USER MOD reduce.3.24.130724 H: found=0, std=0, add=245, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 245 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 DG O5' : rot 180:sc= 0 USER MOD Single : A 15 DT C7 :methyl -30:sc=-0.00212 (180deg=-0.322) USER MOD Single : A 22 DC O3' : rot -47:sc= 0.437 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 1.325 8.430 6.472 1.00 0.00 O ATOM 2 C5' DG A 1 0.128 9.102 6.067 1.00 0.00 C ATOM 3 C4' DG A 1 -1.115 8.192 6.074 1.00 0.00 C ATOM 4 O4' DG A 1 -0.928 7.097 5.176 1.00 0.00 O ATOM 5 C3' DG A 1 -1.437 7.580 7.463 1.00 0.00 C ATOM 6 O3' DG A 1 -2.819 7.582 7.791 1.00 0.00 O ATOM 7 C2' DG A 1 -1.074 6.115 7.230 1.00 0.00 C ATOM 8 C1' DG A 1 -1.583 6.007 5.794 1.00 0.00 C ATOM 9 N9 DG A 1 -1.422 4.696 5.114 1.00 0.00 N ATOM 10 C8 DG A 1 -2.368 4.069 4.337 1.00 0.00 C ATOM 11 N7 DG A 1 -1.932 3.007 3.711 1.00 0.00 N ATOM 12 C5 DG A 1 -0.617 2.893 4.155 1.00 0.00 C ATOM 13 C6 DG A 1 0.379 1.925 3.808 1.00 0.00 C ATOM 14 O6 DG A 1 0.293 1.020 2.984 1.00 0.00 O ATOM 15 N1 DG A 1 1.572 2.072 4.489 1.00 0.00 N ATOM 16 C2 DG A 1 1.780 3.059 5.389 1.00 0.00 C ATOM 17 N2 DG A 1 2.953 3.055 5.972 1.00 0.00 N ATOM 18 N3 DG A 1 0.907 4.022 5.702 1.00 0.00 N ATOM 19 C4 DG A 1 -0.295 3.883 5.057 1.00 0.00 C ATOM 0 H5' DG A 1 0.268 9.506 5.064 1.00 0.00 H new ATOM 0 H5'' DG A 1 -0.047 9.949 6.730 1.00 0.00 H new ATOM 0 H4' DG A 1 -1.942 8.838 5.777 1.00 0.00 H new ATOM 0 H3' DG A 1 -0.925 8.126 8.255 1.00 0.00 H new ATOM 0 H2' DG A 1 -0.005 5.920 7.320 1.00 0.00 H new ATOM 0 H2'' DG A 1 -1.581 5.435 7.915 1.00 0.00 H new ATOM 0 HO5' DG A 1 2.077 9.057 6.446 1.00 0.00 H new ATOM 0 H1' DG A 1 -2.671 6.056 5.739 1.00 0.00 H new ATOM 0 H8 DG A 1 -3.384 4.424 4.251 1.00 0.00 H new ATOM 0 H1 DG A 1 2.326 1.410 4.305 1.00 0.00 H new ATOM 0 H21 DG A 1 3.182 3.770 6.663 1.00 0.00 H new ATOM 0 H22 DG A 1 3.638 2.337 5.735 1.00 0.00 H new ATOM 32 P DG A 2 -3.631 8.879 8.298 1.00 0.00 P ATOM 33 OP1 DG A 2 -3.444 10.003 7.345 1.00 0.00 O ATOM 34 OP2 DG A 2 -3.314 9.084 9.736 1.00 0.00 O ATOM 35 O5' DG A 2 -5.146 8.320 8.184 1.00 0.00 O ATOM 36 C5' DG A 2 -5.783 8.117 6.911 1.00 0.00 C ATOM 37 C4' DG A 2 -6.400 6.713 6.719 1.00 0.00 C ATOM 38 O4' DG A 2 -5.423 5.738 6.353 1.00 0.00 O ATOM 39 C3' DG A 2 -7.158 6.174 7.961 1.00 0.00 C ATOM 40 O3' DG A 2 -8.446 5.611 7.685 1.00 0.00 O ATOM 41 C2' DG A 2 -6.222 5.042 8.395 1.00 0.00 C ATOM 42 C1' DG A 2 -5.800 4.545 7.018 1.00 0.00 C ATOM 43 N9 DG A 2 -4.718 3.535 7.006 1.00 0.00 N ATOM 44 C8 DG A 2 -3.538 3.471 7.714 1.00 0.00 C ATOM 45 N7 DG A 2 -2.757 2.489 7.349 1.00 0.00 N ATOM 46 C5 DG A 2 -3.529 1.774 6.441 1.00 0.00 C ATOM 47 C6 DG A 2 -3.276 0.518 5.796 1.00 0.00 C ATOM 48 O6 DG A 2 -2.304 -0.223 5.945 1.00 0.00 O ATOM 49 N1 DG A 2 -4.294 0.123 4.952 1.00 0.00 N ATOM 50 C2 DG A 2 -5.453 0.796 4.825 1.00 0.00 C ATOM 51 N2 DG A 2 -6.348 0.249 4.049 1.00 0.00 N ATOM 52 N3 DG A 2 -5.750 1.947 5.418 1.00 0.00 N ATOM 53 C4 DG A 2 -4.736 2.399 6.220 1.00 0.00 C ATOM 0 H5' DG A 2 -5.052 8.289 6.121 1.00 0.00 H new ATOM 0 H5'' DG A 2 -6.567 8.864 6.788 1.00 0.00 H new ATOM 0 H4' DG A 2 -7.118 6.860 5.912 1.00 0.00 H new ATOM 0 H3' DG A 2 -7.361 6.968 8.679 1.00 0.00 H new ATOM 0 H2' DG A 2 -5.381 5.396 8.992 1.00 0.00 H new ATOM 0 H2'' DG A 2 -6.730 4.277 8.982 1.00 0.00 H new ATOM 0 H1' DG A 2 -6.611 3.998 6.538 1.00 0.00 H new ATOM 0 H8 DG A 2 -3.282 4.168 8.498 1.00 0.00 H new ATOM 0 H1 DG A 2 -4.161 -0.722 4.396 1.00 0.00 H new ATOM 0 H21 DG A 2 -7.249 0.706 3.908 1.00 0.00 H new ATOM 0 H22 DG A 2 -6.147 -0.636 3.583 1.00 0.00 H new ATOM 65 P DC A 3 -9.736 6.498 7.271 1.00 0.00 P ATOM 66 OP1 DC A 3 -9.580 6.948 5.858 1.00 0.00 O ATOM 67 OP2 DC A 3 -9.977 7.524 8.325 1.00 0.00 O ATOM 68 O5' DC A 3 -10.925 5.398 7.301 1.00 0.00 O ATOM 69 C5' DC A 3 -11.717 5.160 8.458 1.00 0.00 C ATOM 70 C4' DC A 3 -12.516 3.840 8.405 1.00 0.00 C ATOM 71 O4' DC A 3 -13.301 3.743 7.211 1.00 0.00 O ATOM 72 C3' DC A 3 -11.599 2.597 8.470 1.00 0.00 C ATOM 73 O3' DC A 3 -12.167 1.612 9.341 1.00 0.00 O ATOM 74 C2' DC A 3 -11.603 2.157 7.008 1.00 0.00 C ATOM 75 C1' DC A 3 -13.037 2.491 6.608 1.00 0.00 C ATOM 76 N1 DC A 3 -13.294 2.493 5.135 1.00 0.00 N ATOM 77 C2 DC A 3 -14.361 1.721 4.642 1.00 0.00 C ATOM 78 O2 DC A 3 -15.153 1.148 5.394 1.00 0.00 O ATOM 79 N3 DC A 3 -14.579 1.596 3.307 1.00 0.00 N ATOM 80 C4 DC A 3 -13.763 2.235 2.487 1.00 0.00 C ATOM 81 N4 DC A 3 -14.008 2.073 1.218 1.00 0.00 N ATOM 82 C5 DC A 3 -12.688 3.060 2.919 1.00 0.00 C ATOM 83 C6 DC A 3 -12.475 3.156 4.256 1.00 0.00 C ATOM 0 H5' DC A 3 -12.412 5.990 8.588 1.00 0.00 H new ATOM 0 H5'' DC A 3 -11.069 5.147 9.334 1.00 0.00 H new ATOM 0 H4' DC A 3 -13.166 3.859 9.280 1.00 0.00 H new ATOM 0 