG A 4 5.993 8.799 -1.239 1.00 0.18 H new ATOM 0 H5'' DG A 4 6.552 9.254 -2.836 1.00 0.18 H new ATOM 0 H4' DG A 4 7.348 7.076 -2.285 1.00 0.18 H new ATOM 0 H3' DG A 4 5.856 7.531 -4.684 1.00 0.17 H new ATOM 0 H2' DG A 4 4.167 5.891 -4.302 1.00 0.17 H new ATOM 0 H2'' DG A 4 5.447 4.774 -4.734 1.00 0.17 H new ATOM 0 H1' DG A 4 6.023 4.328 -2.519 1.00 0.16 H new ATOM 0 H8 DG A 4 2.576 6.064 -2.057 1.00 0.19 H new ATOM 0 H1 DG A 4 2.857 -0.208 -0.714 1.00 0.16 H new ATOM 0 H21 DG A 4 6.177 0.043 -1.717 1.00 0.15 H new ATOM 0 H22 DG A 4 4.871 -0.983 -1.114 1.00 0.15 H new ATOM 129 P DG A 5 7.590 5.612 -5.982 1.00 0.22 P ATOM 130 OP1 DG A 5 8.931 5.954 -6.504 1.00 0.29 O ATOM 131 OP2 DG A 5 6.383 5.967 -6.761 1.00 0.24 O ATOM 132 O5' DG A 5 7.551 4.029 -5.688 1.00 0.24 O ATOM 133 C5' DG A 5 8.620 3.398 -4.978 1.00 0.26 C ATOM 134 C4' DG A 5 8.461 1.880 -4.951 1.00 0.21 C ATOM 135 O4' DG A 5 7.220 1.535 -4.327 1.00 0.21 O ATOM 136 C3' DG A 5 8.466 1.229 -6.339 1.00 0.22 C ATOM 137 O3' DG A 5 9.359 0.111 -6.331 1.00 0.26 O ATOM 138 C2' DG A 5 7.034 0.741 -6.531 1.00 0.21 C ATOM 139 C1' DG A 5 6.605 0.507 -5.096 1.00 0.19 C ATOM 140 N9 DG A 5 5.150 0.585 -4.872 1.00 0.18 N ATOM 141 C8 DG A 5 4.313 1.656 -5.035 1.00 0.20 C ATOM 142 N7 DG A 5 3.071 1.410 -4.725 1.00 0.20 N ATOM 143 C5 DG A 5 3.082 0.077 -4.330 1.00 0.17 C ATOM 144 C6 DG A 5 2.014 -0.747 -3.882 1.00 0.18 C ATOM 145 O6 DG A 5 0.830 -0.448 -3.740 1.00 0.21 O ATOM 146 N1 DG A 5 2.454 -2.031 -3.584 1.00 0.16 N ATOM 147 C2 DG A 5 3.760 -2.468 -3.704 1.00 0.17 C ATOM 148 N2 DG A 5 3.994 -3.738 -3.373 1.00 0.20 N ATOM 149 N3 DG A 5 4.762 -1.691 -4.123 1.00 0.18 N ATOM 150 C4 DG A 5 4.351 -0.437 -4.418 1.00 0.17 C ATOM 0 H5' DG A 5 8.654 3.779 -3.957 1.00 0.26 H new ATOM 0 H5'' DG A 5 9.570 3.656 -5.446 1.00 0.26 H new ATOM 0 H4' DG A 5 9.323 1.507 -4.398 1.00 0.21 H new ATOM 0 H3' DG A 5 8.786 1.909 -7.128 1.00 0.22 H new ATOM 0 H2' DG A 5 6.411 1.482 -7.031 1.00 0.21 H new ATOM 0 H2'' DG A 5 6.987 -0.170 -7.128 1.00 0.21 H new ATOM 0 H1' DG A 5 6.901 -0.505 -4.819 1.00 0.19 H new ATOM 0 H8 DG A 5 4.651 2.619 -5.389 1.00 0.20 H new ATOM 0 H1 DG A 5 1.761 -2.702 -3.252 1.00 0.16 H new ATOM 0 H21 DG A 5 4.938 -4.117 -3.441 1.00 0.20 H new ATOM 0 H22 DG A 5 3.229 -4.331 -3.052 1.00 0.20 H new ATOM 162 P DG A 6 10.933 0.327 -6.065 1.00 0.28 P ATOM 163 OP1 DG A 6 11.475 1.174 -7.151 1.00 0.33 O ATOM 164 OP2 DG A 6 11.540 -0.993 -5.784 1.00 0.40 O ATOM 165 O5' DG A 6 10.943 1.186 -4.703 1.00 0.23 O ATOM 166 C5' DG A 6 11.729 2.377 -4.605 1.00 0.19 C ATOM 167 C4' DG A 6 13.134 2.082 -4.084 1.00 0.19 C ATOM 168 O4' DG A 6 13.930 3.270 -4.152 1.00 0.24 O ATOM 169 C3' DG A 6 13.168 1.597 -2.629 1.00 0.24 C ATOM 170 O3' DG A 6 13.923 0.382 -2.549 1.00 0.21 O ATOM 171 C2' DG A 6 13.895 2.706 -1.873 1.00 0.37 C ATOM 172 C1' DG A 6 14.728 3.329 -2.978 1.00 0.29 C ATOM 173 N9 DG A 6 15.089 4.740 -2.744 1.00 0.33 N ATOM 174 C8 DG A 6 14.298 5.764 -2.295 1.00 0.40 C ATOM 175 N7 DG A 6 14.917 6.907 -2.194 1.00 0.43 N ATOM 176 C5 DG A 6 16.215 6.622 -2.606 1.00 0.41 C ATOM 177 C6 DG A 6 17.347 7.476 -2.708 1.00 0.48 C ATOM 178 O6 DG A 6 17.423 