USER MOD reduce.3.24.130724 H: found=0, std=0, add=155, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 155 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 13 G O2' : rot -6:sc= -4.42! USER MOD Single : A 13 G O5' : rot 41:sc= -0.384 USER MOD Single : A 14 G O2' : rot -14:sc= -0.228 USER MOD Single : A 15 C O2' : rot -2:sc= -1.74! USER MOD Single : A 16 A O2' : rot -2:sc= -5.33! USER MOD Single : A 17 C O2' : rot -17:sc= -3.35! USER MOD Single : A 18 U O2' : rot 175:sc= -6.25! USER MOD Single : A 19 G O2' : rot -16:sc= 0.188 USER MOD Single : A 19 G O3' : rot 180:sc= 0.18 USER MOD Single : B 59 C O2' : rot -13:sc= -2.12! USER MOD Single : B 59 C O5' : rot 42:sc= -3.21! USER MOD Single : B 60 A O2' : rot -17:sc= 0.209 USER MOD Single : B 61 G O2' : rot -152:sc= -1.77! USER MOD Single : B 62 U O2' : rot -15:sc= -2.18! USER MOD Single : B 63 G O2' : rot -5:sc= -0.19 USER MOD Single : B 64 U O2' : rot -19:sc= 0.289 USER MOD Single : B 65 C O2' : rot -16:sc= 0.168 USER MOD Single : B 65 C O3' : rot 180:sc= 0.179 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 13 4.897 -7.210 -5.692 1.00 0.00 O ATOM 2 C5' G A 13 5.152 -8.218 -6.673 1.00 0.00 C ATOM 3 C4' G A 13 3.885 -8.991 -7.027 1.00 0.00 C ATOM 4 O4' G A 13 3.597 -9.996 -6.043 1.00 0.00 O ATOM 5 C3' G A 13 2.671 -8.069 -7.052 1.00 0.00 C ATOM 6 O3' G A 13 2.404 -7.693 -8.403 1.00 0.00 O ATOM 7 C2' G A 13 1.550 -8.970 -6.577 1.00 0.00 C ATOM 8 O2' G A 13 1.031 -9.775 -7.641 1.00 0.00 O ATOM 9 C1' G A 13 2.266 -9.811 -5.537 1.00 0.00 C ATOM 10 N9 G A 13 2.283 -9.121 -4.234 1.00 0.00 N ATOM 11 C8 G A 13 3.040 -8.074 -3.822 1.00 0.00 C ATOM 12 N7 G A 13 2.843 -7.627 -2.628 1.00 0.00 N ATOM 13 C5 G A 13 1.828 -8.472 -2.172 1.00 0.00 C ATOM 14 C6 G A 13 1.162 -8.498 -0.918 1.00 0.00 C ATOM 15 O6 G A 13 1.336 -7.766 0.056 1.00 0.00 O ATOM 16 N1 G A 13 0.207 -9.504 -0.873 1.00 0.00 N ATOM 17 C2 G A 13 -0.078 -10.381 -1.900 1.00 0.00 C ATOM 18 N2 G A 13 -1.033 -11.279 -1.661 1.00 0.00 N ATOM 19 N3 G A 13 0.544 -10.364 -3.082 1.00 0.00 N ATOM 20 C4 G A 13 1.480 -9.391 -3.151 1.00 0.00 C ATOM 0 H5' G A 13 5.907 -8.909 -6.298 1.00 0.00 H new ATOM 0 H5'' G A 13 5.560 -7.756 -7.572 1.00 0.00 H new ATOM 0 H4' G A 13 4.066 -9.437 -8.005 1.00 0.00 H new ATOM 0 H3' G A 13 2.797 -7.165 -6.457 1.00 0.00 H new ATOM 0 H2' G A 13 0.680 -8.435 -6.197 1.00 0.00 H new ATOM 0 HO2' G A 13 1.444 -9.505 -8.487 1.00 0.00 H new ATOM 0 HO5' G A 13 4.287 -7.563 -5.011 1.00 0.00 H new ATOM 0 H1' G A 13 1.767 -10.766 -5.372 1.00 0.00 H new ATOM 0 H8 G A 13 3.781 -7.630 -4.470 1.00 0.00 H new ATOM 0 H1 G A 13 -0.328 -9.603 -0.010 1.00 0.00 H new ATOM 0 H21 G A 13 -1.289 -11.955 -2.381 1.00 0.00 H new ATOM 0 H22 G A 13 -1.508 -11.291 -0.758 1.00 0.00 H new ATOM 33 P G A 14 1.500 -6.399 -8.716 1.00 0.00 P ATOM 34 OP1 G A 14 1.362 -6.274 -10.184 1.00 0.00 O ATOM 35 OP2 G A 14 2.026 -5.265 -7.924 1.00 0.00 O ATOM 36 O5' G A 14 0.068 -6.817 -8.108 1.00 0.00 O ATOM 37 C5' G A 14 -0.684 -7.874 -8.706 1.00 0.00 C ATOM 38 C4' G A 14 -2.110 -7.938 -8.164 1.00 0.00 C ATOM 