USER MOD reduce.3.24.130724 H: found=0, std=0, add=147, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 147 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 DG O5' : rot 30:sc= 0.00312 USER MOD Single : A 4 DT C7 :methyl 150:sc= -0.379 (180deg=-0.379) USER MOD Single : A 11 DT C7 :methyl -30:sc= -0.13 (180deg=-0.202) USER MOD Single : A 13 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -4.137 9.292 11.382 1.00 0.00 O ATOM 2 C5' DG A 1 -5.245 8.583 11.897 1.00 0.00 C ATOM 3 C4' DG A 1 -5.419 7.238 11.183 1.00 0.00 C ATOM 4 O4' DG A 1 -5.653 7.468 9.802 1.00 0.00 O ATOM 5 C3' DG A 1 -4.187 6.325 11.299 1.00 0.00 C ATOM 6 O3' DG A 1 -4.623 5.009 11.603 1.00 0.00 O ATOM 7 C2' DG A 1 -3.582 6.428 9.901 1.00 0.00 C ATOM 8 C1' DG A 1 -4.849 6.567 9.067 1.00 0.00 C ATOM 9 N9 DG A 1 -4.568 7.082 7.710 1.00 0.00 N ATOM 10 C8 DG A 1 -3.958 8.256 7.346 1.00 0.00 C ATOM 11 N7 DG A 1 -3.842 8.421 6.058 1.00 0.00 N ATOM 12 C5 DG A 1 -4.425 7.279 5.521 1.00 0.00 C ATOM 13 C6 DG A 1 -4.593 6.885 4.160 1.00 0.00 C ATOM 14 O6 DG A 1 -4.240 7.489 3.150 1.00 0.00 O ATOM 15 N1 DG A 1 -5.238 5.657 4.038 1.00 0.00 N ATOM 16 C2 DG A 1 -5.656 4.882 5.105 1.00 0.00 C ATOM 17 N2 DG A 1 -6.206 3.696 4.825 1.00 0.00 N ATOM 18 N3 DG A 1 -5.498 5.252 6.384 1.00 0.00 N ATOM 19 C4 DG A 1 -4.878 6.455 6.526 1.00 0.00 C ATOM 0 H5' DG A 1 -6.149 9.180 11.780 1.00 0.00 H new ATOM 0 H5'' DG A 1 -5.109 8.416 12.966 1.00 0.00 H new ATOM 0 H4' DG A 1 -6.259 6.739 11.666 1.00 0.00 H new ATOM 0 H3' DG A 1 -3.473 6.592 12.078 1.00 0.00 H new ATOM 0 H2' DG A 1 -2.920 7.287 9.797 1.00 0.00 H new ATOM 0 H2'' DG A 1 -3.003 5.545 9.633 1.00 0.00 H new ATOM 0 HO5' DG A 1 -4.011 9.061 10.438 1.00 0.00 H new ATOM 0 H1' DG A 1 -5.336 5.605 8.906 1.00 0.00 H new ATOM 0 H8 DG A 1 -3.605 8.981 8.064 1.00 0.00 H new ATOM 0 H1 DG A 1 -5.414 5.305 3.097 1.00 0.00 H new ATOM 0 H21 DG A 1 -6.528 3.092 5.581 1.00 0.00 H new ATOM 0 H22 DG A 1 -6.303 3.395 3.855 1.00 0.00 H new ATOM 32 P DC A 2 -3.595 3.773 11.788 1.00 0.00 P ATOM 33 OP1 DC A 2 -4.176 2.839 12.776 1.00 0.00 O ATOM 34 OP2 DC A 2 -2.238 4.321 12.006 1.00 0.00 O ATOM 35 O5' DC A 2 -3.624 3.062 10.339 1.00 0.00 O ATOM 36 C5' DC A 2 -4.745 2.309 9.911 1.00 0.00 C ATOM 37 C4' DC A 2 -4.479 1.666 8.547 1.00 0.00 C ATOM 38 O4' DC A 2 -4.306 2.648 7.544 1.00 0.00 O ATOM 39 C3' DC A 2 -3.232 0.766 8.523 1.00 0.00 C ATOM 40 O3' DC A 2 -3.637 -0.595 8.508 1.00 0.00 O ATOM 41 C2' DC A 2 -2.510 1.212 7.248 1.00 0.00 C ATOM 42 C1' DC A 2 -3.553 2.046 6.512 1.00 0.00 C ATOM 43 N1 DC A 2 -2.917 3.066 5.634 1.00 0.00 N ATOM 44 C2 DC A 2 -2.943 2.895 4.246 1.00 0.00 C ATOM 45 O2 DC A 2 -3.435 1.893 3.730 1.00 0.00 O ATOM 46 N3 DC A 2 -2.390 3.863 3.460 1.00 0.00 N ATOM 47 C4 DC A 