USER MOD reduce.3.24.130724 H: found=0, std=0, add=142, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 141 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 -124:sc= 0.327 USER MOD Single : A 2 A O2' : rot -6:sc= -0.0211 USER MOD Single : A 3 C O2' : rot -13:sc= 0.074 USER MOD Single : A 4 U O2' : rot -113:sc= 0.308 USER MOD Single : A 5 G O2' : rot -85:sc= 0.787 USER MOD Single : A 6 G O2' : rot 82:sc= 1.62 USER MOD Single : A 7 G O2' : rot 22:sc= 0.324 USER MOD Single : A 8 G O2' : rot -17:sc= 1.43 USER MOD Single : A 9 C O2' : rot 32:sc= 0.082 USER MOD Single : A 10 G O2' : rot -12:sc= 0.162 USER MOD Single : A 11 G O2' : rot -13:sc= 0.206 USER MOD Single : A 12 U O2' : rot -6:sc= 0.0918 USER MOD Single : A 13 C O2' : rot -29:sc= 0.239 USER MOD Single : A 13 C O3' : rot 180:sc= 0.197 USER MOD ----------------------------------------------------------------- ATOM 1 P G A 1 3.065 -11.628 8.302 1.00 0.00 P ATOM 2 OP1 G A 1 3.702 -10.408 8.969 1.00 0.00 O ATOM 3 OP2 G A 1 1.650 -11.276 7.837 1.00 0.00 O ATOM 4 O5' G A 1 3.951 -12.072 7.034 1.00 0.00 O ATOM 5 C5' G A 1 5.315 -12.451 7.214 1.00 0.00 C ATOM 6 C4' G A 1 5.946 -12.837 5.870 1.00 0.00 C ATOM 7 O4' G A 1 5.184 -13.883 5.249 1.00 0.00 O ATOM 8 C3' G A 1 6.044 -11.703 4.835 1.00 0.00 C ATOM 9 O3' G A 1 7.222 -10.913 5.052 1.00 0.00 O ATOM 10 C2' G A 1 6.078 -12.482 3.517 1.00 0.00 C ATOM 11 O2' G A 1 7.418 -12.858 3.218 1.00 0.00 O ATOM 12 C1' G A 1 5.245 -13.744 3.815 1.00 0.00 C ATOM 13 N9 G A 1 3.861 -13.673 3.252 1.00 0.00 N ATOM 14 C8 G A 1 2.692 -13.224 3.838 1.00 0.00 C ATOM 15 N7 G A 1 1.497 -13.205 3.158 1.00 0.00 N ATOM 16 C5 G A 1 1.971 -13.705 1.966 1.00 0.00 C ATOM 17 C6 G A 1 1.134 -13.935 0.693 1.00 0.00 C ATOM 18 O6 G A 1 -0.072 -13.696 0.637 1.00 0.00 O ATOM 19 N1 G A 1 1.836 -14.419 -0.370 1.00 0.00 N ATOM 20 C2 G A 1 3.287 -14.702 -0.310 1.00 0.00 C ATOM 21 N2 G A 1 3.938 -15.195 -1.461 1.00 0.00 N ATOM 22 N3 G A 1 3.969 -14.504 0.774 1.00 0.00 N ATOM 23 C4 G A 1 3.377 -13.994 1.988 1.00 0.00 C ATOM 0 H5' G A 1 5.377 -13.291 7.906 1.00 0.00 H new ATOM 0 H5'' G A 1 5.872 -11.627 7.661 1.00 0.00 H new ATOM 0 H4' G A 1 6.960 -13.137 6.135 1.00 0.00 H new ATOM 0 H3' G A 1 5.231 -10.978 4.873 1.00 0.00 H new ATOM 0 H2' G A 1 5.699 -11.907 2.672 1.00 0.00 H new ATOM 0 HO2' G A 1 7.665 -12.514 2.334 1.00 0.00 H new ATOM 0 H1' G A 1 5.721 -14.603 3.341 1.00 0.00 H new ATOM 0 H8 G A 1 2.718 -12.878 4.861 1.00 0.00 H new ATOM 0 H1 G A 1 1.340 -14.594 -1.244 1.00 0.00 H new ATOM 0 H21 G A 1 4.938 -15.395 -1.435 1.00 0.00 H new ATOM 0 H22 G A 1 3.409 -15.351 -2.319 1.00 0.00 H new ATOM 35 P A A 2 7.351 -9.399 4.488 1.00 0.00 P ATOM 36 OP1 A A 2 8.588 -8.731 5.090 1.00 0.00 O ATOM 37 OP2 A A 2 6.102 -8.603 4.872 1.00 0.00 O ATOM 38 O5' A A 2 7.491 -9.441 2.881 1.00 0.00 O ATOM 39 C5' A A 2 8.661 -9.997 2.277 1.00 0.00 C ATOM 40 C4' A A 2 8.389 -10.364 0.814 1.00 0.00 C ATOM 41 O4' A A 2 7.261 -11.249 0.732 1.00 0.00 O ATOM 42 C3' A A 2 8.062 -9.188 -0.122 1.00 0.00 C ATOM 43 O3' A A 2 9.250 -8.531 -0.586 1.00 0.00 O ATOM 44 C2' A A 2 7.302 -9.895 -1.251 1.00 0.00 C ATOM 45 O2' A A 2 8.222 -10.424 -2.200 1.00 0.00 O ATOM 46 C1' A A 2 6.589 -11.056 -0.530 1.00 0.00 C ATOM 47 N9 A A 2 5.132 -10.796 -0.312 1.00 0.00 N ATOM 48 C8 A A 2 4.482 -10.276 0.788 1.00 0.00 C ATOM 49 N7 A A 2 3.120 -10.094 0.808 1.00 0.00 N ATOM 50 C5 A A 2 2.845 -10.550 -0.480 1.00 0.00 C ATOM 51 C6 A A 2 1.594 -10.613 -1.166 1.00 0.00 C ATOM 52 N6 A A 2 0.441 -10.254 -0.605 1.00 0.00 N ATOM 53 N1 A A 2 1.565 -11.036 -2.396 1.00 0.00 N ATOM 54 C2 A A 2 2.679 -11.394 -2.965 1.00 0.00 C ATOM 55 N3 A A 2 3.895 -11.426 -2.519 1.00 0.00 N ATOM 56 C4 A A 2 4.046 -10.973 -1.165 1.00 0.00 C ATOM 0 H5' A A 2 8.975 -10.884 2.828 1.00 0.00 H new ATOM 0 H5'' A A 2 9.481 -9.281 2.332 1.00 0.00 H new ATOM 0 H4' A A 2 9.328 -10.808 0.483 1.00 0.00 H new ATOM 0 H3' A A 2 7.493 -8.387 0.349 1.00 0.00 H new ATOM 0 H2' A A 2 6.623 -9.232 -1.788 1.00 0.00 H new ATOM 0 HO2' A A 2 9.130 -10.135 -1.972 1.00 0.00 H new ATOM 0 H1' A A 2 6.640 -11.949 -1.152 1.00 0.00 H new ATOM 0 H8 A A 2 5.060 -10.004 1.659 1.00 0.00 H new ATOM 0 H61 A A 2 -0.427 -10.317 -1.137 1.00 0.00 H new ATOM 0 H62 A A 2 0.426 -9.916 0.357 1.00 0.00 H new ATOM 0 H2 A A 2 2.571 -11.722 -3.988 1.00 0.00 H new ATOM 68 P C A 3 9.218 -7.001 -1.122 1.00 0.00 P ATOM 69 OP1 C A 3 10.643 -6.539 -1.436 1.00 0.00 O ATOM 70 OP2 C A 3 8.615 -6.096 -0.045 1.00 0.00 O ATOM 71 O5' C A 3 8.319 -6.920 -2.459 1.00 0.00 O ATOM 72 C5' C A 3 8.765 -7.548 -3.660 1.00 0.00 C ATOM 73 C4' C A 3 7.624 -7.656 -4.682 1.00 0.00 C ATOM 74 O4' C A 3 6.500 -8.341 -4.117 1.00 0.00 O ATOM 75 C3' C A 3 7.098 -6.320 -5.217 1.00 0.00 C ATOM 76 O3' C A 3 7.899 -5.925 -6.336 1.00 0.00 O ATOM 77 C2' C A 3 5.667 -6.664 -5.628 1.00 0.00 C ATOM 78 O2' C A 3 5.662 -7.172 -6.958 1.00 0.00 O ATOM 79 C1' C A 3 5.272 -7.787 -4.645 1.00 0.00 C ATOM 80 N1 C A 3 4.349 -7.374 -3.534 1.00 0.00 N ATOM 81 C2 C A 3 2.968 -7.352 -3.692 1.00 0.00 C ATOM 82 O2 C A 3 2.420 -7.517 -4.791 1.00 0.00 O ATOM 83 N3 C A 3 2.169 -7.124 -2.495 1.00 0.00 N ATOM 84 C4 C A 3 2.662 -6.954 -1.317 1.00 0.00 C ATOM 85 N4 C A 3 1.761 -6.803 -0.238 1.00 0.00 N ATOM 86 C5 C A 3 4.008 -6.927 -1.120 1.00 0.00 C ATOM 87 C6 C A 3 4.862 -7.115 -2.161 1.00 0.00 C ATOM 0 H5' C A 3 9.150 -8.542 -3.433 1.00 0.00 H new ATOM 0 H5'' C A 3 9.589 -6.977 -4.089 1.00 0.00 H new ATOM 0 H4' C A 3 8.074 -8.199 -5.513 1.00 0.00 H new ATOM 0 H3' C A 3 7.132 -5.492 -4.509 1.00 0.00 H new ATOM 0 H2' C A 3 4.993 -5.808 -5.600 1.00 0.00 H new ATOM 0 HO2' C A 3 6.529 -6.995 -7.379 1.00 0.00 H new ATOM 0 H1' C A 3 4.690 -8.523 -5.200 1.00 0.00 H new ATOM 0 H41 C A 3 2.117 -6.667 0.708 1.00 0.00 H new ATOM 0 H42 C A 3 0.755 -6.830 -0.406 1.00 