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 -0:sc= -0.711 USER MOD Single : A 42 G O5' : rot 180:sc= 0 USER MOD Single : A 43 A O2' : rot 180:sc= -0.241 USER MOD Single : A 44 U O2' : rot 180:sc= -0.139 USER MOD Single : A 45 C O2' : rot -6:sc= -0.867 USER MOD Single : A 46 U O2' : rot -13:sc= 0.112 USER MOD Single : A 47 C O2' : rot -174:sc= -2.1! USER MOD Single : A 48 U O2' : rot -107:sc= -6.03! USER MOD Single : A 49 U O2' : rot -36:sc= -1.21! USER MOD Single : A 50 G O2' : rot -86:sc= -6.01! USER MOD Single : A 51 U O2' : rot 180:sc= -5.38! USER MOD Single : A 52 A O2' : rot -5:sc= -0.594 USER MOD Single : A 53 G O2' : rot 180:sc= -0.372 USER MOD Single : A 54 A O2' : rot 1:sc= -1.77! USER MOD Single : A 55 U O2' : rot -2:sc= -0.732 USER MOD Single : A 56 C O2' : rot 180:sc= -2.28! USER MOD Single : A 57 A O2' : rot 180:sc=7.54e-05 USER MOD Single : A 57 A O3' : rot 137:sc= 0.245 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 42 7.444 -3.560 9.748 1.00 0.00 O ATOM 2 C5' G A 42 8.327 -2.955 10.694 1.00 0.00 C ATOM 3 C4' G A 42 9.090 -1.791 10.079 1.00 0.00 C ATOM 4 O4' G A 42 9.997 -2.241 9.074 1.00 0.00 O ATOM 5 C3' G A 42 8.215 -0.745 9.416 1.00 0.00 C ATOM 6 O3' G A 42 7.698 0.165 10.391 1.00 0.00 O ATOM 7 C2' G A 42 9.202 -0.066 8.500 1.00 0.00 C ATOM 8 O2' G A 42 9.994 0.902 9.199 1.00 0.00 O ATOM 9 C1' G A 42 10.040 -1.248 8.035 1.00 0.00 C ATOM 10 N9 G A 42 9.542 -1.881 6.805 1.00 0.00 N ATOM 11 C8 G A 42 8.767 -3.001 6.681 1.00 0.00 C ATOM 12 N7 G A 42 8.489 -3.317 5.446 1.00 0.00 N ATOM 13 C5 G A 42 9.128 -2.331 4.697 1.00 0.00 C ATOM 14 C6 G A 42 9.181 -2.146 3.287 1.00 0.00 C ATOM 15 O6 G A 42 8.665 -2.836 2.410 1.00 0.00 O ATOM 16 N1 G A 42 9.931 -1.021 2.947 1.00 0.00 N ATOM 17 C2 G A 42 10.554 -0.185 3.857 1.00 0.00 C ATOM 18 N2 G A 42 11.233 0.846 3.355 1.00 0.00 N ATOM 19 N3 G A 42 10.503 -0.363 5.179 1.00 0.00 N ATOM 20 C4 G A 42 9.776 -1.449 5.524 1.00 0.00 C ATOM 0 H5' G A 42 9.032 -3.700 11.063 1.00 0.00 H new ATOM 0 H5'' G A 42 7.756 -2.604 11.553 1.00 0.00 H new ATOM 0 H4' G A 42 9.601 -1.340 10.930 1.00 0.00 H new ATOM 0 H3' G A 42 7.340 -1.144 8.902 1.00 0.00 H new ATOM 0 H2' G A 42 8.741 0.500 7.690 1.00 0.00 H new ATOM 0 HO2' G A 42 9.726 0.925 10.141 1.00 0.00 H new ATOM 0 HO5' G A 42 6.970 -4.305 10.173 1.00 0.00 H new ATOM 0 H1' G A 42 11.042 -0.873 7.826 1.00 0.00 H new ATOM 0 H8 G A 42 8.417 -3.572 7.528 1.00 0.00 H new ATOM 0 H1 G A 42 10.027 -0.798 1.956 1.00 0.00 H new ATOM 0 H21 G A 42 11.712 1.494 3.980 1.00 0.00 H new ATOM 0 H22 G A 42 11.274 0.987 2.346 1.00 0.00 H new ATOM 33 P A A 43 6.315 0.953 10.134 1.00 0.00 P ATOM 34 OP1 A A 43 5.974 1.706 11.362 1.00 0.00 O ATOM 35 OP2 A A 43 5.340 -0.002 9.561 1.00 0.00 O ATOM 36 O5' A A 43 6.711 2.013 8.987 1.00 0.00 O ATOM 37 C5' A A 43 7.654 3.049 9.264 1.00 0.00 C ATOM 38 C4' A A 43 7.986 3.870 8.019 1.00 0.00 C ATOM 39 O4' A A 43 8.661 3.069 7.042 1.00 0.00 O ATOM 40 C3' A A 43 6.779 4.446 7.297 1.00 0.00 C ATOM 41 O3' A A 43 6.344 5.649 7.948 1.00 0.00 O ATOM 42 C2' A A 43 7.362 4.731 5.932 1.00 0.00 C ATOM 43 O2' A A 43 8.120 5.947 5.922 1.00 0.00 O ATOM 44 C1' A A 43 8.252 3.509 5.730 1.00 0.00 C ATOM 45 N9 A A 43 7.556 2.386 5.069 1.00 0.00 N ATOM 46 C8 A A 43 6.924 1.310 5.636 1.00 0.00 C ATOM 47 N7 A A 43 6.367 0.506 4.771 1.00 0.00 N ATOM 48 C5 A A 43 6.651 1.093 3.543 1.00 0.00 C ATOM 49 C6 A A 43 6.336 0.733 2.220 1.00 0.00 C ATOM 