H3' DC A 3 -10.598 2.770 8.865 1.00 0.00 H new ATOM 0 H2' DC A 3 -10.871 2.701 6.411 1.00 0.00 H new ATOM 0 H2'' DC A 3 -11.380 1.096 6.896 1.00 0.00 H new ATOM 0 H1' DC A 3 -13.716 1.712 6.954 1.00 0.00 H new ATOM 0 H41 DC A 3 -13.422 2.534 0.522 1.00 0.00 H new ATOM 0 H42 DC A 3 -14.786 1.485 0.920 1.00 0.00 H new ATOM 0 H5 DC A 3 -12.066 3.589 2.212 1.00 0.00 H new ATOM 0 H6 DC A 3 -11.658 3.756 4.629 1.00 0.00 H new ATOM 95 P DG A 4 -11.368 0.273 9.802 1.00 0.00 P ATOM 96 OP1 DG A 4 -12.091 -0.297 10.975 1.00 0.00 O ATOM 97 OP2 DG A 4 -9.924 0.602 9.958 1.00 0.00 O ATOM 98 O5' DG A 4 -11.521 -0.764 8.566 1.00 0.00 O ATOM 99 C5' DG A 4 -12.788 -1.328 8.231 1.00 0.00 C ATOM 100 C4' DG A 4 -12.781 -2.079 6.886 1.00 0.00 C ATOM 101 O4' DG A 4 -12.553 -1.175 5.801 1.00 0.00 O ATOM 102 C3' DG A 4 -11.705 -3.177 6.798 1.00 0.00 C ATOM 103 O3' DG A 4 -12.278 -4.372 6.275 1.00 0.00 O ATOM 104 C2' DG A 4 -10.707 -2.583 5.812 1.00 0.00 C ATOM 105 C1' DG A 4 -11.648 -1.792 4.906 1.00 0.00 C ATOM 106 N9 DG A 4 -11.002 -0.769 4.059 1.00 0.00 N ATOM 107 C8 DG A 4 -10.136 0.237 4.421 1.00 0.00 C ATOM 108 N7 DG A 4 -9.832 1.062 3.453 1.00 0.00 N ATOM 109 C5 DG A 4 -10.522 0.530 2.349 1.00 0.00 C ATOM 110 C6 DG A 4 -10.635 0.990 0.989 1.00 0.00 C ATOM 111 O6 DG A 4 -10.219 2.025 0.480 1.00 0.00 O ATOM 112 N1 DG A 4 -11.307 0.113 0.165 1.00 0.00 N ATOM 113 C2 DG A 4 -11.900 -1.018 0.601 1.00 0.00 C ATOM 114 N2 DG A 4 -12.416 -1.773 -0.332 1.00 0.00 N ATOM 115 N3 DG A 4 -11.915 -1.438 1.862 1.00 0.00 N ATOM 116 C4 DG A 4 -11.195 -0.619 2.698 1.00 0.00 C ATOM 0 H5' DG A 4 -13.533 -0.534 8.192 1.00 0.00 H new ATOM 0 H5'' DG A 4 -13.094 -2.014 9.021 1.00 0.00 H new ATOM 0 H4' DG A 4 -13.763 -2.547 6.820 1.00 0.00 H new ATOM 0 H3' DG A 4 -11.258 -3.442 7.757 1.00 0.00 H new ATOM 0 H2' DG A 4 -9.970 -1.946 6.301 1.00 0.00 H new ATOM 0 H2'' DG A 4 -10.155 -3.350 5.268 1.00 0.00 H new ATOM 0 H1' DG A 4 -12.106 -2.468 4.184 1.00 0.00 H new ATOM 0 H8 DG A 4 -9.740 0.337 5.421 1.00 0.00 H new ATOM 0 H1 DG A 4 -11.359 0.331 -0.830 1.00 0.00 H new ATOM 0 H21 DG A 4 -12.882 -2.645 -0.082 1.00 0.00 H new ATOM 0 H22 DG A 4 -12.353 -1.490 -1.310 1.00 0.00 H new ATOM 128 P DA A 5 -11.844 -5.832 6.808 1.00 0.00 P ATOM 129 OP1 DA A 5 -12.745 -6.832 6.172 1.00 0.00 O ATOM 130 OP2 DA A 5 -11.759 -5.801 8.293 1.00 0.00 O ATOM 131 O5' DA A 5 -10.346 -6.062 6.230 1.00 0.00 O ATOM 132 C5' DA A 5 -10.097 -6.361 4.859 1.00 0.00 C ATOM 133 C4' DA A 5 -8.621 -6.688 4.576 1.00 0.00 C ATOM 134 O4' DA A 5 -7.768 -5.555 4.717 1.00 0.00 O ATOM 135 C3' DA A 5 -8.087 -7.807 5.514 1.00 0.00 C ATOM 136 O3' DA A 5 -7.658 -9.069 4.979 1.00 0.00 O ATOM 137 C2' DA A 5 -6.881 -7.123 6.157 1.00 0.00 C ATOM 138 C1' DA A 5 -6.514 -6.073 5.117 1.00 0.00 C ATOM 139 N9 DA A 5 -5.595 -5.042 5.645 1.00 0.00 N ATOM 140 C8 DA A 5 -5.857 -3.727 5.931 1.00 0.00 C ATOM 141 N7 DA A 5 -4.806 -3.024 6.287 1.00 0.00 N ATOM 142 C5 DA A 5 -3.764 -3.969 6.193 1.00 0.00 C ATOM 143 C6 DA A 5 -2.358 -3.953 6.412 1.00 0.00 C ATOM 144 N6 DA A 5 -1.656 -2.899 6.749 1.00 0.00 N ATOM 145 N1 DA A 5 -1.611 -5.051 6.246 1.00 0.00 N ATOM 146 C2 DA A 5 -2.214 -6.155 5.827 1.00 0.00 C ATOM 147 N3 DA A 5 -3.503 -6.320 5.550 1.00 0.00 N ATOM 148 C4 DA A 5 -4.229 -5.183 5.757 1.00 0.00 C ATOM 0 H5' DA A 5 -10.400 -5.512 4.246 1.00 0.00 H new ATOM 0 H5'' DA A 5 -10.715 -7.207 4.559 1.00 0.00 H new ATOM 0 H4' DA A 5 -8.600 -7.025 3.539 1.00 0.00 H new ATOM 0 H3' DA A 5 -8.921 -8.131 6.136 1.00 0.00 H new ATOM 0 H2' DA A 5 -7.132 -6.674 7.118 1.00 0.00 H new ATOM 0 H2'' DA A 5 -6.064 -7.822 6.336 1.00 0.00 H new ATOM 0 H1' DA A 5 -5.954 -6.487 4.279 1.00 0.00 H new ATOM 0 H8 DA A 5 -6.848 -3.303 5.869 1.00 0.00 H new ATOM 0 H61 DA A 5 -0.648 -2.980 6.886 1.00 0.00 H new ATOM 0 H62 DA A 5 -2.117 -1.998 6.874 1.00 0.00 H new ATOM 0 H2 DA A 5 -1.583 -7.022 5.695 1.00 0.00 H new ATOM 160 P DG A 6 -7.581 -9.460 3.398 1.00 0.00 P ATOM 161 OP1 DG A 6 -8.916 -9.234 2.784 1.00 0.00 O ATOM 162 OP2 DG A 6 -6.975 -10.815 3.302 1.00 0.00 O ATOM 163 O5' DG A 6 -6.505 -8.404 2.809 1.00 0.00 O ATOM 164 C5' DG A 6 -6.421 -8.051 1.431 1.00 0.00 C ATOM 165 C4' DG A 6 -7.426 -6.980 0.976 1.00 0.00 C ATOM 166 O4' DG A 6 -7.156 -5.766 1.657 1.00 0.00 O ATOM 167 C3' DG A 6 -7.312 -6.695 -0.533 1.00 0.00 C ATOM 168 O3' DG A 6 -8.606 -6.323 -1.016 1.00 0.00 O ATOM 169 C2' DG A 6 -6.270 -5.574 -0.529 1.00 0.00 C ATOM 170 C1' DG A 6 -6.723 -4.809 0.712 1.00 0.00 C ATOM 171 N9 DG A 6 -5.731 -3.956 1.395 1.00 0.00 N ATOM 172 C8 DG A 6 -6.064 -2.823 2.079 1.00 0.00 C ATOM 173 N7 DG A 6 -5.124 -2.325 2.838 1.00 0.00 N ATOM 174 C5 DG A 6 -4.062 -3.204 2.611 1.00 0.00 C ATOM 175 C6 DG A 6 -2.719 -3.188 3.125 1.00 0.00 C ATOM 176 O6 DG A 6 -2.205 -2.327 3.823 1.00 0.00 O ATOM 177 N1 DG A 6 -1.965 -4.284 2.783 1.00 0.00 N ATOM 178 C2 DG A 6 -2.418 -5.276 1.990 1.00 0.00 C ATOM 179 N2 DG A 6 -1.583 -6.244 1.742 1.00 0.00 N ATOM 180 N3 DG A 6 -3.631 -5.318 1.436 1.00 0.00 N ATOM 181 C4 DG A 6 -4.425 -4.245 1.777 1.00 0.00 C ATOM 0 H5' DG A 6 -6.572 -8.948 0.831 1.00 0.00 H new ATOM 0 H5'' DG A 6 -5.412 -7.694 1.223 1.00 0.00 H new ATOM 0 H4' DG A 6 -8.425 -7.355 1.198 1.00 0.00 H new ATOM 0 H3' DG A 6 -7.010 -7.513 -1.187 1.00 0.00 H new ATOM 0 H2' DG A 6 -5.251 -5.950 -0.440 1.00 0.00 H new ATOM 0 H2'' DG A 6 -6.307 -4.965 -1.432 1.00 0.00 H new ATOM 0 H1' DG A 6 -7.484 -4.119 0.346 1.00 0.00 H new ATOM 0 H8 DG A 6 -7.040 -2.368 1.998 1.00 0.00 H new ATOM 0 H1 DG A 6 -1.015 -4.351 3.147 1.00 0.00 H new ATOM 0 H21 DG A 6 -1.867 -7.023 1.149 1.00 0.00 H new ATOM 0 H22 DG A 6 -0.645 -6.223 2.141 1.00 0.00 H new ATOM 193 P DG A 7 -8.894 -5.779 -2.514 1.00 0.00 P ATOM 194 OP1 DG A 7 -10.350 -5.932 -2.766 1.00 0.00 O ATOM 195 OP2 DG A 7 -7.951 -6.447 -3.447 1.00 0.00 O ATOM 196 O5' DG A 7 -8.531 -4.199 -2.441 1.00 0.00 O ATOM 197 C5' DG A 7 -9.339 -3.296 -1.689 1.00 0.00 C ATOM 198 C4' DG A 7 -8.712 -1.893 -1.577 1.00 0.00 C ATOM 199 O4' DG A 7 -7.494 -1.941 -0.839 1.00 0.00 O ATOM 200 C3' DG A 7 -8.406 -1.237 -2.935 1.00 0.00 C ATOM 201 O3' DG A 7 -8.897 0.098 -3.009 1.00 0.00 O ATOM 202 C2' DG A 7 -6.878 -1.238 -2.978 1.00 0.00 C ATOM 203 C1' DG A 7 -6.574 -1.071 -1.487 1.00 0.00 C ATOM 204 N9 DG A 7 -5.180 -1.353 -1.070 1.00 0.00 N ATOM 205 C8 DG A 7 -4.311 -2.350 -1.466 1.00 0.00 C ATOM 206 N7 DG A 7 -3.165 -2.337 -0.827 1.00 0.00 N ATOM 207 C5 DG A 7 -3.263 -1.222 -0.009 1.00 0.00 C ATOM 208 C6 DG A 7 -2.301 -0.656 0.895 1.00 0.00 C ATOM 209 O6 DG A 7 -1.163 -1.057 1.116 1.00 0.00 O ATOM 210 N1 DG A 7 -2.761 0.461 1.564 1.00 0.00 N ATOM 211 C2 DG A 7 -3.977 1.015 1.340 1.00 0.00 C ATOM 212 N2 DG A 7 -4.204 2.134 1.966 1.00 0.00 N ATOM 213 N3 DG A 7 -4.892 0.554 0.476 1.00 0.00 N ATOM 214 C4 DG A 7 -4.479 -0.595 -0.158 1.00 0.00 C ATOM 0 H5' DG A 7 -9.496 -3.701 -0.689 1.00 0.00 H new ATOM 0 H5'' DG A 7 -10.320 -3.215 -2.158 1.00 0.00 H new ATOM 0 H4' DG A 7 -9.464 -1.290 -1.068 1.00 0.00 H new ATOM 0 H3' DG A 7 -8.877 -1.764 -3.764 1.00 0.00 H new ATOM 0 H2' DG A 7 -6.473 -2.164 -3.385 1.00 0.00 H new ATOM 0 H2'' DG A 7 -6.477 -0.422 -3.580 1.00 0.00 H new ATOM 0 H1' DG A 7 -6.684 -0.021 -1.214 1.00 0.00 H new ATOM 0 H8 DG A 7 -4.552 -3.073 -2.231 1.00 0.00 H new ATOM 0 H1 DG A 7 -2.154 0.891 2.262 1.00 0.00 H new ATOM 0 H21 DG A 7 -5.097 2.612 1.848 1.00 0.00 H new ATOM 0 H22 DG A 7 -3.489 2.532 2.574 1.00 0.00 H new ATOM 226 P DA A 8 -10.428 0.409 -3.443 1.00 0.00 P ATOM 227 OP1 DA A 8 -10.632 1.881 -3.419 1.00 0.00 O ATOM 228 OP2 DA A 8 -11.334 -0.439 -2.622 1.00 0.00 O ATOM 229 O5' DA A 8 -10.476 -0.087 -4.981 1.00 0.00 O ATOM 230 C5' DA A 8 -11.710 -0.204 -5.684 1.00 0.00 C ATOM 231 C4' DA A 8 -11.542 -0.558 -7.172 1.00 0.00 C ATOM 232 O4' DA A 8 -10.925 0.524 -7.868 1.00 0.00 O ATOM 233 C3' DA A 8 -10.680 -1.820 -7.398 1.00 0.00 C ATOM 234 O3' DA A 8 -11.225 -2.609 -8.458 1.00 0.00 O ATOM 235 C2' DA A 8 -9.348 -1.196 -7.803 1.00 0.00 C ATOM 236 C1' DA A 8 -9.815 0.017 -8.587 1.00 0.00 C ATOM 237 N9 DA A 8 -8.754 1.037 -8.750 1.00 0.00 N ATOM 238 C8 DA A 8 -8.136 1.806 -7.791 1.00 0.00 C ATOM 239 N7 DA A 8 -7.194 2.595 -8.252 1.00 0.00 N ATOM 240 C5 DA A 8 -7.172 2.290 -9.626 1.00 0.00 C ATOM 241 C6 DA A 8 -6.424 2.725 -10.753 1.00 0.00 C ATOM 242 N6 DA A 8 -5.488 3.654 -10.756 1.00 0.00 N ATOM 243 N1 DA A 8 -6.635 2.212 -11.966 1.00 0.00 N ATOM 244 C2 DA A 8 -7.574 1.285 -12.104 1.00 0.00 C ATOM 245 N3 DA A 8 -8.376 0.796 -11.163 1.00 0.00 N ATOM 246 C4 DA A 8 -8.112 1.338 -9.934 1.00 0.00 C ATOM 0 H5' DA A 8 -12.255 0.736 -5.602 1.00 0.00 H new ATOM 0 H5'' DA A 8 -12.320 -0.969 -5.204 1.00 0.00 H new ATOM 0 H4' DA A 8 -12.545 -0.753 -7.551 1.00 0.00 H new ATOM 0 H3' DA A 8 -10.614 -2.491 -6.541 1.00 0.00 H new ATOM 0 H2' DA A 8 -8.744 -0.920 -6.939 1.00 0.00 H new ATOM 0 H2'' DA A 8 -8.745 -1.871 -8.410 1.00 0.00 H new ATOM 0 H1' DA A 8 -10.083 -0.259 -9.607 1.00 0.00 H new ATOM 0 H8 DA A 8 -8.404 1.764 -6.746 1.00 0.00 H new ATOM 0 H61 DA A 8 -5.009 3.892 -11.624 1.00 0.00 H new ATOM 0 H62 DA A 8 -5.243 4.134 -9.890 1.00 0.00 H new ATOM 0 H2 DA A 8 -7.702 0.880 -13.097 1.00 0.00 H new ATOM 258 P DG A 9 -10.973 -4.208 -8.598 1.00 0.00 P ATOM 259 OP1 DG A 9 -11.909 -4.690 -9.652 1.00 0.00 O ATOM 260 OP2 DG A 9 -11.044 -4.836 -7.250 1.00 0.00 O ATOM 261 O5' DG A 9 -9.472 -4.369 -9.203 1.00 0.00 O ATOM 262 C5' DG A 9 -8.335 -4.610 -8.389 1.00 0.00 C ATOM 263 C4' DG A 9 -7.044 -4.483 -9.214 1.00 0.00 C ATOM 264 O4' DG A 9 -6.802 -3.145 -9.638 1.00 0.00 