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 -7:sc= -0.485 USER MOD Single : A 42 G O5' : rot 180:sc= 0 USER MOD Single : A 43 A O2' : rot 180:sc= -0.224 USER MOD Single : A 44 U O2' : rot 180:sc= -0.144 USER MOD Single : A 45 C O2' : rot -2:sc= -0.696 USER MOD Single : A 46 U O2' : rot 180:sc= -0.0916 USER MOD Single : A 47 C O2' : rot -176:sc= -2.39! USER MOD Single : A 48 U O2' : rot -109:sc= -6.8! USER MOD Single : A 49 U O2' : rot -51:sc= 0.492 USER MOD Single : A 50 G O2' : rot -4:sc= -5.05! USER MOD Single : A 51 U O2' : rot 180:sc= -4.44! USER MOD Single : A 52 A O2' : rot -1:sc= -0.565 USER MOD Single : A 53 G O2' : rot 180:sc= -0.25 USER MOD Single : A 54 A O2' : rot 2:sc= -1.82! USER MOD Single : A 55 U O2' : rot 0:sc= -1.02 USER MOD Single : A 56 C O2' : rot 3:sc= -2.12! USER MOD Single : A 57 A O2' : rot 180:sc= 0 USER MOD Single : A 57 A O3' : rot 139:sc= 0.226 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 42 6.890 -4.652 9.896 1.00 0.00 O ATOM 2 C5' G A 42 7.735 -4.153 10.935 1.00 0.00 C ATOM 3 C4' G A 42 8.549 -2.957 10.464 1.00 0.00 C ATOM 4 O4' G A 42 9.493 -3.340 9.465 1.00 0.00 O ATOM 5 C3' G A 42 7.729 -1.839 9.851 1.00 0.00 C ATOM 6 O3' G A 42 7.174 -1.003 10.869 1.00 0.00 O ATOM 7 C2' G A 42 8.785 -1.101 9.065 1.00 0.00 C ATOM 8 O2' G A 42 9.560 -0.237 9.904 1.00 0.00 O ATOM 9 C1' G A 42 9.617 -2.257 8.529 1.00 0.00 C ATOM 10 N9 G A 42 9.163 -2.756 7.223 1.00 0.00 N ATOM 11 C8 G A 42 8.338 -3.813 6.959 1.00 0.00 C ATOM 12 N7 G A 42 8.102 -3.997 5.690 1.00 0.00 N ATOM 13 C5 G A 42 8.826 -2.984 5.066 1.00 0.00 C ATOM 14 C6 G A 42 8.954 -2.676 3.685 1.00 0.00 C ATOM 15 O6 G A 42 8.444 -3.255 2.729 1.00 0.00 O ATOM 16 N1 G A 42 9.777 -1.571 3.481 1.00 0.00 N ATOM 17 C2 G A 42 10.401 -0.857 4.490 1.00 0.00 C ATOM 18 N2 G A 42 11.157 0.172 4.113 1.00 0.00 N ATOM 19 N3 G A 42 10.279 -1.151 5.787 1.00 0.00 N ATOM 20 C4 G A 42 9.480 -2.220 5.999 1.00 0.00 C ATOM 0 H5' G A 42 8.407 -4.943 11.270 1.00 0.00 H new ATOM 0 H5'' G A 42 7.128 -3.866 11.793 1.00 0.00 H new ATOM 0 H4' G A 42 9.024 -2.594 11.375 1.00 0.00 H new ATOM 0 H3' G A 42 6.879 -2.174 9.257 1.00 0.00 H new ATOM 0 H2' G A 42 8.388 -0.441 8.294 1.00 0.00 H new ATOM 0 HO2' G A 42 9.174 -0.223 10.805 1.00 0.00 H new ATOM 0 HO5' G A 42 6.381 -5.421 10.229 1.00 0.00 H new ATOM 0 H1' G A 42 10.638 -1.895 8.404 1.00 0.00 H new ATOM 0 H8 G A 42 7.919 -4.440 7.732 1.00 0.00 H new ATOM 0 H1 G A 42 9.931 -1.266 2.520 1.00 0.00 H new ATOM 0 H21 G A 42 11.640 0.733 4.814 1.00 0.00 H new ATOM 0 H22 G A 42 11.253 0.399 3.123 1.00 0.00 H new ATOM 33 P A A 43 5.808 -0.187 10.606 1.00 0.00 P ATOM 34 OP1 A A 43 5.424 0.489 11.866 1.00 0.00 O ATOM 35 OP2 A A 43 4.850 -1.095 9.936 1.00 0.00 O ATOM 36 O5' A A 43 6.257 0.941 9.547 1.00 0.00 O ATOM 37 C5' A A 43 7.190 1.954 9.922 1.00 0.00 C ATOM 38 C4' A A 43 7.583 2.838 8.739 1.00 0.00 C ATOM 39 O4' A A 43 8.298 2.081 7.755 1.00 0.00 O ATOM 40 C3' A A 43 6.418 3.460 7.991 1.00 0.00 C ATOM 41 O3' A A 43 5.953 4.628 8.683 1.00 0.00 O ATOM 42 C2' A A 43 7.071 3.818 6.675 1.00 0.00 C ATOM 43 O2' A A 43 7.823 5.034 6.771 1.00 0.00 O ATOM 44 C1' A A 43 7.977 2.612 6.452 1.00 0.00 C ATOM 45 N9 A A 43 7.337 1.538 5.662 1.00 0.00 N ATOM 46 C8 A A 43 6.695 0.407 6.098 1.00 0.00 C ATOM 47 N7 A A 43 6.218 -0.336 5.137 1.00 0.00 N ATOM 48 C5 A A 43 6.568 0.351 3.980 1.00 0.00 C ATOM 49 C6 A A 43 6.351 0.091 2.616 1.00 0.00 C ATOM 50 N6 