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= -0.6 USER MOD Single : A 42 G O5' : rot 180:sc=-0.00247 USER MOD Single : A 43 A O2' : rot -5:sc= -0.22 USER MOD Single : A 44 U O2' : rot -13:sc= -0.0559 USER MOD Single : A 45 C O2' : rot -2:sc= -0.615 USER MOD Single : A 46 U O2' : rot 180:sc= -0.0791 USER MOD Single : A 47 C O2' : rot 169:sc= 0.16! USER MOD Single : A 48 U O2' : rot -112:sc= -6.23! USER MOD Single : A 49 U O2' : rot -47:sc= 0.417 USER MOD Single : A 50 G O2' : rot -8:sc= -4.82! USER MOD Single : A 51 U O2' : rot -131:sc= -3.8! USER MOD Single : A 52 A O2' : rot -8:sc= -0.54 USER MOD Single : A 53 G O2' : rot 180:sc= -0.255 USER MOD Single : A 54 A O2' : rot -3:sc= -1.86! USER MOD Single : A 55 U O2' : rot -2:sc= -0.797 USER MOD Single : A 56 C O2' : rot 180:sc= -1.89! USER MOD Single : A 57 A O2' : rot -14:sc= 0.221 USER MOD Single : A 57 A O3' : rot 180:sc= 0.205 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 42 7.532 -3.710 8.530 1.00 0.00 O ATOM 2 C5' G A 42 8.441 -3.180 9.496 1.00 0.00 C ATOM 3 C4' G A 42 9.084 -1.890 9.006 1.00 0.00 C ATOM 4 O4' G A 42 9.940 -2.134 7.892 1.00 0.00 O ATOM 5 C3' G A 42 8.100 -0.830 8.550 1.00 0.00 C ATOM 6 O3' G A 42 7.595 -0.098 9.671 1.00 0.00 O ATOM 7 C2' G A 42 8.983 0.040 7.690 1.00 0.00 C ATOM 8 O2' G A 42 9.763 0.945 8.480 1.00 0.00 O ATOM 9 C1' G A 42 9.855 -1.004 7.008 1.00 0.00 C ATOM 10 N9 G A 42 9.310 -1.493 5.733 1.00 0.00 N ATOM 11 C8 G A 42 8.584 -2.628 5.502 1.00 0.00 C ATOM 12 N7 G A 42 8.237 -2.790 4.256 1.00 0.00 N ATOM 13 C5 G A 42 8.774 -1.678 3.613 1.00 0.00 C ATOM 14 C6 G A 42 8.719 -1.306 2.242 1.00 0.00 C ATOM 15 O6 G A 42 8.179 -1.905 1.316 1.00 0.00 O ATOM 16 N1 G A 42 9.388 -0.106 2.011 1.00 0.00 N ATOM 17 C2 G A 42 10.031 0.637 2.985 1.00 0.00 C ATOM 18 N2 G A 42 10.623 1.761 2.585 1.00 0.00 N ATOM 19 N3 G A 42 10.082 0.283 4.272 1.00 0.00 N ATOM 20 C4 G A 42 9.434 -0.879 4.511 1.00 0.00 C ATOM 0 H5' G A 42 9.216 -3.916 9.710 1.00 0.00 H new ATOM 0 H5'' G A 42 7.912 -2.992 10.431 1.00 0.00 H new ATOM 0 H4' G A 42 9.625 -1.523 9.879 1.00 0.00 H new ATOM 0 H3' G A 42 7.220 -1.219 8.037 1.00 0.00 H new ATOM 0 H2' G A 42 8.438 0.686 7.001 1.00 0.00 H new ATOM 0 HO2' G A 42 9.542 0.826 9.427 1.00 0.00 H new ATOM 0 HO5' G A 42 7.137 -4.539 8.873 1.00 0.00 H new ATOM 0 H1' G A 42 10.815 -0.534 6.795 1.00 0.00 H new ATOM 0 H8 G A 42 8.322 -3.328 6.282 1.00 0.00 H new ATOM 0 H1 G A 42 9.405 0.250 1.055 1.00 0.00 H new ATOM 0 H21 G A 42 11.112 2.348 3.261 1.00 0.00 H new ATOM 0 H22 G A 42 10.587 2.035 1.603 1.00 0.00 H new ATOM 33 P A A 43 6.143 0.600 9.615 1.00 0.00 P ATOM 34 OP1 A A 43 5.855 1.174 10.949 1.00 0.00 O ATOM 35 OP2 A A 43 5.193 -0.357 9.005 1.00 0.00 O ATOM 36 O5' A A 43 6.367 1.816 8.582 1.00 0.00 O ATOM 37 C5' A A 43 7.251 2.887 8.909 1.00 0.00 C ATOM 38 C4' A A 43 7.430 3.861 7.744 1.00 0.00 C ATOM 39 O4' A A 43 8.082 3.218 6.640 1.00 0.00 O ATOM 40 C3' A A 43 6.140 4.421 7.169 1.00 0.00 C ATOM 41 O3' A A 43 5.669 5.512 7.973 1.00 0.00 O ATOM 42 C2' A A 43 6.608 4.900 5.815 1.00 0.00 C ATOM 43 O2' A A 43 7.275 6.164 5.903 1.00 0.00 O ATOM 44 C1' A A 43 7.566 3.785 5.417 1.00 0.00 C ATOM 45 N9 A A 43 6.917 2.704 4.644 1.00 0.00 N ATOM 46 C8 A A 43 6.427 1.500 5.082 1.00 0.00 C ATOM 47 N7 A A 43 5.897 0.769 4.139 1.00 0.00 N ATOM 48 C5 A A 43 6.044 1.544 2.994 1.00 0.00 C ATOM 49 C6 A A 43 5.680 1.339 1.652 1.00 0.00 C ATOM 50 N6 A A 43 5.073 