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= -0.348 USER MOD Single : A 42 G O5' : rot 180:sc= 0 USER MOD Single : A 43 A O2' : rot -11:sc= -0.208 USER MOD Single : A 44 U O2' : rot -7:sc= -0.147 USER MOD Single : A 45 C O2' : rot -0:sc= -0.701 USER MOD Single : A 46 U O2' : rot 180:sc= -0.134 USER MOD Single : A 47 C O2' : rot 180:sc= -2.94! USER MOD Single : A 48 U O2' : rot -110:sc= -5.84! USER MOD Single : A 49 U O2' : rot -43:sc= 0.0874 USER MOD Single : A 50 G O2' : rot -0:sc= -4.97! USER MOD Single : A 51 U O2' : rot 180:sc= -3.3! USER MOD Single : A 52 A O2' : rot -1:sc= -0.449 USER MOD Single : A 53 G O2' : rot 180:sc= -0.522 USER MOD Single : A 54 A O2' : rot 1:sc= -1.68! USER MOD Single : A 55 U O2' : rot -4:sc= -1.1 USER MOD Single : A 56 C O2' : rot 180:sc= -2.06! USER MOD Single : A 57 A O2' : rot -16:sc= 0.236 USER MOD Single : A 57 A O3' : rot 180:sc= 0.223 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 42 6.157 -3.598 9.757 1.00 0.00 O ATOM 2 C5' G A 42 7.006 -3.103 10.796 1.00 0.00 C ATOM 3 C4' G A 42 7.791 -1.882 10.338 1.00 0.00 C ATOM 4 O4' G A 42 8.739 -2.223 9.327 1.00 0.00 O ATOM 5 C3' G A 42 6.935 -0.774 9.756 1.00 0.00 C ATOM 6 O3' G A 42 6.382 0.030 10.805 1.00 0.00 O ATOM 7 C2' G A 42 7.958 0.000 8.957 1.00 0.00 C ATOM 8 O2' G A 42 8.713 0.887 9.790 1.00 0.00 O ATOM 9 C1' G A 42 8.825 -1.124 8.404 1.00 0.00 C ATOM 10 N9 G A 42 8.390 -1.632 7.091 1.00 0.00 N ATOM 11 C8 G A 42 7.627 -2.735 6.827 1.00 0.00 C ATOM 12 N7 G A 42 7.404 -2.934 5.558 1.00 0.00 N ATOM 13 C5 G A 42 8.069 -1.884 4.932 1.00 0.00 C ATOM 14 C6 G A 42 8.178 -1.573 3.547 1.00 0.00 C ATOM 15 O6 G A 42 7.702 -2.183 2.593 1.00 0.00 O ATOM 16 N1 G A 42 8.935 -0.423 3.339 1.00 0.00 N ATOM 17 C2 G A 42 9.517 0.329 4.343 1.00 0.00 C ATOM 18 N2 G A 42 10.210 1.399 3.958 1.00 0.00 N ATOM 19 N3 G A 42 9.414 0.034 5.645 1.00 0.00 N ATOM 20 C4 G A 42 8.678 -1.080 5.863 1.00 0.00 C ATOM 0 H5' G A 42 7.697 -3.886 11.107 1.00 0.00 H new ATOM 0 H5'' G A 42 6.404 -2.845 11.667 1.00 0.00 H new ATOM 0 H4' G A 42 8.270 -1.525 11.249 1.00 0.00 H new ATOM 0 H3' G A 42 6.082 -1.116 9.170 1.00 0.00 H new ATOM 0 H2' G A 42 7.528 0.646 8.191 1.00 0.00 H new ATOM 0 HO2' G A 42 8.333 0.890 10.693 1.00 0.00 H new ATOM 0 HO5' G A 42 5.667 -4.383 10.081 1.00 0.00 H new ATOM 0 H1' G A 42 9.830 -0.720 8.280 1.00 0.00 H new ATOM 0 H8 G A 42 7.243 -3.384 7.601 1.00 0.00 H new ATOM 0 H1 G A 42 9.070 -0.113 2.377 1.00 0.00 H new ATOM 0 H21 G A 42 10.662 1.992 4.654 1.00 0.00 H new ATOM 0 H22 G A 42 10.289 1.626 2.967 1.00 0.00 H new ATOM 33 P A A 43 4.985 0.808 10.598 1.00 0.00 P ATOM 34 OP1 A A 43 4.625 1.449 11.883 1.00 0.00 O ATOM 35 OP2 A A 43 4.033 -0.117 9.946 1.00 0.00 O ATOM 36 O5' A A 43 5.358 1.972 9.547 1.00 0.00 O ATOM 37 C5' A A 43 6.258 3.019 9.913 1.00 0.00 C ATOM 38 C4' A A 43 6.586 3.934 8.732 1.00 0.00 C ATOM 39 O4' A A 43 7.320 3.229 7.723 1.00 0.00 O ATOM 40 C3' A A 43 5.379 4.511 8.013 1.00 0.00 C ATOM 41 O3' A A 43 4.870 5.648 8.718 1.00 0.00 O ATOM 42 C2' A A 43 5.994 4.922 6.698 1.00 0.00 C ATOM 43 O2' A A 43 6.702 6.162 6.813 1.00 0.00 O ATOM 44 C1' A A 43 6.938 3.757 6.434 1.00 0.00 C ATOM 45 N9 A A 43 6.317 2.665 5.659 1.00 0.00 N ATOM 46 C8 A A 43 5.741 1.506 6.113 1.00 0.00 C ATOM 47 N7 A A 43 5.265 0.745 5.167 1.00 0.00 N ATOM 48 C5 A A 43 5.543 1.449 4.002 1.00 0.00 C ATOM 49 C6 A A 43 5.289 1.181 2.647 1.00 0.00 C ATOM 50 N6 A A 43 4.679 