A A 43 5.704 -0.986 2.163 1.00 0.00 N ATOM 51 N1 A A 43 6.830 0.987 1.740 1.00 0.00 N ATOM 52 C2 A A 43 7.479 2.054 2.187 1.00 0.00 C ATOM 53 N3 A A 43 7.747 2.407 3.432 1.00 0.00 N ATOM 54 C4 A A 43 7.252 1.494 4.292 1.00 0.00 C ATOM 0 H5' A A 43 8.083 1.488 10.338 1.00 0.00 H new ATOM 0 H5'' A A 43 6.757 2.572 10.708 1.00 0.00 H new ATOM 0 H4' A A 43 8.178 3.627 9.198 1.00 0.00 H new ATOM 0 H3' A A 43 5.543 2.819 7.886 1.00 0.00 H new ATOM 0 H2' A A 43 6.366 4.002 5.864 1.00 0.00 H new ATOM 0 HO2' A A 43 8.232 5.235 5.904 1.00 0.00 H new ATOM 0 H1' A A 43 8.852 2.942 5.892 1.00 0.00 H new ATOM 0 H8 A A 43 6.593 0.154 7.143 1.00 0.00 H new ATOM 0 H61 A A 43 5.577 -1.120 1.160 1.00 0.00 H new ATOM 0 H62 A A 43 5.337 -1.674 2.820 1.00 0.00 H new ATOM 0 H2 A A 43 7.839 2.730 1.426 1.00 0.00 H new ATOM 66 P U A 44 4.421 5.118 8.537 1.00 0.00 P ATOM 67 OP1 U A 44 4.202 6.232 9.487 1.00 0.00 O ATOM 68 OP2 U A 44 3.549 3.924 8.592 1.00 0.00 O ATOM 69 O5' U A 44 4.356 5.716 7.040 1.00 0.00 O ATOM 70 C5' U A 44 5.102 6.893 6.716 1.00 0.00 C ATOM 71 C4' U A 44 5.036 7.239 5.228 1.00 0.00 C ATOM 72 O4' U A 44 5.686 6.233 4.454 1.00 0.00 O ATOM 73 C3' U A 44 3.640 7.344 4.645 1.00 0.00 C ATOM 74 O3' U A 44 3.065 8.627 4.937 1.00 0.00 O ATOM 75 C2' U A 44 3.947 7.212 3.164 1.00 0.00 C ATOM 76 O2' U A 44 4.429 8.444 2.614 1.00 0.00 O ATOM 77 C1' U A 44 5.031 6.140 3.173 1.00 0.00 C ATOM 78 N1 U A 44 4.496 4.774 3.045 1.00 0.00 N ATOM 79 C2 U A 44 4.263 4.300 1.771 1.00 0.00 C ATOM 80 O2 U A 44 4.507 4.968 0.769 1.00 0.00 O ATOM 81 N3 U A 44 3.739 3.026 1.685 1.00 0.00 N ATOM 82 C4 U A 44 3.430 2.195 2.745 1.00 0.00 C ATOM 83 O4 U A 44 2.974 1.072 2.547 1.00 0.00 O ATOM 84 C5 U A 44 3.700 2.773 4.041 1.00 0.00 C ATOM 85 C6 U A 44 4.212 4.022 4.151 1.00 0.00 C ATOM 0 H5' U A 44 6.143 6.751 7.006 1.00 0.00 H new ATOM 0 H5'' U A 44 4.721 7.732 7.298 1.00 0.00 H new ATOM 0 H4' U A 44 5.514 8.217 5.176 1.00 0.00 H new ATOM 0 H3' U A 44 2.926 6.615 5.028 1.00 0.00 H new ATOM 0 H2' U A 44 3.081 6.962 2.552 1.00 0.00 H new ATOM 0 HO2' U A 44 4.618 8.324 1.660 1.00 0.00 H new ATOM 0 H1' U A 44 5.693 6.311 2.324 1.00 0.00 H new ATOM 0 H3 U A 44 3.563 2.663 0.748 1.00 0.00 H new ATOM 0 H5 U A 44 3.491 2.202 4.934 1.00 0.00 H new ATOM 0 H6 U A 44 4.400 4.432 5.132 1.00 0.00 H new ATOM 96 P C A 45 1.461 8.795 5.057 1.00 0.00 P ATOM 97 OP1 C A 45 1.175 10.178 5.500 1.00 0.00 O ATOM 98 OP2 C A 45 0.935 7.651 5.834 1.00 0.00 O ATOM 99 O5' C A 45 0.956 8.642 3.534 1.00 0.00 O ATOM 100 C5' C A 45 1.308 9.623 2.557 1.00 0.00 C ATOM 101 C4' C A 45 0.891 9.204 1.148 1.00 0.00 C ATOM 102 O4' C A 45 1.629 8.056 0.737 1.00 0.00 O ATOM 103 C3' C A 45 -0.567 8.816 0.974 1.00 0.00 C ATOM 104 O3' C A 45 -1.391 9.976 0.820 1.00 0.00 O ATOM 105 C2' C A 45 -0.507 8.028 -0.316 1.00 0.00 C ATOM 106 O2' C A 45 -0.479 8.890 -1.460 1.00 0.00 O ATOM 107 C1' C A 45 0.806 7.273 -0.149 1.00 0.00 C ATOM 108 N1 C A 45 0.628 5.942 0.458 1.00 0.00 N ATOM 109 C2 C A 45 0.295 4.902 -0.386 1.00 0.00 C ATOM 110 O2 C A 45 0.163 5.112 -1.592 1.00 0.00 O ATOM 111 N3 C A 45 0.116 3.663 0.155 1.00 0.00 N ATOM 112 C4 C A 45 0.263 3.458 1.469 1.00 0.00 C ATOM 113 N4 C A 45 0.085 2.231 1.961 1.00 0.00 N ATOM 114 C5 C A 45 0.607 4.535 2.345 1.00 0.00 C ATOM 115 C6 C A 45 0.772 5.754 1.801 1.00 0.00 C ATOM 0 H5' C A 45 2.385 9.789 2.582 1.00 0.00 H new ATOM 0 H5'' C A 45 0.833 10.571 2.808 1.00 0.00 H new ATOM 0 