USER MOD reduce.3.24.130724 H: found=0, std=0, add=247, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 247 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 DA O5' : rot 32:sc= 0.0291 USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DT C7 :methyl 150:sc= -0.712 (180deg=-0.712) USER MOD Single : A 18 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 -0.991 11.842 -0.028 1.00 1.61 O ATOM 2 C5' DA A 1 -0.209 11.419 -1.148 1.00 1.56 C ATOM 3 C4' DA A 1 -0.849 10.220 -1.847 1.00 1.48 C ATOM 4 O4' DA A 1 -1.078 9.182 -0.887 1.00 1.45 O ATOM 5 C3' DA A 1 -2.189 10.530 -2.516 1.00 1.30 C ATOM 6 O3' DA A 1 -2.205 9.942 -3.824 1.00 1.55 O ATOM 7 C2' DA A 1 -3.221 9.854 -1.623 1.00 1.14 C ATOM 8 C1' DA A 1 -2.415 8.707 -1.031 1.00 1.18 C ATOM 9 N9 DA A 1 -2.872 8.272 0.304 1.00 1.03 N ATOM 10 C8 DA A 1 -2.952 9.001 1.461 1.00 1.28 C ATOM 11 N7 DA A 1 -3.389 8.322 2.486 1.00 1.38 N ATOM 12 C5 DA A 1 -3.616 7.052 1.969 1.00 1.10 C ATOM 13 C6 DA A 1 -4.088 5.861 2.546 1.00 1.19 C ATOM 14 N6 DA A 1 -4.431 5.754 3.829 1.00 1.57 N ATOM 15 N1 DA A 1 -4.191 4.790 1.748 1.00 1.08 N ATOM 16 C2 DA A 1 -3.849 4.897 0.471 1.00 0.97 C ATOM 17 N3 DA A 1 -3.396 5.952 -0.188 1.00 0.90 N ATOM 18 C4 DA A 1 -3.302 7.012 0.639 1.00 0.89 C ATOM 0 H5' DA A 1 0.795 11.156 -0.815 1.00 1.56 H new ATOM 0 H5'' DA A 1 -0.105 12.243 -1.854 1.00 1.56 H new ATOM 0 H4' DA A 1 -0.150 9.923 -2.629 1.00 1.48 H new ATOM 0 H3' DA A 1 -2.378 11.597 -2.629 1.00 1.30 H new ATOM 0 H2' DA A 1 -3.600 10.527 -0.854 1.00 1.14 H new ATOM 0 H2'' DA A 1 -4.082 9.499 -2.189 1.00 1.14 H new ATOM 0 HO5' DA A 1 -1.438 11.066 0.371 1.00 1.61 H new ATOM 0 H1' DA A 1 -2.521 7.851 -1.697 1.00 1.18 H new ATOM 0 H8 DA A 1 -2.678 10.044 1.520 1.00 1.28 H new ATOM 0 H61 DA A 1 -4.768 4.863 4.194 1.00 1.57 H new ATOM 0 H62 DA A 1 -4.357 6.563 4.446 1.00 1.57 H new ATOM 0 H2 DA A 1 -3.955 3.996 -0.114 1.00 0.97 H new ATOM 31 P DG A 2 -2.997 10.648 -5.037 1.00 1.39 P ATOM 32 OP1 DG A 2 -2.266 10.358 -6.292 1.00 1.41 O ATOM 33 OP2 DG A 2 -3.277 12.050 -4.656 1.00 1.55 O ATOM 34 O5' DG A 2 -4.395 9.847 -5.069 1.00 1.34 O ATOM 35 C5' DG A 2 -4.455 8.496 -5.542 1.00 1.14 C ATOM 36 C4' DG A 2 -4.033 7.503 -4.462 1.00 0.96 C ATOM 37 O4' DG A 2 -4.957 7.568 -3.366 1.00 1.09 O ATOM 38 C3' DG A 2 -3.999 6.049 -4.937 1.00 0.80 C ATOM 39 O3' DG A 2 -2.647 5.654 -5.203 1.00 0.97 O ATOM 40 C2' DG A 2 -4.545 5.276 -3.747 1.00 0.79 C ATOM 41 C1' DG A 2 -5.537 6.276 -3.175 1.00 0.84 C ATOM 42 N9 DG A 2 -6.860 6.271 -3.840 1.00 0.87 N ATOM 43 C8 DG A 2 -7.202 5.778 -5.074 1.00 0.98 C ATOM 44 N7 DG A 2 -8.459 5.925 -5.375 1.00 1.26 N ATOM 45 C5 DG A 2 -8.999 6.561 -4.262 1.00 1.31 C ATOM 46 C6 DG A 2 -10.335 6.979 -4.010 1.00 1.66 C ATOM 47 O6 DG A 2 -11.320 6.868 -4.734 1.00 1.95 O ATOM 48 N1 DG A 2 -10.453 7.579 -2.768 1.00 1.75 N ATOM 49 C2 DG A 2 -9.420 7.758 -1.875 1.00 1.62 C ATOM 50 N2 DG A 2 -9.728 8.358 -0.730 1.00 1.91 N ATOM 51 N3 DG A 2 -8.165 7.367 -2.106 1.00 1.32 N ATOM 52 C4 DG A 2 -8.029 6.777 -3.316 1.00 1.12 C ATOM 0 H5' DG A 2 -3.807 8.385 -6.412 1.00 1.14 H new ATOM 0 H5'' DG A 2 -5.470 8.269 -5.869 1.00 1.14 H new ATOM 0 H4' DG A 2 -3.021 7.790 -4.176 1.00 0.96 H new ATOM 0 H3' DG A 2 -4.566 5.881 -5.853 1.00 0.80 H new ATOM 0 H2' DG A 2 -5.026 4.345 -4.047 1.00 0.79 H new ATOM 0 H2'' DG A 2 -3.764 5.016 -3.032 1.00 0.79 H new ATOM 0 H1' DG A 2 -5.716 6.012 -2.133 1.00 0.84 H new ATOM 0 H8 DG A 2 -6.490 5.309 -5.737 1.00 0.98 H new ATOM 0 H1 DG A 2 -11.376 7.914 -2.493 1.00 1.75 H new ATOM 0 H21 DG A 2 -9.006 8.519 -0.028 1.00 1.91 H new ATOM 0 H22 DG A 2 -10.687 8.658 -0.553 1.00 1.91 H new ATOM 64 P DG A 3 -1.999 5.878 -6.663 1.00 0.55 P ATOM 65 OP1 DG A 3 -3.096 5.989 -7.649 1.00 0.65 O ATOM 66 OP2 DG A 3 -0.942 4.859 -6.865 1.00 0.86 O ATOM 67 O5' DG A 3 -1.291 7.320 -6.534 1.00 0.76 O ATOM 68 C5' DG A 3 0.104 7.461 -6.824 1.00 0.80 C ATOM 69 C4' DG A 3 0.775 8.523 -5.954 1.00 0.68 C ATOM 70 O4' DG A 3 0.305 8.414 -4.601 1.00 0.65 O ATOM 71 C3' DG A 3 2.296 8.385 -5.903 1.00 0.64 C ATOM 72 O3' DG A 3 2.904 9.679 -5.769 1.00 0.73 O ATOM 73 C2' DG A 3 2.509 7.575 -4.638 1.00 0.57 C ATOM 74 C1' DG A 3 1.429 8.166 -3.751 1.00 0.59 C ATOM 75 N9 DG A 3 0.983 7.284 -2.655 1.00 0.48 N ATOM 76 C8 DG A 3 1.024 7.511 -1.304 1.00 0.45 C ATOM 77 N7 DG A 3 0.516 6.548 -0.589 1.00 0.38 N ATOM 78 C5 DG A 3 0.110 5.612 -1.531 1.00 0.35 C ATOM 79 C6 DG A 3 -0.514 4.351 -1.345 1.00 0.30 C ATOM 80 O6 DG A 3 -0.841 3.810 -0.292 1.00 0.31 O ATOM 81 N1 DG A 3 -0.750 3.721 -2.556 1.00 0.31 N ATOM 82 C2 DG A 3 -0.431 4.234 -3.787 1.00 0.38 C ATOM 83 N2 DG A 3 -0.734 3.474 -4.831 1.00 0.44 N ATOM 84 N3 DG A 3 0.153 5.419 -3.970 1.00 0.44 N ATOM 85 C4 DG A 3 0.394 6.051 -2.799 1.00 0.41 C ATOM 