USER MOD reduce.3.24.130724 H: found=0, std=0, add=222, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 222 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 180:sc= 0 USER MOD Single : A 12 DT C7 :methyl -30:sc= -0.41 (180deg=-1.6) USER MOD Single : A 20 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 4.145 8.599 -5.794 1.00 0.43 O ATOM 2 C5' DA A 1 4.568 7.437 -6.511 1.00 0.36 C ATOM 3 C4' DA A 1 3.394 6.529 -6.846 1.00 0.29 C ATOM 4 O4' DA A 1 2.854 5.994 -5.640 1.00 0.25 O ATOM 5 C3' DA A 1 2.245 7.227 -7.593 1.00 0.31 C ATOM 6 O3' DA A 1 2.005 6.574 -8.852 1.00 0.30 O ATOM 7 C2' DA A 1 1.027 7.066 -6.679 1.00 0.31 C ATOM 8 C1' DA A 1 1.440 5.910 -5.779 1.00 0.23 C ATOM 9 N9 DA A 1 0.870 5.961 -4.424 1.00 0.22 N ATOM 10 C8 DA A 1 1.374 5.419 -3.278 1.00 0.23 C ATOM 11 N7 DA A 1 0.658 5.660 -2.218 1.00 0.26 N ATOM 12 C5 DA A 1 -0.401 6.420 -2.696 1.00 0.28 C ATOM 13 C6 DA A 1 -1.515 6.999 -2.062 1.00 0.35 C ATOM 14 N6 DA A 1 -1.745 6.900 -0.748 1.00 0.40 N ATOM 15 N1 DA A 1 -2.373 7.683 -2.836 1.00 0.40 N ATOM 16 C2 DA A 1 -2.132 7.784 -4.141 1.00 0.35 C ATOM 17 N3 DA A 1 -1.125 7.291 -4.846 1.00 0.28 N ATOM 18 C4 DA A 1 -0.284 6.608 -4.044 1.00 0.25 C ATOM 0 H5' DA A 1 5.297 6.886 -5.916 1.00 0.36 H new ATOM 0 H5'' DA A 1 5.070 7.738 -7.430 1.00 0.36 H new ATOM 0 H4' DA A 1 3.797 5.761 -7.506 1.00 0.29 H new ATOM 0 H3' DA A 1 2.467 8.272 -7.807 1.00 0.31 H new ATOM 0 H2' DA A 1 0.825 7.972 -6.108 1.00 0.31 H new ATOM 0 H2'' DA A 1 0.123 6.837 -7.244 1.00 0.31 H new ATOM 0 HO5' DA A 1 4.923 9.160 -5.593 1.00 0.43 H new ATOM 0 H1' DA A 1 1.079 4.990 -6.240 1.00 0.23 H new ATOM 0 H8 DA A 1 2.286 4.841 -3.253 1.00 0.23 H new ATOM 0 H61 DA A 1 -2.570 7.340 -0.340 1.00 0.40 H new ATOM 0 H62 DA A 1 -1.096 6.384 -0.154 1.00 0.40 H new ATOM 0 H2 DA A 1 -2.861 8.348 -4.705 1.00 0.35 H new ATOM 31 P DG A 2 1.938 4.967 -8.952 1.00 0.25 P ATOM 32 OP1 DG A 2 0.532 4.543 -8.762 1.00 0.30 O ATOM 33 OP2 DG A 2 2.993 4.421 -8.086 1.00 0.24 O ATOM 34 O5' DG A 2 2.354 4.672 -10.480 1.00 0.25 O ATOM 35 C5' DG A 2 3.682 4.944 -10.945 1.00 0.23 C ATOM 36 C4' DG A 2 4.677 3.842 -10.561 1.00 0.20 C ATOM 37 O4' DG A 2 4.861 3.809 -9.140 1.00 0.20 O ATOM 38 C3' DG A 2 4.263 2.428 -10.990 1.00 0.20 C ATOM 39 O3' DG A 2 5.376 1.801 -11.644 1.00 0.22 O ATOM 40 C2' DG A 2 3.952 1.718 -9.676 1.00 0.20 C ATOM 41 C1' DG A 2 4.889 2.441 -8.733 1.00 0.20 C ATOM 42 N9 DG A 2 4.535 2.377 -7.293 1.00 0.20 N ATOM 43 C8 DG A 2 5.390 2.341 -6.227 1.00 0.23 C ATOM 44 N7 DG A 2 4.800 2.340 -5.064 1.00 0.23 N ATOM 45 C5 DG A 2 3.445 2.376 -5.377 1.00 0.20 C ATOM 46 C6 DG A 2 2.313 2.398 -4.519 1.00 0.19 C ATOM 47 O6 DG A 2 2.285 2.387 -3.291 1.00 0.20 O ATOM 48 N1 DG A 2 1.129 2.440 -5.238 1.00 0.17 N ATOM 49 C2 DG A 2 1.037 2.456 -6.610 1.00 0.17 C ATOM 50 N2 DG A 2 -0.193 2.501 -7.119 1.00 0.17 N ATOM 51 N3 DG A 2 2.097 2.433 -7.419 1.00 0.18 N ATOM 52 C4 DG A 2 3.269 2.394 -6.739 1.00 0.19 C ATOM 0 H5' DG A 2 4.020 5.894 -10.532 1.00 0.23 H new ATOM 0 H5'' DG A 2 3.668 5.055 -12.029 1.00 0.23 H new ATOM 0 H4' DG A 2 5.591 4.103 -11.095 1.00 0.20 H new ATOM 0 H3' DG A 2 3.418 2.409 -11.678 1.00 0.20 H new ATOM 0 H2' DG A 2 2.907 1.827 -9.385 1.00 0.20 H new ATOM 0 H2'' DG A 2 4.159 0.649 -9.725 1.00 0.20 H new ATOM 0 H1' DG A 2 5.863 1.956 -8.802 1.00 0.20 H new ATOM 0 H8 DG A 2 6.464 2.316 -6.339 1.00 0.23 H new ATOM 0 H1 DG A 2 0.258 2.461 -4.708 1.00 0.17 H new ATOM 0 H21 DG A 2 -0.326 2.515 -8.130 1.00 0.17 H new ATOM 0 H22 DG A 2 -1.002 2.522 -6.498 1.00 0.17 H new ATOM 64 P DG A 3 5.353 0.236 -12.026 1.00 0.25 P ATOM 65 OP1 DG A 3 6.139 0.048 -13.266 1.00 0.28 O ATOM 66 OP2 DG A 3 3.953 -0.239 -11.962 1.00 0.27 O ATOM 67 O5' DG A 3 6.169 -0.432 -10.809 1.00 0.27 O ATOM 68 C5' DG A 3 7.573 -0.196 -10.652 1.00 0.25 C ATOM 69 C4' DG A 3 8.126 -0.932 -9.436 1.00 0.26 C ATOM 70 O4' DG A 3 7.296 -0.659 -8.301 1.00 0.25 O ATOM 71 C3' DG A 3 8.181 -2.449 -9.609 1.00 0.29 C ATOM 72 O3' DG A 3 9.396 -2.955 -9.045 1.00 0.31 O ATOM 73 C2' DG A 3 6.990 -2.959 -8.815 1.00 0.29 C ATOM 74 C1' DG A 3 6.844 -1.894 -7.739 1.00 0.26 C ATOM 75 N9 DG A 3 5.454 -1.700 -7.285 1.00 0.25 N ATOM 76 C8 DG A 3 4.338 -1.440 -8.037 1.00 0.27 C ATOM 77 N7 DG A 3 3.241 -1.341 -7.340 1.00 0.26 N ATOM 78 C5 DG A 3 3.658 -1.549 -6.029 1.00 0.24 C ATOM 79 C6 DG A 3 2.901 -1.560 -4.826 