USER MOD reduce.3.24.130724 H: found=0, std=0, add=172, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 172 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 42 G O2' : rot -1:sc= -0.863 USER MOD Single : A 42 G O5' : rot 180:sc=-0.000638 USER MOD Single : A 43 A O2' : rot 180:sc= -0.268 USER MOD Single : A 44 U O2' : rot -10:sc= -0.114 USER MOD Single : A 45 C O2' : rot -3:sc= -0.652 USER MOD Single : A 46 U O2' : rot 180:sc= -0.131 USER MOD Single : A 47 C O2' : rot -177:sc= -2.49! USER MOD Single : A 48 U O2' : rot -117:sc= -6.75! USER MOD Single : A 49 U O2' : rot -51:sc= 0.583 USER MOD Single : A 50 G O2' : rot -3:sc= -5.11! USER MOD Single : A 51 U O2' : rot 180:sc= -4.2! USER MOD Single : A 52 A O2' : rot 1:sc= -0.68 USER MOD Single : A 53 G O2' : rot 180:sc= -0.293 USER MOD Single : A 54 A O2' : rot -0:sc= -1.77! USER MOD Single : A 55 U O2' : rot 1:sc= -1.08 USER MOD Single : A 56 C O2' : rot 180:sc= -1.8! USER MOD Single : A 57 A O2' : rot -21:sc= 0.22 USER MOD Single : A 57 A O3' : rot 180:sc= 0.218 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 42 7.201 -4.499 9.248 1.00 0.00 O ATOM 2 C5' G A 42 8.042 -3.965 10.272 1.00 0.00 C ATOM 3 C4' G A 42 8.735 -2.689 9.814 1.00 0.00 C ATOM 4 O4' G A 42 9.673 -2.958 8.776 1.00 0.00 O ATOM 5 C3' G A 42 7.803 -1.624 9.268 1.00 0.00 C ATOM 6 O3' G A 42 7.226 -0.873 10.341 1.00 0.00 O ATOM 7 C2' G A 42 8.756 -0.778 8.459 1.00 0.00 C ATOM 8 O2' G A 42 9.468 0.151 9.284 1.00 0.00 O ATOM 9 C1' G A 42 9.683 -1.837 7.876 1.00 0.00 C ATOM 10 N9 G A 42 9.260 -2.339 6.560 1.00 0.00 N ATOM 11 C8 G A 42 8.538 -3.465 6.277 1.00 0.00 C ATOM 12 N7 G A 42 8.306 -3.639 5.007 1.00 0.00 N ATOM 13 C5 G A 42 8.921 -2.546 4.402 1.00 0.00 C ATOM 14 C6 G A 42 9.001 -2.193 3.028 1.00 0.00 C ATOM 15 O6 G A 42 8.541 -2.797 2.063 1.00 0.00 O ATOM 16 N1 G A 42 9.711 -1.008 2.844 1.00 0.00 N ATOM 17 C2 G A 42 10.274 -0.262 3.864 1.00 0.00 C ATOM 18 N2 G A 42 10.923 0.845 3.505 1.00 0.00 N ATOM 19 N3 G A 42 10.197 -0.597 5.155 1.00 0.00 N ATOM 20 C4 G A 42 9.508 -1.744 5.348 1.00 0.00 C ATOM 0 H5' G A 42 8.790 -4.706 10.553 1.00 0.00 H new ATOM 0 H5'' G A 42 7.448 -3.758 11.162 1.00 0.00 H new ATOM 0 H4' G A 42 9.209 -2.315 10.722 1.00 0.00 H new ATOM 0 H3' G A 42 6.960 -2.007 8.694 1.00 0.00 H new ATOM 0 H2' G A 42 8.269 -0.154 7.710 1.00 0.00 H new ATOM 0 HO2' G A 42 9.176 0.053 10.214 1.00 0.00 H new ATOM 0 HO5' G A 42 6.772 -5.318 9.572 1.00 0.00 H new ATOM 0 H1' G A 42 10.662 -1.375 7.752 1.00 0.00 H new ATOM 0 H8 G A 42 8.191 -4.149 7.038 1.00 0.00 H new ATOM 0 H1 G A 42 9.824 -0.666 1.889 1.00 0.00 H new ATOM 0 H21 G A 42 11.358 1.434 4.215 1.00 0.00 H new ATOM 0 H22 G A 42 10.985 1.103 2.520 1.00 0.00 H new ATOM 33 P A A 43 5.800 -0.141 10.167 1.00 0.00 P ATOM 34 OP1 A A 43 5.414 0.437 11.474 1.00 0.00 O ATOM 35 OP2 A A 43 4.883 -1.072 9.473 1.00 0.00 O ATOM 36 O5' A A 43 6.143 1.071 9.162 1.00 0.00 O ATOM 37 C5' A A 43 7.028 2.113 9.575 1.00 0.00 C ATOM 38 C4' A A 43 7.340 3.089 8.441 1.00 0.00 C ATOM 39 O4' A A 43 8.070 2.435 7.395 1.00 0.00 O ATOM 40 C3' A A 43 6.127 3.696 7.759 1.00 0.00 C ATOM 41 O3' A A 43 5.623 4.797 8.530 1.00 0.00 O ATOM 42 C2' A A 43 6.732 4.167 6.457 1.00 0.00 C ATOM 43 O2' A A 43 7.446 5.399 6.620 1.00 0.00 O ATOM 44 C1' A A 43 7.669 3.012 6.134 1.00 0.00 C ATOM 45 N9 A A 43 7.028 1.953 5.329 1.00 0.00 N ATOM 46 C8 A A 43 6.431 0.790 5.748 1.00 0.00 C ATOM 47 N7 A A 43 5.921 0.080 4.780 1.00 