2 -1.837 4.961 3.999 1.00 0.00 C ATOM 48 N4 DC A 2 -1.308 5.886 3.192 1.00 0.00 N ATOM 49 C5 DC A 2 -1.811 5.164 5.420 1.00 0.00 C ATOM 50 C6 DC A 2 -2.356 4.192 6.187 1.00 0.00 C ATOM 0 H5' DC A 2 -5.621 2.955 9.849 1.00 0.00 H new ATOM 0 H5'' DC A 2 -4.971 1.535 10.645 1.00 0.00 H new ATOM 0 H4' DC A 2 -5.359 1.053 8.355 1.00 0.00 H new ATOM 0 H3' DC A 2 -2.577 0.852 9.390 1.00 0.00 H new ATOM 0 H2' DC A 2 -1.619 1.797 7.477 1.00 0.00 H new ATOM 0 H2'' DC A 2 -2.187 0.359 6.652 1.00 0.00 H new ATOM 0 H1' DC A 2 -4.170 1.443 5.846 1.00 0.00 H new ATOM 0 H41 DC A 2 -0.884 6.725 3.587 1.00 0.00 H new ATOM 0 H42 DC A 2 -1.328 5.752 2.181 1.00 0.00 H new ATOM 0 H5 DC A 2 -1.377 6.051 5.856 1.00 0.00 H new ATOM 0 H6 DC A 2 -2.350 4.304 7.261 1.00 0.00 H new ATOM 62 P DA A 3 -2.584 -1.824 8.461 1.00 0.00 P ATOM 63 OP1 DA A 3 -3.237 -3.014 9.049 1.00 0.00 O ATOM 64 OP2 DA A 3 -1.285 -1.357 8.996 1.00 0.00 O ATOM 65 O5' DA A 3 -2.415 -2.077 6.878 1.00 0.00 O ATOM 66 C5' DA A 3 -3.506 -2.500 6.084 1.00 0.00 C ATOM 67 C4' DA A 3 -3.100 -2.541 4.609 1.00 0.00 C ATOM 68 O4' DA A 3 -2.729 -1.243 4.172 1.00 0.00 O ATOM 69 C3' DA A 3 -1.916 -3.485 4.343 1.00 0.00 C ATOM 70 O3' DA A 3 -2.308 -4.439 3.367 1.00 0.00 O ATOM 71 C2' DA A 3 -0.837 -2.525 3.843 1.00 0.00 C ATOM 72 C1' DA A 3 -1.660 -1.380 3.261 1.00 0.00 C ATOM 73 N9 DA A 3 -0.889 -0.117 3.184 1.00 0.00 N ATOM 74 C8 DA A 3 -0.367 0.625 4.216 1.00 0.00 C ATOM 75 N7 DA A 3 0.191 1.744 3.848 1.00 0.00 N ATOM 76 C5 DA A 3 0.047 1.741 2.466 1.00 0.00 C ATOM 77 C6 DA A 3 0.427 2.655 1.462 1.00 0.00 C ATOM 78 N6 DA A 3 1.022 3.821 1.732 1.00 0.00 N ATOM 79 N1 DA A 3 0.165 2.341 0.179 1.00 0.00 N ATOM 80 C2 DA A 3 -0.453 1.195 -0.093 1.00 0.00 C ATOM 81 N3 DA A 3 -0.873 0.262 0.758 1.00 0.00 N ATOM 82 C4 DA A 3 -0.592 0.600 2.047 1.00 0.00 C ATOM 0 H5' DA A 3 -4.348 -1.821 6.218 1.00 0.00 H new ATOM 0 H5'' DA A 3 -3.838 -3.487 6.405 1.00 0.00 H new ATOM 0 H4' DA A 3 -3.967 -2.912 4.063 1.00 0.00 H new ATOM 0 H3' DA A 3 -1.570 -4.065 5.199 1.00 0.00 H new ATOM 0 H2' DA A 3 -0.187 -2.188 4.651 1.00 0.00 H new ATOM 0 H2'' DA A 3 -0.198 -2.988 3.092 1.00 0.00 H new ATOM 0 H1' DA A 3 -1.977 -1.588 2.239 1.00 0.00 H new ATOM 0 H8 DA A 3 -0.415 0.307 5.247 1.00 0.00 H new ATOM 0 H61 DA A 3 1.279 4.451 0.972 1.00 0.00 H new ATOM 0 H62 DA A 3 1.219 4.081 2.698 1.00 0.00 H new ATOM 0 H2 DA A 3 -0.638 0.996 -1.138 1.00 0.00 H new ATOM 94 P DT A 4 -1.328 -5.612 2.836 1.00 0.00 P ATOM 95 OP1 DT A 4 -2.137 -6.836 2.641 1.00 0.00 O ATOM 96 OP2 DT A 4 -0.122 -5.655 3.692 1.00 0.00 O ATOM 97 O5' DT A 4 -0.897 -5.053 1.385 1.00 0.00 O ATOM 98 C5' DT A 4 -1.845 -4.940 0.340 1.00 0.00 C ATOM 99 C4' DT A 4 -1.204 -4.330 -0.909 1.00 0.00 C ATOM 100 O4' DT A 4 -0.693 -3.045 -0.598 1.00 0.00 O ATOM 101 C3' DT A 4 -0.049 -5.180 -1.467 1.00 0.00 C ATOM 102 O3' DT A 4 -0.267 -5.388 -2.855 1.00 0.00 O ATOM 103 C2' DT A 4 1.168 -4.302 -1.182 1.00 0.00 C ATOM 104 C1' DT A 4 0.557 -2.903 -1.239 1.00 0.00 C ATOM 105 N1 DT A 4 1.377 -1.884 -0.527 1.00 0.00 N ATOM 106 C2 DT A 4 1.866 -0.784 -1.235 1.00 0.00 C ATOM 107 O2 DT A 4 1.705 -0.629 -2.444 1.00 0.00 O ATOM 108 N3 DT A 4 2.558 0.164 -0.495 1.00 0.00 N ATOM 109 C4 DT A 4 2.793 0.119 0.872 1.00 0.00 C ATOM 110 O4 DT A 4 3.388 1.034 1.432 1.00 0.00 O ATOM 111 C5 DT A 4 2.279 -1.065 1.530 1.00 0.00 C ATOM 112 C7 DT A 4 2.543 -1.252 3.012 1.00 0.00 C ATOM 113 C6 DT A 4 1.597 -2.004 0.828 1.00 0.00 C ATOM 0 H5' DT A 4 -2.680 -4.320 0.666 1.00 0.00 H new ATOM 0 H5'' DT A 4 -2.251 -5.923 0.103 1.00 0.00 H new ATOM 0 H4' DT A 4 -1.985 -4.280 -1.668 1.00 0.00 H new ATOM 0 H3' DT A 4 0.060 -6.174 -1.033 1.00 0.00 H new ATOM 0 H2' DT A 4 1.610 -4.517 -0.209 1.00 0.00 H new ATOM 0 H2'' DT A 4 1.954 -4.437 -1.925 1.00 0.00 H new ATOM 0 H1' DT A 4 0.488 -2.550 -2.268 1.00 0.00 H new ATOM 0 H3 DT A 4 2.928 0.968 -1.002 1.00 0.00 H new ATOM 0 H71 DT A 4 1.725 -1.817 3.459 1.00 0.00 H new ATOM 0 H72 DT A 4 3.477 -1.796 3.149 1.00 0.00 H new ATOM 0 H73 DT A 4 2.617 -0.277 3.494 1.00 0.00 H new ATOM 0 H6 DT A 4 1.215 -2.871 1.346 1.00 0.00 H new ATOM 126 P DC A 5 0.680 -6.340 -3.759 1.00 0.00 P ATOM 127 OP1 DC A 5 -0.106 -6.790 -4.929 1.00 0.00 O ATOM 128 OP2 DC A 5 1.323 -7.339 -2.877 1.00 0.00 O ATOM 129 O5' DC A 5 1.817 -5.321 -4.275 1.00 0.00 O ATOM 130 C5' DC A 5 1.557 -4.399 -5.316 1.00 0.00 C ATOM 131 C4' DC A 5 2.733 -3.433 -5.472 1.00 0.00 C ATOM 132 O4' DC A 5 2.972 -2.752 -4.257 1.00 0.00 O ATOM 133 C3' DC A 5 4.061 -4.105 -5.857 1.00 0.00 C ATOM 134 O3' DC A 5 4.284 -3.987 -7.254 1.00 0.00 O ATOM 135 C2' DC A 5 5.090 -3.339 -5.018 1.00 0.00 C ATOM 136 C1' DC A 5 4.272 -2.224 -4.370 1.00 0.00 C ATOM 137 N1 DC A 5 4.807 -1.759 -3.059 1.00 0.00 N ATOM 138 C2 DC A 5 5.417 -0.503 -2.991 1.00 0.00 C ATOM 139 O2 DC A 5 5.618 0.172 -3.997 1.00 0.00 O ATOM 140 N3 DC A 5 5.802 -0.029 -1.773 1.00 0.00 N ATOM 141 C4 DC A 5 5.629 -0.754 -0.659 1.00 0.00 C ATOM 142 N4 DC A 5 6.032 -0.246 0.509 1.00 0.00 N ATOM 143 C5 DC A 5 5.038 -2.061 -0.708 1.00 0.00 C ATOM 144 C6 DC A 5 4.640 -2.513 -1.920 1.00 0.00 C ATOM 0 H5' DC A 5 0.646 -3.842 -5.099 1.00 0.00 H new ATOM 0 H5'' DC A 5 1.389 -4.933 -6.251 1.00 0.00 H new ATOM 0 H4' DC A 5 2.433 -2.766 -6.280 1.00 0.00 H new ATOM 0 H3' DC A 5 4.098 -5.177 -5.661 1.00 0.00 H new ATOM 0 H2' DC A 5 5.554 -3.981 -4.270 1.00 0.00 H new ATOM 0 H2'' DC A 5 5.893 -2.939 -5.637 1.00 0.00 H new ATOM 0 H1' DC A 5 4.305 -1.321 -4.980 1.00 0.00 H new ATOM 0 H41 DC A 5 5.909 -0.782 1.368 1.00 