USER MOD reduce.3.24.130724 H: found=0, std=0, add=225, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 225 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 DT C7 :methyl 150:sc= -0.678 (180deg=-0.678) USER MOD Single : A 1 DT O5' : rot 180:sc= 0 USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl -30:sc= -0.669 (180deg=-1.5!) USER MOD Single : A 16 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 20 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 15.117 5.790 -1.501 1.00 1.21 O ATOM 2 C5' DT A 1 14.024 5.462 -2.363 1.00 0.97 C ATOM 3 C4' DT A 1 12.750 6.203 -1.958 1.00 0.75 C ATOM 4 O4' DT A 1 11.688 5.838 -2.826 1.00 0.76 O ATOM 5 C3' DT A 1 12.275 5.901 -0.552 1.00 0.72 C ATOM 6 O3' DT A 1 11.525 7.016 -0.051 1.00 0.89 O ATOM 7 C2' DT A 1 11.356 4.687 -0.740 1.00 0.61 C ATOM 8 C1' DT A 1 10.897 4.811 -2.212 1.00 0.66 C ATOM 9 N1 DT A 1 11.029 3.562 -3.043 1.00 0.72 N ATOM 10 C2 DT A 1 11.343 3.704 -4.398 1.00 0.95 C ATOM 11 O2 DT A 1 11.475 4.797 -4.942 1.00 1.13 O ATOM 12 N3 DT A 1 11.466 2.537 -5.122 1.00 1.11 N ATOM 13 C4 DT A 1 11.312 1.256 -4.641 1.00 1.08 C ATOM 14 O4 DT A 1 11.445 0.288 -5.384 1.00 1.33 O ATOM 15 C5 DT A 1 10.988 1.191 -3.239 1.00 0.90 C ATOM 16 C7 DT A 1 10.808 -0.170 -2.579 1.00 1.05 C ATOM 17 C6 DT A 1 10.853 2.306 -2.496 1.00 0.75 C ATOM 0 H5' DT A 1 13.846 4.387 -2.334 1.00 0.97 H new ATOM 0 H5'' DT A 1 14.282 5.715 -3.392 1.00 0.97 H new ATOM 0 H4' DT A 1 13.007 7.261 -2.016 1.00 0.75 H new ATOM 0 H3' DT A 1 13.086 5.715 0.152 1.00 0.72 H new ATOM 0 H2' DT A 1 11.885 3.751 -0.561 1.00 0.61 H new ATOM 0 H2'' DT A 1 10.511 4.712 -0.052 1.00 0.61 H new ATOM 0 HO5' DT A 1 15.916 5.299 -1.785 1.00 1.21 H new ATOM 0 H1' DT A 1 9.830 5.032 -2.180 1.00 0.66 H new ATOM 0 H3 DT A 1 11.694 2.632 -6.112 1.00 1.11 H new ATOM 0 H71 DT A 1 11.095 -0.106 -1.529 1.00 1.05 H new ATOM 0 H72 DT A 1 9.764 -0.474 -2.652 1.00 1.05 H new ATOM 0 H73 DT A 1 11.436 -0.905 -3.083 1.00 1.05 H new ATOM 0 H6 DT A 1 10.602 2.216 -1.450 1.00 0.75 H new ATOM 31 P DA A 2 12.279 8.278 0.614 1.00 1.52 P ATOM 32 OP1 DA A 2 13.286 8.772 -0.352 1.00 2.41 O ATOM 33 OP2 DA A 2 12.699 7.897 1.982 1.00 2.23 O ATOM 34 O5' DA A 2 11.107 9.379 0.733 1.00 1.30 O ATOM 35 C5' DA A 2 9.994 9.182 1.617 1.00 1.10 C ATOM 36 C4' DA A 2 8.690 8.980 0.846 1.00 0.77 C ATOM 37 O4' DA A 2 8.762 7.773 0.082 1.00 0.67 O ATOM 38 C3' DA A 2 7.440 8.875 1.737 1.00 0.73 C ATOM 39 O3' DA A 2 6.520 9.928 1.385 1.00 0.83 O ATOM 40 C2' DA A 2 6.845 7.504 1.399 1.00 0.68 C ATOM 41 C1' DA A 2 7.453 7.225 0.032 1.00 0.56 C ATOM 42 N9 DA A 2 7.564 5.789 -0.334 1.00 0.46 N ATOM 43 C8 DA A 2 7.752 4.698 0.476 1.00 0.40 C ATOM 44 N7 DA A 2 7.784 3.557 -0.169 1.00 0.36 N ATOM 45 C5 DA A 2 7.611 3.918 -1.500 1.00 0.40 C ATOM 46 C6 DA A 2 7.553 3.171 -2.696 1.00 0.47 C ATOM 47 N6 DA A 2 7.663 1.835 -2.748 1.00 0.48 N ATOM 48 N1 DA A 2 7.374 3.857 -3.838 1.00 0.59 N ATOM 49 C2 DA A 2 7.261 5.181 -3.789 1.00 0.63 C ATOM 50 N3 DA A 2 7.296 5.987 -2.740 1.00 0.58 N ATOM 51 C4 DA A 2 7.477 5.277 -1.608 1.00 0.46 C ATOM 0 H5' DA A 2 9.897 10.044 2.278 1.00 1.10 H new ATOM 0 H5'' DA A 2 10.181 8.315 2.250 1.00 1.10 H new ATOM 0 H4' DA A 2 8.586 9.867 0.221 1.00 0.77 H new ATOM 0 H3' DA A 2 7.658 8.973 2.800 1.00 0.73 H new ATOM 0 H2' DA A 2 7.123 6.746 2.132 1.00 0.68 H new ATOM 0 H2'' DA A 2 5.756 7.529 1.364 1.00 0.68 H new ATOM 0 H1' DA A 2 6.798 7.661 -0.722 1.00 0.56 H new ATOM 0 H8 DA A 2 7.864 4.772 1.548 1.00 0.40 H new ATOM 0 H61 DA A 2 7.613 1.354 -3.646 1.00 0.48 H new ATOM 0 H62 DA A 2 7.797 1.301 -1.890 1.00 0.48 H new ATOM 0 H2 DA A 2 7.120 5.669 -4.742 1.00 0.63 H new ATOM 63 P DG A 3 5.308 10.370 2.365 1.00 1.00 P ATOM 64 OP1 DG A 3 5.428 11.819 2.644 1.00 1.66 O ATOM 65 OP2 DG A 3 5.227 9.405 3.483 1.00 1.35 O ATOM 66 O5' DG A 3 4.020 10.152 1.431 1.00 0.79 O ATOM 67 C5' DG A 3 3.872 8.946 0.685 1.00 0.73 C ATOM 68 C4' DG A 3 2.656 9.002 -0.222 1.00 0.55 C ATOM 69 O4' DG A 3 2.604 7.814 -1.005 1.00 0.53 O ATOM 70 C3' DG A 3 1.329 9.119 0.529 1.00 0.47 C ATOM 71 O3' DG A 3 0.626 10.271 0.045 1.00 0.48 O ATOM 72 C2' DG A 3 0.567 7.839 0.178 1.00 0.45 C ATOM 73 C1' DG A 3 1.250 7.395 -1.105 1.00 0.43 C ATOM 74 N9 DG A 3 1.251 5.934 -1.342 1.00 0.41 N ATOM 75 C8 DG A 3 0.951 5.265 -2.497 1.00 0.43 C ATOM 76 N7 DG A 3 1.056 3.970 -2.403 1.00 0.43 N