0.233 1.212 1.00 0.00 N ATOM 51 N1 A A 43 5.970 2.318 0.783 1.00 0.00 N ATOM 52 C2 A A 43 6.580 3.414 1.216 1.00 0.00 C ATOM 53 N3 A A 43 6.972 3.723 2.441 1.00 0.00 N ATOM 54 C4 A A 43 6.665 2.725 3.294 1.00 0.00 C ATOM 0 H5' A A 43 8.222 2.481 9.194 1.00 0.00 H new ATOM 0 H5'' A A 43 6.864 3.425 9.774 1.00 0.00 H new ATOM 0 H4' A A 43 8.010 4.673 8.182 1.00 0.00 H new ATOM 0 H3' A A 43 5.312 3.714 7.127 1.00 0.00 H new ATOM 0 H2' A A 43 5.803 5.071 5.101 1.00 0.00 H new ATOM 0 HO2' A A 43 7.224 6.497 6.823 1.00 0.00 H new ATOM 0 H1' A A 43 8.340 4.212 4.779 1.00 0.00 H new ATOM 0 H8 A A 43 6.475 1.185 6.114 1.00 0.00 H new ATOM 0 H61 A A 43 4.833 0.141 0.225 1.00 0.00 H new ATOM 0 H62 A A 43 4.850 -0.520 1.863 1.00 0.00 H new ATOM 0 H2 A A 43 6.785 4.159 0.462 1.00 0.00 H new ATOM 66 P U A 44 4.097 5.884 8.021 1.00 0.00 P ATOM 67 OP1 U A 44 3.904 6.938 9.042 1.00 0.00 O ATOM 68 OP2 U A 44 3.327 4.623 8.110 1.00 0.00 O ATOM 69 O5' U A 44 3.827 6.535 6.569 1.00 0.00 O ATOM 70 C5' U A 44 4.452 7.775 6.222 1.00 0.00 C ATOM 71 C4' U A 44 4.210 8.169 4.763 1.00 0.00 C ATOM 72 O4' U A 44 4.841 7.233 3.888 1.00 0.00 O ATOM 73 C3' U A 44 2.759 8.201 4.319 1.00 0.00 C ATOM 74 O3' U A 44 2.131 9.430 4.714 1.00 0.00 O ATOM 75 C2' U A 44 2.930 8.147 2.813 1.00 0.00 C ATOM 76 O2' U A 44 3.284 9.427 2.276 1.00 0.00 O ATOM 77 C1' U A 44 4.069 7.146 2.673 1.00 0.00 C ATOM 78 N1 U A 44 3.600 5.757 2.531 1.00 0.00 N ATOM 79 C2 U A 44 3.265 5.330 1.263 1.00 0.00 C ATOM 80 O2 U A 44 3.376 6.056 0.278 1.00 0.00 O ATOM 81 N3 U A 44 2.799 4.035 1.164 1.00 0.00 N ATOM 82 C4 U A 44 2.641 3.140 2.206 1.00 0.00 C ATOM 83 O4 U A 44 2.223 2.004 1.996 1.00 0.00 O ATOM 84 C5 U A 44 3.011 3.671 3.497 1.00 0.00 C ATOM 85 C6 U A 44 3.467 4.940 3.620 1.00 0.00 C ATOM 0 H5' U A 44 5.525 7.699 6.401 1.00 0.00 H new ATOM 0 H5'' U A 44 4.075 8.563 6.874 1.00 0.00 H new ATOM 0 H4' U A 44 4.614 9.180 4.708 1.00 0.00 H new ATOM 0 H3' U A 44 2.136 7.412 4.739 1.00 0.00 H new ATOM 0 H2' U A 44 2.025 7.868 2.273 1.00 0.00 H new ATOM 0 HO2' U A 44 3.140 10.118 2.956 1.00 0.00 H new ATOM 0 H1' U A 44 4.638 7.387 1.775 1.00 0.00 H new ATOM 0 H3 U A 44 2.547 3.706 0.232 1.00 0.00 H new ATOM 0 H5 U A 44 2.923 3.048 4.375 1.00 0.00 H new ATOM 0 H6 U A 44 3.731 5.315 4.598 1.00 0.00 H new ATOM 96 P C A 45 0.537 9.486 4.980 1.00 0.00 P ATOM 97 OP1 C A 45 0.206 10.831 5.502 1.00 0.00 O ATOM 98 OP2 C A 45 0.156 8.284 5.754 1.00 0.00 O ATOM 99 O5' C A 45 -0.094 9.352 3.502 1.00 0.00 O ATOM 100 C5' C A 45 0.104 10.386 2.534 1.00 0.00 C ATOM 101 C4' C A 45 -0.418 9.990 1.152 1.00 0.00 C ATOM 102 O4' C A 45 0.346 8.906 0.629 1.00 0.00 O ATOM 103 C3' C A 45 -1.860 9.517 1.094 1.00 0.00 C ATOM 104 O3' C A 45 -2.763 10.627 1.061 1.00 0.00 O ATOM 105 C2' C A 45 -1.875 8.780 -0.226 1.00 0.00 C ATOM 106 O2' C A 45 -2.009 9.679 -1.333 1.00 0.00 O ATOM 107 C1' C A 45 -0.509 8.106 -0.212 1.00 0.00 C ATOM 108 N1 C A 45 -0.547 6.743 0.347 1.00 0.00 N ATOM 109 C2 C A 45 -0.900 5.720 -0.509 1.00 0.00 C ATOM 110 O2 C A 45 -1.175 5.972 -1.684 1.00 0.00 O ATOM 111 N3 C A 45 -0.941 4.451 -0.014 1.00 0.00 N ATOM 112 C4 C A 45 -0.643 4.199 1.265 1.00 0.00 C ATOM 113 N4 C A 45 -0.686 2.942 1.710 1.00 0.00 N ATOM 114 C5 C A 45 -0.282 5.258 2.155 1.00 0.00 C ATOM 115 C6 C A 45 -0.254 6.509 1.658 1.00 0.00 C ATOM 0 H5' C A 45 1.167 10.619 2.466 1.00 0.00 H new ATOM 0 H5'' C A 45 -0.401 11.293 2.865 1.00 0.00 H new ATOM 0 