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= -0.951 (180deg=-0.951) USER MOD Single : A 1 DT O5' : rot -75:sc= 1.19 USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl -30:sc= -0.687 (180deg=-1.73!) 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 14.790 5.006 -3.911 1.00 1.57 O ATOM 2 C5' DT A 1 14.345 4.824 -2.565 1.00 1.21 C ATOM 3 C4' DT A 1 13.209 5.790 -2.222 1.00 0.90 C ATOM 4 O4' DT A 1 12.158 5.648 -3.162 1.00 0.77 O ATOM 5 C3' DT A 1 12.586 5.566 -0.853 1.00 0.76 C ATOM 6 O3' DT A 1 12.159 6.827 -0.323 1.00 0.88 O ATOM 7 C2' DT A 1 11.360 4.676 -1.133 1.00 0.61 C ATOM 8 C1' DT A 1 11.243 4.670 -2.676 1.00 0.64 C ATOM 9 N1 DT A 1 11.546 3.352 -3.337 1.00 0.89 N ATOM 10 C2 DT A 1 12.340 3.347 -4.490 1.00 1.32 C ATOM 11 O2 DT A 1 12.768 4.371 -5.015 1.00 1.48 O ATOM 12 N3 DT A 1 12.601 2.113 -5.046 1.00 1.66 N ATOM 13 C4 DT A 1 12.156 0.895 -4.580 1.00 1.63 C ATOM 14 O4 DT A 1 12.453 -0.144 -5.162 1.00 2.00 O ATOM 15 C5 DT A 1 11.341 0.982 -3.396 1.00 1.22 C ATOM 16 C7 DT A 1 10.796 -0.295 -2.771 1.00 1.27 C ATOM 17 C6 DT A 1 11.059 2.166 -2.822 1.00 0.88 C ATOM 0 H5' DT A 1 15.178 4.980 -1.880 1.00 1.21 H new ATOM 0 H5'' DT A 1 14.007 3.797 -2.427 1.00 1.21 H new ATOM 0 H4' DT A 1 13.669 6.778 -2.236 1.00 0.90 H new ATOM 0 H3' DT A 1 13.273 5.114 -0.138 1.00 0.76 H new ATOM 0 H2' DT A 1 11.500 3.669 -0.740 1.00 0.61 H new ATOM 0 H2'' DT A 1 10.461 5.078 -0.667 1.00 0.61 H new ATOM 0 HO5' DT A 1 14.133 4.620 -4.528 1.00 1.57 H new ATOM 0 H1' DT A 1 10.202 4.880 -2.922 1.00 0.64 H new ATOM 0 H3 DT A 1 13.181 2.100 -5.885 1.00 1.66 H new ATOM 0 H71 DT A 1 10.688 -0.156 -1.695 1.00 1.27 H new ATOM 0 H72 DT A 1 9.824 -0.527 -3.206 1.00 1.27 H new ATOM 0 H73 DT A 1 11.485 -1.117 -2.963 1.00 1.27 H new ATOM 0 H6 DT A 1 10.438 2.190 -1.939 1.00 0.88 H new ATOM 31 P DA A 2 11.643 6.958 1.201 1.00 1.02 P ATOM 32 OP1 DA A 2 12.560 7.870 1.925 1.00 1.48 O ATOM 33 OP2 DA A 2 11.388 5.596 1.726 1.00 1.63 O ATOM 34 O5' DA A 2 10.223 7.704 1.020 1.00 1.02 O ATOM 35 C5' DA A 2 10.125 8.909 0.246 1.00 1.28 C ATOM 36 C4' DA A 2 8.952 8.858 -0.734 1.00 1.06 C ATOM 37 O4' DA A 2 8.961 7.598 -1.420 1.00 0.95 O ATOM 38 C3' DA A 2 7.569 9.005 -0.079 1.00 1.01 C ATOM 39 O3' DA A 2 6.759 9.894 -0.870 1.00 0.94 O ATOM 40 C2' DA A 2 6.994 7.597 -0.137 1.00 1.07 C ATOM 41 C1' DA A 2 7.634 7.083 -1.413 1.00 0.88 C ATOM 42 N9 DA A 2 7.710 5.611 -1.525 1.00 0.78 N ATOM 43 C8 DA A 2 7.593 4.657 -0.546 1.00 0.76 C ATOM 44 N7 DA A 2 7.659 3.432 -0.993 1.00 0.68 N ATOM 45 C5 DA A 2 7.839 3.586 -2.362 1.00 0.68 C ATOM 46 C6 DA A 2 7.985 2.664 -3.414 1.00 0.69 C ATOM 47 N6 DA A 2 7.968 1.340 -3.240 1.00 0.64 N ATOM 48 N1 DA A 2 8.151 3.165 -4.651 1.00 0.80 N ATOM 49 C2 DA A 2 8.168 4.483 -4.818 1.00 0.87 C ATOM 50 N3 DA A 2 8.036 5.442 -3.918 1.00 0.84 N ATOM 51 C4 DA A 2 7.872 4.911 -2.692 1.00 0.75 C ATOM 0 H5' DA A 2 11.053 9.064 -0.305 1.00 1.28 H new ATOM 0 H5'' DA A 2 10.004 9.762 0.914 1.00 1.28 H new ATOM 0 H4' DA A 2 9.095 9.708 -1.402 1.00 1.06 H new ATOM 0 H3' DA A 2 7.610 9.408 0.933 1.00 1.01 H new ATOM 0 H2' DA A 2 7.270 7.001 0.733 1.00 1.07 H new ATOM 0 H2'' DA A 2 5.905 7.597 -0.191 1.00 1.07 H new ATOM 0 H1' DA A 2 7.016 7.408 -2.250 1.00 0.88 H new ATOM 0 H8 DA A 2 7.459 4.897 0.498 1.00 0.76 H new ATOM 0 H61 DA A 2 8.079 0.719 -4.041 1.00 0.64 H new ATOM 0 H62 DA A 2 7.844 0.950 -2.306 1.00 0.64 H new ATOM 0 H2 DA A 2 8.310 4.819 -5.835 1.00 0.87 H new ATOM 63 P DG A 3 5.368 10.492 -0.302 1.00 1.03 P ATOM 64 OP1 DG A 3 4.635 11.117 -1.429 1.00 1.37 O ATOM 65 OP2 DG A 3 5.658 11.280 0.916 1.00 1.48 O ATOM 66 O5' DG A 3 4.560 9.165 0.137 1.00 0.74 O ATOM 67 C5' DG A 3 3.278 9.251 0.782 1.00 0.71 C ATOM 68 C4' DG A 3 2.123 9.145 -0.218 1.00 0.55 C ATOM 69 O4' DG A 3 2.268 7.943 -0.993 1.00 0.51 O ATOM 70 C3' DG A 3 0.726 9.087 0.435 1.00 0.53 C ATOM 71 O3' DG A 3 -0.201 9.886 -0.330 1.00 0.50 O ATOM 72 C2' DG A 3 0.359 7.616 0.320 1.00 0.54 C ATOM 73 C1' DG A 3 1.003 7.290 -1.012 1.00 0.48 C ATOM 74 N9 DG A 3 1.211 5.849 -1.282 1.00 0.47 N ATOM 75 C8 DG A 3 1.036 5.182 -2.464 1.00 0.49 C ATOM 76 N7 DG A 3 1.260 3.904 -2.389 1.00 0.48 N ATOM 77 C5 DG A 3 1.612 3.696 -1.064 1.00 0.45 C ATOM 78 C6 DG A 3 1.969 2.491 -0.398 1.00 0.46 C ATOM 79 O6 DG A 3 2.047 1.357 -0.867 1.00 0.51 O ATOM 80 N1 DG A 3 2.255 