USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 274 hydrogens (25 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 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT O5' : rot 16:sc= 0.584 USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 25 DA O3' : rot -45:sc= 0.00469 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 4 6.046 -9.925 -12.090 1.00 1.19 O ATOM 2 C5' DT A 4 6.465 -10.905 -11.135 1.00 0.85 C ATOM 3 C4' DT A 4 7.959 -10.859 -10.904 1.00 0.71 C ATOM 4 O4' DT A 4 8.263 -11.499 -9.638 1.00 0.84 O ATOM 5 C3' DT A 4 8.797 -11.590 -11.959 1.00 0.65 C ATOM 6 O3' DT A 4 10.002 -10.863 -12.231 1.00 0.62 O ATOM 7 C2' DT A 4 9.113 -12.921 -11.303 1.00 0.69 C ATOM 8 C1' DT A 4 9.195 -12.551 -9.834 1.00 0.72 C ATOM 9 N1 DT A 4 8.849 -13.646 -8.906 1.00 0.80 N ATOM 10 C2 DT A 4 7.542 -14.082 -8.869 1.00 1.15 C ATOM 11 O2 DT A 4 6.660 -13.606 -9.565 1.00 1.40 O ATOM 12 N3 DT A 4 7.304 -15.100 -7.983 1.00 1.23 N ATOM 13 C4 DT A 4 8.219 -15.712 -7.150 1.00 0.99 C ATOM 14 O4 DT A 4 7.857 -16.618 -6.404 1.00 1.13 O ATOM 15 C5 DT A 4 9.571 -15.207 -7.241 1.00 0.68 C ATOM 16 C7 DT A 4 10.630 -15.811 -6.373 1.00 0.62 C ATOM 17 C6 DT A 4 9.820 -14.210 -8.103 1.00 0.63 C ATOM 0 H5' DT A 4 6.181 -11.898 -11.484 1.00 0.85 H new ATOM 0 H5'' DT A 4 5.946 -10.739 -10.191 1.00 0.85 H new ATOM 0 H4' DT A 4 8.217 -9.801 -10.939 1.00 0.71 H new ATOM 0 H3' DT A 4 8.282 -11.699 -12.913 1.00 0.65 H new ATOM 0 H2' DT A 4 8.336 -13.661 -11.492 1.00 0.69 H new ATOM 0 H2'' DT A 4 10.050 -13.341 -11.669 1.00 0.69 H new ATOM 0 HO5' DT A 4 6.826 -9.594 -12.583 1.00 1.19 H new ATOM 0 H1' DT A 4 10.229 -12.284 -9.614 1.00 0.72 H new ATOM 0 H3 DT A 4 6.345 -15.443 -7.934 1.00 1.23 H new ATOM 0 H71 DT A 4 11.594 -15.749 -6.878 1.00 0.62 H new ATOM 0 H72 DT A 4 10.679 -15.269 -5.429 1.00 0.62 H new ATOM 0 H73 DT A 4 10.389 -16.856 -6.179 1.00 0.62 H new ATOM 0 H6 DT A 4 10.829 -13.830 -8.172 1.00 0.63 H new ATOM 31 P DG A 5 9.984 -9.660 -13.297 1.00 0.84 P ATOM 32 OP1 DG A 5 8.588 -9.160 -13.374 1.00 1.21 O ATOM 33 OP2 DG A 5 10.668 -10.120 -14.532 1.00 1.24 O ATOM 34 O5' DG A 5 10.881 -8.530 -12.619 1.00 0.54 O ATOM 35 C5' DG A 5 10.663 -7.148 -12.904 1.00 0.51 C ATOM 36 C4' DG A 5 11.953 -6.375 -12.749 1.00 0.43 C ATOM 37 O4' DG A 5 12.549 -6.699 -11.467 1.00 0.34 O ATOM 38 C3' DG A 5 13.021 -6.690 -13.799 1.00 0.43 C ATOM 39 O3' DG A 5 13.772 -5.512 -14.116 1.00 0.48 O ATOM 40 C2' DG A 5 13.901 -7.712 -13.104 1.00 0.37 C ATOM 41 C1' DG A 5 13.838 -7.264 -11.655 1.00 0.30 C ATOM 42 N9 DG A 5 14.006 -8.341 -10.682 1.00 0.40 N ATOM 43 C8 DG A 5 13.021 -9.124 -10.133 1.00 0.51 C ATOM 44 N7 DG A 5 13.474 -10.009 -9.289 1.00 0.57 N ATOM 45 C5 DG A 5 14.847 -9.799 -9.279 1.00 0.80 C ATOM 46 C6 DG A 5 15.871 -10.458 -8.552 1.00 1.25 C ATOM 47 O6 DG A 5 15.763 -11.391 -7.746 1.00 1.36 O ATOM 48 N1 DG A 5 17.131 -9.933 -8.834 1.00 1.65 N ATOM 49 C2 DG A 5 17.362 -8.899 -9.712 1.00 1.61 C ATOM 50 N2 DG A 5 18.642 -8.526 -9.858 1.00 2.08 N ATOM 51 N3 DG A 5 16.416 -8.276 -10.395 1.00 1.16 N ATOM 52 C4 DG A 5 15.191 -8.773 -10.132 1.00 0.77 C ATOM 0 H5' DG A 5 9.906 -6.745 -12.231 1.00 0.51 H new ATOM 0 H5'' DG A 5 10.281 -7.034 -13.919 1.00 0.51 H new ATOM 0 H4' DG A 5 11.669 -5.328 -12.855 1.00 0.43 H new ATOM 0 H3' DG A 5 12.607 -7.052 -14.740 1.00 0.43 H new ATOM 0 H2' DG A 5 13.524 -8.727 -13.232 1.00 0.37 H new ATOM 0 H2'' DG A 5 14.921 -7.699 -13.489 1.00 0.37 H new ATOM 0 H1' DG A 5 14.661 -6.570 -11.484 1.00 0.30 H new ATOM 0 H8 DG A 5 11.974 -9.018 -10.376 1.00 0.51 H new ATOM 0 H1 DG A 5 17.935 -10.342 -8.358 1.00 1.65 H new ATOM 0 H21 DG A 5 18.882 -7.765 -10.494 1.00 2.08 H new ATOM 0 H22 DG A 5 19.375 -9.003 -9.333 1.00 2.08 H new ATOM 64 P DA A 6 13.368 -4.622 -15.394 1.00 0.62 P ATOM 65 OP1 DA A 6 13.019 -5.555 -16.495 1.00 0.71 O ATOM 66 OP2 DA A 6 14.428 -3.604 -15.606 1.00 0.75 O ATOM 67 O5' DA A 6 12.037 -3.873 -14.938 1.00 0.65 O ATOM 68 C5' DA A 6 12.086 -2.787 -14.012 1.00 0.63 C ATOM 69 C4' DA A 6 10.694 -2.257 -13.760 1.00 0.64 C ATOM 70 O4' DA A 6 9.841 -3.337 -13.328 1.00 0.59 O ATOM 71 C3' DA A 6 10.593 -1.216 -12.653 1.00 0.68 C ATOM 72 O3' DA A 6 10.809 0.097 -13.183 1.00 0.87 O ATOM 73 C2' DA A 6 9.162 -1.374 -12.167 1.00 0.60 C ATOM 74 C1' DA A 6 8.851 -2.846 -12.431 1.00 0.58 C ATOM 75 N9 DA A 6 8.873 -3.690 -11.234 1.00 0.58 N ATOM 76 C8 DA A 6 9.917 -3.890 -10.364 1.00 0.59 C ATOM 77 N7 DA A 6 9.633 -4.704 -9.377 1.00 0.62 N ATOM 78 C5 DA A 6 8.314 -5.065 -9.610 1.00 0.65 C ATOM 79 C6 DA A 6 7.428 -5.909 -8.918 1.00 0.73 C ATOM 80 N6 DA A 6 7.751 -6.569 -7.803 1.00 0.78 N ATOM 81 N1 DA A 6 6.180 -6.053 -9.416 1.00 0.78 N ATOM 82 C2 DA A 6 5.855 -5.391 -10.534 1.00 0.76 C ATOM 83 N3 DA A 6 6.599 -4.570 -11.272 1.00 0.69 N ATOM 84 C4 DA A 6 7.832 -4.448 -10.750 1.00 0.63 C ATOM 0 H5' DA A 6 12.721 -1.992 -14.405 1.00 0.63 H new ATOM 0 H5'' DA A 6 12.533 -3.118 -13.075 1.00 0.63 H new ATOM 0 H4' DA A 6 10.404 -1.799 -14.706 1.00 0.64 H new ATOM 0 H3' DA A 6 11.331 -1.348 -11.862 1.00 0.68 H new ATOM 0 H2' DA A 