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 180:sc= 0 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -18:sc= 0.151 USER MOD Single : A 3 C O2' : rot -18:sc= 0.119 USER MOD Single : A 4 G O2' : rot -13:sc= 0.172 USER MOD Single : A 5 G O2' : rot -117:sc= 0.439 USER MOD Single : A 6 U O2' : rot -162:sc= 1.13 USER MOD Single : A 7 G O2' : rot -15:sc= 0.182 USER MOD Single : A 8 A O2' : rot -22:sc= 0.175 USER MOD Single : A 9 A O2' : rot -15:sc= 0.352 USER MOD Single : A 10 A O2' : rot -26:sc= 0.247 USER MOD Single : A 11 U O2' : rot -25:sc= 0.166 USER MOD Single : A 12 G O2' : rot -13:sc= 0.237 USER MOD Single : A 13 C O2' : rot -20:sc= 0.117 USER MOD Single : A 14 C O2' : rot -26:sc= 0.13 USER MOD Single : A 14 C O3' : rot 180:sc= 0.144 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 2.286 -12.712 -11.668 1.00 10.00 O ATOM 2 C5' G A 1 1.575 -11.778 -10.871 1.00 10.00 C ATOM 3 C4' G A 1 0.202 -12.332 -10.466 1.00 10.00 C ATOM 4 O4' G A 1 0.298 -13.331 -9.454 1.00 10.00 O ATOM 5 C3' G A 1 -0.690 -11.252 -9.856 1.00 10.00 C ATOM 6 O3' G A 1 -1.230 -10.347 -10.801 1.00 10.00 O ATOM 7 C2' G A 1 -1.731 -12.129 -9.157 1.00 10.00 C ATOM 8 O2' G A 1 -2.664 -12.755 -10.035 1.00 10.00 O ATOM 9 C1' G A 1 -0.814 -13.204 -8.567 1.00 10.00 C ATOM 10 N9 G A 1 -0.351 -12.807 -7.217 1.00 10.00 N ATOM 11 C8 G A 1 0.884 -12.351 -6.832 1.00 10.00 C ATOM 12 N7 G A 1 0.936 -11.927 -5.596 1.00 10.00 N ATOM 13 C5 G A 1 -0.362 -12.159 -5.111 1.00 10.00 C ATOM 14 C6 G A 1 -0.974 -11.885 -3.834 1.00 10.00 C ATOM 15 O6 G A 1 -0.511 -11.283 -2.864 1.00 10.00 O ATOM 16 N1 G A 1 -2.265 -12.372 -3.736 1.00 10.00 N ATOM 17 C2 G A 1 -2.933 -12.960 -4.761 1.00 10.00 C ATOM 18 N2 G A 1 -4.139 -13.397 -4.528 1.00 10.00 N ATOM 19 N3 G A 1 -2.435 -13.164 -5.982 1.00 10.00 N ATOM 20 C4 G A 1 -1.135 -12.752 -6.089 1.00 10.00 C ATOM 0 H5' G A 1 1.447 -10.847 -11.423 1.00 10.00 H new ATOM 0 H5'' G A 1 2.154 -11.542 -9.978 1.00 10.00 H new ATOM 0 H4' G A 1 -0.212 -12.733 -11.391 1.00 10.00 H new ATOM 0 H3' G A 1 -0.172 -10.557 -9.195 1.00 10.00 H new ATOM 0 H2' G A 1 -2.357 -11.560 -8.469 1.00 10.00 H new ATOM 0 HO2' G A 1 -3.292 -13.297 -9.513 1.00 10.00 H new ATOM 0 HO5' G A 1 3.157 -12.336 -11.915 1.00 10.00 H new ATOM 0 H1' G A 1 -1.343 -14.151 -8.465 1.00 10.00 H new ATOM 0 H8 G A 1 1.739 -12.343 -7.492 1.00 10.00 H new ATOM 0 H1 G A 1 -2.744 -12.284 -2.840 1.00 10.00 H new ATOM 0 H21 G A 1 -4.672 -13.845 -5.274 1.00 10.00 H new ATOM 0 H22 G A 1 -4.549 -13.291 -3.600 1.00 10.00 H new ATOM 33 P G A 2 -1.749 -8.915 -10.341 1.00 10.00 P ATOM 34 OP1 G A 2 -2.008 -8.165 -11.587 1.00 10.00 O ATOM 35 OP2 G A 2 -0.757 -8.383 -9.384 1.00 10.00 O ATOM 36 O5' G A 2 -3.114 -9.160 -9.554 1.00 10.00 O ATOM 37 C5' G A 2 -4.280 -9.658 -10.187 1.00 10.00 C ATOM 38 C4' G A 2 -5.311 -10.142 -9.154 1.00 10.00 C ATOM 39 O4' G A 2 -4.707 -11.023 -8.203 1.00 10.00 O ATOM 40 C3' G A 2 -6.048 -9.038 -8.380 1.00 10.00 C ATOM 41 O3' G A 2 -7.225 -8.570 -9.047 1.00 10.00 O ATOM 42 C2' G A 2 -6.426 -9.837 -7.127 1.00 10.00 C ATOM 43 O2' G A 2 -7.563 -10.656 -7.373 1.00 10.00 O ATOM 44 C1' G A 2 -5.226 -10.751 -6.904 1.00 10.00 C ATOM 45 N9 G A 2 -4.223 -10.095 -6.028 1.00 10.00 N ATOM 46 C8 G A 2 -2.993 -9.586 -6.356 1.00 10.00 C ATOM 47 N7 G A 2 -2.365 -9.004 -5.370 1.00 10.00 N ATOM 48 C5 G A 2 -3.232 -9.181 -4.280 1.00 10.00 C ATOM 49 C6 G A 2 -3.127 -8.805 -2.891 1.00 10.00 C ATOM 50 O6 G A 2 -2.249 -8.160 -2.320 1.00 10.00 O ATOM 51 N1 G A 2 -4.173 -9.251 -2.112 1.00 10.00 N ATOM 52 C2 G A 2 -5.215 -9.959 -2.597 1.00 10.00 C ATOM 53 N2 G A 2 -6.126 -10.336 -1.743 1.00 10.00 N ATOM 54 N3 G A 2 -5.380 -10.302 -3.873 1.00 10.00 N ATOM 55 C4 G A 2 -4.351 -9.885 -4.672 1.00 10.00 C ATOM 0 H5' G A 2 -4.013 -10.480 -10.851 1.00 10.00 H new ATOM 0 H5'' G A 2 -4.722 -8.878 -10.807 1.00 10.00 H new ATOM 0 H4' G A 2 -6.060 -10.651 -9.761 1.00 10.00 H new ATOM 0 H3' G A 2 -5.463 -8.131 -8.228 1.00 10.00 H new ATOM 0 H2' G A 2 -6.660 -9.185 -6.286 1.00 10.00 H new ATOM 0 HO2' G A 2 -8.029 -10.336 -8.173 1.00 10.00 H new ATOM 0 H1' G A 2 -5.501 -11.675 -6.396 1.00 10.00 H new ATOM 0 H8 G A 2 -2.577 -9.660 -7.350 1.00 10.00 H new ATOM 0 H1 G A 2 -4.159 -9.034 -1.115 1.00 10.00 H new ATOM 0 H21 G A 2 -6.932 -10.873 -2.061 1.00 10.00 H new ATOM 0 H22 G A 2 -6.032 -10.094 -0.757 1.00 10.00 H new ATOM 67 P C A 3 -7.852 -7.118 -8.749 1.00 10.00 P ATOM 68 OP1 C A 3 -9.089 -6.968 -9.558 1.00 10.00 O ATOM 69 OP2 C A 3 -6.788 -6.113 -8.889 1.00 10.00 O ATOM 70 O5' C A 3 -8.280 -7.146 -7.209 1.00 10.00 O ATOM 71 C5' C A 3 -9.414 -7.867 -6.759 1.00 10.00 C ATOM 72 C4' C A 3 -9.437 -7.958 -5.228 1.00 10.00 C ATOM 73 O4' C A 3 -8.178 -8.372 -4.711 1.00 10.00 O ATOM 74 C3' C A 3 -9.772 -6.643 -4.528 1.00 10.00 C ATOM 75 O3' C A 3 -11.170 -6.381 -4.468 1.00 10.00 O ATOM 76 C2' C A 3 -9.226 -6.965 -3.137 1.00 10.00 C ATOM 77 O2' C A 3 -10.130 -7.780 -2.403 1.00 10.00 O ATOM 78 C1' C A 3 -7.982 -7.800 -3.422 1.00 10.00 C ATOM 79 N1 C A 3 -6.742 -6.977 -3.323 1.00 10.00 N ATOM 80 C2 C A 3 -6.278 -6.653 -2.041 1.00 10.00 C ATOM 81 O2 C A 3 -6.903 -6.976 -1.034 1.00 10.00 O ATOM 82 N3 C A 3 -5.118 -5.975 -1.873 1.00 10.00 N ATOM 83 C4 C A 3 -4.421 -5.636 -2.938 1.00 10.00 C ATOM 84 N4 C A 3 -3.304 -5.002 -2.709 1.00 10.00 N ATOM 85 C5 C A 3 -4.842 -5.924 -4.268 1.00 10.00 C ATOM 86 C6 C A 3 -6.014 -6.593 -4.423 1.00 10.00 C ATOM 0 H5' C A 3 -9.405 -8.870 -7.186 1.00 10.00 H new ATOM 0 H5'' C A 3 -10.323 -7.379 -7.111 1.00 10.00 H new ATOM 0 H4' C A 3 -10.223 -8.685 -5.024 1.00 10.00 H new ATOM 0 H3' C A 3 -9.368 -5.758 -5.020 1.00 10.00 H new ATOM 0 H2' C A 3 -9.049 -6.058 -2.559 1.00 10.00 H new ATOM 0 HO2' C A 3 -11.019 -7.734 -2.813 1.00 10.00 H new ATOM 0 H1' C A 3 -7.844 -8.590 -2.684 1.00 10.00 H new ATOM 0 H41 C A 3 -2.715 -4.710 -3.488 1.00 10.00 H new ATOM 0 H42 C A 3 -3.020 -4.799 -1.751 1.00 10.00 H new ATOM 0 H5 C A 3 -4.252 -5.622 -5.121 1.00 10.00 H new ATOM 0 H6 C A 3 -6.375 -6.824 -5.414 1.00 10.00 H new ATOM 98 P G A 4 -11.719 -4.924 -4.154 1.00 10.00 P ATOM 99 OP1 G A 4 -13.153 -5.073 -3.819 1.00 10.00 O ATOM 100 OP2 G A 4 -11.406 -4.064 -5.306 1.00 10.00 O ATOM 101 O5' G A 4 -10.961 -4.329 -2.889 1.00 10.00 O ATOM 102 C5' G A 4 -11.319 -4.627 -1.548 1.00 