2.715 0.940 1.00 0.49 N ATOM 81 C2 DG A 3 2.205 3.951 1.556 1.00 0.52 C ATOM 82 N2 DG A 3 2.514 3.988 2.845 1.00 0.60 N ATOM 83 N3 DG A 3 1.871 5.079 0.930 1.00 0.52 N ATOM 84 C4 DG A 3 1.588 4.880 -0.373 1.00 0.46 C ATOM 0 H5' DG A 3 3.206 10.196 1.320 1.00 0.71 H new ATOM 0 H5'' DG A 3 3.191 8.456 1.522 1.00 0.71 H new ATOM 0 H4' DG A 3 2.180 10.050 -0.822 1.00 0.55 H new ATOM 0 H3' DG A 3 0.705 9.461 1.458 1.00 0.53 H new ATOM 0 H2' DG A 3 0.765 7.020 1.137 1.00 0.54 H new ATOM 0 H2'' DG A 3 -0.719 7.454 0.313 1.00 0.54 H new ATOM 0 H1' DG A 3 0.331 7.623 -1.803 1.00 0.48 H new ATOM 0 H8 DG A 3 0.738 5.674 -3.378 1.00 0.49 H new ATOM 0 H1 DG A 3 2.521 1.912 1.509 1.00 0.49 H new ATOM 0 H21 DG A 3 2.493 4.874 3.349 1.00 0.60 H new ATOM 0 H22 DG A 3 2.772 3.130 3.332 1.00 0.60 H new ATOM 96 P DG A 4 -1.776 9.970 0.049 1.00 0.59 P ATOM 97 OP1 DG A 4 -1.921 10.823 1.252 1.00 0.80 O ATOM 98 OP2 DG A 4 -2.339 8.604 0.052 1.00 0.66 O ATOM 99 O5' DG A 4 -2.396 10.773 -1.204 1.00 0.64 O ATOM 100 C5' DG A 4 -1.959 10.507 -2.545 1.00 0.62 C ATOM 101 C4' DG A 4 -2.710 9.333 -3.174 1.00 0.56 C ATOM 102 O4' DG A 4 -2.254 8.098 -2.627 1.00 0.58 O ATOM 103 C3' DG A 4 -4.229 9.371 -2.964 1.00 0.58 C ATOM 104 O3' DG A 4 -4.872 9.535 -4.229 1.00 0.74 O ATOM 105 C2' DG A 4 -4.578 7.995 -2.386 1.00 0.46 C ATOM 106 C1' DG A 4 -3.338 7.191 -2.733 1.00 0.50 C ATOM 107 N9 DG A 4 -3.069 6.039 -1.846 1.00 0.52 N ATOM 108 C8 DG A 4 -2.953 6.001 -0.478 1.00 0.55 C ATOM 109 N7 DG A 4 -2.708 4.812 -0.002 1.00 0.59 N ATOM 110 C5 DG A 4 -2.658 4.005 -1.132 1.00 0.59 C ATOM 111 C6 DG A 4 -2.426 2.609 -1.246 1.00 0.65 C ATOM 112 O6 DG A 4 -2.215 1.794 -0.352 1.00 0.72 O ATOM 113 N1 DG A 4 -2.462 2.195 -2.568 1.00 0.65 N ATOM 114 C2 DG A 4 -2.689 3.015 -3.649 1.00 0.61 C ATOM 115 N2 DG A 4 -2.684 2.431 -4.841 1.00 0.66 N ATOM 116 N3 DG A 4 -2.907 4.327 -3.547 1.00 0.56 N ATOM 117 C4 DG A 4 -2.877 4.749 -2.263 1.00 0.55 C ATOM 0 H5' DG A 4 -0.890 10.293 -2.541 1.00 0.62 H new ATOM 0 H5'' DG A 4 -2.103 11.398 -3.156 1.00 0.62 H new ATOM 0 H4' DG A 4 -2.505 9.417 -4.241 1.00 0.56 H new ATOM 0 H3' DG A 4 -4.544 10.186 -2.313 1.00 0.58 H new ATOM 0 H2' DG A 4 -4.752 8.035 -1.311 1.00 0.46 H new ATOM 0 H2'' DG A 4 -5.477 7.577 -2.839 1.00 0.46 H new ATOM 0 H1' DG A 4 -3.481 6.762 -3.725 1.00 0.50 H new ATOM 0 H8 DG A 4 -3.055 6.876 0.147 1.00 0.55 H new ATOM 0 H1 DG A 4 -2.308 1.204 -2.754 1.00 0.65 H new ATOM 0 H21 DG A 4 -2.846 2.986 -5.681 1.00 0.66 H new ATOM 0 H22 DG A 4 -2.518 1.427 -4.916 1.00 0.66 H new ATOM 129 P DG A 5 -6.226 10.394 -4.347 1.00 0.94 P ATOM 130 OP1 DG A 5 -6.674 10.362 -5.758 1.00 1.34 O ATOM 131 OP2 DG A 5 -6.013 11.695 -3.674 1.00 1.16 O ATOM 132 O5' DG A 5 -7.266 9.531 -3.466 1.00 0.72 O ATOM 133 C5' DG A 5 -8.122 10.159 -2.500 1.00 0.76 C ATOM 134 C4' DG A 5 -9.230 9.214 -2.036 1.00 0.63 C ATOM 135 O4' DG A 5 -9.872 8.649 -3.189 1.00 0.66 O ATOM 136 C3' DG A 5 -8.728 8.035 -1.189 1.00 0.74 C ATOM 137 O3' DG A 5 -9.700 7.660 -0.178 1.00 0.77 O ATOM 138 C2' DG A 5 -8.570 6.924 -2.216 1.00 0.85 C ATOM 139 C1' DG A 5 -9.758 7.225 -3.127 1.00 0.77 C ATOM 140 N9 DG A 5 -9.695 6.714 -4.521 1.00 0.98 N ATOM 141 C8 DG A 5 -8.676 6.090 -5.212 1.00 1.04 C ATOM 142 N7 DG A 5 -8.999 5.747 -6.427 1.00 1.31 N ATOM 143 C5 DG A 5 -10.315 6.168 -6.558 1.00 1.71 C ATOM 144 C6 DG A 5 -11.201 6.063 -7.665 1.00 2.42 C ATOM 145 O6 DG A 5 -10.991 5.571 -8.771 1.00 2.61 O ATOM 146 N1 DG A 5 -12.438 6.613 -7.376 1.00 3.03 N ATOM 147 C2 DG A 5 -12.786 7.189 -6.176 1.00 2.97 C ATOM 148 N2 DG A 5 -14.023 7.661 -6.086 1.00 3.76 N ATOM 149 N3 DG A 5 -11.961 7.288 -5.139 1.00 2.25 N ATOM 150 C4 DG A 5 -10.746 6.759 -5.400 1.00 1.62 C ATOM 0 H5' DG A 5 -8.565 11.056 -2.933 1.00 0.76 H new ATOM 0 H5'' DG A 5 -7.531 10.478 -1.641 1.00 0.76 H new ATOM 0 H4' DG A 5 -9.900 9.815 -1.421 1.00 0.63 H new ATOM 0 H3' DG A 5 -7.811 8.262 -0.645 1.00 0.74 H new ATOM 0 H2' DG A 5 -7.618 6.978 -2.743 1.00 0.85 H new ATOM 0 H2'' DG A 5 -8.631 5.932 -1.768 1.00 0.85 H new ATOM 0 H1' DG A 5 -10.607 6.703 -2.686 1.00 0.77 H new ATOM 0 H8 DG A 5 -7.702 5.903 -4.785 1.00 1.04 H new ATOM 0 H1 DG A 5 -13.146 6.589 -8.110 1.00 3.03 H new ATOM 0 H21 DG A 5 -14.340 8.099 -5.221 1.00 3.76 H new ATOM 0 H22 DG A 5 -14.657 7.585 -6.882 1.00 3.76 H new ATOM 162 P DT A 6 -11.304 7.774 -0.399 1.00 1.01 P ATOM 163 OP1 DT A 6 -11.688 6.871 -1.506 1.00 1.64 O ATOM 164 OP2 DT A 6 -11.667 9.208 -0.454 1.00 1.27 O ATOM 165 O5' DT A 6 -11.893 7.151 0.967 1.00 0.97 O ATOM 166 C5' DT A 6 -12.140 5.743 1.066 1.00 1.08 C ATOM 167 C4' DT A 6 -11.398 5.109 2.242 1.00 1.00 C ATOM 168 O4' DT A 6 -11.380 3.683 2.069 1.00 1.02 O ATOM 169 C3' DT A 6 -9.941 5.554 2.381 1.00 1.07 C ATOM 170 O3' DT A 6 -9.571 5.564 3.768 1.00 1.22 O ATOM 171 C2' DT A 6 -9.175 4.464 1.654 1.00 1.18 C ATOM 172 C1' DT A 6 -10.019 3.238 1.990 1.00 1.07 C ATOM 173 N1 DT A 6 -9.945 2.160 0.979 1.00 1.06 N ATOM 174 C2 DT A 6 -9.336 0.974 1.349 1.00 1.15 C ATOM 175 O2 DT A 6 -8.868 0.798 2.469 1.00 1.30 O ATOM 176 N3 DT A 6 -9.275 -0.007 0.380 1.00 1.18 N ATOM 177 C4 DT A 6 -9.761 0.093 -0.910 1.00 1.21 C ATOM 178 O4 DT A 6 -9.646 -0.844 -1.694 1.00 1.33 O ATOM 179 C5 DT A 6 -10.381 1.363 -1.209 1.00 1.20 C ATOM 180 C7 DT A 6 -10.961 1.607 -2.599 1.00 1.41 C ATOM 181 C6 DT A 6 -10.454 2.337 -0.279 1.00 1.09 C ATOM 0 H5' DT A 6 -11.834 5.256 0.140 1.00 1.08 H new ATOM 0 H5'' DT A 6 -13.210 5.570 1.178 1.00 1.08 H new ATOM 0 H4' DT A 6 -11.934 5.430 3.135 1.00 1.00 H new ATOM 0 H3' DT A 6 -9.752 6.552 1.986 1.00 1.07 H new ATOM 0 H2' DT A 6 -9.120 4.645 0.581 1.00 1.18 H new ATOM 0 H2'' DT A 6 -8.150 4.370 2.014 1.00 1.18 H new ATOM 0 H1' DT A 6 -9.640 2.815 2.920 1.00 1.07 H new ATOM 0 H3 DT A 6 -8.830 -0.887 0.640 1.00 1.18 H new ATOM 0 H71 DT A 6 -11.800 2.299 -2.527 1.00 1.41 H new ATOM 0 H72 DT A 6 -10.193 2.034 -3.244 1.00 1.41 H new ATOM 0 H73 DT A 6 -11.305 0.663 -3.021 1.00 1.41 H new ATOM 0 H6 DT A 6 -10.924 3.276 -0.532 1.00 1.09 H new ATOM 194 P DA A 7 -9.434 6.951 4.583 1.00 1.08 P ATOM 195 OP1 DA A 7 -10.267 6.855 5.805 1.00 1.42 O ATOM 196 OP2 DA A 7 -9.641 8.071 3.637 1.00 1.17 O ATOM 197 O5' DA A 7 -7.883 6.946 5.030 1.00 0.84 O ATOM 198 C5' DA A 7 -7.423 6.080 6.079 1.00 0.70 C ATOM 199 C4' DA A 7 -6.118 5.376 5.705 1.00 0.55 C ATOM 200 O4' DA A 7 -6.271 4.750 4.426 1.00 0.55 O ATOM 201 C3' DA A 7 -4.895 6.303 5.617 1.00 0.61 C ATOM 202 O3' DA A 7 -3.776 5.686 6.275 1.00 0.66 O ATOM 203 C2' DA A 7 -4.619 6.406 4.127 1.00 0.74 C ATOM 204 C1' DA A 7 -5.128 5.061 3.635 1.00 0.58 C ATOM 205 N9 DA A 7 -5.535 5.050 2.216 1.00 0.56 N ATOM 206 C8 DA A 7 -6.076 6.064 1.471 1.00 0.61 C ATOM 207 N7 DA A 7 -6.292 5.750 0.224 1.00 0.62 N ATOM 208 C5 DA A 7 -5.864 4.430 0.137 1.00 0.55 C ATOM 209 C6 DA A 7 -5.827 3.516 -0.927 1.00 0.56 C ATOM 210 N6 DA A 7 -6.237 3.820 -2.156 1.00 0.61 N ATOM 211 N1 DA A 7 -5.347 2.287 -0.673 1.00 0.59 N ATOM 212 C2 DA A 7 -4.932 2.001 0.559 1.00 0.63 C ATOM 213 N3 DA A 7 -4.913 2.772 1.638 1.00 0.61 N ATOM 214 C4 DA A 7 -5.404 3.993 1.346 1.00 0.55 C ATOM 0 H5' DA A 7 -8.188 5.335 6.297 1.00 0.70 H new ATOM 0 H5'' DA A 7 -7.275 6.660 6.990 1.00 0.70 H new ATOM 0 H4' DA A 7 -5.931 4.663 6.508 1.00 0.55 H new ATOM 0 H3' DA A 7 -5.061 7.273 6.086 1.00 0.61 H new ATOM 0 H2' DA A 7 -5.150 7.239 3.667 1.00 0.74 H new ATOM 0 H2'' DA A 7 -3.559 6.547 3.914 1.00 0.74 H new ATOM 0 H1' DA A 7 -4.315 4.340 3.725 1.00 0.58 H new ATOM 0 H8 DA A 7 -6.304 7.037 1.880 1.00 0.61 H new ATOM 0 H61 DA A 7 -6.190 3.120 -2.897 1.00 0.61 H new ATOM 0 H62 DA A 7 -6.598 4.753 -2.357 1.00 0.61 H new ATOM 0 H2 DA A 7 -4.557 0.998 0.700 1.00 0.63 H new ATOM 226 P DG A 8 -2.378 6.471 6.474 1.00 1.14 P ATOM 227 OP1 DG A 8 -2.671 7.919 6.586 1.00 1.41 O ATOM 228 OP2 DG A 8 -1.428 5.991 5.446 1.00 1.57 O ATOM 229 O5' DG A 8 -1.889 5.934 7.914 1.00 1.24 O ATOM 230 C5' DG A 8 -2.262 4.621 8.364 1.00 1.11 C ATOM 231 C4' DG A 8 -1.060 3.683 8.479 1.00 0.91 C ATOM 232 O4' DG A 8 -1.312 2.492 7.735 1.00 0.94 O ATOM 233 C3' DG A 8 0.260 4.265 7.958 1.00 0.85 C ATOM 234 O3' DG A 8 1.198 4.318 9.042 1.00 0.92 O ATOM 235 C2' DG A 8 0.733 3.279 6.889 1.00 0.79 C ATOM 236 C1' DG A 8 -0.070 2.035 7.221 1.00 0.80 C ATOM 237 N9 DG A 8 -0.354 1.147 6.074 1.00 0.78 N ATOM 238 C8 DG A 8 -0.140 -0.200 5.975 1.00 0.84 C ATOM 239 N7 DG A 8 -0.501 -0.714 4.832 1.00 0.82 N ATOM 240 C5 DG A 8 -0.992 0.373 4.117 1.00 0.73 C ATOM 241 C6 DG A 8 -1.531 0.429 2.803 1.00 0.71 C ATOM 242 O6 DG A 8 -1.677 -0.490 1.999 1.00 0.74 O ATOM 243 N1 DG A 8 -1.911 1.722 2.463 1.00 0.66 N ATOM 244 C2 DG A 8 -1.788 2.821 3.283 1.00 0.63 C ATOM 245 N2 DG A 8 -2.202 3.981 2.780 