USER MOD reduce.3.24.130724 H: found=0, std=0, add=154, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 154 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 -28:sc= 0.131 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -22:sc= 0.238 USER MOD Single : A 3 C O2' : rot -12:sc= 0.0934 USER MOD Single : A 4 G O2' : rot -124:sc= 0.216 USER MOD Single : A 5 G O2' : rot -17:sc= 0.015 USER MOD Single : A 6 U O2' : rot 170:sc= 1.25 USER MOD Single : A 7 G O2' : rot -30:sc= 0.072 USER MOD Single : A 8 A O2' : rot -15:sc= 0.0413 USER MOD Single : A 9 A O2' : rot -16:sc= 0.0287 USER MOD Single : A 10 A O2' : rot -25:sc= 0.26 USER MOD Single : A 11 U O2' : rot -23:sc= 0.276 USER MOD Single : A 12 G O2' : rot 180:sc=-0.00294 USER MOD Single : A 13 C O2' : rot -18:sc= 0.0163 USER MOD Single : A 14 C O2' : rot -14:sc= 0.177 USER MOD Single : A 14 C O3' : rot 180:sc= 0.195 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 1.449 -10.958 -12.154 1.00 10.00 O ATOM 2 C5' G A 1 1.337 -11.179 -10.755 1.00 10.00 C ATOM 3 C4' G A 1 0.075 -11.982 -10.402 1.00 10.00 C ATOM 4 O4' G A 1 0.333 -12.844 -9.301 1.00 10.00 O ATOM 5 C3' G A 1 -1.149 -11.139 -10.018 1.00 10.00 C ATOM 6 O3' G A 1 -1.888 -10.712 -11.140 1.00 10.00 O ATOM 7 C2' G A 1 -1.943 -12.177 -9.223 1.00 10.00 C ATOM 8 O2' G A 1 -2.591 -13.108 -10.089 1.00 10.00 O ATOM 9 C1' G A 1 -0.828 -12.904 -8.475 1.00 10.00 C ATOM 10 N9 G A 1 -0.521 -12.289 -7.163 1.00 10.00 N ATOM 11 C8 G A 1 0.559 -11.516 -6.818 1.00 10.00 C ATOM 12 N7 G A 1 0.659 -11.272 -5.541 1.00 10.00 N ATOM 13 C5 G A 1 -0.476 -11.887 -4.992 1.00 10.00 C ATOM 14 C6 G A 1 -0.956 -11.997 -3.633 1.00 10.00 C ATOM 15 O6 G A 1 -0.480 -11.563 -2.586 1.00 10.00 O ATOM 16 N1 G A 1 -2.103 -12.752 -3.525 1.00 10.00 N ATOM 17 C2 G A 1 -2.730 -13.343 -4.570 1.00 10.00 C ATOM 18 N2 G A 1 -3.772 -14.081 -4.302 1.00 10.00 N ATOM 19 N3 G A 1 -2.327 -13.277 -5.842 1.00 10.00 N ATOM 20 C4 G A 1 -1.194 -12.523 -5.986 1.00 10.00 C ATOM 0 H5' G A 1 1.314 -10.220 -10.237 1.00 10.00 H new ATOM 0 H5'' G A 1 2.218 -11.713 -10.400 1.00 10.00 H new ATOM 0 H4' G A 1 -0.162 -12.520 -11.320 1.00 10.00 H new ATOM 0 H3' G A 1 -0.904 -10.216 -9.493 1.00 10.00 H new ATOM 0 H2' G A 1 -2.721 -11.737 -8.600 1.00 10.00 H new ATOM 0 HO2' G A 1 -2.774 -12.680 -10.951 1.00 10.00 H new ATOM 0 HO5' G A 1 2.262 -10.443 -12.340 1.00 10.00 H new ATOM 0 H1' G A 1 -1.147 -13.927 -8.274 1.00 10.00 H new ATOM 0 H8 G A 1 1.266 -11.141 -7.543 1.00 10.00 H new ATOM 0 H1 G A 1 -2.507 -12.874 -2.596 1.00 10.00 H new ATOM 0 H21 G A 1 -4.276 -14.546 -5.057 1.00 10.00 H new ATOM 0 H22 G A 1 -4.083 -14.193 -3.337 1.00 10.00 H new ATOM 33 P G A 2 -2.800 -9.416 -11.088 1.00 10.00 P ATOM 34 OP1 G A 2 -3.449 -9.340 -12.416 1.00 10.00 O ATOM 35 OP2 G A 2 -1.948 -8.294 -10.670 1.00 10.00 O ATOM 36 O5' G A 2 -3.944 -9.669 -9.972 1.00 10.00 O ATOM 37 C5' G A 2 -5.035 -10.542 -10.253 1.00 10.00 C ATOM 38 C4' G A 2 -5.899 -10.964 -9.052 1.00 10.00 C ATOM 39 O4' G A 2 -5.134 -11.689 -8.094 1.00 10.00 O ATOM 40 C3' G A 2 -6.666 -9.865 -8.303 1.00 10.00 C ATOM 41 O3' G A 2 -7.924 -9.564 -8.901 1.00 10.00 O ATOM 42 C2' G A 