USER MOD reduce.3.24.130724 H: found=0, std=0, add=153, rem=0, adj=16 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 -129:sc= 0.815 USER MOD Single : A 1 G O5' : rot 180:sc= -0.19 USER MOD Single : A 2 G O2' : rot -8:sc= -1.52! USER MOD Single : A 3 C O2' : rot -11:sc= 0.321 USER MOD Single : A 4 C O2' : rot -33:sc= 0.289 USER MOD Single : A 5 U O2' : rot -24:sc= 0.424 USER MOD Single : A 6 G O2' : rot -135:sc= -6.42! USER MOD Single : A 7 A O2' : rot 146:sc= -6.71! USER MOD Single : A 8 U O2' : rot 140:sc= 0.737 USER MOD Single : A 9 A O2' : rot -79:sc= 0.651 USER MOD Single : A 10 G O2' : rot -73:sc= 0.797 USER MOD Single : A 11 G O2' : rot -22:sc= 0.364 USER MOD Single : A 12 G O2' : rot -5:sc= -1.94! USER MOD Single : A 13 U O2' : rot -114:sc= 0.661 USER MOD Single : A 14 C O2' : rot -21:sc= 0.206 USER MOD Single : A 14 C O3' : rot 180:sc= 0.23 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -4.565 -5.889 10.842 1.00 0.00 O ATOM 2 C5' G A 1 -3.845 -5.902 12.078 1.00 0.00 C ATOM 3 C4' G A 1 -2.337 -5.899 11.849 1.00 0.00 C ATOM 4 O4' G A 1 -1.972 -7.062 11.095 1.00 0.00 O ATOM 5 C3' G A 1 -1.820 -4.738 11.019 1.00 0.00 C ATOM 6 O3' G A 1 -1.417 -3.712 11.933 1.00 0.00 O ATOM 7 C2' G A 1 -0.559 -5.301 10.382 1.00 0.00 C ATOM 8 O2' G A 1 0.541 -5.240 11.295 1.00 0.00 O ATOM 9 C1' G A 1 -0.959 -6.753 10.125 1.00 0.00 C ATOM 10 N9 G A 1 -1.522 -6.948 8.772 1.00 0.00 N ATOM 11 C8 G A 1 -2.743 -6.550 8.288 1.00 0.00 C ATOM 12 N7 G A 1 -2.946 -6.879 7.044 1.00 0.00 N ATOM 13 C5 G A 1 -1.781 -7.542 6.676 1.00 0.00 C ATOM 14 C6 G A 1 -1.421 -8.130 5.434 1.00 0.00 C ATOM 15 O6 G A 1 -2.078 -8.178 4.395 1.00 0.00 O ATOM 16 N1 G A 1 -0.160 -8.696 5.482 1.00 0.00 N ATOM 17 C2 G A 1 0.663 -8.700 6.587 1.00 0.00 C ATOM 18 N2 G A 1 1.851 -9.289 6.456 1.00 0.00 N ATOM 19 N3 G A 1 0.335 -8.149 7.760 1.00 0.00 N ATOM 20 C4 G A 1 -0.899 -7.590 7.729 1.00 0.00 C ATOM 0 H5' G A 1 -4.125 -6.785 12.653 1.00 0.00 H new ATOM 0 H5'' G A 1 -4.125 -5.032 12.672 1.00 0.00 H new ATOM 0 H4' G A 1 -1.910 -5.846 12.850 1.00 0.00 H new ATOM 0 H3' G A 1 -2.541 -4.346 10.302 1.00 0.00 H new ATOM 0 H2' G A 1 -0.236 -4.762 9.491 1.00 0.00 H new ATOM 0 HO2' G A 1 1.305 -4.808 10.859 1.00 0.00 H new ATOM 0 HO5' G A 1 -5.528 -5.893 11.024 1.00 0.00 H new ATOM 0 H1' G A 1 -0.082 -7.395 10.201 1.00 0.00 H new ATOM 0 H8 G A 1 -3.468 -6.014 8.883 1.00 0.00 H new ATOM 0 H1 G A 1 0.187 -9.145 4.634 1.00 0.00 H new ATOM 0 H21 G A 1 2.496 -9.318 7.246 1.00 0.00 H new ATOM 0 H22 G A 1 2.116 -9.711 5.566 1.00 0.00 H new ATOM 33 P G A 2 -1.134 -2.212 11.416 1.00 0.00 P ATOM 34 OP1 G A 2 -1.355 -1.284 12.546 1.00 0.00 O ATOM 35 OP2 G A 2 -1.868 -2.012 10.144 1.00 0.00 O ATOM 36 O5' G A 2 0.445 -2.245 11.092 1.00 0.00 O ATOM 37 C5' G A 2 0.938 -1.922 9.787 1.00 0.00 C ATOM 38 C4' G A 2 2.243 -2.652 9.488 1.00 0.00 C ATOM 39 O4' G A 2 1.965 -4.038 9.254 1.00 0.00 O ATOM 40 C3' G A 2 2.955 -2.201 8.225 1.00 0.00 C ATOM 41 O3' G A 2 3.888 -1.184 8.605 1.00 0.00 O ATOM 42 C2' G A 2 3.759 -3.431 7.834 