USER MOD reduce.3.24.130724 H: found=0, std=0, add=154, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 154 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 G O2' : rot -17:sc= 0.0983 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -13:sc= 0.0512 USER MOD Single : A 3 C O2' : rot -28:sc= 0.249 USER MOD Single : A 4 G O2' : rot -127:sc= 0.653 USER MOD Single : A 5 G O2' : rot -22:sc= 0.0138 USER MOD Single : A 6 U O2' : rot -163:sc= 1.41 USER MOD Single : A 7 G O2' : rot -26:sc= 0.0973 USER MOD Single : A 8 A O2' : rot -30:sc= 0.0866 USER MOD Single : A 9 A O2' : rot -21:sc= 0.28 USER MOD Single : A 10 A O2' : rot -26:sc= 0.0492 USER MOD Single : A 11 U O2' : rot -24:sc= 0.11 USER MOD Single : A 12 G O2' : rot -17:sc= 0.0878 USER MOD Single : A 13 C O2' : rot -20:sc= 0.0391 USER MOD Single : A 14 C O2' : rot -25:sc= 0.057 USER MOD Single : A 14 C O3' : rot 180:sc= 0.0541 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 1.539 -11.351 -12.434 1.00 10.00 O ATOM 2 C5' G A 1 0.747 -10.703 -11.445 1.00 10.00 C ATOM 3 C4' G A 1 -0.366 -11.626 -10.927 1.00 10.00 C ATOM 4 O4' G A 1 0.135 -12.409 -9.843 1.00 10.00 O ATOM 5 C3' G A 1 -1.610 -10.888 -10.410 1.00 10.00 C ATOM 6 O3' G A 1 -2.539 -10.584 -11.440 1.00 10.00 O ATOM 7 C2' G A 1 -2.167 -11.951 -9.460 1.00 10.00 C ATOM 8 O2' G A 1 -2.846 -12.981 -10.164 1.00 10.00 O ATOM 9 C1' G A 1 -0.892 -12.544 -8.864 1.00 10.00 C ATOM 10 N9 G A 1 -0.511 -11.838 -7.619 1.00 10.00 N ATOM 11 C8 G A 1 0.298 -10.740 -7.449 1.00 10.00 C ATOM 12 N7 G A 1 0.435 -10.358 -6.209 1.00 10.00 N ATOM 13 C5 G A 1 -0.391 -11.245 -5.500 1.00 10.00 C ATOM 14 C6 G A 1 -0.698 -11.365 -4.097 1.00 10.00 C ATOM 15 O6 G A 1 -0.210 -10.772 -3.135 1.00 10.00 O ATOM 16 N1 G A 1 -1.649 -12.328 -3.832 1.00 10.00 N ATOM 17 C2 G A 1 -2.082 -13.229 -4.743 1.00 10.00 C ATOM 18 N2 G A 1 -2.931 -14.130 -4.331 1.00 10.00 N ATOM 19 N3 G A 1 -1.758 -13.222 -6.035 1.00 10.00 N ATOM 20 C4 G A 1 -0.941 -12.174 -6.358 1.00 10.00 C ATOM 0 H5' G A 1 0.306 -9.799 -11.864 1.00 10.00 H new ATOM 0 H5'' G A 1 1.381 -10.393 -10.614 1.00 10.00 H new ATOM 0 H4' G A 1 -0.666 -12.229 -11.784 1.00 10.00 H new ATOM 0 H3' G A 1 -1.399 -9.916 -9.964 1.00 10.00 H new ATOM 0 H2' G A 1 -2.878 -11.538 -8.744 1.00 10.00 H new ATOM 0 HO2' G A 1 -3.058 -12.673 -11.070 1.00 10.00 H new ATOM 0 HO5' G A 1 2.238 -10.739 -12.746 1.00 10.00 H new ATOM 0 H1' G A 1 -1.048 -13.591 -8.606 1.00 10.00 H new ATOM 0 H8 G A 1 0.780 -10.235 -8.273 1.00 10.00 H new ATOM 0 H1 G A 1 -2.049 -12.363 -2.894 1.00 10.00 H new ATOM 0 H21 G A 1 -3.286 -14.831 -4.981 1.00 10.00 H new ATOM 0 H22 G A 1 -3.239 -14.133 -3.359 1.00 10.00 H new ATOM 33 P G A 2 -3.491 -9.305 -11.346 1.00 10.00 P ATOM 34 OP1 G A 2 -4.364 -9.327 -12.539 1.00 10.00 O ATOM 35 OP2 G A 2 -2.633 -8.129 -11.129 1.00 10.00 O ATOM 36 O5' G A 2 -4.422 -9.553 -10.065 1.00 10.00 O ATOM 37 C5' G A 2 -5.601 -10.342 -10.192 1.00 10.00 C ATOM 38 C4' G A 2 -6.208 -10.840 -8.878 1.00 10.00 C ATOM 39 O4' G A 2 -5.237 -11.493 -8.069 1.00 10.00 O ATOM 40 C3' G A 2 -6.905 -9.784 -8.018 1.00 10.00 C ATOM 41 O3' G A 2 -8.216 -9.509 -8.494 1.00 10.00 O ATOM 