10.00 C ATOM 103 C4' G A 4 -10.291 -4.030 -0.573 1.00 10.00 C ATOM 104 O4' G A 4 -8.973 -4.509 -0.819 1.00 10.00 O ATOM 105 C3' G A 4 -10.247 -2.501 -0.592 1.00 10.00 C ATOM 106 O3' G A 4 -11.229 -1.974 0.296 1.00 10.00 O ATOM 107 C2' G A 4 -8.813 -2.262 -0.099 1.00 10.00 C ATOM 108 O2' G A 4 -8.766 -2.299 1.317 1.00 10.00 O ATOM 109 C1' G A 4 -8.028 -3.461 -0.632 1.00 10.00 C ATOM 110 N9 G A 4 -7.348 -3.125 -1.904 1.00 10.00 N ATOM 111 C8 G A 4 -7.798 -3.299 -3.188 1.00 10.00 C ATOM 112 N7 G A 4 -6.984 -2.877 -4.111 1.00 10.00 N ATOM 113 C5 G A 4 -5.894 -2.376 -3.384 1.00 10.00 C ATOM 114 C6 G A 4 -4.660 -1.766 -3.808 1.00 10.00 C ATOM 115 O6 G A 4 -4.242 -1.530 -4.939 1.00 10.00 O ATOM 116 N1 G A 4 -3.840 -1.398 -2.763 1.00 10.00 N ATOM 117 C2 G A 4 -4.130 -1.626 -1.461 1.00 10.00 C ATOM 118 N2 G A 4 -3.192 -1.317 -0.606 1.00 10.00 N ATOM 119 N3 G A 4 -5.252 -2.197 -1.008 1.00 10.00 N ATOM 120 C4 G A 4 -6.106 -2.537 -2.027 1.00 10.00 C ATOM 0 H5' G A 4 -11.375 -5.707 -1.411 1.00 10.00 H new ATOM 0 H5'' G A 4 -12.310 -4.227 -1.332 1.00 10.00 H new ATOM 0 H4' G A 4 -10.633 -4.359 0.408 1.00 10.00 H new ATOM 0 H3' G A 4 -10.463 -2.027 -1.549 1.00 10.00 H new ATOM 0 H2' G A 4 -8.426 -1.298 -0.428 1.00 10.00 H new ATOM 0 HO2' G A 4 -9.677 -2.259 1.676 1.00 10.00 H new ATOM 0 H1' G A 4 -7.246 -3.760 0.066 1.00 10.00 H new ATOM 0 H8 G A 4 -8.752 -3.751 -3.415 1.00 10.00 H new ATOM 0 H1 G A 4 -2.963 -0.926 -2.984 1.00 10.00 H new ATOM 0 H21 G A 4 -3.343 -1.463 0.392 1.00 10.00 H new ATOM 0 H22 G A 4 -2.308 -0.930 -0.937 1.00 10.00 H new ATOM 132 P G A 5 -11.700 -0.459 0.230 1.00 10.00 P ATOM 133 OP1 G A 5 -12.683 -0.265 1.320 1.00 10.00 O ATOM 134 OP2 G A 5 -12.114 -0.142 -1.146 1.00 10.00 O ATOM 135 O5' G A 5 -10.399 0.405 0.553 1.00 10.00 O ATOM 136 C5' G A 5 -9.980 0.659 1.882 1.00 10.00 C ATOM 137 C4' G A 5 -8.580 1.286 1.905 1.00 10.00 C ATOM 138 O4' G A 5 -7.649 0.538 1.135 1.00 10.00 O ATOM 139 C3' G A 5 -8.573 2.705 1.350 1.00 10.00 C ATOM 140 O3' G A 5 -9.008 3.610 2.348 1.00 10.00 O ATOM 141 C2' G A 5 -7.098 2.858 0.949 1.00 10.00 C ATOM 142 O2' G A 5 -6.242 3.282 2.003 1.00 10.00 O ATOM 143 C1' G A 5 -6.711 1.432 0.548 1.00 10.00 C ATOM 144 N9 G A 5 -6.694 1.310 -0.925 1.00 10.00 N ATOM 145 C8 G A 5 -7.734 1.078 -1.787 1.00 10.00 C ATOM 146 N7 G A 5 -7.407 1.175 -3.045 1.00 10.00 N ATOM 147 C5 G A 5 -6.033 1.459 -3.024 1.00 10.00 C ATOM 148 C6 G A 5 -5.069 1.681 -4.076 1.00 10.00 C ATOM 149 O6 G A 5 -5.228 1.708 -5.293 1.00 10.00 O ATOM 150 N1 G A 5 -3.786 1.909 -3.612 1.00 10.00 N ATOM 151 C2 G A 5 -3.458 1.926 -2.294 1.00 10.00 C ATOM 152 N2 G A 5 -2.189 1.886 -1.995 1.00 10.00 N ATOM 153 N3 G A 5 -4.318 1.762 -1.287 1.00 10.00 N ATOM 154 C4 G A 5 -5.594 1.532 -1.720 1.00 10.00 C ATOM 0 H5' G A 5 -9.975 -0.271 2.450 1.00 10.00 H new ATOM 0 H5'' G A 5 -10.690 1.327 2.370 1.00 10.00 H new ATOM 0 H4' G A 5 -8.292 1.290 2.956 1.00 10.00 H new ATOM 0 H3' G A 5 -9.244 2.904 0.514 1.00 10.00 H new ATOM 0 H2' G A 5 -6.988 3.621 0.178 1.00 10.00 H new ATOM 0 HO2' G A 5 -5.853 4.153 1.778 1.00 10.00 H new ATOM 0 H1' G A 5 -5.711 1.187 0.906 1.00 10.00 