8.675 -2.450 1.00 0.51 O ATOM 179 N1 DG A 6 18.463 6.789 -3.165 1.00 0.57 N ATOM 180 C2 DG A 6 18.491 5.447 -3.485 1.00 0.59 C ATOM 181 N2 DG A 6 19.659 4.964 -3.908 1.00 0.75 N ATOM 182 N3 DG A 6 17.428 4.642 -3.389 1.00 0.48 N ATOM 183 C4 DG A 6 16.329 5.296 -2.945 1.00 0.39 C ATOM 0 H5' DG A 6 11.235 3.086 -3.940 1.00 0.19 H new ATOM 0 H5'' DG A 6 11.796 2.851 -5.584 1.00 0.19 H new ATOM 0 H4' DG A 6 13.520 1.283 -4.717 1.00 0.19 H new ATOM 0 H3' DG A 6 12.174 1.400 -2.227 1.00 0.24 H new ATOM 0 H2' DG A 6 13.203 3.421 -1.428 1.00 0.37 H new ATOM 0 H2'' DG A 6 14.513 2.315 -1.065 1.00 0.37 H new ATOM 0 H1' DG A 6 15.668 2.781 -3.044 1.00 0.29 H new ATOM 0 H8 DG A 6 13.255 5.636 -2.047 1.00 0.40 H new ATOM 0 H1 DG A 6 19.329 7.317 -3.273 1.00 0.57 H new ATOM 0 H21 DG A 6 19.743 3.979 -4.160 1.00 0.75 H new ATOM 0 H22 DG A 6 20.469 5.579 -3.980 1.00 0.75 H new ATOM 195 P DG A 7 14.168 -0.345 -1.132 1.00 0.27 P ATOM 196 OP1 DG A 7 14.253 0.697 -0.085 1.00 0.29 O ATOM 197 OP2 DG A 7 15.273 -1.316 -1.293 1.00 0.33 O ATOM 198 O5' DG A 7 12.802 -1.168 -0.908 1.00 0.26 O ATOM 199 C5' DG A 7 11.670 -0.548 -0.291 1.00 0.24 C ATOM 200 C4' DG A 7 10.782 -1.571 0.409 1.00 0.21 C ATOM 201 O4' DG A 7 9.757 -0.899 1.127 1.00 0.21 O ATOM 202 C3' DG A 7 10.090 -2.550 -0.543 1.00 0.19 C ATOM 203 O3' DG A 7 10.648 -3.857 -0.372 1.00 0.18 O ATOM 204 C2' DG A 7 8.620 -2.554 -0.111 1.00 0.23 C ATOM 205 C1' DG A 7 8.641 -1.774 1.197 1.00 0.21 C ATOM 206 N9 DG A 7 7.445 -0.947 1.424 1.00 0.21 N ATOM 207 C8 DG A 7 7.279 0.394 1.203 1.00 0.23 C ATOM 208 N7 DG A 7 6.090 0.836 1.500 1.00 0.25 N ATOM 209 C5 DG A 7 5.416 -0.295 1.950 1.00 0.24 C ATOM 210 C6 DG A 7 4.080 -0.433 2.414 1.00 0.26 C ATOM 211 O6 DG A 7 3.214 0.432 2.517 1.00 0.29 O ATOM 212 N1 DG A 7 3.800 -1.745 2.773 1.00 0.26 N ATOM 213 C2 DG A 7 4.692 -2.794 2.698 1.00 0.24 C ATOM 214 N2 DG A 7 4.238 -3.985 3.090 1.00 0.25 N ATOM 215 N3 DG A 7 5.949 -2.665 2.262 1.00 0.23 N ATOM 216 C4 DG A 7 6.239 -1.392 1.907 1.00 0.22 C ATOM 0 H5' DG A 7 11.089 -0.017 -1.045 1.00 0.24 H new ATOM 0 H5'' DG A 7 12.010 0.194 0.431 1.00 0.24 H new ATOM 0 H4' DG A 7 11.448 -2.140 1.058 1.00 0.21 H new ATOM 0 H3' DG A 7 10.210 -2.268 -1.589 1.00 0.19 H new ATOM 0 H2' DG A 7 7.980 -2.078 -0.854 1.00 0.23 H new ATOM 0 H2'' DG A 7 8.244 -3.567 0.030 1.00 0.23 H new ATOM 0 H1' DG A 7 8.685 -2.495 2.013 1.00 0.21 H new ATOM 0 H8 DG A 7 8.063 1.028 0.817 1.00 0.23 H new ATOM 0 H1 DG A 7 2.862 -1.948 3.119 1.00 0.26 H new ATOM 0 H21 DG A 7 4.850 -4.800 3.058 1.00 0.25 H new ATOM 0 H22 DG A 7 3.278 -4.081 3.422 1.00 0.25 H new ATOM 228 P DG A 8 10.400 -4.997 -1.481 1.00 0.18 P ATOM 229 OP1 DG A 8 11.388 -6.077 -1.267 1.00 0.24 O ATOM 230 OP2 DG A 8 10.301 -4.341 -2.803 1.00 0.21 O ATOM 231 O5' DG A 8 8.943 -5.563 -1.091 1.00 0.15 O ATOM 232 C5' DG A 8 8.806 -6.608 -0.124 1.00 0.16 C ATOM 233 C4' DG A 8 7.367 -7.110 -0.041 1.00 0.15 C ATOM 234 O4' DG A 8 6.502 -6.042 0.351 1.00 0.18 O ATOM 235 C3' DG A 8 6.826 -7.665 -1.364 1.00 0.14 C ATOM 236 O3' DG A 8 6.396 -9.017 -1.171 1.00 0.20 O ATOM 237 C2' DG A 8 5.623 -6.783 -1.694 1.00 0.16 C ATOM 238 C1' DG A 8 5.268 -6.218 -0.333 1.00 0.16 C ATOM 239 N9 DG A 8 4.579 -4.913 -0.376 1.00 0.16 N ATOM 240 C8 DG A 8 5.067 -3.698 -0.779 1.00 0.21 C ATOM 241 N7 DG A 8 4.202 -2.726 -0.695 1.00 0.23 N ATOM 242 C5 DG A 8 3.056 -3.340 -0.201 1.00 0.17 C ATOM 243 C6 DG A 8 1.781 -2.784 0.099 1.00 0.17 C ATOM 244 O6 DG A 8 1.413 -1.617 -0.018 1.00 0.21 O ATOM 245 N1 DG A 8 0.904 -3.749 0.577 1.00 0.14 N ATOM 246 C2 DG A 8 1.212 -5.084 0.746 1.00 0.12 C ATOM 247 N2 DG A 8 0.238 -5.862 1.217 1.00 0.14 N ATOM 248 N3 DG A 8 2.410 -5.608 0.465 1.00 0.12 N ATOM 249 C4 DG A 8 3.278 -4.680 -0.002 1.00 0.14 C ATOM 0 H5' DG A 8 9.122 -6.244 0.854 1.00 0.16 H new ATOM 0 H5'' DG A 8 9.466 -7.435 -0.385 1.00 0.16 H new ATOM 0 H4' DG A 8 7.384 -7.920 0.688 1.00 0.15 H new ATOM 0 H3' DG A 8 7.573 -7.660 -2.158 1.00 0.14 H new ATOM 0 H2' DG A 8 5.875 -5.999 -2.409 1.00 0.16 H new ATOM 0 H2'' DG A 8 4.802 -7.356 -2.125 1.00 0.16 H new ATOM 0 H1' DG A 8 4.577 -6.908 0.152 1.00 0.16 H new ATOM 0 H8 DG A 8 6.077 -3.558 -1.134 1.00 0.21 H new ATOM 0 H1 DG A 8 -0.039 -3.448 0.822 1.00 0.14 H new ATOM 0 H21 DG A 8 0.406 -6.857 1.363 1.00 0.14 H new ATOM 0 H22 DG A 8 -0.675 -5.462 1.432 1.00 0.14 H new ATOM 261 P DG A 9 5.652 -9.813 -2.355 1.00 0.21 P ATOM 262 OP1 DG A 9 5.850 -11.264 -2.136 1.00 0.29 O ATOM 263 OP2 DG A 9 6.048 -9.202 -3.643 1.00 0.21 O ATOM 264 O5' DG A 9 4.101 -9.471 -2.092 1.00 0.24 O ATOM 265 C5' DG A 9 3.406 -10.062 -0.990 1.00 0.25 C ATOM 266 C4' DG A 9 1.906 -9.792 -1.063 1.00 0.19 C ATOM 267 O4' DG A 9 1.661 -8.387 -0.959 1.00 0.19 O ATOM 268 C3' DG A 9 1.252 -10.267 -2.366 1.00 0.15 C ATOM 269 O3' DG A 9 0.175 -11.158 -2.063 1.00 0.18 O ATOM 270 C2' DG A 9 0.700 -8.997 -3.010 1.00 0.14 C ATOM 271 C1' DG A 9 0.567 -8.077 -1.811 1.00 0.14 C ATOM 272 N9 DG A 9 0.630 -6.639 -2.136 1.00 0.13 N ATOM 273 C8 DG A 9 1.673 -5.916 -2.659 1.00 0.16 C ATOM 274 N7 DG A 9 1.406 -4.652 -2.832 1.00 0.16 N ATOM 275 C5 DG A 9 0.093 -4.523 -2.392 1.00 0.12 C ATOM 276 C6 DG A 9 -0.739 -3.372 -2.341 1.00 0.14 C ATOM 277 O6 DG A 9 -0.469 -2.222 -2.680 1.00 0.17 O ATOM 278 N1 DG A 9 -1.995 -3.676 -1.830 1.00 0.13 N ATOM 279 C2 DG A 9 -2.399 -4.932 -1.420 1.00 0.13 C ATOM 280 N2 DG A 9 -3.643 -5.035 -0.956 1.00 0.17 N ATOM 281 N3 DG A 9 -1.616 -6.012 -1.469 1.00 0.12 N ATOM 282 C4 DG A 9 -0.390 -5.734 -1.965 1.00 0.11 C ATOM 0 H5' DG A 9 3.802 -9.667 -0.055 1.00 0.25 H new ATOM 0 H5'' DG A 9 3.583 -11.138 -0.982 1.00 0.25 H new ATOM 0 H4' DG A 9 1.470 -10.354 -0.237 1.00 0.19 H new ATOM 0 H3' DG A 9 1.951 -10.794 -3.016 1.00 0.15 H new ATOM 0 H2' DG A 9 1.376 -8.593 -3.763 1.00 0.14 H new ATOM 0 H2'' DG A 9 -0.257 -9.170 -3.501 1.00 0.14 H new ATOM 0 H1' DG A 9 -0.413 -8.240 -1.364 1.00 0.14 H new ATOM 0 H8 DG A 9 2.629 -6.355 -2.905 1.00 0.16 H new ATOM 0 H1 DG A 9 -2.669 -2.915 -1.752 1.00 0.13 H new ATOM 0 H21 DG A 9 -3.996 -5.938 -0.639 1.00 0.17 H new ATOM 0 H22 DG A 9 -4.243 -4.211 -0.918 1.00 0.17 H new ATOM 294 P DG A 10 0.463 -12.706 -1.728 1.00 0.21 P ATOM 295 OP1 DG A 10 1.690 -13.115 -2.451 1.00 0.32 O ATOM 296 OP2 DG A 10 -0.793 -13.464 -1.923 1.00 0.33 O ATOM 297 O5' DG A 10 0.795 -12.679 -0.152 1.00 