1.00 0.23 C ATOM 80 O6 DG A 3 1.691 -1.384 -4.684 1.00 0.25 O ATOM 81 N1 DG A 3 3.704 -1.808 -3.721 1.00 0.24 N ATOM 82 C2 DG A 3 5.066 -2.018 -3.765 1.00 0.24 C ATOM 83 N2 DG A 3 5.668 -2.239 -2.597 1.00 0.26 N ATOM 84 N3 DG A 3 5.780 -2.009 -4.897 1.00 0.24 N ATOM 85 C4 DG A 3 5.012 -1.768 -5.985 1.00 0.23 C ATOM 0 H5' DG A 3 7.755 0.874 -10.546 1.00 0.25 H new ATOM 0 H5'' DG A 3 8.101 -0.522 -11.548 1.00 0.25 H new ATOM 0 H4' DG A 3 9.146 -0.572 -9.303 1.00 0.26 H new ATOM 0 H3' DG A 3 8.152 -2.757 -10.654 1.00 0.29 H new ATOM 0 H2' DG A 3 6.095 -3.041 -9.431 1.00 0.29 H new ATOM 0 H2'' DG A 3 7.176 -3.945 -8.390 1.00 0.29 H new ATOM 0 H1' DG A 3 7.423 -2.216 -6.873 1.00 0.26 H new ATOM 0 H8 DG A 3 4.365 -1.327 -9.111 1.00 0.27 H new ATOM 0 H1 DG A 3 3.252 -1.837 -2.807 1.00 0.24 H new ATOM 0 H21 DG A 3 6.674 -2.401 -2.565 1.00 0.26 H new ATOM 0 H22 DG A 3 5.122 -2.246 -1.735 1.00 0.26 H new ATOM 97 P DG A 4 9.765 -4.518 -9.176 1.00 0.34 P ATOM 98 OP1 DG A 4 11.227 -4.637 -9.373 1.00 0.41 O ATOM 99 OP2 DG A 4 8.838 -5.130 -10.154 1.00 0.40 O ATOM 100 O5' DG A 4 9.404 -5.090 -7.716 1.00 0.28 O ATOM 101 C5' DG A 4 10.278 -4.852 -6.609 1.00 0.28 C ATOM 102 C4' DG A 4 9.790 -5.563 -5.350 1.00 0.28 C ATOM 103 O4' DG A 4 8.490 -5.077 -4.999 1.00 0.25 O ATOM 104 C3' DG A 4 9.681 -7.084 -5.499 1.00 0.32 C ATOM 105 O3' DG A 4 10.264 -7.717 -4.353 1.00 0.36 O ATOM 106 C2' DG A 4 8.182 -7.348 -5.530 1.00 0.30 C ATOM 107 C1' DG A 4 7.663 -6.195 -4.693 1.00 0.25 C ATOM 108 N9 DG A 4 6.265 -5.820 -4.977 1.00 0.22 N ATOM 109 C8 DG A 4 5.702 -5.452 -6.169 1.00 0.24 C ATOM 110 N7 DG A 4 4.430 -5.177 -6.090 1.00 0.23 N ATOM 111 C5 DG A 4 4.127 -5.378 -4.748 1.00 0.19 C ATOM 112 C6 DG A 4 2.889 -5.234 -4.063 1.00 0.17 C ATOM 113 O6 DG A 4 1.800 -4.896 -4.522 1.00 0.18 O ATOM 114 N1 DG A 4 3.018 -5.534 -2.713 1.00 0.18 N ATOM 115 C2 DG A 4 4.188 -5.925 -2.097 1.00 0.22 C ATOM 116 N2 DG A 4 4.115 -6.173 -0.789 1.00 0.28 N ATOM 117 N3 DG A 4 5.352 -6.062 -2.740 1.00 0.22 N ATOM 118 C4 DG A 4 5.246 -5.772 -4.058 1.00 0.20 C ATOM 0 H5' DG A 4 10.345 -3.781 -6.420 1.00 0.28 H new ATOM 0 H5'' DG A 4 11.282 -5.196 -6.856 1.00 0.28 H new ATOM 0 H4' DG A 4 10.536 -5.351 -4.584 1.00 0.28 H new ATOM 0 H3' DG A 4 10.192 -7.465 -6.383 1.00 0.32 H new ATOM 0 H2' DG A 4 7.782 -7.333 -6.544 1.00 0.30 H new ATOM 0 H2'' DG A 4 7.926 -8.316 -5.101 1.00 0.30 H new ATOM 0 H1' DG A 4 7.690 -6.499 -3.647 1.00 0.25 H new ATOM 0 H8 DG A 4 6.261 -5.395 -7.091 1.00 0.24 H new ATOM 0 H1 DG A 4 2.183 -5.459 -2.132 1.00 0.18 H new ATOM 0 H21 DG A 4 4.948 -6.466 -0.278 1.00 0.28 H new ATOM 0 H22 DG A 4 3.226 -6.070 -0.299 1.00 0.28 H new ATOM 130 P DI A 5 10.191 -9.317 -4.172 1.00 0.42 P ATOM 131 OP1 DI A 5 11.150 -9.706 -3.114 1.00 0.49 O ATOM 132 OP2 DI A 5 10.278 -9.939 -5.512 1.00 0.51 O ATOM 133 O5' DI A 5 8.700 -9.541 -3.607 1.00 0.33 O ATOM 134 C5' DI A 5 8.303 -8.966 -2.359 1.00 0.27 C ATOM 135 C4' DI A 5 6.786 -8.975 -2.194 1.00 0.23 C ATOM 136 O4' DI A 5 6.176 -8.388 -3.348 1.00 0.21 O ATOM 137 C3' DI A 5 6.187 -10.377 -2.027 1.00 0.26 C ATOM 138 O3' DI A 5 5.366 -10.404 -0.855 1.00 0.34 O ATOM 139 C2' DI A 5 5.325 -10.582 -3.269 1.00 0.25 C ATOM 140 C1' DI A 5 5.023 -9.152 -3.683 1.00 0.25 C ATOM 141 N9 DI A 5 4.770 -8.984 -5.126 1.00 0.30 N ATOM 142 C8 DI A 5 5.504 -9.450 -6.186 1.00 0.35 C ATOM 143 N7 DI A 5 5.013 -9.133 -7.351 1.00 0.42 N ATOM 144 C5 DI A 5 3.869 -8.402 -7.044 1.00 0.43 C ATOM 145 C6 DI A 5 2.920 -7.793 -7.909 1.00 0.53 C ATOM 146 O6 DI A 5 2.902 -7.779 -9.137 1.00 0.62 O ATOM 147 N1 DI A 5 1.923 -7.157 -7.188 1.00 0.56 N ATOM 148 C2 DI A 5 1.852 -7.117 -5.814 1.00 0.50 C ATOM 149 N3 DI A 5 2.725 -7.677 -4.995 1.00 0.40 N ATOM 150 C4 DI A 5 3.712 -8.305 -5.683 1.00 0.37 C ATOM 0 H5'' DI A 5 8.762 -9.520 -1.540 1.00 0.27 H new ATOM 0 H2'' DI A 5 5.856 -11.129 -4.048 1.00 0.25 H new ATOM 0 H8 DI A 5 6.417 -10.034 -6.065 1.00 0.35 H new ATOM 0 H5' DI A 5 8.670 -7.942 -2.296 1.00 0.27 H new ATOM 0 H4' DI A 5 6.585 -8.412 -1.283 1.00 0.23 H new ATOM 0 H3' DI A 5 6.948 -11.151 -1.921 1.00 0.26 H new ATOM 0 H2' DI A 5 4.417 -11.143 -3.048 1.00 0.25 H new ATOM 0 H2 DI A 5 1.013 -6.583 -5.368 1.00 0.50 H new ATOM 0 H1' DI A 5 4.113 -8.836 -3.172 1.00 0.25 H new ATOM 0 H1 DI A 5 1.188 -6.684 -7.713 1.00 0.56 H new ATOM 161 P DA A 6 4.537 -11.728 -0.465 1.00 