39 O4' G A 14 -2.186 -8.614 -6.898 1.00 0.00 O ATOM 40 C3' G A 14 -2.665 -6.556 -7.881 1.00 0.00 C ATOM 41 O3' G A 14 -3.198 -5.989 -9.080 1.00 0.00 O ATOM 42 C2' G A 14 -3.806 -6.897 -6.951 1.00 0.00 C ATOM 43 O2' G A 14 -4.915 -7.459 -7.663 1.00 0.00 O ATOM 44 C1' G A 14 -3.139 -7.927 -6.055 1.00 0.00 C ATOM 45 N9 G A 14 -2.476 -7.287 -4.910 1.00 0.00 N ATOM 46 C8 G A 14 -1.234 -6.752 -4.798 1.00 0.00 C ATOM 47 N7 G A 14 -0.888 -6.288 -3.645 1.00 0.00 N ATOM 48 C5 G A 14 -2.035 -6.537 -2.884 1.00 0.00 C ATOM 49 C6 G A 14 -2.297 -6.260 -1.520 1.00 0.00 C ATOM 50 O6 G A 14 -1.552 -5.738 -0.697 1.00 0.00 O ATOM 51 N1 G A 14 -3.577 -6.671 -1.152 1.00 0.00 N ATOM 52 C2 G A 14 -4.488 -7.272 -1.991 1.00 0.00 C ATOM 53 N2 G A 14 -5.666 -7.583 -1.453 1.00 0.00 N ATOM 54 N3 G A 14 -4.247 -7.537 -3.277 1.00 0.00 N ATOM 55 C4 G A 14 -3.009 -7.146 -3.654 1.00 0.00 C ATOM 0 H5' G A 14 -0.183 -8.824 -8.522 1.00 0.00 H new ATOM 0 H5'' G A 14 -0.713 -7.733 -9.786 1.00 0.00 H new ATOM 0 H4' G A 14 -2.669 -8.463 -8.938 1.00 0.00 H new ATOM 0 H3' G A 14 -1.936 -5.847 -7.489 1.00 0.00 H new ATOM 0 H2' G A 14 -4.231 -6.043 -6.423 1.00 0.00 H new ATOM 0 HO2' G A 14 -4.797 -7.308 -8.624 1.00 0.00 H new ATOM 0 H1' G A 14 -3.866 -8.618 -5.629 1.00 0.00 H new ATOM 0 H8 G A 14 -0.561 -6.716 -5.642 1.00 0.00 H new ATOM 0 H1 G A 14 -3.861 -6.514 -0.185 1.00 0.00 H new ATOM 0 H21 G A 14 -6.384 -8.030 -2.022 1.00 0.00 H new ATOM 0 H22 G A 14 -5.850 -7.374 -0.472 1.00 0.00 H new ATOM 67 P C A 15 -3.268 -4.388 -9.232 1.00 0.00 P ATOM 68 OP1 C A 15 -3.973 -4.068 -10.493 1.00 0.00 O ATOM 69 OP2 C A 15 -1.918 -3.836 -8.976 1.00 0.00 O ATOM 70 O5' C A 15 -4.221 -3.990 -7.999 1.00 0.00 O ATOM 71 C5' C A 15 -5.604 -4.336 -8.032 1.00 0.00 C ATOM 72 C4' C A 15 -6.253 -4.227 -6.655 1.00 0.00 C ATOM 73 O4' C A 15 -5.588 -5.042 -5.688 1.00 0.00 O ATOM 74 C3' C A 15 -6.152 -2.837 -6.066 1.00 0.00 C ATOM 75 O3' C A 15 -7.173 -2.002 -6.616 1.00 0.00 O ATOM 76 C2' C A 15 -6.493 -3.128 -4.622 1.00 0.00 C ATOM 77 O2' C A 15 -7.903 -3.309 -4.440 1.00 0.00 O ATOM 78 C1' C A 15 -5.727 -4.426 -4.391 1.00 0.00 C ATOM 79 N1 C A 15 -4.419 -4.147 -3.765 1.00 0.00 N ATOM 80 C2 C A 15 -4.417 -3.896 -2.402 1.00 0.00 C ATOM 81 O2 C A 15 -5.476 -3.877 -1.780 1.00 0.00 O ATOM 82 N3 C A 15 -3.225 -3.660 -1.790 1.00 0.00 N ATOM 83 C4 C A 15 -2.082 -3.669 -2.486 1.00 0.00 C ATOM 84 N4 C A 15 -0.934 -3.434 -1.852 1.00 0.00 N ATOM 85 C5 C A 15 -2.079 -3.923 -3.893 1.00 0.00 C ATOM 86 C6 C A 15 -3.262 -4.152 -4.489 1.00 0.00 C ATOM 0 H5' C A 15 -5.714 -5.354 -8.405 1.00 0.00 H new ATOM 0 H5'' C A 15 -6.125 -3.682 -8.731 1.00 0.00 H new ATOM 0 H4' C A 15 -7.286 -4.526 -6.832 1.00 0.00 H new ATOM 0 H3' C A 15 -5.198 -2.338 -6.237 1.00 0.00 H new ATOM 0 H2' C A 15 -6.232 -2.326 -3.931 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.364 -3.166 -5.293 1.00 0.00 H new ATOM 0 H1' C A 15 -6.250 -5.095 -3.708 1.00 0.00 H new ATOM 0 H41 C A 15 -0.055 -3.438 -2.370 1.00 0.00 H new ATOM 0 H42 C A 15 -0.934 -3.250 -0.849 1.00 0.00 H new ATOM 0 H5 C A 15 -1.158 -3.931 -4.457 1.00 0.00 H new ATOM 0 H6 C A 15 -3.297 -4.342 -5.552 1.00 0.00 H new ATOM 98 P A A 16 -7.045 -0.400 -6.507 1.00 0.00 P ATOM 99 OP1 A A 16 -8.263 0.203 -7.094 1.00 0.00 O ATOM 100 OP2 A A 16 -5.711 -0.006 -7.014 1.00 0.00 O ATOM 101 O5' A A 16 -7.073 -0.150 -4.915 1.00 0.00 O ATOM 102 C5' A A 16 -8.279 -0.358 -4.175 1.00 0.00 C ATOM 103 C4' A A 16 -8.069 -0.204 -2.668 1.00 0.00 C ATOM 104 O4' A A 16 -7.095 -1.122 -2.161 1.00 0.00 O ATOM 105 C3' A A 16 -7.517 1.159 -2.306 1.00 0.00 C ATOM 106 O3' A A 16 -8.594 2.088 -2.180 1.00 0.00 O ATOM 107 C2' A A 16 -6.950 0.896 -0.926 1.00 0.00 C ATOM 108 O2' A A 16 -7.974 0.910 0.074 1.00 0.00 O ATOM 109 C1' A A 16 -6.356 -0.489 -1.095 1.00 0.00 C ATOM 110 N9 A A 16 -4.918 -0.408 -1.409 1.00 0.00 N ATOM 111 C8 A A 16 -4.272 -0.618 -2.572 1.00 0.00 C ATOM 112 N7 A A 16 -2.984 -0.585 -2.560 1.00 0.00 N ATOM 113 C5 A A 16 -2.731 -0.307 -1.219 1.00 0.00 C ATOM 114 C6 A A 16 -1.550 -0.131 -0.497 1.00 0.00 C ATOM 115 N6 A A 16 -0.342 -0.264 -1.050 1.00 0.00 N ATOM 116 N1 A A 16 -1.669 0.142 0.815 1.00 0.00 N ATOM 117 C2 A A 16 -2.881 0.230 1.376 1.00 0.00 C ATOM 118 N3 A A 16 -4.052 0.075 0.786 1.00 0.00 N ATOM 119 C4 A A 16 -3.907 -0.193 -0.517 1.00 0.00 C ATOM 0 H5' A A 16 -8.665 -1.355 -4.386 1.00 0.00 H new ATOM 0 H5'' A A 16 -9.035 0.353 -4.509 1.00 0.00 H new ATOM 0 H4' A A 16 -9.057 -0.376 -2.241 1.00 0.00 H new ATOM 0 H3' A A 16 -6.808 1.562 -3.030 1.00 0.00 H new ATOM 0 H2' A A 16 -6.233 1.646 -0.593 1.00 0.00 H new ATOM 0 HO2' A A 16 -8.835 1.124 -0.342 1.00 0.00 H new ATOM 0 H1' A A 16 -6.435 -1.069 -0.175 1.00 0.00 H new ATOM 0 H8 A A 16 -4.816 -0.808 -3.485 1.00 0.00 H new ATOM 0 H61 A A 16 0.496 -0.126 -0.485 1.00 0.00 H new ATOM 0 H62 A A 16 -0.257 -0.503 -2.038 1.00 0.00 H new ATOM 0 H2 A A 16 -2.904 0.453 2.432 1.00 0.00 H new ATOM 131 P C A 17 -8.296 3.669 -2.214 1.00 0.00 P ATOM 132 OP1 C A 17 -9.572 4.386 -1.995 1.00 0.00 O ATOM 133 OP2 C A 17 -7.480 3.962 -3.412 1.00 0.00 O ATOM 134 O5' C A 17 -7.371 3.871 -0.909 1.00 0.00 O ATOM 135 C5' C A 17 -7.879 3.552 0.388 1.00 0.00 C ATOM 136 C4' C A 17 -6.816 3.699 1.474 1.00 0.00 C ATOM 137 O4' C A 17 -5.770 2.739 1.352 1.00 0.00 O ATOM 138 C3' C A 17 -6.116 5.036 1.393 1.00 0.00 C ATOM 139 O3' C A 17 -6.897 6.000 2.103 1.00 0.00 O ATOM 140 C2' C A 17 -4.846 4.773 2.177 1.00 0.00 C ATOM 141 O2' C A 17 -5.058 4.929 3.585 1.00 0.00 O ATOM 142 C1' C A 17 -4.538 3.323 1.819 1.00 0.00 C ATOM 143 N1 C A 17 -3.507 3.244 0.778 1.00 0.00 N ATOM 144 C2 C A 17 -2.188 3.219 1.184 1.00 0.00 C ATOM 145 O2 C A 17 -1.914 3.289 2.379 1.00 0.00 O ATOM 146 N3 C A 17 -1.224 3.116 0.226 1.00 0.00 N ATOM 147 C4 C A 17 -1.555 3.045 -1.071 1.00 0.00 C ATOM 148 N4 C A 17 -0.597 2.933 -1.991 1.00 0.00 N ATOM 149 C5 C A 17 -2.922 3.077 -1.478 1.00 0.00 C ATOM 150 C6 C A 17 -3.852 3.177 -0.531 1.00 0.00 C ATOM 0 H5' C A 17 -8.257 2.530 0.387 1.00 0.00 H new ATOM 0 H5'' C A 17 -8.723 4.203 0.617 1.00 0.00 H new ATOM 0 H4' C A 17 -7.365 3.573 2.407 1.00 0.00 H new ATOM 0 H3' C A 17 -5.953 5.401 0.379 1.00 0.00 H