USER MOD reduce.3.24.130724 H: found=0, std=0, add=225, rem=0, adj=4 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= -0.0305 (180deg=-0.0305) USER MOD Single : A 1 DT O5' : rot 180:sc= 0 USER MOD Single : A 6 DT C7 :methyl -30:sc= 0 (180deg=-0.468) USER MOD Single : A 11 DT C7 :methyl -30:sc= -1.49 (180deg=-1.86!) 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 15.483 4.853 -0.293 1.00 0.84 O ATOM 2 C5' DT A 1 14.515 4.381 -1.234 1.00 0.67 C ATOM 3 C4' DT A 1 13.137 4.985 -0.970 1.00 0.62 C ATOM 4 O4' DT A 1 12.205 4.480 -1.912 1.00 0.63 O ATOM 5 C3' DT A 1 12.570 4.664 0.398 1.00 0.59 C ATOM 6 O3' DT A 1 11.650 5.694 0.792 1.00 0.83 O ATOM 7 C2' DT A 1 11.816 3.346 0.172 1.00 0.46 C ATOM 8 C1' DT A 1 11.518 3.357 -1.345 1.00 0.48 C ATOM 9 N1 DT A 1 11.939 2.121 -2.088 1.00 0.56 N ATOM 10 C2 DT A 1 12.458 2.266 -3.378 1.00 0.86 C ATOM 11 O2 DT A 1 12.554 3.350 -3.944 1.00 1.06 O ATOM 12 N3 DT A 1 12.838 1.105 -4.017 1.00 1.04 N ATOM 13 C4 DT A 1 12.755 -0.172 -3.511 1.00 0.97 C ATOM 14 O4 DT A 1 13.133 -1.131 -4.177 1.00 1.21 O ATOM 15 C5 DT A 1 12.206 -0.242 -2.178 1.00 0.74 C ATOM 16 C7 DT A 1 12.063 -1.597 -1.495 1.00 0.88 C ATOM 17 C6 DT A 1 11.821 0.869 -1.521 1.00 0.56 C ATOM 0 H5' DT A 1 14.453 3.294 -1.180 1.00 0.67 H new ATOM 0 H5'' DT A 1 14.836 4.632 -2.245 1.00 0.67 H new ATOM 0 H4' DT A 1 13.282 6.063 -1.044 1.00 0.62 H new ATOM 0 H3' DT A 1 13.330 4.593 1.176 1.00 0.59 H new ATOM 0 H2' DT A 1 12.420 2.484 0.456 1.00 0.46 H new ATOM 0 H2'' DT A 1 10.900 3.302 0.761 1.00 0.46 H new ATOM 0 HO5' DT A 1 16.353 4.447 -0.488 1.00 0.84 H new ATOM 0 H1' DT A 1 10.434 3.410 -1.449 1.00 0.48 H new ATOM 0 H3 DT A 1 13.218 1.202 -4.958 1.00 1.04 H new ATOM 0 H71 DT A 1 12.159 -1.473 -0.416 1.00 0.88 H new ATOM 0 H72 DT A 1 11.085 -2.019 -1.726 1.00 0.88 H new ATOM 0 H73 DT A 1 12.842 -2.269 -1.854 1.00 0.88 H new ATOM 0 H6 DT A 1 11.410 0.777 -0.526 1.00 0.56 H new ATOM 31 P DA A 2 12.189 7.118 1.326 1.00 1.20 P ATOM 32 OP1 DA A 2 13.091 7.684 0.298 1.00 1.55 O ATOM 33 OP2 DA A 2 12.676 6.940 2.713 1.00 1.75 O ATOM 34 O5' DA A 2 10.849 8.014 1.371 1.00 1.00 O ATOM 35 C5' DA A 2 9.768 7.675 2.251 1.00 1.00 C ATOM 36 C4' DA A 2 8.488 7.356 1.480 1.00 0.92 C ATOM 37 O4' DA A 2 8.714 6.245 0.598 1.00 0.83 O ATOM 38 C3' DA A 2 7.291 6.977 2.374 1.00 0.95 C ATOM 39 O3' DA A 2 6.138 7.740 1.979 1.00 1.05 O ATOM 40 C2' DA A 2 7.073 5.503 2.075 1.00 0.83 C ATOM 41 C1' DA A 2 7.545 5.441 0.638 1.00 0.74 C ATOM 42 N9 DA A 2 7.872 4.085 0.158 1.00 0.61 N ATOM 43 C8 DA A 2 8.043 2.938 0.884 1.00 0.53 C ATOM 44 N7 DA A 2 8.207 1.873 0.155 1.00 0.45 N ATOM 45 C5 DA A 2 8.149 2.343 -1.150 1.00 0.48 C ATOM 46 C6 DA A 2 8.256 1.702 -2.399 1.00 0.51 C ATOM 47 N6 DA A 2 8.444 0.382 -2.535 1.00 0.51 N ATOM 48 N1 DA A 2 8.158 2.476 -3.495 1.00 0.61 N ATOM 49 C2 DA A 2 7.967 3.785 -3.347 1.00 0.67 C ATOM 50 N3 DA A 2 7.846 4.493 -2.236 1.00 0.67 N ATOM 51 C4 DA A 2 7.950 3.694 -1.158 1.00 0.57 C ATOM 0 H5' DA A 2 9.583 8.503 2.936 1.00 1.00 H new ATOM 0 H5'' DA A 2 10.050 6.815 2.859 1.00 1.00 H new ATOM 0 H4' DA A 2 8.241 8.274 0.947 1.00 0.92 H new ATOM 0 H3' DA A 2 7.461 7.172 3.433 1.00 0.95 H new ATOM 0 H2' DA A 2 7.656 4.856 2.731 1.00 0.83 H new ATOM 0 H2'' DA A 2 6.029 5.208 2.182 1.00 0.83 H new ATOM 0 H1' DA A 2 6.742 5.783 -0.015 1.00 0.74 H new ATOM 0 H8 DA A 2 8.042 2.918 1.964 1.00 0.53 H new ATOM 0 H61 DA A 2 8.514 -0.030 -3.465 1.00 0.51 H new ATOM 0 H62 DA A 2 8.517 -0.211 -1.708 1.00 0.51 H new ATOM 0 H2 DA A 2 7.901 4.350 -4.265 1.00 0.67 H new ATOM 63 P DG A 3 4.627 7.204 2.211 1.00 1.06 P ATOM 64 OP1 DG A 3 4.545 6.534 3.531 1.00 1.17 O ATOM 65 OP2 DG A 3 4.207 6.479 0.987 1.00 1.24 O ATOM 66 O5' DG A 3 3.797 8.580 2.299 1.00 0.90 O ATOM 67 C5' DG A 3 2.369 8.589 2.237 1.00 0.74 C ATOM 68 C4' DG A 3 1.869 8.833 0.816 1.00 0.58 C ATOM 69 O4' DG A 3 2.179 7.702 -0.010 1.00 0.63 O ATOM 70 C3' DG A 3 0.357 9.054 0.727 1.00 0.47 C ATOM 71 O3' DG A 3 0.092 10.141 -0.173 1.00 0.57 O ATOM 72 C2' DG A 3 -0.165 7.748 0.141 1.00 0.47 C ATOM 73 C1' DG A 3 1.006 7.341 -0.734 1.00 0.44 C ATOM 74 N9 DG A 3 1.072 5.894 -1.050 1.00 0.41 N ATOM 75 C8 DG A 3 0.816 5.278 -2.249 1.00 0.43 C ATOM 76 N7 DG A 3 0.941 3.983 -2.217 1.00 0.45 N ATOM 77 C5 DG A 3 1.308 3.710 -0.905 1.00 0.43 C ATOM 78 C6 DG A 3 1.584 2.462 -0.284 1.00 0.47 