USER MOD reduce.3.24.130724 H: found=0, std=0, add=155, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 155 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= -0.191 USER MOD Single : A 1 G O5' : rot 180:sc=-0.00482 USER MOD Single : A 2 G O2' : rot -21:sc= 0.0718 USER MOD Single : A 3 C O2' : rot -22:sc= 0.0256 USER MOD Single : A 4 G O2' : rot 180:sc= -0.0943 USER MOD Single : A 5 C O2' : rot -19:sc= 0.0537 USER MOD Single : A 6 A O2' : rot -15:sc= -0.482 USER MOD Single : A 7 U O2' : rot 16:sc= 0.0387 USER MOD Single : A 8 C O2' : rot 180:sc= -1.06 USER MOD Single : A 9 G O2' : rot 25:sc= 0.162 USER MOD Single : A 10 G O2' : rot 180:sc= -0.152 USER MOD Single : A 11 C O2' : rot -26:sc= 0.0596 USER MOD Single : A 12 G O2' : rot -18:sc= 0.0641 USER MOD Single : A 13 C O2' : rot 180:sc= -0.0928 USER MOD Single : A 14 C O2' : rot -18:sc= 0.104 USER MOD Single : A 14 C O3' : rot 180:sc= 0.122 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 6.766 -8.982 -9.289 1.00 0.00 O ATOM 2 C5' G A 1 7.899 -9.827 -9.224 1.00 0.00 C ATOM 3 C4' G A 1 8.916 -9.332 -8.191 1.00 0.00 C ATOM 4 O4' G A 1 9.554 -8.126 -8.598 1.00 0.00 O ATOM 5 C3' G A 1 8.309 -9.038 -6.826 1.00 0.00 C ATOM 6 O3' G A 1 8.046 -10.207 -6.066 1.00 0.00 O ATOM 7 C2' G A 1 9.428 -8.192 -6.238 1.00 0.00 C ATOM 8 O2' G A 1 10.535 -8.984 -5.877 1.00 0.00 O ATOM 9 C1' G A 1 9.824 -7.344 -7.442 1.00 0.00 C ATOM 10 N9 G A 1 9.017 -6.106 -7.449 1.00 0.00 N ATOM 11 C8 G A 1 7.841 -5.833 -8.098 1.00 0.00 C ATOM 12 N7 G A 1 7.387 -4.628 -7.885 1.00 0.00 N ATOM 13 C5 G A 1 8.337 -4.059 -7.038 1.00 0.00 C ATOM 14 C6 G A 1 8.407 -2.755 -6.461 1.00 0.00 C ATOM 15 O6 G A 1 7.619 -1.824 -6.588 1.00 0.00 O ATOM 16 N1 G A 1 9.536 -2.589 -5.668 1.00 0.00 N ATOM 17 C2 G A 1 10.484 -3.557 -5.449 1.00 0.00 C ATOM 18 N2 G A 1 11.511 -3.223 -4.667 1.00 0.00 N ATOM 19 N3 G A 1 10.427 -4.781 -5.979 1.00 0.00 N ATOM 20 C4 G A 1 9.332 -4.960 -6.763 1.00 0.00 C ATOM 0 H5' G A 1 8.372 -9.878 -10.205 1.00 0.00 H new ATOM 0 H5'' G A 1 7.584 -10.839 -8.969 1.00 0.00 H new ATOM 0 H4' G A 1 9.624 -10.158 -8.118 1.00 0.00 H new ATOM 0 H3' G A 1 7.329 -8.562 -6.853 1.00 0.00 H new ATOM 0 H2' G A 1 9.127 -7.645 -5.344 1.00 0.00 H new ATOM 0 HO2' G A 1 11.238 -8.413 -5.504 1.00 0.00 H new ATOM 0 HO5' G A 1 6.139 -9.326 -9.959 1.00 0.00 H new ATOM 0 H1' G A 1 10.876 -7.060 -7.412 1.00 0.00 H new ATOM 0 H8 G A 1 7.336 -6.550 -8.728 1.00 0.00 H new ATOM 0 H1 G A 1 9.670 -1.684 -5.217 1.00 0.00 H new ATOM 0 H21 G A 1 12.245 -3.904 -4.470 1.00 0.00 H new ATOM 0 H22 G A 1 11.563 -2.287 -4.265 1.00 0.00 H new ATOM 33 P G A 2 6.994 -10.167 -4.856 1.00 0.00 P ATOM 34 OP1 G A 2 5.753 -9.518 -5.348 1.00 0.00 O ATOM 35 OP2 G A 2 6.912 -11.520 -4.265 1.00 0.00 O ATOM 36 O5' G A 2 7.679 -9.182 -3.785 1.00 0.00 O ATOM 37 C5' G A 2 8.834 -9.564 -3.064 1.00 0.00 C ATOM 38 C4' G A 2 9.230 -8.468 -2.070 1.00 0.00 C ATOM 39 O4' G A 2 9.621 -7.261 -2.706 1.00 0.00 O ATOM 40 C3' G A 2 8.100 -8.083 -1.132 1.00 0.00 C ATOM 41 O3' G A 2 7.861 -9.030 -0.111 1.00 0.00 