0.073 2.218 1.00 0.00 N ATOM 51 N1 A A 43 5.691 2.099 1.756 1.00 0.00 N ATOM 52 C2 A A 43 6.307 3.195 2.182 1.00 0.00 C ATOM 53 N3 A A 43 6.605 3.558 3.418 1.00 0.00 N ATOM 54 C4 A A 43 6.185 2.621 4.292 1.00 0.00 C ATOM 0 H5' A A 43 7.179 2.585 10.302 1.00 0.00 H new ATOM 0 H5'' A A 43 5.819 3.609 10.717 1.00 0.00 H new ATOM 0 H4' A A 43 7.152 4.743 9.194 1.00 0.00 H new ATOM 0 H3' A A 43 4.536 3.827 7.919 1.00 0.00 H new ATOM 0 H2' A A 43 5.271 5.098 5.902 1.00 0.00 H new ATOM 0 HO2' A A 43 6.495 6.578 7.676 1.00 0.00 H new ATOM 0 H1' A A 43 7.780 4.126 5.848 1.00 0.00 H new ATOM 0 H8 A A 43 5.687 1.247 7.160 1.00 0.00 H new ATOM 0 H61 A A 43 4.521 -0.068 1.220 1.00 0.00 H new ATOM 0 H62 A A 43 4.371 -0.632 2.888 1.00 0.00 H new ATOM 0 H2 A A 43 6.607 3.888 1.410 1.00 0.00 H new ATOM 66 P U A 44 3.315 6.060 8.589 1.00 0.00 P ATOM 67 OP1 U A 44 3.050 7.162 9.539 1.00 0.00 O ATOM 68 OP2 U A 44 2.504 4.823 8.653 1.00 0.00 O ATOM 69 O5' U A 44 3.205 6.651 7.091 1.00 0.00 O ATOM 70 C5' U A 44 3.890 7.860 6.749 1.00 0.00 C ATOM 71 C4' U A 44 3.763 8.207 5.265 1.00 0.00 C ATOM 72 O4' U A 44 4.435 7.242 4.457 1.00 0.00 O ATOM 73 C3' U A 44 2.344 8.246 4.735 1.00 0.00 C ATOM 74 O3' U A 44 1.716 9.493 5.053 1.00 0.00 O ATOM 75 C2' U A 44 2.600 8.142 3.245 1.00 0.00 C ATOM 76 O2' U A 44 3.010 9.398 2.690 1.00 0.00 O ATOM 77 C1' U A 44 3.724 7.117 3.207 1.00 0.00 C ATOM 78 N1 U A 44 3.240 5.732 3.109 1.00 0.00 N ATOM 79 C2 U A 44 2.959 5.244 1.852 1.00 0.00 C ATOM 80 O2 U A 44 3.093 5.925 0.838 1.00 0.00 O ATOM 81 N3 U A 44 2.508 3.941 1.799 1.00 0.00 N ATOM 82 C4 U A 44 2.316 3.096 2.875 1.00 0.00 C ATOM 83 O4 U A 44 1.918 1.946 2.704 1.00 0.00 O ATOM 84 C5 U A 44 2.628 3.693 4.151 1.00 0.00 C ATOM 85 C6 U A 44 3.068 4.970 4.229 1.00 0.00 C ATOM 0 H5' U A 44 4.945 7.761 7.006 1.00 0.00 H new ATOM 0 H5'' U A 44 3.492 8.680 7.346 1.00 0.00 H new ATOM 0 H4' U A 44 4.198 9.205 5.203 1.00 0.00 H new ATOM 0 H3' U A 44 1.685 7.479 5.142 1.00 0.00 H new ATOM 0 H2' U A 44 1.723 7.864 2.660 1.00 0.00 H new ATOM 0 HO2' U A 44 2.930 10.098 3.371 1.00 0.00 H new ATOM 0 H1' U A 44 4.338 7.311 2.327 1.00 0.00 H new ATOM 0 H3 U A 44 2.296 3.565 0.875 1.00 0.00 H new ATOM 0 H5 U A 44 2.509 3.114 5.055 1.00 0.00 H new ATOM 0 H6 U A 44 3.288 5.395 5.197 1.00 0.00 H new ATOM 96 P C A 45 0.114 9.570 5.226 1.00 0.00 P ATOM 97 OP1 C A 45 -0.238 10.934 5.679 1.00 0.00 O ATOM 98 OP2 C A 45 -0.323 8.396 6.014 1.00 0.00 O ATOM 99 O5' C A 45 -0.421 9.387 3.719 1.00 0.00 O ATOM 100 C5' C A 45 -0.148 10.378 2.730 1.00 0.00 C ATOM 101 C4' C A 45 -0.605 9.932 1.344 1.00 0.00 C ATOM 102 O4' C A 45 0.159 8.813 0.906 1.00 0.00 O ATOM 103 C3' C A 45 -2.051 9.482 1.249 1.00 0.00 C ATOM 104 O3' C A 45 -2.927 10.607 1.134 1.00 0.00 O ATOM 105 C2' C A 45 -2.027 8.683 -0.035 1.00 0.00 C ATOM 106 O2' C A 45 -2.115 9.529 -1.187 1.00 0.00 O ATOM 107 C1' C A 45 -0.669 7.995 0.058 1.00 0.00 C ATOM 108 N1 C A 45 -0.749 6.652 0.661 1.00 0.00 N ATOM 109 C2 C A 45 -1.073 5.605 -0.177 1.00 0.00 C ATOM 110 O2 C A 45 -1.253 5.819 -1.375 1.00 0.00 O ATOM 111 N3 C A 45 -1.178 4.355 0.361 1.00 0.00 N ATOM 112 C4 C A 45 -0.964 4.149 1.668 1.00 0.00 C ATOM 113 N4 C A 45 -1.068 2.914 2.163 1.00 0.00 N ATOM 114 C5 C A 45 -0.626 5.234 2.536 1.00 0.00 C ATOM 115 C6 C A 45 -0.538 6.463 1.994 1.00 0.00 C ATOM 0 H5' C A 45 0.921 10.588 2.711 1.00 0.00 H new ATOM 0 H5'' C A 45 -0.651 11.307 2.997 1.00 0.00 H new ATOM 