0.40 P ATOM 162 OP1 DA A 6 4.312 -11.719 0.998 1.00 0.52 O ATOM 163 OP2 DA A 6 5.193 -12.890 -1.103 1.00 0.43 O ATOM 164 O5' DA A 6 3.122 -11.484 -1.193 1.00 0.35 O ATOM 165 C5' DA A 6 2.205 -10.509 -0.689 1.00 0.34 C ATOM 166 C4' DA A 6 0.972 -10.382 -1.580 1.00 0.29 C ATOM 167 O4' DA A 6 1.380 -10.074 -2.918 1.00 0.42 O ATOM 168 C3' DA A 6 0.123 -11.647 -1.651 1.00 0.19 C ATOM 169 O3' DA A 6 -0.964 -11.547 -0.726 1.00 0.24 O ATOM 170 C2' DA A 6 -0.419 -11.635 -3.069 1.00 0.29 C ATOM 171 C1' DA A 6 0.694 -10.934 -3.837 1.00 0.31 C ATOM 172 N9 DA A 6 1.691 -11.848 -4.429 1.00 0.21 N ATOM 173 C8 DA A 6 2.474 -12.790 -3.811 1.00 0.19 C ATOM 174 N7 DA A 6 3.263 -13.436 -4.625 1.00 0.28 N ATOM 175 C5 DA A 6 2.981 -12.885 -5.870 1.00 0.50 C ATOM 176 C6 DA A 6 3.484 -13.139 -7.157 1.00 0.84 C ATOM 177 N6 DA A 6 4.419 -14.056 -7.406 1.00 0.96 N ATOM 178 N1 DA A 6 2.985 -12.410 -8.169 1.00 1.07 N ATOM 179 C2 DA A 6 2.053 -11.499 -7.913 1.00 0.98 C ATOM 180 N3 DA A 6 1.503 -11.169 -6.754 1.00 0.70 N ATOM 181 C4 DA A 6 2.025 -11.916 -5.760 1.00 0.45 C ATOM 0 H5' DA A 6 2.704 -9.542 -0.618 1.00 0.34 H new ATOM 0 H5'' DA A 6 1.898 -10.785 0.320 1.00 0.34 H new ATOM 0 H4' DA A 6 0.367 -9.594 -1.132 1.00 0.29 H new ATOM 0 H3' DA A 6 0.681 -12.552 -1.411 1.00 0.19 H new ATOM 0 H2' DA A 6 -0.599 -12.643 -3.444 1.00 0.29 H new ATOM 0 H2'' DA A 6 -1.363 -11.095 -3.139 1.00 0.29 H new ATOM 0 H1' DA A 6 0.224 -10.402 -4.664 1.00 0.31 H new ATOM 0 H8 DA A 6 2.440 -12.979 -2.748 1.00 0.19 H new ATOM 0 H61 DA A 6 4.750 -14.201 -8.360 1.00 0.96 H new ATOM 0 H62 DA A 6 4.803 -14.613 -6.643 1.00 0.96 H new ATOM 0 H2 DA A 6 1.693 -10.950 -8.771 1.00 0.98 H new ATOM 193 P DG A 7 -0.709 -11.619 0.862 1.00 0.16 P ATOM 194 OP1 DG A 7 0.551 -10.908 1.169 1.00 0.19 O ATOM 195 OP2 DG A 7 -0.891 -13.022 1.299 1.00 0.27 O ATOM 196 O5' DG A 7 -1.930 -10.747 1.442 1.00 0.14 O ATOM 197 C5' DG A 7 -1.954 -9.329 1.263 1.00 0.11 C ATOM 198 C4' DG A 7 -3.381 -8.812 1.104 1.00 0.13 C ATOM 199 O4' DG A 7 -3.929 -9.345 -0.094 1.00 0.16 O ATOM 200 C3' DG A 7 -4.321 -9.234 2.229 1.00 0.16 C ATOM 201 O3' DG A 7 -4.404 -8.218 3.249 1.00 0.21 O ATOM 202 C2' DG A 7 -5.680 -9.362 1.547 1.00 0.17 C ATOM 203 C1' DG A 7 -5.344 -9.466 0.053 1.00 0.17 C ATOM 204 N9 DG A 7 -5.738 -10.748 -0.556 1.00 0.21 N ATOM 205 C8 DG A 7 -4.984 -11.879 -0.721 1.00 0.25 C ATOM 206 N7 DG A 7 -5.619 -12.859 -1.298 1.00 0.33 N ATOM 207 C5 DG A 7 -6.890 -12.343 -1.532 1.00 0.36 C ATOM 208 C6 DG A 7 -8.023 -12.952 -2.136 1.00 0.48 C ATOM 209 O6 DG A 7 -8.126 -14.090 -2.591 1.00 0.56 O ATOM 210 N1 DG A 7 -9.105 -12.085 -2.177 1.00 0.55 N ATOM 211 C2 DG A 7 -9.103 -10.792 -1.697 1.00 0.52 C ATOM 212 N2 DG A 7 -10.241 -10.112 -1.826 1.00 0.64 N ATOM 213 N3 DG A 7 -8.038 -10.217 -1.129 1.00 0.40 N ATOM 214 C4 DG A 7 -6.972 -11.049 -1.081 1.00 0.31 C ATOM 0 H5' DG A 7 -1.368 -9.062 0.383 1.00 0.11 H new ATOM 0 H5'' DG A 7 -1.483 -8.845 2.118 1.00 0.11 H new ATOM 0 H4' DG A 7 -3.308 -7.724 1.106 1.00 0.13 H new ATOM 0 H3' DG A 7 -3.982 -10.149 2.715 1.00 0.16 H new ATOM 0 H2' DG A 7 -6.219 -10.243 1.896 1.00 0.17 H new ATOM 0 H2'' DG A 7 -6.312 -8.498 1.754 1.00 0.17 H new ATOM 0 H1' DG A 7 -5.900 -8.675 -0.450 1.00 0.17 H new ATOM 0 H8 DG A 7 -3.955 -11.952 -0.401 1.00 0.25 H new ATOM 0 H1 DG A 7 -9.969 -12.430 -2.595 1.00 0.55 H new ATOM 0 H21 DG A 7 -10.302 -9.151 -1.490 1.00 0.64 H new ATOM 0 H22 DG A 7 -11.052 -10.552 -2.261 1.00 0.64 H new ATOM 226 P DG A 8 -3.288 -7.067 3.422 1.00 0.19 P ATOM 227 OP1 DG A 8 -3.793 -5.836 2.778 1.00 0.24 O ATOM 228 OP2 DG A 8 -1.979 -7.620 3.031 1.00 0.20 O ATOM 229 O5' DG A 8 -3.269 -6.819 5.012 1.00 0.20 O ATOM 230 C5' DG A 8 -2.383 -7.558 5.859 1.00 0.21 C ATOM 231 C4' DG A 8 -0.951 -7.025 5.793 1.00 0.21 C ATOM 232 O4' DG A 8 -0.346 -7.378 4.539 1.00 0.22 O ATOM 233 C3' DG A 8 -0.845 -5.498 5.927 1.00 0.20 C ATOM 234 O3' DG A 8 0.106 -5.166 6.949 1.00 0.21 O ATOM 235 C2' DG A 8 -0.318 -5.037 4.570 1.00 0.22 C ATOM 236 C1' DG A 8 0.441 -6.270 4.119 1.00 0.22 C ATOM 237 N9 DG A 8 0.676 -6.363 2.660 1.00 0.23 N ATOM 238 C8 DG A 8 1.838 -6.700 2.017 1.00 0.27 C ATOM 239 N7 DG A 8 1.761 -6.657 0.720 1.00 0.31 N ATOM 240 C5 DG A 8 0.452 -6.264 0.472 1.00 0.28 C ATOM 241 C6 DG A 8 -0.209 -6.048 -0.766 1.00 0.30 C ATOM 242 O6 DG A 8 0.251 -6.151 -1.902 1.00 0.33 O ATOM 243 N1 DG