USER MOD reduce.3.24.130724 H: found=0, std=0, add=176, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 176 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 1 G O2' : rot -17:sc= 0.0871 USER MOD Single : A 1 G O5' : rot 180:sc=-0.00347 USER MOD Single : A 2 G O2' : rot 180:sc= -0.386 USER MOD Single : A 3 A O2' : rot -29:sc= 0.146 USER MOD Single : A 4 U O2' : rot -0:sc= -0.198 USER MOD Single : A 5 G O2' : rot -7:sc= 0.0946 USER MOD Single : A 6 U O2' : rot -15:sc= -0.423 USER MOD Single : A 7 C O2' : rot 180:sc= -0.28 USER MOD Single : A 8 C O2' : rot -22:sc= 0.128 USER MOD Single : A 8 C O3' : rot 180:sc= 0.182 USER MOD Single : B 9 G O2' : rot 180:sc= -0.234 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 G O2' : rot 180:sc= -0.371 USER MOD Single : B 11 A O2' : rot -23:sc= 0.152 USER MOD Single : B 12 U O2' : rot -1:sc= -0.181 USER MOD Single : B 13 G O2' : rot -7:sc= 0.0994 USER MOD Single : B 14 U O2' : rot -15:sc= -0.425 USER MOD Single : B 15 C O2' : rot -11:sc= -0.204 USER MOD Single : B 16 C O2' : rot -27:sc= 0.12 USER MOD Single : B 16 C O3' : rot 180:sc= 0.141 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 5.139 -7.949 5.737 1.00 0.00 O ATOM 2 C5' G A 1 6.464 -8.433 5.774 1.00 0.00 C ATOM 3 C4' G A 1 7.423 -7.370 5.233 1.00 0.00 C ATOM 4 O4' G A 1 7.139 -7.056 3.871 1.00 0.00 O ATOM 5 C3' G A 1 7.315 -6.053 5.976 1.00 0.00 C ATOM 6 O3' G A 1 7.963 -6.082 7.237 1.00 0.00 O ATOM 7 C2' G A 1 8.016 -5.153 4.988 1.00 0.00 C ATOM 8 O2' G A 1 9.405 -5.400 5.025 1.00 0.00 O ATOM 9 C1' G A 1 7.463 -5.672 3.661 1.00 0.00 C ATOM 10 N9 G A 1 6.236 -4.923 3.310 1.00 0.00 N ATOM 11 C8 G A 1 4.928 -5.333 3.375 1.00 0.00 C ATOM 12 N7 G A 1 4.069 -4.428 2.997 1.00 0.00 N ATOM 13 C5 G A 1 4.861 -3.337 2.655 1.00 0.00 C ATOM 14 C6 G A 1 4.485 -2.049 2.172 1.00 0.00 C ATOM 15 O6 G A 1 3.355 -1.620 1.951 1.00 0.00 O ATOM 16 N1 G A 1 5.593 -1.241 1.947 1.00 0.00 N ATOM 17 C2 G A 1 6.902 -1.618 2.162 1.00 0.00 C ATOM 18 N2 G A 1 7.842 -0.704 1.898 1.00 0.00 N ATOM 19 N3 G A 1 7.260 -2.825 2.616 1.00 0.00 N ATOM 20 C4 G A 1 6.191 -3.631 2.841 1.00 0.00 C ATOM 0 H5' G A 1 6.544 -9.344 5.180 1.00 0.00 H new ATOM 0 H5'' G A 1 6.736 -8.694 6.797 1.00 0.00 H new ATOM 0 H4' G A 1 8.414 -7.806 5.356 1.00 0.00 H new ATOM 0 H3' G A 1 6.300 -5.754 6.237 1.00 0.00 H new ATOM 0 H2' G A 1 7.865 -4.089 5.167 1.00 0.00 H new ATOM 0 HO2' G A 1 9.629 -5.884 5.847 1.00 0.00 H new ATOM 0 HO5' G A 1 4.530 -8.635 6.083 1.00 0.00 H new ATOM 0 H1' G A 1 8.184 -5.550 2.853 1.00 0.00 H new ATOM 0 H8 G A 1 4.636 -6.318 3.709 1.00 0.00 H new ATOM 0 H1 G A 1 5.425 -0.298 1.596 1.00 0.00 H new ATOM 0 H21 G A 1 8.827 -0.930 2.039 1.00 0.00 H new ATOM 0 H22 G A 1 7.574 0.219 1.555 1.00 0.00 H new ATOM 33 P G A 2 7.644 -4.958 8.360 1.00 0.00 P ATOM 34 OP1 G A 2 8.420 -5.294 9.575 1.00 0.00 O ATOM 35 OP2 G A 2 6.175 -4.810 8.448 1.00 0.00 O ATOM 36 O5' G A 2 8.248 -3.596 7.744 1.00 0.00 O ATOM 37 C5' G A 2 9.637 -3.343 7.761 1.00 0.00 C ATOM 38 C4' G A 2 9.925 -1.991 7.104 1.00 0.00 C ATOM 39 O4' G A 2 9.434 -1.954 5.760 1.00 0.00 O ATOM 40 C3' G A 2 9.244 -0.832 7.806 1.00 0.00 C ATOM 41 O3' G A 2 9.915 -0.434 8.989 1.00 0.00 O ATOM 42 C2' G A 2 9.336 0.212 6.717 1.00 0.00 C ATOM 43 O2' G A 2 10.664 0.681 6.594 1.00 0.00 O ATOM 44 C1' G A 2 8.986 -0.615 5.487 1.00 0.00 C ATOM 45 N9 G A 2 7.516 -0.597 5.301 1.00 0.00 N ATOM 46 C8 G A 2 6.595 -1.570 5.594 1.00 0.00 C ATOM 47 N7 G A 2 5.364 -1.232 