O ATOM 265 C3' DG A 9 -5.773 -4.922 -8.451 1.00 0.00 C ATOM 266 O3' DG A 9 -5.250 -6.121 -9.023 1.00 0.00 O ATOM 267 C2' DG A 9 -4.800 -3.757 -8.680 1.00 0.00 C ATOM 268 C1' DG A 9 -5.421 -3.073 -9.907 1.00 0.00 C ATOM 269 N9 DG A 9 -4.935 -1.696 -10.188 1.00 0.00 N ATOM 270 C8 DG A 9 -4.458 -0.724 -9.336 1.00 0.00 C ATOM 271 N7 DG A 9 -3.937 0.318 -9.942 1.00 0.00 N ATOM 272 C5 DG A 9 -4.111 0.025 -11.304 1.00 0.00 C ATOM 273 C6 DG A 9 -3.753 0.759 -12.495 1.00 0.00 C ATOM 274 O6 DG A 9 -3.168 1.837 -12.599 1.00 0.00 O ATOM 275 N1 DG A 9 -4.132 0.129 -13.669 1.00 0.00 N ATOM 276 C2 DG A 9 -4.744 -1.081 -13.710 1.00 0.00 C ATOM 277 N2 DG A 9 -5.024 -1.581 -14.893 1.00 0.00 N ATOM 278 N3 DG A 9 -5.072 -1.803 -12.644 1.00 0.00 N ATOM 279 C4 DG A 9 -4.735 -1.194 -11.463 1.00 0.00 C ATOM 0 H5' DG A 9 -8.398 -5.607 -7.953 1.00 0.00 H new ATOM 0 H5'' DG A 9 -8.316 -3.901 -7.562 1.00 0.00 H new ATOM 0 H4' DG A 9 -7.220 -5.146 -10.061 1.00 0.00 H new ATOM 0 H3' DG A 9 -5.953 -5.127 -7.396 1.00 0.00 H new ATOM 0 H2' DG A 9 -4.751 -3.089 -7.820 1.00 0.00 H new ATOM 0 H2'' DG A 9 -3.785 -4.103 -8.874 1.00 0.00 H new ATOM 0 H1' DG A 9 -5.133 -3.570 -10.833 1.00 0.00 H new ATOM 0 H8 DG A 9 -4.508 -0.812 -8.261 1.00 0.00 H new ATOM 0 H1 DG A 9 -3.940 0.601 -14.552 1.00 0.00 H new ATOM 0 H21 DG A 9 -5.484 -2.488 -14.967 1.00 0.00 H new ATOM 0 H22 DG A 9 -4.781 -1.062 -15.737 1.00 0.00 H new ATOM 291 P DG A 10 -4.591 -7.316 -8.132 1.00 0.00 P ATOM 292 OP1 DG A 10 -4.463 -8.496 -9.028 1.00 0.00 O ATOM 293 OP2 DG A 10 -5.368 -7.477 -6.876 1.00 0.00 O ATOM 294 O5' DG A 10 -3.075 -6.829 -7.777 1.00 0.00 O ATOM 295 C5' DG A 10 -2.802 -5.873 -6.750 1.00 0.00 C ATOM 296 C4' DG A 10 -1.367 -5.342 -6.884 1.00 0.00 C ATOM 297 O4' DG A 10 -1.282 -4.066 -6.250 1.00 0.00 O ATOM 298 C3' DG A 10 -0.321 -6.275 -6.225 1.00 0.00 C ATOM 299 O3' DG A 10 0.898 -6.274 -6.972 1.00 0.00 O ATOM 300 C2' DG A 10 -0.125 -5.571 -4.883 1.00 0.00 C ATOM 301 C1' DG A 10 -0.173 -4.121 -5.361 1.00 0.00 C ATOM 302 N9 DG A 10 -0.274 -3.120 -4.278 1.00 0.00 N ATOM 303 C8 DG A 10 -1.274 -2.197 -4.084 1.00 0.00 C ATOM 304 N7 DG A 10 -0.968 -1.237 -3.253 1.00 0.00 N ATOM 305 C5 DG A 10 0.352 -1.537 -2.874 1.00 0.00 C ATOM 306 C6 DG A 10 1.288 -0.844 -2.027 1.00 0.00 C ATOM 307 O6 DG A 10 1.160 0.219 -1.417 1.00 0.00 O ATOM 308 N1 DG A 10 2.513 -1.481 -1.932 1.00 0.00 N ATOM 309 C2 DG A 10 2.806 -2.645 -2.552 1.00 0.00 C ATOM 310 N2 DG A 10 3.964 -3.191 -2.300 1.00 0.00 N ATOM 311 N3 DG A 10 1.991 -3.306 -3.374 1.00 0.00 N ATOM 312 C4 DG A 10 0.776 -2.688 -3.510 1.00 0.00 C ATOM 0 H5' DG A 10 -2.937 -6.332 -5.771 1.00 0.00 H new ATOM 0 H5'' DG A 10 -3.510 -5.047 -6.815 1.00 0.00 H new ATOM 0 H4' DG A 10 -1.145 -5.282 -7.949 1.00 0.00 H new ATOM 0 H3' DG A 10 -0.621 -7.321 -6.156 1.00 0.00 H new ATOM 0 H2' DG A 10 -0.913 -5.804 -4.167 1.00 0.00 H new ATOM 0 H2'' DG A 10 0.823 -5.826 -4.409 1.00 0.00 H new ATOM 0 H1' DG A 10 0.766 -3.853 -5.845 1.00 0.00 H new ATOM 0 H8 DG A 10 -2.233 -2.260 -4.577 1.00 0.00 H new ATOM 0 H1 DG A 10 3.237 -1.046 -1.360 1.00 0.00 H new ATOM 0 H21 DG A 10 4.222 -4.070 -2.749 1.00 0.00 H new ATOM 0 H22 DG A 10 4.611 -2.739 -1.654 1.00 0.00 H new ATOM 324 P DG A 11 1.715 -7.635 -7.328 1.00 0.00 P ATOM 325 OP1 DG A 11 2.764 -7.268 -8.321 1.00 0.00 O ATOM 326 OP2 DG A 11 0.751 -8.714 -7.685 1.00 0.00 O ATOM 327 O5' DG A 11 2.473 -8.049 -5.960 1.00 0.00 O ATOM 328 C5' DG A 11 1.823 -8.776 -4.921 1.00 0.00 C ATOM 329 C4' DG A 11 2.772 -9.013 -3.733 1.00 0.00 C ATOM 330 O4' DG A 11 3.042 -7.775 -3.060 1.00 0.00 O ATOM 331 C3' DG A 11 2.182 -9.989 -2.694 1.00 0.00 C ATOM 332 O3' DG A 11 3.194 -10.934 -2.320 1.00 0.00 O ATOM 333 C2' DG A 11 1.728 -9.008 -1.609 1.00 0.00 C ATOM 334 C1' DG A 11 2.883 -8.005 -1.676 1.00 0.00 C ATOM 335 N9 DG A 11 2.718 -6.749 -0.892 1.00 0.00 N ATOM 336 C8 DG A 11 3.656 -6.174 -0.064 1.00 0.00 C ATOM 337 N7 DG A 11 3.283 -5.047 0.494 1.00 0.00 N ATOM 338 C5 DG A 11 2.005 -4.847 -0.017 1.00 0.00 C ATOM 339 C6 DG A 11 1.108 -3.759 0.189 1.00 0.00 C ATOM 340 O6 DG A 11 1.294 -2.756 0.866 1.00 0.00 O ATOM 341 N1 DG A 11 -0.095 -3.894 -0.480 1.00 0.00 N ATOM 342 C2 DG A 11 -0.407 -4.971 -1.235 1.00 0.00 C ATOM 343 N2 DG A 11 -1.625 -4.988 -1.700 1.00 0.00 N ATOM 344 N3 DG A 11 0.393 -6.009 -1.450 1.00 0.00 N ATOM 345 C4 DG A 11 1.622 -5.893 -0.834 1.00 0.00 C ATOM 0 H5' DG A 11 1.473 -9.733 -5.307 1.00 0.00 H new ATOM 0 H5'' DG A 11 0.944 -8.227 -4.584 1.00 0.00 H new ATOM 0 H4' DG A 11 3.682 -9.444 -4.149 1.00 0.00 H new ATOM 0 H3' DG A 11 1.356 -10.630 -3.003 1.00 0.00 H new ATOM 0 H2' DG A 11 0.764 -8.552 -1.833 1.00 0.00 H new ATOM 0 H2'' DG A 11 1.638 -9.478 -0.630 1.00 0.00 H new ATOM 0 H1' DG A 11 3.769 -8.418 -1.193 