USER MOD reduce.3.24.130724 H: found=0, std=0, add=164, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 164 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 -12:sc= 0.313 USER MOD Single : A 1 G O5' : rot 48:sc= -0.328 USER MOD Single : A 2 G O2' : rot 180:sc= -6.77! USER MOD Single : A 3 C O2' : rot -3:sc= 0.368 USER MOD Single : A 4 U O2' : rot -10:sc= -5.01! USER MOD Single : A 5 C O2' : rot -2:sc= -7.55! USER MOD Single : A 6 U O2' : rot 107:sc= 0.513 USER MOD Single : A 7 C O2' : rot -136:sc= 0.363 USER MOD Single : A 8 A O2' : rot 30:sc= 0.239 USER MOD Single : A 9 G O2' : rot -12:sc= 0.647 USER MOD Single : A 10 U O2' : rot 150:sc= 0.502 USER MOD Single : A 11 G O2' : rot -20:sc= 0.287 USER MOD Single : A 12 A O2' : rot -105:sc= 0.717 USER MOD Single : A 13 G O2' : rot -28:sc= 0.265 USER MOD Single : A 14 C O2' : rot -179:sc= -5.97! USER MOD Single : A 15 C O2' : rot -16:sc= 0.174 USER MOD Single : A 15 C O3' : rot 180:sc= 0.179 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -10.022 3.886 6.100 1.00 0.00 O ATOM 2 C5' G A 1 -11.411 3.828 6.434 1.00 0.00 C ATOM 3 C4' G A 1 -12.271 4.519 5.381 1.00 0.00 C ATOM 4 O4' G A 1 -12.388 5.924 5.647 1.00 0.00 O ATOM 5 C3' G A 1 -11.638 4.408 4.001 1.00 0.00 C ATOM 6 O3' G A 1 -12.232 3.294 3.329 1.00 0.00 O ATOM 7 C2' G A 1 -12.097 5.687 3.314 1.00 0.00 C ATOM 8 O2' G A 1 -13.400 5.537 2.739 1.00 0.00 O ATOM 9 C1' G A 1 -12.106 6.677 4.457 1.00 0.00 C ATOM 10 N9 G A 1 -10.809 7.375 4.551 1.00 0.00 N ATOM 11 C8 G A 1 -9.957 7.490 5.600 1.00 0.00 C ATOM 12 N7 G A 1 -8.871 8.166 5.418 1.00 0.00 N ATOM 13 C5 G A 1 -9.001 8.558 4.083 1.00 0.00 C ATOM 14 C6 G A 1 -8.128 9.332 3.273 1.00 0.00 C ATOM 15 O6 G A 1 -7.048 9.834 3.579 1.00 0.00 O ATOM 16 N1 G A 1 -8.633 9.495 1.988 1.00 0.00 N ATOM 17 C2 G A 1 -9.830 8.979 1.534 1.00 0.00 C ATOM 18 N2 G A 1 -10.144 9.244 0.267 1.00 0.00 N ATOM 19 N3 G A 1 -10.657 8.249 2.289 1.00 0.00 N ATOM 20 C4 G A 1 -10.185 8.077 3.545 1.00 0.00 C ATOM 0 H5' G A 1 -11.573 4.300 7.403 1.00 0.00 H new ATOM 0 H5'' G A 1 -11.719 2.787 6.531 1.00 0.00 H new ATOM 0 H4' G A 1 -13.244 4.028 5.414 1.00 0.00 H new ATOM 0 H3' G A 1 -10.556 4.280 4.015 1.00 0.00 H new ATOM 0 H2' G A 1 -11.462 5.987 2.481 1.00 0.00 H new ATOM 0 HO2' G A 1 -13.652 4.590 2.743 1.00 0.00 H new ATOM 0 HO5' G A 1 -9.783 4.804 5.852 1.00 0.00 H new ATOM 0 H1' G A 1 -12.860 7.450 4.308 1.00 0.00 H new ATOM 0 H8 G A 1 -10.178 7.033 6.553 1.00 0.00 H new ATOM 0 H1 G A 1 -8.075 10.038 1.329 1.00 0.00 H new ATOM 0 H21 G A 1 -11.016 8.890 -0.127 1.00 0.00 H new ATOM 0 H22 G A 1 -9.513 9.801 -0.309 1.00 0.00 H new ATOM 33 P G A 2 -11.316 2.090 2.777 1.00 0.00 P ATOM 34 OP1 G A 2 -12.055 0.822 2.962 1.00 0.00 O ATOM 35 OP2 G A 2 -9.959 2.243 3.346 1.00 0.00 O ATOM 36 O5' G A 2 -11.240 2.403 1.200 1.00 0.00 O ATOM 37 C5' G A 2 -12.436 2.565 0.434 1.00 0.00 C ATOM 38 C4' G A 2 -12.175 3.347 -0.849 1.00 0.00 C ATOM 39 O4' G A 2 -11.855 4.715 -0.566 1.00 0.00 O ATOM 40 C3' G A 2 -10.983 2.769 -1.599 1.00 0.00 C ATOM 41 O3' G A 2 -11.480 1.944 -2.656 1.00 0.00 O ATOM 42 C2' G A 2 -10.315 3.984 -2.220 1.00 0.00 C ATOM 43 O2' G A 2 -10.819 4.239 -3.536 1.00 0.00 O ATOM 44 C1' G A 2 -10.666 5.112 -1.264 1.00 0.00 C ATOM 45 