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= 0.307 USER MOD Single : A 1 G O5' : rot 4:sc= 1.4 USER MOD Single : A 2 G O2' : rot 2:sc= -3.81! USER MOD Single : A 3 C O2' : rot -166:sc= -3.59! USER MOD Single : A 4 U O2' : rot -4:sc= -5.43! USER MOD Single : A 5 C O2' : rot -2:sc= -6.32! USER MOD Single : A 6 U O2' : rot 132:sc= 0.578 USER MOD Single : A 7 C O2' : rot 150:sc= 0.968 USER MOD Single : A 8 A O2' : rot 19:sc= 0.201 USER MOD Single : A 9 G O2' : rot -8:sc= 0.588 USER MOD Single : A 10 U O2' : rot 24:sc= 0.231 USER MOD Single : A 11 G O2' : rot -19:sc= 0.294 USER MOD Single : A 12 A O2' : rot -9:sc= 0.347 USER MOD Single : A 13 G O2' : rot -8:sc= 0.231 USER MOD Single : A 14 C O2' : rot 34:sc= -7.56! USER MOD Single : A 15 C O2' : rot -18:sc= 0.162 USER MOD Single : A 15 C O3' : rot 180:sc= 0.185 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -9.719 3.955 6.299 1.00 0.00 O ATOM 2 C5' G A 1 -10.994 3.321 6.174 1.00 0.00 C ATOM 3 C4' G A 1 -11.968 4.175 5.366 1.00 0.00 C ATOM 4 O4' G A 1 -11.966 5.536 5.822 1.00 0.00 O ATOM 5 C3' G A 1 -11.564 4.219 3.898 1.00 0.00 C ATOM 6 O3' G A 1 -12.357 3.261 3.192 1.00 0.00 O ATOM 7 C2' G A 1 -11.998 5.613 3.465 1.00 0.00 C ATOM 8 O2' G A 1 -13.379 5.638 3.088 1.00 0.00 O ATOM 9 C1' G A 1 -11.752 6.425 4.715 1.00 0.00 C ATOM 10 N9 G A 1 -10.383 6.981 4.728 1.00 0.00 N ATOM 11 C8 G A 1 -9.440 6.941 5.701 1.00 0.00 C ATOM 12 N7 G A 1 -8.317 7.534 5.472 1.00 0.00 N ATOM 13 C5 G A 1 -8.518 8.040 4.186 1.00 0.00 C ATOM 14 C6 G A 1 -7.645 8.800 3.361 1.00 0.00 C ATOM 15 O6 G A 1 -6.504 9.184 3.609 1.00 0.00 O ATOM 16 N1 G A 1 -8.235 9.106 2.141 1.00 0.00 N ATOM 17 C2 G A 1 -9.506 8.732 1.756 1.00 0.00 C ATOM 18 N2 G A 1 -9.891 9.122 0.541 1.00 0.00 N ATOM 19 N3 G A 1 -10.334 8.017 2.526 1.00 0.00 N ATOM 20 C4 G A 1 -9.781 7.706 3.721 1.00 0.00 C ATOM 0 H5' G A 1 -11.408 3.135 7.165 1.00 0.00 H new ATOM 0 H5'' G A 1 -10.873 2.351 5.692 1.00 0.00 H new ATOM 0 H4' G A 1 -12.951 3.721 5.493 1.00 0.00 H new ATOM 0 H3' G A 1 -10.509 4.012 3.721 1.00 0.00 H new ATOM 0 H2' G A 1 -11.465 5.985 2.590 1.00 0.00 H new ATOM 0 HO2' G A 1 -13.709 4.720 2.995 1.00 0.00 H new ATOM 0 HO5' G A 1 -9.754 4.844 5.887 1.00 0.00 H new ATOM 0 H1' G A 1 -12.426 7.280 4.767 1.00 0.00 H new ATOM 0 H8 G A 1 -9.622 6.431 6.635 1.00 0.00 H new ATOM 0 H1 G A 1 -7.685 9.651 1.477 1.00 0.00 H new ATOM 0 H21 G A 1 -10.820 8.877 0.197 1.00 0.00 H new ATOM 0 H22 G A 1 -9.257 9.665 -0.045 1.00 0.00 H new ATOM 33 P G A 2 -11.655 2.087 2.343 1.00 0.00 P ATOM 34 OP1 G A 2 -12.578 0.930 2.302 1.00 0.00 O ATOM 35 OP2 G A 2 -10.275 1.912 2.849 1.00 0.00 O ATOM 36 O5' G A 2 -11.574 2.720 0.866 1.00 0.00 O ATOM 37 C5' G A 2 -12.767 3.011 0.132 1.00 0.00 C ATOM 38 C4' G A 2 -12.490 3.962 -1.028 1.00 0.00 C ATOM 39 O4' G A 2 -12.003 5.227 -0.563 1.00 0.00 O ATOM 40 C3' G A 2 -11.408 3.400 -1.937 1.00 0.00 C ATOM 41 O3' G A 2 -12.046 2.753 -3.041 1.00 0.00 O ATOM 42 C2' G A 2 -10.698 4.638 -2.454 1.00 0.00 C ATOM 43 O2' G A 2 -11.318 5.135 -3.645 1.00 0.00 O ATOM 44 C1' G A 2 -10.839 5.622 -1.306 1.00 0.00 C ATOM 45 N9 G A 2 -9.636 5.638 -0.445 1.00 0.00 N ATOM 46 C8 G A 2 -9.470 5.202 0.833 1.00 0.00 C ATOM 47 N7 G A 2 -8.306 5.357 1.371 