A 8 -1.528 -5.663 -0.579 1.00 0.28 N ATOM 244 C2 DG A 8 -2.139 -5.500 0.644 1.00 0.24 C ATOM 245 N2 DG A 8 -3.416 -5.122 0.613 1.00 0.24 N ATOM 246 N3 DG A 8 -1.519 -5.699 1.814 1.00 0.21 N ATOM 247 C4 DG A 8 -0.228 -6.080 1.653 1.00 0.23 C ATOM 0 H5' DG A 8 -2.393 -8.608 5.566 1.00 0.21 H new ATOM 0 H5'' DG A 8 -2.741 -7.510 6.888 1.00 0.21 H new ATOM 0 H4' DG A 8 -0.441 -7.481 6.641 1.00 0.21 H new ATOM 0 H3' DG A 8 -1.794 -5.033 6.193 1.00 0.20 H new ATOM 0 H2' DG A 8 -1.122 -4.774 3.883 1.00 0.22 H new ATOM 0 H2'' DG A 8 0.328 -4.163 4.654 1.00 0.22 H new ATOM 0 H1' DG A 8 1.439 -6.238 4.557 1.00 0.22 H new ATOM 0 H8 DG A 8 2.740 -6.977 2.542 1.00 0.27 H new ATOM 0 H1 DG A 8 -2.089 -5.487 -1.412 1.00 0.28 H new ATOM 0 H21 DG A 8 -3.928 -4.983 1.484 1.00 0.24 H new ATOM 0 H22 DG A 8 -3.882 -4.971 -0.282 1.00 0.24 H new ATOM 259 P DG A 9 0.325 -3.633 7.403 1.00 0.25 P ATOM 260 OP1 DG A 9 0.100 -3.548 8.863 1.00 0.41 O ATOM 261 OP2 DG A 9 -0.446 -2.765 6.486 1.00 0.39 O ATOM 262 O5' DG A 9 1.896 -3.393 7.122 1.00 0.19 O ATOM 263 C5' DG A 9 2.420 -3.501 5.797 1.00 0.24 C ATOM 264 C4' DG A 9 3.917 -3.211 5.747 1.00 0.16 C ATOM 265 O4' DG A 9 4.430 -3.588 4.463 1.00 0.16 O ATOM 266 C3' DG A 9 4.265 -1.742 5.952 1.00 0.17 C ATOM 267 O3' DG A 9 5.528 -1.631 6.617 1.00 0.22 O ATOM 268 C2' DG A 9 4.375 -1.208 4.535 1.00 0.18 C ATOM 269 C1' DG A 9 4.915 -2.421 3.789 1.00 0.16 C ATOM 270 N9 DG A 9 4.480 -2.501 2.381 1.00 0.17 N ATOM 271 C8 DG A 9 5.245 -2.618 1.250 1.00 0.21 C ATOM 272 N7 DG A 9 4.557 -2.629 0.143 1.00 0.22 N ATOM 273 C5 DG A 9 3.238 -2.513 0.567 1.00 0.19 C ATOM 274 C6 DG A 9 2.039 -2.469 -0.194 1.00 0.21 C ATOM 275 O6 DG A 9 1.909 -2.519 -1.415 1.00 0.25 O ATOM 276 N1 DG A 9 0.923 -2.348 0.622 1.00 0.21 N ATOM 277 C2 DG A 9 0.952 -2.277 1.999 1.00 0.20 C ATOM 278 N2 DG A 9 -0.228 -2.167 2.610 1.00 0.23 N ATOM 279 N3 DG A 9 2.079 -2.317 2.717 1.00 0.17 N ATOM 280 C4 DG A 9 3.180 -2.435 1.937 1.00 0.17 C ATOM 0 H5' DG A 9 1.894 -2.806 5.142 1.00 0.24 H new ATOM 0 H5'' DG A 9 2.232 -4.504 5.414 1.00 0.24 H new ATOM 0 H4' DG A 9 4.359 -3.783 6.563 1.00 0.16 H new ATOM 0 H3' DG A 9 3.536 -1.205 6.558 1.00 0.17 H new ATOM 0 H2' DG A 9 3.411 -0.883 4.144 1.00 0.18 H new ATOM 0 H2'' DG A 9 5.049 -0.354 4.471 1.00 0.18 H new ATOM 0 H1' DG A 9 6.002 -2.341 3.782 1.00 0.16 H new ATOM 0 H8 DG A 9 6.322 -2.694 1.274 1.00 0.21 H new ATOM 0 H1 DG A 9 0.010 -2.309 0.168 1.00 0.21 H new ATOM 0 H21 DG A 9 -0.272 -2.110 3.627 1.00 0.23 H new ATOM 0 H22 DG A 9 -1.087 -2.140 2.060 1.00 0.23 H new ATOM 292 P DG A 10 6.066 -0.194 7.109 1.00 0.27 P ATOM 293 OP1 DG A 10 7.129 -0.414 8.116 1.00 0.37 O ATOM 294 OP2 DG A 10 4.896 0.648 7.445 1.00 0.33 O ATOM 295 O5' DG A 10 6.750 0.404 5.779 1.00 0.23 O ATOM 296 C5' DG A 10 8.058 -0.015 5.382 1.00 0.23 C ATOM 297 C4' DG A 10 8.575 0.808 4.206 1.00 0.19 C ATOM 298 O4' DG A 10 7.707 0.631 3.080 1.00 0.18 O ATOM 299 C3' DG A 10 8.645 2.310 4.491 1.00 0.18 C ATOM 300 O3' DG A 10 9.838 2.855 3.921 1.00 0.22 O ATOM 301 C2' DG A 10 7.429 2.871 3.773 1.00 0.14 C ATOM 302 C1' DG A 10 7.313 1.916 2.598 1.00 0.12 C ATOM 303 N9 DG A 10 5.948 1.800 2.056 1.00 0.12 N ATOM 304 C8 DG A 10 4.765 1.698 2.739 1.00 0.15 C ATOM 305 N7 DG A 10 3.716 1.627 1.970 1.00 0.17 N ATOM 306 C5 DG A 10 4.239 1.686 0.683 1.00 0.16 C ATOM 307 C6 DG A 10 3.572 1.654 -0.570 1.00 0.18 C ATOM 308 O6 DG A 10 2.365 1.569 -0.790 1.00 0.21 O ATOM 309 N1 DG A 10 4.470 1.739 -1.625 1.00 0.19 N ATOM 310 C2 DG A 10 5.838 1.843 -1.496 1.00 0.18 C ATOM 311 N2 DG A 10 6.533 1.915 -2.632 1.00 0.22 N ATOM 312 N3 DG A 10 6.468 1.872 -0.317 1.00 0.15 N ATOM 313 C4 DG A 10 5.607 1.791 0.725 1.00 0.14 C ATOM 0 H5' DG A 10 8.036 -1.070 5.108 1.00 0.23 H new ATOM 0 H5'' DG A 10 8.743 0.081 6.224 1.00 0.23 H new ATOM 0 H4' DG A 10 9.586 0.450 4.014 1.00 0.19 H new ATOM 0 H3' DG A 10 8.657 2.543 5.556 1.00 0.18 H new ATOM 0 H2' DG A 10 6.539 2.860 4.402 1.00 0.14 H new ATOM 0 H2'' DG A 10 7.580 3.902 3.452 1.00 0.14 H new ATOM 0 H1' DG A 10 7.937 2.296 1.790 1.00 0.12 H new ATOM 0 H8 DG A 10 4.707 1.678 3.817 1.00 0.15 H new ATOM 0 H1 DG A 10 4.087 1.723 -2.570 1.00 0.19 H new ATOM 0 H21 DG A 10 7.550 1.993 -2.604 1.00 0.22 H new ATOM 0 H22 DG A 10 6.048 1.892 -3.529 1.00 0.22 H new ATOM 325 P DC A 11 10.643 4.029 4.676 1.00 0.33 P ATOM 326 OP1 DC A 11 