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 -20:sc= 0.0481 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -16:sc= 0.103 USER MOD Single : A 3 C O2' : rot -22:sc= 0.033 USER MOD Single : A 4 G O2' : rot -116:sc= 0.189 USER MOD Single : A 5 G O2' : rot -118:sc= 0.376 USER MOD Single : A 6 U O2' : rot 161:sc= 1.13 USER MOD Single : A 7 G O2' : rot -21:sc= 0.0816 USER MOD Single : A 8 A O2' : rot -23:sc= 0.083 USER MOD Single : A 9 A O2' : rot -13:sc= 0.193 USER MOD Single : A 10 A O2' : rot -23:sc= 0.213 USER MOD Single : A 11 U O2' : rot -17:sc= 0.322 USER MOD Single : A 12 G O2' : rot -24:sc= 0.209 USER MOD Single : A 13 C O2' : rot -15:sc= 0.128 USER MOD Single : A 14 C O2' : rot -28:sc= 0.0707 USER MOD Single : A 14 C O3' : rot 180:sc= 0.0793 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 2.775 -11.223 -10.880 1.00 10.00 O ATOM 2 C5' G A 1 1.603 -10.539 -10.457 1.00 10.00 C ATOM 3 C4' G A 1 0.465 -11.514 -10.125 1.00 10.00 C ATOM 4 O4' G A 1 0.780 -12.362 -9.023 1.00 10.00 O ATOM 5 C3' G A 1 -0.803 -10.758 -9.728 1.00 10.00 C ATOM 6 O3' G A 1 -1.512 -10.315 -10.867 1.00 10.00 O ATOM 7 C2' G A 1 -1.545 -11.853 -8.963 1.00 10.00 C ATOM 8 O2' G A 1 -2.110 -12.824 -9.834 1.00 10.00 O ATOM 9 C1' G A 1 -0.395 -12.532 -8.224 1.00 10.00 C ATOM 10 N9 G A 1 -0.157 -11.961 -6.882 1.00 10.00 N ATOM 11 C8 G A 1 0.897 -11.198 -6.458 1.00 10.00 C ATOM 12 N7 G A 1 0.990 -11.077 -5.162 1.00 10.00 N ATOM 13 C5 G A 1 -0.165 -11.722 -4.689 1.00 10.00 C ATOM 14 C6 G A 1 -0.690 -11.912 -3.360 1.00 10.00 C ATOM 15 O6 G A 1 -0.203 -11.601 -2.273 1.00 10.00 O ATOM 16 N1 G A 1 -1.918 -12.545 -3.347 1.00 10.00 N ATOM 17 C2 G A 1 -2.537 -13.018 -4.456 1.00 10.00 C ATOM 18 N2 G A 1 -3.715 -13.553 -4.309 1.00 10.00 N ATOM 19 N3 G A 1 -2.054 -12.940 -5.692 1.00 10.00 N ATOM 20 C4 G A 1 -0.877 -12.250 -5.747 1.00 10.00 C ATOM 0 H5' G A 1 1.279 -9.854 -11.241 1.00 10.00 H new ATOM 0 H5'' G A 1 1.831 -9.934 -9.580 1.00 10.00 H new ATOM 0 H4' G A 1 0.318 -12.106 -11.028 1.00 10.00 H new ATOM 0 H3' G A 1 -0.642 -9.846 -9.154 1.00 10.00 H new ATOM 0 H2' G A 1 -2.358 -11.456 -8.355 1.00 10.00 H new ATOM 0 HO2' G A 1 -2.199 -12.445 -10.733 1.00 10.00 H new ATOM 0 HO5' G A 1 3.478 -10.572 -11.084 1.00 10.00 H new ATOM 0 H1' G A 1 -0.648 -13.582 -8.076 1.00 10.00 H new ATOM 0 H8 G A 1 1.594 -10.734 -7.140 1.00 10.00 H new ATOM 0 H1 G A 1 -2.387 -12.663 -2.449 1.00 10.00 H new ATOM 0 H21 G A 1 -4.213 -13.920 -5.120 1.00 10.00 H new ATOM 0 H22 G A 1 -4.140 -13.605 -3.383 1.00 10.00 H new ATOM 33 P G A 2 -2.388 -9.000 -10.831 1.00 10.00 P ATOM 34 OP1 G A 2 -2.948 -8.876 -12.193 1.00 10.00 O ATOM 35 OP2 G A 2 -1.523 -7.928 -10.312 1.00 10.00 O ATOM 36 O5' G A 2 -3.551 -9.353 -9.794 1.00 10.00 O ATOM 37 C5' G A 2 -4.630 -10.181 -10.194 1.00 10.00 C ATOM 38 C4' G A 2 -5.523 -10.609 -9.026 1.00 10.00 C ATOM 39 O4' G A 2 -4.781 -11.287 -8.012 1.00 10.00 O ATOM 40 C3' G A 2 -6.268 -9.456 -8.351 1.00 10.00 C ATOM 41 O3' G A 2 -7.464 -9.120 -9.041 1.00 10.00 O ATOM 42 C2' G A 2 -6.564 -10.108 -6.995 1.00 10.00 C ATOM 43 O2' G A 2 -7.699 -10.974 -7.047 1.00 10.00 O ATOM 44 C1' G