1.00 0.00 H new ATOM 0 H8 DG A 11 4.625 -6.617 0.113 1.00 0.00 H new ATOM 0 H1 DG A 11 -0.781 -3.143 -0.400 1.00 0.00 H new ATOM 0 H21 DG A 11 -1.939 -5.767 -2.279 1.00 0.00 H new ATOM 0 H22 DG A 11 -2.264 -4.222 -1.485 1.00 0.00 H new ATOM 357 P DG A 12 3.240 -11.755 -0.921 1.00 0.00 P ATOM 358 OP1 DG A 12 4.240 -12.849 -1.081 1.00 0.00 O ATOM 359 OP2 DG A 12 1.851 -12.116 -0.531 1.00 0.00 O ATOM 360 O5' DG A 12 3.835 -10.676 0.117 1.00 0.00 O ATOM 361 C5' DG A 12 3.915 -10.940 1.510 1.00 0.00 C ATOM 362 C4' DG A 12 4.662 -9.816 2.254 1.00 0.00 C ATOM 363 O4' DG A 12 3.968 -8.577 2.161 1.00 0.00 O ATOM 364 C3' DG A 12 4.805 -10.142 3.759 1.00 0.00 C ATOM 365 O3' DG A 12 6.153 -10.459 4.134 1.00 0.00 O ATOM 366 C2' DG A 12 4.150 -8.944 4.454 1.00 0.00 C ATOM 367 C1' DG A 12 4.139 -7.865 3.379 1.00 0.00 C ATOM 368 N9 DG A 12 3.048 -6.872 3.546 1.00 0.00 N ATOM 369 C8 DG A 12 1.811 -6.850 2.947 1.00 0.00 C ATOM 370 N7 DG A 12 1.063 -5.822 3.259 1.00 0.00 N ATOM 371 C5 DG A 12 1.876 -5.116 4.152 1.00 0.00 C ATOM 372 C6 DG A 12 1.621 -3.911 4.890 1.00 0.00 C ATOM 373 O6 DG A 12 0.610 -3.218 4.875 1.00 0.00 O ATOM 374 N1 DG A 12 2.662 -3.525 5.711 1.00 0.00 N ATOM 375 C2 DG A 12 3.848 -4.175 5.767 1.00 0.00 C ATOM 376 N2 DG A 12 4.765 -3.646 6.529 1.00 0.00 N ATOM 377 N3 DG A 12 4.138 -5.301 5.109 1.00 0.00 N ATOM 378 C4 DG A 12 3.098 -5.733 4.327 1.00 0.00 C ATOM 0 H5' DG A 12 4.426 -11.889 1.673 1.00 0.00 H new ATOM 0 H5'' DG A 12 2.911 -11.045 1.920 1.00 0.00 H new ATOM 0 H4' DG A 12 5.641 -9.739 1.781 1.00 0.00 H new ATOM 0 H3' DG A 12 4.305 -11.061 4.066 1.00 0.00 H new ATOM 0 H2' DG A 12 3.142 -9.180 4.794 1.00 0.00 H new ATOM 0 H2'' DG A 12 4.717 -8.630 5.330 1.00 0.00 H new ATOM 0 H1' DG A 12 5.057 -7.280 3.421 1.00 0.00 H new ATOM 0 H8 DG A 12 1.481 -7.623 2.269 1.00 0.00 H new ATOM 0 H1 DG A 12 2.530 -2.707 6.306 1.00 0.00 H new ATOM 0 H21 DG A 12 5.679 -4.091 6.611 1.00 0.00 H new ATOM 0 H22 DG A 12 4.568 -2.787 7.043 1.00 0.00 H new ATOM 390 P DC A 13 7.418 -9.410 4.188 1.00 0.00 P ATOM 391 OP1 DC A 13 7.332 -8.444 3.059 1.00 0.00 O ATOM 392 OP2 DC A 13 8.644 -10.250 4.285 1.00 0.00 O ATOM 393 O5' DC A 13 7.284 -8.579 5.571 1.00 0.00 O ATOM 394 C5' DC A 13 7.335 -9.236 6.837 1.00 0.00 C ATOM 395 C4' DC A 13 7.432 -8.252 8.021 1.00 0.00 C ATOM 396 O4' DC A 13 8.680 -7.557 8.013 1.00 0.00 O ATOM 397 C3' DC A 13 6.312 -7.186 8.036 1.00 0.00 C ATOM 398 O3' DC A 13 5.553 -7.168 9.242 1.00 0.00 O ATOM 399 C2' DC A 13 7.070 -5.870 7.903 1.00 0.00 C ATOM 400 C1' DC A 13 8.434 -6.249 8.488 1.00 0.00 C ATOM 401 N1 DC A 13 9.576 -5.322 8.193 1.00 0.00 N ATOM 402 C2 DC A 13 10.314 -4.798 9.269 1.00 0.00 C ATOM 403 O2 DC A 13 10.079 -5.125 10.437 1.00 0.00 O ATOM 404 N3 DC A 13 11.325 -3.912 9.065 1.00 0.00 N ATOM 405 C4 DC A 13 11.592 -3.550 7.824 1.00 0.00 C ATOM 406 N4 DC A 13 12.567 -2.701 7.679 1.00 0.00 N ATOM 407 C5 DC A 13 10.891 -4.044 6.691 1.00 0.00 C ATOM 408 C6 DC A 13 9.895 -4.942 6.906 1.00 0.00 C ATOM 0 H5' DC A 13 8.194 -9.907 6.858 1.00 0.00 H new ATOM 0 H5'' DC A 13 6.445 -9.853 6.956 1.00 0.00 H new ATOM 0 H4' DC A 13 7.332 -8.877 8.908 1.00 0.00 H new ATOM 0 H3' DC A 13 5.586 -7.382 7.247 1.00 0.00 H new ATOM 0 H2' DC A 13 7.144 -5.541 6.866 1.00 0.00 H new ATOM 0 H2'' DC A 13 6.594 -5.063 8.460 1.00 0.00 H new ATOM 0 H1' DC A 13 8.381 -6.177 9.574 1.00 0.00 H new ATOM 0 H41 DC A 13 12.828 -2.378 6.747 1.00 0.00 H new ATOM 0 H42 DC A 13 13.071 -2.359 8.497 1.00 0.00 H new ATOM 0 H5 DC A 13 11.142 -3.717 5.693 1.00 0.00 H new ATOM 0 H6 DC A 13 9.353 -5.358 6.070 1.00 0.00 H new ATOM 420 P DG A 14 4.576 -8.398 9.646 1.00 0.00 P ATOM 421 OP1 DG A 14 5.375 -9.374 10.431 1.00 0.00 O ATOM 422 OP2 DG A 14 3.835 -8.860 8.439 1.00 0.00 O ATOM 423 O5' DG A 14 3.528 -7.690 10.650 1.00 0.00 O ATOM 424 C5' DG A 14 2.627 -6.693 10.179 1.00 0.00 C ATOM 425 C4' DG A 14 1.705 -6.115 11.272 1.00 0.00 C ATOM 426 O4' DG A 14 0.826 -7.118 11.783 1.00 0.00 O ATOM 427 C3' DG A 14 2.479 -5.522 12.468 1.00 0.00 C ATOM 428 O3' DG A 14 1.905 -4.263 12.801 1.00 0.00 O ATOM 429 C2' DG A 14 2.295 -6.614 13.526 1.00 0.00 C ATOM 430 C1' DG A 14 0.870 -7.047 13.199 1.00 0.00 C ATOM 431 N9 DG A 14 0.444 -8.326 13.819 1.00 0.00 N ATOM 432 C8 DG A 14 1.185 -9.460 14.059 1.00 0.00 C ATOM 433 N7 DG A 14 0.525 -10.418 14.666 1.00 0.00 N ATOM 434 C5 DG A 14 -0.754 -9.867 14.859 1.00 0.00 C ATOM 435 C6 DG A 14 -1.944 -10.390 15.486 1.00 0.00 C ATOM 436 O6 DG A 14 -2.136 -11.494 16.003 1.00 0.00 O ATOM 437 N1 DG A 14 -3.009 -9.502 15.482 1.00 0.00 N ATOM 438 C2 DG A 14 -2.950 -8.262 14.935 1.00 0.00 C ATOM 439 N2 DG A 14 -4.019 -7.516 15.000 1.00 0.00 N ATOM 440 N3 DG A 14 -1.877 -7.736 14.350 1.00 0.00 N ATOM 441 C4 DG A 14 -0.806 -8.588 