H4' C A 45 1.084 10.099 0.557 1.00 0.00 H new ATOM 0 H3' C A 45 -0.990 8.272 1.818 1.00 0.00 H new ATOM 0 H2' C A 45 -1.371 7.385 -0.484 1.00 0.00 H new ATOM 0 HO2' C A 45 -0.533 9.824 -1.167 1.00 0.00 H new ATOM 0 H1' C A 45 1.248 7.127 -1.135 1.00 0.00 H new ATOM 0 H41 C A 45 0.194 2.062 2.961 1.00 0.00 H new ATOM 0 H42 C A 45 -0.160 1.462 1.337 1.00 0.00 H new ATOM 0 H5 C A 45 0.730 4.375 3.406 1.00 0.00 H new ATOM 0 H6 C A 45 1.021 6.593 2.434 1.00 0.00 H new ATOM 127 P U A 46 -2.950 9.936 1.236 1.00 0.00 P ATOM 128 OP1 U A 46 -3.503 11.301 1.091 1.00 0.00 O ATOM 129 OP2 U A 46 -3.065 9.229 2.531 1.00 0.00 O ATOM 130 O5' U A 46 -3.603 9.003 0.092 1.00 0.00 O ATOM 131 C5' U A 46 -3.623 9.442 -1.268 1.00 0.00 C ATOM 132 C4' U A 46 -4.215 8.394 -2.215 1.00 0.00 C ATOM 133 O4' U A 46 -3.378 7.236 -2.265 1.00 0.00 O ATOM 134 C3' U A 46 -5.587 7.873 -1.831 1.00 0.00 C ATOM 135 O3' U A 46 -6.601 8.799 -2.259 1.00 0.00 O ATOM 136 C2' U A 46 -5.635 6.584 -2.632 1.00 0.00 C ATOM 137 O2' U A 46 -5.958 6.829 -4.007 1.00 0.00 O ATOM 138 C1' U A 46 -4.206 6.072 -2.473 1.00 0.00 C ATOM 139 N1 U A 46 -4.032 5.185 -1.305 1.00 0.00 N ATOM 140 C2 U A 46 -4.328 3.843 -1.466 1.00 0.00 C ATOM 141 O2 U A 46 -4.698 3.376 -2.539 1.00 0.00 O ATOM 142 N3 U A 46 -4.181 3.051 -0.344 1.00 0.00 N ATOM 143 C4 U A 46 -3.771 3.474 0.906 1.00 0.00 C ATOM 144 O4 U A 46 -3.674 2.676 1.833 1.00 0.00 O ATOM 145 C5 U A 46 -3.487 4.887 0.985 1.00 0.00 C ATOM 146 C6 U A 46 -3.625 5.685 -0.100 1.00 0.00 C ATOM 0 H5' U A 46 -2.607 9.680 -1.584 1.00 0.00 H new ATOM 0 H5'' U A 46 -4.203 10.362 -1.341 1.00 0.00 H new ATOM 0 H4' U A 46 -4.292 8.926 -3.163 1.00 0.00 H new ATOM 0 H3' U A 46 -5.753 7.736 -0.763 1.00 0.00 H new ATOM 0 H2' U A 46 -6.397 5.881 -2.296 1.00 0.00 H new ATOM 0 HO2' U A 46 -5.979 5.979 -4.494 1.00 0.00 H new ATOM 0 H1' U A 46 -3.945 5.494 -3.360 1.00 0.00 H new ATOM 0 H3 U A 46 -4.396 2.059 -0.448 1.00 0.00 H new ATOM 0 H5 U A 46 -3.160 5.313 1.922 1.00 0.00 H new ATOM 0 H6 U A 46 -3.409 6.739 -0.011 1.00 0.00 H new ATOM 157 P C A 47 -8.013 8.907 -1.478 1.00 0.00 P ATOM 158 OP1 C A 47 -8.766 10.046 -2.049 1.00 0.00 O ATOM 159 OP2 C A 47 -7.738 8.865 -0.025 1.00 0.00 O ATOM 160 O5' C A 47 -8.781 7.549 -1.881 1.00 0.00 O ATOM 161 C5' C A 47 -9.189 7.333 -3.234 1.00 0.00 C ATOM 162 C4' C A 47 -9.757 5.932 -3.452 1.00 0.00 C ATOM 163 O4' C A 47 -8.744 4.959 -3.283 1.00 0.00 O ATOM 164 C3' C A 47 -10.877 5.519 -2.517 1.00 0.00 C ATOM 165 O3' C A 47 -12.120 6.058 -2.988 1.00 0.00 O ATOM 166 C2' C A 47 -10.841 4.008 -2.656 1.00 0.00 C ATOM 167 O2' C A 47 -11.576 3.578 -3.806 1.00 0.00 O ATOM 168 C1' C A 47 -9.340 3.734 -2.821 1.00 0.00 C ATOM 169 N1 C A 47 -8.656 3.388 -1.570 1.00 0.00 N ATOM 170 C2 C A 47 -8.662 2.065 -1.184 1.00 0.00 C ATOM 171 O2 C A 47 -9.243 1.233 -1.876 1.00 0.00 O ATOM 172 N3 C A 47 -8.012 1.727 -0.034 1.00 0.00 N ATOM 173 C4 C A 47 -7.389 2.661 0.700 1.00 0.00 C ATOM 174 N4 C A 47 -6.752 2.304 1.814 1.00 0.00 N ATOM 175 C5 C A 47 -7.397 4.034 0.304 1.00 0.00 C ATOM 176 C6 C A 47 -8.044 4.349 -0.832 1.00 0.00 C ATOM 0 H5' C A 47 -8.337 7.484 -3.897 1.00 0.00 H new ATOM 0 H5'' C A 47 -9.940 8.074 -3.507 1.00 0.00 H new ATOM 0 H4' C A 47 -10.159 5.981 -4.464 1.00 0.00 H new ATOM 0 H3' C A 47 -10.774 5.864 -1.488 1.00 0.00 H new ATOM 0 H2' C A 47 -11.292 3.479 -1.817 1.00 0.00 H new ATOM 0 HO2' C A 47 -11.590 2.599 -3.838 1.00 0.00 H new ATOM 0 H1' C A 