A 2 -5.318 -10.954 -6.734 1.00 10.00 C ATOM 45 N9 G A 2 -4.336 -10.218 -5.903 1.00 10.00 N ATOM 46 C8 G A 2 -3.186 -9.570 -6.281 1.00 10.00 C ATOM 47 N7 G A 2 -2.501 -9.075 -5.286 1.00 10.00 N ATOM 48 C5 G A 2 -3.257 -9.413 -4.156 1.00 10.00 C ATOM 49 C6 G A 2 -3.045 -9.167 -2.753 1.00 10.00 C ATOM 50 O6 G A 2 -2.115 -8.584 -2.196 1.00 10.00 O ATOM 51 N1 G A 2 -4.048 -9.670 -1.952 1.00 10.00 N ATOM 52 C2 G A 2 -5.119 -10.351 -2.421 1.00 10.00 C ATOM 53 N2 G A 2 -6.017 -10.732 -1.554 1.00 10.00 N ATOM 54 N3 G A 2 -5.366 -10.602 -3.707 1.00 10.00 N ATOM 55 C4 G A 2 -4.389 -10.106 -4.531 1.00 10.00 C ATOM 0 H5' G A 2 -4.235 -11.070 -10.686 1.00 10.00 H new ATOM 0 H5'' G A 2 -5.234 -9.650 -10.930 1.00 10.00 H new ATOM 0 H4' G A 2 -6.254 -11.272 -9.488 1.00 10.00 H new ATOM 0 H3' G A 2 -5.721 -8.514 -8.309 1.00 10.00 H new ATOM 0 H2' G A 2 -6.781 -9.361 -6.232 1.00 10.00 H new ATOM 0 HO2' G A 2 -8.218 -10.785 -7.857 1.00 10.00 H new ATOM 0 H1' G A 2 -5.566 -11.856 -6.174 1.00 10.00 H new ATOM 0 H8 G A 2 -2.875 -9.478 -7.311 1.00 10.00 H new ATOM 0 H1 G A 2 -3.979 -9.520 -0.946 1.00 10.00 H new ATOM 0 H21 G A 2 -6.840 -11.248 -1.865 1.00 10.00 H new ATOM 0 H22 G A 2 -5.896 -10.514 -0.565 1.00 10.00 H new ATOM 67 P C A 3 -8.227 -7.741 -8.785 1.00 10.00 P ATOM 68 OP1 C A 3 -9.559 -7.959 -9.403 1.00 10.00 O ATOM 69 OP2 C A 3 -7.382 -6.637 -9.254 1.00 10.00 O ATOM 70 O5' C A 3 -8.416 -7.576 -7.199 1.00 10.00 O ATOM 71 C5' C A 3 -9.550 -8.101 -6.532 1.00 10.00 C ATOM 72 C4' C A 3 -9.409 -8.128 -5.004 1.00 10.00 C ATOM 73 O4' C A 3 -8.145 -8.623 -4.566 1.00 10.00 O ATOM 74 C3' C A 3 -9.659 -6.816 -4.264 1.00 10.00 C ATOM 75 O3' C A 3 -11.049 -6.545 -4.121 1.00 10.00 O ATOM 76 C2' C A 3 -9.007 -7.180 -2.919 1.00 10.00 C ATOM 77 O2' C A 3 -9.816 -8.009 -2.081 1.00 10.00 O ATOM 78 C1' C A 3 -7.800 -8.023 -3.324 1.00 10.00 C ATOM 79 N1 C A 3 -6.551 -7.200 -3.357 1.00 10.00 N ATOM 80 C2 C A 3 -5.997 -6.859 -2.113 1.00 10.00 C ATOM 81 O2 C A 3 -6.573 -7.106 -1.066 1.00 10.00 O ATOM 82 N3 C A 3 -4.811 -6.241 -2.008 1.00 10.00 N ATOM 83 C4 C A 3 -4.173 -5.953 -3.124 1.00 10.00 C ATOM 84 N4 C A 3 -3.024 -5.362 -2.969 1.00 10.00 N ATOM 85 C5 C A 3 -4.702 -6.205 -4.429 1.00 10.00 C ATOM 86 C6 C A 3 -5.902 -6.841 -4.514 1.00 10.00 C ATOM 0 H5' C A 3 -9.734 -9.114 -6.889 1.00 10.00 H new ATOM 0 H5'' C A 3 -10.424 -7.506 -6.797 1.00 10.00 H new ATOM 0 H4' C A 3 -10.219 -8.809 -4.742 1.00 10.00 H new ATOM 0 H3' C A 3 -9.274 -5.919 -4.749 1.00 10.00 H new ATOM 0 H2' C A 3 -8.804 -6.269 -2.356 1.00 10.00 H new ATOM 0 HO2' C A 3 -10.757 -7.916 -2.339 1.00 10.00 H new ATOM 0 H1' C A 3 -7.572 -8.805 -2.599 1.00 10.00 H new ATOM 0 H41 C A 3 -2.468 -5.106 -3.785 1.00 10.00 H new ATOM 0 H42 C A 3 -2.679 -5.155 -2.032 1.00 10.00 H new ATOM 0 H5 C A 3 -4.167 -5.901 -5.317 1.00 10.00 H new ATOM 0 H6 C A 3 -6.338 -7.061 -5.477 1.00 10.00 H new ATOM 98 P G A 4 -11.609 -5.087 -3.789 1.00 10.00 P ATOM 99 OP1 G A 4 -13.002 -5.264 -3.306 1.00 10.00 O ATOM 100 OP2 G A 4 -11.373 -4.249 -4.973 1.00 10.00 O ATOM 101 O5' G A 4 -10.740 -4.506 -2.592 1.00 10.00 O ATOM 102 C5' G A 4 -10.965 -4.821 -1.225 