USER MOD reduce.3.24.130724 H: found=0, std=0, add=176, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 176 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 180:sc= -0.416 USER MOD Single : A 1 G O5' : rot 24:sc= 0.354 USER MOD Single : A 2 A O2' : rot 180:sc= -0.213 USER MOD Single : A 3 G O2' : rot 180:sc= -0.331 USER MOD Single : A 4 G O2' : rot -28:sc= -0.319 USER MOD Single : A 5 U O2' : rot 180:sc= -0.311 USER MOD Single : A 6 C O2' : rot 180:sc= -0.364 USER MOD Single : A 7 U O2' : rot 180:sc= -0.432 USER MOD Single : A 8 C O2' : rot -18:sc= 0.131 USER MOD Single : A 8 C O3' : rot 180:sc= 0.146 USER MOD Single : B 9 G O2' : rot 180:sc= -0.41 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 A O2' : rot 180:sc= -0.201 USER MOD Single : B 11 G O2' : rot 180:sc= -0.374 USER MOD Single : B 12 G O2' : rot -21:sc= -0.233 USER MOD Single : B 13 U O2' : rot 180:sc= -0.309 USER MOD Single : B 14 C O2' : rot 180:sc= -0.373 USER MOD Single : B 15 U O2' : rot 180:sc= -0.426 USER MOD Single : B 16 C O2' : rot -19:sc= 0.134 USER MOD Single : B 16 C O3' : rot 180:sc= 0.127 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 6.963 -9.673 5.270 1.00 0.00 O ATOM 2 C5' G A 1 6.616 -9.160 4.003 1.00 0.00 C ATOM 3 C4' G A 1 7.475 -7.934 3.687 1.00 0.00 C ATOM 4 O4' G A 1 7.121 -7.372 2.424 1.00 0.00 O ATOM 5 C3' G A 1 7.269 -6.813 4.687 1.00 0.00 C ATOM 6 O3' G A 1 7.969 -7.025 5.898 1.00 0.00 O ATOM 7 C2' G A 1 7.836 -5.660 3.901 1.00 0.00 C ATOM 8 O2' G A 1 9.246 -5.733 3.889 1.00 0.00 O ATOM 9 C1' G A 1 7.322 -5.954 2.499 1.00 0.00 C ATOM 10 N9 G A 1 6.039 -5.255 2.295 1.00 0.00 N ATOM 11 C8 G A 1 4.766 -5.718 2.493 1.00 0.00 C ATOM 12 N7 G A 1 3.836 -4.845 2.219 1.00 0.00 N ATOM 13 C5 G A 1 4.545 -3.717 1.819 1.00 0.00 C ATOM 14 C6 G A 1 4.073 -2.436 1.407 1.00 0.00 C ATOM 15 O6 G A 1 2.912 -2.052 1.297 1.00 0.00 O ATOM 16 N1 G A 1 5.124 -1.574 1.112 1.00 0.00 N ATOM 17 C2 G A 1 6.461 -1.899 1.198 1.00 0.00 C ATOM 18 N2 G A 1 7.336 -0.939 0.882 1.00 0.00 N ATOM 19 N3 G A 1 6.907 -3.101 1.577 1.00 0.00 N ATOM 20 C4 G A 1 5.897 -3.957 1.873 1.00 0.00 C ATOM 0 H5' G A 1 5.560 -8.890 3.987 1.00 0.00 H new ATOM 0 H5'' G A 1 6.761 -9.924 3.239 1.00 0.00 H new ATOM 0 H4' G A 1 8.503 -8.295 3.708 1.00 0.00 H new ATOM 0 H3' G A 1 6.239 -6.686 5.020 1.00 0.00 H new ATOM 0 H2' G A 1 7.561 -4.682 4.296 1.00 0.00 H new ATOM 0 HO2' G A 1 9.608 -4.981 3.375 1.00 0.00 H new ATOM 0 HO5' G A 1 7.363 -8.962 5.813 1.00 0.00 H new ATOM 0 H1' G A 1 8.024 -5.618 1.736 1.00 0.00 H new ATOM 0 H8 G A 1 4.551 -6.716 2.844 1.00 0.00 H new ATOM 0 H1 G A 1 4.887 -0.629 0.809 1.00 0.00 H new ATOM 0 H21 G A 1 8.338 -1.126 0.929 1.00 0.00 H new ATOM 0 H22 G A 1 7.002 -0.019 0.594 1.00 0.00 H new ATOM 33 P A A 2 7.646 -6.133 7.206 1.00 0.00 P ATOM 34 OP1 A A 2 8.567 -6.549 8.286 1.00 0.00 O ATOM 35 OP2 A A 2 6.184 -6.174 7.432 1.00 0.00 O ATOM 36 O5' A A 2 8.038 -4.635 6.760 1.00 0.00 O ATOM 37 C5' A A 2 9.389 -4.230 6.673 1.00 0.00 C ATOM 38 C4' A A 2 9.448 -2.771 6.213 1.00 0.00 C ATOM 39 O4' A A 2 8.796 -2.595 4.960 1.00 0.00 O ATOM 40 C3' A A 2 8.721 -1.845 7.163 1.00 0.00 C ATOM 41 O3' A A 2 9.480 -1.572 8.329 1.00 0.00 O ATOM 42 C2' A A 2 8.551 -0.631 6.288 1.00 0.00 C ATOM 43 O2' A A 2 9.770 0.079 6.206 1.00 0.00 O ATOM 44 C1' A A 2 8.256 -1.265 4.929 1.00 0.00 C ATOM 45 N9 A A 2 6.794 -1.309 4.696 1.00 0.00 N ATOM 46 C8 A A 2 5.920 -2.357 4.854 1.00 0.00 C ATOM 47 N7 A A 2 4.682 -2.062 4.565 1.00 0.00 N ATOM 48 C5 A A 2 4.737 -0.724 4.187 1.00 0.00 C ATOM 49 C6 A A 2 3.753 0.190 3.760 1.00 0.00 C ATOM 50 N6 A A 2 2.458 -0.126 3.641 1.00 0.00 N ATOM 51 N1 A A 2 4.149 1.441 3.460 1.00 0.00 N ATOM 52 C2 A A 2 5.437 1.756 3.578 1.00 0.00 C ATOM 53 N3 A A 2 6.451 0.993 3.967 1.00 0.00 N ATOM 54 C4 A A 2 6.021 -0.257 4.261 1.00 0.00 C ATOM 0 H5' A A 2 9.928 -4.867 5.972 1.00 0.00 H new ATOM 0 H5'' A A 2 9.877 -4.339 7.642 1.00 0.00 H new ATOM 0 H4' A A 2 10.511 -2.535 6.161 1.00 0.00 H new ATOM 0 H3' A A 2 7.789 -2.244 7.562 1.00 0.00 H new ATOM 0 H2' A A 2 7.792 0.066 6.643 1.00 0.00 H new ATOM 0 HO2' A A 2 9.652 0.866 5.635 1.00 0.00 H new ATOM 0 H1' A A 2 8.704 -0.685 4.122 1.00 0.00 H new ATOM 0 H8 A A 2 6.229 -3.337 5.187 1.00 0.00 H new ATOM 0 H61 A A 2 1.788 0.576 3.327 1.00 0.00 H new ATOM 0 H62 A A 2 2.141 -1.069 3.864 1.00 0.00 H new ATOM 0 H2 A A 2 5.692 2.774 3.322 1.00 0.00 H new ATOM 66 P G A 3 8.791 -0.918 9.637 1.00 0.00 P ATOM 67 OP1 G A 3 9.838 -0.739 10.667 1.00 0.00 O ATOM 68 OP2 G A 3 7.579 -1.704 9.953 1.00 0.00 O ATOM 69 O5' G A 3 8.323 0.539 9.143 1.00 0.00 O ATOM 70 C5' G A 3 9.252 1.592 8.980 1.00 0.00 C ATOM 71 C4' G A 3 8.507 2.823 8.464 1.00 0.00 C ATOM 72 O4' G A 3 7.857 2.535 7.233 1.00 0.00 O ATOM 73 C3' G A 3 7.411 3.264 9.396 1.00 0.00 C ATOM 74 O3' G A 3 7.915 3.985 10.510 1.00 0.00 O ATOM 75 C2' G A 3 6.626 4.151 8.456 1.00 0.00 C ATOM 76 O2' G A 3 7.264 5.404 8.325 1.00 0.00 O ATOM 77 C1' G A 3 6.735 3.410 7.127 1.00 0.00 C ATOM 78 N9 G A 3 5.493 2.648 6.904 1.00 0.00 N ATOM 79 C8 G A 3 5.237 1.315 7.105 1.00 0.00 C ATOM 80 N7 G A 3 4.002 0.972 6.856 1.00 0.00 N ATOM 81 C5 G A 3 3.397 2.164 6.467 1.00 0.00 C ATOM 82 C6 G A 3 2.049 2.430 6.080 1.00 0.00 C ATOM 83 O6 G A 3 1.111 1.642 5.991 1.00 0.00 O ATOM 84 N1 G A 3 1.860 3.775 5.782 1.00 0.00 N ATOM 85 C2 G A 3 2.840 4.743 5.837 1.00 0.00 C ATOM 86 N2 G A 3 2.483 5.987 5.507 1.00 0.00 N ATOM 87 N3 G A 3 4.101 4.496 6.193 1.00 0.00 N ATOM 88 C4 G A 3 4.306 3.192 6.495 1.00 0.00 C ATOM 0 H5' G A 3 10.034 1.301 8.279 1.00 0.00 H new ATOM 0 H5'' G A 3 9.741 1.815 9.928 1.00 0.00 H new ATOM 0 H4' G A 3 9.265 3.600 8.365 1.00 0.00 H new ATOM 0 H3' G A 3 6.842 2.456 9.856 1.00 0.00 H new ATOM 0 H2' G A 3 5.605 4.332 8.791 1.00 0.00 H new ATOM 0 HO2' G A 3 6.749 5.971 7.714 1.00 0.00 H new ATOM 0 H1' G A 3 6.870 4.092 6.287 1.00 0.00 H new ATOM 0 H8 G A 3 5.988 0.614 7.438 1.00 0.00 H new ATOM 0 H1 G A 3 0.924 4.068 5.501 1.00 0.00 H new ATOM 0 H21 G A 3 3.172 6.739 5.532 1.00 0.00 H new ATOM 0 H22 G A 3 1.521 6.185 5.230 1.00 0.00 H new ATOM 100 P G A 4 6.928 4.515 11.679 1.00 0.00 P ATOM 101 OP1 G A 4 7.767 4.984 12.805 1.00 0.00 O ATOM 102 OP2 G A 4 5.903 3.474 11.914 1.00 0.00 O ATOM 103 O5' G A 4 6.192 5.805 11.036 1.00 0.00 O ATOM 104 C5' G A 4 6.884 7.029 10.858 1.00 0.00 C ATOM 105 C4' G A 4 5.911 8.111 10.365 1.00 0.00 C ATOM 106 O4' G A 4 5.308 7.748 9.120 1.00 0.00 O ATOM 107 C3' G A 4 4.765 8.326 11.336 1.00 0.00 C ATOM 108 O3' G A 4 5.123 9.197 12.392 1.00 0.00 O ATOM 109 C2' G A 4 3.743 8.963 10.426 1.00 0.00 C ATOM 110 O2' G A 4 4.085 10.315 10.195 1.00 0.00 O ATOM 111 C1' G A 4 3.939 8.188 9.134 1.00 0.00 C ATOM 112 N9 G A 4 3.046 7.015 9.090 1.00 0.00 N ATOM 113 C8 G A 4 3.370 5.697 9.238 1.00 0.00 C ATOM 114 N7 G A 4 2.364 4.880 9.091 1.00 0.00 N ATOM 115 C5 G A 4 1.287 5.722 8.827 1.00 0.00 C ATOM 116 C6 G A 4 -0.082 5.408 8.576 1.00 0.00 C ATOM 