1.00 0.61 N ATOM 246 N3 DG A 8 -1.283 2.770 4.518 1.00 0.65 N ATOM 247 C4 DG A 8 -0.907 1.519 4.869 1.00 0.70 C ATOM 0 H5' DG A 8 -2.988 4.195 7.671 1.00 1.11 H new ATOM 0 H5'' DG A 8 -2.754 4.698 9.334 1.00 1.11 H new ATOM 0 H4' DG A 8 -0.943 3.503 9.548 1.00 0.91 H new ATOM 0 H3' DG A 8 0.155 5.272 7.554 1.00 0.85 H new ATOM 0 H2' DG A 8 0.526 3.640 5.882 1.00 0.79 H new ATOM 0 H2'' DG A 8 1.806 3.098 6.948 1.00 0.79 H new ATOM 0 H1' DG A 8 0.521 1.440 7.917 1.00 0.80 H new ATOM 0 H8 DG A 8 0.290 -0.787 6.773 1.00 0.84 H new ATOM 0 H1 DG A 8 -2.311 1.868 1.536 1.00 0.66 H new ATOM 0 H21 DG A 8 -2.137 4.832 3.339 1.00 0.61 H new ATOM 0 H22 DG A 8 -2.585 4.020 1.835 1.00 0.61 H new ATOM 259 P DG A 9 2.707 4.839 8.829 1.00 0.95 P ATOM 260 OP1 DG A 9 3.143 5.521 10.069 1.00 1.23 O ATOM 261 OP2 DG A 9 2.780 5.550 7.532 1.00 1.09 O ATOM 262 O5' DG A 9 3.531 3.459 8.691 1.00 0.81 O ATOM 263 C5' DG A 9 3.518 2.478 9.743 1.00 0.77 C ATOM 264 C4' DG A 9 4.090 1.132 9.276 1.00 0.64 C ATOM 265 O4' DG A 9 3.387 0.698 8.104 1.00 0.62 O ATOM 266 C3' DG A 9 5.584 1.167 8.915 1.00 0.64 C ATOM 267 O3' DG A 9 6.235 -0.014 9.421 1.00 0.70 O ATOM 268 C2' DG A 9 5.575 1.143 7.405 1.00 0.66 C ATOM 269 C1' DG A 9 4.354 0.283 7.149 1.00 0.61 C ATOM 270 N9 DG A 9 3.789 0.468 5.810 1.00 0.63 N ATOM 271 C8 DG A 9 3.585 1.642 5.149 1.00 0.73 C ATOM 272 N7 DG A 9 3.126 1.497 3.946 1.00 0.78 N ATOM 273 C5 DG A 9 3.012 0.127 3.793 1.00 0.68 C ATOM 274 C6 DG A 9 2.561 -0.612 2.677 1.00 0.70 C ATOM 275 O6 DG A 9 2.183 -0.182 1.591 1.00 0.79 O ATOM 276 N1 DG A 9 2.593 -1.975 2.926 1.00 0.64 N ATOM 277 C2 DG A 9 3.011 -2.552 4.106 1.00 0.59 C ATOM 278 N2 DG A 9 2.966 -3.879 4.161 1.00 0.63 N ATOM 279 N3 DG A 9 3.442 -1.853 5.161 1.00 0.56 N ATOM 280 C4 DG A 9 3.413 -0.521 4.931 1.00 0.60 C ATOM 0 H5' DG A 9 2.496 2.336 10.095 1.00 0.77 H new ATOM 0 H5'' DG A 9 4.098 2.845 10.589 1.00 0.77 H new ATOM 0 H4' DG A 9 3.967 0.457 10.123 1.00 0.64 H new ATOM 0 H3' DG A 9 6.110 2.027 9.329 1.00 0.64 H new ATOM 0 H2' DG A 9 5.477 2.140 6.975 1.00 0.66 H new ATOM 0 H2'' DG A 9 6.484 0.706 6.992 1.00 0.66 H new ATOM 0 H1' DG A 9 4.632 -0.768 7.227 1.00 0.61 H new ATOM 0 H8 DG A 9 3.788 2.607 5.589 1.00 0.73 H new ATOM 0 H1 DG A 9 2.284 -2.598 2.180 1.00 0.64 H new ATOM 0 H21 DG A 9 3.262 -4.365 5.008 1.00 0.63 H new ATOM 0 H22 DG A 9 2.635 -4.412 3.357 1.00 0.63 H new ATOM 292 P DG A 10 7.830 -0.227 9.253 1.00 0.81 P ATOM 293 OP1 DG A 10 8.252 -1.314 10.166 1.00 1.01 O ATOM 294 OP2 DG A 10 8.483 1.100 9.336 1.00 0.93 O ATOM 295 O5' DG A 10 7.971 -0.762 7.735 1.00 0.77 O ATOM 296 C5' DG A 10 7.496 -2.065 7.366 1.00 0.74 C ATOM 297 C4' DG A 10 7.676 -2.334 5.868 1.00 0.68 C ATOM 298 O4' DG A 10 7.060 -1.281 5.113 1.00 0.66 O ATOM 299 C3' DG A 10 9.135 -2.403 5.416 1.00 0.70 C ATOM 300 O3' DG A 10 9.266 -3.345 4.339 1.00 0.75 O ATOM 301 C2' DG A 10 9.405 -1.002 4.908 1.00 0.68 C ATOM 302 C1' DG A 10 8.057 -0.654 4.297 1.00 0.65 C ATOM 303 N9 DG A 10 7.757 0.792 4.250 1.00 0.64 N ATOM 304 C8 DG A 10 8.147 1.784 5.114 1.00 0.71 C ATOM 305 N7 DG A 10 7.715 2.970 4.789 1.00 0.73 N ATOM 306 C5 DG A 10 6.985 2.752 3.624 1.00 0.67 C ATOM 307 C6 DG A 10 6.278 3.675 2.804 1.00 0.68 C ATOM 308 O6 DG A 10 6.142 4.886 2.955 1.00 0.78 O ATOM 309 N1 DG A 10 5.684 3.043 1.725 1.00 0.64 N ATOM 310 C2 DG A 10 5.757 1.695 1.463 1.00 0.59 C ATOM 311 N2 DG A 10 5.122 1.277 0.374 1.00 0.59 N ATOM 312 N3 DG A 10 6.416 0.824 2.228 1.00 0.59 N ATOM 313 C4 DG A 10 7.006 1.423 3.287 1.00 0.62 C ATOM 0 H5' DG A 10 6.442 -2.155 7.627 1.00 0.74 H new ATOM 0 H5'' DG A 10 8.032 -2.823 7.938 1.00 0.74 H new ATOM 0 H4' DG A 10 7.217 -3.307 5.693 1.00 0.68 H new ATOM 0 H3' DG A 10 9.819 -2.717 6.204 1.00 0.70 H new ATOM 0 H2' DG A 10 9.684 -0.318 5.710 1.00 0.68 H new ATOM 0 H2'' DG A 10 10.210 -0.977 4.174 1.00 0.68 H new ATOM 0 H1' DG A 10 8.070 -0.998 3.263 1.00 0.65 H new ATOM 0 H8 DG A 10 8.757 1.599 5.985 1.00 0.71 H new ATOM 0 H1 DG A 10 5.152 3.621 1.075 1.00 0.64 H new ATOM 0 H21 DG A 10 5.137 0.289 0.123 1.00 0.59 H new ATOM 0 H22 DG A 10 4.619 1.944 -0.211 1.00 0.59 H new ATOM 325 P DT A 11 9.620 -4.892 4.628 1.00 0.93 P ATOM 326 OP1 DT A 11 8.545 -5.462 5.471 1.00 1.55 O ATOM 327 OP2 DT A 11 11.026 -4.965 5.083 1.00 1.25 O ATOM 328 O5' DT A 11 9.518 -5.551 3.154 1.00 0.79 O ATOM 