5.333 1.00 0.00 N ATOM 48 C5 G A 2 5.470 0.062 4.837 1.00 0.00 C ATOM 49 C6 G A 2 4.453 0.955 4.390 1.00 0.00 C ATOM 50 O6 G A 2 3.241 0.763 4.337 1.00 0.00 O ATOM 51 N1 G A 2 4.984 2.173 3.983 1.00 0.00 N ATOM 52 C2 G A 2 6.324 2.495 3.995 1.00 0.00 C ATOM 53 N2 G A 2 6.652 3.719 3.568 1.00 0.00 N ATOM 54 N3 G A 2 7.282 1.658 4.409 1.00 0.00 N ATOM 55 C4 G A 2 6.784 0.462 4.816 1.00 0.00 C ATOM 0 H5' G A 2 10.167 -4.135 7.232 1.00 0.00 H new ATOM 0 H5'' G A 2 10.004 -3.345 8.787 1.00 0.00 H new ATOM 0 H4' G A 2 11.009 -1.888 7.156 1.00 0.00 H new ATOM 0 H3' G A 2 8.236 -1.044 8.163 1.00 0.00 H new ATOM 0 H2' G A 2 8.707 1.086 6.886 1.00 0.00 H new ATOM 0 HO2' G A 2 10.708 1.355 5.884 1.00 0.00 H new ATOM 0 H1' G A 2 9.453 -0.225 4.583 1.00 0.00 H new ATOM 0 H8 G A 2 6.866 -2.531 6.005 1.00 0.00 H new ATOM 0 H1 G A 2 4.332 2.883 3.650 1.00 0.00 H new ATOM 0 H21 G A 2 7.630 4.010 3.556 1.00 0.00 H new ATOM 0 H22 G A 2 5.925 4.362 3.255 1.00 0.00 H new ATOM 67 P A A 3 9.179 0.504 10.090 1.00 0.00 P ATOM 68 OP1 A A 3 10.140 0.759 11.186 1.00 0.00 O ATOM 69 OP2 A A 3 7.864 -0.102 10.395 1.00 0.00 O ATOM 70 O5' A A 3 8.918 1.896 9.318 1.00 0.00 O ATOM 71 C5' A A 3 9.989 2.754 8.992 1.00 0.00 C ATOM 72 C4' A A 3 9.467 3.977 8.232 1.00 0.00 C ATOM 73 O4' A A 3 8.742 3.589 7.062 1.00 0.00 O ATOM 74 C3' A A 3 8.499 4.827 9.031 1.00 0.00 C ATOM 75 O3' A A 3 9.161 5.689 9.935 1.00 0.00 O ATOM 76 C2' A A 3 7.814 5.599 7.938 1.00 0.00 C ATOM 77 O2' A A 3 8.657 6.635 7.476 1.00 0.00 O ATOM 78 C1' A A 3 7.678 4.537 6.854 1.00 0.00 C ATOM 79 N9 A A 3 6.364 3.861 6.976 1.00 0.00 N ATOM 80 C8 A A 3 6.079 2.581 7.385 1.00 0.00 C ATOM 81 N7 A A 3 4.813 2.275 7.326 1.00 0.00 N ATOM 82 C5 A A 3 4.211 3.438 6.862 1.00 0.00 C ATOM 83 C6 A A 3 2.872 3.773 6.590 1.00 0.00 C ATOM 84 N6 A A 3 1.856 2.915 6.740 1.00 0.00 N ATOM 85 N1 A A 3 2.616 5.026 6.171 1.00 0.00 N ATOM 86 C2 A A 3 3.627 5.877 6.022 1.00 0.00 C ATOM 87 N3 A A 3 4.922 5.680 6.230 1.00 0.00 N ATOM 88 C4 A A 3 5.146 4.415 6.659 1.00 0.00 C ATOM 0 H5' A A 3 10.720 2.222 8.383 1.00 0.00 H new ATOM 0 H5'' A A 3 10.501 3.071 9.900 1.00 0.00 H new ATOM 0 H4' A A 3 10.367 4.547 8.002 1.00 0.00 H new ATOM 0 H3' A A 3 7.828 4.247 9.665 1.00 0.00 H new ATOM 0 H2' A A 3 6.876 6.064 8.241 1.00 0.00 H new ATOM 0 HO2' A A 3 9.246 6.926 8.203 1.00 0.00 H new ATOM 0 H1' A A 3 7.740 4.979 5.860 1.00 0.00 H new ATOM 0 H8 A A 3 6.836 1.890 7.725 1.00 0.00 H new ATOM 0 H61 A A 3 0.903 3.211 6.528 1.00 0.00 H new ATOM 0 H62 A A 3 2.035 1.965 7.066 1.00 0.00 H new ATOM 0 H2 A A 3 3.356 6.866 5.685 1.00 0.00 H new ATOM 100 P U A 4 8.769 5.703 11.490 1.00 0.00 P ATOM 101 OP1 U A 4 9.735 6.559 12.213 1.00 0.00 O ATOM 102 OP2 U A 4 8.535 4.311 11.930 1.00 0.00 O ATOM 103 O5' U A 4 7.356 6.469 11.427 1.00 0.00 O ATOM 104 C5' U A 4 7.304 7.841 11.091 1.00 0.00 C ATOM 105 C4' U A 4 5.861 8.260 10.814 1.00 0.00 C ATOM 106 O4' U A 4 5.335 7.561 9.689 1.00 0.00 O ATOM 107 C3' U A 4 4.922 7.946 11.960 1.00 0.00 C ATOM 108 O3' U A 4 5.025 8.894 13.007 1.00 0.00 O ATOM 109 C2' U A 4 3.592 8.020 11.245 1.00 0.00 C ATOM 110 O2' U A 4 3.228 9.371 11.050 1.00 0.00 O ATOM 111 C1' U A 4 3.922 7.406 9.882 1.00 0.00 C ATOM 112 N1 U A 4 3.553 5.969 9.865 1.00 0.00 N ATOM 113 C2 U A 4 2.221 5.667 9.635 1.00 0.00 C ATOM 114 O2 U A 4 1.380 6.543 9.449 1.00 0.00 O ATOM 115 N3 U A 4 1.886 4.321 9.622 1.00 0.00 N ATOM 116 C4 U A 4 2.761 3.266 9.828 1.00 0.00 C ATOM 117 O4 U A 4 2.357 