USER MOD reduce.3.24.130724 H: found=0, std=0, add=232, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 232 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 Set 1.1: A 9 DT C7 :methyl -30:sc= 0 (180deg=0) USER MOD Set 1.2: B 9 DT C7 :methyl 150:sc= -0.293 (180deg=-0.293) USER MOD Single : A 1 DT C7 :methyl -30:sc= 0 (180deg=-0.0273) USER MOD Single : A 4 DT C7 :methyl -30:sc= 0 (180deg=-0.0496) USER MOD Single : A 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 4 DT C7 :methyl -30:sc= 0 (180deg=-0.411) USER MOD Single : B 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 P DT A 1 6.005 -3.493 9.921 1.00 0.00 P ATOM 2 OP1 DT A 1 7.349 -2.912 10.202 1.00 0.00 O ATOM 3 OP2 DT A 1 4.848 -3.078 10.738 1.00 0.00 O ATOM 4 O5' DT A 1 5.648 -3.160 8.378 1.00 0.00 O ATOM 5 C5' DT A 1 6.489 -3.573 7.311 1.00 0.00 C ATOM 6 C4' DT A 1 6.261 -2.749 6.036 1.00 0.00 C ATOM 7 O4' DT A 1 5.027 -3.060 5.421 1.00 0.00 O ATOM 8 C3' DT A 1 6.327 -1.230 6.299 1.00 0.00 C ATOM 9 O3' DT A 1 7.486 -0.580 5.760 1.00 0.00 O ATOM 10 C2' DT A 1 5.060 -0.704 5.616 1.00 0.00 C ATOM 11 C1' DT A 1 4.217 -1.920 5.255 1.00 0.00 C ATOM 12 N1 DT A 1 2.961 -2.092 6.050 1.00 0.00 N ATOM 13 C2 DT A 1 1.827 -2.528 5.350 1.00 0.00 C ATOM 14 O2 DT A 1 1.807 -2.762 4.152 1.00 0.00 O ATOM 15 N3 DT A 1 0.653 -2.692 6.084 1.00 0.00 N ATOM 16 C4 DT A 1 0.521 -2.475 7.430 1.00 0.00 C ATOM 17 O4 DT A 1 -0.596 -2.674 7.934 1.00 0.00 O ATOM 18 C5 DT A 1 1.729 -2.028 8.105 1.00 0.00 C ATOM 19 C7 DT A 1 1.730 -1.751 9.598 1.00 0.00 C ATOM 20 C6 DT A 1 2.899 -1.855 7.406 1.00 0.00 C ATOM 0 H5' DT A 1 6.309 -4.627 7.097 1.00 0.00 H new ATOM 0 H5'' DT A 1 7.531 -3.483 7.617 1.00 0.00 H new ATOM 0 H4' DT A 1 7.073 -3.020 5.362 1.00 0.00 H new ATOM 0 H3' DT A 1 6.393 -1.028 7.368 1.00 0.00 H new ATOM 0 H2' DT A 1 4.511 -0.037 6.281 1.00 0.00 H new ATOM 0 H2'' DT A 1 5.312 -0.130 4.724 1.00 0.00 H new ATOM 0 H1' DT A 1 3.882 -1.774 4.228 1.00 0.00 H new ATOM 0 H3 DT A 1 -0.177 -2.999 5.576 1.00 0.00 H new ATOM 0 H71 DT A 1 0.739 -1.418 9.907 1.00 0.00 H new ATOM 0 H72 DT A 1 1.991 -2.662 10.137 1.00 0.00 H new ATOM 0 H73 DT A 1 2.461 -0.974 9.823 1.00 0.00 H new ATOM 0 H6 DT A 1 3.786 -1.528 7.928 1.00 0.00 H new ATOM 33 P DC A 2 7.968 0.825 6.309 1.00 0.00 P ATOM 34 OP1 DC A 2 8.987 1.352 5.374 1.00 0.00 O ATOM 35 OP2 DC A 2 8.405 0.632 7.717 1.00 0.00 O ATOM 36 O5' DC A 2 6.580 1.770 6.329 1.00 0.00 O ATOM 37 C5' DC A 2 6.073 2.726 5.378 1.00 0.00 C ATOM 38 C4' DC A 2 6.690 2.921 3.967 1.00 0.00 C ATOM 39 O4' DC A 2 5.693 2.635 2.988 1.00 0.00 O ATOM 40 C3' DC A 2 7.003 4.407 3.702 1.00 0.00 C ATOM 41 O3' DC A 2 7.966 4.484 2.653 1.00 0.00 O ATOM 42 C2' DC A 2 5.630 4.979 3.326 1.00 0.00 C ATOM 43 C1' DC A 2 5.032 3.819 2.526 1.00 0.00 C ATOM 44 N1 DC A 2 3.577 3.618 2.674 1.00 0.00 N ATOM 45 C2 DC A 2 2.815 3.252 1.532 1.00 0.00 C ATOM 46 