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= 0.262 USER MOD Single : A 1 G O5' : rot 41:sc= -0.013 USER MOD Single : A 2 G O2' : rot -1:sc= -3.49! USER MOD Single : A 3 C O2' : rot 179:sc= -5.14! USER MOD Single : A 4 U O2' : rot 170:sc= -7.28! USER MOD Single : A 5 C O2' : rot 180:sc= -4.49! USER MOD Single : A 6 U O2' : rot -27:sc= 0.387 USER MOD Single : A 7 C O2' : rot -118:sc= -2.26! USER MOD Single : A 8 A O2' : rot 17:sc= 0.191 USER MOD Single : A 9 G O2' : rot -17:sc= 0.56 USER MOD Single : A 10 U O2' : rot 180:sc= 0 USER MOD Single : A 11 G O2' : rot -14:sc= 0.327 USER MOD Single : A 12 A O2' : rot -21:sc= 0.409 USER MOD Single : A 13 G O2' : rot -14:sc= 0.283 USER MOD Single : A 14 C O2' : rot 10:sc= -6.56! USER MOD Single : A 15 C O2' : rot -24:sc= 0.185 USER MOD Single : A 15 C O3' : rot 180:sc= 0.155 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -7.797 2.381 5.371 1.00 0.00 O ATOM 2 C5' G A 1 -9.049 2.070 5.990 1.00 0.00 C ATOM 3 C4' G A 1 -10.144 3.047 5.568 1.00 0.00 C ATOM 4 O4' G A 1 -9.965 4.331 6.182 1.00 0.00 O ATOM 5 C3' G A 1 -10.103 3.302 4.070 1.00 0.00 C ATOM 6 O3' G A 1 -11.007 2.396 3.434 1.00 0.00 O ATOM 7 C2' G A 1 -10.673 4.709 3.962 1.00 0.00 C ATOM 8 O2' G A 1 -12.106 4.697 3.986 1.00 0.00 O ATOM 9 C1' G A 1 -10.105 5.370 5.198 1.00 0.00 C ATOM 10 N9 G A 1 -8.809 6.011 4.902 1.00 0.00 N ATOM 11 C8 G A 1 -7.611 5.872 5.520 1.00 0.00 C ATOM 12 N7 G A 1 -6.618 6.559 5.065 1.00 0.00 N ATOM 13 C5 G A 1 -7.210 7.252 4.008 1.00 0.00 C ATOM 14 C6 G A 1 -6.639 8.183 3.099 1.00 0.00 C ATOM 15 O6 G A 1 -5.479 8.588 3.049 1.00 0.00 O ATOM 16 N1 G A 1 -7.579 8.647 2.188 1.00 0.00 N ATOM 17 C2 G A 1 -8.904 8.265 2.149 1.00 0.00 C ATOM 18 N2 G A 1 -9.649 8.823 1.195 1.00 0.00 N ATOM 19 N3 G A 1 -9.451 7.389 3.000 1.00 0.00 N ATOM 20 C4 G A 1 -8.553 6.923 3.899 1.00 0.00 C ATOM 0 H5' G A 1 -8.936 2.096 7.074 1.00 0.00 H new ATOM 0 H5'' G A 1 -9.344 1.055 5.724 1.00 0.00 H new ATOM 0 H4' G A 1 -11.085 2.589 5.872 1.00 0.00 H new ATOM 0 H3' G A 1 -9.116 3.185 3.622 1.00 0.00 H new ATOM 0 H2' G A 1 -10.417 5.218 3.033 1.00 0.00 H new ATOM 0 HO2' G A 1 -12.427 3.778 3.878 1.00 0.00 H new ATOM 0 HO5' G A 1 -7.665 3.352 5.370 1.00 0.00 H new ATOM 0 H1' G A 1 -10.760 6.162 5.562 1.00 0.00 H new ATOM 0 H8 G A 1 -7.491 5.209 6.364 1.00 0.00 H new ATOM 0 H1 G A 1 -7.265 9.324 1.493 1.00 0.00 H new ATOM 0 H21 G A 1 -10.637 8.582 1.113 1.00 0.00 H new ATOM 0 H22 G A 1 -9.231 9.491 0.547 1.00 0.00 H new ATOM 33 P G A 2 -10.489 1.406 2.275 1.00 0.00 P ATOM 34 OP1 G A 2 -11.359 0.208 2.267 1.00 0.00 O ATOM 35 OP2 G A 2 -9.024 1.255 2.415 1.00 0.00 O ATOM 36 O5' G A 2 -10.785 2.251 0.936 1.00 0.00 O ATOM 37 C5' G A 2 -12.128 2.450 0.487 1.00 0.00 C ATOM 38 C4' G A 2 -12.198 3.488 -0.627 1.00 0.00 C ATOM 39 O4' G A 2 -11.752 4.770 -0.168 1.00 0.00 O ATOM 40 C3' G A 2 -11.291 3.095 -1.788 1.00 0.00 C ATOM 41 O3' G A 2 -12.115 2.590 -2.841 1.00 0.00 O ATOM 42 C2' G A 2 -10.683 4.411 -2.248 1.00 0.00 C ATOM 43 O2' G A 2 -11.480 5.028 -3.266 1.00 0.00 O ATOM 44 C1' G A 2 -10.668 5.242 -0.977 1.00 0.00 C ATOM 45 N9 G A 2 -9.381 5.128 -0.260 1.00 0.00 N ATOM 46 C8 G A 2 -9.089 4.512 0.916 1.00 0.00 C ATOM 47 N7 G A 2 -7.874 4.595 1.348 