6 9.069 -1.128 -11.109 1.00 0.60 H new ATOM 0 H2'' DA A 6 8.481 -0.717 -12.708 1.00 0.60 H new ATOM 0 H1' DA A 6 7.838 -2.893 -12.830 1.00 0.58 H new ATOM 0 H8 DA A 6 10.882 -3.420 -10.482 1.00 0.59 H new ATOM 0 H61 DA A 6 7.062 -7.167 -7.347 1.00 0.78 H new ATOM 0 H62 DA A 6 8.687 -6.475 -7.408 1.00 0.78 H new ATOM 0 H2 DA A 6 4.846 -5.545 -10.887 1.00 0.76 H new ATOM 96 P DG A 7 10.574 1.387 -12.252 1.00 1.05 P ATOM 97 OP1 DG A 7 11.344 2.509 -12.845 1.00 1.36 O ATOM 98 OP2 DG A 7 10.819 0.995 -10.840 1.00 1.08 O ATOM 99 O5' DG A 7 9.022 1.706 -12.421 1.00 1.01 O ATOM 100 C5' DG A 7 8.346 2.575 -11.513 1.00 0.89 C ATOM 101 C4' DG A 7 6.861 2.295 -11.535 1.00 0.81 C ATOM 102 O4' DG A 7 6.635 0.906 -11.187 1.00 0.75 O ATOM 103 C3' DG A 7 6.037 3.113 -10.538 1.00 0.81 C ATOM 104 O3' DG A 7 4.745 3.407 -11.081 1.00 0.88 O ATOM 105 C2' DG A 7 5.919 2.184 -9.345 1.00 0.72 C ATOM 106 C1' DG A 7 5.856 0.817 -10.002 1.00 0.66 C ATOM 107 N9 DG A 7 6.396 -0.268 -9.187 1.00 0.58 N ATOM 108 C8 DG A 7 7.704 -0.451 -8.813 1.00 0.59 C ATOM 109 N7 DG A 7 7.887 -1.511 -8.074 1.00 0.59 N ATOM 110 C5 DG A 7 6.619 -2.063 -7.953 1.00 0.55 C ATOM 111 C6 DG A 7 6.188 -3.226 -7.264 1.00 0.55 C ATOM 112 O6 DG A 7 6.867 -4.018 -6.602 1.00 0.61 O ATOM 113 N1 DG A 7 4.815 -3.430 -7.395 1.00 0.52 N ATOM 114 C2 DG A 7 3.971 -2.606 -8.105 1.00 0.52 C ATOM 115 N2 DG A 7 2.675 -2.955 -8.120 1.00 0.55 N ATOM 116 N3 DG A 7 4.362 -1.519 -8.750 1.00 0.55 N ATOM 117 C4 DG A 7 5.688 -1.310 -8.632 1.00 0.54 C ATOM 0 H5' DG A 7 8.532 3.614 -11.785 1.00 0.89 H new ATOM 0 H5'' DG A 7 8.736 2.435 -10.505 1.00 0.89 H new ATOM 0 H4' DG A 7 6.540 2.560 -12.543 1.00 0.81 H new ATOM 0 H3' DG A 7 6.488 4.074 -10.289 1.00 0.81 H new ATOM 0 H2' DG A 7 6.774 2.273 -8.674 1.00 0.72 H new ATOM 0 H2'' DG A 7 5.027 2.392 -8.754 1.00 0.72 H new ATOM 0 H1' DG A 7 4.807 0.576 -10.174 1.00 0.66 H new ATOM 0 H8 DG A 7 8.503 0.216 -9.102 1.00 0.59 H new ATOM 0 H1 DG A 7 4.409 -4.244 -6.934 1.00 0.52 H new ATOM 0 H21 DG A 7 1.999 -2.385 -8.629 1.00 0.55 H new ATOM 0 H22 DG A 7 2.366 -3.790 -7.623 1.00 0.55 H new ATOM 129 P DG A 8 3.743 4.383 -10.286 1.00 0.96 P ATOM 130 OP1 DG A 8 3.128 5.296 -11.283 1.00 1.20 O ATOM 131 OP2 DG A 8 4.468 4.951 -9.121 1.00 1.05 O ATOM 132 O5' DG A 8 2.606 3.408 -9.741 1.00 0.80 O ATOM 133 C5' DG A 8 1.708 2.752 -10.637 1.00 0.58 C ATOM 134 C4' DG A 8 0.600 2.072 -9.865 1.00 0.46 C ATOM 135 O4' DG A 8 1.162 0.978 -9.095 1.00 0.51 O ATOM 136 C3' DG A 8 -0.128 2.968 -8.857 1.00 0.34 C ATOM 137 O3' DG A 8 -1.529 2.670 -8.849 1.00 0.35 O ATOM 138 C2' DG A 8 0.505 2.596 -7.529 1.00 0.32 C ATOM 139 C1' DG A 8 0.825 1.126 -7.726 1.00 0.39 C ATOM 140 N9 DG A 8 1.949 0.639 -6.928 1.00 0.45 N ATOM 141 C8 DG A 8 3.208 1.181 -6.852 1.00 0.62 C ATOM 142 N7 DG A 8 4.004 0.526 -6.053 1.00 0.69 N ATOM 143 C5 DG A 8 3.223 -0.514 -5.571 1.00 0.53 C ATOM 144 C6 DG A 8 3.544 -1.556 -4.664 1.00 0.54 C ATOM 145 O6 DG A 8 4.619 -1.768 -4.093 1.00 0.68 O ATOM 146 N1 DG A 8 2.460 -2.404 -4.442 1.00 0.42 N ATOM 147 C2 DG A 8 1.224 -2.256 -5.029 1.00 0.37 C ATOM 148 N2 DG A 8 0.298 -3.170 -4.701 1.00 0.44 N ATOM 149 N3 DG A 8 0.914 -1.288 -5.877 1.00 0.35 N ATOM 150 C4 DG A 8 1.953 -0.460 -6.100 1.00 0.40 C ATOM 0 H5' DG A 8 2.250 2.017 -11.232 1.00 0.58 H new ATOM 0 H5'' DG A 8 1.284 3.476 -11.333 1.00 0.58 H new ATOM 0 H4' DG A 8 -0.120 1.759 -10.621 1.00 0.46 H new ATOM 0 H3' DG A 8 -0.040 4.030 -9.085 1.00 0.34 H new ATOM 0 H2' DG A 8 1.400 3.184 -7.326 1.00 0.32 H new ATOM 0 H2'' DG A 8 -0.177 2.756 -6.694 1.00 0.32 H new ATOM 0 H1' DG A 8 -0.042 0.547 -7.410 1.00 0.39 H new ATOM 0 H8 DG A 8 3.509 2.062 -7.399 1.00 0.62 H new ATOM 0 H1 DG A 8 2.592 -3.187 -3.801 1.00 0.42 H new ATOM 0 H21 DG A 8 -0.638 -3.115 -5.103 1.00 0.44 H new ATOM 0 H22 DG A 8 0.530 -3.920 -4.050 1.00 0.44 H new ATOM 162 P DG A 9 -2.580 3.769 -8.322 1.00 0.42 P ATOM 163 OP1 DG A 9 -3.938 3.182 -8.457 1.00 0.78 O ATOM 164 OP2 DG A 9 -2.272 5.063 -8.982 1.00 0.69 O ATOM 165 O5' DG A 9 -2.250 3.907 -6.769 1.00 0.81 O ATOM 166 C5' DG A 9 -3.293 4.023 -5.800 1.00 0.60 C ATOM 167 C4' DG A 9 -3.517 2.695 -5.113 1.00 0.47 C ATOM 168 O4' DG A 9 -2.240 2.030 -4.932 1.00 0.38 O ATOM 169 C3' DG A 9 -4.150 2.790 -3.715 1.00 0.46 C ATOM 170 O3' DG A 9 -5.232 1.860 -3.597 1.00 0.55 O ATOM 171 C2' DG A 9 -3.018 2.412 -2.771 1.00 0.43 C ATOM 172 C1' DG A 9 -2.174 1.492 -3.626 1.00 0.33 C ATOM 173 N9 DG A 9 -0.769 1.412 -3.230 1.00 0.27 N ATOM 174 C8 DG A 9 0.268 2.190 -3.685 1.00 0.33 C ATOM 175 N7 DG A 9 1.416 1.887 -3.145 1.00 0.36 N ATOM 176 C5 DG A 9 1.121 0.843 -2.280 1.00 0.32 C ATOM 177 C6 DG A 9 1.968 0.102 -1.418 1.00 0.41 C ATOM 178 O6 DG A 9 3.186 0.229 -1.248 1.00 0.51 O ATOM 179 N1 DG A 9 1.267 -0.872 -0.710 1.00 0.45 N ATOM 180 C2 DG A 9 -0.086 -1.095 -0.827 1.00 0.44 C ATOM 181 N2 DG A 9 -0.591 -2.079 -0.065 1.00 0.57 N ATOM 182 N3 DG A 9 -0.886 -0.409 -1.628 1.00 0.36 N ATOM 183 C4 DG A 9 -0.221 0.537 -2.319 1.00 0.28 C ATOM 0 H5' DG A 9 -4.213 4.351 -6.283 1.00 0.60 H new ATOM 0 H5'' DG A 9 -3.032 4.783 -5.063 1.00 0.60 H new ATOM 0 H4' DG A 9 -4.207 2.156 -5.762 1.00 0.47 H new ATOM 0 H3' DG A 9 -4.561 3.777 -3.503 1.00 0.46 H new ATOM 0 H2' DG A 9 -2.457 3.286 -2.439 1.00 0.43 H new ATOM 0 H2'' DG A 9 -3.386 1.910 -1.876 1.00 0.43 H new ATOM 0 H1' DG A 9 -2.561 0.478 -3.531 1.00 0.33 H new ATOM 0 H8 DG A 9 0.145 2.974 -4.417 1.00 0.33 H new ATOM 0 H1 DG A 9 1.792 -1.459 -0.062 1.00 0.45 H new ATOM 0 H21 DG A 9 -1.587 -2.295 -0.105 1.00 0.57 H new ATOM 0 H22 DG A 9 0.022 -2.610 0.554 1.00 0.57 H new ATOM 195 P DT A 10 -6.713 2.290 -4.054 1.00 0.56 P ATOM 196 OP1 DT A 10 -6.573 3.348 -5.087 1.00 0.81 O ATOM 197 OP2 DT A 10 -7.518 2.557 -2.835 1.00 0.87 O ATOM 198 O5' DT A 10 -7.293 0.983 -4.760 1.00 0.64 O ATOM 199 C5' DT A 10 -6.618 0.385 -5.866 1.00 0.80 C ATOM 200 C4' DT A 10 -6.949 -1.087 -5.946 1.00 0.78 C ATOM 201 O4' DT A 10 -8.287 -1.247 -6.477 1.00 0.87 O ATOM 202 C3' DT A 10 -6.050 -1.897 -6.872 1.00 0.96 C ATOM 203 O3' DT A 10 -4.929 -2.420 -6.149 1.00 1.39 O ATOM 204 C2' DT A 10 -6.964 -3.016 -7.332 1.00 0.99 C ATOM 205 C1' DT A 10 -8.324 -2.333 -7.397 1.00 0.89 C ATOM 206 N1 DT A 10 -8.670 -1.792 -8.728 1.00 1.11 N ATOM 207 C2 DT A 10 -8.928 -2.685 -9.744 1.00 1.44 C ATOM 208 O2 DT A 10 -8.885 -3.896 -9.596 1.00 1.56 O ATOM 209 N3 DT A 10 -9.241 -2.107 -10.948 1.00 1.84 N ATOM 210 C4 DT A 10 -9.320 -0.758 -11.229 1.00 1.99 C ATOM 211 O4 DT A 10 -9.613 -0.387 -12.363 1.00 2.44 O ATOM 212 C5 DT A 10 -9.037 0.122 -10.118 1.00 1.74 C ATOM 213 C7 DT A 10 -9.100 1.602 -10.333 1.00 2.15 C ATOM 214 C6 DT A 10 -8.730 -0.428 -8.934 1.00 1.35 C ATOM 0 H5' DT A 10 -5.541 0.518 -5.759 1.00 0.80 H new ATOM 0 H5'' DT A 10 -6.910 0.882 -6.791 1.00 0.80 H new ATOM 0 H4' DT A 10 -6.822 -1.454 -4.928 1.00 0.78 H new ATOM 0 H3' DT A 10 -5.633 -1.316 -7.694 1.00 0.96 H new ATOM 0 H2' DT A 10 -6.663 -3.412 -8.302 1.00 0.99 H new ATOM 0 H2'' DT A 10 -6.964 -3.852 -6.633 1.00 0.99 H new ATOM 0 H1' DT A 10 -9.079 -3.084 -7.163 1.00 0.89 H new ATOM 0 H3 DT A 10 -9.437 -2.744 -11.720 1.00 1.84 H new ATOM 0 H71 DT A 10 -9.393 2.092 -9.405 1.00 2.15 H new ATOM 0 H72 DT A 10 -8.121 1.967 -10.643 1.00 2.15 H new ATOM 0 H73 DT A 10 -9.832 1.826 -11.109 1.00 2.15 H new ATOM 0 H6 DT A 10 -8.520 0.227 -8.102 1.00 1.35 H new ATOM 227 P DG A 11 -3.775 -3.222 -6.930 1.00 1.39 P ATOM 228 OP1 DG A 11 -2.536 -3.121 -6.118 1.00 2.26 O ATOM 229 OP2 DG A 11 -3.764 -2.769 -8.345 1.00 1.48 O ATOM 230 O5' DG A 11 -4.268 -4.737 -6.892 1.00 1.06 O ATOM 231 C5' DG A 11 -3.975 -5.636 -7.963 1.00 0.63 C ATOM 232 C4' DG A 11 -3.703 -7.022 -7.424 1.00 0.60 C ATOM 233 O4' DG A 11 -2.300 -7.337 -7.612 1.00 0.49 O ATOM 234 C3' DG A 11 -3.970 -7.198 -5.928 1.00 0.67 C ATOM 235 O3' DG A 11 -4.436 -8.526 -5.658 1.00 0.87 O ATOM 236 C2' DG A 11 -2.605 -6.972 -5.306 1.00 0.51 C ATOM 237 C1' DG A 11 -1.670 -7.546 -6.356 1.00 0.45 C ATOM 238 N9 DG A 11 -0.352 -6.914 -6.401 1.00 0.35 N ATOM 239 C8 DG A 11 0.001 -5.783 -7.096 1.00 0.38 C ATOM 240 N7 DG A 11 1.256 -5.458 -6.949 1.00 0.42 N ATOM 241 C5 DG A 11 1.764 -6.435 -6.103 1.00 0.37 C ATOM 242 C6 DG A 11 3.072 -6.609 -5.587 1.00 0.44 C ATOM 243 O6 DG A 11 4.072 -5.908 -5.784 1.00 0.57 O ATOM 244 N1 DG A 11 3.163 -7.730 -4.764 1.00 0.40 N ATOM 245 C2 DG A 11 2.113 -8.573 -4.482 1.00 0.35 C ATOM 246 N2 DG A 11 2.385 -9.604 -3.665 1.00 0.41 N ATOM 247 N3 DG A 11 0.888 -8.422 -4.958 1.00 0.35 N ATOM 248 C4 DG A 11 0.786 -7.340 -5.756 1.00 0.32 C ATOM 0 H5' DG A 11 -3.109 -5.279 -8.520 1.00 0.63 H new ATOM 0 H5'' DG A 11 -4.812 -5.667 -8.660 1.00 0.63 H new ATOM 0 H4' DG A 11 -4.385 -7.673 -7.971 1.00 0.60 H new ATOM 0 H3' DG A 11 -4.733 -6.523 -5.541 1.00 0.67 H new ATOM 0 H2' DG A 11 -2.411 -5.915 -5.124 1.00 0.51 H new ATOM 0 H2'' DG A 11 -2.505 -7.484 -4.349 1.00 0.51 H new ATOM 0 H1' DG A 11 -1.497 -8.594 -6.111 1.00 0.45 H new ATOM 0 H8 DG A 11 -0.691 -5.219 -7.704 1.00 0.38 H new ATOM 0 H1 DG A 11 4.068 -7.939 -4.343 1.00 0.40 H new ATOM 0 H21 DG A 11 1.650 -10.266 -3.417 1.00 0.41 H new ATOM 0 H22 DG A 11 3.327 -9.725 -3.293 1.00 0.41 H new ATOM 260 P DG A 12 -5.258 -8.829 -4.309 1.00 1.10 P ATOM 261 OP1 DG A 12 -5.913 -10.151 -4.477 1.00 1.54 O ATOM 262 OP2 DG A 12 -6.083 -7.637 -3.985 1.00 1.49 O ATOM 263 O5' DG A 12 -4.128 -8.975 -3.195 1.00 0.85 O ATOM 264 C5' DG A 12 -4.318 -8.454 -1.880 1.00 0.91 C ATOM 265 C4' DG A 12 -3.225 -8.949 -0.962 1.00 0.69 C ATOM 266 O4' DG A 12 -1.939 -8.628 -1.548 1.00 0.59 O ATOM 267 C3' DG A 12 -3.229 -8.326 0.440 1.00 0.64 C ATOM 268 O3' DG A 12 -3.074 -9.343 1.436 1.00 0.65 O ATOM 269 C2' DG A 12 -2.028 -7.392 0.440 1.00 0.59 C ATOM 270 C1' DG A 12 -1.102 -8.031 -0.577 1.00 0.52 C ATOM 271 N9 DG A 12 -0.216 -7.091 -1.260 1.00 0.46 N ATOM 272 C8 DG A 12 -0.555 -6.199 -2.248 1.00 0.46 C ATOM 273 N7 DG A 12 0.450 -5.477 -2.659 1.00 0.44 N ATOM 274 C5 DG A 12 1.522 -5.920 -1.896 1.00 0.42 C ATOM 275 C6 DG A 12 2.878 -5.506 -1.896 1.00 0.44 C ATOM 276 O6 DG A 12 3.412 -4.635 -2.591 1.00 0.46 O ATOM 277 N1 DG A 12 3.638 -6.214 -0.966 1.00 0.46 N ATOM 278 C2 DG A 12 3.140 -7.199 -0.144 1.00 0.47 C ATOM 279 N2 DG A 12 4.021 -7.782 0.683 1.00 0.53 N ATOM 280 N3 DG A 12 1.876 -7.592 -0.135 1.00 0.46 N ATOM 281 C4 DG A 12 1.129 -6.916 -1.030 1.00 0.43 C ATOM 0 H5' DG A 12 -5.292 -8.760 -1.497 1.00 0.91 H new ATOM 0 H5'' DG A 12 -4.314 -7.364 -1.908 1.00 0.91 H new ATOM 0 H4' DG A 12 -3.406 -10.018 -0.852 1.00 0.69 H new ATOM 0 H3' DG A 12 -4.160 -7.806 0.666 1.00 0.64 H new ATOM 0 H2' DG A 12 -2.305 -6.378 0.153 1.00 0.59 H new ATOM 0 H2'' DG A 12 -1.565 -7.329 1.425 1.00 0.59 H new ATOM 0 H1' DG A 12 -0.453 -8.731 -0.050 1.00 0.52 H new ATOM 0 H8 DG A 12 -1.555 -6.105 -2.645 1.00 0.46 H new ATOM 0 H1 DG A 12 4.629 -5.987 -0.890 1.00 0.46 H new ATOM 0 H21 DG A 12 3.714 -8.519 1.317 1.00 0.53 H new ATOM 0 H22 DG A 12 4.998 -7.488 0.677 1.00 0.53 H new ATOM 293 P DG A 13 -3.624 -9.092 2.926 1.00 0.67 P ATOM 294 OP1 DG A 13 -3.080 -10.172 3.788 1.00 0.96 O ATOM 295 OP2 DG A 13 -5.092 -8.882 2.853 1.00 1.01 O ATOM 296 O5' DG A 13 -2.943 -7.718 3.363 1.00 0.71 O ATOM 297 C5' DG A 13 -2.555 -7.482 4.717 1.00 0.58 C ATOM 298 C4' DG A 13 -1.139 -7.959 4.945 1.00 0.45 C ATOM 299 O4' DG A 13 -0.299 -7.484 3.861 1.00 0.42 O ATOM 300 C3' DG A 13 -0.490 -7.452 6.236 1.00 0.56 C ATOM 301 O3' DG A 13 0.317 -8.479 6.824 1.00 0.61 O ATOM 302 C2' DG A 13 0.375 -6.296 5.768 1.00 0.57 C ATOM 303 C1' DG A 13 0.796 -6.749 4.383 1.00 0.42 C ATOM 304 N9 DG A 13 1.096 -5.660 3.455 1.00 0.45 N ATOM 305 C8 DG A 13 0.208 -4.985 2.652 1.00 0.54 C ATOM 306 N7 DG A 13 0.770 -4.058 1.926 1.00 0.59 N ATOM 307 C5 DG A 13 2.114 -4.124 2.271 1.00 0.51 C ATOM 308 C6 DG A 13 3.216 -3.362 1.809 1.00 0.54 C ATOM 309 O6 DG A 13 3.219 -2.448 0.978 1.00 0.64 O ATOM 310 N1 DG A 13 4.409 -3.751 2.415 1.00 0.48 N ATOM 311 C2 DG A 13 4.514 -4.754 3.352 1.00 0.44 C ATOM 312 N2 DG A 13 5.746 -4.991 3.831 1.00 0.47 N ATOM 313 N3 DG A 13 3.492 -5.472 3.790 1.00 0.42 N ATOM 314 C4 DG A 13 2.331 -5.106 3.211 1.00 0.44 C ATOM 0 H5' DG A 13 -3.235 -8.001 5.393 1.00 0.58 H new ATOM 0 H5'' DG A 13 -2.629 -6.419 4.944 1.00 0.58 H new ATOM 0 H4' DG A 13 -1.212 -9.045 5.006 1.00 0.45 H new ATOM 0 H3' DG A 13 -1.216 -7.159 6.994 1.00 0.56 H new ATOM 0 H2' DG A 13 -0.180 -5.358 5.738 1.00 0.57 H new ATOM 0 H2'' DG A 13 1.232 -6.138 6.423 1.00 0.57 H new ATOM 0 H1' DG A 13 1.718 -7.323 4.481 1.00 0.42 H new ATOM 0 H8 DG A 13 -0.850 -5.201 2.625 1.00 0.54 H new ATOM 0 H1 DG A 13 5.262 -3.260 2.146 1.00 0.48 H new ATOM 0 H21 DG A 13 5.890 -5.722 4.528 1.00 0.47 H new ATOM 0 H22 DG A 13 6.537 -4.440 3.498 1.00 0.47 H new ATOM 326 P DT A 14 0.587 -8.476 8.409 1.00 0.97 P ATOM 327 OP1 DT A 14 -0.613 -9.055 9.064 1.00 1.16 O ATOM 328 OP2 DT A 14 1.055 -7.122 8.800 1.00 1.54 O ATOM 329 O5' DT A 14 1.796 -9.497 8.597 1.00 1.17 O ATOM 330 C5' DT A 14 3.016 -9.333 7.875 1.00 1.36 C ATOM 331 C4' DT A 14 4.099 -10.200 8.474 1.00 1.15 C ATOM 332 O4' DT A 14 4.375 -9.755 9.822 1.00 1.14 O ATOM 333 C3' DT A 14 3.742 -11.676 8.607 1.00 1.21 C ATOM 334 O3' DT A 14 4.120 -12.390 7.425 1.00 1.38 O ATOM 335 C2' DT A 14 4.580 -12.118 9.792 1.00 1.23 C ATOM 336 C1' DT A 14 4.613 -10.874 10.671 1.00 1.16 C ATOM 337 N1 DT A 14 3.596 -10.859 11.742 1.00 1.28 N ATOM 338 C2 DT A 14 3.760 -11.719 12.805 1.00 1.37 C ATOM 339 O2 DT A 14 4.702 -12.489 12.901 1.00 1.47 O ATOM 340 N3 DT A 14 2.776 -11.646 13.757 1.00 1.62 N ATOM 341 C4 DT A 14 1.671 -10.818 13.752 1.00 1.88 C ATOM 342 O4 DT A 14 0.869 -10.865 14.681 1.00 2.20 O ATOM 343 C5 DT A 14 1.561 -9.942 12.608 1.00 1.91 C ATOM 344 C7 DT A 14 0.394 -9.008 12.520 1.00 2.43 C ATOM 345 C6 DT A 14 2.516 -10.002 11.668 1.00 1.60 C ATOM 0 H5' DT A 14 3.323 -8.287 7.898 1.00 1.36 H new ATOM 0 H5'' DT A 14 2.866 -9.598 6.828 1.00 1.36 H new ATOM 0 H4' DT A 14 4.939 -10.104 7.786 1.00 1.15 H new ATOM 0 H3' DT A 14 2.675 -11.857 8.741 1.00 1.21 H new ATOM 0 H2' DT A 14 4.132 -12.966 10.309 1.00 1.23 H new ATOM 0 H2'' DT A 14 5.581 -12.423 9.487 1.00 1.23 H new ATOM 0 H1' DT A 14 5.584 -10.851 11.166 1.00 1.16 H new ATOM 0 H3 DT A 14 2.871 -12.272 14.557 1.00 1.62 H new ATOM 0 H71 DT A 14 0.686 -8.112 11.972 1.00 2.43 H new ATOM 0 H72 DT A 14 -0.428 -9.500 12.000 1.00 2.43 H new ATOM 0 H73 DT A 14 0.073 -8.731 13.524 1.00 2.43 H new ATOM 0 H6 DT A 14 2.436 -9.348 10.812 1.00 1.60 H new ATOM 358 P DA A 15 3.240 -13.641 6.929 1.00 1.56 P ATOM 359 OP1 DA A 15 2.956 -14.485 8.118 1.00 2.16 O ATOM 360 OP2 DA A 15 3.906 -14.241 5.745 1.00 1.75 O ATOM 361 O5' DA A 15 1.870 -12.982 6.451 1.00 1.30 O ATOM 362 C5' DA A 15 0.830 -13.777 5.880 1.00 1.35 C ATOM 363 C4' DA A 15 0.873 -13.688 4.372 1.00 1.01 C ATOM 364 O4' DA A 15 -0.216 -14.469 3.820 1.00 0.87 O ATOM 365 C3' DA A 15 0.700 -12.277 3.806 1.00 1.05 C ATOM 366 O3' DA A 15 1.453 -12.128 2.597 1.00 0.84 O ATOM 367 C2' DA A 15 -0.787 -12.201 3.522 1.00 1.14 C ATOM 368 C1' DA A 15 -1.117 -13.627 3.113 1.00 0.98 C ATOM 369 N9 DA A 15 -2.480 -14.049 3.440 1.00 1.29 N ATOM 370 C8 DA A 15 -2.961 -14.472 4.655 1.00 1.56 C ATOM 371 N7 DA A 15 -4.234 -14.785 4.639 1.00 1.84 N ATOM 372 C5 DA A 15 -4.619 -14.552 3.326 