0.00 N ATOM 48 C5 A A 43 6.199 0.824 3.639 1.00 0.00 C ATOM 49 C6 A A 43 5.919 0.619 2.277 1.00 0.00 C ATOM 50 N6 A A 43 5.268 -0.451 1.812 1.00 0.00 N ATOM 51 N1 A A 43 6.335 1.561 1.419 1.00 0.00 N ATOM 52 C2 A A 43 6.986 2.621 1.879 1.00 0.00 C ATOM 53 N3 A A 43 7.309 2.926 3.124 1.00 0.00 N ATOM 54 C4 A A 43 6.876 1.966 3.966 1.00 0.00 C ATOM 0 H5' A A 43 7.957 1.675 9.941 1.00 0.00 H new ATOM 0 H5'' A A 43 6.582 2.657 10.408 1.00 0.00 H new ATOM 0 H4' A A 43 7.902 3.880 8.938 1.00 0.00 H new ATOM 0 H3' A A 43 5.282 3.019 7.635 1.00 0.00 H new ATOM 0 H2' A A 43 6.002 4.383 5.676 1.00 0.00 H new ATOM 0 HO2' A A 43 7.825 5.674 5.759 1.00 0.00 H new ATOM 0 H1' A A 43 8.504 3.399 5.550 1.00 0.00 H new ATOM 0 H8 A A 43 6.388 0.490 6.785 1.00 0.00 H new ATOM 0 H61 A A 43 5.093 -0.547 0.812 1.00 0.00 H new ATOM 0 H62 A A 43 4.946 -1.172 2.457 1.00 0.00 H new ATOM 0 H2 A A 43 7.296 3.336 1.131 1.00 0.00 H new ATOM 66 P U A 44 4.067 5.223 8.451 1.00 0.00 P ATOM 67 OP1 U A 44 3.827 6.278 9.461 1.00 0.00 O ATOM 68 OP2 U A 44 3.250 3.989 8.468 1.00 0.00 O ATOM 69 O5' U A 44 3.937 5.890 6.988 1.00 0.00 O ATOM 70 C5' U A 44 4.630 7.107 6.697 1.00 0.00 C ATOM 71 C4' U A 44 4.507 7.511 5.227 1.00 0.00 C ATOM 72 O4' U A 44 5.164 6.558 4.392 1.00 0.00 O ATOM 73 C3' U A 44 3.090 7.595 4.688 1.00 0.00 C ATOM 74 O3' U A 44 2.486 8.847 5.045 1.00 0.00 O ATOM 75 C2' U A 44 3.355 7.529 3.196 1.00 0.00 C ATOM 76 O2' U A 44 3.789 8.793 2.681 1.00 0.00 O ATOM 77 C1' U A 44 4.463 6.487 3.133 1.00 0.00 C ATOM 78 N1 U A 44 3.957 5.112 2.975 1.00 0.00 N ATOM 79 C2 U A 44 3.683 4.680 1.695 1.00 0.00 C ATOM 80 O2 U A 44 3.863 5.394 0.711 1.00 0.00 O ATOM 81 N3 U A 44 3.192 3.396 1.581 1.00 0.00 N ATOM 82 C4 U A 44 2.954 2.515 2.619 1.00 0.00 C ATOM 83 O4 U A 44 2.522 1.388 2.396 1.00 0.00 O ATOM 84 C5 U A 44 3.264 3.050 3.925 1.00 0.00 C ATOM 85 C6 U A 44 3.744 4.309 4.062 1.00 0.00 C ATOM 0 H5' U A 44 5.683 6.992 6.952 1.00 0.00 H new ATOM 0 H5'' U A 44 4.235 7.906 7.325 1.00 0.00 H new ATOM 0 H4' U A 44 4.952 8.506 5.203 1.00 0.00 H new ATOM 0 H3' U A 44 2.410 6.830 5.064 1.00 0.00 H new ATOM 0 H2' U A 44 2.477 7.281 2.599 1.00 0.00 H new ATOM 0 HO2' U A 44 3.673 9.483 3.367 1.00 0.00 H new ATOM 0 H1' U A 44 5.091 6.701 2.268 1.00 0.00 H new ATOM 0 H3 U A 44 2.984 3.064 0.639 1.00 0.00 H new ATOM 0 H5 U A 44 3.111 2.439 4.802 1.00 0.00 H new ATOM 0 H6 U A 44 3.963 4.687 5.050 1.00 0.00 H new ATOM 96 P C A 45 0.883 8.969 5.209 1.00 0.00 P ATOM 97 OP1 C A 45 0.573 10.328 5.709 1.00 0.00 O ATOM 98 OP2 C A 45 0.404 7.784 5.956 1.00 0.00 O ATOM 99 O5' C A 45 0.348 8.858 3.693 1.00 0.00 O ATOM 100 C5' C A 45 0.657 9.878 2.741 1.00 0.00 C ATOM 101 C4' C A 45 0.211 9.498 1.329 1.00 0.00 C ATOM 102 O4' C A 45 0.956 8.377 0.859 1.00 0.00 O ATOM 103 C3' C A 45 -1.245 9.092 1.181 1.00 0.00 C ATOM 104 O3' C A 45 -2.085 10.244 1.083 1.00 0.00 O ATOM 105 C2' C A 45 -1.210 8.347 -0.135 1.00 0.00 C ATOM 106 O2' C A 45 -1.229 9.245 -1.251 1.00 0.00 O ATOM 107 C1' C A 45 0.119 7.610 -0.030 1.00 0.00 C ATOM 108 N1 C A 45 -0.020 6.258 0.536 1.00 0.00 N ATOM 109 C2 C A 45 -0.365 5.242 -0.333 1.00 0.00 C ATOM 110 O2 C A 45 -0.551 5.491 -1.526 1.00 0.00 O ATOM 111 N3 C A 45 -0.501 3.983 0.172 1.00 0.00 N ATOM 112 C4 C A 45 -0.302 3.735 1.471 1.00 0.00 C ATOM 113 N4 C A 45 -0.438 2.489 1.927 1.00 0.00 N ATOM 114 C5 C A 45 0.053 4.787 2.372 1.00 0.00 C ATOM 115 C6 C A 45 0.175 6.028 1.865 1.00 0.00 C ATOM 0 