N9 G A 2 -9.557 5.388 -0.323 1.00 0.00 N ATOM 46 C8 G A 2 -9.440 5.104 1.004 1.00 0.00 C ATOM 47 N7 G A 2 -8.341 5.445 1.590 1.00 0.00 N ATOM 48 C5 G A 2 -7.625 6.031 0.544 1.00 0.00 C ATOM 49 C6 G A 2 -6.326 6.611 0.542 1.00 0.00 C ATOM 50 O6 G A 2 -5.539 6.720 1.478 1.00 0.00 O ATOM 51 N1 G A 2 -5.983 7.088 -0.717 1.00 0.00 N ATOM 52 C2 G A 2 -6.784 7.017 -1.840 1.00 0.00 C ATOM 53 N2 G A 2 -6.276 7.533 -2.958 1.00 0.00 N ATOM 54 N3 G A 2 -8.005 6.474 -1.846 1.00 0.00 N ATOM 55 C4 G A 2 -8.362 6.002 -0.630 1.00 0.00 C ATOM 0 H5' G A 2 -13.185 3.084 1.032 1.00 0.00 H new ATOM 0 H5'' G A 2 -12.847 1.586 0.188 1.00 0.00 H new ATOM 0 H4' G A 2 -13.086 3.279 -1.444 1.00 0.00 H new ATOM 0 H3' G A 2 -10.315 2.186 -0.965 1.00 0.00 H new ATOM 0 H2' G A 2 -9.240 3.857 -2.345 1.00 0.00 H new ATOM 0 HO2' G A 2 -10.372 5.027 -3.911 1.00 0.00 H new ATOM 0 H1' G A 2 -10.834 6.039 -1.813 1.00 0.00 H new ATOM 0 H8 G A 2 -10.235 4.613 1.545 1.00 0.00 H new ATOM 0 H1 G A 2 -5.067 7.525 -0.820 1.00 0.00 H new ATOM 0 H21 G A 2 -6.818 7.512 -3.822 1.00 0.00 H new ATOM 0 H22 G A 2 -5.345 7.949 -2.950 1.00 0.00 H new ATOM 67 P C A 3 -10.567 0.772 -3.275 1.00 0.00 P ATOM 68 OP1 C A 3 -11.418 -0.072 -4.143 1.00 0.00 O ATOM 69 OP2 C A 3 -9.797 0.154 -2.172 1.00 0.00 O ATOM 70 O5' C A 3 -9.539 1.584 -4.211 1.00 0.00 O ATOM 71 C5' C A 3 -10.020 2.489 -5.210 1.00 0.00 C ATOM 72 C4' C A 3 -8.870 3.203 -5.910 1.00 0.00 C ATOM 73 O4' C A 3 -8.204 4.103 -5.025 1.00 0.00 O ATOM 74 C3' C A 3 -7.809 2.214 -6.356 1.00 0.00 C ATOM 75 O3' C A 3 -8.091 1.820 -7.701 1.00 0.00 O ATOM 76 C2' C A 3 -6.532 3.040 -6.359 1.00 0.00 C ATOM 77 O2' C A 3 -6.303 3.643 -7.638 1.00 0.00 O ATOM 78 C1' C A 3 -6.790 4.094 -5.282 1.00 0.00 C ATOM 79 N1 C A 3 -6.035 3.785 -4.054 1.00 0.00 N ATOM 80 C2 C A 3 -4.715 4.206 -3.991 1.00 0.00 C ATOM 81 O2 C A 3 -4.217 4.812 -4.936 1.00 0.00 O ATOM 82 N3 C A 3 -4.001 3.928 -2.863 1.00 0.00 N ATOM 83 C4 C A 3 -4.561 3.265 -1.842 1.00 0.00 C ATOM 84 N4 C A 3 -3.838 3.009 -0.750 1.00 0.00 N ATOM 85 C5 C A 3 -5.922 2.829 -1.906 1.00 0.00 C ATOM 86 C6 C A 3 -6.618 3.111 -3.025 1.00 0.00 C ATOM 0 H5' C A 3 -10.681 3.224 -4.750 1.00 0.00 H new ATOM 0 H5'' C A 3 -10.612 1.943 -5.944 1.00 0.00 H new ATOM 0 H4' C A 3 -9.313 3.730 -6.755 1.00 0.00 H new ATOM 0 H3' C A 3 -7.754 1.325 -5.728 1.00 0.00 H new ATOM 0 H2' C A 3 -5.641 2.444 -6.163 1.00 0.00 H new ATOM 0 HO2' C A 3 -7.002 3.359 -8.263 1.00 0.00 H new ATOM 0 H1' C A 3 -6.457 5.075 -5.620 1.00 0.00 H new ATOM 0 H41 C A 3 -4.256 2.505 0.032 1.00 0.00 H new ATOM 0 H42 C A 3 -2.867 3.317 -0.697 1.00 0.00 H new ATOM 0 H5 C A 3 -6.376 2.292 -1.086 1.00 0.00 H new ATOM 0 H6 C A 3 -7.649 2.799 -3.106 1.00 0.00 H new ATOM 98 P U A 4 -7.512 0.435 -8.282 1.00 0.00 P ATOM 99 OP1 U A 4 -7.985 0.282 -9.676 1.00 0.00 O ATOM 100 OP2 U A 4 -7.783 -0.631 -7.290 1.00 0.00 O ATOM 101 O5' U A 4 -5.923 0.701 -8.315 1.00 0.00 O ATOM 102 C5' U A 4 -5.324 1.345 -9.441 1.00 0.00 C ATOM 103 C4' U A 4 -3.883 1.767 -9.156 1.00 0.00 C ATOM 104 O4' U A 4 -3.724 2.259 -7.826 1.00 0.00 O ATOM 105 C3' U A 4 -2.931 0.590 -9.235 1.00 0.00 C ATOM 106 O3' U A 4 -2.529 0.404 -10.595 1.00 0.00 O ATOM 107 C2' U A 4 -1.736 1.095 -8.445 1.00 0.00 C ATOM 108 O2' U A 4 -0.845 1.853 -9.271 1.00 0.00 O ATOM 109 C1' U A 4 -2.387 1.972 -7.372 1.00 0.00 C ATOM 110 N1 U A 4 -2.389 1.273 -6.074 1.00 0.00 N ATOM 111 C2 U A 4 -1.304 1.481 -5.245 1.00 0.00 C ATOM 112 O2 U A 4 -0.391 2.247 -5.545 1.00 0.00 O ATOM 113 N3 U A 4 -1.302 0.775 -4.056 1.00 0.00 N ATOM 114 C4 U A 4 -2.280 -0.106 -3.628 1.00 0.00 C ATOM 115 O4 U A 4 -2.174 -0.684 -2.548 1.00 0.00 O ATOM 116 C5 U A 4 -3.378 -0.260 -4.553 1.00 0.00 C ATOM 117 C6 U A 4 -3.402 0.420 -5.726 1.00 0.00 C ATOM 0 H5' U A 4 -5.912 2.222 -9.713 1.00 0.00 H new ATOM 0 H5'' U A 4 -5.342 0.671 -10.297 1.00 0.00 H new ATOM 0 H4' U A 4 -3.664 2.530 -9.903 1.00 0.00 H new ATOM 0 H3' U A 4 -3.352 -0.348 -8.872 1.00 0.00 H new ATOM 0 H2' U A 4 -1.122 0.294 -8.033 1.00 0.00 H new ATOM 0 HO2' U A 4 -1.104 1.752 -10.211 1.00 0.00 H new ATOM 0 H1' U A 4 -1.835 2.900 -7.224 1.00 0.00 H new ATOM 0 H3 U A 4 -0.505 0.917 -3.436 1.00 0.00 H new ATOM 0 H5 U A 4 -4.192 -0.926 -4.307 1.00 0.00 H new ATOM 0 H6 U A 4 -4.236 0.286 -6.399 1.00 0.00 H new ATOM 128 P C A 5 -1.785 -0.952 -11.044 1.00 0.00 P ATOM 129 OP1 C A 5 -1.194 -0.736 -12.384 1.00 0.00 O ATOM 130 OP2 C A 5 -2.711 -2.085 -10.821 1.00 0.00 O ATOM 131 O5' C A 5 -0.585 -1.067 -9.978 1.00 0.00 O ATOM 132 C5' C A 5 0.580 -0.252 -10.115 1.00 0.00 C ATOM 133 C4' C A 5 1.749 -0.788 -9.293 1.00 0.00 C ATOM 134 O4' C A 5 1.585 -0.507 -7.909 1.00 0.00 O ATOM 135 C3' C A 5 1.837 -2.300 -9.368 1.00 0.00 C ATOM 136 O3' C A 5 2.645 -2.664 -10.491 1.00 0.00 O ATOM 137 C2' C A 5 2.600 -2.659 -8.100 1.00 0.00 C ATOM 138 O2' C A 5 4.010 -2.720 -8.340 1.00 0.00 O ATOM 139 C1' C A 5 2.253 -1.519 -7.139 1.00 0.00 C ATOM 140 N1 C A 5 1.400 -2.003 -6.037 1.00 0.00 N ATOM 141 C2 C A 5 1.976 -2.079 -4.780 1.00 0.00 C ATOM 142 O2 C A 5 3.147 -1.747 -4.622 1.00 0.00 O ATOM 143 N3 C A 5 1.214 -2.527 -3.746 1.00 0.00 N ATOM 144 C4 C A 5 -0.061 -2.885 -3.936 1.00 0.00 C ATOM 145 N4 C A 5 -0.777 -3.317 -2.899 1.00 0.00 N ATOM 146 C5 C A 5 -0.661 -2.808 -5.234 1.00 0.00 C ATOM 147 C6 C A 5 0.102 -2.363 -6.251 1.00 0.00 C ATOM 0 H5' C A 5 0.350 0.766 -9.799 1.00 0.00 H new ATOM 0 H5'' C A 5 0.867 -0.203 -11.165 1.00 0.00 H new ATOM 0 H4' C A 5 2.634 -0.306 -9.708 1.00 0.00 H new ATOM 0 H3' C A 5 0.867 -2.788 -9.462 1.00 0.00 H new ATOM 0 H2' C A 5 2.331 -3.641 -7.710 1.00 0.00 H new ATOM 0 HO2' C A 5 4.188 -2.553 -9.289 1.00 0.00 H new ATOM 0 H1' C A 5 3.154 -1.113 -6.679 1.00 0.00 H new ATOM 0 H41 C A 5 -1.750 -3.593 -3.031 1.00 0.00 H new ATOM 0 H42 C A 5 -0.352 -3.372 -1.973 1.00 0.00 H new ATOM 0 H5 C A 5 -1.690 -3.097 -5.392 1.00 0.00 H new ATOM 0 H6 C A 5 -0.317 -2.291 -7.244 1.00 0.00 H new ATOM 159 P U A 6 2.610 -4.170 -11.063 1.00 0.00 P ATOM 160 OP1 U A 6 3.668 -4.302 -12.088 1.00 0.00 O ATOM 161 OP2 U A 6 1.208 -4.503 -11.401 1.00 0.00 O ATOM 162 O5' U A 6 3.038 -5.049 -9.781 1.00 0.00 O ATOM 163 C5' U A 6 4.361 -4.955 -9.246 1.00 0.00 C ATOM 164 C4' U A 6 4.463 -5.600 -7.865 1.00 0.00 C ATOM 165 O4' U A 6 3.308 -5.341 -7.074 1.00 0.00 O ATOM 166 C3' U A 6 4.531 -7.112 -7.961 1.00 0.00 C ATOM 167 O3' U A 6 5.902 -7.496 -8.089 1.00 0.00 O ATOM 168 C2' U A 6 4.030 -7.568 -6.598 1.00 0.00 C ATOM 169 O2' U A 6 5.113 -7.749 -5.679 1.00 0.00 O ATOM 170 C1' U A 6 3.108 -6.427 -6.153 1.00 0.00 C ATOM 171 N1 U A 6 1.700 -6.866 -6.149 1.00 0.00 N ATOM 172 C2 U A 6 1.277 -7.635 -5.083 1.00 0.00 C ATOM 173 O2 U A 6 2.023 -7.933 -4.152 1.00 0.00 O ATOM 174 N3 U A 6 -0.042 -8.053 -5.120 1.00 0.00 N ATOM 175 C4 U A 6 -0.959 -7.769 -6.117 1.00 0.00 C ATOM 176 O4 U A 6 -2.110 -8.195 -6.051 1.00 0.00 O ATOM 177 C5 U A 6 -0.429 -6.960 -7.190 1.00 0.00 C ATOM 178 C6 U A 6 0.859 -6.540 -7.175 1.00 0.00 C ATOM 0 H5' U A 6 4.652 -3.907 -9.180 1.00 0.00 H new ATOM 0 H5'' U A 6 5.063 -5.439 -9.926 1.00 0.00 H new ATOM 0 H4' U A 6 5.363 -5.176 -7.420 1.00 0.00 H new ATOM 0 H3' U A 6 3.968 -7.525 -8.798 1.00 0.00 H new ATOM 0 H2' U A 6 3.522 -8.531 -6.636 1.00 0.00 H new ATOM 0 HO2' U A 6 5.111 -7.020 -5.024 1.00 0.00 H new ATOM 0 H1' U A 6 3.343 -6.113 -5.136 1.00 0.00 H new ATOM 0 H3 U A 6 -0.369 -8.623 -4.340 1.00 0.00 H new ATOM 0 H5 U A 6 -1.069 -6.686 -8.016 1.00 0.00 H new ATOM 0 H6 U A 6 1.228 -5.936 -7.990 1.00 0.00 H new ATOM 189 P C A 7 6.343 -8.604 -9.172 1.00 0.00 P ATOM 190 OP1 C A 7 6.560 -7.923 -10.469 1.00 0.00 O ATOM 191 OP2 C A 7 5.400 -9.740 -9.084 1.00 0.00 O ATOM 192 O5' C A 7 7.773 -9.090 -8.615 1.00 0.00 O ATOM 193 C5' C A 7 8.816 -8.142 -8.370 1.00 0.00 C ATOM 194 C4' C A 7 9.314 -8.213 -6.930 1.00 0.00 C ATOM 195 O4' C A 7 10.055 -7.040 -6.588 1.00 0.00 O ATOM 196 C3' C A 7 8.142 -8.295 -5.947 1.00 0.00 C ATOM 197 O3' C A 7 8.322 -9.460 -5.138 1.00 0.00 O ATOM 198 C2' C A 7 8.286 -7.067 -5.051 1.00 0.00 C ATOM 199 O2' C A 7 8.025 -7.388 -3.680 1.00 0.00 O ATOM 200 C1' C A 7 9.735 -6.655 -5.255 1.00 0.00 C ATOM 201 N1 C A 7 9.908 -5.203 -5.064 1.00 0.00 N ATOM 202 C2 C A 7 10.456 -4.779 -3.864 1.00 0.00 C ATOM 203 O2 C A 7 10.779 -5.601 -3.010 1.00 0.00 O ATOM 204 N3 C A 7 10.620 -3.442 -3.666 1.00 0.00 N ATOM 205 C4 C A 7 10.263 -2.558 -4.607 1.00 0.00 C ATOM 206 N4 C A 7 10.437 -1.256 -4.379 1.00 0.00 N ATOM 207 C5 C A 7 9.698 -2.991 -5.847 1.00 0.00 C ATOM 208 C6 C A 7 9.538 -4.316 -6.033 1.00 0.00 C ATOM 0 H5' C A 7 8.451 -7.137 -8.580 1.00 0.00 H new ATOM 0 H5'' C A 7 9.646 -8.329 -9.052 1.00 0.00 H new ATOM 0 H4' C A 7 9.940 -9.102 -6.861 1.00 0.00 H new ATOM 0 H3' C A 7 7.175 -8.337 -6.448 1.00 0.00 H new ATOM 0 H2' C A 7 7.579 -6.275 -5.298 1.00 0.00 H new ATOM 0 HO2' C A 7 7.463 -6.691 -3.282 1.00 0.00 H new ATOM 0 H1' C A 7 10.394 -7.133 -4.530 1.00 0.00 H new ATOM 0 H41 C A 7 10.169 -0.574 -5.088 1.00 0.00 H new ATOM 0 H42 C A 7 10.838 -0.942 -3.495 1.00 0.00 H new ATOM 0 H5 C A 7 9.410 -2.281 -6.608 1.00 0.00 H new ATOM 0 H6 C A 7 9.113 -4.679 -6.957 1.00 0.00 H new ATOM 220 P A A 8 7.784 -10.892 -5.640 1.00 0.00 P ATOM 221 OP1 A A 8 8.876 -11.880 -5.479 1.00 0.00 O ATOM 222 OP2 A A 8 7.145 -10.709 -6.961 1.00 0.00 O ATOM 223 O5' A A 8 6.633 -11.233 -4.567 1.00 0.00 O ATOM 224 C5' A A 8 6.482 -10.444 -3.385 1.00 0.00 C ATOM 225 C4' A A 8 5.227 -10.835 -2.609 1.00 0.00 C ATOM 226 O4' A A 8 4.047 -10.578 -3.377 1.00 0.00 O ATOM 227 C3' A A 8 5.217 -12.328 -2.309 1.00 0.00 C ATOM 228 O3' A A 8 4.449 -12.544 -1.121 1.00 0.00 O ATOM 229 C2' A A 8 4.452 -12.914 -3.481 1.00 0.00 C ATOM 230 O2' A A 8 3.794 -14.133 -3.119 1.00 0.00 O ATOM 231 C1' A A 8 3.449 -11.811 -3.802 1.00 0.00 C ATOM 232 N9 A A 8 3.145 -11.779 -5.244 