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 -21:sc= 0.1 USER MOD Single : A 1 G O5' : rot 180:sc= -0.012 USER MOD Single : A 2 A O2' : rot 180:sc= -0.186 USER MOD Single : A 3 G O2' : rot 180:sc= -0.365 USER MOD Single : A 4 G O2' : rot -30:sc= 0.0125 USER MOD Single : A 5 U O2' : rot 180:sc= -0.308 USER MOD Single : A 6 C O2' : rot 180:sc= -0.342 USER MOD Single : A 7 U O2' : rot 180:sc= -0.433 USER MOD Single : A 8 C O2' : rot -18:sc= 0.138 USER MOD Single : A 8 C O3' : rot 180:sc= 0.165 USER MOD Single : B 9 G O2' : rot 180:sc= -0.406 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 A O2' : rot -27:sc= 0.125 USER MOD Single : B 11 G O2' : rot 180:sc= -0.38 USER MOD Single : B 12 G O2' : rot -21:sc= -0.192 USER MOD Single : B 13 U O2' : rot -16:sc= -0.192 USER MOD Single : B 14 C O2' : rot -14:sc= -0.242 USER MOD Single : B 15 U O2' : rot 180:sc= -0.453 USER MOD Single : B 16 C O2' : rot -20:sc= 0.119 USER MOD Single : B 16 C O3' : rot 180:sc= 0.132 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 4.976 -8.849 5.031 1.00 0.00 O ATOM 2 C5' G A 1 6.312 -9.262 4.841 1.00 0.00 C ATOM 3 C4' G A 1 7.157 -8.088 4.342 1.00 0.00 C ATOM 4 O4' G A 1 6.699 -7.612 3.078 1.00 0.00 O ATOM 5 C3' G A 1 7.088 -6.886 5.263 1.00 0.00 C ATOM 6 O3' G A 1 7.888 -7.038 6.421 1.00 0.00 O ATOM 7 C2' G A 1 7.632 -5.831 4.337 1.00 0.00 C ATOM 8 O2' G A 1 9.028 -5.993 4.206 1.00 0.00 O ATOM 9 C1' G A 1 6.977 -6.204 3.014 1.00 0.00 C ATOM 10 N9 G A 1 5.717 -5.453 2.855 1.00 0.00 N ATOM 11 C8 G A 1 4.444 -5.830 3.188 1.00 0.00 C ATOM 12 N7 G A 1 3.535 -4.940 2.903 1.00 0.00 N ATOM 13 C5 G A 1 4.259 -3.890 2.348 1.00 0.00 C ATOM 14 C6 G A 1 3.812 -2.631 1.851 1.00 0.00 C ATOM 15 O6 G A 1 2.663 -2.202 1.783 1.00 0.00 O ATOM 16 N1 G A 1 4.874 -1.849 1.409 1.00 0.00 N ATOM 17 C2 G A 1 6.198 -2.231 1.428 1.00 0.00 C ATOM 18 N2 G A 1 7.087 -1.345 0.966 1.00 0.00 N ATOM 19 N3 G A 1 6.620 -3.416 1.881 1.00 0.00 N ATOM 20 C4 G A 1 5.600 -4.191 2.326 1.00 0.00 C ATOM 0 H5' G A 1 6.350 -10.080 4.121 1.00 0.00 H new ATOM 0 H5'' G A 1 6.720 -9.643 5.777 1.00 0.00 H new ATOM 0 H4' G A 1 8.171 -8.485 4.290 1.00 0.00 H new ATOM 0 H3' G A 1 6.099 -6.683 5.675 1.00 0.00 H new ATOM 0 H2' G A 1 7.442 -4.811 4.670 1.00 0.00 H new ATOM 0 HO2' G A 1 9.370 -6.510 4.965 1.00 0.00 H new ATOM 0 HO5' G A 1 4.441 -9.606 5.349 1.00 0.00 H new ATOM 0 H1' G A 1 7.624 -5.967 2.169 1.00 0.00 H new ATOM 0 H8 G A 1 4.213 -6.780 3.646 1.00 0.00 H new ATOM 0 H1 G A 1 4.656 -0.922 1.043 1.00 0.00 H new ATOM 0 H21 G A 1 8.080 -1.576 0.957 1.00 0.00 H new ATOM 0 H22 G A 1 6.772 -0.438 0.622 1.00 0.00 H new ATOM 33 P A A 2 7.676 -6.076 7.703 1.00 0.00 P ATOM 34 OP1 A A 2 8.676 -6.449 8.727 1.00 0.00 O ATOM 35 OP2 A A 2 6.236 -6.091 8.045 1.00 0.00 O ATOM 36 O5' A A 2 8.042 -4.603 7.157 1.00 0.00 O ATOM 37 C5' A A 2 9.387 -4.185 7.025 1.00 0.00 C ATOM 38 C4' A A 2 9.420 -2.745 6.511 1.00 0.00 C ATOM 39 O4' A A 2 8.735 -2.620 5.270 1.00 0.00 O ATOM 40 C3' A A 2 8.706 -1.792 7.443 1.00 0.00 C ATOM 41 O3' A A 2 9.485 -1.480 8.586 1.00 0.00 O ATOM 42 C2' A A 2 8.512 -0.608 6.533 1.00 0.00 C ATOM 43 O2' A A 2 9.724 0.110 6.413 1.00 0.00 O ATOM 44 C1' A A 2 8.206 -1.288 5.196 1.00 0.00 C ATOM 45 N9 A A 2 6.744 -1.328 4.969 1.00 0.00 N ATOM 46 C8 A A 2 5.863 -2.364 5.164 1.00 0.00 C ATOM 47 N7 A A 2 4.626 -2.068 4.873 1.00 0.00 N ATOM 48 C5 A A 2 4.690 -0.743 4.451 1.00 0.00 C ATOM 49 C6 A A 2 3.711 0.166 