C ATOM 79 O6 DG A 3 1.567 1.342 -0.788 1.00 0.53 O ATOM 80 N1 DG A 3 1.919 2.619 1.051 1.00 0.47 N ATOM 81 C2 DG A 3 1.985 3.824 1.712 1.00 0.44 C ATOM 82 N2 DG A 3 2.331 3.766 2.994 1.00 0.49 N ATOM 83 N3 DG A 3 1.725 5.005 1.131 1.00 0.41 N ATOM 84 C4 DG A 3 1.393 4.871 -0.177 1.00 0.40 C ATOM 0 H5' DG A 3 1.981 9.364 2.898 1.00 0.74 H new ATOM 0 H5'' DG A 3 1.983 7.637 2.601 1.00 0.74 H new ATOM 0 H4' DG A 3 2.370 9.741 0.480 1.00 0.58 H new ATOM 0 H3' DG A 3 -0.105 9.299 1.683 1.00 0.47 H new ATOM 0 H2' DG A 3 -0.383 7.008 0.911 1.00 0.47 H new ATOM 0 H2'' DG A 3 -1.081 7.889 -0.433 1.00 0.47 H new ATOM 0 H1' DG A 3 0.900 7.843 -1.696 1.00 0.44 H new ATOM 0 H8 DG A 3 0.536 5.820 -3.140 1.00 0.43 H new ATOM 0 H1 DG A 3 2.133 1.777 1.585 1.00 0.47 H new ATOM 0 H21 DG A 3 2.399 4.623 3.543 1.00 0.49 H new ATOM 0 H22 DG A 3 2.529 2.865 3.429 1.00 0.49 H new ATOM 96 P DG A 4 -1.354 10.856 -0.220 1.00 0.71 P ATOM 97 OP1 DG A 4 -1.150 12.321 -0.252 1.00 1.00 O ATOM 98 OP2 DG A 4 -2.203 10.256 0.835 1.00 1.06 O ATOM 99 O5' DG A 4 -1.934 10.399 -1.654 1.00 0.78 O ATOM 100 C5' DG A 4 -3.346 10.251 -1.856 1.00 0.63 C ATOM 101 C4' DG A 4 -3.661 9.273 -2.989 1.00 0.49 C ATOM 102 O4' DG A 4 -2.924 8.061 -2.789 1.00 0.48 O ATOM 103 C3' DG A 4 -5.145 8.897 -3.081 1.00 0.53 C ATOM 104 O3' DG A 4 -5.583 8.942 -4.451 1.00 0.63 O ATOM 105 C2' DG A 4 -5.200 7.467 -2.562 1.00 0.59 C ATOM 106 C1' DG A 4 -3.814 6.953 -2.910 1.00 0.50 C ATOM 107 N9 DG A 4 -3.328 5.889 -2.011 1.00 0.51 N ATOM 108 C8 DG A 4 -3.102 5.940 -0.659 1.00 0.51 C ATOM 109 N7 DG A 4 -2.652 4.824 -0.156 1.00 0.51 N ATOM 110 C5 DG A 4 -2.580 3.972 -1.253 1.00 0.51 C ATOM 111 C6 DG A 4 -2.165 2.617 -1.327 1.00 0.54 C ATOM 112 O6 DG A 4 -1.771 1.889 -0.419 1.00 0.57 O ATOM 113 N1 DG A 4 -2.249 2.132 -2.623 1.00 0.55 N ATOM 114 C2 DG A 4 -2.678 2.856 -3.713 1.00 0.55 C ATOM 115 N2 DG A 4 -2.687 2.221 -4.879 1.00 0.60 N ATOM 116 N3 DG A 4 -3.069 4.126 -3.646 1.00 0.53 N ATOM 117 C4 DG A 4 -2.994 4.617 -2.390 1.00 0.51 C ATOM 0 H5' DG A 4 -3.784 11.223 -2.083 1.00 0.63 H new ATOM 0 H5'' DG A 4 -3.810 9.900 -0.934 1.00 0.63 H new ATOM 0 H4' DG A 4 -3.383 9.781 -3.912 1.00 0.49 H new ATOM 0 H3' DG A 4 -5.786 9.575 -2.518 1.00 0.53 H new ATOM 0 H2' DG A 4 -5.392 7.429 -1.490 1.00 0.59 H new ATOM 0 H2'' DG A 4 -5.985 6.886 -3.047 1.00 0.59 H new ATOM 0 H1' DG A 4 -3.858 6.525 -3.912 1.00 0.50 H new ATOM 0 H8 DG A 4 -3.281 6.824 -0.065 1.00 0.51 H new ATOM 0 H1 DG A 4 -1.971 1.163 -2.782 1.00 0.55 H new ATOM 0 H21 DG A 4 -2.995 2.706 -5.722 1.00 0.60 H new ATOM 0 H22 DG A 4 -2.386 1.248 -4.932 1.00 0.60 H new ATOM 129 P DG A 5 -7.155 8.851 -4.834 1.00 0.70 P ATOM 130 OP1 DG A 5 -7.575 7.434 -4.738 1.00 0.90 O ATOM 131 OP2 DG A 5 -7.365 9.598 -6.097 1.00 0.75 O ATOM 132 O5' DG A 5 -7.869 9.672 -3.641 1.00 0.77 O ATOM 133 C5' DG A 5 -8.120 9.052 -2.371 1.00 0.92 C ATOM 134 C4' DG A 5 -9.609 8.818 -2.128 1.00 0.80 C ATOM 135 O4' DG A 5 -10.157 8.018 -3.186 1.00 0.75 O ATOM 136 C3' DG A 5 -9.905 8.088 -0.814 1.00 0.76 C ATOM 137 O3' DG A 5 -11.049 8.682 -0.184 1.00 0.89 O ATOM 138 C2' DG A 5 -10.228 6.666 -1.255 1.00 0.64 C ATOM 139 C1' DG A 5 -10.871 6.923 -2.608 1.00 0.69 C ATOM 140 N9 DG A 5 -10.798 5.790 -3.551 1.00 0.74 N ATOM 141 C8 DG A 5 -9.701 5.087 -3.974 1.00 0.92 C ATOM 142 N7 DG A 5 -9.973 4.144 -4.833 1.00 1.06 N ATOM 143 C5 DG A 5 -11.353 4.228 -4.993 1.00 1.03 C ATOM 144 C6 DG A 5 -12.229 3.457 -5.806 1.00 1.33 C ATOM 145 O6 DG A 5 -11.954 2.531 -6.566 1.00 1.55 O ATOM 146 N1 DG A 5 -13.543 3.873 -5.668 1.00 1.46 N ATOM 147 C2 DG A 5 -13.967 4.898 -4.853 1.00 1.33 C ATOM 148 N2 DG A 5 -15.271 5.152 -4.853 1.00 1.65 N ATOM 149 N3 DG A 5 -13.151 5.621 -4.091 1.00 1.00 N ATOM 150 C4 DG A 5 -11.863 5.233 -4.210 1.00 0.86 C ATOM 0 H5' DG A 5 -7.718 9.680 -1.576 1.00 0.92 H new ATOM 0 H5'' DG A 5 -7.592 8.100 -2.323 1.00 0.92 H new ATOM 0 H4' DG A 5 -10.060 9.810 -2.084 1.00 0.80 H new ATOM 0 H3' DG A 5 -9.082 8.131 -0.100 1.00 0.76 H new ATOM 0 H2' DG A 5 -9.335 6.045 -1.334 1.00 0.64 H new ATOM 0 H2'' DG A 5 -10.906 6.164 -0.565 1.00 0.64 H new ATOM 0 H1' DG A 5 -11.932 7.109 -2.441 1.00 0.69 H new ATOM 0 H8 DG A 5 -8.700 5.295 -3.627 1.00 0.92 H new ATOM 0 H1 DG A 5 -14.252 3.381 -6.213 1.00 1.46 H new ATOM 0 H21 DG A 5 -15.645 5.900 -4.269 1.00 1.65 H new ATOM 0 H22 DG A 5 -15.898 4.599 -5.437 1.00 1.65 H new ATOM 162 P DT A 6 -11.349 8.430 1.378 1.00 1.03 P ATOM 163 OP1 DT A 6 -12.333 9.442 1.831 1.00 1.18 O ATOM 164 OP2 DT A 6 -10.053 8.292 2.082 1.00 1.46 O ATOM 165 O5' DT A 6 -12.071 6.988 1.369 1.00 0.98 O ATOM 166 C5' DT A 6 -12.519 6.387 2.590 1.00 0.77 C ATOM 167 C4' DT A 6 -11.901 5.005 2.804 1.00 0.68 C ATOM 168 O4' DT A 6 -12.327 4.116 1.772 1.00 0.61 O ATOM 169 C3' DT A 6 -10.363 4.985 2.793 1.00 0.72 C ATOM 170 O3' DT A 6 -9.885 4.483 4.050 1.00 0.87 O ATOM 171 C2' DT A 6 -10.002 4.005 1.673 1.00 0.69 C ATOM 172 C1' DT A 6 -11.277 3.179 1.570 1.00 0.64 C ATOM 173 N1 DT A 6 -11.483 2.492 0.259 1.00 0.80 N ATOM 174 C2 DT A 6 -12.789 2.295 -0.178 1.00 0.96 C ATOM 175 O2 DT A 6 -13.769 2.630 0.482 1.00 0.98 O ATOM 176 N3 DT A 6 -12.934 1.658 -1.392 1.00 1.23 N ATOM 177 C4 DT A 6 -11.917 1.200 -2.203 1.00 1.36 C ATOM 178 O4 DT A 6 -12.172 0.647 -3.270 1.00 1.64 O ATOM 179 C5 DT A 6 -10.592 1.436 -1.677 1.00 1.22 C ATOM 180 C7 DT A 6 -9.372 0.965 -2.467 1.00 1.48 C ATOM 181 C6 DT A 6 -10.413 2.058 -0.494 1.00 0.97 C ATOM 0 H5' DT A 6 -13.605 6.301 2.575 1.00 0.77 H new ATOM 0 H5'' DT A 6 -12.262 7.034 3.429 1.00 0.77 H new ATOM 0 H4' DT A 6 -12.239 4.700 3.794 1.00 0.68 H new ATOM 0 H3' DT A 6 -9.927 5.972 2.640 1.00 0.72 H new ATOM 0 H2' DT A 6 -9.768 4.517 0.739 1.00 0.69 H new ATOM 0 H2'' DT A 6 -9.136 3.393 1.926 1.00 0.69 H new ATOM 0 H1' DT A 6 -11.234 2.369 2.299 1.00 0.64 H new ATOM 0 H3 DT A 6 -13.888 1.511 -1.723 1.00 1.23 H new ATOM 0 H71 DT A 6 -9.633 0.078 -3.045 1.00 1.48 H new ATOM 0 H72 DT A 6 -9.049 1.756 -3.143 1.00 1.48 H new ATOM 0 H73 DT A 6 -8.563 0.724 -1.777 1.00 1.48 H new ATOM 0 H6 DT A 6 -9.410 2.220 -0.129 1.00 0.97 H new ATOM 194 P DA A 7 -9.440 5.489 5.230 1.00 0.98 P ATOM 195 OP1 DA A 7 -9.821 4.879 6.525 1.00 1.18 O ATOM 196 OP2 DA A 7 -9.919 6.848 4.888 1.00 1.13 O ATOM 197 O5' DA A 7 -7.827 5.479 5.120 1.00 1.02 O ATOM 198 C5' DA A 7 -7.035 4.642 5.977 1.00 0.94 C ATOM 199 C4' DA A 7 -5.627 4.414 5.416 1.00 0.69 C ATOM 200 O4' DA A 7 -5.728 3.882 4.089 1.00 0.62 O ATOM 201 C3' DA A 7 -4.767 5.681 5.321 1.00 0.72 C ATOM 202 O3' DA A 7 -3.393 5.354 5.601 1.00 0.67 O ATOM 203 C2' DA A 7 -4.917 6.087 3.870 1.00 0.67 C ATOM 204 C1' DA A 7 -4.980 4.721 3.209 1.00 0.48 C ATOM 205 N9 DA A 7 -5.636 4.700 1.889 1.00 0.41 N ATOM 206 C8 DA A 7 -6.430 5.650 1.299 1.00 0.47 C ATOM 207 N7 DA A 7 -6.805 5.344 0.087 1.00 0.51 N ATOM 208 C5 DA A 7 -6.220 4.102 -0.138 1.00 0.46 C ATOM 209 C6 DA A 7 -6.230 3.230 -1.239 1.00 0.56 C ATOM 210 N6 DA A 7 -6.871 3.495 -2.377 1.00 0.68 N ATOM 211 N1 DA A 7 -5.547 2.080 -1.119 1.00 0.59 N ATOM 212 C2 DA A 7 -4.903 1.824 0.012 1.00 0.55 C ATOM 213 N3 DA A 7 -4.815 2.558 1.107 1.00 0.47 N ATOM 214 C4 DA A 7 -5.510 3.704 0.958 1.00 0.41 C ATOM 0 H5' DA A 7 -7.533 3.681 6.107 1.00 0.94 H new ATOM 0 H5'' DA A 7 -6.962 5.099 6.964 1.00 0.94 H new ATOM 0 H4' DA A 7 -5.144 3.734 6.117 1.00 0.69 H new ATOM 0 H3' DA A 7 -5.061 6.463 6.021 1.00 0.72 H new ATOM 0 H2' DA A 7 -5.818 6.675 3.694 1.00 0.67 H new ATOM 0 H2'' DA A 7 -4.075 6.681 3.516 1.00 0.67 H new ATOM 0 H1' DA A 7 -3.955 4.392 3.036 1.00 0.48 H new ATOM 0 H8 DA A 7 -6.718 6.567 1.792 1.00 0.47 H new ATOM 0 H61 DA A 7 -6.844 2.825 -3.145 1.00 0.68 H new ATOM 0 H62 DA A 7 -7.388 4.368 -2.480 1.00 0.68 H new ATOM 0 H2 DA A 7 -4.376 0.882 0.042 1.00 0.55 H new ATOM 226 P DG A 8 -2.220 6.459 5.463 1.00 0.71 P ATOM 227 OP1 DG A 8 -2.719 7.735 6.028 1.00 0.83 O ATOM 228 OP2 DG A 8 -1.707 6.421 4.074 1.00 0.83 O ATOM 229 O5' DG A 8 -1.075 5.881 6.441 1.00 0.68 O ATOM 230 C5' DG A 8 -1.352 5.623 7.825 1.00 0.67 C ATOM 231 C4' DG A 8 -0.618 4.379 8.322 1.00 0.59 C ATOM 232 O4' DG A 8 -1.087 3.225 7.610 1.00 0.68 O ATOM 233 C3' DG A 8 0.906 4.431 8.131 1.00 0.52 C ATOM 234 O3' DG A 8 1.563 4.008 9.339 1.00 0.54 O ATOM 235 C2' DG A 8 1.166 3.427 7.026 1.00 0.51 C ATOM 236 C1' DG A 8 0.051 2.442 7.278 1.00 0.53 C ATOM 237 N9 DG A 8 -0.286 1.568 6.137 1.00 0.55 N ATOM 238 C8 DG A 8 -0.247 0.202 6.088 1.00 0.62 C ATOM 239 N7 DG A 8 -0.583 -0.296 4.937 1.00 0.63 N ATOM 240 C5 DG A 8 -0.870 0.814 4.158 1.00 0.57 C ATOM 241 C6 DG A 8 -1.294 0.882 2.806 1.00 0.59 C ATOM 242 O6 DG A 8 -1.490 -0.044 2.022 1.00 0.65 O ATOM 243 N1 DG A 8 -1.477 2.192 2.395 1.00 0.58 N ATOM 244 C2 DG A 8 -1.277 3.303 