ATOM 77 C5 DG A 3 1.459 3.755 -1.092 1.00 0.36 C ATOM 78 C6 DG A 3 1.738 2.535 -0.416 1.00 0.35 C ATOM 79 O6 DG A 3 1.686 1.389 -0.859 1.00 0.41 O ATOM 80 N1 DG A 3 2.116 2.759 0.901 1.00 0.36 N ATOM 81 C2 DG A 3 2.214 4.002 1.490 1.00 0.41 C ATOM 82 N2 DG A 3 2.595 4.030 2.762 1.00 0.51 N ATOM 83 N3 DG A 3 1.952 5.148 0.854 1.00 0.43 N ATOM 84 C4 DG A 3 1.582 4.950 -0.430 1.00 0.38 C ATOM 0 H5' DG A 3 3.779 8.102 1.369 1.00 0.73 H new ATOM 0 H5'' DG A 3 4.767 8.774 0.087 1.00 0.73 H new ATOM 0 H4' DG A 3 2.773 9.899 -0.830 1.00 0.55 H new ATOM 0 H3' DG A 3 1.452 9.230 1.606 1.00 0.47 H new ATOM 0 H2' DG A 3 0.650 7.088 0.964 1.00 0.45 H new ATOM 0 H2'' DG A 3 -0.496 8.027 0.028 1.00 0.45 H new ATOM 0 H1' DG A 3 0.696 7.835 -1.934 1.00 0.43 H new ATOM 0 H8 DG A 3 0.653 5.766 -3.406 1.00 0.43 H new ATOM 0 H1 DG A 3 2.337 1.945 1.475 1.00 0.36 H new ATOM 0 H21 DG A 3 2.684 4.922 3.248 1.00 0.51 H new ATOM 0 H22 DG A 3 2.798 3.159 3.253 1.00 0.51 H new ATOM 96 P DG A 4 -0.864 10.613 0.552 1.00 0.47 P ATOM 97 OP1 DG A 4 -1.036 12.082 0.541 1.00 0.60 O ATOM 98 OP2 DG A 4 -1.125 9.847 1.794 1.00 0.55 O ATOM 99 O5' DG A 4 -1.779 9.988 -0.626 1.00 0.56 O ATOM 100 C5' DG A 4 -1.562 10.360 -1.997 1.00 0.55 C ATOM 101 C4' DG A 4 -2.280 9.419 -2.972 1.00 0.54 C ATOM 102 O4' DG A 4 -1.908 8.065 -2.691 1.00 0.52 O ATOM 103 C3' DG A 4 -3.812 9.493 -2.915 1.00 0.54 C ATOM 104 O3' DG A 4 -4.333 9.617 -4.252 1.00 0.76 O ATOM 105 C2' DG A 4 -4.233 8.158 -2.311 1.00 0.53 C ATOM 106 C1' DG A 4 -3.082 7.257 -2.729 1.00 0.49 C ATOM 107 N9 DG A 4 -2.851 6.096 -1.842 1.00 0.49 N ATOM 108 C8 DG A 4 -2.670 6.070 -0.480 1.00 0.50 C ATOM 109 N7 DG A 4 -2.452 4.880 0.002 1.00 0.54 N ATOM 110 C5 DG A 4 -2.494 4.055 -1.116 1.00 0.54 C ATOM 111 C6 DG A 4 -2.327 2.648 -1.214 1.00 0.58 C ATOM 112 O6 DG A 4 -2.101 1.843 -0.314 1.00 0.61 O ATOM 113 N1 DG A 4 -2.444 2.213 -2.524 1.00 0.62 N ATOM 114 C2 DG A 4 -2.693 3.025 -3.609 1.00 0.62 C ATOM 115 N2 DG A 4 -2.770 2.422 -4.790 1.00 0.69 N ATOM 116 N3 DG A 4 -2.850 4.346 -3.522 1.00 0.58 N ATOM 117 C4 DG A 4 -2.738 4.790 -2.249 1.00 0.53 C ATOM 0 H5' DG A 4 -0.493 10.353 -2.209 1.00 0.55 H new ATOM 0 H5'' DG A 4 -1.912 11.380 -2.155 1.00 0.55 H new ATOM 0 H4' DG A 4 -1.971 9.743 -3.966 1.00 0.54 H new ATOM 0 H3' DG A 4 -4.177 10.342 -2.338 1.00 0.54 H new ATOM 0 H2' DG A 4 -4.337 8.213 -1.227 1.00 0.53 H new ATOM 0 H2'' DG A 4 -5.188 7.812 -2.706 1.00 0.53 H new ATOM 0 H1' DG A 4 -3.324 6.849 -3.710 1.00 0.49 H new ATOM 0 H8 DG A 4 -2.705 6.957 0.135 1.00 0.50 H new ATOM 0 H1 DG A 4 -2.338 1.214 -2.699 1.00 0.62 H new ATOM 0 H21 DG A 4 -2.952 2.969 -5.631 1.00 0.69 H new ATOM 0 H22 DG A 4 -2.647 1.412 -4.856 1.00 0.69 H new ATOM 129 P DG A 5 -5.884 9.993 -4.517 1.00 0.97 P ATOM 130 OP1 DG A 5 -6.690 8.761 -4.358 1.00 1.45 O ATOM 131 OP2 DG A 5 -5.963 10.769 -5.776 1.00 1.43 O ATOM 132 O5' DG A 5 -6.221 10.986 -3.285 1.00 0.98 O ATOM 133 C5' DG A 5 -6.839 10.486 -2.086 1.00 0.88 C ATOM 134 C4' DG A 5 -8.321 10.860 -2.013 1.00 1.05 C ATOM 135 O4' DG A 5 -8.926 10.652 -3.290 1.00 1.31 O ATOM 136 C3' DG A 5 -9.132 10.036 -1.011 1.00 0.97 C ATOM 137 O3' DG A 5 -10.245 10.809 -0.531 1.00 1.27 O ATOM 138 C2' DG A 5 -9.645 8.894 -1.869 1.00 1.07 C ATOM 139 C1' DG A 5 -9.931 9.637 -3.169 1.00 1.38 C ATOM 140 N9 DG A 5 -9.864 8.804 -4.384 1.00 1.67 N ATOM 141 C8 DG A 5 -10.063 7.457 -4.520 1.00 1.87 C ATOM 142 N7 DG A 5 -9.946 7.025 -5.745 1.00 2.24 N ATOM 143 C5 DG A 5 -9.645 8.173 -6.475 1.00 2.31 C ATOM 144 C6 DG A 5 -9.406 8.337 -7.868 1.00 2.75 C ATOM 145 O6 DG A 5 -9.415 7.484 -8.751 1.00 3.09 O ATOM 146 N1 DG A 5 -9.138 9.661 -8.183 1.00 2.88 N ATOM 147 C2 DG A 5 -9.108 10.698 -7.278 1.00 2.66 C ATOM 148 N2 DG A 5 -8.835 11.905 -7.766 1.00 3.03 N ATOM 149 N3 DG A 5 -9.333 10.548 -5.976 1.00 2.22 N ATOM 150 C4 DG A 5 -9.594 9.264 -5.648 1.00 2.02 C ATOM 0 H5' DG A 5 -6.320 10.886 -1.215 1.00 0.88 H new ATOM 0 H5'' DG A 5 -6.735 9.402 -2.048 1.00 0.88 H new ATOM 0 H4' DG A 5 -8.338 11.901 -1.691 1.00 1.05 H new ATOM 0 H3' DG A 5 -8.560 9.718 -0.140 1.00 0.97 H new ATOM 0 H2' DG A 5 -8.904 8.105 -1.996 1.00 1.07 H new ATOM 0 H2'' DG A 5 -10.538 8.429 -1.451 1.00 1.07 H new ATOM 0 H1' DG A 5 -10.952 10.013 -3.108 1.00 1.38 H new ATOM 0 H8 DG A 5 -10.296 6.810 -3.688 1.00 1.87 H new ATOM 0 H1 DG A 5 -8.949 9.883 -9.160 1.00 2.88 H