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 -14:sc= -1.69! USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -6:sc= -0.28 USER MOD Single : A 3 C O2' : rot -2:sc= -0.702 USER MOD Single : A 4 C O2' : rot -14:sc= -1.19! USER MOD Single : A 5 U O2' : rot -26:sc= 0.404 USER MOD Single : A 6 G O2' : rot -145:sc= -6.86! USER MOD Single : A 7 A O2' : rot 125:sc= -6.83! USER MOD Single : A 8 U O2' : rot 138:sc= 0.617 USER MOD Single : A 9 A O2' : rot -79:sc= 0.664 USER MOD Single : A 10 G O2' : rot -74:sc= 0.763 USER MOD Single : A 11 G O2' : rot -28:sc= 0.384 USER MOD Single : A 12 G O2' : rot -15:sc= 0.362 USER MOD Single : A 13 U O2' : rot -17:sc= -0.866 USER MOD Single : A 14 C O2' : rot -23:sc= 0.197 USER MOD Single : A 14 C O3' : rot 180:sc= 0.239 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -3.377 -0.864 10.099 1.00 0.00 O ATOM 2 C5' G A 1 -3.908 -1.996 9.406 1.00 0.00 C ATOM 3 C4' G A 1 -3.066 -3.245 9.644 1.00 0.00 C ATOM 4 O4' G A 1 -3.521 -4.291 8.780 1.00 0.00 O ATOM 5 C3' G A 1 -1.594 -3.095 9.306 1.00 0.00 C ATOM 6 O3' G A 1 -0.920 -2.729 10.515 1.00 0.00 O ATOM 7 C2' G A 1 -1.167 -4.513 8.961 1.00 0.00 C ATOM 8 O2' G A 1 -0.866 -5.255 10.147 1.00 0.00 O ATOM 9 C1' G A 1 -2.420 -5.071 8.286 1.00 0.00 C ATOM 10 N9 G A 1 -2.365 -4.943 6.816 1.00 0.00 N ATOM 11 C8 G A 1 -2.501 -3.813 6.050 1.00 0.00 C ATOM 12 N7 G A 1 -2.389 -4.032 4.770 1.00 0.00 N ATOM 13 C5 G A 1 -2.167 -5.400 4.681 1.00 0.00 C ATOM 14 C6 G A 1 -1.968 -6.217 3.535 1.00 0.00 C ATOM 15 O6 G A 1 -1.950 -5.880 2.354 1.00 0.00 O ATOM 16 N1 G A 1 -1.778 -7.546 3.881 1.00 0.00 N ATOM 17 C2 G A 1 -1.776 -8.034 5.168 1.00 0.00 C ATOM 18 N2 G A 1 -1.571 -9.343 5.319 1.00 0.00 N ATOM 19 N3 G A 1 -1.962 -7.276 6.252 1.00 0.00 N ATOM 20 C4 G A 1 -2.150 -5.971 5.930 1.00 0.00 C ATOM 0 H5' G A 1 -3.950 -1.783 8.338 1.00 0.00 H new ATOM 0 H5'' G A 1 -4.931 -2.178 9.735 1.00 0.00 H new ATOM 0 H4' G A 1 -3.174 -3.448 10.710 1.00 0.00 H new ATOM 0 H3' G A 1 -1.390 -2.369 8.519 1.00 0.00 H new ATOM 0 H2' G A 1 -0.271 -4.562 8.343 1.00 0.00 H new ATOM 0 HO2' G A 1 -0.780 -4.640 10.905 1.00 0.00 H new ATOM 0 HO5' G A 1 -3.939 -0.080 9.924 1.00 0.00 H new ATOM 0 H1' G A 1 -2.517 -6.133 8.511 1.00 0.00 H new ATOM 0 H8 G A 1 -2.684 -2.834 6.468 1.00 0.00 H new ATOM 0 H1 G A 1 -1.628 -8.213 3.124 1.00 0.00 H new ATOM 0 H21 G A 1 -1.560 -9.753 6.253 1.00 0.00 H new ATOM 0 H22 G A 1 -1.425 -9.934 4.501 1.00 0.00 H new ATOM 33 P G A 2 0.408 -1.817 10.474 1.00 0.00 P ATOM 34 OP1 G A 2 0.839 -1.565 11.867 1.00 0.00 O ATOM 35 OP2 G A 2 0.160 -0.678 9.562 1.00 0.00 O ATOM 36 O5' G A 2 1.486 -2.792 9.780 1.00 0.00 O ATOM 37 C5' G A 2 1.902 -4.002 10.423 1.00 0.00 C ATOM 38 C4' G A 2 3.220 -4.522 9.855 1.00 0.00 C ATOM 39 O4' G A 2 3.055 -5.888 9.463 1.00 0.00 O ATOM 40 C3' G A 2 3.697 -3.832 8.590 1.00 0.00 C ATOM 41 O3' G A 2 4.556 -2.760 8.992 1.00 0.00 O ATOM 42 C2' G A 2 4.565 -4.893 7.936 1.00 0.00 C ATOM 43 O2' G A 2 5.857 -4.943 8.550 1.00 0.00 O ATOM 44 C1' G A 2 3.772 -6.161 