1.00 1.84 C ATOM 373 C6 DA A 15 -5.850 -14.693 2.662 1.00 2.21 C ATOM 374 N6 DA A 15 -6.968 -15.119 3.255 1.00 2.57 N ATOM 375 N1 DA A 15 -5.895 -14.375 1.350 1.00 2.30 N ATOM 376 C2 DA A 15 -4.775 -13.948 0.755 1.00 2.02 C ATOM 377 N3 DA A 15 -3.560 -13.775 1.272 1.00 1.60 N ATOM 378 C4 DA A 15 -3.549 -14.098 2.576 1.00 1.53 C ATOM 0 H5' DA A 15 -0.139 -13.437 6.244 1.00 1.35 H new ATOM 0 H5'' DA A 15 0.942 -14.815 6.194 1.00 1.35 H new ATOM 0 H4' DA A 15 1.864 -14.048 4.098 1.00 1.01 H new ATOM 0 H3' DA A 15 1.049 -11.495 4.480 1.00 1.05 H new ATOM 0 H2' DA A 15 -1.352 -11.890 4.400 1.00 1.14 H new ATOM 0 H2'' DA A 15 -1.013 -11.489 2.728 1.00 1.14 H new ATOM 0 H1' DA A 15 -1.029 -13.690 2.028 1.00 0.98 H new ATOM 0 H8 DA A 15 -2.348 -14.540 5.541 1.00 1.56 H new ATOM 0 H61 DA A 15 -7.831 -15.200 2.718 1.00 2.57 H new ATOM 0 H62 DA A 15 -6.959 -15.363 4.245 1.00 2.57 H new ATOM 0 H2 DA A 15 -4.870 -13.710 -0.294 1.00 2.02 H new ATOM 390 P DG A 16 3.000 -11.693 2.665 1.00 0.59 P ATOM 391 OP1 DG A 16 3.535 -12.148 3.973 1.00 0.90 O ATOM 392 OP2 DG A 16 3.098 -10.258 2.293 1.00 1.32 O ATOM 393 O5' DG A 16 3.693 -12.553 1.515 1.00 0.46 O ATOM 394 C5' DG A 16 4.282 -13.824 1.794 1.00 0.48 C ATOM 395 C4' DG A 16 5.788 -13.729 1.717 1.00 0.40 C ATOM 396 O4' DG A 16 6.167 -13.280 0.392 1.00 0.38 O ATOM 397 C3' DG A 16 6.420 -12.733 2.691 1.00 0.45 C ATOM 398 O3' DG A 16 7.693 -13.212 3.138 1.00 0.53 O ATOM 399 C2' DG A 16 6.583 -11.479 1.854 1.00 0.41 C ATOM 400 C1' DG A 16 6.855 -12.039 0.469 1.00 0.34 C ATOM 401 N9 DG A 16 6.381 -11.194 -0.624 1.00 0.35 N ATOM 402 C8 DG A 16 5.134 -11.204 -1.198 1.00 0.42 C ATOM 403 N7 DG A 16 5.001 -10.333 -2.160 1.00 0.47 N ATOM 404 C5 DG A 16 6.239 -9.707 -2.226 1.00 0.41 C ATOM 405 C6 DG A 16 6.698 -8.672 -3.079 1.00 0.45 C ATOM 406 O6 DG A 16 6.078 -8.084 -3.972 1.00 0.55 O ATOM 407 N1 DG A 16 8.023 -8.328 -2.814 1.00 0.43 N ATOM 408 C2 DG A 16 8.799 -8.917 -1.841 1.00 0.40 C ATOM 409 N2 DG A 16 10.052 -8.451 -1.720 1.00 0.48 N ATOM 410 N3 DG A 16 8.380 -9.883 -1.040 1.00 0.36 N ATOM 411 C4 DG A 16 7.101 -10.226 -1.286 1.00 0.34 C ATOM 0 H5' DG A 16 3.920 -14.565 1.081 1.00 0.48 H new ATOM 0 H5'' DG A 16 3.982 -14.162 2.786 1.00 0.48 H new ATOM 0 H4' DG A 16 6.146 -14.727 1.969 1.00 0.40 H new ATOM 0 H3' DG A 16 5.823 -12.571 3.588 1.00 0.45 H new ATOM 0 H2' DG A 16 5.686 -10.860 1.872 1.00 0.41 H new ATOM 0 H2'' DG A 16 7.406 -10.858 2.209 1.00 0.41 H new ATOM 0 H1' DG A 16 7.935 -12.120 0.349 1.00 0.34 H new ATOM 0 H8 DG A 16 4.342 -11.867 -0.884 1.00 0.42 H new ATOM 0 H1 DG A 16 8.446 -7.591 -3.379 1.00 0.43 H new ATOM 0 H21 DG A 16 10.677 -8.846 -1.018 1.00 0.48 H new ATOM 0 H22 DG A 16 10.379 -7.702 -2.331 1.00 0.48 H new ATOM 423 P DG A 17 8.389 -12.555 4.431 1.00 0.68 P ATOM 424 OP1 DG A 17 9.381 -13.533 4.946 1.00 0.82 O ATOM 425 OP2 DG A 17 7.322 -12.051 5.332 1.00 0.93 O ATOM 426 O5' DG A 17 9.184 -11.303 3.847 1.00 0.75 O ATOM 427 C5' DG A 17 10.312 -11.484 2.990 1.00 0.44 C ATOM 428 C4' DG A 17 11.136 -10.217 2.934 1.00 0.39 C ATOM 429 O4' DG A 17 10.626 -9.366 1.876 1.00 0.45 O ATOM 430 C3' DG A 17 11.106 -9.369 4.212 1.00 0.46 C ATOM 431 O3' DG A 17 12.407 -8.835 4.483 1.00 0.51 O ATOM 432 C2' DG A 17 10.129 -8.256 3.878 1.00 0.47 C ATOM 433 C1' DG A 17 10.344 -8.075 2.388 1.00 0.44 C ATOM 434 N9 DG A 17 9.189 -7.542 1.667 1.00 0.47 N ATOM 435 C8 DG A 17 7.903 -8.023 1.687 1.00 0.51 C ATOM 436 N7 DG A 17 7.084 -7.338 0.938 1.00 0.54 N ATOM 437 C5 DG A 17 7.878 -6.341 0.388 1.00 0.53 C ATOM 438 C6 DG A 17 7.545 -5.294 -0.508 1.00 0.57 C ATOM 439 O6 DG A 17 6.444 -5.036 -1.007 1.00 0.62 O ATOM 440 N1 DG A 17 8.649 -4.501 -0.817 1.00 0.57 N ATOM 441 C2 DG A 17 9.915 -4.705 -0.317 1.00 0.53 C ATOM 442 N2 DG A 17 10.859 -3.842 -0.723 1.00 0.56 N ATOM 443 N3 DG A 17 10.237 -5.679 0.519 1.00 0.50 N ATOM 444 C4 DG A 17 9.179 -6.453 0.827 1.00 0.49 C ATOM 0 H5' DG A 17 9.977 -11.753 1.988 1.00 0.44 H new ATOM 0 H5'' DG A 17 10.925 -12.309 3.353 1.00 0.44 H new ATOM 0 H4' DG A 17 12.160 -10.555 2.777 1.00 0.39 H new ATOM 0 H3' DG A 17 10.815 -9.935 5.097 1.00 0.46 H new ATOM 0 H2' DG A 17 9.101 -8.534 4.110 1.00 0.47 H new ATOM 0 H2'' DG A 17 10.346 -7.344 4.434 1.00 0.47 H new ATOM 0 H1' DG A 17 11.144 -7.348 2.248 1.00 0.44 H new ATOM 0 H8 DG A 17 7.600 -8.883 2.266 1.00 0.51 H new ATOM 0 H1 DG A 17 8.509 -3.718 -1.456 1.00 0.57 H new ATOM 0 H21 DG A 17 11.817 -3.940 -0.388 1.00 0.56 H new ATOM 0 H22 DG A 17 10.618 -3.088 -1.367 1.00 0.56 H new ATOM 456 P DG A 18 12.666 -7.998 5.832 1.00 0.54 P ATOM 457 OP1 DG A 18 13.993 -8.405 6.359 1.00 0.82 O ATOM 458 OP2 DG A 18 11.465 -8.119 6.697 1.00 0.72 O ATOM 459 O5' DG A 18 12.773 -6.488 5.332 1.00 0.50 O ATOM 460 C5' DG A 18 13.756 -6.102 4.372 1.00 0.67 C ATOM 461 C4' DG A 18 13.823 -4.595 4.267 1.00 0.51 C ATOM 462 O4' DG A 18 12.756 -4.135 3.399 1.00 0.63 O ATOM 463 C3' DG A 18 13.646 -3.847 5.596 1.00 0.40 C ATOM 464 O3' DG A 18 14.614 -2.797 5.708 1.00 0.54 O ATOM 465 C2' DG A 18 12.243 -3.269 5.507 1.00 0.51 C ATOM 466 C1' DG A 