0.00 H new ATOM 0 H42 DC A 5 6.463 0.678 0.542 1.00 0.00 H new ATOM 0 H5 DC A 5 4.916 -2.658 0.184 1.00 0.00 H new ATOM 0 H6 DC A 5 4.181 -3.488 -1.995 1.00 0.00 H new ATOM 156 P DG A 6 5.524 -4.713 -8.006 1.00 0.00 P ATOM 157 OP1 DG A 6 5.232 -4.723 -9.457 1.00 0.00 O ATOM 158 OP2 DG A 6 5.816 -5.986 -7.310 1.00 0.00 O ATOM 159 O5' DG A 6 6.767 -3.717 -7.760 1.00 0.00 O ATOM 160 C5' DG A 6 6.820 -2.438 -8.362 1.00 0.00 C ATOM 161 C4' DG A 6 8.039 -1.645 -7.873 1.00 0.00 C ATOM 162 O4' DG A 6 7.976 -1.480 -6.464 1.00 0.00 O ATOM 163 C3' DG A 6 9.379 -2.319 -8.196 1.00 0.00 C ATOM 164 O3' DG A 6 10.304 -1.276 -8.466 1.00 0.00 O ATOM 165 C2' DG A 6 9.660 -3.074 -6.898 1.00 0.00 C ATOM 166 C1' DG A 6 9.110 -2.088 -5.870 1.00 0.00 C ATOM 167 N9 DG A 6 8.746 -2.683 -4.562 1.00 0.00 N ATOM 168 C8 DG A 6 8.282 -3.945 -4.280 1.00 0.00 C ATOM 169 N7 DG A 6 8.034 -4.157 -3.019 1.00 0.00 N ATOM 170 C5 DG A 6 8.345 -2.949 -2.412 1.00 0.00 C ATOM 171 C6 DG A 6 8.286 -2.580 -1.035 1.00 0.00 C ATOM 172 O6 DG A 6 7.928 -3.265 -0.079 1.00 0.00 O ATOM 173 N1 DG A 6 8.701 -1.270 -0.819 1.00 0.00 N ATOM 174 C2 DG A 6 9.074 -0.393 -1.820 1.00 0.00 C ATOM 175 N2 DG A 6 9.396 0.845 -1.436 1.00 0.00 N ATOM 176 N3 DG A 6 9.115 -0.734 -3.121 1.00 0.00 N ATOM 177 C4 DG A 6 8.757 -2.029 -3.349 1.00 0.00 C ATOM 0 H5' DG A 6 5.908 -1.887 -8.132 1.00 0.00 H new ATOM 0 H5'' DG A 6 6.863 -2.545 -9.446 1.00 0.00 H new ATOM 0 H4' DG A 6 8.000 -0.691 -8.399 1.00 0.00 H new ATOM 0 H3' DG A 6 9.416 -2.990 -9.055 1.00 0.00 H new ATOM 0 H2' DG A 6 9.150 -4.037 -6.861 1.00 0.00 H new ATOM 0 H2'' DG A 6 10.723 -3.270 -6.755 1.00 0.00 H new ATOM 0 H1' DG A 6 9.899 -1.376 -5.628 1.00 0.00 H new ATOM 0 H8 DG A 6 8.135 -4.698 -5.040 1.00 0.00 H new ATOM 0 H1 DG A 6 8.732 -0.934 0.143 1.00 0.00 H new ATOM 0 H21 DG A 6 9.679 1.537 -2.130 1.00 0.00 H new ATOM 0 H22 DG A 6 9.359 1.099 -0.449 1.00 0.00 H new ATOM 189 P DA A 7 11.884 -1.512 -8.712 1.00 0.00 P ATOM 190 OP1 DA A 7 12.338 -0.552 -9.743 1.00 0.00 O ATOM 191 OP2 DA A 7 12.137 -2.959 -8.889 1.00 0.00 O ATOM 192 O5' DA A 7 12.492 -1.053 -7.291 1.00 0.00 O ATOM 193 C5' DA A 7 12.403 0.297 -6.869 1.00 0.00 C ATOM 194 C4' DA A 7 12.875 0.452 -5.422 1.00 0.00 C ATOM 195 O4' DA A 7 12.084 -0.380 -4.591 1.00 0.00 O ATOM 196 C3' DA A 7 14.348 0.060 -5.222 1.00 0.00 C ATOM 197 O3' DA A 7 15.165 1.134 -4.755 1.00 0.00 O ATOM 198 C2' DA A 7 14.269 -1.144 -4.283 1.00 0.00 C ATOM 199 C1' DA A 7 12.915 -0.944 -3.599 1.00 0.00 C ATOM 200 N9 DA A 7 12.338 -2.220 -3.122 1.00 0.00 N ATOM 201 C8 DA A 7 12.038 -3.347 -3.846 1.00 0.00 C ATOM 202 N7 DA A 7 11.521 -4.315 -3.142 1.00 0.00 N ATOM 203 C5 DA A 7 11.469 -3.792 -1.855 1.00 0.00 C ATOM 204 C6 DA A 7 11.008 -4.309 -0.625 1.00 0.00 