new ATOM 0 H21 DG A 5 -8.799 12.711 -7.142 1.00 3.03 H new ATOM 0 H22 DG A 5 -8.661 12.024 -8.764 1.00 3.03 H new ATOM 162 P DT A 6 -10.412 11.152 1.036 1.00 0.99 P ATOM 163 OP1 DT A 6 -11.655 11.938 1.210 1.00 1.11 O ATOM 164 OP2 DT A 6 -9.124 11.693 1.526 1.00 1.49 O ATOM 165 O5' DT A 6 -10.635 9.699 1.700 1.00 0.95 O ATOM 166 C5' DT A 6 -11.670 8.828 1.233 1.00 0.81 C ATOM 167 C4' DT A 6 -11.484 7.404 1.753 1.00 0.75 C ATOM 168 O4' DT A 6 -12.329 6.515 1.010 1.00 0.90 O ATOM 169 C3' DT A 6 -10.051 6.875 1.621 1.00 0.80 C ATOM 170 O3' DT A 6 -9.689 6.144 2.807 1.00 0.98 O ATOM 171 C2' DT A 6 -10.129 5.928 0.434 1.00 0.85 C ATOM 172 C1' DT A 6 -11.546 5.396 0.585 1.00 0.93 C ATOM 173 N1 DT A 6 -12.146 4.835 -0.663 1.00 1.10 N ATOM 174 C2 DT A 6 -13.531 4.869 -0.795 1.00 1.31 C ATOM 175 O2 DT A 6 -14.269 5.338 0.066 1.00 1.42 O ATOM 176 N3 DT A 6 -14.047 4.325 -1.953 1.00 1.54 N ATOM 177 C4 DT A 6 -13.325 3.752 -2.980 1.00 1.61 C ATOM 178 O4 DT A 6 -13.898 3.296 -3.966 1.00 1.86 O ATOM 179 C5 DT A 6 -11.895 3.750 -2.767 1.00 1.46 C ATOM 180 C7 DT A 6 -10.980 3.129 -3.820 1.00 1.74 C ATOM 181 C6 DT A 6 -11.357 4.277 -1.648 1.00 1.22 C ATOM 0 H5' DT A 6 -11.675 8.820 0.143 1.00 0.81 H new ATOM 0 H5'' DT A 6 -12.639 9.209 1.554 1.00 0.81 H new ATOM 0 H4' DT A 6 -11.735 7.441 2.813 1.00 0.75 H new ATOM 0 H3' DT A 6 -9.312 7.666 1.491 1.00 0.80 H new ATOM 0 H2' DT A 6 -9.980 6.442 -0.515 1.00 0.85 H new ATOM 0 H2'' DT A 6 -9.382 5.136 0.488 1.00 0.85 H new ATOM 0 H1' DT A 6 -11.527 4.563 1.287 1.00 0.93 H new ATOM 0 H3 DT A 6 -15.061 4.349 -2.061 1.00 1.54 H new ATOM 0 H71 DT A 6 -10.016 3.638 -3.811 1.00 1.74 H new ATOM 0 H72 DT A 6 -10.834 2.072 -3.597 1.00 1.74 H new ATOM 0 H73 DT A 6 -11.436 3.233 -4.805 1.00 1.74 H new ATOM 0 H6 DT A 6 -10.285 4.262 -1.520 1.00 1.22 H new ATOM 194 P DA A 7 -9.299 6.906 4.178 1.00 1.05 P ATOM 195 OP1 DA A 7 -10.019 6.244 5.291 1.00 1.48 O ATOM 196 OP2 DA A 7 -9.457 8.362 3.963 1.00 1.29 O ATOM 197 O5' DA A 7 -7.720 6.586 4.336 1.00 0.85 O ATOM 198 C5' DA A 7 -7.216 5.921 5.507 1.00 0.91 C ATOM 199 C4' DA A 7 -5.858 5.257 5.251 1.00 0.81 C ATOM 200 O4' DA A 7 -5.921 4.522 4.021 1.00 0.79 O ATOM 201 C3' DA A 7 -4.683 6.233 5.125 1.00 0.71 C ATOM 202 O3' DA A 7 -3.481 5.616 5.620 1.00 0.80 O ATOM 203 C2' DA A 7 -4.574 6.440 3.629 1.00 0.59 C ATOM 204 C1' DA A 7 -4.952 5.054 3.113 1.00 0.62 C ATOM 205 N9 DA A 7 -5.551 5.037 1.759 1.00 0.57 N ATOM 206 C8 DA A 7 -6.221 6.033 1.101 1.00 0.60 C ATOM 207 N7 DA A 7 -6.630 5.703 -0.092 1.00 0.65 N ATOM 208 C5 DA A 7 -6.198 4.389 -0.238 1.00 0.63 C ATOM 209 C6 DA A 7 -6.317 3.460 -1.288 1.00 0.73 C ATOM 210 N6 DA A 7 -6.932 3.733 -2.439 1.00 0.85 N ATOM 211 N1 DA A 7 -5.774 2.245 -1.098 1.00 0.79 N ATOM 212 C2 DA A 7 -5.163 1.983 0.053 1.00 0.80 C ATOM 213 N3 DA A 7 -4.988 2.767 1.107 1.00 0.72 N ATOM 214 C4 DA A 7 -5.541 3.975 0.887 1.00 0.61 C ATOM 0 H5' DA A 7 -7.933 5.167 5.832 1.00 0.91 H new ATOM 0 H5'' DA A 7 -7.120 6.641 6.320 1.00 0.91 H new ATOM 0 H4' DA A 7 -5.674 4.628 6.122 1.00 0.81 H new ATOM 0 H3' DA A 7 -4.823 7.158 5.684 1.00 0.71 H new ATOM 0 H2' DA A 7 -5.253 7.213 3.269 1.00 0.59 H new ATOM 0 H2'' DA A 7 -3.569 6.733 3.326 1.00 0.59 H new ATOM 0 H1' DA A 7 -4.031 4.475 3.049 1.00 0.62 H new ATOM 0 H8 DA A 7 -6.396 7.007 1.533 1.00 0.60 H new ATOM 0 H61 DA A 7 -6.990 3.022 -3.168 1.00 0.85 H new ATOM 0 H62 DA A 7 -7.345 4.653 -2.591 1.00 0.85 H new ATOM 0 H2 DA A 7 -4.750 0.989 0.142 1.00 0.80 H new ATOM 226 P DG A 8 -2.335 6.468 6.381 1.00 0.70 P ATOM 227 OP1 DG A 8 -2.816 7.858 6.546 1.00 0.85 O ATOM 228 OP2 DG A 8 -1.047 6.214 5.697 1.00 0.98 O ATOM 229 O5' DG A 8 -2.297 5.760 7.827 1.00 0.72 O ATOM 230 C5' DG A 8 -2.513 4.348 7.933 1.00 0.69 C ATOM 231 C4' DG A 8 -1.296 3.617 8.489 1.00 0.61 C ATOM 232 O4' DG A 8 -1.303 2.274 7.996 1.00 0.65 O ATOM 233 C3' DG A 8 0.048 4.239 8.103 1.00 0.57 C ATOM 234 O3' DG A 8 0.921 4.223 9.244 1.00 0.59 O ATOM 235 C2' DG A 8 0.587 3.335 7.010 1.00 0.52 C ATOM 236 C1' DG A 8 -0.061 2.001 7.341 1.00 0.53 C ATOM 237 N9 DG A 8 -0.352 1.147 6.169 1.00 0.56 N ATOM 238 C8 DG A 8 -0.210 -0.208 6.063 1.00 0.65 C ATOM 239 N7 DG A 8 -0.553 -0.689 4.901 1.00 0.71 N ATOM 240 C5 DG A 8 -0.953 0.429 4.179 1.00 0.64 C ATOM 241 C6 DG A 8 -1.433 0.525 2.842 1.00 0.69 C ATOM 242 O6 DG A 8 -1.597 -0.381 2.025 1.00 0.81 O ATOM 