42 C2' G A 2 -6.917 -10.529 -6.679 1.00 10.00 C ATOM 43 O2' G A 2 -7.954 -11.502 -6.591 1.00 10.00 O ATOM 44 C1' G A 2 -5.559 -11.243 -6.707 1.00 10.00 C ATOM 45 N9 G A 2 -4.548 -10.382 -6.057 1.00 10.00 N ATOM 46 C8 G A 2 -3.510 -9.651 -6.571 1.00 10.00 C ATOM 47 N7 G A 2 -2.829 -8.991 -5.670 1.00 10.00 N ATOM 48 C5 G A 2 -3.470 -9.308 -4.459 1.00 10.00 C ATOM 49 C6 G A 2 -3.242 -8.930 -3.083 1.00 10.00 C ATOM 50 O6 G A 2 -2.363 -8.224 -2.599 1.00 10.00 O ATOM 51 N1 G A 2 -4.187 -9.441 -2.213 1.00 10.00 N ATOM 52 C2 G A 2 -5.223 -10.219 -2.598 1.00 10.00 C ATOM 53 N2 G A 2 -6.098 -10.598 -1.717 1.00 10.00 N ATOM 54 N3 G A 2 -5.454 -10.617 -3.836 1.00 10.00 N ATOM 55 C4 G A 2 -4.539 -10.134 -4.715 1.00 10.00 C ATOM 0 H5' G A 2 -5.373 -11.206 -10.817 1.00 10.00 H new ATOM 0 H5'' G A 2 -6.353 -9.756 -10.720 1.00 10.00 H new ATOM 0 H4' G A 2 -6.981 -11.530 -9.216 1.00 10.00 H new ATOM 0 H3' G A 2 -6.431 -8.803 -7.995 1.00 10.00 H new ATOM 0 H2' G A 2 -7.084 -9.858 -5.837 1.00 10.00 H new ATOM 0 HO2' G A 2 -8.596 -11.362 -7.318 1.00 10.00 H new ATOM 0 H1' G A 2 -5.586 -12.188 -6.165 1.00 10.00 H new ATOM 0 H8 G A 2 -3.275 -9.622 -7.625 1.00 10.00 H new ATOM 0 H1 G A 2 -4.097 -9.218 -1.222 1.00 10.00 H new ATOM 0 H21 G A 2 -6.883 -11.185 -1.998 1.00 10.00 H new ATOM 0 H22 G A 2 -6.000 -10.309 -0.744 1.00 10.00 H new ATOM 67 P C A 3 -8.907 -8.098 -8.292 1.00 10.00 P ATOM 68 OP1 C A 3 -10.256 -8.225 -8.897 1.00 10.00 O ATOM 69 OP2 C A 3 -8.010 -7.070 -8.859 1.00 10.00 O ATOM 70 O5' C A 3 -9.069 -7.893 -6.719 1.00 10.00 O ATOM 71 C5' C A 3 -10.066 -8.606 -6.001 1.00 10.00 C ATOM 72 C4' C A 3 -9.942 -8.481 -4.479 1.00 10.00 C ATOM 73 O4' C A 3 -8.640 -8.810 -4.011 1.00 10.00 O ATOM 74 C3' C A 3 -10.285 -7.103 -3.914 1.00 10.00 C ATOM 75 O3' C A 3 -11.689 -6.893 -3.783 1.00 10.00 O ATOM 76 C2' C A 3 -9.654 -7.257 -2.532 1.00 10.00 C ATOM 77 O2' C A 3 -10.562 -7.969 -1.688 1.00 10.00 O ATOM 78 C1' C A 3 -8.387 -8.074 -2.814 1.00 10.00 C ATOM 79 N1 C A 3 -7.175 -7.202 -2.928 1.00 10.00 N ATOM 80 C2 C A 3 -6.672 -6.638 -1.750 1.00 10.00 C ATOM 81 O2 C A 3 -7.313 -6.669 -0.703 1.00 10.00 O ATOM 82 N3 C A 3 -5.465 -6.039 -1.726 1.00 10.00 N ATOM 83 C4 C A 3 -4.771 -5.966 -2.839 1.00 10.00 C ATOM 84 N4 C A 3 -3.610 -5.392 -2.718 1.00 10.00 N ATOM 85 C5 C A 3 -5.251 -6.451 -4.089 1.00 10.00 C ATOM 86 C6 C A 3 -6.465 -7.064 -4.099 1.00 10.00 C ATOM 0 H5' C A 3 -10.014 -9.660 -6.275 1.00 10.00 H new ATOM 0 H5'' C A 3 -11.048 -8.245 -6.307 1.00 10.00 H new ATOM 0 H4' C A 3 -10.683 -9.196 -4.121 1.00 10.00 H new ATOM 0 H3' C A 3 -9.946 -6.268 -4.527 1.00 10.00 H new ATOM 0 H2' C A 3 -9.429 -6.317 -2.028 1.00 10.00 H new ATOM 0 HO2' C A 3 -11.481 -7.813 -1.991 1.00 10.00 H new ATOM 0 H1' C A 3 -8.168 -8.751 -1.989 1.00 10.00 H new ATOM 0 H41 C A 3 -3.003 -5.292 -3.532 1.00 10.00 H new ATOM 0 H42 C A 3 -3.306 -5.042 -1.809 1.00 10.00 H new ATOM 0 H5 C A 3 -4.673 -6.336 -4.994 1.00 10.00 H new ATOM 0 H6 C A 3 -6.872 -7.442 -5.025 1.00 10.00 H new ATOM 98 P G A 4 -12.320 -5.467 -4.100 1.00 10.00 P ATOM 99 OP1 G A 4 -13.752 -5.511 -3.719 1.00 10.00 O ATOM 100 OP2 G A 4 -12.009 -5.166 -5.503 