USER MOD reduce.3.24.130724 H: found=0, std=0, add=222, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 222 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 DA O5' : rot 180:sc= 0 USER MOD Single : A 12 DT C7 :methyl 150:sc= -0.712 (180deg=-0.712) USER MOD Single : A 20 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 5.369 8.082 -8.455 1.00 0.35 O ATOM 2 C5' DA A 1 4.905 7.464 -7.253 1.00 0.30 C ATOM 3 C4' DA A 1 3.672 6.602 -7.511 1.00 0.27 C ATOM 4 O4' DA A 1 3.162 6.120 -6.265 1.00 0.27 O ATOM 5 C3' DA A 1 2.523 7.336 -8.218 1.00 0.30 C ATOM 6 O3' DA A 1 2.130 6.598 -9.384 1.00 0.27 O ATOM 7 C2' DA A 1 1.382 7.338 -7.203 1.00 0.35 C ATOM 8 C1' DA A 1 1.740 6.151 -6.327 1.00 0.32 C ATOM 9 N9 DA A 1 1.231 6.243 -4.950 1.00 0.41 N ATOM 10 C8 DA A 1 1.751 5.693 -3.814 1.00 0.38 C ATOM 11 N7 DA A 1 1.068 5.961 -2.739 1.00 0.50 N ATOM 12 C5 DA A 1 0.018 6.748 -3.194 1.00 0.63 C ATOM 13 C6 DA A 1 -1.064 7.360 -2.538 1.00 0.82 C ATOM 14 N6 DA A 1 -1.268 7.271 -1.221 1.00 0.89 N ATOM 15 N1 DA A 1 -1.920 8.067 -3.295 1.00 0.96 N ATOM 16 C2 DA A 1 -1.707 8.155 -4.604 1.00 0.90 C ATOM 17 N3 DA A 1 -0.732 7.629 -5.330 1.00 0.72 N ATOM 18 C4 DA A 1 0.108 6.926 -4.545 1.00 0.58 C ATOM 0 H5' DA A 1 4.667 8.231 -6.516 1.00 0.30 H new ATOM 0 H5'' DA A 1 5.698 6.849 -6.828 1.00 0.30 H new ATOM 0 H4' DA A 1 4.009 5.801 -8.169 1.00 0.27 H new ATOM 0 H3' DA A 1 2.800 8.341 -8.535 1.00 0.30 H new ATOM 0 H2' DA A 1 1.342 8.267 -6.635 1.00 0.35 H new ATOM 0 H2'' DA A 1 0.410 7.215 -7.681 1.00 0.35 H new ATOM 0 HO5' DA A 1 6.158 8.629 -8.258 1.00 0.35 H new ATOM 0 H1' DA A 1 1.288 5.260 -6.763 1.00 0.32 H new ATOM 0 H8 DA A 1 2.647 5.090 -3.808 1.00 0.38 H new ATOM 0 H61 DA A 1 -2.071 7.736 -0.797 1.00 0.89 H new ATOM 0 H62 DA A 1 -0.621 6.738 -0.640 1.00 0.89 H new ATOM 0 H2 DA A 1 -2.431 8.738 -5.153 1.00 0.90 H new ATOM 31 P DG A 2 1.837 5.016 -9.293 1.00 0.20 P ATOM 32 OP1 DG A 2 0.382 4.820 -9.105 1.00 0.22 O ATOM 33 OP2 DG A 2 2.786 4.429 -8.331 1.00 0.19 O ATOM 34 O5' DG A 2 2.230 4.495 -10.763 1.00 0.26 O ATOM 35 C5' DG A 2 3.536 4.736 -11.293 1.00 0.27 C ATOM 36 C4' DG A 2 4.560 3.715 -10.796 1.00 0.20 C ATOM 37 O4' DG A 2 4.697 3.796 -9.369 1.00 0.20 O ATOM 38 C3' DG A 2 4.213 2.256 -11.126 1.00 0.19 C ATOM 39 O3' DG A 2 5.357 1.636 -11.731 1.00 0.18 O ATOM 40 C2' DG A 2 3.924 1.625 -9.764 1.00 0.17 C ATOM 41 C1' DG A 2 4.811 2.464 -8.872 1.00 0.13 C ATOM 42 N9 DG A 2 4.457 2.464 -7.431 1.00 0.13 N ATOM 43 C8 DG A 2 5.312 2.488 -6.364 1.00 0.14 C ATOM 44 N7 DG A 2 4.721 2.484 -5.203 1.00 0.15 N ATOM 45 C5 DG A 2 3.368 2.457 -5.515 1.00 0.14 C ATOM 46 C6 DG A 2 2.237 2.445 -4.655 1.00 0.16 C ATOM 47 O6 DG A 2 2.213 2.453 -3.427 1.00 0.20 O ATOM 48 N1 DG A 2 1.050 2.423 -5.372 1.00 0.15 N ATOM 49 C2 DG A 2 0.958 2.412 -6.746 1.00 0.13 C ATOM 50 N2 DG A 2 -0.273 2.397 -7.255 1.00 0.15 N ATOM 51 N3 DG A 2 2.018 2.419 -7.558 1.00 0.12 N ATOM 52 C4 DG A 2 3.190 2.443 -6.878 1.00 0.12 C ATOM 0 H5' DG A 2 3.860 5.738 -11.013 1.00 0.27 H new ATOM 0 H5'' DG A 2 3.495 4.706 -12.382 1.00 0.27 H new ATOM 0 H4' DG A 2 5.481 3.975 -11.318 1.00 0.20 H new ATOM 0 H3' DG A 2 3.374 2.150 -11.814 1.00 0.19 H new ATOM 0 H2' DG A 2 2.872 1.699 -9.489 1.00 0.17 H new ATOM 0 H2'' DG A 2 4.188 0.568 -9.733 1.00 0.17 H new ATOM 0 H1' DG A 2 5.816 2.043 -8.908 1.00 0.13 H new ATOM 0 H8 DG A 2 6.386 2.509 -6.474 1.00 0.14 H new ATOM 0 H1 DG A 2 0.179 2.414 -4.841 1.00 0.15 H new ATOM 0 H21 DG A 2 -0.407 2.388 -8.266 1.00 0.15 H new ATOM 0 H22 DG A 2 -1.082 2.394 -6.634 1.00 0.15 H new ATOM 64 P DG A 3 5.401 0.054 -12.025 1.00 0.20 P ATOM 65 OP1 DG A 3 6.174 -0.165 -13.268 1.00 0.28 O ATOM 66 OP2 DG A 3 4.026 -0.481 -11.909 1.00 0.23 O ATOM 67 O5' DG A 3 6.269 -0.505 -10.789 1.00 0.19 O ATOM 68 C5' DG A 3 7.651 -0.152 -10.649 1.00 0.18 C ATOM 69 C4' DG A 3 8.256 -0.768 -9.392 1.00 0.17 C ATOM 70 O4' DG A 3 7.394 -0.512 -8.277 1.00 0.15 O ATOM 71 C3' DG A 3 8.450 -2.281 -9.482 1.00 0.21 C ATOM 72 O3' DG A 3 9.710 -2.636 -8.902 1.00 0.23 O ATOM 73 C2' DG A 3 7.314 -2.856 -8.652 1.00 0.21 C ATOM 74 C1' DG A 3 7.065 -1.749 -7.639 1.00 0.16 C ATOM 75 N9 DG A 3 5.663 -1.660 -7.191 1.00 0.18 N ATOM 76 C8 DG A 3 4.535 -1.465 -7.945 1.00 0.21 C ATOM 77 N7 DG A 3 3.431 -1.441 -7.251 1.00 0.24 N ATOM 78 C5 DG A 3 3.855 -1.636 -5.940 1.00 0.21 C ATOM 79 C6 DG A 3 3.096 -1.707 -4.741 1.00 0.23 C ATOM 80 O6 DG A 3 1.879 -1.608 -4.602 1.00 0.27 O ATOM 81 N1 DG A 3 3.909 -1.915 -3.635 1.00 0.22 N ATOM 82 C2 DG A 3 5.283 -2.039 -3.676 1.00 0.20 C ATOM 83 N2 DG A 3 5.892 -2.235 -2.507 1.00 0.21 N ATOM 84 N3 DG A 3 5.998 -1.973 -4.803 1.00 0.19 N ATOM 85 C4 DG A 3 5.221 -1.771 -5.893 1.00 0.19 C ATOM 0 H5' DG A 3 7.749 0.933 -10.608 1.00 0.18 H new ATOM 0 H5'' DG A 3 8.205 -0.489 -11.525 1.00 0.18 H new ATOM 0 H4' DG A 3 9.238 -0.309 -9.274 1.00 0.17 H new ATOM 0 H3' DG A 3 8.444 -2.650 -10.507 1.00 0.21 H new ATOM 0 H2' DG A 3 6.431 -3.061 -9.257 1.00 0.21 H new ATOM 0 H2'' DG A 3 7.595 -3.793 -8.171 1.00 0.21 H new ATOM 0 H1' DG A 3 7.671 -1.964 -6.759 1.00 0.16 H new ATOM 0 H8 DG A 3 4.558 -1.342 -9.018 1.00 0.21 H new ATOM 0 H1 DG A 3 3.457 -1.981 -2.723 1.00 0.22 H new ATOM 0 H21 DG A 3 6.906 -2.334 -2.471 1.00 0.21 H new ATOM 0 H22 DG A 3 5.344 -2.286 -1.648 1.00 0.21 H new ATOM 97 P DG A 4 10.183 -4.174 -8.862 1.00 0.21 P ATOM 98 OP1 DG A 4 11.640 -4.220 -9.116 1.00 0.27 O ATOM 99 OP2 DG A 4 9.261 -4.963 -9.711 1.00 0.25 O ATOM 100 O5' DG A 4 9.925 -4.580 -7.327 1.00 0.21 O ATOM 101 C5' DG A 4 10.738 -4.031 -6.287 1.00 0.35 C ATOM 102 C4' DG A 4 10.359 -4.597 -4.922 1.00 0.43 C ATOM 103 O4' DG A 4 8.995 -4.270 -4.629 1.00 0.39 O ATOM 104 C3' DG A 4 10.488 -6.120 -4.826 1.00 0.45 C ATOM 105 O3' DG A 4 11.120 -6.463 -3.588 1.00 0.62 O ATOM 106 C2' DG A 4 9.048 -6.614 -4.831 1.00 0.39 C ATOM 107 C1' DG A 4 8.339 -5.450 -4.169 1.00 0.38 C ATOM 108 N9 DG A 4 6.908 -5.334 -4.507 1.00 0.29 N ATOM 109 C8 DG A 4 6.328 -5.095 -5.725 1.00 0.31 C ATOM 110 N7 DG A 4 5.026 -5.039 -5.688 1.00 0.31 N ATOM 111 C5 DG A 4 4.718 -5.259 -4.350 1.00 0.27 C ATOM 112 C6 DG A 4 3.454 -5.312 -3.701 1.00 0.27 C ATOM 113 O6 DG A 4 2.337 -5.171 -4.195 1.00 0.34 O ATOM 114 N1 DG A 4 3.589 -5.557 -2.341 1.00 0.26 N ATOM 115 C2 DG A 4 4.791 -5.729 -1.684 1.00 0.29 C ATOM 116 N2 DG A 4 4.724 -5.957 -0.373 1.00 0.36 N ATOM 117 N3 DG A 4 5.979 -5.679 -2.293 1.00 0.30 N ATOM 118 C4 DG A 4 5.865 -5.441 -3.620 1.00 0.26 C ATOM 0 H5' DG A 4 10.631 -2.946 -6.275 1.00 0.35 H new ATOM 0 H5'' DG A 4 11.787 -4.245 -6.492 1.00 0.35 H new ATOM 0 H4' DG A 4 11.058 -4.151 -4.214 1.00 0.43 H new ATOM 0 H3' DG A 4 11.081 -6.554 -5.631 1.00 0.45 H new ATOM 0 H2' DG A 4 8.680 -6.801 -5.840 1.00 0.39 H new ATOM 0 H2'' DG A 4 8.929 -7.542 -4.271 1.00 0.39 H new ATOM 0 H1' DG A 4 8.385 -5.600 -3.090 1.00 0.38 H new ATOM 0 H8 DG A 4 6.898 -4.965 -6.633 1.00 0.31 H new ATOM 0 H1 DG A 4 2.736 -5.614 -1.785 1.00 0.26 H new ATOM 0 H21 DG A 4 5.580 -6.092 0.166 1.00 0.36 H new ATOM 0 H22 DG A 4 3.817 -5.997 0.092 1.00 0.36 H new ATOM 130 P DI A 5 11.098 -7.980 -3.046 1.00 0.72 P ATOM 131 OP1 DI A 5 12.130 -8.112 -1.994 1.00 0.93 O ATOM 132 OP2 DI A 5 11.113 -8.888 -4.214 1.00 0.71 O ATOM 133 O5' DI A 5 9.651 -8.079 -2.349 1.00 0.65 O ATOM 134 C5' DI A 5 9.116 -9.344 -1.956 1.00 0.63 C ATOM 135 C4' DI A 5 7.637 -9.238 -1.601 1.00 0.51 C ATOM 136 O4' DI A 5 6.916 -8.718 -2.721 1.00 0.44 O ATOM 137 C3' DI A 5 6.990 -10.576 -1.223 1.00 0.50 C ATOM 138 O3' DI A 5 6.318 -10.440 0.034 1.00 0.46 O ATOM 139 C2' DI A 5 5.971 -10.838 -2.329 1.00 0.43 C ATOM 140 C1' DI A 5 5.692 -9.436 -2.838 1.00 0.35 C ATOM 141 N9 DI A 5 5.270 -9.378 -4.250 1.00 0.36 N ATOM 142 C8 DI A 5 5.917 -9.859 -5.359 1.00 0.46 C ATOM 143 N7 DI A 5 5.282 -9.647 -6.477 1.00 0.50 N ATOM 144 C5 DI A 5 4.129 -8.975 -6.083 1.00 0.44 C ATOM 145 C6 DI A 5 3.050 -8.483 -6.867 1.00 0.51 C ATOM 146 O6 DI A 5 2.899 -8.545 -8.085 1.00 0.61 O ATOM 147 N1 DI A 5 2.092 -7.871 -6.074 1.00 0.49 N ATOM 148 C2 DI A 5 2.169 -7.750 -4.705 1.00 0.40 C ATOM 149 N3 DI A 5 3.164 -8.202 -3.960 1.00 0.30 N ATOM 150 C4 DI A 5 4.113 -8.806 -4.719 1.00 0.34 C ATOM 0 H5'' DI A 5 9.247 -10.063 -2.765 1.00 0.63 H new ATOM 0 H2'' DI A 5 6.373 -11.483 -3.110 1.00 0.43 H new ATOM 0 H8 DI A 5 6.877 -10.373 -5.310 1.00 0.46 H new ATOM 0 H5' DI A 5 9.671 -9.725 -1.099 1.00 0.63 H new ATOM 0 H4' DI A 5 7.587 -8.584 -0.731 1.00 0.51 H new ATOM 0 H3' DI A 5 7.716 -11.384 -1.128 1.00 0.50 H new ATOM 0 H2' DI A 5 5.071 -11.321 -1.949 1.00 0.43 H new ATOM 0 H2 DI A 5 1.348 -7.244 -4.197 1.00 0.40 H new ATOM 0 H1' DI A 5 4.870 -9.023 -2.252 1.00 0.35 H new ATOM 0 H1 DI A 5 1.271 -7.482 -6.538 1.00 0.49 H new ATOM 161 P DA A 6 5.457 -11.660 0.637 1.00 0.41 P ATOM 162 OP1 DA A 6 5.466 -11.547 2.113 1.00 0.42 O ATOM 163 OP2 DA A 6 5.911 -12.911 -0.010 1.00 0.43 O ATOM 164 O5' DA A 6 3.968 -11.334 0.116 1.00 0.40 O ATOM 165 C5' DA A 6 3.213 -10.272 0.702 1.00 0.36 C ATOM 166 C4' DA A 6 1.786 -10.229 0.164 1.00 0.33 C ATOM 167 O4' DA A 6 1.805 -10.029 -1.253 1.00 0.42 O ATOM 168 C3' DA A 6 0.989 -11.503 0.413 1.00 0.31 C ATOM 169 O3' DA A 6 0.270 -11.386 1.645 1.00 0.39 O ATOM 170 C2' DA A 6 0.020 -11.537 -0.754 1.00 0.36 C ATOM 171 C1' DA A 6 0.849 -10.906 -1.867 1.00 0.35 C ATOM 172 N9 DA A 6 1.596 -11.879 -2.686 1.00 0.35 N ATOM 173 C8 DA A 6 2.595 -12.737 -2.306 1.00 0.46 C ATOM 174 N7 DA A 6 3.057 -13.474 -3.278 1.00 0.53 N ATOM 175 C5 DA A 6 2.310 -13.075 -4.381 1.00 0.43 C ATOM 176 C6 DA A 6 2.314 -13.477 -5.727 1.00 0.45 C ATOM 177 N6 DA A 6 3.132 -14.414 -6.206 1.00 0.59 N ATOM 178 N1 DA A 6 1.442 -12.875 -6.554 1.00 0.36 N ATOM 179 C2 DA A 6 0.629 -11.943 -6.070 1.00 0.32 C ATOM 180 N3 DA A 6 0.531 -11.481 -4.834 1.00 0.32 N ATOM 181 C4 DA A 6 1.418 -12.103 -4.029 1.00 0.33 C ATOM 0 H5' DA A 6 3.706 -9.321 0.501 1.00 0.36 H new ATOM 0 H5'' DA A 6 3.190 -10.396 1.785 1.00 0.36 H new ATOM 0 H4' DA A 6 1.305 -9.410 0.699 1.00 0.33 H new ATOM 0 H3' DA A 6 1.607 -12.398 0.485 1.00 0.31 H new ATOM 0 H2' DA A 6 -0.288 -12.553 -1.000 1.00 0.36 H new ATOM 0 H2'' DA A 6 -0.888 -10.969 -0.548 1.00 0.36 H new ATOM 0 H1' DA A 6 0.154 -10.395 -2.533 1.00 0.35 H new ATOM 0 H8 DA A 6 2.966 -12.797 -1.294 1.00 0.46 H new ATOM 0 H61 DA A 6 3.093 -14.669 -7.193 1.00 0.59 H new ATOM 0 H62 DA A 6 3.796 -14.876 -5.586 1.00 0.59 H new ATOM 0 H2 DA A 6 -0.047 -11.500 -6.786 1.00 0.32 H new ATOM 193 P DG A 7 -1.189 -12.045 1.807 1.00 0.47 P ATOM 194 OP1 DG A 7 -1.500 -12.134 3.253 1.00 0.56 O ATOM 195 OP2 DG A 7 -1.247 -13.259 0.963 1.00 0.45 O ATOM 196 O5' DG A 7 -2.148 -10.930 1.154 1.00 0.50 O ATOM 197 C5' DG A 7 -2.042 -9.562 1.559 1.00 0.55 C ATOM 198 C4' DG A 7 -3.281 -8.760 1.173 1.00 0.53 C ATOM 199 O4' DG A 7 -3.542 -8.921 -0.211 1.00 0.56 O ATOM 200 C3' DG A 7 -4.550 -9.197 1.888 1.00 0.49 C ATOM 201 O3' DG A 7 -4.726 -8.435 3.091 1.00 0.44 O ATOM 202 C2' DG A 7 -5.670 -8.875 0.897 1.00 0.50 C ATOM 203 C1' DG A 7 -4.931 -8.672 -0.436 1.00 0.52 C ATOM 204 N9 DG A 7 -5.373 -9.583 -1.507 1.00 0.46 N ATOM 205 C8 DG A 7 -5.204 -10.940 -1.601 1.00 0.44 C ATOM 206 N7 DG A 7 -5.708 -11.463 -2.683 1.00 0.41 N ATOM 207 C5 DG A 7 -6.252 -10.375 -3.358 1.00 0.42 C ATOM 208 C6 DG A 7 -6.936 -10.326 -4.603 1.00 0.43 C ATOM 209 O6 DG A 7 -7.200 -11.253 -5.365 1.00 0.44 O ATOM 210 N1 DG A 7 -7.320 -9.031 -4.922 1.00 0.46 N ATOM 211 C2 DG A 7 -7.076 -7.918 -4.144 1.00 0.48 C ATOM 212 N2 DG A 7 -7.524 -6.756 -4.618 1.00 0.52 N ATOM 213 N3 DG A 7 -6.433 -7.962 -2.973 1.00 0.49 N ATOM 214 C4 DG A 7 -6.051 -9.219 -2.646 1.00 0.45 C ATOM 0 H5' DG A 7 -1.161 -9.114 1.099 1.00 0.55 H new ATOM 0 H5'' DG A 7 -1.898 -9.512 2.638 1.00 0.55 H new ATOM 0 H4' DG A 7 -3.052 -7.732 1.454 1.00 0.53 H new ATOM 0 H3' DG A 7 -4.529 -10.249 2.174 1.00 0.49 H new ATOM 0 H2' DG A 7 -6.394 -9.687 0.834 1.00 0.50 H new ATOM 0 H2'' DG A 7 -6.219 -7.980 1.190 1.00 0.50 H new ATOM 0 H1' DG A 7 -5.142 -7.654 -0.764 1.00 0.52 H new ATOM 0 H8 DG A 7 -4.698 -11.524 -0.846 1.00 0.44 H new ATOM 0 H1 DG A 7 -7.821 -8.891 -5.799 1.00 0.46 H new ATOM 0 H21 DG A 7 -7.374 -5.897 -4.088 1.00 0.52 H new ATOM 0 H22 DG A 7 -8.017 -6.725 -5.511 1.00 0.52 H new ATOM 226 P DG A 8 -4.701 -6.822 3.078 1.00 0.42 P ATOM 227 OP1 DG A 8 -5.666 -6.333 4.088 1.00 0.44 O ATOM 228 OP2 DG A 8 -4.807 -6.366 1.674 1.00 0.46 O ATOM 229 O5' DG A 8 -3.215 -6.489 3.601 1.00 0.37 O ATOM 230 C5' DG A 8 -2.787 -6.918 4.898 1.00 0.33 C ATOM 231 C4' DG A 8 -1.364 -6.454 5.200 1.00 0.25 C ATOM 232 O4' DG A 8 -0.495 -6.860 4.136 1.00 0.21 O ATOM 233 C3' DG A 8 -1.225 -4.935 5.345 1.00 0.23 C ATOM 234 O3' DG A 8 -0.441 -4.637 6.504 1.00 0.21 O ATOM 235 C2' DG A 8 -0.469 -4.506 4.097 1.00 0.20 C ATOM 236 C1' DG A 8 0.338 -5.755 3.797 1.00 0.19 C ATOM 237 N9 DG A 8 0.738 -5.888 2.384 1.00 0.19 N ATOM 238 C8 DG A 8 1.986 -6.127 1.870 1.00 0.21 C ATOM 239 N7 DG A 8 2.026 -6.137 0.567 1.00 0.24 N ATOM 240 C5 DG A 8 0.713 -5.890 0.188 1.00 0.24 C ATOM 241 C6 DG A 8 0.148 -5.783 -1.112 1.00 0.27 C ATOM 242 O6 DG A 8 0.716 -5.881 -2.198 1.00 0.30 O ATOM 243 N1 DG