14.340 1.00 0.00 C ATOM 0 H5' DG A 14 2.012 -7.119 9.387 1.00 0.00 H new ATOM 0 H5'' DG A 14 3.201 -5.880 9.735 1.00 0.00 H new ATOM 0 H4' DG A 14 1.147 -5.316 10.783 1.00 0.00 H new ATOM 0 H3' DG A 14 3.536 -5.303 12.314 1.00 0.00 H new ATOM 0 H2' DG A 14 3.014 -7.426 13.419 1.00 0.00 H new ATOM 0 H2'' DG A 14 2.394 -6.233 14.542 1.00 0.00 H new ATOM 0 H1' DG A 14 0.165 -6.329 13.618 1.00 0.00 H new ATOM 0 H8 DG A 14 2.222 -9.554 13.772 1.00 0.00 H new ATOM 0 H1 DG A 14 -3.885 -9.797 15.914 1.00 0.00 H new ATOM 0 H21 DG A 14 -4.011 -6.578 14.599 1.00 0.00 H new ATOM 0 H22 DG A 14 -4.862 -7.871 15.451 1.00 0.00 H new ATOM 453 P DT A 15 2.295 -3.419 14.135 1.00 0.00 P ATOM 454 OP1 DT A 15 3.770 -3.420 14.331 1.00 0.00 O ATOM 455 OP2 DT A 15 1.426 -3.882 15.248 1.00 0.00 O ATOM 456 O5' DT A 15 1.810 -1.922 13.726 1.00 0.00 O ATOM 457 C5' DT A 15 2.617 -1.061 12.933 1.00 0.00 C ATOM 458 C4' DT A 15 1.798 0.025 12.211 1.00 0.00 C ATOM 459 O4' DT A 15 1.026 -0.574 11.174 1.00 0.00 O ATOM 460 C3' DT A 15 0.853 0.787 13.154 1.00 0.00 C ATOM 461 O3' DT A 15 0.873 2.195 12.934 1.00 0.00 O ATOM 462 C2' DT A 15 -0.510 0.195 12.808 1.00 0.00 C ATOM 463 C1' DT A 15 -0.318 -0.164 11.321 1.00 0.00 C ATOM 464 N1 DT A 15 -1.224 -1.245 10.841 1.00 0.00 N ATOM 465 C2 DT A 15 -2.222 -0.913 9.915 1.00 0.00 C ATOM 466 O2 DT A 15 -2.381 0.218 9.458 1.00 0.00 O ATOM 467 N3 DT A 15 -3.068 -1.923 9.512 1.00 0.00 N ATOM 468 C4 DT A 15 -3.027 -3.224 9.961 1.00 0.00 C ATOM 469 O4 DT A 15 -3.850 -4.027 9.521 1.00 0.00 O ATOM 470 C5 DT A 15 -1.974 -3.508 10.938 1.00 0.00 C ATOM 471 C7 DT A 15 -1.836 -4.906 11.528 1.00 0.00 C ATOM 472 C6 DT A 15 -1.124 -2.529 11.346 1.00 0.00 C ATOM 0 H5' DT A 15 3.157 -1.654 12.195 1.00 0.00 H new ATOM 0 H5'' DT A 15 3.365 -0.585 13.567 1.00 0.00 H new ATOM 0 H4' DT A 15 2.511 0.744 11.807 1.00 0.00 H new ATOM 0 H3' DT A 15 1.132 0.677 14.202 1.00 0.00 H new ATOM 0 H2' DT A 15 -0.744 -0.680 13.415 1.00 0.00 H new ATOM 0 H2'' DT A 15 -1.318 0.911 12.956 1.00 0.00 H new ATOM 0 H1' DT A 15 -0.562 0.711 10.719 1.00 0.00 H new ATOM 0 H3 DT A 15 -3.784 -1.688 8.824 1.00 0.00 H new ATOM 0 H71 DT A 15 -2.815 -5.384 11.564 1.00 0.00 H new ATOM 0 H72 DT A 15 -1.165 -5.499 10.906 1.00 0.00 H new ATOM 0 H73 DT A 15 -1.429 -4.837 12.537 1.00 0.00 H new ATOM 0 H6 DT A 15 -0.360 -2.757 12.075 1.00 0.00 H new ATOM 485 P DG A 16 1.836 3.165 13.793 1.00 0.00 P ATOM 486 OP1 DG A 16 1.685 2.842 15.238 1.00 0.00 O ATOM 487 OP2 DG A 16 1.558 4.568 13.355 1.00 0.00 O ATOM 488 O5' DG A 16 3.356 2.779 13.362 1.00 0.00 O ATOM 489 C5' DG A 16 3.980 3.323 12.206 1.00 0.00 C ATOM 490 C4' DG A 16 5.261 2.543 11.849 1.00 0.00 C ATOM 491 O4' DG A 16 4.895 1.275 11.311 1.00 0.00 O ATOM 492 C3' DG A 16 6.087 3.256 10.756 1.00 0.00 C ATOM 493 O3' DG A 16 7.476 2.931 10.896 1.00 0.00 O ATOM 494 C2' DG A 16 5.424 2.691 9.501 1.00 0.00 C ATOM 495 C1' DG A 16 5.246 1.246 9.937 1.00 0.00 C ATOM 496 N9 DG A 16 4.288 0.476 9.100 1.00 0.00 N ATOM 497 C8 DG A 16 4.565 -0.685 8.428 1.00 0.00 C ATOM 498 N7 DG A 16 3.579 -1.137 7.707 1.00 0.00 N ATOM 499 C5 DG A 16 2.548 -0.231 7.968 1.00 0.00 C ATOM 500 C6 DG A 16 1.179 -0.221 7.538 1.00 0.00 C ATOM 501 O6 DG A 16 0.595 -1.065 6.869 1.00 0.00 O ATOM 502 N1 DG A 16 0.452 0.870 7.965 1.00 0.00 N ATOM 503 C2 DG A 16 0.971 1.849 8.736 1.00 0.00 C ATOM 504 N2 DG A 16 0.134 2.793 9.102 1.00 0.00 N ATOM 505 N3 DG A 16 2.222 1.866 9.205 1.00 0.00 N ATOM 506 C4 DG A 16 2.971 0.788 8.791 1.00 0.00 C ATOM 0 H5' DG A 16 4.225 4.371 12.380 1.00 0.00 H new ATOM 0 H5'' DG A 16 3.286 3.293 11.366 1.00 0.00 H new ATOM 0 H4' DG A 16 5.852 2.460 12.761 1.00 0.00 H new ATOM 0 H3' DG A 16 6.087 4.346 10.773 1.00 0.00 H new ATOM 0 H2' DG A 16 4.476 3.179 9.273 1.00 0.00 H new ATOM 0 H2'' DG A 16 6.053 2.787 8.616 1.00 0.00 H new ATOM 0 H1' DG A 16 6.179 0.700 9.794 1.00 0.00 H new ATOM 0 H8 DG A 16 5.521 -1.184 8.491 1.00 0.00 H new ATOM 0 H1 DG A 16 -0.526 0.941 7.684 1.00 0.00 H new ATOM 0 H21 DG A 16 0.458 3.564 9.686 1.00 0.00 H new ATOM 0 H22 DG A 16 -0.840 2.755 8.803 1.00 0.00 H new ATOM 518 P DG A 17 8.609 3.302 9.789 1.00 0.00 P ATOM 519 OP1 DG A 17 9.926 3.292 10.479 1.00 0.00 O ATOM 520 OP2 DG A 17 8.185 4.545 9.091 1.00 0.00 O ATOM 521 O5' DG A 17 8.588 2.081 8.716 1.00 0.00 O ATOM 522 C5' DG A 17 9.088 0.785 9.042 1.00 0.00 C ATOM 523 C4' DG A 17 9.149 -0.190 7.842 1.00 0.00 C ATOM 524 O4' DG A 17 7.844 -0.519 7.369 1.00 0.00 O ATOM 525 C3' DG A 17 9.949 0.380 6.660 1.00 0.00 C ATOM 526 O3' DG A 17 10.884 -0.599 6.210 1.00 0.00 O ATOM 527 C2' DG A 17 8.828 0.664 5.647 1.00 0.00 C ATOM 528 C1' DG A 17 7.880 -0.493 5.949 1.00 0.00 C ATOM 529 N9 DG A 17 6.532 -0.299 5.378 1.00 0.00 N ATOM 530 C8 DG A 17 5.675 0.745 