H4' C A 45 -0.336 10.917 0.584 1.00 0.00 H new ATOM 0 H3' C A 45 -2.168 8.918 1.951 1.00 0.00 H new ATOM 0 H2' C A 45 -2.710 8.089 -0.338 1.00 0.00 H new ATOM 0 HO2' C A 45 -2.091 10.597 -1.001 1.00 0.00 H new ATOM 0 H1' C A 45 -0.154 8.028 -1.240 1.00 0.00 H new ATOM 0 H41 C A 45 -0.461 2.738 2.684 1.00 0.00 H new ATOM 0 H42 C A 45 -0.944 2.185 1.077 1.00 0.00 H new ATOM 0 H5 C A 45 -0.040 5.062 3.189 1.00 0.00 H new ATOM 0 H6 C A 45 0.003 7.335 2.304 1.00 0.00 H new ATOM 127 P U A 46 -4.271 10.472 1.614 1.00 0.00 P ATOM 128 OP1 U A 46 -4.914 11.804 1.579 1.00 0.00 O ATOM 129 OP2 U A 46 -4.221 9.712 2.883 1.00 0.00 O ATOM 130 O5' U A 46 -4.978 9.542 0.497 1.00 0.00 O ATOM 131 C5' U A 46 -5.160 10.030 -0.835 1.00 0.00 C ATOM 132 C4' U A 46 -5.785 8.985 -1.767 1.00 0.00 C ATOM 133 O4' U A 46 -4.894 7.882 -1.958 1.00 0.00 O ATOM 134 C3' U A 46 -7.078 8.366 -1.270 1.00 0.00 C ATOM 135 O3' U A 46 -8.186 9.237 -1.545 1.00 0.00 O ATOM 136 C2' U A 46 -7.138 7.117 -2.131 1.00 0.00 C ATOM 137 O2' U A 46 -7.604 7.411 -3.454 1.00 0.00 O ATOM 138 C1' U A 46 -5.677 6.680 -2.134 1.00 0.00 C ATOM 139 N1 U A 46 -5.344 5.761 -1.029 1.00 0.00 N ATOM 140 C2 U A 46 -5.587 4.413 -1.218 1.00 0.00 C ATOM 141 O2 U A 46 -6.030 3.966 -2.272 1.00 0.00 O ATOM 142 N3 U A 46 -5.299 3.589 -0.147 1.00 0.00 N ATOM 143 C4 U A 46 -4.796 3.988 1.078 1.00 0.00 C ATOM 144 O4 U A 46 -4.578 3.166 1.962 1.00 0.00 O ATOM 145 C5 U A 46 -4.574 5.411 1.188 1.00 0.00 C ATOM 146 C6 U A 46 -4.850 6.239 0.153 1.00 0.00 C ATOM 0 H5' U A 46 -4.196 10.341 -1.239 1.00 0.00 H new ATOM 0 H5'' U A 46 -5.796 10.915 -0.810 1.00 0.00 H new ATOM 0 H4' U A 46 -5.987 9.550 -2.677 1.00 0.00 H new ATOM 0 H3' U A 46 -7.119 8.177 -0.197 1.00 0.00 H new ATOM 0 H2' U A 46 -7.828 6.357 -1.764 1.00 0.00 H new ATOM 0 HO2' U A 46 -7.629 6.586 -3.983 1.00 0.00 H new ATOM 0 H1' U A 46 -5.474 6.151 -3.065 1.00 0.00 H new ATOM 0 H3 U A 46 -5.474 2.592 -0.272 1.00 0.00 H new ATOM 0 H5 U A 46 -4.183 5.820 2.108 1.00 0.00 H new ATOM 0 H6 U A 46 -4.676 7.299 0.263 1.00 0.00 H new ATOM 157 P C A 47 -9.503 9.213 -0.607 1.00 0.00 P ATOM 158 OP1 C A 47 -10.393 10.314 -1.039 1.00 0.00 O ATOM 159 OP2 C A 47 -9.060 9.140 0.803 1.00 0.00 O ATOM 160 O5' C A 47 -10.219 7.817 -0.978 1.00 0.00 O ATOM 161 C5' C A 47 -10.766 7.613 -2.283 1.00 0.00 C ATOM 162 C4' C A 47 -11.258 6.180 -2.483 1.00 0.00 C ATOM 163 O4' C A 47 -10.170 5.277 -2.462 1.00 0.00 O ATOM 164 C3' C A 47 -12.224 5.667 -1.439 1.00 0.00 C ATOM 165 O3' C A 47 -13.549 6.131 -1.732 1.00 0.00 O ATOM 166 C2' C A 47 -12.106 4.165 -1.607 1.00 0.00 C ATOM 167 O2' C A 47 -12.987 3.677 -2.625 1.00 0.00 O ATOM 168 C1' C A 47 -10.632 3.993 -2.005 1.00 0.00 C ATOM 169 N1 C A 47 -9.764 3.618 -0.883 1.00 0.00 N ATOM 170 C2 C A 47 -9.641 2.277 -0.584 1.00 0.00 C ATOM 171 O2 C A 47 -10.234 1.443 -1.266 1.00 0.00 O ATOM 172 N3 C A 47 -8.850 1.923 0.469 1.00 0.00 N ATOM 173 C4 C A 47 -8.216 2.857 1.195 1.00 0.00 C ATOM 174 N4 C A 47 -7.447 2.487 2.216 1.00 0.00 N ATOM 175 C5 C A 47 -8.355 4.246 0.887 1.00 0.00 C ATOM 176 C6 C A 47 -9.138 4.577 -0.153 1.00 0.00 C ATOM 0 H5' C A 47 -10.009 7.844 -3.033 1.00 0.00 H new ATOM 0 H5'' C A 47 -11.593 8.305 -2.441 1.00 0.00 H new ATOM 0 H4' C A 47 -11.776 6.226 -3.441 1.00 0.00 H new ATOM 0 H3' C A 47 -12.014 5.999 -0.422 1.00 0.00 H new ATOM 0 H2' C A 47 -12.383 3.605 -0.714 1.00 0.00 H new ATOM 0 HO2' C A 47 -12.768 2.744 -2.827 1.00 0.00 H new