new ATOM 0 H2' C A 17 -4.037 5.463 1.939 1.00 0.00 H new ATOM 0 HO2' C A 17 -5.886 5.430 3.738 1.00 0.00 H new ATOM 0 H1' C A 17 -4.153 2.788 2.687 1.00 0.00 H new ATOM 0 H41 C A 17 -0.843 2.879 -2.979 1.00 0.00 H new ATOM 0 H42 C A 17 0.382 2.902 -1.707 1.00 0.00 H new ATOM 0 H5 C A 17 -3.194 3.022 -2.522 1.00 0.00 H new ATOM 0 H6 C A 17 -4.895 3.205 -0.809 1.00 0.00 H new ATOM 162 P U A 18 -6.842 7.555 1.691 1.00 0.00 P ATOM 163 OP1 U A 18 -7.691 8.314 2.636 1.00 0.00 O ATOM 164 OP2 U A 18 -7.084 7.657 0.235 1.00 0.00 O ATOM 165 O5' U A 18 -5.305 7.933 1.974 1.00 0.00 O ATOM 166 C5' U A 18 -4.750 7.797 3.285 1.00 0.00 C ATOM 167 C4' U A 18 -3.267 8.143 3.296 1.00 0.00 C ATOM 168 O4' U A 18 -2.488 7.103 2.709 1.00 0.00 O ATOM 169 C3' U A 18 -3.006 9.383 2.457 1.00 0.00 C ATOM 170 O3' U A 18 -2.799 10.490 3.336 1.00 0.00 O ATOM 171 C2' U A 18 -1.705 9.122 1.722 1.00 0.00 C ATOM 172 O2' U A 18 -0.663 9.987 2.176 1.00 0.00 O ATOM 173 C1' U A 18 -1.372 7.667 2.008 1.00 0.00 C ATOM 174 N1 U A 18 -1.120 6.965 0.744 1.00 0.00 N ATOM 175 C2 U A 18 0.194 6.819 0.352 1.00 0.00 C ATOM 176 O2 U A 18 1.129 7.235 1.032 1.00 0.00 O ATOM 177 N3 U A 18 0.400 6.180 -0.854 1.00 0.00 N ATOM 178 C4 U A 18 -0.584 5.678 -1.690 1.00 0.00 C ATOM 179 O4 U A 18 -0.279 5.127 -2.747 1.00 0.00 O ATOM 180 C5 U A 18 -1.934 5.876 -1.197 1.00 0.00 C ATOM 181 C6 U A 18 -2.154 6.506 -0.017 1.00 0.00 C ATOM 0 H5' U A 18 -4.890 6.775 3.637 1.00 0.00 H new ATOM 0 H5'' U A 18 -5.283 8.449 3.977 1.00 0.00 H new ATOM 0 H4' U A 18 -2.992 8.294 4.340 1.00 0.00 H new ATOM 0 H3' U A 18 -3.832 9.595 1.778 1.00 0.00 H new ATOM 0 H2' U A 18 -1.803 9.316 0.654 1.00 0.00 H new ATOM 0 HO2' U A 18 0.178 9.745 1.736 1.00 0.00 H new ATOM 0 H1' U A 18 -0.473 7.574 2.618 1.00 0.00 H new ATOM 0 H3 U A 18 1.367 6.067 -1.158 1.00 0.00 H new ATOM 0 H5 U A 18 -2.772 5.518 -1.776 1.00 0.00 H new ATOM 0 H6 U A 18 -3.168 6.647 0.327 1.00 0.00 H new ATOM 192 P G A 19 -2.718 11.990 2.753 1.00 0.00 P ATOM 193 OP1 G A 19 -2.995 12.935 3.858 1.00 0.00 O ATOM 194 OP2 G A 19 -3.514 12.050 1.508 1.00 0.00 O ATOM 195 O5' G A 19 -1.155 12.105 2.365 1.00 0.00 O ATOM 196 C5' G A 19 -0.174 12.195 3.403 1.00 0.00 C ATOM 197 C4' G A 19 1.252 11.964 2.894 1.00 0.00 C ATOM 198 O4' G A 19 1.428 10.653 2.368 1.00 0.00 O ATOM 199 C3' G A 19 1.609 12.872 1.738 1.00 0.00 C ATOM 200 O3' G A 19 1.925 14.198 2.181 1.00 0.00 O ATOM 201 C2' G A 19 2.832 12.157 1.176 1.00 0.00 C ATOM 202 O2' G A 19 4.029 12.547 1.858 1.00 0.00 O ATOM 203 C1' G A 19 2.505 10.683 1.418 1.00 0.00 C ATOM 204 N9 G A 19 2.129 10.028 0.153 1.00 0.00 N ATOM 205 C8 G A 19 0.905 9.725 -0.323 1.00 0.00 C ATOM 206 N7 G A 19 0.832 9.117 -1.458 1.00 0.00 N ATOM 207 C5 G A 19 2.182 8.997 -1.799 1.00 0.00 C ATOM 208 C6 G A 19 2.780 8.416 -2.947 1.00 0.00 C ATOM 209 O6 G A 19 2.230 7.875 -3.903 1.00 0.00 O ATOM 210 N1 G A 19 4.164 8.509 -2.899 1.00 0.00 N ATOM 211 C2 G A 19 4.890 9.090 -1.878 1.00 0.00 C ATOM 212 N2 G A 19 6.214 9.100 -2.027 1.00 0.00 N ATOM 213 N3 G A 19 4.333 9.637 -0.792 1.00 0.00 N ATOM 214 C4 