1.00 0.00 C ATOM 43 O2' G A 2 4.958 -3.522 8.606 1.00 0.00 O ATOM 44 C1' G A 2 2.796 -4.558 8.203 1.00 0.00 C ATOM 45 N9 G A 2 1.939 -4.951 7.067 1.00 0.00 N ATOM 46 C8 G A 2 0.617 -4.660 6.845 1.00 0.00 C ATOM 47 N7 G A 2 0.150 -5.155 5.734 1.00 0.00 N ATOM 48 C5 G A 2 1.237 -5.819 5.179 1.00 0.00 C ATOM 49 C6 G A 2 1.334 -6.551 3.966 1.00 0.00 C ATOM 50 O6 G A 2 0.458 -6.755 3.129 1.00 0.00 O ATOM 51 N1 G A 2 2.607 -7.062 3.777 1.00 0.00 N ATOM 52 C2 G A 2 3.662 -6.896 4.645 1.00 0.00 C ATOM 53 N2 G A 2 4.822 -7.454 4.302 1.00 0.00 N ATOM 54 N3 G A 2 3.582 -6.210 5.787 1.00 0.00 N ATOM 55 C4 G A 2 2.340 -5.702 5.988 1.00 0.00 C ATOM 0 H5' G A 2 1.096 -0.846 9.712 1.00 0.00 H new ATOM 0 H5'' G A 2 0.191 -2.187 9.039 1.00 0.00 H new ATOM 0 H4' G A 2 2.872 -2.444 10.354 1.00 0.00 H new ATOM 0 H3' G A 2 2.292 -1.833 7.442 1.00 0.00 H new ATOM 0 H2' G A 2 4.080 -3.438 6.792 1.00 0.00 H new ATOM 0 HO2' G A 2 5.073 -2.702 9.130 1.00 0.00 H new ATOM 0 H1' G A 2 3.358 -5.444 8.500 1.00 0.00 H new ATOM 0 H8 G A 2 0.019 -4.075 7.528 1.00 0.00 H new ATOM 0 H1 G A 2 2.776 -7.603 2.929 1.00 0.00 H new ATOM 0 H21 G A 2 5.634 -7.359 4.912 1.00 0.00 H new ATOM 0 H22 G A 2 4.898 -7.976 3.429 1.00 0.00 H new ATOM 67 P C A 3 4.386 -0.086 7.537 1.00 0.00 P ATOM 68 OP1 C A 3 5.389 0.780 8.196 1.00 0.00 O ATOM 69 OP2 C A 3 3.192 0.519 6.904 1.00 0.00 O ATOM 70 O5' C A 3 5.140 -0.984 6.432 1.00 0.00 O ATOM 71 C5' C A 3 6.399 -1.599 6.725 1.00 0.00 C ATOM 72 C4' C A 3 6.922 -2.397 5.535 1.00 0.00 C ATOM 73 O4' C A 3 6.090 -3.545 5.334 1.00 0.00 O ATOM 74 C3' C A 3 6.876 -1.664 4.206 1.00 0.00 C ATOM 75 O3' C A 3 8.151 -1.040 4.026 1.00 0.00 O ATOM 76 C2' C A 3 6.773 -2.792 3.190 1.00 0.00 C ATOM 77 O2' C A 3 8.063 -3.346 2.915 1.00 0.00 O ATOM 78 C1' C A 3 5.902 -3.806 3.931 1.00 0.00 C ATOM 79 N1 C A 3 4.464 -3.663 3.604 1.00 0.00 N ATOM 80 C2 C A 3 3.942 -4.486 2.614 1.00 0.00 C ATOM 81 O2 C A 3 4.664 -5.296 2.036 1.00 0.00 O ATOM 82 N3 C A 3 2.621 -4.377 2.305 1.00 0.00 N ATOM 83 C4 C A 3 1.841 -3.494 2.939 1.00 0.00 C ATOM 84 N4 C A 3 0.554 -3.438 2.593 1.00 0.00 N ATOM 85 C5 C A 3 2.370 -2.641 3.957 1.00 0.00 C ATOM 86 C6 C A 3 3.677 -2.757 4.256 1.00 0.00 C ATOM 0 H5' C A 3 6.292 -2.257 7.587 1.00 0.00 H new ATOM 0 H5'' C A 3 7.125 -0.833 6.998 1.00 0.00 H new ATOM 0 H4' C A 3 7.958 -2.619 5.791 1.00 0.00 H new ATOM 0 H3' C A 3 6.077 -0.927 4.130 1.00 0.00 H new ATOM 0 H2' C A 3 6.372 -2.481 2.225 1.00 0.00 H new ATOM 0 HO2' C A 3 8.756 -2.767 3.296 1.00 0.00 H new ATOM 0 H1' C A 3 6.192 -4.816 3.642 1.00 0.00 H new ATOM 0 H41 C A 3 -0.070 -2.777 3.055 1.00 0.00 H new ATOM 0 H42 C A 3 0.194 -4.056 1.866 1.00 0.00 H new ATOM 0 H5 C A 3 1.742 -1.927 4.469 1.00 0.00 H new ATOM 0 H6 C A 3 4.108 -2.127 5.020 1.00 0.00 H new ATOM 98 P C A 4 8.265 0.415 3.347 1.00 0.00 P ATOM 99 OP1 C A 4 9.655 0.897 3.512 1.00 0.00 O ATOM 100 OP2 C A 4 7.137 1.243 3.830 1.00 0.00 O ATOM 101 O5' C A 4 8.023 0.095 1.788 1.00 0.00 O ATOM 102 C5' C A 4 8.988 -0.650 1.036 1.00 0.00 C ATOM 103 C4' C A 4 