1.00 0.00 N ATOM 48 C5 G A 2 -7.267 5.358 0.346 1.00 0.00 C ATOM 49 C6 G A 2 -5.921 5.803 0.229 1.00 0.00 C ATOM 50 O6 G A 2 -4.984 5.608 1.002 1.00 0.00 O ATOM 51 N1 G A 2 -5.728 6.544 -0.930 1.00 0.00 N ATOM 52 C2 G A 2 -6.704 6.824 -1.866 1.00 0.00 C ATOM 53 N2 G A 2 -6.326 7.552 -2.917 1.00 0.00 N ATOM 54 N3 G A 2 -7.971 6.409 -1.763 1.00 0.00 N ATOM 55 C4 G A 2 -8.183 5.686 -0.641 1.00 0.00 C ATOM 0 H5' G A 2 -12.748 2.771 1.324 1.00 0.00 H new ATOM 0 H5'' G A 2 -12.537 1.505 0.131 1.00 0.00 H new ATOM 0 H4' G A 2 -13.240 3.536 -0.944 1.00 0.00 H new ATOM 0 H3' G A 2 -10.543 2.349 -1.519 1.00 0.00 H new ATOM 0 H2' G A 2 -9.696 4.294 -2.695 1.00 0.00 H new ATOM 0 HO2' G A 2 -12.254 4.461 -3.464 1.00 0.00 H new ATOM 0 H1' G A 2 -10.784 6.300 -1.213 1.00 0.00 H new ATOM 0 H8 G A 2 -9.844 3.973 1.469 1.00 0.00 H new ATOM 0 H1 G A 2 -4.792 6.910 -1.103 1.00 0.00 H new ATOM 0 H21 G A 2 -7.003 7.791 -3.642 1.00 0.00 H new ATOM 0 H22 G A 2 -5.360 7.870 -2.996 1.00 0.00 H new ATOM 67 P C A 3 -11.577 1.418 -3.802 1.00 0.00 P ATOM 68 OP1 C A 3 -12.587 1.183 -4.857 1.00 0.00 O ATOM 69 OP2 C A 3 -11.118 0.296 -2.953 1.00 0.00 O ATOM 70 O5' C A 3 -10.286 2.096 -4.481 1.00 0.00 O ATOM 71 C5' C A 3 -10.431 3.255 -5.303 1.00 0.00 C ATOM 72 C4' C A 3 -9.101 3.677 -5.914 1.00 0.00 C ATOM 73 O4' C A 3 -8.330 4.469 -5.018 1.00 0.00 O ATOM 74 C3' C A 3 -8.230 2.477 -6.208 1.00 0.00 C ATOM 75 O3' C A 3 -8.565 1.973 -7.502 1.00 0.00 O ATOM 76 C2' C A 3 -6.840 3.084 -6.267 1.00 0.00 C ATOM 77 O2' C A 3 -6.525 3.543 -7.587 1.00 0.00 O ATOM 78 C1' C A 3 -6.933 4.249 -5.277 1.00 0.00 C ATOM 79 N1 C A 3 -6.208 3.930 -4.036 1.00 0.00 N ATOM 80 C2 C A 3 -4.854 4.209 -4.002 1.00 0.00 C ATOM 81 O2 C A 3 -4.310 4.722 -4.977 1.00 0.00 O ATOM 82 N3 C A 3 -4.160 3.904 -2.873 1.00 0.00 N ATOM 83 C4 C A 3 -4.772 3.345 -1.820 1.00 0.00 C ATOM 84 N4 C A 3 -4.063 3.055 -0.729 1.00 0.00 N ATOM 85 C5 C A 3 -6.174 3.057 -1.854 1.00 0.00 C ATOM 86 C6 C A 3 -6.849 3.364 -2.975 1.00 0.00 C ATOM 0 H5' C A 3 -10.836 4.075 -4.710 1.00 0.00 H new ATOM 0 H5'' C A 3 -11.149 3.051 -6.097 1.00 0.00 H new ATOM 0 H4' C A 3 -9.365 4.231 -6.815 1.00 0.00 H new ATOM 0 H3' C A 3 -8.331 1.667 -5.486 1.00 0.00 H new ATOM 0 H2' C A 3 -6.051 2.374 -6.021 1.00 0.00 H new ATOM 0 HO2' C A 3 -5.631 3.944 -7.589 1.00 0.00 H new ATOM 0 H1' C A 3 -6.476 5.149 -5.688 1.00 0.00 H new ATOM 0 H41 C A 3 -4.520 2.629 0.078 1.00 0.00 H new ATOM 0 H42 C A 3 -3.064 3.259 -0.701 1.00 0.00 H new ATOM 0 H5 C A 3 -6.672 2.608 -1.007 1.00 0.00 H new ATOM 0 H6 C A 3 -7.908 3.160 -3.035 1.00 0.00 H new ATOM 98 P U A 4 -8.188 0.461 -7.902 1.00 0.00 P ATOM 99 OP1 U A 4 -8.738 0.188 -9.248 1.00 0.00 O ATOM 100 OP2 U A 4 -8.538 -0.422 -6.766 1.00 0.00 O ATOM 101 O5' U A 4 -6.586 0.525 -8.017 1.00 0.00 O ATOM 102 C5' U A 4 -5.969 1.399 -8.964 1.00 0.00 C ATOM 103 C4' U A 4 -4.554 1.782 -8.543 1.00 0.00 C ATOM 104 O4' U A 4 -4.491 2.126 -7.164 1.00 0.00 O ATOM 105 C3' U A 4 -3.600 0.613 -8.687 1.00 0.00 C ATOM 106 O3' U A 4 -3.058 0.624 -10.010 1.00 0.00 O ATOM 107 C2' U A 4 -2.485 0.955 -7.710 1.00 0.00 C ATOM 108 O2' U A 4 -1.420 1.653 -8.362 1.00 0.00 O ATOM 109 C1' U A 4 -3.174 1.846 -6.671 1.00 0.00 C ATOM 110 N1 U A 4 -3.221 