18 12.071 -3.062 4.016 1.00 0.54 C ATOM 467 N9 DG A 18 10.684 -3.082 3.552 1.00 0.50 N ATOM 468 C8 DG A 18 9.681 -3.926 3.965 1.00 0.50 C ATOM 469 N7 DG A 18 8.541 -3.702 3.372 1.00 0.50 N ATOM 470 C5 DG A 18 8.806 -2.644 2.513 1.00 0.49 C ATOM 471 C6 DG A 18 7.953 -1.964 1.608 1.00 0.49 C ATOM 472 O6 DG A 18 6.755 -2.169 1.385 1.00 0.50 O ATOM 473 N1 DG A 18 8.620 -0.949 0.924 1.00 0.51 N ATOM 474 C2 DG A 18 9.949 -0.638 1.100 1.00 0.54 C ATOM 475 N2 DG A 18 10.426 0.370 0.353 1.00 0.58 N ATOM 476 N3 DG A 18 10.755 -1.266 1.942 1.00 0.54 N ATOM 477 C4 DG A 18 10.122 -2.250 2.610 1.00 0.50 C ATOM 0 H5' DG A 18 13.513 -6.531 3.400 1.00 0.67 H new ATOM 0 H5'' DG A 18 14.730 -6.497 4.660 1.00 0.67 H new ATOM 0 H4' DG A 18 14.823 -4.380 3.891 1.00 0.51 H new ATOM 0 H3' DG A 18 13.782 -4.490 6.465 1.00 0.40 H new ATOM 0 H2' DG A 18 11.496 -3.952 5.911 1.00 0.51 H new ATOM 0 H2'' DG A 18 12.153 -2.334 6.060 1.00 0.51 H new ATOM 0 H1' DG A 18 12.453 -2.072 3.765 1.00 0.54 H new ATOM 0 H8 DG A 18 9.823 -4.698 4.707 1.00 0.50 H new ATOM 0 H1 DG A 18 8.088 -0.401 0.248 1.00 0.51 H new ATOM 0 H21 DG A 18 11.404 0.649 0.437 1.00 0.58 H new ATOM 0 H22 DG A 18 9.811 0.857 -0.299 1.00 0.58 H new ATOM 489 P DT A 19 16.069 -3.108 6.320 1.00 0.53 P ATOM 490 OP1 DT A 19 15.884 -4.048 7.455 1.00 0.53 O ATOM 491 OP2 DT A 19 16.766 -1.816 6.545 1.00 0.92 O ATOM 492 O5' DT A 19 16.821 -3.884 5.150 1.00 0.72 O ATOM 493 C5' DT A 19 17.894 -4.783 5.432 1.00 0.72 C ATOM 494 C4' DT A 19 18.544 -5.238 4.146 1.00 0.64 C ATOM 495 O4' DT A 19 19.616 -6.163 4.459 1.00 0.67 O ATOM 496 C3' DT A 19 17.610 -5.980 3.182 1.00 0.60 C ATOM 497 O3' DT A 19 17.870 -5.581 1.831 1.00 0.62 O ATOM 498 C2' DT A 19 17.970 -7.441 3.387 1.00 0.78 C ATOM 499 C1' DT A 19 19.444 -7.368 3.734 1.00 0.68 C ATOM 500 N1 DT A 19 19.931 -8.483 4.572 1.00 0.58 N ATOM 501 C2 DT A 19 20.316 -9.647 3.945 1.00 0.72 C ATOM 502 O2 DT A 19 20.273 -9.798 2.734 1.00 1.03 O ATOM 503 N3 DT A 19 20.754 -10.634 4.790 1.00 0.69 N ATOM 504 C4 DT A 19 20.844 -10.574 6.166 1.00 0.60 C ATOM 505 O4 DT A 19 21.259 -11.545 6.794 1.00 0.71 O ATOM 506 C5 DT A 19 20.424 -9.324 6.758 1.00 0.73 C ATOM 507 C7 DT A 19 20.488 -9.169 8.246 1.00 1.12 C ATOM 508 C6 DT A 19 19.992 -8.349 5.944 1.00 0.69 C ATOM 0 H5' DT A 19 17.520 -5.645 5.984 1.00 0.72 H new ATOM 0 H5'' DT A 19 18.632 -4.293 6.067 1.00 0.72 H new ATOM 0 H4' DT A 19 18.878 -4.323 3.657 1.00 0.64 H new ATOM 0 H3' DT A 19 16.555 -5.775 3.366 1.00 0.60 H new ATOM 0 H2' DT A 19 17.386 -7.895 4.188 1.00 0.78 H new ATOM 0 H2'' DT A 19 17.793 -8.033 2.489 1.00 0.78 H new ATOM 0 H1' DT A 19 20.013 -7.420 2.806 1.00 0.68 H new ATOM 0 H3 DT A 19 21.045 -11.509 4.354 1.00 0.69 H new ATOM 0 H71 DT A 19 20.667 -8.123 8.496 1.00 1.12 H new ATOM 0 H72 DT A 19 19.544 -9.491 8.686 1.00 1.12 H new ATOM 0 H73 DT A 19 21.300 -9.780 8.641 1.00 1.12 H new ATOM 0 H6 DT A 19 19.677 -7.414 6.384 1.00 0.69 H new ATOM 521 P DG A 20 17.161 -4.267 1.235 1.00 0.72 P ATOM 522 OP1 DG A 20 17.930 -3.091 1.716 1.00 1.16 O ATOM 523 OP2 DG A 20 15.705 -4.354 1.513 1.00 1.24 O ATOM 524 O5' DG A 20 17.381 -4.390 -0.339 1.00 0.72 O ATOM 525 C5' DG A 20 16.483 -5.146 -1.153 1.00 0.51 C ATOM 526 C4' DG A 20 16.453 -4.585 -2.555 1.00 0.34 C ATOM 527 O4' DG A 20 15.438 -5.283 -3.322 1.00 0.27 O ATOM 528 C3' DG A 20 16.098 -3.097 -2.645 1.00 0.44 C ATOM 529 O3' DG A 20 16.860 -2.464 -3.679 1.00 0.46 O ATOM 530 C2' DG A 20 14.623 -3.107 -2.999 1.00 0.46 C ATOM 531 C1' DG A 20 14.505 -4.356 -3.851 1.00 0.31 C ATOM 532 N9 DG A 20 13.183 -4.978 -3.831 1.00 0.29 N ATOM 533 C8 DG A 20 12.812 -6.119 -3.162 1.00 0.31 C ATOM 534 N7 DG A 20 11.561 -6.441 -3.345 1.00 0.31 N ATOM 535 C5 DG A 20 11.074 -5.450 -4.187 1.00 0.30 C ATOM 536 C6 DG A 20 9.779 -5.267 -4.733 1.00 0.33 C ATOM 537 O6 DG A 20 8.774 -5.969 -4.573 1.00 0.36 O ATOM 538 N1 DG A 20 9.709 -4.131 -5.539 1.00 0.37 N ATOM 539 C2 DG A 20 10.766 -3.284 -5.780 1.00 0.38 C ATOM 540 N2 DG A 20 10.511 -2.229 -6.569 1.00 0.47 N ATOM 541 N3 DG A 20 11.979 -3.445 -5.276 1.00 0.35 N ATOM 542 C4 DG A 20 12.060 -4.540 -4.495 1.00 0.30 C ATOM 0 H5' DG A 20 15.482 -5.122 -0.722 1.00 0.51 H new ATOM 0 H5'' DG A 20 16.794 -6.190 -1.178 1.00 0.51 H new ATOM 0 H4' DG A 20 17.466 -4.717 -2.934 1.00 0.34 H new ATOM 0 H3' DG A 20 16.311 -2.549 -1.727 1.00 0.44 H new ATOM 0 H2' DG A 20 13.992 -3.159 -2.112 1.00 0.46 H new ATOM 0 H2'' DG A 20 14.330 -2.211 -3.547 1.00 0.46 H new ATOM 0 H1' DG A 20 14.690 -4.076 -4.888 1.00 0.31 H new ATOM 0 H8 DG A 20 13.489 -6.692 -2.546 1.00 0.31 H new ATOM 0 H1 DG A 20 8.815 -3.914 -5.979 1.00 0.37 H new ATOM 0 H21 DG A 20 11.253 -1.563 -6.786 1.00 0.47 H new ATOM 0 H22 DG A 20 9.575 -2.093 -6.952 1.00 0.47 H new ATOM 554 P DG A 21 17.042 -0.866 -3.679 1.00 0.57 P ATOM 555 OP1 DG A 21 18.065 -0.535 -4.704 1.00 0.70 O ATOM 556 OP2 DG A 21 17.241 -0.418 -2.276 1.00 0.76 O ATOM 557 O5' DG A 21 15.634 -0.315 -4.185 1.00 0.55 O ATOM 558 C5' DG A 21 15.294 -0.321 -5.573 1.00 0.58 C ATOM 559 C4' DG A 21 14.324 0.797 -5.881 1.00 0.46 