50 N6 A A 43 5.639 -0.361 1.897 1.00 0.00 N ATOM 51 N1 A A 43 6.772 1.546 1.247 1.00 0.00 N ATOM 52 C2 A A 43 7.470 2.628 1.563 1.00 0.00 C ATOM 53 N3 A A 43 7.829 3.070 2.756 1.00 0.00 N ATOM 54 C4 A A 43 7.376 2.238 3.717 1.00 0.00 C ATOM 0 H5' A A 43 8.568 2.610 9.663 1.00 0.00 H new ATOM 0 H5'' A A 43 7.254 3.707 10.036 1.00 0.00 H new ATOM 0 H4' A A 43 8.599 4.684 8.407 1.00 0.00 H new ATOM 0 H3' A A 43 5.902 3.799 7.272 1.00 0.00 H new ATOM 0 H2' A A 43 6.617 4.876 5.149 1.00 0.00 H new ATOM 0 HO2' A A 43 8.483 6.099 5.024 1.00 0.00 H new ATOM 0 H1' A A 43 9.085 3.794 5.088 1.00 0.00 H new ATOM 0 H8 A A 43 6.890 1.142 6.702 1.00 0.00 H new ATOM 0 H61 A A 43 5.442 -0.569 0.918 1.00 0.00 H new ATOM 0 H62 A A 43 5.305 -0.987 2.629 1.00 0.00 H new ATOM 0 H2 A A 43 7.790 3.234 0.728 1.00 0.00 H new ATOM 66 P U A 44 4.802 6.123 7.857 1.00 0.00 P ATOM 67 OP1 U A 44 4.627 7.294 8.746 1.00 0.00 O ATOM 68 OP2 U A 44 3.942 4.931 8.031 1.00 0.00 O ATOM 69 O5' U A 44 4.661 6.627 6.332 1.00 0.00 O ATOM 70 C5' U A 44 5.388 7.780 5.900 1.00 0.00 C ATOM 71 C4' U A 44 5.254 8.028 4.397 1.00 0.00 C ATOM 72 O4' U A 44 5.868 6.970 3.662 1.00 0.00 O ATOM 73 C3' U A 44 3.832 8.096 3.872 1.00 0.00 C ATOM 74 O3' U A 44 3.263 9.393 4.102 1.00 0.00 O ATOM 75 C2' U A 44 4.077 7.872 2.393 1.00 0.00 C ATOM 76 O2' U A 44 4.559 9.061 1.754 1.00 0.00 O ATOM 77 C1' U A 44 5.141 6.784 2.430 1.00 0.00 C ATOM 78 N1 U A 44 4.573 5.425 2.444 1.00 0.00 N ATOM 79 C2 U A 44 4.260 4.855 1.229 1.00 0.00 C ATOM 80 O2 U A 44 4.477 5.427 0.163 1.00 0.00 O ATOM 81 N3 U A 44 3.690 3.598 1.279 1.00 0.00 N ATOM 82 C4 U A 44 3.411 2.871 2.422 1.00 0.00 C ATOM 83 O4 U A 44 2.906 1.754 2.346 1.00 0.00 O ATOM 84 C5 U A 44 3.767 3.544 3.648 1.00 0.00 C ATOM 85 C6 U A 44 4.324 4.778 3.626 1.00 0.00 C ATOM 0 H5' U A 44 6.441 7.657 6.152 1.00 0.00 H new ATOM 0 H5'' U A 44 5.031 8.655 6.443 1.00 0.00 H new ATOM 0 H4' U A 44 5.728 9.000 4.259 1.00 0.00 H new ATOM 0 H3' U A 44 3.139 7.394 4.335 1.00 0.00 H new ATOM 0 H2' U A 44 3.185 7.604 1.827 1.00 0.00 H new ATOM 0 HO2' U A 44 4.708 8.883 0.802 1.00 0.00 H new ATOM 0 H1' U A 44 5.759 6.868 1.536 1.00 0.00 H new ATOM 0 H3 U A 44 3.452 3.164 0.387 1.00 0.00 H new ATOM 0 H5 U A 44 3.587 3.057 4.595 1.00 0.00 H new ATOM 0 H6 U A 44 4.577 5.262 4.558 1.00 0.00 H new ATOM 96 P C A 45 1.667 9.561 4.278 1.00 0.00 P ATOM 97 OP1 C A 45 1.386 10.969 4.639 1.00 0.00 O ATOM 98 OP2 C A 45 1.186 8.469 5.154 1.00 0.00 O ATOM 99 O5' C A 45 1.098 9.301 2.793 1.00 0.00 O ATOM 100 C5' C A 45 1.405 10.209 1.733 1.00 0.00 C ATOM 101 C4' C A 45 0.908 9.700 0.381 1.00 0.00 C ATOM 102 O4' C A 45 1.608 8.515 0.003 1.00 0.00 O ATOM 103 C3' C A 45 -0.562 9.326 0.318 1.00 0.00 C ATOM 104 O3' C A 45 -1.372 10.488 0.126 1.00 0.00 O ATOM 105 C2' C A 45 -0.589 8.454 -0.916 1.00 0.00 C ATOM 106 O2' C A 45 -0.607 9.240 -2.114 1.00 0.00 O ATOM 107 C1' C A 45 0.718 7.685 -0.770 1.00 0.00 C ATOM 108 N1 C A 45 0.561 6.407 -0.053 1.00 0.00 N ATOM 109 C2 C A 45 0.153 5.312 -0.790 1.00 0.00 C ATOM 110 O2 C A 45 -0.073 5.433 -1.994 1.00 0.00 O ATOM 111 N3 C A 45 0.005 4.121 -0.144 1.00 0.00 N ATOM 112 C4 C A 45 0.251 4.012 1.167 1.00 0.00 C ATOM 113 N4 C A 45 0.102 2.829 1.764 1.00 0.00 N ATOM 114 C5 C A 45 0.671 5.144 1.932 1.00 0.00 C ATOM 115 C6 C A 45 0.806 6.317 1.287 1.00 0.00 C ATOM 0 H5' C A 45 2.483 10.363 1.688 1.00 0.00 H new ATOM 0 H5'' C A 45 0.953 11.178 1.944 1.00 0.00 H