8.247 1.00 0.00 C ATOM 45 N9 G A 2 2.796 -6.479 7.186 1.00 0.00 N ATOM 46 C8 G A 2 1.427 -6.428 7.241 1.00 0.00 C ATOM 47 N7 G A 2 0.845 -6.737 6.117 1.00 0.00 N ATOM 48 C5 G A 2 1.899 -7.015 5.258 1.00 0.00 C ATOM 49 C6 G A 2 1.880 -7.409 3.894 1.00 0.00 C ATOM 50 O6 G A 2 0.906 -7.584 3.167 1.00 0.00 O ATOM 51 N1 G A 2 3.159 -7.589 3.396 1.00 0.00 N ATOM 52 C2 G A 2 4.318 -7.413 4.115 1.00 0.00 C ATOM 53 N2 G A 2 5.464 -7.631 3.471 1.00 0.00 N ATOM 54 N3 G A 2 4.349 -7.042 5.397 1.00 0.00 N ATOM 55 C4 G A 2 3.104 -6.861 5.901 1.00 0.00 C ATOM 0 H5' G A 2 1.130 -4.762 10.303 1.00 0.00 H new ATOM 0 H5'' G A 2 2.012 -3.826 11.493 1.00 0.00 H new ATOM 0 H4' G A 2 3.942 -4.349 10.653 1.00 0.00 H new ATOM 0 H3' G A 2 2.897 -3.455 7.952 1.00 0.00 H new ATOM 0 H2' G A 2 4.753 -4.727 6.875 1.00 0.00 H new ATOM 0 HO2' G A 2 5.937 -4.217 9.203 1.00 0.00 H new ATOM 0 H1' G A 2 4.449 -7.011 8.328 1.00 0.00 H new ATOM 0 H8 G A 2 0.882 -6.157 8.133 1.00 0.00 H new ATOM 0 H1 G A 2 3.249 -7.874 2.421 1.00 0.00 H new ATOM 0 H21 G A 2 6.353 -7.515 3.958 1.00 0.00 H new ATOM 0 H22 G A 2 5.452 -7.914 2.491 1.00 0.00 H new ATOM 67 P C A 3 4.507 -1.340 8.232 1.00 0.00 P ATOM 68 OP1 C A 3 5.243 -0.352 9.050 1.00 0.00 O ATOM 69 OP2 C A 3 3.107 -1.073 7.834 1.00 0.00 O ATOM 70 O5' C A 3 5.365 -1.629 6.899 1.00 0.00 O ATOM 71 C5' C A 3 6.689 -2.166 6.985 1.00 0.00 C ATOM 72 C4' C A 3 7.136 -2.776 5.661 1.00 0.00 C ATOM 73 O4' C A 3 6.365 -3.952 5.397 1.00 0.00 O ATOM 74 C3' C A 3 6.900 -1.901 4.444 1.00 0.00 C ATOM 75 O3' C A 3 8.096 -1.142 4.235 1.00 0.00 O ATOM 76 C2' C A 3 6.795 -2.907 3.307 1.00 0.00 C ATOM 77 O2' C A 3 8.095 -3.285 2.845 1.00 0.00 O ATOM 78 C1' C A 3 6.106 -4.091 3.989 1.00 0.00 C ATOM 79 N1 C A 3 4.641 -4.094 3.766 1.00 0.00 N ATOM 80 C2 C A 3 4.167 -4.712 2.616 1.00 0.00 C ATOM 81 O2 C A 3 4.951 -5.218 1.815 1.00 0.00 O ATOM 82 N3 C A 3 2.824 -4.738 2.396 1.00 0.00 N ATOM 83 C4 C A 3 1.977 -4.182 3.270 1.00 0.00 C ATOM 84 N4 C A 3 0.673 -4.246 3.001 1.00 0.00 N ATOM 85 C5 C A 3 2.456 -3.544 4.455 1.00 0.00 C ATOM 86 C6 C A 3 3.786 -3.523 4.664 1.00 0.00 C ATOM 0 H5' C A 3 6.724 -2.926 7.766 1.00 0.00 H new ATOM 0 H5'' C A 3 7.383 -1.378 7.276 1.00 0.00 H new ATOM 0 H4' C A 3 8.205 -2.944 5.789 1.00 0.00 H new ATOM 0 H3' C A 3 6.038 -1.239 4.529 1.00 0.00 H new ATOM 0 H2' C A 3 6.265 -2.528 2.433 1.00 0.00 H new ATOM 0 HO2' C A 3 8.777 -2.786 3.342 1.00 0.00 H new ATOM 0 H1' C A 3 6.491 -5.024 3.578 1.00 0.00 H new ATOM 0 H41 C A 3 -0.001 -3.833 3.645 1.00 0.00 H new ATOM 0 H42 C A 3 0.350 -4.708 2.151 1.00 0.00 H new ATOM 0 H5 C A 3 1.774 -3.093 5.160 1.00 0.00 H new ATOM 0 H6 C A 3 4.180 -3.050 5.551 1.00 0.00 H new ATOM 98 P C A 4 8.033 0.328 3.580 1.00 0.00 P ATOM 99 OP1 C A 4 9.359 0.964 3.743 1.00 0.00 O ATOM 100 OP2 C A 4 6.821 1.012 4.083 1.00 0.00 O ATOM 101 O5' C A 4 7.817 0.007 2.018 1.00 0.00 O ATOM 102 C5' C A 4 8.838 -0.648 1.257 1.00 0.00 C ATOM 103 C4' C A 4 8.432 -0.808 -0.204 1.00 0.00 C ATOM 104 O4' C A 4 7.510 -1.900 -0.320 1.00 