C ATOM 560 O4' DG A 21 12.968 0.289 -5.786 1.00 0.41 O ATOM 561 C3' DG A 21 14.391 1.993 -4.926 1.00 0.44 C ATOM 562 O3' DG A 21 14.163 3.214 -5.640 1.00 0.48 O ATOM 563 C2' DG A 21 13.260 1.726 -3.951 1.00 0.45 C ATOM 564 C1' DG A 21 12.232 1.036 -4.830 1.00 0.36 C ATOM 565 N9 DG A 21 11.347 0.114 -4.120 1.00 0.35 N ATOM 566 C8 DG A 21 11.698 -0.788 -3.146 1.00 0.38 C ATOM 567 N7 DG A 21 10.690 -1.485 -2.700 1.00 0.41 N ATOM 568 C5 DG A 21 9.603 -1.015 -3.423 1.00 0.43 C ATOM 569 C6 DG A 21 8.238 -1.395 -3.375 1.00 0.53 C ATOM 570 O6 DG A 21 7.708 -2.253 -2.661 1.00 0.60 O ATOM 571 N1 DG A 21 7.463 -0.667 -4.277 1.00 0.57 N ATOM 572 C2 DG A 21 7.957 0.305 -5.117 1.00 0.51 C ATOM 573 N2 DG A 21 7.063 0.905 -5.918 1.00 0.59 N ATOM 574 N3 DG A 21 9.229 0.667 -5.171 1.00 0.42 N ATOM 575 C4 DG A 21 9.990 -0.029 -4.303 1.00 0.38 C ATOM 0 H5' DG A 21 14.851 -1.280 -5.842 1.00 0.58 H new ATOM 0 H5'' DG A 21 16.195 -0.206 -6.176 1.00 0.58 H new ATOM 0 H4' DG A 21 14.602 1.142 -6.877 1.00 0.46 H new ATOM 0 H3' DG A 21 15.359 2.100 -4.437 1.00 0.44 H new ATOM 0 H2' DG A 21 13.578 1.093 -3.123 1.00 0.45 H new ATOM 0 H2'' DG A 21 12.871 2.647 -3.517 1.00 0.45 H new ATOM 0 H1' DG A 21 11.587 1.804 -5.257 1.00 0.36 H new ATOM 0 H8 DG A 21 12.709 -0.908 -2.785 1.00 0.38 H new ATOM 0 H1 DG A 21 6.464 -0.868 -4.317 1.00 0.57 H new ATOM 0 H21 DG A 21 7.366 1.634 -6.564 1.00 0.59 H new ATOM 0 H22 DG A 21 6.081 0.632 -5.881 1.00 0.59 H new ATOM 587 P DG A 22 14.691 4.607 -5.034 1.00 0.50 P ATOM 588 OP1 DG A 22 15.767 5.101 -5.930 1.00 0.94 O ATOM 589 OP2 DG A 22 14.973 4.413 -3.588 1.00 0.67 O ATOM 590 O5' DG A 22 13.441 5.587 -5.175 1.00 0.62 O ATOM 591 C5' DG A 22 12.583 5.855 -4.065 1.00 0.49 C ATOM 592 C4' DG A 22 11.154 5.995 -4.535 1.00 0.47 C ATOM 593 O4' DG A 22 10.569 4.684 -4.677 1.00 0.44 O ATOM 594 C3' DG A 22 10.229 6.730 -3.575 1.00 0.51 C ATOM 595 O3' DG A 22 10.262 8.139 -3.832 1.00 0.63 O ATOM 596 C2' DG A 22 8.863 6.154 -3.909 1.00 0.56 C ATOM 597 C1' DG A 22 9.174 4.743 -4.405 1.00 0.47 C ATOM 598 N9 DG A 22 8.858 3.685 -3.446 1.00 0.39 N ATOM 599 C8 DG A 22 9.738 3.005 -2.639 1.00 0.37 C ATOM 600 N7 DG A 22 9.162 2.109 -1.887 1.00 0.37 N ATOM 601 C5 DG A 22 7.817 2.202 -2.216 1.00 0.38 C ATOM 602 C6 DG A 22 6.702 1.478 -1.724 1.00 0.45 C ATOM 603 O6 DG A 22 6.687 0.582 -0.873 1.00 0.50 O ATOM 604 N1 DG A 22 5.511 1.883 -2.325 1.00 0.51 N ATOM 605 C2 DG A 22 5.420 2.869 -3.282 1.00 0.52 C ATOM 606 N2 DG A 22 4.189 3.128 -3.750 1.00 0.63 N ATOM 607 N3 DG A 22 6.454 3.551 -3.748 1.00 0.46 N ATOM 608 C4 DG A 22 7.612 3.168 -3.175 1.00 0.39 C ATOM 0 H5' DG A 22 12.900 6.769 -3.563 1.00 0.49 H new ATOM 0 H5'' DG A 22 12.657 5.048 -3.335 1.00 0.49 H new ATOM 0 H4' DG A 22 11.228 6.565 -5.461 1.00 0.47 H new ATOM 0 H3' DG A 22 10.502 6.606 -2.527 1.00 0.51 H new ATOM 0 H2' DG A 22 8.212 6.136 -3.035 1.00 0.56 H new ATOM 0 H2'' DG A 22 8.356 6.744 -4.673 1.00 0.56 H new ATOM 0 H1' DG A 22 8.551 4.567 -5.282 1.00 0.47 H new ATOM 0 H8 DG A 22 10.801 3.194 -2.629 1.00 0.37 H new ATOM 0 H1 DG A 22 4.650 1.418 -2.037 1.00 0.51 H new ATOM 0 H21 DG A 22 4.054 3.847 -4.460 1.00 0.63 H new ATOM 0 H22 DG A 22 3.388 2.605 -3.395 1.00 0.63 H new ATOM 620 P DT A 23 9.791 9.171 -2.693 1.00 0.79 P ATOM 621 OP1 DT A 23 9.909 10.539 -3.258 1.00 1.22 O ATOM 622 OP2 DT A 23 10.503 8.834 -1.433 1.00 0.84 O ATOM 623 O5' DT A 23 8.243 8.849 -2.496 1.00 0.91 O ATOM 624 C5' DT A 23 7.486 9.484 -1.465 1.00 0.89 C ATOM 625 C4' DT A 23 6.008 9.275 -1.702 1.00 0.88 C ATOM 626 O4' DT A 23 5.725 7.851 -1.698 1.00 0.83 O ATOM 627 C3' DT A 23 5.092 9.890 -0.637 1.00 0.88 C ATOM 628 O3' DT A 23 3.913 10.429 -1.247 1.00 1.09 O ATOM 629 C2' DT A 23 4.742 8.707 0.247 1.00 0.76 C ATOM 630 C1' DT A 23 4.710 7.566 -0.750 1.00 0.75 C ATOM 631 N1 DT A 23 4.979 6.237 -0.167 1.00 0.68 N ATOM 632 C2 DT A 23 3.906 5.413 0.092 1.00 0.70 C ATOM 633 O2 DT A 23 2.751 5.729 -0.140 1.00 0.77 O ATOM 634 N3 DT A 23 4.236 4.199 0.637 1.00 0.70 N ATOM 635 C4 DT A 23 5.499 3.737 0.941 1.00 0.69 C ATOM 636 O4 DT A 23 5.636 2.618 1.429 1.00 0.77 O ATOM 637 C5 DT A 23 6.580 4.652 0.644 1.00 0.68 C ATOM 638 C7 DT A 23 7.986 4.235 0.944 1.00 0.78 C ATOM 639 C6 DT A 23 6.273 5.844 0.111 1.00 0.68 C ATOM 0 H5' DT A 23 7.711 10.550 -1.442 1.00 0.89 H new ATOM 0 H5'' DT A 23 7.767 9.078 -0.494 1.00 0.89 H new ATOM 0 H4' DT A 23 5.801 9.766 -2.653 1.00 0.88 H new ATOM 0 H3' DT A 23 5.557 10.710 -0.089 1.00 0.88 H new ATOM 0 H2' DT A 23 5.486 8.546 1.027 1.00 0.76 H new ATOM 0 H2'' DT A 23 3.782 8.840 0.745 1.00 0.76 H new ATOM 0 H1' DT A 23 3.706 7.508 -1.170 1.00 0.75 H new ATOM 0 H3 DT A 23 3.461 3.568 0.840 1.00 0.70 H new ATOM 0 H71 DT A 23 8.666 4.713 0.238 1.00 0.78 H new ATOM 0 H72 DT A 23 8.246 4.536 1.959 1.00 0.78 H new ATOM 0 H73 DT A 23 8.072 3.152 0.853 1.00 0.78 H new ATOM 0 H6 DT A 23 7.077 6.530 -0.112 1.00 0.68 H new ATOM 652 P DA A 24 3.020 11.507 -0.455 1.00 1.37 P ATOM 653 OP1 DA A 24 1.790 11.737 -1.256 1.00 2.30 O ATOM 654 OP2 DA A 24 3.887 12.659 -0.098 1.00 2.19 O ATOM 655 