1.00 0.00 N ATOM 233 C8 A A 8 3.910 -11.356 -6.281 1.00 0.00 C ATOM 234 N7 A A 8 3.401 -11.427 -7.466 1.00 0.00 N ATOM 235 C5 A A 8 2.137 -11.963 -7.197 1.00 0.00 C ATOM 236 C6 A A 8 1.058 -12.303 -8.019 1.00 0.00 C ATOM 237 N6 A A 8 1.074 -12.148 -9.343 1.00 0.00 N ATOM 238 N1 A A 8 -0.038 -12.809 -7.426 1.00 0.00 N ATOM 239 C2 A A 8 -0.074 -12.972 -6.102 1.00 0.00 C ATOM 240 N3 A A 8 0.888 -12.684 -5.230 1.00 0.00 N ATOM 241 C4 A A 8 1.975 -12.179 -5.848 1.00 0.00 C ATOM 0 H5' A A 8 6.431 -9.389 -3.654 1.00 0.00 H new ATOM 0 H5'' A A 8 7.358 -10.568 -2.749 1.00 0.00 H new ATOM 0 H4' A A 8 5.237 -10.246 -1.692 1.00 0.00 H new ATOM 0 H3' A A 8 6.211 -12.754 -2.175 1.00 0.00 H new ATOM 0 H2' A A 8 5.087 -13.181 -4.325 1.00 0.00 H new ATOM 0 HO2' A A 8 3.566 -14.111 -2.166 1.00 0.00 H new ATOM 0 H1' A A 8 2.503 -11.983 -3.288 1.00 0.00 H new ATOM 0 H8 A A 8 4.908 -10.974 -6.122 1.00 0.00 H new ATOM 0 H61 A A 8 0.259 -12.412 -9.897 1.00 0.00 H new ATOM 0 H62 A A 8 1.901 -11.765 -9.802 1.00 0.00 H new ATOM 0 H2 A A 8 -0.985 -13.383 -5.693 1.00 0.00 H new ATOM 253 P G A 9 5.002 -12.063 0.312 1.00 0.00 P ATOM 254 OP1 G A 9 6.479 -12.161 0.295 1.00 0.00 O ATOM 255 OP2 G A 9 4.229 -12.756 1.366 1.00 0.00 O ATOM 256 O5' G A 9 4.600 -10.504 0.334 1.00 0.00 O ATOM 257 C5' G A 9 3.843 -9.964 1.421 1.00 0.00 C ATOM 258 C4' G A 9 4.759 -9.398 2.508 1.00 0.00 C ATOM 259 O4' G A 9 6.114 -9.398 2.049 1.00 0.00 O ATOM 260 C3' G A 9 4.407 -7.948 2.871 1.00 0.00 C ATOM 261 O3' G A 9 3.931 -7.940 4.221 1.00 0.00 O ATOM 262 C2' G A 9 5.745 -7.203 2.877 1.00 0.00 C ATOM 263 O2' G A 9 6.250 -7.066 4.210 1.00 0.00 O ATOM 264 C1' G A 9 6.659 -8.076 2.035 1.00 0.00 C ATOM 265 N9 G A 9 6.773 -7.541 0.663 1.00 0.00 N ATOM 266 C8 G A 9 7.794 -6.856 0.097 1.00 0.00 C ATOM 267 N7 G A 9 7.651 -6.462 -1.122 1.00 0.00 N ATOM 268 C5 G A 9 6.374 -6.937 -1.427 1.00 0.00 C ATOM 269 C6 G A 9 5.627 -6.826 -2.630 1.00 0.00 C ATOM 270 O6 G A 9 5.953 -6.278 -3.680 1.00 0.00 O ATOM 271 N1 G A 9 4.387 -7.441 -2.519 1.00 0.00 N ATOM 272 C2 G A 9 3.917 -8.084 -1.392 1.00 0.00 C ATOM 273 N2 G A 9 2.696 -8.615 -1.482 1.00 0.00 N ATOM 274 N3 G A 9 4.613 -8.192 -0.255 1.00 0.00 N ATOM 275 C4 G A 9 5.826 -7.600 -0.339 1.00 0.00 C ATOM 0 H5' G A 9 3.207 -10.741 1.846 1.00 0.00 H new ATOM 0 H5'' G A 9 3.183 -9.178 1.053 1.00 0.00 H new ATOM 0 H4' G A 9 4.627 -10.032 3.385 1.00 0.00 H new ATOM 0 H3' G A 9 3.671 -7.516 2.192 1.00 0.00 H new ATOM 0 H2' G A 9 5.660 -6.189 2.486 1.00 0.00 H new ATOM 0 HO2' G A 9 5.550 -7.309 4.852 1.00 0.00 H new ATOM 0 H1' G A 9 7.670 -8.090 2.442 1.00 0.00 H new ATOM 0 H8 G A 9 8.699 -6.646 0.648 1.00 0.00 H new ATOM 0 H1 G A 9 3.775 -7.415 -3.335 1.00 0.00 H new ATOM 0 H21 G A 9 2.292 -9.104 -0.683 1.00 0.00 H new ATOM 0 H22 G A 9 2.167 -8.532 -2.350 1.00 0.00 H new ATOM 287 P U A 10 2.354 -7.847 4.529 1.00 0.00 P ATOM 288 OP1 U A 10 1.841 -9.220 4.729 1.00 0.00 O ATOM 289 OP2 U A 10 1.733 -6.968 3.514 1.00 0.00 O ATOM 290 O5' U A 10 2.316 -7.085 5.949 1.00 0.00 O ATOM 291 C5' U A 10 2.054 -5.679 6.014 1.00 0.00 C ATOM 292 C4' U A 10 2.989 -4.983 6.999 1.00 0.00 C ATOM 293 O4' U A 10 2.280 -4.521 8.155 1.00 0.00 O ATOM 294 C3' U A 10 4.047 -5.946 7.512 1.00 0.00 C ATOM 295 O3' U A 