new ATOM 0 H4' C A 45 1.082 10.549 -0.280 1.00 0.00 H new ATOM 0 H3' C A 45 -0.943 8.847 1.220 1.00 0.00 H new ATOM 0 H2' C A 45 -1.472 7.819 -0.994 1.00 0.00 H new ATOM 0 HO2' C A 45 -0.692 10.188 -1.882 1.00 0.00 H new ATOM 0 H1' C A 45 1.092 7.455 -1.768 1.00 0.00 H new ATOM 0 H41 C A 45 0.287 2.735 2.763 1.00 0.00 H new ATOM 0 H42 C A 45 -0.197 2.018 1.222 1.00 0.00 H new ATOM 0 H5 C A 45 0.873 5.061 2.990 1.00 0.00 H new ATOM 0 H6 C A 45 1.111 7.196 1.835 1.00 0.00 H new ATOM 127 P U A 46 -2.902 10.525 0.634 1.00 0.00 P ATOM 128 OP1 U A 46 -3.436 11.886 0.405 1.00 0.00 O ATOM 129 OP2 U A 46 -2.952 9.931 1.989 1.00 0.00 O ATOM 130 O5' U A 46 -3.639 9.516 -0.388 1.00 0.00 O ATOM 131 C5' U A 46 -3.720 9.828 -1.782 1.00 0.00 C ATOM 132 C4' U A 46 -4.406 8.719 -2.584 1.00 0.00 C ATOM 133 O4' U A 46 -3.624 7.519 -2.554 1.00 0.00 O ATOM 134 C3' U A 46 -5.771 8.313 -2.063 1.00 0.00 C ATOM 135 O3' U A 46 -6.768 9.240 -2.528 1.00 0.00 O ATOM 136 C2' U A 46 -5.929 6.954 -2.721 1.00 0.00 C ATOM 137 O2' U A 46 -6.325 7.073 -4.093 1.00 0.00 O ATOM 138 C1' U A 46 -4.518 6.387 -2.594 1.00 0.00 C ATOM 139 N1 U A 46 -4.312 5.599 -1.362 1.00 0.00 N ATOM 140 C2 U A 46 -4.696 4.270 -1.382 1.00 0.00 C ATOM 141 O2 U A 46 -5.178 3.741 -2.379 1.00 0.00 O ATOM 142 N3 U A 46 -4.511 3.566 -0.209 1.00 0.00 N ATOM 143 C4 U A 46 -3.986 4.063 0.967 1.00 0.00 C ATOM 144 O4 U A 46 -3.872 3.340 1.953 1.00 0.00 O ATOM 145 C5 U A 46 -3.612 5.458 0.902 1.00 0.00 C ATOM 146 C6 U A 46 -3.784 6.171 -0.238 1.00 0.00 C ATOM 0 H5' U A 46 -2.716 9.991 -2.175 1.00 0.00 H new ATOM 0 H5'' U A 46 -4.268 10.761 -1.913 1.00 0.00 H new ATOM 0 H4' U A 46 -4.511 9.147 -3.581 1.00 0.00 H new ATOM 0 H3' U A 46 -5.873 8.296 -0.978 1.00 0.00 H new ATOM 0 H2' U A 46 -6.701 6.332 -2.269 1.00 0.00 H new ATOM 0 HO2' U A 46 -6.622 7.990 -4.270 1.00 0.00 H new ATOM 0 H1' U A 46 -4.339 5.716 -3.434 1.00 0.00 H new ATOM 0 H3 U A 46 -4.789 2.585 -0.211 1.00 0.00 H new ATOM 0 H5 U A 46 -3.190 5.938 1.773 1.00 0.00 H new ATOM 0 H6 U A 46 -3.498 7.212 -0.259 1.00 0.00 H new ATOM 157 P C A 47 -8.111 9.519 -1.669 1.00 0.00 P ATOM 158 OP1 C A 47 -8.847 10.623 -2.325 1.00 0.00 O ATOM 159 OP2 C A 47 -7.725 9.643 -0.245 1.00 0.00 O ATOM 160 O5' C A 47 -8.984 8.174 -1.833 1.00 0.00 O ATOM 161 C5' C A 47 -9.522 7.810 -3.107 1.00 0.00 C ATOM 162 C4' C A 47 -10.187 6.434 -3.076 1.00 0.00 C ATOM 163 O4' C A 47 -9.226 5.421 -2.870 1.00 0.00 O ATOM 164 C3' C A 47 -11.235 6.237 -2.000 1.00 0.00 C ATOM 165 O3' C A 47 -12.483 6.796 -2.446 1.00 0.00 O ATOM 166 C2' C A 47 -11.302 4.718 -1.912 1.00 0.00 C ATOM 167 O2' C A 47 -12.222 4.190 -2.870 1.00 0.00 O ATOM 168 C1' C A 47 -9.859 4.295 -2.237 1.00 0.00 C ATOM 169 N1 C A 47 -9.038 3.977 -1.061 1.00 0.00 N ATOM 170 C2 C A 47 -9.093 2.693 -0.559 1.00 0.00 C ATOM 171 O2 C A 47 -9.824 1.854 -1.090 1.00 0.00 O ATOM 172 N3 C A 47 -8.308 2.393 0.516 1.00 0.00 N ATOM 173 C4 C A 47 -7.510 3.319 1.067 1.00 0.00 C ATOM 174 N4 C A 47 -6.748 2.991 2.110 1.00 0.00 N ATOM 175 C5 C A 47 -7.466 4.649 0.551 1.00 0.00 C ATOM 176 C6 C A 47 -8.247 4.932 -0.505 1.00 0.00 C ATOM 0 H5' C A 47 -8.725 7.811 -3.851 1.00 0.00 H new ATOM 0 H5'' C A 47 -10.251 8.558 -3.420 1.00 0.00 H new ATOM 0 H4' C A 47 -10.679 6.373 -4.047 1.00 0.00 H new ATOM 0 H3' C A 47 -11.017 6.713 -1.044 1.00 0.00 H new ATOM 0 H2' C A 47 -11.650 4.355 -0.945 1.00 0.00 H new ATOM 0 HO2' C A 47 -12.319 3.225 -2.733 1.00 0.00 H