11.747 4.474 3.796 1.00 0.45 O ATOM 327 OP2 DC A 11 10.936 3.577 6.054 1.00 0.46 O ATOM 328 O5' DC A 11 9.554 5.215 4.755 1.00 0.25 O ATOM 329 C5' DC A 11 9.567 6.135 5.850 1.00 0.34 C ATOM 330 C4' DC A 11 8.483 7.201 5.705 1.00 0.29 C ATOM 331 O4' DC A 11 8.746 8.014 4.574 1.00 0.40 O ATOM 332 C3' DC A 11 7.079 6.644 5.496 1.00 0.17 C ATOM 333 O3' DC A 11 6.393 6.598 6.752 1.00 0.21 O ATOM 334 C2' DC A 11 6.396 7.657 4.567 1.00 0.29 C ATOM 335 C1' DC A 11 7.517 8.640 4.221 1.00 0.35 C ATOM 336 N1 DC A 11 7.589 8.996 2.790 1.00 0.44 N ATOM 337 C2 DC A 11 6.993 10.183 2.399 1.00 0.58 C ATOM 338 O2 DC A 11 6.432 10.894 3.231 1.00 0.64 O ATOM 339 N3 DC A 11 7.047 10.530 1.084 1.00 0.70 N ATOM 340 C4 DC A 11 7.661 9.744 0.190 1.00 0.69 C ATOM 341 N4 DC A 11 7.696 10.114 -1.090 1.00 0.84 N ATOM 342 C5 DC A 11 8.280 8.518 0.590 1.00 0.58 C ATOM 343 C6 DC A 11 8.220 8.183 1.893 1.00 0.46 C ATOM 0 H5' DC A 11 10.544 6.615 5.910 1.00 0.34 H new ATOM 0 H5'' DC A 11 9.421 5.592 6.784 1.00 0.34 H new ATOM 0 H4' DC A 11 8.511 7.750 6.646 1.00 0.29 H new ATOM 0 H3' DC A 11 7.082 5.636 5.081 1.00 0.17 H new ATOM 0 H2' DC A 11 5.995 7.176 3.675 1.00 0.29 H new ATOM 0 H2'' DC A 11 5.563 8.157 5.062 1.00 0.29 H new ATOM 0 H1' DC A 11 7.320 9.564 4.765 1.00 0.35 H new ATOM 0 H41 DC A 11 8.161 9.523 -1.779 1.00 0.84 H new ATOM 0 H42 DC A 11 7.258 10.988 -1.380 1.00 0.84 H new ATOM 0 H5 DC A 11 8.778 7.883 -0.128 1.00 0.58 H new ATOM 0 H6 DC A 11 8.675 7.264 2.231 1.00 0.46 H new ATOM 355 P DT A 12 5.621 5.260 7.206 1.00 0.25 P ATOM 356 OP1 DT A 12 5.256 5.398 8.634 1.00 0.34 O ATOM 357 OP2 DT A 12 6.413 4.094 6.757 1.00 0.30 O ATOM 358 O5' DT A 12 4.268 5.317 6.335 1.00 0.26 O ATOM 359 C5' DT A 12 3.084 5.914 6.870 1.00 0.26 C ATOM 360 C4' DT A 12 1.858 5.587 6.021 1.00 0.26 C ATOM 361 O4' DT A 12 1.970 6.203 4.748 1.00 0.26 O ATOM 362 C3' DT A 12 1.668 4.096 5.756 1.00 0.25 C ATOM 363 O3' DT A 12 0.661 3.579 6.631 1.00 0.27 O ATOM 364 C2' DT A 12 1.186 4.012 4.302 1.00 0.27 C ATOM 365 C1' DT A 12 1.138 5.473 3.856 1.00 0.27 C ATOM 366 N1 DT A 12 1.637 5.702 2.488 1.00 0.25 N ATOM 367 C2 DT A 12 0.752 6.219 1.558 1.00 0.27 C ATOM 368 O2 DT A 12 -0.419 6.473 1.831 1.00 0.31 O ATOM 369 N3 DT A 12 1.259 6.419 0.292 1.00 0.26 N ATOM 370 C4 DT A 12 2.549 6.151 -0.126 1.00 0.24 C ATOM 371 O4 DT A 12 2.889 6.369 -1.287 1.00 0.25 O ATOM 372 C5 DT A 12 3.399 5.613 0.907 1.00 0.22 C ATOM 373 C7 DT A 12 4.845 5.261 0.574 1.00 0.22 C ATOM 374 C6 DT A 12 2.933 5.408 2.156 1.00 0.23 C ATOM 0 H5' DT A 12 3.213 6.995 6.923 1.00 0.26 H new ATOM 0 H5'' DT A 12 2.926 5.561 7.889 1.00 0.26 H new ATOM 0 H4' DT A 12 1.009 5.955 6.598 1.00 0.26 H new ATOM 0 H3' DT A 12 2.580 3.523 5.922 1.00 0.25 H new ATOM 0 H2' DT A 12 1.869 3.427 3.686 1.00 0.27 H new ATOM 0 H2'' DT A 12 0.207 3.538 4.231 1.00 0.27 H new ATOM 0 H1' DT A 12 0.094 5.787 3.866 1.00 0.27 H new ATOM 0 H3 DT A 12 0.620 6.802 -0.404 1.00 0.26 H new ATOM 0 H71 DT A 12 4.916 4.967 -0.473 1.00 0.22 H new ATOM 0 H72 DT A 12 5.481 6.129 0.751 1.00 0.22 H new ATOM 0 H73 DT A 12 5.173 4.436 1.206 1.00 0.22 H new ATOM 0 H6 DT A 12 3.594 5.004 2.909 1.00 0.23 H new ATOM 387 P DG A 13 0.299 2.010 6.617 1.00 0.25 P ATOM 388 OP1 DG A 13 0.194 1.545 8.017 1.00 0.31 O ATOM 389 OP2 DG A 13 1.223 1.331 5.682 1.00 0.30 O ATOM 390 O5' DG A 13 -1.174 1.994 5.970 1.00 0.24 O ATOM 391 C5' DG A 13 -2.301 2.451 6.722 1.00 0.25 C ATOM 392 C4' DG A 13 -3.609 1.921 6.145 1.00 0.25 C ATOM 393 O4' DG A 13 -3.793 2.423 4.814 1.00 0.26 O ATOM 394 C3' DG A 13 -3.669 0.392 6.054 1.00 0.25 C ATOM 395 O3' DG A 13 -4.978 -0.053 6.438 1.00 0.27 O ATOM 396 C2' DG A 13 -3.436 0.118 4.577 1.00 0.24 C ATOM 397 C1' DG A 13 -4.129 1.323 3.973 1.00 0.24 C ATOM 398 N9 DG A 13 -3.721 1.647 2.592 1.00 0.22 N ATOM 399 C8 DG A 13 -4.517 1.917 1.510 1.00 0.23 C ATOM 400 N7 DG A 13 -3.857 2.148 0.412 1.00 0.21 N ATOM 401 C5 DG A 13 -2.525 2.025 0.787 1.00 0.18 C ATOM 402 C6 DG A 13 -1.346 2.169 0.008 1.00 0.17 C ATOM 403 O6 DG A 13 -1.250 2.435 -1.188 1.00 0.18 O ATOM 404 N1 DG A 13 -0.204 1.963 0.772 1.00 0.18 N ATOM 405 C2 DG A 13 -0.196 1.659 2.117 1.00 0.18 C ATOM 406 N2 DG A 13 1.001 1.499 2.680 1.00 0.20 N ATOM 407 N3 DG A 13 -1.305 1.523 2.851 1.00 0.19 N ATOM 408 C4 DG A 13 -2.430 1.719 2.122 1.00 0.19 C ATOM 0 H5' DG A 13 -2.319 3.541 6.727 1.00 0.25 H