2 -6.891 -10.561 -6.958 1.00 10.00 C ATOM 43 O2' G A 2 -8.025 -11.423 -7.021 1.00 10.00 O ATOM 44 C1' G A 2 -5.614 -11.377 -6.790 1.00 10.00 C ATOM 45 N9 G A 2 -4.619 -10.609 -6.018 1.00 10.00 N ATOM 46 C8 G A 2 -3.547 -9.870 -6.450 1.00 10.00 C ATOM 47 N7 G A 2 -2.902 -9.264 -5.494 1.00 10.00 N ATOM 48 C5 G A 2 -3.574 -9.661 -4.328 1.00 10.00 C ATOM 49 C6 G A 2 -3.349 -9.375 -2.936 1.00 10.00 C ATOM 50 O6 G A 2 -2.465 -8.700 -2.415 1.00 10.00 O ATOM 51 N1 G A 2 -4.287 -9.950 -2.102 1.00 10.00 N ATOM 52 C2 G A 2 -5.283 -10.762 -2.525 1.00 10.00 C ATOM 53 N2 G A 2 -6.057 -11.308 -1.624 1.00 10.00 N ATOM 54 N3 G A 2 -5.523 -11.069 -3.795 1.00 10.00 N ATOM 55 C4 G A 2 -4.632 -10.483 -4.651 1.00 10.00 C ATOM 0 H5' G A 2 -4.640 -11.443 -10.723 1.00 10.00 H new ATOM 0 H5'' G A 2 -5.681 -10.057 -10.985 1.00 10.00 H new ATOM 0 H4' G A 2 -6.661 -11.576 -9.535 1.00 10.00 H new ATOM 0 H3' G A 2 -6.139 -8.911 -8.274 1.00 10.00 H new ATOM 0 H2' G A 2 -7.082 -9.869 -6.138 1.00 10.00 H new ATOM 0 HO2' G A 2 -8.615 -11.135 -7.749 1.00 10.00 H new ATOM 0 H1' G A 2 -5.805 -12.297 -6.238 1.00 10.00 H new ATOM 0 H8 G A 2 -3.263 -9.797 -7.489 1.00 10.00 H new ATOM 0 H1 G A 2 -4.225 -9.750 -1.104 1.00 10.00 H new ATOM 0 H21 G A 2 -6.817 -11.925 -1.911 1.00 10.00 H new ATOM 0 H22 G A 2 -5.901 -11.117 -0.634 1.00 10.00 H new ATOM 67 P C A 3 -8.640 -8.157 -8.703 1.00 10.00 P ATOM 68 OP1 C A 3 -9.912 -8.241 -9.462 1.00 10.00 O ATOM 69 OP2 C A 3 -7.656 -7.130 -9.100 1.00 10.00 O ATOM 70 O5' C A 3 -8.973 -7.970 -7.141 1.00 10.00 O ATOM 71 C5' C A 3 -10.116 -8.556 -6.518 1.00 10.00 C ATOM 72 C4' C A 3 -10.027 -8.553 -4.975 1.00 10.00 C ATOM 73 O4' C A 3 -8.697 -8.865 -4.591 1.00 10.00 O ATOM 74 C3' C A 3 -10.400 -7.242 -4.267 1.00 10.00 C ATOM 75 O3' C A 3 -11.779 -7.177 -3.923 1.00 10.00 O ATOM 76 C2' C A 3 -9.535 -7.286 -2.999 1.00 10.00 C ATOM 77 O2' C A 3 -10.131 -7.823 -1.824 1.00 10.00 O ATOM 78 C1' C A 3 -8.402 -8.246 -3.350 1.00 10.00 C ATOM 79 N1 C A 3 -7.113 -7.520 -3.285 1.00 10.00 N ATOM 80 C2 C A 3 -6.574 -7.190 -2.069 1.00 10.00 C ATOM 81 O2 C A 3 -7.228 -7.385 -1.025 1.00 10.00 O ATOM 82 N3 C A 3 -5.358 -6.614 -1.988 1.00 10.00 N ATOM 83 C4 C A 3 -4.674 -6.381 -3.185 1.00 10.00 C ATOM 84 N4 C A 3 -3.530 -5.782 -2.968 1.00 10.00 N ATOM 85 C5 C A 3 -5.208 -6.622 -4.390 1.00 10.00 C ATOM 86 C6 C A 3 -6.435 -7.194 -4.469 1.00 10.00 C ATOM 0 H5' C A 3 -10.229 -9.582 -6.868 1.00 10.00 H new ATOM 0 H5'' C A 3 -11.010 -8.014 -6.827 1.00 10.00 H new ATOM 0 H4' C A 3 -10.769 -9.289 -4.664 1.00 10.00 H new ATOM 0 H3' C A 3 -10.230 -6.370 -4.899 1.00 10.00 H new ATOM 0 H2' C A 3 -9.282 -6.254 -2.756 1.00 10.00 H new ATOM 0 HO2' C A 3 -11.097 -7.914 -1.960 1.00 10.00 H new ATOM 0 H1' C A 3 -8.306 -9.061 -2.632 1.00 10.00 H new ATOM 0 H41 C A 3 -2.920 -5.548 -3.751 1.00 10.00 H new ATOM 0 H42 C A 3 -3.249 -5.550 -2.015 1.00 10.00 H new ATOM 0 H5 C A 3 -4.667 -6.364 -5.288 1.00 10.00 H new ATOM 0 H6 C A 3 -6.884 -7.396 -5.430 1.00 10.00 H new ATOM 98 P G A 4 -12.498 -5.785 -3.571 1.00 10.00 P ATOM 99 OP1 G A 4 -13.617 -6.153 -2.667 1.00 10.00 O ATOM 100 OP2 G A 4 -12.825 -5.149 -4.858 1.00 10.00 