1.169 -5.364 1.00 0.00 N ATOM 111 C2 U A 4 -2.138 1.340 -4.526 1.00 0.00 C ATOM 112 O2 U A 4 -1.179 2.045 -4.833 1.00 0.00 O ATOM 113 N3 U A 4 -2.193 0.670 -3.320 1.00 0.00 N ATOM 114 C4 U A 4 -3.225 -0.144 -2.884 1.00 0.00 C ATOM 115 O4 U A 4 -3.166 -0.698 -1.788 1.00 0.00 O ATOM 116 C5 U A 4 -4.317 -0.263 -3.823 1.00 0.00 C ATOM 117 C6 U A 4 -4.284 0.385 -5.012 1.00 0.00 C ATOM 0 H5' U A 4 -6.572 2.300 -9.074 1.00 0.00 H new ATOM 0 H5'' U A 4 -5.939 0.915 -9.940 1.00 0.00 H new ATOM 0 H4' U A 4 -4.281 2.620 -9.185 1.00 0.00 H new ATOM 0 H3' U A 4 -4.066 -0.356 -8.505 1.00 0.00 H new ATOM 0 H2' U A 4 -2.026 0.070 -7.270 1.00 0.00 H new ATOM 0 HO2' U A 4 -0.796 1.999 -7.690 1.00 0.00 H new ATOM 0 H1' U A 4 -2.624 2.775 -6.523 1.00 0.00 H new ATOM 0 H3 U A 4 -1.399 0.785 -2.691 1.00 0.00 H new ATOM 0 H5 U A 4 -5.170 -0.876 -3.574 1.00 0.00 H new ATOM 0 H6 U A 4 -5.114 0.280 -5.695 1.00 0.00 H new ATOM 128 P C A 5 -2.037 -0.531 -10.483 1.00 0.00 P ATOM 129 OP1 C A 5 -1.535 -0.180 -11.830 1.00 0.00 O ATOM 130 OP2 C A 5 -2.682 -1.843 -10.255 1.00 0.00 O ATOM 131 O5' C A 5 -0.820 -0.380 -9.437 1.00 0.00 O ATOM 132 C5' C A 5 0.270 0.502 -9.722 1.00 0.00 C ATOM 133 C4' C A 5 1.511 0.160 -8.897 1.00 0.00 C ATOM 134 O4' C A 5 1.292 0.344 -7.502 1.00 0.00 O ATOM 135 C3' C A 5 1.883 -1.304 -9.026 1.00 0.00 C ATOM 136 O3' C A 5 2.701 -1.475 -10.185 1.00 0.00 O ATOM 137 C2' C A 5 2.741 -1.529 -7.792 1.00 0.00 C ATOM 138 O2' C A 5 4.113 -1.207 -8.046 1.00 0.00 O ATOM 139 C1' C A 5 2.124 -0.573 -6.767 1.00 0.00 C ATOM 140 N1 C A 5 1.341 -1.317 -5.761 1.00 0.00 N ATOM 141 C2 C A 5 1.945 -1.556 -4.537 1.00 0.00 C ATOM 142 O2 C A 5 3.086 -1.150 -4.324 1.00 0.00 O ATOM 143 N3 C A 5 1.246 -2.246 -3.594 1.00 0.00 N ATOM 144 C4 C A 5 0.004 -2.683 -3.842 1.00 0.00 C ATOM 145 N4 C A 5 -0.653 -3.353 -2.895 1.00 0.00 N ATOM 146 C5 C A 5 -0.624 -2.439 -5.105 1.00 0.00 C ATOM 147 C6 C A 5 0.076 -1.755 -6.032 1.00 0.00 C ATOM 0 H5' C A 5 -0.031 1.529 -9.516 1.00 0.00 H new ATOM 0 H5'' C A 5 0.513 0.448 -10.783 1.00 0.00 H new ATOM 0 H4' C A 5 2.288 0.821 -9.280 1.00 0.00 H new ATOM 0 H3' C A 5 1.027 -1.974 -9.108 1.00 0.00 H new ATOM 0 H2' C A 5 2.751 -2.567 -7.459 1.00 0.00 H new ATOM 0 HO2' C A 5 4.641 -1.361 -7.235 1.00 0.00 H new ATOM 0 H1' C A 5 2.898 -0.034 -6.220 1.00 0.00 H new ATOM 0 H41 C A 5 -1.599 -3.691 -3.072 1.00 0.00 H new ATOM 0 H42 C A 5 -0.210 -3.528 -1.993 1.00 0.00 H new ATOM 0 H5 C A 5 -1.625 -2.791 -5.308 1.00 0.00 H new ATOM 0 H6 C A 5 -0.367 -1.552 -6.996 1.00 0.00 H new ATOM 159 P U A 6 2.919 -2.944 -10.812 1.00 0.00 P ATOM 160 OP1 U A 6 3.935 -2.845 -11.884 1.00 0.00 O ATOM 161 OP2 U A 6 1.590 -3.525 -11.107 1.00 0.00 O ATOM 162 O5' U A 6 3.563 -3.758 -9.581 1.00 0.00 O ATOM 163 C5' U A 6 4.902 -3.490 -9.159 1.00 0.00 C ATOM 164 C4' U A 6 5.220 -4.147 -7.818 1.00 0.00 C ATOM 165 O4' U A 6 4.140 -4.032 -6.898 1.00 0.00 O ATOM 166 C3' U A 6 5.425 -5.640 -7.967 1.00 0.00 C ATOM 167 O3' U A 6 6.791 -5.884 -8.311 1.00 0.00 O ATOM 168 C2' U A 6 5.184 -6.153 -6.556 1.00 0.00 C ATOM 169 O2' U A 6 6.398 -6.175 -5.795 1.00 0.00 O ATOM 170 C1' U A 6 4.182 -5.143 -5.984 1.00 0.00 C ATOM 171 N1 U A 6 2.853 -5.762 -5.827 1.00 0.00 N ATOM 172 C2 U A 6 2.616 -6.461 -4.659 1.00 0.00 C ATOM 173 O2 U A 6 3.466 -6.567 -3.777 1.00 0.00 O ATOM 174 N3 U A 6 1.365 -7.038 -4.538 1.00 0.00 N ATOM 175 C4 U A 6 0.345 -6.979 -5.472 1.00 0.00 C ATOM 176 O4 U A 6 -0.732 -7.532 -5.258 1.00 0.00 O ATOM 177 C5 U A 6 0.679 -6.230 -6.661 1.00 0.00 C ATOM 178 C6 U A 6 1.898 -5.654 -6.803 1.00 0.00 C ATOM 0 H5' U A 6 5.048 -2.413 -9.079 1.00 0.00 H new ATOM 0 H5'' U A 6 5.600 -3.851 -9.915 1.00 0.00 H new ATOM 0 H4' U A 6 6.115 -3.636 -7.463 1.00 0.00 H new ATOM 0 H3' U A 6 4.788 -6.100 -8.723 1.00 0.00 H new ATOM 0 H2' U A 6 4.816 -7.179 -6.531 1.00 0.00 H new ATOM 0 HO2' U A 6 7.161 -6.282 -6.400 1.00 0.00 H new ATOM 0 H1' U A 6 4.487 -4.806 -4.993 1.00 0.00 H new ATOM 0 H3 U A 6 1.176 -7.556 -3.680 1.00 0.00 H new ATOM 0 H5 U A 6 -0.053 -6.127 -7.448 1.00 0.00 H new ATOM 0 H6 U A 6 2.120 -5.099 -7.703 1.00 0.00 H new ATOM 189 P C A 7 7.206 -7.238 -9.077 1.00 0.00 P ATOM 190 OP1 C A 7 8.305 -6.923 -10.017 1.00 0.00 O ATOM 191 OP2 C A 7 5.971 -7.882 -9.576 1.00 0.00 O ATOM 192 O5' C A 7 7.804 -8.146 -7.889 1.00 0.00 O ATOM 193 C5' C A 7 9.202 -8.441 -7.838 1.00 0.00 C ATOM 194 C4' C A 7 9.631 -8.914 -6.453 1.00 0.00 C ATOM 195 O4' C A 7 10.663 -8.080 -5.927 1.00 0.00 O ATOM 196 C3' C A 7 8.465 -8.846 -5.459 1.00 0.00 C ATOM 197 O3' C A 7 8.270 -10.152 -4.909 1.00 0.00 O ATOM 198 C2' C A 7 8.951 -7.929 -4.335 1.00 0.00 C ATOM 199 O2' C A 7 8.600 -8.452 -3.048 1.00 0.00 O ATOM 200 C1' C A 7 10.457 -7.908 -4.530 1.00 0.00 C ATOM 201 N1 C A 7 11.039 -6.637 -4.056 1.00 0.00 N ATOM 202 C2 C A 7 11.263 -6.510 -2.695 1.00 0.00 C ATOM 203 O2 C A 7 10.978 -7.433 -1.936 1.00 0.00 O ATOM 204 N3 C A 7 11.800 -5.347 -2.236 1.00 0.00 N ATOM 205 C4 C A 7 12.105 -4.351 -3.076 1.00 0.00 C ATOM 206 N4 C A 7 12.630 -3.225 -2.592 1.00 0.00 N ATOM 207 C5 C A 7 11.875 -4.477 -4.482 1.00 0.00 C ATOM 208 C6 C A 7 11.341 -5.631 -4.928 1.00 0.00 C ATOM 0 H5' C A 7 9.771 -7.552 -8.111 1.00 0.00 H new ATOM 0 H5'' C A 7 9.438 -9.210 -8.574 1.00 0.00 H new ATOM 0 H4' C A 7 9.979 -9.940 -6.572 1.00 0.00 H new ATOM 0 H3' C A 7 7.542 -8.495 -5.921 1.00 0.00 H new ATOM 0 H2' C A 7 8.503 -6.936 -4.372 1.00 0.00 H new ATOM 0 HO2' C A 7 7.997 -7.827 -2.594 1.00 0.00 H new ATOM 0 H1' C A 7 10.946 -8.693 -3.954 1.00 0.00 H new ATOM 0 H41 C A 7 12.866 -2.460 -3.224 1.00 0.00 H new ATOM 0 H42 C A 7 12.795 -3.129 -1.590 1.00 0.00 H new ATOM 0 H5 C A 7 12.121 -3.675 -5.163 1.00 0.00 H new ATOM 0 H6 C A 7 11.151 -5.761 -5.983 1.00 0.00 H new ATOM 220 P A A 8 7.120 -11.120 -5.489 1.00 0.00 P ATOM 221 OP1 A A 8 7.769 -12.333 -6.033 1.00 0.00 O ATOM 222 OP2 A A 8 6.226 -10.312 -6.350 1.00 0.00 O ATOM 223 O5' A A 8 6.302 -11.536 -4.164 1.00 0.00 O ATOM 224 C5' A A 8 6.063 -10.579 -3.128 1.00 0.00 C ATOM 225 C4' A A 8 4.739 -10.837 -2.410 1.00 0.00 C ATOM 226 O4' A A 8 3.676 -10.071 -2.989 1.00 0.00 O ATOM 227 C3' A A 8 4.322 -12.294 -2.534 1.00 0.00 C ATOM 228 O3' A A 8 3.521 -12.621 -1.397 1.00 0.00 O ATOM 229 C2' A A 8 3.426 -12.298 -3.758 1.00 0.00 C ATOM 230 O2' A A 8 2.473 -13.366 -3.708 1.00 0.00 O ATOM 231 C1' A A 8 2.748 -10.937 -3.661 1.00 0.00 C ATOM 232 N9 A A 8 2.411 -10.410 -4.997 1.00 0.00 N ATOM 233 C8 A A 8 3.143 -9.627 -5.827 1.00 0.00 C ATOM 234 N7 A A 8 