new ATOM 0 H5'' DG A 13 -2.203 2.130 7.759 1.00 0.25 H new ATOM 0 H4' DG A 13 -4.386 2.259 6.830 1.00 0.25 H new ATOM 0 H3' DG A 13 -2.950 -0.115 6.698 1.00 0.25 H new ATOM 0 H2' DG A 13 -2.377 0.076 4.323 1.00 0.24 H new ATOM 0 H2'' DG A 13 -3.879 -0.824 4.253 1.00 0.24 H new ATOM 0 H1' DG A 13 -5.196 1.107 3.915 1.00 0.24 H new ATOM 0 H8 DG A 13 -5.596 1.936 1.563 1.00 0.23 H new ATOM 0 H1 DG A 13 0.698 2.043 0.302 1.00 0.18 H new ATOM 0 H21 DG A 13 1.072 1.273 3.672 1.00 0.20 H new ATOM 0 H22 DG A 13 1.846 1.603 2.119 1.00 0.20 H new ATOM 420 P DG A 14 -5.416 -1.595 6.260 1.00 0.26 P ATOM 421 OP1 DG A 14 -6.456 -1.902 7.267 1.00 0.27 O ATOM 422 OP2 DG A 14 -4.189 -2.419 6.192 1.00 0.26 O ATOM 423 O5' DG A 14 -6.107 -1.601 4.803 1.00 0.26 O ATOM 424 C5' DG A 14 -7.418 -1.056 4.614 1.00 0.28 C ATOM 425 C4' DG A 14 -7.921 -1.290 3.192 1.00 0.25 C ATOM 426 O4' DG A 14 -6.900 -0.921 2.254 1.00 0.22 O ATOM 427 C3' DG A 14 -8.286 -2.744 2.897 1.00 0.25 C ATOM 428 O3' DG A 14 -9.408 -2.778 2.006 1.00 0.26 O ATOM 429 C2' DG A 14 -7.049 -3.279 2.199 1.00 0.24 C ATOM 430 C1' DG A 14 -6.612 -2.050 1.423 1.00 0.19 C ATOM 431 N9 DG A 14 -5.174 -2.023 1.098 1.00 0.19 N ATOM 432 C8 DG A 14 -4.104 -2.224 1.928 1.00 0.21 C ATOM 433 N7 DG A 14 -2.947 -2.144 1.330 1.00 0.20 N ATOM 434 C5 DG A 14 -3.275 -1.871 0.005 1.00 0.18 C ATOM 435 C6 DG A 14 -2.429 -1.678 -1.121 1.00 0.18 C ATOM 436 O6 DG A 14 -1.201 -1.711 -1.167 1.00 0.20 O ATOM 437 N1 DG A 14 -3.162 -1.425 -2.273 1.00 0.18 N ATOM 438 C2 DG A 14 -4.539 -1.365 -2.336 1.00 0.16 C ATOM 439 N2 DG A 14 -5.064 -1.110 -3.534 1.00 0.18 N ATOM 440 N3 DG A 14 -5.336 -1.547 -1.278 1.00 0.15 N ATOM 441 C4 DG A 14 -4.636 -1.794 -0.146 1.00 0.17 C ATOM 0 H5' DG A 14 -7.402 0.013 4.824 1.00 0.28 H new ATOM 0 H5'' DG A 14 -8.108 -1.511 5.325 1.00 0.28 H new ATOM 0 H4' DG A 14 -8.821 -0.683 3.097 1.00 0.25 H new ATOM 0 H3' DG A 14 -8.556 -3.318 3.783 1.00 0.25 H new ATOM 0 H2' DG A 14 -6.289 -3.615 2.904 1.00 0.24 H new ATOM 0 H2'' DG A 14 -7.274 -4.122 1.546 1.00 0.24 H new ATOM 0 H1' DG A 14 -7.143 -2.047 0.471 1.00 0.19 H new ATOM 0 H8 DG A 14 -4.208 -2.430 2.983 1.00 0.21 H new ATOM 0 H1 DG A 14 -2.643 -1.272 -3.138 1.00 0.18 H new ATOM 0 H21 DG A 14 -6.076 -1.053 -3.646 1.00 0.18 H new ATOM 0 H22 DG A 14 -4.454 -0.972 -4.339 1.00 0.18 H new ATOM 453 P DG A 15 -10.047 -4.180 1.537 1.00 0.29 P ATOM 454 OP1 DG A 15 -11.485 -4.175 1.884 1.00 0.35 O ATOM 455 OP2 DG A 15 -9.173 -5.270 2.024 1.00 0.35 O ATOM 456 O5' DG A 15 -9.914 -4.107 -0.067 1.00 0.25 O ATOM 457 C5' DG A 15 -10.715 -3.195 -0.829 1.00 0.24 C ATOM 458 C4' DG A 15 -10.252 -3.130 -2.281 1.00 0.19 C ATOM 459 O4' DG A 15 -8.834 -2.949 -2.319 1.00 0.17 O ATOM 460 C3' DG A 15 -10.573 -4.390 -3.090 1.00 0.22 C ATOM 461 O3' DG A 15 -11.290 -4.020 -4.275 1.00 0.23 O ATOM 462 C2' DG A 15 -9.213 -4.975 -3.461 1.00 0.23 C ATOM 463 C1' DG A 15 -8.306 -3.762 -3.361 1.00 0.20 C ATOM 464 N9 DG A 15 -6.906 -4.080 -3.022 1.00 0.20 N ATOM 465 C8 DG A 15 -6.378 -4.451 -1.813 1.00 0.23 C ATOM 466 N7 DG A 15 -5.090 -4.653 -1.838 1.00 0.23 N ATOM 467 C5 DG A 15 -4.737 -4.399 -3.159 1.00 0.20 C ATOM 468 C6 DG A 15 -3.463 -4.457 -3.789 1.00 0.22 C ATOM 469 O6 DG A 15 -2.380 -4.750 -3.291 1.00 0.26 O ATOM 470 N1 DG A 15 -3.546 -4.126 -5.135 1.00 0.22 N ATOM 471 C2 DG A 15 -4.707 -3.782 -5.796 1.00 0.22 C ATOM 472 N2 DG A 15 -4.588 -3.498 -7.093 1.00 0.26 N ATOM 473 N3 DG A 15 -5.905 -3.727 -5.205 1.00 0.20 N ATOM 474 C4 DG A 15 -5.843 -4.047 -3.892 1.00 0.19 C ATOM 0 H5' DG A 15 -10.662 -2.202 -0.383 1.00 0.24 H new ATOM 0 H5'' DG A 15 -11.759 -3.506 -0.792 1.00 0.24 H new ATOM 0 H4' DG A 15 -10.792 -2.296 -2.729 1.00 0.19 H new ATOM 0 H3' DG A 15 -11.186 -5.102 -2.537 1.00 0.22 H new ATOM 0 H2' DG A 15 -8.910 -5.768 -2.777 1.00 0.23 H new ATOM 0 H2'' DG A 15 -9.213 -5.402 -4.464 1.00 0.23 H new ATOM 0 H1' DG A 15 -8.285 -3.279 -4.338 1.00 0.20 H new ATOM 0 H8 DG A 15 -6.975 -4.566 -0.920 1.00 0.23 H new ATOM 0 H1 DG A 15 -2.682 -4.138 -5.677 1.00 0.22 H new ATOM 0 H21 DG A 15 -5.411 -3.237 -7.636 1.00 0.26 H new ATOM 0 H22 DG A 15 -3.674 -3.542 -7.543 1.00 0.26 H new ATOM 486 P DA A 16 -10.691 -2.933 -5.305 1.00 0.21 P ATOM 487 OP1 DA A 16 -11.672 -2.746 -6.397 1.00 0.26 O ATOM 488 OP2 DA A 16 -9.298 -3.313 -5.628 1.00 0.24 O ATOM 489 O5' DA A 16 -10.658 -1.582 -4.425 