new ATOM 0 H1' C A 47 -9.924 3.395 -2.849 1.00 0.00 H new ATOM 0 H41 C A 47 -6.138 3.689 2.535 1.00 0.00 H new ATOM 0 H42 C A 47 -6.775 2.042 2.483 1.00 0.00 H new ATOM 0 H5 C A 47 -6.828 5.400 0.993 1.00 0.00 H new ATOM 0 H6 C A 47 -8.246 5.930 -0.917 1.00 0.00 H new ATOM 188 P U A 48 -13.593 7.355 -1.414 1.00 0.00 P ATOM 189 OP1 U A 48 -14.669 8.000 -2.200 1.00 0.00 O ATOM 190 OP2 U A 48 -12.893 8.126 -0.362 1.00 0.00 O ATOM 191 O5' U A 48 -14.204 6.027 -0.734 1.00 0.00 O ATOM 192 C5' U A 48 -15.565 6.034 -0.274 1.00 0.00 C ATOM 193 C4' U A 48 -16.003 4.677 0.270 1.00 0.00 C ATOM 194 O4' U A 48 -16.107 3.720 -0.797 1.00 0.00 O ATOM 195 C3' U A 48 -15.055 4.096 1.320 1.00 0.00 C ATOM 196 O3' U A 48 -15.851 3.446 2.329 1.00 0.00 O ATOM 197 C2' U A 48 -14.287 3.061 0.505 1.00 0.00 C ATOM 198 O2' U A 48 -13.759 2.015 1.319 1.00 0.00 O ATOM 199 C1' U A 48 -15.368 2.561 -0.423 1.00 0.00 C ATOM 200 N1 U A 48 -14.895 1.895 -1.661 1.00 0.00 N ATOM 201 C2 U A 48 -15.325 0.598 -1.902 1.00 0.00 C ATOM 202 O2 U A 48 -16.034 -0.013 -1.106 1.00 0.00 O ATOM 203 N3 U A 48 -14.903 0.027 -3.089 1.00 0.00 N ATOM 204 C4 U A 48 -14.101 0.626 -4.043 1.00 0.00 C ATOM 205 O4 U A 48 -13.792 0.025 -5.070 1.00 0.00 O ATOM 206 C5 U A 48 -13.698 1.973 -3.710 1.00 0.00 C ATOM 207 C6 U A 48 -14.098 2.555 -2.553 1.00 0.00 C ATOM 0 H5' U A 48 -16.222 6.322 -1.095 1.00 0.00 H new ATOM 0 H5'' U A 48 -15.678 6.788 0.505 1.00 0.00 H new ATOM 0 H4' U A 48 -16.967 4.858 0.746 1.00 0.00 H new ATOM 0 H3' U A 48 -14.411 4.818 1.821 1.00 0.00 H new ATOM 0 H2' U A 48 -13.408 3.460 -0.002 1.00 0.00 H new ATOM 0 HO2' U A 48 -12.788 2.119 1.396 1.00 0.00 H new ATOM 0 H1' U A 48 -15.935 1.796 0.107 1.00 0.00 H new ATOM 0 H3 U A 48 -15.213 -0.926 -3.279 1.00 0.00 H new ATOM 0 H5 U A 48 -13.069 2.524 -4.393 1.00 0.00 H new ATOM 0 H6 U A 48 -13.780 3.563 -2.331 1.00 0.00 H new ATOM 218 P U A 49 -15.428 3.341 3.892 1.00 0.00 P ATOM 219 OP1 U A 49 -16.555 2.730 4.632 1.00 0.00 O ATOM 220 OP2 U A 49 -14.906 4.660 4.313 1.00 0.00 O ATOM 221 O5' U A 49 -14.204 2.299 3.903 1.00 0.00 O ATOM 222 C5' U A 49 -14.381 0.952 3.476 1.00 0.00 C ATOM 223 C4' U A 49 -13.045 0.217 3.443 1.00 0.00 C ATOM 224 O4' U A 49 -12.139 0.941 2.589 1.00 0.00 O ATOM 225 C3' U A 49 -12.345 0.089 4.798 1.00 0.00 C ATOM 226 O3' U A 49 -11.735 -1.199 4.833 1.00 0.00 O ATOM 227 C2' U A 49 -11.290 1.169 4.809 1.00 0.00 C ATOM 228 O2' U A 49 -10.128 0.764 5.541 1.00 0.00 O ATOM 229 C1' U A 49 -10.981 1.359 3.342 1.00 0.00 C ATOM 230 N1 U A 49 -10.668 2.759 3.001 1.00 0.00 N ATOM 231 C2 U A 49 -9.374 3.187 3.218 1.00 0.00 C ATOM 232 O2 U A 49 -8.512 2.445 3.682 1.00 0.00 O ATOM 233 N3 U A 49 -9.106 4.504 2.890 1.00 0.00 N ATOM 234 C4 U A 49 -10.008 5.415 2.370 1.00 0.00 C ATOM 235 O4 U A 49 -9.660 6.565 2.114 1.00 0.00 O ATOM 236 C5 U A 49 -11.336 4.879 2.176 1.00 0.00 C ATOM 237 C6 U A 49 -11.621 3.594 2.495 1.00 0.00 C ATOM 0 H5' U A 49 -14.835 0.936 2.485 1.00 0.00 H new ATOM 0 H5'' U A 49 -15.067 0.439 4.150 1.00 0.00 H new ATOM 0 H4' U A 49 -13.280 -0.788 3.093 1.00 0.00 H new ATOM 0 H3' U A 49 -13.015 0.194 5.652 1.00 0.00 H new ATOM 0 H2' U A 49 -11.623 2.084 5.299 1.00 0.00 H new ATOM 0 HO2' U A 49 -10.399 0.220 6.310 1.00 0.00 H new ATOM 0 H1' U A 49 -10.099 0.766 3.100 1.00 0.00 H new ATOM 0 H3 U A 49 -8.154 4.834 3.046 1.00 0.00 H new ATOM 0 H5 U A 49 -12.112 5.512 1.771 1.00 0.00 H new ATOM 0 H6 U A 49 -12.624 3.222 