O ATOM 42 C2' G A 2 8.616 -6.758 -0.598 1.00 0.00 C ATOM 43 O2' G A 2 9.599 -6.959 0.401 1.00 0.00 O ATOM 44 C1' G A 2 9.292 -6.176 -1.840 1.00 0.00 C ATOM 45 N9 G A 2 8.379 -5.228 -2.511 1.00 0.00 N ATOM 46 C8 G A 2 7.427 -5.464 -3.469 1.00 0.00 C ATOM 47 N7 G A 2 6.798 -4.390 -3.865 1.00 0.00 N ATOM 48 C5 G A 2 7.372 -3.365 -3.109 1.00 0.00 C ATOM 49 C6 G A 2 7.092 -1.963 -3.084 1.00 0.00 C ATOM 50 O6 G A 2 6.292 -1.319 -3.765 1.00 0.00 O ATOM 51 N1 G A 2 7.864 -1.300 -2.143 1.00 0.00 N ATOM 52 C2 G A 2 8.805 -1.892 -1.340 1.00 0.00 C ATOM 53 N2 G A 2 9.458 -1.105 -0.488 1.00 0.00 N ATOM 54 N3 G A 2 9.088 -3.199 -1.367 1.00 0.00 N ATOM 55 C4 G A 2 8.327 -3.879 -2.268 1.00 0.00 C ATOM 0 H5' G A 2 9.656 -9.752 -3.755 1.00 0.00 H new ATOM 0 H5'' G A 2 8.646 -10.496 -2.531 1.00 0.00 H new ATOM 0 H4' G A 2 10.061 -8.912 -1.522 1.00 0.00 H new ATOM 0 H3' G A 2 7.126 -8.028 -1.618 1.00 0.00 H new ATOM 0 H2' G A 2 7.838 -6.139 -0.151 1.00 0.00 H new ATOM 0 HO2' G A 2 9.502 -7.858 0.779 1.00 0.00 H new ATOM 0 H1' G A 2 10.196 -5.631 -1.569 1.00 0.00 H new ATOM 0 H8 G A 2 7.216 -6.448 -3.861 1.00 0.00 H new ATOM 0 H1 G A 2 7.721 -0.295 -2.040 1.00 0.00 H new ATOM 0 H21 G A 2 10.167 -1.500 0.130 1.00 0.00 H new ATOM 0 H22 G A 2 9.249 -0.107 -0.453 1.00 0.00 H new ATOM 67 P C A 3 6.414 -9.126 0.585 1.00 0.00 P ATOM 68 OP1 C A 3 5.387 -9.104 -0.479 1.00 0.00 O ATOM 69 OP2 C A 3 6.452 -10.258 1.533 1.00 0.00 O ATOM 70 O5' C A 3 6.292 -7.761 1.441 1.00 0.00 O ATOM 71 C5' C A 3 7.046 -7.584 2.621 1.00 0.00 C ATOM 72 C4' C A 3 6.831 -6.196 3.214 1.00 0.00 C ATOM 73 O4' C A 3 7.331 -5.168 2.367 1.00 0.00 O ATOM 74 C3' C A 3 5.368 -5.852 3.436 1.00 0.00 C ATOM 75 O3' C A 3 4.769 -6.503 4.542 1.00 0.00 O ATOM 76 C2' C A 3 5.499 -4.354 3.646 1.00 0.00 C ATOM 77 O2' C A 3 6.061 -4.048 4.905 1.00 0.00 O ATOM 78 C1' C A 3 6.522 -4.010 2.566 1.00 0.00 C ATOM 79 N1 C A 3 5.817 -3.626 1.324 1.00 0.00 N ATOM 80 C2 C A 3 5.495 -2.285 1.165 1.00 0.00 C ATOM 81 O2 C A 3 5.786 -1.467 2.034 1.00 0.00 O ATOM 82 N3 C A 3 4.854 -1.891 0.038 1.00 0.00 N ATOM 83 C4 C A 3 4.524 -2.778 -0.898 1.00 0.00 C ATOM 84 N4 C A 3 3.884 -2.340 -1.980 1.00 0.00 N ATOM 85 C5 C A 3 4.839 -4.165 -0.753 1.00 0.00 C ATOM 86 C6 C A 3 5.489 -4.556 0.370 1.00 0.00 C ATOM 0 H5' C A 3 8.104 -7.729 2.404 1.00 0.00 H new ATOM 0 H5'' C A 3 6.764 -8.342 3.352 1.00 0.00 H new ATOM 0 H4' C A 3 7.364 -6.240 4.164 1.00 0.00 H new ATOM 0 H3' C A 3 4.711 -6.167 2.625 1.00 0.00 H new ATOM 0 H2' C A 3 4.547 -3.826 3.602 1.00 0.00 H new ATOM 0 HO2' C A 3 5.935 -4.807 5.512 1.00 0.00 H new ATOM 0 H1' C A 3 7.149 -3.169 2.860 1.00 0.00 H new ATOM 0 H41 C A 3 3.618 -2.995 -2.715 1.00 0.00 H new ATOM 0 H42 C A 3 3.660 -1.349 -2.074 1.00 0.00 H new ATOM 0 H5 C A 3 4.567 -4.880 -1.516 1.00 0.00 H new ATOM 0 H6 C A 3 5.748 -5.595 0.513 1.00 0.00 H new ATOM 98 P G A 4 3.176 -6.642 4.633 1.00 0.00 P ATOM 99 OP1 G A 4 2.665 -7.077 3.312 1.00 0.00 O ATOM 100 OP2 G A 4 2.858 -7.444 5.837 1.00 0.00 O ATOM 101 O5' G A 4 2.671 -5.141 4.900 1.00 0.00 O ATOM 