8.533 -0.863 -0.405 1.00 0.00 C ATOM 104 O4' C A 4 7.580 -1.933 -0.448 1.00 0.00 O ATOM 105 C3' C A 4 7.788 0.310 -1.019 1.00 0.00 C ATOM 106 O3' C A 4 8.754 1.137 -1.674 1.00 0.00 O ATOM 107 C2' C A 4 6.954 -0.360 -2.099 1.00 0.00 C ATOM 108 O2' C A 4 7.751 -0.662 -3.247 1.00 0.00 O ATOM 109 C1' C A 4 6.527 -1.640 -1.386 1.00 0.00 C ATOM 110 N1 C A 4 5.269 -1.447 -0.635 1.00 0.00 N ATOM 111 C2 C A 4 4.084 -1.839 -1.237 1.00 0.00 C ATOM 112 O2 C A 4 4.092 -2.356 -2.354 1.00 0.00 O ATOM 113 N3 C A 4 2.915 -1.638 -0.566 1.00 0.00 N ATOM 114 C4 C A 4 2.915 -1.071 0.647 1.00 0.00 C ATOM 115 N4 C A 4 1.741 -0.896 1.252 1.00 0.00 N ATOM 116 C5 C A 4 4.136 -0.664 1.270 1.00 0.00 C ATOM 117 C6 C A 4 5.278 -0.870 0.600 1.00 0.00 C ATOM 0 H5' C A 4 9.154 -1.616 1.512 1.00 0.00 H new ATOM 0 H5'' C A 4 9.942 -0.123 1.043 1.00 0.00 H new ATOM 0 H4' C A 4 9.457 -1.041 -0.955 1.00 0.00 H new ATOM 0 H3' C A 4 7.213 0.902 -0.307 1.00 0.00 H new ATOM 0 H2' C A 4 6.130 0.248 -2.473 1.00 0.00 H new ATOM 0 HO2' C A 4 8.439 0.027 -3.358 1.00 0.00 H new ATOM 0 H1' C A 4 6.360 -2.439 -2.108 1.00 0.00 H new ATOM 0 H41 C A 4 1.703 -0.467 2.177 1.00 0.00 H new ATOM 0 H42 C A 4 0.881 -1.191 0.790 1.00 0.00 H new ATOM 0 H5 C A 4 4.138 -0.206 2.248 1.00 0.00 H new ATOM 0 H6 C A 4 6.217 -0.575 1.044 1.00 0.00 H new ATOM 129 P U A 5 8.406 2.665 -2.044 1.00 0.00 P ATOM 130 OP1 U A 5 9.476 3.183 -2.928 1.00 0.00 O ATOM 131 OP2 U A 5 8.075 3.382 -0.793 1.00 0.00 O ATOM 132 O5' U A 5 7.056 2.519 -2.912 1.00 0.00 O ATOM 133 C5' U A 5 7.106 2.448 -4.342 1.00 0.00 C ATOM 134 C4' U A 5 5.758 2.763 -4.965 1.00 0.00 C ATOM 135 O4' U A 5 4.792 1.843 -4.469 1.00 0.00 O ATOM 136 C3' U A 5 5.202 4.129 -4.607 1.00 0.00 C ATOM 137 O3' U A 5 5.604 5.030 -5.645 1.00 0.00 O ATOM 138 C2' U A 5 3.699 3.936 -4.727 1.00 0.00 C ATOM 139 O2' U A 5 3.274 4.099 -6.084 1.00 0.00 O ATOM 140 C1' U A 5 3.522 2.483 -4.283 1.00 0.00 C ATOM 141 N1 U A 5 3.134 2.367 -2.859 1.00 0.00 N ATOM 142 C2 U A 5 1.785 2.428 -2.553 1.00 0.00 C ATOM 143 O2 U A 5 0.915 2.585 -3.409 1.00 0.00 O ATOM 144 N3 U A 5 1.464 2.302 -1.215 1.00 0.00 N ATOM 145 C4 U A 5 2.358 2.125 -0.177 1.00 0.00 C ATOM 146 O4 U A 5 1.947 2.017 0.976 1.00 0.00 O ATOM 147 C5 U A 5 3.745 2.074 -0.576 1.00 0.00 C ATOM 148 C6 U A 5 4.081 2.195 -1.883 1.00 0.00 C ATOM 0 H5' U A 5 7.424 1.451 -4.646 1.00 0.00 H new ATOM 0 H5'' U A 5 7.853 3.149 -4.716 1.00 0.00 H new ATOM 0 H4' U A 5 5.928 2.713 -6.041 1.00 0.00 H new ATOM 0 H3' U A 5 5.522 4.501 -3.634 1.00 0.00 H new ATOM 0 H2' U A 5 3.118 4.651 -4.144 1.00 0.00 H new ATOM 0 HO2' U A 5 3.919 4.659 -6.564 1.00 0.00 H new ATOM 0 H1' U A 5 2.725 2.024 -4.868 1.00 0.00 H new ATOM 0 H3 U A 5 0.474 2.344 -0.971 1.00 0.00 H new ATOM 0 H5 U A 5 4.516 1.939 0.169 1.00 0.00 H new ATOM 0 H6 U A 5 5.123 2.155 -2.163 1.00 0.00 H new ATOM 159 P G A 6 6.161 6.499 -5.290 1.00 0.00 P ATOM 160 OP1 G A 6 6.606 7.143 -6.547 1.00 0.00 O ATOM 161 OP2 G A 6 7.096 6.379 -4.151 1.00 0.00 O ATOM 162 O5' G A 6 4.836 7.259 -4.776 1.00 0.00 O ATOM 