0 H4' C A 45 -0.473 10.826 0.735 1.00 0.00 H new ATOM 0 H3' C A 45 -2.408 8.927 2.116 1.00 0.00 H new ATOM 0 H2' C A 45 -2.865 7.995 -0.144 1.00 0.00 H new ATOM 0 HO2' C A 45 -2.178 10.465 -0.902 1.00 0.00 H new ATOM 0 H1' C A 45 -0.271 7.879 -0.950 1.00 0.00 H new ATOM 0 H41 C A 45 -0.907 2.747 3.156 1.00 0.00 H new ATOM 0 H42 C A 45 -1.309 2.137 1.548 1.00 0.00 H new ATOM 0 H5 C A 45 -0.448 5.073 3.589 1.00 0.00 H new ATOM 0 H6 C A 45 -0.298 7.308 2.622 1.00 0.00 H new ATOM 127 P U A 46 -4.455 10.504 1.639 1.00 0.00 P ATOM 128 OP1 U A 46 -5.072 11.844 1.527 1.00 0.00 O ATOM 129 OP2 U A 46 -4.464 9.795 2.939 1.00 0.00 O ATOM 130 O5' U A 46 -5.135 9.540 0.537 1.00 0.00 O ATOM 131 C5' U A 46 -5.252 9.978 -0.819 1.00 0.00 C ATOM 132 C4' U A 46 -5.860 8.911 -1.734 1.00 0.00 C ATOM 133 O4' U A 46 -4.989 7.783 -1.843 1.00 0.00 O ATOM 134 C3' U A 46 -7.185 8.341 -1.268 1.00 0.00 C ATOM 135 O3' U A 46 -8.257 9.228 -1.622 1.00 0.00 O ATOM 136 C2' U A 46 -7.242 7.056 -2.074 1.00 0.00 C ATOM 137 O2' U A 46 -7.669 7.294 -3.420 1.00 0.00 O ATOM 138 C1' U A 46 -5.790 6.594 -2.020 1.00 0.00 C ATOM 139 N1 U A 46 -5.509 5.694 -0.886 1.00 0.00 N ATOM 140 C2 U A 46 -5.770 4.346 -1.053 1.00 0.00 C ATOM 141 O2 U A 46 -6.210 3.886 -2.102 1.00 0.00 O ATOM 142 N3 U A 46 -5.511 3.539 0.038 1.00 0.00 N ATOM 143 C4 U A 46 -5.024 3.955 1.262 1.00 0.00 C ATOM 144 O4 U A 46 -4.829 3.144 2.162 1.00 0.00 O ATOM 145 C5 U A 46 -4.785 5.377 1.350 1.00 0.00 C ATOM 146 C6 U A 46 -5.031 6.188 0.295 1.00 0.00 C ATOM 0 H5' U A 46 -4.266 10.254 -1.194 1.00 0.00 H new ATOM 0 H5'' U A 46 -5.869 10.876 -0.855 1.00 0.00 H new ATOM 0 H4' U A 46 -6.010 9.442 -2.674 1.00 0.00 H new ATOM 0 H3' U A 46 -7.274 8.195 -0.192 1.00 0.00 H new ATOM 0 H2' U A 46 -7.954 6.326 -1.690 1.00 0.00 H new ATOM 0 HO2' U A 46 -7.693 6.446 -3.910 1.00 0.00 H new ATOM 0 H1' U A 46 -5.569 6.043 -2.934 1.00 0.00 H new ATOM 0 H3 U A 46 -5.697 2.542 -0.070 1.00 0.00 H new ATOM 0 H5 U A 46 -4.405 5.798 2.269 1.00 0.00 H new ATOM 0 H6 U A 46 -4.846 7.248 0.388 1.00 0.00 H new ATOM 157 P C A 47 -9.616 9.271 -0.747 1.00 0.00 P ATOM 158 OP1 C A 47 -10.450 10.386 -1.248 1.00 0.00 O ATOM 159 OP2 C A 47 -9.239 9.220 0.683 1.00 0.00 O ATOM 160 O5' C A 47 -10.354 7.886 -1.117 1.00 0.00 O ATOM 161 C5' C A 47 -10.839 7.669 -2.445 1.00 0.00 C ATOM 162 C4' C A 47 -11.362 6.248 -2.650 1.00 0.00 C ATOM 163 O4' C A 47 -10.303 5.315 -2.564 1.00 0.00 O ATOM 164 C3' C A 47 -12.405 5.770 -1.658 1.00 0.00 C ATOM 165 O3' C A 47 -13.696 6.262 -2.048 1.00 0.00 O ATOM 166 C2' C A 47 -12.316 4.265 -1.825 1.00 0.00 C ATOM 167 O2' C A 47 -13.123 3.826 -2.919 1.00 0.00 O ATOM 168 C1' C A 47 -10.823 4.050 -2.112 1.00 0.00 C ATOM 169 N1 C A 47 -10.035 3.681 -0.930 1.00 0.00 N ATOM 170 C2 C A 47 -9.956 2.343 -0.593 1.00 0.00 C ATOM 171 O2 C A 47 -10.549 1.505 -1.270 1.00 0.00 O ATOM 172 N3 C A 47 -9.210 1.999 0.496 1.00 0.00 N ATOM 173 C4 C A 47 -8.579 2.937 1.218 1.00 0.00 C ATOM 174 N4 C A 47 -7.849 2.576 2.270 1.00 0.00 N ATOM 175 C5 C A 47 -8.675 4.319 0.874 1.00 0.00 C ATOM 176 C6 C A 47 -9.413 4.642 -0.200 1.00 0.00 C ATOM 0 H5' C A 47 -10.038 7.865 -3.158 1.00 0.00 H new ATOM 0 H5'' C A 47 -11.636 8.381 -2.658 1.00 0.00 H new ATOM 0 H4' C A 47 -11.829 6.300 -3.633 1.00 0.00 H new ATOM 0 H3' C A 47 -12.253 6.102 -0.631 1.00 0.00 H new ATOM 0 H2' C A 47 -12.674 3.706 -0.960 1.00 0.00 H new ATOM 0 HO2' C A 47 -13.049 2.853 -3.011 1.00 0.00 H