117 O6 G A 4 -0.613 4.302 8.530 1.00 0.00 O ATOM 118 N1 G A 4 -0.843 6.554 8.375 1.00 0.00 N ATOM 119 C2 G A 4 -0.350 7.841 8.391 1.00 0.00 C ATOM 120 N2 G A 4 -1.233 8.823 8.177 1.00 0.00 N ATOM 121 N3 G A 4 0.936 8.140 8.615 1.00 0.00 N ATOM 122 C4 G A 4 1.695 7.034 8.828 1.00 0.00 C ATOM 0 H5' G A 4 7.692 6.899 10.138 1.00 0.00 H new ATOM 0 H5'' G A 4 7.341 7.339 11.798 1.00 0.00 H new ATOM 0 H4' G A 4 6.513 9.014 10.265 1.00 0.00 H new ATOM 0 H3' G A 4 4.430 7.419 11.839 1.00 0.00 H new ATOM 0 H2' G A 4 2.728 8.939 10.824 1.00 0.00 H new ATOM 0 HO2' G A 4 4.592 10.659 10.960 1.00 0.00 H new ATOM 0 H1' G A 4 3.708 8.816 8.273 1.00 0.00 H new ATOM 0 H8 G A 4 4.372 5.360 9.458 1.00 0.00 H new ATOM 0 H1 G A 4 -1.841 6.433 8.203 1.00 0.00 H new ATOM 0 H21 G A 4 -0.925 9.795 8.178 1.00 0.00 H new ATOM 0 H22 G A 4 -2.215 8.599 8.013 1.00 0.00 H new ATOM 134 P U A 5 4.298 9.200 13.778 1.00 0.00 P ATOM 135 OP1 U A 5 4.721 10.380 14.564 1.00 0.00 O ATOM 136 OP2 U A 5 4.406 7.849 14.369 1.00 0.00 O ATOM 137 O5' U A 5 2.768 9.419 13.322 1.00 0.00 O ATOM 138 C5' U A 5 2.287 10.684 12.924 1.00 0.00 C ATOM 139 C4' U A 5 0.786 10.587 12.609 1.00 0.00 C ATOM 140 O4' U A 5 0.494 9.820 11.433 1.00 0.00 O ATOM 141 C3' U A 5 0.004 9.953 13.726 1.00 0.00 C ATOM 142 O3' U A 5 -0.218 10.845 14.802 1.00 0.00 O ATOM 143 C2' U A 5 -1.266 9.638 12.980 1.00 0.00 C ATOM 144 O2' U A 5 -2.015 10.815 12.750 1.00 0.00 O ATOM 145 C1' U A 5 -0.745 9.118 11.663 1.00 0.00 C ATOM 146 N1 U A 5 -0.474 7.664 11.743 1.00 0.00 N ATOM 147 C2 U A 5 -1.507 6.775 11.462 1.00 0.00 C ATOM 148 O2 U A 5 -2.649 7.149 11.196 1.00 0.00 O ATOM 149 N3 U A 5 -1.176 5.429 11.497 1.00 0.00 N ATOM 150 C4 U A 5 0.074 4.904 11.786 1.00 0.00 C ATOM 151 O4 U A 5 0.257 3.690 11.788 1.00 0.00 O ATOM 152 C5 U A 5 1.081 5.902 12.065 1.00 0.00 C ATOM 153 C6 U A 5 0.778 7.220 12.033 1.00 0.00 C ATOM 0 H5' U A 5 2.832 11.032 12.046 1.00 0.00 H new ATOM 0 H5'' U A 5 2.457 11.415 13.715 1.00 0.00 H new ATOM 0 H4' U A 5 0.492 11.626 12.460 1.00 0.00 H new ATOM 0 H3' U A 5 0.488 9.103 14.208 1.00 0.00 H new ATOM 0 H2' U A 5 -1.918 8.948 13.515 1.00 0.00 H new ATOM 0 HO2' U A 5 -2.835 10.591 12.263 1.00 0.00 H new ATOM 0 H1' U A 5 -1.470 9.274 10.864 1.00 0.00 H new ATOM 0 H3 U A 5 -1.921 4.764 11.291 1.00 0.00 H new ATOM 0 H5 U A 5 2.088 5.592 12.302 1.00 0.00 H new ATOM 0 H6 U A 5 1.554 7.941 12.244 1.00 0.00 H new ATOM 164 P C A 6 -0.685 10.295 16.245 1.00 0.00 P ATOM 165 OP1 C A 6 -0.965 11.458 17.115 1.00 0.00 O ATOM 166 OP2 C A 6 0.291 9.270 16.678 1.00 0.00 O ATOM 167 O5' C A 6 -2.075 9.554 15.930 1.00 0.00 O ATOM 168 C5' C A 6 -3.252 10.290 15.684 1.00 0.00 C ATOM 169 C4' C A 6 -4.383 9.324 15.331 1.00 0.00 C ATOM 170 O4' C A 6 -4.088 8.573 14.154 1.00 0.00 O ATOM 171 C3' C A 6 -4.619 8.292 16.413 1.00 0.00 C ATOM 172 O3' C A 6 -5.336 8.809 17.516 1.00 0.00 O ATOM 173 C2' C A 6 -5.428 7.291 15.631 1.00 0.00 C ATOM 174 O2' C A 6 -6.737 7.782 15.433 1.00 0.00 O ATOM 175 C1' C A 6 -4.703 7.283 14.290 1.00 0.00 C ATOM 176 N1 C A 6 -3.678 6.210 14.283 1.00 0.00 N ATOM 177 C2 C A 6 -4.130 4.914 14.088 1.00 0.00 C ATOM 178 O2 C A 6 -5.323 4.701 13.890 1.00 0.00 O ATOM 179 N3 C A 6 -3.224 3.899 14.127 1.00 0.00 N ATOM 180 C4 C A 6 -1.927 4.143 14.355 1.00 0.00 C ATOM 181 N4 C A 6 -1.074 3.115 14.393 1.00 0.00 N ATOM 182 C5 C A 6 -1.442 5.478 14.550 1.00 0.00 C ATOM 183 C6 C A 6 -2.352 6.475 14.498 1.00 0.00 C ATOM 0 H5' C A 6 -3.091 