0.15 O ATOM 298 C5' DG A 10 1.115 -13.891 0.534 1.00 0.16 C ATOM 299 C4' DG A 10 0.974 -13.744 2.047 1.00 0.22 C ATOM 300 O4' DG A 10 1.205 -15.013 2.672 1.00 0.30 O ATOM 301 C3' DG A 10 1.955 -12.749 2.676 1.00 0.20 C ATOM 302 O3' DG A 10 1.270 -11.966 3.661 1.00 0.22 O ATOM 303 C2' DG A 10 2.987 -13.636 3.353 1.00 0.26 C ATOM 304 C1' DG A 10 2.128 -14.826 3.742 1.00 0.27 C ATOM 305 N9 DG A 10 2.861 -16.096 3.936 1.00 0.35 N ATOM 306 C8 DG A 10 4.065 -16.498 3.408 1.00 0.53 C ATOM 307 N7 DG A 10 4.431 -17.693 3.776 1.00 0.61 N ATOM 308 C5 DG A 10 3.401 -18.120 4.607 1.00 0.48 C ATOM 309 C6 DG A 10 3.244 -19.347 5.307 1.00 0.55 C ATOM 310 O6 DG A 10 4.002 -20.315 5.327 1.00 0.69 O ATOM 311 N1 DG A 10 2.061 -19.371 6.032 1.00 0.51 N ATOM 312 C2 DG A 10 1.142 -18.346 6.081 1.00 0.45 C ATOM 313 N2 DG A 10 0.062 -18.556 6.835 1.00 0.60 N ATOM 314 N3 DG A 10 1.287 -17.191 5.424 1.00 0.34 N ATOM 315 C4 DG A 10 2.436 -17.149 4.710 1.00 0.34 C ATOM 0 H5' DG A 10 2.136 -14.186 0.292 1.00 0.16 H new ATOM 0 H5'' DG A 10 0.461 -14.690 0.184 1.00 0.16 H new ATOM 0 H4' DG A 10 -0.036 -13.368 2.210 1.00 0.22 H new ATOM 0 H3' DG A 10 2.395 -12.062 1.953 1.00 0.20 H new ATOM 0 H2' DG A 10 3.798 -13.914 2.680 1.00 0.26 H new ATOM 0 H2'' DG A 10 3.442 -13.154 4.218 1.00 0.26 H new ATOM 0 H1' DG A 10 1.673 -14.599 4.706 1.00 0.27 H new ATOM 0 H8 DG A 10 4.654 -15.879 2.748 1.00 0.53 H new ATOM 0 H1 DG A 10 1.856 -20.213 6.570 1.00 0.51 H new ATOM 0 H21 DG A 10 -0.655 -17.834 6.912 1.00 0.60 H new ATOM 0 H22 DG A 10 -0.047 -19.438 7.335 1.00 0.60 H new ATOM 327 P DG A 11 2.059 -10.862 4.529 1.00 0.26 P ATOM 328 OP1 DG A 11 3.482 -11.260 4.606 1.00 0.32 O ATOM 329 OP2 DG A 11 1.294 -10.619 5.772 1.00 0.32 O ATOM 330 O5' DG A 11 1.953 -9.545 3.609 1.00 0.28 O ATOM 331 C5' DG A 11 0.673 -9.007 3.266 1.00 0.27 C ATOM 332 C4' DG A 11 -0.306 -9.109 4.431 1.00 0.23 C ATOM 333 O4' DG A 11 0.173 -8.334 5.532 1.00 0.25 O ATOM 334 C3' DG A 11 -1.716 -8.619 4.097 1.00 0.23 C ATOM 335 O3' DG A 11 -2.642 -9.691 4.292 1.00 0.24 O ATOM 336 C2' DG A 11 -2.008 -7.508 5.105 1.00 0.23 C ATOM 337 C1' DG A 11 -0.633 -7.168 5.658 1.00 0.23 C ATOM 338 N9 DG A 11 0.047 -6.063 4.957 1.00 0.24 N ATOM 339 C8 DG A 11 1.316 -6.021 4.444 1.00 0.26 C ATOM 340 N7 DG A 11 1.631 -4.876 3.906 1.00 0.27 N ATOM 341 C5 DG A 11 0.489 -4.102 4.075 1.00 0.25 C ATOM 342 C6 DG A 11 0.234 -2.756 3.690 1.00 0.27 C ATOM 343 O6 DG A 11 0.986 -1.972 3.115 1.00 0.30 O ATOM 344 N1 DG A 11 -1.047 -2.359 4.047 1.00 0.28 N ATOM 345 C2 DG A 11 -1.970 -3.152 4.694 1.00 0.26 C ATOM 346 N2 DG A 11 -3.152 -2.593 4.954 1.00 0.31 N ATOM 347 N3 DG A 11 -1.733 -4.416 5.057 1.00 0.24 N ATOM 348 C4 DG A 11 -0.488 -4.821 4.716 1.00 0.24 C ATOM 0 H5' DG A 11 0.272 -9.541 2.404 1.00 0.27 H new ATOM 0 H5'' DG A 11 0.783 -7.963 2.972 1.00 0.27 H new ATOM 0 H4' DG A 11 -0.369 -10.170 4.673 1.00 0.23 H new ATOM 0 H3' DG A 11 -1.800 -8.271 3.068 1.00 0.23 H new ATOM 0 H2' DG A 11 -2.475 -6.646 4.629 1.00 0.23 H new ATOM 0 H2'' DG A 11 -2.685 -7.845 5.890 1.00 0.23 H new ATOM 0 H1' DG A 11 -0.770 -6.842 6.689 1.00 0.23 H new ATOM 0 H8 DG A 11 1.994 -6.860 4.482 1.00 