USER MOD reduce.3.24.130724 H: found=0, std=0, add=152, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 153 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= -0.318 USER MOD Single : A 2 G O2' : rot -22:sc= 0.119 USER MOD Single : A 3 C O2' : rot -74:sc= 1.23 USER MOD Single : A 4 A O2' : rot -19:sc= 0.177 USER MOD Single : A 5 C O2' : rot -19:sc= 0.12 USER MOD Single : A 6 U O2' : rot -140:sc= 1.26 USER MOD Single : A 7 U O2' : rot -105:sc= 0.532 USER MOD Single : A 8 C O2' : rot 21:sc= 0.206 USER MOD Single : A 9 G O2' : rot -23:sc= 0.133 USER MOD Single : A 10 G O2' : rot -17:sc= 0.0612 USER MOD Single : A 11 U O2' : rot -22:sc= 0.247 USER MOD Single : A 12 G O2' : rot -24:sc= 0.103 USER MOD Single : A 13 C O2' : rot -108:sc= 0.422 USER MOD Single : A 14 C O2' : rot -10:sc= 0.417 USER MOD Single : A 14 C O3' : rot 180:sc= 0.254 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 G A 1 -10.823 -2.319 10.166 1.00 10.00 O ATOM 2 P G A 1 -10.388 -3.833 10.381 1.00 10.00 P ATOM 3 OP1 G A 1 -11.457 -4.514 11.145 1.00 10.00 O ATOM 4 OP2 G A 1 -9.004 -3.840 10.908 1.00 10.00 O ATOM 5 O5' G A 1 -10.374 -4.412 8.898 1.00 10.00 O ATOM 6 C5' G A 1 -10.713 -5.769 8.626 1.00 10.00 C ATOM 7 C4' G A 1 -11.291 -5.901 7.236 1.00 10.00 C ATOM 8 O4' G A 1 -12.204 -4.793 6.973 1.00 10.00 O ATOM 9 C3' G A 1 -10.281 -5.844 6.097 1.00 10.00 C ATOM 10 O3' G A 1 -9.688 -7.121 5.856 1.00 10.00 O ATOM 11 C2' G A 1 -11.169 -5.412 4.939 1.00 10.00 C ATOM 12 O2' G A 1 -11.975 -6.475 4.471 1.00 10.00 O ATOM 13 C1' G A 1 -12.053 -4.376 5.625 1.00 10.00 C ATOM 14 N9 G A 1 -11.496 -3.026 5.572 1.00 10.00 N ATOM 15 C8 G A 1 -10.972 -2.279 6.600 1.00 10.00 C ATOM 16 N7 G A 1 -10.563 -1.098 6.223 1.00 10.00 N ATOM 17 C5 G A 1 -10.832 -1.057 4.863 1.00 10.00 C ATOM 18 C6 G A 1 -10.607 -0.026 3.911 1.00 10.00 C ATOM 19 O6 G A 1 -10.107 1.090 4.096 1.00 10.00 O ATOM 20 N1 G A 1 -11.027 -0.394 2.636 1.00 10.00 N ATOM 21 C2 G A 1 -11.592 -1.608 2.325 1.00 10.00 C ATOM 22 N2 G A 1 -11.936 -1.792 1.041 1.00 10.00 N ATOM 23 N3 G A 1 -11.810 -2.577 3.203 1.00 10.00 N ATOM 24 C4 G A 1 -11.407 -2.238 4.446 1.00 10.00 C ATOM 0 H5' G A 1 -11.435 -6.124 9.362 1.00 10.00 H new ATOM 0 H5'' G A 1 -9.827 -6.397 8.719 1.00 10.00 H new ATOM 0 H4' G A 1 -11.759 -6.885 7.245 1.00 10.00 H new ATOM 0 H3' G A 1 -9.434 -5.184 6.282 1.00 10.00 H new ATOM 0 H2' G A 1 -10.610 -5.061 4.071 1.00 10.00 H new ATOM 0 HO2' G A 1 -12.532 -6.161 3.729 1.00 10.00 H new ATOM 0 H1' G A 1 -13.010 -4.321 5.106 1.00 10.00 H new ATOM 0 H8 G A 1 -10.905 -2.634 7.618 1.00 10.00 H new ATOM 0 H1 G A 1 -10.908 0.282 1.882 1.00 10.00 H new ATOM 0 H21 G A 1 -12.360 -2.672 0.748 1.00 10.00 H new ATOM 0 H22 G A 1 -11.774 -1.052 0.358 1.00 10.00 H new ATOM 37 P G A 2 -8.144 -7.268 5.414 1.00 10.00 P ATOM 38 OP1 G A 2 -7.625 -8.524 6.002 1.00 10.00 O ATOM 39 OP2 G A 2 -7.446 -5.998 5.716 1.00 10.00 O ATOM 40 O5' G A 2 -8.169 -7.452 3.829 1.00 10.00 O ATOM 41 C5' G A 2 -9.274 -8.081 3.188 1.00 10.00 C ATOM 42 C4' G A 2 -9.456 -7.620 1.756 1.00 10.00 C ATOM 43 O4' G A 2 -10.165 -6.357 