0 H5' DG A 3 0.229 7.723 -7.874 1.00 0.80 H new ATOM 0 H5'' DG A 3 0.602 6.503 -6.673 1.00 0.80 H new ATOM 0 H4' DG A 3 0.520 9.482 -6.406 1.00 0.68 H new ATOM 0 H3' DG A 3 2.726 7.929 -6.794 1.00 0.64 H new ATOM 0 H2' DG A 3 2.373 6.506 -4.802 1.00 0.57 H new ATOM 0 H2'' DG A 3 3.508 7.709 -4.222 1.00 0.57 H new ATOM 0 H1' DG A 3 1.840 9.056 -3.274 1.00 0.59 H new ATOM 0 H8 DG A 3 1.440 8.408 -0.871 1.00 0.45 H new ATOM 0 H1 DG A 3 -1.196 2.804 -2.530 1.00 0.31 H new ATOM 0 H21 DG A 3 -0.523 3.797 -5.775 1.00 0.44 H new ATOM 0 H22 DG A 3 -1.178 2.567 -4.690 1.00 0.44 H new ATOM 97 P DG A 4 4.502 9.860 -5.908 1.00 0.79 P ATOM 98 OP1 DG A 4 4.803 11.306 -6.020 1.00 0.94 O ATOM 99 OP2 DG A 4 4.988 8.928 -6.952 1.00 0.92 O ATOM 100 O5' DG A 4 5.053 9.347 -4.476 1.00 0.63 O ATOM 101 C5' DG A 4 4.894 10.155 -3.300 1.00 0.51 C ATOM 102 C4' DG A 4 5.253 9.402 -2.013 1.00 0.47 C ATOM 103 O4' DG A 4 4.354 8.304 -1.817 1.00 0.50 O ATOM 104 C3' DG A 4 6.677 8.826 -1.987 1.00 0.48 C ATOM 105 O3' DG A 4 7.331 9.253 -0.778 1.00 0.50 O ATOM 106 C2' DG A 4 6.469 7.314 -1.961 1.00 0.51 C ATOM 107 C1' DG A 4 5.107 7.215 -1.301 1.00 0.51 C ATOM 108 N9 DG A 4 4.365 5.972 -1.592 1.00 0.50 N ATOM 109 C8 DG A 4 4.170 5.352 -2.798 1.00 0.51 C ATOM 110 N7 DG A 4 3.439 4.272 -2.729 1.00 0.50 N ATOM 111 C5 DG A 4 3.132 4.165 -1.375 1.00 0.49 C ATOM 112 C6 DG A 4 2.365 3.184 -0.689 1.00 0.50 C ATOM 113 O6 DG A 4 1.796 2.197 -1.151 1.00 0.51 O ATOM 114 N1 DG A 4 2.306 3.448 0.670 1.00 0.51 N ATOM 115 C2 DG A 4 2.908 4.520 1.295 1.00 0.52 C ATOM 116 N2 DG A 4 2.747 4.608 2.610 1.00 0.55 N ATOM 117 N3 DG A 4 3.625 5.441 0.655 1.00 0.51 N ATOM 118 C4 DG A 4 3.695 5.202 -0.673 1.00 0.50 C ATOM 0 H5' DG A 4 3.862 10.501 -3.238 1.00 0.51 H new ATOM 0 H5'' DG A 4 5.523 11.041 -3.385 1.00 0.51 H new ATOM 0 H4' DG A 4 5.178 10.151 -1.224 1.00 0.47 H new ATOM 0 H3' DG A 4 7.288 9.146 -2.831 1.00 0.48 H new ATOM 0 H2' DG A 4 6.474 6.881 -2.961 1.00 0.51 H new ATOM 0 H2'' DG A 4 7.242 6.802 -1.388 1.00 0.51 H new ATOM 0 H1' DG A 4 5.253 7.226 -0.221 1.00 0.51 H new ATOM 0 H8 DG A 4 4.584 5.723 -3.724 1.00 0.51 H new ATOM 0 H1 DG A 4 1.777 2.800 1.253 1.00 0.51 H new ATOM 0 H21 DG A 4 3.170 5.380 3.125 1.00 0.55 H new ATOM 0 H22 DG A 4 2.200 3.903 3.105 1.00 0.55 H new ATOM 130 P DC A 5 8.888 8.929 -0.493 1.00 0.54 P ATOM 131 OP1 DC A 5 9.604 10.216 -0.332 1.00 0.71 O ATOM 132 OP2 DC A 5 9.355 7.953 -1.503 1.00 0.66 O ATOM 133 O5' DC A 5 8.837 8.196 0.943 1.00 0.54 O ATOM 134 C5' DC A 5 8.644 8.952 2.150 1.00 0.54 C ATOM 135 C4' DC A 5 8.664 8.053 3.389 1.00 0.51 C ATOM 136 O4' DC A 5 7.620 7.073 3.286 1.00 0.56 O ATOM 137 C3' DC A 5 9.968 7.280 3.574 1.00 0.45 C ATOM 138 O3' DC A 5 10.203 7.056 4.980 1.00 0.53 O ATOM 139 C2' DC A 5 9.673 5.978 2.860 1.00 0.44 C ATOM 140 C1' DC A 5 8.219 5.773 3.255 1.00 0.50 C ATOM 141 N1 DC A 5 7.451 4.940 2.311 1.00 0.49 N ATOM 142 C2 DC A 5 6.727 3.875 2.830 1.00 0.52 C ATOM 143 O2 DC A 5 6.704 3.670 4.042 1.00 0.59 O ATOM 144 N3 DC A 5 6.046 3.079 1.964 1.00 0.52 N ATOM 145 C4 DC A 5 6.073 3.314 0.649 1.00 0.48 C ATOM 146 N4 DC A 5 5.403 2.508 -0.170 1.00 0.50 N ATOM 147 C5 DC A 5 6.811 4.411 0.112 1.00 0.46 C ATOM 148 C6 DC A 5 7.483 5.194 0.974 1.00 0.48 C ATOM 0 H5' DC A 5 7.693 9.482 2.100 1.00 0.54 H new ATOM 0 H5'' DC A 5 9.425 9.707 2.235 1.00 0.54 H new ATOM 0 H4' DC A 5 8.537 8.725 4.238 1.00 0.51 H new ATOM 0 H3' DC A 5 10.853 7.789 3.193 1.00 0.45 H new ATOM 0 H2' DC A 5 9.803 6.058 1.781 1.00 0.44 H new ATOM 0 H2'' DC A 5 10.314 5.164 3.199 1.00 0.44 H new ATOM 0 H1' DC A 5 8.200 5.252 4.212 1.00 0.50 H new ATOM 0 H41 DC A 5 5.416 2.677 -1.176 1.00 0.50 H new ATOM 0 H42 DC A 5 4.876 1.721 0.208 1.00 0.50 H new ATOM 0 H5 DC A 5 6.829 4.606 -0.950 1.00 0.46 H new ATOM 0 H6 DC A 5 8.053 6.032 0.602 1.00 0.48 H new ATOM 160 P DT A 6 11.030 5.771 5.512 1.00 0.53 P ATOM 161 OP1 DT A 6 10.090 4.634 5.632 1.00 0.60 O ATOM 162 OP2 DT A 6 11.836 6.186 6.680 1.00 0.66 O ATOM 163 O5' DT A 6 12.040 5.455 4.298 1.00 0.58 O ATOM 164 C5' DT A 6 13.115 6.344 3.970 1.00 0.88 C ATOM 165 C4' DT A 6 14.044 5.714 2.937 1.00 1.11 C ATOM 166 O4' DT A 6 14.711 4.606 3.530 1.00 1.36 O ATOM 167 C3' DT A 6 13.313 5.208 1.694 1.00 0.88 C ATOM 168 O3' DT A 6 13.740 5.959 0.552 1.00 0.90 O ATOM 169 C2' DT A 6 13.726 3.744 1.537 1.00 0.98 C ATOM 170 C1' DT A 6 14.834 3.562 2.571 1.00 1.27 C ATOM 171 N1 DT A 6 14.751 2.290 3.316 1.00 1.56 N ATOM 172 C2 DT A 6 15.893 1.517 3.409 1.00 1.88 C ATOM 173 O2 DT A 6 16.951 1.841 2.875 1.00 2.00 O ATOM 174 N3 DT A 6 15.778 0.352 4.141 1.00 2.20 N ATOM 175 C4 DT A 6 14.638 -0.103 4.777 1.00 2.27 C ATOM 176 O4 DT A 6 14.654 -1.159 5.404 1.00 2.61 O ATOM 177 C5 DT A 6 13.492 0.771 4.624 1.00 2.01 C ATOM 