47 -9.236 2.889 -3.501 1.00 0.00 H new ATOM 0 H41 C A 47 -6.276 3.009 2.377 1.00 0.00 H new ATOM 0 H42 C A 47 -6.740 1.326 2.104 1.00 0.00 H new ATOM 0 H5 C A 47 -6.902 4.790 0.895 1.00 0.00 H new ATOM 0 H6 C A 47 -8.077 5.377 -1.161 1.00 0.00 H new ATOM 188 P U A 48 -13.336 6.377 -1.976 1.00 0.00 P ATOM 189 OP1 U A 48 -14.392 7.079 -2.737 1.00 0.00 O ATOM 190 OP2 U A 48 -12.767 7.005 -0.762 1.00 0.00 O ATOM 191 O5' U A 48 -13.902 4.921 -1.565 1.00 0.00 O ATOM 192 C5' U A 48 -15.318 4.738 -1.417 1.00 0.00 C ATOM 193 C4' U A 48 -15.705 3.291 -1.113 1.00 0.00 C ATOM 194 O4' U A 48 -15.476 2.465 -2.267 1.00 0.00 O ATOM 195 C3' U A 48 -14.932 2.676 0.061 1.00 0.00 C ATOM 196 O3' U A 48 -15.834 1.858 0.829 1.00 0.00 O ATOM 197 C2' U A 48 -13.932 1.783 -0.664 1.00 0.00 C ATOM 198 O2' U A 48 -13.496 0.692 0.146 1.00 0.00 O ATOM 199 C1' U A 48 -14.760 1.313 -1.838 1.00 0.00 C ATOM 200 N1 U A 48 -13.991 0.774 -2.988 1.00 0.00 N ATOM 201 C2 U A 48 -14.280 -0.515 -3.411 1.00 0.00 C ATOM 202 O2 U A 48 -15.145 -1.201 -2.872 1.00 0.00 O ATOM 203 N3 U A 48 -13.541 -0.985 -4.481 1.00 0.00 N ATOM 204 C4 U A 48 -12.552 -0.293 -5.156 1.00 0.00 C ATOM 205 O4 U A 48 -11.953 -0.812 -6.095 1.00 0.00 O ATOM 206 C5 U A 48 -12.318 1.040 -4.651 1.00 0.00 C ATOM 207 C6 U A 48 -13.032 1.524 -3.605 1.00 0.00 C ATOM 0 H5' U A 48 -15.818 5.057 -2.332 1.00 0.00 H new ATOM 0 H5'' U A 48 -15.680 5.381 -0.615 1.00 0.00 H new ATOM 0 H4' U A 48 -16.760 3.324 -0.841 1.00 0.00 H new ATOM 0 H3' U A 48 -14.477 3.398 0.739 1.00 0.00 H new ATOM 0 H2' U A 48 -13.006 2.288 -0.939 1.00 0.00 H new ATOM 0 HO2' U A 48 -12.561 0.830 0.406 1.00 0.00 H new ATOM 0 H1' U A 48 -15.379 0.479 -1.508 1.00 0.00 H new ATOM 0 H3 U A 48 -13.744 -1.931 -4.803 1.00 0.00 H new ATOM 0 H5 U A 48 -11.564 1.660 -5.113 1.00 0.00 H new ATOM 0 H6 U A 48 -12.837 2.526 -3.252 1.00 0.00 H new ATOM 218 P U A 49 -15.706 1.640 2.434 1.00 0.00 P ATOM 219 OP1 U A 49 -16.880 0.857 2.881 1.00 0.00 O ATOM 220 OP2 U A 49 -15.431 2.957 3.051 1.00 0.00 O ATOM 221 O5' U A 49 -14.396 0.721 2.626 1.00 0.00 O ATOM 222 C5' U A 49 -14.337 -0.600 2.096 1.00 0.00 C ATOM 223 C4' U A 49 -12.977 -1.248 2.357 1.00 0.00 C ATOM 224 O4' U A 49 -11.974 -0.470 1.681 1.00 0.00 O ATOM 225 C3' U A 49 -12.561 -1.311 3.830 1.00 0.00 C ATOM 226 O3' U A 49 -11.908 -2.564 4.048 1.00 0.00 O ATOM 227 C2' U A 49 -11.562 -0.190 4.016 1.00 0.00 C ATOM 228 O2' U A 49 -10.535 -0.556 4.944 1.00 0.00 O ATOM 229 C1' U A 49 -10.999 0.017 2.624 1.00 0.00 C ATOM 230 N1 U A 49 -10.717 1.438 2.333 1.00 0.00 N ATOM 231 C2 U A 49 -9.502 1.943 2.760 1.00 0.00 C ATOM 232 O2 U A 49 -8.664 1.240 3.322 1.00 0.00 O ATOM 233 N3 U A 49 -9.282 3.287 2.516 1.00 0.00 N ATOM 234 C4 U A 49 -10.156 4.156 1.888 1.00 0.00 C ATOM 235 O4 U A 49 -9.855 5.335 1.722 1.00 0.00 O ATOM 236 C5 U A 49 -11.398 3.543 1.476 1.00 0.00 C ATOM 237 C6 U A 49 -11.637 2.229 1.709 1.00 0.00 C ATOM 0 H5' U A 49 -14.528 -0.572 1.023 1.00 0.00 H new ATOM 0 H5'' U A 49 -15.123 -1.208 2.544 1.00 0.00 H new ATOM 0 H4' U A 49 -13.065 -2.274 2.001 1.00 0.00 H new ATOM 0 H3' U A 49 -13.404 -1.217 4.514 1.00 0.00 H new ATOM 0 H2' U A 49 -12.012 0.713 4.429 1.00 0.00 H new ATOM 0 HO2' U A 49 -10.944 -0.903 5.764 1.00 0.00 H new ATOM 0 H1' U A 49 -10.054 -0.520 2.550 1.00 0.00 H new ATOM 0 H3 U A 49 -8.391 3.673 2.829 1.00 0.00 H new ATOM 0 H5 U A 49 -12.146 4.140 0.976 1.00 0.00 H new ATOM 0 H6 U A 49 -12.576 1.799 