1.779 1.00 10.00 O ATOM 44 C3' G A 2 -8.206 -7.352 0.924 1.00 10.00 C ATOM 45 O3' G A 2 -7.781 -8.537 0.261 1.00 10.00 O ATOM 46 C2' G A 2 -8.695 -6.301 -0.069 1.00 10.00 C ATOM 47 O2' G A 2 -9.431 -6.892 -1.123 1.00 10.00 O ATOM 48 C1' G A 2 -9.628 -5.473 0.814 1.00 10.00 C ATOM 49 N9 G A 2 -8.968 -4.396 1.548 1.00 10.00 N ATOM 50 C8 G A 2 -8.583 -4.438 2.862 1.00 10.00 C ATOM 51 N7 G A 2 -8.063 -3.318 3.289 1.00 10.00 N ATOM 52 C5 G A 2 -8.103 -2.482 2.181 1.00 10.00 C ATOM 53 C6 G A 2 -7.674 -1.133 2.032 1.00 10.00 C ATOM 54 O6 G A 2 -7.170 -0.385 2.884 1.00 10.00 O ATOM 55 N1 G A 2 -7.891 -0.662 0.741 1.00 10.00 N ATOM 56 C2 G A 2 -8.453 -1.405 -0.273 1.00 10.00 C ATOM 57 N2 G A 2 -8.588 -0.795 -1.455 1.00 10.00 N ATOM 58 N3 G A 2 -8.858 -2.659 -0.147 1.00 10.00 N ATOM 59 C4 G A 2 -8.655 -3.134 1.097 1.00 10.00 C ATOM 0 H5' G A 2 -10.183 -7.872 3.751 1.00 10.00 H new ATOM 0 H5'' G A 2 -9.131 -9.161 3.203 1.00 10.00 H new ATOM 0 H4' G A 2 -9.965 -8.461 1.286 1.00 10.00 H new ATOM 0 H3' G A 2 -7.346 -7.025 1.508 1.00 10.00 H new ATOM 0 H2' G A 2 -7.892 -5.741 -0.548 1.00 10.00 H new ATOM 0 HO2' G A 2 -9.187 -7.838 -1.202 1.00 10.00 H new ATOM 0 H1' G A 2 -10.365 -5.009 0.159 1.00 10.00 H new ATOM 0 H8 G A 2 -8.698 -5.313 3.485 1.00 10.00 H new ATOM 0 H1 G A 2 -7.615 0.298 0.532 1.00 10.00 H new ATOM 0 H21 G A 2 -8.998 -1.296 -2.243 1.00 10.00 H new ATOM 0 H22 G A 2 -8.281 0.171 -1.568 1.00 10.00 H new ATOM 71 P C A 3 -6.324 -8.614 -0.410 1.00 10.00 P ATOM 72 OP1 C A 3 -6.234 -9.922 -1.099 1.00 10.00 O ATOM 73 OP2 C A 3 -5.314 -8.251 0.611 1.00 10.00 O ATOM 74 O5' C A 3 -6.342 -7.481 -1.529 1.00 10.00 O ATOM 75 C5' C A 3 -6.464 -7.809 -2.911 1.00 10.00 C ATOM 76 C4' C A 3 -6.232 -6.580 -3.760 1.00 10.00 C ATOM 77 O4' C A 3 -6.764 -5.419 -3.072 1.00 10.00 O ATOM 78 C3' C A 3 -4.774 -6.235 -4.028 1.00 10.00 C ATOM 79 O3' C A 3 -4.311 -6.932 -5.179 1.00 10.00 O ATOM 80 C2' C A 3 -4.816 -4.728 -4.263 1.00 10.00 C ATOM 81 O2' C A 3 -5.105 -4.433 -5.615 1.00 10.00 O ATOM 82 C1' C A 3 -5.987 -4.279 -3.388 1.00 10.00 C ATOM 83 N1 C A 3 -5.581 -3.620 -2.130 1.00 10.00 N ATOM 84 C2 C A 3 -5.272 -2.255 -2.150 1.00 10.00 C ATOM 85 O2 C A 3 -5.277 -1.646 -3.230 1.00 10.00 O ATOM 86 N3 C A 3 -4.972 -1.627 -0.989 1.00 10.00 N ATOM 87 C4 C A 3 -4.974 -2.304 0.161 1.00 10.00 C ATOM 88 N4 C A 3 -4.727 -1.633 1.287 1.00 10.00 N ATOM 89 C5 C A 3 -5.270 -3.694 0.209 1.00 10.00 C ATOM 90 C6 C A 3 -5.559 -4.304 -0.945 1.00 10.00 C ATOM 0 H5' C A 3 -7.456 -8.216 -3.110 1.00 10.00 H new ATOM 0 H5'' C A 3 -5.743 -8.583 -3.174 1.00 10.00 H new ATOM 0 H4' C A 3 -6.715 -6.816 -4.708 1.00 10.00 H new ATOM 0 H3' C A 3 -4.097 -6.513 -3.221 1.00 10.00 H new ATOM 0 H2' C A 3 -3.869 -4.240 -4.032 1.00 10.00 H new ATOM 0 HO2' C A 3 -4.314 -4.612 -6.165 1.00 10.00 H new ATOM 0 H1' C A 3 -6.545 -3.537 -3.959 1.00 10.00 H new ATOM 0 H41 C A 3 -4.722 -2.123 2.182 1.00 10.00 H new ATOM 0 H42 C A 3 -4.543 -0.630 1.253 1.00 10.00 H new ATOM 0 H5 C A 3 -5.262 -4.237 1.143 1.00 10.00 H new ATOM 0 H6 C A 3 -5.780 -5.361 -0.942 1.00 10.00 H new ATOM 