G A 19 2.984 9.557 -0.817 1.00 0.00 C ATOM 0 H5' G A 19 -0.402 11.462 4.177 1.00 0.00 H new ATOM 0 H5'' G A 19 -0.234 13.179 3.869 1.00 0.00 H new ATOM 0 H4' G A 19 1.876 12.149 3.769 1.00 0.00 H new ATOM 0 H3' G A 19 0.804 13.020 1.018 1.00 0.00 H new ATOM 0 H2' G A 19 3.020 12.389 0.128 1.00 0.00 H new ATOM 0 HO2' G A 19 3.862 13.366 2.370 1.00 0.00 H new ATOM 0 HO3' G A 19 2.152 14.756 1.408 1.00 0.00 H new ATOM 0 H1' G A 19 3.367 10.140 1.805 1.00 0.00 H new ATOM 0 H8 G A 19 0.013 9.983 0.229 1.00 0.00 H new ATOM 0 H1 G A 19 4.687 8.116 -3.681 1.00 0.00 H new ATOM 0 H21 G A 19 6.805 9.515 -1.307 1.00 0.00 H new ATOM 0 H22 G A 19 6.636 8.693 -2.861 1.00 0.00 H new TER 227 G A 19 ATOM 228 O5' C B 59 8.519 4.744 -8.004 1.00 0.00 O ATOM 229 C5' C B 59 9.941 4.647 -8.059 1.00 0.00 C ATOM 230 C4' C B 59 10.626 5.567 -7.042 1.00 0.00 C ATOM 231 O4' C B 59 10.196 6.934 -7.194 1.00 0.00 O ATOM 232 C3' C B 59 10.262 5.190 -5.608 1.00 0.00 C ATOM 233 O3' C B 59 11.301 4.368 -5.071 1.00 0.00 O ATOM 234 C2' C B 59 10.297 6.527 -4.896 1.00 0.00 C ATOM 235 O2' C B 59 11.638 6.930 -4.592 1.00 0.00 O ATOM 236 C1' C B 59 9.668 7.414 -5.944 1.00 0.00 C ATOM 237 N1 C B 59 8.201 7.288 -5.910 1.00 0.00 N ATOM 238 C2 C B 59 7.514 7.889 -4.869 1.00 0.00 C ATOM 239 O2 C B 59 8.123 8.531 -4.015 1.00 0.00 O ATOM 240 N3 C B 59 6.159 7.737 -4.821 1.00 0.00 N ATOM 241 C4 C B 59 5.516 7.022 -5.757 1.00 0.00 C ATOM 242 N4 C B 59 4.191 6.893 -5.692 1.00 0.00 N ATOM 243 C5 C B 59 6.236 6.403 -6.827 1.00 0.00 C ATOM 244 C6 C B 59 7.560 6.568 -6.859 1.00 0.00 C ATOM 0 H5' C B 59 10.282 4.901 -9.063 1.00 0.00 H new ATOM 0 H5'' C B 59 10.240 3.616 -7.872 1.00 0.00 H new ATOM 0 H4' C B 59 11.695 5.457 -7.227 1.00 0.00 H new ATOM 0 H3' C B 59 9.315 4.659 -5.518 1.00 0.00 H new ATOM 0 H2' C B 59 9.793 6.541 -3.930 1.00 0.00 H new ATOM 0 HO2' C B 59 12.245 6.172 -4.723 1.00 0.00 H new ATOM 0 HO5' C B 59 8.259 5.684 -7.907 1.00 0.00 H new ATOM 0 H1' C B 59 9.891 8.469 -5.785 1.00 0.00 H new ATOM 0 H41 C B 59 3.696 6.351 -6.400 1.00 0.00 H new ATOM 0 H42 C B 59 3.672 7.336 -4.934 1.00 0.00 H new ATOM 0 H5 C B 59 5.726 5.823 -7.582 1.00 0.00 H new ATOM 0 H6 C B 59 8.131 6.118 -7.658 1.00 0.00 H new ATOM 257 P A B 60 10.966 3.277 -3.937 1.00 0.00 P ATOM 258 OP1 A B 60 12.234 2.640 -3.518 1.00 0.00 O ATOM 259 OP2 A B 60 9.843 2.441 -4.417 1.00 0.00 O ATOM 260 O5' A B 60 10.433 4.190 -2.722 1.00 0.00 O ATOM 261 C5' A B 60 11.282 5.177 -2.130 1.00 0.00 C ATOM 262 C4' A B 60 10.572 5.931 -1.008 1.00 0.00 C ATOM 263 O4' A B 60 9.623 6.884 -1.513 1.00 0.00 O ATOM 264 C3' A B 60 9.752 4.991 -0.146 1.00 0.00 C ATOM 265 O3' A B 60 10.597 4.436 0.868 1.00 0.00 O ATOM 266 C2' A B 60 8.774 5.956 0.491 1.00 0.00 C ATOM 267 O2' A B 60 9.382 6.693 1.559 1.00 0.00 O ATOM 268 C1' A B 60 8.438 6.857 -0.689 1.00 0.00 C ATOM 269 N9 A B 60 7.274 6.339 -1.439 1.00 0.00 N ATOM 270 C8 A B 60 7.222 5.594 -2.575 1.00 0.00 C ATOM 271 N7 A B 60 6.055 5.263 -3.018 1.00 0.00 N ATOM 272 C5 A B 60 5.215 5.857 -2.071 1.00 0.00 C ATOM 273 C6 A B 60 3.823 5.901 -1.934 