243 N1 DG A 8 -1.725 1.839 2.499 1.00 0.64 N ATOM 244 C2 DG A 8 -1.571 2.925 3.332 1.00 0.58 C ATOM 245 N2 DG A 8 -1.889 4.109 2.819 1.00 0.63 N ATOM 246 N3 DG A 8 -1.124 2.835 4.588 1.00 0.54 N ATOM 247 C4 DG A 8 -0.834 1.562 4.944 1.00 0.56 C ATOM 0 H5' DG A 8 -2.758 3.945 6.950 1.00 0.69 H new ATOM 0 H5'' DG A 8 -3.372 4.161 8.577 1.00 0.69 H new ATOM 0 H4' DG A 8 -1.381 3.677 9.574 1.00 0.61 H new ATOM 0 H3' DG A 8 -0.038 5.273 7.770 1.00 0.57 H new ATOM 0 H2' DG A 8 0.308 3.687 6.017 1.00 0.52 H new ATOM 0 H2'' DG A 8 1.675 3.275 7.032 1.00 0.52 H new ATOM 0 H1' DG A 8 0.652 1.453 7.957 1.00 0.53 H new ATOM 0 H8 DG A 8 0.154 -0.826 6.871 1.00 0.65 H new ATOM 0 H1 DG A 8 -2.080 2.013 1.559 1.00 0.64 H new ATOM 0 H21 DG A 8 -1.797 4.952 3.386 1.00 0.63 H new ATOM 0 H22 DG A 8 -2.225 4.175 1.858 1.00 0.63 H new ATOM 259 P DG A 9 2.452 4.711 9.130 1.00 0.57 P ATOM 260 OP1 DG A 9 2.865 5.263 10.439 1.00 0.75 O ATOM 261 OP2 DG A 9 2.593 5.534 7.907 1.00 0.64 O ATOM 262 O5' DG A 9 3.242 3.321 8.891 1.00 0.47 O ATOM 263 C5' DG A 9 3.225 2.281 9.884 1.00 0.44 C ATOM 264 C4' DG A 9 3.811 0.969 9.345 1.00 0.41 C ATOM 265 O4' DG A 9 3.131 0.604 8.136 1.00 0.41 O ATOM 266 C3' DG A 9 5.312 1.031 9.015 1.00 0.44 C ATOM 267 O3' DG A 9 5.964 -0.168 9.480 1.00 0.52 O ATOM 268 C2' DG A 9 5.331 1.076 7.505 1.00 0.42 C ATOM 269 C1' DG A 9 4.122 0.224 7.189 1.00 0.38 C ATOM 270 N9 DG A 9 3.591 0.447 5.840 1.00 0.33 N ATOM 271 C8 DG A 9 3.412 1.635 5.195 1.00 0.31 C ATOM 272 N7 DG A 9 2.985 1.516 3.976 1.00 0.30 N ATOM 273 C5 DG A 9 2.869 0.147 3.794 1.00 0.30 C ATOM 274 C6 DG A 9 2.450 -0.579 2.653 1.00 0.35 C ATOM 275 O6 DG A 9 2.097 -0.135 1.564 1.00 0.41 O ATOM 276 N1 DG A 9 2.476 -1.945 2.881 1.00 0.39 N ATOM 277 C2 DG A 9 2.859 -2.541 4.062 1.00 0.39 C ATOM 278 N2 DG A 9 2.812 -3.868 4.089 1.00 0.47 N ATOM 279 N3 DG A 9 3.256 -1.858 5.139 1.00 0.37 N ATOM 280 C4 DG A 9 3.236 -0.521 4.931 1.00 0.32 C ATOM 0 H5' DG A 9 2.201 2.112 10.216 1.00 0.44 H new ATOM 0 H5'' DG A 9 3.794 2.602 10.756 1.00 0.44 H new ATOM 0 H4' DG A 9 3.675 0.242 10.146 1.00 0.41 H new ATOM 0 H3' DG A 9 5.824 1.874 9.478 1.00 0.44 H new ATOM 0 H2' DG A 9 5.235 2.091 7.119 1.00 0.42 H new ATOM 0 H2'' DG A 9 6.250 0.662 7.089 1.00 0.42 H new ATOM 0 H1' DG A 9 4.400 -0.829 7.237 1.00 0.38 H new ATOM 0 H8 DG A 9 3.608 2.591 5.658 1.00 0.31 H new ATOM 0 H1 DG A 9 2.190 -2.556 2.116 1.00 0.39 H new ATOM 0 H21 DG A 9 3.083 -4.371 4.934 1.00 0.47 H new ATOM 0 H22 DG A 9 2.505 -4.384 3.265 1.00 0.47 H new ATOM 292 P DG A 10 7.556 -0.393 9.275 1.00 0.70 P ATOM 293 OP1 DG A 10 7.996 -1.461 10.201 1.00 0.88 O ATOM 294 OP2 DG A 10 8.216 0.933 9.313 1.00 0.76 O ATOM 295 O5' DG A 10 7.655 -0.964 7.767 1.00 0.80 O ATOM 296 C5' DG A 10 7.177 -2.280 7.443 1.00 0.74 C ATOM 297 C4' DG A 10 7.388 -2.619 5.963 1.00 0.72 C ATOM 298 O4' DG A 10 6.829 -1.582 5.146 1.00 0.65 O ATOM 299 C3' DG A 10 8.851 -2.744 5.550 1.00 0.78 C ATOM 300 O3' DG A 10 8.966 -3.646 4.432 1.00 0.84 O ATOM 301 C2' DG A 10 9.192 -1.333 5.111 1.00 0.70 C ATOM 302 C1' DG A 10 7.892 -0.934 4.429 1.00 0.59 C ATOM 303 N9 DG A 10 7.602 0.516 4.426 1.00 0.52 N ATOM 304 C8 DG A 10 7.908 1.460 5.373 1.00 0.57 C ATOM 305 N7 DG A 10 7.472 2.655 5.090 1.00 0.54 N ATOM 306 C5 DG A 10 6.832 2.496 3.863 1.00 0.44 C ATOM 307 C6 DG A 10 6.161 3.454 3.050 1.00 0.43 C ATOM 308 O6 DG A 10 5.985 4.652 3.264 1.00 0.50 O ATOM 309 N1 DG A 10 5.661 2.876 1.891 1.00 0.40 N ATOM 310 C2 DG A 10 5.788 1.549 1.553 1.00 0.40 C ATOM 311 N2 DG A 10 5.250 1.183 0.393 1.00 0.45 N ATOM 312 N3 DG A 10 6.412 0.647 2.314 1.00 0.42 N ATOM 313 C4 DG A 10 6.908 1.191 3.450 1.00 0.44 C ATOM 0 H5' DG A 10 6.116 -2.350 7.683 1.00 0.74 H new ATOM 0 H5'' DG A 10 7.693 -3.015 8.061 1.00 0.74 H new ATOM 0 H4' DG A 10 6.904 -3.586 5.823 1.00 0.72 H new ATOM 0 H3' DG A 10 9.500 -3.127 6.338 1.00 0.78 H new ATOM 0 H2' DG A 10 9.435 -0.684 5.952 1.00 0.70 H new ATOM 0 H2'' DG A 10 10.043 -1.305 4.431 1.00 0.70 H new ATOM 0 H1' DG A 10 7.982 -1.230 3.384 1.00 0.59 H new ATOM 0 H8 DG A 10 8.461 1.233 6.273 1.00 0.57 H new ATOM 0 H1 DG A 10 5.161 3.482 1.240 1.00 0.40 H new ATOM 0 H21 DG A 10 5.311 0.212 0.086 1.00 0.45 H new ATOM 0 H22 DG A 10 4.776 1.873 -0.190 1.00 0.45 H new ATOM 325 P DT A 11 8.911 -5.248 4.639 1.00 1.05 P ATOM 326 OP1 DT A 11 7.570 -5.605 5.157 1.00 1.29 O