2.607 -9.281 -6.948 1.00 0.00 N ATOM 235 C5 A A 8 1.359 -9.907 -6.869 1.00 0.00 C ATOM 236 C6 A A 8 0.267 -9.954 -7.742 1.00 0.00 C ATOM 237 N6 A A 8 0.251 -9.332 -8.921 1.00 0.00 N ATOM 238 N1 A A 8 -0.806 -10.664 -7.353 1.00 0.00 N ATOM 239 C2 A A 8 -0.810 -11.295 -6.175 1.00 0.00 C ATOM 240 N3 A A 8 0.168 -11.316 -5.273 1.00 0.00 N ATOM 241 C4 A A 8 1.232 -10.598 -5.685 1.00 0.00 C ATOM 0 H5' A A 8 6.055 -9.576 -3.555 1.00 0.00 H new ATOM 0 H5'' A A 8 6.880 -10.613 -2.407 1.00 0.00 H new ATOM 0 H4' A A 8 4.902 -10.560 -1.369 1.00 0.00 H new ATOM 0 H3' A A 8 5.160 -12.988 -2.601 1.00 0.00 H new ATOM 0 H2' A A 8 3.963 -12.453 -4.694 1.00 0.00 H new ATOM 0 HO2' A A 8 2.408 -13.704 -2.790 1.00 0.00 H new ATOM 0 H1' A A 8 1.808 -11.010 -3.114 1.00 0.00 H new ATOM 0 H8 A A 8 4.138 -9.305 -5.559 1.00 0.00 H new ATOM 0 H61 A A 8 -0.571 -9.398 -9.521 1.00 0.00 H new ATOM 0 H62 A A 8 1.061 -8.790 -9.223 1.00 0.00 H new ATOM 0 H2 A A 8 -1.704 -11.848 -5.928 1.00 0.00 H new ATOM 253 P G A 9 4.187 -12.717 0.064 1.00 0.00 P ATOM 254 OP1 G A 9 5.284 -13.710 0.010 1.00 0.00 O ATOM 255 OP2 G A 9 3.102 -12.865 1.060 1.00 0.00 O ATOM 256 O5' G A 9 4.840 -11.255 0.241 1.00 0.00 O ATOM 257 C5' G A 9 4.257 -10.303 1.135 1.00 0.00 C ATOM 258 C4' G A 9 5.141 -10.084 2.365 1.00 0.00 C ATOM 259 O4' G A 9 6.517 -10.250 2.011 1.00 0.00 O ATOM 260 C3' G A 9 4.989 -8.668 2.935 1.00 0.00 C ATOM 261 O3' G A 9 4.383 -8.783 4.226 1.00 0.00 O ATOM 262 C2' G A 9 6.423 -8.177 3.167 1.00 0.00 C ATOM 263 O2' G A 9 6.808 -8.344 4.537 1.00 0.00 O ATOM 264 C1' G A 9 7.264 -9.054 2.257 1.00 0.00 C ATOM 265 N9 G A 9 7.597 -8.341 1.008 1.00 0.00 N ATOM 266 C8 G A 9 8.774 -7.786 0.634 1.00 0.00 C ATOM 267 N7 G A 9 8.818 -7.176 -0.502 1.00 0.00 N ATOM 268 C5 G A 9 7.508 -7.336 -0.963 1.00 0.00 C ATOM 269 C6 G A 9 6.909 -6.886 -2.170 1.00 0.00 C ATOM 270 O6 G A 9 7.424 -6.247 -3.085 1.00 0.00 O ATOM 271 N1 G A 9 5.573 -7.256 -2.245 1.00 0.00 N ATOM 272 C2 G A 9 4.892 -7.971 -1.281 1.00 0.00 C ATOM 273 N2 G A 9 3.611 -8.230 -1.537 1.00 0.00 N ATOM 274 N3 G A 9 5.448 -8.399 -0.140 1.00 0.00 N ATOM 275 C4 G A 9 6.751 -8.051 -0.043 1.00 0.00 C ATOM 0 H5' G A 9 3.273 -10.650 1.449 1.00 0.00 H new ATOM 0 H5'' G A 9 4.110 -9.356 0.616 1.00 0.00 H new ATOM 0 H4' G A 9 4.828 -10.814 3.112 1.00 0.00 H new ATOM 0 H3' G A 9 4.406 -8.016 2.284 1.00 0.00 H new ATOM 0 H2' G A 9 6.541 -7.115 2.952 1.00 0.00 H new ATOM 0 HO2' G A 9 6.008 -8.472 5.088 1.00 0.00 H new ATOM 0 H1' G A 9 8.215 -9.306 2.725 1.00 0.00 H new ATOM 0 H8 G A 9 9.647 -7.852 1.266 1.00 0.00 H new ATOM 0 H1 G A 9 5.054 -6.978 -3.078 1.00 0.00 H new ATOM 0 H21 G A 9 3.052 -8.755 -0.864 1.00 0.00 H new ATOM 0 H22 G A 9 3.189 -7.904 -2.406 1.00 0.00 H new ATOM 287 P U A 10 2.782 -8.873 4.374 1.00 0.00 P ATOM 288 OP1 U A 10 2.471 -9.592 5.629 1.00 0.00 O ATOM 289 OP2 U A 10 2.225 -9.356 3.090 1.00 0.00 O ATOM 290 O5' U A 10 2.357 -7.330 4.558 1.00 0.00 O ATOM 291 C5' U A 10 1.298 -6.967 5.449 1.00 0.00 C ATOM 292 C4' U A 10 0.676 -5.626 5.061 1.00 0.00 C ATOM 293 O4' U A 10 -0.748 -5.728 4.957 1.00 0.00 O ATOM 294 C3' U A 10 0.941 -4.560 6.118 1.00 0.00 C ATOM 295 O3' U A 10 0.919 -3.283 5.477 1.00 0.00 O ATOM 296 C2' U A 10 -0.280 -4.656 