1.00 0.00 N ATOM 48 C5 G A 2 -7.593 5.972 0.337 1.00 0.00 C ATOM 49 C6 G A 2 -6.240 6.408 0.298 1.00 0.00 C ATOM 50 O6 G A 2 -5.390 6.334 1.183 1.00 0.00 O ATOM 51 N1 G A 2 -5.922 6.976 -0.929 1.00 0.00 N ATOM 52 C2 G A 2 -6.793 7.111 -1.991 1.00 0.00 C ATOM 53 N2 G A 2 -6.298 7.685 -3.089 1.00 0.00 N ATOM 54 N3 G A 2 -8.066 6.705 -1.963 1.00 0.00 N ATOM 55 C4 G A 2 -8.399 6.148 -0.777 1.00 0.00 C ATOM 0 H5' G A 2 -13.507 3.454 0.799 1.00 0.00 H new ATOM 0 H5'' G A 2 -13.196 2.085 -0.250 1.00 0.00 H new ATOM 0 H4' G A 2 -13.435 4.082 -1.558 1.00 0.00 H new ATOM 0 H3' G A 2 -10.743 2.694 -1.440 1.00 0.00 H new ATOM 0 H2' G A 2 -9.660 4.451 -2.730 1.00 0.00 H new ATOM 0 HO2' G A 2 -12.100 4.585 -3.860 1.00 0.00 H new ATOM 0 H1' G A 2 -10.945 6.637 -1.688 1.00 0.00 H new ATOM 0 H8 G A 2 -10.282 4.743 1.378 1.00 0.00 H new ATOM 0 H1 G A 2 -4.970 7.320 -1.055 1.00 0.00 H new ATOM 0 H21 G A 2 -6.891 7.814 -3.909 1.00 0.00 H new ATOM 0 H22 G A 2 -5.326 7.995 -3.109 1.00 0.00 H new ATOM 67 P C A 3 -11.464 1.370 -3.627 1.00 0.00 P ATOM 68 OP1 C A 3 -12.483 0.782 -4.526 1.00 0.00 O ATOM 69 OP2 C A 3 -10.927 0.576 -2.500 1.00 0.00 O ATOM 70 O5' C A 3 -10.226 1.867 -4.528 1.00 0.00 O ATOM 71 C5' C A 3 -10.359 3.010 -5.376 1.00 0.00 C ATOM 72 C4' C A 3 -9.019 3.422 -5.976 1.00 0.00 C ATOM 73 O4' C A 3 -8.311 4.321 -5.129 1.00 0.00 O ATOM 74 C3' C A 3 -8.098 2.230 -6.127 1.00 0.00 C ATOM 75 O3' C A 3 -8.357 1.605 -7.385 1.00 0.00 O ATOM 76 C2' C A 3 -6.725 2.881 -6.183 1.00 0.00 C ATOM 77 O2' C A 3 -6.371 3.236 -7.524 1.00 0.00 O ATOM 78 C1' C A 3 -6.897 4.122 -5.301 1.00 0.00 C ATOM 79 N1 C A 3 -6.226 3.932 -4.006 1.00 0.00 N ATOM 80 C2 C A 3 -4.872 4.217 -3.941 1.00 0.00 C ATOM 81 O2 C A 3 -4.285 4.640 -4.935 1.00 0.00 O ATOM 82 N3 C A 3 -4.226 4.018 -2.760 1.00 0.00 N ATOM 83 C4 C A 3 -4.883 3.558 -1.687 1.00 0.00 C ATOM 84 N4 C A 3 -4.220 3.369 -0.545 1.00 0.00 N ATOM 85 C5 C A 3 -6.282 3.265 -1.752 1.00 0.00 C ATOM 86 C6 C A 3 -6.909 3.466 -2.924 1.00 0.00 C ATOM 0 H5' C A 3 -10.774 3.841 -4.805 1.00 0.00 H new ATOM 0 H5'' C A 3 -11.065 2.790 -6.177 1.00 0.00 H new ATOM 0 H4' C A 3 -9.264 3.881 -6.934 1.00 0.00 H new ATOM 0 H3' C A 3 -8.207 1.482 -5.341 1.00 0.00 H new ATOM 0 H2' C A 3 -5.924 2.224 -5.845 1.00 0.00 H new ATOM 0 HO2' C A 3 -5.413 3.438 -7.567 1.00 0.00 H new ATOM 0 H1' C A 3 -6.443 4.998 -5.765 1.00 0.00 H new ATOM 0 H41 C A 3 -4.711 3.019 0.278 1.00 0.00 H new ATOM 0 H42 C A 3 -3.222 3.574 -0.495 1.00 0.00 H new ATOM 0 H5 C A 3 -6.816 2.895 -0.889 1.00 0.00 H new ATOM 0 H6 C A 3 -7.965 3.256 -3.008 1.00 0.00 H new ATOM 98 P U A 4 -7.851 0.102 -7.663 1.00 0.00 P ATOM 99 OP1 U A 4 -8.500 -0.384 -8.902 1.00 0.00 O ATOM 100 OP2 U A 4 -7.983 -0.672 -6.408 1.00 0.00 O ATOM 101 O5' U A 4 -6.283 0.310 -7.964 1.00 0.00 O ATOM 102 C5' U A 4 -5.861 1.114 -9.068 1.00 0.00 C ATOM 103 C4' U A 4 -4.492 1.741 -8.822 1.00 0.00 C ATOM 104 O4' U A 4 -4.369 2.234 -7.490 1.00 0.00 O ATOM 105 C3' U A 4 -3.384 0.716 -8.963 1.00 0.00 C ATOM 106 O3' U A 4 -2.961 0.696 -10.329 1.00 0.00 O ATOM 107 C2' U A 4 -2.261 1.303 -8.120 1.00 0.00 C ATOM 108 O2' U A 4 -1.404 2.141 -8.904 1.00 0.00 O ATOM 109 C1' U A 4 -3.005 2.111 -7.052 1.00 0.00 C ATOM 110 N1 U A 4 -2.928 