4.000 1.00 0.00 C ATOM 50 N6 A A 2 2.412 -0.142 3.899 1.00 0.00 N ATOM 51 N1 A A 2 4.117 1.402 3.657 1.00 0.00 N ATOM 52 C2 A A 2 5.407 1.709 3.758 1.00 0.00 C ATOM 53 N3 A A 2 6.417 0.951 4.166 1.00 0.00 N ATOM 54 C4 A A 2 5.978 -0.285 4.503 1.00 0.00 C ATOM 0 H5' A A 2 9.918 -4.842 6.336 1.00 0.00 H new ATOM 0 H5'' A A 2 9.897 -4.252 7.986 1.00 0.00 H new ATOM 0 H4' A A 2 10.479 -2.502 6.424 1.00 0.00 H new ATOM 0 H3' A A 2 7.783 -2.181 7.872 1.00 0.00 H new ATOM 0 H2' A A 2 7.750 0.092 6.876 1.00 0.00 H new ATOM 0 HO2' A A 2 9.592 0.878 5.819 1.00 0.00 H new ATOM 0 H1' A A 2 8.656 -0.740 4.368 1.00 0.00 H new ATOM 0 H8 A A 2 6.167 -3.335 5.525 1.00 0.00 H new ATOM 0 H61 A A 2 1.747 0.556 3.566 1.00 0.00 H new ATOM 0 H62 A A 2 2.088 -1.075 4.155 1.00 0.00 H new ATOM 0 H2 A A 2 5.669 2.716 3.467 1.00 0.00 H new ATOM 66 P G A 3 8.816 -0.795 9.888 1.00 0.00 P ATOM 67 OP1 G A 3 9.881 -0.578 10.892 1.00 0.00 O ATOM 68 OP2 G A 3 7.616 -1.582 10.249 1.00 0.00 O ATOM 69 O5' G A 3 8.325 0.644 9.362 1.00 0.00 O ATOM 70 C5' G A 3 9.241 1.701 9.156 1.00 0.00 C ATOM 71 C4' G A 3 8.475 2.910 8.620 1.00 0.00 C ATOM 72 O4' G A 3 7.810 2.584 7.408 1.00 0.00 O ATOM 73 C3' G A 3 7.384 3.359 9.553 1.00 0.00 C ATOM 74 O3' G A 3 7.887 4.093 10.658 1.00 0.00 O ATOM 75 C2' G A 3 6.597 4.232 8.604 1.00 0.00 C ATOM 76 O2' G A 3 7.238 5.480 8.456 1.00 0.00 O ATOM 77 C1' G A 3 6.703 3.475 7.282 1.00 0.00 C ATOM 78 N9 G A 3 5.451 2.733 7.055 1.00 0.00 N ATOM 79 C8 G A 3 5.164 1.411 7.279 1.00 0.00 C ATOM 80 N7 G A 3 3.926 1.089 7.021 1.00 0.00 N ATOM 81 C5 G A 3 3.351 2.285 6.599 1.00 0.00 C ATOM 82 C6 G A 3 2.015 2.570 6.187 1.00 0.00 C ATOM 83 O6 G A 3 1.061 1.800 6.101 1.00 0.00 O ATOM 84 N1 G A 3 1.858 3.913 5.858 1.00 0.00 N ATOM 85 C2 G A 3 2.858 4.861 5.907 1.00 0.00 C ATOM 86 N2 G A 3 2.533 6.105 5.545 1.00 0.00 N ATOM 87 N3 G A 3 4.108 4.596 6.287 1.00 0.00 N ATOM 88 C4 G A 3 4.281 3.294 6.619 1.00 0.00 C ATOM 0 H5' G A 3 10.015 1.399 8.450 1.00 0.00 H new ATOM 0 H5'' G A 3 9.743 1.954 10.090 1.00 0.00 H new ATOM 0 H4' G A 3 9.224 3.691 8.493 1.00 0.00 H new ATOM 0 H3' G A 3 6.820 2.555 10.027 1.00 0.00 H new ATOM 0 H2' G A 3 5.576 4.417 8.939 1.00 0.00 H new ATOM 0 HO2' G A 3 6.723 6.041 7.839 1.00 0.00 H new ATOM 0 H1' G A 3 6.855 4.145 6.435 1.00 0.00 H new ATOM 0 H8 G A 3 5.896 0.701 7.636 1.00 0.00 H new ATOM 0 H1 G A 3 0.933 4.219 5.558 1.00 0.00 H new ATOM 0 H21 G A 3 3.238 6.842 5.564 1.00 0.00 H new ATOM 0 H22 G A 3 1.580 6.318 5.249 1.00 0.00 H new ATOM 100 P G A 4 6.898 4.646 11.813 1.00 0.00 P ATOM 101 OP1 G A 4 7.733 5.140 12.931 1.00 0.00 O ATOM 102 OP2 G A 4 5.874 3.610 12.067 1.00 0.00 O ATOM 103 O5' G A 4 6.163 5.922 11.141 1.00 0.00 O ATOM 104 C5' G A 4 6.853 7.144 10.944 1.00 0.00 C ATOM 105 C4' G A 4 5.881 8.209 10.415 1.00 0.00 C ATOM 106 O4' G A 4 5.291 7.815 9.173 1.00 0.00 O ATOM 107 C3' G A 4 4.722 8.440 11.366 1.00 0.00 C ATOM 108 O3' G A 4 5.064 9.316 12.423 1.00 0.00 O ATOM 109 C2' G A 4 3.730 9.081 10.431 1.00 0.00 C ATOM 110 O2' G A 4 4.120 10.416 10.180 1.00 0.00 O ATOM 111 C1' G A 4 3.929 8.278 9.156 1.00 0.00 C ATOM 112 N9 G A 4 3.019 7.117 9.118 1.00 0.00 N ATOM 113 C8 G A 4 3.323 5.796 9.286 1.00 0.00 C ATOM 114 N7 G A 4 2.310 4.991 9.131 1.00 0.00 N ATOM 115 C5 G A 4 1.248 5.843 8.840 1.00 0.00 C ATOM 116 C6 G A 4 -0.120 5.543 8.572 1.00 0.00 C ATOM 117 O6 G A 4 -0.664 4.444 8.527 1.00 0.00 O ATOM 118 N1 G A 4 -0.864 6.697 8.349 1.00 