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 180:sc= -0.249 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -17:sc= 0.0476 USER MOD Single : A 3 A O2' : rot -30:sc= 0.142 USER MOD Single : A 4 U O2' : rot 180:sc= -0.246 USER MOD Single : A 5 G O2' : rot -8:sc= 0.111 USER MOD Single : A 6 U O2' : rot -17:sc= -0.415 USER MOD Single : A 7 C O2' : rot -13:sc= -0.223 USER MOD Single : A 8 C O2' : rot -26:sc= 0.187 USER MOD Single : A 8 C O3' : rot 180:sc= 0.197 USER MOD Single : B 9 G O2' : rot -23:sc= 0.1 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 G O2' : rot 180:sc= -0.365 USER MOD Single : B 11 A O2' : rot -25:sc= 0.153 USER MOD Single : B 12 U O2' : rot -1:sc= -0.193 USER MOD Single : B 13 G O2' : rot -7:sc= 0.103 USER MOD Single : B 14 U O2' : rot -17:sc= -0.41 USER MOD Single : B 15 C O2' : rot -11:sc= -0.201 USER MOD Single : B 16 C O2' : rot -28:sc= 0.207 USER MOD Single : B 16 C O3' : rot 180:sc= 0.2 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 5.152 -8.062 5.966 1.00 0.00 O ATOM 2 C5' G A 1 6.501 -8.479 6.017 1.00 0.00 C ATOM 3 C4' G A 1 7.418 -7.374 5.483 1.00 0.00 C ATOM 4 O4' G A 1 7.140 -7.080 4.115 1.00 0.00 O ATOM 5 C3' G A 1 7.246 -6.057 6.212 1.00 0.00 C ATOM 6 O3' G A 1 7.862 -6.055 7.486 1.00 0.00 O ATOM 7 C2' G A 1 7.934 -5.138 5.232 1.00 0.00 C ATOM 8 O2' G A 1 9.332 -5.315 5.309 1.00 0.00 O ATOM 9 C1' G A 1 7.439 -5.692 3.896 1.00 0.00 C ATOM 10 N9 G A 1 6.209 -4.975 3.494 1.00 0.00 N ATOM 11 C8 G A 1 4.906 -5.400 3.548 1.00 0.00 C ATOM 12 N7 G A 1 4.043 -4.516 3.132 1.00 0.00 N ATOM 13 C5 G A 1 4.827 -3.423 2.776 1.00 0.00 C ATOM 14 C6 G A 1 4.444 -2.152 2.256 1.00 0.00 C ATOM 15 O6 G A 1 3.313 -1.741 2.006 1.00 0.00 O ATOM 16 N1 G A 1 5.547 -1.337 2.030 1.00 0.00 N ATOM 17 C2 G A 1 6.856 -1.693 2.275 1.00 0.00 C ATOM 18 N2 G A 1 7.790 -0.775 2.002 1.00 0.00 N ATOM 19 N3 G A 1 7.220 -2.884 2.765 1.00 0.00 N ATOM 20 C4 G A 1 6.156 -3.697 2.992 1.00 0.00 C ATOM 0 H5' G A 1 6.631 -9.386 5.427 1.00 0.00 H new ATOM 0 H5'' G A 1 6.775 -8.724 7.043 1.00 0.00 H new ATOM 0 H4' G A 1 8.425 -7.767 5.626 1.00 0.00 H new ATOM 0 H3' G A 1 6.216 -5.791 6.448 1.00 0.00 H new ATOM 0 H2' G A 1 7.730 -4.080 5.396 1.00 0.00 H new ATOM 0 HO2' G A 1 9.773 -4.717 4.670 1.00 0.00 H new ATOM 0 HO5' G A 1 4.575 -8.777 6.308 1.00 0.00 H new ATOM 0 H1' G A 1 8.184 -5.568 3.110 1.00 0.00 H new ATOM 0 H8 G A 1 4.621 -6.379 3.903 1.00 0.00 H new ATOM 0 H1 G A 1 5.375 -0.405 1.654 1.00 0.00 H new ATOM 0 H21 G A 1 8.775 -0.985 2.164 1.00 0.00 H new ATOM 0 H22 G A 1 7.517 0.135 1.631 1.00 0.00 H new ATOM 33 P G A 2 7.539 -4.889 8.560 1.00 0.00 P ATOM 34 OP1 G A 2 8.302 -5.177 9.794 1.00 0.00 O ATOM 35 OP2 G A 2 6.069 -4.730 8.628 1.00 0.00 O ATOM 36 O5' G A 2 8.155 -3.559 7.890 1.00 0.00 O ATOM 37 C5' G A 2 9.550 -3.354 7.835 1.00 0.00 C ATOM 38 C4' G A 2 9.850 -2.034 7.120 1.00 0.00 C ATOM 39 O4' G A 2 9.304 -2.027 5.797 1.00 0.00 O ATOM 40 C3' G A 2 9.231 -0.832 7.807 1.00 0.00 C ATOM 41 O3' G A 2 9.949 -0.418 8.956 1.00 0.00 O ATOM 42 C2' G A 2 9.338 0.168 6.682 1.00 0.00 C ATOM 43 O2' G A 2 10.689 0.539 6.502 1.00 0.00 O ATOM 44 C1' G A 2 8.903 -0.680 5.493 1.00 0.00 C ATOM 45 N9 G A 2 7.430 -0.609 5.354 1.00 0.00 N ATOM 46 C8 G A 2 6.484 -1.540 5.703 1.00 0.00 C ATOM 47 N7 G A 2 5.259 -1.172 5.452 1.00 0.00 N ATOM 48 C5 G A 2 5.396 0.098 4.906 1.00 0.00 C ATOM 49 C6 G A 2 4.399 1.005 4.445 1.00 0.00 C ATOM 50 O6 G A 2 3.181 0.848 