0.00 O ATOM 105 C3' C A 4 7.669 0.369 -0.786 1.00 0.00 C ATOM 106 O3' C A 4 8.632 1.251 -1.375 1.00 0.00 O ATOM 107 C2' C A 4 6.883 -0.272 -1.914 1.00 0.00 C ATOM 108 O2' C A 4 7.717 -0.506 -3.051 1.00 0.00 O ATOM 109 C1' C A 4 6.472 -1.590 -1.268 1.00 0.00 C ATOM 110 N1 C A 4 5.198 -1.455 -0.533 1.00 0.00 N ATOM 111 C2 C A 4 4.029 -1.832 -1.180 1.00 0.00 C ATOM 112 O2 C A 4 4.067 -2.278 -2.325 1.00 0.00 O ATOM 113 N3 C A 4 2.848 -1.690 -0.520 1.00 0.00 N ATOM 114 C4 C A 4 2.813 -1.199 0.726 1.00 0.00 C ATOM 115 N4 C A 4 1.627 -1.090 1.319 1.00 0.00 N ATOM 116 C5 C A 4 4.016 -0.810 1.393 1.00 0.00 C ATOM 117 C6 C A 4 5.173 -0.957 0.736 1.00 0.00 C ATOM 0 H5' C A 4 9.042 -1.628 1.688 1.00 0.00 H new ATOM 0 H5'' C A 4 9.763 -0.074 1.318 1.00 0.00 H new ATOM 0 H4' C A 4 9.376 -0.935 -0.734 1.00 0.00 H new ATOM 0 H3' C A 4 7.056 0.912 -0.066 1.00 0.00 H new ATOM 0 H2' C A 4 6.054 0.331 -2.284 1.00 0.00 H new ATOM 0 HO2' C A 4 8.557 -0.013 -2.947 1.00 0.00 H new ATOM 0 H1' C A 4 6.339 -2.359 -2.029 1.00 0.00 H new ATOM 0 H41 C A 4 1.563 -0.720 2.267 1.00 0.00 H new ATOM 0 H42 C A 4 0.782 -1.376 0.825 1.00 0.00 H new ATOM 0 H5 C A 4 3.992 -0.410 2.396 1.00 0.00 H new ATOM 0 H6 C A 4 6.099 -0.678 1.217 1.00 0.00 H new ATOM 129 P U A 5 8.316 2.823 -1.524 1.00 0.00 P ATOM 130 OP1 U A 5 9.449 3.457 -2.236 1.00 0.00 O ATOM 131 OP2 U A 5 7.892 3.338 -0.203 1.00 0.00 O ATOM 132 O5' U A 5 7.037 2.832 -2.501 1.00 0.00 O ATOM 133 C5' U A 5 7.166 2.476 -3.881 1.00 0.00 C ATOM 134 C4' U A 5 5.869 2.689 -4.639 1.00 0.00 C ATOM 135 O4' U A 5 4.919 1.718 -4.206 1.00 0.00 O ATOM 136 C3' U A 5 5.201 4.025 -4.373 1.00 0.00 C ATOM 137 O3' U A 5 5.629 4.917 -5.408 1.00 0.00 O ATOM 138 C2' U A 5 3.728 3.732 -4.604 1.00 0.00 C ATOM 139 O2' U A 5 3.404 3.814 -5.994 1.00 0.00 O ATOM 140 C1' U A 5 3.608 2.289 -4.111 1.00 0.00 C ATOM 141 N1 U A 5 3.153 2.205 -2.705 1.00 0.00 N ATOM 142 C2 U A 5 1.788 2.194 -2.470 1.00 0.00 C ATOM 143 O2 U A 5 0.958 2.272 -3.373 1.00 0.00 O ATOM 144 N3 U A 5 1.405 2.090 -1.147 1.00 0.00 N ATOM 145 C4 U A 5 2.250 1.997 -0.058 1.00 0.00 C ATOM 146 O4 U A 5 1.785 1.898 1.074 1.00 0.00 O ATOM 147 C5 U A 5 3.658 2.020 -0.385 1.00 0.00 C ATOM 148 C6 U A 5 4.054 2.121 -1.674 1.00 0.00 C ATOM 0 H5' U A 5 7.467 1.431 -3.961 1.00 0.00 H new ATOM 0 H5'' U A 5 7.957 3.071 -4.338 1.00 0.00 H new ATOM 0 H4' U A 5 6.140 2.625 -5.693 1.00 0.00 H new ATOM 0 H3' U A 5 5.416 4.446 -3.391 1.00 0.00 H new ATOM 0 H2' U A 5 3.059 4.431 -4.102 1.00 0.00 H new ATOM 0 HO2' U A 5 4.038 4.411 -6.443 1.00 0.00 H new ATOM 0 H1' U A 5 2.869 1.763 -4.716 1.00 0.00 H new ATOM 0 H3 U A 5 0.403 2.081 -0.956 1.00 0.00 H new ATOM 0 H5 U A 5 4.395 1.956 0.402 1.00 0.00 H new ATOM 0 H6 U A 5 5.110 2.136 -1.898 1.00 0.00 H new ATOM 159 P G A 6 6.182 6.387 -5.048 1.00 0.00 P ATOM 160 OP1 G A 6 6.706 7.002 -6.288 1.00 0.00 O ATOM 161 OP2 G A 6 7.050 6.277 -3.854 1.00 0.00 O ATOM 162 O5' G A 6 4.838 7.164 -4.625 1.00 0.00 O ATOM 163 C5' G A 6 3.794 7.384 -5.578 1.00 0.00 C ATOM 164 C4' G A 