C ATOM 205 N6 DA A 7 10.471 -5.529 -0.505 1.00 0.00 N ATOM 206 N1 DA A 7 11.090 -3.529 0.471 1.00 0.00 N ATOM 207 C2 DA A 7 11.592 -2.302 0.352 1.00 0.00 C ATOM 208 N3 DA A 7 12.048 -1.698 -0.742 1.00 0.00 N ATOM 209 C4 DA A 7 11.960 -2.510 -1.832 1.00 0.00 C ATOM 0 H5' DA A 7 11.373 0.642 -6.958 1.00 0.00 H new ATOM 0 H5'' DA A 7 13.008 0.926 -7.522 1.00 0.00 H new ATOM 0 H4' DA A 7 12.773 1.506 -5.166 1.00 0.00 H new ATOM 0 H3' DA A 7 14.852 -0.193 -6.155 1.00 0.00 H new ATOM 0 H2' DA A 7 14.313 -2.087 -4.828 1.00 0.00 H new ATOM 0 H2'' DA A 7 15.089 -1.153 -3.565 1.00 0.00 H new ATOM 0 H1' DA A 7 13.015 -0.311 -2.717 1.00 0.00 H new ATOM 0 H8 DA A 7 12.215 -3.425 -4.908 1.00 0.00 H new ATOM 0 H61 DA A 7 10.152 -5.858 0.406 1.00 0.00 H new ATOM 0 H62 DA A 7 10.381 -6.129 -1.325 1.00 0.00 H new ATOM 0 H2 DA A 7 11.635 -1.721 1.262 1.00 0.00 H new ATOM 221 P DC A 8 15.067 1.803 -3.278 1.00 0.00 P ATOM 222 OP1 DC A 8 15.753 0.914 -2.315 1.00 0.00 O ATOM 223 OP2 DC A 8 13.670 2.216 -3.021 1.00 0.00 O ATOM 224 O5' DC A 8 15.967 3.139 -3.440 1.00 0.00 O ATOM 225 C5' DC A 8 15.845 4.222 -2.532 1.00 0.00 C ATOM 226 C4' DC A 8 15.085 5.406 -3.156 1.00 0.00 C ATOM 227 O4' DC A 8 14.025 4.948 -3.986 1.00 0.00 O ATOM 228 C3' DC A 8 14.439 6.261 -2.059 1.00 0.00 C ATOM 229 O3' DC A 8 14.330 7.606 -2.510 1.00 0.00 O ATOM 230 C2' DC A 8 13.092 5.555 -1.955 1.00 0.00 C ATOM 231 C1' DC A 8 12.780 5.346 -3.437 1.00 0.00 C ATOM 232 N1 DC A 8 11.707 4.397 -3.854 1.00 0.00 N ATOM 233 C2 DC A 8 10.863 3.760 -2.933 1.00 0.00 C ATOM 234 O2 DC A 8 10.838 4.054 -1.741 1.00 0.00 O ATOM 235 N3 DC A 8 10.024 2.789 -3.394 1.00 0.00 N ATOM 236 C4 DC A 8 9.940 2.495 -4.698 1.00 0.00 C ATOM 237 N4 DC A 8 9.135 1.500 -5.078 1.00 0.00 N ATOM 238 C5 DC A 8 10.682 3.239 -5.674 1.00 0.00 C ATOM 239 C6 DC A 8 11.555 4.158 -5.200 1.00 0.00 C ATOM 0 H5' DC A 8 16.837 4.550 -2.221 1.00 0.00 H new ATOM 0 H5'' DC A 8 15.324 3.888 -1.635 1.00 0.00 H new ATOM 0 H4' DC A 8 15.809 5.980 -3.734 1.00 0.00 H new ATOM 0 H3' DC A 8 14.970 6.335 -1.110 1.00 0.00 H new ATOM 0 H2' DC A 8 13.157 4.615 -1.407 1.00 0.00 H new ATOM 0 H2'' DC A 8 12.340 6.165 -1.454 1.00 0.00 H new ATOM 0 H1' DC A 8 12.346 6.278 -3.799 1.00 0.00 H new ATOM 0 H41 DC A 8 9.055 1.258 -6.066 1.00 0.00 H new ATOM 0 H42 DC A 8 8.600 0.982 -4.381 1.00 0.00 H new ATOM 0 H5 DC A 8 10.551 3.074 -6.733 1.00 0.00 H new ATOM 0 H6 DC A 8 12.152 4.722 -5.901 1.00 0.00 H new ATOM 251 P DG A 9 13.588 8.768 -1.655 1.00 0.00 P ATOM 252 OP1 DG A 9 14.139 10.072 -2.084 1.00 0.00 O ATOM 253 OP2 DG A 9 13.626 8.392 -0.224 1.00 0.00 O ATOM 254 O5' DG A 9 12.055 8.684 -2.158 1.00 0.00 O ATOM 255 C5' DG A 9 11.703 9.016 -3.489 1.00 0.00 C ATOM 256 C4' DG A 9 10.258 8.609 -3.802 1.00 