1.00 10.00 C ATOM 103 C4' G A 4 -9.870 -4.177 -0.359 1.00 10.00 C ATOM 104 O4' G A 4 -8.567 -4.685 -0.629 1.00 10.00 O ATOM 105 C3' G A 4 -9.827 -2.662 -0.536 1.00 10.00 C ATOM 106 O3' G A 4 -10.796 -2.072 0.315 1.00 10.00 O ATOM 107 C2' G A 4 -8.373 -2.351 -0.174 1.00 10.00 C ATOM 108 O2' G A 4 -8.184 -2.231 1.230 1.00 10.00 O ATOM 109 C1' G A 4 -7.640 -3.597 -0.673 1.00 10.00 C ATOM 110 N9 G A 4 -7.090 -3.404 -2.040 1.00 10.00 N ATOM 111 C8 G A 4 -7.656 -3.643 -3.269 1.00 10.00 C ATOM 112 N7 G A 4 -6.891 -3.372 -4.289 1.00 10.00 N ATOM 113 C5 G A 4 -5.711 -2.910 -3.692 1.00 10.00 C ATOM 114 C6 G A 4 -4.459 -2.472 -4.251 1.00 10.00 C ATOM 115 O6 G A 4 -4.112 -2.422 -5.426 1.00 10.00 O ATOM 116 N1 G A 4 -3.534 -2.071 -3.306 1.00 10.00 N ATOM 117 C2 G A 4 -3.751 -2.158 -1.970 1.00 10.00 C ATOM 118 N2 G A 4 -2.783 -1.785 -1.181 1.00 10.00 N ATOM 119 N3 G A 4 -4.878 -2.587 -1.407 1.00 10.00 N ATOM 120 C4 G A 4 -5.829 -2.936 -2.320 1.00 10.00 C ATOM 0 H5' G A 4 -10.964 -5.902 -1.086 1.00 10.00 H new ATOM 0 H5'' G A 4 -11.946 -4.461 -0.915 1.00 10.00 H new ATOM 0 H4' G A 4 -10.142 -4.433 0.665 1.00 10.00 H new ATOM 0 H3' G A 4 -10.075 -2.274 -1.524 1.00 10.00 H new ATOM 0 H2' G A 4 -8.032 -1.409 -0.603 1.00 10.00 H new ATOM 0 HO2' G A 4 -7.912 -1.315 1.446 1.00 10.00 H new ATOM 0 H1' G A 4 -6.781 -3.805 -0.035 1.00 10.00 H new ATOM 0 H8 G A 4 -8.659 -4.027 -3.381 1.00 10.00 H new ATOM 0 H1 G A 4 -2.644 -1.691 -3.629 1.00 10.00 H new ATOM 0 H21 G A 4 -2.902 -1.833 -0.169 1.00 10.00 H new ATOM 0 H22 G A 4 -1.906 -1.445 -1.575 1.00 10.00 H new ATOM 132 P G A 5 -11.261 -0.579 0.106 1.00 10.00 P ATOM 133 OP1 G A 5 -12.382 -0.352 1.039 1.00 10.00 O ATOM 134 OP2 G A 5 -11.487 -0.379 -1.344 1.00 10.00 O ATOM 135 O5' G A 5 -10.028 0.332 0.527 1.00 10.00 O ATOM 136 C5' G A 5 -9.786 0.716 1.869 1.00 10.00 C ATOM 137 C4' G A 5 -8.488 1.529 1.941 1.00 10.00 C ATOM 138 O4' G A 5 -7.410 0.791 1.372 1.00 10.00 O ATOM 139 C3' G A 5 -8.589 2.884 1.238 1.00 10.00 C ATOM 140 O3' G A 5 -9.132 3.864 2.118 1.00 10.00 O ATOM 141 C2' G A 5 -7.123 3.102 0.832 1.00 10.00 C ATOM 142 O2' G A 5 -6.301 3.683 1.835 1.00 10.00 O ATOM 143 C1' G A 5 -6.607 1.682 0.607 1.00 10.00 C ATOM 144 N9 G A 5 -6.615 1.335 -0.830 1.00 10.00 N ATOM 145 C8 G A 5 -7.665 1.057 -1.662 1.00 10.00 C ATOM 146 N7 G A 5 -7.344 0.962 -2.926 1.00 10.00 N ATOM 147 C5 G A 5 -5.950 1.140 -2.922 1.00 10.00 C ATOM 148 C6 G A 5 -4.963 1.131 -3.974 1.00 10.00 C ATOM 149 O6 G A 5 -5.124 1.021 -5.188 1.00 10.00 O ATOM 150 N1 G A 5 -3.658 1.246 -3.522 1.00 10.00 N ATOM 151 C2 G A 5 -3.341 1.403 -2.208 1.00 10.00 C ATOM 152 N2 G A 5 -2.103 1.260 -1.834 1.00 10.00 N ATOM 153 N3 G A 5 -4.220 1.476 -1.216 1.00 10.00 N ATOM 154 C4 G A 5 -5.506 1.329 -1.634 1.00 10.00 C ATOM 0 H5' G A 5 -9.710 -0.167 2.503 1.00 10.00 H new ATOM 0 H5'' G A 5 -10.620 1.308 2.245 1.00 10.00 H new ATOM 0 H4' G A 5 -8.306 1.719 2.999 1.00 10.00 H new ATOM 0 H3' G A 5 -9.261 2.943 0.382 1.00 10.00 H new ATOM 0 H2' G A 5 -7.084 3.785 -0.016 1.00 10.00 H new ATOM 0 HO2' G A 5 -5.965 4.549 1.522 1.00 10.00 H new ATOM 0 H1' G A 5 -5.570 1.604 0.935 1.00 