1.394 1.00 0.00 H new ATOM 248 P G A 50 -11.846 -3.263 5.496 1.00 0.00 P ATOM 249 OP1 G A 50 -13.230 -3.466 5.980 1.00 0.00 O ATOM 250 OP2 G A 50 -10.867 -2.530 6.329 1.00 0.00 O ATOM 251 O5' G A 50 -11.221 -4.698 5.119 1.00 0.00 O ATOM 252 C5' G A 50 -11.984 -5.629 4.346 1.00 0.00 C ATOM 253 C4' G A 50 -11.122 -6.363 3.331 1.00 0.00 C ATOM 254 O4' G A 50 -10.679 -5.476 2.311 1.00 0.00 O ATOM 255 C3' G A 50 -9.873 -7.002 3.887 1.00 0.00 C ATOM 256 O3' G A 50 -10.154 -8.292 4.403 1.00 0.00 O ATOM 257 C2' G A 50 -8.968 -7.081 2.687 1.00 0.00 C ATOM 258 O2' G A 50 -9.271 -8.221 1.874 1.00 0.00 O ATOM 259 C1' G A 50 -9.311 -5.783 1.979 1.00 0.00 C ATOM 260 N9 G A 50 -8.508 -4.623 2.398 1.00 0.00 N ATOM 261 C8 G A 50 -7.696 -4.471 3.491 1.00 0.00 C ATOM 262 N7 G A 50 -7.115 -3.307 3.559 1.00 0.00 N ATOM 263 C5 G A 50 -7.572 -2.643 2.427 1.00 0.00 C ATOM 264 C6 G A 50 -7.290 -1.332 1.968 1.00 0.00 C ATOM 265 O6 G A 50 -6.549 -0.495 2.477 1.00 0.00 O ATOM 266 N1 G A 50 -7.973 -1.050 0.787 1.00 0.00 N ATOM 267 C2 G A 50 -8.812 -1.932 0.130 1.00 0.00 C ATOM 268 N2 G A 50 -9.378 -1.502 -0.995 1.00 0.00 N ATOM 269 N3 G A 50 -9.069 -3.162 0.564 1.00 0.00 N ATOM 270 C4 G A 50 -8.421 -3.445 1.712 1.00 0.00 C ATOM 0 H5' G A 50 -12.785 -5.101 3.828 1.00 0.00 H new ATOM 0 H5'' G A 50 -12.457 -6.352 5.011 1.00 0.00 H new ATOM 0 H4' G A 50 -11.781 -7.150 2.964 1.00 0.00 H new ATOM 0 H3' G A 50 -9.434 -6.445 4.715 1.00 0.00 H new ATOM 0 H2' G A 50 -7.911 -7.195 2.928 1.00 0.00 H new ATOM 0 HO2' G A 50 -9.966 -8.758 2.309 1.00 0.00 H new ATOM 0 H1' G A 50 -9.119 -5.941 0.918 1.00 0.00 H new ATOM 0 H8 G A 50 -7.551 -5.246 4.229 1.00 0.00 H new ATOM 0 H1 G A 50 -7.845 -0.125 0.377 1.00 0.00 H new ATOM 0 H21 G A 50 -10.005 -2.114 -1.517 1.00 0.00 H new ATOM 0 H22 G A 50 -9.185 -0.560 -1.335 1.00 0.00 H new ATOM 282 P U A 51 -8.993 -9.062 5.182 1.00 0.00 P ATOM 283 OP1 U A 51 -9.558 -10.295 5.775 1.00 0.00 O ATOM 284 OP2 U A 51 -8.262 -8.091 6.026 1.00 0.00 O ATOM 285 O5' U A 51 -8.057 -9.471 3.935 1.00 0.00 O ATOM 286 C5' U A 51 -6.699 -9.844 4.120 1.00 0.00 C ATOM 287 C4' U A 51 -6.091 -10.388 2.830 1.00 0.00 C ATOM 288 O4' U A 51 -6.774 -11.590 2.470 1.00 0.00 O ATOM 289 C3' U A 51 -6.162 -9.453 1.623 1.00 0.00 C ATOM 290 O3' U A 51 -4.951 -9.621 0.886 1.00 0.00 O ATOM 291 C2' U A 51 -7.338 -9.948 0.799 1.00 0.00 C ATOM 292 O2' U A 51 -7.037 -9.904 -0.600 1.00 0.00 O ATOM 293 C1' U A 51 -7.537 -11.389 1.270 1.00 0.00 C ATOM 294 N1 U A 51 -8.947 -11.757 1.569 1.00 0.00 N ATOM 295 C2 U A 51 -9.433 -12.939 1.030 1.00 0.00 C ATOM 296 O2 U A 51 -8.740 -13.664 0.319 1.00 0.00 O ATOM 297 N3 U A 51 -10.742 -13.259 1.337 1.00 0.00 N ATOM 298 C4 U A 51 -11.602 -12.514 2.124 1.00 0.00 C ATOM 299 O4 U A 51 -12.752 -12.895 2.330 1.00 0.00 O ATOM 300 C5 U A 51 -11.018 -11.300 2.647 1.00 0.00 C ATOM 301 C6 U A 51 -9.736 -10.963 2.364 1.00 0.00 C ATOM 0 H5' U A 51 -6.631 -10.599 4.903 1.00 0.00 H new ATOM 0 H5'' U A 51 -6.126 -8.981 4.459 1.00 0.00 H new ATOM 0 H4' U A 51 -5.034 -10.533 3.055 1.00 0.00 H new ATOM 0 H3' U A 51 -6.282 -8.403 1.891 1.00 0.00 H new ATOM 0 H2' U A 51 -8.230 -9.336 0.931 1.00 0.00 H new ATOM 0 HO2' U A 51 -7.808 -10.229 -1.111 1.00 0.00 H new ATOM 0 H1' U A 51 -7.212 -12.020 0.443 1.00 0.00 H new ATOM 0 H3 U A 51 -11.109 -14.127 0.946 1.00 0.00 H new ATOM 0 H5 U A 51 -11.612 -10.651 3.273 1.00 0.00 H new ATOM 0 H6 U A 51 -9.327 -10.051 2.772 1.00 0.00 H