0.00 C ATOM 257 O4' DG A 9 9.852 7.434 -3.120 1.00 0.00 O ATOM 258 C3' DG A 9 9.210 9.696 -3.507 1.00 0.00 C ATOM 259 O3' DG A 9 8.761 10.173 -4.767 1.00 0.00 O ATOM 260 C2' DG A 9 8.155 8.938 -2.691 1.00 0.00 C ATOM 261 C1' DG A 9 8.441 7.485 -3.050 1.00 0.00 C ATOM 262 N9 DG A 9 7.917 6.502 -2.070 1.00 0.00 N ATOM 263 C8 DG A 9 7.799 6.596 -0.702 1.00 0.00 C ATOM 264 N7 DG A 9 7.487 5.475 -0.116 1.00 0.00 N ATOM 265 C5 DG A 9 7.332 4.581 -1.168 1.00 0.00 C ATOM 266 C6 DG A 9 6.967 3.202 -1.151 1.00 0.00 C ATOM 267 O6 DG A 9 6.827 2.470 -0.175 1.00 0.00 O ATOM 268 N1 DG A 9 6.748 2.696 -2.429 1.00 0.00 N ATOM 269 C2 DG A 9 6.873 3.436 -3.592 1.00 0.00 C ATOM 270 N2 DG A 9 6.518 2.844 -4.737 1.00 0.00 N ATOM 271 N3 DG A 9 7.290 4.712 -3.613 1.00 0.00 N ATOM 272 C4 DG A 9 7.503 5.225 -2.370 1.00 0.00 C ATOM 0 H5' DG A 9 12.381 8.518 -4.182 1.00 0.00 H new ATOM 0 H5'' DG A 9 11.822 10.089 -3.642 1.00 0.00 H new ATOM 0 H4' DG A 9 10.289 8.433 -4.877 1.00 0.00 H new ATOM 0 H3' DG A 9 9.538 10.574 -2.951 1.00 0.00 H new ATOM 0 H2' DG A 9 8.261 9.120 -1.622 1.00 0.00 H new ATOM 0 H2'' DG A 9 7.142 9.232 -2.965 1.00 0.00 H new ATOM 0 H1' DG A 9 7.940 7.206 -3.977 1.00 0.00 H new ATOM 0 H8 DG A 9 7.952 7.518 -0.161 1.00 0.00 H new ATOM 0 H1 DG A 9 6.478 1.716 -2.514 1.00 0.00 H new ATOM 0 H21 DG A 9 6.593 3.352 -5.618 1.00 0.00 H new ATOM 0 H22 DG A 9 6.172 1.885 -4.729 1.00 0.00 H new ATOM 284 P DA A 10 7.464 11.110 -4.972 1.00 0.00 P ATOM 285 OP1 DA A 10 7.679 11.943 -6.176 1.00 0.00 O ATOM 286 OP2 DA A 10 7.112 11.745 -3.682 1.00 0.00 O ATOM 287 O5' DA A 10 6.361 9.986 -5.323 1.00 0.00 O ATOM 288 C5' DA A 10 6.498 9.175 -6.477 1.00 0.00 C ATOM 289 C4' DA A 10 5.477 8.037 -6.468 1.00 0.00 C ATOM 290 O4' DA A 10 5.600 7.250 -5.299 1.00 0.00 O ATOM 291 C3' DA A 10 4.024 8.524 -6.543 1.00 0.00 C ATOM 292 O3' DA A 10 3.515 8.223 -7.834 1.00 0.00 O ATOM 293 C2' DA A 10 3.348 7.745 -5.412 1.00 0.00 C ATOM 294 C1' DA A 10 4.346 6.637 -5.095 1.00 0.00 C ATOM 295 N9 DA A 10 4.222 6.169 -3.696 1.00 0.00 N ATOM 296 C8 DA A 10 4.523 6.856 -2.547 1.00 0.00 C ATOM 297 N7 DA A 10 4.366 6.167 -1.452 1.00 0.00 N ATOM 298 C5 DA A 10 3.931 4.928 -1.907 1.00 0.00 C ATOM 299 C6 DA A 10 3.608 3.728 -1.243 1.00 0.00 C ATOM 300 N6 DA A 10 3.703 3.600 0.083 1.00 0.00 N ATOM 301 N1 DA A 10 3.210 2.671 -1.978 1.00 0.00 N ATOM 302 C2 DA A 10 3.138 2.800 -3.302 1.00 0.00 C ATOM 303 N3 DA A 10 3.419 3.870 -4.044 1.00 0.00 N ATOM 304 C4 DA A 10 3.822 4.920 -3.275 1.00 0.00 C ATOM 0 H5' DA A 10 7.507 8.764 -6.520 1.00 0.00 H new ATOM 0 H5'' DA A 10 6.363 9.783 -7.372 1.00 0.00 H new ATOM 0 H4' DA A 10 5.699 7.452 -7.361 1.00 0.00 H new ATOM 0 H3' DA A 10 3.872 9.596 -6.418 1.00 0.00 H new ATOM 0 H2' DA A 10 3.162 