329 C5' DT A 11 10.472 -5.232 2.127 1.00 0.66 C ATOM 330 C4' DT A 11 9.797 -4.740 0.839 1.00 0.52 C ATOM 331 O4' DT A 11 9.220 -3.446 1.061 1.00 0.54 O ATOM 332 C3' DT A 11 10.765 -4.596 -0.352 1.00 0.42 C ATOM 333 O3' DT A 11 10.361 -5.452 -1.448 1.00 0.44 O ATOM 334 C2' DT A 11 10.661 -3.122 -0.772 1.00 0.42 C ATOM 335 C1' DT A 11 9.345 -2.695 -0.144 1.00 0.44 C ATOM 336 N1 DT A 11 9.286 -1.257 0.203 1.00 0.47 N ATOM 337 C2 DT A 11 8.368 -0.455 -0.464 1.00 0.48 C ATOM 338 O2 DT A 11 7.645 -0.881 -1.362 1.00 0.49 O ATOM 339 N3 DT A 11 8.345 0.875 -0.090 1.00 0.54 N ATOM 340 C4 DT A 11 9.144 1.466 0.869 1.00 0.61 C ATOM 341 O4 DT A 11 9.029 2.661 1.126 1.00 0.68 O ATOM 342 C5 DT A 11 10.071 0.560 1.505 1.00 0.62 C ATOM 343 C7 DT A 11 11.029 1.092 2.569 1.00 0.76 C ATOM 344 C6 DT A 11 10.114 -0.743 1.163 1.00 0.56 C ATOM 0 H5' DT A 11 11.073 -6.114 1.906 1.00 0.66 H new ATOM 0 H5'' DT A 11 11.154 -4.465 2.493 1.00 0.66 H new ATOM 0 H4' DT A 11 9.052 -5.496 0.591 1.00 0.52 H new ATOM 0 H3' DT A 11 11.782 -4.883 -0.083 1.00 0.42 H new ATOM 0 H2' DT A 11 11.499 -2.533 -0.399 1.00 0.42 H new ATOM 0 H2'' DT A 11 10.649 -3.008 -1.856 1.00 0.42 H new ATOM 0 H1' DT A 11 8.546 -2.872 -0.865 1.00 0.44 H new ATOM 0 H3 DT A 11 7.674 1.477 -0.567 1.00 0.54 H new ATOM 0 H71 DT A 11 11.264 2.135 2.358 1.00 0.76 H new ATOM 0 H72 DT A 11 10.561 1.017 3.550 1.00 0.76 H new ATOM 0 H73 DT A 11 11.947 0.504 2.559 1.00 0.76 H new ATOM 0 H6 DT A 11 10.818 -1.396 1.658 1.00 0.56 H new ATOM 357 P DA A 12 8.917 -5.327 -2.171 1.00 0.48 P ATOM 358 OP1 DA A 12 7.911 -5.022 -1.135 1.00 0.65 O ATOM 359 OP2 DA A 12 8.734 -6.507 -3.044 1.00 0.80 O ATOM 360 O5' DA A 12 9.073 -4.027 -3.121 1.00 0.60 O ATOM 361 C5' DA A 12 7.937 -3.220 -3.492 1.00 0.57 C ATOM 362 C4' DA A 12 6.788 -4.048 -4.087 1.00 0.47 C ATOM 363 O4' DA A 12 6.218 -4.878 -3.070 1.00 0.49 O ATOM 364 C3' DA A 12 5.646 -3.201 -4.670 1.00 0.46 C ATOM 365 O3' DA A 12 5.562 -3.414 -6.088 1.00 0.44 O ATOM 366 C2' DA A 12 4.383 -3.728 -3.988 1.00 0.52 C ATOM 367 C1' DA A 12 4.935 -4.367 -2.725 1.00 0.52 C ATOM 368 N9 DA A 12 5.100 -3.452 -1.565 1.00 0.55 N ATOM 369 C8 DA A 12 4.993 -2.081 -1.500 1.00 0.59 C ATOM 370 N7 DA A 12 5.189 -1.591 -0.306 1.00 0.62 N ATOM 371 C5 DA A 12 5.446 -2.713 0.478 1.00 0.58 C ATOM 372 C6 DA A 12 5.737 -2.877 1.848 1.00 0.61 C ATOM 373 N6 DA A 12 5.816 -1.862 2.709 1.00 0.68 N ATOM 374 N1 DA A 12 5.939 -4.129 2.288 1.00 0.61 N ATOM 375 C2 DA A 12 5.855 -5.141 1.429 1.00 0.60 C ATOM 376 N3 DA A 12 5.589 -5.114 0.135 1.00 0.57 N ATOM 377 C4 DA A 12 5.393 -3.848 -0.281 1.00 0.55 C ATOM 0 H5' DA A 12 8.251 -2.470 -4.217 1.00 0.57 H new ATOM 0 H5'' DA A 12 7.576 -2.684 -2.614 1.00 0.57 H new ATOM 0 H4' DA A 12 7.232 -4.624 -4.899 1.00 0.47 H new ATOM 0 H3' DA A 12 5.791 -2.133 -4.505 1.00 0.46 H new ATOM 0 H2' DA A 12 3.679 -2.927 -3.763 1.00 0.52 H new ATOM 0 H2'' DA A 12 3.856 -4.450 -4.612 1.00 0.52 H new ATOM 0 H1' DA A 12 4.215 -5.118 -2.400 1.00 0.52 H new ATOM 0 H8 DA A 12 4.767 -1.467 -2.359 1.00 0.59 H new ATOM 0 H61 DA A 12 6.030 -2.041 3.690 1.00 0.68 H new ATOM 0 H62 DA A 12 5.662 -0.907 2.387 1.00 0.68 H new ATOM 0 H2 DA A 12 6.028 -6.121 1.847 1.00 0.60 H new ATOM 389 P DG A 13 4.377 -2.754 -6.975 1.00 0.49 P ATOM 390 OP1 DG A 13 3.097 -3.389 -6.590 1.00 0.69 O ATOM 391 OP2 DG A 13 4.803 -2.772 -8.393 1.00 0.56 O ATOM 392 O5' DG A 13 4.348 -1.216 -6.474 1.00 0.64 O ATOM 393 C5' DG A 13 5.042 -0.182 -7.194 1.00 0.63 C ATOM 394 C4' DG A 13 4.236 1.123 -7.243 1.00 0.60 C ATOM 395 O4' DG A 13 3.842 1.497 -5.912 1.00 0.61 O ATOM 396 C3' DG A 13 5.015 2.312 -7.832 1.00 0.59 C ATOM 397 O3' DG A 13 4.241 2.994 -8.852 1.00 0.66 O ATOM 398 C2' DG A 13 5.263 3.241 -6.644 1.00 0.59 C ATOM 399 C1' DG A 13 4.113 2.889 -5.720 1.00 0.60 C ATOM 400 N9 DG A 13 4.385 3.109 -4.288 1.00 0.57 N ATOM 401 C8 DG A 13 4.764 2.201 -3.340 1.00 0.59 C ATOM 402 N7 DG A 13 4.880 2.699 -2.143 1.00 0.56 N ATOM 403 C5 DG A 13 4.556 4.041 -2.309 1.00 0.54 C ATOM 404 C6 DG A 13 4.503 5.090 -1.354 1.00 0.59 C ATOM 405 O6 DG A 13 4.742 5.034 -0.148 1.00 0.65 O ATOM 406 N1 DG A 13 4.127 6.291 -1.938 1.00 0.63 N ATOM 407 C2 DG A 13 3.839 6.464 -3.273 1.00 0.61 C ATOM 408 N2 DG A 13 3.499 7.692 -3.647 1.00 0.67 N ATOM 409 N3 DG A 13 3.889 5.480 -4.172 1.00 0.56 N ATOM 410 C4 DG A 13 