5.611 1.00 0.00 C ATOM 531 N7 DG A 17 4.521 0.638 4.998 1.00 0.00 N ATOM 532 C5 DG A 17 4.660 -0.547 4.259 1.00 0.00 C ATOM 533 C6 DG A 17 3.769 -1.185 3.331 1.00 0.00 C ATOM 534 O6 DG A 17 2.649 -0.832 2.988 1.00 0.00 O ATOM 535 N1 DG A 17 4.289 -2.332 2.755 1.00 0.00 N ATOM 536 C2 DG A 17 5.505 -2.830 3.046 1.00 0.00 C ATOM 537 N2 DG A 17 5.858 -3.901 2.390 1.00 0.00 N ATOM 538 N3 DG A 17 6.362 -2.280 3.907 1.00 0.00 N ATOM 539 C4 DG A 17 5.886 -1.126 4.478 1.00 0.00 C ATOM 0 H5' DG A 17 8.459 0.350 9.818 1.00 0.00 H new ATOM 0 H5'' DG A 17 10.088 0.889 9.463 1.00 0.00 H new ATOM 0 H4' DG A 17 9.651 -1.081 8.218 1.00 0.00 H new ATOM 0 H3' DG A 17 10.551 1.264 6.868 1.00 0.00 H new ATOM 0 H2' DG A 17 8.361 1.636 5.808 1.00 0.00 H new ATOM 0 H2'' DG A 17 9.186 0.649 4.618 1.00 0.00 H new ATOM 0 H1' DG A 17 8.220 -1.428 5.504 1.00 0.00 H new ATOM 0 H8 DG A 17 5.928 1.582 6.244 1.00 0.00 H new ATOM 0 H1 DG A 17 3.718 -2.828 2.071 1.00 0.00 H new ATOM 0 H21 DG A 17 6.768 -4.329 2.564 1.00 0.00 H new ATOM 0 H22 DG A 17 5.224 -4.311 1.704 1.00 0.00 H new ATOM 551 P DC A 18 11.924 -0.356 4.990 1.00 0.00 P ATOM 552 OP1 DC A 18 13.030 -1.330 5.189 1.00 0.00 O ATOM 553 OP2 DC A 18 12.258 1.091 4.914 1.00 0.00 O ATOM 554 O5' DC A 18 11.082 -0.800 3.672 1.00 0.00 O ATOM 555 C5' DC A 18 11.033 -0.004 2.492 1.00 0.00 C ATOM 556 C4' DC A 18 10.066 -0.631 1.477 1.00 0.00 C ATOM 557 O4' DC A 18 8.717 -0.565 1.928 1.00 0.00 O ATOM 558 C3' DC A 18 10.010 0.108 0.141 1.00 0.00 C ATOM 559 O3' DC A 18 11.066 -0.199 -0.757 1.00 0.00 O ATOM 560 C2' DC A 18 8.675 -0.388 -0.419 1.00 0.00 C ATOM 561 C1' DC A 18 7.893 -0.884 0.820 1.00 0.00 C ATOM 562 N1 DC A 18 6.553 -0.234 0.844 1.00 0.00 N ATOM 563 C2 DC A 18 5.567 -0.746 -0.007 1.00 0.00 C ATOM 564 O2 DC A 18 5.736 -1.789 -0.643 1.00 0.00 O ATOM 565 N3 DC A 18 4.378 -0.117 -0.164 1.00 0.00 N ATOM 566 C4 DC A 18 4.165 0.983 0.526 1.00 0.00 C ATOM 567 N4 DC A 18 3.013 1.557 0.334 1.00 0.00 N ATOM 568 C5 DC A 18 5.103 1.523 1.453 1.00 0.00 C ATOM 569 C6 DC A 18 6.298 0.893 1.583 1.00 0.00 C ATOM 0 H5' DC A 18 12.029 0.077 2.056 1.00 0.00 H new ATOM 0 H5'' DC A 18 10.710 1.007 2.738 1.00 0.00 H new ATOM 0 H4' DC A 18 10.449 -1.645 1.365 1.00 0.00 H new ATOM 0 H3' DC A 18 10.107 1.186 0.271 1.00 0.00 H new ATOM 0 H2' DC A 18 8.139 0.410 -0.933 1.00 0.00 H new ATOM 0 H2'' DC A 18 8.822 -1.190 -1.142 1.00 0.00 H new ATOM 0 H1' DC A 18 7.689 -1.955 0.823 1.00 0.00 H new ATOM 0 H41 DC A 18 2.780 2.414 0.836 1.00 0.00 H new ATOM 0 H42 DC A 18 2.343 1.150 -0.319 1.00 0.00 H new ATOM 0 H5 DC A 18 4.871 2.404 2.033 1.00 0.00 H new ATOM 0 H6 DC A 18 7.043 1.277 2.264 1.00 0.00 H new ATOM 581 P DC A 19 11.493 0.848 -1.910 1.00 0.00 P ATOM 582 OP1 DC A 19 12.435 0.163 -2.840 1.00 0.00 O ATOM 583 OP2 DC A 19 11.928 2.109 -1.252 1.00 0.00 O ATOM 584 O5' DC A 19 10.115 1.142 -2.713 1.00 0.00 O ATOM 585 C5' DC A 19 10.038 2.148 -3.713 1.00 0.00 C ATOM 586 C4' DC A 19 8.605 2.419 -4.208 1.00 0.00 C ATOM 587 O4' DC A 19 8.050 1.332 -4.944 1.00 0.00 O ATOM 588 C3' DC A 19 7.587 2.785 -3.096 1.00 0.00 C ATOM 589 O3' DC A 19 7.294 4.184 -3.194 1.00 0.00 O ATOM 590 C2' DC A 19 6.397 1.858 -3.411 1.00 0.00 C ATOM 591 C1' DC A 19 6.644 1.495 -4.873 1.00 0.00 C ATOM 592 N1 DC A 19 5.927 0.306 -5.435 1.00 0.00 N ATOM 593 C2 DC A 19 5.466 0.379 -6.760 1.00 0.00 C ATOM 594 O2 DC A 19 5.602 1.402 -7.443 1.00 0.00 O ATOM 595 N3 DC A 19 4.844 -0.671 -7.354 1.00 0.00 N ATOM 596 C4 DC A 19 4.671 -1.769 -6.650 1.00 0.00 C ATOM 597 N4 DC A 19 4.084 -2.761 -7.264 1.00 0.00 N ATOM 598 C5 DC A 19 5.120 -1.921 -5.311 1.00 0.00 C ATOM 599 C6 DC A 19 5.741 -0.860 -4.728 1.00 0.00 C ATOM 0 H5' DC A 19 10.656 1.853 -4.561 1.00 0.00 H new ATOM 0 H5'' DC A 19 10.458 3.073 -3.318 1.00 0.00 H new ATOM 0 H4' DC A 19 8.747 3.287 -4.852 1.00 0.00 H new ATOM 0 H3' DC A 19 7.920 2.641 -2.068 1.00 0.00 H new ATOM 0 H2' DC A 19 6.387 0.977 -2.769 1.00 0.00 H new ATOM 0 H2'' DC A 19 5.441 2.363 -3.274 1.00 0.00 H new ATOM 0 H1' DC A 19 6.230 2.285 -5.500 1.00 0.00 H new ATOM 0 H41 DC A 19 3.921 -3.640 -6.773 1.00 0.00 H new ATOM 0 H42 DC A 19 3.789 -2.657 -8.235 1.00 0.00 H new ATOM 0 H5 DC A 19 4.974 -2.847 -4.774 1.00 0.00 H new ATOM 0 H6 DC A 19 6.089 -0.933 -3.708 1.00 0.00 H new ATOM 611 P DG A 20 6.161 4.924 -2.292 1.00 0.00 P ATOM 612 OP1 DG A 20 6.540 6.361 -2.229 1.00 0.00 O ATOM 613 OP2 DG A 20 5.982 4.179 -1.016 1.00 0.00 O ATOM 614 O5' DG A 20 4.814 4.813 -3.195 1.00 0.00 O ATOM 615 C5' DG A 20 3.520 4.647 -2.626 1.00 0.00 C ATOM 616 C4' DG A 20 2.439 4.600 -3.713 1.00 0.00 C ATOM 617 O4' DG A 20 2.592 3.472 -4.571 1.00 0.00 O ATOM 618 C3' DG A 20 1.007 4.529 -3.119 1.00 0.00 C ATOM 619 O3' DG A 20 0.159 5.563 -3.613 1.00 0.00 O