O2 DC A 2 3.315 3.292 0.390 1.00 0.00 O ATOM 47 N3 DC A 2 1.544 2.867 1.696 1.00 0.00 N ATOM 48 C4 DC A 2 0.998 2.790 2.880 1.00 0.00 C ATOM 49 N4 DC A 2 -0.283 2.451 2.935 1.00 0.00 N ATOM 50 C5 DC A 2 1.691 3.143 4.070 1.00 0.00 C ATOM 51 C6 DC A 2 2.974 3.569 3.909 1.00 0.00 C ATOM 0 H5' DC A 2 6.108 3.699 5.868 1.00 0.00 H new ATOM 0 H5'' DC A 2 5.021 2.483 5.225 1.00 0.00 H new ATOM 0 H4' DC A 2 7.576 2.288 3.917 1.00 0.00 H new ATOM 0 H3' DC A 2 7.438 4.960 4.535 1.00 0.00 H new ATOM 0 H2' DC A 2 5.032 5.224 4.204 1.00 0.00 H new ATOM 0 H2'' DC A 2 5.712 5.889 2.732 1.00 0.00 H new ATOM 0 H1' DC A 2 5.181 4.048 1.471 1.00 0.00 H new ATOM 0 H41 DC A 2 -0.753 2.378 3.837 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.798 2.263 2.075 1.00 0.00 H new ATOM 0 H5 DC A 2 1.228 3.077 5.043 1.00 0.00 H new ATOM 0 H6 DC A 2 3.536 3.878 4.778 1.00 0.00 H new ATOM 63 P DG A 3 8.685 5.874 2.247 1.00 0.00 P ATOM 64 OP1 DG A 3 9.821 5.624 1.334 1.00 0.00 O ATOM 65 OP2 DG A 3 8.955 6.642 3.478 1.00 0.00 O ATOM 66 O5' DG A 3 7.545 6.655 1.422 1.00 0.00 O ATOM 67 C5' DG A 3 7.036 6.214 0.166 1.00 0.00 C ATOM 68 C4' DG A 3 5.806 7.055 -0.240 1.00 0.00 C ATOM 69 O4' DG A 3 4.652 6.581 0.457 1.00 0.00 O ATOM 70 C3' DG A 3 5.951 8.564 0.063 1.00 0.00 C ATOM 71 O3' DG A 3 6.281 9.439 -1.011 1.00 0.00 O ATOM 72 C2' DG A 3 4.547 8.963 0.518 1.00 0.00 C ATOM 73 C1' DG A 3 3.787 7.659 0.776 1.00 0.00 C ATOM 74 N9 DG A 3 3.314 7.529 2.179 1.00 0.00 N ATOM 75 C8 DG A 3 3.940 7.916 3.340 1.00 0.00 C ATOM 76 N7 DG A 3 3.283 7.615 4.425 1.00 0.00 N ATOM 77 C5 DG A 3 2.110 7.021 3.957 1.00 0.00 C ATOM 78 C6 DG A 3 0.998 6.450 4.643 1.00 0.00 C ATOM 79 O6 DG A 3 0.804 6.342 5.860 1.00 0.00 O ATOM 80 N1 DG A 3 0.021 5.935 3.814 1.00 0.00 N ATOM 81 C2 DG A 3 0.101 5.972 2.451 1.00 0.00 C ATOM 82 N2 DG A 3 -0.892 5.425 1.790 1.00 0.00 N ATOM 83 N3 DG A 3 1.138 6.461 1.771 1.00 0.00 N ATOM 84 C4 DG A 3 2.115 6.980 2.573 1.00 0.00 C ATOM 0 H5' DG A 3 6.761 5.161 0.227 1.00 0.00 H new ATOM 0 H5'' DG A 3 7.810 6.297 -0.597 1.00 0.00 H new ATOM 0 H4' DG A 3 5.712 6.941 -1.320 1.00 0.00 H new ATOM 0 H3' DG A 3 6.783 8.671 0.759 1.00 0.00 H new ATOM 0 H2' DG A 3 4.590 9.572 1.421 1.00 0.00 H new ATOM 0 H2'' DG A 3 4.047 9.559 -0.245 1.00 0.00 H new ATOM 0 H1' DG A 3 2.894 7.654 0.152 1.00 0.00 H new ATOM 0 H8 DG A 3 4.893 8.425 3.352 1.00 0.00 H new ATOM 0 H1 DG A 3 -0.800 5.506 4.240 1.00 0.00 H new ATOM 0 H21 DG A 3 -0.886 5.423 0.770 1.00 0.00 H new ATOM 0 H22 DG A 3 -1.670 5.002 2.296 1.00 0.00 H new ATOM 96 P DT A 4 7.598 9.344 -1.937 1.00 0.00 P ATOM 97 OP1 DT A 4 8.705 8.716 -1.155 1.00 0.00 O ATOM 98 OP2 DT A 4 7.808 10.676 -2.559 1.00 0.00 O ATOM 99 O5' DT A 4 7.090 8.352 -3.118 1.00 0.00 O ATOM 100 C5' DT A 4 6.109 8.780 -4.068 1.00 0.00 C ATOM 101 C4' DT A 4 4.770 8.061 -3.887 1.00 0.00 C ATOM 102 O4' DT A 4 4.165 8.346 -2.649 1.00 0.00 O ATOM 103 C3' DT A 4 3.664 8.530 -4.839 1.00 0.00 C ATOM 104 O3' DT A 4 3.689 8.089 -6.160 1.00 0.00 O ATOM 105 C2' DT A 4 2.448 7.910 -4.196 1.00 0.00 C ATOM 106 C1' DT A 4 2.762 8.258 -2.753 1.00 0.00 C ATOM 107 N1 DT A 4 2.016 9.490 -2.378 1.00 0.00 N ATOM 108 C2 DT A 4 2.556 10.795 -2.481 1.00 0.00 C ATOM 109 O2 DT A 4 3.663 11.101 -2.924 1.00 0.00 O ATOM 110 N3 DT A 4 1.734 11.831 -2.084 1.00 0.00 N ATOM 111 C4 DT A 4 0.420 11.713 -1.677 1.00 0.00 C ATOM 112 O4 DT A 4 -0.181 12.723 -1.336 1.00 0.00 O ATOM 113 C5 DT A 4 -0.107 10.347 -1.716 1.00 0.00 C ATOM 114 C7 DT A 4 -1.548 10.035 -1.355 1.00 0.00 C ATOM 115 C6 DT A 4 0.694 9.311 -2.043 1.00 0.00 C ATOM 0 H5' DT A 4 6.481 8.601 -5.077 1.00 0.00 H new ATOM 0 H5'' DT A 4 5.957 9.855 -3.971 1.00 0.00 H new ATOM 0 H4' DT A 4 5.064 7.022 -4.036 1.00 0.00 H new ATOM 0 H3' DT A 4 3.734 9.613 -4.943 1.00 0.00 H new ATOM 0 H2' DT A 4 1.513 8.350 -4.545 1.00 0.00 H new ATOM 0 H2'' DT A 4 2.379 6.836 -4.368 1.00 0.00 H new ATOM 0 H1' DT A 4 2.434 7.503 -2.039 1.00 0.00 H new ATOM 0 H3 DT A 4 2.134 12.769 -2.092 1.00 0.00 H new ATOM 0 H71 DT A 4 -1.903 10.756 -0.619 1.00 0.00 H new ATOM 0 H72 DT A 4 -2.168 10.094 -2.249 1.00 0.00 H new ATOM 0 H73 DT A 4 -1.609 9.030 -0.937 1.00 0.00 H new ATOM 0 H6 DT A 4 0.285 8.312 -2.042 1.00 0.00 H new ATOM 128 P DT A 5 4.036 9.085 -7.325 1.00 0.00 P ATOM 129 OP1 DT A 5 4.402 10.429 -6.808 1.00 0.00 O ATOM 130 OP2 DT A 5 3.040 8.950 -8.397 1.00 0.00 O ATOM 131 O5' DT A 5 5.404 8.341 -7.776 1.00 0.00 O ATOM 132 C5' DT A 5 6.611 9.018 -7.974 1.00 0.00 C ATOM 133 C4' DT A 5 7.434 7.927 -8.625 1.00 0.00 C ATOM 134 O4' DT A 5 7.553 8.336 -10.003 1.00 0.00 O ATOM 135 C3' DT A 5 8.824 7.697 -8.076 1.00 0.00 C ATOM 136 O3' DT A 5 9.071 6.349 -8.367 1.00 0.00 O ATOM 137 C2' DT A 5 9.685 8.604 -8.949 1.00 0.00 C ATOM 138 C1' DT A 5 8.936 8.517 -10.289 1.00 0.00 C ATOM 139 N1 DT A 5 9.002 9.713 -11.148 1.00 0.00 N ATOM 140 C2 DT A 5 9.166 9.501 -12.520 1.00 0.00 C ATOM 141 O2 DT A 5 9.293 8.398 -13.040 1.00 0.00 O ATOM 142 N3 DT A 5 9.187 10.622 -13.336 1.00 0.00 N ATOM 143 C4 DT A 5 9.050 11.929 -12.919 1.00 0.00 C ATOM 144 O4 DT A 5 9.112 12.819 -13.756 1.00 0.00 O ATOM 145 C5 DT A 5 8.839 12.083 -11.484 1.00 0.00 C ATOM 146 C7 DT A 5 8.683 13.472 -10.866 1.00 0.00 C ATOM 147 C6 DT A 5 8.815 10.994 -10.662 1.00 0.00 C ATOM 0 H5' DT A 5 7.049 9.366 -7.039 1.00 0.00 H new ATOM 0 H5'' DT A 5 6.496 9.891 -8.617 1.00 0.00 H new ATOM 0 H4' DT A 5 6.925 6.980 -8.445 1.00 0.00 H new ATOM 0 H3' DT A 5 8.989 7.896 -7.017 1.00 0.00 H new ATOM 0 H2' DT A 5 9.729 9.624 -8.567 1.00 0.00 H new ATOM 0 H2'' DT A 5 10.712 8.248 -9.027 1.00 0.00 H new ATOM 0 H1' DT A 5 9.419 7.702 -10.828 1.00 0.00 H new ATOM 0 H3 DT A 5 9.315 10.465 -14.336 1.00 0.00 H new ATOM 0 H71 DT A 5 8.042 13.409 -9.987 1.00 0.00 H new ATOM 0 H72 DT A 5 