102 P A A 4 -2.791 -6.803 -5.678 1.00 10.00 P ATOM 103 OP1 A A 4 -2.581 -7.817 -6.739 1.00 10.00 O ATOM 104 OP2 A A 4 -1.919 -6.812 -4.484 1.00 10.00 O ATOM 105 O5' A A 4 -2.727 -5.356 -6.338 1.00 10.00 O ATOM 106 C5' A A 4 -2.252 -5.161 -7.666 1.00 10.00 C ATOM 107 C4' A A 4 -1.576 -3.815 -7.799 1.00 10.00 C ATOM 108 O4' A A 4 -2.127 -2.884 -6.826 1.00 10.00 O ATOM 109 C3' A A 4 -0.079 -3.809 -7.528 1.00 10.00 C ATOM 110 O3' A A 4 0.642 -4.141 -8.709 1.00 10.00 O ATOM 111 C2' A A 4 0.171 -2.375 -7.102 1.00 10.00 C ATOM 112 O2' A A 4 0.301 -1.528 -8.227 1.00 10.00 O ATOM 113 C1' A A 4 -1.100 -2.043 -6.328 1.00 10.00 C ATOM 114 N9 A A 4 -0.988 -2.255 -4.882 1.00 10.00 N ATOM 115 C8 A A 4 -1.231 -3.410 -4.177 1.00 10.00 C ATOM 116 N7 A A 4 -1.023 -3.297 -2.888 1.00 10.00 N ATOM 117 C5 A A 4 -0.613 -1.982 -2.730 1.00 10.00 C ATOM 118 C6 A A 4 -0.236 -1.246 -1.594 1.00 10.00 C ATOM 119 N6 A A 4 -0.224 -1.752 -0.359 1.00 10.00 N ATOM 120 N1 A A 4 0.118 0.044 -1.776 1.00 10.00 N ATOM 121 C2 A A 4 0.098 0.547 -3.021 1.00 10.00 C ATOM 122 N3 A A 4 -0.235 -0.049 -4.168 1.00 10.00 N ATOM 123 C4 A A 4 -0.585 -1.328 -3.951 1.00 10.00 C ATOM 0 H5' A A 4 -3.083 -5.227 -8.368 1.00 10.00 H new ATOM 0 H5'' A A 4 -1.550 -5.953 -7.927 1.00 10.00 H new ATOM 0 H4' A A 4 -1.752 -3.541 -8.839 1.00 10.00 H new ATOM 0 H3' A A 4 0.242 -4.536 -6.782 1.00 10.00 H new ATOM 0 H2' A A 4 1.088 -2.245 -6.527 1.00 10.00 H new ATOM 0 HO2' A A 4 0.502 -2.067 -9.021 1.00 10.00 H new ATOM 0 H1' A A 4 -1.306 -0.982 -6.470 1.00 10.00 H new ATOM 0 H8 A A 4 -1.563 -4.326 -4.643 1.00 10.00 H new ATOM 0 H61 A A 4 0.060 -1.169 0.428 1.00 10.00 H new ATOM 0 H62 A A 4 -0.498 -2.722 -0.203 1.00 10.00 H new ATOM 0 H2 A A 4 0.394 1.582 -3.106 1.00 10.00 H new ATOM 135 P C A 5 2.143 -4.697 -8.606 1.00 10.00 P ATOM 136 OP1 C A 5 2.669 -4.800 -9.990 1.00 10.00 O ATOM 137 OP2 C A 5 2.136 -5.896 -7.737 1.00 10.00 O ATOM 138 O5' C A 5 2.924 -3.531 -7.856 1.00 10.00 O ATOM 139 C5' C A 5 3.710 -2.592 -8.579 1.00 10.00 C ATOM 140 C4' C A 5 3.909 -1.338 -7.762 1.00 10.00 C ATOM 141 O4' C A 5 2.838 -1.240 -6.792 1.00 10.00 O ATOM 142 C3' C A 5 5.161 -1.285 -6.904 1.00 10.00 C ATOM 143 O3' C A 5 6.279 -0.847 -7.669 1.00 10.00 O ATOM 144 C2' C A 5 4.771 -0.252 -5.855 1.00 10.00 C ATOM 145 O2' C A 5 4.833 1.057 -6.389 1.00 10.00 O ATOM 146 C1' C A 5 3.314 -0.644 -5.602 1.00 10.00 C ATOM 147 N1 C A 5 3.161 -1.569 -4.462 1.00 10.00 N ATOM 148 C2 C A 5 3.391 -1.071 -3.177 1.00 10.00 C ATOM 149 O2 C A 5 3.766 0.102 -3.046 1.00 10.00 O ATOM 150 N3 C A 5 3.219 -1.879 -2.106 1.00 10.00 N ATOM 151 C4 C A 5 2.824 -3.141 -2.277 1.00 10.00 C ATOM 152 N4 C A 5 2.661 -3.897 -1.188 1.00 10.00 N ATOM 153 C5 C A 5 2.583 -3.681 -3.575 1.00 10.00 C ATOM 154 C6 C A 5 2.768 -2.872 -4.630 1.00 10.00 C ATOM 0 H5' C A 5 3.221 -2.347 -9.521 1.00 10.00 H new ATOM 0 H5'' C A 5 4.677 -3.030 -8.827 1.00 10.00 H new ATOM 0 H4' C A 5 3.960 -0.550 -8.513 1.00 10.00 H new ATOM 0 H3' C A 5 5.459 -2.246 -6.486 1.00 10.00 H new ATOM 0 H2' C A 5 5.410 -0.243 -4.972 1.00 10.00 H new ATOM 0 HO2' C A 5 5.394 