A 8 -1.215 -5.528 -1.053 1.00 0.29 N ATOM 244 C2 DG A 8 -1.946 -5.391 0.108 1.00 0.28 C ATOM 245 N2 DG A 8 -3.248 -5.149 -0.039 1.00 0.31 N ATOM 246 N3 DG A 8 -1.415 -5.488 1.330 1.00 0.24 N ATOM 247 C4 DG A 8 -0.085 -5.737 1.293 1.00 0.22 C ATOM 0 H5' DG A 8 -2.837 -8.005 4.957 1.00 0.33 H new ATOM 0 H5'' DG A 8 -3.467 -6.526 5.655 1.00 0.33 H new ATOM 0 H4' DG A 8 -1.099 -6.910 6.154 1.00 0.25 H new ATOM 0 H3' DG A 8 -2.186 -4.431 5.451 1.00 0.23 H new ATOM 0 H2' DG A 8 -1.140 -4.244 3.279 1.00 0.20 H new ATOM 0 H2'' DG A 8 0.167 -3.639 4.278 1.00 0.20 H new ATOM 0 H1' DG A 8 1.264 -5.708 4.370 1.00 0.19 H new ATOM 0 H8 DG A 8 2.856 -6.292 2.488 1.00 0.21 H new ATOM 0 H1 DG A 8 -1.715 -5.435 -1.937 1.00 0.29 H new ATOM 0 H21 DG A 8 -3.842 -5.038 0.783 1.00 0.31 H new ATOM 0 H22 DG A 8 -3.651 -5.075 -0.973 1.00 0.31 H new ATOM 259 P DG A 9 0.214 -3.179 6.692 1.00 0.24 P ATOM 260 OP1 DG A 9 0.561 -3.009 8.121 1.00 0.34 O ATOM 261 OP2 DG A 9 -0.660 -2.190 6.022 1.00 0.26 O ATOM 262 O5' DG A 9 1.583 -3.293 5.850 1.00 0.22 O ATOM 263 C5' DG A 9 2.674 -4.074 6.347 1.00 0.22 C ATOM 264 C4' DG A 9 4.012 -3.609 5.774 1.00 0.20 C ATOM 265 O4' DG A 9 4.058 -3.858 4.365 1.00 0.18 O ATOM 266 C3' DG A 9 4.285 -2.112 5.977 1.00 0.21 C ATOM 267 O3' DG A 9 5.544 -1.945 6.638 1.00 0.25 O ATOM 268 C2' DG A 9 4.363 -1.539 4.563 1.00 0.18 C ATOM 269 C1' DG A 9 4.734 -2.763 3.751 1.00 0.18 C ATOM 270 N9 DG A 9 4.323 -2.698 2.335 1.00 0.17 N ATOM 271 C8 DG A 9 5.111 -2.736 1.214 1.00 0.18 C ATOM 272 N7 DG A 9 4.449 -2.626 0.098 1.00 0.18 N ATOM 273 C5 DG A 9 3.123 -2.508 0.504 1.00 0.16 C ATOM 274 C6 DG A 9 1.943 -2.358 -0.273 1.00 0.16 C ATOM 275 O6 DG A 9 1.840 -2.298 -1.496 1.00 0.19 O ATOM 276 N1 DG A 9 0.813 -2.276 0.529 1.00 0.17 N ATOM 277 C2 DG A 9 0.814 -2.330 1.906 1.00 0.17 C ATOM 278 N2 DG A 9 -0.374 -2.235 2.502 1.00 0.19 N ATOM 279 N3 DG A 9 1.923 -2.469 2.640 1.00 0.16 N ATOM 280 C4 DG A 9 3.037 -2.552 1.874 1.00 0.15 C ATOM 0 H5' DG A 9 2.515 -5.122 6.095 1.00 0.22 H new ATOM 0 H5'' DG A 9 2.702 -4.009 7.435 1.00 0.22 H new ATOM 0 H4' DG A 9 4.769 -4.174 6.317 1.00 0.20 H new ATOM 0 H3' DG A 9 3.522 -1.622 6.582 1.00 0.21 H new ATOM 0 H2' DG A 9 3.414 -1.109 4.243 1.00 0.18 H new ATOM 0 H2'' DG A 9 5.113 -0.752 4.482 1.00 0.18 H new ATOM 0 H1' DG A 9 5.820 -2.854 3.743 1.00 0.18 H new ATOM 0 H8 DG A 9 6.185 -2.847 1.253 1.00 0.18 H new ATOM 0 H1 DG A 9 -0.088 -2.167 0.063 1.00 0.17 H new ATOM 0 H21 DG A 9 -0.438 -2.268 3.519 1.00 0.19 H new ATOM 0 H22 DG A 9 -1.219 -2.129 1.941 1.00 0.19 H new ATOM 292 P DG A 10 6.074 -0.473 7.021 1.00 0.28 P ATOM 293 OP1 DG A 10 7.172 -0.616 8.004 1.00 0.35 O ATOM 294 OP2 DG A 10 4.903 0.373 7.341 1.00 0.30 O ATOM 295 O5' DG A 10 6.707 0.047 5.635 1.00 0.26 O ATOM 296 C5' DG A 10 7.976 -0.437 5.186 1.00 0.26 C ATOM 297 C4' DG A 10 8.483 0.357 3.986 1.00 0.23 C ATOM 298 O4' DG A 10 7.565 0.211 2.896 1.00 0.23 O ATOM 299 C3' DG A 10 8.629 1.856 4.262 1.00 0.20 C ATOM 300 O3' DG A 10 9.875 2.326 3.736 1.00 0.20 O ATOM 301 C2' DG A 10 7.476 2.490 3.499 1.00 0.17 C ATOM 302 C1' DG A 10 7.276 1.502 2.364 1.00 0.16 C ATOM 303 N9 DG A 10 5.901 1.476 1.839 1.00 0.15 N ATOM 304 C8 DG A 10 4.724 1.428 2.538 1.00 0.18 C ATOM 305 N7 DG A 10 3.661 1.428 1.787 1.00 0.19 N ATOM 306 C5 DG A 10 4.166 1.479 0.493 1.00 0.17 C ATOM 307 C6 DG A 10 3.479 1.505 -0.748 1.00 0.17 C ATOM 308 O6 DG A 10 2.267 1.488 -0.950 1.00 0.18 O ATOM 309 N1 DG A 10 4.361 1.560 -1.816 1.00 0.16 N ATOM 310 C2 DG A 10 5.736 1.586 -1.709 1.00 0.16 C ATOM 311 N2 DG A 10 6.416 1.642 -2.855 1.00 0.18 N ATOM 312 N3 DG A 10 6.386 1.561 -0.541 1.00 0.15 N ATOM 313 C4 DG A 10 5.538 1.508 0.513 1.00 0.15 C ATOM 0 H5' DG A 10 7.891 -1.490 4.918 1.00 0.26 H new ATOM 0 H5'' DG A 10 8.700 -0.373 5.999 1.00 0.26 H new ATOM 0 H4' DG A 10 9.470 -0.044 3.754 1.00 0.23 H new ATOM 0 H3' DG A 10 8.612 2.093 5.326 1.00 0.20 H new ATOM 0 H2' DG A 10 6.583 2.590 4.116 1.00 0.17 H new ATOM 0 H2'' DG A 10 7.725 3.487 3.135 1.00 0.17 H new ATOM 0 H1' DG A 10 7.924 1.796 1.538 1.00 0.16 H new ATOM 0 H8 DG A 10 4.682 1.393 3.617 1.00 0.18 H new ATOM 0 H1 DG A 10 3.962 1.583 -2.754 1.00 0.16 H new ATOM 0 H21 DG A 10 7.436 1.664 -2.842 1.00 0.18 H new ATOM 0 H22 DG A 10 5.916 1.663 -3.744 1.00 0.18 H new ATOM 325 P DC A 11 10.678 3.508 4.482 1.00 0.19 P ATOM 326 OP1 DC A 11 