9.662 13.853 -10.575 1.00 0.00 H new ATOM 0 H73 DT A 5 8.234 14.146 -11.595 1.00 0.00 H new ATOM 0 H6 DT A 5 8.646 11.136 -9.605 1.00 0.00 H new ATOM 160 P DT A 6 9.993 5.408 -7.432 1.00 0.00 P ATOM 161 OP1 DT A 6 11.178 6.178 -6.987 1.00 0.00 O ATOM 162 OP2 DT A 6 10.189 4.128 -8.141 1.00 0.00 O ATOM 163 O5' DT A 6 9.069 5.091 -6.139 1.00 0.00 O ATOM 164 C5' DT A 6 9.143 5.852 -4.944 1.00 0.00 C ATOM 165 C4' DT A 6 8.171 5.331 -3.874 1.00 0.00 C ATOM 166 O4' DT A 6 6.845 5.535 -4.351 1.00 0.00 O ATOM 167 C3' DT A 6 8.358 3.833 -3.545 1.00 0.00 C ATOM 168 O3' DT A 6 8.356 3.603 -2.128 1.00 0.00 O ATOM 169 C2' DT A 6 7.161 3.216 -4.276 1.00 0.00 C ATOM 170 C1' DT A 6 6.121 4.339 -4.209 1.00 0.00 C ATOM 171 N1 DT A 6 5.063 4.299 -5.266 1.00 0.00 N ATOM 172 C2 DT A 6 3.729 4.405 -4.850 1.00 0.00 C ATOM 173 O2 DT A 6 3.382 4.497 -3.682 1.00 0.00 O ATOM 174 N3 DT A 6 2.756 4.392 -5.840 1.00 0.00 N ATOM 175 C4 DT A 6 2.995 4.320 -7.193 1.00 0.00 C ATOM 176 O4 DT A 6 2.012 4.391 -7.946 1.00 0.00 O ATOM 177 C5 DT A 6 4.395 4.183 -7.562 1.00 0.00 C ATOM 178 C7 DT A 6 4.800 4.012 -9.018 1.00 0.00 C ATOM 179 C6 DT A 6 5.376 4.192 -6.603 1.00 0.00 C ATOM 0 H5' DT A 6 8.917 6.896 -5.163 1.00 0.00 H new ATOM 0 H5'' DT A 6 10.161 5.821 -4.556 1.00 0.00 H new ATOM 0 H4' DT A 6 8.371 5.879 -2.953 1.00 0.00 H new ATOM 0 H3' DT A 6 9.310 3.405 -3.858 1.00 0.00 H new ATOM 0 H2' DT A 6 7.406 2.950 -5.304 1.00 0.00 H new ATOM 0 H2'' DT A 6 6.810 2.307 -3.786 1.00 0.00 H new ATOM 0 H1' DT A 6 5.582 4.238 -3.267 1.00 0.00 H new ATOM 0 H3 DT A 6 1.783 4.440 -5.539 1.00 0.00 H new ATOM 0 H71 DT A 6 5.789 4.443 -9.174 1.00 0.00 H new ATOM 0 H72 DT A 6 4.823 2.951 -9.267 1.00 0.00 H new ATOM 0 H73 DT A 6 4.078 4.519 -9.658 1.00 0.00 H new ATOM 0 H6 DT A 6 6.411 4.114 -6.901 1.00 0.00 H new ATOM 192 P DC A 7 8.974 2.248 -1.447 1.00 0.00 P ATOM 193 OP1 DC A 7 10.237 2.511 -0.710 1.00 0.00 O ATOM 194 OP2 DC A 7 8.969 1.142 -2.438 1.00 0.00 O ATOM 195 O5' DC A 7 7.915 1.888 -0.296 1.00 0.00 O ATOM 196 C5' DC A 7 6.567 1.567 -0.582 1.00 0.00 C ATOM 197 C4' DC A 7 6.233 0.150 -0.122 1.00 0.00 C ATOM 198 O4' DC A 7 4.834 0.027 -0.256 1.00 0.00 O ATOM 199 C3' DC A 7 6.843 -0.941 -1.022 1.00 0.00 C ATOM 200 O3' DC A 7 8.088 -1.539 -0.629 1.00 0.00 O ATOM 201 C2' DC A 7 5.710 -1.946 -1.232 1.00 0.00 C ATOM 202 C1' DC A 7 4.495 -1.311 -0.532 1.00 0.00 C ATOM 203 N1 DC A 7 3.215 -1.294 -1.288 1.00 0.00 N ATOM 204 C2 DC A 7 2.021 -1.391 -0.549 1.00 0.00 C ATOM 205 O2 DC A 7 2.045 -1.432 0.685 1.00 0.00 O ATOM 206 N3 DC A 7 0.858 -1.479 -1.208 1.00 0.00 N ATOM 207 C4 DC A 7 0.790 -1.419 -2.515 1.00 0.00 C ATOM 208 N4 DC A 7 -0.399 -1.574 -3.039 1.00 0.00 N ATOM 209 C5 DC A 7 1.959 -1.229 -3.324 1.00 0.00 C ATOM 210 C6 DC A 7 3.143 -1.158 -2.665 1.00 0.00 C ATOM 0 H5' DC A 7 6.387 1.657 -1.653 1.00 0.00 H new ATOM 0 H5'' DC A 7 5.907 2.279 -0.087 1.00 0.00 H new ATOM 0 H4' DC A 7 6.621 0.014 0.887 1.00 0.00 H new ATOM 0 H3' DC A 7 7.189 -0.473 -1.944 1.00 0.00 H new ATOM 0 H2' DC A 7 5.516 -2.110 -2.292 1.00 0.00 H new ATOM 0 H2'' DC A 7 5.955 -2.916 -0.799 1.00 0.00 H new ATOM 0 H1' DC A 7 4.303 -1.936 0.340 1.00 0.00 H new ATOM 0 H41 DC A 7 -0.519 -1.538 -4.051 1.00 0.00 H new ATOM 0 H42 DC A 7 -1.206 -1.731 -2.435 1.00 0.00 H new ATOM 0 H5 DC A 7 1.900 -1.147 -4.399 1.00 0.00 H new ATOM 0 H6 DC A 7 4.050 -0.992 -3.227 1.00 0.00 H new ATOM 222 P DG A 8 8.459 -2.222 0.808 1.00 0.00 P ATOM 223 OP1 DG A 8 8.327 -1.232 1.905 1.00 0.00 O ATOM 224 OP2 DG A 8 9.796 -2.816 0.588 1.00 0.00 O ATOM 225 O5' DG A 8 7.393 -3.421 1.015 1.00 0.00 O ATOM 226 C5' DG A 8 6.418 -3.441 2.057 1.00 0.00 C ATOM 227 C4' DG A 8 5.390 -4.577 1.876 1.00 0.00 C ATOM 228 O4' DG A 8 4.474 -4.240 0.835 1.00 0.00 O ATOM 229 C3' DG A 8 6.014 -5.946 1.534 1.00 0.00 C ATOM 230 O3' DG A 8 6.066 -6.890 2.594 1.00 0.00 O ATOM 231 C2' DG A 8 5.064 -6.526 0.483 1.00 0.00 C ATOM 232 C1' DG A 8 4.067 -5.412 0.147 1.00 0.00 C ATOM 233 N9 DG A 8 3.991 -5.141 -1.314 1.00 0.00 N ATOM 234 C8 DG A 8 5.011 -5.087 -2.230 1.00 0.00 C ATOM 235 N7 DG A 8 4.628 -4.867 -3.455 1.00 0.00 N ATOM 236 C5 DG A 8 3.234 -4.786 -3.362 1.00 0.00 C ATOM 237 C6 DG A 8 2.227 -4.571 -4.347 1.00 0.00 C ATOM 238 O6 DG A 8 2.355 -4.390 -5.559 1.00 0.00 O ATOM 239 N1 DG A 8 0.937 -4.563 -3.850 1.00 0.00 N ATOM 240 C2 DG A 8 0.645 -4.729 -2.523 1.00 0.00 C ATOM 241 N2 DG A 8 -0.607 -4.625 -2.169 1.00 0.00 N ATOM 242 N3 DG A 8 1.563 -4.913 -1.574 1.00 0.00 N ATOM 243 C4 DG A 8 2.841 -4.945 -2.042 1.00 0.00 C ATOM 0 H5' DG A 8 5.897 -2.484 2.083 1.00 0.00 H new ATOM 0 H5'' DG A 8 6.919 -3.557 3.018 1.00 0.00 H new ATOM 0 H4' DG A 8 4.894 -4.676 2.841 1.00 0.00 H new ATOM 0 H3' DG A 8 7.050 -5.782 1.239 1.00 0.00 H new ATOM 0 H2' DG A 8 5.611 -6.840 -0.406 1.00 0.00 H new ATOM 0 H2'' DG A 8 4.549 -7.406 0.867 1.00 0.00 H new ATOM 0 H1' DG A 8 3.071 -5.728 0.459 1.00 0.00 H new ATOM 0 H8 DG A 8 6.048 -5.217 -1.957 1.00 0.00 H new ATOM 0 H1 DG A 8 0.166 -4.427 -4.503 1.00 0.00 H new ATOM 0 H21 DG A 8 -0.872 -4.741 -1.191 1.00 0.00 H new ATOM 0 H22 DG A 8 -1.321 -4.428 -2.871 1.00 0.00 H new ATOM 255 P DT A 9 7.045 -6.773 3.867 1.00 0.00 P ATOM 256 OP1 DT A 9 8.132 -5.821 3.552 1.00 0.00 O ATOM 257 OP2 DT A 9 7.389 -8.142 4.316 1.00 0.00 O ATOM 258 O5' DT A 9 6.146 -6.081 5.027 1.00 0.00 O ATOM 259 C5' DT A 9 5.059 -6.758 5.647 1.00 0.00 C ATOM 260 C4' DT A 9 3.729 -6.189 5.157 1.00 0.00 C ATOM 261 O4' DT A 9 3.546 -6.418 3.769 1.00 0.00 O ATOM 262 C3' DT A 9 2.500 -6.822 5.800 1.00 0.00 C ATOM 263 O3' DT A 9 2.165 -6.327 7.078 1.00 0.00 O ATOM 264 C2' DT A 9 1.448 -6.365 4.804 1.00 0.00 C ATOM 265 C1' DT A 9 2.179 -6.586 3.482 1.00 0.00 C ATOM 266 N1 DT A 9 1.786 -7.915 2.918 1.00 0.00 N ATOM 267 C2 DT A 9 2.514 -9.097 3.186 1.00 0.00 C ATOM 268 O2 DT A 9 3.591 -9.181 3.736 1.00 0.00 O ATOM 269 N3 DT A 9 1.913 -10.288 2.794 1.00 0.00 N ATOM 270 C4 DT A 9 0.669 -10.413 2.224 1.00 0.00 C ATOM 271 O4 DT A 9 0.260 -11.546 1.956 1.00 0.00 O ATOM 272 C5 DT A 9 -0.031 -9.163 1.992 1.00 0.00 C ATOM 273 C7 DT A 9 -1.408 -9.115 1.354 1.00 0.00 C ATOM 274 C6 DT A 9 0.553 -7.969 2.317 1.00 0.00 C ATOM 0 H5' DT A 9 5.129 -6.656 6.730 1.00 0.00 H new ATOM 0 H5'' DT A 9 5.111 -7.824 5.423 1.00 0.00 H new ATOM 0 H4' DT A 9 3.800 -5.133 5.419 1.00 0.00 H new ATOM 0 H3' DT A 9 2.624 -7.891 5.972 1.00 0.00 H new ATOM 0 H2' DT A 9 0.533 -6.953 4.872 1.00 0.00 H new ATOM 0 H2'' DT A 9 1.168 -5.322 4.950 1.00 0.00 H new ATOM 0 H1' DT A 9 1.918 -5.878 2.696 1.00 0.00 H new ATOM 0 H3 DT A 9 2.443 -11.146 2.943 1.00 0.00 H new ATOM 0 H71 DT A 9 -1.521 -9.956 0.670 1.00 0.00 H new ATOM 0 H72 DT A 9 -2.171 -9.173 2.130 1.00 0.00 H new ATOM 0 H73 DT A 9 -1.521 -8.181 0.803 1.00 0.00 H new ATOM 0 H6 DT A 9 0.032 -7.049 2.096 1.00 0.00 H new ATOM 287 P DT A 10 1.215 -7.175 8.070 1.00 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1.00 0.00 C ATOM 0 H5' DT B 6 -5.260 -0.343 8.030 1.00 0.00 H new ATOM 0 H5'' DT B 6 -4.050 0.914 8.192 1.00 0.00 H new ATOM 0 H4' DT B 6 -6.701 1.217 6.780 1.00 0.00 H new ATOM 0 H3' DT B 6 -4.727 -0.290 5.658 1.00 0.00 H new ATOM 0 H2' DT B 6 -2.859 1.220 6.134 1.00 0.00 H new ATOM 0 H2'' DT B 6 -3.264 1.689 4.495 1.00 0.00 H new ATOM 0 H1' DT B 6 -4.289 3.674 5.179 1.00 0.00 H new ATOM 0 H3 DT B 6 -0.160 5.101 6.653 1.00 0.00 H new ATOM 0 H71 DT B 6 -3.597 4.412 10.755 1.00 0.00 H new ATOM 0 H72 DT B 6 -2.107 3.474 11.015 1.00 0.00 H new ATOM 0 H73 DT B 6 -2.040 5.251 10.950 1.00 0.00 H new ATOM 0 H6 DT B 6 -4.144 3.313 8.708 1.00 0.00 H new ATOM 511 P DC B 7 -7.023 0.027 4.156 1.00 0.00 P ATOM 512 OP1 DC B 7 -8.197 0.908 4.000 1.00 0.00 O ATOM 513 OP2 DC B 7 -7.047 -1.069 5.147 1.00 0.00 O ATOM 514 O5' DC B 7 -6.750 -0.613 2.727 1.00 0.00 O ATOM 515 C5' DC B 7 -7.065 0.121 1.556 1.00 0.00 C ATOM 516 C4' DC B 7 -6.766 -0.705 0.316 1.00 0.00 C ATOM 517 O4' DC B 7 -5.382 -0.681 0.055 1.00 0.00 O ATOM 518 C3' DC B 7 -7.224 -2.163 0.461 1.00 0.00 C ATOM 519 O3' DC B 7 -7.851 -2.525 -0.760 1.00 0.00 O ATOM 520 C2' DC B 7 -5.901 -2.864 0.798 1.00 0.00 C ATOM 521 C1' DC B 7 -4.844 -1.982 0.119 1.00 0.00 C ATOM 522 N1 DC B 7 -3.580 -1.823 0.859 1.00 0.00 N ATOM 523 C2 DC B 7 -2.357 -1.956 0.154 1.00 0.00 C ATOM 524 O2 DC B 7 -2.320 -2.421 -0.994 1.00 0.00 O ATOM 525 N3 DC B 7 -1.227 -1.589 0.758 1.00 0.00 N ATOM 526 C4 DC B 7 -1.216 -1.076 1.953 1.00 0.00 C ATOM 527 N4 DC B 7 -0.032 -0.752 2.438 1.00 0.00 N ATOM 528 C5 DC B 7 -2.395 -0.937 2.740 1.00 0.00 C ATOM 529 C6 DC B 7 -3.555 -1.327 2.136 1.00 0.00 C ATOM 0 H5' DC B 7 -6.488 1.046 1.533 1.00 0.00 H new ATOM 0 H5'' DC B 7 -8.118 0.403 1.568 1.00 0.00 H new