4.419 1.00 0.00 O ATOM 51 N1 G A 2 4.958 2.192 3.987 1.00 0.00 N ATOM 52 C2 G A 2 6.308 2.473 3.965 1.00 0.00 C ATOM 53 N2 G A 2 6.664 3.673 3.493 1.00 0.00 N ATOM 54 N3 G A 2 7.248 1.621 4.389 1.00 0.00 N ATOM 55 C4 G A 2 6.722 0.456 4.847 1.00 0.00 C ATOM 0 H5' G A 2 10.028 -4.180 7.309 1.00 0.00 H new ATOM 0 H5'' G A 2 9.964 -3.335 8.843 1.00 0.00 H new ATOM 0 H4' G A 2 10.938 -1.963 7.125 1.00 0.00 H new ATOM 0 H3' G A 2 8.228 -0.997 8.201 1.00 0.00 H new ATOM 0 H2' G A 2 8.765 1.082 6.837 1.00 0.00 H new ATOM 0 HO2' G A 2 11.206 0.286 7.295 1.00 0.00 H new ATOM 0 H1' G A 2 9.350 -0.335 4.561 1.00 0.00 H new ATOM 0 H8 G A 2 6.732 -2.493 6.146 1.00 0.00 H new ATOM 0 H1 G A 2 4.321 2.910 3.641 1.00 0.00 H new ATOM 0 H21 G A 2 7.649 3.934 3.454 1.00 0.00 H new ATOM 0 H22 G A 2 5.950 4.327 3.172 1.00 0.00 H new ATOM 67 P A A 3 9.261 0.543 10.069 1.00 0.00 P ATOM 68 OP1 A A 3 10.264 0.810 11.123 1.00 0.00 O ATOM 69 OP2 A A 3 7.956 -0.051 10.434 1.00 0.00 O ATOM 70 O5' A A 3 8.975 1.928 9.288 1.00 0.00 O ATOM 71 C5' A A 3 10.031 2.806 8.957 1.00 0.00 C ATOM 72 C4' A A 3 9.483 4.018 8.200 1.00 0.00 C ATOM 73 O4' A A 3 8.754 3.617 7.038 1.00 0.00 O ATOM 74 C3' A A 3 8.510 4.854 9.007 1.00 0.00 C ATOM 75 O3' A A 3 9.167 5.717 9.913 1.00 0.00 O ATOM 76 C2' A A 3 7.819 5.622 7.916 1.00 0.00 C ATOM 77 O2' A A 3 8.660 6.658 7.452 1.00 0.00 O ATOM 78 C1' A A 3 7.687 4.560 6.831 1.00 0.00 C ATOM 79 N9 A A 3 6.377 3.877 6.954 1.00 0.00 N ATOM 80 C8 A A 3 6.101 2.591 7.345 1.00 0.00 C ATOM 81 N7 A A 3 4.835 2.281 7.294 1.00 0.00 N ATOM 82 C5 A A 3 4.225 3.449 6.852 1.00 0.00 C ATOM 83 C6 A A 3 2.883 3.783 6.595 1.00 0.00 C ATOM 84 N6 A A 3 1.870 2.920 6.738 1.00 0.00 N ATOM 85 N1 A A 3 2.619 5.041 6.196 1.00 0.00 N ATOM 86 C2 A A 3 3.626 5.898 6.052 1.00 0.00 C ATOM 87 N3 A A 3 4.924 5.702 6.247 1.00 0.00 N ATOM 88 C4 A A 3 5.155 4.432 6.655 1.00 0.00 C ATOM 0 H5' A A 3 10.769 2.287 8.345 1.00 0.00 H new ATOM 0 H5'' A A 3 10.542 3.133 9.863 1.00 0.00 H new ATOM 0 H4' A A 3 10.372 4.601 7.960 1.00 0.00 H new ATOM 0 H3' A A 3 7.845 4.268 9.642 1.00 0.00 H new ATOM 0 H2' A A 3 6.879 6.083 8.221 1.00 0.00 H new ATOM 0 HO2' A A 3 9.238 6.962 8.183 1.00 0.00 H new ATOM 0 H1' A A 3 7.746 5.004 5.837 1.00 0.00 H new ATOM 0 H8 A A 3 6.864 1.897 7.666 1.00 0.00 H new ATOM 0 H61 A A 3 0.915 3.217 6.537 1.00 0.00 H new ATOM 0 H62 A A 3 2.053 1.966 7.048 1.00 0.00 H new ATOM 0 H2 A A 3 3.349 6.892 5.732 1.00 0.00 H new ATOM 100 P U A 4 8.788 5.710 11.472 1.00 0.00 P ATOM 101 OP1 U A 4 9.755 6.565 12.196 1.00 0.00 O ATOM 102 OP2 U A 4 8.568 4.311 11.898 1.00 0.00 O ATOM 103 O5' U A 4 7.370 6.466 11.429 1.00 0.00 O ATOM 104 C5' U A 4 7.306 7.843 11.112 1.00 0.00 C ATOM 105 C4' U A 4 5.857 8.252 10.852 1.00 0.00 C ATOM 106 O4' U A 4 5.328 7.564 9.721 1.00 0.00 O ATOM 107 C3' U A 4 4.932 7.909 11.999 1.00 0.00 C ATOM 108 O3' U A 4 5.041 8.831 13.068 1.00 0.00 O ATOM 109 C2' U A 4 3.597 7.995 11.297 1.00 0.00 C ATOM 110 O2' U A 4 3.238 9.350 11.129 1.00 0.00 O ATOM 111 C1' U A 4 3.918 7.405 9.921 1.00 0.00 C ATOM 112 N1 U A 4 3.550 5.968 9.882 1.00 0.00 N ATOM 113 C2 U A 4 2.216 5.667 9.663 1.00 0.00 C ATOM 114 O2 U A 4 1.372 6.545 9.502 1.00 0.00 O ATOM 115 N3 U A 4 1.883 4.321 9.633 1.00 0.00 N ATOM 116 C4 U A 4 2.763 3.264 9.811 1.00 0.00 C ATOM 117 O4 U A 4 2.361 2.105 9.778 1.00 0.00 O ATOM 118 C5 U A 4 4.139 3.669 10.019 1.00 0.00 C ATOM 119 C6 U A 4 4.486 4.977 10.045 1.00 0.00 