7.017 1.00 0.00 C ATOM 297 O2' U A 10 -0.541 -3.416 7.683 1.00 0.00 O ATOM 298 C1' U A 10 -1.379 -4.996 6.018 1.00 0.00 C ATOM 299 N1 U A 10 -2.438 -5.801 6.649 1.00 0.00 N ATOM 300 C2 U A 10 -3.622 -5.164 6.971 1.00 0.00 C ATOM 301 O2 U A 10 -3.801 -3.968 6.754 1.00 0.00 O ATOM 302 N3 U A 10 -4.596 -5.954 7.552 1.00 0.00 N ATOM 303 C4 U A 10 -4.489 -7.305 7.836 1.00 0.00 C ATOM 304 O4 U A 10 -5.423 -7.912 8.356 1.00 0.00 O ATOM 305 C5 U A 10 -3.218 -7.886 7.466 1.00 0.00 C ATOM 306 C6 U A 10 -2.250 -7.132 6.895 1.00 0.00 C ATOM 0 H5' U A 10 1.681 -6.911 6.468 1.00 0.00 H new ATOM 0 H5'' U A 10 0.531 -7.742 5.439 1.00 0.00 H new ATOM 0 H4' U A 10 1.128 -5.354 4.107 1.00 0.00 H new ATOM 0 H3' U A 10 1.888 -4.685 6.643 1.00 0.00 H new ATOM 0 H2' U A 10 -0.177 -5.383 7.822 1.00 0.00 H new ATOM 0 HO2' U A 10 -1.333 -3.511 8.252 1.00 0.00 H new ATOM 0 H1' U A 10 -1.858 -4.091 5.644 1.00 0.00 H new ATOM 0 H3 U A 10 -5.476 -5.499 7.794 1.00 0.00 H new ATOM 0 H5 U A 10 -3.039 -8.935 7.648 1.00 0.00 H new ATOM 0 H6 U A 10 -1.310 -7.592 6.628 1.00 0.00 H new ATOM 317 P G A 11 1.938 -2.123 5.932 1.00 0.00 P ATOM 318 OP1 G A 11 2.235 -2.303 7.370 1.00 0.00 O ATOM 319 OP2 G A 11 1.416 -0.829 5.440 1.00 0.00 O ATOM 320 O5' G A 11 3.266 -2.479 5.096 1.00 0.00 O ATOM 321 C5' G A 11 4.387 -3.091 5.737 1.00 0.00 C ATOM 322 C4' G A 11 5.675 -2.842 4.961 1.00 0.00 C ATOM 323 O4' G A 11 5.974 -3.941 4.088 1.00 0.00 O ATOM 324 C3' G A 11 5.543 -1.608 4.068 1.00 0.00 C ATOM 325 O3' G A 11 6.249 -0.530 4.682 1.00 0.00 O ATOM 326 C2' G A 11 6.278 -2.007 2.801 1.00 0.00 C ATOM 327 O2' G A 11 7.686 -1.764 2.908 1.00 0.00 O ATOM 328 C1' G A 11 5.971 -3.491 2.730 1.00 0.00 C ATOM 329 N9 G A 11 4.661 -3.728 2.097 1.00 0.00 N ATOM 330 C8 G A 11 3.578 -4.393 2.572 1.00 0.00 C ATOM 331 N7 G A 11 2.531 -4.445 1.821 1.00 0.00 N ATOM 332 C5 G A 11 2.950 -3.728 0.696 1.00 0.00 C ATOM 333 C6 G A 11 2.250 -3.425 -0.500 1.00 0.00 C ATOM 334 O6 G A 11 1.101 -3.731 -0.809 1.00 0.00 O ATOM 335 N1 G A 11 3.035 -2.684 -1.375 1.00 0.00 N ATOM 336 C2 G A 11 4.333 -2.282 -1.135 1.00 0.00 C ATOM 337 N2 G A 11 4.919 -1.576 -2.102 1.00 0.00 N ATOM 338 N3 G A 11 5.000 -2.564 -0.011 1.00 0.00 N ATOM 339 C4 G A 11 4.254 -3.286 0.858 1.00 0.00 C ATOM 0 H5' G A 11 4.216 -4.164 5.827 1.00 0.00 H new ATOM 0 H5'' G A 11 4.488 -2.699 6.749 1.00 0.00 H new ATOM 0 H4' G A 11 6.461 -2.709 5.704 1.00 0.00 H new ATOM 0 H3' G A 11 4.511 -1.303 3.894 1.00 0.00 H new ATOM 0 H2' G A 11 5.974 -1.447 1.916 1.00 0.00 H new ATOM 0 HO2' G A 11 7.861 -1.193 3.685 1.00 0.00 H new ATOM 0 H1' G A 11 6.702 -4.028 2.125 1.00 0.00 H new ATOM 0 H8 G A 11 3.592 -4.862 3.545 1.00 0.00 H new ATOM 0 H1 G A 11 2.618 -2.416 -2.266 1.00 0.00 H new ATOM 0 H21 G A 11 5.878 -1.249 -1.985 1.00 0.00 H new ATOM 0 H22 G A 11 4.408 -1.362 -2.959 1.00 0.00 H new ATOM 351 P A A 12 5.491 0.853 5.012 1.00 0.00 P ATOM 352 OP1 A A 12 6.367 1.664 5.886 1.00 0.00 O ATOM 353 OP2 A A 12 4.111 0.534 5.442 1.00 0.00 O ATOM 354 O5' A A 12 5.420 1.564 3.570 1.00 0.00 O ATOM 355 C5' A A 12 6.611 2.054 2.950 1.00 0.00 C ATOM 356 C4' A A 12 6.447 2.193 1.441 1.00 0.00 C ATOM 357 O4' A A 12 5.942 0.994 0.863 1.00 0.00 O ATOM 358 C3' A A 12 5.424 3.256 1.088 