1.00 10.00 O ATOM 101 O5' G A 4 -11.540 -4.446 -3.143 1.00 10.00 O ATOM 102 C5' G A 4 -11.770 -4.414 -1.741 1.00 10.00 C ATOM 103 C4' G A 4 -10.673 -3.668 -0.961 1.00 10.00 C ATOM 104 O4' G A 4 -9.379 -4.188 -1.215 1.00 10.00 O ATOM 105 C3' G A 4 -10.589 -2.166 -1.210 1.00 10.00 C ATOM 106 O3' G A 4 -11.666 -1.505 -0.550 1.00 10.00 O ATOM 107 C2' G A 4 -9.188 -1.909 -0.620 1.00 10.00 C ATOM 108 O2' G A 4 -9.179 -1.863 0.802 1.00 10.00 O ATOM 109 C1' G A 4 -8.407 -3.174 -0.995 1.00 10.00 C ATOM 110 N9 G A 4 -7.571 -3.022 -2.207 1.00 10.00 N ATOM 111 C8 G A 4 -7.873 -3.406 -3.490 1.00 10.00 C ATOM 112 N7 G A 4 -6.891 -3.270 -4.337 1.00 10.00 N ATOM 113 C5 G A 4 -5.844 -2.778 -3.547 1.00 10.00 C ATOM 114 C6 G A 4 -4.474 -2.485 -3.866 1.00 10.00 C ATOM 115 O6 G A 4 -3.906 -2.574 -4.944 1.00 10.00 O ATOM 116 N1 G A 4 -3.721 -2.060 -2.794 1.00 10.00 N ATOM 117 C2 G A 4 -4.230 -1.892 -1.553 1.00 10.00 C ATOM 118 N2 G A 4 -3.390 -1.493 -0.637 1.00 10.00 N ATOM 119 N3 G A 4 -5.492 -2.157 -1.197 1.00 10.00 N ATOM 120 C4 G A 4 -6.256 -2.606 -2.244 1.00 10.00 C ATOM 0 H5' G A 4 -11.840 -5.436 -1.368 1.00 10.00 H new ATOM 0 H5'' G A 4 -12.731 -3.937 -1.548 1.00 10.00 H new ATOM 0 H4' G A 4 -10.983 -3.830 0.071 1.00 10.00 H new ATOM 0 H3' G A 4 -10.689 -1.806 -2.234 1.00 10.00 H new ATOM 0 H2' G A 4 -8.799 -0.960 -0.988 1.00 10.00 H new ATOM 0 HO2' G A 4 -8.756 -1.031 1.100 1.00 10.00 H new ATOM 0 H1' G A 4 -7.712 -3.411 -0.189 1.00 10.00 H new ATOM 0 H8 G A 4 -8.842 -3.789 -3.774 1.00 10.00 H new ATOM 0 H1 G A 4 -2.732 -1.862 -2.944 1.00 10.00 H new ATOM 0 H21 G A 4 -3.711 -1.347 0.320 1.00 10.00 H new ATOM 0 H22 G A 4 -2.413 -1.327 -0.879 1.00 10.00 H new ATOM 132 P G A 5 -11.975 0.036 -0.778 1.00 10.00 P ATOM 133 OP1 G A 5 -13.107 0.343 0.120 1.00 10.00 O ATOM 134 OP2 G A 5 -12.180 0.264 -2.217 1.00 10.00 O ATOM 135 O5' G A 5 -10.709 0.885 -0.294 1.00 10.00 O ATOM 136 C5' G A 5 -10.460 1.059 1.095 1.00 10.00 C ATOM 137 C4' G A 5 -9.054 1.595 1.400 1.00 10.00 C ATOM 138 O4' G A 5 -8.008 0.766 0.895 1.00 10.00 O ATOM 139 C3' G A 5 -8.804 2.994 0.852 1.00 10.00 C ATOM 140 O3' G A 5 -9.422 3.999 1.645 1.00 10.00 O ATOM 141 C2' G A 5 -7.270 3.017 0.908 1.00 10.00 C ATOM 142 O2' G A 5 -6.760 3.172 2.232 1.00 10.00 O ATOM 143 C1' G A 5 -6.919 1.594 0.483 1.00 10.00 C ATOM 144 N9 G A 5 -6.698 1.466 -0.976 1.00 10.00 N ATOM 145 C8 G A 5 -7.610 1.205 -1.969 1.00 10.00 C ATOM 146 N7 G A 5 -7.083 1.020 -3.149 1.00 10.00 N ATOM 147 C5 G A 5 -5.710 1.195 -2.928 1.00 10.00 C ATOM 148 C6 G A 5 -4.582 1.107 -3.819 1.00 10.00 C ATOM 149 O6 G A 5 -4.559 0.834 -5.020 1.00 10.00 O ATOM 150 N1 G A 5 -3.373 1.349 -3.202 1.00 10.00 N ATOM 151 C2 G A 5 -3.248 1.623 -1.882 1.00 10.00 C ATOM 152 N2 G A 5 -2.022 1.638 -1.448 1.00 10.00 N ATOM 153 N3 G A 5 -4.255 1.687 -1.010 1.00 10.00 N ATOM 154 C4 G A 5 -5.472 1.481 -1.600 1.00 10.00 C ATOM 0 H5' G A 5 -10.595 0.104 1.603 1.00 10.00 H new ATOM 0 H5'' G A 5 -11.200 1.746 1.506 1.00 10.00 H new ATOM 0 H4' G A 5 -9.032 1.609 2.490 1.00 10.00 H new ATOM 0 H3' G A 5 -9.218 3.197 -0.135 1.00 10.00 H new ATOM 0 H2' G A 5 -6.868 3.835 0.310 1.00 10.00 H new ATOM 