C ATOM 0 H5' U A 4 7.915 8.051 10.232 1.00 0.00 H new ATOM 0 H5'' U A 4 7.718 8.433 11.931 1.00 0.00 H new ATOM 0 H4' U A 4 5.895 9.331 10.703 1.00 0.00 H new ATOM 0 H3' U A 4 5.132 6.951 12.478 1.00 0.00 H new ATOM 0 H2' U A 4 2.788 7.496 11.830 1.00 0.00 H new ATOM 0 HO2' U A 4 2.372 9.405 10.673 1.00 0.00 H new ATOM 0 H1' U A 4 3.355 7.910 9.137 1.00 0.00 H new ATOM 0 H3 U A 4 0.904 4.088 9.465 1.00 0.00 H new ATOM 0 H5 U A 4 4.900 2.915 10.155 1.00 0.00 H new ATOM 0 H6 U A 4 5.521 5.247 10.197 1.00 0.00 H new ATOM 130 P G A 5 4.285 8.567 14.468 1.00 0.00 P ATOM 131 OP1 G A 5 4.690 9.627 15.418 1.00 0.00 O ATOM 132 OP2 G A 5 4.476 7.145 14.830 1.00 0.00 O ATOM 133 O5' G A 5 2.731 8.787 14.106 1.00 0.00 O ATOM 134 C5' G A 5 2.202 10.086 13.923 1.00 0.00 C ATOM 135 C4' G A 5 0.714 9.979 13.583 1.00 0.00 C ATOM 136 O4' G A 5 0.511 9.222 12.395 1.00 0.00 O ATOM 137 C3' G A 5 -0.054 9.232 14.652 1.00 0.00 C ATOM 138 O3' G A 5 -0.335 10.039 15.785 1.00 0.00 O ATOM 139 C2' G A 5 -1.305 8.873 13.889 1.00 0.00 C ATOM 140 O2' G A 5 -2.205 9.962 13.900 1.00 0.00 O ATOM 141 C1' G A 5 -0.804 8.659 12.467 1.00 0.00 C ATOM 142 N9 G A 5 -0.776 7.214 12.177 1.00 0.00 N ATOM 143 C8 G A 5 0.270 6.339 12.265 1.00 0.00 C ATOM 144 N7 G A 5 -0.042 5.106 11.971 1.00 0.00 N ATOM 145 C5 G A 5 -1.400 5.167 11.674 1.00 0.00 C ATOM 146 C6 G A 5 -2.309 4.133 11.293 1.00 0.00 C ATOM 147 O6 G A 5 -2.086 2.936 11.119 1.00 0.00 O ATOM 148 N1 G A 5 -3.590 4.627 11.113 1.00 0.00 N ATOM 149 C2 G A 5 -3.968 5.940 11.267 1.00 0.00 C ATOM 150 N2 G A 5 -5.255 6.222 11.043 1.00 0.00 N ATOM 151 N3 G A 5 -3.123 6.914 11.619 1.00 0.00 N ATOM 152 C4 G A 5 -1.859 6.456 11.806 1.00 0.00 C ATOM 0 H5' G A 5 2.734 10.599 13.122 1.00 0.00 H new ATOM 0 H5'' G A 5 2.339 10.678 14.828 1.00 0.00 H new ATOM 0 H4' G A 5 0.367 11.007 13.482 1.00 0.00 H new ATOM 0 H3' G A 5 0.481 8.383 15.078 1.00 0.00 H new ATOM 0 H2' G A 5 -1.823 8.010 14.307 1.00 0.00 H new ATOM 0 HO2' G A 5 -1.872 10.656 14.507 1.00 0.00 H new ATOM 0 H1' G A 5 -1.454 9.136 11.733 1.00 0.00 H new ATOM 0 H8 G A 5 1.266 6.641 12.552 1.00 0.00 H new ATOM 0 H1 G A 5 -4.314 3.961 10.844 1.00 0.00 H new ATOM 0 H21 G A 5 -5.592 7.180 11.142 1.00 0.00 H new ATOM 0 H22 G A 5 -5.900 5.480 10.773 1.00 0.00 H new ATOM 164 P U A 6 -0.853 9.379 17.170 1.00 0.00 P ATOM 165 OP1 U A 6 -0.982 10.460 18.171 1.00 0.00 O ATOM 166 OP2 U A 6 0.009 8.212 17.462 1.00 0.00 O ATOM 167 O5' U A 6 -2.336 8.828 16.837 1.00 0.00 O ATOM 168 C5' U A 6 -3.459 9.688 16.842 1.00 0.00 C ATOM 169 C4' U A 6 -4.745 8.878 16.594 1.00 0.00 C ATOM 170 O4' U A 6 -4.758 8.279 15.290 1.00 0.00 O ATOM 171 C3' U A 6 -4.910 7.717 17.565 1.00 0.00 C ATOM 172 O3' U A 6 -5.399 8.106 18.832 1.00 0.00 O ATOM 173 C2' U A 6 -5.930 6.899 16.817 1.00 0.00 C ATOM 174 O2' U A 6 -7.199 7.516 16.902 1.00 0.00 O ATOM 175 C1' U A 6 -5.437 7.008 15.388 1.00 0.00 C ATOM 176 N1 U A 6 -4.500 5.901 15.073 1.00 0.00 N ATOM 177 C2 U A 6 -5.031 4.744 14.520 1.00 0.00 C ATOM 178 O2 U A 6 -6.237 4.596 14.339 1.00 0.00 O ATOM 179 N3 U A 6 -4.123 3.756 14.182 1.00 0.00 N ATOM 180 C4 U A 6 -2.749 3.821 14.343 1.00 0.00 C ATOM 181 O4 U A 6 -2.037 2.873 14.025 1.00 0.00 O ATOM 182 C5 U A 6 -2.282 5.069 14.905 1.00 0.00 C ATOM 183 C6 U A 6 -3.152 6.043 15.252 1.00 0.00 C ATOM 0 H5' U A 6 -3.346 10.451 16.072 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.525 10.207 17.798 1.00 0.00 H new ATOM 0 H4' U A 6 -5.546 