0.00 H new ATOM 0 H5 C A 3 4.401 -6.755 -0.129 1.00 0.00 H new ATOM 0 H6 C A 3 5.928 -7.076 -1.989 1.00 0.00 H new ATOM 99 P U A 4 8.083 -4.377 -6.736 1.00 0.00 P ATOM 100 OP1 U A 4 8.947 -4.266 -7.995 1.00 0.00 O ATOM 101 OP2 U A 4 8.759 -3.630 -5.584 1.00 0.00 O ATOM 102 O5' U A 4 6.635 -3.738 -7.010 1.00 0.00 O ATOM 103 C5' U A 4 5.886 -4.072 -8.185 1.00 0.00 C ATOM 104 C4' U A 4 4.440 -3.556 -8.079 1.00 0.00 C ATOM 105 O4' U A 4 3.739 -4.248 -7.039 1.00 0.00 O ATOM 106 C3' U A 4 4.303 -2.062 -7.759 1.00 0.00 C ATOM 107 O3' U A 4 4.381 -1.284 -8.960 1.00 0.00 O ATOM 108 C2' U A 4 2.940 -1.984 -7.097 1.00 0.00 C ATOM 109 O2' U A 4 1.946 -1.704 -8.074 1.00 0.00 O ATOM 110 C1' U A 4 2.719 -3.383 -6.492 1.00 0.00 C ATOM 111 N1 U A 4 2.720 -3.435 -4.993 1.00 0.00 N ATOM 112 C2 U A 4 1.523 -3.404 -4.268 1.00 0.00 C ATOM 113 O2 U A 4 0.409 -3.274 -4.786 1.00 0.00 O ATOM 114 N3 U A 4 1.536 -3.538 -2.909 1.00 0.00 N ATOM 115 C4 U A 4 2.662 -3.720 -2.161 1.00 0.00 C ATOM 116 O4 U A 4 2.605 -3.846 -0.939 1.00 0.00 O ATOM 117 C5 U A 4 4.009 -3.758 -2.920 1.00 0.00 C ATOM 118 C6 U A 4 4.005 -3.598 -4.261 1.00 0.00 C ATOM 0 H5' U A 4 5.881 -5.153 -8.323 1.00 0.00 H new ATOM 0 H5'' U A 4 6.367 -3.640 -9.063 1.00 0.00 H new ATOM 0 H4' U A 4 4.026 -3.734 -9.072 1.00 0.00 H new ATOM 0 H3' U A 4 5.092 -1.665 -7.121 1.00 0.00 H new ATOM 0 H2' U A 4 2.883 -1.198 -6.344 1.00 0.00 H new ATOM 0 HO2' U A 4 1.571 -0.813 -7.913 1.00 0.00 H new ATOM 0 H1' U A 4 1.714 -3.708 -6.762 1.00 0.00 H new ATOM 0 H3 U A 4 0.642 -3.499 -2.420 1.00 0.00 H new ATOM 0 H5 U A 4 4.936 -3.910 -2.387 1.00 0.00 H new ATOM 0 H6 U A 4 4.938 -3.588 -4.804 1.00 0.00 H new ATOM 129 P G A 5 4.977 0.218 -8.956 1.00 0.00 P ATOM 130 OP1 G A 5 5.081 0.732 -10.393 1.00 0.00 O ATOM 131 OP2 G A 5 6.367 0.209 -8.317 1.00 0.00 O ATOM 132 O5' G A 5 4.003 1.181 -8.105 1.00 0.00 O ATOM 133 C5' G A 5 2.724 1.577 -8.610 1.00 0.00 C ATOM 134 C4' G A 5 1.785 1.915 -7.445 1.00 0.00 C ATOM 135 O4' G A 5 1.731 0.787 -6.567 1.00 0.00 O ATOM 136 C3' G A 5 2.203 3.122 -6.598 1.00 0.00 C ATOM 137 O3' G A 5 1.649 4.331 -7.128 1.00 0.00 O ATOM 138 C2' G A 5 1.625 2.759 -5.234 1.00 0.00 C ATOM 139 O2' G A 5 0.285 3.214 -5.117 1.00 0.00 O ATOM 140 C1' G A 5 1.670 1.210 -5.201 1.00 0.00 C ATOM 141 N9 G A 5 2.860 0.681 -4.452 1.00 0.00 N ATOM 142 C8 G A 5 4.197 0.717 -4.806 1.00 0.00 C ATOM 143 N7 G A 5 5.187 0.263 -3.967 1.00 0.00 N ATOM 144 C5 G A 5 4.365 -0.104 -2.924 1.00 0.00 C ATOM 145 C6 G A 5 4.835 -0.661 -1.566 1.00 0.00 C ATOM 146 O6 G A 5 6.019 -0.875 -1.312 1.00 0.00 O ATOM 147 N1 G A 5 3.837 -0.887 -0.666 1.00 0.00 N ATOM 148 C2 G A 5 2.412 -0.613 -0.964 1.00 0.00 C ATOM 149 N2 G A 5 1.442 -0.864 0.026 1.00 0.00 N ATOM 150 N3 G A 5 2.041 -0.148 -2.116 1.00 0.00 N ATOM 151 C4 G A 5 2.972 0.145 -3.177 1.00 0.00 C ATOM 0 H5' G A 5 2.297 0.775 -9.212 1.00 0.00 H new ATOM 0 H5'' G A 