3.184 1.00 0.58 C ATOM 245 N2 DG A 8 -1.501 4.477 2.602 1.00 0.64 N ATOM 246 N3 DG A 8 -0.877 3.244 4.460 1.00 0.55 N ATOM 247 C4 DG A 8 -0.693 1.968 4.880 1.00 0.54 C ATOM 0 H5' DG A 8 -2.425 5.493 7.964 1.00 0.67 H new ATOM 0 H5'' DG A 8 -1.055 6.485 8.423 1.00 0.67 H new ATOM 0 H4' DG A 8 -0.826 4.329 9.391 1.00 0.59 H new ATOM 0 H3' DG A 8 1.273 5.430 7.894 1.00 0.52 H new ATOM 0 H2' DG A 8 1.105 3.877 6.035 1.00 0.51 H new ATOM 0 H2'' DG A 8 2.151 2.967 7.107 1.00 0.51 H new ATOM 0 H1' DG A 8 0.374 1.760 8.065 1.00 0.53 H new ATOM 0 H8 DG A 8 0.038 -0.409 6.932 1.00 0.62 H new ATOM 0 H1 DG A 8 -1.783 2.346 1.434 1.00 0.58 H new ATOM 0 H21 DG A 8 -1.372 5.341 3.129 1.00 0.64 H new ATOM 0 H22 DG A 8 -1.802 4.514 1.628 1.00 0.64 H new ATOM 259 P DG A 9 3.176 4.003 9.448 1.00 0.59 P ATOM 260 OP1 DG A 9 3.550 4.292 10.851 1.00 0.80 O ATOM 261 OP2 DG A 9 3.711 4.846 8.352 1.00 0.67 O ATOM 262 O5' DG A 9 3.558 2.465 9.129 1.00 0.70 O ATOM 263 C5' DG A 9 3.373 1.429 10.109 1.00 0.59 C ATOM 264 C4' DG A 9 3.814 0.059 9.575 1.00 0.53 C ATOM 265 O4' DG A 9 3.168 -0.185 8.320 1.00 0.55 O ATOM 266 C3' DG A 9 5.325 -0.073 9.330 1.00 0.51 C ATOM 267 O3' DG A 9 5.759 -1.400 9.695 1.00 0.58 O ATOM 268 C2' DG A 9 5.443 0.117 7.834 1.00 0.49 C ATOM 269 C1' DG A 9 4.167 -0.555 7.377 1.00 0.49 C ATOM 270 N9 DG A 9 3.712 -0.130 6.047 1.00 0.48 N ATOM 271 C8 DG A 9 3.669 1.134 5.528 1.00 0.50 C ATOM 272 N7 DG A 9 3.203 1.192 4.311 1.00 0.49 N ATOM 273 C5 DG A 9 2.921 -0.137 4.006 1.00 0.46 C ATOM 274 C6 DG A 9 2.392 -0.704 2.820 1.00 0.47 C ATOM 275 O6 DG A 9 2.056 -0.133 1.785 1.00 0.48 O ATOM 276 N1 DG A 9 2.267 -2.079 2.928 1.00 0.48 N ATOM 277 C2 DG A 9 2.606 -2.821 4.034 1.00 0.49 C ATOM 278 N2 DG A 9 2.420 -4.132 3.942 1.00 0.52 N ATOM 279 N3 DG A 9 3.100 -2.294 5.151 1.00 0.48 N ATOM 280 C4 DG A 9 3.231 -0.951 5.065 1.00 0.46 C ATOM 0 H5' DG A 9 2.323 1.386 10.400 1.00 0.59 H new ATOM 0 H5'' DG A 9 3.943 1.671 11.006 1.00 0.59 H new ATOM 0 H4' DG A 9 3.538 -0.657 10.349 1.00 0.53 H new ATOM 0 H3' DG A 9 5.927 0.632 9.904 1.00 0.51 H new ATOM 0 H2' DG A 9 5.484 1.169 7.550 1.00 0.49 H new ATOM 0 H2'' DG A 9 6.334 -0.359 7.423 1.00 0.49 H new ATOM 0 H1' DG A 9 4.349 -1.628 7.313 1.00 0.49 H new ATOM 0 H8 DG A 9 3.992 2.006 6.077 1.00 0.50 H new ATOM 0 H1 DG A 9 1.894 -2.581 2.122 1.00 0.48 H new ATOM 0 H21 DG A 9 2.653 -4.737 4.730 1.00 0.52 H new ATOM 0 H22 DG A 9 2.044 -4.535 3.083 1.00 0.52 H new ATOM 292 P DG A 10 7.318 -1.835 9.620 1.00 0.69 P ATOM 293 OP1 DG A 10 7.543 -2.918 10.604 1.00 0.88 O ATOM 294 OP2 DG A 10 8.145 -0.607 9.680 1.00 0.84 O ATOM 295 O5' DG A 10 7.455 -2.466 8.136 1.00 0.61 O ATOM 296 C5' DG A 10 6.866 -3.739 7.820 1.00 0.61 C ATOM 297 C4' DG A 10 7.124 -4.164 6.367 1.00 0.58 C ATOM 298 O4' DG A 10 6.687 -3.134 5.478 1.00 0.55 O ATOM 299 C3' DG A 10 8.588 -4.424 6.016 1.00 0.64 C ATOM 300 O3' DG A 10 8.647 -5.347 4.910 1.00 0.75 O ATOM 301 C2' DG A 10 9.063 -3.054 5.581 1.00 0.59 C ATOM 302 C1' DG A 10 7.836 -2.566 4.827 1.00 0.51 C ATOM 303 N9 DG A 10 7.646 -1.107 4.823 1.00 0.43 N ATOM 304 C8 DG A 10 8.010 -0.184 5.768 1.00 0.47 C ATOM 305 N7 DG A 10 7.623 1.030 5.497 1.00 0.50 N ATOM 306 C5 DG A 10 6.959 0.903 4.282 1.00 0.45 C ATOM 307 C6 DG A 10 6.317 1.888 3.486 1.00 0.54 C ATOM 308 O6 DG A 10 6.198 3.089 3.705 1.00 0.72 O ATOM 309 N1 DG A 10 5.774 1.337 2.339 1.00 0.49 N ATOM 310 C2 DG A 10 5.839 0.010 1.993 1.00 0.40 C ATOM 311 N2 DG A 10 5.268 -0.323 0.842 1.00 0.44 N ATOM 312 N3 DG A 10 6.435 -0.920 2.735 1.00 0.38 N ATOM 313 C4 DG A 10 6.972 -0.402 3.863 1.00 0.38 C ATOM 0 H5' DG A 10 5.791 -3.692 7.996 1.00 0.61 H new ATOM 0 H5'' DG A 10 7.266 -4.497 8.493 1.00 0.61 H new ATOM 0 H4' DG A 10 6.576 -5.100 6.260 1.00 0.58 H new ATOM 0 H3' DG A 10 9.180 -4.851 6.825 1.00 0.64 H new ATOM 0 H2' DG A 10 9.313 -2.413 6.427 1.00 0.59 H new ATOM 0 H2'' DG A 10 9.948 -3.103 4.946 1.00 0.59 H new ATOM 0 H1' DG A 10 7.969 -2.869 3.788 1.00 0.51 H new ATOM 0 H8 DG A 10 8.567 -0.440 6.657 1.00 0.47 H new ATOM 0 H1 DG A 10 5.287 1.966 1.700 1.00 0.49 H new ATOM 0 H21 DG A 10 5.282 -1.293 0.528 1.00 0.44 H new ATOM 0 H22 DG A 10 4.815 0.391 0.272 1.00 0.44 H new ATOM 325 P DT A 11 10.057 -5.850 4.305 1.00 1.01 P ATOM 326 OP1 DT A 11 10.806 -6.517 5.394 1.00 1.50 O ATOM 327 OP2 DT A 11 10.677 -4.726 3.569 1.00 1.29 O