2.346 1.00 0.00 H new ATOM 248 P G A 50 -11.230 -1.904 6.185 1.00 0.00 P ATOM 249 OP1 G A 50 -12.372 -2.013 7.120 1.00 0.00 O ATOM 250 OP2 G A 50 -9.968 -1.262 6.615 1.00 0.00 O ATOM 251 O5' G A 50 -10.890 -3.368 5.619 1.00 0.00 O ATOM 252 C5' G A 50 -11.946 -4.235 5.201 1.00 0.00 C ATOM 253 C4' G A 50 -11.424 -5.392 4.366 1.00 0.00 C ATOM 254 O4' G A 50 -11.012 -4.877 3.104 1.00 0.00 O ATOM 255 C3' G A 50 -10.231 -6.118 4.977 1.00 0.00 C ATOM 256 O3' G A 50 -10.599 -7.418 5.408 1.00 0.00 O ATOM 257 C2' G A 50 -9.251 -6.245 3.818 1.00 0.00 C ATOM 258 O2' G A 50 -9.456 -7.467 3.100 1.00 0.00 O ATOM 259 C1' G A 50 -9.604 -5.043 2.965 1.00 0.00 C ATOM 260 N9 G A 50 -8.953 -3.785 3.386 1.00 0.00 N ATOM 261 C8 G A 50 -8.272 -3.512 4.544 1.00 0.00 C ATOM 262 N7 G A 50 -7.754 -2.321 4.587 1.00 0.00 N ATOM 263 C5 G A 50 -8.109 -1.759 3.370 1.00 0.00 C ATOM 264 C6 G A 50 -7.826 -0.469 2.856 1.00 0.00 C ATOM 265 O6 G A 50 -7.176 0.432 3.387 1.00 0.00 O ATOM 266 N1 G A 50 -8.380 -0.295 1.591 1.00 0.00 N ATOM 267 C2 G A 50 -9.107 -1.251 0.905 1.00 0.00 C ATOM 268 N2 G A 50 -9.559 -0.909 -0.304 1.00 0.00 N ATOM 269 N3 G A 50 -9.366 -2.468 1.391 1.00 0.00 N ATOM 270 C4 G A 50 -8.841 -2.648 2.625 1.00 0.00 C ATOM 0 H5' G A 50 -12.675 -3.668 4.622 1.00 0.00 H new ATOM 0 H5'' G A 50 -12.466 -4.623 6.076 1.00 0.00 H new ATOM 0 H4' G A 50 -12.237 -6.114 4.294 1.00 0.00 H new ATOM 0 H3' G A 50 -9.829 -5.590 5.842 1.00 0.00 H new ATOM 0 H2' G A 50 -8.206 -6.269 4.129 1.00 0.00 H new ATOM 0 HO2' G A 50 -8.955 -8.189 3.533 1.00 0.00 H new ATOM 0 H1' G A 50 -9.265 -5.231 1.946 1.00 0.00 H new ATOM 0 H8 G A 50 -8.175 -4.224 5.350 1.00 0.00 H new ATOM 0 H1 G A 50 -8.239 0.606 1.135 1.00 0.00 H new ATOM 0 H21 G A 50 -10.101 -1.576 -0.853 1.00 0.00 H new ATOM 0 H22 G A 50 -9.362 0.019 -0.678 1.00 0.00 H new ATOM 282 P U A 51 -9.493 -8.324 6.131 1.00 0.00 P ATOM 283 OP1 U A 51 -10.154 -9.544 6.646 1.00 0.00 O ATOM 284 OP2 U A 51 -8.710 -7.462 7.045 1.00 0.00 O ATOM 285 O5' U A 51 -8.553 -8.740 4.893 1.00 0.00 O ATOM 286 C5' U A 51 -7.207 -9.160 5.103 1.00 0.00 C ATOM 287 C4' U A 51 -6.620 -9.757 3.831 1.00 0.00 C ATOM 288 O4' U A 51 -7.347 -10.943 3.497 1.00 0.00 O ATOM 289 C3' U A 51 -6.665 -8.844 2.612 1.00 0.00 C ATOM 290 O3' U A 51 -5.480 -9.081 1.853 1.00 0.00 O ATOM 291 C2' U A 51 -7.892 -9.289 1.840 1.00 0.00 C ATOM 292 O2' U A 51 -7.675 -9.207 0.427 1.00 0.00 O ATOM 293 C1' U A 51 -8.090 -10.738 2.286 1.00 0.00 C ATOM 294 N1 U A 51 -9.503 -11.124 2.550 1.00 0.00 N ATOM 295 C2 U A 51 -9.975 -12.287 1.959 1.00 0.00 C ATOM 296 O2 U A 51 -9.268 -12.983 1.234 1.00 0.00 O ATOM 297 N3 U A 51 -11.288 -12.622 2.233 1.00 0.00 N ATOM 298 C4 U A 51 -12.163 -11.910 3.034 1.00 0.00 C ATOM 299 O4 U A 51 -13.316 -12.300 3.204 1.00 0.00 O ATOM 300 C5 U A 51 -11.591 -10.715 3.611 1.00 0.00 C ATOM 301 C6 U A 51 -10.307 -10.364 3.360 1.00 0.00 C ATOM 0 H5' U A 51 -7.173 -9.897 5.905 1.00 0.00 H new ATOM 0 H5'' U A 51 -6.603 -8.311 5.424 1.00 0.00 H new ATOM 0 H4' U A 51 -5.570 -9.942 4.057 1.00 0.00 H new ATOM 0 H3' U A 51 -6.716 -7.782 2.854 1.00 0.00 H new ATOM 0 H2' U A 51 -8.763 -8.663 2.035 1.00 0.00 H new ATOM 0 HO2' U A 51 -8.482 -9.501 -0.045 1.00 0.00 H new ATOM 0 H1' U A 51 -7.747 -11.358 1.458 1.00 0.00 H new ATOM 0 H3 U A 51 -11.646 -13.475 1.804 1.00 0.00 H new ATOM 0 H5 U A 51 -12.197 -10.092 4.252 1.00 0.00 H new ATOM 0 H6 U A 51 -9.908 -9.466 3.808 1.00 0.00 H new ATOM 