6 2.423 7.386 -4.912 1.00 0.00 C ATOM 165 O4' G A 6 2.338 6.286 -4.016 1.00 0.00 O ATOM 166 C3' G A 6 2.139 8.588 -4.025 1.00 0.00 C ATOM 167 O3' G A 6 1.404 9.532 -4.812 1.00 0.00 O ATOM 168 C2' G A 6 1.194 8.048 -2.941 1.00 0.00 C ATOM 169 O2' G A 6 -0.146 8.432 -3.190 1.00 0.00 O ATOM 170 C1' G A 6 1.306 6.533 -3.065 1.00 0.00 C ATOM 171 N9 G A 6 1.668 5.917 -1.774 1.00 0.00 N ATOM 172 C8 G A 6 2.909 5.571 -1.311 1.00 0.00 C ATOM 173 N7 G A 6 2.903 5.092 -0.097 1.00 0.00 N ATOM 174 C5 G A 6 1.561 5.126 0.269 1.00 0.00 C ATOM 175 C6 G A 6 0.936 4.731 1.483 1.00 0.00 C ATOM 176 O6 G A 6 1.460 4.269 2.495 1.00 0.00 O ATOM 177 N1 G A 6 -0.433 4.929 1.442 1.00 0.00 N ATOM 178 C2 G A 6 -1.124 5.444 0.368 1.00 0.00 C ATOM 179 N2 G A 6 -2.444 5.576 0.503 1.00 0.00 N ATOM 180 N3 G A 6 -0.548 5.818 -0.777 1.00 0.00 N ATOM 181 C4 G A 6 0.795 5.630 -0.754 1.00 0.00 C ATOM 0 H5' G A 6 3.828 6.607 -6.342 1.00 0.00 H new ATOM 0 H5'' G A 6 3.956 8.336 -6.084 1.00 0.00 H new ATOM 0 H4' G A 6 1.722 7.370 -5.746 1.00 0.00 H new ATOM 0 H3' G A 6 3.038 9.049 -3.617 1.00 0.00 H new ATOM 0 H2' G A 6 1.458 8.428 -1.954 1.00 0.00 H new ATOM 0 HO2' G A 6 -0.605 8.589 -2.338 1.00 0.00 H new ATOM 0 H1' G A 6 0.352 6.104 -3.372 1.00 0.00 H new ATOM 0 H8 G A 6 3.810 5.684 -1.896 1.00 0.00 H new ATOM 0 H1 G A 6 -0.971 4.674 2.270 1.00 0.00 H new ATOM 0 H21 G A 6 -3.000 5.953 -0.265 1.00 0.00 H new ATOM 0 H22 G A 6 -2.898 5.300 1.374 1.00 0.00 H new ATOM 193 P A A 7 1.115 11.022 -4.261 1.00 0.00 P ATOM 194 OP1 A A 7 1.280 11.972 -5.383 1.00 0.00 O ATOM 195 OP2 A A 7 1.881 11.216 -3.009 1.00 0.00 O ATOM 196 O5' A A 7 -0.452 10.950 -3.889 1.00 0.00 O ATOM 197 C5' A A 7 -1.295 10.021 -4.571 1.00 0.00 C ATOM 198 C4' A A 7 -2.622 9.807 -3.873 1.00 0.00 C ATOM 199 O4' A A 7 -2.393 9.042 -2.681 1.00 0.00 O ATOM 200 C3' A A 7 -3.309 11.068 -3.398 1.00 0.00 C ATOM 201 O3' A A 7 -4.687 10.679 -3.250 1.00 0.00 O ATOM 202 C2' A A 7 -2.655 11.283 -2.031 1.00 0.00 C ATOM 203 O2' A A 7 -3.474 12.067 -1.178 1.00 0.00 O ATOM 204 C1' A A 7 -2.533 9.856 -1.510 1.00 0.00 C ATOM 205 N9 A A 7 -1.332 9.656 -0.661 1.00 0.00 N ATOM 206 C8 A A 7 -0.042 10.069 -0.887 1.00 0.00 C ATOM 207 N7 A A 7 0.793 9.727 0.053 1.00 0.00 N ATOM 208 C5 A A 7 0.005 9.039 0.964 1.00 0.00 C ATOM 209 C6 A A 7 0.294 8.416 2.188 1.00 0.00 C ATOM 210 N6 A A 7 1.512 8.382 2.728 1.00 0.00 N ATOM 211 N1 A A 7 -0.716 7.825 2.843 1.00 0.00 N ATOM 212 C2 A A 7 -1.931 7.853 2.312 1.00 0.00 C ATOM 213 N3 A A 7 -2.330 8.402 1.175 1.00 0.00 N ATOM 214 C4 A A 7 -1.293 8.988 0.544 1.00 0.00 C ATOM 0 H5' A A 7 -0.778 9.065 -4.659 1.00 0.00 H new ATOM 0 H5'' A A 7 -1.477 10.379 -5.584 1.00 0.00 H new ATOM 0 H4' A A 7 -3.255 9.326 -4.618 1.00 0.00 H new ATOM 0 H3' A A 7 -3.239 11.956 -4.026 1.00 0.00 H new ATOM 0 H2' A A 7 -1.708 11.820 -2.082 1.00 0.00 H new ATOM 0 HO2' A A 7 -3.634 11.582 -0.342 1.00 0.00 H new ATOM 0 H1' A A 7 -3.399 9.611 -0.895 1.00 0.00 H new ATOM 0 H8 A A 7 0.253 10.626 -1.764 1.00 0.00 H new ATOM 0 H61 A A 7 1.661 