ATOM 327 OP2 DT A 11 10.120 -5.655 5.391 1.00 1.27 O ATOM 328 O5' DT A 11 9.035 -5.801 3.124 1.00 0.98 O ATOM 329 C5' DT A 11 10.154 -5.454 2.289 1.00 0.84 C ATOM 330 C4' DT A 11 9.703 -4.819 0.971 1.00 0.64 C ATOM 331 O4' DT A 11 9.185 -3.514 1.224 1.00 0.53 O ATOM 332 C3' DT A 11 10.827 -4.655 -0.070 1.00 0.52 C ATOM 333 O3' DT A 11 10.582 -5.508 -1.212 1.00 0.53 O ATOM 334 C2' DT A 11 10.763 -3.177 -0.499 1.00 0.47 C ATOM 335 C1' DT A 11 9.426 -2.713 0.070 1.00 0.45 C ATOM 336 N1 DT A 11 9.420 -1.296 0.496 1.00 0.41 N ATOM 337 C2 DT A 11 8.578 -0.403 -0.163 1.00 0.42 C ATOM 338 O2 DT A 11 7.894 -0.716 -1.136 1.00 0.51 O ATOM 339 N3 DT A 11 8.598 0.893 0.301 1.00 0.39 N ATOM 340 C4 DT A 11 9.374 1.380 1.336 1.00 0.41 C ATOM 341 O4 DT A 11 9.306 2.558 1.667 1.00 0.45 O ATOM 342 C5 DT A 11 10.222 0.390 1.955 1.00 0.46 C ATOM 343 C7 DT A 11 11.151 0.806 3.093 1.00 0.61 C ATOM 344 C6 DT A 11 10.220 -0.887 1.529 1.00 0.45 C ATOM 0 H5' DT A 11 10.742 -6.347 2.080 1.00 0.84 H new ATOM 0 H5'' DT A 11 10.805 -4.761 2.822 1.00 0.84 H new ATOM 0 H4' DT A 11 8.958 -5.502 0.562 1.00 0.64 H new ATOM 0 H3' DT A 11 11.801 -4.928 0.336 1.00 0.52 H new ATOM 0 H2' DT A 11 11.596 -2.602 -0.093 1.00 0.47 H new ATOM 0 H2'' DT A 11 10.800 -3.069 -1.583 1.00 0.47 H new ATOM 0 H1' DT A 11 8.670 -2.811 -0.709 1.00 0.45 H new ATOM 0 H3 DT A 11 7.980 1.558 -0.164 1.00 0.39 H new ATOM 0 H71 DT A 11 11.447 1.846 2.959 1.00 0.61 H new ATOM 0 H72 DT A 11 10.632 0.696 4.045 1.00 0.61 H new ATOM 0 H73 DT A 11 12.038 0.173 3.088 1.00 0.61 H new ATOM 0 H6 DT A 11 10.864 -1.606 2.013 1.00 0.45 H new ATOM 357 P DA A 12 9.206 -5.448 -2.061 1.00 0.69 P ATOM 358 OP1 DA A 12 8.105 -5.144 -1.128 1.00 0.62 O ATOM 359 OP2 DA A 12 9.135 -6.657 -2.910 1.00 1.25 O ATOM 360 O5' DA A 12 9.417 -4.172 -3.033 1.00 0.97 O ATOM 361 C5' DA A 12 8.328 -3.296 -3.389 1.00 0.86 C ATOM 362 C4' DA A 12 7.146 -4.040 -4.026 1.00 0.73 C ATOM 363 O4' DA A 12 6.508 -4.859 -3.041 1.00 0.67 O ATOM 364 C3' DA A 12 6.069 -3.113 -4.610 1.00 0.66 C ATOM 365 O3' DA A 12 6.026 -3.266 -6.038 1.00 0.70 O ATOM 366 C2' DA A 12 4.759 -3.604 -3.997 1.00 0.67 C ATOM 367 C1' DA A 12 5.231 -4.306 -2.735 1.00 0.63 C ATOM 368 N9 DA A 12 5.375 -3.439 -1.536 1.00 0.55 N ATOM 369 C8 DA A 12 5.280 -2.069 -1.418 1.00 0.51 C ATOM 370 N7 DA A 12 5.405 -1.637 -0.194 1.00 0.49 N ATOM 371 C5 DA A 12 5.602 -2.795 0.551 1.00 0.51 C ATOM 372 C6 DA A 12 5.804 -3.018 1.924 1.00 0.56 C ATOM 373 N6 DA A 12 5.830 -2.041 2.824 1.00 0.60 N ATOM 374 N1 DA A 12 5.970 -4.288 2.325 1.00 0.62 N ATOM 375 C2 DA A 12 5.934 -5.259 1.421 1.00 0.64 C ATOM 376 N3 DA A 12 5.749 -5.178 0.114 1.00 0.62 N ATOM 377 C4 DA A 12 5.587 -3.893 -0.257 1.00 0.55 C ATOM 0 H5' DA A 12 8.690 -2.538 -4.083 1.00 0.86 H new ATOM 0 H5'' DA A 12 7.983 -2.773 -2.497 1.00 0.86 H new ATOM 0 H4' DA A 12 7.572 -4.623 -4.843 1.00 0.73 H new ATOM 0 H3' DA A 12 6.259 -2.062 -4.394 1.00 0.66 H new ATOM 0 H2' DA A 12 4.081 -2.780 -3.774 1.00 0.67 H new ATOM 0 H2'' DA A 12 4.227 -4.282 -4.664 1.00 0.67 H new ATOM 0 H1' DA A 12 4.470 -5.039 -2.469 1.00 0.63 H new ATOM 0 H8 DA A 12 5.117 -1.414 -2.261 1.00 0.51 H new ATOM 0 H61 DA A 12 5.980 -2.259 3.809 1.00 0.60 H new ATOM 0 H62 DA A 12 5.700 -1.073 2.530 1.00 0.60 H new ATOM 0 H2 DA A 12 6.076 -6.257 1.808 1.00 0.64 H new ATOM 389 P DG A 13 4.871 -2.561 -6.930 1.00 0.68 P ATOM 390 OP1 DG A 13 3.563 -3.146 -6.558 1.00 0.82 O ATOM 391 OP2 DG A 13 5.306 -2.585 -8.345 1.00 0.80 O ATOM 392 O5' DG A 13 4.896 -1.029 -6.425 1.00 0.69 O ATOM 393 C5' DG A 13 5.397 0.024 -7.265 1.00 0.71 C ATOM 394 C4' DG A 13 4.411 1.194 -7.363 1.00 0.68 C ATOM 395 O4' DG A 13 3.871 1.469 -6.065 1.00 0.63 O ATOM 396 C3' DG A 13 5.043 2.496 -7.881 1.00 0.73 C ATOM 397 O3' DG A 13 4.220 3.103 -8.911 1.00 0.80 O ATOM 398 C2' DG A 13 5.123 3.400 -6.654 1.00 0.70 C ATOM 399 C1' DG A 13 3.997 2.865 -5.784 1.00 0.64 C ATOM 400 N9 DG A 13 4.229 3.015 -4.340 1.00 0.61 N ATOM 401 C8 DG A 13 4.554 2.059 -3.420 1.00 0.66 C ATOM 402 N7 DG A 13 4.682 2.511 -2.206 1.00 0.61 N ATOM 403 C5 DG A 13 4.422 3.871 -2.334 1.00 0.51 C ATOM 404 C6 DG A 13 4.412 4.891 -1.351 1.00 0.44 C ATOM 405 O6 DG A 13 4.644 4.790 -0.148 1.00 0.43 O ATOM 406 N1 DG A 13 4.097 6.122 -1.903 1.00 0.46 N ATOM 407 C2 DG A 13 3.829 6.350 -3.235 1.00 0.52 C ATOM 408 N2 DG A 13 3.548 7.606 -3.569 1.00 