ATOM 0 H1' C A 47 -10.583 3.201 -2.752 1.00 0.00 H new ATOM 0 H41 C A 47 -6.963 3.192 2.771 1.00 0.00 H new ATOM 0 H42 C A 47 -7.342 1.498 2.443 1.00 0.00 H new ATOM 0 H5 C A 47 -7.849 5.002 1.469 1.00 0.00 H new ATOM 0 H6 C A 47 -9.271 5.617 -0.412 1.00 0.00 H new ATOM 188 P U A 48 -14.641 6.281 -0.556 1.00 0.00 P ATOM 189 OP1 U A 48 -15.828 6.968 -1.114 1.00 0.00 O ATOM 190 OP2 U A 48 -13.962 6.838 0.636 1.00 0.00 O ATOM 191 O5' U A 48 -15.050 4.754 -0.234 1.00 0.00 O ATOM 192 C5' U A 48 -16.437 4.397 -0.165 1.00 0.00 C ATOM 193 C4' U A 48 -16.650 2.896 0.019 1.00 0.00 C ATOM 194 O4' U A 48 -16.304 2.203 -1.192 1.00 0.00 O ATOM 195 C3' U A 48 -15.821 2.282 1.159 1.00 0.00 C ATOM 196 O3' U A 48 -16.618 1.308 1.854 1.00 0.00 O ATOM 197 C2' U A 48 -14.723 1.570 0.377 1.00 0.00 C ATOM 198 O2' U A 48 -14.148 0.487 1.109 1.00 0.00 O ATOM 199 C1' U A 48 -15.508 1.087 -0.828 1.00 0.00 C ATOM 200 N1 U A 48 -14.737 0.634 -2.029 1.00 0.00 N ATOM 201 C2 U A 48 -15.374 -0.277 -2.858 1.00 0.00 C ATOM 202 O2 U A 48 -16.506 -0.690 -2.621 1.00 0.00 O ATOM 203 N3 U A 48 -14.667 -0.695 -3.970 1.00 0.00 N ATOM 204 C4 U A 48 -13.394 -0.292 -4.329 1.00 0.00 C ATOM 205 O4 U A 48 -12.860 -0.733 -5.344 1.00 0.00 O ATOM 206 C5 U A 48 -12.801 0.655 -3.416 1.00 0.00 C ATOM 207 C6 U A 48 -13.469 1.081 -2.318 1.00 0.00 C ATOM 0 H5' U A 48 -16.938 4.722 -1.077 1.00 0.00 H new ATOM 0 H5'' U A 48 -16.905 4.930 0.663 1.00 0.00 H new ATOM 0 H4' U A 48 -17.704 2.780 0.273 1.00 0.00 H new ATOM 0 H3' U A 48 -15.463 2.997 1.899 1.00 0.00 H new ATOM 0 H2' U A 48 -13.864 2.197 0.139 1.00 0.00 H new ATOM 0 HO2' U A 48 -13.219 0.702 1.336 1.00 0.00 H new ATOM 0 H1' U A 48 -16.039 0.183 -0.530 1.00 0.00 H new ATOM 0 H3 U A 48 -15.129 -1.365 -4.585 1.00 0.00 H new ATOM 0 H5 U A 48 -11.807 1.030 -3.612 1.00 0.00 H new ATOM 0 H6 U A 48 -12.995 1.788 -1.654 1.00 0.00 H new ATOM 218 P U A 49 -16.466 1.010 3.442 1.00 0.00 P ATOM 219 OP1 U A 49 -17.531 0.059 3.831 1.00 0.00 O ATOM 220 OP2 U A 49 -16.358 2.311 4.140 1.00 0.00 O ATOM 221 O5' U A 49 -15.050 0.253 3.582 1.00 0.00 O ATOM 222 C5' U A 49 -14.840 -1.014 2.968 1.00 0.00 C ATOM 223 C4' U A 49 -13.394 -1.487 3.120 1.00 0.00 C ATOM 224 O4' U A 49 -12.543 -0.546 2.442 1.00 0.00 O ATOM 225 C3' U A 49 -12.886 -1.570 4.564 1.00 0.00 C ATOM 226 O3' U A 49 -12.084 -2.748 4.677 1.00 0.00 O ATOM 227 C2' U A 49 -12.005 -0.351 4.747 1.00 0.00 C ATOM 228 O2' U A 49 -10.908 -0.625 5.625 1.00 0.00 O ATOM 229 C1' U A 49 -11.529 -0.058 3.338 1.00 0.00 C ATOM 230 N1 U A 49 -11.327 1.386 3.095 1.00 0.00 N ATOM 231 C2 U A 49 -10.096 1.922 3.431 1.00 0.00 C ATOM 232 O2 U A 49 -9.181 1.230 3.870 1.00 0.00 O ATOM 233 N3 U A 49 -9.954 3.286 3.243 1.00 0.00 N ATOM 234 C4 U A 49 -10.920 4.147 2.754 1.00 0.00 C ATOM 235 O4 U A 49 -10.683 5.346 2.625 1.00 0.00 O ATOM 236 C5 U A 49 -12.172 3.502 2.431 1.00 0.00 C ATOM 237 C6 U A 49 -12.335 2.169 2.610 1.00 0.00 C ATOM 0 H5' U A 49 -15.092 -0.951 1.909 1.00 0.00 H new ATOM 0 H5'' U A 49 -15.511 -1.749 3.412 1.00 0.00 H new ATOM 0 H4' U A 49 -13.369 -2.496 2.708 1.00 0.00 H new ATOM 0 H3' U A 49 -13.690 -1.604 5.299 1.00 0.00 H new ATOM 0 H2' U A 49 -12.527 0.489 5.204 1.00 0.00 H new ATOM 0 HO2' U A 49 -11.237 -1.083 6.427 1.00 0.00 H new ATOM 0 H1' U A 49 -10.565 -0.543 3.183 1.00 0.00 H new ATOM 0 H3 U A 49 -9.052 3.695 3.488 1.00 0.00 H new ATOM 0 H5 U A 49 -12.989 4.091 2.041 1.00 0.00 H new ATOM 0 H6 U A 49 -13.284 1.715 2.364 1.00 0.00 H new ATOM 248 P G A 50 -11.849 -3.498 6.082 1.00 0.00 P ATOM 249 OP1 G A 50 -13.169 -3.820 6.668 1.00 0.00 O ATOM 250 OP2 G A 50 -10.856 -2.728 6.864 1.00 0.00 O ATOM 251 O5' G A 50 -11.160 -4.867 5.589 1.00 0.00 O ATOM 252 C5' G A 50 -11.931 -5.817 4.846 1.00 0.00 C ATOM 253 C4' G A 50 -11.127 -6.456 3.725 1.00 0.00 C ATOM 254 O4' G A 50 -10.835 -5.503 2.710 1.00 0.00 O ATOM 255 C3' G A 50 -9.795 -7.040 4.130 1.00 0.00 C ATOM 256 O3' G A 50 -9.951 -8.364 4.612 1.00 0.00 O ATOM 257 C2' G A 50 -9.011 -7.022 2.845 1.00 0.00 C ATOM 258 O2' G A 50 -9.329 -8.148 2.019 1.00 0.00 O ATOM 259 C1' G A 50 -9.494 -5.722 2.227 1.00 0.00 C ATOM 260 N9 G A 50 -8.711 -4.534 2.606 1.00 0.00 N ATOM 261 C8 G A 50 -7.804 -4.375 3.621 1.00 0.00 C ATOM 262 N7 G A 50 -7.276 -3.187 3.675 1.00 0.00 N ATOM 263 C5 G A 50 -7.873 -2.511 2.618 1.00 0.00 C ATOM 264 C6 G A 50 -7.699 -1.173 2.185 1.00 0.00 C ATOM 265 O6 G A 50 -6.947 -0.320 2.649 1.00 0.00 O ATOM 266 N1 G A 50 -8.507 -0.886 1.088 1.00 0.00 N ATOM 267 C2 G A 50 -9.363 -1.786 0.479 1.00 0.00 C ATOM 268 N2 G A 50 -10.054 -1.345 -0.570 1.00 0.00 N ATOM 269 N3 G A 50 -9.518 -3.043 0.888 1.00 0.00 N ATOM 270 C4 G A 50 -8.748 -3.331 1.958 1.00 0.00 C ATOM 0 H5' G A 50 -12.807 -5.323 4.427 1.00 0.00 H new ATOM 0 H5'' G A 50 -12.294 -6.594 5.519 1.00 0.00 H new ATOM 0 H4' G A 50 -11.772 -7.268 3.388 1.00 0.00 H new ATOM 0 H3' G A 50 -9.309 -6.489 4.935 1.00 0.00 H new ATOM 0 H2' G A 50 -7.931 -7.081 2.978 1.00 0.00 H new ATOM 0 HO2' G A 50 -9.894 -8.772 2.520 1.00 0.00 H new ATOM 0 H1' G A 50 -9.407 -5.833 1.146 1.00 0.00 H new ATOM 0 H8 G A 50 -7.550 -5.164 4.313 1.00 0.00 H new ATOM 0 H1 G A 50 -8.465 0.058 0.705 1.00 0.00 H new ATOM 0 H21 G A 50 -10.699 -1.969 -1.055 1.00 0.00 H new ATOM 0 H22 G A 50 -9.938 -0.383 -0.889 1.00 0.00 H new ATOM 282 P U A 51 -8.678 -9.094 5.241 1.00 0.00 P ATOM 283 OP1 U A 51 -9.112 -10.383 5.826 1.00 0.00 O ATOM 284 OP2 U A 51 -7.925 -8.116 6.058 1.00 0.00 O ATOM 285 O5' U A 51 -7.843 -9.394 3.894 1.00 0.00 O ATOM 286 C5' U A 51 -6.449 -9.669 3.930 1.00 0.00 C ATOM 287 C4' U A 51 -5.930 -10.117 2.565 1.00 0.00 C ATOM 288 O4' U A 51 -6.544 -11.361 2.225 1.00 0.00 O ATOM 289 C3' U A 51 -6.198 -9.152 1.410 1.00 0.00 C ATOM 290 O3' U A 51 -5.058 -9.185 0.551 1.00 0.00 O ATOM 291 C2' U A 51 -7.402 -9.724 0.678 1.00 0.00 C ATOM 292 O2' U A 51 -7.230 -9.626 -0.740 1.00 0.00 O ATOM 293 C1' U A 51 -7.446 -11.187 1.122 1.00 0.00 C ATOM 294 N1 U A 51 -8.785 -11.665 1.560 1.00 0.00 N ATOM 295 C2 U A 51 -9.237 -12.873 1.048 1.00 0.00 C ATOM 296 O2 U A 51 -8.574 -13.532 0.251 1.00 0.00 O ATOM 297 N3 U A 51 -10.478 -13.296 1.487 1.00 0.00 N ATOM 298 C4 U A 51 -11.299 -12.631 2.380 1.00 0.00 C ATOM 299 O4 U A 51 -12.388 -13.102 2.699 1.00 0.00 O ATOM 300 C5 U A 51 -10.753 -11.384 2.864 1.00 0.00 C ATOM 301 C6 U A 51 -9.539 -10.946 2.451 1.00 0.00 C ATOM 0 H5' U A 51 -6.249 -10.445 4.669 1.00 0.00 H new ATOM 0 H5'' U A 51 -5.910 -8.778 4.251 1.00 0.00 H new ATOM 0 H4' U A 51 -4.848 -10.178 2.679 1.00 0.00 H new ATOM 0 H3' U A 51 -6.379 -8.128 1.736 1.00 0.00 H new ATOM 0 H2' U A 51 -8.324 -9.189 0.906 1.00 0.00 H new ATOM 0 HO2' U A 51 -8.035 -9.237 -1.141 1.00 0.00 H new ATOM 0 H1' U A 51 -7.170 -11.771 0.244 1.00 0.00 H new ATOM 0 H3 U A 51 -10.821 -14.183 1.117 1.00 0.00 H new ATOM 0 H5 U A 51 -11.321 -10.792 3.566 1.00 0.00 H new ATOM 0 H6 U A 51 -9.157 -10.010 2.832 