10.00 H new ATOM 0 H8 G A 5 -8.676 0.927 -1.304 1.00 10.00 H new ATOM 0 H1 G A 5 -2.901 1.211 -4.205 1.00 10.00 H new ATOM 0 H21 G A 5 -1.850 1.375 -0.852 1.00 10.00 H new ATOM 0 H22 G A 5 -1.385 1.033 -2.522 1.00 10.00 H new ATOM 166 P U A 6 -9.841 5.179 1.574 1.00 10.00 P ATOM 167 OP1 U A 6 -10.327 5.992 2.719 1.00 10.00 O ATOM 168 OP2 U A 6 -10.809 4.809 0.529 1.00 10.00 O ATOM 169 O5' U A 6 -8.679 6.008 0.867 1.00 10.00 O ATOM 170 C5' U A 6 -7.675 6.644 1.639 1.00 10.00 C ATOM 171 C4' U A 6 -6.503 7.076 0.754 1.00 10.00 C ATOM 172 O4' U A 6 -5.957 5.976 0.034 1.00 10.00 O ATOM 173 C3' U A 6 -6.900 8.088 -0.312 1.00 10.00 C ATOM 174 O3' U A 6 -7.127 9.394 0.216 1.00 10.00 O ATOM 175 C2' U A 6 -5.715 7.944 -1.260 1.00 10.00 C ATOM 176 O2' U A 6 -4.709 8.854 -0.873 1.00 10.00 O ATOM 177 C1' U A 6 -5.253 6.486 -1.100 1.00 10.00 C ATOM 178 N1 U A 6 -5.507 5.737 -2.369 1.00 10.00 N ATOM 179 C2 U A 6 -4.528 5.746 -3.379 1.00 10.00 C ATOM 180 O2 U A 6 -3.403 6.202 -3.214 1.00 10.00 O ATOM 181 N3 U A 6 -4.867 5.202 -4.603 1.00 10.00 N ATOM 182 C4 U A 6 -6.109 4.706 -4.924 1.00 10.00 C ATOM 183 O4 U A 6 -6.388 4.397 -6.076 1.00 10.00 O ATOM 184 C5 U A 6 -7.029 4.624 -3.809 1.00 10.00 C ATOM 185 C6 U A 6 -6.724 5.146 -2.595 1.00 10.00 C ATOM 0 H5' U A 6 -7.320 5.965 2.414 1.00 10.00 H new ATOM 0 H5'' U A 6 -8.095 7.513 2.145 1.00 10.00 H new ATOM 0 H4' U A 6 -5.788 7.510 1.453 1.00 10.00 H new ATOM 0 H3' U A 6 -7.859 7.918 -0.801 1.00 10.00 H new ATOM 0 H2' U A 6 -5.960 8.161 -2.300 1.00 10.00 H new ATOM 0 HO2' U A 6 -3.851 8.576 -1.256 1.00 10.00 H new ATOM 0 H1' U A 6 -4.182 6.386 -0.923 1.00 10.00 H new ATOM 0 H3 U A 6 -4.143 5.166 -5.321 1.00 10.00 H new ATOM 0 H5 U A 6 -7.982 4.135 -3.948 1.00 10.00 H new ATOM 0 H6 U A 6 -7.449 5.096 -1.796 1.00 10.00 H new ATOM 196 P G A 7 -7.780 10.529 -0.685 1.00 10.00 P ATOM 197 OP1 G A 7 -8.162 11.647 0.204 1.00 10.00 O ATOM 198 OP2 G A 7 -8.826 9.909 -1.527 1.00 10.00 O ATOM 199 O5' G A 7 -6.620 11.065 -1.646 1.00 10.00 O ATOM 200 C5' G A 7 -6.915 12.089 -2.593 1.00 10.00 C ATOM 201 C4' G A 7 -5.757 12.483 -3.524 1.00 10.00 C ATOM 202 O4' G A 7 -4.775 13.291 -2.885 1.00 10.00 O ATOM 203 C3' G A 7 -5.026 11.305 -4.168 1.00 10.00 C ATOM 204 O3' G A 7 -5.652 10.823 -5.335 1.00 10.00 O ATOM 205 C2' G A 7 -3.656 11.894 -4.476 1.00 10.00 C ATOM 206 O2' G A 7 -3.584 12.613 -5.704 1.00 10.00 O ATOM 207 C1' G A 7 -3.488 12.868 -3.318 1.00 10.00 C ATOM 208 N9 G A 7 -2.805 12.207 -2.194 1.00 10.00 N ATOM 209 C8 G A 7 -3.343 11.692 -1.044 1.00 10.00 C ATOM 210 N7 G A 7 -2.459 11.452 -0.110 1.00 10.00 N ATOM 211 C5 G A 7 -1.233 11.670 -0.769 1.00 10.00 C ATOM 212 C6 G A 7 0.130 11.478 -0.353 1.00 10.00 C ATOM 213 O6 G A 7 0.564 11.165 0.754 1.00 10.00 O ATOM 214 N1 G A 7 1.046 11.646 -1.371 1.00 10.00 N ATOM 215 C2 G A 7 0.721 12.032 -2.627 1.00 10.00 C ATOM 216 N2 G A 7 1.699 12.079 -3.491 1.00 10.00 N ATOM 217 N3 G A 7 -0.514 12.300 -3.044 1.00 10.00 N ATOM 218 C4 G A 7 -1.449 12.073 -2.068 1.00 10.00 C ATOM 0 H5' G A 7 -7.241 12.977 -2.052 1.00 10.00 H new ATOM 0 H5'' G A 7 -7.755 11.762 -3.205 1.00 10.00 H new ATOM 0 H4' G