0.62 N ATOM 409 N3 DG A 13 3.841 5.396 -4.162 1.00 0.54 N ATOM 410 C4 DG A 13 4.144 4.185 -3.640 1.00 0.53 C ATOM 0 H5' DG A 13 5.594 -0.370 -8.262 1.00 0.71 H new ATOM 0 H5'' DG A 13 6.348 0.382 -6.870 1.00 0.71 H new ATOM 0 H4' DG A 13 3.648 0.883 -8.076 1.00 0.68 H new ATOM 0 H3' DG A 13 6.019 2.324 -8.336 1.00 0.73 H new ATOM 0 H2' DG A 13 6.091 3.327 -6.157 1.00 0.70 H new ATOM 0 H2'' DG A 13 4.975 4.449 -6.911 1.00 0.70 H new ATOM 0 H1' DG A 13 3.103 3.442 -6.019 1.00 0.64 H new ATOM 0 H8 DG A 13 4.693 1.019 -3.677 1.00 0.66 H new ATOM 0 H1 DG A 13 4.061 6.923 -1.273 1.00 0.46 H new ATOM 0 H21 DG A 13 3.340 7.841 -4.540 1.00 0.62 H new ATOM 0 H22 DG A 13 3.540 8.334 -2.855 1.00 0.62 H new ATOM 422 P DG A 14 2.649 3.476 -8.716 1.00 0.76 P ATOM 423 OP1 DG A 14 2.209 4.256 -9.897 1.00 0.85 O ATOM 424 OP2 DG A 14 2.444 4.034 -7.363 1.00 0.81 O ATOM 425 O5' DG A 14 1.922 2.036 -8.790 1.00 0.66 O ATOM 426 C5' DG A 14 1.901 1.289 -10.018 1.00 0.71 C ATOM 427 C4' DG A 14 1.012 0.044 -9.928 1.00 0.66 C ATOM 428 O4' DG A 14 1.407 -0.747 -8.802 1.00 0.65 O ATOM 429 C3' DG A 14 -0.490 0.343 -9.766 1.00 0.68 C ATOM 430 O3' DG A 14 -1.237 -0.345 -10.789 1.00 0.76 O ATOM 431 C2' DG A 14 -0.847 -0.231 -8.398 1.00 0.61 C ATOM 432 C1' DG A 14 0.227 -1.291 -8.226 1.00 0.56 C ATOM 433 N9 DG A 14 0.511 -1.642 -6.823 1.00 0.50 N ATOM 434 C8 DG A 14 0.504 -2.878 -6.239 1.00 0.51 C ATOM 435 N7 DG A 14 0.761 -2.860 -4.962 1.00 0.52 N ATOM 436 C5 DG A 14 0.954 -1.514 -4.676 1.00 0.49 C ATOM 437 C6 DG A 14 1.262 -0.878 -3.443 1.00 0.50 C ATOM 438 O6 DG A 14 1.412 -1.389 -2.340 1.00 0.53 O ATOM 439 N1 DG A 14 1.369 0.495 -3.593 1.00 0.50 N ATOM 440 C2 DG A 14 1.199 1.174 -4.779 1.00 0.53 C ATOM 441 N2 DG A 14 1.334 2.492 -4.732 1.00 0.61 N ATOM 442 N3 DG A 14 0.912 0.582 -5.935 1.00 0.54 N ATOM 443 C4 DG A 14 0.804 -0.759 -5.810 1.00 0.49 C ATOM 0 H5' DG A 14 2.917 0.989 -10.275 1.00 0.71 H new ATOM 0 H5'' DG A 14 1.544 1.930 -10.824 1.00 0.71 H new ATOM 0 H4' DG A 14 1.148 -0.474 -10.878 1.00 0.66 H new ATOM 0 H3' DG A 14 -0.716 1.406 -9.849 1.00 0.68 H new ATOM 0 H2' DG A 14 -0.808 0.524 -7.613 1.00 0.61 H new ATOM 0 H2'' DG A 14 -1.850 -0.657 -8.381 1.00 0.61 H new ATOM 0 H1' DG A 14 -0.118 -2.211 -8.699 1.00 0.56 H new ATOM 0 H8 DG A 14 0.304 -3.787 -6.787 1.00 0.51 H new ATOM 0 H1 DG A 14 1.590 1.044 -2.763 1.00 0.50 H new ATOM 0 H21 DG A 14 1.219 3.047 -5.580 1.00 0.61 H new ATOM 0 H22 DG A 14 1.553 2.951 -3.848 1.00 0.61 H new ATOM 455 P DG A 15 -2.854 -0.288 -10.818 1.00 0.82 P ATOM 456 OP1 DG A 15 -3.305 -0.584 -12.197 1.00 0.93 O ATOM 457 OP2 DG A 15 -3.282 0.965 -10.154 1.00 0.94 O ATOM 458 O5' DG A 15 -3.278 -1.526 -9.870 1.00 0.89 O ATOM 459 C5' DG A 15 -3.133 -2.882 -10.320 1.00 0.65 C ATOM 460 C4' DG A 15 -3.560 -3.889 -9.247 1.00 0.65 C ATOM 461 O4' DG A 15 -2.866 -3.593 -8.027 1.00 0.71 O ATOM 462 C3' DG A 15 -5.061 -3.879 -8.919 1.00 0.67 C ATOM 463 O3' DG A 15 -5.512 -5.221 -8.645 1.00 0.72 O ATOM 464 C2' DG A 15 -5.135 -3.040 -7.668 1.00 0.60 C ATOM 465 C1' DG A 15 -3.834 -3.423 -6.991 1.00 0.61 C ATOM 466 N9 DG A 15 -3.326 -2.416 -6.045 1.00 0.56 N ATOM 467 C8 DG A 15 -3.397 -1.048 -6.118 1.00 0.57 C ATOM 468 N7 DG A 15 -2.904 -0.437 -5.078 1.00 0.53 N ATOM 469 C5 DG A 15 -2.474 -1.476 -4.258 1.00 0.49 C ATOM 470 C6 DG A 15 -1.854 -1.434 -2.984 1.00 0.48 C ATOM 471 O6 DG A 15 -1.562 -0.453 -2.308 1.00 0.49 O ATOM 472 N1 DG A 15 -1.588 -2.706 -2.508 1.00 0.49 N ATOM 473 C2 DG A 15 -1.875 -3.877 -3.165 1.00 0.50 C ATOM 474 N2 DG A 15 -1.544 -5.009 -2.543 1.00 0.55 N ATOM 475 N3 DG A 15 -2.454 -3.922 -4.362 1.00 0.52 N ATOM 476 C4 DG A 15 -2.726 -2.687 -4.845 1.00 0.51 C ATOM 0 H5' DG A 15 -2.094 -3.064 -10.596 1.00 0.65 H new ATOM 0 H5'' DG A 15 -3.732 -3.032 -11.218 1.00 0.65 H new ATOM 0 H4' DG A 15 -3.318 -4.870 -9.657 1.00 0.65 H new ATOM 0 H3' DG A 15 -5.680 -3.496 -9.730 1.00 0.67 H new ATOM 0 H2' DG A 15 -5.188 -1.974 -7.888 1.00 0.60 H new ATOM 0 H2'' DG A 15 -6.005 -3.283 -7.058 1.00 0.60 H new ATOM 0 H1' DG A 15 -4.016 -4.325 -6.407 1.00 0.61 H new ATOM 0 H8 DG A 15 -3.823 -0.525 -6.961 1.00 0.57 H new ATOM 0 H1 DG A 15 -1.142 -2.780 -1.594 1.00 0.49 H new ATOM 0 H21 DG A 15 -1.734 -5.908 -2.985 1.00 0.55 H new ATOM 0 H22 DG A 15 -1.101 -4.976 -1.625 1.00 0.55 H new ATOM 488 P DT A 16 -7.052 -5.534 -8.249 1.00 0.79 P ATOM 489 OP1 