7.913 3.622 1.00 0.00 H new ATOM 0 H62 A A 7 2.295 8.825 2.248 1.00 0.00 H new ATOM 0 H2 A A 7 -2.701 7.360 2.886 1.00 0.00 H new ATOM 226 P U A 8 -5.828 11.581 -2.553 1.00 0.00 P ATOM 227 OP1 U A 8 -7.063 11.457 -3.358 1.00 0.00 O ATOM 228 OP2 U A 8 -5.289 12.925 -2.247 1.00 0.00 O ATOM 229 O5' U A 8 -6.045 10.765 -1.184 1.00 0.00 O ATOM 230 C5' U A 8 -5.985 9.331 -1.223 1.00 0.00 C ATOM 231 C4' U A 8 -5.699 8.715 0.141 1.00 0.00 C ATOM 232 O4' U A 8 -4.574 9.366 0.741 1.00 0.00 O ATOM 233 C3' U A 8 -6.829 8.857 1.154 1.00 0.00 C ATOM 234 O3' U A 8 -6.742 7.734 2.041 1.00 0.00 O ATOM 235 C2' U A 8 -6.417 10.090 1.934 1.00 0.00 C ATOM 236 O2' U A 8 -7.019 10.113 3.231 1.00 0.00 O ATOM 237 C1' U A 8 -4.923 9.877 2.026 1.00 0.00 C ATOM 238 N1 U A 8 -4.171 11.124 2.265 1.00 0.00 N ATOM 239 C2 U A 8 -4.064 11.573 3.571 1.00 0.00 C ATOM 240 O2 U A 8 -4.574 10.981 4.520 1.00 0.00 O ATOM 241 N3 U A 8 -3.344 12.737 3.750 1.00 0.00 N ATOM 242 C4 U A 8 -2.733 13.479 2.757 1.00 0.00 C ATOM 243 O4 U A 8 -2.118 14.503 3.045 1.00 0.00 O ATOM 244 C5 U A 8 -2.889 12.945 1.425 1.00 0.00 C ATOM 245 C6 U A 8 -3.594 11.802 1.227 1.00 0.00 C ATOM 0 H5' U A 8 -5.210 9.023 -1.925 1.00 0.00 H new ATOM 0 H5'' U A 8 -6.931 8.942 -1.601 1.00 0.00 H new ATOM 0 H4' U A 8 -5.540 7.657 -0.068 1.00 0.00 H new ATOM 0 H3' U A 8 -7.827 8.916 0.719 1.00 0.00 H new ATOM 0 H2' U A 8 -6.714 11.034 1.478 1.00 0.00 H new ATOM 0 HO2' U A 8 -6.359 10.408 3.893 1.00 0.00 H new ATOM 0 H1' U A 8 -4.679 9.221 2.862 1.00 0.00 H new ATOM 0 H3 U A 8 -3.254 13.082 4.706 1.00 0.00 H new ATOM 0 H5 U A 8 -2.444 13.456 0.584 1.00 0.00 H new ATOM 0 H6 U A 8 -3.702 11.418 0.223 1.00 0.00 H new ATOM 256 P A A 9 -8.070 6.987 2.573 1.00 0.00 P ATOM 257 OP1 A A 9 -8.687 7.833 3.618 1.00 0.00 O ATOM 258 OP2 A A 9 -7.717 5.581 2.876 1.00 0.00 O ATOM 259 O5' A A 9 -9.034 7.002 1.280 1.00 0.00 O ATOM 260 C5' A A 9 -9.433 5.782 0.641 1.00 0.00 C ATOM 261 C4' A A 9 -9.856 6.019 -0.809 1.00 0.00 C ATOM 262 O4' A A 9 -9.191 7.196 -1.304 1.00 0.00 O ATOM 263 C3' A A 9 -9.459 4.915 -1.791 1.00 0.00 C ATOM 264 O3' A A 9 -10.604 4.077 -2.000 1.00 0.00 O ATOM 265 C2' A A 9 -9.216 5.688 -3.080 1.00 0.00 C ATOM 266 O2' A A 9 -10.452 6.056 -3.700 1.00 0.00 O ATOM 267 C1' A A 9 -8.509 6.911 -2.533 1.00 0.00 C ATOM 268 N9 A A 9 -7.086 6.642 -2.244 1.00 0.00 N ATOM 269 C8 A A 9 -6.519 6.192 -1.082 1.00 0.00 C ATOM 270 N7 A A 9 -5.228 6.022 -1.158 1.00 0.00 N ATOM 271 C5 A A 9 -4.923 6.391 -2.461 1.00 0.00 C ATOM 272 C6 A A 9 -3.717 6.440 -3.177 1.00 0.00 C ATOM 273 N6 A A 9 -2.537 6.103 -2.660 1.00 0.00 N ATOM 274 N1 A A 9 -3.765 6.854 -4.450 1.00 0.00 N ATOM 275 C2 A A 9 -4.935 7.194 -4.973 1.00 0.00 C ATOM 276 N3 A A 9 -6.133 7.192 -4.411 1.00 0.00 N ATOM 277 C4 A A 9 -6.048 6.772 -3.134 1.00 0.00 C ATOM 0 H5' A A 9 -10.259 5.335 1.193 1.00 0.00 H new ATOM 0 H5'' A A 9 -8.609 5.070 0.668 1.00 0.00 H new ATOM 0 H4' A A 9 -10.943 6.083 -0.768 1.00 0.00 H new ATOM 0 H3' A A 9 -8.615 4.309 -1.462 1.00 0.00 H new ATOM 0 H2' A