2.107 9.808 1.00 0.00 O ATOM 118 C5 U A 4 4.135 3.672 10.047 1.00 0.00 C ATOM 119 C6 U A 4 4.484 4.980 10.056 1.00 0.00 C ATOM 0 H5' U A 4 7.921 8.032 10.213 1.00 0.00 H new ATOM 0 H5'' U A 4 7.714 8.438 11.905 1.00 0.00 H new ATOM 0 H4' U A 4 5.910 9.336 10.649 1.00 0.00 H new ATOM 0 H3' U A 4 5.114 6.998 12.462 1.00 0.00 H new ATOM 0 H2' U A 4 2.781 7.530 11.783 1.00 0.00 H new ATOM 0 HO2' U A 4 3.920 9.954 11.426 1.00 0.00 H new ATOM 0 H1' U A 4 3.364 7.898 9.085 1.00 0.00 H new ATOM 0 H3 U A 4 0.909 4.087 9.445 1.00 0.00 H new ATOM 0 H5 U A 4 4.893 2.919 10.206 1.00 0.00 H new ATOM 0 H6 U A 4 5.517 5.250 10.217 1.00 0.00 H new ATOM 130 P G A 5 4.270 8.659 14.413 1.00 0.00 P ATOM 131 OP1 G A 5 4.660 9.749 15.333 1.00 0.00 O ATOM 132 OP2 G A 5 4.480 7.250 14.813 1.00 0.00 O ATOM 133 O5' G A 5 2.714 8.847 14.044 1.00 0.00 O ATOM 134 C5' G A 5 2.165 10.135 13.837 1.00 0.00 C ATOM 135 C4' G A 5 0.676 9.999 13.510 1.00 0.00 C ATOM 136 O4' G A 5 0.475 9.220 12.336 1.00 0.00 O ATOM 137 C3' G A 5 -0.073 9.255 14.594 1.00 0.00 C ATOM 138 O3' G A 5 -0.356 10.073 15.719 1.00 0.00 O ATOM 139 C2' G A 5 -1.324 8.867 13.848 1.00 0.00 C ATOM 140 O2' G A 5 -2.240 9.941 13.852 1.00 0.00 O ATOM 141 C1' G A 5 -0.832 8.643 12.424 1.00 0.00 C ATOM 142 N9 G A 5 -0.789 7.197 12.149 1.00 0.00 N ATOM 143 C8 G A 5 0.268 6.336 12.232 1.00 0.00 C ATOM 144 N7 G A 5 -0.031 5.096 11.951 1.00 0.00 N ATOM 145 C5 G A 5 -1.393 5.139 11.669 1.00 0.00 C ATOM 146 C6 G A 5 -2.294 4.091 11.304 1.00 0.00 C ATOM 147 O6 G A 5 -2.059 2.896 11.135 1.00 0.00 O ATOM 148 N1 G A 5 -3.583 4.568 11.135 1.00 0.00 N ATOM 149 C2 G A 5 -3.974 5.878 11.283 1.00 0.00 C ATOM 150 N2 G A 5 -5.267 6.144 11.069 1.00 0.00 N ATOM 151 N3 G A 5 -3.138 6.865 11.618 1.00 0.00 N ATOM 152 C4 G A 5 -1.866 6.423 11.796 1.00 0.00 C ATOM 0 H5' G A 5 2.684 10.638 13.022 1.00 0.00 H new ATOM 0 H5'' G A 5 2.300 10.749 14.728 1.00 0.00 H new ATOM 0 H4' G A 5 0.314 11.021 13.397 1.00 0.00 H new ATOM 0 H3' G A 5 0.478 8.419 15.026 1.00 0.00 H new ATOM 0 H2' G A 5 -1.825 8.002 14.282 1.00 0.00 H new ATOM 0 HO2' G A 5 -1.905 10.655 14.434 1.00 0.00 H new ATOM 0 H1' G A 5 -1.493 9.104 11.691 1.00 0.00 H new ATOM 0 H8 G A 5 1.264 6.653 12.506 1.00 0.00 H new ATOM 0 H1 G A 5 -4.302 3.891 10.879 1.00 0.00 H new ATOM 0 H21 G A 5 -5.614 7.098 11.164 1.00 0.00 H new ATOM 0 H22 G A 5 -5.906 5.392 10.810 1.00 0.00 H new ATOM 164 P U A 6 -0.863 9.426 17.114 1.00 0.00 P ATOM 165 OP1 U A 6 -0.995 10.518 18.103 1.00 0.00 O ATOM 166 OP2 U A 6 0.007 8.268 17.415 1.00 0.00 O ATOM 167 O5' U A 6 -2.345 8.862 16.793 1.00 0.00 O ATOM 168 C5' U A 6 -3.472 9.716 16.790 1.00 0.00 C ATOM 169 C4' U A 6 -4.752 8.894 16.559 1.00 0.00 C ATOM 170 O4' U A 6 -4.758 8.266 15.270 1.00 0.00 O ATOM 171 C3' U A 6 -4.907 7.755 17.555 1.00 0.00 C ATOM 172 O3' U A 6 -5.401 8.166 18.813 1.00 0.00 O ATOM 173 C2' U A 6 -5.916 6.906 16.827 1.00 0.00 C ATOM 174 O2' U A 6 -7.195 7.501 16.908 1.00 0.00 O ATOM 175 C1' U A 6 -5.432 6.995 15.393 1.00 0.00 C ATOM 176 N1 U A 6 -4.494 5.887 15.084 1.00 0.00 N ATOM 177 C2 U A 6 -5.027 4.723 14.546 1.00 0.00 C ATOM 178 O2 U A 6 -6.234 4.570 14.376 1.00 0.00 O ATOM 179 N3 U A 6 -4.118 3.735 14.209 1.00 0.00 N ATOM 180 C4 U A 6 -2.743 3.806 14.359 1.00 0.00 C ATOM 181 O4 U A 6 -2.030 2.857 14.043 1.00 0.00 O ATOM 182 C5 U A 6 -2.275 5.060 14.905 1.00 0.00 C ATOM 183 C6 U A 6 -3.146 6.035 15.251 1.00 0.00 C ATOM 0 H5' U A 6 -3.367 10.468 16.008 