new ATOM 312 P A A 52 -3.828 -8.476 0.756 1.00 0.00 P ATOM 313 OP1 A A 52 -2.631 -9.075 0.124 1.00 0.00 O ATOM 314 OP2 A A 52 -3.706 -7.801 2.068 1.00 0.00 O ATOM 315 O5' A A 52 -4.474 -7.434 -0.283 1.00 0.00 O ATOM 316 C5' A A 52 -5.327 -7.892 -1.331 1.00 0.00 C ATOM 317 C4' A A 52 -5.682 -6.767 -2.294 1.00 0.00 C ATOM 318 O4' A A 52 -6.450 -5.735 -1.659 1.00 0.00 O ATOM 319 C3' A A 52 -4.460 -6.073 -2.861 1.00 0.00 C ATOM 320 O3' A A 52 -3.954 -6.840 -3.962 1.00 0.00 O ATOM 321 C2' A A 52 -5.038 -4.754 -3.323 1.00 0.00 C ATOM 322 O2' A A 52 -5.688 -4.880 -4.593 1.00 0.00 O ATOM 323 C1' A A 52 -6.037 -4.463 -2.209 1.00 0.00 C ATOM 324 N9 A A 52 -5.481 -3.666 -1.104 1.00 0.00 N ATOM 325 C8 A A 52 -5.082 -4.085 0.139 1.00 0.00 C ATOM 326 N7 A A 52 -4.667 -3.119 0.911 1.00 0.00 N ATOM 327 C5 A A 52 -4.802 -1.980 0.121 1.00 0.00 C ATOM 328 C6 A A 52 -4.527 -0.623 0.354 1.00 0.00 C ATOM 329 N6 A A 52 -4.044 -0.166 1.505 1.00 0.00 N ATOM 330 N1 A A 52 -4.772 0.238 -0.647 1.00 0.00 N ATOM 331 C2 A A 52 -5.257 -0.225 -1.795 1.00 0.00 C ATOM 332 N3 A A 52 -5.557 -1.468 -2.132 1.00 0.00 N ATOM 333 C4 A A 52 -5.298 -2.307 -1.108 1.00 0.00 C ATOM 0 H5' A A 52 -6.239 -8.308 -0.903 1.00 0.00 H new ATOM 0 H5'' A A 52 -4.835 -8.697 -1.876 1.00 0.00 H new ATOM 0 H4' A A 52 -6.250 -7.261 -3.083 1.00 0.00 H new ATOM 0 H3' A A 52 -3.629 -5.953 -2.166 1.00 0.00 H new ATOM 0 H2' A A 52 -4.297 -3.970 -3.475 1.00 0.00 H new ATOM 0 HO2' A A 52 -5.611 -5.804 -4.909 1.00 0.00 H new ATOM 0 H1' A A 52 -6.852 -3.886 -2.646 1.00 0.00 H new ATOM 0 H8 A A 52 -5.109 -5.119 0.450 1.00 0.00 H new ATOM 0 H61 A A 52 -3.862 0.831 1.622 1.00 0.00 H new ATOM 0 H62 A A 52 -3.856 -0.812 2.271 1.00 0.00 H new ATOM 0 H2 A A 52 -5.430 0.518 -2.559 1.00 0.00 H new ATOM 345 P G A 53 -2.395 -6.804 -4.367 1.00 0.00 P ATOM 346 OP1 G A 53 -2.177 -7.779 -5.458 1.00 0.00 O ATOM 347 OP2 G A 53 -1.591 -6.893 -3.127 1.00 0.00 O ATOM 348 O5' G A 53 -2.225 -5.328 -4.971 1.00 0.00 O ATOM 349 C5' G A 53 -2.900 -4.951 -6.169 1.00 0.00 C ATOM 350 C4' G A 53 -2.714 -3.467 -6.450 1.00 0.00 C ATOM 351 O4' G A 53 -3.331 -2.693 -5.421 1.00 0.00 O ATOM 352 C3' G A 53 -1.269 -3.007 -6.479 1.00 0.00 C ATOM 353 O3' G A 53 -0.678 -3.288 -7.753 1.00 0.00 O ATOM 354 C2' G A 53 -1.446 -1.514 -6.279 1.00 0.00 C ATOM 355 O2' G A 53 -1.846 -0.865 -7.492 1.00 0.00 O ATOM 356 C1' G A 53 -2.563 -1.492 -5.238 1.00 0.00 C ATOM 357 N9 G A 53 -2.062 -1.463 -3.852 1.00 0.00 N ATOM 358 C8 G A 53 -1.868 -2.497 -2.974 1.00 0.00 C ATOM 359 N7 G A 53 -1.384 -2.124 -1.821 1.00 0.00 N ATOM 360 C5 G A 53 -1.246 -0.745 -1.947 1.00 0.00 C ATOM 361 C6 G A 53 -0.764 0.214 -1.015 1.00 0.00 C ATOM 362 O6 G A 53 -0.364 0.026 0.135 1.00 0.00 O ATOM 363 N1 G A 53 -0.790 1.501 -1.551 1.00 0.00 N ATOM 364 C2 G A 53 -1.228 1.817 -2.826 1.00 0.00 C ATOM 365 N2 G A 53 -1.181 3.102 -3.179 1.00 0.00 N ATOM 366 N3 G A 53 -1.680 0.914 -3.692 1.00 0.00 N ATOM 367 C4 G A 53 -1.660 -0.338 -3.188 1.00 0.00 C ATOM 0 H5' G A 53 -3.962 -5.179 -6.080 1.00 0.00 H new ATOM 0 H5'' G A 53 -2.518 -5.535 -7.006 1.00 0.00 H new ATOM 0 H4' G A 53 -3.157 -3.323 -7.435 1.00 0.00 H new ATOM 0 H3' G A 53 -0.619 -3.487 -5.748 1.00 0.00 H new ATOM 0 H2' G A 53 -0.539 -0.990 -5.978 1.00 0.00 H new ATOM 0 HO2' G A 53 -1.953 0.095 -7.329 1.00 0.00 H new ATOM 0 H1' G A 53 -3.150 -0.585 -5.381 1.00 0.00 H new ATOM 0 H8 G A 53 -2.095 -3.525 -3.214 1.00 0.00 H new ATOM 0 H1 G A 53 -0.462 2.266 -0.961 1.00 0.00 H new ATOM 0 H21 G A 53 -1.492 3.388 -4.107 1.00 0.00 H new ATOM 0 H22 G A 53 -0.834 3.799 -2.521 1.00 0.00 H new ATOM 379 P A A 54 0.908 -3.556 -7.879 1.00 0.00 P ATOM 380 OP1 A A 54 1.205 -3.914 -9.285 1.00 0.00 O ATOM 381 OP2 A A 54 1.312 -4.468 -6.785 1.00 0.00 O ATOM 382 O5' A A 54 1.540 -2.107 -7.586 1.00 0.00 O ATOM 383 C5' A A 54 1.315 -1.020 -8.478 1.00 0.00 C ATOM 384 C4' A A 54 1.853 0.286 -7.905 1.00 0.00 C ATOM 385 O4' A A 54 1.132 0.656 -6.725 1.00 0.00 O ATOM 386 C3' A A 54 3.309 0.263 -7.474 1.00 0.00 C ATOM 387 O3' A A 54 4.185 0.452 -8.582 1.00 0.00 O ATOM 388 C2' A A 54 3.363 1.482 -6.584 1.00 0.00 C ATOM 389 O2' A A 54 3.484 2.687 -7.351 1.00 0.00 O ATOM 390 C1' A A 54 2.024 1.406 -5.875 1.00 0.00 C ATOM 391 N9 A A 54 2.102 0.736 -4.566 1.00 0.00 N ATOM 392 C8 A A 54 1.805 -0.561 -4.231 1.00 0.00 C ATOM 393 N7 A A 54 1.976 -0.830 -2.967 1.00 0.00 N ATOM 394 C5 A A 54 2.422 0.373 -2.430 1.00 0.00 C ATOM 395 C6 A A 54 2.787 0.757 -1.132 1.00 0.00 C ATOM 396 N6 A A 54 2.756 -0.071 -0.089 1.00 0.00 N ATOM 397 N1 A A 54 3.185 2.028 -0.956 1.00 0.00 N ATOM 398 C2 A A 54 3.217 2.849 -1.998 1.00 0.00 C ATOM 399 N3 A A 54 2.897 2.610 -3.256 1.00 0.00 N ATOM 400 C4 A A 54 2.502 1.329 -3.400 1.00 0.00 C ATOM 0 H5' A A 54 0.247 -0.922 -8.673 1.00 0.00 H new ATOM 0 H5'' A A 54 1.796 -1.226 -9.434 1.00 0.00 H new ATOM 0 H4' A A 54 1.737 0.982 -8.736 1.00 0.00 H new ATOM 0 H3' A A 54 3.612 -0.676 -7.010 1.00 0.00 H new ATOM 0 H2' A A 54 4.219 1.499 -5.910 1.00 0.00 H new ATOM 0 HO2' A A 54 3.476 2.469 -8.306 1.00 0.00 H new ATOM 0 H1' A A 54 1.675 2.422 -5.691 1.00 0.00 H new ATOM 0 H8 A A 54 1.461 -1.292 -4.948 1.00 0.00 H new ATOM 0 H61 A A 54 3.033 0.262 0.835 1.00 0.00 H new ATOM 0 H62 A A 54 2.456 -1.038 -0.214 1.00 0.00 H new ATOM 0 H2 A A 54 3.552 3.854 -1.787 1.00 0.00 H new ATOM 412 P U A 55 5.685 -0.130 -8.546 1.00 0.00 P ATOM 413 OP1 U A 55 6.336 0.170 -9.841 1.00 0.00 O ATOM 414 OP2 U A 55 5.638 -1.520 -8.041 1.00 0.00 O ATOM 415 O5' U A 55 6.347 0.804 -7.414 1.00 0.00 O ATOM 416 C5' U A 55 6.462 2.210 -7.614 1.00 0.00 C ATOM 417 C4' U A 55 6.947 2.923 -6.352 1.00 0.00 C ATOM 418 O4' U A 55 5.993 2.766 -5.300 1.00 0.00 O ATOM 419 C3' U A 55 8.242 2.396 -5.764 1.00 0.00 C ATOM 420 O3' U A 55 9.365 2.942 -6.462 1.00 0.00 O ATOM 421 C2' U A 55 8.179 2.965 -4.359 1.00 0.00 C ATOM 422 O2' U A 55 8.655 4.316 -4.317 1.00 0.00 O ATOM 423 C1' U A 55 6.688 2.887 -4.042 1.00 0.00 C ATOM 424 N1 U A 55 6.346 1.727 -3.197 1.00 0.00 N ATOM 425 C2 U A 55 6.521 1.875 -1.839 1.00 0.00 C ATOM 426 O2 U A 55 6.926 2.926 -1.345 1.00 0.00 O ATOM 427 N3 U A 55 6.218 0.775 -1.063 1.00 0.00 N ATOM 428 C4 U A 55 5.756 -0.444 -1.516 1.00 0.00 C ATOM 429 O4 U A 55 5.511 -1.351 -0.718 1.00 0.00 O ATOM 430 C5 U A 55 5.600 -0.515 -2.956 1.00 0.00 C ATOM 431 C6 U A 55 5.900 0.552 -3.738 1.00 0.00 C ATOM 0 H5' U A 55 5.495 2.615 -7.912 1.00 0.00 H new ATOM 0 H5'' U A 55 7.156 2.406 -8.432 1.00 0.00 H new ATOM 0 H4' U A 55 7.093 3.951 -6.684 1.00 0.00 H new ATOM 0 H3' U A 55 8.350 1.313 -5.814 1.00 0.00 H new ATOM 0 H2' U A 55 8.804 2.429 -3.645 1.00 0.00 H new ATOM 0 HO2' U A 55 8.926 4.596 -5.216 1.00 0.00 H new ATOM 0 H1' U A 55 6.401 3.781 -3.488 1.00 0.00 H new ATOM 0 H3 U A 55 6.348 0.872 -0.056 1.00 0.00 H new ATOM 0 H5 U A 55 5.241 -1.427 -3.410 1.00 0.00 H new ATOM 0 H6 U A 55 5.785 0.473 -4.809 1.00 0.00 H new ATOM 442 P C