11.843 3.874 3.647 1.00 0.24 O ATOM 327 OP2 DC A 11 10.877 3.113 5.895 1.00 0.27 O ATOM 328 O5' DC A 11 9.627 4.729 4.444 1.00 0.22 O ATOM 329 C5' DC A 11 9.633 5.727 5.471 1.00 0.21 C ATOM 330 C4' DC A 11 8.577 6.800 5.212 1.00 0.27 C ATOM 331 O4' DC A 11 8.904 7.527 4.037 1.00 0.27 O ATOM 332 C3' DC A 11 7.178 6.255 4.986 1.00 0.31 C ATOM 333 O3' DC A 11 6.500 6.135 6.240 1.00 0.39 O ATOM 334 C2' DC A 11 6.511 7.332 4.135 1.00 0.38 C ATOM 335 C1' DC A 11 7.694 8.051 3.476 1.00 0.30 C ATOM 336 N1 DC A 11 7.769 7.868 2.015 1.00 0.40 N ATOM 337 C2 DC A 11 7.232 8.865 1.216 1.00 0.65 C ATOM 338 O2 DC A 11 6.716 9.854 1.732 1.00 0.76 O ATOM 339 N3 DC A 11 7.295 8.714 -0.134 1.00 0.81 N ATOM 340 C4 DC A 11 7.863 7.628 -0.680 1.00 0.71 C ATOM 341 N4 DC A 11 7.909 7.510 -2.007 1.00 0.88 N ATOM 342 C5 DC A 11 8.418 6.597 0.142 1.00 0.52 C ATOM 343 C6 DC A 11 8.351 6.757 1.477 1.00 0.41 C ATOM 0 H5' DC A 11 10.618 6.190 5.525 1.00 0.21 H new ATOM 0 H5'' DC A 11 9.448 5.258 6.437 1.00 0.21 H new ATOM 0 H4' DC A 11 8.577 7.413 6.113 1.00 0.27 H new ATOM 0 H3' DC A 11 7.168 5.271 4.517 1.00 0.31 H new ATOM 0 H2' DC A 11 5.840 6.899 3.393 1.00 0.38 H new ATOM 0 H2'' DC A 11 5.916 8.013 4.743 1.00 0.38 H new ATOM 0 H1' DC A 11 7.557 9.116 3.664 1.00 0.30 H new ATOM 0 H41 DC A 11 8.339 6.688 -2.431 1.00 0.88 H new ATOM 0 H42 DC A 11 7.514 8.242 -2.598 1.00 0.88 H new ATOM 0 H5 DC A 11 8.875 5.721 -0.293 1.00 0.52 H new ATOM 0 H6 DC A 11 8.761 5.999 2.128 1.00 0.41 H new ATOM 355 P DT A 12 5.728 4.774 6.624 1.00 0.35 P ATOM 356 OP1 DT A 12 5.417 4.810 8.070 1.00 0.42 O ATOM 357 OP2 DT A 12 6.490 3.636 6.063 1.00 0.36 O ATOM 358 O5' DT A 12 4.344 4.904 5.809 1.00 0.26 O ATOM 359 C5' DT A 12 3.229 5.592 6.382 1.00 0.25 C ATOM 360 C4' DT A 12 1.981 5.469 5.511 1.00 0.28 C ATOM 361 O4' DT A 12 2.213 6.084 4.245 1.00 0.29 O ATOM 362 C3' DT A 12 1.551 4.023 5.230 1.00 0.32 C ATOM 363 O3' DT A 12 0.252 3.792 5.783 1.00 0.28 O ATOM 364 C2' DT A 12 1.480 3.922 3.706 1.00 0.43 C ATOM 365 C1' DT A 12 1.429 5.383 3.292 1.00 0.36 C ATOM 366 N1 DT A 12 1.978 5.657 1.950 1.00 0.33 N ATOM 367 C2 DT A 12 1.161 6.319 1.052 1.00 0.40 C ATOM 368 O2 DT A 12 0.021 6.678 1.340 1.00 0.50 O ATOM 369 N3 DT A 12 1.696 6.546 -0.198 1.00 0.37 N ATOM 370 C4 DT A 12 2.956 6.177 -0.627 1.00 0.28 C ATOM 371 O4 DT A 12 3.328 6.431 -1.770 1.00 0.28 O ATOM 372 C5 DT A 12 3.738 5.492 0.371 1.00 0.23 C ATOM 373 C7 DT A 12 5.140 5.011 0.017 1.00 0.21 C ATOM 374 C6 DT A 12 3.243 5.257 1.604 1.00 0.26 C ATOM 0 H5' DT A 12 3.479 6.645 6.513 1.00 0.25 H new ATOM 0 H5'' DT A 12 3.022 5.188 7.373 1.00 0.25 H new ATOM 0 H4' DT A 12 1.188 5.957 6.078 1.00 0.28 H new ATOM 0 H3' DT A 12 2.237 3.296 5.664 1.00 0.32 H new ATOM 0 H2' DT A 12 2.348 3.411 3.291 1.00 0.43 H new ATOM 0 H2'' DT A 12 0.598 3.373 3.375 1.00 0.43 H new ATOM 0 H1' DT A 12 0.384 5.691 3.254 1.00 0.36 H new ATOM 0 H3 DT A 12 1.104 7.033 -0.871 1.00 0.37 H new ATOM 0 H71 DT A 12 5.764 5.018 0.911 1.00 0.21 H new ATOM 0 H72 DT A 12 5.087 3.998 -0.381 1.00 0.21 H new ATOM 0 H73 DT A 12 5.573 5.673 -0.733 1.00 0.21 H new ATOM 0 H6 DT A 12 3.854 4.744 2.332 1.00 0.26 H new ATOM 387 P DG A 13 -0.634 2.547 5.274 1.00 0.22 P ATOM 388 OP1 DG A 13 0.284 1.482 4.817 1.00 0.25 O ATOM 389 OP2 DG A 13 -1.680 3.064 4.364 1.00 0.19 O ATOM 390 O5' DG A 13 -1.350 2.042 6.623 1.00 0.24 O ATOM 391 C5' DG A 13 -2.603 2.591 7.033 1.00 0.22 C ATOM 392 C4' DG A 13 -3.773 1.968 6.275 1.00 0.19 C ATOM 393 O4' DG A 13 -3.809 2.450 4.922 1.00 0.17 O ATOM 394 C3' DG A 13 -3.722 0.434 6.196 1.00 0.22 C ATOM 395 O3' DG A 13 -5.006 -0.093 6.556 1.00 0.25 O ATOM 396 C2' DG A 13 -3.430 0.155 4.724 1.00 0.20 C ATOM 397 C1' DG A 13 -4.123 1.339 4.085 1.00 0.17 C ATOM 398 N9 DG A 13 -3.707 1.654 2.697 1.00 0.15 N ATOM 399 C8 DG A 13 -4.503 2.015 1.642 1.00 0.15 C ATOM 400 N7 DG A 13 -3.857 2.217 0.531 1.00 0.16 N ATOM 401 C5 DG A 13 -2.531 1.974 0.865 1.00 0.16 C ATOM 402 C6 DG A 13 -1.366 2.038 0.053 1.00 0.19 C ATOM 403 O6 DG A 13 -1.282 2.326 -1.139 1.00 0.24 O ATOM 404 N1 DG A 13 -0.225 1.720 0.774 1.00 0.19 N ATOM 405 C2 DG A 13 -0.203 1.382 2.110 1.00 0.16 C ATOM 406 N2 DG A 13 0.994 1.110 2.627 1.00 0.18 N ATOM 407 N3 DG A 13 -1.297 1.319 2.877 1.00 0.15 N ATOM 408 C4 DG A 13 -2.422 1.628 2.191 1.00 0.15 C ATOM 0 H5' DG A 13 -2.598 3.669 6.870 1.00 0.22 