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.538 10.249 17.739 1.00 0.00 H new ATOM 0 H4' U A 6 -5.559 9.619 16.663 1.00 0.00 H new ATOM 0 H3' U A 6 -3.966 7.267 17.809 1.00 0.00 H new ATOM 0 H2' U A 6 -5.997 5.893 17.220 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.193 8.187 17.608 1.00 0.00 H new ATOM 0 H1' U A 6 -6.266 6.915 14.695 1.00 0.00 H new ATOM 0 H3 U A 6 -4.496 2.874 13.813 1.00 0.00 H new ATOM 0 H5 U A 6 -1.215 5.220 15.038 1.00 0.00 H new ATOM 0 H6 U A 6 -2.766 6.955 15.670 1.00 0.00 H new ATOM 194 P C A 7 -5.344 7.164 20.084 1.00 0.00 P ATOM 195 OP1 C A 7 -6.047 7.814 21.213 1.00 0.00 O ATOM 196 OP2 C A 7 -3.940 6.727 20.250 1.00 0.00 O ATOM 197 O5' C A 7 -6.213 5.877 19.623 1.00 0.00 O ATOM 198 C5' C A 7 -7.627 5.911 19.624 1.00 0.00 C ATOM 199 C4' C A 7 -8.187 4.546 19.193 1.00 0.00 C ATOM 200 O4' C A 7 -7.771 4.180 17.872 1.00 0.00 O ATOM 201 C3' C A 7 -7.696 3.419 20.074 1.00 0.00 C ATOM 202 O3' C A 7 -8.349 3.387 21.330 1.00 0.00 O ATOM 203 C2' C A 7 -8.064 2.234 19.211 1.00 0.00 C ATOM 204 O2' C A 7 -9.454 2.001 19.293 1.00 0.00 O ATOM 205 C1' C A 7 -7.738 2.738 17.804 1.00 0.00 C ATOM 206 N1 C A 7 -6.395 2.248 17.387 1.00 0.00 N ATOM 207 C2 C A 7 -6.292 0.910 17.016 1.00 0.00 C ATOM 208 O2 C A 7 -7.285 0.186 17.023 1.00 0.00 O ATOM 209 N3 C A 7 -5.070 0.433 16.650 1.00 0.00 N ATOM 210 C4 C A 7 -3.992 1.228 16.653 1.00 0.00 C ATOM 211 N4 C A 7 -2.812 0.722 16.282 1.00 0.00 N ATOM 212 C5 C A 7 -4.082 2.605 17.030 1.00 0.00 C ATOM 213 C6 C A 7 -5.300 3.070 17.381 1.00 0.00 C ATOM 0 H5' C A 7 -7.981 6.688 18.947 1.00 0.00 H new ATOM 0 H5'' C A 7 -7.992 6.165 20.619 1.00 0.00 H new ATOM 0 H4' C A 7 -9.268 4.670 19.258 1.00 0.00 H new ATOM 0 H3' C A 7 -6.643 3.482 20.347 1.00 0.00 H new ATOM 0 H2' C A 7 -7.552 1.314 19.493 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.691 1.233 18.732 1.00 0.00 H new ATOM 0 H1' C A 7 -8.453 2.373 17.067 1.00 0.00 H new ATOM 0 H41 C A 7 -1.981 1.314 16.279 1.00 0.00 H new ATOM 0 H42 C A 7 -2.742 -0.256 16.002 1.00 0.00 H new ATOM 0 H5 C A 7 -3.212 3.246 17.034 1.00 0.00 H new ATOM 0 H6 C A 7 -5.412 4.107 17.662 1.00 0.00 H new ATOM 225 P C A 8 -7.784 2.468 22.531 1.00 0.00 P ATOM 226 OP1 C A 8 -8.678 2.635 23.699 1.00 0.00 O ATOM 227 OP2 C A 8 -6.337 2.743 22.671 1.00 0.00 O ATOM 228 O5' C A 8 -7.952 0.962 21.985 1.00 0.00 O ATOM 229 C5' C A 8 -9.210 0.319 21.984 1.00 0.00 C ATOM 230 C4' C A 8 -9.043 -1.113 21.468 1.00 0.00 C ATOM 231 O4' C A 8 -8.560 -1.136 20.131 1.00 0.00 O ATOM 232 C3' C A 8 -8.004 -1.879 22.252 1.00 0.00 C ATOM 233 O3' C A 8 -8.473 -2.312 23.512 1.00 0.00 O ATOM 234 C2' C A 8 -7.736 -3.027 21.330 1.00 0.00 C ATOM 235 O2' C A 8 -8.771 -3.981 21.440 1.00 0.00 O ATOM 236 C1' C A 8 -7.806 -2.350 19.966 1.00 0.00 C ATOM 237 N1 C A 8 -6.427 -2.053 19.518 1.00 0.00 N ATOM 238 C2 C A 8 -5.726 -3.068 18.873 1.00 0.00 C ATOM 239 O2 C A 8 -6.275 -4.138 18.619 1.00 0.00 O ATOM 240 N3 C A 8 -4.424 -2.843 18.543 1.00 0.00 N ATOM 241 C4 C A 8 -3.830 -1.680 18.842 1.00 0.00 C ATOM 242 N4 C A 8 -2.551 -1.499 18.498 1.00 0.00 N ATOM 243 C5 C A 8 -4.535 -0.639 19.528 1.00 0.00 C ATOM 244 C6 C A 8 -5.824 -0.871 19.838 1.00 0.00 C ATOM 0 H5' C A 8 -9.911 0.866 21.354 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.628 0.309 22.991 1.00 0.00 H new ATOM 0 H4' C A 8 -10.034 -1.557 21.559 1.00 0.00 H new ATOM 0 H3' C A 8 -7.125 -1.287 22.506 1.00 0.00 H new ATOM 0 H2' C A 8 -6.800 -3.550 21.526 