102 C5' G A 4 2.914 -4.503 6.137 1.00 0.00 C ATOM 103 C4' G A 4 2.498 -3.038 6.100 1.00 0.00 C ATOM 104 O4' G A 4 3.186 -2.315 5.095 1.00 0.00 O ATOM 105 C3' G A 4 1.015 -2.851 5.805 1.00 0.00 C ATOM 106 O3' G A 4 0.178 -3.092 6.921 1.00 0.00 O ATOM 107 C2' G A 4 1.032 -1.378 5.406 1.00 0.00 C ATOM 108 O2' G A 4 1.176 -0.533 6.540 1.00 0.00 O ATOM 109 C1' G A 4 2.313 -1.313 4.586 1.00 0.00 C ATOM 110 N9 G A 4 1.988 -1.571 3.167 1.00 0.00 N ATOM 111 C8 G A 4 2.142 -2.714 2.420 1.00 0.00 C ATOM 112 N7 G A 4 1.736 -2.599 1.184 1.00 0.00 N ATOM 113 C5 G A 4 1.282 -1.285 1.097 1.00 0.00 C ATOM 114 C6 G A 4 0.721 -0.579 -0.006 1.00 0.00 C ATOM 115 O6 G A 4 0.510 -0.983 -1.147 1.00 0.00 O ATOM 116 N1 G A 4 0.397 0.730 0.326 1.00 0.00 N ATOM 117 C2 G A 4 0.605 1.294 1.560 1.00 0.00 C ATOM 118 N2 G A 4 0.241 2.567 1.700 1.00 0.00 N ATOM 119 N3 G A 4 1.134 0.641 2.603 1.00 0.00 N ATOM 120 C4 G A 4 1.446 -0.647 2.303 1.00 0.00 C ATOM 0 H5' G A 4 3.973 -4.576 6.383 1.00 0.00 H new ATOM 0 H5'' G A 4 2.367 -5.018 6.927 1.00 0.00 H new ATOM 0 H4' G A 4 2.741 -2.666 7.095 1.00 0.00 H new ATOM 0 H3' G A 4 0.611 -3.542 5.065 1.00 0.00 H new ATOM 0 H2' G A 4 0.122 -1.058 4.898 1.00 0.00 H new ATOM 0 HO2' G A 4 1.185 0.403 6.251 1.00 0.00 H new ATOM 0 H1' G A 4 2.789 -0.335 4.653 1.00 0.00 H new ATOM 0 H8 G A 4 2.561 -3.626 2.819 1.00 0.00 H new ATOM 0 H1 G A 4 -0.025 1.313 -0.397 1.00 0.00 H new ATOM 0 H21 G A 4 0.371 3.039 2.595 1.00 0.00 H new ATOM 0 H22 G A 4 -0.168 3.070 0.913 1.00 0.00 H new ATOM 132 P C A 5 -1.394 -3.391 6.724 1.00 0.00 P ATOM 133 OP1 C A 5 -1.981 -3.667 8.053 1.00 0.00 O ATOM 134 OP2 C A 5 -1.525 -4.412 5.658 1.00 0.00 O ATOM 135 O5' C A 5 -2.012 -2.005 6.166 1.00 0.00 O ATOM 136 C5' C A 5 -2.119 -0.866 6.994 1.00 0.00 C ATOM 137 C4' C A 5 -2.689 0.329 6.223 1.00 0.00 C ATOM 138 O4' C A 5 -1.863 0.676 5.121 1.00 0.00 O ATOM 139 C3' C A 5 -4.076 0.076 5.636 1.00 0.00 C ATOM 140 O3' C A 5 -5.133 0.181 6.570 1.00 0.00 O ATOM 141 C2' C A 5 -4.118 1.180 4.586 1.00 0.00 C ATOM 142 O2' C A 5 -4.351 2.436 5.191 1.00 0.00 O ATOM 143 C1' C A 5 -2.678 1.161 4.065 1.00 0.00 C ATOM 144 N1 C A 5 -2.585 0.288 2.867 1.00 0.00 N ATOM 145 C2 C A 5 -3.046 0.808 1.662 1.00 0.00 C ATOM 146 O2 C A 5 -3.502 1.949 1.599 1.00 0.00 O ATOM 147 N3 C A 5 -2.984 0.034 0.549 1.00 0.00 N ATOM 148 C4 C A 5 -2.476 -1.194 0.617 1.00 0.00 C ATOM 149 N4 C A 5 -2.426 -1.912 -0.502 1.00 0.00 N ATOM 150 C5 C A 5 -1.990 -1.745 1.844 1.00 0.00 C ATOM 151 C6 C A 5 -2.066 -0.975 2.952 1.00 0.00 C ATOM 0 H5' C A 5 -1.137 -0.610 7.393 1.00 0.00 H new ATOM 0 H5'' C A 5 -2.760 -1.092 7.846 1.00 0.00 H new ATOM 0 H4' C A 5 -2.740 1.124 6.967 1.00 0.00 H new ATOM 0 H3' C A 5 -4.216 -0.938 5.262 1.00 0.00 H new ATOM 0 H2' C A 5 -4.894 1.033 3.835 1.00 0.00 H new ATOM 0 HO2' C A 5 -4.739 2.303 6.081 1.00 0.00 H new ATOM 0 H1' C A 5 -2.349 2.156 3.764 1.00 0.00 H new ATOM 0 H41 C A 5 -2.043 -2.857 -0.485 1.00 0.00 H new ATOM 0 H42 C A 5 -2.771 -1.517 -1.377 1.00 0.00 H new ATOM 0 H5 C A 5 -1.577 -2.742 1.884 1.00 0.00 H