1.00 0.18 O ATOM 490 C5' DA A 16 -11.718 -0.623 -4.530 1.00 0.12 C ATOM 491 C4' DA A 16 -11.332 0.717 -3.903 1.00 0.13 C ATOM 492 O4' DA A 16 -12.365 1.673 -4.152 1.00 0.21 O ATOM 493 C3' DA A 16 -11.124 0.657 -2.386 1.00 0.23 C ATOM 494 O3' DA A 16 -9.777 1.034 -2.068 1.00 0.27 O ATOM 495 C2' DA A 16 -12.103 1.679 -1.804 1.00 0.29 C ATOM 496 C1' DA A 16 -12.477 2.521 -3.014 1.00 0.24 C ATOM 497 N9 DA A 16 -13.855 3.044 -2.978 1.00 0.39 N ATOM 498 C8 DA A 16 -15.006 2.408 -2.590 1.00 0.50 C ATOM 499 N7 DA A 16 -16.075 3.151 -2.675 1.00 0.63 N ATOM 500 C5 DA A 16 -15.597 4.367 -3.154 1.00 0.61 C ATOM 501 C6 DA A 16 -16.233 5.581 -3.462 1.00 0.72 C ATOM 502 N6 DA A 16 -17.545 5.773 -3.326 1.00 0.86 N ATOM 503 N1 DA A 16 -15.460 6.583 -3.915 1.00 0.69 N ATOM 504 C2 DA A 16 -14.155 6.385 -4.048 1.00 0.57 C ATOM 505 N3 DA A 16 -13.445 5.297 -3.793 1.00 0.45 N ATOM 506 C4 DA A 16 -14.245 4.310 -3.341 1.00 0.47 C ATOM 0 H5' DA A 16 -12.610 -1.011 -4.039 1.00 0.12 H new ATOM 0 H5'' DA A 16 -11.972 -0.474 -5.580 1.00 0.12 H new ATOM 0 H4' DA A 16 -10.383 0.996 -4.362 1.00 0.13 H new ATOM 0 H3' DA A 16 -11.293 -0.343 -1.986 1.00 0.23 H new ATOM 0 H2' DA A 16 -12.975 1.197 -1.363 1.00 0.29 H new ATOM 0 H2'' DA A 16 -11.641 2.280 -1.021 1.00 0.29 H new ATOM 0 H1' DA A 16 -11.813 3.385 -3.036 1.00 0.24 H new ATOM 0 H8 DA A 16 -15.026 1.385 -2.245 1.00 0.50 H new ATOM 0 H61 DA A 16 -17.956 6.676 -3.564 1.00 0.86 H new ATOM 0 H62 DA A 16 -18.138 5.017 -2.983 1.00 0.86 H new ATOM 0 H2 DA A 16 -13.593 7.230 -4.416 1.00 0.57 H new ATOM 518 P DG A 17 -9.214 2.506 -2.409 1.00 0.22 P ATOM 519 OP1 DG A 17 -7.922 2.678 -1.708 1.00 0.28 O ATOM 520 OP2 DG A 17 -10.302 3.485 -2.193 1.00 0.19 O ATOM 521 O5' DG A 17 -8.918 2.421 -3.990 1.00 0.26 O ATOM 522 C5' DG A 17 -9.476 3.385 -4.887 1.00 0.22 C ATOM 523 C4' DG A 17 -8.771 3.365 -6.240 1.00 0.22 C ATOM 524 O4' DG A 17 -7.411 3.769 -6.082 1.00 0.24 O ATOM 525 C3' DG A 17 -8.755 1.985 -6.912 1.00 0.22 C ATOM 526 O3' DG A 17 -9.401 2.067 -8.186 1.00 0.31 O ATOM 527 C2' DG A 17 -7.273 1.663 -7.107 1.00 0.15 C ATOM 528 C1' DG A 17 -6.636 3.038 -7.021 1.00 0.18 C ATOM 529 N9 DG A 17 -5.235 3.029 -6.557 1.00 0.19 N ATOM 530 C8 DG A 17 -4.086 3.148 -7.294 1.00 0.22 C ATOM 531 N7 DG A 17 -2.994 3.084 -6.586 1.00 0.26 N ATOM 532 C5 DG A 17 -3.450 2.911 -5.283 1.00 0.24 C ATOM 533 C6 DG A 17 -2.715 2.776 -4.072 1.00 0.29 C ATOM 534 O6 DG A 17 -1.496 2.781 -3.915 1.00 0.33 O ATOM 535 N1 DG A 17 -3.558 2.621 -2.981 1.00 0.29 N ATOM 536 C2 DG A 17 -4.936 2.599 -3.042 1.00 0.25 C ATOM 537 N2 DG A 17 -5.578 2.441 -1.884 1.00 0.28 N ATOM 538 N3 DG A 17 -5.628 2.725 -4.179 1.00 0.20 N ATOM 539 C4 DG A 17 -4.821 2.877 -5.255 1.00 0.20 C ATOM 0 H5' DG A 17 -9.396 4.380 -4.449 1.00 0.22 H new ATOM 0 H5'' DG A 17 -10.538 3.182 -5.026 1.00 0.22 H new ATOM 0 H4' DG A 17 -9.338 4.047 -6.873 1.00 0.22 H new ATOM 0 H3' DG A 17 -9.271 1.227 -6.322 1.00 0.22 H new ATOM 0 H2' DG A 17 -6.897 0.990 -6.336 1.00 0.15 H new ATOM 0 H2'' DG A 17 -7.083 1.185 -8.068 1.00 0.15 H new ATOM 0 H1' DG A 17 -6.618 3.470 -8.021 1.00 0.18 H new ATOM 0 H8 DG A 17 -4.086 3.283 -8.366 1.00 0.22 H new ATOM 0 H1 DG A 17 -3.126 2.515 -2.063 1.00 0.29 H new ATOM 0 H21 DG A 17 -6.598 2.417 -1.865 1.00 0.28 H new ATOM 0 H22 DG A 17 -5.049 2.344 -1.017 1.00 0.28 H new ATOM 551 P DG A 18 -9.595 0.745 -9.087 1.00 0.37 P ATOM 552 OP1 DG A 18 -10.467 1.086 -10.233 1.00 0.50 O ATOM 553 OP2 DG A 18 -9.961 -0.374 -8.191 1.00 0.41 O ATOM 554 O5' DG A 18 -8.109 0.478 -9.645 1.00 0.30 O ATOM 555 C5' DG A 18 -7.535 1.347 -10.625 1.00 0.33 C ATOM 556 C4' DG A 18 -6.127 0.902 -11.011 1.00 0.26 C ATOM 557 O4' DG A 18 -5.273 0.962 -9.866 1.00 0.26 O ATOM 558 C3' DG A 18 -6.059 -0.529 -11.557 1.00 0.21 C ATOM 559 O3' DG A 18 -5.389 -0.522 -12.823 1.00 0.25 O ATOM 560 C2' DG A 18 -5.228 -1.296 -10.532 1.00 0.21 C ATOM 561 C1' DG A 18 -4.427 -0.184 -9.879 1.00 0.19 C ATOM 562 N9 DG A 18 -4.026 -0.461 -8.486 1.00 0.19 N ATOM 563 C8 DG A 18 -4.821 -0.621 -7.381 1.00 0.19 C ATOM 564 N7 DG A 18 -4.159 -0.840 -6.280 1.00 0.20 N ATOM 565 C5 DG A 18 -2.827 -0.827 -6.681 1.00 0.19 C ATOM 566 C6 DG A 18 -1.645 -1.011 -5.913 1.00 0.20 C ATOM 567 O6 DG A 18 -1.544 -1.225 -4.708 1.00 0.23 O ATOM 568 N1 DG A 18 -0.507 -0.922 -6.704 1.00 0.21 N ATOM 569 C2 DG A 18 -0.504 -0.688 -8.063 1.00 