DT A 16 -7.319 -6.967 -8.509 1.00 0.89 O ATOM 490 OP2 DT A 16 -7.909 -4.498 -8.874 1.00 0.94 O ATOM 491 O5' DT A 16 -7.065 -5.296 -6.649 1.00 0.92 O ATOM 492 C5' DT A 16 -6.267 -6.112 -5.775 1.00 0.94 C ATOM 493 C4' DT A 16 -5.896 -5.389 -4.475 1.00 0.68 C ATOM 494 O4' DT A 16 -5.812 -3.986 -4.705 1.00 0.59 O ATOM 495 C3' DT A 16 -6.900 -5.592 -3.337 1.00 0.58 C ATOM 496 O3' DT A 16 -6.280 -6.390 -2.316 1.00 0.67 O ATOM 497 C2' DT A 16 -7.165 -4.156 -2.779 1.00 0.57 C ATOM 498 C1' DT A 16 -6.074 -3.332 -3.472 1.00 0.49 C ATOM 499 N1 DT A 16 -6.468 -1.939 -3.782 1.00 0.48 N ATOM 500 C2 DT A 16 -5.877 -0.920 -3.052 1.00 0.55 C ATOM 501 O2 DT A 16 -5.045 -1.136 -2.177 1.00 0.68 O ATOM 502 N3 DT A 16 -6.271 0.362 -3.371 1.00 0.60 N ATOM 503 C4 DT A 16 -7.186 0.715 -4.342 1.00 0.60 C ATOM 504 O4 DT A 16 -7.458 1.895 -4.541 1.00 0.69 O ATOM 505 C5 DT A 16 -7.751 -0.409 -5.056 1.00 0.59 C ATOM 506 C7 DT A 16 -8.778 -0.162 -6.159 1.00 0.78 C ATOM 507 C6 DT A 16 -7.385 -1.673 -4.762 1.00 0.53 C ATOM 0 H5' DT A 16 -5.356 -6.411 -6.293 1.00 0.94 H new ATOM 0 H5'' DT A 16 -6.813 -7.025 -5.536 1.00 0.94 H new ATOM 0 H4' DT A 16 -4.943 -5.822 -4.172 1.00 0.68 H new ATOM 0 H3' DT A 16 -7.816 -6.087 -3.661 1.00 0.58 H new ATOM 0 H2' DT A 16 -8.164 -3.800 -3.029 1.00 0.57 H new ATOM 0 H2'' DT A 16 -7.076 -4.118 -1.693 1.00 0.57 H new ATOM 0 H1' DT A 16 -5.219 -3.270 -2.798 1.00 0.49 H new ATOM 0 H3 DT A 16 -5.846 1.122 -2.839 1.00 0.60 H new ATOM 0 H71 DT A 16 -8.704 -0.950 -6.908 1.00 0.78 H new ATOM 0 H72 DT A 16 -9.780 -0.162 -5.730 1.00 0.78 H new ATOM 0 H73 DT A 16 -8.584 0.803 -6.627 1.00 0.78 H new ATOM 0 H6 DT A 16 -7.825 -2.492 -5.311 1.00 0.53 H new ATOM 520 P DA A 17 -7.166 -7.118 -1.178 1.00 0.76 P ATOM 521 OP1 DA A 17 -6.449 -8.341 -0.748 1.00 1.17 O ATOM 522 OP2 DA A 17 -8.561 -7.215 -1.670 1.00 0.70 O ATOM 523 O5' DA A 17 -7.127 -6.057 0.035 1.00 0.94 O ATOM 524 C5' DA A 17 -7.908 -6.273 1.214 1.00 1.15 C ATOM 525 C4' DA A 17 -7.862 -5.072 2.157 1.00 1.03 C ATOM 526 O4' DA A 17 -8.040 -3.867 1.410 1.00 1.05 O ATOM 527 C3' DA A 17 -8.959 -5.086 3.211 1.00 1.04 C ATOM 528 O3' DA A 17 -8.549 -4.326 4.355 1.00 1.26 O ATOM 529 C2' DA A 17 -10.106 -4.380 2.508 1.00 1.06 C ATOM 530 C1' DA A 17 -9.362 -3.360 1.644 1.00 1.09 C ATOM 531 N9 DA A 17 -9.984 -3.120 0.328 1.00 1.17 N ATOM 532 C8 DA A 17 -10.274 -4.018 -0.668 1.00 1.11 C ATOM 533 N7 DA A 17 -10.847 -3.482 -1.711 1.00 1.40 N ATOM 534 C5 DA A 17 -10.938 -2.133 -1.383 1.00 1.64 C ATOM 535 C6 DA A 17 -11.451 -1.018 -2.070 1.00 2.06 C ATOM 536 N6 DA A 17 -11.996 -1.095 -3.283 1.00 2.28 N ATOM 537 N1 DA A 17 -11.380 0.173 -1.454 1.00 2.33 N ATOM 538 C2 DA A 17 -10.838 0.244 -0.243 1.00 2.22 C ATOM 539 N3 DA A 17 -10.327 -0.724 0.501 1.00 1.85 N ATOM 540 C4 DA A 17 -10.412 -1.905 -0.144 1.00 1.53 C ATOM 0 H5' DA A 17 -7.542 -7.158 1.735 1.00 1.15 H new ATOM 0 H5'' DA A 17 -8.942 -6.474 0.933 1.00 1.15 H new ATOM 0 H4' DA A 17 -6.892 -5.125 2.652 1.00 1.03 H new ATOM 0 H3' DA A 17 -9.210 -6.085 3.567 1.00 1.04 H new ATOM 0 H2' DA A 17 -10.703 -5.067 1.908 1.00 1.06 H new ATOM 0 H2'' DA A 17 -10.785 -3.901 3.213 1.00 1.06 H new ATOM 0 H1' DA A 17 -9.377 -2.414 2.185 1.00 1.09 H new ATOM 0 H8 DA A 17 -10.049 -5.072 -0.596 1.00 1.11 H new ATOM 0 H61 DA A 17 -12.353 -0.254 -3.736 1.00 2.28 H new ATOM 0 H62 DA A 17 -12.056 -1.995 -3.759 1.00 2.28 H new ATOM 0 H2 DA A 17 -10.811 1.230 0.196 1.00 2.22 H new ATOM 552 P DI A 18 -9.297 -4.504 5.769 1.00 1.38 P ATOM 553 OP1 DI A 18 -10.577 -5.213 5.537 1.00 1.62 O ATOM 554 OP2 DI A 18 -9.299 -3.194 6.459 1.00 1.63 O ATOM 555 O5' DI A 18 -8.311 -5.495 6.570 1.00 1.19 O ATOM 556 C5' DI A 18 -7.041 -5.035 7.049 1.00 1.07 C ATOM 557 C4' DI A 18 -5.881 -5.788 6.401 1.00 0.73 C ATOM 558 O4' DI A 18 -5.908 -5.594 4.981 1.00 0.60 O ATOM 559 C3' DI A 18 -4.496 -5.337 6.890 1.00 0.77 C ATOM 560 O3' DI A 18 -3.761 -6.478 7.367 1.00 0.73 O ATOM 561 C2' DI A 18 -3.826 -4.758 5.648 1.00 0.78 C ATOM 562 C1' DI A 18 -4.561 -5.476 4.536 1.00 0.60 C ATOM 563 N9 DI A 18 -4.548 -4.744 3.255 1.00 0.58 N ATOM 564 C8 DI A 18 -4.606 -3.390 3.038 1.00 0.66 C ATOM 565 N7 DI A 18 -4.508 -3.050 1.784 1.00 0.69 N ATOM 566 C5 DI A 18 -4.377 -4.264 1.117 1.00 0.63 C ATOM 567 C6 DI A 18 -4.229 -4.531 -0.271 1.00 0.70 C ATOM 568 O6 DI A 18 -4.169 -3.736 -1.204 1.00 0.81 O ATOM 569 N1 DI