10 5.215 -5.188 7.841 1.00 0.00 O ATOM 296 C2' U A 10 3.447 -6.483 8.803 1.00 0.00 C ATOM 297 O2' U A 10 4.467 -6.861 9.734 1.00 0.00 O ATOM 298 C1' U A 10 2.645 -5.294 9.309 1.00 0.00 C ATOM 299 N1 U A 10 1.445 -5.741 10.035 1.00 0.00 N ATOM 300 C2 U A 10 1.601 -6.130 11.352 1.00 0.00 C ATOM 301 O2 U A 10 2.698 -6.133 11.908 1.00 0.00 O ATOM 302 N3 U A 10 0.449 -6.520 12.010 1.00 0.00 N ATOM 303 C4 U A 10 -0.825 -6.556 11.473 1.00 0.00 C ATOM 304 O4 U A 10 -1.782 -6.916 12.154 1.00 0.00 O ATOM 305 C5 U A 10 -0.894 -6.135 10.090 1.00 0.00 C ATOM 306 C6 U A 10 0.223 -5.748 9.425 1.00 0.00 C ATOM 0 H5' U A 10 1.019 -5.514 6.314 1.00 0.00 H new ATOM 0 H5'' U A 10 2.173 -5.239 5.024 1.00 0.00 H new ATOM 0 H4' U A 10 3.436 -4.150 6.457 1.00 0.00 H new ATOM 0 H3' U A 10 4.311 -6.727 6.798 1.00 0.00 H new ATOM 0 H2' U A 10 2.848 -7.383 8.664 1.00 0.00 H new ATOM 0 HO2' U A 10 4.137 -6.737 10.649 1.00 0.00 H new ATOM 0 H1' U A 10 3.234 -4.700 10.008 1.00 0.00 H new ATOM 0 H3 U A 10 0.548 -6.808 12.983 1.00 0.00 H new ATOM 0 H5 U A 10 -1.847 -6.129 9.581 1.00 0.00 H new ATOM 0 H6 U A 10 0.145 -5.439 8.393 1.00 0.00 H new ATOM 317 P G A 11 6.684 -5.792 7.577 1.00 0.00 P ATOM 318 OP1 G A 11 6.531 -7.135 6.974 1.00 0.00 O ATOM 319 OP2 G A 11 7.483 -5.624 8.812 1.00 0.00 O ATOM 320 O5' G A 11 7.275 -4.800 6.455 1.00 0.00 O ATOM 321 C5' G A 11 6.459 -3.775 5.881 1.00 0.00 C ATOM 322 C4' G A 11 7.096 -3.199 4.620 1.00 0.00 C ATOM 323 O4' G A 11 6.835 -4.027 3.481 1.00 0.00 O ATOM 324 C3' G A 11 6.514 -1.838 4.277 1.00 0.00 C ATOM 325 O3' G A 11 7.325 -0.828 4.885 1.00 0.00 O ATOM 326 C2' G A 11 6.703 -1.765 2.774 1.00 0.00 C ATOM 327 O2' G A 11 8.019 -1.313 2.432 1.00 0.00 O ATOM 328 C1' G A 11 6.482 -3.212 2.351 1.00 0.00 C ATOM 329 N9 G A 11 5.078 -3.435 1.952 1.00 0.00 N ATOM 330 C8 G A 11 4.020 -3.848 2.692 1.00 0.00 C ATOM 331 N7 G A 11 2.879 -3.960 2.096 1.00 0.00 N ATOM 332 C5 G A 11 3.200 -3.575 0.791 1.00 0.00 C ATOM 333 C6 G A 11 2.375 -3.482 -0.363 1.00 0.00 C ATOM 334 O6 G A 11 1.174 -3.724 -0.463 1.00 0.00 O ATOM 335 N1 G A 11 3.095 -3.054 -1.473 1.00 0.00 N ATOM 336 C2 G A 11 4.444 -2.754 -1.477 1.00 0.00 C ATOM 337 N2 G A 11 4.960 -2.359 -2.639 1.00 0.00 N ATOM 338 N3 G A 11 5.226 -2.839 -0.396 1.00 0.00 N ATOM 339 C4 G A 11 4.546 -3.252 0.696 1.00 0.00 C ATOM 0 H5' G A 11 6.306 -2.979 6.610 1.00 0.00 H new ATOM 0 H5'' G A 11 5.476 -4.181 5.641 1.00 0.00 H new ATOM 0 H4' G A 11 8.163 -3.134 4.831 1.00 0.00 H new ATOM 0 H3' G A 11 5.483 -1.702 4.604 1.00 0.00 H new ATOM 0 H2' G A 11 6.032 -1.060 2.283 1.00 0.00 H new ATOM 0 HO2' G A 11 8.413 -0.845 3.198 1.00 0.00 H new ATOM 0 H1' G A 11 7.093 -3.465 1.485 1.00 0.00 H new ATOM 0 H8 G A 11 4.127 -4.075 3.742 1.00 0.00 H new ATOM 0 H1 G A 11 2.588 -2.954 -2.352 1.00 0.00 H new ATOM 0 H21 G A 11 5.950 -2.124 -2.704 1.00 0.00 H new ATOM 0 H22 G A 11 4.365 -2.292 -3.465 1.00 0.00 H new ATOM 351 P A A 12 6.715 0.627 5.207 1.00 0.00 P ATOM 352 OP1 A A 12 7.757 1.423 5.894 1.00 0.00 O ATOM 353 OP2 A A 12 5.390 0.444 5.842 1.00 0.00 O ATOM 354 O5' A A 12 6.490 1.251 3.740 1.00 0.00 O ATOM 355 C5' A A 12 7.548 1.953 3.081 1.00 0.00 C ATOM 356 C4' A A 12 7.082 2.579 1.768 1.00 0.00 C ATOM 357 O4' A A 12 6.515 1.607 0.894 