1.056 -7.192 1.00 10.00 H new ATOM 0 H1' C A 5 2.740 0.244 -5.339 1.00 10.00 H new ATOM 0 H41 C A 5 2.360 -4.867 -1.281 1.00 10.00 H new ATOM 0 H42 C A 5 2.838 -3.504 -0.263 1.00 10.00 H new ATOM 0 H5 C A 5 2.263 -4.704 -3.704 1.00 10.00 H new ATOM 0 H6 C A 5 2.605 -3.253 -5.627 1.00 10.00 H new ATOM 166 P U A 6 7.715 -1.540 -7.491 1.00 10.00 P ATOM 167 OP1 U A 6 8.652 -0.881 -8.436 1.00 10.00 O ATOM 168 OP2 U A 6 7.516 -3.004 -7.566 1.00 10.00 O ATOM 169 O5' U A 6 8.148 -1.167 -6.007 1.00 10.00 O ATOM 170 C5' U A 6 8.712 0.105 -5.708 1.00 10.00 C ATOM 171 C4' U A 6 9.003 0.226 -4.229 1.00 10.00 C ATOM 172 O4' U A 6 7.778 0.035 -3.468 1.00 10.00 O ATOM 173 C3' U A 6 9.937 -0.820 -3.639 1.00 10.00 C ATOM 174 O3' U A 6 11.303 -0.544 -3.935 1.00 10.00 O ATOM 175 C2' U A 6 9.626 -0.667 -2.156 1.00 10.00 C ATOM 176 O2' U A 6 10.186 0.520 -1.629 1.00 10.00 O ATOM 177 C1' U A 6 8.102 -0.536 -2.208 1.00 10.00 C ATOM 178 N1 U A 6 7.401 -1.822 -2.060 1.00 10.00 N ATOM 179 C2 U A 6 7.293 -2.354 -0.785 1.00 10.00 C ATOM 180 O2 U A 6 7.735 -1.802 0.207 1.00 10.00 O ATOM 181 N3 U A 6 6.649 -3.562 -0.710 1.00 10.00 N ATOM 182 C4 U A 6 6.110 -4.283 -1.750 1.00 10.00 C ATOM 183 O4 U A 6 5.560 -5.363 -1.520 1.00 10.00 O ATOM 184 C5 U A 6 6.257 -3.669 -3.032 1.00 10.00 C ATOM 185 C6 U A 6 6.881 -2.493 -3.147 1.00 10.00 C ATOM 0 H5' U A 6 8.025 0.894 -6.014 1.00 10.00 H new ATOM 0 H5'' U A 6 9.631 0.244 -6.277 1.00 10.00 H new ATOM 0 H4' U A 6 9.464 1.211 -4.155 1.00 10.00 H new ATOM 0 H3' U A 6 9.793 -1.828 -4.027 1.00 10.00 H new ATOM 0 H2' U A 6 10.013 -1.474 -1.534 1.00 10.00 H new ATOM 0 HO2' U A 6 10.554 0.341 -0.738 1.00 10.00 H new ATOM 0 H1' U A 6 7.778 0.083 -1.372 1.00 10.00 H new ATOM 0 H3 U A 6 6.560 -3.971 0.220 1.00 10.00 H new ATOM 0 H5 U A 6 5.862 -4.157 -3.911 1.00 10.00 H new ATOM 0 H6 U A 6 6.982 -2.052 -4.127 1.00 10.00 H new ATOM 196 P U A 7 12.419 -1.687 -3.749 1.00 10.00 P ATOM 197 OP1 U A 7 13.349 -1.622 -4.901 1.00 10.00 O ATOM 198 OP2 U A 7 11.715 -2.962 -3.468 1.00 10.00 O ATOM 199 O5' U A 7 13.209 -1.261 -2.435 1.00 10.00 O ATOM 200 C5' U A 7 14.450 -1.873 -2.089 1.00 10.00 C ATOM 201 C4' U A 7 15.161 -1.044 -1.044 1.00 10.00 C ATOM 202 O4' U A 7 15.323 0.298 -1.570 1.00 10.00 O ATOM 203 C3' U A 7 14.413 -0.893 0.282 1.00 10.00 C ATOM 204 O3' U A 7 15.281 -1.025 1.404 1.00 10.00 O ATOM 205 C2' U A 7 13.823 0.509 0.234 1.00 10.00 C ATOM 206 O2' U A 7 13.793 1.095 1.521 1.00 10.00 O ATOM 207 C1' U A 7 14.861 1.232 -0.619 1.00 10.00 C ATOM 208 N1 U A 7 14.330 2.405 -1.329 1.00 10.00 N ATOM 209 C2 U A 7 14.750 3.659 -0.920 1.00 10.00 C ATOM 210 O2 U A 7 15.547 3.835 -0.014 1.00 10.00 O ATOM 211 N3 U A 7 14.204 4.707 -1.620 1.00 10.00 N ATOM 212 C4 U A 7 13.301 4.635 -2.660 1.00 10.00 C ATOM 213 O4 U A 7 12.900 5.672 -3.188 1.00 10.00 O ATOM 214 C5 U A 7 12.917 3.306 -3.023 1.00 10.00 C ATOM 215 C6 U A 7 13.428 2.260 -2.363 1.00 10.00 C ATOM 0 H5' U A 7 15.076 -1.971 -2.976 1.00 10.00 H new ATOM 0 H5'' U A 7 14.275 -2.880 -1.709 1.00 10.00 H new ATOM 0 H4' U A 7 16.094 -1.568 -0.838 1.00 10.00 H new