0 HO2' G A 5 -7.448 3.574 2.803 1.00 10.00 H new ATOM 0 H1' G A 5 -5.979 1.297 0.949 1.00 10.00 H new ATOM 0 H8 G A 5 -8.674 1.157 -1.789 1.00 10.00 H new ATOM 0 H1 G A 5 -2.527 1.320 -3.771 1.00 10.00 H new ATOM 0 H21 G A 5 -1.831 1.836 -0.466 1.00 10.00 H new ATOM 0 H22 G A 5 -1.251 1.452 -2.090 1.00 10.00 H new ATOM 166 P U A 6 -9.968 5.332 0.967 1.00 10.00 P ATOM 167 OP1 U A 6 -10.544 6.171 2.036 1.00 10.00 O ATOM 168 OP2 U A 6 -10.802 4.968 -0.195 1.00 10.00 O ATOM 169 O5' U A 6 -8.631 6.037 0.475 1.00 10.00 O ATOM 170 C5' U A 6 -7.738 6.610 1.420 1.00 10.00 C ATOM 171 C4' U A 6 -6.424 7.040 0.767 1.00 10.00 C ATOM 172 O4' U A 6 -5.750 5.937 0.162 1.00 10.00 O ATOM 173 C3' U A 6 -6.650 8.098 -0.306 1.00 10.00 C ATOM 174 O3' U A 6 -6.817 9.399 0.258 1.00 10.00 O ATOM 175 C2' U A 6 -5.355 7.899 -1.096 1.00 10.00 C ATOM 176 O2' U A 6 -4.300 8.701 -0.563 1.00 10.00 O ATOM 177 C1' U A 6 -4.991 6.424 -0.946 1.00 10.00 C ATOM 178 N1 U A 6 -5.240 5.660 -2.208 1.00 10.00 N ATOM 179 C2 U A 6 -4.197 5.575 -3.144 1.00 10.00 C ATOM 180 O2 U A 6 -3.116 6.130 -2.997 1.00 10.00 O ATOM 181 N3 U A 6 -4.422 4.843 -4.290 1.00 10.00 N ATOM 182 C4 U A 6 -5.630 4.299 -4.651 1.00 10.00 C ATOM 183 O4 U A 6 -5.769 3.783 -5.758 1.00 10.00 O ATOM 184 C5 U A 6 -6.671 4.428 -3.653 1.00 10.00 C ATOM 185 C6 U A 6 -6.464 5.091 -2.481 1.00 10.00 C ATOM 0 H5' U A 6 -7.533 5.888 2.211 1.00 10.00 H new ATOM 0 H5'' U A 6 -8.210 7.473 1.890 1.00 10.00 H new ATOM 0 H4' U A 6 -5.811 7.452 1.569 1.00 10.00 H new ATOM 0 H3' U A 6 -7.555 8.009 -0.907 1.00 10.00 H new ATOM 0 H2' U A 6 -5.493 8.189 -2.138 1.00 10.00 H new ATOM 0 HO2' U A 6 -3.576 8.768 -1.220 1.00 10.00 H new ATOM 0 H1' U A 6 -3.925 6.294 -0.757 1.00 10.00 H new ATOM 0 H3 U A 6 -3.632 4.694 -4.917 1.00 10.00 H new ATOM 0 H5 U A 6 -7.638 3.987 -3.843 1.00 10.00 H new ATOM 0 H6 U A 6 -7.265 5.171 -1.761 1.00 10.00 H new ATOM 196 P G A 7 -7.386 10.618 -0.595 1.00 10.00 P ATOM 197 OP1 G A 7 -7.310 11.828 0.261 1.00 10.00 O ATOM 198 OP2 G A 7 -8.725 10.222 -1.067 1.00 10.00 O ATOM 199 O5' G A 7 -6.419 10.901 -1.840 1.00 10.00 O ATOM 200 C5' G A 7 -6.865 11.675 -2.945 1.00 10.00 C ATOM 201 C4' G A 7 -5.734 12.086 -3.903 1.00 10.00 C ATOM 202 O4' G A 7 -4.772 12.931 -3.280 1.00 10.00 O ATOM 203 C3' G A 7 -4.981 10.927 -4.557 1.00 10.00 C ATOM 204 O3' G A 7 -5.625 10.401 -5.709 1.00 10.00 O ATOM 205 C2' G A 7 -3.633 11.555 -4.867 1.00 10.00 C ATOM 206 O2' G A 7 -3.636 12.262 -6.106 1.00 10.00 O ATOM 207 C1' G A 7 -3.471 12.585 -3.758 1.00 10.00 C ATOM 208 N9 G A 7 -2.663 12.099 -2.631 1.00 10.00 N ATOM 209 C8 G A 7 -3.090 11.688 -1.402 1.00 10.00 C ATOM 210 N7 G A 7 -2.143 11.610 -0.503 1.00 10.00 N ATOM 211 C5 G A 7 -0.979 11.858 -1.247 1.00 10.00 C ATOM 212 C6 G A 7 0.414 11.806 -0.892 1.00 10.00 C ATOM 213 O6 G A 7 0.935 11.579 0.200 1.00 10.00 O ATOM 214 N1 G A 7 1.256 12.013 -1.963 1.00 10.00 N ATOM 215 C2 G A 7 0.835 12.325 -3.212 1.00 10.00 C ATOM 216 N2 G A 7 1.763 12.465 -4.119 1.00 10.00 N ATOM 217 N3 G A 7 -0.437 12.422 -3.583 1.00 10.00 N ATOM 218 C4 G A 7 -1.296 12.149 -2.556 1.00 10.00 C ATOM 0 H5' G A 7 -7.360 12.572 -2.574 1.00 10.00 