1.440 -5.738 1.00 0.00 N ATOM 111 C2 U A 4 -1.821 1.706 -4.953 1.00 0.00 C ATOM 112 O2 U A 4 -0.934 2.476 -5.314 1.00 0.00 O ATOM 113 N3 U A 4 -1.770 1.055 -3.734 1.00 0.00 N ATOM 114 C4 U A 4 -2.718 0.172 -3.239 1.00 0.00 C ATOM 115 O4 U A 4 -2.574 -0.354 -2.139 1.00 0.00 O ATOM 116 C5 U A 4 -3.838 -0.045 -4.125 1.00 0.00 C ATOM 117 C6 U A 4 -3.910 0.582 -5.324 1.00 0.00 C ATOM 0 H5' U A 4 -6.594 1.901 -9.246 1.00 0.00 H new ATOM 0 H5'' U A 4 -5.824 0.503 -9.970 1.00 0.00 H new ATOM 0 H4' U A 4 -4.405 2.542 -9.557 1.00 0.00 H new ATOM 0 H3' U A 4 -3.675 -0.292 -8.667 1.00 0.00 H new ATOM 0 H2' U A 4 -1.606 0.542 -7.697 1.00 0.00 H new ATOM 0 HO2' U A 4 -1.689 2.115 -9.841 1.00 0.00 H new ATOM 0 H1' U A 4 -2.554 3.095 -6.929 1.00 0.00 H new ATOM 0 H3 U A 4 -0.959 1.242 -3.144 1.00 0.00 H new ATOM 0 H5 U A 4 -4.630 -0.717 -3.827 1.00 0.00 H new ATOM 0 H6 U A 4 -4.760 0.401 -5.966 1.00 0.00 H new ATOM 128 P C A 5 -2.129 -0.555 -10.909 1.00 0.00 P ATOM 129 OP1 C A 5 -1.629 -0.193 -12.254 1.00 0.00 O ATOM 130 OP2 C A 5 -2.942 -1.778 -10.728 1.00 0.00 O ATOM 131 O5' C A 5 -0.870 -0.633 -9.908 1.00 0.00 O ATOM 132 C5' C A 5 0.182 0.331 -9.996 1.00 0.00 C ATOM 133 C4' C A 5 1.395 -0.078 -9.166 1.00 0.00 C ATOM 134 O4' C A 5 1.211 0.211 -7.784 1.00 0.00 O ATOM 135 C3' C A 5 1.623 -1.574 -9.210 1.00 0.00 C ATOM 136 O3' C A 5 2.422 -1.885 -10.354 1.00 0.00 O ATOM 137 C2' C A 5 2.454 -1.820 -7.963 1.00 0.00 C ATOM 138 O2' C A 5 3.854 -1.694 -8.235 1.00 0.00 O ATOM 139 C1' C A 5 1.970 -0.729 -7.003 1.00 0.00 C ATOM 140 N1 C A 5 1.153 -1.314 -5.926 1.00 0.00 N ATOM 141 C2 C A 5 1.770 -1.513 -4.703 1.00 0.00 C ATOM 142 O2 C A 5 2.943 -1.183 -4.547 1.00 0.00 O ATOM 143 N3 C A 5 1.045 -2.075 -3.700 1.00 0.00 N ATOM 144 C4 C A 5 -0.233 -2.429 -3.888 1.00 0.00 C ATOM 145 N4 C A 5 -0.910 -2.979 -2.880 1.00 0.00 N ATOM 146 C5 C A 5 -0.876 -2.225 -5.150 1.00 0.00 C ATOM 147 C6 C A 5 -0.149 -1.665 -6.137 1.00 0.00 C ATOM 0 H5' C A 5 -0.183 1.300 -9.654 1.00 0.00 H new ATOM 0 H5'' C A 5 0.478 0.452 -11.038 1.00 0.00 H new ATOM 0 H4' C A 5 2.228 0.479 -9.594 1.00 0.00 H new ATOM 0 H3' C A 5 0.705 -2.159 -9.258 1.00 0.00 H new ATOM 0 H2' C A 5 2.334 -2.826 -7.561 1.00 0.00 H new ATOM 0 HO2' C A 5 3.986 -1.498 -9.186 1.00 0.00 H new ATOM 0 H1' C A 5 2.811 -0.229 -6.522 1.00 0.00 H new ATOM 0 H41 C A 5 -1.884 -3.253 -3.009 1.00 0.00 H new ATOM 0 H42 C A 5 -0.454 -3.126 -1.979 1.00 0.00 H new ATOM 0 H5 C A 5 -1.906 -2.509 -5.306 1.00 0.00 H new ATOM 0 H6 C A 5 -0.600 -1.493 -7.103 1.00 0.00 H new ATOM 159 P U A 6 2.591 -3.414 -10.831 1.00 0.00 P ATOM 160 OP1 U A 6 3.681 -3.469 -11.831 1.00 0.00 O ATOM 161 OP2 U A 6 1.251 -3.942 -11.172 1.00 0.00 O ATOM 162 O5' U A 6 3.098 -4.151 -9.489 1.00 0.00 O ATOM 163 C5' U A 6 4.451 -4.004 -9.053 1.00 0.00 C ATOM 164 C4' U A 6 4.712 -4.740 -7.739 1.00 0.00 C ATOM 165 O4' U A 6 3.629 -4.598 -6.827 1.00 0.00 O ATOM 166 C3' U A 6 4.838 -6.236 -7.950 1.00 0.00 C ATOM 167 O3' U A 6 6.202 -6.538 -8.260 1.00 0.00 O ATOM 168 C2' U A 6 4.523 -6.799 -6.570 1.00 0.00 C ATOM 169 O2' U A 6 5.711 -6.954 -5.788 1.00 0.00 O ATOM 170 C1' U A 6 3.589 -5.745 -5.962 1.00 0.00 C ATOM 171 N1 U A 6 2.216 -6.271 -5.839 1.00 0.00 N ATOM 172 C2 U A 6 1.947 -7.100 -4.767 1.00 0.00 C ATOM 173 O2 U A 6 2.804 -7.393 -3.936 1.00 0.00 O ATOM 174 N3 U A 6 0.654 -7.583 -4.681 1.00 0.00 N ATOM 175 C4 U A 6 -0.379 -7.312 -5.562 1.00 0.00 C ATOM 176 O4 U A 6 -1.494 -7.797 -5.389 1.00 0.00 O ATOM 177 C5 U A 6 -0.008 -6.438 -6.652 1.00 0.00 C ATOM 178 C6 U A 6 1.253 -5.952 -6.756 1.00 0.00 C ATOM 0 H5' U A 6 4.678 -2.945 -8.927 1.00 0.00 H new ATOM 0 H5'' U A 6 5.123 -4.385 -9.822 1.00 0.00 H new ATOM 0 H4' U A 6 5.631 -4.301 -7.351 1.00 0.00 H new ATOM 0 H3' U A 6 4.202 -6.626 -8.745 1.00 0.00 H new ATOM 0 H2' U A 6 4.075 -7.792 -6.609 1.00 0.00 H new ATOM 0 HO2' U A 6 5.571 -6.564 -4.900 1.00 0.00 H new ATOM 0 H1' U A 6 3.912 -5.475 -4.957 1.00 0.00 H new ATOM 0 H3 U A 6 0.441 -8.197 -3.894 1.00 0.00 H new ATOM 0 H5 U A 6 -0.746 -6.169 -7.394 1.00 0.00 H new ATOM 0 H6 U A 6 1.502 -5.300 -7.580 1.00 0.00 H new ATOM 189 P C A 7 6.603 -7.973 -8.872 1.00 0.00 P ATOM 190 OP1 C A 7 7.383 -7.748 -10.109 1.00 0.00 O ATOM 191 OP2 C A 7 5.387 -8.816 -8.910 1.00 0.00 O ATOM 192 O5' C A 7 7.596 -8.568 -7.752 1.00 0.00 O ATOM 193 C5' C A 7 8.836 -9.172 -8.131 1.00 0.00 C ATOM 194 C4' C A 7 9.719 -9.454 -6.918 1.00 0.00 C ATOM 195 O4' C A 7 10.778 -8.504 -6.826 1.00 0.00 O ATOM 196 C3' C A 7 8.918 -9.344 -5.618 1.00 0.00 C ATOM 197 O3' C A 7 8.984 -10.606 -4.947 1.00 0.00 O ATOM 198 C2' C A 7 9.669 -8.320 -4.766 1.00 0.00 C ATOM 199 O2' C A 7 9.811 -8.772 -3.415 1.00 0.00 O ATOM 200 C1' C A 7 11.021 -8.209 -5.455 1.00 0.00 C ATOM 201 N1 C A 7 11.589 -6.858 -5.296 1.00 0.00 N ATOM 202 C2 C A 7 12.165 -6.550 -4.074 1.00 0.00 C ATOM 203 O2 C A 7 12.183 -7.387 -3.174 1.00 0.00 O ATOM 204 N3 C A 7 12.698 -5.309 -3.908 1.00 0.00 N ATOM 205 C4 C A 7 12.667 -4.409 -4.899 1.00 0.00 C ATOM 206 N4 C A 7 13.199 -3.202 -4.701 1.00 0.00 N ATOM 207 C5 C A 7 12.075 -4.724 -6.162 1.00 0.00 C ATOM 208 C6 C A 7 11.550 -5.955 -6.317 1.00 0.00 C ATOM 0 H5' C A 7 9.365 -8.515 -8.822 1.00 0.00 H new ATOM 0 H5'' C A 7 8.640 -10.103 -8.663 1.00 0.00 H new ATOM 0 H4' C A 7 10.111 -10.463 -7.048 1.00 0.00 H new ATOM 0 H3' C A 7 7.879 -9.065 -5.791 1.00 0.00 H new ATOM 0 H2' C A 7 9.149 -7.365 -4.697 1.00 0.00 H new ATOM 0 HO2' C A 7 10.638 -8.410 -3.034 1.00 0.00 H new ATOM 0 H1' C A 7 11.748 -8.895 -5.021 1.00 0.00 H new ATOM 0 H41 C A 7 13.181 -2.508 -5.448 1.00 0.00 H new ATOM 0 H42 C A 7 13.623 -2.973 -3.802 1.00 0.00 H new ATOM 0 H5 C A 7 12.050 -4.001 -6.963 1.00 0.00 H new ATOM 0 H6 C A 7 11.095 -6.229 -7.257 1.00 0.00 H new ATOM 220 P A A 8 7.957 -11.789 -5.325 1.00 0.00 P ATOM 221 OP1 A A 8 8.741 -13.023 -5.558 1.00 0.00 O ATOM 222 OP2 A A 8 7.038 -11.289 -6.372 1.00 0.00 O ATOM 223 O5' A A 8 7.118 -11.975 -3.963 1.00 0.00 O ATOM 224 C5' A A 8 6.590 -10.839 -3.272 1.00 0.00 C ATOM 225 C4' A A 8 5.291 -11.178 -2.547 1.00 0.00 C ATOM 226 O4' A A 8 4.162 -10.593 -3.208 1.00 0.00 O ATOM 227 C3' A A 8 5.046 -12.682 -2.541 1.00 0.00 C ATOM 228 O3' A A 8 4.281 -13.006 -1.376 1.00 0.00 O ATOM 229 C2' A A 8 4.168 -12.897 -3.759 1.00 0.00 C ATOM 230 O2' A A 8 3.340 -14.057 -3.612 1.00 0.00 O ATOM 231 C1' A A 8 3.340 -11.619 -3.786 1.00 0.00 C ATOM 232 N9 A A 8 2.948 -11.272 -5.165 1.00 0.00 N ATOM 233 C8 A A 8 3.604 -10.541 -6.100 1.00 0.00 C ATOM 234 