ATOM 0 H3' U A 7 13.657 -1.669 0.400 1.00 10.00 H new ATOM 0 H2' U A 7 12.800 0.541 -0.140 1.00 10.00 H new ATOM 0 HO2' U A 7 12.875 1.085 1.864 1.00 10.00 H new ATOM 0 H1' U A 7 15.646 1.604 0.039 1.00 10.00 H new ATOM 0 H3 U A 7 14.499 5.642 -1.340 1.00 10.00 H new ATOM 0 H5 U A 7 12.216 3.147 -3.829 1.00 10.00 H new ATOM 0 H6 U A 7 13.123 1.265 -2.651 1.00 10.00 H new ATOM 226 P C A 8 15.481 -2.456 2.104 1.00 10.00 P ATOM 227 OP1 C A 8 16.550 -2.326 3.121 1.00 10.00 O ATOM 228 OP2 C A 8 15.626 -3.456 1.024 1.00 10.00 O ATOM 229 O5' C A 8 14.104 -2.743 2.852 1.00 10.00 O ATOM 230 C5' C A 8 13.663 -1.947 3.950 1.00 10.00 C ATOM 231 C4' C A 8 12.438 -2.569 4.592 1.00 10.00 C ATOM 232 O4' C A 8 11.351 -2.580 3.626 1.00 10.00 O ATOM 233 C3' C A 8 12.577 -4.021 5.046 1.00 10.00 C ATOM 234 O3' C A 8 11.790 -4.278 6.209 1.00 10.00 O ATOM 235 C2' C A 8 12.048 -4.814 3.855 1.00 10.00 C ATOM 236 O2' C A 8 11.523 -6.070 4.246 1.00 10.00 O ATOM 237 C1' C A 8 10.916 -3.906 3.382 1.00 10.00 C ATOM 238 N1 C A 8 10.649 -4.038 1.941 1.00 10.00 N ATOM 239 C2 C A 8 9.592 -4.826 1.475 1.00 10.00 C ATOM 240 O2 C A 8 8.846 -5.391 2.289 1.00 10.00 O ATOM 241 N3 C A 8 9.406 -4.947 0.138 1.00 10.00 N ATOM 242 C4 C A 8 10.230 -4.318 -0.708 1.00 10.00 C ATOM 243 N4 C A 8 10.025 -4.437 -2.016 1.00 10.00 N ATOM 244 C5 C A 8 11.307 -3.519 -0.255 1.00 10.00 C ATOM 245 C6 C A 8 11.476 -3.404 1.060 1.00 10.00 C ATOM 0 H5' C A 8 13.430 -0.939 3.607 1.00 10.00 H new ATOM 0 H5'' C A 8 14.462 -1.856 4.686 1.00 10.00 H new ATOM 0 H4' C A 8 12.269 -1.956 5.477 1.00 10.00 H new ATOM 0 H3' C A 8 13.600 -4.280 5.318 1.00 10.00 H new ATOM 0 H2' C A 8 12.811 -5.041 3.111 1.00 10.00 H new ATOM 0 HO2' C A 8 11.298 -6.048 5.200 1.00 10.00 H new ATOM 0 H1' C A 8 9.999 -4.172 3.908 1.00 10.00 H new ATOM 0 H41 C A 8 10.644 -3.964 -2.674 1.00 10.00 H new ATOM 0 H42 C A 8 9.249 -5.001 -2.361 1.00 10.00 H new ATOM 0 H5 C A 8 11.967 -3.021 -0.950 1.00 10.00 H new ATOM 0 H6 C A 8 12.285 -2.796 1.438 1.00 10.00 H new ATOM 257 P G A 9 12.435 -4.288 7.681 1.00 10.00 P ATOM 258 OP1 G A 9 13.898 -4.083 7.577 1.00 10.00 O ATOM 259 OP2 G A 9 11.910 -5.487 8.370 1.00 10.00 O ATOM 260 O5' G A 9 11.822 -3.012 8.410 1.00 10.00 O ATOM 261 C5' G A 9 10.498 -2.543 8.157 1.00 10.00 C ATOM 262 C4' G A 9 10.478 -1.038 8.263 1.00 10.00 C ATOM 263 O4' G A 9 11.402 -0.488 7.296 1.00 10.00 O ATOM 264 C3' G A 9 9.161 -0.354 7.927 1.00 10.00 C ATOM 265 O3' G A 9 8.261 -0.374 9.029 1.00 10.00 O ATOM 266 C2' G A 9 9.610 1.064 7.594 1.00 10.00 C ATOM 267 O2' G A 9 9.777 1.850 8.760 1.00 10.00 O ATOM 268 C1' G A 9 10.980 0.817 6.962 1.00 10.00 C ATOM 269 N9 G A 9 11.006 0.957 5.510 1.00 10.00 N ATOM 270 C8 G A 9 11.822 1.818 4.828 1.00 10.00 C ATOM 271 N7 G A 9 11.682 1.753 3.534 1.00 10.00 N ATOM 272 C5 G A 9 10.702 0.786 3.347 1.00 10.00 C ATOM 273 C6 G A 9 10.130 0.286 2.150 1.00 10.00 C ATOM 274 O6 G A 9 10.380 0.608 0.983 1.00 10.00 O ATOM 275 N1 G A 9 9.169 -0.689 2.392 1.00 10.00 N ATOM 276 C2 G A 9 8.804 -1.124 3.646 1.00 10.00 C ATOM 277 N2 G A 9 7.857 -2.070 3.695 1.00 10.00 