H new ATOM 0 H8 G A 5 -8.733 0.837 -1.454 1.00 10.00 H new ATOM 0 H1 G A 5 -3.047 2.073 -4.296 1.00 10.00 H new ATOM 0 H21 G A 5 -1.895 1.897 -1.018 1.00 10.00 H new ATOM 0 H22 G A 5 -1.491 1.844 -2.738 1.00 10.00 H new ATOM 166 P U A 6 -9.557 5.050 2.004 1.00 10.00 P ATOM 167 OP1 U A 6 -9.847 5.682 3.309 1.00 10.00 O ATOM 168 OP2 U A 6 -10.636 4.940 0.999 1.00 10.00 O ATOM 169 O5' U A 6 -8.354 5.826 1.299 1.00 10.00 O ATOM 170 C5' U A 6 -7.391 6.513 2.071 1.00 10.00 C ATOM 171 C4' U A 6 -6.177 6.938 1.240 1.00 10.00 C ATOM 172 O4' U A 6 -5.519 5.812 0.652 1.00 10.00 O ATOM 173 C3' U A 6 -6.435 7.932 0.104 1.00 10.00 C ATOM 174 O3' U A 6 -6.757 9.274 0.474 1.00 10.00 O ATOM 175 C2' U A 6 -5.063 7.785 -0.553 1.00 10.00 C ATOM 176 O2' U A 6 -4.031 8.457 0.166 1.00 10.00 O ATOM 177 C1' U A 6 -4.823 6.276 -0.516 1.00 10.00 C ATOM 178 N1 U A 6 -5.301 5.642 -1.785 1.00 10.00 N ATOM 179 C2 U A 6 -4.388 5.546 -2.846 1.00 10.00 C ATOM 180 O2 U A 6 -3.213 5.881 -2.752 1.00 10.00 O ATOM 181 N3 U A 6 -4.851 5.077 -4.053 1.00 10.00 N ATOM 182 C4 U A 6 -6.166 4.798 -4.343 1.00 10.00 C ATOM 183 O4 U A 6 -6.501 4.515 -5.490 1.00 10.00 O ATOM 184 C5 U A 6 -7.054 4.868 -3.198 1.00 10.00 C ATOM 185 C6 U A 6 -6.619 5.278 -1.975 1.00 10.00 C ATOM 0 H5' U A 6 -7.062 5.874 2.890 1.00 10.00 H new ATOM 0 H5'' U A 6 -7.849 7.395 2.519 1.00 10.00 H new ATOM 0 H4' U A 6 -5.565 7.446 1.985 1.00 10.00 H new ATOM 0 H3' U A 6 -7.321 7.728 -0.497 1.00 10.00 H new ATOM 0 H2' U A 6 -5.045 8.222 -1.551 1.00 10.00 H new ATOM 0 HO2' U A 6 -3.255 8.586 -0.419 1.00 10.00 H new ATOM 0 H1' U A 6 -3.768 6.011 -0.451 1.00 10.00 H new ATOM 0 H3 U A 6 -4.165 4.924 -4.792 1.00 10.00 H new ATOM 0 H5 U A 6 -8.090 4.587 -3.319 1.00 10.00 H new ATOM 0 H6 U A 6 -7.311 5.319 -1.147 1.00 10.00 H new ATOM 196 P G A 7 -7.613 10.201 -0.514 1.00 10.00 P ATOM 197 OP1 G A 7 -7.949 11.451 0.207 1.00 10.00 O ATOM 198 OP2 G A 7 -8.729 9.385 -1.033 1.00 10.00 O ATOM 199 O5' G A 7 -6.732 10.654 -1.769 1.00 10.00 O ATOM 200 C5' G A 7 -7.325 11.426 -2.816 1.00 10.00 C ATOM 201 C4' G A 7 -6.380 11.803 -3.976 1.00 10.00 C ATOM 202 O4' G A 7 -5.439 12.808 -3.613 1.00 10.00 O ATOM 203 C3' G A 7 -5.598 10.614 -4.518 1.00 10.00 C ATOM 204 O3' G A 7 -6.210 9.904 -5.579 1.00 10.00 O ATOM 205 C2' G A 7 -4.253 11.188 -4.926 1.00 10.00 C ATOM 206 O2' G A 7 -4.236 11.551 -6.300 1.00 10.00 O ATOM 207 C1' G A 7 -4.133 12.427 -4.045 1.00 10.00 C ATOM 208 N9 G A 7 -3.281 12.150 -2.872 1.00 10.00 N ATOM 209 C8 G A 7 -3.660 11.909 -1.578 1.00 10.00 C ATOM 210 N7 G A 7 -2.661 11.813 -0.734 1.00 10.00 N ATOM 211 C5 G A 7 -1.528 11.911 -1.559 1.00 10.00 C ATOM 212 C6 G A 7 -0.115 11.806 -1.280 1.00 10.00 C ATOM 213 O6 G A 7 0.475 11.644 -0.211 1.00 10.00 O ATOM 214 N1 G A 7 0.671 11.873 -2.411 1.00 10.00 N ATOM 215 C2 G A 7 0.192 12.058 -3.660 1.00 10.00 C ATOM 216 N2 G A 7 1.086 12.091 -4.613 1.00 10.00 N ATOM 217 N3 G A 7 -1.093 12.215 -3.966 1.00 10.00 N ATOM 218 C4 G A 7 -1.908 12.106 -2.870 1.00 10.00 C ATOM 0 H5' G A 7 -7.728 12.343 -2.385 1.00 10.00 H new ATOM 0 H5'' G A 7 -8.168 10.868 -3.223 1.00 10.00 H new ATOM 0 H4' G A 7 -7.048 12.182 -4.749 1.00 10.00 H new ATOM 0 H3' G A 7 -5.528 9.848 -3.746 1.00 10.00 H new ATOM 0 H2' G A 7 -3.435 10.478 -4.802 1.00 10.00 H new ATOM 0 HO2' G A 7 -5.000 11.141 -6.756 1.00 10.00 H new ATOM 0 H1' G A 7 -3.675 13.234 -4.617 1.00 10.00 H new ATOM 0 H8 G A 7 -4.693 11.807 -1.279 1.00 10.00 H new ATOM 0 H1 G A 7 1.680 11.777 -2.297 1.00 10.00 H new ATOM 0 H21 G A 7 0.795 12.227 -5.581 1.00 10.00 H new ATOM 0 H22 G A 7 2.075 11.980 -4.389 1.00 10.00 H new ATOM 230 P A A 8 -6.061 8.321 -5.632 1.00 10.00 P ATOM 231 OP1 A A 8 -6.635 7.906 -6.932 1.00 10.00 O ATOM 232 OP2 A A 8 -6.634 7.826 -4.374 1.00 10.00 O ATOM 233 O5' A A 8 -4.483 8.057 -5.628 1.00 10.00 O ATOM 234 C5' A A 8 -3.747 7.975 -6.836 1.00 10.00 C ATOM 235 C4' A A 8 -2.229 7.974 -6.610 1.00 10.00 C ATOM 236 O4' A A 8 -1.816 9.097 -5.845 1.00 10.00 O ATOM 237 C3' A A 8 -1.663 6.735 -5.913 1.00 10.00 C ATOM 238 O3' A A 8 -1.508 5.671 -6.833 1.00 10.00 O ATOM 239 C2' A A 8 -0.303 7.288 -5.454 1.00 10.00 C ATOM 240 O2' A A 8 0.645 7.244 -6.518 1.00 10.00 O ATOM 241 C1' A A 8 -0.674 8.727 -5.087 1.00 10.00 C ATOM 242 N9 A A 8 -0.970 8.745 -3.640 1.00 10.00 N ATOM 243 C8 A A 8 -2.178 8.665 -2.992 1.00 10.00 C ATOM 244 N7 A A 8 -2.077 8.605 -1.690 1.00 10.00 N ATOM 245 C5 A A 8 -0.697 8.585 -1.469 1.00 10.00 C ATOM 246 C6 A A 8 0.134 8.466 -0.333 1.00 10.00 C ATOM 247 N6 A A 8 -0.314 8.335 0.900 1.00 10.00 N ATOM 248 N1 A A 8 1.465 8.462 -0.446 1.00 10.00 N ATOM 249 C2 A A 8 1.972 8.577 -1.668 1.00 10.00 C ATOM 250 N3 A A 8 1.330 8.694 -2.822 1.00 10.00 N ATOM 251 C4 A A 8 -0.020 8.681 -2.652 1.00 10.00 C ATOM 0 H5' A A 8 -4.014 8.816 -7.476 1.00 10.00 H new ATOM 0 H5'' A A 8 -4.031 7.067 -7.368 1.00 10.00 H new ATOM 0 H4' A A 8 -1.835 7.996 -7.626 1.00 10.00 H new ATOM 0 H3' A A 8 -2.280 6.322 -5.115 1.00 10.00 H new ATOM 0 H2' A A 8 0.164 6.732 -4.640 1.00 10.00 H new ATOM 0 HO2' A A 8 0.366 6.574 -7.177 1.00 10.00 H new ATOM 0 H1' A A 8 0.130 9.430 -5.304 1.00 10.00 H new ATOM 0 H8 A A 8 -3.125 8.653 -3.511 1.00 10.00 H new ATOM 0 H61 A A 8 0.343 8.254 1.676 1.00 10.00 H new ATOM 0 H62 A A 8 -1.318 8.315 1.078 1.00 10.00 H new ATOM 0 H2 A A 8 3.050 8.575 -1.730 1.00 10.00 H new ATOM 263 P A A 9 -1.248 4.181 -6.362 1.00 10.00 P ATOM 264 OP1 A A 9 -0.991 3.448 -7.618 1.00 10.00 O ATOM 265 OP2 A A 9 -2.373 3.775 -5.496 1.00 10.00 O ATOM 266 O5' A A 9 0.120 4.298 -5.513 1.00 10.00 O ATOM 267 C5' A A 9 0.390 3.460 -4.395 1.00 10.00 C ATOM 268 C4' A A 9 1.555 4.006 -3.538 1.00 10.00 C ATOM 269 O4' A A 9 1.163 5.193 -2.841 1.00 10.00 O ATOM 270 C3' A A 9 2.048 2.990 -2.487 1.00 10.00 C ATOM 271 O3' A A 9 3.241 2.290 -2.861 1.00 10.00 O ATOM 272 C2' A A 9 2.341 3.879 -1.273 1.00 10.00 C ATOM 273 O2' A A 9 3.704 4.278 -1.261 1.00 10.00 O ATOM 274 C1' A A 9 1.459 5.101 -1.451 1.00 10.00 C ATOM 275 N9 A A 9 0.238 4.946 -0.626 1.00 10.00 N ATOM 276 C8 A A 9 -1.026 4.638 -1.043 1.00 10.00 C ATOM 277 N7 A A 9 -1.893 4.480 -0.080 1.00 10.00 N ATOM 278 C5 A A 9 -1.139 4.718 1.068 1.00 10.00 C ATOM 279 C6 A A 9 -1.420 4.696 2.451 1.00 10.00 C ATOM 280 N6 A A 9 -2.602 4.412 2.960 1.00 10.00 N ATOM 