163 C5' G A 6 3.768 7.558 -5.682 1.00 0.00 C ATOM 164 C4' G A 6 2.416 7.541 -4.976 1.00 0.00 C ATOM 165 O4' G A 6 2.378 6.447 -4.071 1.00 0.00 O ATOM 166 C3' G A 6 2.139 8.746 -4.088 1.00 0.00 C ATOM 167 O3' G A 6 1.350 9.663 -4.856 1.00 0.00 O ATOM 168 C2' G A 6 1.248 8.199 -2.963 1.00 0.00 C ATOM 169 O2' G A 6 -0.107 8.573 -3.152 1.00 0.00 O ATOM 170 C1' G A 6 1.371 6.681 -3.089 1.00 0.00 C ATOM 171 N9 G A 6 1.777 6.063 -1.814 1.00 0.00 N ATOM 172 C8 G A 6 3.032 5.706 -1.393 1.00 0.00 C ATOM 173 N7 G A 6 3.061 5.221 -0.182 1.00 0.00 N ATOM 174 C5 G A 6 1.733 5.259 0.227 1.00 0.00 C ATOM 175 C6 G A 6 1.145 4.858 1.458 1.00 0.00 C ATOM 176 O6 G A 6 1.699 4.389 2.450 1.00 0.00 O ATOM 177 N1 G A 6 -0.225 5.062 1.461 1.00 0.00 N ATOM 178 C2 G A 6 -0.949 5.585 0.412 1.00 0.00 C ATOM 179 N2 G A 6 -2.264 5.714 0.587 1.00 0.00 N ATOM 180 N3 G A 6 -0.406 5.965 -0.747 1.00 0.00 N ATOM 181 C4 G A 6 0.935 5.772 -0.767 1.00 0.00 C ATOM 0 H5' G A 6 3.765 6.832 -6.495 1.00 0.00 H new ATOM 0 H5'' G A 6 3.933 8.538 -6.131 1.00 0.00 H new ATOM 0 H4' G A 6 1.690 7.506 -5.788 1.00 0.00 H new ATOM 0 H3' G A 6 3.043 9.230 -3.719 1.00 0.00 H new ATOM 0 H2' G A 6 1.551 8.583 -1.989 1.00 0.00 H new ATOM 0 HO2' G A 6 -0.481 8.887 -2.302 1.00 0.00 H new ATOM 0 H1' G A 6 0.411 6.244 -3.365 1.00 0.00 H new ATOM 0 H8 G A 6 3.914 5.816 -2.006 1.00 0.00 H new ATOM 0 H1 G A 6 -0.737 4.805 2.305 1.00 0.00 H new ATOM 0 H21 G A 6 -2.843 6.096 -0.161 1.00 0.00 H new ATOM 0 H22 G A 6 -2.691 5.430 1.469 1.00 0.00 H new ATOM 193 P A A 7 1.111 11.177 -4.343 1.00 0.00 P ATOM 194 OP1 A A 7 1.307 12.089 -5.491 1.00 0.00 O ATOM 195 OP2 A A 7 1.888 11.378 -3.099 1.00 0.00 O ATOM 196 O5' A A 7 -0.454 11.174 -3.964 1.00 0.00 O ATOM 197 C5' A A 7 -1.318 10.177 -4.511 1.00 0.00 C ATOM 198 C4' A A 7 -2.610 10.035 -3.739 1.00 0.00 C ATOM 199 O4' A A 7 -2.347 9.287 -2.538 1.00 0.00 O ATOM 200 C3' A A 7 -3.208 11.329 -3.239 1.00 0.00 C ATOM 201 O3' A A 7 -4.541 10.947 -2.883 1.00 0.00 O ATOM 202 C2' A A 7 -2.389 11.551 -1.976 1.00 0.00 C ATOM 203 O2' A A 7 -2.996 12.490 -1.110 1.00 0.00 O ATOM 204 C1' A A 7 -2.405 10.148 -1.391 1.00 0.00 C ATOM 205 N9 A A 7 -1.243 9.862 -0.525 1.00 0.00 N ATOM 206 C8 A A 7 0.077 10.180 -0.722 1.00 0.00 C ATOM 207 N7 A A 7 0.865 9.760 0.227 1.00 0.00 N ATOM 208 C5 A A 7 0.008 9.119 1.114 1.00 0.00 C ATOM 209 C6 A A 7 0.221 8.457 2.332 1.00 0.00 C ATOM 210 N6 A A 7 1.421 8.315 2.894 1.00 0.00 N ATOM 211 N1 A A 7 -0.847 7.936 2.956 1.00 0.00 N ATOM 212 C2 A A 7 -2.045 8.068 2.400 1.00 0.00 C ATOM 213 N3 A A 7 -2.377 8.664 1.267 1.00 0.00 N ATOM 214 C4 A A 7 -1.281 9.175 0.667 1.00 0.00 C ATOM 0 H5' A A 7 -0.799 9.219 -4.521 1.00 0.00 H new ATOM 0 H5'' A A 7 -1.545 10.428 -5.547 1.00 0.00 H new ATOM 0 H4' A A 7 -3.300 9.571 -4.444 1.00 0.00 H new ATOM 0 H3' A A 7 -3.211 12.195 -3.901 1.00 0.00 H new ATOM 0 H2' A A 7 -1.394 11.963 -2.146 1.00 0.00 H new ATOM 0 HO2' A A 7 -2.816 12.241 -0.179 1.00 0.00 H new ATOM 0 H1' A A 7 -3.285 10.012 -0.763 1.00 0.00 H new ATOM 0 H8 A A 7 0.430 