9.608 16.717 1.00 0.00 H new ATOM 0 H3' U A 6 -3.975 7.211 17.808 1.00 0.00 H new ATOM 0 H2' U A 6 -6.031 5.880 17.191 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.199 8.165 17.636 1.00 0.00 H new ATOM 0 H1' U A 6 -6.264 6.942 14.681 1.00 0.00 H new ATOM 0 H3 U A 6 -4.501 2.900 13.776 1.00 0.00 H new ATOM 0 H5 U A 6 -1.223 5.225 15.049 1.00 0.00 H new ATOM 0 H6 U A 6 -2.772 6.958 15.682 1.00 0.00 H new ATOM 194 P C A 7 -5.345 7.078 20.083 1.00 0.00 P ATOM 195 OP1 C A 7 -6.042 7.709 21.226 1.00 0.00 O ATOM 196 OP2 C A 7 -3.943 6.630 20.238 1.00 0.00 O ATOM 197 O5' C A 7 -6.222 5.805 19.599 1.00 0.00 O ATOM 198 C5' C A 7 -7.635 5.852 19.590 1.00 0.00 C ATOM 199 C4' C A 7 -8.205 4.499 19.139 1.00 0.00 C ATOM 200 O4' C A 7 -7.776 4.143 17.820 1.00 0.00 O ATOM 201 C3' C A 7 -7.743 3.356 20.017 1.00 0.00 C ATOM 202 O3' C A 7 -8.431 3.311 21.253 1.00 0.00 O ATOM 203 C2' C A 7 -8.092 2.181 19.132 1.00 0.00 C ATOM 204 O2' C A 7 -9.483 1.940 19.184 1.00 0.00 O ATOM 205 C1' C A 7 -7.741 2.701 17.737 1.00 0.00 C ATOM 206 N1 C A 7 -6.391 2.218 17.338 1.00 0.00 N ATOM 207 C2 C A 7 -6.275 0.878 16.978 1.00 0.00 C ATOM 208 O2 C A 7 -7.264 0.147 16.980 1.00 0.00 O ATOM 209 N3 C A 7 -5.047 0.405 16.626 1.00 0.00 N ATOM 210 C4 C A 7 -3.974 1.208 16.631 1.00 0.00 C ATOM 211 N4 C A 7 -2.789 0.705 16.275 1.00 0.00 N ATOM 212 C5 C A 7 -4.077 2.588 16.995 1.00 0.00 C ATOM 213 C6 C A 7 -5.301 3.047 17.332 1.00 0.00 C ATOM 0 H5' C A 7 -7.976 6.641 18.920 1.00 0.00 H new ATOM 0 H5'' C A 7 -8.005 6.098 20.585 1.00 0.00 H new ATOM 0 H4' C A 7 -9.285 4.635 19.191 1.00 0.00 H new ATOM 0 H3' C A 7 -6.696 3.411 20.316 1.00 0.00 H new ATOM 0 H2' C A 7 -7.582 1.260 19.414 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.876 2.448 19.924 1.00 0.00 H new ATOM 0 H1' C A 7 -8.443 2.343 16.984 1.00 0.00 H new ATOM 0 H41 C A 7 -1.962 1.301 16.273 1.00 0.00 H new ATOM 0 H42 C A 7 -2.712 -0.276 16.005 1.00 0.00 H new ATOM 0 H5 C A 7 -3.212 3.235 17.000 1.00 0.00 H new ATOM 0 H6 C A 7 -5.423 4.086 17.601 1.00 0.00 H new ATOM 225 P C A 8 -7.889 2.393 22.467 1.00 0.00 P ATOM 226 OP1 C A 8 -8.826 2.533 23.603 1.00 0.00 O ATOM 227 OP2 C A 8 -6.454 2.696 22.659 1.00 0.00 O ATOM 228 O5' C A 8 -8.006 0.886 21.906 1.00 0.00 O ATOM 229 C5' C A 8 -9.251 0.218 21.855 1.00 0.00 C ATOM 230 C4' C A 8 -9.034 -1.209 21.343 1.00 0.00 C ATOM 231 O4' C A 8 -8.488 -1.217 20.028 1.00 0.00 O ATOM 232 C3' C A 8 -8.032 -1.966 22.189 1.00 0.00 C ATOM 233 O3' C A 8 -8.600 -2.455 23.385 1.00 0.00 O ATOM 234 C2' C A 8 -7.654 -3.088 21.254 1.00 0.00 C ATOM 235 O2' C A 8 -8.624 -4.113 21.316 1.00 0.00 O ATOM 236 C1' C A 8 -7.710 -2.417 19.880 1.00 0.00 C ATOM 237 N1 C A 8 -6.327 -2.086 19.466 1.00 0.00 N ATOM 238 C2 C A 8 -5.582 -3.088 18.850 1.00 0.00 C ATOM 239 O2 C A 8 -6.094 -4.175 18.592 1.00 0.00 O ATOM 240 N3 C A 8 -4.278 -2.830 18.551 1.00 0.00 N ATOM 241 C4 C A 8 -3.724 -1.648 18.855 1.00 0.00 C ATOM 242 N4 C A 8 -2.443 -1.434 18.542 1.00 0.00 N ATOM 243 C5 C A 8 -4.476 -0.620 19.510 1.00 0.00 C ATOM 244 C6 C A 8 -5.766 -0.884 19.789 1.00 0.00 C ATOM 0 H5' C A 8 -9.938 0.752 21.199 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.707 0.197 22.845 1.00 0.00 H new ATOM 0 H4' C A 8 -10.019 -1.674 21.376 1.00 0.00 H new ATOM 0 H3' C A 8 -7.194 -1.358 22.530 1.00 0.00 H new ATOM 0 H2' C A 8 -6.690 -3.540 21.486 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.072 -4.087 22.187 