1.00 0.00 C ATOM 359 O3' A A 12 6.091 4.518 0.982 1.00 0.00 O ATOM 360 C2' A A 12 4.975 2.834 -0.307 1.00 0.00 C ATOM 361 O2' A A 12 5.787 3.435 -1.321 1.00 0.00 O ATOM 362 C1' A A 12 5.143 1.317 -0.286 1.00 0.00 C ATOM 363 N9 A A 12 3.826 0.665 -0.226 1.00 0.00 N ATOM 364 C8 A A 12 3.332 -0.219 0.672 1.00 0.00 C ATOM 365 N7 A A 12 2.125 -0.645 0.488 1.00 0.00 N ATOM 366 C5 A A 12 1.761 0.040 -0.677 1.00 0.00 C ATOM 367 C6 A A 12 0.589 0.059 -1.446 1.00 0.00 C ATOM 368 N6 A A 12 -0.493 -0.664 -1.148 1.00 0.00 N ATOM 369 N1 A A 12 0.574 0.852 -2.534 1.00 0.00 N ATOM 370 C2 A A 12 1.645 1.583 -2.852 1.00 0.00 C ATOM 371 N3 A A 12 2.800 1.639 -2.199 1.00 0.00 N ATOM 372 C4 A A 12 2.791 0.838 -1.115 1.00 0.00 C ATOM 0 H5' A A 12 7.438 1.377 3.165 1.00 0.00 H new ATOM 0 H5'' A A 12 6.872 3.022 3.378 1.00 0.00 H new ATOM 0 H4' A A 12 7.438 2.443 1.063 1.00 0.00 H new ATOM 0 H3' A A 12 4.614 3.348 1.812 1.00 0.00 H new ATOM 0 H2' A A 12 3.956 3.146 -0.538 1.00 0.00 H new ATOM 0 HO2' A A 12 6.229 4.231 -0.957 1.00 0.00 H new ATOM 0 H1' A A 12 5.635 0.961 -1.191 1.00 0.00 H new ATOM 0 H8 A A 12 3.923 -0.556 1.510 1.00 0.00 H new ATOM 0 H61 A A 12 -1.320 -0.613 -1.742 1.00 0.00 H new ATOM 0 H62 A A 12 -0.492 -1.268 -0.326 1.00 0.00 H new ATOM 0 H2 A A 12 1.563 2.196 -3.737 1.00 0.00 H new ATOM 384 P G A 13 5.371 5.868 1.493 1.00 0.00 P ATOM 385 OP1 G A 13 6.418 6.791 1.985 1.00 0.00 O ATOM 386 OP2 G A 13 4.249 5.486 2.381 1.00 0.00 O ATOM 387 O5' G A 13 4.753 6.484 0.138 1.00 0.00 O ATOM 388 C5' G A 13 5.496 7.430 -0.641 1.00 0.00 C ATOM 389 C4' G A 13 4.974 7.512 -2.075 1.00 0.00 C ATOM 390 O4' G A 13 4.662 6.210 -2.590 1.00 0.00 O ATOM 391 C3' G A 13 3.677 8.314 -2.146 1.00 0.00 C ATOM 392 O3' G A 13 3.987 9.650 -2.553 1.00 0.00 O ATOM 393 C2' G A 13 2.915 7.635 -3.270 1.00 0.00 C ATOM 394 O2' G A 13 3.314 8.128 -4.554 1.00 0.00 O ATOM 395 C1' G A 13 3.312 6.185 -3.077 1.00 0.00 C ATOM 396 N9 G A 13 2.410 5.532 -2.112 1.00 0.00 N ATOM 397 C8 G A 13 2.648 5.130 -0.841 1.00 0.00 C ATOM 398 N7 G A 13 1.668 4.608 -0.184 1.00 0.00 N ATOM 399 C5 G A 13 0.635 4.660 -1.124 1.00 0.00 C ATOM 400 C6 G A 13 -0.716 4.235 -1.015 1.00 0.00 C ATOM 401 O6 G A 13 -1.278 3.719 -0.052 1.00 0.00 O ATOM 402 N1 G A 13 -1.419 4.468 -2.190 1.00 0.00 N ATOM 403 C2 G A 13 -0.892 5.039 -3.332 1.00 0.00 C ATOM 404 N2 G A 13 -1.727 5.182 -4.360 1.00 0.00 N ATOM 405 N3 G A 13 0.378 5.442 -3.442 1.00 0.00 N ATOM 406 C4 G A 13 1.083 5.224 -2.309 1.00 0.00 C ATOM 0 H5' G A 13 6.548 7.146 -0.652 1.00 0.00 H new ATOM 0 H5'' G A 13 5.436 8.413 -0.175 1.00 0.00 H new ATOM 0 H4' G A 13 5.765 7.987 -2.656 1.00 0.00 H new ATOM 0 H3' G A 13 3.133 8.351 -1.202 1.00 0.00 H new ATOM 0 H2' G A 13 1.839 7.806 -3.240 1.00 0.00 H new ATOM 0 HO2' G A 13 3.826 8.956 -4.442 1.00 0.00 H new ATOM 0 H1' G A 13 3.241 5.617 -4.005 1.00 0.00 H new ATOM 0 H8 G A 13 3.624 5.242 -0.393 1.00 0.00 H new ATOM 0 H1 G A 13 -2.402 4.196 -2.211 1.00 0.00 H new ATOM 0 H21 G A 13 -1.397 5.597 -5.231 1.00 0.00 H new ATOM 0 H22 G A 13 -2.696 4.876 -4.276 1.00 0.00 H new ATOM 418 P C A 14 3.496 10.905 -1.672 1.00 0.00 P ATOM 419 OP1 C A 14 4.319 12.079 -2.040 1.00 0.00 O ATOM 420 OP2 C A 14 3.415 10.475 -0.259 1.00 0.00 O ATOM 