5 2.833 2.443 -9.263 1.00 0.00 H new ATOM 0 H4' G A 5 0.829 2.165 -7.904 1.00 0.00 H new ATOM 0 H3' G A 5 3.276 3.309 -6.568 1.00 0.00 H new ATOM 0 H2' G A 5 2.180 3.216 -4.415 1.00 0.00 H new ATOM 0 HO2' G A 5 0.281 4.148 -4.820 1.00 0.00 H new ATOM 0 H1' G A 5 0.792 0.827 -4.681 1.00 0.00 H new ATOM 0 H8 G A 5 4.472 1.114 -5.772 1.00 0.00 H new ATOM 0 H1 G A 5 4.081 -1.260 0.251 1.00 0.00 H new ATOM 0 H21 G A 5 0.457 -0.680 -0.166 1.00 0.00 H new ATOM 0 H22 G A 5 1.724 -1.230 0.935 1.00 0.00 H new ATOM 163 P G A 6 2.599 5.533 -7.663 1.00 0.00 P ATOM 164 OP1 G A 6 3.620 4.958 -8.648 1.00 0.00 O ATOM 165 OP2 G A 6 3.337 6.165 -6.482 1.00 0.00 O ATOM 166 O5' G A 6 1.716 6.662 -8.417 1.00 0.00 O ATOM 167 C5' G A 6 0.444 6.376 -9.009 1.00 0.00 C ATOM 168 C4' G A 6 -0.654 6.870 -8.043 1.00 0.00 C ATOM 169 O4' G A 6 -0.381 6.355 -6.722 1.00 0.00 O ATOM 170 C3' G A 6 -0.822 8.406 -7.898 1.00 0.00 C ATOM 171 O3' G A 6 -2.221 8.740 -7.926 1.00 0.00 O ATOM 172 C2' G A 6 -0.286 8.700 -6.497 1.00 0.00 C ATOM 173 O2' G A 6 -0.934 9.812 -5.900 1.00 0.00 O ATOM 174 C1' G A 6 -0.582 7.388 -5.741 1.00 0.00 C ATOM 175 N9 G A 6 0.250 7.076 -4.523 1.00 0.00 N ATOM 176 C8 G A 6 0.159 5.939 -3.735 1.00 0.00 C ATOM 177 N7 G A 6 0.964 5.731 -2.638 1.00 0.00 N ATOM 178 C5 G A 6 1.680 6.899 -2.722 1.00 0.00 C ATOM 179 C6 G A 6 2.802 7.336 -1.760 1.00 0.00 C ATOM 180 O6 G A 6 3.161 6.651 -0.804 1.00 0.00 O ATOM 181 N1 G A 6 3.366 8.542 -2.052 1.00 0.00 N ATOM 182 C2 G A 6 2.933 9.367 -3.205 1.00 0.00 C ATOM 183 N2 G A 6 3.564 10.604 -3.444 1.00 0.00 N ATOM 184 N3 G A 6 1.987 8.973 -3.997 1.00 0.00 N ATOM 185 C4 G A 6 1.289 7.724 -3.826 1.00 0.00 C ATOM 0 H5' G A 6 0.340 5.306 -9.189 1.00 0.00 H new ATOM 0 H5'' G A 6 0.353 6.872 -9.975 1.00 0.00 H new ATOM 0 H4' G A 6 -1.579 6.505 -8.490 1.00 0.00 H new ATOM 0 H3' G A 6 -0.317 8.962 -8.688 1.00 0.00 H new ATOM 0 H2' G A 6 0.769 8.973 -6.491 1.00 0.00 H new ATOM 0 HO2' G A 6 -1.784 9.523 -5.507 1.00 0.00 H new ATOM 0 H1' G A 6 -1.587 7.473 -5.327 1.00 0.00 H new ATOM 0 H8 G A 6 -0.572 5.187 -3.992 1.00 0.00 H new ATOM 0 H1 G A 6 4.115 8.890 -1.454 1.00 0.00 H new ATOM 0 H21 G A 6 3.274 11.180 -4.234 1.00 0.00 H new ATOM 0 H22 G A 6 4.310 10.923 -2.827 1.00 0.00 H new ATOM 197 P G A 7 -3.061 9.065 -9.276 1.00 0.00 P ATOM 198 OP1 G A 7 -2.339 8.510 -10.508 1.00 0.00 O ATOM 199 OP2 G A 7 -3.233 10.577 -9.426 1.00 0.00 O ATOM 200 O5' G A 7 -4.508 8.358 -9.154 1.00 0.00 O ATOM 201 C5' G A 7 -4.616 6.939 -8.977 1.00 0.00 C ATOM 202 C4' G A 7 -4.929 6.580 -7.515 1.00 0.00 C ATOM 203 O4' G A 7 -4.028 7.300 -6.645 1.00 0.00 O ATOM 204 C3' G A 7 -6.368 6.867 -7.009 1.00 0.00 C ATOM 205 O3' G A 7 -6.892 5.689 -6.384 1.00 0.00 O ATOM 206 C2' G A 7 -6.177 7.932 -5.932 1.00 0.00 C ATOM 207 O2' G A 7 -7.110 7.800 -4.870 1.00 0.00 O ATOM 208 C1' G A 7 -4.739 7.672 -5.457 1.00 0.00 C ATOM 209 N9 G A 7 -4.097 