1.00 0.00 H new ATOM 312 P A A 52 -4.040 -7.949 0.380 1.00 0.00 P ATOM 313 OP1 A A 52 -2.880 -8.413 -0.412 1.00 0.00 O ATOM 314 OP2 A A 52 -3.825 -7.344 1.714 1.00 0.00 O ATOM 315 O5' A A 52 -4.871 -6.904 -0.515 1.00 0.00 O ATOM 316 C5' A A 52 -5.776 -7.373 -1.513 1.00 0.00 C ATOM 317 C4' A A 52 -6.301 -6.235 -2.380 1.00 0.00 C ATOM 318 O4' A A 52 -7.080 -5.298 -1.620 1.00 0.00 O ATOM 319 C3' A A 52 -5.197 -5.416 -3.020 1.00 0.00 C ATOM 320 O3' A A 52 -4.737 -6.086 -4.201 1.00 0.00 O ATOM 321 C2' A A 52 -5.926 -4.136 -3.363 1.00 0.00 C ATOM 322 O2' A A 52 -6.694 -4.273 -4.564 1.00 0.00 O ATOM 323 C1' A A 52 -6.823 -3.973 -2.141 1.00 0.00 C ATOM 324 N9 A A 52 -6.213 -3.179 -1.062 1.00 0.00 N ATOM 325 C8 A A 52 -5.626 -3.613 0.100 1.00 0.00 C ATOM 326 N7 A A 52 -5.186 -2.647 0.858 1.00 0.00 N ATOM 327 C5 A A 52 -5.507 -1.493 0.147 1.00 0.00 C ATOM 328 C6 A A 52 -5.305 -0.128 0.410 1.00 0.00 C ATOM 329 N6 A A 52 -4.708 0.320 1.509 1.00 0.00 N ATOM 330 N1 A A 52 -5.743 0.751 -0.508 1.00 0.00 N ATOM 331 C2 A A 52 -6.339 0.295 -1.605 1.00 0.00 C ATOM 332 N3 A A 52 -6.587 -0.955 -1.962 1.00 0.00 N ATOM 333 C4 A A 52 -6.135 -1.810 -1.022 1.00 0.00 C ATOM 0 H5' A A 52 -6.613 -7.882 -1.035 1.00 0.00 H new ATOM 0 H5'' A A 52 -5.274 -8.108 -2.142 1.00 0.00 H new ATOM 0 H4' A A 52 -6.898 -6.737 -3.141 1.00 0.00 H new ATOM 0 H3' A A 52 -4.316 -5.256 -2.398 1.00 0.00 H new ATOM 0 H2' A A 52 -5.272 -3.286 -3.556 1.00 0.00 H new ATOM 0 HO2' A A 52 -6.486 -5.131 -4.989 1.00 0.00 H new ATOM 0 H1' A A 52 -7.723 -3.446 -2.459 1.00 0.00 H new ATOM 0 H8 A A 52 -5.537 -4.657 0.362 1.00 0.00 H new ATOM 0 H61 A A 52 -4.587 1.323 1.651 1.00 0.00 H new ATOM 0 H62 A A 52 -4.371 -0.339 2.211 1.00 0.00 H new ATOM 0 H2 A A 52 -6.667 1.051 -2.303 1.00 0.00 H new ATOM 345 P G A 53 -3.233 -5.890 -4.746 1.00 0.00 P ATOM 346 OP1 G A 53 -3.035 -6.795 -5.900 1.00 0.00 O ATOM 347 OP2 G A 53 -2.309 -5.953 -3.591 1.00 0.00 O ATOM 348 O5' G A 53 -3.255 -4.380 -5.289 1.00 0.00 O ATOM 349 C5' G A 53 -4.077 -4.023 -6.399 1.00 0.00 C ATOM 350 C4' G A 53 -4.055 -2.520 -6.630 1.00 0.00 C ATOM 351 O4' G A 53 -4.636 -1.840 -5.514 1.00 0.00 O ATOM 352 C3' G A 53 -2.666 -1.926 -6.777 1.00 0.00 C ATOM 353 O3' G A 53 -2.180 -2.103 -8.111 1.00 0.00 O ATOM 354 C2' G A 53 -2.957 -0.466 -6.498 1.00 0.00 C ATOM 355 O2' G A 53 -3.552 0.178 -7.631 1.00 0.00 O ATOM 356 C1' G A 53 -3.946 -0.589 -5.343 1.00 0.00 C ATOM 357 N9 G A 53 -3.291 -0.595 -4.023 1.00 0.00 N ATOM 358 C8 G A 53 -2.920 -1.657 -3.240 1.00 0.00 C ATOM 359 N7 G A 53 -2.332 -1.312 -2.128 1.00 0.00 N ATOM 360 C5 G A 53 -2.310 0.078 -2.179 1.00 0.00 C ATOM 361 C6 G A 53 -1.790 1.017 -1.248 1.00 0.00 C ATOM 362 O6 G A 53 -1.247 0.795 -0.164 1.00 0.00 O ATOM 363 N1 G A 53 -1.969 2.326 -1.694 1.00 0.00 N ATOM 364 C2 G A 53 -2.577 2.680 -2.887 1.00 0.00 C ATOM 365 N2 G A 53 -2.663 3.983 -3.157 1.00 0.00 N ATOM 366 N3 G A 53 -3.065 1.794 -3.753 1.00 0.00 N ATOM 367 C4 G A 53 -2.896 0.521 -3.337 1.00 0.00 C ATOM 0 H5' G A 53 -5.100 -4.352 -6.219 1.00 0.00 H new ATOM 0 H5'' G A 53 -3.729 -4.538 -7.295 1.00 0.00 H new ATOM 0 H4' G A 53 -4.606 -2.385 -7.561 1.00 0.00 H new ATOM 0 H3' G A 53 -1.907 -2.370 -6.133 1.00 0.00 H new ATOM 0 H2' G A 53 -2.075 0.136 -6.278 1.00 0.00 H new ATOM 0 HO2' G A 53 -3.729 1.118 -7.418 1.00 0.00 H new ATOM 0 H1' G A 53 -4.613 0.273 -5.365 1.00 0.00 H new ATOM 0 H8 G A 53 -3.098 -2.685 -3.518 1.00 0.00 H new ATOM 0 H1 