ATOM 328 O5' DT A 11 9.618 -6.971 3.229 1.00 0.88 O ATOM 329 C5' DT A 11 10.361 -7.142 2.011 1.00 0.79 C ATOM 330 C4' DT A 11 9.652 -6.512 0.808 1.00 0.62 C ATOM 331 O4' DT A 11 9.136 -5.218 1.162 1.00 0.57 O ATOM 332 C3' DT A 11 10.565 -6.304 -0.411 1.00 0.56 C ATOM 333 O3' DT A 11 9.836 -6.601 -1.617 1.00 0.63 O ATOM 334 C2' DT A 11 10.880 -4.817 -0.347 1.00 0.49 C ATOM 335 C1' DT A 11 9.553 -4.295 0.158 1.00 0.44 C ATOM 336 N1 DT A 11 9.613 -2.945 0.753 1.00 0.40 N ATOM 337 C2 DT A 11 8.900 -1.942 0.124 1.00 0.38 C ATOM 338 O2 DT A 11 8.264 -2.127 -0.912 1.00 0.45 O ATOM 339 N3 DT A 11 8.982 -0.698 0.697 1.00 0.41 N ATOM 340 C4 DT A 11 9.707 -0.359 1.819 1.00 0.42 C ATOM 341 O4 DT A 11 9.706 0.795 2.237 1.00 0.53 O ATOM 342 C5 DT A 11 10.426 -1.459 2.409 1.00 0.42 C ATOM 343 C7 DT A 11 11.310 -1.204 3.627 1.00 0.55 C ATOM 344 C6 DT A 11 10.356 -2.695 1.878 1.00 0.44 C ATOM 0 H5' DT A 11 10.512 -8.205 1.826 1.00 0.79 H new ATOM 0 H5'' DT A 11 11.349 -6.695 2.124 1.00 0.79 H new ATOM 0 H4' DT A 11 8.865 -7.216 0.539 1.00 0.62 H new ATOM 0 H3' DT A 11 11.453 -6.936 -0.409 1.00 0.56 H new ATOM 0 H2' DT A 11 11.703 -4.593 0.332 1.00 0.49 H new ATOM 0 H2'' DT A 11 11.148 -4.405 -1.320 1.00 0.49 H new ATOM 0 H1' DT A 11 8.870 -4.210 -0.687 1.00 0.44 H new ATOM 0 H3 DT A 11 8.454 0.050 0.248 1.00 0.41 H new ATOM 0 H71 DT A 11 11.699 -0.187 3.588 1.00 0.55 H new ATOM 0 H72 DT A 11 10.723 -1.333 4.536 1.00 0.55 H new ATOM 0 H73 DT A 11 12.140 -1.910 3.628 1.00 0.55 H new ATOM 0 H6 DT A 11 10.895 -3.504 2.347 1.00 0.44 H new ATOM 357 P DA A 12 10.380 -6.139 -3.071 1.00 0.75 P ATOM 358 OP1 DA A 12 9.705 -6.963 -4.099 1.00 0.96 O ATOM 359 OP2 DA A 12 11.859 -6.098 -3.022 1.00 0.88 O ATOM 360 O5' DA A 12 9.836 -4.616 -3.191 1.00 0.78 O ATOM 361 C5' DA A 12 8.967 -4.188 -4.261 1.00 0.70 C ATOM 362 C4' DA A 12 7.624 -4.931 -4.262 1.00 0.61 C ATOM 363 O4' DA A 12 7.402 -5.516 -2.979 1.00 0.74 O ATOM 364 C3' DA A 12 6.409 -4.049 -4.553 1.00 0.54 C ATOM 365 O3' DA A 12 6.147 -4.015 -5.973 1.00 0.59 O ATOM 366 C2' DA A 12 5.284 -4.774 -3.825 1.00 0.58 C ATOM 367 C1' DA A 12 6.012 -5.434 -2.648 1.00 0.60 C ATOM 368 N9 DA A 12 5.905 -4.698 -1.371 1.00 0.46 N ATOM 369 C8 DA A 12 5.703 -3.359 -1.165 1.00 0.43 C ATOM 370 N7 DA A 12 5.650 -3.021 0.090 1.00 0.46 N ATOM 371 C5 DA A 12 5.831 -4.217 0.769 1.00 0.46 C ATOM 372 C6 DA A 12 5.877 -4.530 2.135 1.00 0.55 C ATOM 373 N6 DA A 12 5.734 -3.618 3.094 1.00 0.67 N ATOM 374 N1 DA A 12 6.073 -5.816 2.466 1.00 0.58 N ATOM 375 C2 DA A 12 6.212 -6.718 1.501 1.00 0.54 C ATOM 376 N3 DA A 12 6.186 -6.549 0.188 1.00 0.51 N ATOM 377 C4 DA A 12 5.988 -5.248 -0.111 1.00 0.44 C ATOM 0 H5' DA A 12 9.467 -4.347 -5.216 1.00 0.70 H new ATOM 0 H5'' DA A 12 8.786 -3.117 -4.171 1.00 0.70 H new ATOM 0 H4' DA A 12 7.709 -5.666 -5.063 1.00 0.61 H new ATOM 0 H3' DA A 12 6.535 -3.014 -4.236 1.00 0.54 H new ATOM 0 H2' DA A 12 4.510 -4.084 -3.487 1.00 0.58 H new ATOM 0 H2'' DA A 12 4.797 -5.511 -4.464 1.00 0.58 H new ATOM 0 H1' DA A 12 5.540 -6.405 -2.498 1.00 0.60 H new ATOM 0 H8 DA A 12 5.597 -2.648 -1.971 1.00 0.43 H new ATOM 0 H61 DA A 12 5.776 -3.898 4.074 1.00 0.67 H new ATOM 0 H62 DA A 12 5.583 -2.640 2.849 1.00 0.67 H new ATOM 0 H2 DA A 12 6.368 -7.733 1.835 1.00 0.54 H new ATOM 389 P DG A 13 4.778 -3.382 -6.588 1.00 0.65 P ATOM 390 OP1 DG A 13 3.623 -4.099 -5.997 1.00 0.75 O ATOM 391 OP2 DG A 13 4.921 -3.324 -8.061 1.00 0.73 O ATOM 392 O5' DG A 13 4.768 -1.863 -6.032 1.00 0.85 O ATOM 393 C5' DG A 13 5.358 -0.790 -6.787 1.00 0.71 C ATOM 394 C4' DG A 13 4.477 0.471 -6.799 1.00 0.67 C ATOM 395 O4' DG A 13 3.945 0.694 -5.485 1.00 0.68 O ATOM 396 C3' DG A 13 5.236 1.745 -7.209 1.00 0.59 C ATOM 397 O3' DG A 13 4.518 2.494 -8.228 1.00 0.69 O ATOM 398 C2' DG A 13 5.360 2.556 -5.922 1.00 0.61 C ATOM 399 C1' DG A 13 4.189 2.050 -5.096 1.00 0.63 C ATOM 400 N9 DG A 13 4.424 2.068 -3.640 1.00 0.56 N ATOM 401 C8 DG A 13 4.758 1.029 -2.814 1.00 0.53 C ATOM 402 N7 DG A 13 4.875 1.365 -1.560 1.00 0.49 N ATOM 403 C5 DG A 13 4.599 2.729 -1.554 1.00 0.49 C ATOM 404 C6 DG A 13 4.571 3.647 -0.472 1.00 0.50 C ATOM 405 O6 DG A 13 4.779 3.427 0.717 1.00 0.51 O ATOM 406 N1 DG A 13 4.248 4.926 -0.896 1.00 0.59 N ATOM 407 C2 DG A 13 3.983 5.282 -2.198 1.00 0.64 C ATOM 408 N2 DG A 13 3.688 6.561 -2.411 1.00 0.75 N ATOM 409 N3 DG A 13 4.009 4.423 -3.219 1.00 0.61 N ATOM 410 C4 DG A 13 4.323 3.167 -2.823 1.00 0.54 C ATOM 0 H5' DG A 13 5.528 -1.121 -7.812 1.00 0.71 H new ATOM 0 H5'' DG A 13 6.333 -0.545 -6.365 1.00 0.71 H new ATOM 0 H4' DG A 13 3.696 0.287 -7.537 1.00 0.67 H new ATOM 0 H3' DG A 13 6.206 1.511 -7.647 1.00 0.59 H new ATOM 0 H2' DG A 13 6.313 2.381 -5.423 1.00 0.61 H new ATOM 0 H2'' DG A 13 5.290 3.627 -6.110 1.00 0.61 H new ATOM 0 H1' DG A 13 3.348 2.717 -5.286 1.00 0.63 H new ATOM 0 H8 DG A 13 4.911 0.021 -3.170 1.00 0.53 H new ATOM 0 H1 DG A 13 4.203 5.660 -0.189 1.00 0.59 H new ATOM 0 H21 DG A 13 3.482 6.886 -3.355 1.00 0.75 H new ATOM 0 H22 DG A 13 3.668 7.217 -1.630 1.00 0.75 H new ATOM 422 P DG A 14 3.036 3.138 -8.036 1.00 0.58 P ATOM 423 OP1 DG A 14 2.848 4.181 -9.072 1.00 1.00 O ATOM 424 OP2 DG A 14 2.830 3.486 -6.614 1.00 0.63 O ATOM 425 O5' DG A 14 2.062 1.906 -8.406 1.00 0.75 O ATOM 426 C5' DG A 14 2.055 1.353 -9.733 1.00 0.65 C ATOM 427 C4' DG A 14 1.150 0.124 -9.840 1.00 0.48 C ATOM 428 O4' DG A 14 1.452 -0.777 -8.769 1.00 0.57 O ATOM 429 C3' DG A 14 -0.355 0.431 -9.767 1.00 0.43 C ATOM 430 O3' DG A 14 -1.046 -0.277 -10.813 1.00 0.42 O ATOM 431 C2' DG A 14 -0.779 -0.114 -8.412 1.00 0.48 C ATOM 432 C1' DG A 14 0.225 -1.237 -8.216 1.00 0.48 C ATOM 433 N9 DG A 14 0.465 -1.602 -6.809 1.00 0.52 N ATOM 434 C8 DG A 14 0.477 -2.850 -6.252 1.00 0.60 C ATOM 435 N7 DG A 14 0.701 -2.855 -4.969 1.00 0.62 N ATOM 436 C5 DG A 14 0.851 -1.511 -4.649 1.00 0.55 C ATOM 437 C6 DG A 14 1.113 -0.899 -3.394 1.00 0.56 C ATOM 438 O6 DG A 14 1.256 -1.438 -2.300 1.00 0.60 O ATOM 439 N1 DG A 14 1.188 0.479 -3.505 1.00 0.52 N ATOM 440 C2 DG A 14 1.033 1.184 -4.677 1.00 0.50 C ATOM 441 N2 DG A 14 1.139 2.503 -4.588 1.00 0.52 N ATOM 442 N3 DG A 14 0.787 0.615 -5.857 1.00 0.48 N ATOM 443 C4 DG A 14 0.709 -0.733 -5.769 1.00 0.50 C ATOM 0 H5' DG A 14 3.071 1.080 -10.017 1.00 0.65 H new ATOM 0 H5'' DG A 14 1.720 2.112 -10.440 1.00 0.65 H new ATOM 0 H4' DG A 14 1.350 -0.301 -10.824 1.00 0.48 H new ATOM 0 H3' DG A 14 -0.577 1.492 -9.885 1.00 0.43 H new ATOM 0 H2' DG A 14 -0.712 0.639 -7.627 1.00 0.48 H new ATOM 0 H2'' DG A 14 -1.807 -0.478 -8.418 1.00 0.48 H new ATOM 0 H1' DG A 14 -0.175 -2.131 -8.695 1.00 0.48 H new ATOM 0 H8 DG A 14 0.315 -3.751 -6.825 1.00 0.60 H new ATOM 0 H1 DG A 14 1.372 1.012 -2.655 1.00 0.52 H new ATOM 0 H21 DG A 14 1.034 3.081 -5.422 1.00 0.52 H new ATOM 0 H22 DG A 14 1.326 2.940 -3.685 1.00 0.52 H new ATOM 455 P DG A 15 -2.657 -0.208 -10.944 1.00 0.53 P ATOM 456 OP1 DG A 15 -3.022 -0.479 -12.354 1.00 0.69 O ATOM 457 OP2 DG A 15 -3.119 1.038 -10.288 1.00 0.66 O ATOM 458 O5' DG A 15 -3.146 -1.458 -10.043 1.00 0.55 O ATOM 459 C5' DG A 15 -2.923 -2.810 -10.471 1.00 0.59 C ATOM 460 C4' DG A 15 -3.362 -3.829 -9.411 1.00 0.51 C ATOM 461 O4' DG A 15 -2.708 -3.532 -8.168 1.00 0.49 O ATOM 462 C3' DG A 15 -4.874 -3.850 -9.128 1.00 0.55 C ATOM 463 O3' DG A 15 -5.322 -5.215 -8.974 1.00 0.69 O ATOM 464 C2' DG A 15 -4.998 -3.097 -7.826 1.00 0.52 C ATOM 465 C1' DG A 15 -3.697 -3.471 -7.141 1.00 0.43 C ATOM 466 N9 DG A 15 -3.254 -2.497 -6.129 1.00 0.38 N ATOM 467 C8 DG A 15 -3.356 -1.131 -6.156 1.00 0.43 C ATOM 468 N7 DG A 15 -2.913 -0.546 -5.082 1.00 0.43 N ATOM 469 C5 DG A 15 -2.483 -1.597 -4.283 1.00 0.38 C ATOM 470 C6 DG A 15 -1.904 -1.574 -2.989 1.00 0.39 C ATOM 471 O6 DG A 15 -1.657 -0.601 -2.281 1.00 0.45 O ATOM 472 N1 DG A 15 -1.613 -2.849 -2.540 1.00 0.39 N ATOM 473 C2 DG A 15 -1.847 -4.008 -3.241 1.00 0.36 C ATOM 474 N2 DG A 15 -1.498 -5.142 -2.642 1.00 0.41 N ATOM 475 N3 DG A 15 -2.392 -4.037 -4.457 1.00 0.35 N ATOM 476 C4 DG A 15 -2.684 -2.797 -4.915 1.00 0.35 C ATOM 0 H5' DG A 15 -1.865 -2.950 -10.692 1.00 0.59 H new ATOM 0 H5'' DG A 15 -3.469 -2.992 -11.397 1.00 0.59 H new ATOM 0 H4' DG A 15 -3.088 -4.802 -9.819 1.00 0.51 H new ATOM 0 H3' DG A 15 -5.474 -3.411 -9.925 1.00 0.55 H new ATOM 0 H2' DG A 15 -5.087 -2.022 -7.980 1.00 0.52 H new ATOM 0 H2'' DG A 15 -5.870 -3.410 -7.252 1.00 0.52 H new ATOM 0 H1' DG A 15 -3.845 -4.413 -6.614 1.00 0.43 H new ATOM 0 H8 DG A 15 -3.768 -0.588 -6.994 1.00 0.43 H new ATOM 0 H1 DG A 15 -1.191 -2.936 -1.615 1.00 0.39 H new ATOM 0 H21 DG A 15 -1.647 -6.034 -3.113 1.00 0.41 H new ATOM 0 H22 DG A 15 -1.081 -5.120 -1.711 1.00 0.41 H new ATOM 488 P DT A 16 -6.722 -5.574 -8.242 1.00 0.83 P ATOM 489 OP1 DT A 16 -7.107 -6.952 -8.623 1.00 1.12 O ATOM 490 OP2 DT A 16 -7.664 -4.452 -8.472 1.00 0.95 O ATOM 491 O5' DT A 16 -6.297 -5.574 -6.680 1.00 0.75 O ATOM 492 C5' DT A 16 -7.270 -5.413 -5.634 1.00 0.74 C ATOM 493 C4' DT A 16 -6.638 -4.866 -4.350 1.00 0.57 C ATOM 494 O4' DT A 16 -6.093 -3.574 -4.609 1.00 0.46 O ATOM 495 C3' DT A 16 -7.628 -4.724 -3.188 1.00 0.54 C ATOM 496 O3' DT A 16 -7.209 -5.570 -2.105 1.00 0.58 O ATOM 497 C2' DT A 16 -7.517 -3.237 -2.741 1.00 0.56 C ATOM 498 C1' DT A 16 -6.239 -2.770 -3.442 1.00 0.47 C ATOM 499 N1 DT A 16 -6.286 -1.362 -3.891 1.00 0.43 N ATOM 500 C2 DT A 16 -5.597 -0.414 -3.153 1.00 0.50 C ATOM 501 O2 DT A 16 -4.971 -0.697 -2.137 1.00 0.59 O ATOM 502 N3 DT A 16 -5.661 0.881 -3.622 1.00 0.55 N ATOM 503 C4 DT A 16 -6.342 1.310 -4.743 1.00 0.55 C ATOM 504 O4 DT A 16 -6.333 2.495 -5.061 1.00 0.67 O ATOM 505 C5 DT A 16 -7.033 0.257 -5.451 1.00 0.50 C ATOM 506 C7 DT A 16 -7.822 0.592 -6.715 1.00 0.66 C ATOM 507 C6 DT A 16 -6.987 -1.017 -5.015 1.00 0.45 C ATOM 0 H5' DT A 16 -7.743 -6.373 -5.426 1.00 0.74 H new ATOM 0 H5'' DT A 16 -8.056 -4.736 -5.969 1.00 0.74 H new ATOM 0 H4' DT A 16 -5.877 -5.588 -4.055 1.00 0.57 H new ATOM 0 H3' DT A 16 -8.643 -5.000 -3.473 1.00 0.54 H new ATOM 0 H2' DT A 16 -8.385 -2.655 -3.051 1.00 0.56 H new ATOM 0 H2'' DT A 16 -7.442 -3.144 -1.658 1.00 0.56 H new ATOM 0 H1' DT A 16 -5.419 -2.859 -2.729 1.00 0.47 H new ATOM 0 H3 DT A 16 -5.157 1.590 -3.089 1.00 0.55 H new ATOM 0 H71 DT A 16 -7.819 -0.268 -7.384 1.00 0.66 H new ATOM 0 H72 DT A 16 -8.849 0.840 -6.448 1.00 0.66 H new ATOM 0 H73 DT A 16 -7.362 1.443 -7.216 1.00 0.66 H new ATOM 0 H6 DT A 16 -7.515 -1.783 -5.564 1.00 0.45 H new ATOM 520 P DA A 17 -8.293 -6.203 -1.085 1.00 0.65 P ATOM 521 OP1 DA A 17 -7.649 -7.319 -0.356 1.00 0.93 O ATOM 522 OP2 DA A 17 -9.546 -6.442 -1.838 1.00 0.72 O ATOM 523 O5' DA A 17 -8.551 -5.003 -0.032 1.00 0.67 O ATOM 524 C5' DA A 17 -7.466 -4.460 0.735 1.00 0.77 C ATOM 525 C4' DA A 17 -7.944 -3.658 1.955 1.00 0.75 C ATOM 526 O4' DA A 17 -8.826 -2.615 1.530 1.00 0.72 O ATOM 527 C3' DA A 17 -8.708 -4.474 2.998 1.00 0.72 C ATOM 528 O3' DA A 17 -8.514 -3.887 4.304 1.00 0.85 O ATOM 529 C2' DA A 17 -10.155 -4.317 2.557 1.00 0.64 C ATOM 530 C1' DA A 17 -10.157 -2.903 1.988 1.00 0.65 C ATOM 531 N9 DA A 17 -11.068 -2.722 0.843 1.00 0.58 N ATOM 532 C8 DA A 17 -11.023 -3.315 -0.391 1.00 0.54 C ATOM 533 N7 DA A 17 -11.981 -2.939 -1.194 1.00 0.64 N ATOM 534 C5 DA A 17 -12.713 -2.032 -0.434 1.00 0.72 C ATOM 535 C6 DA A 17 -13.862 -1.270 -0.708 1.00 0.92 C ATOM 536 N6 DA A 17 -14.502 -1.306 -1.877 1.00 1.05 N ATOM 537 N1 DA A 17 -14.321 -0.474 0.269 1.00 1.07 N ATOM 538 C2 DA A 17 -13.681 -0.441 1.433 1.00 1.05 C ATOM 539 N3 DA A 17 -12.599 -1.104 1.810 1.00 0.89 N ATOM 540 C4 DA A 17 -12.162 -1.894 0.808 1.00 0.70 C ATOM 0 H5' DA A 17 -6.862 -3.816 0.096 1.00 0.77 H new ATOM 0 H5'' DA A 17 -6.821 -5.272 1.070 1.00 0.77 H new ATOM 0 H4' DA A 17 -7.030 -3.287 2.419 1.00 0.75 H new ATOM 0 H3' DA A 17 -8.391 -5.515 3.066 1.00 0.72 H new ATOM 0 H2' DA A 17 -10.437 -5.059 1.810 1.00 0.64 H new ATOM 0 H2'' DA A 17 -10.850 -4.423 3.390 1.00 0.64 H new ATOM 0 H1' DA A 17 -10.498 -2.238 2.782 1.00 0.65 H new ATOM 0 H8 DA A 17 -10.264 -4.029 -0.674 1.00 0.54 H new ATOM 0 H61 DA A 17 -15.332 -0.731 -2.022 1.00 1.05 H new ATOM 0 H62 DA A 17 -14.161 -1.908 -2.627 1.00 1.05 H new ATOM 0 H2 DA A 17 -14.103 0.220 2.176 1.00 1.05 H new ATOM 552 P DI A 18 -9.377 -4.352 5.594 1.00 0.92 P ATOM 553 OP1 DI A 18 -10.320 -5.413 5.170 1.00 1.30 O ATOM 554 OP2 DI A 18 -9.897 -3.137 6.265 1.00 1.02 O ATOM 555 O5' DI A 18 -8.272 -5.027 6.557 1.00 1.40 O ATOM 556 C5' DI A 18 -7.048 -4.350 6.880 1.00 1.24 C ATOM 557 C4' DI A 18 -5.836 -5.089 6.310 1.00 0.87 C ATOM 558 O4' DI A 18 -5.827 -4.962 4.882 1.00 0.65 O ATOM 559 C3' DI A 18 -4.478 -4.573 6.819 1.00 0.71 C ATOM 560 O3' DI A 18 -3.697 -5.691 7.289 1.00 0.69 O ATOM 561 C2' DI A 18 -3.832 -3.955 5.586 1.00 0.66 C ATOM 562 C1' DI A 18 -4.481 -4.751 4.473 1.00 0.53 C ATOM 563 N9 DI A 18 -4.491 -4.056 3.169 1.00 0.46 N ATOM 564 C8 DI A 18 -4.546 -2.709 2.909 1.00 0.54 C ATOM 565 N7 DI A 18 -4.490 -2.412 1.643 1.00 0.56 N ATOM 566 C5 DI A 18 -4.394 -3.648 1.014 1.00 0.47 C ATOM 567 C6 DI A 18 -4.304 -3.961 -0.368 1.00 0.53 C ATOM 568 O6 DI A 18 -4.274 -3.198 -1.328 1.00 0.65 O ATOM 569 N1 DI A 18 -4.229 -5.325 -0.566 1.00 0.52 N ATOM 570 C2 DI A 18 -4.241 -6.264 0.438 1.00 0.49 C ATOM 571 N3 DI A 18 -4.322 -5.994 1.727 1.00 0.44 N ATOM 572 C4 DI A 18 -4.396 -4.660 1.943 1.00 0.42 C ATOM 0 H5'' DI A 18 -7.076 -3.335 6.484 1.00 1.24 H new ATOM 0 H2'' DI A 18 -4.042 -2.889 5.504 1.00 0.66 H new ATOM 0 H8 DI A 18 -4.629 -1.956 3.693 1.00 0.54 H new ATOM 0 H5' DI A 18 -6.950 -4.268 7.962 1.00 1.24 H new ATOM 0 H4' DI A 18 -5.945 -6.121 6.643 1.00 0.87 H new ATOM 0 H3' DI A 18 -4.562 -3.862 7.641 1.00 0.71 H new ATOM 0 H2' DI A 18 -2.748 -4.067 5.592 1.00 0.66 H new ATOM 0 H2 DI A 18 -4.179 -7.313 0.147 1.00 0.49 H new ATOM 0 H1' DI A 18 -3.913 -5.669 4.321 1.00 0.53 H new ATOM 0 H1 DI A 18 -4.160 -5.660 -1.527 1.00 0.52 H new ATOM 583 P DG A 19 -2.086 -5.629 7.461 1.00 0.61 P ATOM 584 OP1 DG A 19 -1.728 -6.304 8.731 1.00 0.79 O ATOM 585 OP2 DG A 19 -1.622 -4.243 7.211 1.00 0.67 O ATOM 586 O5' DG A 19 -1.574 -6.569 6.247 1.00 0.64 O ATOM 587 C5' DG A 19 -2.027 -7.930 6.151 1.00 0.68 C ATOM 588 C4' DG A 19 -1.381 -8.692 4.987 1.00 0.57 C ATOM 589 O4' DG A 19 -1.704 -8.055 3.741 1.00 0.54 O ATOM 590 C3' DG A 19 0.151 -8.787 5.059 1.00 0.55 C ATOM 591 O3' DG A 19 0.554 -10.141 4.764 1.00 0.62 O ATOM 592 C2' DG A 19 0.617 -7.846 3.952 1.00 0.45 C ATOM 593 C1' DG A 19 -0.516 -8.013 2.956 1.00 0.44 C ATOM 594 N9 DG A 19 -0.640 -6.908 1.990 1.00 0.41 N ATOM 595 C8 DG A 19 -0.668 -6.960 0.622 1.00 0.48 C ATOM 596 N7 DG A 19 -0.767 -5.792 0.050 1.00 0.50 N ATOM 597 C5 DG A 19 -0.809 -4.901 1.121 1.00 0.42 C ATOM 598 C6 DG A 19 -0.913 -3.484 1.131 1.00 0.44 C ATOM 599 O6 DG A 19 -0.975 -2.715 0.181 1.00 0.51 O ATOM 600 N1 DG A 19 -0.923 -2.984 2.420 1.00 0.44 N ATOM 601 C2 DG A 19 -0.837 -3.746 3.564 1.00 0.47 C ATOM 602 N2 DG A 19 -0.852 -3.089 4.717 1.00 0.59 N ATOM 603 N3 DG A 19 -0.739 -5.071 3.560 1.00 0.45 N ATOM 604 C4 DG A 19 -0.731 -5.580 2.309 1.00 0.40 C ATOM 0 H5' DG A 19 -3.110 -7.940 6.029 1.00 0.68 H new ATOM 0 H5'' DG A 19 -1.807 -8.448 7.085 1.00 0.68 H new ATOM 0 H4' DG A 19 -1.784 -9.702 5.058 1.00 0.57 H new ATOM 0 H3' DG A 19 0.563 -8.528 6.034 1.00 0.55 H new ATOM 0 H2' DG A 19 0.718 -6.817 4.297 1.00 0.45 H new ATOM 0 H2'' DG A 19 1.581 -8.139 3.537 1.00 0.45 H new ATOM 0 H1' DG A 19 -0.331 -8.908 2.362 1.00 0.44 H new ATOM 0 H8 DG A 19 -0.613 -7.885 0.067 1.00 0.48 H new ATOM 0 H1 DG A 19 -1.000 -1.973 2.532 1.00 0.44 H new ATOM 0 H21 DG A 19 -0.791 -3.601 5.597 1.00 0.59 H new ATOM 0 H22 DG A 19 -0.924 -2.072 4.723 1.00 0.59 H new ATOM 616 P DG A 20 2.100 -10.523 4.483 1.00 0.68 P ATOM 617 OP1 DG A 20 2.275 -11.972 4.730 1.00 0.79 O ATOM 618 OP2 DG A 20 2.954 -9.546 5.193 1.00 0.79 O ATOM 619 O5' DG A 20 2.245 -10.260 2.899 1.00 0.64 O ATOM 620 C5' DG A 20 1.552 -11.090 1.960 1.00 0.61 C ATOM 621 C4' DG A 20 2.037 -10.854 0.531 1.00 0.57 C ATOM 622 O4' DG A 20 1.748 -9.503 0.145 1.00 0.57 O ATOM 623 C3' DG A 20 3.540 -11.053 0.343 1.00 0.60 C ATOM 624 O3' DG A 20 3.833 -11.563 -0.963 1.00 0.73 O ATOM 625 C2' DG A 20 4.078 -9.641 0.509 1.00 0.53 C ATOM 626 C1' DG A 20 2.978 -8.846 -0.171 1.00 0.48 C ATOM 627 N9 DG A 20 2.857 -7.440 0.268 1.00 0.43 N ATOM 628 C8 DG A 20 3.010 -6.903 1.523 1.00 0.47 C ATOM 629 N7 DG A 20 2.808 -5.617 1.575 1.00 0.46 N ATOM 630 C5 DG A 20 2.500 -5.274 0.265 1.00 0.39 C ATOM 631 C6 DG A 20 2.185 -4.009 -0.296 1.00 0.42 C ATOM 632 O6 DG A 20 2.111 -2.922 0.266 1.00 0.48 O ATOM 633 N1 DG A 20 1.943 -4.105 -1.656 1.00 0.47 N ATOM 634 C2 DG A 20 1.997 -5.268 -2.390 1.00 0.50 C ATOM 635 N2 DG A 20 1.742 -5.161 -3.686 1.00 0.63 N ATOM 636 N3 DG A 20 2.289 -6.456 -1.867 1.00 0.46 N ATOM 637 C4 DG A 20 2.529 -6.384 -0.540 1.00 0.40 C ATOM 0 H5' DG A 20 0.482 -10.891 2.019 1.00 0.61 H new ATOM 0 H5'' DG A 20 1.696 -12.138 2.225 1.00 0.61 H new ATOM 0 H4' DG A 20 1.515 -11.591 -0.079 1.00 0.57 H new ATOM 0 H3' DG A 20 3.975 -11.772 1.038 1.00 0.60 H new ATOM 0 H2' DG A 20 4.203 -9.365 1.556 1.00 0.53 H new ATOM 0 H2'' DG A 20 5.046 -9.506 0.026 1.00 0.53 H new ATOM 0 HO3' DG A 20 4.801 -11.680 -1.059 1.00 0.73 H new ATOM 0 H1' DG A 20 3.217 -8.811 -1.234 1.00 0.48 H new ATOM 0 H8 DG A 20 3.274 -7.493 2.388 1.00 0.47 H new ATOM 0 H1 DG A 20 1.706 -3.246 -2.153 1.00 0.47 H new ATOM 0 H21 DG A 20 1.767 -5.989 -4.281 1.00 0.63 H new ATOM 0 H22 DG A 20 1.520 -4.250 -4.089 1.00 0.63 H new TER 650 DG A 20