H new ATOM 0 H5'' DG A 13 -2.737 2.431 8.103 1.00 0.22 H new ATOM 0 H4' DG A 13 -4.657 2.259 6.842 1.00 0.19 H new ATOM 0 H3' DG A 13 -2.983 -0.015 6.860 1.00 0.22 H new ATOM 0 H2' DG A 13 -2.362 0.132 4.509 1.00 0.20 H new ATOM 0 H2'' DG A 13 -3.842 -0.798 4.391 1.00 0.20 H new ATOM 0 H1' DG A 13 -5.185 1.107 4.004 1.00 0.17 H new ATOM 0 H8 DG A 13 -5.574 2.123 1.725 1.00 0.15 H new ATOM 0 H1 DG A 13 0.666 1.738 0.278 1.00 0.19 H new ATOM 0 H21 DG A 13 1.078 0.853 3.611 1.00 0.18 H new ATOM 0 H22 DG A 13 1.826 1.159 2.039 1.00 0.18 H new ATOM 420 P DG A 14 -5.345 -1.658 6.379 1.00 0.27 P ATOM 421 OP1 DG A 14 -6.310 -2.047 7.432 1.00 0.30 O ATOM 422 OP2 DG A 14 -4.070 -2.396 6.238 1.00 0.27 O ATOM 423 O5' DG A 14 -6.108 -1.693 4.960 1.00 0.25 O ATOM 424 C5' DG A 14 -7.424 -1.144 4.825 1.00 0.24 C ATOM 425 C4' DG A 14 -7.983 -1.371 3.424 1.00 0.21 C ATOM 426 O4' DG A 14 -7.015 -0.958 2.449 1.00 0.21 O ATOM 427 C3' DG A 14 -8.318 -2.830 3.124 1.00 0.22 C ATOM 428 O3' DG A 14 -9.480 -2.886 2.286 1.00 0.24 O ATOM 429 C2' DG A 14 -7.100 -3.319 2.362 1.00 0.20 C ATOM 430 C1' DG A 14 -6.733 -2.065 1.587 1.00 0.20 C ATOM 431 N9 DG A 14 -5.313 -1.991 1.198 1.00 0.18 N ATOM 432 C8 DG A 14 -4.200 -2.133 1.986 1.00 0.19 C ATOM 433 N7 DG A 14 -3.075 -2.031 1.334 1.00 0.20 N ATOM 434 C5 DG A 14 -3.468 -1.804 0.018 1.00 0.19 C ATOM 435 C6 DG A 14 -2.678 -1.613 -1.148 1.00 0.21 C ATOM 436 O6 DG A 14 -1.454 -1.607 -1.247 1.00 0.24 O ATOM 437 N1 DG A 14 -3.471 -1.417 -2.272 1.00 0.21 N ATOM 438 C2 DG A 14 -4.850 -1.403 -2.277 1.00 0.20 C ATOM 439 N2 DG A 14 -5.435 -1.196 -3.456 1.00 0.23 N ATOM 440 N3 DG A 14 -5.593 -1.582 -1.180 1.00 0.19 N ATOM 441 C4 DG A 14 -4.838 -1.777 -0.073 1.00 0.18 C ATOM 0 H5' DG A 14 -7.397 -0.075 5.039 1.00 0.24 H new ATOM 0 H5'' DG A 14 -8.087 -1.600 5.561 1.00 0.24 H new ATOM 0 H4' DG A 14 -8.904 -0.790 3.377 1.00 0.21 H new ATOM 0 H3' DG A 14 -8.529 -3.424 4.013 1.00 0.22 H new ATOM 0 H2' DG A 14 -6.299 -3.645 3.026 1.00 0.20 H new ATOM 0 H2'' DG A 14 -7.331 -4.158 1.706 1.00 0.20 H new ATOM 0 H1' DG A 14 -7.306 -2.063 0.660 1.00 0.20 H new ATOM 0 H8 DG A 14 -4.250 -2.313 3.050 1.00 0.19 H new ATOM 0 H1 DG A 14 -2.996 -1.272 -3.163 1.00 0.21 H new ATOM 0 H21 DG A 14 -6.453 -1.175 -3.524 1.00 0.23 H new ATOM 0 H22 DG A 14 -4.865 -1.059 -4.291 1.00 0.23 H new ATOM 453 P DG A 15 -10.102 -4.299 1.832 1.00 0.25 P ATOM 454 OP1 DG A 15 -11.521 -4.339 2.252 1.00 0.31 O ATOM 455 OP2 DG A 15 -9.176 -5.371 2.261 1.00 0.34 O ATOM 456 O5' DG A 15 -10.053 -4.204 0.225 1.00 0.23 O ATOM 457 C5' DG A 15 -10.923 -3.315 -0.483 1.00 0.14 C ATOM 458 C4' DG A 15 -10.585 -3.279 -1.970 1.00 0.14 C ATOM 459 O4' DG A 15 -9.183 -3.059 -2.129 1.00 0.15 O ATOM 460 C3' DG A 15 -10.934 -4.573 -2.711 1.00 0.20 C ATOM 461 O3' DG A 15 -11.850 -4.286 -3.780 1.00 0.24 O ATOM 462 C2' DG A 15 -9.608 -5.082 -3.275 1.00 0.21 C ATOM 463 C1' DG A 15 -8.722 -3.848 -3.221 1.00 0.16 C ATOM 464 N9 DG A 15 -7.295 -4.140 -2.982 1.00 0.15 N ATOM 465 C8 DG A 15 -6.686 -4.533 -1.820 1.00 0.20 C ATOM 466 N7 DG A 15 -5.397 -4.695 -1.926 1.00 0.22 N ATOM 467 C5 DG A 15 -5.129 -4.388 -3.256 1.00 0.17 C ATOM 468 C6 DG A 15 -3.893 -4.387 -3.957 1.00 0.18 C ATOM 469 O6 DG A 15 -2.773 -4.664 -3.530 1.00 0.22 O ATOM 470 N1 DG A 15 -4.063 -4.015 -5.285 1.00 0.14 N ATOM 471 C2 DG A 15 -5.270 -3.687 -5.867 1.00 0.14 C ATOM 472 N2 DG A 15 -5.233 -3.359 -7.159 1.00 0.18 N ATOM 473 N3 DG A 15 -6.433 -3.687 -5.208 1.00 0.13 N ATOM 474 C4 DG A 15 -6.287 -4.047 -3.911 1.00 0.13 C ATOM 0 H5' DG A 15 -10.841 -2.312 -0.064 1.00 0.14 H new ATOM 0 H5'' DG A 15 -11.957 -3.632 -0.350 1.00 0.14 H new ATOM 0 H4' DG A 15 -11.184 -2.475 -2.397 1.00 0.14 H new ATOM 0 H3' DG A 15 -11.407 -5.309 -2.061 1.00 0.20 H new ATOM 0 H2' DG A 15 -9.201 -5.898 -2.678 1.00 0.21 H new ATOM 0 H2'' DG A 15 -9.719 -5.456 -4.293 1.00 0.21 H new ATOM 0 H1' DG A 15 -8.787 -3.354 -4.190 1.00 0.16 H new ATOM 0 H8 DG A 15 -7.225 -4.694 -0.898 1.00 0.20 H new ATOM 0 H1 DG A 15 -3.231 -3.982 -5.875 1.00 0.14 H new ATOM 0 H21 DG A 15 -6.093 -3.107 -7.646 1.00 0.18 H new ATOM 0 H22 DG A 15 -4.345 -3.360 -7.660 1.00 0.18 H new ATOM 486 P DA A 16 -11.431 -3.349 -5.024 1.00 0.27 P ATOM 487 OP1 DA A 16 -12.477 -3.473 -6.064 1.00 0.35 O ATOM 488 OP2 DA A 16 -10.019 -3.630 -5.366 1.00 0.32 O ATOM 489 O5' DA A 16 -11.515 -1.864 -4.405 1.00 0.22 O ATOM 490 C5' DA A 16 -12.782 -1.234 -4.186 1.00 0.21 C ATOM 491 C4' DA A 16 -12.643 0.284 -4.090 1.00 0.27 C ATOM 492 O4' DA A 16 -13.879 0.857 -3.649 1.00 0.41 O ATOM 493 C3' DA A 16 -11.556 0.753 -3.114 1.00 0.33 C ATOM 494 O3' DA A 16 -10.711 1.702 -3.776 1.00 0.30 O ATOM 495 C2' DA A 16 -12.322 1.437 -1.988 1.00 0.49 C ATOM 496 C1' DA A 16 -13.577 1.887 -2.710 1.00 0.50 C ATOM 497 N9 DA A 16 -14.752 2.072 -1.836 1.00 0.65 N ATOM 498 C8 DA A 16 -15.150 1.326 -0.756 1.00 0.71 C ATOM 499 N7 DA A 16 -16.239 1.762 -0.186 1.00 0.86 N ATOM 500 C5 DA A 16 -16.588 2.877 -0.941 1.00 0.91 C ATOM 501 C6 DA A 16 -17.652 3.790 -0.854 1.00 1.07 C ATOM 502 N6 DA A 16 -18.601 3.717 0.080 1.00 1.20 N ATOM 503 N1 DA A 16 -17.694 4.776 -1.765 1.00 1.11 N ATOM 504 C2 DA A 16 -16.745 4.843 -2.690 1.00 1.00 C ATOM 505 N3 DA A 16 -15.702 4.051 -2.877 1.00 0.83 N ATOM 506 C4 DA A 16 -15.687 3.072 -1.949 1.00 0.79 C ATOM 0 H5' DA A 16 -13.227 -1.618 -3.268 1.00 0.21 H new ATOM 0 H5'' DA A 16 -13.461 -1.488 -5.000 1.00 0.21 H new ATOM 0 H4' DA A 16 -12.364 0.611 -5.091 1.00 0.27 H new ATOM 0 H3' DA A 16 -10.928 -0.061 -2.751 1.00 0.33 H new ATOM 0 H2' DA A 16 -12.543 0.754 -1.168 1.00 0.49 H new ATOM 0 H2'' DA A 16 -11.769 2.275 -1.565 1.00 0.49 H new ATOM 0 H1' DA A 16 -13.381 2.862 -3.157 1.00 0.50 H new ATOM 0 H8 DA A 16 -14.611 0.457 -0.409 1.00 0.71 H new ATOM 0 H61 DA A 16 -19.352 4.406 0.098 1.00 1.20 H new ATOM 0 H62 DA A 16 -18.575 2.972 0.776 1.00 1.20 H new ATOM 0 H2 DA A 16 -16.837 5.660 -3.390 1.00 1.00 H new ATOM 518 P DG A 17 -9.798 2.726 -2.932 1.00 0.23 P ATOM 519 OP1 DG A 17 -9.000 1.948 -1.959 1.00 0.37 O ATOM 520 OP2 DG A 17 -10.657 3.834 -2.462 1.00 0.36 O ATOM 521 O5' DG A 17 -8.801 3.304 -4.056 1.00 0.21 O ATOM 522 C5' DG A 17 -9.305 4.108 -5.125 1.00 0.18 C ATOM 523 C4' DG A 17 -8.577 3.819 -6.434 1.00 0.22 C ATOM 524 O4' DG A 17 -7.194 4.147 -6.298 1.00 0.22 O ATOM 525 C3' DG A 17 -8.652 2.351 -6.874 1.00 0.28 C ATOM 526 O3' DG A 17 -9.238 2.273 -8.177 1.00 0.35 O ATOM 527 C2' DG A 17 -7.197 1.888 -6.935 1.00 0.25 C ATOM 528 C1' DG A 17 -6.454 3.205 -7.062 1.00 0.21 C ATOM 529 N9 DG A 17 -5.075 3.175 -6.540 1.00 0.18 N ATOM 530 C8 DG A 17 -3.895 3.299 -7.228 1.00 0.20 C ATOM 531 N7 DG A 17 -2.834 3.208 -6.478 1.00 0.19 N ATOM 532 C5 DG A 17 -3.342 3.008 -5.200 1.00 0.16 C ATOM 533 C6 DG A 17 -2.658 2.837 -3.965 1.00 0.16 C ATOM 534 O6 DG A 17 -1.447 2.828 -3.760 1.00 0.18 O ATOM 535 N1 DG A 17 -3.545 2.666 -2.912 1.00 0.18 N ATOM 536 C2 DG A 17 -4.920 2.659 -3.027 1.00 0.20 C ATOM 537 N2 DG A 17 -5.606 2.481 -1.899 1.00 0.26 N ATOM 538 N3 DG A 17 -5.564 2.818 -4.187 1.00 0.19 N ATOM 539 C4 DG A 17 -4.714 2.987 -5.227 1.00 0.17 C ATOM 0 H5' DG A 17 -9.195 5.162 -4.872 1.00 0.18 H new ATOM 0 H5'' DG A 17 -10.371 3.920 -5.251 1.00 0.18 H new ATOM 0 H4' DG A 17 -9.077 4.427 -7.188 1.00 0.22 H new ATOM 0 H3' DG A 17 -9.253 1.742 -6.199 1.00 0.28 H new ATOM 0 H2' DG A 17 -6.905 1.339 -6.040 1.00 0.25 H new ATOM 0 H2'' DG A 17 -7.013 1.231 -7.785 1.00 0.25 H new ATOM 0 H1' DG A 17 -6.372 3.450 -8.121 1.00 0.21 H new ATOM 0 H8 DG A 17 -3.850 3.458 -8.295 1.00 0.20 H new ATOM 0 H1 DG A 17 -3.150 2.535 -1.981 1.00 0.18 H new ATOM 0 H21 DG A 17 -6.626 2.466 -1.919 1.00 0.26 H new ATOM 0 H22 DG A 17 -5.112 2.359 -1.015 1.00 0.26 H new ATOM 551 P DG A 18 -9.418 0.848 -8.908 1.00 0.43 P ATOM 552 OP1 DG A 18 -10.320 1.029 -10.067 1.00 0.56 O ATOM 553 OP2 DG A 18 -9.737 -0.164 -7.875 1.00 0.49 O ATOM 554 O5' DG A 18 -7.937 0.548 -9.464 1.00 0.34 O ATOM 555 C5' DG A 18 -7.364 1.373 -10.481 1.00 0.34 C ATOM 556 C4' DG A 18 -5.960 0.910 -10.857 1.00 0.28 C ATOM 557 O4' DG A 18 -5.115 0.952 -9.703 1.00 0.27 O ATOM 558 C3' DG A 18 -5.906 -0.520 -11.408 1.00 0.23 C ATOM 559 O3' DG A 18 -5.215 -0.516 -12.663 1.00 0.24 O ATOM 560 C2' DG A 18 -5.105 -1.304 -10.373 1.00 0.23 C ATOM 561 C1' DG A 18 -4.291 -0.208 -9.711 1.00 0.23 C ATOM 562 N9 DG A 18 -3.909 -0.497 -8.315 1.00 0.23 N ATOM 563 C8 DG A 18 -4.716 -0.641 -7.216 1.00 0.24 C ATOM 564 N7 DG A 18 -4.068 -0.882 -6.111 1.00 0.24 N ATOM 565 C5 DG A 18 -2.733 -0.899 -6.502 1.00 0.23 C ATOM 566 C6 DG A 18 -1.561 -1.115 -5.728 1.00 0.24 C ATOM 567 O6 DG A 18 -1.474 -1.336 -4.522 1.00 0.27 O ATOM 568 N1 DG A 18 -0.416 -1.050 -6.510 1.00 0.24 N ATOM 569 C2 DG A 18 -0.397 -0.809 -7.867 