312 P A A 52 -4.321 -7.982 1.659 1.00 0.00 P ATOM 313 OP1 A A 52 -3.168 -8.641 1.007 1.00 0.00 O ATOM 314 OP2 A A 52 -4.133 -7.275 2.946 1.00 0.00 O ATOM 315 O5' A A 52 -4.966 -6.952 0.611 1.00 0.00 O ATOM 316 C5' A A 52 -5.868 -7.425 -0.387 1.00 0.00 C ATOM 317 C4' A A 52 -6.210 -6.345 -1.402 1.00 0.00 C ATOM 318 O4' A A 52 -6.920 -5.253 -0.801 1.00 0.00 O ATOM 319 C3' A A 52 -4.986 -5.729 -2.044 1.00 0.00 C ATOM 320 O3' A A 52 -4.541 -6.579 -3.107 1.00 0.00 O ATOM 321 C2' A A 52 -5.543 -4.426 -2.574 1.00 0.00 C ATOM 322 O2' A A 52 -6.241 -4.616 -3.810 1.00 0.00 O ATOM 323 C1' A A 52 -6.495 -4.034 -1.449 1.00 0.00 C ATOM 324 N9 A A 52 -5.883 -3.176 -0.423 1.00 0.00 N ATOM 325 C8 A A 52 -5.440 -3.511 0.831 1.00 0.00 C ATOM 326 N7 A A 52 -4.975 -2.498 1.512 1.00 0.00 N ATOM 327 C5 A A 52 -5.122 -1.417 0.644 1.00 0.00 C ATOM 328 C6 A A 52 -4.814 -0.051 0.764 1.00 0.00 C ATOM 329 N6 A A 52 -4.272 0.481 1.856 1.00 0.00 N ATOM 330 N1 A A 52 -5.086 0.738 -0.287 1.00 0.00 N ATOM 331 C2 A A 52 -5.625 0.201 -1.376 1.00 0.00 C ATOM 332 N3 A A 52 -5.960 -1.058 -1.607 1.00 0.00 N ATOM 333 C4 A A 52 -5.675 -1.824 -0.534 1.00 0.00 C ATOM 0 H5' A A 52 -6.783 -7.778 0.089 1.00 0.00 H new ATOM 0 H5'' A A 52 -5.426 -8.279 -0.901 1.00 0.00 H new ATOM 0 H4' A A 52 -6.816 -6.861 -2.147 1.00 0.00 H new ATOM 0 H3' A A 52 -4.130 -5.591 -1.383 1.00 0.00 H new ATOM 0 H2' A A 52 -4.786 -3.676 -2.803 1.00 0.00 H new ATOM 0 HO2' A A 52 -6.147 -5.548 -4.099 1.00 0.00 H new ATOM 0 H1' A A 52 -7.312 -3.467 -1.896 1.00 0.00 H new ATOM 0 H8 A A 52 -5.473 -4.518 1.219 1.00 0.00 H new ATOM 0 H61 A A 52 -4.069 1.480 1.890 1.00 0.00 H new ATOM 0 H62 A A 52 -4.060 -0.110 2.660 1.00 0.00 H new ATOM 0 H2 A A 52 -5.817 0.889 -2.187 1.00 0.00 H new ATOM 345 P G A 53 -2.998 -6.611 -3.566 1.00 0.00 P ATOM 346 OP1 G A 53 -2.840 -7.673 -4.585 1.00 0.00 O ATOM 347 OP2 G A 53 -2.152 -6.621 -2.351 1.00 0.00 O ATOM 348 O5' G A 53 -2.824 -5.190 -4.288 1.00 0.00 O ATOM 349 C5' G A 53 -3.544 -4.910 -5.486 1.00 0.00 C ATOM 350 C4' G A 53 -3.364 -3.461 -5.915 1.00 0.00 C ATOM 351 O4' G A 53 -3.941 -2.583 -4.943 1.00 0.00 O ATOM 352 C3' G A 53 -1.922 -3.010 -6.050 1.00 0.00 C ATOM 353 O3' G A 53 -1.381 -3.413 -7.312 1.00 0.00 O ATOM 354 C2' G A 53 -2.100 -1.505 -6.000 1.00 0.00 C ATOM 355 O2' G A 53 -2.579 -0.992 -7.249 1.00 0.00 O ATOM 356 C1' G A 53 -3.153 -1.381 -4.903 1.00 0.00 C ATOM 357 N9 G A 53 -2.565 -1.249 -3.560 1.00 0.00 N ATOM 358 C8 G A 53 -2.321 -2.214 -2.618 1.00 0.00 C ATOM 359 N7 G A 53 -1.753 -1.762 -1.534 1.00 0.00 N ATOM 360 C5 G A 53 -1.609 -0.399 -1.778 1.00 0.00 C ATOM 361 C6 G A 53 -1.050 0.620 -0.960 1.00 0.00 C ATOM 362 O6 G A 53 -0.569 0.511 0.167 1.00 0.00 O ATOM 363 N1 G A 53 -1.098 1.862 -1.592 1.00 0.00 N ATOM 364 C2 G A 53 -1.621 2.089 -2.853 1.00 0.00 C ATOM 365 N2 G A 53 -1.583 3.343 -3.306 1.00 0.00 N ATOM 366 N3 G A 53 -2.146 1.129 -3.613 1.00 0.00 N ATOM 367 C4 G A 53 -2.106 -0.081 -3.015 1.00 0.00 C ATOM 0 H5' G A 53 -4.603 -5.117 -5.333 1.00 0.00 H new ATOM 0 H5'' G A 53 -3.202 -5.572 -6.281 1.00 0.00 H new ATOM 0 H4' G A 53 -3.845 -3.415 -6.892 1.00 0.00 H new ATOM 0 H3' G A 53 -1.242 -3.417 -5.301 1.00 0.00 H new ATOM 0 H2' G A 53 -1.183 -0.946 -5.812 1.00 0.00 H new ATOM 0 HO2' G A 53 -2.685 -0.020 -7.184 1.00 0.00 H new ATOM 0 H1' G A 53 -3.742 -0.481 -5.083 1.00 0.00 H new ATOM 0 H8 G A 53 -2.576 -3.254 -2.760 1.00 0.00 H new ATOM 0 H1 G A 53 -0.719 2.663 -1.087 1.00 0.00 H new ATOM 0 H21 G A 53 -1.956 3.563 -4.230 1.00 0.00 H new ATOM 0 H22 G A 53 -1.181 4.082 -2.729 1.00 0.00 H new ATOM 379 P A A 54 0.200 -3.683 -7.479 1.00 0.00 P ATOM 380 OP1 A A 54 0.446 -4.174 -8.854 1.00 0.00 O ATOM 381 OP2 A A 54 0.660 -4.477 -6.318 1.00 0.00 O ATOM 382 O5' A A 54 0.819 -2.205 -7.354 1.00 0.00 O ATOM 383 C5' A A 54 0.527 -1.209 -8.329 1.00 0.00 C ATOM 384 C4' A A 54 1.083 0.148 -7.911 1.00 0.00 C ATOM 385 O4' A A 54 0.437 0.619 -6.723 1.00 0.00 O ATOM 386 C3' A A 54 2.564 0.167 -7.577 1.00 0.00 C ATOM 387 O3' A A 54 3.355 0.263 -8.760 1.00 0.00 O ATOM 388 C2' A A 54 2.670 1.453 -6.796 1.00 0.00 C ATOM 389 O2' A A 54 2.731 2.592 -7.662 1.00 0.00 O ATOM 390 C1' A A 54 1.382 1.432 -5.995 1.00 0.00 C ATOM 391 N9 A A 54 1.549 0.867 -4.646 1.00 0.00 N ATOM 392 C8 A A 54 1.265 -0.394 -4.188 1.00 0.00 C ATOM 393 N7 A A 54 1.518 -0.562 -2.919 1.00 0.00 N ATOM 394 C5 A A 54 2.008 0.675 -2.514 1.00 0.00 C ATOM 395 C6 A A 54 2.464 1.157 -1.279 1.00 0.00 C ATOM 396 N6 A A 54 2.494 0.416 -0.173 1.00 0.00 N ATOM 397 N1 A A 54 2.884 2.433 -1.233 1.00 0.00 N ATOM 398 C2 A A 54 2.852 3.166 -2.339 1.00 0.00 C ATOM 399 N3 A A 54 2.445 2.829 -3.549 1.00 0.00 N ATOM 400 C4 A A 54 2.030 1.547 -3.562 1.00 0.00 C ATOM 0 H5' A A 54 -0.552 -1.136 -8.467 1.00 0.00 H new ATOM 0 H5'' A A 54 0.953 -1.500 -9.289 1.00 0.00 H new ATOM 0 H4' A A 54 0.902 0.769 -8.789 1.00 0.00 H new ATOM 0 H3' A A 54 2.909 -0.725 -7.054 1.00 0.00 H new ATOM 0 H2' A A 54 3.570 1.526 -6.186 1.00 0.00 H new ATOM 0 HO2' A A 54 2.673 2.297 -8.595 1.00 0.00 H new ATOM 0 H1' A A 54 1.043 2.460 -5.867 1.00 0.00 H new ATOM 0 H8 A A 54 0.869 -1.176 -4.819 1.00 0.00 H new ATOM 0 H61 A A 54 2.836 0.817 0.700 1.00 0.00 H new ATOM 0 H62 A A 54 2.175 -0.553 -0.199 1.00 0.00 H new ATOM 0 H2 A A 54 3.209 4.180 -2.235 1.00 0.00 H new ATOM 412 P U A 55 4.858 -0.309 -8.790 1.00 0.00 P ATOM 413 OP1 U A 55 5.405 -0.114 -10.151 1.00 0.00 O ATOM 414 OP2 U A 55 4.862 -1.653 -8.171 1.00 0.00 O ATOM 415 O5' U A 55 5.595 0.716 -7.792 1.00 0.00 O ATOM 416 C5' U A 55 5.690 2.102 -8.112 1.00 0.00 C ATOM 417 C4' U A 55 6.264 2.907 -6.948 1.00 0.00 C ATOM 418 O4' U A 55 5.390 2.832 -5.821 1.00 0.00 O ATOM 419 C3' U A 55 7.597 2.414 -6.420 1.00 0.00 C ATOM 420 O3' U A 55 8.672 2.892 -7.235 1.00 0.00 O ATOM 421 C2' U A 55 7.640 3.086 -5.060 1.00 0.00 C ATOM 422 O2' U A 55 8.117 4.434 -5.155 1.00 0.00 O ATOM 423 C1' U A 55 6.175 3.039 -4.629 1.00 0.00 C ATOM 424 N1 U A 55 5.900 1.944 -3.680 1.00 0.00 N ATOM 425 C2 U A 55 6.173 2.192 -2.353 1.00 0.00 C ATOM 426 O2 U A 55 6.591 3.283 -1.968 1.00 0.00 O ATOM 427 N3 U A 55 5.951 1.147 -1.480 1.00 0.00 N ATOM 428 C4 U A 55 5.478 -0.109 -1.809 1.00 0.00 C ATOM 429 O4 U A 55 5.312 -0.960 -0.933 1.00 0.00 O ATOM 430 C5 U A 55 5.216 -0.284 -3.224 1.00 0.00 C ATOM 431 C6 U A 55 5.435 0.728 -4.100 1.00 0.00 C ATOM 0 H5' U A 55 4.703 2.486 -8.369 1.00 0.00 H new ATOM 0 H5'' U A 55 6.321 2.231 -8.991 1.00 0.00 H new ATOM 0 H4' U A 55 6.384 3.908 -7.363 1.00 0.00 H new ATOM 0 H3' U A 55 7.695 1.329 -6.399 1.00 0.00 H new ATOM 0 H2' U A 55 8.317 2.603 -4.356 1.00 0.00 H new ATOM 0 HO2' U A 55 8.353 4.633 -6.085 1.00 0.00 H new ATOM 0 H1' U A 55 5.926 3.971 -4.122 1.00 0.00 H new ATOM 0 H3 U A 55 6.156 1.318 -0.496 1.00 0.00 H new ATOM 0 H5 U A 55 4.842 -1.231 -3.585 1.00 0.00 H new ATOM 0 H6 U A 55 5.238 0.571 -5.150 1.00 0.00 H new ATOM 442 P C A 56 10.048 