4.251 4.301 -3.620 1.00 0.54 C ATOM 0 H5' DG A 13 5.245 -0.521 -8.210 1.00 0.63 H new ATOM 0 H5'' DG A 13 6.006 0.005 -6.721 1.00 0.63 H new ATOM 0 H4' DG A 13 3.383 0.918 -7.890 1.00 0.60 H new ATOM 0 H3' DG A 13 5.939 1.991 -8.313 1.00 0.59 H new ATOM 0 H2' DG A 13 6.231 3.057 -6.178 1.00 0.59 H new ATOM 0 H2'' DG A 13 5.244 4.291 -6.937 1.00 0.59 H new ATOM 0 H1' DG A 13 3.279 3.544 -5.972 1.00 0.60 H new ATOM 0 H8 DG A 13 4.951 1.161 -3.564 1.00 0.59 H new ATOM 0 H1 DG A 13 4.059 7.108 -1.332 1.00 0.63 H new ATOM 0 H21 DG A 13 3.274 7.884 -4.623 1.00 0.67 H new ATOM 0 H22 DG A 13 3.463 8.443 -2.958 1.00 0.67 H new ATOM 422 P DG A 14 2.697 3.459 -8.654 1.00 0.75 P ATOM 423 OP1 DG A 14 2.307 4.278 -9.826 1.00 0.89 O ATOM 424 OP2 DG A 14 2.525 4.010 -7.292 1.00 0.81 O ATOM 425 O5' DG A 14 1.887 2.065 -8.746 1.00 0.69 O ATOM 426 C5' DG A 14 1.894 1.295 -9.960 1.00 0.74 C ATOM 427 C4' DG A 14 0.989 0.061 -9.873 1.00 0.69 C ATOM 428 O4' DG A 14 1.358 -0.725 -8.737 1.00 0.66 O ATOM 429 C3' DG A 14 -0.510 0.377 -9.738 1.00 0.75 C ATOM 430 O3' DG A 14 -1.233 -0.257 -10.811 1.00 0.84 O ATOM 431 C2' DG A 14 -0.916 -0.242 -8.402 1.00 0.69 C ATOM 432 C1' DG A 14 0.171 -1.282 -8.193 1.00 0.62 C ATOM 433 N9 DG A 14 0.432 -1.615 -6.780 1.00 0.53 N ATOM 434 C8 DG A 14 0.404 -2.841 -6.174 1.00 0.52 C ATOM 435 N7 DG A 14 0.692 -2.809 -4.902 1.00 0.49 N ATOM 436 C5 DG A 14 0.927 -1.462 -4.646 1.00 0.46 C ATOM 437 C6 DG A 14 1.282 -0.813 -3.434 1.00 0.44 C ATOM 438 O6 DG A 14 1.459 -1.313 -2.326 1.00 0.48 O ATOM 439 N1 DG A 14 1.422 0.556 -3.613 1.00 0.46 N ATOM 440 C2 DG A 14 1.240 1.218 -4.809 1.00 0.51 C ATOM 441 N2 DG A 14 1.412 2.533 -4.792 1.00 0.58 N ATOM 442 N3 DG A 14 0.907 0.611 -5.944 1.00 0.53 N ATOM 443 C4 DG A 14 0.768 -0.724 -5.790 1.00 0.49 C ATOM 0 H5' DG A 14 2.914 0.980 -10.182 1.00 0.74 H new ATOM 0 H5'' DG A 14 1.568 1.924 -10.788 1.00 0.74 H new ATOM 0 H4' DG A 14 1.133 -0.466 -10.816 1.00 0.69 H new ATOM 0 H3' DG A 14 -0.721 1.446 -9.781 1.00 0.75 H new ATOM 0 H2' DG A 14 -0.935 0.495 -7.600 1.00 0.69 H new ATOM 0 H2'' DG A 14 -1.908 -0.692 -8.445 1.00 0.69 H new ATOM 0 H1' DG A 14 -0.153 -2.208 -8.668 1.00 0.62 H new ATOM 0 H8 DG A 14 0.165 -3.753 -6.701 1.00 0.52 H new ATOM 0 H1 DG A 14 1.679 1.114 -2.799 1.00 0.46 H new ATOM 0 H21 DG A 14 1.290 3.074 -5.648 1.00 0.58 H new ATOM 0 H22 DG A 14 1.666 3.003 -3.923 1.00 0.58 H new ATOM 455 P DG A 15 -2.843 -0.146 -10.914 1.00 0.94 P ATOM 456 OP1 DG A 15 -3.237 -0.355 -12.326 1.00 1.16 O ATOM 457 OP2 DG A 15 -3.267 1.084 -10.204 1.00 1.03 O ATOM 458 O5' DG A 15 -3.342 -1.417 -10.052 1.00 0.80 O ATOM 459 C5' DG A 15 -3.010 -2.755 -10.450 1.00 0.86 C ATOM 460 C4' DG A 15 -3.336 -3.773 -9.352 1.00 0.77 C ATOM 461 O4' DG A 15 -2.657 -3.398 -8.142 1.00 0.71 O ATOM 462 C3' DG A 15 -4.832 -3.885 -9.013 1.00 0.76 C ATOM 463 O3' DG A 15 -5.194 -5.271 -8.835 1.00 0.80 O ATOM 464 C2' DG A 15 -4.956 -3.131 -7.711 1.00 0.66 C ATOM 465 C1' DG A 15 -3.607 -3.411 -7.078 1.00 0.63 C ATOM 466 N9 DG A 15 -3.198 -2.412 -6.074 1.00 0.56 N ATOM 467 C8 DG A 15 -3.387 -1.054 -6.084 1.00 0.58 C ATOM 468 N7 DG A 15 -2.979 -0.454 -5.004 1.00 0.53 N ATOM 469 C5 DG A 15 -2.479 -1.488 -4.219 1.00 0.48 C ATOM 470 C6 DG A 15 -1.901 -1.450 -2.926 1.00 0.48 C ATOM 471 O6 DG A 15 -1.717 -0.481 -2.199 1.00 0.50 O ATOM 472 N1 DG A 15 -1.531 -2.711 -2.498 1.00 0.50 N ATOM 473 C2 DG A 15 -1.692 -3.872 -3.214 1.00 0.51 C ATOM 474 N2 DG A 15 -1.273 -4.991 -2.632 1.00 0.57 N ATOM 475 N3 DG A 15 -2.233 -3.916 -4.430 1.00 0.51 N ATOM 476 C4 DG A 15 -2.605 -2.690 -4.868 1.00 0.50 C ATOM 0 H5' DG A 15 -1.949 -2.809 -10.692 1.00 0.86 H new ATOM 0 H5'' DG A 15 -3.558 -3.011 -11.357 1.00 0.86 H new ATOM 0 H4' DG A 15 -3.011 -4.737 -9.743 1.00 0.77 H new ATOM 0 H3' DG A 15 -5.484 -3.490 -9.792 1.00 0.76 H new ATOM 0 H2' DG A 15 -5.124 -2.065 -7.867 1.00 0.66 H new ATOM 0 H2'' DG A 15 -5.781 -3.498 -7.100 1.00 0.66 H new ATOM 0 H1' DG A 15 -3.666 -4.363 -6.551 1.00 0.63 H new ATOM 0 H8 DG A 15 -3.835 -0.529 -6.915 1.00 0.58 H new ATOM 0 H1 DG A 15 -1.103 -2.786 -1.575 1.00 0.50 H new ATOM 0 H21 DG A 15 -1.367 -5.884 -3.116 1.00 0.57 H new ATOM 0 H22 DG A 15 -0.858 -4.957 -1.701 1.00 0.57 H new ATOM 488 P DT A 16 -6.605 -5.698 -8.164 1.00 0.83 P ATOM 489 OP1 DT A 16 -6.908 -7.091 -8.564 1.00 0.99 O ATOM 490 OP2 