178 C7 DT A 6 12.159 0.400 5.273 1.00 2.28 C ATOM 179 C6 DT A 6 13.581 1.912 3.916 1.00 1.66 C ATOM 0 H5' DT A 6 13.678 6.589 4.871 1.00 0.88 H new ATOM 0 H5'' DT A 6 12.713 7.280 3.581 1.00 0.88 H new ATOM 0 H4' DT A 6 14.737 6.495 2.623 1.00 1.11 H new ATOM 0 H3' DT A 6 12.232 5.313 1.784 1.00 0.88 H new ATOM 0 H2' DT A 6 12.890 3.071 1.725 1.00 0.98 H new ATOM 0 H2'' DT A 6 14.083 3.535 0.528 1.00 0.98 H new ATOM 0 H1' DT A 6 15.778 3.571 2.026 1.00 1.27 H new ATOM 0 H3 DT A 6 16.613 -0.228 4.220 1.00 2.20 H new ATOM 0 H71 DT A 6 11.613 1.308 5.527 1.00 2.28 H new ATOM 0 H72 DT A 6 11.569 -0.195 4.577 1.00 2.28 H new ATOM 0 H73 DT A 6 12.344 -0.178 6.179 1.00 2.28 H new ATOM 0 H6 DT A 6 12.710 2.543 3.819 1.00 1.66 H new ATOM 192 P DA A 7 12.661 6.749 -0.349 1.00 0.88 P ATOM 193 OP1 DA A 7 13.395 7.530 -1.372 1.00 1.10 O ATOM 194 OP2 DA A 7 11.709 7.430 0.556 1.00 1.02 O ATOM 195 O5' DA A 7 11.879 5.551 -1.097 1.00 0.69 O ATOM 196 C5' DA A 7 12.478 4.863 -2.207 1.00 0.75 C ATOM 197 C4' DA A 7 11.605 3.709 -2.710 1.00 0.66 C ATOM 198 O4' DA A 7 11.342 2.806 -1.631 1.00 0.63 O ATOM 199 C3' DA A 7 10.248 4.142 -3.284 1.00 0.58 C ATOM 200 O3' DA A 7 10.021 3.467 -4.537 1.00 0.56 O ATOM 201 C2' DA A 7 9.238 3.671 -2.249 1.00 0.52 C ATOM 202 C1' DA A 7 9.954 2.488 -1.629 1.00 0.55 C ATOM 203 N9 DA A 7 9.564 2.218 -0.238 1.00 0.54 N ATOM 204 C8 DA A 7 9.778 2.991 0.868 1.00 0.54 C ATOM 205 N7 DA A 7 9.311 2.475 1.973 1.00 0.57 N ATOM 206 C5 DA A 7 8.745 1.269 1.560 1.00 0.58 C ATOM 207 C6 DA A 7 8.078 0.241 2.249 1.00 0.64 C ATOM 208 N6 DA A 7 7.858 0.261 3.564 1.00 0.67 N ATOM 209 N1 DA A 7 7.649 -0.808 1.528 1.00 0.70 N ATOM 210 C2 DA A 7 7.869 -0.827 0.218 1.00 0.72 C ATOM 211 N3 DA A 7 8.477 0.071 -0.539 1.00 0.66 N ATOM 212 C4 DA A 7 8.896 1.109 0.212 1.00 0.58 C ATOM 0 H5' DA A 7 13.453 4.476 -1.910 1.00 0.75 H new ATOM 0 H5'' DA A 7 12.649 5.568 -3.020 1.00 0.75 H new ATOM 0 H4' DA A 7 12.173 3.248 -3.518 1.00 0.66 H new ATOM 0 H3' DA A 7 10.185 5.214 -3.471 1.00 0.58 H new ATOM 0 H2' DA A 7 9.015 4.445 -1.514 1.00 0.52 H new ATOM 0 H2'' DA A 7 8.291 3.382 -2.705 1.00 0.52 H new ATOM 0 H1' DA A 7 9.698 1.601 -2.209 1.00 0.55 H new ATOM 0 H8 DA A 7 10.287 3.943 0.832 1.00 0.54 H new ATOM 0 H61 DA A 7 7.368 -0.514 4.011 1.00 0.67 H new ATOM 0 H62 DA A 7 8.180 1.051 4.123 1.00 0.67 H new ATOM 0 H2 DA A 7 7.499 -1.698 -0.302 1.00 0.72 H new ATOM 224 P DG A 8 8.821 3.908 -5.533 1.00 0.50 P ATOM 225 OP1 DG A 8 9.274 5.087 -6.303 1.00 0.64 O ATOM 226 OP2 DG A 8 7.577 3.992 -4.739 1.00 0.64 O ATOM 227 O5' DG A 8 8.704 2.650 -6.538 1.00 0.46 O ATOM 228 C5' DG A 8 8.123 1.414 -6.098 1.00 0.58 C ATOM 229 C4' DG A 8 7.054 0.918 -7.070 1.00 0.50 C ATOM 230 O4' DG A 8 6.455 -0.274 -6.550 1.00 0.61 O ATOM 231 C3' DG A 8 5.930 1.919 -7.311 1.00 0.42 C ATOM 232 O3' DG A 8 5.480 1.824 -8.669 1.00 0.41 O ATOM 233 C2' DG A 8 4.828 1.472 -6.365 1.00 0.47 C ATOM 234 C1' DG A 8 5.078 -0.026 -6.235 1.00 0.53 C ATOM 235 N9 DG A 8 4.833 -0.533 -4.874 1.00 0.52 N ATOM 236 C8 DG A 8 5.240 0.010 -3.688 1.00 0.59 C ATOM 237 N7 DG A 8 4.840 -0.644 -2.636 1.00 0.60 N ATOM 238 C5 DG A 8 4.112 -1.704 -3.163 1.00 0.52 C ATOM 239 C6 DG A 8 3.430 -2.755 -2.497 1.00 0.54 C ATOM 240 O6 DG A 8 3.336 -2.955 -1.290 1.00 0.65 O ATOM 241 N1 DG A 8 2.821 -3.615 -3.394 1.00 0.50 N ATOM 242 C2 DG A 8 2.863 -3.487 -4.764 1.00 0.47 C ATOM 243 N2 DG A 8 2.221 -4.420 -5.461 1.00 0.52 N ATOM 244 N3 DG A 8 3.502 -2.501 -5.397 1.00 0.46 N ATOM 245 C4 DG A 8 4.102 -1.647 -4.535 1.00 0.47 C ATOM 0 H5' DG A 8 7.683 1.550 -5.110 1.00 0.58 H new ATOM 0 H5'' DG A 8 8.903 0.660 -5.998 1.00 0.58 H new ATOM 0 H4' DG A 8 7.567 0.750 -8.017 1.00 0.50 H new ATOM 0 H3' DG A 8 6.236 2.951 -7.142 1.00 0.42 H new ATOM 0 H2' DG A 8 4.893 1.978 -5.402 1.00 0.47 H new ATOM 0 H2'' DG A 8 3.838 1.683 -6.770 1.00 0.47 H new ATOM 0 H1' DG A 8 4.390 -0.534 -6.911 1.00 0.53 H new ATOM 0 H8 DG A 8 5.842 0.905 -3.629 1.00 0.59 H new ATOM 0 H1 DG A 8 2.301 -4.404 -3.011 1.00 0.50 H new ATOM 0 H21 DG A 8 2.215 -4.381 -6.480 1.00 0.52 H new ATOM 0 H22 DG A 8 1.735 -5.174 -4.976 1.00 0.52 H new ATOM 257 P DG A 9 4.241 2.715 -9.196 1.00 0.42 P ATOM 258 OP1 DG A 9 4.499 3.084 -10.604 1.00 0.63 O ATOM 259 OP2 DG A 9 3.960 3.769 -8.194 1.00 0.50 O ATOM 260 O5' DG A 9 3.020 1.656 -9.175 1.00 0.39 O ATOM 261 C5' DG A 9 3.002 0.560 -10.104 1.00 0.45 C ATOM 262 C4' DG A 9 1.799 -0.369 -9.900 1.00 0.45 C ATOM 263 O4' DG A 9 1.842 -0.957 -8.595 1.00 0.48 O ATOM 264 C3' DG A 9 0.427 0.316 -10.036 1.00 0.55 C ATOM 265 O3' DG A 9 -0.330 -0.335 -11.072 1.00 0.69 O ATOM 266 C2' DG A 9 -0.246 0.083 -8.684 1.00 0.56 C ATOM 267 C1' DG A 9 0.496 -1.141 -8.187 1.00 0.54 C ATOM 268 N9 DG A 9 0.460 -1.325 -6.729 1.00 0.55 