A 7 -6.268 13.048 -4.304 1.00 10.00 H new ATOM 0 H3' G A 7 -5.002 10.432 -3.516 1.00 10.00 H new ATOM 0 H2' G A 7 -2.898 11.117 -4.580 1.00 10.00 H new ATOM 0 HO2' G A 7 -4.312 12.326 -6.294 1.00 10.00 H new ATOM 0 H1' G A 7 -2.894 13.720 -3.649 1.00 10.00 H new ATOM 0 H8 G A 7 -4.399 11.502 -0.920 1.00 10.00 H new ATOM 0 H1 G A 7 2.029 11.468 -1.164 1.00 10.00 H new ATOM 0 H21 G A 7 1.516 12.363 -4.453 1.00 10.00 H new ATOM 0 H22 G A 7 2.646 11.832 -3.203 1.00 10.00 H new ATOM 230 P A A 8 -5.583 9.284 -5.710 1.00 10.00 P ATOM 231 OP1 A A 8 -6.077 9.222 -7.104 1.00 10.00 O ATOM 232 OP2 A A 8 -6.308 8.548 -4.666 1.00 10.00 O ATOM 233 O5' A A 8 -4.039 8.876 -5.681 1.00 10.00 O ATOM 234 C5' A A 8 -3.219 9.006 -6.830 1.00 10.00 C ATOM 235 C4' A A 8 -1.733 8.806 -6.511 1.00 10.00 C ATOM 236 O4' A A 8 -1.319 9.694 -5.486 1.00 10.00 O ATOM 237 C3' A A 8 -1.330 7.402 -6.057 1.00 10.00 C ATOM 238 O3' A A 8 -1.160 6.519 -7.152 1.00 10.00 O ATOM 239 C2' A A 8 0.015 7.707 -5.371 1.00 10.00 C ATOM 240 O2' A A 8 1.104 7.827 -6.284 1.00 10.00 O ATOM 241 C1' A A 8 -0.293 9.064 -4.742 1.00 10.00 C ATOM 242 N9 A A 8 -0.680 8.832 -3.339 1.00 10.00 N ATOM 243 C8 A A 8 -1.915 8.711 -2.752 1.00 10.00 C ATOM 244 N7 A A 8 -1.853 8.479 -1.465 1.00 10.00 N ATOM 245 C5 A A 8 -0.484 8.385 -1.204 1.00 10.00 C ATOM 246 C6 A A 8 0.311 8.140 -0.059 1.00 10.00 C ATOM 247 N6 A A 8 -0.161 7.972 1.160 1.00 10.00 N ATOM 248 N1 A A 8 1.643 8.045 -0.161 1.00 10.00 N ATOM 249 C2 A A 8 2.183 8.235 -1.359 1.00 10.00 C ATOM 250 N3 A A 8 1.584 8.533 -2.499 1.00 10.00 N ATOM 251 C4 A A 8 0.231 8.579 -2.350 1.00 10.00 C ATOM 0 H5' A A 8 -3.365 9.994 -7.267 1.00 10.00 H new ATOM 0 H5'' A A 8 -3.529 8.277 -7.579 1.00 10.00 H new ATOM 0 H4' A A 8 -1.245 8.996 -7.467 1.00 10.00 H new ATOM 0 H3' A A 8 -2.067 6.904 -5.427 1.00 10.00 H new ATOM 0 H2' A A 8 0.331 6.920 -4.687 1.00 10.00 H new ATOM 0 HO2' A A 8 0.893 7.344 -7.110 1.00 10.00 H new ATOM 0 H1' A A 8 0.573 9.726 -4.758 1.00 10.00 H new ATOM 0 H8 A A 8 -2.844 8.798 -3.297 1.00 10.00 H new ATOM 0 H61 A A 8 0.479 7.799 1.935 1.00 10.00 H new ATOM 0 H62 A A 8 -1.166 8.015 1.328 1.00 10.00 H new ATOM 0 H2 A A 8 3.257 8.132 -1.409 1.00 10.00 H new ATOM 263 P A A 9 -1.220 4.951 -6.924 1.00 10.00 P ATOM 264 OP1 A A 9 -0.690 4.333 -8.154 1.00 10.00 O ATOM 265 OP2 A A 9 -2.551 4.583 -6.418 1.00 10.00 O ATOM 266 O5' A A 9 -0.115 4.706 -5.805 1.00 10.00 O ATOM 267 C5' A A 9 -0.466 4.139 -4.554 1.00 10.00 C ATOM 268 C4' A A 9 0.726 4.218 -3.596 1.00 10.00 C ATOM 269 O4' A A 9 0.612 5.353 -2.733 1.00 10.00 O ATOM 270 C3' A A 9 0.854 2.976 -2.715 1.00 10.00 C ATOM 271 O3' A A 9 1.695 1.980 -3.286 1.00 10.00 O ATOM 272 C2' A A 9 1.492 3.584 -1.472 1.00 10.00 C ATOM 273 O2' A A 9 2.895 3.698 -1.647 1.00 10.00 O ATOM 274 C1' A A 9 0.892 4.968 -1.391 1.00 10.00 C ATOM 275 N9 A A 9 -0.327 4.906 -0.554 1.00 10.00 N ATOM 276 C8 A A 9 -1.631 4.877 -0.959 1.00 10.00 C ATOM 277 N7 A A 9 -2.503 4.824 0.016 1.00 10.00 N ATOM 278 C5 A A 9 -1.695 4.746 1.154 1.00 10.00 C ATOM 279 C6 A A 9 -1.941 4.619 2.541 1.00 10.00 C ATOM 280 N6 A A 9 -3.131 4.480 3.093 1.00 10.00 N