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.918 -2.938 23.898 1.00 0.00 H new ATOM 0 H1' C A 8 -8.158 -3.064 19.126 1.00 0.00 H new ATOM 0 H41 C A 8 -2.006 -0.540 18.766 1.00 0.00 H new ATOM 0 H42 C A 8 -1.902 -2.164 18.079 1.00 0.00 H new ATOM 0 H5 C A 8 -4.027 0.327 19.769 1.00 0.00 H new ATOM 0 H6 C A 8 -6.368 -0.132 20.277 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 2.585 -9.185 13.423 1.00 0.00 O ATOM 259 C5' G B 9 2.024 -10.479 13.409 1.00 0.00 C ATOM 260 C4' G B 9 0.620 -10.450 14.018 1.00 0.00 C ATOM 261 O4' G B 9 0.648 -10.017 15.376 1.00 0.00 O ATOM 262 C3' G B 9 -0.304 -9.476 13.316 1.00 0.00 C ATOM 263 O3' G B 9 -0.766 -9.962 12.067 1.00 0.00 O ATOM 264 C2' G B 9 -1.403 -9.397 14.347 1.00 0.00 C ATOM 265 O2' G B 9 -2.159 -10.589 14.323 1.00 0.00 O ATOM 266 C1' G B 9 -0.601 -9.357 15.649 1.00 0.00 C ATOM 267 N9 G B 9 -0.350 -7.950 16.034 1.00 0.00 N ATOM 268 C8 G B 9 0.817 -7.232 15.967 1.00 0.00 C ATOM 269 N7 G B 9 0.706 -6.001 16.381 1.00 0.00 N ATOM 270 C5 G B 9 -0.630 -5.890 16.749 1.00 0.00 C ATOM 271 C6 G B 9 -1.344 -4.773 17.276 1.00 0.00 C ATOM 272 O6 G B 9 -0.921 -3.646 17.520 1.00 0.00 O ATOM 273 N1 G B 9 -2.677 -5.084 17.517 1.00 0.00 N ATOM 274 C2 G B 9 -3.258 -6.312 17.280 1.00 0.00 C ATOM 275 N2 G B 9 -4.559 -6.427 17.565 1.00 0.00 N ATOM 276 N3 G B 9 -2.592 -7.362 16.784 1.00 0.00 N ATOM 277 C4 G B 9 -1.286 -7.080 16.543 1.00 0.00 C ATOM 0 H5' G B 9 2.658 -11.165 13.970 1.00 0.00 H new ATOM 0 H5'' G B 9 1.978 -10.853 12.386 1.00 0.00 H new ATOM 0 H4' G B 9 0.259 -11.474 13.917 1.00 0.00 H new ATOM 0 H3' G B 9 0.150 -8.523 13.045 1.00 0.00 H new ATOM 0 H2' G B 9 -2.090 -8.563 14.202 1.00 0.00 H new ATOM 0 HO2' G B 9 -2.057 -11.023 13.450 1.00 0.00 H new ATOM 0 HO5' G B 9 3.484 -9.214 13.033 1.00 0.00 H new ATOM 0 H1' G B 9 -1.137 -9.843 16.464 1.00 0.00 H new ATOM 0 H8 G B 9 1.745 -7.649 15.604 1.00 0.00 H new ATOM 0 H1 G B 9 -3.271 -4.348 17.898 1.00 0.00 H new ATOM 0 H21 G B 9 -5.039 -7.313 17.409 1.00 0.00 H new ATOM 0 H22 G B 9 -5.072 -5.628 17.939 1.00 0.00 H new ATOM 290 P G B 10 -1.435 -8.961 10.982 1.00 0.00 P ATOM 291 OP1 G B 10 -1.729 -9.742 9.761 1.00 0.00 O ATOM 292 OP2 G B 10 -0.582 -7.756 10.892 1.00 0.00 O ATOM 293 O5' G B 10 -2.838 -8.530 11.649 1.00 0.00 O ATOM 294 C5' G B 10 -3.946 -9.407 11.640 1.00 0.00 C ATOM 295 C4' G B 10 -5.137 -8.742 12.335 1.00 0.00 C ATOM 296 O4' G B 10 -4.813 -8.374 13.679 1.00 0.00 O ATOM 297 C3' G B 10 -5.570 -7.452 11.665 1.00 0.00 C ATOM 298 O3' G B 10 -6.333 -7.670 10.492 1.00 0.00 O ATOM 299 C2' G B 10 -6.396 -6.854 12.781 1.00 0.00 C ATOM 300 O2' G B 10 -7.623 -7.545 12.912 1.00 0.00 O ATOM 301 C1' G B 10 -5.522 -7.161 13.990 1.00 0.00 C ATOM 302 N9 G B 10 -4.566 -6.047 14.184 1.00 0.00 N ATOM 303 C8 G B 10 -3.234 -5.983 13.861 1.00 0.00 C ATOM 304 N7 G B 10 -2.673 -4.841 14.140 1.00 0.00 N ATOM 305 C5 G B 10 -3.707 -4.084 14.681 1.00 0.00 C ATOM 306 C6 G B 10 -3.701 -2.743 15.164 1.00 0.00 C ATOM 307 O6 G B 10 -2.758 -1.957 15.218 1.00 0.00 O ATOM 308 N1 G B 10 -4.959 -2.353 15.608 1.00 0.00 N ATOM 309 C2 G B 10 -6.083 -3.151 15.599 1.00 0.00 C ATOM 310 N2 G B 10 -7.212 -2.606 16.063 1.00 0.00 N ATOM 311 N3 G B 10 -6.091 -4.413 15.152 1.00 0.00 N ATOM 312 C4 G B 10 -4.872 -4.812 14.708 1.00 0.00 C ATOM 0 H5' G B 10 -3.690 -10.337 12.147 1.00 0.00 H new ATOM 0 H5'' G B 10 -4.209 -9.665 10.614 1.00 0.00 H new ATOM 0 H4' G B 10 -5.932 -9.486 12.287 1.00 0.00 H new ATOM 0 H3' G B 10 -4.751 -6.829 11.305 1.00 0.00 H new ATOM 0 H2' G B 10 -6.641 -5.802 12.637 1.00 0.00 H new ATOM 0 HO2' G B 10 -8.146 -7.148 13.639 1.00 0.00 H new ATOM 0 H1' G B 10 -6.108 -7.276 14.902 1.00 0.00 H new ATOM 0 H8 G B 10 -2.698 -6.807 13.415 1.00 0.00 H new ATOM 0 H1 G B 10 -5.058 -1.404 15.968 1.00 0.00 H new ATOM 0 H21 G B 10 -8.073 -3.152 16.079 1.00 0.00 H new ATOM 0 H22 G B 10 -7.212 -1.644 16.401 1.00 0.00 H new ATOM 324 P A B 11 -6.565 -6.478 9.416 1.00 0.00 P ATOM 325 OP1 A B 11 -7.418 -7.005 8.328 1.00 0.00 O ATOM 326 OP2 A B 11 -5.245 -5.894 9.094 1.00 0.00 O ATOM 327 O5' A B 11 -7.415 -5.369 10.225 1.00 0.00 O ATOM 328 C5' A B 11 -8.763 -5.602 10.570 1.00 0.00 C ATOM 329 C4' A B 11 -9.313 -4.410 11.359 1.00 0.00 C ATOM 330 O4' A B 11 -8.524 -4.150 12.523 1.00 0.00 O ATOM 331 C3' A B 11 -9.312 -3.108 10.583 1.00 0.00 C ATOM 332 O3' A B 11 -10.406 -3.010 9.695 1.00 0.00 O ATOM 333 C2' A B 11 -9.415 -2.103 11.697 1.00 0.00 C ATOM 334 O2' A B 11 -10.744 -2.049 12.177 1.00 0.00 O ATOM 335 C1' A B 11 -8.520 -2.730 12.759 1.00 0.00 C ATOM 336 N9 A B 11 -7.142 -2.197 12.632 1.00 0.00 N ATOM 337 C8 A B 11 -6.001 -2.830 12.203 1.00 0.00 C ATOM 338 N7 A B 11 -4.929 -2.091 12.264 1.00 0.00 N ATOM 339 C5 A B 11 -5.391 -0.875 12.751 1.00 0.00 C ATOM 340 C6 A B 11 -4.747 0.343 13.037 1.00 0.00 C ATOM 341 N6 A B 11 -3.432 0.531 12.879 1.00 0.00 N ATOM 342 N1 A B 11 -5.507 1.362 13.478 1.00 0.00 N ATOM 343 C2 A B 11 -6.815 1.172 13.634 1.00 0.00 C ATOM 344 N3 A B 11 -7.532 0.078 13.416 1.00 0.00 N ATOM 345 C4 A B 11 -6.742 -0.925 12.965 1.00 0.00 C ATOM 0 H5' A B 11 -8.843 -6.511 11.166 1.00 0.00 H new ATOM 0 H5'' A B 11 -9.356 -5.758 9.669 1.00 0.00 H new ATOM 0 H4' A B 11 -10.335 -4.704 11.598 1.00 0.00 H new ATOM 0 H3' A B 11 -8.441 -2.983 9.939 1.00 0.00 H new ATOM 0 H2' A B 11 -9.138 -1.089 11.409 1.00 0.00 H new ATOM 0 HO2' A B 11 -11.359 -2.342 11.472 1.00 0.00 H new ATOM 0 H1' A B 11 -8.879 -2.501 13.762 1.00 0.00 H new ATOM 0 H8 A B 11 -5.993 -3.850 11.847 1.00 0.00 H new ATOM 0 H61 A B 11 -3.016 1.435 13.102 1.00 0.00 H new ATOM 0 H62 A B 11 -2.846 -0.230 12.536 1.00 0.00 H new ATOM 0 H2 A B 11 -7.370 2.028 13.988 1.00 0.00 H new ATOM 357 P U B 12 -10.173 -2.685 8.141 1.00 0.00 P ATOM 358 OP1 U B 12 -11.465 -2.820 7.433 1.00 0.00 O ATOM 359 OP2 U B 12 -8.988 -3.436 7.675 1.00 0.00 O ATOM 360 O5' U B 12 -9.797 -1.124 8.223 1.00 0.00 O ATOM 361 C5' U B 12 -10.778 -0.172 8.583 1.00 0.00 C ATOM 362 C4' U B 12 -10.120 1.177 8.872 1.00 0.00 C ATOM 363 O4' U B 12 -9.239 1.085 9.989 1.00 0.00 O ATOM 364 C3' U B 12 -9.267 1.679 7.726 1.00 0.00 C ATOM 365 O3' U B 12 -10.049 2.250 6.692 1.00 0.00 O ATOM 366 C2' U B 12 -8.427 2.709 8.448 1.00 0.00 C ATOM 367 O2' U B 12 -9.187 3.880 8.664 1.00 0.00 O ATOM 368 C1' U B 12 -8.181 2.035 9.800 1.00 0.00 C ATOM 369 N1 U B 12 -6.866 1.348 9.798 1.00 0.00 N ATOM 370 C2 U B 12 -5.749 2.133 10.031 1.00 0.00 C ATOM 371 O2 U B 12 -5.837 3.341 10.236 1.00 0.00 O ATOM 372 N3 U B 12 -4.524 1.483 10.022 1.00 0.00 N ATOM 373 C4 U B 12 -4.327 0.130 9.793 1.00 0.00 C ATOM 374 O4 U B 12 -3.194 -0.344 9.795 1.00 0.00 O ATOM 375 C5 U B 12 -5.548 -0.617 9.574 1.00 0.00 C ATOM 376 C6 U B 12 -6.755 -0.003 9.585 1.00 0.00 C ATOM 0 H5' U B 12 -11.323 -0.515 9.462 1.00 0.00 H new ATOM 0 H5'' U B 12 -11.505 -0.066 7.778 1.00 0.00 H new ATOM 0 H4' U B 12 -10.951 1.859 9.052 1.00 0.00 H new ATOM 0 H3' U B 12 -8.694 0.909 7.210 1.00 0.00 H new