H new ATOM 0 H5'' G A 7 -7.611 11.106 -3.499 1.00 10.00 H new ATOM 0 H4' G A 7 -6.270 12.621 -4.687 1.00 10.00 H new ATOM 0 H3' G A 7 -4.917 10.049 -3.914 1.00 10.00 H new ATOM 0 H2' G A 7 -2.852 10.798 -4.931 1.00 10.00 H new ATOM 0 HO2' G A 7 -4.317 11.881 -6.699 1.00 10.00 H new ATOM 0 H1' G A 7 -2.947 13.444 -4.177 1.00 10.00 H new ATOM 0 H8 G A 7 -4.121 11.448 -1.190 1.00 10.00 H new ATOM 0 H1 G A 7 2.260 11.926 -1.805 1.00 10.00 H new ATOM 0 H21 G A 7 1.507 12.700 -5.078 1.00 10.00 H new ATOM 0 H22 G A 7 2.744 12.340 -3.869 1.00 10.00 H new ATOM 230 P A A 8 -5.297 8.938 -6.279 1.00 10.00 P ATOM 231 OP1 A A 8 -5.474 9.050 -7.743 1.00 10.00 O ATOM 232 OP2 A A 8 -6.069 7.918 -5.554 1.00 10.00 O ATOM 233 O5' A A 8 -3.747 8.675 -5.992 1.00 10.00 O ATOM 234 C5' A A 8 -2.851 8.416 -7.057 1.00 10.00 C ATOM 235 C4' A A 8 -1.403 8.317 -6.578 1.00 10.00 C ATOM 236 O4' A A 8 -1.079 9.387 -5.689 1.00 10.00 O ATOM 237 C3' A A 8 -0.998 7.021 -5.869 1.00 10.00 C ATOM 238 O3' A A 8 -0.778 5.933 -6.761 1.00 10.00 O ATOM 239 C2' A A 8 0.324 7.528 -5.257 1.00 10.00 C ATOM 240 O2' A A 8 1.354 7.596 -6.240 1.00 10.00 O ATOM 241 C1' A A 8 -0.055 8.937 -4.814 1.00 10.00 C ATOM 242 N9 A A 8 -0.472 8.856 -3.399 1.00 10.00 N ATOM 243 C8 A A 8 -1.715 8.700 -2.834 1.00 10.00 C ATOM 244 N7 A A 8 -1.690 8.543 -1.533 1.00 10.00 N ATOM 245 C5 A A 8 -0.321 8.573 -1.228 1.00 10.00 C ATOM 246 C6 A A 8 0.457 8.438 -0.053 1.00 10.00 C ATOM 247 N6 A A 8 -0.042 8.250 1.153 1.00 10.00 N ATOM 248 N1 A A 8 1.795 8.440 -0.100 1.00 10.00 N ATOM 249 C2 A A 8 2.358 8.615 -1.292 1.00 10.00 C ATOM 250 N3 A A 8 1.775 8.783 -2.467 1.00 10.00 N ATOM 251 C4 A A 8 0.418 8.748 -2.363 1.00 10.00 C ATOM 0 H5' A A 8 -2.933 9.209 -7.800 1.00 10.00 H new ATOM 0 H5'' A A 8 -3.134 7.486 -7.550 1.00 10.00 H new ATOM 0 H4' A A 8 -0.849 8.356 -7.516 1.00 10.00 H new ATOM 0 H3' A A 8 -1.739 6.613 -5.182 1.00 10.00 H new ATOM 0 H2' A A 8 0.706 6.886 -4.463 1.00 10.00 H new ATOM 0 HO2' A A 8 1.205 6.904 -6.918 1.00 10.00 H new ATOM 0 H1' A A 8 0.763 9.655 -4.869 1.00 10.00 H new ATOM 0 H8 A A 8 -2.629 8.706 -3.409 1.00 10.00 H new ATOM 0 H61 A A 8 0.582 8.161 1.955 1.00 10.00 H new ATOM 0 H62 A A 8 -1.052 8.193 1.284 1.00 10.00 H new ATOM 0 H2 A A 8 3.438 8.621 -1.302 1.00 10.00 H new ATOM 263 P A A 9 -0.592 4.450 -6.212 1.00 10.00 P ATOM 264 OP1 A A 9 0.025 3.631 -7.278 1.00 10.00 O ATOM 265 OP2 A A 9 -1.838 3.973 -5.586 1.00 10.00 O ATOM 266 O5' A A 9 0.550 4.620 -5.121 1.00 10.00 O ATOM 267 C5' A A 9 0.612 3.787 -3.988 1.00 10.00 C ATOM 268 C4' A A 9 1.649 4.326 -3.000 1.00 10.00 C ATOM 269 O4' A A 9 1.193 5.467 -2.272 1.00 10.00 O ATOM 270 C3' A A 9 2.029 3.230 -2.007 1.00 10.00 C ATOM 271 O3' A A 9 3.278 2.637 -2.360 1.00 10.00 O ATOM 272 C2' A A 9 2.116 3.988 -0.684 1.00 10.00 C ATOM 273 O2' A A 9 3.459 4.381 -0.428 1.00 10.00 O ATOM 274 C1' A A 9 1.248 5.214 -0.873 1.00 10.00 C ATOM 275 N9 A A 9 -0.097 4.984 -0.301 1.00 10.00 N ATOM 276 C8 A A 9 -1.265 4.765 -0.971 1.00 10.00 C ATOM 277 N7 A A 9 -2.314 4.627 -0.210 1.00 10.00 N ATOM 278 C5 A A 9 -1.787 4.747 1.074 1.00 10.00 C ATOM 279 C6 A A 9 -2.341 4.683 2.368 1.00 10.00 