O ATOM 101 O5' G A 4 -11.472 -4.825 -2.756 1.00 10.00 O ATOM 102 C5' G A 4 -11.587 -4.639 -1.343 1.00 10.00 C ATOM 103 C4' G A 4 -10.423 -3.891 -0.655 1.00 10.00 C ATOM 104 O4' G A 4 -9.186 -4.539 -0.923 1.00 10.00 O ATOM 105 C3' G A 4 -10.213 -2.392 -0.938 1.00 10.00 C ATOM 106 O3' G A 4 -11.113 -1.543 -0.222 1.00 10.00 O ATOM 107 C2' G A 4 -8.753 -2.233 -0.475 1.00 10.00 C ATOM 108 O2' G A 4 -8.611 -2.000 0.921 1.00 10.00 O ATOM 109 C1' G A 4 -8.132 -3.589 -0.812 1.00 10.00 C ATOM 110 N9 G A 4 -7.387 -3.485 -2.082 1.00 10.00 N ATOM 111 C8 G A 4 -7.807 -3.754 -3.357 1.00 10.00 C ATOM 112 N7 G A 4 -6.900 -3.553 -4.272 1.00 10.00 N ATOM 113 C5 G A 4 -5.795 -3.079 -3.550 1.00 10.00 C ATOM 114 C6 G A 4 -4.474 -2.675 -3.956 1.00 10.00 C ATOM 115 O6 G A 4 -3.950 -2.699 -5.068 1.00 10.00 O ATOM 116 N1 G A 4 -3.691 -2.220 -2.912 1.00 10.00 N ATOM 117 C2 G A 4 -4.088 -2.232 -1.614 1.00 10.00 C ATOM 118 N2 G A 4 -3.222 -1.845 -0.719 1.00 10.00 N ATOM 119 N3 G A 4 -5.282 -2.632 -1.186 1.00 10.00 N ATOM 120 C4 G A 4 -6.098 -3.033 -2.205 1.00 10.00 C ATOM 0 H5' G A 4 -11.688 -5.619 -0.876 1.00 10.00 H new ATOM 0 H5'' G A 4 -12.510 -4.094 -1.143 1.00 10.00 H new ATOM 0 H4' G A 4 -10.745 -3.934 0.385 1.00 10.00 H new ATOM 0 H3' G A 4 -10.404 -2.102 -1.971 1.00 10.00 H new ATOM 0 H2' G A 4 -8.291 -1.370 -0.956 1.00 10.00 H new ATOM 0 HO2' G A 4 -8.104 -1.174 1.065 1.00 10.00 H new ATOM 0 H1' G A 4 -7.436 -3.903 -0.034 1.00 10.00 H new ATOM 0 H8 G A 4 -8.803 -4.103 -3.585 1.00 10.00 H new ATOM 0 H1 G A 4 -2.764 -1.855 -3.129 1.00 10.00 H new ATOM 0 H21 G A 4 -3.478 -1.838 0.268 1.00 10.00 H new ATOM 0 H22 G A 4 -2.289 -1.549 -1.006 1.00 10.00 H new ATOM 132 P G A 5 -11.143 0.041 -0.464 1.00 10.00 P ATOM 133 OP1 G A 5 -12.244 0.633 0.322 1.00 10.00 O ATOM 134 OP2 G A 5 -11.033 0.340 -1.905 1.00 10.00 O ATOM 135 O5' G A 5 -9.792 0.552 0.173 1.00 10.00 O ATOM 136 C5' G A 5 -9.676 0.957 1.525 1.00 10.00 C ATOM 137 C4' G A 5 -8.316 1.630 1.671 1.00 10.00 C ATOM 138 O4' G A 5 -7.264 0.800 1.183 1.00 10.00 O ATOM 139 C3' G A 5 -8.274 2.917 0.853 1.00 10.00 C ATOM 140 O3' G A 5 -8.978 3.956 1.519 1.00 10.00 O ATOM 141 C2' G A 5 -6.759 3.093 0.724 1.00 10.00 C ATOM 142 O2' G A 5 -6.176 3.603 1.915 1.00 10.00 O ATOM 143 C1' G A 5 -6.314 1.636 0.526 1.00 10.00 C ATOM 144 N9 G A 5 -6.189 1.278 -0.909 1.00 10.00 N ATOM 145 C8 G A 5 -7.168 0.983 -1.828 1.00 10.00 C ATOM 146 N7 G A 5 -6.732 0.807 -3.047 1.00 10.00 N ATOM 147 C5 G A 5 -5.342 0.984 -2.928 1.00 10.00 C ATOM 148 C6 G A 5 -4.276 0.956 -3.901 1.00 10.00 C ATOM 149 O6 G A 5 -4.327 0.821 -5.122 1.00 10.00 O ATOM 150 N1 G A 5 -3.020 1.119 -3.350 1.00 10.00 N ATOM 151 C2 G A 5 -2.792 1.336 -2.034 1.00 10.00 C ATOM 152 N2 G A 5 -1.544 1.365 -1.646 1.00 10.00 N ATOM 153 N3 G A 5 -3.747 1.406 -1.104 1.00 10.00 N ATOM 154 C4 G A 5 -5.006 1.228 -1.612 1.00 10.00 C ATOM 0 H5' G A 5 -9.756 0.099 2.193 1.00 10.00 H new ATOM 0 H5'' G A 5 -10.478 1.645 1.792 1.00 10.00 H new ATOM 0 H4' G A 5 -8.177 1.826 2.734 1.00 10.00 H new ATOM 0 H3' G A 5 -8.767 2.914 -0.119 1.00 10.00 H new ATOM 0 H2' G A 5 -6.472 3.791 -0.062 1.00 10.00 H new ATOM 0 HO2' G A 