ATOM 620 C2' DG A 20 0.486 3.188 -3.646 1.00 0.00 C ATOM 621 C1' DG A 20 1.282 3.083 -4.944 1.00 0.00 C ATOM 622 N9 DG A 20 1.245 1.737 -5.543 1.00 0.00 N ATOM 623 C8 DG A 20 1.874 0.594 -5.119 1.00 0.00 C ATOM 624 N7 DG A 20 1.605 -0.468 -5.837 1.00 0.00 N ATOM 625 C5 DG A 20 0.702 0.012 -6.803 1.00 0.00 C ATOM 626 C6 DG A 20 -0.003 -0.641 -7.881 1.00 0.00 C ATOM 627 O6 DG A 20 0.055 -1.817 -8.250 1.00 0.00 O ATOM 628 N1 DG A 20 -0.851 0.197 -8.583 1.00 0.00 N ATOM 629 C2 DG A 20 -0.948 1.532 -8.344 1.00 0.00 C ATOM 630 N2 DG A 20 -1.808 2.209 -9.057 1.00 0.00 N ATOM 631 N3 DG A 20 -0.304 2.185 -7.387 1.00 0.00 N ATOM 632 C4 DG A 20 0.500 1.369 -6.639 1.00 0.00 C ATOM 0 H5' DG A 20 3.314 5.468 -1.939 1.00 0.00 H new ATOM 0 H5'' DG A 20 3.492 3.728 -2.041 1.00 0.00 H new ATOM 0 H4' DG A 20 2.566 5.525 -4.275 1.00 0.00 H new ATOM 0 H3' DG A 20 1.019 4.634 -2.034 1.00 0.00 H new ATOM 0 H2' DG A 20 0.692 2.364 -2.963 1.00 0.00 H new ATOM 0 H2'' DG A 20 -0.590 3.198 -3.817 1.00 0.00 H new ATOM 0 H1' DG A 20 0.863 3.714 -5.728 1.00 0.00 H new ATOM 0 H8 DG A 20 2.535 0.572 -4.265 1.00 0.00 H new ATOM 0 H1 DG A 20 -1.433 -0.207 -9.317 1.00 0.00 H new ATOM 0 H21 DG A 20 -1.914 3.213 -8.911 1.00 0.00 H new ATOM 0 H22 DG A 20 -2.374 1.734 -9.760 1.00 0.00 H new ATOM 644 P DG A 21 0.187 7.069 -3.017 1.00 0.00 P ATOM 645 OP1 DG A 21 1.587 7.577 -3.053 1.00 0.00 O ATOM 646 OP2 DG A 21 -0.560 7.096 -1.725 1.00 0.00 O ATOM 647 O5' DG A 21 -0.654 7.877 -4.131 1.00 0.00 O ATOM 648 C5' DG A 21 -2.062 7.726 -4.260 1.00 0.00 C ATOM 649 C4' DG A 21 -2.602 8.169 -5.638 1.00 0.00 C ATOM 650 O4' DG A 21 -2.254 9.529 -5.899 1.00 0.00 O ATOM 651 C3' DG A 21 -2.023 7.312 -6.788 1.00 0.00 C ATOM 652 O3' DG A 21 -2.887 6.993 -7.883 1.00 0.00 O ATOM 653 C2' DG A 21 -0.862 8.169 -7.283 1.00 0.00 C ATOM 654 C1' DG A 21 -1.384 9.582 -7.026 1.00 0.00 C ATOM 655 N9 DG A 21 -0.311 10.588 -6.787 1.00 0.00 N ATOM 656 C8 DG A 21 0.809 10.488 -5.989 1.00 0.00 C ATOM 657 N7 DG A 21 1.581 11.549 -6.007 1.00 0.00 N ATOM 658 C5 DG A 21 0.928 12.412 -6.898 1.00 0.00 C ATOM 659 C6 DG A 21 1.261 13.742 -7.346 1.00 0.00 C ATOM 660 O6 DG A 21 2.225 14.452 -7.043 1.00 0.00 O ATOM 661 N1 DG A 21 0.344 14.262 -8.241 1.00 0.00 N ATOM 662 C2 DG A 21 -0.763 13.600 -8.665 1.00 0.00 C ATOM 663 N2 DG A 21 -1.550 14.210 -9.520 1.00 0.00 N ATOM 664 N3 DG A 21 -1.110 12.370 -8.276 1.00 0.00 N ATOM 665 C4 DG A 21 -0.229 11.830 -7.378 1.00 0.00 C ATOM 0 H5' DG A 21 -2.555 8.307 -3.481 1.00 0.00 H new ATOM 0 H5'' DG A 21 -2.325 6.681 -4.094 1.00 0.00 H new ATOM 0 H4' DG A 21 -3.684 8.044 -5.600 1.00 0.00 H new ATOM 0 H3' DG A 21 -1.782 6.321 -6.404 1.00 0.00 H new ATOM 0 H2' DG A 21 0.058 7.967 -6.735 1.00 0.00 H new ATOM 0 H2'' DG A 21 -0.648 7.998 -8.338 1.00 0.00 H new ATOM 0 H1' DG A 21 -1.902 9.912 -7.926 1.00 0.00 H new ATOM 0 H8 DG A 21 1.032 9.611 -5.399 1.00 0.00 H new ATOM 0 H1 DG A 21 0.509 15.200 -8.605 1.00 0.00 H new ATOM 0 H21 DG A 21 -2.391 13.744 -9.861 1.00 0.00 H new ATOM 0 H22 DG A 21 -1.321 15.150 -9.843 1.00 0.00 H new ATOM 677 P DC A 22 -4.429 6.516 -7.698 1.00 0.00 P ATOM 678 OP1 DC A 22 -4.770 5.618 -8.836 1.00 0.00 O ATOM 679 OP2 DC A 22 -5.262 7.727 -7.466 1.00 0.00 O ATOM 680 O5' DC A 22 -4.403 5.647 -6.336 1.00 0.00 O ATOM 681 C5' DC A 22 -4.095 4.255 -6.323 1.00 0.00 C ATOM 682 C4' DC A 22 -3.641 3.790 -4.928 1.00 0.00 C ATOM 683 O4' DC A 22 -4.524 4.196 -3.891 1.00 0.00 O ATOM 684 C3' DC A 22 -3.571 2.253 -4.800 1.00 0.00 C ATOM 685 O3' DC A 22 -2.303 1.714 -5.131 1.00 0.00 O ATOM 686 C2' DC A 22 -3.847 2.017 -3.312 1.00 0.00 C ATOM 687 C1' DC A 22 -4.184 3.413 -2.771 1.00 0.00 C ATOM 688 N1 DC A 22 -5.265 3.473 -1.753 1.00 0.00 N ATOM 689 C2 DC A 22 -4.995 4.063 -0.506 1.00 0.00 C ATOM 690 O2 DC A 22 -3.908 4.590 -0.254 1.00 0.00 O ATOM 691 N3 DC A 22 -5.925 4.070 0.480 1.00 0.00 N ATOM 692 C4 DC A 22 -7.092 3.522 0.225 1.00 0.00 C ATOM 693 N4 DC A 22 -7.946 3.532 1.204 1.00 0.00 N ATOM 694 C5 DC A 22 -7.445 2.952 -1.026 1.00 0.00 C ATOM 695 C6 DC A 22 -6.507 2.940 -1.998 1.00 0.00 C ATOM 0 H5' DC A 22 -3.309 4.048 -7.050 1.00 0.00 H new ATOM 0 H5'' DC A 22 -4.972 3.685 -6.630 1.00 0.00 H new ATOM 0 H4' DC A 22 -2.658 4.250 -4.822 1.00 0.00 H new ATOM 0 H3' DC A 22 -4.270 1.772 -5.484 1.00 0.00 H new ATOM 0 H2' DC A 22 -4.673 1.322 -3.165 1.00 0.00 H new ATOM 0 H2'' DC A 22 -2.979 1.592 -2.808 1.00 0.00 H new ATOM 0 HO3' DC A 22 -1.988 2.110 -5.970 1.00 0.00 H new ATOM 0 H1' DC A 22 -3.310 3.778 -2.231 1.00 0.00 H new ATOM 0 H41 DC A 22 -8.872 3.124 1.077 1.00 0.00 H new ATOM 0 H42 DC A 22 -7.690 3.948 2.099 1.00 0.00 H new ATOM 0 H5 DC A 22 -8.430 2.542 -1.195 1.00 0.00 H new ATOM 0 H6 DC A 22 -6.733 2.513 -2.964 1.00 0.00 H new TER 708 DC A 22