10.994 14.868 1.00 0.00 H new ATOM 0 H5'' C A 6 -3.519 10.876 16.563 1.00 0.00 H new ATOM 0 H4' C A 6 -5.257 9.961 15.197 1.00 0.00 H new ATOM 0 H3' C A 6 -3.713 7.902 16.876 1.00 0.00 H new ATOM 0 H2' C A 6 -5.511 6.318 16.115 1.00 0.00 H new ATOM 0 HO2' C A 6 -7.258 7.127 14.923 1.00 0.00 H new ATOM 0 H1' C A 6 -5.386 7.091 13.462 1.00 0.00 H new ATOM 0 H41 C A 6 -0.082 3.281 14.565 1.00 0.00 H new ATOM 0 H42 C A 6 -1.415 2.164 14.250 1.00 0.00 H new ATOM 0 H5 C A 6 -0.396 5.678 14.730 1.00 0.00 H new ATOM 0 H6 C A 6 -2.029 7.497 14.628 1.00 0.00 H new ATOM 195 P U A 7 -5.396 7.999 18.912 1.00 0.00 P ATOM 196 OP1 U A 7 -6.254 8.760 19.848 1.00 0.00 O ATOM 197 OP2 U A 7 -4.009 7.661 19.300 1.00 0.00 O ATOM 198 O5' U A 7 -6.156 6.627 18.539 1.00 0.00 O ATOM 199 C5' U A 7 -7.552 6.601 18.323 1.00 0.00 C ATOM 200 C4' U A 7 -8.004 5.160 18.075 1.00 0.00 C ATOM 201 O4' U A 7 -7.367 4.588 16.927 1.00 0.00 O ATOM 202 C3' U A 7 -7.633 4.241 19.220 1.00 0.00 C ATOM 203 O3' U A 7 -8.481 4.383 20.344 1.00 0.00 O ATOM 204 C2' U A 7 -7.820 2.914 18.541 1.00 0.00 C ATOM 205 O2' U A 7 -9.198 2.637 18.408 1.00 0.00 O ATOM 206 C1' U A 7 -7.246 3.170 17.157 1.00 0.00 C ATOM 207 N1 U A 7 -5.824 2.736 17.090 1.00 0.00 N ATOM 208 C2 U A 7 -5.585 1.373 16.961 1.00 0.00 C ATOM 209 O2 U A 7 -6.498 0.550 16.924 1.00 0.00 O ATOM 210 N3 U A 7 -4.260 0.987 16.872 1.00 0.00 N ATOM 211 C4 U A 7 -3.162 1.828 16.904 1.00 0.00 C ATOM 212 O4 U A 7 -2.024 1.371 16.828 1.00 0.00 O ATOM 213 C5 U A 7 -3.496 3.232 17.027 1.00 0.00 C ATOM 214 C6 U A 7 -4.787 3.637 17.112 1.00 0.00 C ATOM 0 H5' U A 7 -7.810 7.226 17.468 1.00 0.00 H new ATOM 0 H5'' U A 7 -8.072 7.013 19.188 1.00 0.00 H new ATOM 0 H4' U A 7 -9.084 5.231 17.947 1.00 0.00 H new ATOM 0 H3' U A 7 -6.644 4.421 19.642 1.00 0.00 H new ATOM 0 H2' U A 7 -7.360 2.084 19.077 1.00 0.00 H new ATOM 0 HO2' U A 7 -9.316 1.771 17.964 1.00 0.00 H new ATOM 0 H1' U A 7 -7.780 2.604 16.394 1.00 0.00 H new ATOM 0 H3 U A 7 -4.075 -0.011 16.774 1.00 0.00 H new ATOM 0 H5 U A 7 -2.705 3.967 17.051 1.00 0.00 H new ATOM 0 H6 U A 7 -5.005 4.691 17.199 1.00 0.00 H new ATOM 225 P C A 8 -8.113 3.669 21.749 1.00 0.00 P ATOM 226 OP1 C A 8 -9.185 3.983 22.720 1.00 0.00 O ATOM 227 OP2 C A 8 -6.709 4.003 22.074 1.00 0.00 O ATOM 228 O5' C A 8 -8.184 2.089 21.420 1.00 0.00 O ATOM 229 C5' C A 8 -9.425 1.427 21.288 1.00 0.00 C ATOM 230 C4' C A 8 -9.189 -0.059 20.997 1.00 0.00 C ATOM 231 O4' C A 8 -8.436 -0.254 19.805 1.00 0.00 O ATOM 232 C3' C A 8 -8.375 -0.739 22.075 1.00 0.00 C ATOM 233 O3' C A 8 -9.129 -1.006 23.238 1.00 0.00 O ATOM 234 C2' C A 8 -7.983 -2.001 21.364 1.00 0.00 C ATOM 235 O2' C A 8 -9.082 -2.888 21.332 1.00 0.00 O ATOM 236 C1' C A 8 -7.703 -1.485 19.952 1.00 0.00 C ATOM 237 N1 C A 8 -6.242 -1.250 19.790 1.00 0.00 N ATOM 238 C2 C A 8 -5.434 -2.360 19.570 1.00 0.00 C ATOM 239 O2 C A 8 -5.930 -3.481 19.491 1.00 0.00 O ATOM 240 N3 C A 8 -4.089 -2.167 19.449 1.00 0.00 N ATOM 241 C4 C A 8 -3.559 -0.939 19.542 1.00 0.00 C ATOM 242 N4 C A 8 -2.237 -0.792 19.406 1.00 0.00 N ATOM 243 C5 C A 8 -4.379 0.211 19.776 1.00 0.00 C ATOM 244 C6 C A 8 -5.707 0.004 19.890 1.00 0.00 C ATOM 0 H5' C A 8 -10.005 1.878 20.482 1.00 0.00 H new ATOM 0 H5'' C A 8 -10.008 1.540 22.202 1.00 0.00 H new ATOM 0 H4' C A 8 -10.192 -0.480 20.925 1.00 0.00 H new ATOM 0 H3' C A 8 -7.542 -0.143 22.447 1.00 0.00 H new ATOM 0 H2' C A 8 -7.151 -2.536 21.823 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.740 -2.618 22.007 1.00 0.00 H new ATOM 0 HO3' C A 8 -8.560 -1.447 23.903 1.00 0.00 H new ATOM 0 H1' C A 8 -8.011 -2.204 19.193 1.00 0.00 H new ATOM 0 H41 C A 8 -1.817 0.135 19.474 1.00 0.00 H new ATOM 0 H42 C A 8 -1.648 -1.607 19.234 1.00 0.00 H new ATOM 0 H5 C A 8 -3.953 1.200 19.858 1.00 0.00 H new ATOM 0 H6 C A 8 -6.361 0.846 20.064 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.463 -11.242 17.653 1.00 0.00 O ATOM 259 C5' G B 9 2.850 -10.467 16.647 1.00 0.00 C ATOM 260 C4' G B 9 1.355 -10.339 16.938 1.00 0.00 C ATOM 261 O4' G B 9 1.122 -9.599 18.136 1.00 0.00 O ATOM 262 C3' G B 9 0.634 -9.564 15.855 1.00 0.00 C ATOM 263 O3' G B 9 0.389 -10.342 14.699 1.00 0.00 O ATOM 264 C2' G B 9 -0.636 -9.217 16.588 1.00 0.00 C ATOM 265 O2' G B 9 -1.464 -10.356 16.679 1.00 0.00 O ATOM 266 C1' G B 9 -0.112 -8.883 17.977 1.00 0.00 C ATOM 267 N9 G B 9 0.138 -7.432 18.066 1.00 0.00 N ATOM 268 C8 G B 9 1.299 -6.743 17.839 1.00 0.00 C ATOM 269 N7 G B 9 1.192 -5.454 18.003 1.00 0.00 N ATOM 270 C5 G B 9 -0.141 -5.273 18.357 1.00 0.00 C ATOM 271 C6 G B 9 -0.856 -4.076 18.654 1.00 0.00 C ATOM 272 O6 G B 9 -0.434 -2.922 18.678 1.00 0.00 O ATOM 273 N1 G B 9 -2.193 -4.335 18.937 1.00 0.00 N ATOM 274 C2 G B 9 -2.772 -5.586 18.942 1.00 0.00 C ATOM 275 N2 G B 9 -4.075 -5.646 19.231 1.00 0.00 N ATOM 276 N3 G B 9 -2.103 -6.711 18.672 1.00 0.00 N ATOM 277 C4 G B 9 -0.796 -6.480 18.388 1.00 0.00 C ATOM 0 H5' G B 9 3.003 -10.931 15.673 1.00 0.00 H new ATOM 0 H5'' G B 9 3.308 -9.479 16.605 1.00 0.00 H new ATOM 0 H4' G B 9 0.988 -11.363 17.010 1.00 0.00 H new ATOM 0 H3' G B 9 1.187 -8.712 15.461 1.00 0.00 H new ATOM 0 H2' G B 9 -1.217 -8.426 16.113 1.00 0.00 H new ATOM 0 HO2' G B 9 -2.287 -10.125 17.157 1.00 0.00 H new ATOM 0 HO5' G B 9 4.421 -11.324 17.464 1.00 0.00 H new ATOM 0 H1' G B 9 -0.827 -9.160 18.752 1.00 0.00 H new ATOM 0 H8 G B 9 2.222 -7.224 17.550 1.00 0.00 H new ATOM 0 H1 G B 9 -2.791 -3.538 19.158 1.00 0.00 H new ATOM 0 H21 G B 9 -4.553 -6.547 19.248 1.00 0.00 H new ATOM 0 H22 G B 9 -4.592 -4.791 19.434 1.00 0.00 H new ATOM 290 P A B 10 -0.069 -9.645 13.316 1.00 0.00 P ATOM 291 OP1 A B 10 -0.300 -10.711 12.317 1.00 0.00 O ATOM 292 OP2 A B 10 0.888 -8.556 13.020 1.00 0.00 O ATOM 293 O5' A B 10 -1.491 -8.974 13.672 1.00 0.00 O ATOM 294 C5' A B 10 -2.657 -9.761 13.802 1.00 0.00 C ATOM 295 C4' A B 10 -3.838 -8.855 14.156 1.00 0.00 C ATOM 296 O4' A B 10 -3.592 -8.128 15.355 1.00 0.00 O ATOM 297 C3' A B 10 -4.078 -7.797 13.102 1.00 0.00 C ATOM 298 O3' A B 10 -4.741 -8.318 11.963 1.00 0.00 O ATOM 299 C2' A B 10 -4.933 -6.826 13.874 1.00 0.00 C ATOM 300 O2' A B 10 -6.256 -7.316 13.964 1.00 0.00 O ATOM 301 C1' A B 10 -4.293 -6.879 15.261 1.00 0.00 C ATOM 302 N9 A B 10 -3.351 -5.748 15.430 1.00 0.00 N ATOM 303 C8 A B 10 -1.982 -5.733 15.317 1.00 0.00 C ATOM 304 N7 A B 10 -1.447 -4.561 15.527 1.00 0.00 N ATOM 305 C5 A B 10 -2.537 -3.740 15.801 1.00 0.00 C ATOM 306 C6 A B 10 -2.647 -2.370 16.111 1.00 0.00 C ATOM 307 N6 A B 10 -1.595 -1.548 16.200 1.00 0.00 N ATOM 308 N1 A B 10 -3.881 -1.875 16.329 1.00 0.00 N ATOM 309 C2 A B 10 -4.927 -2.692 16.241 1.00 0.00 C ATOM 310 N3 A B 10 -4.955 -3.988 15.959 1.00 0.00 N ATOM 311 C4 A B 10 -3.701 -4.455 15.745 1.00 0.00 C ATOM 0 H5' A B 10 -2.517 -10.515 14.576 1.00 0.00 H new ATOM 0 H5'' A B 10 -2.857 -10.293 12.872 1.00 0.00 H new ATOM 0 H4' A B 10 -4.692 -9.526 14.249 1.00 0.00 H new ATOM 0 H3' A B 10 -3.172 -7.360 12.683 1.00 0.00 H new