1.00 0.00 C ATOM 274 N6 A B 60 2.987 5.307 -2.790 1.00 0.00 N ATOM 275 N1 A B 60 3.327 6.579 -0.881 1.00 0.00 N ATOM 276 C2 A B 60 4.150 7.179 -0.014 1.00 0.00 C ATOM 277 N3 A B 60 5.478 7.196 -0.049 1.00 0.00 N ATOM 278 C4 A B 60 5.950 6.512 -1.109 1.00 0.00 C ATOM 0 H5' A B 60 11.608 5.883 -2.894 1.00 0.00 H new ATOM 0 H5'' A B 60 12.178 4.698 -1.736 1.00 0.00 H new ATOM 0 H4' A B 60 11.369 6.419 -0.447 1.00 0.00 H new ATOM 0 H3' A B 60 9.289 4.161 -0.681 1.00 0.00 H new ATOM 0 H2' A B 60 7.909 5.478 0.950 1.00 0.00 H new ATOM 0 HO2' A B 60 10.207 6.243 1.839 1.00 0.00 H new ATOM 0 H1' A B 60 8.162 7.859 -0.360 1.00 0.00 H new ATOM 0 H8 A B 60 8.123 5.290 -3.088 1.00 0.00 H new ATOM 0 H61 A B 60 1.979 5.369 -2.645 1.00 0.00 H new ATOM 0 H62 A B 60 3.356 4.791 -3.589 1.00 0.00 H new ATOM 0 H2 A B 60 3.684 7.708 0.804 1.00 0.00 H new ATOM 290 P G B 61 10.466 2.878 1.265 1.00 0.00 P ATOM 291 OP1 G B 61 11.632 2.512 2.100 1.00 0.00 O ATOM 292 OP2 G B 61 10.169 2.111 0.035 1.00 0.00 O ATOM 293 O5' G B 61 9.155 2.861 2.197 1.00 0.00 O ATOM 294 C5' G B 61 9.211 3.374 3.528 1.00 0.00 C ATOM 295 C4' G B 61 7.817 3.549 4.122 1.00 0.00 C ATOM 296 O4' G B 61 7.034 4.443 3.330 1.00 0.00 O ATOM 297 C3' G B 61 7.038 2.244 4.137 1.00 0.00 C ATOM 298 O3' G B 61 7.227 1.603 5.402 1.00 0.00 O ATOM 299 C2' G B 61 5.592 2.686 4.050 1.00 0.00 C ATOM 300 O2' G B 61 5.012 2.853 5.347 1.00 0.00 O ATOM 301 C1' G B 61 5.667 4.003 3.295 1.00 0.00 C ATOM 302 N9 G B 61 5.188 3.804 1.918 1.00 0.00 N ATOM 303 C8 G B 61 5.877 3.601 0.766 1.00 0.00 C ATOM 304 N7 G B 61 5.194 3.416 -0.314 1.00 0.00 N ATOM 305 C5 G B 61 3.882 3.499 0.165 1.00 0.00 C ATOM 306 C6 G B 61 2.649 3.377 -0.525 1.00 0.00 C ATOM 307 O6 G B 61 2.461 3.170 -1.722 1.00 0.00 O ATOM 308 N1 G B 61 1.569 3.523 0.338 1.00 0.00 N ATOM 309 C2 G B 61 1.661 3.757 1.694 1.00 0.00 C ATOM 310 N2 G B 61 0.512 3.856 2.353 1.00 0.00 N ATOM 311 N3 G B 61 2.813 3.875 2.347 1.00 0.00 N ATOM 312 C4 G B 61 3.878 3.736 1.530 1.00 0.00 C ATOM 0 H5' G B 61 9.730 4.333 3.527 1.00 0.00 H new ATOM 0 H5'' G B 61 9.792 2.698 4.155 1.00 0.00 H new ATOM 0 H4' G B 61 7.976 3.925 5.133 1.00 0.00 H new ATOM 0 H3' G B 61 7.340 1.561 3.343 1.00 0.00 H new ATOM 0 H2' G B 61 4.957 1.952 3.554 1.00 0.00 H new ATOM 0 HO2' G B 61 4.046 2.695 5.296 1.00 0.00 H new ATOM 0 H1' G B 61 5.035 4.766 3.750 1.00 0.00 H new ATOM 0 H8 G B 61 6.957 3.594 0.753 1.00 0.00 H new ATOM 0 H1 G B 61 0.634 3.451 -0.064 1.00 0.00 H new ATOM 0 H21 G B 61 0.514 4.029 3.358 1.00 0.00 H new ATOM 0 H22 G B 61 -0.372 3.759 1.854 1.00 0.00 H new ATOM 324 P U B 62 6.722 0.089 5.628 1.00 0.00 P ATOM 325 OP1 U B 62 7.443 -0.476 6.792 1.00 0.00 O ATOM 326 OP2 U B 62 6.753 -0.614 4.326 1.00 0.00 O ATOM 327 O5' U B 62 5.181 0.319 6.047 1.00 0.00 O ATOM 328 C5' U B 62 4.884 0.979 7.280 1.00 0.00 C ATOM 329 C4' U B 62 3.428 1.441 7.373 1.00 0.00 C ATOM 330 O4' U B 62 3.074 2.290 6.275 1.00 0.00 O ATOM 331 C3' U B 62 2.428 0.301 7.296 1.00 0.00 C ATOM 332 O3' U B 62 2.235 -0.263 8.595 1.00 0.00 O ATOM 333 C2' U B 62 1.176 