ATOM 0 H2' U B 12 -7.524 2.992 7.907 1.00 0.00 H new ATOM 0 HO2' U B 12 -10.081 3.765 8.280 1.00 0.00 H new ATOM 0 H1' U B 12 -8.168 2.768 10.606 1.00 0.00 H new ATOM 0 H3 U B 12 -3.695 2.050 10.199 1.00 0.00 H new ATOM 0 H5 U B 12 -5.495 -1.681 9.399 1.00 0.00 H new ATOM 0 H6 U B 12 -7.648 -0.588 9.423 1.00 0.00 H new ATOM 387 P G B 13 -9.379 2.670 5.286 1.00 0.00 P ATOM 388 OP1 G B 13 -10.457 3.124 4.380 1.00 0.00 O ATOM 389 OP2 G B 13 -8.479 1.574 4.864 1.00 0.00 O ATOM 390 O5' G B 13 -8.472 3.946 5.663 1.00 0.00 O ATOM 391 C5' G B 13 -9.056 5.214 5.890 1.00 0.00 C ATOM 392 C4' G B 13 -7.954 6.223 6.220 1.00 0.00 C ATOM 393 O4' G B 13 -7.233 5.838 7.384 1.00 0.00 O ATOM 394 C3' G B 13 -6.907 6.290 5.129 1.00 0.00 C ATOM 395 O3' G B 13 -7.331 7.058 4.013 1.00 0.00 O ATOM 396 C2' G B 13 -5.776 6.952 5.874 1.00 0.00 C ATOM 397 O2' G B 13 -5.960 8.352 5.883 1.00 0.00 O ATOM 398 C1' G B 13 -5.930 6.424 7.294 1.00 0.00 C ATOM 399 N9 G B 13 -4.881 5.422 7.554 1.00 0.00 N ATOM 400 C8 G B 13 -4.949 4.062 7.460 1.00 0.00 C ATOM 401 N7 G B 13 -3.825 3.453 7.726 1.00 0.00 N ATOM 402 C5 G B 13 -2.943 4.493 8.011 1.00 0.00 C ATOM 403 C6 G B 13 -1.559 4.460 8.365 1.00 0.00 C ATOM 404 O6 G B 13 -0.826 3.485 8.522 1.00 0.00 O ATOM 405 N1 G B 13 -1.051 5.737 8.539 1.00 0.00 N ATOM 406 C2 G B 13 -1.766 6.904 8.406 1.00 0.00 C ATOM 407 N2 G B 13 -1.097 8.041 8.623 1.00 0.00 N ATOM 408 N3 G B 13 -3.061 6.943 8.082 1.00 0.00 N ATOM 409 C4 G B 13 -3.583 5.704 7.899 1.00 0.00 C ATOM 0 H5' G B 13 -9.771 5.157 6.711 1.00 0.00 H new ATOM 0 H5'' G B 13 -9.609 5.536 5.008 1.00 0.00 H new ATOM 0 H4' G B 13 -8.468 7.176 6.347 1.00 0.00 H new ATOM 0 H3' G B 13 -6.659 5.325 4.687 1.00 0.00 H new ATOM 0 H2' G B 13 -4.801 6.748 5.432 1.00 0.00 H new ATOM 0 HO2' G B 13 -6.718 8.586 5.308 1.00 0.00 H new ATOM 0 H1' G B 13 -5.826 7.217 8.034 1.00 0.00 H new ATOM 0 H8 G B 13 -5.853 3.536 7.190 1.00 0.00 H new ATOM 0 H1 G B 13 -0.065 5.818 8.786 1.00 0.00 H new ATOM 0 H21 G B 13 -1.575 8.938 8.539 1.00 0.00 H new ATOM 0 H22 G B 13 -0.108 8.011 8.873 1.00 0.00 H new ATOM 421 P U B 14 -6.518 7.013 2.614 1.00 0.00 P ATOM 422 OP1 U B 14 -7.245 7.854 1.636 1.00 0.00 O ATOM 423 OP2 U B 14 -6.246 5.594 2.297 1.00 0.00 O ATOM 424 O5' U B 14 -5.104 7.730 2.933 1.00 0.00 O ATOM 425 C5' U B 14 -4.978 9.139 2.944 1.00 0.00 C ATOM 426 C4' U B 14 -3.507 9.532 3.169 1.00 0.00 C ATOM 427 O4' U B 14 -3.033 9.114 4.457 1.00 0.00 O ATOM 428 C3' U B 14 -2.564 8.881 2.170 1.00 0.00 C ATOM 429 O3' U B 14 -2.551 9.516 0.907 1.00 0.00 O ATOM 430 C2' U B 14 -1.259 9.081 2.891 1.00 0.00 C ATOM 431 O2' U B 14 -0.878 10.439 2.818 1.00 0.00 O ATOM 432 C1' U B 14 -1.638 8.768 4.325 1.00 0.00 C ATOM 433 N1 U B 14 -1.440 7.326 4.616 1.00 0.00 N ATOM 434 C2 U B 14 -0.214 6.937 5.137 1.00 0.00 C ATOM 435 O2 U B 14 0.710 7.731 5.305 1.00 0.00 O ATOM 436 N3 U B 14 -0.084 5.598 5.460 1.00 0.00 N ATOM 437 C4 U B 14 -1.059 4.626 5.311 1.00 0.00 C ATOM 438 O4 U B 14 -0.828 3.458 5.614 1.00 0.00 O ATOM 439 C5 U B 14 -2.310 5.123 4.781 1.00 0.00 C ATOM 440 C6 U B 14 -2.454 6.425 4.450 1.00 0.00 C ATOM 0 H5' U B 14 -5.601 9.562 3.732 1.00 0.00 H new ATOM 0 H5'' U B 14 -5.333 9.552 2.000 1.00 0.00 H new ATOM 0 H4' U B 14 -3.501 10.617 3.064 1.00 0.00 H new ATOM 0 H3' U B 14 -2.825 7.852 1.922 1.00 0.00 H new ATOM 0 H2' U B 14 -0.442 8.481 2.491 1.00 0.00 H new ATOM 0 HO2' U B 14 -1.388 10.884 2.110 1.00 0.00 H new ATOM 0 H1' U B 14 -1.018 9.327 5.026 1.00 0.00 H new ATOM 0 H3 U B 14 0.813 5.299 5.843 1.00 0.00 H new ATOM 0 H5 U B 14 -3.140 4.444 4.648 1.00 0.00 H new ATOM 0 H6 U B 14 -3.396 6.763 4.043 1.00 0.00 H new ATOM 451 P C B 15 -1.845 8.802 -0.363 1.00 0.00 P ATOM 452 OP1 C B 15 -1.867 9.754 -1.496 1.00 0.00 O ATOM 453 OP2 C B 15 -2.450 7.462 -0.522 1.00 0.00 O ATOM 454 O5' C B 15 -0.304 8.600 0.094 1.00 0.00 O ATOM 455 C5' C B 15 0.608 9.681 0.097 1.00 0.00 C ATOM 456 C4' C B 15 1.999 9.192 0.527 1.00 0.00 C ATOM 457 O4' C B 15 1.992 8.628 1.844 1.00 0.00 O ATOM 458 C3' C B 15 2.520 8.085 -0.363 1.00 0.00 C ATOM 459 O3' C B 15 2.988 8.567 -1.609 1.00 0.00 O ATOM 460 C2' C B 15 3.643 7.562 0.502 1.00 0.00 C ATOM 461 O2' C B 15 4.741 8.447 0.441 1.00 0.00 O ATOM 462 C1' C B 15 3.039 7.636 1.905 1.00 0.00 C ATOM 463 N1 C B 15 2.497 6.306 2.296 1.00 0.00 N ATOM 464 C2 C B 15 3.417 5.324 2.653 1.00 0.00 C ATOM 465 O2 C B 15 4.621 5.574 2.657 1.00 0.00 O ATOM 466 N3 C B 15 2.949 4.091 2.992 1.00 0.00 N ATOM 467 C4 C B 15 1.636 3.826 2.978 1.00 0.00 C ATOM 468 N4 C B 15 1.218 2.604 3.321 1.00 0.00 N ATOM 469 C5 C B 15 0.677 4.825 2.617 1.00 0.00 C ATOM 470 C6 C B 15 1.153 6.046 2.292 1.00 0.00 C ATOM 0 H5' C B 15 0.261 10.459 0.777 1.00 0.00 H new ATOM 0 H5'' C B 15 0.661 10.126 -0.897 1.00 0.00 H new ATOM 0 H4' C B 15 2.624 10.083 0.471 1.00 0.00 H new ATOM 0 H3' C B 15 1.775 7.343 -0.650 1.00 0.00 H new ATOM 0 H2' C B 15 3.992 6.572 0.210 1.00 0.00 H new ATOM 0 HO2' C B 15 4.595 9.100 -0.275 1.00 0.00 H new ATOM 0 H1' C B 15 3.784 7.909 2.653 1.00 0.00 H new ATOM 0 H41 C B 15 0.222 2.386 3.316 1.00 0.00 H new ATOM 0 H42 C B 15 1.895 1.890 3.588 1.00 0.00 H new ATOM 0 H5 C B 15 -0.382 4.612 2.605 1.00 0.00 H new ATOM 0 H6 C B 15 0.461 6.831 2.024 1.00 0.00 H new ATOM 482 P C B 16 3.291 7.551 -2.827 1.00 0.00 P ATOM 483 OP1 C B 16 3.784 8.343 -3.976 1.00 0.00 O ATOM 484 OP2 C B 16 2.110 6.676 -2.993 1.00 0.00 O ATOM 485 O5' C B 16 4.508 6.644 -2.287 1.00 0.00 O ATOM 486 C5' C B 16 5.832 7.137 -2.257 1.00 0.00 C ATOM 487 C4' C B 16 6.767 6.030 -1.762 1.00 0.00 C ATOM 488 O4' C B 16 6.430 5.611 -0.444 1.00 0.00 O ATOM 489 C3' C B 16 6.661 4.780 -2.611 1.00 0.00 C ATOM 490 O3' C B 16 7.387 4.887 -3.816 1.00 0.00 O ATOM 491 C2' C B 16 7.272 3.757 -1.689 1.00 0.00 C ATOM 492 O2' C B 16 8.680 3.821 -1.779 1.00 0.00 O ATOM 493 C1' C B 16 6.827 4.237 -0.306 1.00 0.00 C ATOM 494 N1 C B 16 5.677 3.409 0.126 1.00 0.00 N ATOM 495 C2 C B 16 5.955 2.184 0.726 1.00 0.00 C ATOM 496 O2 C B 16 7.116 1.853 0.956 1.00 0.00 O ATOM 497 N3 C B 16 4.909 1.369 1.041 1.00 0.00 N ATOM 498 C4 C B 16 3.649 1.731 0.766 1.00 0.00 C ATOM 499 N4 C B 16 2.652 0.904 1.095 1.00 0.00 N ATOM 500 C5 C B 16 3.355 2.978 0.125 1.00 0.00 C ATOM 501 C6 C B 16 4.397 3.778 -0.170 1.00 0.00 C ATOM 0 H5' C B 16 5.896 8.005 -1.600 1.00 0.00 H new ATOM 0 H5'' C B 16 6.133 7.467 -3.251 1.00 0.00 H new ATOM 0 H4' C B 16 7.767 6.462 -1.808 1.00 0.00 H new ATOM 0 H3' C B 16 5.646 4.552 -2.937 1.00 0.00 H new ATOM 0 H2' C B 16 6.975 2.733 -1.914 1.00 0.00 H new ATOM 0 HO2' C B 16 8.937 4.148 -2.667 1.00 0.00 H new ATOM 0 HO3' C B 16 7.292 4.058 -4.330 1.00 0.00 H new ATOM 0 H1' C B 16 7.623 4.150 0.434 1.00 0.00 H new ATOM 0 H41 C B 16 1.686 1.164 0.893 1.00 0.00 H new ATOM 0 H42 C B 16 2.857 0.013 1.548 1.00 0.00 H new ATOM 0 H5 C B 16 2.341 3.264 -0.112 1.00 0.00 H new ATOM 0 H6 C B 16 4.217 4.729 -0.649 1.00 0.00 H new TER 514 C B 16