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.219 -3.879 22.306 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.762 -2.803 23.975 1.00 0.00 H new ATOM 0 H1' C A 8 -8.285 -2.984 19.220 1.00 0.00 H new ATOM 0 H41 C A 8 -2.083 -0.620 18.718 1.00 0.00 H new ATOM 0 H42 C A 8 -2.043 -2.240 18.016 1.00 0.00 H new ATOM 0 H5 C A 8 -4.053 0.292 19.786 1.00 0.00 H new ATOM 0 H6 C A 8 -6.392 -0.108 20.349 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 2.456 -9.485 13.840 1.00 0.00 O ATOM 259 C5' G B 9 1.836 -10.753 13.782 1.00 0.00 C ATOM 260 C4' G B 9 0.386 -10.658 14.266 1.00 0.00 C ATOM 261 O4' G B 9 0.316 -10.242 15.628 1.00 0.00 O ATOM 262 C3' G B 9 -0.429 -9.636 13.500 1.00 0.00 C ATOM 263 O3' G B 9 -0.809 -10.093 12.216 1.00 0.00 O ATOM 264 C2' G B 9 -1.603 -9.499 14.438 1.00 0.00 C ATOM 265 O2' G B 9 -2.432 -10.638 14.340 1.00 0.00 O ATOM 266 C1' G B 9 -0.908 -9.511 15.801 1.00 0.00 C ATOM 267 N9 G B 9 -0.606 -8.121 16.207 1.00 0.00 N ATOM 268 C8 G B 9 0.594 -7.456 16.185 1.00 0.00 C ATOM 269 N7 G B 9 0.523 -6.221 16.596 1.00 0.00 N ATOM 270 C5 G B 9 -0.820 -6.051 16.915 1.00 0.00 C ATOM 271 C6 G B 9 -1.504 -4.903 17.414 1.00 0.00 C ATOM 272 O6 G B 9 -1.043 -3.794 17.673 1.00 0.00 O ATOM 273 N1 G B 9 -2.858 -5.155 17.604 1.00 0.00 N ATOM 274 C2 G B 9 -3.482 -6.357 17.345 1.00 0.00 C ATOM 275 N2 G B 9 -4.797 -6.416 17.582 1.00 0.00 N ATOM 276 N3 G B 9 -2.845 -7.435 16.874 1.00 0.00 N ATOM 277 C4 G B 9 -1.520 -7.211 16.683 1.00 0.00 C ATOM 0 H5' G B 9 2.387 -11.463 14.399 1.00 0.00 H new ATOM 0 H5'' G B 9 1.861 -11.131 12.760 1.00 0.00 H new ATOM 0 H4' G B 9 -0.013 -11.661 14.118 1.00 0.00 H new ATOM 0 H3' G B 9 0.093 -8.706 13.275 1.00 0.00 H new ATOM 0 H2' G B 9 -2.226 -8.625 14.245 1.00 0.00 H new ATOM 0 HO2' G B 9 -3.191 -10.543 14.952 1.00 0.00 H new ATOM 0 HO5' G B 9 3.383 -9.559 13.530 1.00 0.00 H new ATOM 0 H1' G B 9 -1.534 -9.967 16.568 1.00 0.00 H new ATOM 0 H8 G B 9 1.515 -7.915 15.857 1.00 0.00 H new ATOM 0 H1 G B 9 -3.433 -4.393 17.962 1.00 0.00 H new ATOM 0 H21 G B 9 -5.308 -7.281 17.408 1.00 0.00 H new ATOM 0 H22 G B 9 -5.288 -5.596 17.937 1.00 0.00 H new ATOM 290 P G B 10 -1.398 -9.067 11.113 1.00 0.00 P ATOM 291 OP1 G B 10 -1.675 -9.831 9.877 1.00 0.00 O ATOM 292 OP2 G B 10 -0.499 -7.893 11.063 1.00 0.00 O ATOM 293 O5' G B 10 -2.807 -8.592 11.734 1.00 0.00 O ATOM 294 C5' G B 10 -3.921 -9.458 11.751 1.00 0.00 C ATOM 295 C4' G B 10 -5.106 -8.758 12.421 1.00 0.00 C ATOM 296 O4' G B 10 -4.784 -8.360 13.757 1.00 0.00 O ATOM 297 C3' G B 10 -5.513 -7.478 11.717 1.00 0.00 C ATOM 298 O3' G B 10 -6.258 -7.709 10.534 1.00 0.00 O ATOM 299 C2' G B 10 -6.350 -6.856 12.809 1.00 0.00 C ATOM 300 O2' G B 10 -7.574 -7.548 12.937 1.00 0.00 O ATOM 301 C1' G B 10 -5.492 -7.140 14.036 1.00 0.00 C ATOM 302 N9 G B 10 -4.533 -6.026 14.220 1.00 0.00 N ATOM 303 C8 G B 10 -3.198 -5.974 13.910 1.00 0.00 C ATOM 304 N7 G B 10 -2.634 -4.831 14.181 1.00 0.00 N ATOM 305 C5 G B 10 -3.668 -4.063 14.702 1.00 0.00 C ATOM 306 C6 G B 10 -3.660 -2.716 15.169 1.00 0.00 C ATOM 307 O6 G B 10 -2.713 -1.936 15.224 1.00 0.00 O ATOM 308 N1 G B 10 -4.920 -2.314 15.596 1.00 0.00 N ATOM 309 C2 G B 10 -6.048 -3.106 15.585 1.00 0.00 C ATOM 310 N2 G B 10 -7.178 -2.548 16.033 1.00 0.00 N ATOM 311 N3 G B 10 -6.059 -4.373 15.153 1.00 0.00 N ATOM 312 C4 G B 10 -4.838 -4.784 14.726 1.00 0.00 C ATOM 0 H5' G B 10 -3.675 -10.373 12.289 1.00 0.00 H new ATOM 0 H5'' G B 10 -4.185 -9.748 10.734 1.00 0.00 H new ATOM 0 H4' G