ATOM 0 H4' DC B 7 -7.321 -0.262 -0.510 1.00 0.00 H new ATOM 0 H3' DC B 7 -7.966 -2.409 1.220 1.00 0.00 H new ATOM 0 H2' DC B 7 -5.742 -2.924 1.875 1.00 0.00 H new ATOM 0 H2'' DC B 7 -5.879 -3.884 0.415 1.00 0.00 H new ATOM 0 H1' DC B 7 -4.619 -2.465 -0.832 1.00 0.00 H new ATOM 0 H41 DC B 7 0.043 -0.345 3.370 1.00 0.00 H new ATOM 0 H42 DC B 7 0.808 -0.908 1.880 1.00 0.00 H new ATOM 0 H5 DC B 7 -2.372 -0.549 3.748 1.00 0.00 H new ATOM 0 H6 DC B 7 -4.483 -1.242 2.682 1.00 0.00 H new ATOM 541 P DG B 8 -8.532 -3.957 -1.023 1.00 0.00 P ATOM 542 OP1 DG B 8 -9.315 -3.851 -2.278 1.00 0.00 O ATOM 543 OP2 DG B 8 -9.206 -4.437 0.216 1.00 0.00 O ATOM 544 O5' DG B 8 -7.258 -4.915 -1.291 1.00 0.00 O ATOM 545 C5' DG B 8 -6.334 -4.662 -2.349 1.00 0.00 C ATOM 546 C4' DG B 8 -5.028 -5.467 -2.212 1.00 0.00 C ATOM 547 O4' DG B 8 -4.220 -4.939 -1.177 1.00 0.00 O ATOM 548 C3' DG B 8 -5.242 -6.948 -1.866 1.00 0.00 C ATOM 549 O3' DG B 8 -5.456 -7.769 -3.024 1.00 0.00 O ATOM 550 C2' DG B 8 -4.080 -7.300 -0.925 1.00 0.00 C ATOM 551 C1' DG B 8 -3.393 -5.957 -0.648 1.00 0.00 C ATOM 552 N9 DG B 8 -3.217 -5.660 0.797 1.00 0.00 N ATOM 553 C8 DG B 8 -4.155 -5.707 1.793 1.00 0.00 C ATOM 554 N7 DG B 8 -3.746 -5.236 2.944 1.00 0.00 N ATOM 555 C5 DG B 8 -2.420 -4.856 2.694 1.00 0.00 C ATOM 556 C6 DG B 8 -1.430 -4.253 3.527 1.00 0.00 C ATOM 557 O6 DG B 8 -1.493 -3.934 4.732 1.00 0.00 O ATOM 558 N1 DG B 8 -0.238 -4.013 2.878 1.00 0.00 N ATOM 559 C2 DG B 8 -0.003 -4.342 1.575 1.00 0.00 C ATOM 560 N2 DG B 8 1.198 -4.097 1.127 1.00 0.00 N ATOM 561 N3 DG B 8 -0.876 -4.954 0.780 1.00 0.00 N ATOM 562 C4 DG B 8 -2.083 -5.154 1.381 1.00 0.00 C ATOM 0 H5' DG B 8 -6.098 -3.598 -2.371 1.00 0.00 H new ATOM 0 H5'' DG B 8 -6.805 -4.904 -3.302 1.00 0.00 H new ATOM 0 H4' DG B 8 -4.558 -5.390 -3.192 1.00 0.00 H new ATOM 0 H3' DG B 8 -6.176 -7.152 -1.342 1.00 0.00 H new ATOM 0 H2' DG B 8 -4.440 -7.760 -0.004 1.00 0.00 H new ATOM 0 H2'' DG B 8 -3.394 -8.009 -1.389 1.00 0.00 H new ATOM 0 H1' DG B 8 -2.403 -6.005 -1.101 1.00 0.00 H new ATOM 0 H8 DG B 8 -5.150 -6.100 1.642 1.00 0.00 H new ATOM 0 H1 DG B 8 0.512 -3.563 3.403 1.00 0.00 H new ATOM 0 H21 DG B 8 1.437 -4.320 0.161 1.00 0.00 H new ATOM 0 H22 DG B 8 1.897 -3.682 1.743 1.00 0.00 H new ATOM 574 P DT B 9 -4.303 -8.403 -3.990 1.00 0.00 P ATOM 575 OP1 DT B 9 -4.944 -8.621 -5.306 1.00 0.00 O ATOM 576 OP2 DT B 9 -3.769 -9.600 -3.304 1.00 0.00 O ATOM 577 O5' DT B 9 -3.109 -7.301 -4.114 1.00 0.00 O ATOM 578 C5' DT B 9 -3.014 -6.322 -5.153 1.00 0.00 C ATOM 579 C4' DT B 9 -1.916 -6.632 -6.194 1.00 0.00 C ATOM 580 O4' DT B 9 -0.634 -6.453 -5.604 1.00 0.00 O ATOM 581 C3' DT B 9 -1.947 -8.045 -6.792 1.00 0.00 C ATOM 582 O3' DT B 9 -1.637 -8.010 -8.183 1.00 0.00 O ATOM 583 C2' DT B 9 -0.822 -8.750 -6.049 1.00 0.00 C ATOM 584 C1' DT B 9 0.162 -7.592 -5.886 1.00 0.00 C ATOM 585 N1 DT B 9 1.118 -7.835 -4.778 1.00 0.00 N