5 -6.876 3.988 2.483 1.00 10.00 H new ATOM 0 H1' G A 5 -5.322 1.498 0.955 1.00 10.00 H new ATOM 0 H8 G A 5 -8.212 0.903 -1.564 1.00 10.00 H new ATOM 0 H1 G A 5 -2.214 1.073 -3.974 1.00 10.00 H new ATOM 0 H21 G A 5 -1.319 1.525 -0.664 1.00 10.00 H new ATOM 0 H22 G A 5 -0.796 1.227 -2.325 1.00 10.00 H new ATOM 166 P U A 6 -9.798 5.044 0.703 1.00 10.00 P ATOM 167 OP1 U A 6 -10.583 5.857 1.660 1.00 10.00 O ATOM 168 OP2 U A 6 -10.501 4.400 -0.426 1.00 10.00 O ATOM 169 O5' U A 6 -8.637 5.965 0.138 1.00 10.00 O ATOM 170 C5' U A 6 -7.925 6.783 1.051 1.00 10.00 C ATOM 171 C4' U A 6 -6.595 7.291 0.504 1.00 10.00 C ATOM 172 O4' U A 6 -5.688 6.253 0.143 1.00 10.00 O ATOM 173 C3' U A 6 -6.741 8.224 -0.691 1.00 10.00 C ATOM 174 O3' U A 6 -7.238 9.487 -0.266 1.00 10.00 O ATOM 175 C2' U A 6 -5.272 8.209 -1.100 1.00 10.00 C ATOM 176 O2' U A 6 -4.516 9.110 -0.287 1.00 10.00 O ATOM 177 C1' U A 6 -4.834 6.758 -0.888 1.00 10.00 C ATOM 178 N1 U A 6 -4.960 5.961 -2.154 1.00 10.00 N ATOM 179 C2 U A 6 -3.871 5.948 -3.042 1.00 10.00 C ATOM 180 O2 U A 6 -2.846 6.589 -2.869 1.00 10.00 O ATOM 181 N3 U A 6 -3.968 5.160 -4.167 1.00 10.00 N ATOM 182 C4 U A 6 -5.072 4.431 -4.529 1.00 10.00 C ATOM 183 O4 U A 6 -5.068 3.791 -5.575 1.00 10.00 O ATOM 184 C5 U A 6 -6.179 4.512 -3.600 1.00 10.00 C ATOM 185 C6 U A 6 -6.106 5.259 -2.466 1.00 10.00 C ATOM 0 H5' U A 6 -7.741 6.218 1.965 1.00 10.00 H new ATOM 0 H5'' U A 6 -8.546 7.636 1.323 1.00 10.00 H new ATOM 0 H4' U A 6 -6.184 7.848 1.346 1.00 10.00 H new ATOM 0 H3' U A 6 -7.436 7.964 -1.489 1.00 10.00 H new ATOM 0 H2' U A 6 -5.116 8.534 -2.129 1.00 10.00 H new ATOM 0 HO2' U A 6 -3.559 8.971 -0.447 1.00 10.00 H new ATOM 0 H1' U A 6 -3.784 6.688 -0.604 1.00 10.00 H new ATOM 0 H3 U A 6 -3.154 5.115 -4.780 1.00 10.00 H new ATOM 0 H5 U A 6 -7.086 3.965 -3.813 1.00 10.00 H new ATOM 0 H6 U A 6 -6.956 5.303 -1.801 1.00 10.00 H new ATOM 196 P G A 7 -7.965 10.501 -1.242 1.00 10.00 P ATOM 197 OP1 G A 7 -8.442 11.593 -0.362 1.00 10.00 O ATOM 198 OP2 G A 7 -8.940 9.723 -2.032 1.00 10.00 O ATOM 199 O5' G A 7 -6.873 11.141 -2.214 1.00 10.00 O ATOM 200 C5' G A 7 -7.266 11.942 -3.328 1.00 10.00 C ATOM 201 C4' G A 7 -6.088 12.456 -4.182 1.00 10.00 C ATOM 202 O4' G A 7 -5.287 13.450 -3.540 1.00 10.00 O ATOM 203 C3' G A 7 -5.145 11.328 -4.566 1.00 10.00 C ATOM 204 O3' G A 7 -5.531 10.536 -5.675 1.00 10.00 O ATOM 205 C2' G A 7 -3.816 12.017 -4.775 1.00 10.00 C ATOM 206 O2' G A 7 -3.688 12.538 -6.090 1.00 10.00 O ATOM 207 C1' G A 7 -3.904 13.154 -3.768 1.00 10.00 C ATOM 208 N9 G A 7 -3.272 12.761 -2.492 1.00 10.00 N ATOM 209 C8 G A 7 -3.874 12.355 -1.334 1.00 10.00 C ATOM 210 N7 G A 7 -3.051 12.237 -0.320 1.00 10.00 N ATOM 211 C5 G A 7 -1.785 12.428 -0.900 1.00 10.00 C ATOM 212 C6 G A 7 -0.447 12.286 -0.371 1.00 10.00 C ATOM 213 O6 G A 7 -0.091 12.028 0.783 1.00 10.00 O ATOM 214 N1 G A 7 0.541 12.432 -1.330 1.00 10.00 N ATOM 215 C2 G A 7 0.282 12.758 -2.624 1.00 10.00 C ATOM 216 N2 G A 7 1.287 12.805 -3.446 1.00 10.00 N ATOM 217 N3 G A 7 -0.928 12.945 -3.144 1.00 10.00 N ATOM 218 C4 G A 7 -1.924 12.738 -2.234 1.00 10.00 C ATOM 0 H5' G A 7 -7.837 12.796 -2.964 1.00 10.00 H new