1.00 0.22 C ATOM 570 N2 DG A 18 0.803 -0.788 -8.447 1.00 0.22 N ATOM 571 N3 DG A 18 -1.499 -0.606 -8.597 1.00 0.21 N ATOM 572 C4 DG A 18 -2.625 -0.665 -7.851 1.00 0.21 C ATOM 0 H5' DG A 18 -7.326 2.406 -10.134 1.00 0.34 H new ATOM 0 H5'' DG A 18 -8.002 1.357 -11.365 1.00 0.34 H new ATOM 0 H4' DG A 18 -5.627 1.589 -11.642 1.00 0.28 H new ATOM 0 H3' DG A 18 -6.895 -0.949 -11.572 1.00 0.23 H new ATOM 0 H2' DG A 18 -5.751 -1.819 -9.662 1.00 0.23 H new ATOM 0 H2'' DG A 18 -4.471 -2.061 -10.835 1.00 0.23 H new ATOM 0 H1' DG A 18 -3.362 -0.096 -10.270 1.00 0.23 H new ATOM 0 H8 DG A 18 -5.792 -0.562 -7.262 1.00 0.24 H new ATOM 0 H1 DG A 18 0.480 -1.191 -6.045 1.00 0.24 H new ATOM 0 H21 DG A 18 0.882 -0.615 -9.449 1.00 0.22 H new ATOM 0 H22 DG A 18 1.642 -0.945 -7.889 1.00 0.22 H new ATOM 584 P DG A 19 -5.079 -1.868 -13.528 1.00 0.23 P ATOM 585 OP1 DG A 19 -5.116 -1.507 -14.962 1.00 0.28 O ATOM 586 OP2 DG A 19 -6.041 -2.857 -12.991 1.00 0.27 O ATOM 587 O5' DG A 19 -3.592 -2.365 -13.170 1.00 0.23 O ATOM 588 C5' DG A 19 -2.451 -1.693 -13.713 1.00 0.26 C ATOM 589 C4' DG A 19 -1.148 -2.331 -13.243 1.00 0.31 C ATOM 590 O4' DG A 19 -1.048 -2.223 -11.819 1.00 0.29 O ATOM 591 C3' DG A 19 -1.024 -3.818 -13.597 1.00 0.35 C ATOM 592 O3' DG A 19 0.263 -4.065 -14.170 1.00 0.47 O ATOM 593 C2' DG A 19 -1.134 -4.531 -12.255 1.00 0.31 C ATOM 594 C1' DG A 19 -0.597 -3.474 -11.310 1.00 0.29 C ATOM 595 N9 DG A 19 -1.076 -3.600 -9.922 1.00 0.23 N ATOM 596 C8 DG A 19 -2.358 -3.518 -9.444 1.00 0.21 C ATOM 597 N7 DG A 19 -2.454 -3.680 -8.154 1.00 0.20 N ATOM 598 C5 DG A 19 -1.140 -3.885 -7.745 1.00 0.22 C ATOM 599 C6 DG A 19 -0.619 -4.120 -6.444 1.00 0.26 C ATOM 600 O6 DG A 19 -1.230 -4.194 -5.379 1.00 0.28 O ATOM 601 N1 DG A 19 0.760 -4.274 -6.468 1.00 0.30 N ATOM 602 C2 DG A 19 1.543 -4.212 -7.602 1.00 0.32 C ATOM 603 N2 DG A 19 2.854 -4.384 -7.426 1.00 0.38 N ATOM 604 N3 DG A 19 1.055 -3.991 -8.826 1.00 0.30 N ATOM 605 C4 DG A 19 -0.290 -3.838 -8.820 1.00 0.24 C ATOM 0 H5' DG A 19 -2.471 -0.644 -13.417 1.00 0.26 H new ATOM 0 H5'' DG A 19 -2.497 -1.718 -14.802 1.00 0.26 H new ATOM 0 H4' DG A 19 -0.352 -1.793 -13.758 1.00 0.31 H new ATOM 0 H3' DG A 19 -1.776 -4.149 -14.313 1.00 0.35 H new ATOM 0 H2' DG A 19 -2.162 -4.808 -12.020 1.00 0.31 H new ATOM 0 H2'' DG A 19 -0.543 -5.446 -12.226 1.00 0.31 H new ATOM 0 H1' DG A 19 0.487 -3.578 -11.268 1.00 0.29 H new ATOM 0 H8 DG A 19 -3.212 -3.336 -10.079 1.00 0.21 H new ATOM 0 H1 DG A 19 1.230 -4.446 -5.579 1.00 0.30 H new ATOM 0 H21 DG A 19 3.485 -4.349 -8.227 1.00 0.38 H new ATOM 0 H22 DG A 19 3.225 -4.550 -6.491 1.00 0.38 H new ATOM 617 P DC A 20 0.572 -5.460 -14.916 1.00 0.57 P ATOM 618 OP1 DC A 20 1.938 -5.388 -15.483 1.00 0.69 O ATOM 619 OP2 DC A 20 -0.575 -5.777 -15.796 1.00 0.60 O ATOM 620 O5' DC A 20 0.585 -6.519 -13.703 1.00 0.54 O ATOM 621 C5' DC A 20 1.672 -6.547 -12.774 1.00 0.63 C ATOM 622 C4' DC A 20 1.595 -7.767 -11.857 1.00 0.61 C ATOM 623 O4' DC A 20 0.371 -7.744 -11.122 1.00 0.38 O ATOM 624 C3' DC A 20 1.629 -9.096 -12.594 1.00 0.84 C ATOM 625 O3' DC A 20 2.972 -9.537 -12.824 1.00 1.12 O ATOM 626 C2' DC A 20 0.890 -10.027 -11.646 1.00 0.78 C ATOM 627 C1' DC A 20 -0.112 -9.088 -10.971 1.00 0.50 C ATOM 628 N1 DC A 20 -1.469 -9.142 -11.547 1.00 0.66 N ATOM 629 C2 DC A 20 -2.462 -9.733 -10.782 1.00 0.85 C ATOM 630 O2 DC A 20 -2.194 -10.189 -9.672 1.00 0.83 O ATOM 631 N3 DC A 20 -3.722 -9.791 -11.293 1.00 1.11 N ATOM 632 C4 DC A 20 -3.997 -9.290 -12.504 1.00 1.16 C ATOM 633 N4 DC A 20 -5.243 -9.363 -12.974 1.00 1.45 N ATOM 634 C5 DC A 20 -2.976 -8.680 -13.297 1.00 0.96 C ATOM 635 C6 DC A 20 -1.732 -8.626 -12.783 1.00 0.75 C ATOM 0 H5' DC A 20 1.662 -5.638 -12.173 1.00 0.63 H new ATOM 0 H5'' DC A 20 2.616 -6.559 -13.318 1.00 0.63 H new ATOM 0 H4' DC A 20 2.475 -7.700 -11.217 1.00 0.61 H new ATOM 0 H3' DC A 20 1.180 -9.048 -13.586 1.00 0.84 H new ATOM 0 H2' DC A 20 0.391 -10.836 -12.179 1.00 0.78 H new ATOM 0 H2'' DC A 20 1.563 -10.488 -10.924 1.00 0.78 H new ATOM 0 HO3' DC A 20 2.958 -10.395 -13.298 1.00 1.12 H new ATOM 0 H1' DC A 20 -0.191 -9.405 -9.931 1.00 0.50 H new ATOM 0 H41 DC A 20 -5.464 -8.985 -13.895 1.00 1.45 H new ATOM 0 H42 DC A 20 -5.975 -9.797 -12.412 1.00 1.45 H new ATOM 0 H5 DC A 20 -3.194 -8.276 -14.275 1.00 0.96 H new ATOM 0 H6 DC A 20 -0.936 -8.171 -13.354 1.00 0.75 H new TER 648 DC A 20