ATOM 281 N1 A A 9 -0.934 4.620 3.418 1.00 10.00 N ATOM 282 C2 A A 9 0.300 4.675 2.932 1.00 10.00 C ATOM 283 N3 A A 9 0.696 4.769 1.669 1.00 10.00 N ATOM 284 C4 A A 9 -0.369 4.806 0.817 1.00 10.00 C ATOM 0 H5' A A 9 -0.769 3.100 -4.687 1.00 10.00 H new ATOM 0 H5'' A A 9 -1.320 4.668 -4.131 1.00 10.00 H new ATOM 0 H4' A A 9 1.610 4.299 -4.229 1.00 10.00 H new ATOM 0 H3' A A 9 -0.089 2.455 -2.550 1.00 10.00 H new ATOM 0 H2' A A 9 1.318 2.982 -0.580 1.00 10.00 H new ATOM 0 HO2' A A 9 3.171 3.174 -2.428 1.00 10.00 H new ATOM 0 H1' A A 9 1.556 5.701 -0.932 1.00 10.00 H new ATOM 0 H8 A A 9 -1.919 4.896 -2.000 1.00 10.00 H new ATOM 0 H61 A A 9 -3.217 4.395 4.106 1.00 10.00 H new ATOM 0 H62 A A 9 -3.966 4.458 2.507 1.00 10.00 H new ATOM 0 H2 A A 9 1.091 4.638 3.666 1.00 10.00 H new ATOM 296 P A A 10 1.601 0.445 -2.848 1.00 10.00 P ATOM 297 OP1 A A 10 2.605 -0.290 -3.646 1.00 10.00 O ATOM 298 OP2 A A 10 0.180 0.053 -2.846 1.00 10.00 O ATOM 299 O5' A A 10 2.102 0.458 -1.328 1.00 10.00 O ATOM 300 C5' A A 10 3.468 0.543 -0.976 1.00 10.00 C ATOM 301 C4' A A 10 3.626 0.916 0.509 1.00 10.00 C ATOM 302 O4' A A 10 2.728 1.944 0.923 1.00 10.00 O ATOM 303 C3' A A 10 3.443 -0.264 1.465 1.00 10.00 C ATOM 304 O3' A A 10 4.666 -0.928 1.755 1.00 10.00 O ATOM 305 C2' A A 10 2.933 0.439 2.725 1.00 10.00 C ATOM 306 O2' A A 10 4.012 0.958 3.497 1.00 10.00 O ATOM 307 C1' A A 10 2.134 1.610 2.171 1.00 10.00 C ATOM 308 N9 A A 10 0.689 1.289 2.037 1.00 10.00 N ATOM 309 C8 A A 10 -0.062 1.102 0.900 1.00 10.00 C ATOM 310 N7 A A 10 -1.344 1.006 1.103 1.00 10.00 N ATOM 311 C5 A A 10 -1.452 1.132 2.488 1.00 10.00 C ATOM 312 C6 A A 10 -2.539 1.175 3.386 1.00 10.00 C ATOM 313 N6 A A 10 -3.795 1.038 3.011 1.00 10.00 N ATOM 314 N1 A A 10 -2.345 1.360 4.696 1.00 10.00 N ATOM 315 C2 A A 10 -1.090 1.456 5.118 1.00 10.00 C ATOM 316 N3 A A 10 0.036 1.418 4.407 1.00 10.00 N ATOM 317 C4 A A 10 -0.223 1.275 3.072 1.00 10.00 C ATOM 0 H5' A A 10 3.963 1.289 -1.598 1.00 10.00 H new ATOM 0 H5'' A A 10 3.959 -0.411 -1.171 1.00 10.00 H new ATOM 0 H4' A A 10 4.655 1.270 0.569 1.00 10.00 H new ATOM 0 H3' A A 10 2.789 -1.036 1.058 1.00 10.00 H new ATOM 0 H2' A A 10 2.368 -0.234 3.370 1.00 10.00 H new ATOM 0 HO2' A A 10 4.832 0.465 3.286 1.00 10.00 H new ATOM 0 H1' A A 10 2.167 2.459 2.854 1.00 10.00 H new ATOM 0 H8 A A 10 0.378 1.040 -0.084 1.00 10.00 H new ATOM 0 H61 A A 10 -4.542 1.078 3.705 1.00 10.00 H new ATOM 0 H62 A A 10 -4.020 0.892 2.027 1.00 10.00 H new ATOM 0 H2 A A 10 -0.965 1.582 6.183 1.00 10.00 H new ATOM 329 P U A 11 4.677 -2.473 2.146 1.00 10.00 P ATOM 330 OP1 U A 11 6.043 -2.721 2.672 1.00 10.00 O ATOM 331 OP2 U A 11 4.207 -3.218 0.972 1.00 10.00 O ATOM 332 O5' U A 11 3.637 -2.690 3.338 1.00 10.00 O ATOM 333 C5' U A 11 3.995 -2.435 4.685 1.00 10.00 C ATOM 334 C4' U A 11 2.795 -2.471 5.628 1.00 10.00 C ATOM 335 O4' U A 11 1.776 -1.607 5.133 1.00 10.00 O ATOM 336 C3' U A 11 2.154 -3.845 5.864 1.00 10.00 C ATOM 337 O3' U A 11 2.759 -4.594 6.922 1.00 10.00 O ATOM 338 C2' U A 11 0.777 -3.358 6.326 1.00 10.00 C ATOM 339 O2' U A 11 0.824 -3.051 7.715 1.00 10.00 O ATOM 340 C1' U A 11 0.509 -2.065 