O5' DA A 24 2.606 10.755 0.889 1.00 0.71 O ATOM 656 C5' DA A 24 1.251 10.732 1.340 1.00 0.56 C ATOM 657 C4' DA A 24 0.671 9.345 1.177 1.00 0.50 C ATOM 658 O4' DA A 24 1.688 8.363 1.497 1.00 0.59 O ATOM 659 C3' DA A 24 -0.507 9.026 2.096 1.00 0.47 C ATOM 660 O3' DA A 24 -1.394 8.096 1.465 1.00 0.48 O ATOM 661 C2' DA A 24 0.164 8.395 3.301 1.00 0.60 C ATOM 662 C1' DA A 24 1.332 7.649 2.674 1.00 0.61 C ATOM 663 N9 DA A 24 2.520 7.564 3.526 1.00 0.72 N ATOM 664 C8 DA A 24 3.564 8.454 3.606 1.00 0.79 C ATOM 665 N7 DA A 24 4.491 8.105 4.465 1.00 0.92 N ATOM 666 C5 DA A 24 4.028 6.905 4.986 1.00 0.95 C ATOM 667 C6 DA A 24 4.557 6.025 5.947 1.00 1.10 C ATOM 668 N6 DA A 24 5.715 6.228 6.580 1.00 1.23 N ATOM 669 N1 DA A 24 3.845 4.915 6.240 1.00 1.13 N ATOM 670 C2 DA A 24 2.684 4.712 5.606 1.00 1.03 C ATOM 671 N3 DA A 24 2.084 5.464 4.686 1.00 0.88 N ATOM 672 C4 DA A 24 2.816 6.559 4.418 1.00 0.84 C ATOM 0 H5' DA A 24 0.659 11.451 0.773 1.00 0.56 H new ATOM 0 H5'' DA A 24 1.203 11.034 2.386 1.00 0.56 H new ATOM 0 H4' DA A 24 0.322 9.311 0.145 1.00 0.50 H new ATOM 0 H3' DA A 24 -1.111 9.898 2.348 1.00 0.47 H new ATOM 0 H2' DA A 24 0.499 9.145 4.018 1.00 0.60 H new ATOM 0 H2'' DA A 24 -0.508 7.722 3.834 1.00 0.60 H new ATOM 0 H1' DA A 24 1.010 6.624 2.492 1.00 0.61 H new ATOM 0 H8 DA A 24 3.616 9.357 3.016 1.00 0.79 H new ATOM 0 H61 DA A 24 6.046 5.551 7.268 1.00 1.23 H new ATOM 0 H62 DA A 24 6.269 7.060 6.375 1.00 1.23 H new ATOM 0 H2 DA A 24 2.159 3.809 5.880 1.00 1.03 H new ATOM 684 P DA A 25 -2.888 7.901 2.030 1.00 0.99 P ATOM 685 OP1 DA A 25 -3.822 8.434 1.006 1.00 1.53 O ATOM 686 OP2 DA A 25 -2.938 8.432 3.416 1.00 1.66 O ATOM 687 O5' DA A 25 -3.074 6.318 2.093 1.00 0.80 O ATOM 688 C5' DA A 25 -2.200 5.445 1.377 1.00 0.63 C ATOM 689 C4' DA A 25 -2.573 4.004 1.640 1.00 0.52 C ATOM 690 O4' DA A 25 -1.693 3.136 0.892 1.00 0.48 O ATOM 691 C3' DA A 25 -2.422 3.554 3.086 1.00 0.64 C ATOM 692 O3' DA A 25 -3.609 3.832 3.834 1.00 0.92 O ATOM 693 C2' DA A 25 -2.207 2.058 2.948 1.00 0.64 C ATOM 694 C1' DA A 25 -1.476 1.926 1.613 1.00 0.49 C ATOM 695 N9 DA A 25 -0.029 1.725 1.732 1.00 0.44 N ATOM 696 C8 DA A 25 0.975 2.493 1.196 1.00 0.45 C ATOM 697 N7 DA A 25 2.179 2.060 1.476 1.00 0.47 N ATOM 698 C5 DA A 25 1.956 0.930 2.250 1.00 0.48 C ATOM 699 C6 DA A 25 2.831 0.015 2.862 1.00 0.58 C ATOM 700 N6 DA A 25 4.163 0.101 2.796 1.00 0.66 N ATOM 701 N1 DA A 25 2.284 -1.003 3.562 1.00 0.65 N ATOM 702 C2 DA A 25 0.950 -1.087 3.636 1.00 0.62 C ATOM 703 N3 DA A 25 0.026 -0.290 3.105 1.00 0.53 N ATOM 704 C4 DA A 25 0.601 0.711 2.416 1.00 0.46 C ATOM 0 H5' DA A 25 -1.168 5.623 1.680 1.00 0.63 H new ATOM 0 H5'' DA A 25 -2.259 5.655 0.309 1.00 0.63 H new ATOM 0 H4' DA A 25 -3.623 3.941 1.356 1.00 0.52 H new ATOM 0 H3' DA A 25 -1.616 4.061 3.616 1.00 0.64 H new ATOM 0 H2' DA A 25 -1.614 1.660 3.772 1.00 0.64 H new ATOM 0 H2'' DA A 25 -3.152 1.515 2.944 1.00 0.64 H new ATOM 0 HO3' DA A 25 -3.921 4.738 3.628 1.00 0.92 H new ATOM 0 H1' DA A 25 -1.871 1.041 1.115 1.00 0.49 H new ATOM 0 H8 DA A 25 0.789 3.373 0.598 1.00 0.45 H new ATOM 0 H61 DA A 25 4.743 -0.596 3.263 1.00 0.66 H new ATOM 0 H62 DA A 25 4.600 0.864 2.279 1.00 0.66 H new ATOM 0 H2 DA A 25 0.569 -1.920 4.208 1.00 0.62 H new TER 717 DA A 25 HETATM 718 C17 BO6 A 101 13.671 -7.718 -6.346 1.00 0.45 C HETATM 719 C18 BO6 A 101 14.620 -6.763 -6.701 1.00 0.44 C HETATM 720 N19 BO6 A 101 14.242 -5.648 -7.447 1.00 0.43 N HETATM 721 C31 BO6 A 101 15.250 -4.631 -7.826 1.00 0.49 C HETATM 722 C20 BO6 A 101 12.912 -5.492 -7.837 1.00 0.45 C HETATM 723 C21 BO6 A 101 11.965 -6.448 -7.481 1.00 0.48 C HETATM 724 C16 BO6 A 101 12.332 -7.570 -6.734 1.00 0.47 C HETATM 725 C15 BO6 A 101 11.412 -8.542 -6.357 1.00 0.55 C HETATM 726 C14 BO6 A 101 11.758 -10.027 -6.208 1.00 0.53 C HETATM 727 C7 BO6 A 101 10.968 -10.929 -5.502 1.00 0.49 C HETATM 728 C6 BO6 A 101 9.642 -11.095 -5.875 1.00 0.52 C HETATM 729 C8 BO6 A 101 11.452 -11.667 -4.445 1.00 0.46 C HETATM 730 C9 BO6 A 101 10.611 -12.546 -3.787 1.00 0.45 C HETATM 731 C2 BO6 A 101 9.336 -12.677 -4.178 1.00 0.43 C HETATM 732 N1 BO6 A 101 8.350 -13.441 -3.715 1.00 0.43 N HETATM 733 C3 BO6 A 101 8.854 -11.958 -5.212 1.00 0.48 C HETATM 734 C4 BO6 A 101 7.574 -12.287 -5.377 1.00 0.51 C HETATM 735 C10 BO6 A 101 6.654 -11.861 -6.259 1.00 0.60 C HETATM 736 C5 BO6 A 101 7.261 -13.210 -4.445 1.00 0.47 C HETATM 737 C13 BO6 A 101 6.026 -13.722 -4.378 1.00 0.50 C HETATM 738 C12 BO6 A 101 5.052 -13.309 -5.270 1.00 0.59 C HETATM 739 C11 BO6 A 101 5.362 -12.368 -6.222 1.00 0.64 C HETATM 740 C22 BO6 A 101 4.424 -11.918 -7.145 1.00 0.77 C HETATM 741 C23 BO6 A 101 4.229 -10.439 -7.498 1.00 0.59 C HETATM 742 C24 BO6 A 101 3.107 -9.946 -8.156 1.00 0.49 C HETATM 743 C25 BO6 A 101 1.852 -10.496 -7.859 1.00 0.42 C HETATM 744 C26 BO6 A 101 0.706 -10.029 -8.497 1.00 0.50 C HETATM 745 N27 BO6 A 101 0.800 -9.005 -9.439 1.00 0.54 N HETATM 746 C30 BO6 A 101 -0.419 -8.508 -10.118 1.00 0.70 C HETATM 747 C28 BO6 A 101 2.043 -8.451 -9.740 1.00 0.59 C HETATM 748 C29 BO6 A 101 3.188 -8.919 -9.102 1.00 0.62 C