ATOM 586 C2 DT B 9 2.475 -8.011 -5.073 1.00 0.00 C ATOM 587 O2 DT B 9 2.935 -7.998 -6.212 1.00 0.00 O ATOM 588 N3 DT B 9 3.317 -8.237 -4.005 1.00 0.00 N ATOM 589 C4 DT B 9 2.938 -8.349 -2.683 1.00 0.00 C ATOM 590 O4 DT B 9 3.798 -8.552 -1.840 1.00 0.00 O ATOM 591 C5 DT B 9 1.502 -8.195 -2.455 1.00 0.00 C ATOM 592 C7 DT B 9 0.932 -8.327 -1.060 1.00 0.00 C ATOM 593 C6 DT B 9 0.656 -7.941 -3.482 1.00 0.00 C ATOM 0 H5' DT B 9 -2.815 -5.348 -4.706 1.00 0.00 H new ATOM 0 H5'' DT B 9 -3.975 -6.249 -5.662 1.00 0.00 H new ATOM 0 H4' DT B 9 -2.115 -5.938 -7.011 1.00 0.00 H new ATOM 0 H3' DT B 9 -2.921 -8.525 -6.695 1.00 0.00 H new ATOM 0 H2' DT B 9 -1.147 -9.157 -5.092 1.00 0.00 H new ATOM 0 H2'' DT B 9 -0.400 -9.577 -6.621 1.00 0.00 H new ATOM 0 H1' DT B 9 0.764 -7.465 -6.786 1.00 0.00 H new ATOM 0 H3 DT B 9 4.312 -8.330 -4.211 1.00 0.00 H new ATOM 0 H71 DT B 9 0.044 -7.701 -0.969 1.00 0.00 H new ATOM 0 H72 DT B 9 0.663 -9.367 -0.874 1.00 0.00 H new ATOM 0 H73 DT B 9 1.677 -8.009 -0.331 1.00 0.00 H new ATOM 0 H6 DT B 9 -0.399 -7.819 -3.283 1.00 0.00 H new ATOM 606 P DT B 10 -2.215 -9.129 -9.192 1.00 0.00 P ATOM 607 OP1 DT B 10 -2.574 -10.341 -8.422 1.00 0.00 O ATOM 608 OP2 DT B 10 -1.376 -9.232 -10.407 1.00 0.00 O ATOM 609 O5' DT B 10 -3.571 -8.451 -9.713 1.00 0.00 O ATOM 610 C5' DT B 10 -4.614 -8.122 -8.817 1.00 0.00 C ATOM 611 C4' DT B 10 -5.891 -7.958 -9.626 1.00 0.00 C ATOM 612 O4' DT B 10 -6.235 -9.200 -10.219 1.00 0.00 O ATOM 613 C3' DT B 10 -7.090 -7.591 -8.741 1.00 0.00 C ATOM 614 O3' DT B 10 -7.417 -6.206 -8.652 1.00 0.00 O ATOM 615 C2' DT B 10 -8.223 -8.458 -9.302 1.00 0.00 C ATOM 616 C1' DT B 10 -7.605 -9.129 -10.543 1.00 0.00 C ATOM 617 N1 DT B 10 -8.091 -10.487 -10.928 1.00 0.00 N ATOM 618 C2 DT B 10 -7.495 -11.097 -12.051 1.00 0.00 C ATOM 619 O2 DT B 10 -6.625 -10.563 -12.750 1.00 0.00 O ATOM 620 N3 DT B 10 -7.927 -12.360 -12.383 1.00 0.00 N ATOM 621 C4 DT B 10 -8.896 -13.095 -11.721 1.00 0.00 C ATOM 622 O4 DT B 10 -9.173 -14.206 -12.139 1.00 0.00 O ATOM 623 C5 DT B 10 -9.488 -12.404 -10.575 1.00 0.00 C ATOM 624 C7 DT B 10 -10.587 -13.063 -9.751 1.00 0.00 C ATOM 625 C6 DT B 10 -9.098 -11.155 -10.241 1.00 0.00 C ATOM 0 H5' DT B 10 -4.381 -7.202 -8.282 1.00 0.00 H new ATOM 0 H5'' DT B 10 -4.735 -8.905 -8.068 1.00 0.00 H new ATOM 0 H4' DT B 10 -5.697 -7.172 -10.356 1.00 0.00 H new ATOM 0 H3' DT B 10 -6.867 -7.790 -7.693 1.00 0.00 H new ATOM 0 H2' DT B 10 -8.557 -9.197 -8.574 1.00 0.00 H new ATOM 0 H2'' DT B 10 -9.092 -7.856 -9.566 1.00 0.00 H new ATOM 0 H1' DT B 10 -7.881 -8.539 -11.417 1.00 0.00 H new ATOM 0 H3 DT B 10 -7.492 -12.797 -13.195 1.00 0.00 H new ATOM 0 H71 DT B 10 -10.531 -12.709 -8.721 1.00 0.00 H new ATOM 0 H72 DT B 10 -11.560 -12.807 -10.171 1.00 0.00 H new ATOM 0 H73 DT B 10 -10.457 -14.145 -9.771 1.00 0.00 H new ATOM 0 H6 DT B 10 -9.584 -10.659 -9.414 1.00 0.00 H new TER 638 DT B 10