N7 A A 8 3.028 -10.382 -7.245 1.00 0.00 N ATOM 235 C5 A A 8 1.839 -11.090 -7.063 1.00 0.00 C ATOM 236 C6 A A 8 0.745 -11.334 -7.899 1.00 0.00 C ATOM 237 N6 A A 8 0.663 -10.869 -9.146 1.00 0.00 N ATOM 238 N1 A A 8 -0.261 -12.074 -7.402 1.00 0.00 N ATOM 239 C2 A A 8 -0.199 -12.549 -6.156 1.00 0.00 C ATOM 240 N3 A A 8 0.787 -12.379 -5.280 1.00 0.00 N ATOM 241 C4 A A 8 1.782 -11.636 -5.801 1.00 0.00 C ATOM 0 H5' A A 8 6.411 -10.031 -3.982 1.00 0.00 H new ATOM 0 H5'' A A 8 7.325 -10.475 -2.553 1.00 0.00 H new ATOM 0 H4' A A 8 5.397 -10.790 -1.534 1.00 0.00 H new ATOM 0 H3' A A 8 5.960 -13.276 -2.548 1.00 0.00 H new ATOM 0 H2' A A 8 4.729 -13.074 -4.677 1.00 0.00 H new ATOM 0 HO2' A A 8 3.282 -14.300 -2.664 1.00 0.00 H new ATOM 0 H1' A A 8 2.413 -11.739 -3.225 1.00 0.00 H new ATOM 0 H8 A A 8 4.572 -10.108 -5.895 1.00 0.00 H new ATOM 0 H61 A A 8 -0.158 -11.076 -9.715 1.00 0.00 H new ATOM 0 H62 A A 8 1.421 -10.306 -9.531 1.00 0.00 H new ATOM 0 H2 A A 8 -1.042 -13.136 -5.823 1.00 0.00 H new ATOM 253 P G A 9 4.941 -12.909 0.088 1.00 0.00 P ATOM 254 OP1 G A 9 6.178 -13.722 0.095 1.00 0.00 O ATOM 255 OP2 G A 9 3.883 -13.163 1.090 1.00 0.00 O ATOM 256 O5' G A 9 5.359 -11.355 0.178 1.00 0.00 O ATOM 257 C5' G A 9 4.737 -10.489 1.131 1.00 0.00 C ATOM 258 C4' G A 9 5.705 -10.117 2.257 1.00 0.00 C ATOM 259 O4' G A 9 7.046 -10.114 1.761 1.00 0.00 O ATOM 260 C3' G A 9 5.428 -8.714 2.815 1.00 0.00 C ATOM 261 O3' G A 9 4.981 -8.864 4.163 1.00 0.00 O ATOM 262 C2' G A 9 6.802 -8.035 2.881 1.00 0.00 C ATOM 263 O2' G A 9 7.352 -8.106 4.202 1.00 0.00 O ATOM 264 C1' G A 9 7.647 -8.823 1.899 1.00 0.00 C ATOM 265 N9 G A 9 7.742 -8.115 0.607 1.00 0.00 N ATOM 266 C8 G A 9 8.786 -7.423 0.096 1.00 0.00 C ATOM 267 N7 G A 9 8.625 -6.849 -1.047 1.00 0.00 N ATOM 268 C5 G A 9 7.307 -7.192 -1.356 1.00 0.00 C ATOM 269 C6 G A 9 6.528 -6.860 -2.496 1.00 0.00 C ATOM 270 O6 G A 9 6.852 -6.188 -3.472 1.00 0.00 O ATOM 271 N1 G A 9 5.252 -7.402 -2.417 1.00 0.00 N ATOM 272 C2 G A 9 4.778 -8.169 -1.372 1.00 0.00 C ATOM 273 N2 G A 9 3.521 -8.599 -1.483 1.00 0.00 N ATOM 274 N3 G A 9 5.505 -8.486 -0.293 1.00 0.00 N ATOM 275 C4 G A 9 6.755 -7.969 -0.347 1.00 0.00 C ATOM 0 H5' G A 9 3.858 -10.978 1.551 1.00 0.00 H new ATOM 0 H5'' G A 9 4.391 -9.584 0.632 1.00 0.00 H new ATOM 0 H4' G A 9 5.568 -10.856 3.046 1.00 0.00 H new ATOM 0 H3' G A 9 4.699 -8.164 2.220 1.00 0.00 H new ATOM 0 H2' G A 9 6.754 -6.973 2.638 1.00 0.00 H new ATOM 0 HO2' G A 9 6.676 -8.456 4.819 1.00 0.00 H new ATOM 0 H1' G A 9 8.669 -8.931 2.262 1.00 0.00 H new ATOM 0 H8 G A 9 9.723 -7.354 0.628 1.00 0.00 H new ATOM 0 H1 G A 9 4.615 -7.219 -3.192 1.00 0.00 H new ATOM 0 H21 G A 9 3.110 -9.171 -0.745 1.00 0.00 H new ATOM 0 H22 G A 9 2.970 -8.356 -2.306 1.00 0.00 H new ATOM 287 P U A 10 3.454 -8.533 4.554 1.00 0.00 P ATOM 288 OP1 U A 10 2.626 -9.716 4.231 1.00 0.00 O ATOM 289 OP2 U A 10 3.107 -7.212 3.985 1.00 0.00 O ATOM 290 O5' U A 10 3.523 -8.389 6.156 1.00 0.00 O ATOM 291 C5' U A 10 2.421 -7.837 6.880 1.00 0.00 C ATOM 292 C4' U A 10 2.561 -6.327 7.047 1.00 0.00 C ATOM 293 O4' U A 10 1.277 -5.695 7.113 1.00 0.00 O ATOM 294 C3' U A 10 3.268 -5.987 8.351 1.00 0.00 C ATOM 295 O3' U A 10 3.951 -4.743 8.177 1.00 0.00 O ATOM 296 C2' U A 10 