N ATOM 278 N3 G A 9 9.330 -0.667 4.775 1.00 10.00 N ATOM 279 C4 G A 9 10.269 0.281 4.556 1.00 10.00 C ATOM 0 H5' G A 9 9.801 -2.980 8.873 1.00 10.00 H new ATOM 0 H5'' G A 9 10.172 -2.854 7.165 1.00 10.00 H new ATOM 0 H4' G A 9 10.711 -0.855 9.312 1.00 10.00 H new ATOM 0 H3' G A 9 8.613 -0.839 7.120 1.00 10.00 H new ATOM 0 H2' G A 9 8.894 1.598 6.969 1.00 10.00 H new ATOM 0 HO2' G A 9 9.240 1.473 9.488 1.00 10.00 H new ATOM 0 H1' G A 9 11.646 1.583 7.359 1.00 10.00 H new ATOM 0 H8 G A 9 12.516 2.487 5.315 1.00 10.00 H new ATOM 0 H1 G A 9 8.704 -1.110 1.588 1.00 10.00 H new ATOM 0 H21 G A 9 7.544 -2.433 4.596 1.00 10.00 H new ATOM 0 H22 G A 9 7.448 -2.428 2.832 1.00 10.00 H new ATOM 291 P G A 10 6.684 -0.511 8.757 1.00 10.00 P ATOM 292 OP1 G A 10 5.965 -0.002 9.948 1.00 10.00 O ATOM 293 OP2 G A 10 6.432 -1.896 8.296 1.00 10.00 O ATOM 294 O5' G A 10 6.395 0.472 7.539 1.00 10.00 O ATOM 295 C5' G A 10 6.251 1.870 7.748 1.00 10.00 C ATOM 296 C4' G A 10 6.372 2.662 6.465 1.00 10.00 C ATOM 297 O4' G A 10 6.996 1.835 5.446 1.00 10.00 O ATOM 298 C3' G A 10 5.072 3.115 5.813 1.00 10.00 C ATOM 299 O3' G A 10 4.641 4.336 6.399 1.00 10.00 O ATOM 300 C2' G A 10 5.511 3.309 4.367 1.00 10.00 C ATOM 301 O2' G A 10 6.316 4.463 4.223 1.00 10.00 O ATOM 302 C1' G A 10 6.367 2.058 4.195 1.00 10.00 C ATOM 303 N9 G A 10 5.580 0.877 3.862 1.00 10.00 N ATOM 304 C8 G A 10 5.138 -0.074 4.741 1.00 10.00 C ATOM 305 N7 G A 10 4.503 -1.058 4.163 1.00 10.00 N ATOM 306 C5 G A 10 4.516 -0.724 2.812 1.00 10.00 C ATOM 307 C6 G A 10 3.978 -1.407 1.682 1.00 10.00 C ATOM 308 O6 G A 10 3.394 -2.501 1.643 1.00 10.00 O ATOM 309 N1 G A 10 4.212 -0.712 0.497 1.00 10.00 N ATOM 310 C2 G A 10 4.883 0.488 0.417 1.00 10.00 C ATOM 311 N2 G A 10 5.010 1.022 -0.809 1.00 10.00 N ATOM 312 N3 G A 10 5.390 1.131 1.456 1.00 10.00 N ATOM 313 C4 G A 10 5.172 0.475 2.614 1.00 10.00 C ATOM 0 H5' G A 10 7.010 2.209 8.453 1.00 10.00 H new ATOM 0 H5'' G A 10 5.281 2.068 8.204 1.00 10.00 H new ATOM 0 H4' G A 10 6.931 3.544 6.777 1.00 10.00 H new ATOM 0 H3' G A 10 4.234 2.426 5.922 1.00 10.00 H new ATOM 0 H2' G A 10 4.695 3.436 3.655 1.00 10.00 H new ATOM 0 HO2' G A 10 6.201 5.042 5.006 1.00 10.00 H new ATOM 0 H1' G A 10 7.069 2.215 3.376 1.00 10.00 H new ATOM 0 H8 G A 10 5.298 -0.017 5.807 1.00 10.00 H new ATOM 0 H1 G A 10 3.863 -1.120 -0.370 1.00 10.00 H new ATOM 0 H21 G A 10 5.497 1.910 -0.931 1.00 10.00 H new ATOM 0 H22 G A 10 4.619 0.540 -1.618 1.00 10.00 H new ATOM 325 P U A 11 3.242 5.003 5.984 1.00 10.00 P ATOM 326 OP1 U A 11 3.165 6.334 6.632 1.00 10.00 O ATOM 327 OP2 U A 11 2.172 4.008 6.237 1.00 10.00 O ATOM 328 O5' U A 11 3.352 5.212 4.412 1.00 10.00 O ATOM 329 C5' U A 11 3.476 6.506 3.833 1.00 10.00 C ATOM 330 C4' U A 11 3.047 6.458 2.384 1.00 10.00 C ATOM 331 O4' U A 11 3.369 5.158 1.825 1.00 10.00 O ATOM 332 C3' U A 11 1.551 6.613 2.146 1.00 10.00 C ATOM 333 O3' U A 11 1.209 7.992 2.042 1.00 10.00 O ATOM 334 C2' U A 11 1.331 5.889 0.823 1.00 10.00 C ATOM 335 O2' U A 11 1.588 6.754 -0.268 1.00 10.00 O ATOM 336 C1' U A 11 2.392 4.787 0.868 1.00 10.00 C ATOM 337 