8.846 -4.781 1.00 0.00 N ATOM 210 C8 G A 7 -3.519 8.900 -3.524 1.00 0.00 C ATOM 211 N7 G A 7 -2.907 10.036 -3.045 1.00 0.00 N ATOM 212 C5 G A 7 -3.111 10.823 -4.154 1.00 0.00 C ATOM 213 C6 G A 7 -2.679 12.295 -4.302 1.00 0.00 C ATOM 214 O6 G A 7 -2.083 12.904 -3.415 1.00 0.00 O ATOM 215 N1 G A 7 -3.016 12.869 -5.492 1.00 0.00 N ATOM 216 C2 G A 7 -3.741 12.136 -6.556 1.00 0.00 C ATOM 217 N2 G A 7 -4.076 12.811 -7.748 1.00 0.00 N ATOM 218 N3 G A 7 -4.081 10.894 -6.409 1.00 0.00 N ATOM 219 C4 G A 7 -3.802 10.145 -5.212 1.00 0.00 C ATOM 0 H5' G A 7 -3.684 6.461 -9.280 1.00 0.00 H new ATOM 0 H5'' G A 7 -5.400 6.548 -9.625 1.00 0.00 H new ATOM 0 H4' G A 7 -4.811 5.497 -7.488 1.00 0.00 H new ATOM 0 H3' G A 7 -7.042 7.171 -7.810 1.00 0.00 H new ATOM 0 H2' G A 7 -6.339 8.944 -6.303 1.00 0.00 H new ATOM 0 HO2' G A 7 -7.458 6.884 -4.853 1.00 0.00 H new ATOM 0 H1' G A 7 -4.726 6.898 -4.690 1.00 0.00 H new ATOM 0 H8 G A 7 -3.549 8.021 -2.898 1.00 0.00 H new ATOM 0 H1 G A 7 -2.759 13.842 -5.656 1.00 0.00 H new ATOM 0 H21 G A 7 -4.575 12.319 -8.489 1.00 0.00 H new ATOM 0 H22 G A 7 -3.819 13.791 -7.869 1.00 0.00 H new ATOM 231 P G A 8 -7.802 4.619 -7.175 1.00 0.00 P ATOM 232 OP1 G A 8 -7.107 4.212 -8.476 1.00 0.00 O ATOM 233 OP2 G A 8 -9.165 5.239 -7.493 1.00 0.00 O ATOM 234 O5' G A 8 -8.000 3.326 -6.243 1.00 0.00 O ATOM 235 C5' G A 8 -8.511 3.478 -4.922 1.00 0.00 C ATOM 236 C4' G A 8 -8.406 2.125 -4.185 1.00 0.00 C ATOM 237 O4' G A 8 -8.900 1.073 -5.039 1.00 0.00 O ATOM 238 C3' G A 8 -6.989 1.696 -3.715 1.00 0.00 C ATOM 239 O3' G A 8 -7.066 1.131 -2.402 1.00 0.00 O ATOM 240 C2' G A 8 -6.601 0.577 -4.684 1.00 0.00 C ATOM 241 O2' G A 8 -5.751 -0.390 -4.083 1.00 0.00 O ATOM 242 C1' G A 8 -7.973 -0.030 -5.049 1.00 0.00 C ATOM 243 N9 G A 8 -8.092 -0.766 -6.364 1.00 0.00 N ATOM 244 C8 G A 8 -7.298 -0.802 -7.518 1.00 0.00 C ATOM 245 N7 G A 8 -7.712 -1.406 -8.681 1.00 0.00 N ATOM 246 C5 G A 8 -8.950 -1.799 -8.236 1.00 0.00 C ATOM 247 C6 G A 8 -10.001 -2.551 -9.076 1.00 0.00 C ATOM 248 O6 G A 8 -9.803 -2.881 -10.244 1.00 0.00 O ATOM 249 N1 G A 8 -11.168 -2.822 -8.425 1.00 0.00 N ATOM 250 C2 G A 8 -11.408 -2.421 -7.020 1.00 0.00 C ATOM 251 N2 G A 8 -12.642 -2.735 -6.414 1.00 0.00 N ATOM 252 N3 G A 8 -10.507 -1.788 -6.337 1.00 0.00 N ATOM 253 C4 G A 8 -9.216 -1.425 -6.874 1.00 0.00 C ATOM 0 H5' G A 8 -9.549 3.809 -4.955 1.00 0.00 H new ATOM 0 H5'' G A 8 -7.949 4.243 -4.386 1.00 0.00 H new ATOM 0 H4' G A 8 -8.997 2.277 -3.282 1.00 0.00 H new ATOM 0 H3' G A 8 -6.289 2.531 -3.697 1.00 0.00 H new ATOM 0 H2' G A 8 -6.032 0.935 -5.542 1.00 0.00 H new ATOM 0 HO2' G A 8 -5.368 -0.022 -3.259 1.00 0.00 H new ATOM 0 H1' G A 8 -8.167 -0.814 -4.317 1.00 0.00 H new ATOM 0 H8 G A 8 -6.323 -0.337 -7.493 1.00 0.00 H new ATOM 0 H1 G A 8 -11.904 -3.320 -8.925 1.00 0.00 H new ATOM 0 H21 G A 8 -12.819 -2.464 -5.447 1.00 0.00 H new ATOM 0 H22 G A 8 -13.358 -3.233 -6.943 1.00 0.00 H new ATOM 265 P C A 9 -6.998 1.980 -1.029 1.00 0.00 P ATOM 266 OP1 C A 9 -8.243 2.860 -0.904 1.00 0.00 O ATOM 267 OP2 C A 9 -5.742 2.854 -1.017 1.00 0.00 O ATOM 268 O5' C A 9 -6.944 0.930 0.193 1.00 0.00 O ATOM 269 C5' C A 9 -7.835 -0.193 0.235 1.00 0.00 C ATOM 270 C4' C A 9 -7.131 -1.378 0.969 1.00 0.00 C ATOM 271 O4' C A 9 -6.013 -1.885 0.206 1.00 0.00 O ATOM 272 C3' C A 9 -6.526 -1.187 2.374 1.00 0.00 C ATOM 273 O3' C A 9 -6.505 -2.477 3.076 1.00 0.00 O ATOM 274 C2' C A 9 -5.070 -0.759 2.051 1.00 0.00 C ATOM 275 O2' C A 9 -4.190 -0.957 3.148 1.00 0.00 O ATOM 276 C1' C A 9 -4.724 -1.661 0.856 1.00 0.00 C ATOM 277 N1 C A 9 -3.767 -1.064 -0.130 1.00 0.00 N ATOM 278 C2 C A 9 -2.390 -1.177 -0.022 1.00 0.00 C ATOM 279 O2 C A 9 -1.853 -1.797 0.902 1.00 0.00 O ATOM 280 N3 C A 9 -1.587 -0.513 -1.054 1.00 0.00 N ATOM 281 C4 C A 9 -2.111 0.148 -2.041 1.00 0.00 C ATOM 282 N4 C A 9 -1.251 0.764 -2.975 1.00 0.00 N ATOM 283 C5 C A 9 -3.460 0.257 -2.191 1.00 0.00 C ATOM 284 C6 C A 9 -4.295 -0.319 -1.290 1.00 0.00 C ATOM 0 H5' C A 9 -8.114 -0.490 -0.776 1.00 0.00 H new ATOM 0 H5'' C A 9 -8.755 0.077 0.753 1.00 0.00 H new ATOM 0 H4' C A 9 -8.001 -2.026 1.074 1.00 0.00 H new ATOM 0 H3' C A 9 -7.072 -0.480 2.999 1.00 0.00 H new ATOM 0 H2' C A 9 -4.971 0.305 1.836 1.00 0.00 H new ATOM 0 HO2' C A 9 -4.484 -1.735 3.667 1.00 0.00 H new ATOM 0 H1' C A 9 -4.218 -2.560 1.208 1.00 0.00 H new ATOM 0 H41 C A 9 -1.641 1.288 -3.758 1.00 0.00 H new ATOM 0 H42 C A 9 -0.240 0.685 -2.867 1.00 0.00 H new ATOM 0 H5 C A 9 -3.866 0.803 -3.029 1.00 0.00 H new ATOM 0 H6 C A 9 -5.363 -0.231 -1.424 1.00 0.00 H new ATOM 296 P G A 10 -7.793 -3.347 3.611 1.00 0.00 P ATOM 297 OP1 G A 10 -8.754 -2.419 4.357 1.00 0.00 O ATOM 298 OP2 G A 10 -7.311 -4.446 4.559 1.00 0.00 O ATOM 299 O5' G A 10 -8.571 -4.028 2.346 1.00 0.00 O ATOM 300 C5' G A 10 -8.121 -5.223 1.670 1.00 0.00 C ATOM 301 C4' G A 10 -8.304 -5.059 0.147 1.00 0.00 C ATOM 302 O4' G A 10 -7.442 -3.999 -0.276 1.00 0.00 O ATOM 303 C3' G A 10 -7.967 -6.248 -0.770 1.00 0.00 C ATOM 304 O3' G A 10 -9.133 -7.040 -1.032 1.00 0.00 O ATOM 305 C2' G A 10 -7.456 -5.526 -2.036 1.00 0.00 C ATOM 306 O2' G A 10 -8.552 -5.168 -2.870 1.00 0.00 O ATOM 307 C1' G A 10 -6.781 -4.259 -1.513 1.00 0.00 C ATOM 308 N9 G A 10 -5.301 -4.393 -1.270 1.00 0.00 N ATOM 309 C8 G A 10 -4.644 -4.949 -0.185 1.00 0.00 C ATOM 310 N7 G A 10 -3.278 -5.100 -0.158 1.00 0.00 N ATOM 311 C5 G A 10 -3.021 -4.537 -1.387 1.00 0.00 C ATOM 312 C6 G A 10 -1.624 -4.362 -2.018 1.00 0.00 C ATOM 313 O6 G A 10 -0.602 -4.771 -1.470 1.00 0.00 O ATOM 314 N1 G A 10 -1.613 -3.725 -3.225 1.00 0.00 N ATOM 315 C2 G A 10 -2.858 -3.217 -3.859 1.00 0.00 C ATOM 316 N2 G A 10 -2.769 -2.484 -5.058 1.00 0.00 N ATOM 317 N3 G A 10 -4.024 -3.416 -3.327 1.00 0.00 N ATOM 318 C4 G A 10 -4.203 -4.081 -2.065 1.00 0.00 C ATOM 0 H5' G A 10 -8.685 -6.086 2.023 1.00 0.00 H