1.00 0.00 O ATOM 358 C3' A A 12 5.967 3.581 1.993 1.00 0.00 C ATOM 359 O3' A A 12 6.543 4.868 2.233 1.00 0.00 O ATOM 360 C2' A A 12 5.267 3.624 0.636 1.00 0.00 C ATOM 361 O2' A A 12 5.793 4.672 -0.186 1.00 0.00 O ATOM 362 C1' A A 12 5.560 2.250 0.035 1.00 0.00 C ATOM 363 N9 A A 12 4.313 1.469 -0.073 1.00 0.00 N ATOM 364 C8 A A 12 3.816 0.509 0.742 1.00 0.00 C ATOM 365 N7 A A 12 2.674 -0.007 0.428 1.00 0.00 N ATOM 366 C5 A A 12 2.362 0.691 -0.743 1.00 0.00 C ATOM 367 C6 A A 12 1.268 0.642 -1.615 1.00 0.00 C ATOM 368 N6 A A 12 0.234 -0.183 -1.440 1.00 0.00 N ATOM 369 N1 A A 12 1.282 1.471 -2.675 1.00 0.00 N ATOM 370 C2 A A 12 2.309 2.303 -2.869 1.00 0.00 C ATOM 371 N3 A A 12 3.392 2.432 -2.108 1.00 0.00 N ATOM 372 C4 A A 12 3.355 1.591 -1.054 1.00 0.00 C ATOM 0 H5' A A 12 8.372 1.267 2.884 1.00 0.00 H new ATOM 0 H5'' A A 12 7.932 2.732 3.739 1.00 0.00 H new ATOM 0 H4' A A 12 7.973 3.042 1.344 1.00 0.00 H new ATOM 0 H3' A A 12 5.314 3.325 2.827 1.00 0.00 H new ATOM 0 H2' A A 12 4.200 3.829 0.719 1.00 0.00 H new ATOM 0 HO2' A A 12 5.155 5.416 -0.216 1.00 0.00 H new ATOM 0 H1' A A 12 5.968 2.335 -0.972 1.00 0.00 H new ATOM 0 H8 A A 12 4.354 0.187 1.621 1.00 0.00 H new ATOM 0 H61 A A 12 -0.539 -0.180 -2.105 1.00 0.00 H new ATOM 0 H62 A A 12 0.217 -0.817 -0.641 1.00 0.00 H new ATOM 0 H2 A A 12 2.254 2.941 -3.739 1.00 0.00 H new ATOM 384 P G A 13 5.612 6.103 2.693 1.00 0.00 P ATOM 385 OP1 G A 13 6.486 7.157 3.256 1.00 0.00 O ATOM 386 OP2 G A 13 4.497 5.563 3.501 1.00 0.00 O ATOM 387 O5' G A 13 5.008 6.638 1.298 1.00 0.00 O ATOM 388 C5' G A 13 5.713 7.620 0.532 1.00 0.00 C ATOM 389 C4' G A 13 5.122 7.782 -0.869 1.00 0.00 C ATOM 390 O4' G A 13 4.742 6.516 -1.428 1.00 0.00 O ATOM 391 C3' G A 13 3.845 8.610 -0.851 1.00 0.00 C ATOM 392 O3' G A 13 4.183 9.981 -1.068 1.00 0.00 O ATOM 393 C2' G A 13 3.112 8.097 -2.075 1.00 0.00 C ATOM 394 O2' G A 13 3.608 8.695 -3.279 1.00 0.00 O ATOM 395 C1' G A 13 3.430 6.615 -2.012 1.00 0.00 C ATOM 396 N9 G A 13 2.425 5.918 -1.193 1.00 0.00 N ATOM 397 C8 G A 13 2.492 5.519 0.097 1.00 0.00 C ATOM 398 N7 G A 13 1.455 4.933 0.598 1.00 0.00 N ATOM 399 C5 G A 13 0.575 4.938 -0.488 1.00 0.00 C ATOM 400 C6 G A 13 -0.751 4.436 -0.589 1.00 0.00 C ATOM 401 O6 G A 13 -1.421 3.876 0.275 1.00 0.00 O ATOM 402 N1 G A 13 -1.279 4.646 -1.857 1.00 0.00 N ATOM 403 C2 G A 13 -0.619 5.260 -2.903 1.00 0.00 C ATOM 404 N2 G A 13 -1.297 5.368 -4.045 1.00 0.00 N ATOM 405 N3 G A 13 0.627 5.733 -2.816 1.00 0.00 N ATOM 406 C4 G A 13 1.163 5.541 -1.590 1.00 0.00 C ATOM 0 H5' G A 13 6.762 7.334 0.453 1.00 0.00 H new ATOM 0 H5'' G A 13 5.682 8.577 1.052 1.00 0.00 H new ATOM 0 H4' G A 13 5.903 8.266 -1.455 1.00 0.00 H new ATOM 0 H3' G A 13 3.279 8.536 0.077 1.00 0.00 H new ATOM 0 H2' G A 13 2.046 8.324 -2.084 1.00 0.00 H new ATOM 0 HO2' G A 13 3.969 9.584 -3.078 1.00 0.00 H new ATOM 0 H1' G A 13 3.410 6.150 -2.998 1.00 0.00 H new ATOM 0 H8 G A 13 3.381 5.684 0.688 1.00 0.00 H new ATOM 0 H1 G A 13 -2.230 4.321 -2.029 1.00 0.00 H new ATOM 0 H21 G A 13 -0.864 5.812 -4.855 1.00 0.00 H new ATOM 0 H22 G A 13 -2.249 5.007 -4.109 1.00 0.00 H new ATOM 418 P C A 14 3.390 11.149 -0.292 1.00 0.00 P ATOM 419 OP1 C A 14 4.124 12.418 -0.492 1.00 0.00 O ATOM 420 OP2 C A 14 3.092 10.677 1.079 