281 N1 A A 9 -0.465 4.946 3.351 1.00 10.00 N ATOM 282 C2 A A 9 0.747 5.218 2.888 1.00 10.00 C ATOM 283 N3 A A 9 1.174 5.253 1.629 1.00 10.00 N ATOM 284 C4 A A 9 0.161 5.001 0.750 1.00 10.00 C ATOM 0 H5' A A 9 0.634 2.456 -4.743 1.00 10.00 H new ATOM 0 H5'' A A 9 -0.506 3.375 -3.780 1.00 10.00 H new ATOM 0 H4' A A 9 2.363 4.214 -4.239 1.00 10.00 H new ATOM 0 H3' A A 9 1.310 2.204 -2.329 1.00 10.00 H new ATOM 0 H2' A A 9 2.147 3.354 -0.338 1.00 10.00 H new ATOM 0 HO2' A A 9 4.214 3.720 -1.885 1.00 10.00 H new ATOM 0 H1' A A 9 1.948 6.018 -1.123 1.00 10.00 H new ATOM 0 H8 A A 9 -1.287 4.534 -2.086 1.00 10.00 H new ATOM 0 H61 A A 9 -2.736 4.414 3.971 1.00 10.00 H new ATOM 0 H62 A A 9 -3.383 4.190 2.343 1.00 10.00 H new ATOM 0 H2 A A 9 1.491 5.442 3.638 1.00 10.00 H new ATOM 296 P A A 10 3.506 0.776 -2.399 1.00 10.00 P ATOM 297 OP1 A A 10 4.854 0.376 -2.866 1.00 10.00 O ATOM 298 OP2 A A 10 2.354 -0.044 -2.787 1.00 10.00 O ATOM 299 O5' A A 10 3.531 0.772 -0.804 1.00 10.00 O ATOM 300 C5' A A 10 4.702 1.072 -0.072 1.00 10.00 C ATOM 301 C4' A A 10 4.376 1.258 1.415 1.00 10.00 C ATOM 302 O4' A A 10 3.388 2.275 1.587 1.00 10.00 O ATOM 303 C3' A A 10 3.897 0.002 2.157 1.00 10.00 C ATOM 304 O3' A A 10 4.960 -0.774 2.708 1.00 10.00 O ATOM 305 C2' A A 10 3.109 0.658 3.291 1.00 10.00 C ATOM 306 O2' A A 10 4.010 1.098 4.300 1.00 10.00 O ATOM 307 C1' A A 10 2.481 1.869 2.606 1.00 10.00 C ATOM 308 N9 A A 10 1.134 1.535 2.075 1.00 10.00 N ATOM 309 C8 A A 10 0.693 1.325 0.788 1.00 10.00 C ATOM 310 N7 A A 10 -0.599 1.150 0.680 1.00 10.00 N ATOM 311 C5 A A 10 -1.043 1.220 2.010 1.00 10.00 C ATOM 312 C6 A A 10 -2.294 1.124 2.674 1.00 10.00 C ATOM 313 N6 A A 10 -3.462 0.959 2.089 1.00 10.00 N ATOM 314 N1 A A 10 -2.370 1.197 4.006 1.00 10.00 N ATOM 315 C2 A A 10 -1.246 1.360 4.686 1.00 10.00 C ATOM 316 N3 A A 10 -0.015 1.498 4.216 1.00 10.00 N ATOM 317 C4 A A 10 0.014 1.418 2.858 1.00 10.00 C ATOM 0 H5' A A 10 5.161 1.979 -0.465 1.00 10.00 H new ATOM 0 H5'' A A 10 5.429 0.269 -0.193 1.00 10.00 H new ATOM 0 H4' A A 10 5.333 1.533 1.858 1.00 10.00 H new ATOM 0 H3' A A 10 3.359 -0.697 1.516 1.00 10.00 H new ATOM 0 H2' A A 10 2.384 -0.004 3.764 1.00 10.00 H new ATOM 0 HO2' A A 10 4.824 0.553 4.272 1.00 10.00 H new ATOM 0 H1' A A 10 2.322 2.690 3.305 1.00 10.00 H new ATOM 0 H8 A A 10 1.359 1.306 -0.062 1.00 10.00 H new ATOM 0 H61 A A 10 -4.311 0.901 2.652 1.00 10.00 H new ATOM 0 H62 A A 10 -3.518 0.889 1.073 1.00 10.00 H new ATOM 0 H2 A A 10 -1.345 1.383 5.761 1.00 10.00 H new ATOM 329 P U A 11 4.758 -2.329 3.011 1.00 10.00 P ATOM 330 OP1 U A 11 5.981 -2.845 3.676 1.00 10.00 O ATOM 331 OP2 U A 11 4.312 -2.953 1.757 1.00 10.00 O ATOM 332 O5' U A 11 3.576 -2.406 4.085 1.00 10.00 O ATOM 333 C5' U A 11 3.805 -2.111 5.453 1.00 10.00 C ATOM 334 C4' U A 11 2.526 -2.157 6.294 1.00 10.00 C ATOM 335 O4' U A 11 1.541 -1.244 5.835 1.00 10.00 O ATOM 336 C3' U A 11 1.863 -3.534 6.355 1.00 10.00 C ATOM 337 O3' U A 11 2.467 -4.408 7.298 1.00 10.00 O ATOM 338 C2' U A 11 0.481 -3.121 6.853 1.00 10.00 C ATOM 339 O2' U A 11 0.481 -2.912 8.268 1.00 10.00 O ATOM 340 C1' U A 11 0.257 -1.790 6.136 1.00 