0.00 N ATOM 119 C2 G A 4 -0.356 7.978 8.360 1.00 0.00 C ATOM 120 N2 G A 4 -1.223 8.968 8.123 1.00 0.00 N ATOM 121 N3 G A 4 0.930 8.264 8.599 1.00 0.00 N ATOM 122 C4 G A 4 1.672 7.151 8.835 1.00 0.00 C ATOM 0 H5' G A 4 7.671 7.001 10.237 1.00 0.00 H new ATOM 0 H5'' G A 4 7.297 7.477 11.882 1.00 0.00 H new ATOM 0 H4' G A 4 6.482 9.111 10.301 1.00 0.00 H new ATOM 0 H3' G A 4 4.372 7.540 11.871 1.00 0.00 H new ATOM 0 H2' G A 4 2.708 9.090 10.811 1.00 0.00 H new ATOM 0 HO2' G A 4 4.590 10.772 10.963 1.00 0.00 H new ATOM 0 H1' G A 4 3.718 8.893 8.281 1.00 0.00 H new ATOM 0 H8 G A 4 4.317 5.449 9.526 1.00 0.00 H new ATOM 0 H1 G A 4 -1.861 6.587 8.163 1.00 0.00 H new ATOM 0 H21 G A 4 -0.903 9.936 8.119 1.00 0.00 H new ATOM 0 H22 G A 4 -2.205 8.755 7.946 1.00 0.00 H new ATOM 134 P U A 5 4.226 9.316 13.801 1.00 0.00 P ATOM 135 OP1 U A 5 4.627 10.506 14.584 1.00 0.00 O ATOM 136 OP2 U A 5 4.344 7.970 14.401 1.00 0.00 O ATOM 137 O5' U A 5 2.697 9.515 13.330 1.00 0.00 O ATOM 138 C5' U A 5 2.197 10.778 12.947 1.00 0.00 C ATOM 139 C4' U A 5 0.698 10.663 12.631 1.00 0.00 C ATOM 140 O4' U A 5 0.417 9.907 11.446 1.00 0.00 O ATOM 141 C3' U A 5 -0.074 10.004 13.741 1.00 0.00 C ATOM 142 O3' U A 5 -0.305 10.879 14.828 1.00 0.00 O ATOM 143 C2' U A 5 -1.339 9.681 12.992 1.00 0.00 C ATOM 144 O2' U A 5 -2.106 10.850 12.779 1.00 0.00 O ATOM 145 C1' U A 5 -0.812 9.187 11.667 1.00 0.00 C ATOM 146 N1 U A 5 -0.523 7.736 11.729 1.00 0.00 N ATOM 147 C2 U A 5 -1.548 6.839 11.449 1.00 0.00 C ATOM 148 O2 U A 5 -2.695 7.204 11.191 1.00 0.00 O ATOM 149 N3 U A 5 -1.205 5.497 11.474 1.00 0.00 N ATOM 150 C4 U A 5 0.052 4.982 11.753 1.00 0.00 C ATOM 151 O4 U A 5 0.247 3.770 11.748 1.00 0.00 O ATOM 152 C5 U A 5 1.051 5.989 12.033 1.00 0.00 C ATOM 153 C6 U A 5 0.735 7.304 12.009 1.00 0.00 C ATOM 0 H5' U A 5 2.736 11.144 12.074 1.00 0.00 H new ATOM 0 H5'' U A 5 2.356 11.501 13.747 1.00 0.00 H new ATOM 0 H4' U A 5 0.388 11.699 12.495 1.00 0.00 H new ATOM 0 H3' U A 5 0.421 9.155 14.212 1.00 0.00 H new ATOM 0 H2' U A 5 -1.980 8.974 13.518 1.00 0.00 H new ATOM 0 HO2' U A 5 -2.923 10.620 12.290 1.00 0.00 H new ATOM 0 H1' U A 5 -1.538 9.346 10.870 1.00 0.00 H new ATOM 0 H3 U A 5 -1.945 4.826 11.268 1.00 0.00 H new ATOM 0 H5 U A 5 2.062 5.688 12.264 1.00 0.00 H new ATOM 0 H6 U A 5 1.505 8.032 12.218 1.00 0.00 H new ATOM 164 P C A 6 -0.754 10.303 16.266 1.00 0.00 P ATOM 165 OP1 C A 6 -1.051 11.450 17.152 1.00 0.00 O ATOM 166 OP2 C A 6 0.241 9.291 16.682 1.00 0.00 O ATOM 167 O5' C A 6 -2.134 9.542 15.949 1.00 0.00 O ATOM 168 C5' C A 6 -3.324 10.261 15.717 1.00 0.00 C ATOM 169 C4' C A 6 -4.442 9.279 15.365 1.00 0.00 C ATOM 170 O4' C A 6 -4.144 8.544 14.178 1.00 0.00 O ATOM 171 C3' C A 6 -4.650 8.233 16.439 1.00 0.00 C ATOM 172 O3' C A 6 -5.365 8.728 17.554 1.00 0.00 O ATOM 173 C2' C A 6 -5.448 7.225 15.656 1.00 0.00 C ATOM 174 O2' C A 6 -6.767 7.695 15.475 1.00 0.00 O ATOM 175 C1' C A 6 -4.735 7.242 14.308 1.00 0.00 C ATOM 176 N1 C A 6 -3.692 6.188 14.282 1.00 0.00 N ATOM 177 C2 C A 6 -4.123 4.885 14.086 1.00 0.00 C ATOM 178 O2 C A 6 -5.314 4.653 13.900 1.00 0.00 O ATOM 179 N3 C A 6 -3.199 3.887 14.108 1.00 0.00 N ATOM 180 C4 C A 6 -1.905 4.151 14.322 1.00 0.00 C ATOM 181 N4 C A 6 -1.035 3.137 14.344 1.00 0.00 N ATOM 182 C5 C A 6 -1.440 5.493 14.516 1.00 0.00 C ATOM 183 C6 C A 6 -2.367 6.476 14.481 1.00 0.00 C ATOM 0 H5' C A 6 -3.180 10.974 14.905 1.00 0.00 H new ATOM 0 H5'' C A 6 -3.594 10.837 16.602 1.00 