ATOM 0 H5'' G A 7 -7.934 11.360 -3.963 1.00 10.00 H new ATOM 0 H4' G A 7 -6.573 12.897 -5.053 1.00 10.00 H new ATOM 0 H3' G A 7 -5.129 10.575 -3.778 1.00 10.00 H new ATOM 0 H2' G A 7 -2.961 11.353 -4.648 1.00 10.00 H new ATOM 0 HO2' G A 7 -4.204 11.984 -6.713 1.00 10.00 H new ATOM 0 H1' G A 7 -3.384 14.028 -4.159 1.00 10.00 H new ATOM 0 H8 G A 7 -4.932 12.150 -1.261 1.00 10.00 H new ATOM 0 H1 G A 7 1.512 12.288 -1.052 1.00 10.00 H new ATOM 0 H21 G A 7 1.134 13.046 -4.425 1.00 10.00 H new ATOM 0 H22 G A 7 2.229 12.601 -3.112 1.00 10.00 H new ATOM 230 P A A 8 -5.295 8.962 -5.649 1.00 10.00 P ATOM 231 OP1 A A 8 -5.754 8.472 -6.966 1.00 10.00 O ATOM 232 OP2 A A 8 -5.913 8.426 -4.431 1.00 10.00 O ATOM 233 O5' A A 8 -3.709 8.829 -5.557 1.00 10.00 O ATOM 234 C5' A A 8 -2.885 9.091 -6.678 1.00 10.00 C ATOM 235 C4' A A 8 -1.402 9.132 -6.300 1.00 10.00 C ATOM 236 O4' A A 8 -1.123 10.134 -5.334 1.00 10.00 O ATOM 237 C3' A A 8 -0.852 7.815 -5.757 1.00 10.00 C ATOM 238 O3' A A 8 -0.542 6.940 -6.824 1.00 10.00 O ATOM 239 C2' A A 8 0.393 8.313 -4.999 1.00 10.00 C ATOM 240 O2' A A 8 1.544 8.518 -5.824 1.00 10.00 O ATOM 241 C1' A A 8 -0.125 9.644 -4.448 1.00 10.00 C ATOM 242 N9 A A 8 -0.666 9.416 -3.092 1.00 10.00 N ATOM 243 C8 A A 8 -1.961 9.337 -2.646 1.00 10.00 C ATOM 244 N7 A A 8 -2.063 9.159 -1.352 1.00 10.00 N ATOM 245 C5 A A 8 -0.735 9.066 -0.929 1.00 10.00 C ATOM 246 C6 A A 8 -0.084 8.855 0.310 1.00 10.00 C ATOM 247 N6 A A 8 -0.693 8.668 1.463 1.00 10.00 N ATOM 248 N1 A A 8 1.249 8.864 0.402 1.00 10.00 N ATOM 249 C2 A A 8 1.936 9.049 -0.721 1.00 10.00 C ATOM 250 N3 A A 8 1.475 9.214 -1.951 1.00 10.00 N ATOM 251 C4 A A 8 0.117 9.220 -1.984 1.00 10.00 C ATOM 0 H5' A A 8 -3.172 10.043 -7.125 1.00 10.00 H new ATOM 0 H5'' A A 8 -3.046 8.323 -7.434 1.00 10.00 H new ATOM 0 H4' A A 8 -0.908 9.352 -7.246 1.00 10.00 H new ATOM 0 H3' A A 8 -1.531 7.238 -5.129 1.00 10.00 H new ATOM 0 H2' A A 8 0.750 7.595 -4.261 1.00 10.00 H new ATOM 0 HO2' A A 8 1.406 8.084 -6.692 1.00 10.00 H new ATOM 0 H1' A A 8 0.671 10.385 -4.377 1.00 10.00 H new ATOM 0 H8 A A 8 -2.817 9.414 -3.301 1.00 10.00 H new ATOM 0 H61 A A 8 -0.146 8.523 2.311 1.00 10.00 H new ATOM 0 H62 A A 8 -1.712 8.668 1.507 1.00 10.00 H new ATOM 0 H2 A A 8 3.011 9.067 -0.616 1.00 10.00 H new ATOM 263 P A A 9 -0.256 5.405 -6.575 1.00 10.00 P ATOM 264 OP1 A A 9 0.479 4.964 -7.775 1.00 10.00 O ATOM 265 OP2 A A 9 -1.517 4.732 -6.195 1.00 10.00 O ATOM 266 O5' A A 9 0.794 5.351 -5.378 1.00 10.00 O ATOM 267 C5' A A 9 0.573 4.548 -4.239 1.00 10.00 C ATOM 268 C4' A A 9 1.583 4.910 -3.145 1.00 10.00 C ATOM 269 O4' A A 9 1.137 5.989 -2.328 1.00 10.00 O ATOM 270 C3' A A 9 1.795 3.723 -2.217 1.00 10.00 C ATOM 271 O3' A A 9 2.787 2.831 -2.692 1.00 10.00 O ATOM 272 C2' A A 9 2.221 4.418 -0.929 1.00 10.00 C ATOM 273 O2' A A 9 3.600 4.773 -0.907 1.00 10.00 O ATOM 274 C1' A A 9 1.392 5.690 -0.959 1.00 10.00 C ATOM 275 N9 A A 9 0.128 5.452 -0.234 1.00 10.00 N ATOM 276 C8 A A 9 -1.108 5.217 -0.762 1.00 10.00 C ATOM 277 N7 A A 9 -2.037 4.960 0.118 1.00 10.00 N ATOM 278 C5 A A 9 -1.343 5.025 1.331 1.00 10.00 C ATOM 279 C6 A A 9 -1.685 4.820 2.686 1.00 10.00 C