N1 U A 11 1.859 3.457 1.212 1.00 10.00 N ATOM 338 C2 U A 11 1.352 2.686 0.179 1.00 10.00 C ATOM 339 O2 U A 11 1.288 3.079 -0.973 1.00 10.00 O ATOM 340 N3 U A 11 0.908 1.438 0.545 1.00 10.00 N ATOM 341 C4 U A 11 0.924 0.888 1.807 1.00 10.00 C ATOM 342 O4 U A 11 0.497 -0.256 1.979 1.00 10.00 O ATOM 343 C5 U A 11 1.456 1.742 2.819 1.00 10.00 C ATOM 344 C6 U A 11 1.892 2.965 2.502 1.00 10.00 C ATOM 0 H5' U A 11 4.508 6.850 3.906 1.00 10.00 H new ATOM 0 H5'' U A 11 2.862 7.221 4.381 1.00 10.00 H new ATOM 0 H4' U A 11 3.571 7.296 1.925 1.00 10.00 H new ATOM 0 H3' U A 11 0.937 6.211 2.952 1.00 10.00 H new ATOM 0 H2' U A 11 0.312 5.523 0.696 1.00 10.00 H new ATOM 0 HO2' U A 11 1.499 7.685 0.025 1.00 10.00 H new ATOM 0 H1' U A 11 2.809 4.697 -0.135 1.00 10.00 H new ATOM 0 H3 U A 11 0.525 0.856 -0.200 1.00 10.00 H new ATOM 0 H5 U A 11 1.506 1.400 3.842 1.00 10.00 H new ATOM 0 H6 U A 11 2.286 3.594 3.286 1.00 10.00 H new ATOM 355 P G A 12 -0.311 8.468 2.220 1.00 10.00 P ATOM 356 OP1 G A 12 -0.329 9.950 2.164 1.00 10.00 O ATOM 357 OP2 G A 12 -0.868 7.767 3.401 1.00 10.00 O ATOM 358 O5' G A 12 -1.033 7.911 0.917 1.00 10.00 O ATOM 359 C5' G A 12 -1.405 8.793 -0.136 1.00 10.00 C ATOM 360 C4' G A 12 -1.965 8.013 -1.303 1.00 10.00 C ATOM 361 O4' G A 12 -1.404 6.672 -1.315 1.00 10.00 O ATOM 362 C3' G A 12 -3.467 7.787 -1.273 1.00 10.00 C ATOM 363 O3' G A 12 -4.167 8.903 -1.803 1.00 10.00 O ATOM 364 C2' G A 12 -3.619 6.565 -2.167 1.00 10.00 C ATOM 365 O2' G A 12 -3.548 6.910 -3.535 1.00 10.00 O ATOM 366 C1' G A 12 -2.381 5.758 -1.779 1.00 10.00 C ATOM 367 N9 G A 12 -2.647 4.767 -0.741 1.00 10.00 N ATOM 368 C8 G A 12 -2.477 4.899 0.618 1.00 10.00 C ATOM 369 N7 G A 12 -2.807 3.826 1.285 1.00 10.00 N ATOM 370 C5 G A 12 -3.226 2.933 0.309 1.00 10.00 C ATOM 371 C6 G A 12 -3.704 1.604 0.427 1.00 10.00 C ATOM 372 O6 G A 12 -3.876 0.936 1.458 1.00 10.00 O ATOM 373 N1 G A 12 -4.016 1.050 -0.811 1.00 10.00 N ATOM 374 C2 G A 12 -3.890 1.708 -2.011 1.00 10.00 C ATOM 375 N2 G A 12 -4.254 1.018 -3.102 1.00 10.00 N ATOM 376 N3 G A 12 -3.451 2.951 -2.138 1.00 10.00 N ATOM 377 C4 G A 12 -3.136 3.500 -0.944 1.00 10.00 C ATOM 0 H5' G A 12 -0.539 9.370 -0.458 1.00 10.00 H new ATOM 0 H5'' G A 12 -2.147 9.506 0.223 1.00 10.00 H new ATOM 0 H4' G A 12 -1.709 8.625 -2.168 1.00 10.00 H new ATOM 0 H3' G A 12 -3.872 7.652 -0.270 1.00 10.00 H new ATOM 0 H2' G A 12 -4.571 6.050 -2.041 1.00 10.00 H new ATOM 0 HO2' G A 12 -3.792 7.852 -3.648 1.00 10.00 H new ATOM 0 H1' G A 12 -2.043 5.205 -2.656 1.00 10.00 H new ATOM 0 H8 G A 12 -2.108 5.800 1.086 1.00 10.00 H new ATOM 0 H1 G A 12 -4.362 0.091 -0.829 1.00 10.00 H new ATOM 0 H21 G A 12 -4.185 1.448 -4.024 1.00 10.00 H new ATOM 0 H22 G A 12 -4.600 0.063 -3.009 1.00 10.00 H new ATOM 389 P C A 13 -5.666 9.215 -1.324 1.00 10.00 P ATOM 390 OP1 C A 13 -6.088 10.477 -1.972 1.00 10.00 O ATOM 391 OP2 C A 13 -5.704 9.112 0.154 1.00 10.00 O ATOM 392 O5' C A 13 -6.534 8.026 -1.927 1.00 10.00 O ATOM 393 C5' C A 13 -6.834 7.974 -3.320 1.00 10.00 C ATOM 394 C4' C A 13 -7.336 6.598 -3.701 1.00 10.00 C ATOM 395 O4' C A 13 -6.567 5.588 -3.003 1.00 10.00 O ATOM 396 C3' C A 13 -8.772 6.289 -3.311 1.00 10.00 C ATOM 397 O3' C A 13 -9.676 6.806 -4.282 1.00 10.00 O ATOM 398 C2' C A 13 -8.793 4.765 -3.267 1.00 10.00 C ATOM 399 O2' C A 13 -9.047 4.205 -4.542 1.00 10.00 O ATOM 400 C1' C A 13 -7.361 4.428 -2.837 1.00 10.00 C ATOM 401 N1 C A 13 -7.249 3.979 -1.439 1.00 10.00 N ATOM 402 C2 C A 13 -7.494 2.631 -1.144 1.00 10.00 C ATOM 403 O2 C A 13 -7.835 1.867 -2.057 1.00 10.00 O ATOM 404 N3 C A 13 -7.352 2.192 0.129 1.00 10.00 N ATOM 405 C4 C A 13 -6.982 3.038 1.093 1.00 10.00 C ATOM 406 N4 C A 13 -6.856 2.558 2.332 1.00 10.00 N ATOM 407 C5 C A 13 -6.727 4.416 0.824 1.00 10.00 C ATOM 408 C6 C A 13 -6.878 4.838 -0.440 1.00 10.00 C ATOM 0 H5' C A 13 -5.943 8.216 -3.900 1.00 10.00 H new ATOM 0 H5'' C A 13 -7.587 8.723 -3.564 1.00 10.00 H new ATOM 0 H4' C A 13 -7.246 6.588 -4.787 1.00 10.00 H new ATOM 0 H3' C A 13 -9.079 6.738 -2.367 1.00 10.00 H new ATOM 0 H2' C A 13 -9.571 4.376 -2.610 1.00 10.00 H new ATOM 0 HO2' C A 13 -9.951 3.827 -4.559 1.00 10.00 H new ATOM 0 H1' C A 13 -7.025 3.599 -3.460 1.00 10.00 H new ATOM 0 H41 C A 13 -6.575 3.177 3.093 1.00 10.00 H new ATOM 0 H42 C A 13 -7.041 1.572 2.518 1.00 10.00 H new ATOM 0 H5 C A 13 -6.424 5.093 1.609 1.00 10.00 H new ATOM 0 H6 C A 13 -6.703 5.878 -0.675 1.00 10.00 H new ATOM 420 P C A 14 -11.132 7.330 -3.857 1.00 10.00 P ATOM 421 OP1 C A 14 -11.668 8.133 -4.979 1.00 10.00 O ATOM 422 OP2 C A 14 -11.024 7.951 -2.514 1.00 10.00 O ATOM 423 O5' C A 14 -12.002 6.004 -3.727 1.00 10.00 O ATOM 424 C5' C A 14 -12.456 5.308 -4.885 1.00 10.00 C ATOM 425 C4' C A 14 -12.754 3.864 -4.545 1.00 10.00 C ATOM 426 O4' C A 14 -11.726 3.364 -3.653 1.00 10.00 O ATOM 427 C3' C A 14 -14.060 3.626 -3.802 1.00 10.00 C ATOM 428 O3' C A 14 -15.128 3.376 -4.719 1.00 10.00 O ATOM 429 C2' C A 14 -13.793 2.380 -2.963 1.00 10.00 C ATOM 430 O2' C A 14 -14.223 1.232 -3.662 1.00 10.00 O ATOM 431 C1' C A 14 -12.266 2.354 -2.821 1.00 10.00 C ATOM 432 N1 C A 14 -11.803 2.587 -1.443 1.00 10.00 N ATOM 433 C2 C A 14 -11.511 1.488 -0.622 1.00 10.00 C ATOM 434 O2 C A 14 -11.699 0.341 -1.054 1.00 10.00 O ATOM 435 N3 C A 14 -11.052 1.703 0.634 1.00 10.00 N ATOM 436 C4 C A 14 -10.882 2.951 1.077 1.00 10.00 C ATOM 437 N4 C A 14 -10.421 3.121 2.319 1.00 10.00 N ATOM 438 C5 C A 14 -11.175 4.083 0.266 1.00 10.00 C ATOM 439 C6 C A 14 -11.631 3.858 -0.971 1.00 10.00 C ATOM 0 H5' C A 14 -11.698 5.356 -5.667 1.00 10.00 H new ATOM 0 H5'' C A 14 -13.352 5.788 -5.279 1.00 10.00 H new ATOM 0 H4' C A 14 -12.806 3.365 -5.513 1.00 10.00 H new ATOM 0 H3' C A 14 -14.356 4.488 -3.204 1.00 10.00 H new ATOM 0 H2' C A 14 -14.312 2.394 -2.005 1.00 10.00 H new ATOM 0 HO2' C A 14 -14.735 1.503 -4.453 1.00 10.00 H new ATOM 0 HO3' C A 14 -15.958 3.224 -4.221 1.00 10.00 H new ATOM 0 H1' C A 14 -11.930 1.357 -3.108 1.00 10.00 H new ATOM 0 H41 C A 14 -10.280 4.062 2.686 1.00 10.00 H new ATOM 0 H42 C A 14 -10.210 2.310 2.900 1.00 10.00 H new ATOM 0 H5 C A 14 -11.034 5.088 0.636 1.00 10.00 H new ATOM 0 H6 C A 14 -11.868 4.697 -1.609 1.00 10.00 H new TER 452 C A 14