A 9 -8.667 5.138 -3.844 1.00 0.00 H new ATOM 0 HO2' A A 9 -10.820 5.284 -4.179 1.00 0.00 H new ATOM 0 H1' A A 9 -8.531 7.731 -3.250 1.00 0.00 H new ATOM 0 H8 A A 9 -7.088 5.996 -0.185 1.00 0.00 H new ATOM 0 H61 A A 9 -1.695 6.160 -3.232 1.00 0.00 H new ATOM 0 H62 A A 9 -2.476 5.788 -1.692 1.00 0.00 H new ATOM 0 H2 A A 9 -4.906 7.518 -6.003 1.00 0.00 H new ATOM 289 P G A 10 -10.521 2.810 -2.999 1.00 0.00 P ATOM 290 OP1 G A 10 -11.884 2.252 -3.151 1.00 0.00 O ATOM 291 OP2 G A 10 -9.412 1.936 -2.553 1.00 0.00 O ATOM 292 O5' G A 10 -10.097 3.500 -4.392 1.00 0.00 O ATOM 293 C5' G A 10 -10.320 2.850 -5.648 1.00 0.00 C ATOM 294 C4' G A 10 -9.035 2.278 -6.246 1.00 0.00 C ATOM 295 O4' G A 10 -7.965 3.215 -6.069 1.00 0.00 O ATOM 296 C3' G A 10 -8.512 1.012 -5.596 1.00 0.00 C ATOM 297 O3' G A 10 -9.114 -0.098 -6.268 1.00 0.00 O ATOM 298 C2' G A 10 -7.040 1.037 -5.983 1.00 0.00 C ATOM 299 O2' G A 10 -6.860 0.589 -7.329 1.00 0.00 O ATOM 300 C1' G A 10 -6.717 2.525 -5.867 1.00 0.00 C ATOM 301 N9 G A 10 -6.193 2.865 -4.532 1.00 0.00 N ATOM 302 C8 G A 10 -6.896 3.115 -3.385 1.00 0.00 C ATOM 303 N7 G A 10 -6.143 3.333 -2.345 1.00 0.00 N ATOM 304 C5 G A 10 -4.848 3.222 -2.839 1.00 0.00 C ATOM 305 C6 G A 10 -3.602 3.358 -2.167 1.00 0.00 C ATOM 306 O6 G A 10 -3.400 3.597 -0.981 1.00 0.00 O ATOM 307 N1 G A 10 -2.533 3.174 -3.030 1.00 0.00 N ATOM 308 C2 G A 10 -2.644 2.889 -4.372 1.00 0.00 C ATOM 309 N2 G A 10 -1.508 2.744 -5.053 1.00 0.00 N ATOM 310 N3 G A 10 -3.808 2.756 -5.012 1.00 0.00 N ATOM 311 C4 G A 10 -4.865 2.936 -4.182 1.00 0.00 C ATOM 0 H5' G A 10 -10.758 3.561 -6.349 1.00 0.00 H new ATOM 0 H5'' G A 10 -11.044 2.046 -5.514 1.00 0.00 H new ATOM 0 H4' G A 10 -9.310 2.067 -7.279 1.00 0.00 H new ATOM 0 H3' G A 10 -8.699 0.942 -4.524 1.00 0.00 H new ATOM 0 H2' G A 10 -6.410 0.392 -5.371 1.00 0.00 H new ATOM 0 HO2' G A 10 -6.976 -0.383 -7.369 1.00 0.00 H new ATOM 0 H1' G A 10 -5.955 2.804 -6.594 1.00 0.00 H new ATOM 0 H8 G A 10 -7.975 3.130 -3.346 1.00 0.00 H new ATOM 0 H1 G A 10 -1.594 3.256 -2.641 1.00 0.00 H new ATOM 0 H21 G A 10 -1.535 2.532 -6.050 1.00 0.00 H new ATOM 0 H22 G A 10 -0.612 2.845 -4.577 1.00 0.00 H new ATOM 323 P G A 11 -8.867 -1.606 -5.751 1.00 0.00 P ATOM 324 OP1 G A 11 -9.852 -2.488 -6.415 1.00 0.00 O ATOM 325 OP2 G A 11 -8.780 -1.579 -4.273 1.00 0.00 O ATOM 326 O5' G A 11 -7.407 -1.946 -6.344 1.00 0.00 O ATOM 327 C5' G A 11 -6.286 -2.148 -5.473 1.00 0.00 C ATOM 328 C4' G A 11 -4.979 -1.726 -6.140 1.00 0.00 C ATOM 329 O4' G A 11 -4.548 -0.478 -5.589 1.00 0.00 O ATOM 330 C3' G A 11 -3.812 -2.668 -5.904 1.00 0.00 C ATOM 331 O3' G A 11 -3.776 -3.571 -7.017 1.00 0.00 O ATOM 332 C2' G A 11 -2.599 -1.755 -6.022 1.00 0.00 C ATOM 333 O2' G A 11 -2.244 -1.560 -7.393 1.00 0.00 O ATOM 334 C1' G A 11 -3.122 -0.452 -5.415 1.00 0.00 C ATOM 335 N9 G A 11 -2.824 -0.334 -3.971 1.00 0.00 N ATOM 336 C8 G A 11 -3.681 -0.036 -2.943 1.00 0.00 C ATOM 337 N7 G A 11 -3.104 0.021 -1.777 1.00 0.00 N ATOM 338 C5 G A 11 -1.770 -0.259 -2.048 1.00 0.00 C ATOM 339 C6 G A 11 -0.659 -0.338 -1.164 1.00 0.00 C ATOM 340 O6 G A 11 -0.642 -0.168 0.053 1.00 0.00 O ATOM 341 N1 G A 11 0.510 -0.645 -1.839 1.00 0.00 N ATOM 342 C2 G A 11 0.608 -0.854 -3.195 1.00 0.00 C ATOM 343 N2 G A 11 1.814 -1.154 -3.675 1.00 0.00 N ATOM 344 N3 G A 11 -0.429 -0.781 -4.035 1.00 0.00 N ATOM 345 C4 G A 11 -1.583 -0.481 -3.391 1.00 0.00 C ATOM 0 H5' G A 11 -6.229 -3.199 -5.189 1.00 0.00 H new ATOM 0 H5'' G A 11 -6.429 -1.577 -4.555 1.00 0.00 H new ATOM 0 H4' G A 11 -5.212 -1.699 -7.204 1.00 0.00 H new ATOM 0 H3' G A 11 -3.861 -3.218 -4.964 1.00 0.00 H new ATOM 0 H2' G A 11 -1.705 -2.145 -5.535 1.00 0.00 H new ATOM 0 HO2' G A 11 -2.515 -2.343 -7.916 1.00 0.00 H new ATOM 0 H1' G A 11 -2.641 0.394 -5.906 1.00 0.00 H new ATOM 0 H8 G A 11 -4.737 0.136 -3.087 1.00 0.00 H new ATOM 0 H1 G A 11 1.365 -0.722 -1.288 1.00 0.00 H new ATOM 0 H21 G A 11 1.939 -1.318 -4.674 1.00 0.00 H new ATOM 0 H22 G A 11 2.612 -1.220 -3.044 1.00 0.00 H new ATOM 357 P G A 12 -3.830 -5.164 -6.789 1.00 0.00 P ATOM 358 OP1 G A 12 -4.047 -5.811 -8.102 1.00 0.00 O ATOM 359 OP2 G A 12 -4.756 -5.444 -5.668 1.00 0.00 O ATOM 360 O5' G A 12 -2.333 -5.501 -6.298 1.00 0.00 O ATOM 361 C5' G A 12 -1.544 -6.492 -6.969 1.00 0.00 C ATOM 362 C4' G A 12 -0.053 -6.274 -6.741 1.00 0.00 C ATOM 363 O4' G A 12 0.157 -4.939 -6.272 1.00 0.00 O ATOM 364 C3' G A 12 0.555 -7.158 -5.663 1.00 0.00 C ATOM 365 O3' G A 12 1.121 -8.296 -6.320 1.00 0.00 O ATOM 366 C2' G A 12 1.708 -6.319 -5.135 1.00 0.00 C ATOM 367 O2' G A 12 2.855 -6.442 -5.980 1.00 0.00 O ATOM 368 C1' G A 12 1.130 -4.908 -5.219 1.00 0.00 C ATOM 369 N9 G A 12 0.456 -4.503 -3.966 1.00 0.00 N ATOM 370 C8 G A 12 -0.846 -4.114 -3.781 1.00 0.00 C ATOM 371 N7 G A 12 -1.133 -3.818 -2.546 1.00 0.00 N ATOM 372 C5 G A 12 0.060 -4.024 -1.864 1.00 0.00 C ATOM 373 C6 G A 12 0.361 -3.863 -0.484 1.00 0.00 C ATOM 374 O6 G A 12 -0.387 -3.498 0.421 1.00 0.00 O ATOM 375 N1 G A 12 1.681 -4.176 -0.210 1.00 0.00 N ATOM 376 C2 G A 12 2.604 -4.593 -1.142 1.00 0.00 C ATOM 377 N2 G A 12 3.837 -4.847 -0.705 1.00 0.00 N ATOM 378 N3 G A 12 2.333 -4.747 -2.440 1.00 0.00 N ATOM 379 C4 G A 12 1.044 -4.445 -2.726 1.00 0.00 C ATOM 0 H5' G A 12 -1.757 -6.464 -8.038 1.00 0.00 H new ATOM 0 H5'' G A 12 -1.825 -7.483 -6.614 1.00 0.00 H new ATOM 0 H4' G A 12 0.414 -6.500 -7.700 1.00 0.00 H new ATOM 0 H3' G A 12 -0.151 -7.474 -4.895 1.00 0.00 H new ATOM 0 H2' G A 12 2.044 -6.606 -4.139 1.00 0.00 H new ATOM 0 HO2' G A 12 2.739 -7.208 -6.580 1.00 0.00 H new ATOM 0 H1' G A 12 1.934 -4.194 -5.397 1.00 0.00 H new ATOM 0 H8 G A 12 -1.566 -4.058 -4.584 1.00 0.00 H new ATOM 0 H1 G A 12 1.994 -4.091 0.757 1.00 0.00 H new ATOM 0 H21 G A 12 4.556 -5.159 -1.358 1.00 0.00 H new ATOM 0 H22 G A 12 4.062 -4.730 0.283 1.00 0.00 H new ATOM 391 P U A 13 0.864 -9.784 -5.758 1.00 0.00 P ATOM 392 OP1 U A 13 1.119 -10.744 -6.856 1.00 0.00 O ATOM 393 OP2 U A 13 -0.437 -9.797 -5.054 1.00 0.00 O ATOM 394 O5' U A 13 2.033 -9.952 -4.660 1.00 0.00 O ATOM 395 C5' U A 13 3.410 -9.900 -5.045 1.00 0.00 C ATOM 396 C4' U