DT A 16 -7.589 -4.621 -8.430 1.00 0.94 O ATOM 491 O5' DT A 16 -6.248 -5.686 -6.587 1.00 0.79 O ATOM 492 C5' DT A 16 -7.276 -5.629 -5.587 1.00 0.76 C ATOM 493 C4' DT A 16 -6.728 -5.157 -4.238 1.00 0.70 C ATOM 494 O4' DT A 16 -6.217 -3.831 -4.373 1.00 0.68 O ATOM 495 C3' DT A 16 -7.776 -5.136 -3.121 1.00 0.67 C ATOM 496 O3' DT A 16 -7.324 -5.962 -2.036 1.00 0.76 O ATOM 497 C2' DT A 16 -7.827 -3.657 -2.650 1.00 0.57 C ATOM 498 C1' DT A 16 -6.507 -3.104 -3.181 1.00 0.58 C ATOM 499 N1 DT A 16 -6.562 -1.670 -3.546 1.00 0.55 N ATOM 500 C2 DT A 16 -6.006 -0.750 -2.671 1.00 0.66 C ATOM 501 O2 DT A 16 -5.488 -1.077 -1.607 1.00 0.76 O ATOM 502 N3 DT A 16 -6.071 0.573 -3.060 1.00 0.74 N ATOM 503 C4 DT A 16 -6.632 1.051 -4.228 1.00 0.72 C ATOM 504 O4 DT A 16 -6.627 2.252 -4.474 1.00 0.88 O ATOM 505 C5 DT A 16 -7.189 0.023 -5.079 1.00 0.62 C ATOM 506 C7 DT A 16 -7.843 0.414 -6.404 1.00 0.71 C ATOM 507 C6 DT A 16 -7.140 -1.276 -4.722 1.00 0.56 C ATOM 0 H5' DT A 16 -7.727 -6.615 -5.472 1.00 0.76 H new ATOM 0 H5'' DT A 16 -8.066 -4.954 -5.915 1.00 0.76 H new ATOM 0 H4' DT A 16 -5.955 -5.873 -3.959 1.00 0.70 H new ATOM 0 H3' DT A 16 -8.748 -5.502 -3.452 1.00 0.67 H new ATOM 0 H2' DT A 16 -8.686 -3.128 -3.063 1.00 0.57 H new ATOM 0 H2'' DT A 16 -7.895 -3.577 -1.565 1.00 0.57 H new ATOM 0 H1' DT A 16 -5.759 -3.207 -2.395 1.00 0.58 H new ATOM 0 H3 DT A 16 -5.667 1.262 -2.425 1.00 0.74 H new ATOM 0 H71 DT A 16 -7.724 -0.398 -7.122 1.00 0.71 H new ATOM 0 H72 DT A 16 -8.904 0.604 -6.244 1.00 0.71 H new ATOM 0 H73 DT A 16 -7.368 1.315 -6.793 1.00 0.71 H new ATOM 0 H6 DT A 16 -7.566 -2.021 -5.378 1.00 0.56 H new ATOM 520 P DA A 17 -8.382 -6.613 -1.005 1.00 0.83 P ATOM 521 OP1 DA A 17 -7.686 -7.653 -0.213 1.00 1.04 O ATOM 522 OP2 DA A 17 -9.608 -6.958 -1.762 1.00 0.91 O ATOM 523 O5' DA A 17 -8.728 -5.381 -0.020 1.00 0.69 O ATOM 524 C5' DA A 17 -7.698 -4.756 0.760 1.00 0.74 C ATOM 525 C4' DA A 17 -8.271 -3.861 1.864 1.00 0.75 C ATOM 526 O4' DA A 17 -9.062 -2.823 1.276 1.00 0.73 O ATOM 527 C3' DA A 17 -9.176 -4.587 2.856 1.00 0.82 C ATOM 528 O3' DA A 17 -9.139 -3.917 4.128 1.00 1.06 O ATOM 529 C2' DA A 17 -10.554 -4.432 2.233 1.00 0.83 C ATOM 530 C1' DA A 17 -10.447 -3.054 1.586 1.00 0.77 C ATOM 531 N9 DA A 17 -11.211 -2.915 0.332 1.00 0.76 N ATOM 532 C8 DA A 17 -11.246 -3.751 -0.754 1.00 0.77 C ATOM 533 N7 DA A 17 -12.026 -3.337 -1.715 1.00 0.98 N ATOM 534 C5 DA A 17 -12.544 -2.139 -1.228 1.00 1.08 C ATOM 535 C6 DA A 17 -13.440 -1.200 -1.768 1.00 1.36 C ATOM 536 N6 DA A 17 -13.996 -1.329 -2.971 1.00 1.59 N ATOM 537 N1 DA A 17 -13.736 -0.128 -1.017 1.00 1.49 N ATOM 538 C2 DA A 17 -13.178 -0.004 0.182 1.00 1.39 C ATOM 539 N3 DA A 17 -12.328 -0.812 0.795 1.00 1.16 N ATOM 540 C4 DA A 17 -12.051 -1.877 0.018 1.00 0.97 C ATOM 0 H5' DA A 17 -7.060 -4.161 0.106 1.00 0.74 H new ATOM 0 H5'' DA A 17 -7.067 -5.524 1.208 1.00 0.74 H new ATOM 0 H4' DA A 17 -7.403 -3.485 2.406 1.00 0.75 H new ATOM 0 H3' DA A 17 -8.890 -5.624 3.030 1.00 0.82 H new ATOM 0 H2' DA A 17 -10.763 -5.213 1.502 1.00 0.83 H new ATOM 0 H2'' DA A 17 -11.348 -4.474 2.979 1.00 0.83 H new ATOM 0 H1' DA A 17 -10.862 -2.338 2.295 1.00 0.77 H new ATOM 0 H8 DA A 17 -10.680 -4.669 -0.809 1.00 0.77 H new ATOM 0 H61 DA A 17 -14.640 -0.617 -3.314 1.00 1.59 H new ATOM 0 H62 DA A 17 -13.778 -2.140 -3.549 1.00 1.59 H new ATOM 0 H2 DA A 17 -13.457 0.881 0.734 1.00 1.39 H new ATOM 552 P DI A 18 -9.724 -4.620 5.460 1.00 1.14 P ATOM 553 OP1 DI A 18 -10.885 -5.455 5.076 1.00 1.38 O ATOM 554 OP2 DI A 18 -9.876 -3.580 6.503 1.00 1.38 O ATOM 555 O5' DI A 18 -8.523 -5.603 5.894 1.00 0.92 O ATOM 556 C5' DI A 18 -7.364 -5.093 6.567 1.00 0.86 C ATOM 557 C4' DI A 18 -6.094 -5.802 6.106 1.00 0.65 C ATOM 558 O4' DI A 18 -5.955 -5.648 4.688 1.00 0.55 O ATOM 559 C3' DI A 18 -4.804 -5.265 6.748 1.00 0.73 C ATOM 560 O3' DI A 18 -3.980 -6.377 7.147 1.00 0.81 O ATOM 561 C2' DI A 18 -4.146 -4.484 5.619 1.00 0.75 C ATOM 562 C1' DI A 18 -4.608 -5.278 4.413 1.00 0.62 C ATOM 563 N9 DI A 18 -4.584 -4.524 3.141 1.00 0.62 N ATOM 564 C8 DI A 18 -4.618 -3.167 2.935 1.00 0.68 C ATOM 565 N7 DI A 18 -4.535 -2.820 1.683 1.00 0.72 N ATOM 566 C5 DI A 18 -4.442 -4.030 1.005 1.00 0.68 C ATOM 567 C6 DI A 18 -4.328 -4.289 -0.388 1.00 0.72 C ATOM 568 O6 DI A 18 -4.272 -3.489 -1.316 1.00 0.81 O ATOM 569 N1 DI A 18 -4.266 -5.646 -0.638 