new ATOM 0 H6 C A 5 -1.718 -1.355 3.901 1.00 0.00 H new ATOM 163 P A A 6 -6.566 -0.519 6.291 1.00 0.00 P ATOM 164 OP1 A A 6 -6.327 -1.957 6.044 1.00 0.00 O ATOM 165 OP2 A A 6 -7.498 -0.106 7.369 1.00 0.00 O ATOM 166 O5' A A 6 -7.085 0.147 4.918 1.00 0.00 O ATOM 167 C5' A A 6 -7.582 1.471 4.873 1.00 0.00 C ATOM 168 C4' A A 6 -7.868 1.840 3.417 1.00 0.00 C ATOM 169 O4' A A 6 -6.737 1.583 2.599 1.00 0.00 O ATOM 170 C3' A A 6 -9.006 1.021 2.825 1.00 0.00 C ATOM 171 O3' A A 6 -10.280 1.560 3.113 1.00 0.00 O ATOM 172 C2' A A 6 -8.685 1.076 1.341 1.00 0.00 C ATOM 173 O2' A A 6 -9.107 2.311 0.794 1.00 0.00 O ATOM 174 C1' A A 6 -7.159 1.113 1.329 1.00 0.00 C ATOM 175 N9 A A 6 -6.590 -0.222 1.054 1.00 0.00 N ATOM 176 C8 A A 6 -5.985 -1.113 1.912 1.00 0.00 C ATOM 177 N7 A A 6 -5.593 -2.218 1.337 1.00 0.00 N ATOM 178 C5 A A 6 -5.948 -2.045 0.002 1.00 0.00 C ATOM 179 C6 A A 6 -5.807 -2.842 -1.147 1.00 0.00 C ATOM 180 N6 A A 6 -5.240 -4.053 -1.134 1.00 0.00 N ATOM 181 N1 A A 6 -6.264 -2.370 -2.311 1.00 0.00 N ATOM 182 C2 A A 6 -6.829 -1.173 -2.346 1.00 0.00 C ATOM 183 N3 A A 6 -7.029 -0.326 -1.351 1.00 0.00 N ATOM 184 C4 A A 6 -6.562 -0.831 -0.182 1.00 0.00 C ATOM 0 H5' A A 6 -6.856 2.162 5.302 1.00 0.00 H new ATOM 0 H5'' A A 6 -8.491 1.554 5.469 1.00 0.00 H new ATOM 0 H4' A A 6 -8.128 2.898 3.431 1.00 0.00 H new ATOM 0 H3' A A 6 -9.067 0.011 3.231 1.00 0.00 H new ATOM 0 H2' A A 6 -9.150 0.259 0.789 1.00 0.00 H new ATOM 0 HO2' A A 6 -9.717 2.755 1.420 1.00 0.00 H new ATOM 0 H1' A A 6 -6.808 1.773 0.536 1.00 0.00 H new ATOM 0 H8 A A 6 -5.847 -0.916 2.965 1.00 0.00 H new ATOM 0 H61 A A 6 -5.163 -4.590 -1.998 1.00 0.00 H new ATOM 0 H62 A A 6 -4.884 -4.440 -0.260 1.00 0.00 H new ATOM 0 H2 A A 6 -7.172 -0.845 -3.316 1.00 0.00 H new ATOM 196 P U A 7 -11.605 0.639 3.081 1.00 0.00 P ATOM 197 OP1 U A 7 -11.369 -0.540 3.941 1.00 0.00 O ATOM 198 OP2 U A 7 -12.768 1.509 3.362 1.00 0.00 O ATOM 199 O5' U A 7 -11.727 0.113 1.562 1.00 0.00 O ATOM 200 C5' U A 7 -12.068 0.968 0.496 1.00 0.00 C ATOM 201 C4' U A 7 -12.146 0.180 -0.813 1.00 0.00 C ATOM 202 O4' U A 7 -10.932 -0.529 -1.018 1.00 0.00 O ATOM 203 C3' U A 7 -13.284 -0.846 -0.764 1.00 0.00 C ATOM 204 O3' U A 7 -13.946 -0.989 -2.010 1.00 0.00 O ATOM 205 C2' U A 7 -12.529 -2.099 -0.335 1.00 0.00 C ATOM 206 O2' U A 7 -13.191 -3.309 -0.652 1.00 0.00 O ATOM 207 C1' U A 7 -11.219 -1.917 -1.086 1.00 0.00 C ATOM 208 N1 U A 7 -10.160 -2.748 -0.470 1.00 0.00 N ATOM 209 C2 U A 7 -9.592 -3.751 -1.246 1.00 0.00 C ATOM 210 O2 U A 7 -9.922 -3.957 -2.410 1.00 0.00 O ATOM 211 N3 U A 7 -8.622 -4.515 -0.629 1.00 0.00 N ATOM 212 C4 U A 7 -8.181 -4.348 0.663 1.00 0.00 C ATOM 213 O4 U A 7 -7.305 -5.081 1.118 1.00 0.00 O ATOM 214 C5 U A 7 -8.813 -3.281 1.404 1.00 0.00 C ATOM 215 C6 U A 7 -9.775 -2.523 0.829 1.00 0.00 C ATOM 0 H5' U A 7 -11.327 1.762 0.407 1.00 0.00 H new ATOM 0 H5'' U A 7 -13.026 1.447 0.697 1.00 0.00 H new ATOM 0 H4' U A 7 -12.323 0.890 -1.621 1.00 0.00 H new ATOM 0 H3' U A 7 -14.102 -0.577 -0.096 1.00 0.00 H new ATOM 0 H2' U A 7 -12.419 -2.193 0.745 