N ATOM 269 C8 DG A 9 -0.038 -2.383 -6.025 1.00 0.64 C ATOM 270 N7 DG A 9 0.029 -2.239 -4.731 1.00 0.65 N ATOM 271 C5 DG A 9 0.616 -0.989 -4.568 1.00 0.55 C ATOM 272 C6 DG A 9 0.945 -0.286 -3.379 1.00 0.54 C ATOM 273 O6 DG A 9 0.769 -0.634 -2.215 1.00 0.59 O ATOM 274 N1 DG A 9 1.527 0.942 -3.658 1.00 0.49 N ATOM 275 C2 DG A 9 1.762 1.436 -4.923 1.00 0.46 C ATOM 276 N2 DG A 9 2.334 2.634 -4.993 1.00 0.50 N ATOM 277 N3 DG A 9 1.451 0.778 -6.040 1.00 0.45 N ATOM 278 C4 DG A 9 0.885 -0.423 -5.787 1.00 0.50 C ATOM 0 H5' DG A 9 3.922 -0.015 -9.999 1.00 0.45 H new ATOM 0 H5'' DG A 9 2.985 0.951 -11.121 1.00 0.45 H new ATOM 0 H4' DG A 9 1.888 -1.108 -10.696 1.00 0.45 H new ATOM 0 H3' DG A 9 0.503 1.373 -10.291 1.00 0.55 H new ATOM 0 H2' DG A 9 -0.128 0.935 -8.014 1.00 0.56 H new ATOM 0 H2'' DG A 9 -1.316 -0.098 -8.784 1.00 0.56 H new ATOM 0 H1' DG A 9 0.020 -2.031 -8.599 1.00 0.54 H new ATOM 0 H8 DG A 9 -0.451 -3.262 -6.498 1.00 0.64 H new ATOM 0 H1 DG A 9 1.802 1.524 -2.867 1.00 0.49 H new ATOM 0 H21 DG A 9 2.533 3.052 -5.902 1.00 0.50 H new ATOM 0 H22 DG A 9 2.574 3.135 -4.138 1.00 0.50 H new ATOM 290 P DG A 10 -1.859 0.089 -11.378 1.00 0.92 P ATOM 291 OP1 DG A 10 -2.270 -0.540 -12.653 1.00 1.18 O ATOM 292 OP2 DG A 10 -1.973 1.555 -11.209 1.00 1.02 O ATOM 293 O5' DG A 10 -2.674 -0.624 -10.178 1.00 0.80 O ATOM 294 C5' DG A 10 -2.791 -2.053 -10.115 1.00 0.82 C ATOM 295 C4' DG A 10 -3.626 -2.514 -8.914 1.00 0.75 C ATOM 296 O4' DG A 10 -2.989 -2.122 -7.686 1.00 0.63 O ATOM 297 C3' DG A 10 -5.052 -1.946 -8.881 1.00 0.79 C ATOM 298 O3' DG A 10 -5.977 -3.011 -8.596 1.00 0.89 O ATOM 299 C2' DG A 10 -5.015 -0.957 -7.720 1.00 0.71 C ATOM 300 C1' DG A 10 -4.001 -1.624 -6.813 1.00 0.63 C ATOM 301 N9 DG A 10 -3.373 -0.710 -5.840 1.00 0.54 N ATOM 302 C8 DG A 10 -2.758 0.485 -6.080 1.00 0.49 C ATOM 303 N7 DG A 10 -2.302 1.074 -5.005 1.00 0.44 N ATOM 304 C5 DG A 10 -2.648 0.202 -3.976 1.00 0.42 C ATOM 305 C6 DG A 10 -2.420 0.307 -2.574 1.00 0.41 C ATOM 306 O6 DG A 10 -1.849 1.201 -1.959 1.00 0.46 O ATOM 307 N1 DG A 10 -2.933 -0.784 -1.891 1.00 0.44 N ATOM 308 C2 DG A 10 -3.582 -1.848 -2.477 1.00 0.51 C ATOM 309 N2 DG A 10 -4.006 -2.804 -1.662 1.00 0.58 N ATOM 310 N3 DG A 10 -3.795 -1.951 -3.791 1.00 0.54 N ATOM 311 C4 DG A 10 -3.304 -0.894 -4.476 1.00 0.48 C ATOM 0 H5' DG A 10 -1.796 -2.495 -10.055 1.00 0.82 H new ATOM 0 H5'' DG A 10 -3.247 -2.419 -11.035 1.00 0.82 H new ATOM 0 H4' DG A 10 -3.693 -3.597 -9.020 1.00 0.75 H new ATOM 0 H3' DG A 10 -5.362 -1.484 -9.818 1.00 0.79 H new ATOM 0 H2' DG A 10 -4.698 0.037 -8.034 1.00 0.71 H new ATOM 0 H2'' DG A 10 -5.988 -0.845 -7.241 1.00 0.71 H new ATOM 0 H1' DG A 10 -4.502 -2.389 -6.220 1.00 0.63 H new ATOM 0 H8 DG A 10 -2.657 0.906 -7.069 1.00 0.49 H new ATOM 0 H1 DG A 10 -2.822 -0.800 -0.877 1.00 0.44 H new ATOM 0 H21 DG A 10 -4.493 -3.617 -2.039 1.00 0.58 H new ATOM 0 H22 DG A 10 -3.845 -2.727 -0.658 1.00 0.58 H new ATOM 323 P DC A 11 -7.577 -2.785 -8.641 1.00 0.95 P ATOM 324 OP1 DC A 11 -8.121 -3.549 -9.787 1.00 1.48 O ATOM 325 OP2 DC A 11 -7.845 -1.333 -8.527 1.00 1.18 O ATOM 326 O5' DC A 11 -8.061 -3.498 -7.278 1.00 0.71 O ATOM 327 C5' DC A 11 -9.291 -3.126 -6.642 1.00 0.62 C ATOM 328 C4' DC A 11 -9.335 -3.589 -5.185 1.00 0.49 C ATOM 329 O4' DC A 11 -8.270 -2.966 -4.450 1.00 0.49 O ATOM 330 C3' DC A 11 -10.635 -3.238 -4.457 1.00 0.39 C ATOM 331 O3' DC A 11 -10.954 -4.279 -3.519 1.00 0.55 O ATOM 332 C2' DC A 11 -10.276 -1.967 -3.707 1.00 0.37 C ATOM 333 C1' DC A 11 -8.832 -2.258 -3.342 1.00 0.41 C ATOM 334 N1 DC A 11 -8.008 -1.057 -3.099 1.00 0.42 N ATOM 335 C2 DC A 11 -8.026 -0.525 -1.822 1.00 0.66 C ATOM 336 O2 DC A 11 -8.751 -1.013 -0.964 1.00 0.83 O ATOM 337 N3 DC A 11 -7.241 0.552 -1.562 1.00 0.73 N ATOM 338 C4 DC A 11 -6.470 1.087 -2.514 1.00 0.52 C ATOM 339 N4 DC A 11 -5.712 2.139 -2.217 1.00 0.61 N ATOM 340 C5 DC A 11 -6.451 0.545 -3.838 1.00 0.38 C ATOM 341 C6 DC A 11 -7.233 -0.522 -4.085 1.00 0.40 C ATOM 0 H5' DC A 11 -10.129 -3.560 -7.188 1.00 0.62 H new ATOM 0 H5'' DC A 11 -9.410 -2.043 -6.684 1.00 0.62 H new ATOM 0 H4' DC A 11 -9.246 -4.675 -5.224 1.00 0.49 H new ATOM 0 H3' DC A 11 -11.491 -3.122 -5.122 1.00 0.39 H new ATOM 0 H2' DC A 11 -10.375 -1.077 -4.329 1.00 0.37 H new ATOM 0 H2'' DC A 11 -10.903 -1.813 -2.828 1.00 0.37 H new ATOM 0 H1' DC A 11 -8.831 -2.818 -2.407 1.00 0.41 H new ATOM 0 H41 DC A 11 -5.118 2.558 -2.933 1.00 0.61 H new ATOM 0 H42 DC A 11 -5.724 2.526 -1.274 1.00 0.61 H new ATOM 0 H5 DC A 11 -5.832 0.976 -4.611 1.00 0.38 H new ATOM 0 H6 DC A 11 -7.247 -0.958 -5.073 1.00 0.40 H new ATOM 353 P DT A 12 -12.448 -4.882 -3.417 1.00 0.72 P ATOM 354 OP1 DT A 12 -12.414 -6.052 -2.513 1.00 1.01 O ATOM 355 OP2 DT A 12 -12.976 -5.030 -4.792 1.00 0.84 O ATOM 356 O5' DT A 12 -13.266 -3.694 -2.685 1.00 0.76 O ATOM 357 C5' DT A 12 -12.717 -2.990 -1.558 1.00 0.81 C ATOM 358 C4' DT A 12 -13.055 -3.664 -0.225 1.00 0.93 C ATOM 359 O4' DT A 12 -12.454 -4.964 -0.177 1.00 1.04 O ATOM 360 C3' DT A 12 -12.541 -2.903 0.995 1.00 1.13 C ATOM 361 O3' DT A 12 -13.400 -3.147 2.118 1.00 1.42 O ATOM 362 C2' DT A 12 -11.189 -3.543 1.247 1.00 1.20 C ATOM 363 C1' DT A 12 -11.488 -4.992 0.882 1.00 1.24 C ATOM 364 N1 DT A 12 -10.319 -5.757 0.403 1.00 1.30 N ATOM 365 C2 DT A 12 -10.033 -6.953 1.038 1.00 1.73 C ATOM 366 O2 DT A 12 -10.713 -7.383 1.966 1.00 2.06 O ATOM 367 N3 DT A 12 -8.934 -7.642 0.568 1.00 1.85 N ATOM 368 C4 DT A 12 -8.106 -7.248 -0.467 1.00 1.58 C ATOM 369 O4 DT A 12 -7.156 -7.947 -0.805 1.00 1.79 O ATOM 370 C5 DT A 12 -8.479 -5.989 -1.073 1.00 1.16 C ATOM 371 C7 DT A 12 -7.645 -5.429 -2.225 1.00 1.05 C ATOM 372 C6 DT A 12 -9.549 -5.296 -0.631 1.00 1.05 C ATOM 0 H5' DT A 12 -13.097 -1.968 -1.552 1.00 0.81 H new ATOM 0 H5'' DT A 12 -11.634 -2.927 -1.665 1.00 0.81 H new ATOM 0 H4' DT A 12 -14.144 -3.699 -0.183 1.00 0.93 H new ATOM 0 H3' DT A 12 -12.497 -1.824 0.847 1.00 1.13 H new ATOM 0 H2' DT A 12 -10.405 -3.113 0.623 1.00 1.20 H new ATOM 0 H2'' DT A 12 -10.867 -3.435 2.283 1.00 1.20 H new ATOM 0 H1' DT A 12 -11.833 -5.490 1.788 1.00 1.24 H new ATOM 0 H3 DT A 12 -8.711 -8.525 1.027 1.00 1.85 H new ATOM 0 H71 DT A 12 -8.283 -4.840 -2.884 1.00 1.05 H new ATOM 0 H72 DT A 12 -6.852 -4.796 -1.826 1.00 1.05 H new ATOM 0 H73 DT A 12 -7.204 -6.251 -2.788 1.00 1.05 H new ATOM 0 H6 DT A 12 -9.803 -4.358 -1.103 1.00 1.05 H new ATOM 385 P DA A 13 -13.628 -2.024 3.255 1.00 1.89 P ATOM 386 OP1 DA A 13 -13.798 -2.715 4.554 1.00 2.56 O ATOM 387 OP2 DA A 13 -14.671 -1.090 2.777 1.00 2.35 O ATOM 388 O5' DA A 13 -12.222 -1.234 3.276 1.00 1.56 O ATOM 389 C5' DA A 13 -11.320 -1.348 4.386 1.00 1.24 C ATOM 390 C4' DA A 13 -10.477 -0.084 4.547 1.00 0.74 C ATOM 391 O4' DA A 13 -9.791 0.187 3.318 1.00 0.71 O ATOM 392 C3' DA A 13 -11.295 1.166 4.894 1.00 1.09 C ATOM 393 O3' DA A 13 -10.602 1.947 5.881 1.00 1.19 O ATOM 394 C2' DA A 13 -11.357 1.935 3.583 1.00 1.29 C ATOM 395 C1' DA A 13 -10.039 1.540 2.942 1.00 0.96 C ATOM 396 N9 DA A 13 -10.039 1.610 1.469 1.00 1.03 N ATOM 397 C8 DA A 13 -10.721 0.834 0.566 1.00 1.05 C ATOM 398 N7 DA A 13 -10.505 1.160 -0.680 1.00 1.14 N ATOM 399 C5 DA A 13 -9.616 2.229 -0.592 1.00 1.18 C ATOM 400 C6 DA A 13 -8.992 3.033 -1.562 1.00 1.32 C ATOM 401 N6 DA A 13 -9.176 2.875 -2.872 1.00 1.41 N ATOM 402 N1 DA A 13 -8.171 4.002 -1.123 1.00 1.42 N ATOM 403 C2 DA A 13 -7.989 4.153 0.185 1.00 1.39 C ATOM 404 N3 DA A 13 -8.513 3.467 1.185 1.00 1.25 N ATOM 405 C4 DA A 13 -9.330 2.506 0.714 1.00 1.14 C ATOM 0 H5' DA A 13 -10.666 -2.208 4.239 1.00 1.24 H new ATOM 0 H5'' DA A 13 -11.885 -1.530 5.300 1.00 1.24 H new ATOM 0 H4' DA A 13 -9.796 -0.283 5.374 1.00 0.74 H new ATOM 0 H3' DA A 13 -12.279 0.930 5.299 1.00 1.09 H new ATOM 0 H2' DA A 13 -12.213 1.643 2.975 1.00 1.29 H new ATOM 0 H2'' DA A 13 -11.431 3.011 3.741 1.00 1.29 H new ATOM 0 H1' DA A 13 -9.279 2.242 3.285 1.00 0.96 H new ATOM 0 H8 DA A 13 -11.377 0.027 0.859 1.00 1.05 H new ATOM 0 H61 DA A 13 -8.697 3.488 -3.532 1.00 1.41 H new ATOM 0 H62 DA A 13 -9.796 2.141 -3.215 1.00 1.41 H new ATOM 0 H2 DA A 13 -7.318 4.949 0.471 1.00 1.39 H new ATOM 417 P DG A 14 -11.139 2.026 7.401 1.00 1.63 P ATOM 418 OP1 DG A 14 -12.586 1.715 7.400 1.00 2.19 O ATOM 419 OP2 DG A 14 -10.660 3.293 8.001 1.00 2.10 O ATOM 420 O5' DG A 14 -10.367 0.808 8.120 1.00 1.47 O ATOM 421 C5' DG A 14 -9.051 0.987 8.658 1.00 1.07 C ATOM 422 C4' DG A 14 -8.014 0.172 7.891 1.00 0.58 C ATOM 423 O4' DG A 14 -7.907 0.656 6.556 1.00 0.63 O ATOM 424 C3' DG A 14 -6.602 0.222 8.491 1.00 0.58 C ATOM 425 O3' DG A 14 -6.317 -1.054 9.098 1.00 0.74 O ATOM 426 C2' DG A 14 -5.678 0.496 7.291 1.00 0.71 C ATOM 427 C1' DG A 14 -6.610 0.306 6.099 1.00 0.52 C ATOM 428 N9 DG A 14 -6.285 1.164 4.945 1.00 0.54 N ATOM 429 C8 DG A 14 -5.788 2.441 4.932 1.00 0.67 C ATOM 430 N7 DG A 14 -5.594 2.921 3.734 1.00 0.69 N ATOM 431 C5 DG A 14 -5.993 1.886 2.894 1.00 0.57 C ATOM 432 C6 DG A 14 -6.014 1.812 1.474 1.00 0.59 C ATOM 433 O6 DG A 14 -5.660 2.656 0.654 1.00 0.69 O ATOM 434 N1 DG A 14 -6.492 0.588 1.041 1.00 0.60 N ATOM 435 C2 DG A 14 -6.896 -0.438 1.861 1.00 0.61 C ATOM 436 N2 DG A 14 -7.324 -1.540 1.263 1.00 0.78 N ATOM 437 N3 DG A 14 -6.877 -0.376 3.184 1.00 0.54 N ATOM 438 C4 DG A 14 -6.417 0.809 3.631 1.00 0.51 C ATOM 0 H5' DG A 14 -9.043 0.692 9.707 1.00 1.07 H new ATOM 0 H5'' DG A 14 -8.783 2.043 8.622 1.00 1.07 H new ATOM 0 H4' DG A 14 -8.372 -0.856 7.941 1.00 0.58 H new ATOM 0 H3' DG A 14 -6.477 0.983 9.262 1.00 0.58 H new ATOM 0 H2' DG A 14 -5.261 1.503 7.323 1.00 0.71 H new ATOM 0 H2'' DG A 14 -4.837 -0.196 7.261 1.00 0.71 H new ATOM 0 H1' DG A 14 -6.521 -0.724 5.752 1.00 0.52 H new ATOM 0 H8 DG A 14 -5.576 3.000 5.832 1.00 0.67 H new ATOM 0 H1 DG A 14 -6.549 0.435 0.034 1.00 0.60 H new ATOM 0 H21 DG A 14 -7.637 -2.335 1.821 1.00 0.78 H new ATOM 0 H22 DG A 14 -7.341 -1.594 0.245 1.00 0.78 H new ATOM 450 P DG A 15 -4.847 -1.723 9.094 1.00 0.70 P ATOM 451 OP1 DG A 15 -4.756 -2.646 10.250 1.00 0.76 O ATOM 452 OP2 DG A 15 -3.834 -0.656 8.921 1.00 0.82 O ATOM 453 O5' DG A 15 -4.890 -2.620 7.750 1.00 0.76 O ATOM 454 C5' DG A 15 -5.976 -3.540 7.539 1.00 0.62 C ATOM 455 C4' DG A 15 -5.748 -4.485 6.354 1.00 0.58 C ATOM 456 O4' DG A 15 -5.802 -3.767 5.114 1.00 0.55 O ATOM 457 C3' DG A 15 -4.407 -5.236 6.375 1.00 0.55 C ATOM 458 O3' DG A 15 -4.664 -6.646 6.232 1.00 0.66 O ATOM 459 C2' DG A 15 -3.671 -4.704 5.147 1.00 0.49 C ATOM 460 C1' DG A 15 -4.843 -4.363 4.249 1.00 0.50 C ATOM 461 N9 DG A 15 -4.530 -3.413 3.163 1.00 0.44 N ATOM 462 C8 DG A 15 -4.672 -3.571 1.805 1.00 0.45 C ATOM 463 N7 DG A 15 -4.280 -2.542 1.112 1.00 0.44 N ATOM 464 C5 DG A 15 -3.848 -1.634 2.072 1.00 0.41 C ATOM 465 C6 DG A 15 -3.313 -0.330 1.913 1.00 0.44 C ATOM 466 O6 DG A 15 -3.100 0.283 0.868 1.00 0.55 O ATOM 467 N1 DG A 15 -3.008 0.248 3.136 1.00 0.42 N ATOM 468 C2 DG A 15 -3.195 -0.356 4.361 1.00 0.41 C ATOM 469 N2 DG A 15 -2.843 0.355 5.427 1.00 0.45 N ATOM 470 N3 DG A 15 -3.695 -1.581 4.512 1.00 0.41 N ATOM 471 C4 DG A 15 -3.999 -2.159 3.330 1.00 0.40 C ATOM 0 H5' DG A 15 -6.894 -2.976 7.374 1.00 0.62 H new ATOM 0 H5'' DG A 15 -6.123 -4.131 8.443 1.00 0.62 H new ATOM 0 H4' DG A 15 -6.549 -5.219 6.445 1.00 0.58 H new ATOM 0 H3' DG A 15 -3.837 -5.094 7.293 1.00 0.55 H new ATOM 0 H2' DG A 15 -3.057 -3.833 5.377 1.00 0.49 H new ATOM 0 H2'' DG A 15 -3.012 -5.450 4.703 1.00 0.49 H new ATOM 0 H1' DG A 15 -5.180 -5.269 3.746 1.00 0.50 H new ATOM 0 H8 DG A 15 -5.072 -4.467 1.354 1.00 0.45 H new ATOM 0 H1 DG A 15 -2.616 1.190 3.129 1.00 0.42 H new ATOM 0 H21 DG A 15 -2.957 -0.037 6.362 1.00 0.45 H new ATOM 0 H22 DG A 15 -2.459 1.293 5.310 1.00 0.45 H new ATOM 483 P DG A 16 -3.483 -7.699 5.905 1.00 0.74 P ATOM 484 OP1 DG A 16 -3.942 -9.050 6.300 1.00 0.92 O ATOM 485 OP2 DG A 16 -2.216 -7.160 6.448 1.00 0.78 O ATOM 486 O5' DG A 16 -3.405 -7.652 4.292 1.00 0.71 O ATOM 487 C5' DG A 16 -4.423 -8.264 3.484 1.00 0.60 C ATOM 488 C4' DG A 16 -3.970 -8.418 2.030 1.00 0.58 C ATOM 489 O4' DG A 16 -3.608 -7.130 1.506 1.00 0.59 O ATOM 490 C3' DG A 16 -2.749 -9.325 1.852 1.00 0.56 C ATOM 491 O3' DG A 16 -2.845 -10.038 0.605 1.00 0.58 O ATOM 492 C2' DG A 16 -1.606 -8.332 1.792 1.00 0.53 C ATOM 493 C1' DG A 16 -2.271 -7.210 1.017 1.00 0.55 C ATOM 494 N9 DG A 16 -1.642 -5.893 1.201 1.00 0.53 N ATOM 495 C8 DG A 16 -1.214 -5.308 2.361 1.00 0.52 C ATOM 496 N7 DG A 16 -0.697 -4.125 2.196 1.00 0.54 N ATOM 497 C5 DG A 16 -0.789 -3.908 0.826 1.00 0.55 C ATOM 498 C6 DG A 16 -0.384 -2.787 0.056 1.00 0.59 C ATOM 499 O6 DG A 16 0.123 -1.739 0.444 1.00 0.63 O ATOM 500 N1 DG A 16 -0.650 -2.974 -1.290 1.00 0.60 N ATOM 501 C2 DG A 16 -1.237 -4.094 -1.833 1.00 0.59 C ATOM 502 N2 DG A 16 -1.417 -4.084 -3.149 1.00 0.63 N ATOM 503 N3 DG A 16 -1.621 -5.150 -1.113 1.00 0.57 N ATOM 504 C4 DG A 16 -1.366 -4.987 0.207 1.00 0.54 C ATOM 0 H5' DG A 16 -5.330 -7.661 3.521 1.00 0.60 H new ATOM 0 H5'' DG A 16 -4.674 -9.243 3.893 1.00 0.60 H new ATOM 0 H4' DG A 16 -4.812 -8.870 1.506 1.00 0.58 H new ATOM 0 H3' DG A 16 -2.640 -10.073 2.637 1.00 0.56 H new ATOM 0 H2' DG A 16 -1.276 -8.016 2.782 1.00 0.53 H new ATOM 0 H2'' DG A 16 -0.732 -8.733 1.278 1.00 0.53 H new ATOM 0 H1' DG A 16 -2.193 -7.440 -0.046 1.00 0.55 H new ATOM 0 H8 DG A 16 -1.298 -5.785 3.327 1.00 0.52 H new ATOM 0 H1 DG A 16 -0.390 -2.223 -1.929 1.00 0.60 H new ATOM 0 H21 DG A 16 -1.847 -4.885 -3.611 1.00 0.63 H new ATOM 0 H22 DG A 16 -1.125 -3.275 -3.697 1.00 0.63 H new ATOM 516 P DC A 17 -1.786 -11.201 0.235 1.00 0.61 P ATOM 517 OP1 DC A 17 -1.769 -12.161 1.360 1.00 0.64 O ATOM 518 OP2 DC A 17 -0.523 -10.561 -0.193 1.00 0.67 O ATOM 519 O5' DC A 17 -2.460 -11.929 -1.041 1.00 0.66 O ATOM 520 C5' DC A 17 -2.914 -11.189 -2.188 1.00 0.77 C ATOM 521 C4' DC A 17 -1.758 -10.712 -3.074 1.00 0.72 C ATOM 522 O4' DC A 17 -1.403 -9.383 -2.734 1.00 0.70 O ATOM 523 C3' DC A 17 -0.482 -11.539 -2.952 1.00 0.67 C ATOM 524 O3' DC A 17 -0.409 -12.469 -4.037 1.00 0.80 O ATOM 525 C2' DC A 17 0.659 -10.520 -3.067 1.00 0.67 C ATOM 526 C1' DC A 17 -0.063 -9.174 -3.171 1.00 0.67 C ATOM 527 N1 DC A 17 0.512 -8.114 -2.318 1.00 0.62 N ATOM 528 C2 DC A 17 1.083 -7.008 -2.937 1.00 0.57 C ATOM 529 O2 DC A 17 1.126 -6.936 -4.164 1.00 0.60 O ATOM 530 N3 DC A 17 1.593 -6.022 -2.148 1.00 0.55 N ATOM 531 C4 DC A 17 1.543 -6.121 -0.813 1.00 0.56 C ATOM 532 N4 DC A 17 2.043 -5.149 -0.065 1.00 0.55 N ATOM 533 C5 DC A 17 0.959 -7.254 -0.180 1.00 0.62 C ATOM 534 C6 DC A 17 0.460 -8.220 -0.963 1.00 0.65 C ATOM 0 H5' DC A 17 -3.492 -10.327 -1.855 1.00 0.77 H new ATOM 0 H5'' DC A 17 -3.585 -11.814 -2.777 1.00 0.77 H new ATOM 0 H4' DC A 17 -2.135 -10.808 -4.092 1.00 0.72 H new ATOM 0 H3' DC A 17 -0.440 -12.106 -2.022 1.00 0.67 H new ATOM 0 H2' DC A 17 1.316 -10.555 -2.198 1.00 0.67 H new ATOM 0 H2'' DC A 17 1.279 -10.710 -3.943 1.00 0.67 H new ATOM 0 H1' DC A 17 0.023 -8.839 -4.205 1.00 0.67 H new ATOM 0 H41 DC A 17 2.008 -5.219 0.952 1.00 0.55 H new ATOM 0 H42 DC A 17 2.463 -4.331 -0.506 1.00 0.55 H new ATOM 0 H5 DC A 17 0.919 -7.333 0.896 1.00 0.62 H new ATOM 0 H6 DC A 17 0.011 -9.093 -0.513 1.00 0.65 H new ATOM 546 P DT A 18 0.593 -13.728 -3.962 1.00 0.92 P ATOM 547 OP1 DT A 18 0.389 -14.551 -5.174 1.00 1.23 O ATOM 548 OP2 DT A 18 0.465 -14.346 -2.623 1.00 0.92 O ATOM 549 O5' DT A 18 2.046 -13.030 -4.065 1.00 0.93 O ATOM 550 C5' DT A 18 3.238 -13.736 -3.689 1.00 1.03 C ATOM 551 C4' DT A 18 3.299 -13.992 -2.181 1.00 0.97 C ATOM 552 O4' DT A 18 4.528 -14.648 -1.858 1.00 1.19 O ATOM 553 C3' DT A 18 3.206 -12.721 -1.331 1.00 0.86 C ATOM 554 O3' DT A 18 1.981 -12.741 -0.572 1.00 0.74 O ATOM 555 C2' DT A 18 4.412 -12.775 -0.393 1.00 0.93 C ATOM 556 C1' DT A 18 5.338 -13.780 -1.066 1.00 1.12 C ATOM 557 N1 DT A 18 6.360 -13.177 -1.952 1.00 1.38 N ATOM 558 C2 DT A 18 7.577 -13.828 -2.064 1.00 1.74 C ATOM 559 O2 DT A 18 7.824 -14.868 -1.457 1.00 1.89 O ATOM 560 N3 DT A 18 8.505 -13.241 -2.898 1.00 2.03 N ATOM 561 C4 DT A 18 8.330 -12.077 -3.621 1.00 2.02 C ATOM 562 O4 DT A 18 9.232 -11.646 -4.335 1.00 2.31 O ATOM 563 C5 DT A 18 7.032 -11.464 -3.445 1.00 1.72 C ATOM 564 C7 DT A 18 6.701 -10.169 -4.185 1.00 1.89 C ATOM 565 C6 DT A 18 6.108 -12.018 -2.635 1.00 1.42 C ATOM 0 H5' DT A 18 4.112 -13.161 -3.995 1.00 1.03 H new ATOM 0 H5'' DT A 18 3.280 -14.687 -4.220 1.00 1.03 H new ATOM 0 H4' DT A 18 2.431 -14.608 -1.947 1.00 0.97 H new ATOM 0 H3' DT A 18 3.206 -11.814 -1.935 1.00 0.86 H new ATOM 0 H2' DT A 18 4.885 -11.799 -0.290 1.00 0.93 H new ATOM 0 H2'' DT A 18 4.128 -13.098 0.608 1.00 0.93 H new ATOM 0 H1' DT A 18 5.880 -14.292 -0.271 1.00 1.12 H new ATOM 0 H3 DT A 18 9.406 -13.711 -2.990 1.00 2.03 H new ATOM 0 H71 DT A 18 5.631 -10.129 -4.387 1.00 1.89 H new ATOM 0 H72 DT A 18 6.987 -9.315 -3.570 1.00 1.89 H new ATOM 0 H73 DT A 18 7.249 -10.138 -5.127 1.00 1.89 H new ATOM 0 H6 DT A 18 5.148 -11.537 -2.522 1.00 1.42 H new ATOM 578 P DA A 19 1.718 -13.812 0.614 1.00 0.72 P ATOM 579 OP1 DA A 19 2.527 -15.023 0.349 1.00 0.81 O ATOM 580 OP2 DA A 19 0.255 -13.935 0.805 1.00 0.80 O ATOM 581 O5' DA A 19 2.334 -13.065 1.905 1.00 0.71 O ATOM 582 C5' DA A 19 1.676 -11.922 2.472 1.00 0.58 C ATOM 583 C4' DA A 19 2.664 -10.968 3.146 1.00 0.55 C ATOM 584 O4' DA A 19 3.637 -10.556 2.190 1.00 0.61 O ATOM 585 C3' DA A 19 2.006 -9.707 3.721 1.00 0.61 C ATOM 586 O3' DA A 19 2.279 -9.609 5.126 1.00 0.62 O ATOM 587 C2' DA A 19 2.659 -8.537 2.990 1.00 0.89 C ATOM 588 C1' DA A 19 3.874 -9.157 2.315 1.00 0.72 C ATOM 589 N9 DA A 19 4.112 -8.637 0.959 1.00 0.62 N ATOM 590 C8 DA A 19 3.581 -9.080 -0.223 1.00 0.62 C ATOM 591 N7 DA A 19 3.971 -8.401 -1.265 1.00 0.70 N ATOM 592 C5 DA A 19 4.822 -7.437 -0.732 1.00 0.72 C ATOM 593 C6 DA A 19 5.563 -6.400 -1.318 1.00 0.87 C ATOM 594 N6 DA A 19 5.563 -6.159 -2.627 1.00 1.02 N ATOM 595 N1 DA A 19 6.299 -5.629 -0.500 1.00 0.91 N ATOM 596 C2 DA A 19 6.293 -5.879 0.806 1.00 0.86 C ATOM 597 N3 DA A 19 5.642 -6.818 1.473 1.00 0.76 N ATOM 598 C4 DA A 19 4.914 -7.574 0.625 1.00 0.67 C ATOM 0 H5' DA A 19 0.937 -12.254 3.202 1.00 0.58 H new ATOM 0 H5'' DA A 19 1.135 -11.390 1.690 1.00 0.58 H new ATOM 0 H4' DA A 19 3.106 -11.518 3.977 1.00 0.55 H new ATOM 0 H3' DA A 19 0.924 -9.720 3.591 1.00 0.61 H new ATOM 0 H2' DA A 19 1.981 -8.093 2.261 1.00 0.89 H new ATOM 0 H2'' DA A 19 2.947 -7.745 3.681 1.00 0.89 H new ATOM 0 H1' DA A 19 4.743 -8.917 2.927 1.00 0.72 H new ATOM 0 H8 DA A 19 2.901 -9.916 -0.286 1.00 0.62 H new ATOM 0 H61 DA A 19 6.119 -5.392 -3.004 1.00 1.02 H new ATOM 0 H62 DA A 19 5.007 -6.741 -3.253 1.00 1.02 H new ATOM 0 H2 DA A 19 6.906 -5.223 1.407 1.00 0.86 H new ATOM 610 P DG A 20 1.556 -8.484 6.035 1.00 0.68 P ATOM 611 OP1 DG A 20 0.798 -9.171 7.106 1.00 0.85 O ATOM 612 OP2 DG A 20 0.863 -7.532 5.135 1.00 0.72 O ATOM 613 O5' DG A 20 2.807 -7.723 6.717 1.00 0.76 O ATOM 614 C5' DG A 20 3.459 -6.636 6.050 1.00 0.65 C ATOM 615 C4' DG A 20 3.088 -5.292 6.666 1.00 0.58 C ATOM 616 O4' DG A 20 3.826 -4.259 6.004 1.00 0.63 O ATOM 617 C3' DG A 20 1.600 -4.953 6.549 1.00 0.61 C ATOM 618 O3' DG A 20 1.108 -4.459 7.799 1.00 0.67 O ATOM 619 C2' DG A 20 1.540 -3.853 5.504 1.00 0.83 C ATOM 620 