G A 53 -1.627 3.079 -1.097 1.00 0.00 H new ATOM 0 H21 G A 53 -3.102 4.297 -4.023 1.00 0.00 H new ATOM 0 H22 G A 53 -2.290 4.666 -2.498 1.00 0.00 H new ATOM 379 P A A 54 -0.597 -2.215 -8.395 1.00 0.00 P ATOM 380 OP1 A A 54 -0.402 -2.484 -9.837 1.00 0.00 O ATOM 381 OP2 A A 54 -0.009 -3.127 -7.388 1.00 0.00 O ATOM 382 O5' A A 54 -0.078 -0.725 -8.087 1.00 0.00 O ATOM 383 C5' A A 54 -0.488 0.374 -8.895 1.00 0.00 C ATOM 384 C4' A A 54 -0.007 1.696 -8.308 1.00 0.00 C ATOM 385 O4' A A 54 -0.628 1.950 -7.044 1.00 0.00 O ATOM 386 C3' A A 54 1.483 1.774 -8.028 1.00 0.00 C ATOM 387 O3' A A 54 2.214 2.087 -9.210 1.00 0.00 O ATOM 388 C2' A A 54 1.538 2.948 -7.081 1.00 0.00 C ATOM 389 O2' A A 54 1.482 4.195 -7.785 1.00 0.00 O ATOM 390 C1' A A 54 0.291 2.725 -6.244 1.00 0.00 C ATOM 391 N9 A A 54 0.557 1.995 -4.994 1.00 0.00 N ATOM 392 C8 A A 54 0.385 0.665 -4.708 1.00 0.00 C ATOM 393 N7 A A 54 0.705 0.343 -3.485 1.00 0.00 N ATOM 394 C5 A A 54 1.124 1.545 -2.926 1.00 0.00 C ATOM 395 C6 A A 54 1.599 1.884 -1.651 1.00 0.00 C ATOM 396 N6 A A 54 1.729 0.999 -0.664 1.00 0.00 N ATOM 397 N1 A A 54 1.931 3.168 -1.440 1.00 0.00 N ATOM 398 C2 A A 54 1.799 4.044 -2.429 1.00 0.00 C ATOM 399 N3 A A 54 1.362 3.850 -3.660 1.00 0.00 N ATOM 400 C4 A A 54 1.038 2.554 -3.840 1.00 0.00 C ATOM 0 H5' A A 54 -1.575 0.383 -8.978 1.00 0.00 H new ATOM 0 H5'' A A 54 -0.093 0.255 -9.904 1.00 0.00 H new ATOM 0 H4' A A 54 -0.270 2.419 -9.081 1.00 0.00 H new ATOM 0 H3' A A 54 1.907 0.845 -7.648 1.00 0.00 H new ATOM 0 H2' A A 54 2.458 3.004 -6.499 1.00 0.00 H new ATOM 0 HO2' A A 54 1.467 4.025 -8.750 1.00 0.00 H new ATOM 0 H1' A A 54 -0.111 3.698 -5.963 1.00 0.00 H new ATOM 0 H8 A A 54 0.018 -0.050 -5.429 1.00 0.00 H new ATOM 0 H61 A A 54 2.080 1.298 0.246 1.00 0.00 H new ATOM 0 H62 A A 54 1.478 0.023 -0.818 1.00 0.00 H new ATOM 0 H2 A A 54 2.090 5.057 -2.194 1.00 0.00 H new ATOM 412 P U A 55 3.747 1.628 -9.365 1.00 0.00 P ATOM 413 OP1 U A 55 4.230 2.045 -10.701 1.00 0.00 O ATOM 414 OP2 U A 55 3.860 0.215 -8.939 1.00 0.00 O ATOM 415 O5' U A 55 4.454 2.554 -8.255 1.00 0.00 O ATOM 416 C5' U A 55 4.440 3.972 -8.383 1.00 0.00 C ATOM 417 C4' U A 55 5.015 4.654 -7.144 1.00 0.00 C ATOM 418 O4' U A 55 4.207 4.369 -6.002 1.00 0.00 O ATOM 419 C3' U A 55 6.403 4.195 -6.745 1.00 0.00 C ATOM 420 O3' U A 55 7.393 4.858 -7.538 1.00 0.00 O ATOM 421 C2' U A 55 6.473 4.679 -5.309 1.00 0.00 C ATOM 422 O2' U A 55 6.861 6.056 -5.238 1.00 0.00 O ATOM 423 C1' U A 55 5.037 4.477 -4.827 1.00 0.00 C ATOM 424 N1 U A 55 4.874 3.255 -4.018 1.00 0.00 N ATOM 425 C2 U A 55 5.201 3.348 -2.682 1.00 0.00 C ATOM 426 O2 U A 55 5.589 4.400 -2.178 1.00 0.00 O ATOM 427 N3 U A 55 5.066 2.192 -1.942 1.00 0.00 N ATOM 428 C4 U A 55 4.635 0.966 -2.408 1.00 0.00 C ATOM 429 O4 U A 55 4.551 0.006 -1.641 1.00 0.00 O ATOM 430 C5 U A 55 4.314 0.956 -3.822 1.00 0.00 C ATOM 431 C6 U A 55 4.446 2.079 -4.570 1.00 0.00 C ATOM 0 H5' U A 55 3.418 4.313 -8.545 1.00 0.00 H new ATOM 0 H5'' U A 55 5.017 4.264 -9.261 1.00 0.00 H new ATOM 0 H4' U A 55 5.045 5.707 -7.423 1.00 0.00 H new ATOM 0 H3' U A 55 6.578 3.127 -6.872 1.00 0.00 H new ATOM 0 H2' U A 55 7.213 4.151 -4.707 1.00 0.00 H new ATOM 0 HO2' U A 55 7.032 6.395 -6.142 1.00 0.00 H new ATOM 0 H1' U A 55 4.760 5.319 -4.193 1.00 0.00 H new ATOM 0 H3 U A 55 5.309 2.248 -0.953 1.00 0.00 H new ATOM 0 H5 U A 55 3.966 0.044 -4.284 1.00 0.00 H new ATOM 0 H6 U A 55 4.208 2.044 -5.623 1.00 0.00 H new ATOM 