1.00 0.00 H new ATOM 0 HO2' U A 7 -13.895 -3.134 -1.311 1.00 0.00 H new ATOM 0 H1' U A 7 -11.280 -2.239 -2.125 1.00 0.00 H new ATOM 0 H3 U A 7 -8.198 -5.264 -1.176 1.00 0.00 H new ATOM 0 H5 U A 7 -8.516 -3.087 2.424 1.00 0.00 H new ATOM 0 H6 U A 7 -10.245 -1.733 1.397 1.00 0.00 H new ATOM 226 P C A 8 -14.778 0.227 -2.647 1.00 0.00 P ATOM 227 OP1 C A 8 -14.995 1.249 -1.594 1.00 0.00 O ATOM 228 OP2 C A 8 -15.946 -0.341 -3.354 1.00 0.00 O ATOM 229 O5' C A 8 -13.780 0.846 -3.741 1.00 0.00 O ATOM 230 C5' C A 8 -13.805 0.387 -5.080 1.00 0.00 C ATOM 231 C4' C A 8 -12.787 1.146 -5.931 1.00 0.00 C ATOM 232 O4' C A 8 -12.991 2.551 -5.811 1.00 0.00 O ATOM 233 C3' C A 8 -11.371 0.856 -5.475 1.00 0.00 C ATOM 234 O3' C A 8 -10.840 -0.339 -6.013 1.00 0.00 O ATOM 235 C2' C A 8 -10.694 2.139 -5.950 1.00 0.00 C ATOM 236 O2' C A 8 -10.464 2.213 -7.343 1.00 0.00 O ATOM 237 C1' C A 8 -11.739 3.178 -5.562 1.00 0.00 C ATOM 238 N1 C A 8 -11.674 3.592 -4.137 1.00 0.00 N ATOM 239 C2 C A 8 -12.506 4.636 -3.746 1.00 0.00 C ATOM 240 O2 C A 8 -13.246 5.186 -4.561 1.00 0.00 O ATOM 241 N3 C A 8 -12.488 5.042 -2.449 1.00 0.00 N ATOM 242 C4 C A 8 -11.677 4.458 -1.573 1.00 0.00 C ATOM 243 N4 C A 8 -11.697 4.896 -0.318 1.00 0.00 N ATOM 244 C5 C A 8 -10.801 3.395 -1.957 1.00 0.00 C ATOM 245 C6 C A 8 -10.829 2.983 -3.241 1.00 0.00 C ATOM 0 H5' C A 8 -14.804 0.518 -5.496 1.00 0.00 H new ATOM 0 H5'' C A 8 -13.586 -0.680 -5.108 1.00 0.00 H new ATOM 0 H4' C A 8 -12.924 0.820 -6.962 1.00 0.00 H new ATOM 0 H3' C A 8 -11.247 0.656 -4.411 1.00 0.00 H new ATOM 0 H2' C A 8 -9.699 2.248 -5.518 1.00 0.00 H new ATOM 0 HO2' C A 8 -10.030 3.065 -7.558 1.00 0.00 H new ATOM 0 H1' C A 8 -11.576 4.091 -6.135 1.00 0.00 H new ATOM 0 H41 C A 8 -11.088 4.470 0.380 1.00 0.00 H new ATOM 0 H42 C A 8 -12.322 5.658 -0.054 1.00 0.00 H new ATOM 0 H5 C A 8 -10.137 2.936 -1.240 1.00 0.00 H new ATOM 0 H6 C A 8 -10.188 2.176 -3.564 1.00 0.00 H new ATOM 257 P G A 9 -9.415 -0.902 -5.502 1.00 0.00 P ATOM 258 OP1 G A 9 -9.621 -2.277 -4.994 1.00 0.00 O ATOM 259 OP2 G A 9 -8.779 0.114 -4.638 1.00 0.00 O ATOM 260 O5' G A 9 -8.555 -0.995 -6.855 1.00 0.00 O ATOM 261 C5' G A 9 -8.526 0.111 -7.723 1.00 0.00 C ATOM 262 C4' G A 9 -7.552 -0.075 -8.883 1.00 0.00 C ATOM 263 O4' G A 9 -8.106 -0.928 -9.866 1.00 0.00 O ATOM 264 C3' G A 9 -7.410 1.261 -9.610 1.00 0.00 C ATOM 265 O3' G A 9 -6.298 1.293 -10.481 1.00 0.00 O ATOM 266 C2' G A 9 -8.723 1.300 -10.386 1.00 0.00 C ATOM 267 O2' G A 9 -8.622 2.067 -11.575 1.00 0.00 O ATOM 268 C1' G A 9 -9.034 -0.179 -10.642 1.00 0.00 C ATOM 269 N9 G A 9 -10.432 -0.506 -10.274 1.00 0.00 N ATOM 270 C8 G A 9 -11.501 0.344 -10.145 1.00 0.00 C ATOM 271 N7 G A 9 -12.612 -0.238 -9.801 1.00 0.00 N ATOM 272 C5 G A 9 -12.256 -1.575 -9.683 1.00 0.00 C ATOM 273 C6 G A 9 -13.049 -2.695 -9.298 1.00 0.00 C ATOM 274 O6 G A 9 -14.234 -2.719 -8.979 1.00 0.00 O ATOM 275 N1 G A 9 -12.319 -3.873 -9.308 1.00 0.00 N ATOM 276 C2 G A 9 -10.983 -3.967 -9.638 1.00 0.00 C ATOM 277 N2 G A 9 -10.436 -5.179 -9.595 1.00 0.00 N ATOM 278 N3 G A 9 -10.231 -2.920 -9.989 1.00 0.00 N ATOM 279 C4 G A 9 -10.928 -1.754 -9.988 1.00 0.00 C ATOM 0 H5' G A 9 -8.248 1.002 -7.160 1.00 0.00 H new ATOM 0 H5'' G A 9 -9.527 0.283 -8.119 1.00 0.00 H new ATOM 0 H4' G A 9 -6.620 -0.466 -8.475 1.00 0.00 H new ATOM 0 H3' G A 9 -7.239 2.108 -8.945 1.00 0.00 H new ATOM 0 H2' G A 9 -9.526 1.795 -9.839 1.00 0.00 H new ATOM 0 HO2' G A 9 -7.689 2.084 -11.875 1.00 0.00 H new ATOM 0 H1' G A 9 -8.937 -0.419 -11.701 1.00 0.00 H new ATOM 0 H8 G A 9 -11.426 1.408 -10.315 1.00 0.00 H new ATOM 0 H1 G A 9 -12.805 -4.733 -9.053 1.00 0.00 H new ATOM 0 H21 G A 9 -9.451 -5.303 -9.830 1.00 0.00 H new ATOM 0 H22 G A 9 -11.001 -5.984 -9.327 1.00 0.00 H new ATOM 291 P G A 10 -4.787 1.386 -9.917 1.00 0.00 P ATOM 292 OP1 G A 10 -4.464 0.133 -9.206 1.00 0.00 O ATOM 293 OP2 G A 10 -3.911 1.860 -11.016 1.00 0.00 O ATOM 294 O5' G A 10 -4.921 2.550 -8.814 1.00 0.00 O ATOM 295 C5' G A 10 -5.355 3.843 -9.177 1.00 0.00 C ATOM 296 C4' G A 10 -5.616 4.699 -7.934 1.00 0.00 C ATOM 297 O4' G A 10 -6.512 4.041 -7.043 1.00 0.00 O ATOM 298 C3' G A 10 -4.320 4.959 -7.168 1.00 0.00 C ATOM 299 O3' G A 10 -3.650 6.103 -7.684 1.00 0.00 O ATOM 300 C2' G A 10 -4.909 5.191 -5.787 1.00 0.00 C ATOM 301 O2' G A 10 -5.466 6.482 -5.632 1.00 0.00 O ATOM 302 C1' G A 10 -6.009 4.136 -5.719 1.00 0.00 C ATOM 303 N9 G A 10 -5.476 2.835 -5.259 1.00 0.00 N ATOM 304 C8 G A 10 -5.294 1.699 -5.989 1.00 0.00 C ATOM 305 N7 G A 10 -4.773 0.711 -5.311 1.00 0.00 N ATOM 306 C5 G A 10 -4.597 1.224 -4.032 1.00 0.00 C ATOM 307 C6 G A 10 -4.050 0.621 -2.857 1.00 0.00 C ATOM 308 O6 G A 10 -3.593 -0.515 -2.727 1.00 0.00 O ATOM 309 N1 G A 10 -4.076 1.485 -1.776 1.00 0.00 N ATOM 310 C2 G A 10 -4.561 2.773 -1.811 1.00 0.00 C ATOM 311 N2 G A 10 -4.526 3.455 -0.663 1.00 0.00 N ATOM 312 N3 G A 10 -5.050 3.355 -2.911 1.00 0.00 N ATOM 313 C4 G A 10 -5.045 2.524 -3.986 1.00 0.00 C ATOM 0 H5' G A 10 -6.265 3.772 -9.773 1.00 0.00 H new ATOM 0 H5'' G A 10 -4.602 4.322 -9.802 1.00 0.00 H new ATOM 0 H4' G A 10 -6.046 5.638 -8.282 1.00 0.00 H new ATOM 0 H3' G A 10 -3.561 4.178 -7.213 1.00 0.00 H new ATOM 0 H2' G A 10 -4.154 5.120 -5.004 1.00 0.00 H new ATOM 0 HO2' G A 10 -5.831 6.574 -4.727 1.00 0.00 H new ATOM 0 H1' G A 10 -6.787 4.409 -5.006 1.00 0.00 H new ATOM 0 H8 G A 10 -5.557 1.622 -7.034 1.00 0.00 H new ATOM 0 H1 G A 10 -3.709 1.142 -0.888 1.00 0.00 H new ATOM 0 H21 G A 10 -4.872 4.414 -0.629 1.00 0.00 H new ATOM 0 H22 G A 10 -4.153 3.017 0.179 1.00 0.00 H new ATOM 325 P C A 11 -2.071 6.312 -7.474 1.00 0.00 P ATOM 326 OP1 C A 11 -1.688 7.568 -8.155 1.00 0.00 O ATOM 327 OP2 C A 11 -1.383 5.054 -7.844 1.00 0.00 O ATOM 328 O5' C A 11 -1.921 6.531 -5.893 1.00 0.00 O ATOM 329 C5' C A 11 -2.400 7.695 -5.260 1.00 0.00 C ATOM 330 C4' C A 11 -2.239 7.564 -3.748 1.00 0.00 C ATOM 331 O4' C A 11 -2.907 6.409 -3.258 1.00 0.00 O ATOM 332 C3' C A 11 -0.785 7.400 -3.322 1.00 0.00 C ATOM 333 O3' C A 11 -0.079 8.631 -3.296 1.00 0.00 O ATOM 334 C2' C A 11 -0.961 6.777 -1.950 1.00 0.00 C ATOM 335 O2' C A 11 -1.349 7.751 -1.002 1.00 0.00 O ATOM 336 