new ATOM 0 H1' C A 47 -10.744 3.236 -2.832 1.00 0.00 H new ATOM 0 H41 C A 47 -7.367 3.284 2.823 1.00 0.00 H new ATOM 0 H42 C A 47 -7.772 1.591 2.523 1.00 0.00 H new ATOM 0 H5 C A 47 -8.172 5.077 1.456 1.00 0.00 H new ATOM 0 H6 C A 47 -9.513 5.678 -0.487 1.00 0.00 H new ATOM 188 P U A 48 -14.874 6.501 -0.971 1.00 0.00 P ATOM 189 OP1 U A 48 -15.996 7.173 -1.664 1.00 0.00 O ATOM 190 OP2 U A 48 -14.277 7.125 0.231 1.00 0.00 O ATOM 191 O5' U A 48 -15.356 5.012 -0.571 1.00 0.00 O ATOM 192 C5' U A 48 -16.756 4.754 -0.379 1.00 0.00 C ATOM 193 C4' U A 48 -17.051 3.284 -0.081 1.00 0.00 C ATOM 194 O4' U A 48 -16.828 2.466 -1.245 1.00 0.00 O ATOM 195 C3' U A 48 -16.202 2.708 1.056 1.00 0.00 C ATOM 196 O3' U A 48 -17.024 1.810 1.827 1.00 0.00 O ATOM 197 C2' U A 48 -15.160 1.917 0.284 1.00 0.00 C ATOM 198 O2' U A 48 -14.593 0.881 1.077 1.00 0.00 O ATOM 199 C1' U A 48 -16.004 1.374 -0.845 1.00 0.00 C ATOM 200 N1 U A 48 -15.258 0.877 -2.029 1.00 0.00 N ATOM 201 C2 U A 48 -15.468 -0.436 -2.423 1.00 0.00 C ATOM 202 O2 U A 48 -16.241 -1.180 -1.824 1.00 0.00 O ATOM 203 N3 U A 48 -14.757 -0.862 -3.529 1.00 0.00 N ATOM 204 C4 U A 48 -13.868 -0.104 -4.269 1.00 0.00 C ATOM 205 O4 U A 48 -13.275 -0.592 -5.229 1.00 0.00 O ATOM 206 C5 U A 48 -13.715 1.251 -3.793 1.00 0.00 C ATOM 207 C6 U A 48 -14.401 1.691 -2.709 1.00 0.00 C ATOM 0 H5' U A 48 -17.302 5.056 -1.273 1.00 0.00 H new ATOM 0 H5'' U A 48 -17.125 5.368 0.443 1.00 0.00 H new ATOM 0 H4' U A 48 -18.098 3.264 0.222 1.00 0.00 H new ATOM 0 H3' U A 48 -15.782 3.444 1.742 1.00 0.00 H new ATOM 0 H2' U A 48 -14.296 2.496 -0.041 1.00 0.00 H new ATOM 0 HO2' U A 48 -13.662 1.103 1.289 1.00 0.00 H new ATOM 0 H1' U A 48 -16.539 0.498 -0.479 1.00 0.00 H new ATOM 0 H3 U A 48 -14.902 -1.827 -3.828 1.00 0.00 H new ATOM 0 H5 U A 48 -13.045 1.923 -4.308 1.00 0.00 H new ATOM 0 H6 U A 48 -14.265 2.710 -2.377 1.00 0.00 H new ATOM 218 P U A 49 -16.844 1.543 3.419 1.00 0.00 P ATOM 219 OP1 U A 49 -17.961 0.678 3.862 1.00 0.00 O ATOM 220 OP2 U A 49 -16.633 2.851 4.078 1.00 0.00 O ATOM 221 O5' U A 49 -15.478 0.695 3.554 1.00 0.00 O ATOM 222 C5' U A 49 -15.341 -0.605 2.977 1.00 0.00 C ATOM 223 C4' U A 49 -13.917 -1.134 3.148 1.00 0.00 C ATOM 224 O4' U A 49 -13.013 -0.224 2.480 1.00 0.00 O ATOM 225 C3' U A 49 -13.442 -1.218 4.604 1.00 0.00 C ATOM 226 O3' U A 49 -12.683 -2.420 4.755 1.00 0.00 O ATOM 227 C2' U A 49 -12.532 -0.026 4.799 1.00 0.00 C ATOM 228 O2' U A 49 -11.472 -0.325 5.715 1.00 0.00 O ATOM 229 C1' U A 49 -12.003 0.226 3.404 1.00 0.00 C ATOM 230 N1 U A 49 -11.692 1.656 3.158 1.00 0.00 N ATOM 231 C2 U A 49 -10.458 2.109 3.589 1.00 0.00 C ATOM 232 O2 U A 49 -9.636 1.362 4.115 1.00 0.00 O ATOM 233 N3 U A 49 -10.201 3.455 3.401 1.00 0.00 N ATOM 234 C4 U A 49 -11.056 4.377 2.824 1.00 0.00 C ATOM 235 O4 U A 49 -10.724 5.554 2.709 1.00 0.00 O ATOM 236 C5 U A 49 -12.319 3.820 2.401 1.00 0.00 C ATOM 237 C6 U A 49 -12.595 2.505 2.576 1.00 0.00 C ATOM 0 H5' U A 49 -15.593 -0.565 1.917 1.00 0.00 H new ATOM 0 H5'' U A 49 -16.046 -1.291 3.446 1.00 0.00 H new ATOM 0 H4' U A 49 -13.921 -2.143 2.736 1.00 0.00 H new ATOM 0 H3' U A 49 -14.265 -1.220 5.319 1.00 0.00 H new ATOM 0 H2' U A 49 -13.040 0.838 5.227 1.00 0.00 H new ATOM 0 HO2' U A 49 -11.830 -0.825 6.478 1.00 0.00 H new ATOM 0 H1' U A 49 -11.065 -0.315 3.276 1.00 0.00 H new ATOM 0 H3 U A 49 -9.295 3.801 3.718 1.00 0.00 H new ATOM 0 H5 U A 49 -13.055 4.461 1.938 1.00 0.00 H new ATOM 0 H6 U