2.124 -5.768 9.330 1.00 0.00 C ATOM 297 O2' U A 10 2.487 -4.844 10.362 1.00 0.00 O ATOM 298 C1' U A 10 1.028 -5.201 8.438 1.00 0.00 C ATOM 299 N1 U A 10 -0.305 -5.618 8.913 1.00 0.00 N ATOM 300 C2 U A 10 -0.927 -4.814 9.848 1.00 0.00 C ATOM 301 O2 U A 10 -0.407 -3.786 10.277 1.00 0.00 O ATOM 302 N3 U A 10 -2.174 -5.233 10.276 1.00 0.00 N ATOM 303 C4 U A 10 -2.842 -6.369 9.854 1.00 0.00 C ATOM 304 O4 U A 10 -3.951 -6.647 10.304 1.00 0.00 O ATOM 305 C5 U A 10 -2.117 -7.149 8.876 1.00 0.00 C ATOM 306 C6 U A 10 -0.895 -6.758 8.442 1.00 0.00 C ATOM 0 H5' U A 10 2.356 -8.308 7.861 1.00 0.00 H new ATOM 0 H5'' U A 10 1.492 -8.062 6.357 1.00 0.00 H new ATOM 0 H4' U A 10 3.129 -5.974 6.186 1.00 0.00 H new ATOM 0 H3' U A 10 3.979 -6.748 8.674 1.00 0.00 H new ATOM 0 H2' U A 10 1.828 -6.675 9.858 1.00 0.00 H new ATOM 0 HO2' U A 10 3.211 -4.266 10.043 1.00 0.00 H new ATOM 0 H1' U A 10 1.039 -4.111 8.454 1.00 0.00 H new ATOM 0 H3 U A 10 -2.645 -4.650 10.968 1.00 0.00 H new ATOM 0 H5 U A 10 -2.556 -8.056 8.486 1.00 0.00 H new ATOM 0 H6 U A 10 -0.376 -7.359 7.709 1.00 0.00 H new ATOM 317 P G A 11 5.551 -4.664 8.334 1.00 0.00 P ATOM 318 OP1 G A 11 6.037 -5.984 8.792 1.00 0.00 O ATOM 319 OP2 G A 11 5.882 -3.446 9.108 1.00 0.00 O ATOM 320 O5' G A 11 6.043 -4.446 6.816 1.00 0.00 O ATOM 321 C5' G A 11 5.468 -3.418 6.005 1.00 0.00 C ATOM 322 C4' G A 11 6.332 -3.125 4.784 1.00 0.00 C ATOM 323 O4' G A 11 6.206 -4.153 3.794 1.00 0.00 O ATOM 324 C3' G A 11 5.898 -1.841 4.096 1.00 0.00 C ATOM 325 O3' G A 11 6.670 -0.758 4.622 1.00 0.00 O ATOM 326 C2' G A 11 6.317 -2.081 2.659 1.00 0.00 C ATOM 327 O2' G A 11 7.707 -1.799 2.462 1.00 0.00 O ATOM 328 C1' G A 11 6.018 -3.564 2.497 1.00 0.00 C ATOM 329 N9 G A 11 4.640 -3.771 2.015 1.00 0.00 N ATOM 330 C8 G A 11 3.600 -4.399 2.616 1.00 0.00 C ATOM 331 N7 G A 11 2.475 -4.434 1.982 1.00 0.00 N ATOM 332 C5 G A 11 2.790 -3.747 0.804 1.00 0.00 C ATOM 333 C6 G A 11 1.973 -3.442 -0.319 1.00 0.00 C ATOM 334 O6 G A 11 0.791 -3.721 -0.500 1.00 0.00 O ATOM 335 N1 G A 11 2.680 -2.737 -1.286 1.00 0.00 N ATOM 336 C2 G A 11 4.008 -2.369 -1.191 1.00 0.00 C ATOM 337 N2 G A 11 4.509 -1.695 -2.226 1.00 0.00 N ATOM 338 N3 G A 11 4.781 -2.652 -0.138 1.00 0.00 N ATOM 339 C4 G A 11 4.115 -3.338 0.818 1.00 0.00 C ATOM 0 H5' G A 11 5.350 -2.510 6.596 1.00 0.00 H new ATOM 0 H5'' G A 11 4.471 -3.721 5.683 1.00 0.00 H new ATOM 0 H4' G A 11 7.354 -3.054 5.156 1.00 0.00 H new ATOM 0 H3' G A 11 4.841 -1.605 4.218 1.00 0.00 H new ATOM 0 H2' G A 11 5.806 -1.445 1.936 1.00 0.00 H new ATOM 0 HO2' G A 11 8.032 -1.230 3.191 1.00 0.00 H new ATOM 0 H1' G A 11 6.675 -4.023 1.759 1.00 0.00 H new ATOM 0 H8 G A 11 3.708 -4.854 3.590 1.00 0.00 H new ATOM 0 H1 G A 11 2.178 -2.470 -2.133 1.00 0.00 H new ATOM 0 H21 G A 11 5.484 -1.395 -2.216 1.00 0.00 H new ATOM 0 H22 G A 11 3.917 -1.479 -3.028 1.00 0.00 H new ATOM 351 P A A 12 5.944 0.579 5.146 1.00 0.00 P ATOM 352 OP1 A A 12 6.878 1.291 6.047 1.00 0.00 O ATOM 353 OP2 A A 12 4.590 0.218 5.623 1.00 0.00 O ATOM 354 O5' A A 12 5.789 1.445 3.798 1.00 0.00 O ATOM 355 C5' A A 12 6.869 2.257 3.335 1.00 0.00 C ATOM 356 C4' A A 12 6.733 2.588 1.851 1.00 0.00 C ATOM 357 O4' A A 12 6.281 1.465 1.095 1.00 0.00 O ATOM 358 C3' A A 12 5.679 