ATOM 280 N6 A A 9 -2.885 4.471 3.104 1.00 10.00 N ATOM 281 N1 A A 9 -0.771 4.922 3.659 1.00 10.00 N ATOM 282 C2 A A 9 0.471 5.210 3.291 1.00 10.00 C ATOM 283 N3 A A 9 0.951 5.419 2.073 1.00 10.00 N ATOM 284 C4 A A 9 -0.022 5.316 1.125 1.00 10.00 C ATOM 0 H5' A A 9 0.669 3.494 -4.501 1.00 10.00 H new ATOM 0 H5'' A A 9 -0.443 4.694 -3.872 1.00 10.00 H new ATOM 0 H4' A A 9 2.500 5.195 -3.661 1.00 10.00 H new ATOM 0 H3' A A 9 0.915 3.088 -2.112 1.00 10.00 H new ATOM 0 H2' A A 9 2.075 3.774 -0.062 1.00 10.00 H new ATOM 0 HO2' A A 9 4.074 4.287 -1.613 1.00 10.00 H new ATOM 0 H1' A A 9 1.909 6.523 -0.483 1.00 10.00 H new ATOM 0 H8 A A 9 -1.302 5.242 -1.824 1.00 10.00 H new ATOM 0 H61 A A 9 -3.060 4.340 4.100 1.00 10.00 H new ATOM 0 H62 A A 9 -3.639 4.332 2.431 1.00 10.00 H new ATOM 0 H2 A A 9 1.189 5.284 4.094 1.00 10.00 H new ATOM 296 P A A 10 2.693 1.285 -2.355 1.00 10.00 P ATOM 297 OP1 A A 10 3.873 0.641 -2.973 1.00 10.00 O ATOM 298 OP2 A A 10 1.325 0.844 -2.698 1.00 10.00 O ATOM 299 O5' A A 10 2.902 1.219 -0.774 1.00 10.00 O ATOM 300 C5' A A 10 4.161 1.501 -0.186 1.00 10.00 C ATOM 301 C4' A A 10 4.082 1.573 1.343 1.00 10.00 C ATOM 302 O4' A A 10 3.126 2.529 1.799 1.00 10.00 O ATOM 303 C3' A A 10 3.773 0.218 1.983 1.00 10.00 C ATOM 304 O3' A A 10 4.965 -0.496 2.303 1.00 10.00 O ATOM 305 C2' A A 10 3.076 0.673 3.264 1.00 10.00 C ATOM 306 O2' A A 10 4.044 0.937 4.278 1.00 10.00 O ATOM 307 C1' A A 10 2.376 1.968 2.870 1.00 10.00 C ATOM 308 N9 A A 10 0.971 1.717 2.468 1.00 10.00 N ATOM 309 C8 A A 10 0.424 1.699 1.209 1.00 10.00 C ATOM 310 N7 A A 10 -0.867 1.535 1.184 1.00 10.00 N ATOM 311 C5 A A 10 -1.203 1.430 2.536 1.00 10.00 C ATOM 312 C6 A A 10 -2.414 1.277 3.245 1.00 10.00 C ATOM 313 N6 A A 10 -3.597 1.210 2.674 1.00 10.00 N ATOM 314 N1 A A 10 -2.429 1.226 4.577 1.00 10.00 N ATOM 315 C2 A A 10 -1.268 1.316 5.209 1.00 10.00 C ATOM 316 N3 A A 10 -0.052 1.468 4.689 1.00 10.00 N ATOM 317 C4 A A 10 -0.090 1.524 3.326 1.00 10.00 C ATOM 0 H5' A A 10 4.537 2.448 -0.574 1.00 10.00 H new ATOM 0 H5'' A A 10 4.876 0.731 -0.475 1.00 10.00 H new ATOM 0 H4' A A 10 5.076 1.891 1.658 1.00 10.00 H new ATOM 0 H3' A A 10 3.199 -0.456 1.347 1.00 10.00 H new ATOM 0 H2' A A 10 2.389 -0.077 3.657 1.00 10.00 H new ATOM 0 HO2' A A 10 4.854 0.415 4.101 1.00 10.00 H new ATOM 0 H1' A A 10 2.333 2.657 3.714 1.00 10.00 H new ATOM 0 H8 A A 10 1.016 1.812 0.313 1.00 10.00 H new ATOM 0 H61 A A 10 -4.434 1.099 3.246 1.00 10.00 H new ATOM 0 H62 A A 10 -3.677 1.269 1.659 1.00 10.00 H new ATOM 0 H2 A A 10 -1.314 1.259 6.286 1.00 10.00 H new ATOM 329 P U A 11 4.983 -2.088 2.333 1.00 10.00 P ATOM 330 OP1 U A 11 6.258 -2.502 2.961 1.00 10.00 O ATOM 331 OP2 U A 11 4.708 -2.574 0.968 1.00 10.00 O ATOM 332 O5' U A 11 3.788 -2.486 3.323 1.00 10.00 O ATOM 333 C5' U A 11 3.994 -2.448 4.726 1.00 10.00 C ATOM 334 C4' U A 11 2.719 -2.490 5.577 1.00 10.00 C ATOM 335 O4' U A 11 1.698 -1.581 5.161 1.00 10.00 O ATOM 336 C3' U A 11 2.050 -3.853 5.678 1.00 10.00 C ATOM 337 O3' U A 11 2.680 -4.702 6.626 1.00 10.00 O ATOM 338 C2' U A 11 0.697 -3.405 6.233 1.00 10.00 C ATOM 339 O2' U A 11 0.767 -3.271 7.654 1.00 10.00 O ATOM 340 