5.564 1.00 10.00 C ATOM 341 N1 U A 11 -0.464 -2.260 4.453 1.00 10.00 N ATOM 342 C2 U A 11 -1.822 -2.117 4.770 1.00 10.00 C ATOM 343 O2 U A 11 -2.222 -1.936 5.920 1.00 10.00 O ATOM 344 N3 U A 11 -2.721 -2.197 3.730 1.00 10.00 N ATOM 345 C4 U A 11 -2.397 -2.429 2.421 1.00 10.00 C ATOM 346 O4 U A 11 -3.276 -2.431 1.582 1.00 10.00 O ATOM 347 C5 U A 11 -0.997 -2.665 2.180 1.00 10.00 C ATOM 348 C6 U A 11 -0.069 -2.573 3.169 1.00 10.00 C ATOM 0 H5' U A 11 4.475 -1.459 4.751 1.00 10.00 H new ATOM 0 H5'' U A 11 4.729 -3.173 5.008 1.00 10.00 H new ATOM 0 H4' U A 11 3.205 -2.157 6.588 1.00 10.00 H new ATOM 0 H3' U A 11 2.210 -4.513 5.005 1.00 10.00 H new ATOM 0 H2' U A 11 0.011 -4.113 6.149 1.00 10.00 H new ATOM 0 HO2' U A 11 1.616 -3.467 8.115 1.00 10.00 H new ATOM 0 H1' U A 11 0.030 -1.315 6.194 1.00 10.00 H new ATOM 0 H3 U A 11 -3.708 -2.073 3.954 1.00 10.00 H new ATOM 0 H5 U A 11 -0.674 -2.923 1.182 1.00 10.00 H new ATOM 0 H6 U A 11 0.975 -2.744 2.950 1.00 10.00 H new ATOM 359 P G A 12 2.562 -6.182 7.091 1.00 10.00 P ATOM 360 OP1 G A 12 2.864 -6.504 8.504 1.00 10.00 O ATOM 361 OP2 G A 12 3.347 -6.871 6.047 1.00 10.00 O ATOM 362 O5' G A 12 0.990 -6.499 6.862 1.00 10.00 O ATOM 363 C5' G A 12 0.059 -6.405 7.940 1.00 10.00 C ATOM 364 C4' G A 12 -1.433 -6.426 7.545 1.00 10.00 C ATOM 365 O4' G A 12 -1.785 -5.368 6.655 1.00 10.00 O ATOM 366 C3' G A 12 -2.003 -7.736 6.980 1.00 10.00 C ATOM 367 O3' G A 12 -2.373 -8.617 8.045 1.00 10.00 O ATOM 368 C2' G A 12 -3.236 -7.170 6.261 1.00 10.00 C ATOM 369 O2' G A 12 -4.286 -6.969 7.193 1.00 10.00 O ATOM 370 C1' G A 12 -2.788 -5.805 5.741 1.00 10.00 C ATOM 371 N9 G A 12 -2.239 -5.876 4.360 1.00 10.00 N ATOM 372 C8 G A 12 -0.923 -5.955 3.980 1.00 10.00 C ATOM 373 N7 G A 12 -0.724 -5.937 2.694 1.00 10.00 N ATOM 374 C5 G A 12 -2.015 -5.826 2.161 1.00 10.00 C ATOM 375 C6 G A 12 -2.470 -5.738 0.795 1.00 10.00 C ATOM 376 O6 G A 12 -1.814 -5.705 -0.247 1.00 10.00 O ATOM 377 N1 G A 12 -3.838 -5.719 0.686 1.00 10.00 N ATOM 378 C2 G A 12 -4.683 -5.734 1.738 1.00 10.00 C ATOM 379 N2 G A 12 -5.944 -5.864 1.433 1.00 10.00 N ATOM 380 N3 G A 12 -4.319 -5.793 3.029 1.00 10.00 N ATOM 381 C4 G A 12 -2.955 -5.827 3.176 1.00 10.00 C ATOM 0 H5' G A 12 0.257 -5.483 8.487 1.00 10.00 H new ATOM 0 H5'' G A 12 0.245 -7.230 8.628 1.00 10.00 H new ATOM 0 H4' G A 12 -1.897 -6.296 8.523 1.00 10.00 H new ATOM 0 H3' G A 12 -1.332 -8.324 6.354 1.00 10.00 H new ATOM 0 H2' G A 12 -3.592 -7.837 5.476 1.00 10.00 H new ATOM 0 HO2' G A 12 -4.159 -7.563 7.962 1.00 10.00 H new ATOM 0 H1' G A 12 -3.632 -5.118 5.683 1.00 10.00 H new ATOM 0 H8 G A 12 -0.115 -6.027 4.693 1.00 10.00 H new ATOM 0 H1 G A 12 -4.242 -5.692 -0.250 1.00 10.00 H new ATOM 0 H21 G A 12 -6.648 -5.884 2.171 1.00 10.00 H new ATOM 0 H22 G A 12 -6.227 -5.945 0.456 1.00 10.00 H new ATOM 393 P C A 13 -2.306 -10.203 7.903 1.00 10.00 P ATOM 394 OP1 C A 13 -2.648 -10.785 9.226 1.00 10.00 O ATOM 395 OP2 C A 13 -1.024 -10.555 7.272 1.00 10.00 O ATOM 396 O5' C A 13 -3.491 -10.573 6.903 1.00 10.00 O ATOM 397 C5' C A 13 -4.849 -10.462 7.301 1.00 10.00 C ATOM 398 C4' C A 13 -5.819 -10.538 6.119 1.00 10.00 C ATOM 