3.650 1.619 1.00 0.00 C ATOM 359 O3' A A 12 6.282 4.938 1.751 1.00 0.00 O ATOM 360 C2' A A 12 5.322 3.435 0.155 1.00 0.00 C ATOM 361 O2' A A 12 6.207 4.160 -0.707 1.00 0.00 O ATOM 362 C1' A A 12 5.489 1.926 -0.016 1.00 0.00 C ATOM 363 N9 A A 12 4.168 1.269 -0.055 1.00 0.00 N ATOM 364 C8 A A 12 3.611 0.379 0.804 1.00 0.00 C ATOM 365 N7 A A 12 2.416 -0.038 0.537 1.00 0.00 N ATOM 366 C5 A A 12 2.132 0.656 -0.644 1.00 0.00 C ATOM 367 C6 A A 12 1.012 0.685 -1.484 1.00 0.00 C ATOM 368 N6 A A 12 -0.089 -0.033 -1.261 1.00 0.00 N ATOM 369 N1 A A 12 1.069 1.481 -2.565 1.00 0.00 N ATOM 370 C2 A A 12 2.159 2.208 -2.812 1.00 0.00 C ATOM 371 N3 A A 12 3.272 2.258 -2.088 1.00 0.00 N ATOM 372 C4 A A 12 3.193 1.452 -1.009 1.00 0.00 C ATOM 0 H5' A A 12 7.813 1.739 3.507 1.00 0.00 H new ATOM 0 H5'' A A 12 6.902 3.181 3.912 1.00 0.00 H new ATOM 0 H4' A A 12 7.726 2.913 1.540 1.00 0.00 H new ATOM 0 H3' A A 12 4.833 3.593 2.304 1.00 0.00 H new ATOM 0 H2' A A 12 4.324 3.788 -0.103 1.00 0.00 H new ATOM 0 HO2' A A 12 6.769 4.758 -0.171 1.00 0.00 H new ATOM 0 H1' A A 12 5.987 1.682 -0.955 1.00 0.00 H new ATOM 0 H8 A A 12 4.144 0.032 1.677 1.00 0.00 H new ATOM 0 H61 A A 12 -0.876 0.027 -1.907 1.00 0.00 H new ATOM 0 H62 A A 12 -0.144 -0.642 -0.445 1.00 0.00 H new ATOM 0 H2 A A 12 2.135 2.824 -3.699 1.00 0.00 H new ATOM 384 P G A 13 5.374 6.228 2.082 1.00 0.00 P ATOM 385 OP1 G A 13 6.263 7.309 2.565 1.00 0.00 O ATOM 386 OP2 G A 13 4.231 5.787 2.911 1.00 0.00 O ATOM 387 O5' G A 13 4.813 6.646 0.630 1.00 0.00 O ATOM 388 C5' G A 13 5.515 7.601 -0.171 1.00 0.00 C ATOM 389 C4' G A 13 4.885 7.758 -1.553 1.00 0.00 C ATOM 390 O4' G A 13 4.486 6.493 -2.097 1.00 0.00 O ATOM 391 C3' G A 13 3.616 8.596 -1.485 1.00 0.00 C ATOM 392 O3' G A 13 3.952 9.955 -1.767 1.00 0.00 O ATOM 393 C2' G A 13 2.794 8.052 -2.636 1.00 0.00 C ATOM 394 O2' G A 13 3.178 8.642 -3.883 1.00 0.00 O ATOM 395 C1' G A 13 3.136 6.573 -2.586 1.00 0.00 C ATOM 396 N9 G A 13 2.206 5.858 -1.694 1.00 0.00 N ATOM 397 C8 G A 13 2.378 5.458 -0.410 1.00 0.00 C ATOM 398 N7 G A 13 1.384 4.879 0.175 1.00 0.00 N ATOM 399 C5 G A 13 0.417 4.886 -0.834 1.00 0.00 C ATOM 400 C6 G A 13 -0.915 4.390 -0.822 1.00 0.00 C ATOM 401 O6 G A 13 -1.515 3.839 0.099 1.00 0.00 O ATOM 402 N1 G A 13 -1.547 4.596 -2.043 1.00 0.00 N ATOM 403 C2 G A 13 -0.974 5.204 -3.142 1.00 0.00 C ATOM 404 N2 G A 13 -1.742 5.309 -4.226 1.00 0.00 N ATOM 405 N3 G A 13 0.278 5.672 -3.161 1.00 0.00 N ATOM 406 C4 G A 13 0.913 5.482 -1.983 1.00 0.00 C ATOM 0 H5' G A 13 6.554 7.290 -0.279 1.00 0.00 H new ATOM 0 H5'' G A 13 5.522 8.566 0.337 1.00 0.00 H new ATOM 0 H4' G A 13 5.646 8.231 -2.174 1.00 0.00 H new ATOM 0 H3' G A 13 3.109 8.555 -0.521 1.00 0.00 H new ATOM 0 H2' G A 13 1.727 8.261 -2.555 1.00 0.00 H new ATOM 0 HO2' G A 13 3.812 9.371 -3.718 1.00 0.00 H new ATOM 0 H1' G A 13 3.047 6.107 -3.567 1.00 0.00 H new ATOM 0 H8 G A 13 3.314 5.618 0.105 1.00 0.00 H new ATOM 0 H1 G A 13 -2.510 4.272 -2.134 1.00 0.00 H new ATOM 0 H21 G A 13 -1.375 5.749 -5.070 1.00 0.00 H new ATOM 0 H22 G A 13 -2.696 4.950 -4.211 1.00 0.00 H new ATOM 418 P C A 14 3.308 11.148 -0.900 1.00 0.00 P ATOM 419 OP1 C A 14 4.137 12.359 -1.091 1.00 0.00 O ATOM 420 OP2 C A 14 3.047 10.640 0.466 1.00 0.00 