C1' C A 11 -2.146 5.850 -2.194 1.00 0.00 C ATOM 337 N1 C A 11 -1.661 4.493 -2.528 1.00 0.00 N ATOM 338 C2 C A 11 -1.193 3.710 -1.482 1.00 0.00 C ATOM 339 O2 C A 11 -1.173 4.149 -0.329 1.00 0.00 O ATOM 340 N3 C A 11 -0.759 2.452 -1.744 1.00 0.00 N ATOM 341 C4 C A 11 -0.768 1.980 -2.990 1.00 0.00 C ATOM 342 N4 C A 11 -0.341 0.739 -3.203 1.00 0.00 N ATOM 343 C5 C A 11 -1.235 2.766 -4.088 1.00 0.00 C ATOM 344 C6 C A 11 -1.673 4.013 -3.812 1.00 0.00 C ATOM 0 H5' C A 11 -3.449 7.851 -5.511 1.00 0.00 H new ATOM 0 H5'' C A 11 -1.853 8.567 -5.619 1.00 0.00 H new ATOM 0 H4' C A 11 -2.657 8.486 -3.343 1.00 0.00 H new ATOM 0 H3' C A 11 -0.179 6.803 -4.003 1.00 0.00 H new ATOM 0 H2' C A 11 -0.057 6.302 -1.570 1.00 0.00 H new ATOM 0 HO2' C A 11 -1.035 8.633 -1.292 1.00 0.00 H new ATOM 0 H1' C A 11 -2.769 5.758 -1.305 1.00 0.00 H new ATOM 0 H41 C A 11 -0.339 0.356 -4.148 1.00 0.00 H new ATOM 0 H42 C A 11 -0.016 0.170 -2.421 1.00 0.00 H new ATOM 0 H5 C A 11 -1.238 2.379 -5.096 1.00 0.00 H new ATOM 0 H6 C A 11 -2.037 4.640 -4.612 1.00 0.00 H new ATOM 356 P G A 12 1.519 8.674 -3.546 1.00 0.00 P ATOM 357 OP1 G A 12 1.919 10.100 -3.670 1.00 0.00 O ATOM 358 OP2 G A 12 1.844 7.730 -4.639 1.00 0.00 O ATOM 359 O5' G A 12 2.149 8.088 -2.187 1.00 0.00 O ATOM 360 C5' G A 12 2.136 8.824 -0.984 1.00 0.00 C ATOM 361 C4' G A 12 3.017 8.117 0.039 1.00 0.00 C ATOM 362 O4' G A 12 2.443 6.887 0.449 1.00 0.00 O ATOM 363 C3' G A 12 4.391 7.772 -0.525 1.00 0.00 C ATOM 364 O3' G A 12 5.282 8.872 -0.534 1.00 0.00 O ATOM 365 C2' G A 12 4.802 6.700 0.469 1.00 0.00 C ATOM 366 O2' G A 12 5.207 7.272 1.706 1.00 0.00 O ATOM 367 C1' G A 12 3.494 5.961 0.679 1.00 0.00 C ATOM 368 N9 G A 12 3.373 4.818 -0.253 1.00 0.00 N ATOM 369 C8 G A 12 2.995 4.797 -1.572 1.00 0.00 C ATOM 370 N7 G A 12 2.953 3.596 -2.091 1.00 0.00 N ATOM 371 C5 G A 12 3.373 2.769 -1.051 1.00 0.00 C ATOM 372 C6 G A 12 3.553 1.352 -1.005 1.00 0.00 C ATOM 373 O6 G A 12 3.341 0.520 -1.885 1.00 0.00 O ATOM 374 N1 G A 12 4.031 0.927 0.222 1.00 0.00 N ATOM 375 C2 G A 12 4.284 1.749 1.295 1.00 0.00 C ATOM 376 N2 G A 12 4.749 1.167 2.402 1.00 0.00 N ATOM 377 N3 G A 12 4.095 3.066 1.273 1.00 0.00 N ATOM 378 C4 G A 12 3.641 3.514 0.073 1.00 0.00 C ATOM 0 H5' G A 12 1.117 8.911 -0.607 1.00 0.00 H new ATOM 0 H5'' G A 12 2.499 9.837 -1.158 1.00 0.00 H new ATOM 0 H4' G A 12 3.108 8.814 0.872 1.00 0.00 H new ATOM 0 H3' G A 12 4.392 7.466 -1.571 1.00 0.00 H new ATOM 0 H2' G A 12 5.635 6.090 0.121 1.00 0.00 H new ATOM 0 HO2' G A 12 5.408 8.222 1.577 1.00 0.00 H new ATOM 0 H1' G A 12 3.450 5.561 1.692 1.00 0.00 H new ATOM 0 H8 G A 12 2.754 5.689 -2.131 1.00 0.00 H new ATOM 0 H1 G A 12 4.209 -0.070 0.339 1.00 0.00 H new ATOM 0 H21 G A 12 4.953 1.731 3.227 1.00 0.00 H new ATOM 0 H22 G A 12 4.900 0.158 2.423 1.00 0.00 H new ATOM 390 P C A 13 6.482 8.949 -1.614 1.00 0.00 P ATOM 391 OP1 C A 13 7.186 10.241 -1.442 1.00 0.00 O ATOM 392 OP2 C A 13 5.932 8.599 -2.944 1.00 0.00 O ATOM 393 O5' C A 13 7.492 7.777 -1.180 1.00 0.00 O ATOM 394 C5' C A 13 8.283 7.864 -0.006 1.00 0.00 C