H5' C A 45 1.731 10.063 2.744 1.00 0.00 H new ATOM 0 H5'' C A 45 0.172 10.808 3.036 1.00 0.00 H new ATOM 0 H4' C A 45 0.375 10.415 0.763 1.00 0.00 H new ATOM 0 H3' C A 45 -1.637 8.514 2.018 1.00 0.00 H new ATOM 0 H2' C A 45 -2.068 7.695 -0.299 1.00 0.00 H new ATOM 0 HO2' C A 45 -1.303 10.167 -0.928 1.00 0.00 H new ATOM 0 H1' C A 45 0.534 7.505 -1.032 1.00 0.00 H new ATOM 0 H41 C A 45 -0.289 2.289 2.916 1.00 0.00 H new ATOM 0 H42 C A 45 -0.691 1.736 1.287 1.00 0.00 H new ATOM 0 H5 C A 45 0.217 4.593 3.422 1.00 0.00 H new ATOM 0 H6 C A 45 0.430 6.850 2.518 1.00 0.00 H new ATOM 127 P U A 46 -3.630 10.183 1.541 1.00 0.00 P ATOM 128 OP1 U A 46 -4.195 11.547 1.444 1.00 0.00 O ATOM 129 OP2 U A 46 -3.701 9.446 2.823 1.00 0.00 O ATOM 130 O5' U A 46 -4.316 9.271 0.398 1.00 0.00 O ATOM 131 C5' U A 46 -4.374 9.734 -0.953 1.00 0.00 C ATOM 132 C4' U A 46 -4.956 8.687 -1.909 1.00 0.00 C ATOM 133 O4' U A 46 -4.098 7.543 -1.990 1.00 0.00 O ATOM 134 C3' U A 46 -6.307 8.131 -1.504 1.00 0.00 C ATOM 135 O3' U A 46 -7.351 9.037 -1.891 1.00 0.00 O ATOM 136 C2' U A 46 -6.350 6.864 -2.337 1.00 0.00 C ATOM 137 O2' U A 46 -6.695 7.140 -3.700 1.00 0.00 O ATOM 138 C1' U A 46 -4.914 6.371 -2.211 1.00 0.00 C ATOM 139 N1 U A 46 -4.719 5.456 -1.070 1.00 0.00 N ATOM 140 C2 U A 46 -5.011 4.119 -1.265 1.00 0.00 C ATOM 141 O2 U A 46 -5.377 3.679 -2.351 1.00 0.00 O ATOM 142 N3 U A 46 -4.866 3.299 -0.164 1.00 0.00 N ATOM 143 C4 U A 46 -4.461 3.691 1.098 1.00 0.00 C ATOM 144 O4 U A 46 -4.371 2.871 2.006 1.00 0.00 O ATOM 145 C5 U A 46 -4.177 5.102 1.213 1.00 0.00 C ATOM 146 C6 U A 46 -4.313 5.927 0.148 1.00 0.00 C ATOM 0 H5' U A 46 -3.372 10.006 -1.284 1.00 0.00 H new ATOM 0 H5'' U A 46 -4.980 10.639 -0.998 1.00 0.00 H new ATOM 0 H4' U A 46 -5.055 9.230 -2.849 1.00 0.00 H new ATOM 0 H3' U A 46 -6.440 7.971 -0.434 1.00 0.00 H new ATOM 0 H2' U A 46 -7.098 6.142 -2.010 1.00 0.00 H new ATOM 0 HO2' U A 46 -6.712 6.303 -4.209 1.00 0.00 H new ATOM 0 H1' U A 46 -4.651 5.820 -3.114 1.00 0.00 H new ATOM 0 H3 U A 46 -5.078 2.310 -0.294 1.00 0.00 H new ATOM 0 H5 U A 46 -3.852 5.505 2.161 1.00 0.00 H new ATOM 0 H6 U A 46 -4.096 6.979 0.263 1.00 0.00 H new ATOM 157 P C A 47 -8.742 9.095 -1.070 1.00 0.00 P ATOM 158 OP1 C A 47 -9.543 10.219 -1.606 1.00 0.00 O ATOM 159 OP2 C A 47 -8.425 9.045 0.374 1.00 0.00 O ATOM 160 O5' C A 47 -9.482 7.720 -1.468 1.00 0.00 O ATOM 161 C5' C A 47 -9.913 7.507 -2.813 1.00 0.00 C ATOM 162 C4' C A 47 -10.457 6.096 -3.035 1.00 0.00 C ATOM 163 O4' C A 47 -9.423 5.139 -2.894 1.00 0.00 O ATOM 164 C3' C A 47 -11.550 5.650 -2.085 1.00 0.00 C ATOM 165 O3' C A 47 -12.809 6.176 -2.528 1.00 0.00 O ATOM 166 C2' C A 47 -11.495 4.141 -2.248 1.00 0.00 C ATOM 167 O2' C A 47 -12.259 3.721 -3.381 1.00 0.00 O ATOM 168 C1' C A 47 -9.996 3.891 -2.463 1.00 0.00 C ATOM 169 N1 C A 47 -9.275 3.502 -1.245 1.00 0.00 N ATOM 170 C2 C A 47 -9.261 2.165 -0.907 1.00 0.00 C ATOM 171 O2 C A 47 -9.849 1.352 -1.616 1.00 0.00 O ATOM 172 N3 C A 47 -8.584 1.793 0.217 1.00 0.00 N ATOM 173 C4 C A 47 -7.956 2.706 0.973 1.00 0.00 C ATOM 174 N4 C A 47 -7.299 2.318 2.063 1.00 0.00 N ATOM 175 C5 C A 47 -7.982 4.092 0.624 1.00 0.00 C ATOM 176 C6 C A 47 -8.653 4.441 -0.486 1.00 0.00 C ATOM 0 H5' C A 47 -9.078 7.682 -3.491 1.00 0.00 H new ATOM 0 H5'' C A 47 -10.685 8.235 -3.064 1.00 0.00 H new ATOM 0 H4' C A 47 -10.877 6.150 -4.039 1.00 0.00 H new ATOM 0 H3' C A 47 -11.431 5.979 -1.053 1.00 0.00 H new ATOM 0 H2' C A 47 -11.911 3.591 -1.403 1.00 0.00 H new ATOM 0 HO2' C A 47 -12.243 2.743 -3.442 1.00 0.00 H new ATOM 0 H1' C A 47 -9.903 3.074 -3.179 1.00 0.00 H new ATOM 0 H41 C A 47 -6.819 3.007 2.642 1.00 0.00 H new ATOM 0 H42 C A 47 -7.275 1.331 2.320 1.00 0.00 H new ATOM 0 H5 C A 47 -7.480 4.831 1.231 1.00 0.00 H new ATOM 0 H6 C A 47 -8.698 5.480 -0.778 1.00 0.00 H new ATOM 188 P U A 48 -14.016 6.450 -1.494 1.00 0.00 P ATOM 189 OP1 U A 48 -15.092 7.158 -2.223 1.00 0.00 O ATOM 190 OP2 U A 48 -13.443 7.050 -0.269 1.00 0.00 O ATOM 191 O5' U A 48 -14.551 4.973 -1.124 1.00 0.00 O ATOM 192 C5' U A 48 -15.960 4.756 -0.964 1.00 0.00 C ATOM 193 C4' U A 48 -16.309 3.291 -0.713 1.00 0.00 C ATOM 194 O4' U A 48 -16.082 2.513 -1.901 1.00 0.00 O ATOM 195 C3' U A 48 -15.501 2.649 0.421 1.00 0.00 C ATOM 196 O3' U A 48 -16.370 1.779 1.167 1.00 0.00 O ATOM 197 C2' U A 48 -14.492 1.814 -0.358 1.00 0.00 C ATOM 198 O2' U A 48 -13.999 0.710 0.401 1.00 0.00 O ATOM 199 C1' U A 48 -15.340 1.360 -1.523 1.00 0.00 C ATOM 200 N1 U A 48 -14.594 0.862 -2.707 1.00 0.00 N ATOM 201 C2 U A 48 -14.879 -0.419 -3.156 1.00 0.00 C ATOM 202 O2 U A 48 -15.709 -1.135 -2.601 1.00 0.00 O ATOM 203 N3 U A 48 -14.174 -0.848 -4.265 1.00 0.00 N ATOM 204 C4 U A 48 -13.223 -0.121 -4.958 1.00 0.00 C ATOM 205 O4 U A 48 -12.656 -0.604 -5.936 1.00 0.00 O ATOM 206 C5 U A 48 -12.990 1.201 -4.424 1.00 0.00 C ATOM 207 C6 U A 48 -13.669 1.644 -3.337 1.00 0.00 C ATOM 0 H5' U A 48 -16.480 5.100 -1.858 1.00 0.00 H new ATOM 0 H5'' U A 48 -16.324 5.359 -0.132 1.00 0.00 H new ATOM 0 H4' U A 48 -17.360 3.291 -0.424 1.00 0.00 H new ATOM 0 H3' U A 48 -15.052 3.352 1.122 1.00 0.00 H new ATOM 0 H2' U A 48 -13.588 2.355 -0.638 1.00 0.00 H new ATOM 0 HO2' U A 48 -13.035 0.814 0.541 1.00 0.00 H new ATOM 0 H1' U A 48 -15.936 0.506 -1.202 1.00 0.00 H new ATOM 0 H3 U A 48 -14.374 -1.789 -4.604 1.00 0.00 H new ATOM 0 H5 U A 48 -12.264 1.846 -4.897 1.00 0.00 H new ATOM 0 H6 U A 48 -13.474 2.638 -2.961 1.00 0.00 H new ATOM 218 P U A 49 -16.211 1.495 2.757 1.00 0.00 P ATOM 219 OP1 U A 49 -17.358 0.665 3.187 1.00 0.00 O ATOM 220 OP2 U A 49 -15.956 2.790 3.426 1.00 0.00 O ATOM 221 O5' U A 49 -14.878 0.601 2.887 1.00 0.00 O ATOM 222 C5' U A 49 -14.798 -0.693 2.297 1.00 0.00 C ATOM 223 C4' U A 49 -13.423 -1.324 2.516 1.00 0.00 C ATOM 224 O4' U A 49 -12.444 -0.500 1.860 1.00 0.00 O ATOM 225 C3' U A 49 -12.996 -1.431 3.983 1.00 0.00 C ATOM 226 O3' U A 49 -12.326 -2.681 4.162 1.00 0.00 O ATOM 227 C2' U A 49 -12.007 -0.304 4.199 1.00 0.00 C ATOM 228 O2' U A 49 -10.961 -0.694 5.095 1.00 0.00 O ATOM 229 C1' U A 49 -11.468 -0.029 2.809 1.00 0.00 C ATOM 230 N1 U A 49 -11.224 1.409 2.573 1.00 0.00 N ATOM 231 C2 U A 49 -10.013 1.926 2.997 1.00 0.00 C ATOM 232 O2 U A 49 -9.145 1.220 3.506 1.00 0.00 O ATOM 233 N3 U A 49 -9.833 3.285 2.813 1.00 0.00 N ATOM 234 C4 U A 49 -10.743 4.160 2.247 1.00 0.00 C ATOM 235 O4 U A 49 -10.476 5.354 2.131 1.00 0.00 O ATOM 236 C5 U A 49 -11.978 3.534 1.832 1.00 0.00 C ATOM 237 C6 U A 49 -12.178 2.206 2.006 1.00 0.00 C ATOM 0 H5' U A 49 -15.000 -0.620 1.228 1.00 0.00 H new ATOM 0 H5'' U A 49 -15.567 -1.337 2.724 1.00 0.00 H new ATOM 0 H4' U A 49 -13.490 -2.337 2.120 1.00 0.00 H new ATOM 0 H3' U A 49 -13.838 -1.370 4.672 1.00 0.00 H new ATOM 0 H2' U A 49 -12.463 0.575 4.655 1.00 0.00 H new ATOM 0 HO2' U A 49 -11.352 -1.072 5.910 1.00 0.00 H new ATOM 0 H1' U A 49 -10.512 -0.541 2.701 1.00 0.00 H new ATOM 0 H3 U A 49 -8.945 3.679 3.124 1.00 0.00 H new ATOM 0 