0.00 H new ATOM 0 H4' C A 6 -5.329 9.902 15.245 1.00 0.00 H new ATOM 0 H3' C A 6 -3.733 7.854 16.889 1.00 0.00 H new ATOM 0 H2' C A 6 -5.509 6.246 16.131 1.00 0.00 H new ATOM 0 HO2' C A 6 -7.282 7.036 14.964 1.00 0.00 H new ATOM 0 H1' C A 6 -5.422 7.046 13.485 1.00 0.00 H new ATOM 0 H41 C A 6 -0.044 3.318 14.506 1.00 0.00 H new ATOM 0 H42 C A 6 -1.362 2.182 14.199 1.00 0.00 H new ATOM 0 H5 C A 6 -0.395 5.709 14.683 1.00 0.00 H new ATOM 0 H6 C A 6 -2.059 7.503 14.612 1.00 0.00 H new ATOM 195 P U A 7 -5.395 7.907 18.944 1.00 0.00 P ATOM 196 OP1 U A 7 -6.260 8.643 19.894 1.00 0.00 O ATOM 197 OP2 U A 7 -3.998 7.595 19.316 1.00 0.00 O ATOM 198 O5' U A 7 -6.130 6.521 18.568 1.00 0.00 O ATOM 199 C5' U A 7 -7.527 6.467 18.369 1.00 0.00 C ATOM 200 C4' U A 7 -7.950 5.017 18.114 1.00 0.00 C ATOM 201 O4' U A 7 -7.319 4.471 16.951 1.00 0.00 O ATOM 202 C3' U A 7 -7.540 4.096 19.244 1.00 0.00 C ATOM 203 O3' U A 7 -8.372 4.207 20.384 1.00 0.00 O ATOM 204 C2' U A 7 -7.708 2.771 18.555 1.00 0.00 C ATOM 205 O2' U A 7 -9.082 2.466 18.441 1.00 0.00 O ATOM 206 C1' U A 7 -7.162 3.055 17.165 1.00 0.00 C ATOM 207 N1 U A 7 -5.731 2.655 17.074 1.00 0.00 N ATOM 208 C2 U A 7 -5.463 1.302 16.920 1.00 0.00 C ATOM 209 O2 U A 7 -6.356 0.458 16.878 1.00 0.00 O ATOM 210 N3 U A 7 -4.130 0.947 16.812 1.00 0.00 N ATOM 211 C4 U A 7 -3.052 1.812 16.850 1.00 0.00 C ATOM 212 O4 U A 7 -1.905 1.382 16.757 1.00 0.00 O ATOM 213 C5 U A 7 -3.417 3.206 16.999 1.00 0.00 C ATOM 214 C6 U A 7 -4.716 3.580 17.101 1.00 0.00 C ATOM 0 H5' U A 7 -7.809 7.094 17.523 1.00 0.00 H new ATOM 0 H5'' U A 7 -8.045 6.860 19.244 1.00 0.00 H new ATOM 0 H4' U A 7 -9.033 5.064 18.004 1.00 0.00 H new ATOM 0 H3' U A 7 -6.549 4.295 19.652 1.00 0.00 H new ATOM 0 H2' U A 7 -7.222 1.945 19.075 1.00 0.00 H new ATOM 0 HO2' U A 7 -9.189 1.602 17.990 1.00 0.00 H new ATOM 0 H1' U A 7 -7.695 2.485 16.404 1.00 0.00 H new ATOM 0 H3 U A 7 -3.923 -0.045 16.693 1.00 0.00 H new ATOM 0 H5 U A 7 -2.643 3.958 17.029 1.00 0.00 H new ATOM 0 H6 U A 7 -4.958 4.627 17.206 1.00 0.00 H new ATOM 225 P C A 8 -7.963 3.491 21.776 1.00 0.00 P ATOM 226 OP1 C A 8 -9.030 3.763 22.764 1.00 0.00 O ATOM 227 OP2 C A 8 -6.566 3.865 22.085 1.00 0.00 O ATOM 228 O5' C A 8 -7.991 1.913 21.432 1.00 0.00 O ATOM 229 C5' C A 8 -9.213 1.214 21.313 1.00 0.00 C ATOM 230 C4' C A 8 -8.935 -0.262 21.006 1.00 0.00 C ATOM 231 O4' C A 8 -8.193 -0.425 19.802 1.00 0.00 O ATOM 232 C3' C A 8 -8.083 -0.925 22.065 1.00 0.00 C ATOM 233 O3' C A 8 -8.807 -1.224 23.238 1.00 0.00 O ATOM 234 C2' C A 8 -7.668 -2.170 21.339 1.00 0.00 C ATOM 235 O2' C A 8 -8.743 -3.086 21.320 1.00 0.00 O ATOM 236 C1' C A 8 -7.427 -1.638 19.926 1.00 0.00 C ATOM 237 N1 C A 8 -5.976 -1.368 19.738 1.00 0.00 N ATOM 238 C2 C A 8 -5.146 -2.460 19.508 1.00 0.00 C ATOM 239 O2 C A 8 -5.617 -3.593 19.441 1.00 0.00 O ATOM 240 N3 C A 8 -3.809 -2.236 19.362 1.00 0.00 N ATOM 241 C4 C A 8 -3.306 -0.996 19.443 1.00 0.00 C ATOM 242 N4 C A 8 -1.990 -0.819 19.282 1.00 0.00 N ATOM 243 C5 C A 8 -4.147 0.135 19.690 1.00 0.00 C ATOM 244 C6 C A 8 -5.469 -0.102 19.827 1.00 0.00 C ATOM 0 H5' C A 8 -9.819 1.653 20.520 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.785 1.302 22.237 1.00 0.00 H new ATOM 0 H4' C A 8 -9.926 -0.712 20.946 1.00 0.00 H new ATOM 0 H3' C A 8 -7.262 -0.306 22.427 1.00 0.00 H new ATOM 0 H2' C A 8 -6.814 -2.684 21.779 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.395 -2.839 22.008 1.00 0.00 H new