B 10 -5.912 -9.491 12.386 1.00 0.00 H new ATOM 0 H3' G B 10 -4.683 -6.870 11.357 1.00 0.00 H new ATOM 0 H2' G B 10 -6.592 -5.806 12.643 1.00 0.00 H new ATOM 0 HO2' G B 10 -8.109 -7.138 13.649 1.00 0.00 H new ATOM 0 H1' G B 10 -6.090 -7.233 14.943 1.00 0.00 H new ATOM 0 H8 G B 10 -2.662 -6.807 13.479 1.00 0.00 H new ATOM 0 H1 G B 10 -5.017 -1.360 15.944 1.00 0.00 H new ATOM 0 H21 G B 10 -8.043 -3.088 16.047 1.00 0.00 H new ATOM 0 H22 G B 10 -7.175 -1.582 16.360 1.00 0.00 H new ATOM 324 P A B 11 -6.477 -6.528 9.443 1.00 0.00 P ATOM 325 OP1 A B 11 -7.311 -7.069 8.347 1.00 0.00 O ATOM 326 OP2 A B 11 -5.154 -5.942 9.137 1.00 0.00 O ATOM 327 O5' A B 11 -7.344 -5.416 10.228 1.00 0.00 O ATOM 328 C5' A B 11 -8.695 -5.652 10.558 1.00 0.00 C ATOM 329 C4' A B 11 -9.258 -4.459 11.335 1.00 0.00 C ATOM 330 O4' A B 11 -8.481 -4.187 12.504 1.00 0.00 O ATOM 331 C3' A B 11 -9.259 -3.161 10.552 1.00 0.00 C ATOM 332 O3' A B 11 -10.347 -3.075 9.655 1.00 0.00 O ATOM 333 C2' A B 11 -9.376 -2.149 11.657 1.00 0.00 C ATOM 334 O2' A B 11 -10.709 -2.100 12.127 1.00 0.00 O ATOM 335 C1' A B 11 -8.486 -2.765 12.730 1.00 0.00 C ATOM 336 N9 A B 11 -7.110 -2.224 12.608 1.00 0.00 N ATOM 337 C8 A B 11 -5.964 -2.850 12.181 1.00 0.00 C ATOM 338 N7 A B 11 -4.896 -2.105 12.246 1.00 0.00 N ATOM 339 C5 A B 11 -5.367 -0.892 12.735 1.00 0.00 C ATOM 340 C6 A B 11 -4.730 0.328 13.025 1.00 0.00 C ATOM 341 N6 A B 11 -3.415 0.524 12.872 1.00 0.00 N ATOM 342 N1 A B 11 -5.497 1.342 13.466 1.00 0.00 N ATOM 343 C2 A B 11 -6.804 1.145 13.618 1.00 0.00 C ATOM 344 N3 A B 11 -7.514 0.047 13.396 1.00 0.00 N ATOM 345 C4 A B 11 -6.717 -0.950 12.945 1.00 0.00 C ATOM 0 H5' A B 11 -8.779 -6.559 11.156 1.00 0.00 H new ATOM 0 H5'' A B 11 -9.277 -5.814 9.651 1.00 0.00 H new ATOM 0 H4' A B 11 -10.280 -4.759 11.567 1.00 0.00 H new ATOM 0 H3' A B 11 -8.384 -3.035 9.915 1.00 0.00 H new ATOM 0 H2' A B 11 -9.103 -1.135 11.364 1.00 0.00 H new ATOM 0 HO2' A B 11 -11.314 -2.432 11.431 1.00 0.00 H new ATOM 0 H1' A B 11 -8.854 -2.533 13.730 1.00 0.00 H new ATOM 0 H8 A B 11 -5.949 -3.869 11.823 1.00 0.00 H new ATOM 0 H61 A B 11 -3.005 1.430 13.098 1.00 0.00 H new ATOM 0 H62 A B 11 -2.823 -0.233 12.530 1.00 0.00 H new ATOM 0 H2 A B 11 -7.365 1.998 13.971 1.00 0.00 H new ATOM 357 P U B 12 -10.105 -2.749 8.103 1.00 0.00 P ATOM 358 OP1 U B 12 -11.390 -2.894 7.384 1.00 0.00 O ATOM 359 OP2 U B 12 -8.910 -3.490 7.645 1.00 0.00 O ATOM 360 O5' U B 12 -9.742 -1.185 8.187 1.00 0.00 O ATOM 361 C5' U B 12 -10.733 -0.241 8.543 1.00 0.00 C ATOM 362 C4' U B 12 -10.088 1.113 8.837 1.00 0.00 C ATOM 363 O4' U B 12 -9.211 1.027 9.957 1.00 0.00 O ATOM 364 C3' U B 12 -9.235 1.624 7.695 1.00 0.00 C ATOM 365 O3' U B 12 -10.018 2.190 6.659 1.00 0.00 O ATOM 366 C2' U B 12 -8.406 2.658 8.421 1.00 0.00 C ATOM 367 O2' U B 12 -9.175 3.823 8.636 1.00 0.00 O ATOM 368 C1' U B 12 -8.159 1.984 9.773 1.00 0.00 C ATOM 369 N1 U B 12 -6.839 1.308 9.774 1.00 0.00 N ATOM 370 C2 U B 12 -5.728 2.099 10.016 1.00 0.00 C ATOM 371 O2 U B 12 -5.825 3.306 10.225 1.00 0.00 O ATOM 372 N3 U B 12 -4.499 1.457 10.012 1.00 0.00 N ATOM 373 C4 U B 12 -4.291 0.106 9.780 1.00 0.00 C ATOM 374 O4 U B 12 -3.155 -0.361 9.787 1.00 0.00 O ATOM 375 C5 U B 12 -5.507 -0.649 9.551 1.00 0.00 C ATOM 376 C6 U B 12 -6.717 -0.042 9.557 1.00 0.00 C ATOM 0 H5' U B 12 -11.280 -0.590 9.419 1.00 0.00 H new ATOM 0 H5'' U B 12 -11.457 -0.140 7.734 1.00 0.00 H new ATOM 0 H4' U B 12 -10.926 1.787 9.015 1.00 0.00 H new ATOM 0 H3' U