421 O5' C A 14 1.998 11.151 -2.211 1.00 0.00 O ATOM 422 C5' C A 14 1.778 11.894 -3.413 1.00 0.00 C ATOM 423 C4' C A 14 0.459 11.514 -4.083 1.00 0.00 C ATOM 424 O4' C A 14 0.219 10.112 -4.002 1.00 0.00 O ATOM 425 C3' C A 14 -0.723 12.159 -3.383 1.00 0.00 C ATOM 426 O3' C A 14 -0.984 13.417 -4.009 1.00 0.00 O ATOM 427 C2' C A 14 -1.877 11.220 -3.700 1.00 0.00 C ATOM 428 O2' C A 14 -2.573 11.630 -4.884 1.00 0.00 O ATOM 429 C1' C A 14 -1.193 9.866 -3.901 1.00 0.00 C ATOM 430 N1 C A 14 -1.495 8.956 -2.780 1.00 0.00 N ATOM 431 C2 C A 14 -2.762 8.399 -2.738 1.00 0.00 C ATOM 432 O2 C A 14 -3.580 8.664 -3.617 1.00 0.00 O ATOM 433 N3 C A 14 -3.067 7.561 -1.710 1.00 0.00 N ATOM 434 C4 C A 14 -2.164 7.282 -0.760 1.00 0.00 C ATOM 435 N4 C A 14 -2.494 6.456 0.233 1.00 0.00 N ATOM 436 C5 C A 14 -0.854 7.855 -0.799 1.00 0.00 C ATOM 437 C6 C A 14 -0.563 8.684 -1.821 1.00 0.00 C ATOM 0 H5' C A 14 2.601 11.717 -4.105 1.00 0.00 H new ATOM 0 H5'' C A 14 1.776 12.960 -3.186 1.00 0.00 H new ATOM 0 H4' C A 14 0.549 11.849 -5.116 1.00 0.00 H new ATOM 0 H3' C A 14 -0.567 12.315 -2.316 1.00 0.00 H new ATOM 0 H2' C A 14 -2.632 11.201 -2.914 1.00 0.00 H new ATOM 0 HO2' C A 14 -2.065 12.337 -5.334 1.00 0.00 H new ATOM 0 H1' C A 14 -1.558 9.382 -4.807 1.00 0.00 H new ATOM 0 H41 C A 14 -1.814 6.237 0.961 1.00 0.00 H new ATOM 0 H42 C A 14 -3.426 6.043 0.264 1.00 0.00 H new ATOM 0 H5 C A 14 -0.123 7.631 -0.036 1.00 0.00 H new ATOM 0 H6 C A 14 0.416 9.137 -1.881 1.00 0.00 H new ATOM 449 P C A 15 -1.942 14.498 -3.299 1.00 0.00 P ATOM 450 OP1 C A 15 -2.058 15.671 -4.193 1.00 0.00 O ATOM 451 OP2 C A 15 -1.484 14.674 -1.904 1.00 0.00 O ATOM 452 O5' C A 15 -3.365 13.743 -3.270 1.00 0.00 O ATOM 453 C5' C A 15 -4.126 13.582 -4.470 1.00 0.00 C ATOM 454 C4' C A 15 -5.613 13.416 -4.174 1.00 0.00 C ATOM 455 O4' C A 15 -5.908 12.085 -3.737 1.00 0.00 O ATOM 456 C3' C A 15 -6.047 14.347 -3.051 1.00 0.00 C ATOM 457 O3' C A 15 -6.538 15.590 -3.564 1.00 0.00 O ATOM 458 C2' C A 15 -7.146 13.557 -2.362 1.00 0.00 C ATOM 459 O2' C A 15 -8.418 13.771 -2.986 1.00 0.00 O ATOM 460 C1' C A 15 -6.677 12.119 -2.530 1.00 0.00 C ATOM 461 N1 C A 15 -5.866 11.684 -1.378 1.00 0.00 N ATOM 462 C2 C A 15 -6.490 10.904 -0.417 1.00 0.00 C ATOM 463 O2 C A 15 -7.679 10.615 -0.536 1.00 0.00 O ATOM 464 N3 C A 15 -5.753 10.475 0.643 1.00 0.00 N ATOM 465 C4 C A 15 -4.457 10.798 0.757 1.00 0.00 C ATOM 466 N4 C A 15 -3.764 10.360 1.807 1.00 0.00 N ATOM 467 C5 C A 15 -3.810 11.606 -0.232 1.00 0.00 C ATOM 468 C6 C A 15 -4.548 12.024 -1.278 1.00 0.00 C ATOM 0 H5' C A 15 -3.764 12.711 -5.017 1.00 0.00 H new ATOM 0 H5'' C A 15 -3.977 14.448 -5.115 1.00 0.00 H new ATOM 0 H4' C A 15 -6.141 13.644 -5.100 1.00 0.00 H new ATOM 0 H3' C A 15 -5.232 14.622 -2.381 1.00 0.00 H new ATOM 0 H2' C A 15 -7.296 13.844 -1.321 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.410 14.628 -3.460 1.00 0.00 H new ATOM 0 HO3' C A 15 -6.811 16.166 -2.820 1.00 0.00 H new ATOM 0 H1' C A 15 -7.526 11.437 -2.583 1.00 0.00 H new ATOM 0 H41 C A 15 -2.777 10.600 1.903 1.00 0.00 H new ATOM 0 H42 C A 15 -4.220 9.784 2.515 1.00 0.00 H new ATOM 0 H5 C A 15 -2.767 11.871 -0.142 1.00 0.00 H new ATOM 0 H6 C A 15 -4.093 12.634 -2.045 1.00 0.00 H new TER 481 C A 15