C1' U A 11 0.421 -2.050 5.598 1.00 10.00 C ATOM 341 N1 U A 11 -0.632 -2.201 4.554 1.00 10.00 N ATOM 342 C2 U A 11 -1.958 -2.345 5.010 1.00 10.00 C ATOM 343 O2 U A 11 -2.260 -2.290 6.206 1.00 10.00 O ATOM 344 N3 U A 11 -2.930 -2.589 4.058 1.00 10.00 N ATOM 345 C4 U A 11 -2.714 -2.668 2.714 1.00 10.00 C ATOM 346 O4 U A 11 -3.670 -2.801 1.967 1.00 10.00 O ATOM 347 C5 U A 11 -1.326 -2.587 2.325 1.00 10.00 C ATOM 348 C6 U A 11 -0.328 -2.349 3.218 1.00 10.00 C ATOM 0 H5' U A 11 4.545 -1.540 4.971 1.00 10.00 H new ATOM 0 H5'' U A 11 4.626 -3.290 5.007 1.00 10.00 H new ATOM 0 H4' U A 11 3.121 -2.201 6.548 1.00 10.00 H new ATOM 0 H3' U A 11 2.051 -4.422 4.749 1.00 10.00 H new ATOM 0 H2' U A 11 -0.088 -4.127 6.009 1.00 10.00 H new ATOM 0 HO2' U A 11 1.499 -3.824 7.999 1.00 10.00 H new ATOM 0 H1' U A 11 0.003 -1.297 6.266 1.00 10.00 H new ATOM 0 H3 U A 11 -3.886 -2.721 4.388 1.00 10.00 H new ATOM 0 H5 U A 11 -1.070 -2.721 1.284 1.00 10.00 H new ATOM 0 H6 U A 11 0.696 -2.276 2.882 1.00 10.00 H new ATOM 359 P G A 12 2.448 -6.278 6.598 1.00 10.00 P ATOM 360 OP1 G A 12 2.889 -6.777 7.916 1.00 10.00 O ATOM 361 OP2 G A 12 3.118 -6.793 5.390 1.00 10.00 O ATOM 362 O5' G A 12 0.860 -6.470 6.485 1.00 10.00 O ATOM 363 C5' G A 12 0.031 -6.553 7.636 1.00 10.00 C ATOM 364 C4' G A 12 -1.473 -6.465 7.324 1.00 10.00 C ATOM 365 O4' G A 12 -1.837 -5.418 6.429 1.00 10.00 O ATOM 366 C3' G A 12 -2.054 -7.768 6.784 1.00 10.00 C ATOM 367 O3' G A 12 -2.252 -8.660 7.875 1.00 10.00 O ATOM 368 C2' G A 12 -3.319 -7.214 6.099 1.00 10.00 C ATOM 369 O2' G A 12 -4.396 -6.936 6.993 1.00 10.00 O ATOM 370 C1' G A 12 -2.821 -5.891 5.515 1.00 10.00 C ATOM 371 N9 G A 12 -2.279 -6.060 4.149 1.00 10.00 N ATOM 372 C8 G A 12 -0.981 -6.036 3.730 1.00 10.00 C ATOM 373 N7 G A 12 -0.827 -5.948 2.438 1.00 10.00 N ATOM 374 C5 G A 12 -2.147 -5.956 1.948 1.00 10.00 C ATOM 375 C6 G A 12 -2.696 -5.849 0.618 1.00 10.00 C ATOM 376 O6 G A 12 -2.123 -5.636 -0.449 1.00 10.00 O ATOM 377 N1 G A 12 -4.067 -5.992 0.586 1.00 10.00 N ATOM 378 C2 G A 12 -4.837 -6.205 1.675 1.00 10.00 C ATOM 379 N2 G A 12 -6.084 -6.526 1.470 1.00 10.00 N ATOM 380 N3 G A 12 -4.389 -6.217 2.932 1.00 10.00 N ATOM 381 C4 G A 12 -3.029 -6.094 2.999 1.00 10.00 C ATOM 0 H5' G A 12 0.298 -5.750 8.323 1.00 10.00 H new ATOM 0 H5'' G A 12 0.232 -7.493 8.150 1.00 10.00 H new ATOM 0 H4' G A 12 -1.901 -6.244 8.302 1.00 10.00 H new ATOM 0 H3' G A 12 -1.462 -8.368 6.093 1.00 10.00 H new ATOM 0 H2' G A 12 -3.722 -7.936 5.389 1.00 10.00 H new ATOM 0 HO2' G A 12 -5.160 -6.588 6.487 1.00 10.00 H new ATOM 0 H1' G A 12 -3.633 -5.173 5.404 1.00 10.00 H new ATOM 0 H8 G A 12 -0.147 -6.086 4.414 1.00 10.00 H new ATOM 0 H1 G A 12 -4.531 -5.933 -0.321 1.00 10.00 H new ATOM 0 H21 G A 12 -6.704 -6.696 2.262 1.00 10.00 H new ATOM 0 H22 G A 12 -6.440 -6.607 0.517 1.00 10.00 H new ATOM 393 P C A 13 -2.185 -10.243 7.684 1.00 10.00 P ATOM 394 OP1 C A 13 -2.497 -10.886 8.974 1.00 10.00 O ATOM 395 OP2 C A 13 -0.948 -10.630 6.976 1.00 10.00 O ATOM 396 O5' C A 13 -3.392 -10.559 6.725 1.00 10.00 O ATOM 397 C5' C A 13 -4.718 -10.411 7.184 1.00 10.00 C ATOM 398 C4' C A 13 -5.720 -10.739 6.087 1.00 