8.378 -4.544 1.00 0.00 H new ATOM 0 H2'' DA A 10 2.385 7.340 -5.723 1.00 0.00 H new ATOM 0 H1' DA A 10 4.189 5.754 -5.714 1.00 0.00 H new ATOM 0 H8 DA A 10 4.862 7.882 -2.550 1.00 0.00 H new ATOM 0 H61 DA A 10 3.460 2.715 0.529 1.00 0.00 H new ATOM 0 H62 DA A 10 4.018 4.387 0.650 1.00 0.00 H new ATOM 0 H2 DA A 10 2.810 1.925 -3.843 1.00 0.00 H new ATOM 316 P DT A 11 2.026 8.635 -8.310 1.00 0.00 P ATOM 317 OP1 DT A 11 2.015 8.689 -9.789 1.00 0.00 O ATOM 318 OP2 DT A 11 1.589 9.812 -7.527 1.00 0.00 O ATOM 319 O5' DT A 11 1.149 7.366 -7.849 1.00 0.00 O ATOM 320 C5' DT A 11 1.333 6.093 -8.438 1.00 0.00 C ATOM 321 C4' DT A 11 0.518 5.048 -7.673 1.00 0.00 C ATOM 322 O4' DT A 11 0.936 5.016 -6.322 1.00 0.00 O ATOM 323 C3' DT A 11 -0.992 5.336 -7.684 1.00 0.00 C ATOM 324 O3' DT A 11 -1.657 4.331 -8.435 1.00 0.00 O ATOM 325 C2' DT A 11 -1.362 5.321 -6.198 1.00 0.00 C ATOM 326 C1' DT A 11 -0.173 4.618 -5.548 1.00 0.00 C ATOM 327 N1 DT A 11 0.034 5.020 -4.129 1.00 0.00 N ATOM 328 C2 DT A 11 -0.063 4.051 -3.130 1.00 0.00 C ATOM 329 O2 DT A 11 -0.419 2.894 -3.342 1.00 0.00 O ATOM 330 N3 DT A 11 0.266 4.462 -1.846 1.00 0.00 N ATOM 331 C4 DT A 11 0.663 5.736 -1.469 1.00 0.00 C ATOM 332 O4 DT A 11 0.970 5.967 -0.302 1.00 0.00 O ATOM 333 C5 DT A 11 0.682 6.699 -2.553 1.00 0.00 C ATOM 334 C7 DT A 11 1.036 8.143 -2.254 1.00 0.00 C ATOM 335 C6 DT A 11 0.374 6.317 -3.818 1.00 0.00 C ATOM 0 H5' DT A 11 2.389 5.825 -8.425 1.00 0.00 H new ATOM 0 H5'' DT A 11 1.023 6.117 -9.483 1.00 0.00 H new ATOM 0 H4' DT A 11 0.691 4.097 -8.176 1.00 0.00 H new ATOM 0 H3' DT A 11 -1.276 6.279 -8.151 1.00 0.00 H new ATOM 0 H2' DT A 11 -1.496 6.329 -5.807 1.00 0.00 H new ATOM 0 H2'' DT A 11 -2.293 4.783 -6.021 1.00 0.00 H new ATOM 0 H1' DT A 11 -0.329 3.540 -5.525 1.00 0.00 H new ATOM 0 H3 DT A 11 0.210 3.759 -1.109 1.00 0.00 H new ATOM 0 H71 DT A 11 0.728 8.390 -1.238 1.00 0.00 H new ATOM 0 H72 DT A 11 2.113 8.281 -2.350 1.00 0.00 H new ATOM 0 H73 DT A 11 0.522 8.797 -2.958 1.00 0.00 H new ATOM 0 H6 DT A 11 0.396 7.055 -4.607 1.00 0.00 H new ATOM 348 P DG A 12 -3.242 4.393 -8.758 1.00 0.00 P ATOM 349 OP1 DG A 12 -3.479 3.656 -10.020 1.00 0.00 O ATOM 350 OP2 DG A 12 -3.695 5.796 -8.632 1.00 0.00 O ATOM 351 O5' DG A 12 -3.896 3.548 -7.552 1.00 0.00 O ATOM 352 C5' DG A 12 -3.805 2.137 -7.508 1.00 0.00 C ATOM 353 C4' DG A 12 -4.480 1.599 -6.243 1.00 0.00 C ATOM 354 O4' DG A 12 -3.763 2.029 -5.096 1.00 0.00 O ATOM 355 C3' DG A 12 -5.933 2.082 -6.101 1.00 0.00 C ATOM 356 O3' DG A 12 -6.760 0.966 -5.806 1.00 0.00 O ATOM 357 C2' DG A 12 -5.817 3.064 -4.938 1.00 0.00 C ATOM 358 C1' DG A 12 -4.699 2.428 -4.117 1.00 0.00 C ATOM 359 N9 DG A 12 -4.067 3.365 -3.157 1.00 0.00 N ATOM 360 C8 DG A 12 -3.610 4.640 -3.382 1.00 0.00 C ATOM 361 