B 12 -8.654 0.859 7.179 1.00 0.00 H new ATOM 0 H2' U B 12 -7.503 2.948 7.883 1.00 0.00 H new ATOM 0 HO2' U B 12 -10.067 3.702 8.248 1.00 0.00 H new ATOM 0 H1' U B 12 -8.154 2.716 10.581 1.00 0.00 H new ATOM 0 H3 U B 12 -3.675 2.029 10.196 1.00 0.00 H new ATOM 0 H5 U B 12 -5.447 -1.712 9.373 1.00 0.00 H new ATOM 0 H6 U B 12 -7.605 -0.632 9.387 1.00 0.00 H new ATOM 387 P G B 13 -9.346 2.618 5.256 1.00 0.00 P ATOM 388 OP1 G B 13 -10.425 3.063 4.346 1.00 0.00 O ATOM 389 OP2 G B 13 -8.435 1.530 4.836 1.00 0.00 O ATOM 390 O5' G B 13 -8.452 3.901 5.637 1.00 0.00 O ATOM 391 C5' G B 13 -9.048 5.164 5.862 1.00 0.00 C ATOM 392 C4' G B 13 -7.956 6.182 6.198 1.00 0.00 C ATOM 393 O4' G B 13 -7.238 5.801 7.365 1.00 0.00 O ATOM 394 C3' G B 13 -6.905 6.259 5.111 1.00 0.00 C ATOM 395 O3' G B 13 -7.330 7.028 3.996 1.00 0.00 O ATOM 396 C2' G B 13 -5.781 6.927 5.863 1.00 0.00 C ATOM 397 O2' G B 13 -5.974 8.326 5.875 1.00 0.00 O ATOM 398 C1' G B 13 -5.938 6.394 7.281 1.00 0.00 C ATOM 399 N9 G B 13 -4.886 5.396 7.543 1.00 0.00 N ATOM 400 C8 G B 13 -4.946 4.035 7.442 1.00 0.00 C ATOM 401 N7 G B 13 -3.821 3.431 7.714 1.00 0.00 N ATOM 402 C5 G B 13 -2.947 4.473 8.010 1.00 0.00 C ATOM 403 C6 G B 13 -1.566 4.444 8.375 1.00 0.00 C ATOM 404 O6 G B 13 -0.829 3.472 8.529 1.00 0.00 O ATOM 405 N1 G B 13 -1.065 5.722 8.561 1.00 0.00 N ATOM 406 C2 G B 13 -1.783 6.887 8.428 1.00 0.00 C ATOM 407 N2 G B 13 -1.121 8.026 8.657 1.00 0.00 N ATOM 408 N3 G B 13 -3.076 6.922 8.094 1.00 0.00 N ATOM 409 C4 G B 13 -3.592 5.681 7.900 1.00 0.00 C ATOM 0 H5' G B 13 -9.766 5.100 6.679 1.00 0.00 H new ATOM 0 H5'' G B 13 -9.599 5.482 4.977 1.00 0.00 H new ATOM 0 H4' G B 13 -8.478 7.131 6.324 1.00 0.00 H new ATOM 0 H3' G B 13 -6.649 5.297 4.667 1.00 0.00 H new ATOM 0 H2' G B 13 -4.802 6.731 5.425 1.00 0.00 H new ATOM 0 HO2' G B 13 -6.731 8.557 5.297 1.00 0.00 H new ATOM 0 H1' G B 13 -5.841 7.186 8.023 1.00 0.00 H new ATOM 0 H8 G B 13 -5.845 3.505 7.162 1.00 0.00 H new ATOM 0 H1 G B 13 -0.081 5.806 8.818 1.00 0.00 H new ATOM 0 H21 G B 13 -1.602 8.921 8.573 1.00 0.00 H new ATOM 0 H22 G B 13 -0.135 7.999 8.915 1.00 0.00 H new ATOM 421 P U B 14 -6.511 6.994 2.600 1.00 0.00 P ATOM 422 OP1 U B 14 -7.241 7.831 1.621 1.00 0.00 O ATOM 423 OP2 U B 14 -6.226 5.578 2.280 1.00 0.00 O ATOM 424 O5' U B 14 -5.105 7.722 2.926 1.00 0.00 O ATOM 425 C5' U B 14 -4.992 9.132 2.944 1.00 0.00 C ATOM 426 C4' U B 14 -3.527 9.538 3.182 1.00 0.00 C ATOM 427 O4' U B 14 -3.056 9.111 4.467 1.00 0.00 O ATOM 428 C3' U B 14 -2.571 8.908 2.181 1.00 0.00 C ATOM 429 O3' U B 14 -2.548 9.563 0.929 1.00 0.00 O ATOM 430 C2' U B 14 -1.268 9.090 2.912 1.00 0.00 C ATOM 431 O2' U B 14 -0.863 10.443 2.847 1.00 0.00 O ATOM 432 C1' U B 14 -1.658 8.773 4.342 1.00 0.00 C ATOM 433 N1 U B 14 -1.453 7.331 4.634 1.00 0.00 N ATOM 434 C2 U B 14 -0.231 6.949 5.171 1.00 0.00 C ATOM 435 O2 U B 14 0.685 7.748 5.355 1.00 0.00 O ATOM 436 N3 U B 14 -0.096 5.609 5.490 1.00 0.00 N ATOM 437 C4 U B 14 -1.062 4.631 5.323 1.00 0.00 C ATOM 438 O4 U B 14 -0.825 3.463 5.623 1.00 0.00 O ATOM 439 C5 U B 14 -2.309 5.121 4.780 1.00 0.00 C ATOM 440 C6 U B 14 -2.458 6.423 4.453 1.00 0.00 C ATOM 0 H5' U B 14 -5.625 9.546 3.729 1.00 0.00 H new ATOM 0 H5'' U B 14 -5.344 9.546 1.999 1.00 0.00 H new ATOM 0 H4' U B 14 -3.533 10.624 3.089 1.00 0.00 H new ATOM 0 H3' U B 14 -2.831 7.883 1.916 1.00 0.00 H new ATOM 0 H2' U B 14 -0.456 8.482 2.513 1.00 0.00 H new ATOM 0 HO2' U B 14 -1.376 10.905 2.151 1.00 0.00 H new