ATOM 0 HO3' C A 8 -8.213 -1.652 23.889 1.00 0.00 H new ATOM 0 H1' C A 8 -7.732 -2.359 19.167 1.00 0.00 H new ATOM 0 H41 C A 8 -1.590 0.118 19.340 1.00 0.00 H new ATOM 0 H42 C A 8 -1.386 -1.621 19.101 1.00 0.00 H new ATOM 0 H5 C A 8 -3.742 1.134 19.764 1.00 0.00 H new ATOM 0 H6 C A 8 -6.139 0.725 20.011 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.874 -11.020 16.895 1.00 0.00 O ATOM 259 C5' G B 9 3.194 -10.251 15.927 1.00 0.00 C ATOM 260 C4' G B 9 1.711 -10.174 16.289 1.00 0.00 C ATOM 261 O4' G B 9 1.516 -9.470 17.515 1.00 0.00 O ATOM 262 C3' G B 9 0.918 -9.394 15.261 1.00 0.00 C ATOM 263 O3' G B 9 0.638 -10.153 14.099 1.00 0.00 O ATOM 264 C2' G B 9 -0.323 -9.101 16.062 1.00 0.00 C ATOM 265 O2' G B 9 -1.115 -10.265 16.165 1.00 0.00 O ATOM 266 C1' G B 9 0.257 -8.786 17.433 1.00 0.00 C ATOM 267 N9 G B 9 0.470 -7.331 17.551 1.00 0.00 N ATOM 268 C8 G B 9 1.598 -6.602 17.285 1.00 0.00 C ATOM 269 N7 G B 9 1.465 -5.322 17.497 1.00 0.00 N ATOM 270 C5 G B 9 0.149 -5.190 17.927 1.00 0.00 C ATOM 271 C6 G B 9 -0.581 -4.024 18.301 1.00 0.00 C ATOM 272 O6 G B 9 -0.189 -2.861 18.344 1.00 0.00 O ATOM 273 N1 G B 9 -1.893 -4.330 18.647 1.00 0.00 N ATOM 274 C2 G B 9 -2.437 -5.596 18.641 1.00 0.00 C ATOM 275 N2 G B 9 -3.721 -5.702 18.997 1.00 0.00 N ATOM 276 N3 G B 9 -1.754 -6.693 18.299 1.00 0.00 N ATOM 277 C4 G B 9 -0.471 -6.416 17.953 1.00 0.00 C ATOM 0 H5' G B 9 3.316 -10.698 14.940 1.00 0.00 H new ATOM 0 H5'' G B 9 3.620 -9.249 15.878 1.00 0.00 H new ATOM 0 H4' G B 9 1.376 -11.209 16.350 1.00 0.00 H new ATOM 0 H3' G B 9 1.428 -8.517 14.862 1.00 0.00 H new ATOM 0 H2' G B 9 -0.946 -8.316 15.634 1.00 0.00 H new ATOM 0 HO2' G B 9 -1.920 -10.068 16.688 1.00 0.00 H new ATOM 0 HO5' G B 9 4.825 -11.071 16.663 1.00 0.00 H new ATOM 0 H1' G B 9 -0.413 -9.103 18.232 1.00 0.00 H new ATOM 0 H8 G B 9 2.516 -7.047 16.931 1.00 0.00 H new ATOM 0 H1 G B 9 -2.499 -3.558 18.927 1.00 0.00 H new ATOM 0 H21 G B 9 -4.173 -6.616 19.010 1.00 0.00 H new ATOM 0 H22 G B 9 -4.249 -4.869 19.256 1.00 0.00 H new ATOM 290 P A B 10 0.087 -9.437 12.760 1.00 0.00 P ATOM 291 OP1 A B 10 -0.163 -10.487 11.747 1.00 0.00 O ATOM 292 OP2 A B 10 0.993 -8.312 12.442 1.00 0.00 O ATOM 293 O5' A B 10 -1.334 -8.822 13.207 1.00 0.00 O ATOM 294 C5' A B 10 -2.467 -9.649 13.374 1.00 0.00 C ATOM 295 C4' A B 10 -3.652 -8.792 13.827 1.00 0.00 C ATOM 296 O4' A B 10 -3.361 -8.100 15.037 1.00 0.00 O ATOM 297 C3' A B 10 -3.983 -7.705 12.830 1.00 0.00 C ATOM 298 O3' A B 10 -4.685 -8.204 11.701 1.00 0.00 O ATOM 299 C2' A B 10 -4.836 -6.811 13.687 1.00 0.00 C ATOM 300 O2' A B 10 -6.113 -7.391 13.848 1.00 0.00 O ATOM 301 C1' A B 10 -4.104 -6.872 15.026 1.00 0.00 C ATOM 302 N9 A B 10 -3.186 -5.717 15.159 1.00 0.00 N ATOM 303 C8 A B 10 -1.831 -5.657 14.949 1.00 0.00 C ATOM 304 N7 A B 10 -1.313 -4.478 15.163 1.00 0.00 N ATOM 305 C5 A B 10 -2.402 -3.699 15.543 1.00 0.00 C ATOM 306 C6 A B 10 -2.527 -2.345 15.910 1.00 0.00 C ATOM 307 N6 A B 10 -1.493 -1.497 15.957 1.00 0.00 N ATOM 308 N1 A B 10 -3.755 -1.894 16.230 1.00 0.00 N ATOM 309 C2 A B 10 -4.783 -2.737 16.185 1.00 0.00 C ATOM 310 N3 A B 10 -4.796 -4.024 15.859 1.00 0.00 N ATOM 311 C4 A B 10 -3.548 -4.446 15.543 1.00 0.00 C ATOM 0 H5' A B 10 -2.261 -10.425 14.111 1.00 0.00 H new ATOM 0 H5'' A B 10 -2.705 -10.154 12.438 1.00 0.00 H new ATOM 0 H4' A B 10 -4.478 -9.494 13.942 1.00 0.00 H new ATOM 0 H3' A B 10 -3.117 -7.216 12.384 1.00 0.00 H new ATOM 0 H2' A B 10 -4.972 -5.808 