442 P C A 56 8.818 4.164 -7.840 1.00 0.00 P ATOM 443 OP1 C A 56 9.564 5.034 -8.777 1.00 0.00 O ATOM 444 OP2 C A 56 8.574 2.747 -8.190 1.00 0.00 O ATOM 445 O5' C A 56 9.567 4.206 -6.413 1.00 0.00 O ATOM 446 C5' C A 56 9.925 5.452 -5.814 1.00 0.00 C ATOM 447 C4' C A 56 10.510 5.261 -4.415 1.00 0.00 C ATOM 448 O4' C A 56 9.536 4.729 -3.525 1.00 0.00 O ATOM 449 C3' C A 56 11.671 4.292 -4.336 1.00 0.00 C ATOM 450 O3' C A 56 12.882 4.947 -4.725 1.00 0.00 O ATOM 451 C2' C A 56 11.703 3.959 -2.854 1.00 0.00 C ATOM 452 O2' C A 56 12.527 4.880 -2.129 1.00 0.00 O ATOM 453 C1' C A 56 10.232 4.083 -2.443 1.00 0.00 C ATOM 454 N1 C A 56 9.587 2.780 -2.189 1.00 0.00 N ATOM 455 C2 C A 56 9.776 2.215 -0.939 1.00 0.00 C ATOM 456 O2 C A 56 10.443 2.811 -0.097 1.00 0.00 O ATOM 457 N3 C A 56 9.210 1.000 -0.682 1.00 0.00 N ATOM 458 C4 C A 56 8.490 0.370 -1.622 1.00 0.00 C ATOM 459 N4 C A 56 7.948 -0.815 -1.349 1.00 0.00 N ATOM 460 C5 C A 56 8.296 0.952 -2.915 1.00 0.00 C ATOM 461 C6 C A 56 8.860 2.150 -3.154 1.00 0.00 C ATOM 0 H5' C A 56 9.046 6.093 -5.756 1.00 0.00 H new ATOM 0 H5'' C A 56 10.652 5.963 -6.445 1.00 0.00 H new ATOM 0 H4' C A 56 10.849 6.262 -4.147 1.00 0.00 H new ATOM 0 H3' C A 56 11.571 3.420 -4.982 1.00 0.00 H new ATOM 0 H2' C A 56 12.126 2.977 -2.644 1.00 0.00 H new ATOM 0 HO2' C A 56 12.527 4.641 -1.179 1.00 0.00 H new ATOM 0 H1' C A 56 10.189 4.649 -1.512 1.00 0.00 H new ATOM 0 H41 C A 56 7.399 -1.300 -2.059 1.00 0.00 H new ATOM 0 H42 C A 56 8.082 -1.237 -0.430 1.00 0.00 H new ATOM 0 H5 C A 56 7.716 0.447 -3.673 1.00 0.00 H new ATOM 0 H6 C A 56 8.735 2.617 -4.120 1.00 0.00 H new ATOM 473 P A A 57 14.106 4.118 -5.366 1.00 0.00 P ATOM 474 OP1 A A 57 15.152 5.082 -5.776 1.00 0.00 O ATOM 475 OP2 A A 57 13.551 3.170 -6.358 1.00 0.00 O ATOM 476 O5' A A 57 14.670 3.266 -4.119 1.00 0.00 O ATOM 477 C5' A A 57 15.254 3.924 -2.993 1.00 0.00 C ATOM 478 C4' A A 57 15.612 2.937 -1.883 1.00 0.00 C ATOM 479 O4' A A 57 14.439 2.334 -1.346 1.00 0.00 O ATOM 480 C3' A A 57 16.488 1.783 -2.329 1.00 0.00 C ATOM 481 O3' A A 57 17.868 2.162 -2.395 1.00 0.00 O ATOM 482 C2' A A 57 16.231 0.746 -1.247 1.00 0.00 C ATOM 483 O2' A A 57 17.165 0.875 -0.168 1.00 0.00 O ATOM 484 C1' A A 57 14.804 1.060 -0.789 1.00 0.00 C ATOM 485 N9 A A 57 13.810 0.063 -1.233 1.00 0.00 N ATOM 486 C8 A A 57 12.996 0.089 -2.336 1.00 0.00 C ATOM 487 N7 A A 57 12.242 -0.969 -2.461 1.00 0.00 N ATOM 488 C5 A A 57 12.582 -1.752 -1.362 1.00 0.00 C ATOM 489 C6 A A 57 12.137 -3.007 -0.916 1.00 0.00 C ATOM 490 N6 A A 57 11.210 -3.722 -1.554 1.00 0.00 N ATOM 491 N1 A A 57 12.685 -3.491 0.211 1.00 0.00 N ATOM 492 C2 A A 57 13.607 -2.773 0.842 1.00 0.00 C ATOM 493 N3 A A 57 14.106 -1.589 0.525 1.00 0.00 N ATOM 494 C4 A A 57 13.537 -1.130 -0.610 1.00 0.00 C ATOM 0 H5' A A 57 14.559 4.669 -2.607 1.00 0.00 H new ATOM 0 H5'' A A 57 16.151 4.458 -3.308 1.00 0.00 H new ATOM 0 H4' A A 57 16.153 3.544 -1.157 1.00 0.00 H new ATOM 0 H3' A A 57 16.262 1.423 -3.333 1.00 0.00 H new ATOM 0 H2' A A 57 16.347 -0.277 -1.604 1.00 0.00 H new ATOM 0 HO2' A A 57 17.912 1.444 -0.448 1.00 0.00 H new ATOM 0 HO3' A A 57 18.405 1.395 -2.684 1.00 0.00 H new ATOM 0 H1' A A 57 14.799 1.054 0.301 1.00 0.00 H new ATOM 0 H8 A A 57 12.980 0.910 -3.037 1.00 0.00 H new ATOM 0 H61 A A 57 10.923 -4.629 -1.186 1.00 0.00 H new ATOM 0 H62 A A 57 10.788 -3.362 -2.410 1.00 0.00 H new ATOM 0 H2 A A 57 14.006 -3.218 1.741 1.00 0.00 H new TER 507 A A 57