A 49 -13.549 2.118 2.249 1.00 0.00 H new ATOM 248 P G A 50 -12.499 -3.139 6.183 1.00 0.00 P ATOM 249 OP1 G A 50 -13.839 -3.396 6.755 1.00 0.00 O ATOM 250 OP2 G A 50 -11.491 -2.382 6.960 1.00 0.00 O ATOM 251 O5' G A 50 -11.849 -4.545 5.747 1.00 0.00 O ATOM 252 C5' G A 50 -12.631 -5.493 5.015 1.00 0.00 C ATOM 253 C4' G A 50 -11.812 -6.197 3.946 1.00 0.00 C ATOM 254 O4' G A 50 -11.455 -5.289 2.911 1.00 0.00 O ATOM 255 C3' G A 50 -10.514 -6.807 4.418 1.00 0.00 C ATOM 256 O3' G A 50 -10.729 -8.109 4.944 1.00 0.00 O ATOM 257 C2' G A 50 -9.686 -6.858 3.162 1.00 0.00 C ATOM 258 O2' G A 50 -10.010 -8.003 2.365 1.00 0.00 O ATOM 259 C1' G A 50 -10.109 -5.567 2.480 1.00 0.00 C ATOM 260 N9 G A 50 -9.301 -4.388 2.837 1.00 0.00 N ATOM 261 C8 G A 50 -8.421 -4.218 3.873 1.00 0.00 C ATOM 262 N7 G A 50 -7.859 -3.043 3.901 1.00 0.00 N ATOM 263 C5 G A 50 -8.404 -2.388 2.803 1.00 0.00 C ATOM 264 C6 G A 50 -8.179 -1.071 2.329 1.00 0.00 C ATOM 265 O6 G A 50 -7.415 -0.225 2.785 1.00 0.00 O ATOM 266 N1 G A 50 -8.945 -0.799 1.199 1.00 0.00 N ATOM 267 C2 G A 50 -9.807 -1.695 0.594 1.00 0.00 C ATOM 268 N2 G A 50 -10.451 -1.269 -0.493 1.00 0.00 N ATOM 269 N3 G A 50 -10.011 -2.934 1.041 1.00 0.00 N ATOM 270 C4 G A 50 -9.283 -3.207 2.145 1.00 0.00 C ATOM 0 H5' G A 50 -13.476 -4.985 4.550 1.00 0.00 H new ATOM 0 H5'' G A 50 -13.043 -6.232 5.702 1.00 0.00 H new ATOM 0 H4' G A 50 -12.470 -7.000 3.614 1.00 0.00 H new ATOM 0 H3' G A 50 -10.038 -6.243 5.220 1.00 0.00 H new ATOM 0 H2' G A 50 -8.613 -6.943 3.336 1.00 0.00 H new ATOM 0 HO2' G A 50 -10.708 -8.526 2.812 1.00 0.00 H new ATOM 0 H1' G A 50 -9.992 -5.723 1.408 1.00 0.00 H new ATOM 0 H8 G A 50 -8.212 -4.988 4.601 1.00 0.00 H new ATOM 0 H1 G A 50 -8.864 0.130 0.787 1.00 0.00 H new ATOM 0 H21 G A 50 -11.099 -1.890 -0.978 1.00 0.00 H new ATOM 0 H22 G A 50 -10.296 -0.322 -0.839 1.00 0.00 H new ATOM 282 P U A 51 -9.502 -8.859 5.640 1.00 0.00 P ATOM 283 OP1 U A 51 -9.998 -10.106 6.265 1.00 0.00 O ATOM 284 OP2 U A 51 -8.737 -7.875 6.438 1.00 0.00 O ATOM 285 O5' U A 51 -8.642 -9.243 4.333 1.00 0.00 O ATOM 286 C5' U A 51 -7.265 -9.580 4.421 1.00 0.00 C ATOM 287 C4' U A 51 -6.729 -10.085 3.085 1.00 0.00 C ATOM 288 O4' U A 51 -7.385 -11.313 2.758 1.00 0.00 O ATOM 289 C3' U A 51 -6.930 -9.135 1.903 1.00 0.00 C ATOM 290 O3' U A 51 -5.764 -9.223 1.081 1.00 0.00 O ATOM 291 C2' U A 51 -8.135 -9.682 1.151 1.00 0.00 C ATOM 292 O2' U A 51 -7.927 -9.612 -0.264 1.00 0.00 O ATOM 293 C1' U A 51 -8.237 -11.138 1.616 1.00 0.00 C ATOM 294 N1 U A 51 -9.605 -11.586 2.006 1.00 0.00 N ATOM 295 C2 U A 51 -10.060 -12.791 1.487 1.00 0.00 C ATOM 296 O2 U A 51 -9.391 -13.456 0.699 1.00 0.00 O ATOM 297 N3 U A 51 -11.314 -13.204 1.903 1.00 0.00 N ATOM 298 C4 U A 51 -12.147 -12.531 2.779 1.00 0.00 C ATOM 299 O4 U A 51 -13.242 -12.998 3.085 1.00 0.00 O ATOM 300 C5 U A 51 -11.601 -11.286 3.270 1.00 0.00 C ATOM 301 C6 U A 51 -10.374 -10.857 2.880 1.00 0.00 C ATOM 0 H5' U A 51 -7.124 -10.346 5.184 1.00 0.00 H new ATOM 0 H5'' U A 51 -6.695 -8.707 4.737 1.00 0.00 H new ATOM 0 H4' U A 51 -5.654 -10.192 3.228 1.00 0.00 H new ATOM 0 H3' U A 51 -7.085 -8.097 2.198 1.00 0.00 H new ATOM 0 H2' U A 51 -9.045 -9.115 1.350 1.00 0.00 H new ATOM 0 HO2' U A 51 -8.712 -9.970 -0.728 1.00 0.00 H new ATOM 0 H1' U A 51 -7.944 -11.741 0.756 1.00 0.00 H new ATOM 0 H3 U A 51 -11.656 -14.089 1.528 1.00 0.00 H new ATOM 0 H5 U A 51 -12.179 -10.687 3.958 1.00 0.00 H new ATOM 0 H6 U A 51 -9.994 -9.922 3.265 1.00 0.00 H new ATOM 312 P A A 52 -4.685 -8.030 0.955 1.00 0.00 P ATOM 313 OP1 A A 52 -3.481 -8.568 0.284 1.00 0.00 O ATOM 314 OP2 A A 52 -4.559 -7.383 2.280 1.00 0.00 O ATOM 315 O5' A A 52 -5.387 -6.984 -0.043 1.00 0.00 O ATOM 316 C5' A A 52 -6.231 -7.449 -1.094 1.00 0.00 C ATOM 317 C4' A A 52 -6.639 -6.321 -2.033 1.00 0.00 C ATOM 318 O4' A A 52 -7.438 -5.328 -1.368 1.00 0.00 O ATOM 319 C3' A A 52 -5.454 -5.567 -2.608 1.00 0.00 C ATOM 320 O3' A A 52 -4.932 -6.295 -3.728 1.00 0.00 O ATOM 321 C2' A A 52 -6.100 -4.268 -3.045 1.00 0.00 C ATOM 322 O2' A A 52 -6.776 -4.411 -4.299 1.00 0.00 O ATOM 323 C1' A A 52 -7.082 -4.032 -1.904 1.00 0.00 C ATOM 324 N9 A A 52 -6.530 -3.228 -0.799 1.00 0.00 N ATOM 325 C8 A A 52 -6.093 -3.646 0.433 1.00 0.00 C ATOM 326 N7 A A 52 -5.695 -2.673 1.208 1.00 0.00 N ATOM 327 C5 A A 52 -5.882 -1.530 0.432 1.00 0.00 C ATOM 328 C6 A A 52 -5.646 -0.165 0.674 1.00 0.00 C ATOM 329 N6 A A 52 -5.152 0.299 1.818 1.00 0.00 N ATOM 330 N1 A A 52 -5.938 0.699 -0.313 1.00 0.00 N ATOM 331 C2 A A 52 -6.429 0.230 -1.456 1.00 0.00 C ATOM 332 N3 A A 52 -6.695 -1.020 -1.801 1.00 0.00 N ATOM 333 C4 A A 52 -6.391 -1.861 -0.790 1.00 0.00 C ATOM 0 H5' A A 52 -7.123 -7.908 -0.668 1.00 0.00 H new ATOM 0 H5'' A A 52 -5.714 -8.224 -1.660 1.00 0.00 H new ATOM 0 H4' A A 52 -7.195 -6.826 -2.823 1.00 0.00 H new ATOM 0 H3' A A 52 -4.618 -5.421 -1.924 1.00 0.00 H new ATOM 0 H2' A A 52 -5.397 -3.451 -3.209 1.00 0.00 H new ATOM 0 HO2' A A 52 -6.665 -5.327 -4.628 1.00 0.00 H new ATOM 0 H1' A A 52 -7.929 -3.479 -2.311 1.00 0.00 H new ATOM 0 H8 A A 52 -6.079 -4.683 0.734 1.00 0.00 H new ATOM 0 H61 A A 52 -5.001 1.300 1.939 1.00 0.00 H new ATOM 0 H62 A A 52 -4.924 -0.347 2.574 1.00 0.00 H new ATOM 0 H2 A A 52 -6.641 0.974 -2.210 1.00 0.00 H new ATOM 345 P G A 53 -3.381 -6.186 -4.156 1.00 0.00 P ATOM 346 OP1 G A 53 -3.139 -7.138 -5.264 1.00 0.00 O ATOM 347 OP2 G A 53 -2.554 -6.256 -2.931 1.00 0.00 O ATOM 348 O5' G A 53 -3.281 -4.697 -4.748 1.00 0.00 O ATOM 349 C5' G A 53 -3.987 -4.346 -5.936 1.00 0.00 C ATOM 350 C4' G A 53 -3.874 -2.855 -6.221 1.00 0.00 C ATOM 351 O4' G A 53 -4.521 -2.101 -5.194 1.00 0.00 O ATOM 352 C3' G A 53 -2.453 -2.328 -6.266 1.00 0.00 C ATOM 353 O3' G A 53 -1.859 -2.583 -7.543 1.00 0.00 O ATOM 354 C2' G A 53 -2.693 -0.843 -6.068 1.00 0.00 C ATOM 355 O2' G A 53 -3.120 -0.209 -7.280 1.00 0.00 O ATOM 356 C1' G A 53 -3.807 -0.864 -5.023 1.00 0.00 C ATOM 357 N9 G A 53 -3.303 -0.806 -3.639 1.00 0.00 N ATOM 358 C8 G A 53 -3.078 -1.830 -2.757 1.00 0.00 C ATOM 359 N7 G A 53 -2.618 -1.440 -1.602 1.00 0.00 N ATOM 360 C5 G A 53 -2.525 -0.059 -1.728 1.00 0.00 C ATOM 361 C6 G A 53 -2.080 0.912 -0.792 1.00 0.00 C ATOM 362 O6 G A 53 -1.689 0.730 0.362 1.00 0.00 O ATOM 363 N1 G A 53 -2.139 2.198 -1.326 1.00 0.00 N ATOM 364 C2 G A 53 -2.577 2.504 -2.602 1.00 0.00 C ATOM 365 N2 G A 53 -2.565 3.791 -2.949 1.00 0.00 N ATOM 366 N3 G A 53 -2.998 1.589 -3.476 1.00 0.00 N ATOM 367 C4 G A 53 -2.943 0.336 -2.973 1.00 0.00 C ATOM 0 H5' G A 53 -5.037 -4.621 -5.834 1.00 0.00 H new ATOM 0 H5'' G A 53 -3.590 -4.912 -6.779 1.00 0.00 H new ATOM 0 H4' G A 53 -4.333 -2.738 -7.203 1.00 0.00 H new ATOM 0 H3' G A 53 -1.777 -2.778 -5.539 1.00 0.00 H new ATOM 0 H2' G A 53 -1.807 -0.282 -5.770 1.00 0.00 H new ATOM 0 HO2' G A 53 -3.266 0.746 -7.116 1.00 0.00 H new ATOM 0 H1' G A 53 -4.434 0.016 -5.171 1.00 0.00 H new ATOM 0 H8 G A 53 -3.265 -2.866 -2.997 1.00 0.00 