O ATOM 421 O5' C A 14 1.892 11.386 -1.628 1.00 0.00 O ATOM 422 C5' C A 14 1.842 11.704 -3.021 1.00 0.00 C ATOM 423 C4' C A 14 0.480 11.376 -3.628 1.00 0.00 C ATOM 424 O4' C A 14 0.161 9.993 -3.487 1.00 0.00 O ATOM 425 C3' C A 14 -0.639 12.109 -2.913 1.00 0.00 C ATOM 426 O3' C A 14 -0.817 13.387 -3.532 1.00 0.00 O ATOM 427 C2' C A 14 -1.852 11.248 -3.226 1.00 0.00 C ATOM 428 O2' C A 14 -2.461 11.634 -4.463 1.00 0.00 O ATOM 429 C1' C A 14 -1.258 9.839 -3.310 1.00 0.00 C ATOM 430 N1 C A 14 -1.565 9.074 -2.087 1.00 0.00 N ATOM 431 C2 C A 14 -2.821 8.495 -1.999 1.00 0.00 C ATOM 432 O2 C A 14 -3.616 8.603 -2.930 1.00 0.00 O ATOM 433 N3 C A 14 -3.139 7.812 -0.864 1.00 0.00 N ATOM 434 C4 C A 14 -2.260 7.700 0.140 1.00 0.00 C ATOM 435 N4 C A 14 -2.604 7.028 1.239 1.00 0.00 N ATOM 436 C5 C A 14 -0.962 8.293 0.051 1.00 0.00 C ATOM 437 C6 C A 14 -0.657 8.968 -1.075 1.00 0.00 C ATOM 0 H5' C A 14 2.618 11.150 -3.549 1.00 0.00 H new ATOM 0 H5'' C A 14 2.056 12.764 -3.160 1.00 0.00 H new ATOM 0 H4' C A 14 0.555 11.670 -4.675 1.00 0.00 H new ATOM 0 H3' C A 14 -0.462 12.259 -1.848 1.00 0.00 H new ATOM 0 H2' C A 14 -2.645 11.336 -2.483 1.00 0.00 H new ATOM 0 HO2' C A 14 -1.769 11.936 -5.088 1.00 0.00 H new ATOM 0 H1' C A 14 -1.686 9.282 -4.144 1.00 0.00 H new ATOM 0 H41 C A 14 -1.942 6.937 2.009 1.00 0.00 H new ATOM 0 H42 C A 14 -3.529 6.605 1.309 1.00 0.00 H new ATOM 0 H5 C A 14 -0.250 8.203 0.858 1.00 0.00 H new ATOM 0 H6 C A 14 0.314 9.429 -1.177 1.00 0.00 H new ATOM 449 P C A 15 -1.671 14.537 -2.795 1.00 0.00 P ATOM 450 OP1 C A 15 -1.440 15.813 -3.508 1.00 0.00 O ATOM 451 OP2 C A 15 -1.413 14.446 -1.341 1.00 0.00 O ATOM 452 O5' C A 15 -3.191 14.076 -3.068 1.00 0.00 O ATOM 453 C5' C A 15 -3.637 13.817 -4.401 1.00 0.00 C ATOM 454 C4' C A 15 -5.129 13.499 -4.445 1.00 0.00 C ATOM 455 O4' C A 15 -5.386 12.172 -3.977 1.00 0.00 O ATOM 456 C3' C A 15 -5.916 14.429 -3.534 1.00 0.00 C ATOM 457 O3' C A 15 -6.332 15.613 -4.226 1.00 0.00 O ATOM 458 C2' C A 15 -7.102 13.570 -3.138 1.00 0.00 C ATOM 459 O2' C A 15 -8.144 13.628 -4.119 1.00 0.00 O ATOM 460 C1' C A 15 -6.487 12.179 -3.061 1.00 0.00 C ATOM 461 N1 C A 15 -6.034 11.874 -1.691 1.00 0.00 N ATOM 462 C2 C A 15 -6.871 11.102 -0.903 1.00 0.00 C ATOM 463 O2 C A 15 -7.944 10.703 -1.351 1.00 0.00 O ATOM 464 N3 C A 15 -6.471 10.803 0.362 1.00 0.00 N ATOM 465 C4 C A 15 -5.299 11.245 0.835 1.00 0.00 C ATOM 466 N4 C A 15 -4.938 10.933 2.079 1.00 0.00 N ATOM 467 C5 C A 15 -4.431 12.044 0.025 1.00 0.00 C ATOM 468 C6 C A 15 -4.835 12.335 -1.226 1.00 0.00 C ATOM 0 H5' C A 15 -3.074 12.981 -4.817 1.00 0.00 H new ATOM 0 H5'' C A 15 -3.431 14.684 -5.029 1.00 0.00 H new ATOM 0 H4' C A 15 -5.435 13.617 -5.485 1.00 0.00 H new ATOM 0 H3' C A 15 -5.341 14.793 -2.683 1.00 0.00 H new ATOM 0 H2' C A 15 -7.577 13.888 -2.210 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.015 14.416 -4.687 1.00 0.00 H new ATOM 0 HO3' C A 15 -6.837 16.189 -3.614 1.00 0.00 H new ATOM 0 H1' C A 15 -7.219 11.415 -3.321 1.00 0.00 H new ATOM 0 H41 C A 15 -4.047 11.264 2.450 1.00 0.00 H new ATOM 0 H42 C A 15 -5.552 10.363 2.660 1.00 0.00 H new ATOM 0 H5 C A 15 -3.485 12.401 0.404 1.00 0.00 H new ATOM 0 H6 C A 15 -4.207 12.937 -1.866 1.00 0.00 H new TER 481 C A 15