ATOM 395 C4' C A 13 9.156 6.613 0.130 1.00 0.00 C ATOM 396 O4' C A 13 8.381 5.463 0.434 1.00 0.00 O ATOM 397 C3' C A 13 9.905 6.266 -1.152 1.00 0.00 C ATOM 398 O3' C A 13 11.025 7.101 -1.394 1.00 0.00 O ATOM 399 C2' C A 13 10.272 4.814 -0.870 1.00 0.00 C ATOM 400 O2' C A 13 11.373 4.723 0.020 1.00 0.00 O ATOM 401 C1' C A 13 9.010 4.328 -0.148 1.00 0.00 C ATOM 402 N1 C A 13 8.095 3.652 -1.094 1.00 0.00 N ATOM 403 C2 C A 13 8.128 2.264 -1.133 1.00 0.00 C ATOM 404 O2 C A 13 8.889 1.638 -0.404 1.00 0.00 O ATOM 405 N3 C A 13 7.301 1.609 -1.990 1.00 0.00 N ATOM 406 C4 C A 13 6.466 2.289 -2.781 1.00 0.00 C ATOM 407 N4 C A 13 5.675 1.597 -3.589 1.00 0.00 N ATOM 408 C5 C A 13 6.423 3.715 -2.765 1.00 0.00 C ATOM 409 C6 C A 13 7.251 4.357 -1.912 1.00 0.00 C ATOM 0 H5' C A 13 7.641 7.966 0.869 1.00 0.00 H new ATOM 0 H5'' C A 13 8.911 8.754 -0.046 1.00 0.00 H new ATOM 0 H4' C A 13 9.854 6.860 0.930 1.00 0.00 H new ATOM 0 H3' C A 13 9.329 6.412 -2.066 1.00 0.00 H new ATOM 0 H2' C A 13 10.553 4.255 -1.763 1.00 0.00 H new ATOM 0 HO2' C A 13 11.585 3.780 0.183 1.00 0.00 H new ATOM 0 H1' C A 13 9.271 3.604 0.624 1.00 0.00 H new ATOM 0 H41 C A 13 5.025 2.084 -4.206 1.00 0.00 H new ATOM 0 H42 C A 13 5.716 0.578 -3.593 1.00 0.00 H new ATOM 0 H5 C A 13 5.753 4.262 -3.412 1.00 0.00 H new ATOM 0 H6 C A 13 7.248 5.436 -1.874 1.00 0.00 H new ATOM 421 P C A 14 11.663 7.215 -2.870 1.00 0.00 P ATOM 422 OP1 C A 14 10.558 7.391 -3.840 1.00 0.00 O ATOM 423 OP2 C A 14 12.760 8.213 -2.827 1.00 0.00 O ATOM 424 O5' C A 14 12.328 5.767 -3.126 1.00 0.00 O ATOM 425 C5' C A 14 13.484 5.372 -2.415 1.00 0.00 C ATOM 426 C4' C A 14 13.878 3.937 -2.775 1.00 0.00 C ATOM 427 O4' C A 14 12.902 2.996 -2.359 1.00 0.00 O ATOM 428 C3' C A 14 14.029 3.724 -4.279 1.00 0.00 C ATOM 429 O3' C A 14 15.248 4.218 -4.801 1.00 0.00 O ATOM 430 C2' C A 14 13.963 2.197 -4.330 1.00 0.00 C ATOM 431 O2' C A 14 15.203 1.620 -3.961 1.00 0.00 O ATOM 432 C1' C A 14 12.932 1.888 -3.248 1.00 0.00 C ATOM 433 N1 C A 14 11.597 1.674 -3.851 1.00 0.00 N ATOM 434 C2 C A 14 11.177 0.360 -4.022 1.00 0.00 C ATOM 435 O2 C A 14 11.885 -0.582 -3.661 1.00 0.00 O ATOM 436 N3 C A 14 9.969 0.129 -4.595 1.00 0.00 N ATOM 437 C4 C A 14 9.201 1.149 -4.987 1.00 0.00 C ATOM 438 N4 C A 14 8.036 0.875 -5.566 1.00 0.00 N ATOM 439 C5 C A 14 9.604 2.510 -4.801 1.00 0.00 C ATOM 440 C6 C A 14 10.811 2.724 -4.232 1.00 0.00 C ATOM 0 H5' C A 14 13.300 5.446 -1.343 1.00 0.00 H new ATOM 0 H5'' C A 14 14.307 6.049 -2.645 1.00 0.00 H new ATOM 0 H4' C A 14 14.828 3.786 -2.262 1.00 0.00 H new ATOM 0 H3' C A 14 13.287 4.250 -4.880 1.00 0.00 H new ATOM 0 H2' C A 14 13.723 1.813 -5.321 1.00 0.00 H new ATOM 0 HO2' C A 14 15.911 2.295 -4.028 1.00 0.00 H new ATOM 0 HO3' C A 14 15.283 4.049 -5.766 1.00 0.00 H new ATOM 0 H1' C A 14 13.201 0.977 -2.714 1.00 0.00 H new ATOM 0 H41 C A 14 7.429 1.634 -5.875 1.00 0.00 H new ATOM 0 H42 C A 14 7.749 -0.094 -5.701 1.00 0.00 H new ATOM 0 H5 C A 14 8.970 3.331 -5.103 1.00 0.00 H new ATOM 0 H6 C A 14 11.157 3.735 -4.077 1.00 0.00 H new TER 453 C A 14