399 O4' C A 13 -5.612 -9.468 5.216 1.00 10.00 O ATOM 400 C3' C A 13 -5.738 -11.844 5.326 1.00 10.00 C ATOM 401 O3' C A 13 -6.540 -12.844 5.962 1.00 10.00 O ATOM 402 C2' C A 13 -6.334 -11.377 3.990 1.00 10.00 C ATOM 403 O2' C A 13 -7.756 -11.380 4.010 1.00 10.00 O ATOM 404 C1' C A 13 -5.853 -9.924 3.895 1.00 10.00 C ATOM 405 N1 C A 13 -4.615 -9.791 3.075 1.00 10.00 N ATOM 406 C2 C A 13 -4.771 -9.700 1.693 1.00 10.00 C ATOM 407 O2 C A 13 -5.845 -9.967 1.140 1.00 10.00 O ATOM 408 N3 C A 13 -3.745 -9.363 0.894 1.00 10.00 N ATOM 409 C4 C A 13 -2.575 -9.109 1.460 1.00 10.00 C ATOM 410 N4 C A 13 -1.614 -8.758 0.661 1.00 10.00 N ATOM 411 C5 C A 13 -2.319 -9.272 2.850 1.00 10.00 C ATOM 412 C6 C A 13 -3.363 -9.635 3.637 1.00 10.00 C ATOM 0 H5' C A 13 -4.994 -9.517 7.824 1.00 10.00 H new ATOM 0 H5'' C A 13 -5.082 -11.257 8.009 1.00 10.00 H new ATOM 0 H4' C A 13 -6.807 -10.481 6.575 1.00 10.00 H new ATOM 0 H3' C A 13 -4.751 -12.296 5.235 1.00 10.00 H new ATOM 0 H2' C A 13 -6.034 -12.022 3.164 1.00 10.00 H new ATOM 0 HO2' C A 13 -8.071 -11.908 4.773 1.00 10.00 H new ATOM 0 H1' C A 13 -6.618 -9.326 3.401 1.00 10.00 H new ATOM 0 H41 C A 13 -0.689 -8.549 1.037 1.00 10.00 H new ATOM 0 H42 C A 13 -1.784 -8.691 -0.343 1.00 10.00 H new ATOM 0 H5 C A 13 -1.333 -9.113 3.262 1.00 10.00 H new ATOM 0 H6 C A 13 -3.216 -9.801 4.694 1.00 10.00 H new ATOM 424 P C A 14 -6.244 -14.403 5.847 1.00 10.00 P ATOM 425 OP1 C A 14 -7.362 -15.113 6.509 1.00 10.00 O ATOM 426 OP2 C A 14 -4.885 -14.674 6.350 1.00 10.00 O ATOM 427 O5' C A 14 -6.252 -14.758 4.292 1.00 10.00 O ATOM 428 C5' C A 14 -7.443 -15.108 3.600 1.00 10.00 C ATOM 429 C4' C A 14 -7.184 -15.260 2.097 1.00 10.00 C ATOM 430 O4' C A 14 -6.763 -14.014 1.561 1.00 10.00 O ATOM 431 C3' C A 14 -6.100 -16.275 1.718 1.00 10.00 C ATOM 432 O3' C A 14 -6.543 -17.625 1.653 1.00 10.00 O ATOM 433 C2' C A 14 -5.684 -15.771 0.332 1.00 10.00 C ATOM 434 O2' C A 14 -6.468 -16.266 -0.751 1.00 10.00 O ATOM 435 C1' C A 14 -5.901 -14.257 0.462 1.00 10.00 C ATOM 436 N1 C A 14 -4.584 -13.582 0.632 1.00 10.00 N ATOM 437 C2 C A 14 -3.859 -13.355 -0.537 1.00 10.00 C ATOM 438 O2 C A 14 -4.283 -13.672 -1.640 1.00 10.00 O ATOM 439 N3 C A 14 -2.621 -12.841 -0.503 1.00 10.00 N ATOM 440 C4 C A 14 -2.110 -12.520 0.663 1.00 10.00 C ATOM 441 N4 C A 14 -0.923 -12.000 0.605 1.00 10.00 N ATOM 442 C5 C A 14 -2.760 -12.782 1.908 1.00 10.00 C ATOM 443 C6 C A 14 -4.006 -13.326 1.855 1.00 10.00 C ATOM 0 H5' C A 14 -8.202 -14.343 3.766 1.00 10.00 H new ATOM 0 H5'' C A 14 -7.839 -16.041 4.000 1.00 10.00 H new ATOM 0 H4' C A 14 -8.131 -15.617 1.693 1.00 10.00 H new ATOM 0 H3' C A 14 -5.307 -16.320 2.464 1.00 10.00 H new ATOM 0 H2' C A 14 -4.672 -16.097 0.091 1.00 10.00 H new ATOM 0 HO2' C A 14 -6.835 -17.144 -0.515 1.00 10.00 H new ATOM 0 HO3' C A 14 -5.792 -18.204 1.404 1.00 10.00 H new ATOM 0 H1' C A 14 -6.367 -13.853 -0.437 1.00 10.00 H new ATOM 0 H41 C A 14 -0.447 -11.719 1.462 1.00 10.00 H new ATOM 0 H42 C A 14 -0.466 -11.872 -0.298 1.00 10.00 H new ATOM 0 H5 C A 14 -2.283 -12.558 2.851 1.00 10.00 H new ATOM 0 H6 C A 14 -4.538 -13.555 2.766 1.00 10.00 H new TER 456 C A 14