ATOM 0 H2' A B 10 -4.982 -5.832 13.429 1.00 0.00 H new ATOM 0 HO2' A B 10 -6.807 -6.681 14.468 1.00 0.00 H new ATOM 0 H1' A B 10 -5.050 -6.802 16.042 1.00 0.00 H new ATOM 0 H8 A B 10 -1.401 -6.611 15.076 1.00 0.00 H new ATOM 0 H61 A B 10 -1.735 -0.564 16.428 1.00 0.00 H new ATOM 0 H62 A B 10 -0.653 -1.906 16.040 1.00 0.00 H new ATOM 0 H2 A B 10 -5.889 -2.236 16.425 1.00 0.00 H new ATOM 323 P G B 11 -4.779 -7.496 10.572 1.00 0.00 P ATOM 324 OP1 G B 11 -5.564 -8.282 9.594 1.00 0.00 O ATOM 325 OP2 G B 11 -3.394 -7.094 10.245 1.00 0.00 O ATOM 326 O5' G B 11 -5.611 -6.167 10.927 1.00 0.00 O ATOM 327 C5' G B 11 -7.018 -6.196 11.063 1.00 0.00 C ATOM 328 C4' G B 11 -7.497 -4.795 11.445 1.00 0.00 C ATOM 329 O4' G B 11 -6.884 -4.369 12.654 1.00 0.00 O ATOM 330 C3' G B 11 -7.113 -3.758 10.426 1.00 0.00 C ATOM 331 O3' G B 11 -7.952 -3.793 9.282 1.00 0.00 O ATOM 332 C2' G B 11 -7.331 -2.512 11.251 1.00 0.00 C ATOM 333 O2' G B 11 -8.709 -2.213 11.314 1.00 0.00 O ATOM 334 C1' G B 11 -6.867 -2.943 12.641 1.00 0.00 C ATOM 335 N9 G B 11 -5.506 -2.430 12.871 1.00 0.00 N ATOM 336 C8 G B 11 -4.298 -3.070 12.755 1.00 0.00 C ATOM 337 N7 G B 11 -3.269 -2.300 12.982 1.00 0.00 N ATOM 338 C5 G B 11 -3.837 -1.060 13.264 1.00 0.00 C ATOM 339 C6 G B 11 -3.217 0.186 13.582 1.00 0.00 C ATOM 340 O6 G B 11 -2.019 0.437 13.691 1.00 0.00 O ATOM 341 N1 G B 11 -4.161 1.189 13.780 1.00 0.00 N ATOM 342 C2 G B 11 -5.526 1.018 13.693 1.00 0.00 C ATOM 343 N2 G B 11 -6.286 2.091 13.924 1.00 0.00 N ATOM 344 N3 G B 11 -6.107 -0.146 13.400 1.00 0.00 N ATOM 345 C4 G B 11 -5.205 -1.136 13.197 1.00 0.00 C ATOM 0 H5' G B 11 -7.310 -6.917 11.826 1.00 0.00 H new ATOM 0 H5'' G B 11 -7.482 -6.514 10.129 1.00 0.00 H new ATOM 0 H4' G B 11 -8.581 -4.874 11.528 1.00 0.00 H new ATOM 0 H3' G B 11 -6.114 -3.870 10.005 1.00 0.00 H new ATOM 0 H2' G B 11 -6.816 -1.638 10.852 1.00 0.00 H new ATOM 0 HO2' G B 11 -8.844 -1.404 11.851 1.00 0.00 H new ATOM 0 H1' G B 11 -7.511 -2.552 13.429 1.00 0.00 H new ATOM 0 H8 G B 11 -4.207 -4.115 12.499 1.00 0.00 H new ATOM 0 H1 G B 11 -3.817 2.122 14.007 1.00 0.00 H new ATOM 0 H21 G B 11 -7.302 2.017 13.872 1.00 0.00 H new ATOM 0 H22 G B 11 -5.851 2.985 14.152 1.00 0.00 H new ATOM 357 P G B 12 -7.710 -2.788 8.037 1.00 0.00 P ATOM 358 OP1 G B 12 -8.568 -3.235 6.917 1.00 0.00 O ATOM 359 OP2 G B 12 -6.250 -2.660 7.835 1.00 0.00 O ATOM 360 O5' G B 12 -8.272 -1.361 8.554 1.00 0.00 O ATOM 361 C5' G B 12 -9.664 -1.121 8.673 1.00 0.00 C ATOM 362 C4' G B 12 -9.905 0.345 9.058 1.00 0.00 C ATOM 363 O4' G B 12 -9.276 0.673 10.300 1.00 0.00 O ATOM 364 C3' G B 12 -9.321 1.300 8.033 1.00 0.00 C ATOM 365 O3' G B 12 -10.180 1.479 6.923 1.00 0.00 O ATOM 366 C2' G B 12 -9.221 2.558 8.859 1.00 0.00 C ATOM 367 O2' G B 12 -10.503 3.134 9.005 1.00 0.00 O ATOM 368 C1' G B 12 -8.779 2.019 10.210 1.00 0.00 C ATOM 369 N9 G B 12 -7.307 2.007 10.308 1.00 0.00 N ATOM 370 C8 G B 12 -6.462 0.935 10.260 1.00 0.00 C ATOM 371 N7 G B 12 -5.205 1.238 10.434 1.00 0.00 N ATOM 372 C5 G B 12 -5.217 2.619 10.608 1.00 0.00 C ATOM 373 C6 G B 12 -4.137 3.522 10.840 1.00 0.00 C ATOM 374 O6 G B 12 -2.940 3.268 10.948 1.00 0.00 O ATOM 375 N1 G B 12 -4.580 4.837 10.938 1.00 0.00 N ATOM 376 C2 G B 12 -5.896 5.236 10.847 1.00 0.00 C ATOM 377 N2 G B 12 -6.134 6.546 10.967 1.00 0.00 N ATOM 378 N3 G B 12 -6.914 4.390 10.642 1.00 0.00 N ATOM 379 C4 G B 12 -6.501 3.101 10.528 1.00 0.00 C ATOM 0 H5' G B 12 -10.093 -1.780 9.427 1.00 0.00 H new ATOM 