13.283 1.00 0.00 H new ATOM 0 HO2' A B 10 -6.313 -7.962 13.077 1.00 0.00 H new ATOM 0 H1' A B 10 -4.807 -6.834 15.858 1.00 0.00 H new ATOM 0 H8 A B 10 -1.246 -6.509 14.635 1.00 0.00 H new ATOM 0 H61 A B 10 -1.642 -0.526 16.230 1.00 0.00 H new ATOM 0 H62 A B 10 -0.556 -1.822 15.720 1.00 0.00 H new ATOM 0 H2 A B 10 -5.741 -2.316 16.451 1.00 0.00 H new ATOM 323 P G B 11 -4.775 -7.350 10.330 1.00 0.00 P ATOM 324 OP1 G B 11 -5.564 -8.134 9.353 1.00 0.00 O ATOM 325 OP2 G B 11 -3.408 -6.907 9.981 1.00 0.00 O ATOM 326 O5' G B 11 -5.632 -6.048 10.732 1.00 0.00 O ATOM 327 C5' G B 11 -7.043 -6.097 10.831 1.00 0.00 C ATOM 328 C4' G B 11 -7.547 -4.719 11.255 1.00 0.00 C ATOM 329 O4' G B 11 -6.958 -4.326 12.488 1.00 0.00 O ATOM 330 C3' G B 11 -7.164 -3.642 10.278 1.00 0.00 C ATOM 331 O3' G B 11 -7.984 -3.652 9.121 1.00 0.00 O ATOM 332 C2' G B 11 -7.418 -2.430 11.143 1.00 0.00 C ATOM 333 O2' G B 11 -8.802 -2.164 11.202 1.00 0.00 O ATOM 334 C1' G B 11 -6.957 -2.900 12.520 1.00 0.00 C ATOM 335 N9 G B 11 -5.602 -2.376 12.769 1.00 0.00 N ATOM 336 C8 G B 11 -4.387 -2.997 12.639 1.00 0.00 C ATOM 337 N7 G B 11 -3.368 -2.218 12.879 1.00 0.00 N ATOM 338 C5 G B 11 -3.951 -0.991 13.187 1.00 0.00 C ATOM 339 C6 G B 11 -3.349 0.257 13.529 1.00 0.00 C ATOM 340 O6 G B 11 -2.154 0.523 13.639 1.00 0.00 O ATOM 341 N1 G B 11 -4.305 1.242 13.748 1.00 0.00 N ATOM 342 C2 G B 11 -5.669 1.054 13.660 1.00 0.00 C ATOM 343 N2 G B 11 -6.445 2.111 13.914 1.00 0.00 N ATOM 344 N3 G B 11 -6.234 -0.111 13.345 1.00 0.00 N ATOM 345 C4 G B 11 -5.319 -1.085 13.122 1.00 0.00 C ATOM 0 H5' G B 11 -7.346 -6.851 11.557 1.00 0.00 H new ATOM 0 H5'' G B 11 -7.480 -6.382 9.874 1.00 0.00 H new ATOM 0 H4' G B 11 -8.631 -4.817 11.320 1.00 0.00 H new ATOM 0 H3' G B 11 -6.157 -3.722 9.869 1.00 0.00 H new ATOM 0 H2' G B 11 -6.920 -1.531 10.781 1.00 0.00 H new ATOM 0 HO2' G B 11 -8.960 -1.378 11.765 1.00 0.00 H new ATOM 0 H1' G B 11 -7.608 -2.545 13.318 1.00 0.00 H new ATOM 0 H8 G B 11 -4.283 -4.036 12.363 1.00 0.00 H new ATOM 0 H1 G B 11 -3.973 2.175 13.992 1.00 0.00 H new ATOM 0 H21 G B 11 -7.460 2.023 13.862 1.00 0.00 H new ATOM 0 H22 G B 11 -6.023 3.006 14.160 1.00 0.00 H new ATOM 357 P G B 12 -7.734 -2.607 7.911 1.00 0.00 P ATOM 358 OP1 G B 12 -8.568 -3.029 6.764 1.00 0.00 O ATOM 359 OP2 G B 12 -6.272 -2.457 7.736 1.00 0.00 O ATOM 360 O5' G B 12 -8.318 -1.202 8.461 1.00 0.00 O ATOM 361 C5' G B 12 -9.715 -0.981 8.568 1.00 0.00 C ATOM 362 C4' G B 12 -9.980 0.477 8.971 1.00 0.00 C ATOM 363 O4' G B 12 -9.371 0.796 10.226 1.00 0.00 O ATOM 364 C3' G B 12 -9.400 1.453 7.965 1.00 0.00 C ATOM 365 O3' G B 12 -10.263 1.649 6.862 1.00 0.00 O ATOM 366 C2' G B 12 -9.299 2.700 8.808 1.00 0.00 C ATOM 367 O2' G B 12 -10.579 3.284 8.951 1.00 0.00 O ATOM 368 C1' G B 12 -8.869 2.142 10.155 1.00 0.00 C ATOM 369 N9 G B 12 -7.398 2.125 10.267 1.00 0.00 N ATOM 370 C8 G B 12 -6.557 1.051 10.222 1.00 0.00 C ATOM 371 N7 G B 12 -5.301 1.348 10.412 1.00 0.00 N ATOM 372 C5 G B 12 -5.309 2.727 10.593 1.00 0.00 C ATOM 373 C6 G B 12 -4.228 3.625 10.841 1.00 0.00 C ATOM 374 O6 G B 12 -3.034 3.366 10.959 1.00 0.00 O ATOM 375 N1 G B 12 -4.667 4.940 10.942 1.00 0.00 N ATOM 376 C2 G B 12 -5.981 5.344 10.839 1.00 0.00 C ATOM 377 N2 G B 12 -6.216 6.655 10.963 1.00 0.00 N ATOM 378 N3 G B 12 -7.000 4.505 10.619 1.00 0.00 N ATOM 379 C4 G B 12 -6.591 3.215 10.502 1.00 0.00 C ATOM 0 H5' G B 12 -10.144 -1.657 9.308 1.00 0.00 H new ATOM 0 H5'' G B 12 -10.201 -1.200 7.617 1.00 0.00 H new ATOM 0 H4' G B 12 -11.065 0.569 9.025 1.00 0.00 H new ATOM 0 H3' G B 12 -8.461 1.127 7.517 1.00 0.00 H new ATOM 0 H2' G B 12 -8.632 3.456 8.393 1.00 0.00 H new ATOM 0 HO2' G B 12 -11.166 2.965 8.234 1.00 0.00 H new ATOM 0 H1' G B 12 -9.258 2.760 10.965 1.00 0.00 H new ATOM 0 H8 G B 12 -6.901 0.043 10.045 1.00 0.00 H new ATOM 0 H1 G B 12 -3.964 5.661 11.105 1.00 0.00 H new ATOM 0 H21 G B 12 -7.170 7.011 10.895 1.00 0.00 H new ATOM 0 H22 G B 12 -5.442 7.299 11.125 1.00 0.00 H new ATOM 391 P U B 13 -9.698 2.207 5.459 1.00 0.00 P ATOM 392 OP1 U B 13 -10.853 2.562 4.606 1.00 0.00 O ATOM 393 OP2 U B 13 -8.690 1.244 4.964 1.00 0.00 O ATOM 394 O5' U B 13 -8.930 3.564 5.860 1.00 0.00 O ATOM 395 C5' U B 13 -9.630 4.755 6.149 1.00 0.00 C ATOM 396 C4' U B 13 -8.624 5.885 6.418 1.00 0.00 C ATOM 397 O4' U B 13 -7.896 5.725 7.642 1.00 0.00 O ATOM 398 C3' U B 13 -7.590 5.999 5.331 1.00 0.00 C ATOM 399 O3' U B 13 -8.095 6.626 4.167 1.00 0.00 O ATOM 400 C2' U B 13 -6.590 6.860 6.053 1.00 0.00 C ATOM 401 O2' U B 13 -7.067 8.186 6.152 1.00 0.00 O ATOM 402 C1' U B 13 -6.567 6.240 7.428 1.00 0.00 C ATOM 403 N1 U B 13 -5.599 5.121 7.484 1.00 0.00 N ATOM 404 C2 U B 13 -4.275 5.399 7.807 1.00 0.00 C ATOM 405 O2 U B 13 -3.866 6.544 7.998 1.00 0.00 O ATOM 406 N3 U B 13 -3.431 4.304 7.906 1.00 0.00 N ATOM 407 C4 U B 13 -3.788 2.979 7.710 1.00 0.00 C ATOM 408 O4 U B 13 -2.957 2.083 7.826 1.00 0.00 O ATOM 409 C5 U B 13 -5.181 2.789 7.373 1.00 0.00 C ATOM 410 C6 U B 13 -6.020 3.845 7.276 1.00 0.00 C ATOM 0 H5' U B 13 -10.273 4.611 7.018 1.00 0.00 H new ATOM 0 H5'' U B 13 -10.278 5.021 5.314 1.00 0.00 H new ATOM 0 H4' U B 13 -9.249 6.777 6.468 1.00 0.00 H new ATOM 0 H3' U B 13 -7.208 5.053 4.948 1.00 0.00 H new ATOM 0 H2' U B 13 -5.619 6.904 5.560 1.00 0.00 H new ATOM 0 HO2' U B 13 -7.809 8.315 5.524 1.00 0.00 H new ATOM 0 H1' U B 13 -6.272 6.970 8.182 1.00 0.00 H new ATOM 0 H3 U B 13 -2.457 4.490 8.145 1.00 0.00 H new ATOM 0 H5 U B 13 -5.556 1.792 7.197 1.00 0.00 H new ATOM 0 H6 U B 13 -7.056 3.670 7.026 1.00 0.00 H new ATOM 421 P C B 14 -7.306 6.513 2.765 1.00 0.00 P ATOM 422 OP1 C B 14 -7.991 7.378 1.778 1.00 0.00 O ATOM 423 OP2 C B 14 -7.105 5.078 2.469 1.00 0.00 O ATOM 424 O5' C B 14 -5.871 7.159 3.090 1.00 0.00 O ATOM 425 C5' C B 14 -5.714 8.553 3.221 1.00 0.00 C ATOM 426 C4' C B 14 -4.266 8.862 3.607 1.00 0.00 C ATOM 427 O4' C B 14 -3.916 8.274 4.860 1.00 0.00 O ATOM 428 C3' C B 14 -3.272 8.305 2.609 1.00 0.00 C ATOM 429 O3' C B 14 -3.168 9.095 1.442 1.00 0.00 O ATOM 430 C2' C B 14 -2.015 8.357 3.440 1.00 0.00 C ATOM 431 O2' C B 14 -1.553 9.689 3.537 1.00 0.00 O ATOM 432 C1' C B 14 -2.526 7.914 4.807 1.00 0.00 C ATOM 433 N1 C B 14 -2.358 6.446 4.951 1.00 0.00 N ATOM 434 C2 C B 14 -1.081 5.986 5.238 1.00 0.00 C ATOM 435 O2 C B 14 -0.164 6.783 5.407 1.00 0.00 O ATOM 436 N3 C B 14 -0.880 4.644 5.323 1.00 0.00 N ATOM 437 C4 C B 14 -1.886 3.783 5.128 1.00 0.00 C ATOM 438 N4 C B 14 -1.638 2.472 5.211 1.00 0.00 N ATOM 439 C5 C B 14 -3.214 4.240 4.843 1.00 0.00 C ATOM 440 C6 C B 14 -3.401 5.576 4.771 1.00 0.00 C ATOM 0 H5' C B 14 -6.395 8.938 3.980 1.00 0.00 H new ATOM 0 H5'' C B 14 -5.967 9.049 2.284 1.00 0.00 H new ATOM 0 H4' C B 14 -4.216 9.950 3.644 1.00 0.00 H new ATOM 0 H3' C B 14 -3.529 7.321 2.216 1.00 0.00 H new ATOM 0 H2' C B 14 -1.198 7.758 3.038 1.00 0.00 H new ATOM 0 HO2' C B 14 -2.007 10.242 2.868 1.00 0.00 H new ATOM 0 H1' C B 14 -1.974 