C1' DG A 20 2.928 -3.239 5.571 1.00 0.65 C ATOM 621 N9 DG A 20 3.399 -2.746 4.265 1.00 0.61 N ATOM 622 C8 DG A 20 3.353 -3.382 3.051 1.00 0.63 C ATOM 623 N7 DG A 20 3.776 -2.657 2.056 1.00 0.61 N ATOM 624 C5 DG A 20 4.135 -1.452 2.652 1.00 0.55 C ATOM 625 C6 DG A 20 4.664 -0.272 2.069 1.00 0.52 C ATOM 626 O6 DG A 20 4.920 -0.054 0.888 1.00 0.56 O ATOM 627 N1 DG A 20 4.888 0.707 3.020 1.00 0.54 N ATOM 628 C2 DG A 20 4.640 0.577 4.366 1.00 0.60 C ATOM 629 N2 DG A 20 4.934 1.629 5.123 1.00 0.68 N ATOM 630 N3 DG A 20 4.139 -0.528 4.921 1.00 0.61 N ATOM 631 C4 DG A 20 3.911 -1.500 4.006 1.00 0.57 C ATOM 0 H5' DG A 20 3.186 -6.640 4.995 1.00 0.65 H new ATOM 0 H5'' DG A 20 4.539 -6.774 6.100 1.00 0.65 H new ATOM 0 H4' DG A 20 3.328 -5.361 7.727 1.00 0.58 H new ATOM 0 H3' DG A 20 0.997 -5.821 6.281 1.00 0.61 H new ATOM 0 H2' DG A 20 1.322 -4.250 4.513 1.00 0.83 H new ATOM 0 H2'' DG A 20 0.764 -3.122 5.732 1.00 0.83 H new ATOM 0 H1' DG A 20 2.889 -2.388 6.251 1.00 0.65 H new ATOM 0 H8 DG A 20 2.997 -4.395 2.931 1.00 0.63 H new ATOM 0 H1 DG A 20 5.268 1.597 2.697 1.00 0.54 H new ATOM 0 H21 DG A 20 4.773 1.594 6.130 1.00 0.68 H new ATOM 0 H22 DG A 20 5.321 2.471 4.697 1.00 0.68 H new ATOM 643 P DG A 21 -0.374 -3.827 7.914 1.00 0.73 P ATOM 644 OP1 DG A 21 -1.004 -4.329 9.156 1.00 0.91 O ATOM 645 OP2 DG A 21 -1.062 -3.997 6.613 1.00 0.81 O ATOM 646 O5' DG A 21 -0.058 -2.256 8.118 1.00 0.61 O ATOM 647 C5' DG A 21 0.722 -1.814 9.240 1.00 0.62 C ATOM 648 C4' DG A 21 0.985 -0.303 9.216 1.00 0.58 C ATOM 649 O4' DG A 21 1.645 0.058 7.999 1.00 0.56 O ATOM 650 C3' DG A 21 -0.275 0.569 9.321 1.00 0.58 C ATOM 651 O3' DG A 21 -0.168 1.421 10.477 1.00 0.62 O ATOM 652 C2' DG A 21 -0.269 1.411 8.047 1.00 0.53 C ATOM 653 C1' DG A 21 1.192 1.357 7.639 1.00 0.51 C ATOM 654 N9 DG A 21 1.428 1.543 6.192 1.00 0.52 N ATOM 655 C8 DG A 21 2.084 2.562 5.554 1.00 0.58 C ATOM 656 N7 DG A 21 2.125 2.435 4.256 1.00 0.59 N ATOM 657 C5 DG A 21 1.446 1.242 4.017 1.00 0.52 C ATOM 658 C6 DG A 21 1.168 0.577 2.791 1.00 0.51 C ATOM 659 O6 DG A 21 1.469 0.921 1.650 1.00 0.56 O ATOM 660 N1 DG A 21 0.460 -0.599 3.000 1.00 0.47 N ATOM 661 C2 DG A 21 0.067 -1.074 4.232 1.00 0.45 C ATOM 662 N2 DG A 21 -0.608 -2.220 4.241 1.00 0.48 N ATOM 663 N3 DG A 21 0.326 -0.451 5.378 1.00 0.45 N ATOM 664 C4 DG A 21 1.016 0.694 5.197 1.00 0.48 C ATOM 0 H5' DG A 21 1.674 -2.345 9.248 1.00 0.62 H new ATOM 0 H5'' DG A 21 0.204 -2.074 10.163 1.00 0.62 H new ATOM 0 H4' DG A 21 1.596 -0.113 10.099 1.00 0.58 H new ATOM 0 H3' DG A 21 -1.189 -0.016 9.423 1.00 0.58 H new ATOM 0 H2' DG A 21 -0.922 0.995 7.280 1.00 0.53 H new ATOM 0 H2'' DG A 21 -0.604 2.432 8.231 1.00 0.53 H new ATOM 0 H1' DG A 21 1.717 2.173 8.135 1.00 0.51 H new ATOM 0 H8 DG A 21 2.527 3.396 6.078 1.00 0.58 H new ATOM 0 H1 DG A 21 0.212 -1.153 2.180 1.00 0.47 H new ATOM 0 H21 DG A 21 -0.924 -2.619 5.125 1.00 0.48 H new ATOM 0 H22 DG A 21 -0.810 -2.700 3.364 1.00 0.48 H new ATOM 676 P DG A 22 -1.363 2.424 10.897 1.00 0.68 P ATOM 677 OP1 DG A 22 -1.199 2.774 12.326 1.00 0.80 O ATOM 678 OP2 DG A 22 -2.640 1.849 10.422 1.00 0.74 O ATOM 679 O5' DG A 22 -1.048 3.736 10.017 1.00 0.67 O ATOM 680 C5' DG A 22 0.149 4.492 10.239 1.00 0.69 C ATOM 681 C4' DG A 22 0.191 5.751 9.375 1.00 0.72 C ATOM 682 O4' DG A 22 0.228 5.384 7.988 1.00 0.61 O ATOM 683 C3' DG A 22 -1.018 6.667 9.557 1.00 0.84 C ATOM 684 O3' DG A 22 -0.646 8.045 9.434 1.00 0.99 O ATOM 685 C2' DG A 22 -1.932 6.239 8.423 1.00 0.77 C ATOM 686 C1' DG A 22 -0.911 5.950 7.336 1.00 0.66 C ATOM 687 N9 DG A 22 -1.360 4.989 6.314 1.00 0.52 N ATOM 688 C8 DG A 22 -2.064 3.824 6.477 1.00 0.48 C ATOM 689 N7 DG A 22 -2.265 3.168 5.369 1.00 0.41 N ATOM 690 C5 DG A 22 -1.654 3.957 4.400 1.00 0.36 C ATOM 691 C6 DG A 22 -1.548 3.759 2.999 1.00 0.32 C ATOM 692 O6 DG A 22 -1.958 2.813 2.331 1.00 0.38 O ATOM 693 N1 DG A 22 -0.859 4.797 2.389 1.00 0.31 N ATOM 694 C2 DG A 22 -0.333 5.889 3.041 1.00 0.39 C ATOM 695 N2 DG A 22 0.292 6.782 2.282 1.00 0.43 N ATOM 696 N3 DG A 22 -0.427 6.078 4.358 1.00 0.48 N ATOM 697 C4 DG A 22 -1.100 5.076 4.970 1.00 0.44 C ATOM 0 H5' DG A 22 1.017 3.871 10.020 1.00 0.69 H new ATOM 0 H5'' DG A 22 0.214 4.770 11.291 1.00 0.69 H new ATOM 0 H4' DG A 22 1.083 6.291 9.692 1.00 0.72 H new ATOM 0 H3' DG A 22 -1.482 6.584 10.540 1.00 0.84 H new ATOM 0 H2' DG A 22 -2.525 5.361 8.678 1.00 0.77 H new ATOM 0 H2'' DG A 22 -2.632 7.024 8.136 1.00 0.77 H new ATOM 0 HO3' DG A 22 -1.438 8.610 9.553 1.00 0.99 H new ATOM 0 H1' DG A 22 -0.714 6.887 6.814 1.00 0.66 H new ATOM 0 H8 DG A 22 -2.420 3.481 7.437 1.00 0.48 H new ATOM 0 H1 DG A 22 -0.732 4.747 1.378 1.00 0.31 H new ATOM 0 H21 DG A 22 0.703 7.613 2.706 1.00 0.43 H new ATOM 0 H22 DG A 22 0.361 6.636 1.275 1.00 0.43 H new TER 710 DG A 22