10.00 C ATOM 399 O4' C A 13 -5.782 -9.694 5.119 1.00 10.00 O ATOM 400 C3' C A 13 -5.439 -12.037 5.332 1.00 10.00 C ATOM 401 O3' C A 13 -5.831 -13.164 6.108 1.00 10.00 O ATOM 402 C2' C A 13 -6.279 -11.758 4.082 1.00 10.00 C ATOM 403 O2' C A 13 -7.673 -11.907 4.325 1.00 10.00 O ATOM 404 C1' C A 13 -5.999 -10.270 3.835 1.00 10.00 C ATOM 405 N1 C A 13 -4.809 -10.043 2.944 1.00 10.00 N ATOM 406 C2 C A 13 -4.984 -10.079 1.559 1.00 10.00 C ATOM 407 O2 C A 13 -6.047 -10.442 1.056 1.00 10.00 O ATOM 408 N3 C A 13 -3.975 -9.770 0.718 1.00 10.00 N ATOM 409 C4 C A 13 -2.812 -9.437 1.221 1.00 10.00 C ATOM 410 N4 C A 13 -1.863 -9.112 0.405 1.00 10.00 N ATOM 411 C5 C A 13 -2.554 -9.362 2.612 1.00 10.00 C ATOM 412 C6 C A 13 -3.558 -9.741 3.442 1.00 10.00 C ATOM 0 H5' C A 13 -4.874 -9.389 7.529 1.00 10.00 H new ATOM 0 H5'' C A 13 -4.885 -11.065 8.040 1.00 10.00 H new ATOM 0 H4' C A 13 -6.663 -10.856 6.621 1.00 10.00 H new ATOM 0 H3' C A 13 -4.402 -12.284 5.102 1.00 10.00 H new ATOM 0 H2' C A 13 -6.033 -12.435 3.264 1.00 10.00 H new ATOM 0 HO2' C A 13 -7.808 -12.432 5.141 1.00 10.00 H new ATOM 0 H1' C A 13 -6.840 -9.812 3.315 1.00 10.00 H new ATOM 0 H41 C A 13 -0.947 -8.848 0.767 1.00 10.00 H new ATOM 0 H42 C A 13 -2.031 -9.119 -0.601 1.00 10.00 H new ATOM 0 H5 C A 13 -1.603 -9.019 2.993 1.00 10.00 H new ATOM 0 H6 C A 13 -3.376 -9.807 4.505 1.00 10.00 H new ATOM 424 P C A 14 -5.036 -14.537 5.996 1.00 10.00 P ATOM 425 OP1 C A 14 -5.625 -15.493 6.949 1.00 10.00 O ATOM 426 OP2 C A 14 -3.589 -14.241 6.060 1.00 10.00 O ATOM 427 O5' C A 14 -5.404 -15.018 4.536 1.00 10.00 O ATOM 428 C5' C A 14 -6.718 -15.444 4.204 1.00 10.00 C ATOM 429 C4' C A 14 -6.818 -15.719 2.700 1.00 10.00 C ATOM 430 O4' C A 14 -6.604 -14.535 1.933 1.00 10.00 O ATOM 431 C3' C A 14 -5.775 -16.739 2.236 1.00 10.00 C ATOM 432 O3' C A 14 -6.186 -18.090 2.411 1.00 10.00 O ATOM 433 C2' C A 14 -5.631 -16.380 0.761 1.00 10.00 C ATOM 434 O2' C A 14 -6.613 -17.047 -0.007 1.00 10.00 O ATOM 435 C1' C A 14 -5.897 -14.869 0.739 1.00 10.00 C ATOM 436 N1 C A 14 -4.599 -14.129 0.652 1.00 10.00 N ATOM 437 C2 C A 14 -4.028 -13.961 -0.615 1.00 10.00 C ATOM 438 O2 C A 14 -4.549 -14.439 -1.615 1.00 10.00 O ATOM 439 N3 C A 14 -2.836 -13.326 -0.765 1.00 10.00 N ATOM 440 C4 C A 14 -2.171 -12.985 0.315 1.00 10.00 C ATOM 441 N4 C A 14 -1.012 -12.413 0.156 1.00 10.00 N ATOM 442 C5 C A 14 -2.696 -13.115 1.621 1.00 10.00 C ATOM 443 C6 C A 14 -3.907 -13.710 1.762 1.00 10.00 C ATOM 0 H5' C A 14 -7.440 -14.679 4.491 1.00 10.00 H new ATOM 0 H5'' C A 14 -6.969 -16.345 4.764 1.00 10.00 H new ATOM 0 H4' C A 14 -7.825 -16.104 2.542 1.00 10.00 H new ATOM 0 H3' C A 14 -4.849 -16.689 2.808 1.00 10.00 H new ATOM 0 H2' C A 14 -4.662 -16.660 0.348 1.00 10.00 H new ATOM 0 HO2' C A 14 -7.018 -17.761 0.528 1.00 10.00 H new ATOM 0 HO3' C A 14 -5.479 -18.691 2.095 1.00 10.00 H new ATOM 0 H1' C A 14 -6.494 -14.588 -0.129 1.00 10.00 H new ATOM 0 H41 C A 14 -0.465 -12.133 0.970 1.00 10.00 H new ATOM 0 H42 C A 14 -0.651 -12.245 -0.783 1.00 10.00 H new ATOM 0 H5 C A 14 -2.150 -12.752 2.479 1.00 10.00 H new ATOM 0 H6 C A 14 -4.327 -13.854 2.747 1.00 10.00 H new TER 456 C A 14