8.390 5.617 1.00 0.00 H new ATOM 0 H41 C B 14 -2.392 1.800 5.066 1.00 0.00 H new ATOM 0 H42 C B 14 -0.695 2.144 5.420 1.00 0.00 H new ATOM 0 H5 C B 14 -4.029 3.547 4.693 1.00 0.00 H new ATOM 0 H6 C B 14 -4.388 5.964 4.568 1.00 0.00 H new ATOM 452 P U B 15 -2.459 8.511 0.113 1.00 0.00 P ATOM 453 OP1 U B 15 -2.456 9.578 -0.913 1.00 0.00 O ATOM 454 OP2 U B 15 -3.079 7.203 -0.193 1.00 0.00 O ATOM 455 O5' U B 15 -0.933 8.244 0.563 1.00 0.00 O ATOM 456 C5' U B 15 -0.021 9.312 0.716 1.00 0.00 C ATOM 457 C4' U B 15 1.362 8.757 1.067 1.00 0.00 C ATOM 458 O4' U B 15 1.347 8.016 2.291 1.00 0.00 O ATOM 459 C3' U B 15 1.866 7.776 0.029 1.00 0.00 C ATOM 460 O3' U B 15 2.343 8.402 -1.147 1.00 0.00 O ATOM 461 C2' U B 15 2.979 7.139 0.813 1.00 0.00 C ATOM 462 O2' U B 15 4.071 8.030 0.898 1.00 0.00 O ATOM 463 C1' U B 15 2.364 7.000 2.197 1.00 0.00 C ATOM 464 N1 U B 15 1.784 5.642 2.378 1.00 0.00 N ATOM 465 C2 U B 15 2.671 4.610 2.653 1.00 0.00 C ATOM 466 O2 U B 15 3.884 4.792 2.729 1.00 0.00 O ATOM 467 N3 U B 15 2.116 3.357 2.840 1.00 0.00 N ATOM 468 C4 U B 15 0.771 3.043 2.772 1.00 0.00 C ATOM 469 O4 U B 15 0.392 1.887 2.942 1.00 0.00 O ATOM 470 C5 U B 15 -0.087 4.176 2.493 1.00 0.00 C ATOM 471 C6 U B 15 0.431 5.416 2.312 1.00 0.00 C ATOM 0 H5' U B 15 -0.363 9.987 1.500 1.00 0.00 H new ATOM 0 H5'' U B 15 0.032 9.894 -0.204 1.00 0.00 H new ATOM 0 H4' U B 15 2.000 9.639 1.132 1.00 0.00 H new ATOM 0 H3' U B 15 1.106 7.096 -0.355 1.00 0.00 H new ATOM 0 H2' U B 15 3.339 6.206 0.379 1.00 0.00 H new ATOM 0 HO2' U B 15 4.795 7.613 1.411 1.00 0.00 H new ATOM 0 H1' U B 15 3.112 7.126 2.980 1.00 0.00 H new ATOM 0 H3 U B 15 2.759 2.593 3.048 1.00 0.00 H new ATOM 0 H5 U B 15 -1.155 4.031 2.428 1.00 0.00 H new ATOM 0 H6 U B 15 -0.234 6.243 2.112 1.00 0.00 H new ATOM 482 P C B 16 2.694 7.527 -2.462 1.00 0.00 P ATOM 483 OP1 C B 16 3.197 8.446 -3.507 1.00 0.00 O ATOM 484 OP2 C B 16 1.534 6.655 -2.750 1.00 0.00 O ATOM 485 O5' C B 16 3.919 6.583 -1.995 1.00 0.00 O ATOM 486 C5' C B 16 5.228 7.099 -1.865 1.00 0.00 C ATOM 487 C4' C B 16 6.183 5.980 -1.437 1.00 0.00 C ATOM 488 O4' C B 16 5.804 5.401 -0.193 1.00 0.00 O ATOM 489 C3' C B 16 6.186 4.819 -2.405 1.00 0.00 C ATOM 490 O3' C B 16 6.891 5.100 -3.595 1.00 0.00 O ATOM 491 C2' C B 16 6.874 3.775 -1.571 1.00 0.00 C ATOM 492 O2' C B 16 8.262 4.035 -1.525 1.00 0.00 O ATOM 493 C1' C B 16 6.265 4.036 -0.193 1.00 0.00 C ATOM 494 N1 C B 16 5.134 3.096 0.034 1.00 0.00 N ATOM 495 C2 C B 16 5.448 1.786 0.378 1.00 0.00 C ATOM 496 O2 C B 16 6.621 1.445 0.511 1.00 0.00 O ATOM 497 N3 C B 16 4.426 0.901 0.557 1.00 0.00 N ATOM 498 C4 C B 16 3.150 1.282 0.402 1.00 0.00 C ATOM 499 N4 C B 16 2.179 0.386 0.599 1.00 0.00 N ATOM 500 C5 C B 16 2.813 2.625 0.037 1.00 0.00 C ATOM 501 C6 C B 16 3.835 3.490 -0.131 1.00 0.00 C ATOM 0 H5' C B 16 5.241 7.903 -1.129 1.00 0.00 H new ATOM 0 H5'' C B 16 5.556 7.528 -2.812 1.00 0.00 H new ATOM 0 H4' C B 16 7.157 6.468 -1.387 1.00 0.00 H new ATOM 0 H3' C B 16 5.198 4.537 -2.769 1.00 0.00 H new ATOM 0 H2' C B 16 6.751 2.756 -1.939 1.00 0.00 H new ATOM 0 HO2' C B 16 8.511 4.614 -2.275 1.00 0.00 H new ATOM 0 HO3' C B 16 6.864 4.317 -4.184 1.00 0.00 H new ATOM 0 H1' C B 16 6.991 3.881 0.605 1.00 0.00 H new ATOM 0 H41 C B 16 1.203 0.659 0.485 1.00 0.00 H new ATOM 0 H42 C B 16 2.414 -0.571 0.863 1.00 0.00 H new ATOM 0 H5 C B 16 1.786 2.932 -0.098 1.00 0.00 H new ATOM 0 H6 C B 16 3.623 4.514 -0.401 1.00 0.00 H new TER 514 C B 16