new ATOM 0 H5'' G A 10 -7.073 -5.411 1.902 1.00 0.00 H new ATOM 0 H4' G A 10 -9.377 -4.902 0.038 1.00 0.00 H new ATOM 0 H3' G A 10 -7.248 -6.953 -0.353 1.00 0.00 H new ATOM 0 H2' G A 10 -6.784 -6.151 -2.623 1.00 0.00 H new ATOM 0 HO2' G A 10 -9.361 -5.628 -2.562 1.00 0.00 H new ATOM 0 H1' G A 10 -6.865 -3.464 -2.254 1.00 0.00 H new ATOM 0 H8 G A 10 -5.223 -5.274 0.667 1.00 0.00 H new ATOM 0 H1 G A 10 -0.724 -3.593 -3.707 1.00 0.00 H new ATOM 0 H21 G A 10 -3.616 -2.130 -5.503 1.00 0.00 H new ATOM 0 H22 G A 10 -1.858 -2.307 -5.481 1.00 0.00 H new ATOM 330 P G A 11 -9.025 -8.594 -1.473 1.00 0.00 P ATOM 331 OP1 G A 11 -10.427 -9.205 -1.546 1.00 0.00 O ATOM 332 OP2 G A 11 -8.190 -9.356 -0.441 1.00 0.00 O ATOM 333 O5' G A 11 -8.317 -8.696 -2.918 1.00 0.00 O ATOM 334 C5' G A 11 -8.992 -8.254 -4.099 1.00 0.00 C ATOM 335 C4' G A 11 -7.985 -8.038 -5.236 1.00 0.00 C ATOM 336 O4' G A 11 -6.987 -7.102 -4.814 1.00 0.00 O ATOM 337 C3' G A 11 -7.226 -9.285 -5.712 1.00 0.00 C ATOM 338 O3' G A 11 -7.969 -9.978 -6.722 1.00 0.00 O ATOM 339 C2' G A 11 -5.932 -8.683 -6.263 1.00 0.00 C ATOM 340 O2' G A 11 -6.124 -8.301 -7.621 1.00 0.00 O ATOM 341 C1' G A 11 -5.713 -7.420 -5.404 1.00 0.00 C ATOM 342 N9 G A 11 -4.691 -7.607 -4.328 1.00 0.00 N ATOM 343 C8 G A 11 -4.849 -8.002 -3.011 1.00 0.00 C ATOM 344 N7 G A 11 -3.783 -8.116 -2.151 1.00 0.00 N ATOM 345 C5 G A 11 -2.802 -7.780 -3.054 1.00 0.00 C ATOM 346 C6 G A 11 -1.301 -7.638 -2.740 1.00 0.00 C ATOM 347 O6 G A 11 -0.814 -7.810 -1.620 1.00 0.00 O ATOM 348 N1 G A 11 -0.543 -7.283 -3.808 1.00 0.00 N ATOM 349 C2 G A 11 -1.085 -7.021 -5.151 1.00 0.00 C ATOM 350 N2 G A 11 -0.195 -6.644 -6.178 1.00 0.00 N ATOM 351 N3 G A 11 -2.353 -7.127 -5.391 1.00 0.00 N ATOM 352 C4 G A 11 -3.307 -7.504 -4.374 1.00 0.00 C ATOM 0 H5' G A 11 -9.526 -7.326 -3.895 1.00 0.00 H new ATOM 0 H5'' G A 11 -9.737 -8.991 -4.398 1.00 0.00 H new ATOM 0 H4' G A 11 -8.599 -7.695 -6.069 1.00 0.00 H new ATOM 0 H3' G A 11 -7.054 -10.029 -4.934 1.00 0.00 H new ATOM 0 H2' G A 11 -5.092 -9.377 -6.226 1.00 0.00 H new ATOM 0 HO2' G A 11 -6.957 -8.693 -7.956 1.00 0.00 H new ATOM 0 H1' G A 11 -5.332 -6.619 -6.038 1.00 0.00 H new ATOM 0 H8 G A 11 -5.841 -8.228 -2.648 1.00 0.00 H new ATOM 0 H1 G A 11 0.464 -7.192 -3.672 1.00 0.00 H new ATOM 0 H21 G A 11 -0.549 -6.458 -7.116 1.00 0.00 H new ATOM 0 H22 G A 11 0.802 -6.558 -5.982 1.00 0.00 H new ATOM 364 P U A 12 -7.794 -11.568 -6.952 1.00 0.00 P ATOM 365 OP1 U A 12 -8.750 -12.038 -8.053 1.00 0.00 O ATOM 366 OP2 U A 12 -8.119 -12.305 -5.651 1.00 0.00 O ATOM 367 O5' U A 12 -6.273 -11.884 -7.378 1.00 0.00 O ATOM 368 C5' U A 12 -5.789 -11.530 -8.677 1.00 0.00 C ATOM 369 C4' U A 12 -4.258 -11.641 -8.747 1.00 0.00 C ATOM 370 O4' U A 12 -3.653 -10.719 -7.831 1.00 0.00 O ATOM 371 C3' U A 12 -3.669 -13.022 -8.415 1.00 0.00 C ATOM 372 O3' U A 12 -3.684 -13.878 -9.566 1.00 0.00 O ATOM 373 C2' U A 12 -2.254 -12.669 -7.963 1.00 0.00 C ATOM 374 O2' U A 12 -1.394 -12.595 -9.096 1.00 0.00 O ATOM 375 C1' U A 12 -2.414 -11.270 -7.329 1.00 0.00 C ATOM 376 N1 U A 12 -2.393 -11.267 -5.825 1.00 0.00 N ATOM 377 C2 U A 12 -1.197 -11.117 -5.116 1.00 0.00 C ATOM 378 O2 U A 12 -0.100 -10.969 -5.665 1.00 0.00 O ATOM 379 N3 U A 12 -1.196 -11.134 -3.752 1.00 0.00 N ATOM 380 C4 U A 12 -2.303 -11.289 -2.973 1.00 0.00 C ATOM 381 O4 U A 12 -2.224 -11.301 -1.745 1.00 0.00 O ATOM 382 C5 U A 12 -3.648 -11.449 -3.712 1.00 0.00 C ATOM 383 C6 U A 12 -3.662 -11.432 -5.064 1.00 0.00 C ATOM 0 H5' U A 12 -6.094 -10.511 -8.917 1.00 0.00 H new ATOM 0 H5'' U A 12 -6.238 -12.182 -9.426 1.00 0.00 H new ATOM 0 H4' U A 12 -4.036 -11.429 -9.793 1.00 0.00 H new ATOM 0 H3' U A 12 -4.226 -13.578 -7.661 1.00 0.00 H new ATOM 0 H2' U A 12 -1.825 -13.400 -7.278 1.00 0.00 H new ATOM 0 HO2' U A 12 -1.881 -12.883 -9.896 1.00 0.00 H new ATOM 0 H1' U A 12 -1.554 -10.662 -7.611 1.00 0.00 H new ATOM 0 H3 U A 12 -0.299 -11.022 -3.280 1.00 0.00 H new ATOM 0 H5 U A 12 -4.566 -11.573 -3.157 1.00 0.00 H new ATOM 0 H6 U A 12 -4.597 -11.538 -5.594 1.00 0.00 H new ATOM 394 P C A 13 -3.652 -15.491 -9.424 1.00 0.00 P ATOM 395 OP1 C A 13 -3.838 -16.134 -10.801 1.00 0.00 O ATOM 396 OP2 C A 13 -4.784 -15.939 -8.497 1.00 0.00 O ATOM 397 O5' C A 13 -2.236 -15.941 -8.798 1.00 0.00 O ATOM 398 C5' C A 13 -1.039 -15.838 -9.575 1.00 0.00 C ATOM 399 C4' C A 13 0.215 -16.065 -8.715 1.00 0.00 C ATOM 400 O4' C A 13 0.320 -15.060 -7.701 1.00 0.00 O ATOM 401 C3' C A 13 0.284 -17.404 -7.970 1.00 0.00 C ATOM 402 O3' C A 13 0.773 -18.442 -8.815 1.00 0.00 O ATOM 403 C2' C A 13 1.250 -17.106 -6.831 1.00 0.00 C ATOM 404 O2' C A 13 2.587 -17.329 -7.266 1.00 0.00 O ATOM 405 C1' C A 13 1.032 -15.599 -6.563 1.00 0.00 C ATOM 406 N1 C A 13 0.296 -15.308 -5.290 1.00 0.00 N ATOM 407 C2 C A 13 0.957 -15.080 -4.087 1.00 0.00 C ATOM 408 O2 C A 13 2.190 -15.110 -3.998 1.00 0.00 O ATOM 409 N3 C A 13 0.135 -14.803 -2.909 1.00 0.00 N ATOM 410 C4 C A 13 -1.158 -14.761 -2.944 1.00 0.00 C ATOM 411 N4 C A 13 -1.859 -14.484 -1.747 1.00 0.00 N ATOM 412 C5 C A 13 -1.842 -14.976 -4.102 1.00 0.00 C ATOM 413 C6 C A 13 -1.187 -15.242 -5.261 1.00 0.00 C ATOM 0 H5' C A 13 -0.989 -14.853 -10.039 1.00 0.00 H new ATOM 0 H5'' C A 13 -1.065 -16.570 -10.382 1.00 0.00 H new ATOM 0 H4' C A 13 1.021 -16.038 -9.448 1.00 0.00 H new ATOM 0 H3' C A 13 -0.687 -17.758 -7.625 1.00 0.00 H new ATOM 0 H2' C A 13 1.086 -17.728 -5.951 1.00 0.00 H new ATOM 0 HO2' C A 13 2.594 -18.020 -7.961 1.00 0.00 H new ATOM 0 HO3' C A 13 0.808 -19.283 -8.313 1.00 0.00 H new ATOM 0 H1' C A 13 2.006 -15.127 -6.435 1.00 0.00 H new ATOM 0 H41 C A 13 -2.878 -14.446 -1.750 1.00 0.00 H new ATOM 0 H42 C A 13 -1.345 -14.323 -0.881 1.00 0.00 H new ATOM 0 H5 C A 13 -2.921 -14.934 -4.098 1.00 0.00 H new ATOM 0 H6 C A 13 -1.749 -15.407 -6.169 1.00 0.00 H new TER 425 C A 13