A 56 10.767 2.146 -6.544 1.00 0.00 P ATOM 443 OP1 C A 56 11.681 2.910 -7.423 1.00 0.00 O ATOM 444 OP2 C A 56 10.475 0.727 -6.843 1.00 0.00 O ATOM 445 O5' C A 56 11.331 2.236 -5.036 1.00 0.00 O ATOM 446 C5' C A 56 11.680 3.496 -4.461 1.00 0.00 C ATOM 447 C4' C A 56 12.070 3.360 -2.989 1.00 0.00 C ATOM 448 O4' C A 56 10.964 2.927 -2.210 1.00 0.00 O ATOM 449 C3' C A 56 13.161 2.347 -2.707 1.00 0.00 C ATOM 450 O3' C A 56 14.434 2.944 -2.968 1.00 0.00 O ATOM 451 C2' C A 56 12.978 2.084 -1.219 1.00 0.00 C ATOM 452 O2' C A 56 13.756 2.991 -0.430 1.00 0.00 O ATOM 453 C1' C A 56 11.474 2.312 -1.012 1.00 0.00 C ATOM 454 N1 C A 56 10.710 1.069 -0.781 1.00 0.00 N ATOM 455 C2 C A 56 10.686 0.568 0.510 1.00 0.00 C ATOM 456 O2 C A 56 11.300 1.147 1.401 1.00 0.00 O ATOM 457 N3 C A 56 9.973 -0.572 0.750 1.00 0.00 N ATOM 458 C4 C A 56 9.315 -1.188 -0.245 1.00 0.00 C ATOM 459 N4 C A 56 8.618 -2.292 0.012 1.00 0.00 N ATOM 460 C5 C A 56 9.347 -0.674 -1.579 1.00 0.00 C ATOM 461 C6 C A 56 10.054 0.449 -1.800 1.00 0.00 C ATOM 0 H5' C A 56 10.838 4.183 -4.552 1.00 0.00 H new ATOM 0 H5'' C A 56 12.509 3.932 -5.018 1.00 0.00 H new ATOM 0 H4' C A 56 12.424 4.358 -2.731 1.00 0.00 H new ATOM 0 H3' C A 56 13.111 1.441 -3.311 1.00 0.00 H new ATOM 0 H2' C A 56 13.307 1.090 -0.915 1.00 0.00 H new ATOM 0 HO2' C A 56 14.217 3.624 -1.019 1.00 0.00 H new ATOM 0 H1' C A 56 11.355 2.930 -0.122 1.00 0.00 H new ATOM 0 H41 C A 56 8.116 -2.765 -0.740 1.00 0.00 H new ATOM 0 H42 C A 56 8.586 -2.666 0.961 1.00 0.00 H new ATOM 0 H5 C A 56 8.822 -1.170 -2.382 1.00 0.00 H new ATOM 0 H6 C A 56 10.102 0.863 -2.796 1.00 0.00 H new ATOM 473 P A A 57 15.710 2.059 -3.398 1.00 0.00 P ATOM 474 OP1 A A 57 16.819 2.981 -3.729 1.00 0.00 O ATOM 475 OP2 A A 57 15.262 1.061 -4.394 1.00 0.00 O ATOM 476 O5' A A 57 16.096 1.277 -2.044 1.00 0.00 O ATOM 477 C5' A A 57 16.541 1.999 -0.893 1.00 0.00 C ATOM 478 C4' A A 57 16.843 1.067 0.280 1.00 0.00 C ATOM 479 O4' A A 57 15.619 0.482 0.754 1.00 0.00 O ATOM 480 C3' A A 57 17.787 -0.084 -0.080 1.00 0.00 C ATOM 481 O3' A A 57 18.726 -0.332 0.973 1.00 0.00 O ATOM 482 C2' A A 57 16.850 -1.263 -0.255 1.00 0.00 C ATOM 483 O2' A A 57 17.496 -2.501 0.062 1.00 0.00 O ATOM 484 C1' A A 57 15.747 -0.943 0.731 1.00 0.00 C ATOM 485 N9 A A 57 14.438 -1.527 0.384 1.00 0.00 N ATOM 486 C8 A A 57 13.757 -1.476 -0.804 1.00 0.00 C ATOM 487 N7 A A 57 12.624 -2.124 -0.791 1.00 0.00 N ATOM 488 C5 A A 57 12.551 -2.640 0.499 1.00 0.00 C ATOM 489 C6 A A 57 11.590 -3.428 1.155 1.00 0.00 C ATOM 490 N6 A A 57 10.472 -3.853 0.570 1.00 0.00 N ATOM 491 N1 A A 57 11.834 -3.760 2.435 1.00 0.00 N ATOM 492 C2 A A 57 12.951 -3.336 3.011 1.00 0.00 C ATOM 493 N3 A A 57 13.924 -2.596 2.504 1.00 0.00 N ATOM 494 C4 A A 57 13.651 -2.279 1.221 1.00 0.00 C ATOM 0 H5' A A 57 15.778 2.719 -0.598 1.00 0.00 H new ATOM 0 H5'' A A 57 17.436 2.568 -1.145 1.00 0.00 H new ATOM 0 H4' A A 57 17.329 1.684 1.036 1.00 0.00 H new ATOM 0 H3' A A 57 18.387 0.123 -0.966 1.00 0.00 H new ATOM 0 H2' A A 57 16.497 -1.392 -1.278 1.00 0.00 H new ATOM 0 HO2' A A 57 16.864 -3.240 -0.060 1.00 0.00 H new ATOM 0 HO3' A A 57 18.840 -1.298 1.089 1.00 0.00 H new ATOM 0 H1' A A 57 16.022 -1.373 1.694 1.00 0.00 H new ATOM 0 H8 A A 57 14.124 -0.948 -1.672 1.00 0.00 H new ATOM 0 H61 A A 57 9.808 -4.423 1.093 1.00 0.00 H new ATOM 0 H62 A A 57 10.280 -3.608 -0.401 1.00 0.00 H new ATOM 0 H2 A A 57 13.086 -3.637 4.039 1.00 0.00 H new TER 507 A A 57