H5 U A 49 -12.752 4.134 1.377 1.00 0.00 H new ATOM 0 H6 U A 49 -13.113 1.767 1.689 1.00 0.00 H new ATOM 248 P G A 50 -12.254 -3.414 5.593 1.00 0.00 P ATOM 249 OP1 G A 50 -13.635 -3.636 6.077 1.00 0.00 O ATOM 250 OP2 G A 50 -11.276 -2.694 6.439 1.00 0.00 O ATOM 251 O5' G A 50 -11.622 -4.836 5.183 1.00 0.00 O ATOM 252 C5' G A 50 -12.384 -5.756 4.396 1.00 0.00 C ATOM 253 C4' G A 50 -11.525 -6.445 3.348 1.00 0.00 C ATOM 254 O4' G A 50 -11.110 -5.516 2.352 1.00 0.00 O ATOM 255 C3' G A 50 -10.256 -7.078 3.866 1.00 0.00 C ATOM 256 O3' G A 50 -10.499 -8.389 4.347 1.00 0.00 O ATOM 257 C2' G A 50 -9.369 -7.106 2.652 1.00 0.00 C ATOM 258 O2' G A 50 -9.665 -8.226 1.809 1.00 0.00 O ATOM 259 C1' G A 50 -9.743 -5.792 1.988 1.00 0.00 C ATOM 260 N9 G A 50 -8.946 -4.636 2.427 1.00 0.00 N ATOM 261 C8 G A 50 -8.124 -4.506 3.517 1.00 0.00 C ATOM 262 N7 G A 50 -7.551 -3.341 3.609 1.00 0.00 N ATOM 263 C5 G A 50 -8.023 -2.651 2.500 1.00 0.00 C ATOM 264 C6 G A 50 -7.754 -1.327 2.073 1.00 0.00 C ATOM 265 O6 G A 50 -7.010 -0.501 2.596 1.00 0.00 O ATOM 266 N1 G A 50 -8.449 -1.017 0.907 1.00 0.00 N ATOM 267 C2 G A 50 -9.287 -1.887 0.233 1.00 0.00 C ATOM 268 N2 G A 50 -9.863 -1.430 -0.876 1.00 0.00 N ATOM 269 N3 G A 50 -9.533 -3.131 0.636 1.00 0.00 N ATOM 270 C4 G A 50 -8.873 -3.440 1.771 1.00 0.00 C ATOM 0 H5' G A 50 -13.201 -5.226 3.906 1.00 0.00 H new ATOM 0 H5'' G A 50 -12.835 -6.505 5.047 1.00 0.00 H new ATOM 0 H4' G A 50 -12.175 -7.232 2.966 1.00 0.00 H new ATOM 0 H3' G A 50 -9.819 -6.536 4.705 1.00 0.00 H new ATOM 0 H2' G A 50 -8.307 -7.210 2.874 1.00 0.00 H new ATOM 0 HO2' G A 50 -10.365 -8.772 2.224 1.00 0.00 H new ATOM 0 H1' G A 50 -9.569 -5.913 0.919 1.00 0.00 H new ATOM 0 H8 G A 50 -7.966 -5.298 4.234 1.00 0.00 H new ATOM 0 H1 G A 50 -8.332 -0.080 0.522 1.00 0.00 H new ATOM 0 H21 G A 50 -10.490 -2.032 -1.410 1.00 0.00 H new ATOM 0 H22 G A 50 -9.678 -0.478 -1.192 1.00 0.00 H new ATOM 282 P U A 51 -9.307 -9.145 5.092 1.00 0.00 P ATOM 283 OP1 U A 51 -9.824 -10.417 5.646 1.00 0.00 O ATOM 284 OP2 U A 51 -8.605 -8.178 5.966 1.00 0.00 O ATOM 285 O5' U A 51 -8.363 -9.477 3.829 1.00 0.00 O ATOM 286 C5' U A 51 -6.984 -9.781 3.991 1.00 0.00 C ATOM 287 C4' U A 51 -6.364 -10.254 2.680 1.00 0.00 C ATOM 288 O4' U A 51 -6.981 -11.484 2.292 1.00 0.00 O ATOM 289 C3' U A 51 -6.506 -9.292 1.503 1.00 0.00 C ATOM 290 O3' U A 51 -5.301 -9.374 0.742 1.00 0.00 O ATOM 291 C2' U A 51 -7.672 -9.826 0.689 1.00 0.00 C ATOM 292 O2' U A 51 -7.418 -9.700 -0.714 1.00 0.00 O ATOM 293 C1' U A 51 -7.760 -11.295 1.101 1.00 0.00 C ATOM 294 N1 U A 51 -9.137 -11.782 1.385 1.00 0.00 N ATOM 295 C2 U A 51 -9.535 -12.968 0.785 1.00 0.00 C ATOM 296 O2 U A 51 -8.795 -13.598 0.033 1.00 0.00 O ATOM 297 N3 U A 51 -10.813 -13.403 1.081 1.00 0.00 N ATOM 298 C4 U A 51 -11.720 -12.771 1.911 1.00 0.00 C ATOM 299 O4 U A 51 -12.836 -13.250 2.101 1.00 0.00 O ATOM 300 C5 U A 51 -11.227 -11.545 2.496 1.00 0.00 C ATOM 301 C6 U A 51 -9.977 -11.095 2.225 1.00 0.00 C ATOM 0 H5' U A 51 -6.866 -10.553 4.751 1.00 0.00 H new ATOM 0 H5'' U A 51 -6.454 -8.898 4.349 1.00 0.00 H new ATOM 0 H4' U A 51 -5.298 -10.345 2.889 1.00 0.00 H new ATOM 0 H3' U A 51 -6.675 -8.257 1.800 1.00 0.00 H new ATOM 0 H2' U A 51 -8.598 -9.281 0.871 1.00 0.00 H new ATOM 0 HO2' U A 51 -8.182 -10.052 -1.218 1.00 0.00 H new ATOM 0 H1' U A 51 -7.391 -11.865 0.249 1.00 0.00 H new ATOM 0 H3 U A 51 -11.116 -14.274 0.645 1.00 0.00 H new ATOM 0 H5 U A 51 -11.864 -10.979 3.159 1.00 