10.00 C ATOM 341 N1 U A 11 -0.583 -1.973 4.925 1.00 10.00 N ATOM 342 C2 U A 11 -1.971 -1.981 5.114 1.00 10.00 C ATOM 343 O2 U A 11 -2.503 -1.863 6.220 1.00 10.00 O ATOM 344 N3 U A 11 -2.752 -2.161 4.001 1.00 10.00 N ATOM 345 C4 U A 11 -2.290 -2.391 2.737 1.00 10.00 C ATOM 346 O4 U A 11 -3.091 -2.611 1.849 1.00 10.00 O ATOM 347 C5 U A 11 -0.854 -2.385 2.605 1.00 10.00 C ATOM 348 C6 U A 11 -0.041 -2.181 3.673 1.00 10.00 C ATOM 0 H5' U A 11 4.253 -1.121 5.536 1.00 10.00 H new ATOM 0 H5'' U A 11 4.526 -2.822 5.857 1.00 10.00 H new ATOM 0 H4' U A 11 2.876 -1.885 7.290 1.00 10.00 H new ATOM 0 H3' U A 11 1.910 -4.084 5.415 1.00 10.00 H new ATOM 0 H2' U A 11 -0.284 -3.873 6.658 1.00 10.00 H new ATOM 0 HO2' U A 11 1.198 -3.440 8.677 1.00 10.00 H new ATOM 0 H1' U A 11 -0.290 -1.093 6.771 1.00 10.00 H new ATOM 0 H3 U A 11 -3.763 -2.120 4.128 1.00 10.00 H new ATOM 0 H5 U A 11 -0.414 -2.547 1.632 1.00 10.00 H new ATOM 0 H6 U A 11 1.031 -2.181 3.543 1.00 10.00 H new ATOM 359 P G A 12 2.421 -5.979 7.092 1.00 10.00 P ATOM 360 OP1 G A 12 2.905 -6.554 8.367 1.00 10.00 O ATOM 361 OP2 G A 12 3.211 -6.243 5.879 1.00 10.00 O ATOM 362 O5' G A 12 0.884 -6.426 6.868 1.00 10.00 O ATOM 363 C5' G A 12 -0.044 -6.496 7.950 1.00 10.00 C ATOM 364 C4' G A 12 -1.533 -6.574 7.542 1.00 10.00 C ATOM 365 O4' G A 12 -1.952 -5.488 6.723 1.00 10.00 O ATOM 366 C3' G A 12 -2.035 -7.882 6.901 1.00 10.00 C ATOM 367 O3' G A 12 -2.322 -8.829 7.935 1.00 10.00 O ATOM 368 C2' G A 12 -3.301 -7.361 6.210 1.00 10.00 C ATOM 369 O2' G A 12 -4.368 -7.337 7.144 1.00 10.00 O ATOM 370 C1' G A 12 -2.937 -5.934 5.794 1.00 10.00 C ATOM 371 N9 G A 12 -2.362 -5.864 4.429 1.00 10.00 N ATOM 372 C8 G A 12 -1.039 -5.790 4.097 1.00 10.00 C ATOM 373 N7 G A 12 -0.799 -5.686 2.821 1.00 10.00 N ATOM 374 C5 G A 12 -2.078 -5.655 2.248 1.00 10.00 C ATOM 375 C6 G A 12 -2.507 -5.513 0.878 1.00 10.00 C ATOM 376 O6 G A 12 -1.832 -5.349 -0.138 1.00 10.00 O ATOM 377 N1 G A 12 -3.872 -5.612 0.727 1.00 10.00 N ATOM 378 C2 G A 12 -4.737 -5.750 1.754 1.00 10.00 C ATOM 379 N2 G A 12 -5.989 -5.935 1.440 1.00 10.00 N ATOM 380 N3 G A 12 -4.400 -5.809 3.049 1.00 10.00 N ATOM 381 C4 G A 12 -3.043 -5.777 3.231 1.00 10.00 C ATOM 0 H5' G A 12 0.096 -5.620 8.584 1.00 10.00 H new ATOM 0 H5'' G A 12 0.195 -7.370 8.556 1.00 10.00 H new ATOM 0 H4' G A 12 -1.997 -6.526 8.527 1.00 10.00 H new ATOM 0 H3' G A 12 -1.350 -8.398 6.228 1.00 10.00 H new ATOM 0 H2' G A 12 -3.615 -7.975 5.366 1.00 10.00 H new ATOM 0 HO2' G A 12 -4.118 -7.851 7.940 1.00 10.00 H new ATOM 0 H1' G A 12 -3.838 -5.321 5.791 1.00 10.00 H new ATOM 0 H8 G A 12 -0.252 -5.816 4.836 1.00 10.00 H new ATOM 0 H1 G A 12 -4.253 -5.579 -0.219 1.00 10.00 H new ATOM 0 H21 G A 12 -6.688 -6.046 2.175 1.00 10.00 H new ATOM 0 H22 G A 12 -6.269 -5.969 0.460 1.00 10.00 H new ATOM 393 P C A 13 -2.115 -10.400 7.738 1.00 10.00 P ATOM 394 OP1 C A 13 -2.299 -11.035 9.064 1.00 10.00 O ATOM 395 OP2 C A 13 -0.860 -10.607 6.992 1.00 10.00 O ATOM 396 O5' C A 13 -3.311 -10.837 6.781 1.00 10.00 O ATOM 397 C5' C A 13 -4.646 -10.924 7.248 1.00 10.00 C ATOM 398 C4' C A 13 -5.645 -11.004 6.085 1.00 10.00 C ATOM 399 