10.727 -1.583 1.00 0.00 H new ATOM 0 H61 A A 7 1.513 7.823 3.783 1.00 0.00 H new ATOM 0 H62 A A 7 2.247 8.699 2.436 1.00 0.00 H new ATOM 0 H2 A A 7 -2.863 7.627 2.950 1.00 0.00 H new ATOM 226 P U A 8 -5.705 11.946 -2.395 1.00 0.00 P ATOM 227 OP1 U A 8 -6.654 12.132 -3.515 1.00 0.00 O ATOM 228 OP2 U A 8 -5.115 13.123 -1.724 1.00 0.00 O ATOM 229 O5' U A 8 -6.405 11.011 -1.289 1.00 0.00 O ATOM 230 C5' U A 8 -6.302 9.581 -1.423 1.00 0.00 C ATOM 231 C4' U A 8 -5.823 8.902 -0.138 1.00 0.00 C ATOM 232 O4' U A 8 -4.775 9.675 0.461 1.00 0.00 O ATOM 233 C3' U A 8 -6.886 8.778 0.945 1.00 0.00 C ATOM 234 O3' U A 8 -6.525 7.661 1.772 1.00 0.00 O ATOM 235 C2' U A 8 -6.662 10.036 1.754 1.00 0.00 C ATOM 236 O2' U A 8 -7.203 9.916 3.072 1.00 0.00 O ATOM 237 C1' U A 8 -5.153 10.081 1.780 1.00 0.00 C ATOM 238 N1 U A 8 -4.637 11.438 2.026 1.00 0.00 N ATOM 239 C2 U A 8 -4.622 11.898 3.331 1.00 0.00 C ATOM 240 O2 U A 8 -5.000 11.215 4.282 1.00 0.00 O ATOM 241 N3 U A 8 -4.153 13.184 3.510 1.00 0.00 N ATOM 242 C4 U A 8 -3.705 14.032 2.517 1.00 0.00 C ATOM 243 O4 U A 8 -3.310 15.161 2.803 1.00 0.00 O ATOM 244 C5 U A 8 -3.750 13.477 1.184 1.00 0.00 C ATOM 245 C6 U A 8 -4.207 12.214 0.988 1.00 0.00 C ATOM 0 H5' U A 8 -5.612 9.345 -2.233 1.00 0.00 H new ATOM 0 H5'' U A 8 -7.274 9.175 -1.703 1.00 0.00 H new ATOM 0 H4' U A 8 -5.514 7.907 -0.458 1.00 0.00 H new ATOM 0 H3' U A 8 -7.903 8.653 0.575 1.00 0.00 H new ATOM 0 H2' U A 8 -7.138 10.928 1.347 1.00 0.00 H new ATOM 0 HO2' U A 8 -6.591 10.331 3.716 1.00 0.00 H new ATOM 0 H1' U A 8 -4.756 9.453 2.577 1.00 0.00 H new ATOM 0 H3 U A 8 -4.136 13.541 4.465 1.00 0.00 H new ATOM 0 H5 U A 8 -3.420 14.068 0.342 1.00 0.00 H new ATOM 0 H6 U A 8 -4.231 11.813 -0.014 1.00 0.00 H new ATOM 256 P A A 9 -7.656 6.745 2.470 1.00 0.00 P ATOM 257 OP1 A A 9 -8.151 7.451 3.673 1.00 0.00 O ATOM 258 OP2 A A 9 -7.123 5.368 2.590 1.00 0.00 O ATOM 259 O5' A A 9 -8.833 6.740 1.368 1.00 0.00 O ATOM 260 C5' A A 9 -9.187 5.540 0.670 1.00 0.00 C ATOM 261 C4' A A 9 -9.668 5.847 -0.747 1.00 0.00 C ATOM 262 O4' A A 9 -9.049 7.070 -1.190 1.00 0.00 O ATOM 263 C3' A A 9 -9.274 4.812 -1.803 1.00 0.00 C ATOM 264 O3' A A 9 -10.414 3.978 -2.045 1.00 0.00 O ATOM 265 C2' A A 9 -9.058 5.664 -3.047 1.00 0.00 C ATOM 266 O2' A A 9 -10.307 6.037 -3.637 1.00 0.00 O ATOM 267 C1' A A 9 -8.372 6.871 -2.437 1.00 0.00 C ATOM 268 N9 A A 9 -6.939 6.624 -2.181 1.00 0.00 N ATOM 269 C8 A A 9 -6.341 6.135 -1.050 1.00 0.00 C ATOM 270 N7 A A 9 -5.046 6.017 -1.152 1.00 0.00 N ATOM 271 C5 A A 9 -4.771 6.466 -2.437 1.00 0.00 C ATOM 272 C6 A A 9 -3.578 6.597 -3.163 1.00 0.00 C ATOM 273 N6 A A 9 -2.379 6.279 -2.678 1.00 0.00 N ATOM 274 N1 A A 9 -3.659 7.074 -4.414 1.00 0.00 N ATOM 275 C2 A A 9 -4.849 7.398 -4.904 1.00 0.00 C ATOM 276 N3 A A 9 -6.037 7.322 -4.328 1.00 0.00 N ATOM 277 C4 A A 9 -5.918 6.838 -3.074 1.00 0.00 C ATOM 0 H5' A A 9 -9.970 5.015 1.217 1.00 0.00 H new ATOM 0 H5'' A A 9 -8.326 4.873 0.628 1.00 0.00 H new ATOM 0 H4' A A 9 -10.755 5.878 -0.671 1.00 0.00 H new ATOM 0 H3' A A 9 -8.418 4.198 -1.525 1.00 0.00 H new ATOM 0 H2' A A 9 -8.502 5.172 -3.845 1.00 0.00 H new ATOM 0 HO2' A A 9 -10.657 5.288 -4.162 1.00 0.00 H new ATOM 0 H1' A A 9 -8.420 7.730 -3.106 1.00 0.00 H new ATOM 0 H8 A A 9 -6.890 5.872 -0.158 1.00 0.00 H new ATOM 0 H61 A A 9 -1.547 6.397 -3.256 1.00 0.00 H new ATOM 0 H62 A A 9 -2.293 5.917 -1.728 1.00 0.00 H new ATOM 0 H2 A A 9 -4.847 7.777 -5.915 1.00 0.00 H new ATOM 289 P G A 10 -10.330 2.759 -3.102 1.00 0.00 P ATOM 290 OP1 G A 10 -11.691 2.201 -3.274 1.00 0.00 O ATOM 291 OP2 G A 10 -9.214 1.873 -2.704 1.00 0.00 O ATOM 292 O5' G A 10 -9.917 3.514 -4.464 1.00 0.00 O ATOM 293 C5' G A 10 -10.138 2.919 -5.747 1.00 0.00 C ATOM 294 C4' G A 10 -8.852 2.370 -6.363 1.00 0.00 C ATOM 295 O4' G A 10 -7.790 3.313 -6.178 1.00 0.00 O ATOM 296 C3' G A 10 -8.315 1.097 -5.739 1.00 0.00 C ATOM 297 O3' G A 10 -8.914 -0.006 -6.430 1.00 0.00 O ATOM 298 C2' G A 10 -6.845 1.141 -6.129 1.00 0.00 C ATOM 299 O2' G A 10 -6.663 0.713 -7.483 1.00 0.00 O ATOM 300 C1' G A 10 -6.534 2.630 -5.992 1.00 0.00 C ATOM 301 N9 G A 10 -6.007 2.956 -4.654 1.00 0.00 N ATOM 302 C8 G A 10 -6.705 3.181 -3.499 1.00 0.00 C ATOM 303 N7 G A 10 -5.946 3.399 -2.462 1.00 0.00 N ATOM 304 C5 G A 10 -4.653 3.316 -2.966 1.00 0.00 C ATOM 305 C6 G A 10 -3.405 3.466 -2.304 1.00 0.00 C ATOM 306 O6 G A 10 -3.195 3.700 -1.116 1.00 0.00 O ATOM 307 N1 G A 10 -2.340 3.307 -3.177 1.00 0.00 N ATOM 308 C2 G A 10 -2.456 3.036 -4.522 1.00 0.00 C ATOM 309 N2 G A 10 -1.325 2.918 -5.214 1.00 0.00 N ATOM 310 N3 G A 10 -3.625 2.893 -5.154 1.00 0.00 N ATOM 311 C4 G A 10 -4.678 3.046 -4.313 1.00 0.00 C ATOM 0 H5' G A 10 -10.572 3.660 -6.418 1.00 0.00 H new ATOM 0 H5'' G A 10 -10.865 2.112 -5.650 1.00 0.00 H new ATOM 0 H4' G A 10 -9.131 2.175 -7.399 1.00 0.00 H new ATOM 0 H3' G A 10 -8.496 1.005 -4.668 1.00 0.00 H new ATOM 0 H2' G A 10 -6.208 0.492 -5.528 1.00 0.00 H new ATOM 0 HO2' G A 10 -6.788 -0.257 -7.539 1.00 0.00 H new ATOM 0 H1' G A 10 -5.777 2.926 -6.719 1.00 0.00 H new ATOM 0 H8 G A 10 -7.784 3.178 -3.451 1.00 0.00 H new ATOM 0 H1 G A 10 -1.399 3.398 -2.794 1.00 0.00 H new ATOM 0 H21 G A 10 -1.357 2.718 -6.214 1.00 0.00 H new ATOM 0 H22 G A 10 -0.426 3.028 -4.745 1.00 0.00 H new ATOM 323 P G A 11 -8.652 -1.521 -5.943 1.00 0.00 P ATOM 324 OP1 G A 11 -9.629 -2.400 -6.624 1.00 0.00 O ATOM 325 OP2 G A 11 -8.564 -1.524 -4.464 1.00 0.00 O ATOM 326 O5' G A 11 -7.188 -1.832 -6.543 1.00 0.00 O ATOM 327 C5' G A 11 -6.068 -2.050 -5.678 1.00 0.00 C ATOM 328 C4' G A 11 -4.766 -1.590 -6.329 1.00 0.00 C ATOM 329 O4' G A 11 -4.381 -0.327 -5.771 1.00 0.00 O ATOM 330 C3' G A 11 -3.571 -2.491 -6.078 1.00 0.00 C ATOM 331 O3' G A 11 -3.491 -3.394 -7.186 1.00 0.00 O ATOM 332 C2' G A 11 -2.387 -1.541 -6.180 1.00 0.00 C ATOM 333 O2' G A 11 -2.023 -1.328 -7.547 1.00 0.00 O ATOM 334 C1' G A 11 -2.958 -0.259 -5.574 1.00 0.00 C ATOM 335 N9 G A 11 -2.689 -0.147 -4.125 1.00 0.00 N ATOM 336 C8 G A 11 -3.570 0.113 -3.107 1.00 0.00 C ATOM 337 N7 G A 11 -3.016 0.159 -1.929 1.00 0.00 N ATOM 338 C5 G A 11 -1.671 -0.089 -2.181 1.00 