C ATOM 280 N6 A A 9 -3.627 4.503 2.588 1.00 10.00 N ATOM 281 N1 A A 9 -1.565 4.767 3.456 1.00 10.00 N ATOM 282 C2 A A 9 -0.261 4.929 3.255 1.00 10.00 C ATOM 283 N3 A A 9 0.401 5.036 2.106 1.00 10.00 N ATOM 284 C4 A A 9 -0.433 4.934 1.034 1.00 10.00 C ATOM 0 H5' A A 9 0.875 2.772 -4.286 1.00 10.00 H new ATOM 0 H5'' A A 9 -0.366 3.736 -3.510 1.00 10.00 H new ATOM 0 H4' A A 9 2.510 4.638 -3.592 1.00 10.00 H new ATOM 0 H3' A A 9 1.321 2.402 -1.974 1.00 10.00 H new ATOM 0 H2' A A 9 1.790 3.376 0.157 1.00 10.00 H new ATOM 0 HO2' A A 9 4.069 3.818 -0.948 1.00 10.00 H new ATOM 0 H1' A A 9 1.660 6.080 -0.354 1.00 10.00 H new ATOM 0 H8 A A 9 -1.316 4.710 -2.048 1.00 10.00 H new ATOM 0 H61 A A 9 -3.980 4.464 3.544 1.00 10.00 H new ATOM 0 H62 A A 9 -4.270 4.403 1.802 1.00 10.00 H new ATOM 0 H2 A A 9 0.345 4.981 4.148 1.00 10.00 H new ATOM 296 P A A 10 3.514 1.077 -2.215 1.00 10.00 P ATOM 297 OP1 A A 10 4.906 0.809 -2.648 1.00 10.00 O ATOM 298 OP2 A A 10 2.412 0.420 -2.940 1.00 10.00 O ATOM 299 O5' A A 10 3.405 0.852 -0.637 1.00 10.00 O ATOM 300 C5' A A 10 4.503 1.164 0.214 1.00 10.00 C ATOM 301 C4' A A 10 4.096 1.396 1.674 1.00 10.00 C ATOM 302 O4' A A 10 2.999 2.295 1.763 1.00 10.00 O ATOM 303 C3' A A 10 3.718 0.147 2.469 1.00 10.00 C ATOM 304 O3' A A 10 4.851 -0.529 2.987 1.00 10.00 O ATOM 305 C2' A A 10 2.903 0.807 3.592 1.00 10.00 C ATOM 306 O2' A A 10 3.711 1.453 4.580 1.00 10.00 O ATOM 307 C1' A A 10 2.161 1.915 2.845 1.00 10.00 C ATOM 308 N9 A A 10 0.830 1.466 2.388 1.00 10.00 N ATOM 309 C8 A A 10 0.396 1.120 1.130 1.00 10.00 C ATOM 310 N7 A A 10 -0.873 0.819 1.075 1.00 10.00 N ATOM 311 C5 A A 10 -1.314 0.996 2.392 1.00 10.00 C ATOM 312 C6 A A 10 -2.556 0.867 3.061 1.00 10.00 C ATOM 313 N6 A A 10 -3.680 0.493 2.484 1.00 10.00 N ATOM 314 N1 A A 10 -2.661 1.128 4.371 1.00 10.00 N ATOM 315 C2 A A 10 -1.558 1.487 5.013 1.00 10.00 C ATOM 316 N3 A A 10 -0.331 1.641 4.534 1.00 10.00 N ATOM 317 C4 A A 10 -0.279 1.383 3.197 1.00 10.00 C ATOM 0 H5' A A 10 5.002 2.057 -0.162 1.00 10.00 H new ATOM 0 H5'' A A 10 5.228 0.351 0.172 1.00 10.00 H new ATOM 0 H4' A A 10 5.005 1.801 2.119 1.00 10.00 H new ATOM 0 H3' A A 10 3.202 -0.622 1.894 1.00 10.00 H new ATOM 0 H2' A A 10 2.299 0.067 4.116 1.00 10.00 H new ATOM 0 HO2' A A 10 4.593 1.026 4.612 1.00 10.00 H new ATOM 0 H1' A A 10 1.966 2.767 3.497 1.00 10.00 H new ATOM 0 H8 A A 10 1.045 1.099 0.267 1.00 10.00 H new ATOM 0 H61 A A 10 -4.537 0.423 3.033 1.00 10.00 H new ATOM 0 H62 A A 10 -3.693 0.273 1.488 1.00 10.00 H new ATOM 0 H2 A A 10 -1.675 1.680 6.069 1.00 10.00 H new ATOM 329 P U A 11 4.808 -2.093 3.316 1.00 10.00 P ATOM 330 OP1 U A 11 6.048 -2.405 4.054 1.00 10.00 O ATOM 331 OP2 U A 11 4.480 -2.855 2.102 1.00 10.00 O ATOM 332 O5' U A 11 3.604 -2.297 4.344 1.00 10.00 O ATOM 333 C5' U A 11 3.757 -1.978 5.713 1.00 10.00 C ATOM 334 C4' U A 11 2.438 -2.112 6.474 1.00 10.00 C ATOM 335 O4' U A 11 1.439 -1.252 5.929 1.00 10.00 O ATOM 336 C3' U A 11 1.811 -3.509 6.476 1.00 10.00 C ATOM 337 O3' U A 11 2.395 -4.417 7.398 1.00 10.00 O ATOM 338 C2' U A 11 0.401 -3.131 6.934 1.00 10.00 C ATOM 339 O2' U A 11 0.341 -2.912 8.341 1.00 10.00 O ATOM 340 