O4' C A 13 -5.552 -9.873 5.232 1.00 10.00 O ATOM 400 C3' C A 13 -5.514 -12.258 5.216 1.00 10.00 C ATOM 401 O3' C A 13 -6.223 -13.317 5.867 1.00 10.00 O ATOM 402 C2' C A 13 -6.212 -11.764 3.942 1.00 10.00 C ATOM 403 O2' C A 13 -7.629 -11.859 4.030 1.00 10.00 O ATOM 404 C1' C A 13 -5.841 -10.278 3.897 1.00 10.00 C ATOM 405 N1 C A 13 -4.683 -9.979 2.997 1.00 10.00 N ATOM 406 C2 C A 13 -4.957 -9.707 1.648 1.00 10.00 C ATOM 407 O2 C A 13 -6.072 -9.887 1.165 1.00 10.00 O ATOM 408 N3 C A 13 -3.983 -9.237 0.833 1.00 10.00 N ATOM 409 C4 C A 13 -2.787 -9.013 1.335 1.00 10.00 C ATOM 410 N4 C A 13 -1.897 -8.529 0.513 1.00 10.00 N ATOM 411 C5 C A 13 -2.443 -9.279 2.688 1.00 10.00 C ATOM 412 C6 C A 13 -3.412 -9.795 3.491 1.00 10.00 C ATOM 0 H5' C A 13 -4.874 -10.055 7.866 1.00 10.00 H new ATOM 0 H5'' C A 13 -4.754 -11.803 7.883 1.00 10.00 H new ATOM 0 H4' C A 13 -6.615 -11.040 6.582 1.00 10.00 H new ATOM 0 H3' C A 13 -4.512 -12.646 5.030 1.00 10.00 H new ATOM 0 H2' C A 13 -5.911 -12.349 3.073 1.00 10.00 H new ATOM 0 HO2' C A 13 -7.871 -12.496 4.735 1.00 10.00 H new ATOM 0 H1' C A 13 -6.681 -9.723 3.479 1.00 10.00 H new ATOM 0 H41 C A 13 -0.951 -8.334 0.842 1.00 10.00 H new ATOM 0 H42 C A 13 -2.147 -8.346 -0.459 1.00 10.00 H new ATOM 0 H5 C A 13 -1.451 -9.079 3.064 1.00 10.00 H new ATOM 0 H6 C A 13 -3.185 -10.059 4.513 1.00 10.00 H new ATOM 424 P C A 14 -5.894 -14.862 5.664 1.00 10.00 P ATOM 425 OP1 C A 14 -6.929 -15.627 6.398 1.00 10.00 O ATOM 426 OP2 C A 14 -4.489 -15.094 6.028 1.00 10.00 O ATOM 427 O5' C A 14 -6.041 -15.151 4.112 1.00 10.00 O ATOM 428 C5' C A 14 -7.276 -15.535 3.529 1.00 10.00 C ATOM 429 C4' C A 14 -7.170 -15.485 2.005 1.00 10.00 C ATOM 430 O4' C A 14 -6.780 -14.183 1.594 1.00 10.00 O ATOM 431 C3' C A 14 -6.126 -16.440 1.419 1.00 10.00 C ATOM 432 O3' C A 14 -6.595 -17.781 1.277 1.00 10.00 O ATOM 433 C2' C A 14 -5.889 -15.785 0.056 1.00 10.00 C ATOM 434 O2' C A 14 -6.867 -16.184 -0.896 1.00 10.00 O ATOM 435 C1' C A 14 -6.086 -14.295 0.359 1.00 10.00 C ATOM 436 N1 C A 14 -4.781 -13.576 0.386 1.00 10.00 N ATOM 437 C2 C A 14 -4.297 -13.104 -0.839 1.00 10.00 C ATOM 438 O2 C A 14 -4.939 -13.234 -1.873 1.00 10.00 O ATOM 439 N3 C A 14 -3.084 -12.511 -0.921 1.00 10.00 N ATOM 440 C4 C A 14 -2.372 -12.390 0.172 1.00 10.00 C ATOM 441 N4 C A 14 -1.214 -11.814 0.015 1.00 10.00 N ATOM 442 C5 C A 14 -2.804 -12.840 1.452 1.00 10.00 C ATOM 443 C6 C A 14 -4.020 -13.449 1.524 1.00 10.00 C ATOM 0 H5' C A 14 -8.071 -14.871 3.869 1.00 10.00 H new ATOM 0 H5'' C A 14 -7.543 -16.542 3.851 1.00 10.00 H new ATOM 0 H4' C A 14 -8.157 -15.775 1.644 1.00 10.00 H new ATOM 0 H3' C A 14 -5.242 -16.556 2.046 1.00 10.00 H new ATOM 0 H2' C A 14 -4.918 -16.048 -0.363 1.00 10.00 H new ATOM 0 HO2' C A 14 -7.220 -17.065 -0.653 1.00 10.00 H new ATOM 0 HO3' C A 14 -5.884 -18.338 0.897 1.00 10.00 H new ATOM 0 H1' C A 14 -6.675 -13.826 -0.429 1.00 10.00 H new ATOM 0 H41 C A 14 -0.598 -11.681 0.817 1.00 10.00 H new ATOM 0 H42 C A 14 -0.924 -11.496 -0.910 1.00 10.00 H new ATOM 0 H5 C A 14 -2.192 -12.704 2.331 1.00 10.00 H new ATOM 0 H6 C A 14 -4.384 -13.829 2.467 1.00 10.00 H new TER 456 C A 14