H new ATOM 0 H1 G A 53 -1.837 2.970 -0.732 1.00 0.00 H new ATOM 0 H21 G A 53 -2.878 4.072 -3.878 1.00 0.00 H new ATOM 0 H22 G A 53 -2.243 4.495 -2.285 1.00 0.00 H new ATOM 379 P A A 54 -0.263 -2.768 -7.676 1.00 0.00 P ATOM 380 OP1 A A 54 0.051 -3.111 -9.081 1.00 0.00 O ATOM 381 OP2 A A 54 0.195 -3.650 -6.580 1.00 0.00 O ATOM 382 O5' A A 54 0.275 -1.283 -7.386 1.00 0.00 O ATOM 383 C5' A A 54 -0.035 -0.214 -8.274 1.00 0.00 C ATOM 384 C4' A A 54 0.419 1.125 -7.709 1.00 0.00 C ATOM 385 O4' A A 54 -0.299 1.441 -6.509 1.00 0.00 O ATOM 386 C3' A A 54 1.879 1.198 -7.309 1.00 0.00 C ATOM 387 O3' A A 54 2.709 1.445 -8.440 1.00 0.00 O ATOM 388 C2' A A 54 1.872 2.416 -6.420 1.00 0.00 C ATOM 389 O2' A A 54 1.878 3.626 -7.186 1.00 0.00 O ATOM 390 C1' A A 54 0.565 2.238 -5.672 1.00 0.00 C ATOM 391 N9 A A 54 0.732 1.562 -4.372 1.00 0.00 N ATOM 392 C8 A A 54 0.531 0.246 -4.034 1.00 0.00 C ATOM 393 N7 A A 54 0.766 -0.016 -2.777 1.00 0.00 N ATOM 394 C5 A A 54 1.153 1.211 -2.251 1.00 0.00 C ATOM 395 C6 A A 54 1.542 1.615 -0.965 1.00 0.00 C ATOM 396 N6 A A 54 1.606 0.787 0.078 1.00 0.00 N ATOM 397 N1 A A 54 1.863 2.908 -0.800 1.00 0.00 N ATOM 398 C2 A A 54 1.802 3.732 -1.837 1.00 0.00 C ATOM 399 N3 A A 54 1.451 3.476 -3.082 1.00 0.00 N ATOM 400 C4 A A 54 1.134 2.174 -3.218 1.00 0.00 C ATOM 0 H5' A A 54 -1.110 -0.189 -8.455 1.00 0.00 H new ATOM 0 H5'' A A 54 0.446 -0.387 -9.236 1.00 0.00 H new ATOM 0 H4' A A 54 0.234 1.814 -8.533 1.00 0.00 H new ATOM 0 H3' A A 54 2.256 0.284 -6.850 1.00 0.00 H new ATOM 0 H2' A A 54 2.746 2.498 -5.774 1.00 0.00 H new ATOM 0 HO2' A A 54 1.874 3.408 -8.142 1.00 0.00 H new ATOM 0 H1' A A 54 0.150 3.223 -5.460 1.00 0.00 H new ATOM 0 H8 A A 54 0.208 -0.503 -4.743 1.00 0.00 H new ATOM 0 H61 A A 54 1.896 1.138 0.991 1.00 0.00 H new ATOM 0 H62 A A 54 1.365 -0.197 -0.037 1.00 0.00 H new ATOM 0 H2 A A 54 2.078 4.756 -1.634 1.00 0.00 H new ATOM 412 P U A 55 4.243 0.966 -8.449 1.00 0.00 P ATOM 413 OP1 U A 55 4.833 1.305 -9.762 1.00 0.00 O ATOM 414 OP2 U A 55 4.306 -0.422 -7.939 1.00 0.00 O ATOM 415 O5' U A 55 4.870 1.946 -7.339 1.00 0.00 O ATOM 416 C5' U A 55 4.886 3.355 -7.544 1.00 0.00 C ATOM 417 C4' U A 55 5.363 4.093 -6.298 1.00 0.00 C ATOM 418 O4' U A 55 4.454 3.880 -5.219 1.00 0.00 O ATOM 419 C3' U A 55 6.704 3.641 -5.755 1.00 0.00 C ATOM 420 O3' U A 55 7.772 4.255 -6.486 1.00 0.00 O ATOM 421 C2' U A 55 6.655 4.195 -4.344 1.00 0.00 C ATOM 422 O2' U A 55 7.064 5.568 -4.310 1.00 0.00 O ATOM 423 C1' U A 55 5.176 4.040 -3.982 1.00 0.00 C ATOM 424 N1 U A 55 4.916 2.864 -3.131 1.00 0.00 N ATOM 425 C2 U A 55 5.113 3.020 -1.776 1.00 0.00 C ATOM 426 O2 U A 55 5.456 4.095 -1.287 1.00 0.00 O ATOM 427 N3 U A 55 4.898 1.900 -0.999 1.00 0.00 N ATOM 428 C4 U A 55 4.501 0.655 -1.447 1.00 0.00 C ATOM 429 O4 U A 55 4.333 -0.268 -0.649 1.00 0.00 O ATOM 430 C5 U A 55 4.318 0.580 -2.881 1.00 0.00 C ATOM 431 C6 U A 55 4.532 1.665 -3.665 1.00 0.00 C ATOM 0 H5' U A 55 3.886 3.697 -7.811 1.00 0.00 H new ATOM 0 H5'' U A 55 5.539 3.595 -8.383 1.00 0.00 H new ATOM 0 H4' U A 55 5.436 5.129 -6.629 1.00 0.00 H new ATOM 0 H3' U A 55 6.873 2.566 -5.816 1.00 0.00 H new ATOM 0 H2' U A 55 7.326 3.687 -3.651 1.00 0.00 H new ATOM 0 HO2' U A 55 7.350 5.846 -5.205 1.00 0.00 H new ATOM 0 H1' U A 55 4.861 4.918 -3.419 1.00 0.00 H new ATOM 0 H3 U A 55 5.047 2.001 0.005 1.00 0.00 H new ATOM 0 H5 U A 55 4.007 -0.351 -3.331 1.00 0.00 H new ATOM 0 H6 U A 55 4.396 1.581 -4.733 1.00 0.00 