C1' U A 11 0.158 -1.812 6.204 1.00 10.00 C ATOM 341 N1 U A 11 -0.693 -2.045 5.004 1.00 10.00 N ATOM 342 C2 U A 11 -2.077 -2.085 5.225 1.00 10.00 C ATOM 343 O2 U A 11 -2.591 -1.841 6.319 1.00 10.00 O ATOM 344 N3 U A 11 -2.875 -2.397 4.151 1.00 10.00 N ATOM 345 C4 U A 11 -2.438 -2.600 2.870 1.00 10.00 C ATOM 346 O4 U A 11 -3.269 -2.792 1.997 1.00 10.00 O ATOM 347 C5 U A 11 -1.002 -2.545 2.705 1.00 10.00 C ATOM 348 C6 U A 11 -0.170 -2.282 3.750 1.00 10.00 C ATOM 0 H5' U A 11 4.131 -0.959 5.810 1.00 10.00 H new ATOM 0 H5'' U A 11 4.503 -2.636 6.159 1.00 10.00 H new ATOM 0 H4' U A 11 2.725 -1.855 7.494 1.00 10.00 H new ATOM 0 H3' U A 11 1.912 -4.031 5.525 1.00 10.00 H new ATOM 0 H2' U A 11 -0.329 -3.912 6.721 1.00 10.00 H new ATOM 0 HO2' U A 11 1.065 -3.405 8.780 1.00 10.00 H new ATOM 0 H1' U A 11 -0.401 -1.092 6.802 1.00 10.00 H new ATOM 0 H3 U A 11 -3.877 -2.485 4.323 1.00 10.00 H new ATOM 0 H5 U A 11 -0.578 -2.717 1.727 1.00 10.00 H new ATOM 0 H6 U A 11 0.899 -2.259 3.597 1.00 10.00 H new ATOM 359 P G A 12 2.273 -5.988 7.173 1.00 10.00 P ATOM 360 OP1 G A 12 2.760 -6.610 8.426 1.00 10.00 O ATOM 361 OP2 G A 12 2.966 -6.323 5.917 1.00 10.00 O ATOM 362 O5' G A 12 0.729 -6.316 6.979 1.00 10.00 O ATOM 363 C5' G A 12 -0.151 -6.424 8.081 1.00 10.00 C ATOM 364 C4' G A 12 -1.619 -6.509 7.647 1.00 10.00 C ATOM 365 O4' G A 12 -2.033 -5.450 6.789 1.00 10.00 O ATOM 366 C3' G A 12 -2.027 -7.826 6.986 1.00 10.00 C ATOM 367 O3' G A 12 -2.198 -8.807 7.998 1.00 10.00 O ATOM 368 C2' G A 12 -3.343 -7.363 6.356 1.00 10.00 C ATOM 369 O2' G A 12 -4.375 -7.276 7.330 1.00 10.00 O ATOM 370 C1' G A 12 -3.012 -5.952 5.883 1.00 10.00 C ATOM 371 N9 G A 12 -2.478 -5.936 4.501 1.00 10.00 N ATOM 372 C8 G A 12 -1.173 -5.844 4.106 1.00 10.00 C ATOM 373 N7 G A 12 -0.998 -5.799 2.813 1.00 10.00 N ATOM 374 C5 G A 12 -2.307 -5.823 2.299 1.00 10.00 C ATOM 375 C6 G A 12 -2.821 -5.713 0.952 1.00 10.00 C ATOM 376 O6 G A 12 -2.215 -5.540 -0.109 1.00 10.00 O ATOM 377 N1 G A 12 -4.197 -5.812 0.889 1.00 10.00 N ATOM 378 C2 G A 12 -4.995 -5.898 1.977 1.00 10.00 C ATOM 379 N2 G A 12 -6.277 -5.974 1.768 1.00 10.00 N ATOM 380 N3 G A 12 -4.576 -5.946 3.243 1.00 10.00 N ATOM 381 C4 G A 12 -3.213 -5.917 3.337 1.00 10.00 C ATOM 0 H5' G A 12 -0.017 -5.563 8.736 1.00 10.00 H new ATOM 0 H5'' G A 12 0.106 -7.309 8.663 1.00 10.00 H new ATOM 0 H4' G A 12 -2.130 -6.429 8.607 1.00 10.00 H new ATOM 0 H3' G A 12 -1.337 -8.283 6.277 1.00 10.00 H new ATOM 0 H2' G A 12 -3.691 -8.041 5.577 1.00 10.00 H new ATOM 0 HO2' G A 12 -4.113 -7.778 8.130 1.00 10.00 H new ATOM 0 H1' G A 12 -3.914 -5.341 5.869 1.00 10.00 H new ATOM 0 H8 G A 12 -0.352 -5.811 4.807 1.00 10.00 H new ATOM 0 H1 G A 12 -4.637 -5.821 -0.031 1.00 10.00 H new ATOM 0 H21 G A 12 -6.919 -6.041 2.558 1.00 10.00 H new ATOM 0 H22 G A 12 -6.640 -5.967 0.815 1.00 10.00 H new ATOM 393 P C A 13 -2.049 -10.351 7.705 1.00 10.00 P ATOM 394 OP1 C A 13 -2.334 -11.048 8.982 1.00 10.00 O ATOM 395 OP2 C A 13 -0.763 -10.591 7.027 1.00 10.00 O ATOM 396 O5' C A 13 -3.228 -10.635 6.685 1.00 10.00 O ATOM 397 C5' C A 13 -4.578 -10.688 7.106 1.00 10.00 C ATOM 398 C4' C A 13 -5.516 -10.938 5.929 1.00 