0 H5'' G B 12 -10.164 -1.346 7.731 1.00 0.00 H new ATOM 0 H4' G B 12 -10.988 0.452 9.122 1.00 0.00 H new ATOM 0 H3' G B 12 -8.384 0.964 7.589 1.00 0.00 H new ATOM 0 H2' G B 12 -8.561 3.312 8.430 1.00 0.00 H new ATOM 0 HO2' G B 12 -11.092 2.805 8.294 1.00 0.00 H new ATOM 0 H1' G B 12 -9.162 2.645 11.016 1.00 0.00 H new ATOM 0 H8 G B 12 -6.805 -0.075 10.093 1.00 0.00 H new ATOM 0 H1 G B 12 -3.877 5.561 11.089 1.00 0.00 H new ATOM 0 H21 G B 12 -7.089 6.898 10.908 1.00 0.00 H new ATOM 0 H22 G B 12 -5.360 7.193 11.118 1.00 0.00 H new ATOM 391 P U B 13 -9.614 2.030 5.518 1.00 0.00 P ATOM 392 OP1 U B 13 -10.768 2.358 4.652 1.00 0.00 O ATOM 393 OP2 U B 13 -8.587 1.079 5.041 1.00 0.00 O ATOM 394 O5' U B 13 -8.870 3.404 5.909 1.00 0.00 O ATOM 395 C5' U B 13 -9.592 4.583 6.193 1.00 0.00 C ATOM 396 C4' U B 13 -8.609 5.732 6.470 1.00 0.00 C ATOM 397 O4' U B 13 -7.872 5.579 7.691 1.00 0.00 O ATOM 398 C3' U B 13 -7.583 5.886 5.380 1.00 0.00 C ATOM 399 O3' U B 13 -8.107 6.526 4.232 1.00 0.00 O ATOM 400 C2' U B 13 -6.588 6.750 6.108 1.00 0.00 C ATOM 401 O2' U B 13 -7.070 8.074 6.226 1.00 0.00 O ATOM 402 C1' U B 13 -6.550 6.113 7.475 1.00 0.00 C ATOM 403 N1 U B 13 -5.564 5.007 7.510 1.00 0.00 N ATOM 404 C2 U B 13 -4.240 5.301 7.820 1.00 0.00 C ATOM 405 O2 U B 13 -3.845 6.449 8.022 1.00 0.00 O ATOM 406 N3 U B 13 -3.379 4.217 7.894 1.00 0.00 N ATOM 407 C4 U B 13 -3.719 2.889 7.685 1.00 0.00 C ATOM 408 O4 U B 13 -2.873 2.005 7.777 1.00 0.00 O ATOM 409 C5 U B 13 -5.113 2.683 7.365 1.00 0.00 C ATOM 410 C6 U B 13 -5.969 3.728 7.292 1.00 0.00 C ATOM 0 H5' U B 13 -10.238 4.427 7.057 1.00 0.00 H new ATOM 0 H5'' U B 13 -10.238 4.838 5.353 1.00 0.00 H new ATOM 0 H4' U B 13 -9.256 6.607 6.532 1.00 0.00 H new ATOM 0 H3' U B 13 -7.188 4.953 4.979 1.00 0.00 H new ATOM 0 H2' U B 13 -5.622 6.809 5.607 1.00 0.00 H new ATOM 0 HO2' U B 13 -6.411 8.621 6.703 1.00 0.00 H new ATOM 0 H1' U B 13 -6.262 6.836 8.238 1.00 0.00 H new ATOM 0 H3 U B 13 -2.405 4.415 8.123 1.00 0.00 H new ATOM 0 H5 U B 13 -5.476 1.682 7.182 1.00 0.00 H new ATOM 0 H6 U B 13 -7.005 3.540 7.053 1.00 0.00 H new ATOM 421 P C B 14 -7.328 6.450 2.821 1.00 0.00 P ATOM 422 OP1 C B 14 -8.036 7.319 1.854 1.00 0.00 O ATOM 423 OP2 C B 14 -7.105 5.023 2.500 1.00 0.00 O ATOM 424 O5' C B 14 -5.902 7.115 3.144 1.00 0.00 O ATOM 425 C5' C B 14 -5.768 8.509 3.298 1.00 0.00 C ATOM 426 C4' C B 14 -4.325 8.838 3.685 1.00 0.00 C ATOM 427 O4' C B 14 -3.959 8.232 4.925 1.00 0.00 O ATOM 428 C3' C B 14 -3.323 8.320 2.675 1.00 0.00 C ATOM 429 O3' C B 14 -3.239 9.132 1.521 1.00 0.00 O ATOM 430 C2' C B 14 -2.065 8.385 3.504 1.00 0.00 C ATOM 431 O2' C B 14 -1.635 9.725 3.628 1.00 0.00 O ATOM 432 C1' C B 14 -2.563 7.902 4.861 1.00 0.00 C ATOM 433 N1 C B 14 -2.363 6.435 4.972 1.00 0.00 N ATOM 434 C2 C B 14 -1.076 5.995 5.243 1.00 0.00 C ATOM 435 O2 C B 14 -0.173 6.808 5.423 1.00 0.00 O ATOM 436 N3 C B 14 -0.846 4.655 5.298 1.00 0.00 N ATOM 437 C4 C B 14 -1.837 3.779 5.091 1.00 0.00 C ATOM 438 N4 C B 14 -1.563 2.471 5.145 1.00 0.00 N ATOM 439 C5 C B 14 -3.174 4.215 4.822 1.00 0.00 C ATOM 440 C6 C B 14 -3.389 5.548 4.779 1.00 0.00 C ATOM 0 H5' C B 14 -6.454 8.869 4.065 1.00 0.00 H new ATOM 0 H5'' C B 14 -6.033 9.016 2.370 1.00 0.00 H new ATOM 0 H4' C B 14 -4.297 9.926 3.742 1.00 0.00 H new ATOM 0 H3' C B 14 -3.560 7.338 2.265 1.00 0.00 H new ATOM 0 H2' C B 14 -1.234 7.814 3.089 1.00 0.00 H new ATOM 0 HO2' C B 14 -0.818 9.758 4.169 1.00 0.00 H new ATOM 0 H1' C B 14 -2.020 8.371 5.681 1.00 0.00 H new ATOM 0 H41 C B 14 -2.304 1.788 4.990 1.00 0.00 H new ATOM 0 H42 C B 14 -0.613 2.157 5.341 1.00 0.00 H new ATOM 0 H5 C B 14 -3.975 3.509 4.661 1.00 0.00 H new ATOM 0 H6 C B 14 -4.385 5.920 4.590 1.00 0.00 H new ATOM 452 P U B 15 -2.520 8.587 0.181 1.00 0.00 P ATOM 453 OP1 U B 15 -2.545 9.670 -0.827 1.00 0.00 O ATOM 454 OP2 U B 15 -3.109 7.270 -0.145 1.00 0.00 O ATOM 455 O5' U B 15 -0.988 8.350 0.623 1.00 0.00 O ATOM 456 C5' U B 15 -0.104 9.437 0.802 1.00 0.00 C ATOM 457 C4' U B 15 1.296 8.912 1.131 1.00 0.00 C ATOM 458 O4' U B 15 1.309 8.133 2.333 1.00 0.00 O ATOM 459 C3' U B 15 1.824 7.981 0.060 1.00 0.00 C ATOM 460 O3' U B 15 2.292 8.662 -1.089 1.00 0.00 O ATOM 461 C2' U B 15 2.948 7.331 0.819 1.00 0.00 C ATOM 462 O2' U B 15 4.037 8.224 0.927 1.00 0.00 O ATOM 463 C1' U B 15 2.343 7.138 2.200 1.00 0.00 C ATOM 464 N1 U B 15 1.787 5.763 2.339 1.00 0.00 N ATOM 465 C2 U B 15 2.694 4.735 2.563 1.00 0.00 C ATOM 466 O2 U B 15 3.905 4.932 2.628 1.00 0.00 O ATOM 467 N3 U B 15 2.161 3.467 2.714 1.00 0.00 N ATOM 468 C4 U B 15 0.819 3.136 2.659 1.00 0.00 C ATOM 469 O4 U B 15 0.459 1.969 2.796 1.00 0.00 O ATOM 470 C5 U B 15 -0.061 4.265 2.436 1.00 0.00 C ATOM 471 C6 U B 15 0.436 5.518 2.289 1.00 0.00 C ATOM 0 H5' U B 15 -0.461 10.080 1.607 1.00 0.00 H new ATOM 0 H5'' U B 15 -0.072 10.045 -0.102 1.00 0.00 H new ATOM 0 H4' U B 15 1.908 9.809 1.222 1.00 0.00 H new ATOM 0 H3' U B 15 1.077 7.301 -0.350 1.00 0.00 H new ATOM 0 H2' U B 15 3.313 6.417 0.351 1.00 0.00 H new ATOM 0 HO2' U B 15 4.765 7.794 1.423 1.00 0.00 H new ATOM 0 H1' U B 15 3.093 7.252 2.983 1.00 0.00 H new ATOM 0 H3 U B 15 2.819 2.706 2.881 1.00 0.00 H new ATOM 0 H5 U B 15 -1.128 4.106 2.386 1.00 0.00 H new ATOM 0 H6 U B 15 -0.245 6.341 2.129 1.00 0.00 H new ATOM 482 P C B 16 2.670 7.846 -2.434 1.00 0.00 P ATOM 483 OP1 C B 16 3.130 8.819 -3.449 1.00 0.00 O ATOM 484 OP2 C B 16 1.543 6.940 -2.747 1.00 0.00 O ATOM 485 O5' C B 16 3.934 6.936 -2.006 1.00 0.00 O ATOM 486 C5' C B 16 5.224 7.498 -1.870 1.00 0.00 C ATOM 487 C4' C B 16 6.229 6.406 -1.486 1.00 0.00 C ATOM 488 O4' C B 16 5.883 5.768 -0.261 1.00 0.00 O ATOM 489 C3' C B 16 6.280 5.281 -2.496 1.00 0.00 C ATOM 490 O3' C B 16 6.991 5.627 -3.664 1.00 0.00 O ATOM 491 C2' C B 16 6.998 4.228 -1.702 1.00 0.00 C ATOM 492 O2' C B 16 8.379 4.525 -1.650 1.00 0.00 O ATOM 493 C1' C B 16 6.385 4.418 -0.314 1.00 0.00 C ATOM 494 N1 C B 16 5.281 3.439 -0.118 1.00 0.00 N ATOM 495 C2 C B 16 5.632 2.131 0.199 1.00 0.00 C ATOM 496 O2 C B 16 6.814 1.822 0.332 1.00 0.00 O ATOM 497 N3 C B 16 4.635 1.214 0.355 1.00 0.00 N ATOM 498 C4 C B 16 3.349 1.562 0.204 1.00 0.00 C ATOM 499 N4 C B 16 2.402 0.634 0.376 1.00 0.00 N ATOM 500 C5 C B 16 2.975 2.903 -0.130 1.00 0.00 C ATOM 501 C6 C B 16 3.973 3.799 -0.277 1.00 0.00 C ATOM 0 H5' C B 16 5.212 8.278 -1.109 1.00 0.00 H new ATOM 0 H5'' C B 16 5.525 7.970 -2.805 1.00 0.00 H new ATOM 0 H4' C B 16 7.181 6.934 -1.422 1.00 0.00 H new ATOM 0 H3' C B 16 5.302 4.984 -2.876 1.00 0.00 H new ATOM 0 H2' C B 16 6.903 3.220 -2.106 1.00 0.00 H new ATOM 0 HO2' C B 16 8.606 5.152 -2.368 1.00 0.00 H new ATOM 0 HO3' C B 16 6.995 4.866 -4.282 1.00 0.00 H new ATOM 0 H1' C B 16 7.120 4.253 0.474 1.00 0.00 H new ATOM 0 H41 C B 16 1.419 0.882 0.265 1.00 0.00 H new ATOM 0 H42 C B 16 2.663 -0.322 0.618 1.00 0.00 H new ATOM 0 H5 C B 16 1.940 3.185 -0.259 1.00 0.00 H new ATOM 0 H6 C B 16 3.733 4.822 -0.526 1.00 0.00 H new TER 514 C B 16