1.060 6.917 1.00 0.00 C ATOM 334 O2' U B 62 0.647 1.797 8.026 1.00 0.00 O ATOM 335 C1' U B 62 1.733 1.977 5.849 1.00 0.00 C ATOM 336 N1 U B 62 1.739 1.294 4.550 1.00 0.00 N ATOM 337 C2 U B 62 0.543 1.195 3.863 1.00 0.00 C ATOM 338 O2 U B 62 -0.516 1.612 4.328 1.00 0.00 O ATOM 339 N3 U B 62 0.605 0.578 2.626 1.00 0.00 N ATOM 340 C4 U B 62 1.747 0.069 2.030 1.00 0.00 C ATOM 341 O4 U B 62 1.698 -0.439 0.912 1.00 0.00 O ATOM 342 C5 U B 62 2.944 0.214 2.833 1.00 0.00 C ATOM 343 C6 U B 62 2.899 0.806 4.044 1.00 0.00 C ATOM 0 H5' U B 62 5.541 1.841 7.392 1.00 0.00 H new ATOM 0 H5'' U B 62 5.099 0.304 8.108 1.00 0.00 H new ATOM 0 H4' U B 62 3.378 1.946 8.338 1.00 0.00 H new ATOM 0 H3' U B 62 2.715 -0.510 6.626 1.00 0.00 H new ATOM 0 H2' U B 62 0.342 0.436 6.595 1.00 0.00 H new ATOM 0 HO2' U B 62 1.056 1.477 8.857 1.00 0.00 H new ATOM 0 H1' U B 62 1.134 2.880 5.726 1.00 0.00 H new ATOM 0 H3 U B 62 -0.268 0.490 2.107 1.00 0.00 H new ATOM 0 H5 U B 62 3.886 -0.157 2.457 1.00 0.00 H new ATOM 0 H6 U B 62 3.806 0.893 4.623 1.00 0.00 H new ATOM 354 P G B 63 1.666 -1.763 8.739 1.00 0.00 P ATOM 355 OP1 G B 63 1.475 -2.049 10.179 1.00 0.00 O ATOM 356 OP2 G B 63 2.506 -2.659 7.915 1.00 0.00 O ATOM 357 O5' G B 63 0.212 -1.657 8.049 1.00 0.00 O ATOM 358 C5' G B 63 -0.796 -0.810 8.608 1.00 0.00 C ATOM 359 C4' G B 63 -2.120 -0.916 7.851 1.00 0.00 C ATOM 360 O4' G B 63 -2.080 -0.239 6.590 1.00 0.00 O ATOM 361 C3' G B 63 -2.458 -2.353 7.505 1.00 0.00 C ATOM 362 O3' G B 63 -3.149 -2.929 8.614 1.00 0.00 O ATOM 363 C2' G B 63 -3.433 -2.167 6.358 1.00 0.00 C ATOM 364 O2' G B 63 -4.745 -1.835 6.825 1.00 0.00 O ATOM 365 C1' G B 63 -2.799 -1.014 5.609 1.00 0.00 C ATOM 366 N9 G B 63 -1.894 -1.511 4.557 1.00 0.00 N ATOM 367 C8 G B 63 -0.546 -1.619 4.562 1.00 0.00 C ATOM 368 N7 G B 63 0.029 -2.023 3.483 1.00 0.00 N ATOM 369 C5 G B 63 -1.064 -2.224 2.641 1.00 0.00 C ATOM 370 C6 G B 63 -1.100 -2.672 1.299 1.00 0.00 C ATOM 371 O6 G B 63 -0.156 -2.979 0.574 1.00 0.00 O ATOM 372 N1 G B 63 -2.400 -2.740 0.820 1.00 0.00 N ATOM 373 C2 G B 63 -3.533 -2.419 1.540 1.00 0.00 C ATOM 374 N2 G B 63 -4.696 -2.573 0.910 1.00 0.00 N ATOM 375 N3 G B 63 -3.509 -1.992 2.806 1.00 0.00 N ATOM 376 C4 G B 63 -2.248 -1.917 3.293 1.00 0.00 C ATOM 0 H5' G B 63 -0.451 0.224 8.591 1.00 0.00 H new ATOM 0 H5'' G B 63 -0.954 -1.076 9.653 1.00 0.00 H new ATOM 0 H4' G B 63 -2.855 -0.472 8.523 1.00 0.00 H new ATOM 0 H3' G B 63 -1.602 -2.985 7.269 1.00 0.00 H new ATOM 0 H2' G B 63 -3.582 -3.062 5.754 1.00 0.00 H new ATOM 0 HO2' G B 63 -4.762 -1.871 7.804 1.00 0.00 H new ATOM 0 H1' G B 63 -3.552 -0.405 5.109 1.00 0.00 H new ATOM 0 H8 G B 63 0.030 -1.374 5.442 1.00 0.00 H new ATOM 0 H1 G B 63 -2.529 -3.053 -0.142 1.00 0.00 H new ATOM 0 H21 G B 63 -5.569 -2.352 1.389 1.00 0.00 H new ATOM 0 H22 G B 63 -4.714 -2.912 -0.052 1.00 0.00 H new ATOM 388 P U B 64 -2.863 -4.451 9.044 1.00 0.00 P ATOM 389 OP1 U B 64 -3.467 -4.679 10.377 1.00 0.00 O ATOM 390 OP2 U B 64 -1.427 -4.735 8.825 1.00 0.00 O ATOM 391 O5' U B 64 -3.712 -5.275 7.957 1.00 0.00 O ATOM 392 C5' U B 64 -5.111 -5.031 7.804 1.00 0.00 C ATOM 393 C4' U B 64 -5.667 -5.735 6.574 1.00 0.00 C ATOM 394 O4' U B 64 -5.423 -4.995 5.374 1.00 0.00 O ATOM 395 C3' U B 64 -4.981 -7.068 6.356 1.00 0.00 C ATOM 396 O3' U B 64 -5.672 -8.070 7.106 1.00 0.00 O ATOM 397 C2' U B 64 -5.223 -7.307 4.882 1.00 0.00 C ATOM 398 O2' U B 64 -6.518 -7.870 4.646 1.00 0.00 O ATOM 399 C1' U B 64 -5.112 -5.907 4.304 1.00 0.00 C ATOM 400 N1 U B 64 -3.767 -5.650 3.753 1.00 0.00 N ATOM 401 C2 U B 64 -3.598 -5.846 2.395 1.00 0.00 C ATOM 402 O2 U B 64 -4.511 -6.246 1.675 1.00 0.00 O ATOM 403 N3 U B 64 -2.341 -5.572 1.891 1.00 0.00 N ATOM 404 C4 U B 64 -1.249 -5.128 2.620 1.00 0.00 C ATOM 405 O4 U B 64 -0.172 -4.912 2.068 1.00 0.00 O ATOM 406 C5 U B 64 -1.516 -4.955 4.033 1.00 0.00 C ATOM 407 C6 U B 64 -2.739 -5.214 4.547 1.00 0.00 C ATOM 0 H5' U B 64 -5.288 -3.959 7.722 1.00 0.00 H new ATOM 0 H5'' U B 64 -5.641 -5.375 8.692 1.00 0.00 H new ATOM 0 H4' U B 64 -6.735 -5.843 6.763 1.00 0.00 H new ATOM 0 H3' U B 64 -3.931 -7.088 6.649 1.00 0.00 H new ATOM 0 H2' U B 64 -4.527 -8.019 4.437 1.00 0.00 H new ATOM 0 HO2' U B 64 -6.862 -8.259 5.477 1.00 0.00 H new ATOM 0 H1' U B 64 -5.803 -5.780 3.471 1.00 0.00 H new ATOM 0 H3 U B 64 -2.204 -5.709 0.890 1.00 0.00 H new ATOM 0 H5 U B 64 -0.726 -4.614 4.686 1.00 0.00 H new ATOM 0 H6 U B 64 -2.909 -5.075 5.604 1.00 0.00 H new ATOM 418 P C B 65 -4.846 -9.235 7.851 1.00 0.00 P ATOM 419 OP1 C B 65 -5.764 -9.932 8.778 1.00 0.00 O ATOM 420 OP2 C B 65 -3.582 -8.655 8.359 1.00 0.00 O ATOM 421 O5' C B 65 -4.491 -10.237 6.643 1.00 0.00 O ATOM 422 C5' C B 65 -5.521 -11.013 6.029 1.00 0.00 C ATOM 423 C4' C B 65 -5.026 -11.732 4.778 1.00 0.00 C ATOM 424 O4' C B 65 -4.809 -10.825 3.700 1.00 0.00 O ATOM 425 C3' C B 65 -3.691 -12.411 5.013 1.00 0.00 C ATOM 426 O3' C B 65 -3.853 -13.700 5.618 1.00 0.00 O ATOM 427 C2' C B 65 -3.150 -12.522 3.599 1.00 0.00 C ATOM 428 O2' C B 65 -3.655 -13.685 2.933 1.00 0.00 O ATOM 429 C1' C B 65 -3.661 -11.239 2.947 1.00 0.00 C ATOM 430 N1 C B 65 -2.633 -10.194 2.969 1.00 0.00 N ATOM 431 C2 C B 65 -1.807 -10.078 1.867 1.00 0.00 C ATOM 432 O2 C B 65 -1.926 -10.855 0.923 1.00 0.00 O ATOM 433 N3 C B 65 -0.875 -9.087 1.864 1.00 0.00 N ATOM 434 C4 C B 65 -0.766 -8.244 2.902 1.00 0.00 C ATOM 435 N4 C B 65 0.177 -7.300 2.882 1.00 0.00 N ATOM 436 C5 C B 65 -1.631 -8.365 4.038 1.00 0.00 C ATOM 437 C6 C B 65 -2.535 -9.354 4.028 1.00 0.00 C ATOM 0 H5' C B 65 -6.357 -10.364 5.767 1.00 0.00 H new ATOM 0 H5'' C B 65 -5.898 -11.745 6.743 1.00 0.00 H new ATOM 0 H4' C B 65 -5.804 -12.457 4.538 1.00 0.00 H new ATOM 0 H3' C B 65 -3.035 -11.871 5.696 1.00 0.00 H new ATOM 0 H2' C B 65 -2.066 -12.627 3.558 1.00 0.00 H new ATOM 0 HO2' C B 65 -4.030 -14.304 3.594 1.00 0.00 H new ATOM 0 HO3' C B 65 -2.974 -14.110 5.754 1.00 0.00 H new ATOM 0 H1' C B 65 -3.915 -11.413 1.902 1.00 0.00 H new ATOM 0 H41 C B 65 0.269 -6.654 3.666 1.00 0.00 H new ATOM 0 H42 C B 65 0.806 -7.225 2.083 1.00 0.00 H new ATOM 0 H5 C B 65 -1.557 -7.683 4.872 1.00 0.00 H new ATOM 0 H6 C B 65 -3.194 -9.483 4.874 1.00 0.00 H new TER 450 C B 65