A 13 4.296 -9.422 -3.899 1.00 0.00 C ATOM 397 O4' U A 13 3.814 -8.159 -3.424 1.00 0.00 O ATOM 398 C3' U A 13 4.285 -10.311 -2.668 1.00 0.00 C ATOM 399 O3' U A 13 5.378 -11.227 -2.798 1.00 0.00 O ATOM 400 C2' U A 13 4.633 -9.348 -1.544 1.00 0.00 C ATOM 401 O2' U A 13 6.046 -9.133 -1.478 1.00 0.00 O ATOM 402 C1' U A 13 3.919 -8.074 -1.991 1.00 0.00 C ATOM 403 N1 U A 13 2.564 -7.956 -1.408 1.00 0.00 N ATOM 404 C2 U A 13 2.470 -7.573 -0.081 1.00 0.00 C ATOM 405 O2 U A 13 3.458 -7.342 0.612 1.00 0.00 O ATOM 406 N3 U A 13 1.193 -7.468 0.430 1.00 0.00 N ATOM 407 C4 U A 13 0.018 -7.710 -0.256 1.00 0.00 C ATOM 408 O4 U A 13 -1.063 -7.583 0.314 1.00 0.00 O ATOM 409 C5 U A 13 0.195 -8.107 -1.634 1.00 0.00 C ATOM 410 C6 U A 13 1.442 -8.216 -2.155 1.00 0.00 C ATOM 0 H5' U A 13 3.525 -9.231 -5.898 1.00 0.00 H new ATOM 0 H5'' U A 13 3.735 -10.889 -5.369 1.00 0.00 H new ATOM 0 H4' U A 13 5.300 -9.403 -4.323 1.00 0.00 H new ATOM 0 H3' U A 13 3.351 -10.852 -2.516 1.00 0.00 H new ATOM 0 H2' U A 13 4.341 -9.700 -0.555 1.00 0.00 H new ATOM 0 HO2' U A 13 6.508 -9.839 -1.977 1.00 0.00 H new ATOM 0 H1' U A 13 4.479 -7.200 -1.659 1.00 0.00 H new ATOM 0 H3 U A 13 1.108 -7.185 1.406 1.00 0.00 H new ATOM 0 H5 U A 13 -0.667 -8.317 -2.250 1.00 0.00 H new ATOM 0 H6 U A 13 1.556 -8.516 -3.186 1.00 0.00 H new ATOM 421 P C A 14 5.397 -12.608 -1.968 1.00 0.00 P ATOM 422 OP1 C A 14 6.726 -13.235 -2.143 1.00 0.00 O ATOM 423 OP2 C A 14 4.173 -13.368 -2.305 1.00 0.00 O ATOM 424 O5' C A 14 5.272 -12.104 -0.442 1.00 0.00 O ATOM 425 C5' C A 14 6.425 -11.663 0.283 1.00 0.00 C ATOM 426 C4' C A 14 6.183 -11.688 1.790 1.00 0.00 C ATOM 427 O4' C A 14 5.329 -10.600 2.145 1.00 0.00 O ATOM 428 C3' C A 14 5.453 -12.922 2.297 1.00 0.00 C ATOM 429 O3' C A 14 6.379 -13.977 2.570 1.00 0.00 O ATOM 430 C2' C A 14 4.827 -12.409 3.588 1.00 0.00 C ATOM 431 O2' C A 14 5.775 -12.450 4.659 1.00 0.00 O ATOM 432 C1' C A 14 4.475 -10.964 3.239 1.00 0.00 C ATOM 433 N1 C A 14 3.065 -10.820 2.819 1.00 0.00 N ATOM 434 C2 C A 14 2.130 -10.491 3.792 1.00 0.00 C ATOM 435 O2 C A 14 2.481 -10.319 4.958 1.00 0.00 O ATOM 436 N3 C A 14 0.825 -10.362 3.425 1.00 0.00 N ATOM 437 C4 C A 14 0.450 -10.551 2.153 1.00 0.00 C ATOM 438 N4 C A 14 -0.840 -10.408 1.856 1.00 0.00 N ATOM 439 C5 C A 14 1.408 -10.891 1.148 1.00 0.00 C ATOM 440 C6 C A 14 2.694 -11.014 1.520 1.00 0.00 C ATOM 0 H5' C A 14 6.686 -10.651 -0.028 1.00 0.00 H new ATOM 0 H5'' C A 14 7.275 -12.301 0.039 1.00 0.00 H new ATOM 0 H4' C A 14 7.180 -11.652 2.229 1.00 0.00 H new ATOM 0 H3' C A 14 4.733 -13.334 1.589 1.00 0.00 H new ATOM 0 H2' C A 14 3.972 -12.998 3.920 1.00 0.00 H new ATOM 0 HO2' C A 14 6.474 -13.106 4.453 1.00 0.00 H new ATOM 0 HO3' C A 14 5.893 -14.763 2.897 1.00 0.00 H new ATOM 0 H1' C A 14 4.612 -10.328 4.114 1.00 0.00 H new ATOM 0 H41 C A 14 -1.161 -10.544 0.897 1.00 0.00 H new ATOM 0 H42 C A 14 -1.507 -10.162 2.587 1.00 0.00 H new ATOM 0 H5 C A 14 1.108 -11.044 0.122 1.00 0.00 H new ATOM 0 H6 C A 14 3.441 -11.269 0.783 1.00 0.00 H new TER 453 C A 14