1.00 0.00 O ATOM 421 O5' C A 14 2.003 11.236 -1.107 1.00 0.00 O ATOM 422 C5' C A 14 1.947 11.906 -2.369 1.00 0.00 C ATOM 423 C4' C A 14 0.717 11.494 -3.174 1.00 0.00 C ATOM 424 O4' C A 14 0.451 10.095 -3.048 1.00 0.00 O ATOM 425 C3' C A 14 -0.535 12.182 -2.664 1.00 0.00 C ATOM 426 O3' C A 14 -0.690 13.423 -3.359 1.00 0.00 O ATOM 427 C2' C A 14 -1.640 11.240 -3.108 1.00 0.00 C ATOM 428 O2' C A 14 -2.070 11.532 -4.443 1.00 0.00 O ATOM 429 C1' C A 14 -0.969 9.868 -3.024 1.00 0.00 C ATOM 430 N1 C A 14 -1.377 9.169 -1.791 1.00 0.00 N ATOM 431 C2 C A 14 -2.675 8.687 -1.737 1.00 0.00 C ATOM 432 O2 C A 14 -3.424 8.826 -2.701 1.00 0.00 O ATOM 433 N3 C A 14 -3.086 8.066 -0.599 1.00 0.00 N ATOM 434 C4 C A 14 -2.257 7.921 0.443 1.00 0.00 C ATOM 435 N4 C A 14 -2.693 7.309 1.544 1.00 0.00 N ATOM 436 C5 C A 14 -0.915 8.414 0.391 1.00 0.00 C ATOM 437 C6 C A 14 -0.518 9.029 -0.741 1.00 0.00 C ATOM 0 H5' C A 14 2.848 11.681 -2.940 1.00 0.00 H new ATOM 0 H5'' C A 14 1.932 12.984 -2.208 1.00 0.00 H new ATOM 0 H4' C A 14 0.940 11.770 -4.205 1.00 0.00 H new ATOM 0 H3' C A 14 -0.525 12.381 -1.592 1.00 0.00 H new ATOM 0 H2' C A 14 -2.541 11.316 -2.500 1.00 0.00 H new ATOM 0 HO2' C A 14 -2.792 10.919 -4.695 1.00 0.00 H new ATOM 0 H1' C A 14 -1.266 9.233 -3.859 1.00 0.00 H new ATOM 0 H41 C A 14 -2.070 7.193 2.344 1.00 0.00 H new ATOM 0 H42 C A 14 -3.649 6.957 1.587 1.00 0.00 H new ATOM 0 H5 C A 14 -0.244 8.298 1.229 1.00 0.00 H new ATOM 0 H6 C A 14 0.488 9.414 -0.817 1.00 0.00 H new ATOM 449 P C A 15 -1.875 14.438 -2.962 1.00 0.00 P ATOM 450 OP1 C A 15 -1.838 15.584 -3.899 1.00 0.00 O ATOM 451 OP2 C A 15 -1.815 14.675 -1.503 1.00 0.00 O ATOM 452 O5' C A 15 -3.197 13.576 -3.279 1.00 0.00 O ATOM 453 C5' C A 15 -3.698 13.488 -4.613 1.00 0.00 C ATOM 454 C4' C A 15 -5.185 13.154 -4.633 1.00 0.00 C ATOM 455 O4' C A 15 -5.438 11.897 -3.997 1.00 0.00 O ATOM 456 C3' C A 15 -5.990 14.194 -3.863 1.00 0.00 C ATOM 457 O3' C A 15 -6.434 15.252 -4.720 1.00 0.00 O ATOM 458 C2' C A 15 -7.156 13.380 -3.333 1.00 0.00 C ATOM 459 O2' C A 15 -8.214 13.291 -4.294 1.00 0.00 O ATOM 460 C1' C A 15 -6.526 12.018 -3.075 1.00 0.00 C ATOM 461 N1 C A 15 -6.054 11.901 -1.681 1.00 0.00 N ATOM 462 C2 C A 15 -6.848 11.187 -0.799 1.00 0.00 C ATOM 463 O2 C A 15 -7.903 10.690 -1.184 1.00 0.00 O ATOM 464 N3 C A 15 -6.426 11.058 0.489 1.00 0.00 N ATOM 465 C4 C A 15 -5.273 11.605 0.894 1.00 0.00 C ATOM 466 N4 C A 15 -4.889 11.459 2.163 1.00 0.00 N ATOM 467 C5 C A 15 -4.450 12.343 -0.014 1.00 0.00 C ATOM 468 C6 C A 15 -4.875 12.466 -1.286 1.00 0.00 C ATOM 0 H5' C A 15 -3.146 12.724 -5.160 1.00 0.00 H new ATOM 0 H5'' C A 15 -3.530 14.434 -5.129 1.00 0.00 H new ATOM 0 H4' C A 15 -5.480 13.129 -5.682 1.00 0.00 H new ATOM 0 H3' C A 15 -5.419 14.692 -3.080 1.00 0.00 H new ATOM 0 H2' C A 15 -7.617 13.817 -2.448 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.084 13.971 -4.987 1.00 0.00 H new ATOM 0 HO3' C A 15 -6.949 15.902 -4.198 1.00 0.00 H new ATOM 0 H1' C A 15 -7.254 11.219 -3.218 1.00 0.00 H new ATOM 0 H41 C A 15 -4.012 11.872 2.481 1.00 0.00 H new ATOM 0 H42 C A 15 -5.472 10.934 2.815 1.00 0.00 H new ATOM 0 H5 C A 15 -3.520 12.786 0.309 1.00 0.00 H new ATOM 0 H6 C A 15 -4.279 13.016 -1.999 1.00 0.00 H new TER 481 C A 15