ATOM 0 H1' U B 14 -1.046 9.336 5.047 1.00 0.00 H new ATOM 0 H3 U B 14 0.797 5.315 5.884 1.00 0.00 H new ATOM 0 H5 U B 14 -3.132 4.437 4.634 1.00 0.00 H new ATOM 0 H6 U B 14 -3.397 6.756 4.037 1.00 0.00 H new ATOM 451 P C B 15 -1.838 8.867 -0.349 1.00 0.00 P ATOM 452 OP1 C B 15 -1.856 9.835 -1.468 1.00 0.00 O ATOM 453 OP2 C B 15 -2.447 7.530 -0.529 1.00 0.00 O ATOM 454 O5' C B 15 -0.299 8.654 0.109 1.00 0.00 O ATOM 455 C5' C B 15 0.616 9.732 0.122 1.00 0.00 C ATOM 456 C4' C B 15 2.008 9.237 0.544 1.00 0.00 C ATOM 457 O4' C B 15 2.005 8.661 1.856 1.00 0.00 O ATOM 458 C3' C B 15 2.526 8.136 -0.355 1.00 0.00 C ATOM 459 O3' C B 15 2.986 8.625 -1.601 1.00 0.00 O ATOM 460 C2' C B 15 3.655 7.610 0.501 1.00 0.00 C ATOM 461 O2' C B 15 4.752 8.495 0.436 1.00 0.00 O ATOM 462 C1' C B 15 3.061 7.677 1.909 1.00 0.00 C ATOM 463 N1 C B 15 2.535 6.342 2.305 1.00 0.00 N ATOM 464 C2 C B 15 3.469 5.366 2.642 1.00 0.00 C ATOM 465 O2 C B 15 4.670 5.623 2.622 1.00 0.00 O ATOM 466 N3 C B 15 3.015 4.129 2.991 1.00 0.00 N ATOM 467 C4 C B 15 1.704 3.857 3.004 1.00 0.00 C ATOM 468 N4 C B 15 1.300 2.633 3.358 1.00 0.00 N ATOM 469 C5 C B 15 0.732 4.850 2.662 1.00 0.00 C ATOM 470 C6 C B 15 1.193 6.074 2.327 1.00 0.00 C ATOM 0 H5' C B 15 0.271 10.503 0.811 1.00 0.00 H new ATOM 0 H5'' C B 15 0.668 10.187 -0.867 1.00 0.00 H new ATOM 0 H4' C B 15 2.633 10.129 0.492 1.00 0.00 H new ATOM 0 H3' C B 15 1.780 7.395 -0.642 1.00 0.00 H new ATOM 0 H2' C B 15 4.002 6.621 0.202 1.00 0.00 H new ATOM 0 HO2' C B 15 4.601 9.151 -0.276 1.00 0.00 H new ATOM 0 H1' C B 15 3.809 7.956 2.651 1.00 0.00 H new ATOM 0 H41 C B 15 0.305 2.409 3.373 1.00 0.00 H new ATOM 0 H42 C B 15 1.987 1.923 3.613 1.00 0.00 H new ATOM 0 H5 C B 15 -0.325 4.630 2.671 1.00 0.00 H new ATOM 0 H6 C B 15 0.491 6.854 2.072 1.00 0.00 H new ATOM 482 P C B 16 3.295 7.613 -2.821 1.00 0.00 P ATOM 483 OP1 C B 16 3.776 8.409 -3.971 1.00 0.00 O ATOM 484 OP2 C B 16 2.122 6.726 -2.984 1.00 0.00 O ATOM 485 O5' C B 16 4.523 6.716 -2.287 1.00 0.00 O ATOM 486 C5' C B 16 5.842 7.220 -2.268 1.00 0.00 C ATOM 487 C4' C B 16 6.792 6.124 -1.777 1.00 0.00 C ATOM 488 O4' C B 16 6.487 5.718 -0.450 1.00 0.00 O ATOM 489 C3' C B 16 6.665 4.858 -2.593 1.00 0.00 C ATOM 490 O3' C B 16 7.303 4.948 -3.849 1.00 0.00 O ATOM 491 C2' C B 16 7.326 3.859 -1.692 1.00 0.00 C ATOM 492 O2' C B 16 8.732 3.966 -1.790 1.00 0.00 O ATOM 493 C1' C B 16 6.869 4.337 -0.318 1.00 0.00 C ATOM 494 N1 C B 16 5.713 3.513 0.104 1.00 0.00 N ATOM 495 C2 C B 16 5.981 2.293 0.718 1.00 0.00 C ATOM 496 O2 C B 16 7.139 1.965 0.970 1.00 0.00 O ATOM 497 N3 C B 16 4.932 1.480 1.024 1.00 0.00 N ATOM 498 C4 C B 16 3.676 1.840 0.727 1.00 0.00 C ATOM 499 N4 C B 16 2.674 1.015 1.046 1.00 0.00 N ATOM 500 C5 C B 16 3.391 3.081 0.072 1.00 0.00 C ATOM 501 C6 C B 16 4.437 3.880 -0.212 1.00 0.00 C ATOM 0 H5' C B 16 5.902 8.090 -1.614 1.00 0.00 H new ATOM 0 H5'' C B 16 6.133 7.550 -3.265 1.00 0.00 H new ATOM 0 H4' C B 16 7.786 6.565 -1.856 1.00 0.00 H new ATOM 0 H3' C B 16 5.637 4.611 -2.857 1.00 0.00 H new ATOM 0 H2' C B 16 7.077 2.822 -1.918 1.00 0.00 H new ATOM 0 HO2' C B 16 8.973 4.313 -2.674 1.00 0.00 H new ATOM 0 HO3' C B 16 7.192 4.104 -4.334 1.00 0.00 H new ATOM 0 H1' C B 16 7.657 4.242 0.429 1.00 0.00 H new ATOM 0 H41 C B 16 1.712 1.273 0.827 1.00 0.00 H new ATOM 0 H42 C B 16 2.872 0.127 1.508 1.00 0.00 H new ATOM 0 H5 C B 16 2.380 3.364 -0.183 1.00 0.00 H new ATOM 0 H6 C B 16 4.263 4.828 -0.699 1.00 0.00 H new TER 514 C B 16