0.26 H new ATOM 0 H1 DG A 11 -1.327 -1.407 3.812 1.00 0.28 H new ATOM 0 H21 DG A 11 -3.876 -3.130 5.431 1.00 0.31 H new ATOM 0 H22 DG A 11 -3.332 -1.628 4.676 1.00 0.31 H new ATOM 360 P DG A 12 -3.713 -10.063 3.152 1.00 0.26 P ATOM 361 OP1 DG A 12 -4.581 -11.147 3.665 1.00 0.27 O ATOM 362 OP2 DG A 12 -2.986 -10.241 1.876 1.00 0.36 O ATOM 363 O5' DG A 12 -4.593 -8.719 3.047 1.00 0.25 O ATOM 364 C5' DG A 12 -5.496 -8.357 4.096 1.00 0.21 C ATOM 365 C4' DG A 12 -6.187 -7.030 3.800 1.00 0.21 C ATOM 366 O4' DG A 12 -5.212 -5.985 3.744 1.00 0.26 O ATOM 367 C3' DG A 12 -6.950 -7.017 2.473 1.00 0.20 C ATOM 368 O3' DG A 12 -8.290 -6.564 2.695 1.00 0.18 O ATOM 369 C2' DG A 12 -6.199 -6.012 1.604 1.00 0.22 C ATOM 370 C1' DG A 12 -5.523 -5.136 2.645 1.00 0.20 C ATOM 371 N9 DG A 12 -4.263 -4.515 2.187 1.00 0.22 N ATOM 372 C8 DG A 12 -3.034 -5.099 1.998 1.00 0.23 C ATOM 373 N7 DG A 12 -2.116 -4.273 1.581 1.00 0.24 N ATOM 374 C5 DG A 12 -2.778 -3.053 1.487 1.00 0.26 C ATOM 375 C6 DG A 12 -2.286 -1.782 1.083 1.00 0.31 C ATOM 376 O6 DG A 12 -1.148 -1.483 0.724 1.00 0.35 O ATOM 377 N1 DG A 12 -3.281 -0.814 1.130 1.00 0.34 N ATOM 378 C2 DG A 12 -4.587 -1.040 1.517 1.00 0.32 C ATOM 379 N2 DG A 12 -5.402 0.014 1.500 1.00 0.37 N ATOM 380 N3 DG A 12 -5.050 -2.236 1.895 1.00 0.28 N ATOM 381 C4 DG A 12 -4.093 -3.191 1.856 1.00 0.25 C ATOM 0 H5' DG A 12 -4.952 -8.284 5.038 1.00 0.21 H new ATOM 0 H5'' DG A 12 -6.245 -9.139 4.220 1.00 0.21 H new ATOM 0 H4' DG A 12 -6.907 -6.882 4.605 1.00 0.21 H new ATOM 0 H3' DG A 12 -7.006 -8.003 2.011 1.00 0.20 H new ATOM 0 H2' DG A 12 -5.476 -6.499 0.949 1.00 0.22 H new ATOM 0 H2'' DG A 12 -6.873 -5.441 0.966 1.00 0.22 H new ATOM 0 H1' DG A 12 -6.203 -4.319 2.887 1.00 0.20 H new ATOM 0 H8 DG A 12 -2.846 -6.147 2.178 1.00 0.23 H new ATOM 0 H1 DG A 12 -3.028 0.136 0.858 1.00 0.34 H new ATOM 0 H21 DG A 12 -6.378 -0.092 1.776 1.00 0.37 H new ATOM 0 H22 DG A 12 -5.049 0.927 1.211 1.00 0.37 H new ATOM 393 P DG A 13 -9.383 -6.647 1.516 1.00 0.18 P ATOM 394 OP1 DG A 13 -10.708 -6.897 2.127 1.00 0.23 O ATOM 395 OP2 DG A 13 -8.868 -7.563 0.474 1.00 0.21 O ATOM 396 O5' DG A 13 -9.377 -5.153 0.920 1.00 0.16 O ATOM 397 C5' DG A 13 -10.095 -4.105 1.579 1.00 0.11 C ATOM 398 C4' DG A 13 -10.030 -2.803 0.787 1.00 0.14 C ATOM 399 O4' DG A 13 -8.674 -2.394 0.660 1.00 0.18 O ATOM 400 C3' DG A 13 -10.600 -2.914 -0.629 1.00 0.20 C ATOM 401 O3' DG A 13 -11.800 -2.136 -0.731 1.00 0.26 O ATOM 402 C2' DG A 13 -9.522 -2.328 -1.546 1.00 0.25 C ATOM 403 C1' DG A 13 -8.540 -1.694 -0.569 1.00 0.24 C ATOM 404 N9 DG A 13 -7.129 -1.795 -0.985 1.00 0.25 N ATOM 405 C8 DG A 13 -6.336 -2.910 -1.050 1.00 0.29 C ATOM 406 N7 DG A 13 -5.120 -2.670 -1.451 1.00 0.29 N ATOM 407 C5 DG A 13 -5.102 -1.299 -1.667 1.00 0.24 C ATOM 408 C6 DG A 13 -4.040 -0.465 -2.111 1.00 0.24 C ATOM 409 O6 DG A 13 -2.889 -0.788 -2.401 1.00 0.26 O ATOM 410 N1 DG A 13 -4.440 0.863 -2.198 1.00 0.23 N ATOM 411 C2 DG A 13 -5.705 1.330 -1.893 1.00 0.22 C ATOM 412 N2 DG A 13 -5.905 2.639 -2.036 1.00 0.24 N ATOM 413 N3 DG A 13 -6.701 0.544 -1.473 1.00 0.21 N ATOM 414 C4 DG A 13 -6.328 -0.752 -1.385 1.00 0.23 C ATOM 0 H5' DG A 13 -9.680 -3.948 2.575 1.00 0.11 H new ATOM 0 H5'' DG A 13 -11.136 -4.401 1.710 1.00 0.11 H new ATOM 0 H4' DG A 13 -10.634 -2.086 1.343 1.00 0.14 H new ATOM 0 H3' DG A 13 -10.847 -3.943 -0.892 1.00 0.20 H new ATOM 0 H2' DG A 13 -9.046 -3.099 -2.152 1.00 0.25 H new ATOM 0 H2'' DG A 13 -9.936 -1.592 -2.235 1.00 0.25 H new ATOM 0 H1' DG A 13 -8.777 -0.632 -0.506 1.00 0.24 H new ATOM 0 H8 DG A 13 -6.687 -3.898 -0.792 1.00 0.29 H new ATOM 0 H1 DG A 13 -3.748 1.544 -2.510 1.00 0.23 H new ATOM 0 H21 DG A 13 -6.818 3.041 -1.826 1.00 0.24 H new ATOM 0 H22 DG A 13 -5.145 3.239 -2.356 1.00 0.24 H new ATOM 426 P DG A 14 -11.829 -0.584 -0.300 1.00 0.30 P ATOM 427 OP1 DG A 14 -12.923 0.082 -1.043 1.00 0.38 O ATOM 428 OP2 DG A 14 -10.451 -0.051 -0.386 1.00 0.27 O ATOM 429 O5' DG A 14 -12.246 -0.654 1.254 1.00 0.30 O ATOM 430 C5' DG A 14 -13.503 -1.217 1.643 1.00 0.33 C ATOM 431 C4' DG A 14 -14.005 -0.618 2.954 1.00 0.34 C ATOM 432 O4' DG A 14 -15.234 -1.244 3.329 1.00 0.39 O ATOM 433 C3' DG A 14 -13.035 -0.787 4.130 1.00 0.39 C ATOM 434 O3' DG A 14 -12.733 0.499 4.683 1.00 0.43 O ATOM 435 C2' DG A 14 -13.805 -1.619 5.154 1.00 0.46 C ATOM 436 C1' DG A 14 -15.244 -1.363 4.746 1.00 0.41 C ATOM 437 N9 DG A 14 -16.181 -2.445 5.105 1.00 0.45 N ATOM 438 C8 DG A 14 -15.993 -3.802 5.045 1.00 0.52 C ATOM 439 N7 DG A 14 -17.023 -4.497 5.434 1.00 0.58 N ATOM 440 C5 DG A 14 -17.967 -3.535 5.779 1.00 0.54 C ATOM 441 C6 DG A 14 -19.289 -3.695 6.275 1.00 0.60 C ATOM 442 O6 DG A 14 -19.896 -4.737 6.509 1.00 0.70 O ATOM 443 N1 DG A 14 -19.900 -2.468 6.495 1.00 0.56 N ATOM 444 C2 DG A 14 -19.315 -1.240 6.268 1.00 0.47 C ATOM 445 N2 DG A 14 -20.062 -0.170 6.540 1.00 0.48 N ATOM 446 N3 DG A 14 -18.071 -1.088 5.802 1.00 0.41 N ATOM 447 C4 DG A 14 -17.459 -2.275 5.581 1.00 0.45 C ATOM 0 H5' DG A 14 -13.401 -2.297 1.751 1.00 0.33 H new ATOM 0 H5'' DG A 14 -14.239 -1.044 0.858 1.00 0.33 H new ATOM 0 H4' DG A 14 -14.120 0.449 2.761 1.00 0.34 H new ATOM 0 H3' DG A 14 -12.096 -1.257 3.836 1.00 0.39 H new ATOM 0 H2' DG A 14 -13.547 -2.676 5.099 1.00 0.46 H new ATOM 0 H2'' DG A 14 -13.606 -1.295 6.176 1.00 0.46 H new ATOM 0 H1' DG A 14 -15.592 -0.474 5.272 1.00 0.41 H new ATOM 0 H8 DG A 14 -15.073 -4.254 4.705 1.00 0.52 H new ATOM 0 H1 DG A 14 -20.855 -2.475 6.852 1.00 0.56 H new ATOM 0 H21 DG A 14 -19.685 0.766 6.393 1.00 0.48 H new ATOM 0 H22 DG A 14 -21.011 -0.287 6.895 1.00 0.48 H new ATOM 459 P DG A 15 -11.583 0.659 5.798 1.00 0.47 P ATOM 460 OP1 DG A 15 -11.868 -0.288 6.899 1.00 0.69 O ATOM 461 OP2 DG A 15 -11.417 2.101 6.088 1.00 0.60 O ATOM 462 O5' DG A 15 -10.271 0.147 5.019 1.00 0.40 O ATOM 463 C5' DG A 15 -8.965 0.510 5.471 1.00 0.38 C ATOM 464 C4' DG A 15 -8.703 2.004 5.294 1.00 0.22 C ATOM 465 O4' DG A 15 -7.335 2.287 5.604 1.00 0.23 O ATOM 466 C3' DG A 15 -8.944 2.506 3.878 1.00 0.17 C ATOM 467 O3' DG A 15 -9.342 3.883 3.910 1.00 0.18 O ATOM 468 C2' DG A 15 -7.579 2.372 3.226 1.00 0.24 C ATOM 469 C1' DG A 15 -6.641 2.640 4.399 1.00 0.19 C ATOM 470 N9 DG A 15 -5.394 1.853 4.356 1.00 0.20 N ATOM 471 C8 DG A 15 -5.200 0.534 4.671 1.00 0.23 C ATOM 472 N7 DG A 15 -3.970 0.130 4.521 1.00 0.24 N ATOM 473 C5 DG A 15 -3.298 1.263 4.075 1.00 0.22 C ATOM 474 C6 DG A 15 -1.927 1.435 3.741 1.00 0.23 C ATOM 475 O6 DG A 15 -1.023 0.602 3.772 1.00 0.26 O ATOM 476 N1 DG A 15 -1.661 2.736 3.336 1.00 0.21 N ATOM 477 C2 DG A 15 -2.595 3.748 3.261 1.00 0.18 C ATOM 478 N2 DG A 15 -2.149 4.935 2.849 1.00 0.18 N ATOM 479 N3 DG A 15 -3.885 3.588 3.575 1.00 0.17 N ATOM 480 C4 DG A 15 -4.162 2.324 3.972 1.00 0.19 C ATOM 0 H5' DG A 15 -8.217 -0.059 4.919 1.00 0.38 H new ATOM 0 H5'' DG A 15 -8.856 0.243 6.522 1.00 0.38 H new ATOM 0 H4' DG A 15 -9.402 2.507 5.962 1.00 0.22 H new ATOM 0 H3' DG A 15 -9.728 1.961 3.352 1.00 0.17 H new ATOM 0 H2' DG A 15 -7.426 1.381 2.799 1.00 0.24 H new ATOM 0 H2'' DG A 15 -7.440 3.091 2.419 1.00 0.24 H new ATOM 0 H1' DG A 15 -6.362 3.693 4.353 1.00 0.19 H new ATOM 0 H8 DG A 15 -5.995 -0.113 5.013 1.00 0.23 H new ATOM 0 H1 DG A 15 -0.701 2.961 3.074 1.00 0.21 H new ATOM 0 H21 DG A 15 -2.792 5.723 2.773 1.00 0.18 H new ATOM 0 H22 DG A 15 -1.165 5.055 2.610 1.00 0.18 H new ATOM 492 P DG A 16 -10.016 4.566 2.612 1.00 0.31 P ATOM 493 OP1 DG A 16 -10.934 5.631 3.072 1.00 0.43 O ATOM 494 OP2 DG A 16 -10.521 3.488 1.734 1.00 0.42 O ATOM 495 O5' DG A 16 -8.762 5.264 1.880 1.00 0.24 O ATOM 496 C5' DG A 16 -8.509 6.663 2.042 1.00 0.23 C ATOM 497 C4' DG A 16 -7.332 7.125 1.186 1.00 0.17 C ATOM 498 O4' DG A 16 -6.201 6.284 1.432 1.00 0.16 O ATOM 499 C3' DG A 16 -7.608 7.086 -0.321 1.00 0.17 C ATOM 500 O3' DG A 16 -7.324 8.368 -0.890 1.00 0.16 O ATOM 501 C2' DG A 16 -6.633 6.050 -0.870 1.00 0.22 C ATOM 502 C1' DG A 16 -5.548 6.043 0.191 1.00 0.16 C ATOM 503 N9 DG A 16 -4.822 4.764 0.302 1.00 0.17 N ATOM 504 C8 DG A 16 -5.298 3.542 0.694 1.00 0.20 C ATOM 505 N7 DG A 16 -4.403 2.596 0.684 1.00 0.21 N ATOM 506 C5 DG A 16 -3.245 3.234 0.253 1.00 0.19 C ATOM 507 C6 DG A 16 -1.942 2.708 0.045 1.00 0.22 C ATOM 508 O6 DG A 16 -1.553 1.552 0.206 1.00 0.25 O ATOM 509 N1 DG A 16 -1.062 3.690 -0.395 1.00 0.22 N ATOM 510 C2 DG A 16 -1.397 5.013 -0.609 1.00 0.19 C ATOM 511 N2 DG A 16 -0.417 5.811 -1.033 1.00 0.22 N ATOM 512 N3 DG A 16 -2.623 5.507 -0.413 1.00 0.16 N ATOM 513 C4 DG A 16 -3.492 4.563 0.016 1.00 0.17 C ATOM 0 H5' DG A 16 -8.303 6.877 3.091 1.00 0.23 H new ATOM 0 H5'' DG A 16 -9.401 7.228 1.771 1.00 0.23 H new ATOM 0 H4' DG A 16 -7.150 8.162 1.470 1.00 0.17 H new ATOM 0 H3' DG A 16 -8.645 6.840 -0.551 1.00 0.17 H new ATOM 0 H2' DG A 16 -7.099 5.071 -0.983 1.00 0.22 H new ATOM 0 H2'' DG A 16 -6.245 6.333 -1.848 1.00 0.22 H new ATOM 0 H1' DG A 16 -4.808 6.796 -0.079 1.00 0.16 H new ATOM 0 H8 DG A 16 -6.325 3.377 0.986 1.00 0.20 H new ATOM 0 H1 DG A 16 -0.097 3.413 -0.573 1.00 0.22 H new ATOM 0 H21 DG A 16 -0.603 6.798 -1.209 1.00 0.22 H new ATOM 0 H22 DG A 16 0.519 5.434 -1.182 1.00 0.22 H new ATOM 525 P DG A 17 -7.450 8.602 -2.477 1.00 0.20 P ATOM 526 OP1 DG A 17 -7.712 10.039 -2.717 1.00 0.28 O ATOM 527 OP2 DG A 17 -8.374 7.583 -3.022 1.00 0.25 O ATOM 528 O5' DG A 17 -5.966 8.267 -3.003 1.00 0.19 O ATOM 529 C5' DG A 17 -4.899 9.202 -2.812 1.00 0.21 C ATOM 530 C4' DG A 17 -3.653 8.798 -3.593 1.00 0.20 C ATOM 531 O4' DG A 17 -3.169 7.545 -3.109 1.00 0.20 O ATOM 532 C3' DG A 17 -3.893 8.640 -5.100 1.00 0.22 C ATOM 533 O3' DG A 17 -3.000 9.500 -5.816 1.00 0.26 O ATOM 534 C2' DG A 17 -3.555 7.181 -5.400 1.00 0.22 C ATOM 535 C1' DG A 17 -2.674 6.808 -4.221 1.00 0.20 C ATOM 536 N9 DG A 17 -2.710 5.376 -3.865 1.00 0.20 N ATOM 537 C8 DG A 17 -3.773 4.624 -3.433 1.00 0.25 C ATOM 538 N7 DG A 17 -3.475 3.377 -3.198 1.00 0.25 N ATOM 539 C5 DG A 17 -2.121 3.292 -3.495 1.00 0.20 C ATOM 540 C6 DG A 17 -1.245 2.175 -3.428 1.00 0.21 C ATOM 541 O6 DG A 17 -1.506 1.023 -3.086 1.00 0.23 O ATOM 542 N1 DG A 17 0.045 2.517 -3.815 1.00 0.19 N ATOM 543 C2 DG A 17 0.442 3.776 -4.215 1.00 0.18 C ATOM 544 N2 DG A 17 1.725 3.915 -4.550 1.00 0.20 N ATOM 545 N3 DG A 17 -0.381 4.827 -4.277 1.00 0.18 N ATOM 546 C4 DG A 17 -1.642 4.511 -3.904 1.00 0.18 C ATOM 0 H5' DG A 17 -4.658 9.269 -1.751 1.00 0.21 H new ATOM 0 H5'' DG A 17 -5.222 10.194 -3.129 1.00 0.21 H new ATOM 0 H4' DG A 17 -2.937 9.606 -3.445 1.00 0.20 H new ATOM 0 H3' DG A 17 -4.912 8.896 -5.391 1.00 0.22 H new ATOM 0 H2' DG A 17 -4.448 6.559 -5.454 1.00 0.22 H new ATOM 0 H2'' DG A 17 -3.032 7.071 -6.350 1.00 0.22 H new ATOM 0 H1' DG A 17 -1.641 7.032 -4.488 1.00 0.20 H new ATOM 0 H8 DG A 17 -4.766 5.028 -3.300 1.00 0.25 H new ATOM 0 H1 DG A 17 0.752 1.782 -3.802 1.00 0.19 H new ATOM 0 H21 DG A 17 2.077 4.823 -4.854 1.00 0.20 H new ATOM 0 H22 DG A 17 2.354 3.114 -4.502 1.00 0.20 H new ATOM 558 P DT A 18 -3.163 9.700 -7.406 1.00 0.36 P ATOM 559 OP1 DT A 18 -3.257 11.151 -7.681 1.00 0.49 O ATOM 560 OP2 DT A 18 -4.230 8.790 -7.879 1.00 0.39 O ATOM 561 O5' DT A 18 -1.756 9.168 -7.978 1.00 0.41 O ATOM 562 C5' DT A 18 -0.567 9.945 -7.813 1.00 0.45 C ATOM 563 C4' DT A 18 0.531 9.503 -8.777 1.00 0.55 C ATOM 564 O4' DT A 18 0.884 8.138 -8.511 1.00 0.53 O ATOM 565 C3' DT A 18 0.128 9.579 -10.248 1.00 0.60 C ATOM 566 O3' DT A 18 1.235 9.959 -11.071 1.00 0.70 O ATOM 567 C2' DT A 18 -0.315 8.158 -10.545 1.00 0.53 C ATOM 568 C1' DT A 18 0.671 7.373 -9.700 1.00 0.53 C ATOM 569 N1 DT A 18 0.200 6.033 -9.299 1.00 0.47 N ATOM 570 C2 DT A 18 0.996 4.953 -9.633 1.00 0.57 C ATOM 571 O2 DT A 18 2.055 5.086 -10.243 1.00 0.69 O ATOM 572 N3 DT A 18 0.530 3.712 -9.240 1.00 0.56 N ATOM 573 C4 DT A 18 -0.645 3.462 -8.554 1.00 0.48 C ATOM 574 O4 DT A 18 -0.964 2.314 -8.254 1.00 0.54 O ATOM 575 C5 DT A 18 -1.411 4.650 -8.248 1.00 0.36 C ATOM 576 C7 DT A 18 -2.728 4.519 -7.491 1.00 0.29 C ATOM 577 C6 DT A 18 -0.978 5.873 -8.620 1.00 0.37 C ATOM 0 H5' DT A 18 -0.210 9.852 -6.787 1.00 0.45 H new ATOM 0 H5'' DT A 18 -0.794 10.998 -7.977 1.00 0.45 H new ATOM 0 H4' DT A 18 1.360 10.191 -8.612 1.00 0.55 H new ATOM 0 H3' DT A 18 -0.643 10.324 -10.447 1.00 0.60 H new ATOM 0 H2' DT A 18 -1.349 7.977 -10.250 1.00 0.53 H new ATOM 0 H2'' DT A 18 -0.238 7.914 -11.604 1.00 0.53 H new ATOM 0 HO3' DT A 18 0.948 9.998 -12.007 1.00 0.70 H new ATOM 0 H1' DT A 18 1.568 7.215 -10.298 1.00 0.53 H new ATOM 0 H3 DT A 18 1.107 2.905 -9.478 1.00 0.56 H new ATOM 0 H71 DT A 18 -3.187 3.558 -7.722 1.00 0.29 H new ATOM 0 H72 DT A 18 -2.540 4.583 -6.419 1.00 0.29 H new ATOM 0 H73 DT A 18 -3.401 5.323 -7.789 1.00 0.29 H new ATOM 0 H6 DT A 18 -1.572 6.742 -8.377 1.00 0.37 H new TER 591 DT A 18