10.00 C ATOM 399 O4' C A 13 -5.594 -9.836 5.036 1.00 10.00 O ATOM 400 C3' C A 13 -5.111 -12.150 5.096 1.00 10.00 C ATOM 401 O3' C A 13 -5.438 -13.359 5.767 1.00 10.00 O ATOM 402 C2' C A 13 -5.918 -11.870 3.833 1.00 10.00 C ATOM 403 O2' C A 13 -7.289 -12.212 3.994 1.00 10.00 O ATOM 404 C1' C A 13 -5.757 -10.348 3.717 1.00 10.00 C ATOM 405 N1 C A 13 -4.591 -9.989 2.851 1.00 10.00 N ATOM 406 C2 C A 13 -4.816 -9.936 1.476 1.00 10.00 C ATOM 407 O2 C A 13 -5.902 -10.272 1.009 1.00 10.00 O ATOM 408 N3 C A 13 -3.849 -9.520 0.628 1.00 10.00 N ATOM 409 C4 C A 13 -2.688 -9.141 1.119 1.00 10.00 C ATOM 410 N4 C A 13 -1.799 -8.717 0.266 1.00 10.00 N ATOM 411 C5 C A 13 -2.395 -9.167 2.509 1.00 10.00 C ATOM 412 C6 C A 13 -3.359 -9.626 3.348 1.00 10.00 C ATOM 0 H5' C A 13 -4.846 -9.751 7.595 1.00 10.00 H new ATOM 0 H5'' C A 13 -4.700 -11.479 7.845 1.00 10.00 H new ATOM 0 H4' C A 13 -6.483 -11.108 6.402 1.00 10.00 H new ATOM 0 H3' C A 13 -4.047 -12.282 4.899 1.00 10.00 H new ATOM 0 H2' C A 13 -5.587 -12.439 2.964 1.00 10.00 H new ATOM 0 HO2' C A 13 -7.385 -12.835 4.744 1.00 10.00 H new ATOM 0 H1' C A 13 -6.637 -9.911 3.245 1.00 10.00 H new ATOM 0 H41 C A 13 -0.883 -8.411 0.594 1.00 10.00 H new ATOM 0 H42 C A 13 -2.019 -8.691 -0.730 1.00 10.00 H new ATOM 0 H5 C A 13 -1.439 -8.833 2.885 1.00 10.00 H new ATOM 0 H6 C A 13 -3.159 -9.706 4.406 1.00 10.00 H new ATOM 424 P C A 14 -4.361 -14.527 5.838 1.00 10.00 P ATOM 425 OP1 C A 14 -4.849 -15.578 6.751 1.00 10.00 O ATOM 426 OP2 C A 14 -3.029 -13.938 6.071 1.00 10.00 O ATOM 427 O5' C A 14 -4.456 -15.084 4.350 1.00 10.00 O ATOM 428 C5' C A 14 -5.659 -15.701 3.918 1.00 10.00 C ATOM 429 C4' C A 14 -5.719 -15.886 2.401 1.00 10.00 C ATOM 430 O4' C A 14 -5.891 -14.626 1.765 1.00 10.00 O ATOM 431 C3' C A 14 -4.476 -16.504 1.755 1.00 10.00 C ATOM 432 O3' C A 14 -4.341 -17.914 1.856 1.00 10.00 O ATOM 433 C2' C A 14 -4.683 -16.069 0.301 1.00 10.00 C ATOM 434 O2' C A 14 -5.615 -16.891 -0.396 1.00 10.00 O ATOM 435 C1' C A 14 -5.271 -14.661 0.486 1.00 10.00 C ATOM 436 N1 C A 14 -4.174 -13.659 0.373 1.00 10.00 N ATOM 437 C2 C A 14 -3.790 -13.319 -0.929 1.00 10.00 C ATOM 438 O2 C A 14 -4.442 -13.662 -1.910 1.00 10.00 O ATOM 439 N3 C A 14 -2.603 -12.724 -1.164 1.00 10.00 N ATOM 440 C4 C A 14 -1.807 -12.487 -0.155 1.00 10.00 C ATOM 441 N4 C A 14 -0.682 -11.918 -0.469 1.00 10.00 N ATOM 442 C5 C A 14 -2.123 -12.803 1.192 1.00 10.00 C ATOM 443 C6 C A 14 -3.327 -13.382 1.430 1.00 10.00 C ATOM 0 H5' C A 14 -6.507 -15.097 4.240 1.00 10.00 H new ATOM 0 H5'' C A 14 -5.758 -16.673 4.402 1.00 10.00 H new ATOM 0 H4' C A 14 -6.552 -16.575 2.261 1.00 10.00 H new ATOM 0 H3' C A 14 -3.560 -16.176 2.246 1.00 10.00 H new ATOM 0 H2' C A 14 -3.768 -16.125 -0.288 1.00 10.00 H new ATOM 0 HO2' C A 14 -5.643 -17.778 0.019 1.00 10.00 H new ATOM 0 HO3' C A 14 -3.516 -18.196 1.409 1.00 10.00 H new ATOM 0 H1' C A 14 -6.012 -14.423 -0.277 1.00 10.00 H new ATOM 0 H41 C A 14 -0.002 -11.697 0.258 1.00 10.00 H new ATOM 0 H42 C A 14 -0.479 -11.692 -1.443 1.00 10.00 H new ATOM 0 H5 C A 14 -1.433 -12.591 1.995 1.00 10.00 H new ATOM 0 H6 C A 14 -3.622 -13.625 2.440 1.00 10.00 H new TER 456 C A 14