1.00 0.70 N ATOM 570 C2 DI A 18 -4.308 -6.624 0.328 1.00 0.65 C ATOM 571 N3 DI A 18 -4.413 -6.403 1.624 1.00 0.61 N ATOM 572 C4 DI A 18 -4.476 -5.079 1.892 1.00 0.62 C ATOM 0 H5'' DI A 18 -7.274 -4.023 6.379 1.00 0.86 H new ATOM 0 H2'' DI A 18 -4.482 -3.448 5.584 1.00 0.75 H new ATOM 0 H8 DI A 18 -4.707 -2.445 3.747 1.00 0.68 H new ATOM 0 H5' DI A 18 -7.482 -5.218 7.643 1.00 0.86 H new ATOM 0 H4' DI A 18 -6.211 -6.842 6.411 1.00 0.65 H new ATOM 0 H3' DI A 18 -4.970 -4.654 7.635 1.00 0.73 H new ATOM 0 H2' DI A 18 -3.060 -4.465 5.709 1.00 0.75 H new ATOM 0 H2 DI A 18 -4.250 -7.661 -0.003 1.00 0.65 H new ATOM 0 H1' DI A 18 -3.929 -6.119 4.273 1.00 0.62 H new ATOM 0 H1 DI A 18 -4.183 -5.944 -1.610 1.00 0.70 H new ATOM 583 P DG A 19 -2.399 -6.227 7.470 1.00 0.84 P ATOM 584 OP1 DG A 19 -2.107 -6.931 8.741 1.00 1.02 O ATOM 585 OP2 DG A 19 -2.003 -4.807 7.312 1.00 0.86 O ATOM 586 O5' DG A 19 -1.729 -7.082 6.274 1.00 0.85 O ATOM 587 C5' DG A 19 -2.073 -8.467 6.105 1.00 0.83 C ATOM 588 C4' DG A 19 -1.329 -9.126 4.939 1.00 0.73 C ATOM 589 O4' DG A 19 -1.673 -8.479 3.707 1.00 0.69 O ATOM 590 C3' DG A 19 0.200 -9.088 5.059 1.00 0.66 C ATOM 591 O3' DG A 19 0.728 -10.403 4.802 1.00 0.70 O ATOM 592 C2' DG A 19 0.630 -8.126 3.951 1.00 0.60 C ATOM 593 C1' DG A 19 -0.482 -8.346 2.939 1.00 0.63 C ATOM 594 N9 DG A 19 -0.670 -7.231 1.991 1.00 0.59 N ATOM 595 C8 DG A 19 -0.713 -7.267 0.622 1.00 0.61 C ATOM 596 N7 DG A 19 -0.885 -6.098 0.067 1.00 0.59 N ATOM 597 C5 DG A 19 -0.961 -5.226 1.150 1.00 0.56 C ATOM 598 C6 DG A 19 -1.145 -3.819 1.176 1.00 0.55 C ATOM 599 O6 DG A 19 -1.264 -3.049 0.233 1.00 0.58 O ATOM 600 N1 DG A 19 -1.166 -3.332 2.471 1.00 0.54 N ATOM 601 C2 DG A 19 -1.023 -4.097 3.606 1.00 0.57 C ATOM 602 N2 DG A 19 -1.062 -3.449 4.765 1.00 0.61 N ATOM 603 N3 DG A 19 -0.850 -5.415 3.587 1.00 0.59 N ATOM 604 C4 DG A 19 -0.830 -5.911 2.329 1.00 0.57 C ATOM 0 H5' DG A 19 -3.147 -8.552 5.939 1.00 0.83 H new ATOM 0 H5'' DG A 19 -1.849 -9.007 7.025 1.00 0.83 H new ATOM 0 H4' DG A 19 -1.641 -10.170 4.962 1.00 0.73 H new ATOM 0 H3' DG A 19 0.550 -8.778 6.044 1.00 0.66 H new ATOM 0 H2' DG A 19 0.677 -7.093 4.295 1.00 0.60 H new ATOM 0 H2'' DG A 19 1.612 -8.373 3.547 1.00 0.60 H new ATOM 0 H1' DG A 19 -0.231 -9.216 2.332 1.00 0.63 H new ATOM 0 H8 DG A 19 -0.614 -8.180 0.054 1.00 0.61 H new ATOM 0 H1 DG A 19 -1.298 -2.328 2.594 1.00 0.54 H new ATOM 0 H21 DG A 19 -0.962 -3.963 5.640 1.00 0.61 H new ATOM 0 H22 DG A 19 -1.192 -2.437 4.780 1.00 0.61 H new ATOM 616 P DG A 20 2.320 -10.684 4.802 1.00 0.65 P ATOM 617 OP1 DG A 20 2.540 -12.125 5.057 1.00 0.80 O ATOM 618 OP2 DG A 20 2.964 -9.673 5.671 1.00 0.77 O ATOM 619 O5' DG A 20 2.735 -10.369 3.276 1.00 0.52 O ATOM 620 C5' DG A 20 2.259 -11.189 2.202 1.00 0.61 C ATOM 621 C4' DG A 20 2.748 -10.682 0.847 1.00 0.56 C ATOM 622 O4' DG A 20 2.174 -9.396 0.576 1.00 0.50 O ATOM 623 C3' DG A 20 4.271 -10.529 0.751 1.00 0.63 C ATOM 624 O3' DG A 20 4.761 -11.030 -0.498 1.00 0.81 O ATOM 625 C2' DG A 20 4.477 -9.022 0.850 1.00 0.55 C ATOM 626 C1' DG A 20 3.220 -8.521 0.163 1.00 0.47 C ATOM 627 N9 DG A 20 2.838 -7.142 0.527 1.00 0.44 N ATOM 628 C8 DG A 20 2.862 -6.542 1.759 1.00 0.50 C ATOM 629 N7 DG A 20 2.487 -5.296 1.746 1.00 0.50 N ATOM 630 C5 DG A 20 2.194 -5.048 0.412 1.00 0.43 C ATOM 631 C6 DG A 20 1.740 -3.857 -0.209 1.00 0.44 C ATOM 632 O6 DG A 20 1.514 -2.767 0.311 1.00 0.49 O ATOM 633 N1 DG A 20 1.564 -4.032 -1.573 1.00 0.43 N ATOM 634 C2 DG A 20 1.796 -5.206 -2.255 1.00 0.43 C ATOM 635 N2 DG A 20 1.563 -5.186 -3.562 1.00 0.48 N ATOM 636 N3 DG A 20 2.226 -6.325 -1.675 1.00 0.41 N ATOM 637 C4 DG A 20 2.403 -6.173 -0.344 1.00 0.41 C ATOM 0 H5' DG A 20 1.169 -11.207 2.213 1.00 0.61 H new ATOM 0 H5'' DG A 20 2.596 -12.215 2.350 1.00 0.61 H new ATOM 0 H4' DG A 20 2.438 -11.437 0.125 1.00 0.56 H new ATOM 0 H3' DG A 20 4.804 -11.087 1.521 1.00 0.63 H new ATOM 0 H2' DG A 20 4.548 -8.681 1.883 1.00 0.55 H new ATOM 0 H2'' DG A 20 5.384 -8.694 0.343 1.00 0.55 H new ATOM 0 HO3' DG A 20 5.734 -10.920 -0.536 1.00 0.81 H new ATOM 0 H1' DG A 20 3.399 -8.510 -0.912 1.00 0.47 H new ATOM 0 H8 DG A 20 3.165 -7.057 2.659 1.00 0.50 H new ATOM 0 H1 DG A 20 1.238 -3.230 -2.113 1.00 0.43 H new ATOM 0 H21 DG A 20 1.717 -6.026 -4.120 1.00 0.48 H new ATOM 0 H22 DG A 20 1.230 -4.331 -4.008 1.00 0.48 H new TER 650 DG A 20