0.00 H new ATOM 0 H6 U A 51 -9.635 -10.177 2.680 1.00 0.00 H new ATOM 312 P A A 52 -4.233 -8.173 0.646 1.00 0.00 P ATOM 313 OP1 A A 52 -3.015 -8.690 -0.018 1.00 0.00 O ATOM 314 OP2 A A 52 -4.131 -7.541 1.981 1.00 0.00 O ATOM 315 O5' A A 52 -4.941 -7.130 -0.347 1.00 0.00 O ATOM 316 C5' A A 52 -5.752 -7.603 -1.420 1.00 0.00 C ATOM 317 C4' A A 52 -6.138 -6.481 -2.372 1.00 0.00 C ATOM 318 O4' A A 52 -6.960 -5.492 -1.735 1.00 0.00 O ATOM 319 C3' A A 52 -4.940 -5.726 -2.916 1.00 0.00 C ATOM 320 O3' A A 52 -4.389 -6.455 -4.020 1.00 0.00 O ATOM 321 C2' A A 52 -5.572 -4.428 -3.366 1.00 0.00 C ATOM 322 O2' A A 52 -6.218 -4.568 -4.636 1.00 0.00 O ATOM 323 C1' A A 52 -6.579 -4.194 -2.246 1.00 0.00 C ATOM 324 N9 A A 52 -6.043 -3.419 -1.117 1.00 0.00 N ATOM 325 C8 A A 52 -5.625 -3.865 0.111 1.00 0.00 C ATOM 326 N7 A A 52 -5.226 -2.913 0.909 1.00 0.00 N ATOM 327 C5 A A 52 -5.393 -1.755 0.154 1.00 0.00 C ATOM 328 C6 A A 52 -5.148 -0.401 0.426 1.00 0.00 C ATOM 329 N6 A A 52 -4.663 0.030 1.587 1.00 0.00 N ATOM 330 N1 A A 52 -5.420 0.486 -0.546 1.00 0.00 N ATOM 331 C2 A A 52 -5.904 0.047 -1.703 1.00 0.00 C ATOM 332 N3 A A 52 -6.178 -1.193 -2.077 1.00 0.00 N ATOM 333 C4 A A 52 -5.892 -2.056 -1.080 1.00 0.00 C ATOM 0 H5' A A 52 -6.654 -8.065 -1.018 1.00 0.00 H new ATOM 0 H5'' A A 52 -5.215 -8.377 -1.968 1.00 0.00 H new ATOM 0 H4' A A 52 -6.670 -6.989 -3.176 1.00 0.00 H new ATOM 0 H3' A A 52 -4.122 -5.579 -2.211 1.00 0.00 H new ATOM 0 H2' A A 52 -4.866 -3.611 -3.514 1.00 0.00 H new ATOM 0 HO2' A A 52 -6.128 -5.492 -4.949 1.00 0.00 H new ATOM 0 H1' A A 52 -7.408 -3.624 -2.666 1.00 0.00 H new ATOM 0 H8 A A 52 -5.626 -4.908 0.391 1.00 0.00 H new ATOM 0 H61 A A 52 -4.503 1.026 1.734 1.00 0.00 H new ATOM 0 H62 A A 52 -4.451 -0.636 2.330 1.00 0.00 H new ATOM 0 H2 A A 52 -6.102 0.809 -2.442 1.00 0.00 H new ATOM 345 P G A 53 -2.833 -6.331 -4.419 1.00 0.00 P ATOM 346 OP1 G A 53 -2.554 -7.290 -5.511 1.00 0.00 O ATOM 347 OP2 G A 53 -2.030 -6.372 -3.176 1.00 0.00 O ATOM 348 O5' G A 53 -2.751 -4.846 -5.020 1.00 0.00 O ATOM 349 C5' G A 53 -3.456 -4.514 -6.215 1.00 0.00 C ATOM 350 C4' G A 53 -3.361 -3.025 -6.510 1.00 0.00 C ATOM 351 O4' G A 53 -4.016 -2.274 -5.484 1.00 0.00 O ATOM 352 C3' G A 53 -1.946 -2.483 -6.559 1.00 0.00 C ATOM 353 O3' G A 53 -1.355 -2.738 -7.838 1.00 0.00 O ATOM 354 C2' G A 53 -2.207 -1.003 -6.367 1.00 0.00 C ATOM 355 O2' G A 53 -2.686 -0.393 -7.571 1.00 0.00 O ATOM 356 C1' G A 53 -3.288 -1.047 -5.292 1.00 0.00 C ATOM 357 N9 G A 53 -2.738 -1.044 -3.927 1.00 0.00 N ATOM 358 C8 G A 53 -2.466 -2.103 -3.100 1.00 0.00 C ATOM 359 N7 G A 53 -1.943 -1.758 -1.956 1.00 0.00 N ATOM 360 C5 G A 53 -1.862 -0.372 -2.032 1.00 0.00 C ATOM 361 C6 G A 53 -1.371 0.564 -1.082 1.00 0.00 C ATOM 362 O6 G A 53 -0.912 0.339 0.039 1.00 0.00 O ATOM 363 N1 G A 53 -1.466 1.870 -1.560 1.00 0.00 N ATOM 364 C2 G A 53 -1.974 2.225 -2.798 1.00 0.00 C ATOM 365 N2 G A 53 -1.988 3.527 -3.093 1.00 0.00 N ATOM 366 N3 G A 53 -2.435 1.343 -3.684 1.00 0.00 N ATOM 367 C4 G A 53 -2.348 0.071 -3.235 1.00 0.00 C ATOM 0 H5' G A 53 -4.502 -4.802 -6.116 1.00 0.00 H new ATOM 0 H5'' G A 53 -3.047 -5.081 -7.052 1.00 0.00 H new ATOM 0 H4' G A 53 -3.822 -2.917 -7.492 1.00 0.00 H new ATOM 0 H3' G A 53 -1.261 -2.920 -5.833 1.00 0.00 H new ATOM 0 H2' G A 53 -1.327 -0.417 -6.102 1.00 0.00 H new ATOM 0 HO2' G A 53 -2.846 0.561 -7.413 1.00 0.00 H new ATOM 0 H1' G A 53 -3.912 -0.158 -5.389 1.00 0.00 H new ATOM 0 H8 G A 53 -2.666 -3.129 -3.371 1.00 0.00 H new ATOM 0 H1 G A 53 -1.137 2.620 -0.952 1.00 0.00 H new ATOM 0 H21 G A 53 -2.352 3.842 -3.992 1.00 0.00 H new ATOM 0 H22 G A 53 -1.635 4.206 -2.419 1.00 0.00 H new ATOM 379 P A A 54 0.240 -2.915 -7.987 1.00 0.00 P ATOM 380 OP1 A A 54 0.539 -3.257 -9.396 1.00 0.00 O ATOM 381 OP2 A A 54 0.713 -3.797 -6.897 1.00 0.00 O ATOM 382 O5' A A 54 0.784 -1.430 -7.704 1.00 0.00 O ATOM 383 C5' A A 54 0.471 -0.355 -8.584 1.00 0.00 C ATOM 384 C4' A A 54 0.951 0.974 -8.014 1.00 0.00 C ATOM 385 O4' A A 54 0.250 1.295 -6.806 1.00 0.00 O ATOM 386 C3' A A 54 2.419 1.021 -7.633 1.00 0.00 C ATOM 387 O3' A A 54 3.239 1.272 -8.771 1.00 0.00 O ATOM 388 C2' A A 54 2.444 2.221 -6.718 1.00 0.00 C ATOM 389 O2' A A 54 2.465 3.446 -7.460 1.00 0.00 O ATOM 390 C1' A A 54 1.142 2.051 -5.959 1.00 0.00 C ATOM 391 N9 A A 54 1.304 1.330 -4.686 1.00 0.00 N ATOM 392 C8 A A 54 1.066 0.011 -4.395 1.00 0.00 C ATOM 393 N7 A A 54 1.299 -0.305 -3.152 1.00 0.00 N ATOM 394 C5 A A 54 1.725 0.890 -2.581 1.00 0.00 C ATOM 395 C6 A A 54 2.131 1.231 -1.283 1.00 0.00 C ATOM 396 N6 A A 54 2.170 0.358 -0.278 1.00 0.00 N ATOM 397 N1 A A 54 2.493 2.506 -1.067 1.00 0.00 N ATOM 398 C2 A A 54 2.454 3.372 -2.073 1.00 0.00 C ATOM 399 N3 A A 54 2.089 3.175 -3.327 1.00 0.00 N ATOM 400 C4 A A 54 1.731 1.888 -3.511 1.00 0.00 C ATOM 0 H5' A A 54 -0.606 -0.317 -8.749 1.00 0.00 H new ATOM 0 H5'' A A 54 0.936 -0.528 -9.555 1.00 0.00 H new ATOM 0 H4' A A 54 0.766 1.673 -8.829 1.00 0.00 H new ATOM 0 H3' A A 54 2.789 0.094 -7.196 1.00 0.00 H new ATOM 0 H2' A A 54 3.325 2.274 -6.079 1.00 0.00 H new ATOM 0 HO2' A A 54 2.461 3.247 -8.420 1.00 0.00 H new ATOM 0 H1' A A 54 0.757 3.041 -5.715 1.00 0.00 H new ATOM 0 H8 A A 54 0.717 -0.701 -5.129 1.00 0.00 H new ATOM 0 H61 A A 54 2.474 0.659 0.648 1.00 0.00 H new ATOM 0 H62 A A 54 1.896 -0.612 -0.434 1.00 0.00 H new ATOM 0 H2 A A 54 2.764 4.378 -1.832 1.00 0.00 H new ATOM 412 P U A 55 4.767 0.770 -8.812 1.00 0.00 P ATOM 413 OP1 U A 55 5.345 1.132 -10.126 1.00 0.00 O ATOM 414 OP2 U A 55 4.814 -0.631 -8.339 1.00 0.00 O ATOM 415 O5' U A 55 5.427 1.712 -7.687 1.00 0.00 O ATOM 416 C5' U A 55 5.459 3.127 -7.849 1.00 0.00 C ATOM 417 C4' U A 55 5.970 3.821 -6.588 1.00 0.00 C ATOM 418 O4' U A 55 5.082 3.578 -5.496 1.00 0.00 O ATOM 419 C3' U A 55 7.318 3.339 -6.090 1.00 0.00 C ATOM 420 O3' U A 55 8.373 3.970 -6.823 1.00 0.00 O ATOM 421 C2' U A 55 7.305 3.839 -4.658 1.00 0.00 C ATOM 422 O2' U A 55 7.726 5.205 -4.574 1.00 0.00 O ATOM 423 C1' U A 55 5.836 3.680 -4.270 1.00 0.00 C ATOM 424 N1 U A 55 5.587 2.475 -3.458 1.00 0.00 N ATOM 425 C2 U A 55 5.827 2.577 -2.106 1.00 0.00 C ATOM 426 O2 U A 55 6.215 3.624 -1.591 1.00 0.00 O ATOM 427 N3 U A 55 5.609 1.435 -1.362 1.00 0.00 N ATOM 428 C4 U A 55 5.173 0.216 -1.841 1.00 0.00 C ATOM 429 O4 U A 55 5.005 -0.731 -1.072 1.00 0.00 O ATOM 430 C5 U A 55 4.946 0.196 -3.272 1.00 0.00 C ATOM 431 C6 U A 55 5.160 1.303 -4.023 1.00 0.00 C ATOM 0 H5' U A 55 4.459 3.490 -8.086 1.00 0.00 H new ATOM 0 H5'' U A 55 6.100 3.384 -8.693 1.00 0.00 H new ATOM 0 H4' U A 55 6.044 4.867 -6.885 1.00 0.00 H new ATOM 0 H3' U A 55 7.477 2.265 -6.192 1.00 0.00 H new ATOM 0 H2' U A 55 7.989 3.299 -4.003 1.00 0.00 H new ATOM 0 HO2' U A 55 7.919 5.544 -5.473 1.00 0.00 H new ATOM 0 H1' U A 55 5.541 4.537 -3.665 1.00 0.00 H new ATOM 0 H3 U A 55 5.788 1.498 -0.360 1.00 0.00 H new ATOM 0 H5 U A 55 4.602 -0.712 -3.745 1.00 0.00 H new ATOM 0 H6 U A 55 4.990 1.260 -5.089 1.00 0.00 