0.00 C ATOM 339 C6 G A 11 -0.576 -0.162 -1.279 1.00 0.00 C ATOM 340 O6 G A 11 -0.583 -0.017 -0.059 1.00 0.00 O ATOM 341 N1 G A 11 0.611 -0.432 -1.939 1.00 0.00 N ATOM 342 C2 G A 11 0.738 -0.609 -3.298 1.00 0.00 C ATOM 343 N2 G A 11 1.960 -0.870 -3.763 1.00 0.00 N ATOM 344 N3 G A 11 -0.284 -0.542 -4.155 1.00 0.00 N ATOM 345 C4 G A 11 -1.457 -0.279 -3.525 1.00 0.00 C ATOM 0 H5' G A 11 -5.998 -3.109 -5.430 1.00 0.00 H new ATOM 0 H5'' G A 11 -6.219 -1.512 -4.742 1.00 0.00 H new ATOM 0 H4' G A 11 -4.987 -1.575 -7.396 1.00 0.00 H new ATOM 0 H3' G A 11 -3.615 -3.040 -5.137 1.00 0.00 H new ATOM 0 H2' G A 11 -1.486 -1.905 -5.686 1.00 0.00 H new ATOM 0 HO2' G A 11 -2.346 -2.076 -8.092 1.00 0.00 H new ATOM 0 H1' G A 11 -2.495 0.605 -6.051 1.00 0.00 H new ATOM 0 H8 G A 11 -4.627 0.266 -3.267 1.00 0.00 H new ATOM 0 H1 G A 11 1.457 -0.505 -1.374 1.00 0.00 H new ATOM 0 H21 G A 11 2.106 -1.009 -4.763 1.00 0.00 H new ATOM 0 H22 G A 11 2.749 -0.930 -3.119 1.00 0.00 H new ATOM 357 P G A 12 -3.117 -4.945 -6.964 1.00 0.00 P ATOM 358 OP1 G A 12 -3.787 -5.738 -8.019 1.00 0.00 O ATOM 359 OP2 G A 12 -3.339 -5.279 -5.539 1.00 0.00 O ATOM 360 O5' G A 12 -1.532 -4.964 -7.244 1.00 0.00 O ATOM 361 C5' G A 12 -0.885 -6.159 -7.694 1.00 0.00 C ATOM 362 C4' G A 12 0.558 -6.237 -7.206 1.00 0.00 C ATOM 363 O4' G A 12 0.953 -4.964 -6.686 1.00 0.00 O ATOM 364 C3' G A 12 0.781 -7.200 -6.052 1.00 0.00 C ATOM 365 O3' G A 12 1.182 -8.451 -6.617 1.00 0.00 O ATOM 366 C2' G A 12 1.990 -6.612 -5.341 1.00 0.00 C ATOM 367 O2' G A 12 3.201 -6.987 -6.003 1.00 0.00 O ATOM 368 C1' G A 12 1.739 -5.114 -5.494 1.00 0.00 C ATOM 369 N9 G A 12 0.984 -4.552 -4.354 1.00 0.00 N ATOM 370 C8 G A 12 -0.266 -3.986 -4.349 1.00 0.00 C ATOM 371 N7 G A 12 -0.653 -3.581 -3.173 1.00 0.00 N ATOM 372 C5 G A 12 0.412 -3.901 -2.339 1.00 0.00 C ATOM 373 C6 G A 12 0.567 -3.697 -0.941 1.00 0.00 C ATOM 374 O6 G A 12 -0.223 -3.184 -0.154 1.00 0.00 O ATOM 375 N1 G A 12 1.793 -4.164 -0.491 1.00 0.00 N ATOM 376 C2 G A 12 2.752 -4.753 -1.282 1.00 0.00 C ATOM 377 N2 G A 12 3.879 -5.139 -0.682 1.00 0.00 N ATOM 378 N3 G A 12 2.616 -4.948 -2.595 1.00 0.00 N ATOM 379 C4 G A 12 1.423 -4.497 -3.054 1.00 0.00 C ATOM 0 H5' G A 12 -0.903 -6.195 -8.783 1.00 0.00 H new ATOM 0 H5'' G A 12 -1.437 -7.028 -7.337 1.00 0.00 H new ATOM 0 H4' G A 12 1.125 -6.570 -8.076 1.00 0.00 H new ATOM 0 H3' G A 12 -0.088 -7.336 -5.409 1.00 0.00 H new ATOM 0 H2' G A 12 2.103 -6.945 -4.309 1.00 0.00 H new ATOM 0 HO2' G A 12 2.996 -7.611 -6.730 1.00 0.00 H new ATOM 0 H1' G A 12 2.691 -4.585 -5.538 1.00 0.00 H new ATOM 0 H8 G A 12 -0.872 -3.886 -5.237 1.00 0.00 H new ATOM 0 H1 G A 12 1.999 -4.063 0.503 1.00 0.00 H new ATOM 0 H21 G A 12 4.621 -5.581 -1.225 1.00 0.00 H new ATOM 0 H22 G A 12 3.999 -4.992 0.320 1.00 0.00 H new ATOM 391 P U A 13 0.796 -9.839 -5.896 1.00 0.00 P ATOM 392 OP1 U A 13 1.059 -10.945 -6.843 1.00 0.00 O ATOM 393 OP2 U A 13 -0.548 -9.690 -5.291 1.00 0.00 O ATOM 394 O5' U A 13 1.876 -9.926 -4.705 1.00 0.00 O ATOM 395 C5' U A 13 3.277 -9.872 -4.987 1.00 0.00 C