N7 DG A 12 -2.997 5.181 -2.368 1.00 0.00 N ATOM 362 C5 DG A 12 -3.057 4.200 -1.387 1.00 0.00 C ATOM 363 C6 DG A 12 -2.553 4.215 -0.054 1.00 0.00 C ATOM 364 O6 DG A 12 -1.891 5.097 0.485 1.00 0.00 O ATOM 365 N1 DG A 12 -2.896 3.071 0.662 1.00 0.00 N ATOM 366 C2 DG A 12 -3.608 2.009 0.134 1.00 0.00 C ATOM 367 N2 DG A 12 -3.908 1.003 0.963 1.00 0.00 N ATOM 368 N3 DG A 12 -4.036 1.970 -1.139 1.00 0.00 N ATOM 369 C4 DG A 12 -3.737 3.096 -1.846 1.00 0.00 C ATOM 0 H5' DG A 12 -2.759 1.833 -7.527 1.00 0.00 H new ATOM 0 H5'' DG A 12 -4.278 1.708 -8.391 1.00 0.00 H new ATOM 0 H4' DG A 12 -4.481 0.512 -6.327 1.00 0.00 H new ATOM 0 H3' DG A 12 -6.375 2.542 -6.985 1.00 0.00 H new ATOM 0 H2' DG A 12 -5.560 4.069 -5.273 1.00 0.00 H new ATOM 0 H2'' DG A 12 -6.746 3.144 -4.374 1.00 0.00 H new ATOM 0 H1' DG A 12 -5.077 1.615 -3.497 1.00 0.00 H new ATOM 0 H8 DG A 12 -3.748 5.152 -4.323 1.00 0.00 H new ATOM 0 H1 DG A 12 -2.604 3.012 1.637 1.00 0.00 H new ATOM 0 H21 DG A 12 -4.432 0.198 0.619 1.00 0.00 H new ATOM 0 H22 DG A 12 -3.613 1.041 1.939 1.00 0.00 H new ATOM 381 P DC A 13 -8.356 1.094 -5.568 1.00 0.00 P ATOM 382 OP1 DC A 13 -8.977 -0.212 -5.879 1.00 0.00 O ATOM 383 OP2 DC A 13 -8.840 2.318 -6.245 1.00 0.00 O ATOM 384 O5' DC A 13 -8.451 1.328 -3.975 1.00 0.00 O ATOM 385 C5' DC A 13 -8.131 0.291 -3.067 1.00 0.00 C ATOM 386 C4' DC A 13 -8.091 0.825 -1.634 1.00 0.00 C ATOM 387 O4' DC A 13 -7.131 1.851 -1.489 1.00 0.00 O ATOM 388 C3' DC A 13 -9.411 1.429 -1.140 1.00 0.00 C ATOM 389 O3' DC A 13 -10.124 0.497 -0.354 1.00 0.00 O ATOM 390 C2' DC A 13 -8.968 2.627 -0.297 1.00 0.00 C ATOM 391 C1' DC A 13 -7.444 2.486 -0.268 1.00 0.00 C ATOM 392 N1 DC A 13 -6.744 3.794 -0.132 1.00 0.00 N ATOM 393 C2 DC A 13 -6.012 4.054 1.029 1.00 0.00 C ATOM 394 O2 DC A 13 -5.971 3.251 1.958 1.00 0.00 O ATOM 395 N3 DC A 13 -5.337 5.234 1.122 1.00 0.00 N ATOM 396 C4 DC A 13 -5.372 6.138 0.134 1.00 0.00 C ATOM 397 N4 DC A 13 -4.693 7.278 0.287 1.00 0.00 N ATOM 398 C5 DC A 13 -6.150 5.912 -1.051 1.00 0.00 C ATOM 399 C6 DC A 13 -6.813 4.734 -1.132 1.00 0.00 C ATOM 0 H5' DC A 13 -7.165 -0.142 -3.327 1.00 0.00 H new ATOM 0 H5'' DC A 13 -8.869 -0.507 -3.143 1.00 0.00 H new ATOM 0 H4' DC A 13 -7.853 -0.061 -1.046 1.00 0.00 H new ATOM 0 H3' DC A 13 -10.080 1.710 -1.954 1.00 0.00 H new ATOM 0 H2' DC A 13 -9.277 3.571 -0.745 1.00 0.00 H new ATOM 0 H2'' DC A 13 -9.395 2.595 0.705 1.00 0.00 H new ATOM 0 HO3' DC A 13 -10.962 0.901 -0.047 1.00 0.00 H new ATOM 0 H1' DC A 13 -7.111 1.917 0.600 1.00 0.00 H new ATOM 0 H41 DC A 13 -4.705 7.981 -0.451 1.00 0.00 H new ATOM 0 H42 DC A 13 -4.163 7.445 1.142 1.00 0.00 H new ATOM 0 H5 DC A 13 -6.204 6.647 -1.841 1.00 0.00 H new ATOM 0 H6 DC A 13 -7.412 4.528 -2.006 1.00 0.00 H new TER 412 DC A 13