H new ATOM 442 P C A 56 9.802 3.245 -7.012 1.00 0.00 P ATOM 443 OP1 C A 56 10.632 4.089 -7.900 1.00 0.00 O ATOM 444 OP2 C A 56 9.558 1.828 -7.360 1.00 0.00 O ATOM 445 O5' C A 56 10.439 3.298 -5.532 1.00 0.00 O ATOM 446 C5' C A 56 10.776 4.544 -4.920 1.00 0.00 C ATOM 447 C4' C A 56 11.299 4.348 -3.497 1.00 0.00 C ATOM 448 O4' C A 56 10.282 3.828 -2.650 1.00 0.00 O ATOM 449 C3' C A 56 12.449 3.371 -3.369 1.00 0.00 C ATOM 450 O3' C A 56 13.678 4.027 -3.702 1.00 0.00 O ATOM 451 C2' C A 56 12.407 3.018 -1.890 1.00 0.00 C ATOM 452 O2' C A 56 13.215 3.911 -1.115 1.00 0.00 O ATOM 453 C1' C A 56 10.920 3.165 -1.542 1.00 0.00 C ATOM 454 N1 C A 56 10.233 1.876 -1.327 1.00 0.00 N ATOM 455 C2 C A 56 10.350 1.295 -0.074 1.00 0.00 C ATOM 456 O2 C A 56 11.001 1.859 0.802 1.00 0.00 O ATOM 457 N3 C A 56 9.733 0.097 0.146 1.00 0.00 N ATOM 458 C4 C A 56 9.033 -0.500 -0.830 1.00 0.00 C ATOM 459 N4 C A 56 8.438 -1.667 -0.592 1.00 0.00 N ATOM 460 C5 C A 56 8.914 0.098 -2.124 1.00 0.00 C ATOM 461 C6 C A 56 9.528 1.278 -2.328 1.00 0.00 C ATOM 0 H5' C A 56 9.898 5.190 -4.900 1.00 0.00 H new ATOM 0 H5'' C A 56 11.532 5.052 -5.519 1.00 0.00 H new ATOM 0 H4' C A 56 11.636 5.345 -3.214 1.00 0.00 H new ATOM 0 H3' C A 56 12.378 2.502 -4.023 1.00 0.00 H new ATOM 0 H2' C A 56 12.801 2.024 -1.677 1.00 0.00 H new ATOM 0 HO2' C A 56 13.166 3.659 -0.169 1.00 0.00 H new ATOM 0 H1' C A 56 10.853 3.723 -0.608 1.00 0.00 H new ATOM 0 H41 C A 56 7.904 -2.127 -1.329 1.00 0.00 H new ATOM 0 H42 C A 56 8.516 -2.101 0.328 1.00 0.00 H new ATOM 0 H5 C A 56 8.350 -0.381 -2.911 1.00 0.00 H new ATOM 0 H6 C A 56 9.461 1.756 -3.294 1.00 0.00 H new ATOM 473 P A A 57 14.932 3.205 -4.294 1.00 0.00 P ATOM 474 OP1 A A 57 15.987 4.175 -4.659 1.00 0.00 O ATOM 475 OP2 A A 57 14.422 2.256 -5.309 1.00 0.00 O ATOM 476 O5' A A 57 15.450 2.354 -3.027 1.00 0.00 O ATOM 477 C5' A A 57 15.989 3.017 -1.881 1.00 0.00 C ATOM 478 C4' A A 57 16.306 2.036 -0.753 1.00 0.00 C ATOM 479 O4' A A 57 15.113 1.437 -0.261 1.00 0.00 O ATOM 480 C3' A A 57 17.199 0.881 -1.157 1.00 0.00 C ATOM 481 O3' A A 57 18.580 1.261 -1.171 1.00 0.00 O ATOM 482 C2' A A 57 16.900 -0.148 -0.078 1.00 0.00 C ATOM 483 O2' A A 57 17.782 -0.002 1.041 1.00 0.00 O ATOM 484 C1' A A 57 15.451 0.161 0.309 1.00 0.00 C ATOM 485 N9 A A 57 14.483 -0.833 -0.193 1.00 0.00 N ATOM 486 C8 A A 57 13.744 -0.810 -1.346 1.00 0.00 C ATOM 487 N7 A A 57 13.004 -1.870 -1.521 1.00 0.00 N ATOM 488 C5 A A 57 13.274 -2.652 -0.403 1.00 0.00 C ATOM 489 C6 A A 57 12.805 -3.909 0.013 1.00 0.00 C ATOM 490 N6 A A 57 11.926 -4.627 -0.686 1.00 0.00 N ATOM 491 N1 A A 57 13.278 -4.391 1.174 1.00 0.00 N ATOM 492 C2 A A 57 14.154 -3.671 1.865 1.00 0.00 C ATOM 493 N3 A A 57 14.669 -2.484 1.581 1.00 0.00 N ATOM 494 C4 A A 57 14.175 -2.028 0.411 1.00 0.00 C ATOM 0 H5' A A 57 15.278 3.763 -1.525 1.00 0.00 H new ATOM 0 H5'' A A 57 16.896 3.551 -2.164 1.00 0.00 H new ATOM 0 H4' A A 57 16.820 2.646 -0.010 1.00 0.00 H new ATOM 0 H3' A A 57 17.013 0.514 -2.166 1.00 0.00 H new ATOM 0 H2' A A 57 17.040 -1.174 -0.418 1.00 0.00 H new ATOM 0 HO2' A A 57 18.585 0.486 0.763 1.00 0.00 H new ATOM 0 HO3' A A 57 19.128 0.492 -1.434 1.00 0.00 H new ATOM 0 H1' A A 57 15.390 0.148 1.397 1.00 0.00 H new ATOM 0 H8 A A 57 13.771 0.011 -2.047 1.00 0.00 H new ATOM 0 H61 A A 57 11.618 -5.535 -0.338 1.00 0.00 H new ATOM 0 H62 A A 57 11.561 -4.268 -1.569 1.00 0.00 H new ATOM 0 H2 A A 57 14.495 -4.116 2.788 1.00 0.00 H new TER 507 A A 57