0.21 C ATOM 570 N2 DG A 18 0.691 -0.641 -8.652 1.00 0.24 N ATOM 571 N3 DG A 18 -1.615 -0.514 -8.786 1.00 0.20 N ATOM 572 C4 DG A 18 -2.735 -0.597 -8.031 1.00 0.19 C ATOM 0 H5' DG A 18 -7.502 2.365 -10.236 1.00 0.33 H new ATOM 0 H5'' DG A 18 -8.168 1.365 -11.512 1.00 0.33 H new ATOM 0 H4' DG A 18 -5.809 1.582 -11.802 1.00 0.26 H new ATOM 0 H3' DG A 18 -7.044 -0.972 -11.703 1.00 0.21 H new ATOM 0 H2' DG A 18 -5.854 -1.825 -9.813 1.00 0.21 H new ATOM 0 H2'' DG A 18 -4.585 -2.040 -11.002 1.00 0.21 H new ATOM 0 H1' DG A 18 -3.505 -0.058 -10.446 1.00 0.19 H new ATOM 0 H8 DG A 18 -5.899 -0.570 -7.419 1.00 0.19 H new ATOM 0 H1 DG A 18 0.396 -1.039 -6.244 1.00 0.21 H new ATOM 0 H21 DG A 18 0.759 -0.471 -9.655 1.00 0.24 H new ATOM 0 H22 DG A 18 1.538 -0.775 -8.099 1.00 0.24 H new ATOM 584 P DG A 19 -5.337 -1.855 -13.725 1.00 0.19 P ATOM 585 OP1 DG A 19 -5.548 -1.468 -15.137 1.00 0.22 O ATOM 586 OP2 DG A 19 -6.214 -2.870 -13.099 1.00 0.25 O ATOM 587 O5' DG A 19 -3.810 -2.334 -13.556 1.00 0.17 O ATOM 588 C5' DG A 19 -2.756 -1.654 -14.241 1.00 0.21 C ATOM 589 C4' DG A 19 -1.400 -2.291 -13.956 1.00 0.24 C ATOM 590 O4' DG A 19 -1.117 -2.211 -12.553 1.00 0.27 O ATOM 591 C3' DG A 19 -1.315 -3.768 -14.352 1.00 0.22 C ATOM 592 O3' DG A 19 -0.066 -4.015 -15.007 1.00 0.26 O ATOM 593 C2' DG A 19 -1.355 -4.507 -13.023 1.00 0.19 C ATOM 594 C1' DG A 19 -0.693 -3.497 -12.106 1.00 0.23 C ATOM 595 N9 DG A 19 -1.067 -3.627 -10.685 1.00 0.20 N ATOM 596 C8 DG A 19 -2.307 -3.533 -10.111 1.00 0.22 C ATOM 597 N7 DG A 19 -2.305 -3.700 -8.818 1.00 0.22 N ATOM 598 C5 DG A 19 -0.967 -3.922 -8.510 1.00 0.19 C ATOM 599 C6 DG A 19 -0.349 -4.168 -7.254 1.00 0.19 C ATOM 600 O6 DG A 19 -0.877 -4.241 -6.146 1.00 0.22 O ATOM 601 N1 DG A 19 1.022 -4.338 -7.386 1.00 0.19 N ATOM 602 C2 DG A 19 1.716 -4.277 -8.577 1.00 0.18 C ATOM 603 N2 DG A 19 3.033 -4.465 -8.504 1.00 0.22 N ATOM 604 N3 DG A 19 1.137 -4.046 -9.758 1.00 0.17 N ATOM 605 C4 DG A 19 -0.201 -3.879 -9.648 1.00 0.17 C ATOM 0 H5' DG A 19 -2.739 -0.608 -13.936 1.00 0.21 H new ATOM 0 H5'' DG A 19 -2.948 -1.670 -15.314 1.00 0.21 H new ATOM 0 H4' DG A 19 -0.681 -1.736 -14.559 1.00 0.24 H new ATOM 0 H3' DG A 19 -2.110 -4.076 -15.031 1.00 0.22 H new ATOM 0 H2' DG A 19 -2.373 -4.740 -12.712 1.00 0.19 H new ATOM 0 H2'' DG A 19 -0.809 -5.450 -13.060 1.00 0.19 H new ATOM 0 H1' DG A 19 0.384 -3.658 -12.155 1.00 0.23 H new ATOM 0 H8 DG A 19 -3.205 -3.338 -10.678 1.00 0.22 H new ATOM 0 H1 DG A 19 1.558 -4.522 -6.538 1.00 0.19 H new ATOM 0 H21 DG A 19 3.601 -4.432 -9.351 1.00 0.22 H new ATOM 0 H22 DG A 19 3.474 -4.642 -7.601 1.00 0.22 H new ATOM 617 P DC A 20 0.122 -5.298 -15.962 1.00 0.28 P ATOM 618 OP1 DC A 20 1.447 -5.198 -16.615 1.00 0.37 O ATOM 619 OP2 DC A 20 -1.098 -5.444 -16.787 1.00 0.30 O ATOM 620 O5' DC A 20 0.169 -6.520 -14.913 1.00 0.29 O ATOM 621 C5' DC A 20 1.283 -6.678 -14.029 1.00 0.33 C ATOM 622 C4' DC A 20 1.232 -8.018 -13.298 1.00 0.42 C ATOM 623 O4' DC A 20 -0.013 -8.148 -12.611 1.00 0.43 O ATOM 624 C3' DC A 20 1.344 -9.226 -14.214 1.00 0.50 C ATOM 625 O3' DC A 20 2.711 -9.580 -14.455 1.00 0.64 O ATOM 626 C2' DC A 20 0.618 -10.309 -13.431 1.00 0.57 C ATOM 627 C1' DC A 20 -0.449 -9.515 -12.681 1.00 0.52 C ATOM 628 N1 DC A 20 -1.775 -9.530 -13.328 1.00 0.50 N ATOM 629 C2 DC A 20 -2.769 -10.282 -12.724 1.00 0.66 C ATOM 630 O2 DC A 20 -2.529 -10.902 -11.689 1.00 0.81 O ATOM 631 N3 DC A 20 -3.999 -10.313 -13.304 1.00 0.72 N ATOM 632 C4 DC A 20 -4.246 -9.632 -14.431 1.00 0.61 C ATOM 633 N4 DC A 20 -5.462 -9.684 -14.973 1.00 0.70 N ATOM 634 C5 DC A 20 -3.223 -8.853 -15.058 1.00 0.44 C ATOM 635 C6 DC A 20 -2.009 -8.830 -14.476 1.00 0.39 C ATOM 0 H5' DC A 20 1.290 -5.866 -13.302 1.00 0.33 H new ATOM 0 H5'' DC A 20 2.211 -6.607 -14.596 1.00 0.33 H new ATOM 0 H4' DC A 20 2.090 -8.009 -12.625 1.00 0.42 H new ATOM 0 H3' DC A 20 0.923 -9.054 -15.205 1.00 0.50 H new ATOM 0 H2' DC A 20 0.178 -11.059 -14.088 1.00 0.57 H new ATOM 0 H2'' DC A 20 1.287 -10.835 -12.749 1.00 0.57 H new ATOM 0 HO3' DC A 20 2.747 -10.361 -15.046 1.00 0.64 H new ATOM 0 H1' DC A 20 -0.564 -9.983 -11.703 1.00 0.52 H new ATOM 0 H41 DC A 20 -5.660 -9.169 -15.831 1.00 0.70 H new ATOM 0 H42 DC A 20 -6.194 -10.239 -14.530 1.00 0.70 H new ATOM 0 H5 DC A 20 -3.418 -8.302 -15.967 1.00 0.44 H new ATOM 0 H6 DC A 20 -1.213 -8.252 -14.922 1.00 0.39 H new TER 648 DC A 20