H new ATOM 442 P C A 56 9.211 3.539 -6.621 1.00 0.00 P ATOM 443 OP1 C A 56 10.054 4.367 -7.513 1.00 0.00 O ATOM 444 OP2 C A 56 8.993 2.109 -6.936 1.00 0.00 O ATOM 445 O5' C A 56 9.813 3.640 -5.129 1.00 0.00 O ATOM 446 C5' C A 56 10.124 4.907 -4.550 1.00 0.00 C ATOM 447 C4' C A 56 10.619 4.764 -3.111 1.00 0.00 C ATOM 448 O4' C A 56 9.592 4.266 -2.264 1.00 0.00 O ATOM 449 C3' C A 56 11.775 3.804 -2.930 1.00 0.00 C ATOM 450 O3' C A 56 13.001 4.461 -3.263 1.00 0.00 O ATOM 451 C2' C A 56 11.712 3.505 -1.440 1.00 0.00 C ATOM 452 O2' C A 56 12.492 4.442 -0.688 1.00 0.00 O ATOM 453 C1' C A 56 10.217 3.640 -1.127 1.00 0.00 C ATOM 454 N1 C A 56 9.546 2.346 -0.896 1.00 0.00 N ATOM 455 C2 C A 56 9.646 1.794 0.371 1.00 0.00 C ATOM 456 O2 C A 56 10.274 2.385 1.246 1.00 0.00 O ATOM 457 N3 C A 56 9.041 0.592 0.605 1.00 0.00 N ATOM 458 C4 C A 56 8.370 -0.035 -0.374 1.00 0.00 C ATOM 459 N4 C A 56 7.789 -1.207 -0.124 1.00 0.00 N ATOM 460 C5 C A 56 8.268 0.535 -1.682 1.00 0.00 C ATOM 461 C6 C A 56 8.868 1.719 -1.897 1.00 0.00 C ATOM 0 H5' C A 56 9.239 5.543 -4.569 1.00 0.00 H new ATOM 0 H5'' C A 56 10.887 5.404 -5.150 1.00 0.00 H new ATOM 0 H4' C A 56 10.939 5.774 -2.855 1.00 0.00 H new ATOM 0 H3' C A 56 11.723 2.912 -3.554 1.00 0.00 H new ATOM 0 H2' C A 56 12.117 2.527 -1.179 1.00 0.00 H new ATOM 0 HO2' C A 56 12.432 4.226 0.266 1.00 0.00 H new ATOM 0 H1' C A 56 10.122 4.221 -0.210 1.00 0.00 H new ATOM 0 H41 C A 56 7.277 -1.690 -0.862 1.00 0.00 H new ATOM 0 H42 C A 56 7.856 -1.621 0.806 1.00 0.00 H new ATOM 0 H5 C A 56 7.728 0.032 -2.470 1.00 0.00 H new ATOM 0 H6 C A 56 8.812 2.177 -2.873 1.00 0.00 H new ATOM 473 P A A 57 14.273 3.631 -3.801 1.00 0.00 P ATOM 474 OP1 A A 57 15.326 4.599 -4.181 1.00 0.00 O ATOM 475 OP2 A A 57 13.792 2.640 -4.790 1.00 0.00 O ATOM 476 O5' A A 57 14.772 2.836 -2.494 1.00 0.00 O ATOM 477 C5' A A 57 15.281 3.549 -1.365 1.00 0.00 C ATOM 478 C4' A A 57 15.655 2.608 -0.224 1.00 0.00 C ATOM 479 O4' A A 57 14.502 1.960 0.298 1.00 0.00 O ATOM 480 C3' A A 57 16.602 1.494 -0.623 1.00 0.00 C ATOM 481 O3' A A 57 17.962 1.944 -0.649 1.00 0.00 O ATOM 482 C2' A A 57 16.361 0.452 0.458 1.00 0.00 C ATOM 483 O2' A A 57 17.284 0.603 1.542 1.00 0.00 O ATOM 484 C1' A A 57 14.923 0.730 0.907 1.00 0.00 C ATOM 485 N9 A A 57 13.965 -0.321 0.518 1.00 0.00 N ATOM 486 C8 A A 57 13.111 -0.360 -0.553 1.00 0.00 C ATOM 487 N7 A A 57 12.389 -1.445 -0.614 1.00 0.00 N ATOM 488 C5 A A 57 12.796 -2.176 0.498 1.00 0.00 C ATOM 489 C6 A A 57 12.411 -3.428 1.005 1.00 0.00 C ATOM 490 N6 A A 57 11.487 -4.195 0.427 1.00 0.00 N ATOM 491 N1 A A 57 13.016 -3.852 2.127 1.00 0.00 N ATOM 492 C2 A A 57 13.936 -3.082 2.697 1.00 0.00 C ATOM 493 N3 A A 57 14.381 -1.894 2.319 1.00 0.00 N ATOM 494 C4 A A 57 13.755 -1.497 1.192 1.00 0.00 C ATOM 0 H5' A A 57 14.533 4.262 -1.018 1.00 0.00 H new ATOM 0 H5'' A A 57 16.157 4.125 -1.663 1.00 0.00 H new ATOM 0 H4' A A 57 16.142 3.257 0.504 1.00 0.00 H new ATOM 0 H3' A A 57 16.427 1.111 -1.629 1.00 0.00 H new ATOM 0 H2' A A 57 16.503 -0.568 0.102 1.00 0.00 H new ATOM 0 HO2' A A 57 18.035 1.164 1.256 1.00 0.00 H new ATOM 0 HO3' A A 57 18.547 1.202 -0.908 1.00 0.00 H new ATOM 0 H1' A A 57 14.928 0.772 1.996 1.00 0.00 H new ATOM 0 H8 A A 57 13.042 0.435 -1.281 1.00 0.00 H new ATOM 0 H61 A A 57 11.244 -5.097 0.837 1.00 0.00 H new ATOM 0 H62 A A 57 11.023 -3.880 -0.425 1.00 0.00 H new ATOM 0 H2 A A 57 14.384 -3.481 3.595 1.00 0.00 H new TER 507 A A 57