2.057 -7.357 1.00 0.00 P ATOM 443 OP1 C A 56 10.912 2.737 -8.348 1.00 0.00 O ATOM 444 OP2 C A 56 9.703 0.630 -7.540 1.00 0.00 O ATOM 445 O5' C A 56 10.726 2.226 -5.904 1.00 0.00 O ATOM 446 C5' C A 56 11.168 3.502 -5.437 1.00 0.00 C ATOM 447 C4' C A 56 11.722 3.417 -4.015 1.00 0.00 C ATOM 448 O4' C A 56 10.703 3.069 -3.089 1.00 0.00 O ATOM 449 C3' C A 56 12.802 2.375 -3.817 1.00 0.00 C ATOM 450 O3' C A 56 14.060 2.902 -4.253 1.00 0.00 O ATOM 451 C2' C A 56 12.788 2.176 -2.309 1.00 0.00 C ATOM 452 O2' C A 56 13.694 3.073 -1.656 1.00 0.00 O ATOM 453 C1' C A 56 11.331 2.483 -1.934 1.00 0.00 C ATOM 454 N1 C A 56 10.548 1.293 -1.550 1.00 0.00 N ATOM 455 C2 C A 56 10.670 0.846 -0.244 1.00 0.00 C ATOM 456 O2 C A 56 11.422 1.430 0.534 1.00 0.00 O ATOM 457 N3 C A 56 9.943 -0.244 0.140 1.00 0.00 N ATOM 458 C4 C A 56 9.135 -0.867 -0.729 1.00 0.00 C ATOM 459 N4 C A 56 8.433 -1.926 -0.328 1.00 0.00 N ATOM 460 C5 C A 56 9.014 -0.411 -2.080 1.00 0.00 C ATOM 461 C6 C A 56 9.735 0.666 -2.444 1.00 0.00 C ATOM 0 H5' C A 56 10.338 4.208 -5.464 1.00 0.00 H new ATOM 0 H5'' C A 56 11.937 3.889 -6.106 1.00 0.00 H new ATOM 0 H4' C A 56 12.137 4.411 -3.848 1.00 0.00 H new ATOM 0 H3' C A 56 12.646 1.450 -4.373 1.00 0.00 H new ATOM 0 H2' C A 56 13.108 1.179 -2.006 1.00 0.00 H new ATOM 0 HO2' C A 56 13.663 2.923 -0.688 1.00 0.00 H new ATOM 0 H1' C A 56 11.351 3.144 -1.067 1.00 0.00 H new ATOM 0 H41 C A 56 7.816 -2.406 -0.983 1.00 0.00 H new ATOM 0 H42 C A 56 8.513 -2.256 0.634 1.00 0.00 H new ATOM 0 H5 C A 56 8.367 -0.914 -2.783 1.00 0.00 H new ATOM 0 H6 C A 56 9.668 1.037 -3.456 1.00 0.00 H new ATOM 473 P A A 57 15.234 1.938 -4.789 1.00 0.00 P ATOM 474 OP1 A A 57 16.336 2.787 -5.293 1.00 0.00 O ATOM 475 OP2 A A 57 14.623 0.924 -5.678 1.00 0.00 O ATOM 476 O5' A A 57 15.745 1.194 -3.456 1.00 0.00 O ATOM 477 C5' A A 57 16.358 1.944 -2.404 1.00 0.00 C ATOM 478 C4' A A 57 16.760 1.060 -1.225 1.00 0.00 C ATOM 479 O4' A A 57 15.576 0.557 -0.585 1.00 0.00 O ATOM 480 C3' A A 57 17.612 -0.148 -1.623 1.00 0.00 C ATOM 481 O3' A A 57 18.664 -0.372 -0.678 1.00 0.00 O ATOM 482 C2' A A 57 16.626 -1.299 -1.605 1.00 0.00 C ATOM 483 O2' A A 57 17.266 -2.534 -1.263 1.00 0.00 O ATOM 484 C1' A A 57 15.644 -0.869 -0.534 1.00 0.00 C ATOM 485 N9 A A 57 14.285 -1.412 -0.713 1.00 0.00 N ATOM 486 C8 A A 57 13.495 -1.410 -1.833 1.00 0.00 C ATOM 487 N7 A A 57 12.347 -2.009 -1.671 1.00 0.00 N ATOM 488 C5 A A 57 12.380 -2.438 -0.348 1.00 0.00 C ATOM 489 C6 A A 57 11.459 -3.142 0.446 1.00 0.00 C ATOM 490 N6 A A 57 10.276 -3.559 -0.002 1.00 0.00 N ATOM 491 N1 A A 57 11.812 -3.400 1.717 1.00 0.00 N ATOM 492 C2 A A 57 12.993 -2.986 2.158 1.00 0.00 C ATOM 493 N3 A A 57 13.938 -2.320 1.514 1.00 0.00 N ATOM 494 C4 A A 57 13.556 -2.076 0.243 1.00 0.00 C ATOM 0 H5' A A 57 15.668 2.715 -2.060 1.00 0.00 H new ATOM 0 H5'' A A 57 17.240 2.455 -2.790 1.00 0.00 H new ATOM 0 H4' A A 57 17.357 1.690 -0.566 1.00 0.00 H new ATOM 0 H3' A A 57 18.101 -0.017 -2.588 1.00 0.00 H new ATOM 0 H2' A A 57 16.160 -1.487 -2.573 1.00 0.00 H new ATOM 0 HO2' A A 57 16.603 -3.256 -1.258 1.00 0.00 H new ATOM 0 HO3' A A 57 18.732 -1.331 -0.486 1.00 0.00 H new ATOM 0 H1' A A 57 16.000 -1.252 0.422 1.00 0.00 H new ATOM 0 H8 A A 57 13.795 -0.954 -2.765 1.00 0.00 H new ATOM 0 H61 A A 57 9.646 -4.067 0.619 1.00 0.00 H new ATOM 0 H62 A A 57 10.001 -3.371 -0.966 1.00 0.00 H new ATOM 0 H2 A A 57 13.214 -3.226 3.187 1.00 0.00 H new TER 507 A A 57