A 18 -4.132 -5.889 -0.510 1.00 0.69 N ATOM 570 C2 DI A 18 -4.172 -6.861 0.464 1.00 0.64 C ATOM 571 N3 DI A 18 -4.306 -6.634 1.756 1.00 0.58 N ATOM 572 C4 DI A 18 -4.402 -5.308 2.012 1.00 0.57 C ATOM 0 H5'' DI A 18 -6.941 -3.969 6.845 1.00 1.07 H new ATOM 0 H2'' DI A 18 -3.946 -3.676 5.585 1.00 0.78 H new ATOM 0 H8 DI A 18 -4.724 -2.664 3.843 1.00 0.66 H new ATOM 0 H5' DI A 18 -6.995 -5.159 8.131 1.00 1.07 H new ATOM 0 H4' DI A 18 -6.020 -6.832 6.682 1.00 0.73 H new ATOM 0 H3' DI A 18 -4.546 -4.616 7.706 1.00 0.77 H new ATOM 0 H2' DI A 18 -2.755 -4.962 5.628 1.00 0.78 H new ATOM 0 H2 DI A 18 -4.086 -7.899 0.142 1.00 0.64 H new ATOM 0 H1' DI A 18 -4.074 -6.432 4.343 1.00 0.60 H new ATOM 0 H1 DI A 18 -4.023 -6.193 -1.478 1.00 0.69 H new ATOM 583 P DG A 19 -2.178 -6.393 7.681 1.00 0.77 P ATOM 584 OP1 DG A 19 -1.892 -7.190 8.895 1.00 0.93 O ATOM 585 OP2 DG A 19 -1.756 -4.971 7.619 1.00 0.90 O ATOM 586 O5' DG A 19 -1.531 -7.166 6.418 1.00 0.69 O ATOM 587 C5' DG A 19 -1.770 -8.569 6.230 1.00 0.68 C ATOM 588 C4' DG A 19 -0.976 -9.146 5.056 1.00 0.61 C ATOM 589 O4' DG A 19 -1.393 -8.531 3.830 1.00 0.63 O ATOM 590 C3' DG A 19 0.545 -8.951 5.165 1.00 0.66 C ATOM 591 O3' DG A 19 1.202 -10.215 4.934 1.00 0.74 O ATOM 592 C2' DG A 19 0.867 -7.973 4.034 1.00 0.63 C ATOM 593 C1' DG A 19 -0.230 -8.316 3.040 1.00 0.57 C ATOM 594 N9 DG A 19 -0.521 -7.248 2.062 1.00 0.52 N ATOM 595 C8 DG A 19 -0.595 -7.331 0.696 1.00 0.52 C ATOM 596 N7 DG A 19 -0.846 -6.192 0.108 1.00 0.53 N ATOM 597 C5 DG A 19 -0.945 -5.291 1.166 1.00 0.53 C ATOM 598 C6 DG A 19 -1.205 -3.895 1.153 1.00 0.57 C ATOM 599 O6 DG A 19 -1.393 -3.164 0.193 1.00 0.62 O ATOM 600 N1 DG A 19 -1.223 -3.368 2.432 1.00 0.61 N ATOM 601 C2 DG A 19 -1.012 -4.088 3.585 1.00 0.61 C ATOM 602 N2 DG A 19 -1.063 -3.409 4.725 1.00 0.70 N ATOM 603 N3 DG A 19 -0.767 -5.394 3.603 1.00 0.57 N ATOM 604 C4 DG A 19 -0.748 -5.929 2.362 1.00 0.52 C ATOM 0 H5' DG A 19 -2.834 -8.734 6.061 1.00 0.68 H new ATOM 0 H5'' DG A 19 -1.506 -9.105 7.142 1.00 0.68 H new ATOM 0 H4' DG A 19 -1.182 -10.216 5.076 1.00 0.61 H new ATOM 0 H3' DG A 19 0.870 -8.586 6.139 1.00 0.66 H new ATOM 0 H2' DG A 19 0.819 -6.934 4.360 1.00 0.63 H new ATOM 0 H2'' DG A 19 1.863 -8.132 3.621 1.00 0.63 H new ATOM 0 H1' DG A 19 0.086 -9.176 2.450 1.00 0.57 H new ATOM 0 H8 DG A 19 -0.458 -8.255 0.154 1.00 0.52 H new ATOM 0 H1 DG A 19 -1.407 -2.369 2.527 1.00 0.61 H new ATOM 0 H21 DG A 19 -0.914 -3.890 5.612 1.00 0.70 H new ATOM 0 H22 DG A 19 -1.251 -2.407 4.713 1.00 0.70 H new ATOM 616 P DG A 20 2.809 -10.325 4.779 1.00 0.87 P ATOM 617 OP1 DG A 20 3.217 -11.705 5.125 1.00 1.13 O ATOM 618 OP2 DG A 20 3.425 -9.174 5.480 1.00 1.01 O ATOM 619 O5' DG A 20 3.021 -10.118 3.195 1.00 0.83 O ATOM 620 C5' DG A 20 2.483 -11.058 2.257 1.00 0.79 C ATOM 621 C4' DG A 20 2.870 -10.710 0.821 1.00 0.63 C ATOM 622 O4' DG A 20 2.302 -9.442 0.463 1.00 0.61 O ATOM 623 C3' DG A 20 4.379 -10.600 0.592 1.00 0.56 C ATOM 624 O3' DG A 20 4.737 -11.091 -0.705 1.00 0.63 O ATOM 625 C2' DG A 20 4.624 -9.103 0.695 1.00 0.46 C ATOM 626 C1' DG A 20 3.358 -8.573 0.048 1.00 0.46 C ATOM 627 N9 DG A 20 2.999 -7.199 0.444 1.00 0.43 N ATOM 628 C8 DG A 20 3.059 -6.616 1.683 1.00 0.42 C ATOM 629 N7 DG A 20 2.681 -5.370 1.699 1.00 0.41 N ATOM 630 C5 DG A 20 2.346 -5.106 0.376 1.00 0.39 C ATOM 631 C6 DG A 20 1.868 -3.911 -0.220 1.00 0.40 C ATOM 632 O6 DG A 20 1.639 -2.830 0.319 1.00 0.45 O ATOM 633 N1 DG A 20 1.656 -4.074 -1.580 1.00 0.41 N ATOM 634 C2 DG A 20 1.870 -5.238 -2.281 1.00 0.43 C ATOM 635 N2 DG A 20 1.598 -5.207 -3.579 1.00 0.51 N ATOM 636 N3 DG A 20 2.320 -6.359 -1.726 1.00 0.44 N ATOM 637 C4 DG A 20 2.536 -6.222 -0.399 1.00 0.40 C ATOM 0 H5' DG A 20 1.397 -11.079 2.346 1.00 0.79 H new ATOM 0 H5'' DG A 20 2.842 -12.058 2.498 1.00 0.79 H new ATOM 0 H4' DG A 20 2.490 -11.530 0.211 1.00 0.63 H new ATOM 0 H3' DG A 20 4.969 -11.185 1.298 1.00 0.56 H new ATOM 0 H2' DG A 20 4.733 -8.770 1.727 1.00 0.46 H new ATOM 0 H2'' DG A 20 5.523 -8.792 0.163 1.00 0.46 H new ATOM 0 HO3' DG A 20 5.706 -11.009 -0.830 1.00 0.63 H new ATOM 0 H1' DG A 20 3.520 -8.545 -1.030 1.00 0.46 H new ATOM 0 H8 DG A 20 3.390 -7.142 2.566 1.00 0.42 H new ATOM 0 H1 DG A 20 1.314 -3.267 -2.102 1.00 0.41 H new ATOM 0 H21 DG A 20 1.738 -6.041 -4.149 1.00 0.51 H new ATOM 0 H22 DG A 20 1.249 -4.349 -4.007 1.00 0.51 H new TER 650 DG A 20