ATOM 396 C4' U A 13 4.107 -9.867 -3.708 1.00 0.00 C ATOM 397 O4' U A 13 4.018 -8.577 -3.092 1.00 0.00 O ATOM 398 C3' U A 13 3.626 -10.825 -2.632 1.00 0.00 C ATOM 399 O3' U A 13 4.341 -12.051 -2.809 1.00 0.00 O ATOM 400 C2' U A 13 4.133 -10.181 -1.352 1.00 0.00 C ATOM 401 O2' U A 13 5.515 -10.484 -1.144 1.00 0.00 O ATOM 402 C1' U A 13 3.949 -8.694 -1.659 1.00 0.00 C ATOM 403 N1 U A 13 2.640 -8.181 -1.197 1.00 0.00 N ATOM 404 C2 U A 13 2.560 -7.708 0.102 1.00 0.00 C ATOM 405 O2 U A 13 3.520 -7.715 0.870 1.00 0.00 O ATOM 406 N3 U A 13 1.329 -7.224 0.495 1.00 0.00 N ATOM 407 C4 U A 13 0.187 -7.172 -0.281 1.00 0.00 C ATOM 408 O4 U A 13 -0.851 -6.713 0.185 1.00 0.00 O ATOM 409 C5 U A 13 0.347 -7.685 -1.621 1.00 0.00 C ATOM 410 C6 U A 13 1.548 -8.166 -2.028 1.00 0.00 C ATOM 0 H5' U A 13 3.498 -8.977 -5.568 1.00 0.00 H new ATOM 0 H5'' U A 13 3.558 -10.728 -5.601 1.00 0.00 H new ATOM 0 H4' U A 13 5.107 -10.156 -4.033 1.00 0.00 H new ATOM 0 H3' U A 13 2.552 -11.009 -2.641 1.00 0.00 H new ATOM 0 H2' U A 13 3.619 -10.519 -0.452 1.00 0.00 H new ATOM 0 HO2' U A 13 5.611 -11.042 -0.344 1.00 0.00 H new ATOM 0 H1' U A 13 4.714 -8.113 -1.144 1.00 0.00 H new ATOM 0 H3 U A 13 1.255 -6.871 1.449 1.00 0.00 H new ATOM 0 H5 U A 13 -0.492 -7.686 -2.301 1.00 0.00 H new ATOM 0 H6 U A 13 1.648 -8.548 -3.033 1.00 0.00 H new ATOM 421 P C A 14 3.625 -13.467 -2.528 1.00 0.00 P ATOM 422 OP1 C A 14 4.347 -14.510 -3.290 1.00 0.00 O ATOM 423 OP2 C A 14 2.166 -13.297 -2.713 1.00 0.00 O ATOM 424 O5' C A 14 3.909 -13.698 -0.959 1.00 0.00 O ATOM 425 C5' C A 14 5.250 -13.804 -0.472 1.00 0.00 C ATOM 426 C4' C A 14 5.339 -13.441 1.008 1.00 0.00 C ATOM 427 O4' C A 14 4.972 -12.074 1.181 1.00 0.00 O ATOM 428 C3' C A 14 4.378 -14.193 1.911 1.00 0.00 C ATOM 429 O3' C A 14 4.925 -15.460 2.285 1.00 0.00 O ATOM 430 C2' C A 14 4.299 -13.264 3.119 1.00 0.00 C ATOM 431 O2' C A 14 5.403 -13.491 3.999 1.00 0.00 O ATOM 432 C1' C A 14 4.403 -11.873 2.482 1.00 0.00 C ATOM 433 N1 C A 14 3.083 -11.219 2.335 1.00 0.00 N ATOM 434 C2 C A 14 2.717 -10.288 3.296 1.00 0.00 C ATOM 435 O2 C A 14 3.476 -10.027 4.229 1.00 0.00 O ATOM 436 N3 C A 14 1.508 -9.674 3.186 1.00 0.00 N ATOM 437 C4 C A 14 0.686 -9.963 2.169 1.00 0.00 C ATOM 438 N4 C A 14 -0.486 -9.329 2.118 1.00 0.00 N ATOM 439 C5 C A 14 1.054 -10.921 1.173 1.00 0.00 C ATOM 440 C6 C A 14 2.252 -11.522 1.293 1.00 0.00 C ATOM 0 H5' C A 14 5.900 -13.146 -1.049 1.00 0.00 H new ATOM 0 H5'' C A 14 5.613 -14.821 -0.621 1.00 0.00 H new ATOM 0 H4' C A 14 6.365 -13.685 1.282 1.00 0.00 H new ATOM 0 H3' C A 14 3.414 -14.411 1.452 1.00 0.00 H new ATOM 0 H2' C A 14 3.398 -13.405 3.717 1.00 0.00 H new ATOM 0 HO2' C A 14 5.770 -14.385 3.839 1.00 0.00 H new ATOM 0 HO3' C A 14 4.293 -15.930 2.868 1.00 0.00 H new ATOM 0 H1' C A 14 5.007 -11.224 3.116 1.00 0.00 H new ATOM 0 H41 C A 14 -1.138 -9.523 1.358 1.00 0.00 H new ATOM 0 H42 C A 14 -0.730 -8.650 2.839 1.00 0.00 H new ATOM 0 H5 C A 14 0.392 -11.154 0.352 1.00 0.00 H new ATOM 0 H6 C A 14 2.560 -12.251 0.558 1.00 0.00 H new TER 453 C A 14