USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 274 hydrogens (25 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 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT O5' : rot -78:sc= 1.23 USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 25 DA O3' : rot -43:sc= 0.0117 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 4 5.544 -9.523 -12.034 1.00 0.70 O ATOM 2 C5' DT A 4 5.972 -10.519 -11.101 1.00 0.54 C ATOM 3 C4' DT A 4 7.475 -10.521 -10.939 1.00 0.43 C ATOM 4 O4' DT A 4 7.812 -11.117 -9.661 1.00 0.45 O ATOM 5 C3' DT A 4 8.235 -11.329 -11.995 1.00 0.41 C ATOM 6 O3' DT A 4 9.461 -10.672 -12.336 1.00 0.47 O ATOM 7 C2' DT A 4 8.511 -12.649 -11.300 1.00 0.41 C ATOM 8 C1' DT A 4 8.676 -12.227 -9.851 1.00 0.39 C ATOM 9 N1 DT A 4 8.311 -13.264 -8.866 1.00 0.37 N ATOM 10 C2 DT A 4 6.989 -13.640 -8.774 1.00 0.45 C ATOM 11 O2 DT A 4 6.107 -13.158 -9.467 1.00 0.57 O ATOM 12 N3 DT A 4 6.733 -14.607 -7.835 1.00 0.49 N ATOM 13 C4 DT A 4 7.646 -15.220 -7.000 1.00 0.45 C ATOM 14 O4 DT A 4 7.267 -16.075 -6.204 1.00 0.54 O ATOM 15 C5 DT A 4 9.014 -14.778 -7.150 1.00 0.42 C ATOM 16 C7 DT A 4 10.071 -15.389 -6.283 1.00 0.56 C ATOM 17 C6 DT A 4 9.280 -13.833 -8.064 1.00 0.40 C ATOM 0 H5' DT A 4 5.641 -11.501 -11.439 1.00 0.54 H new ATOM 0 H5'' DT A 4 5.502 -10.339 -10.134 1.00 0.54 H new ATOM 0 H4' DT A 4 7.771 -9.476 -11.034 1.00 0.43 H new ATOM 0 H3' DT A 4 7.681 -11.448 -12.926 1.00 0.41 H new ATOM 0 H2' DT A 4 7.690 -13.354 -11.427 1.00 0.41 H new ATOM 0 H2'' DT A 4 9.408 -13.132 -11.687 1.00 0.41 H new ATOM 0 HO5' DT A 4 5.562 -8.643 -11.604 1.00 0.70 H new ATOM 0 H1' DT A 4 9.731 -12.010 -9.683 1.00 0.39 H new ATOM 0 H3 DT A 4 5.762 -14.906 -7.744 1.00 0.49 H new ATOM 0 H71 DT A 4 11.022 -15.391 -6.815 1.00 0.56 H new ATOM 0 H72 DT A 4 10.170 -14.808 -5.366 1.00 0.56 H new ATOM 0 H73 DT A 4 9.792 -16.413 -6.036 1.00 0.56 H new ATOM 0 H6 DT A 4 10.301 -13.501 -8.178 1.00 0.40 H new ATOM 31 P DG A 5 9.591 -9.903 -13.742 1.00 0.47 P ATOM 32 OP1 DG A 5 8.379 -9.061 -13.903 1.00 0.70 O ATOM 33 OP2 DG A 5 9.936 -10.899 -14.788 1.00 0.88 O ATOM 34 O5' DG A 5 10.844 -8.938 -13.538 1.00 0.37 O ATOM 35 C5' DG A 5 10.666 -7.538 -13.321 1.00 0.38 C ATOM 36 C4' DG A 5 12.008 -6.860 -13.172 1.00 0.45 C ATOM 37 O4' DG A 5 12.756 -7.516 -12.116 1.00 0.47 O ATOM 38 C3' DG A 5 12.900 -6.918 -14.414 1.00 0.48 C ATOM 39 O3' DG A 5 13.668 -5.715 -14.534 1.00 0.63 O ATOM 40 C2' DG A 5 13.805 -8.103 -14.138 1.00 0.46 C ATOM 41 C1' DG A 5 13.969 -8.044 -12.630 1.00 0.45 C ATOM 42 N9 DG A 5 14.202 -9.340 -11.997 1.00 0.42 N ATOM 43 C8 DG A 5 13.252 -10.230 -11.557 1.00 0.48 C ATOM 44 N7 DG A 5 13.761 -11.310 -11.032 1.00 0.52 N ATOM 45 C5 DG A 5 15.134 -11.124 -11.131 1.00 0.49 C ATOM 46 C6 DG A 5 16.206 -11.961 -10.727 1.00 0.58 C ATOM 47 O6 DG A 5 16.151 -13.072 -10.185 1.00 0.67 O ATOM 48 N1 DG A 5 17.446 -11.393 -11.012 1.00 0.60 N ATOM 49 C2 DG A 5 17.619 -10.167 -11.611 1.00 0.56 C ATOM 50 N2 DG A 5 18.889 -9.781 -11.806 1.00 0.67 N ATOM 51 N3 DG A 5 16.629 -9.377 -11.992 1.00 0.47 N ATOM 52 C4 DG A 5 15.422 -9.914 -11.723 1.00 0.43 C ATOM 0 H5' DG A 5 10.066 -7.374 -12.426 1.00 0.38 H new ATOM 0 H5'' DG A 5 10.119 -7.100 -14.156 1.00 0.38 H new ATOM 0 H4' DG A 5 11.774 -5.815 -12.969 1.00 0.45 H new ATOM 0 H3' DG A 5 12.338 -7.016 -15.343 1.00 0.48 H new ATOM 0 H2' DG A 5 13.355 -9.042 -14.461 1.00 0.46 H new ATOM 0 H2'' DG A 5 14.761 -8.013 -14.654 1.00 0.46 H new ATOM 0 H1' DG A 5 14.848 -7.438 -12.413 1.00 0.45 H new ATOM 0 H8 DG A 5 12.190 -10.053 -11.638 1.00 0.48 H new ATOM 0 H1 DG A 5 18.281 -11.922 -10.760 1.00 0.60 H new ATOM 0 H21 DG A 5 19.087 -8.882 -12.246 1.00 0.67 H new ATOM 0 H22 DG A 5 19.656 -10.386 -11.515 1.00 0.67 H new ATOM 64 P DA A 6 13.247 -4.599 -15.612 1.00 0.65 P ATOM 65 OP1 DA A 6 12.941 -5.302 -16.885 1.00 0.70 O ATOM 66 OP2 DA A 6 14.273 -3.525 -15.597 1.00 0.78 O ATOM 67 O5' DA A 6 11.886 -4.000 -15.038 1.00 0.74 O ATOM 68 C5' DA A 6 11.892 -3.082 -13.945 1.00 0.76 C ATOM 69 C4' DA A 6 10.493 -2.571 -13.687 1.00 0.74 C ATOM 70 O4' DA A 6 9.592 -3.689 -13.548 1.00 0.60 O ATOM 71 C3' DA A 6 10.327 -1.776 -12.400 1.00 0.84 C ATOM 72 O3' DA A 6 10.606 -0.390 -12.630 1.00 1.09 O ATOM 73 C2' DA A 6 8.860 -1.982 -12.061 1.00 0.64 C ATOM 74 C1' DA A 6 8.545 -3.360 -12.642 1.00 0.58 C ATOM 75 N9 DA A 6 8.463 -4.428 -11.643 1.00 0.56 N ATOM 76 C8 DA A 6 9.439 -4.840 -10.769 1.00 0.60 C ATOM 77 N7 DA A 6 9.067 -5.826 -9.989 1.00 0.61 N ATOM 78 C5 DA A 6 7.759 -6.083 -10.375 1.00 0.58 C ATOM 79 C6 DA A 6 6.807 -7.016 -9.929 1.00 0.63 C ATOM 80 N6 DA A 6 7.036 -7.901 -8.956 1.00 0.73 N ATOM 81 N1 DA A 6 5.595 -7.009 -10.525 1.00 0.64 N ATOM 82 C2 DA A 6 5.364 -6.122 -11.500 1.00 0.60 C ATOM 83 N3 DA A 6 6.177 -5.197 -12.006 1.00 0.56 N ATOM 84 C4 DA A 6 7.373 -5.230 -11.393 1.00 0.55 C ATOM 0 H5' DA A 6 12.557 -2.247 -14.165 1.00 0.76 H new ATOM 0 H5'' DA A 6 12.279 -3.571 -13.051 1.00 0.76 H new ATOM 0 H4' DA A 6 10.282 -1.921 -14.536 1.00 0.74 H new ATOM 0 H3' DA A 6 11.000 -2.091 -11.603 1.00 0.84 H new ATOM 0 H2' DA A 6 8.690 -1.953 -10.985 1.00 0.64 H new ATOM 0 H2'' DA A 6 8.234 -1.208 -12.504 1.00 0.64 H new ATOM 0 H1' DA A 6 7.564 -3.295 -13.113 1.00 0.58 H new ATOM 0 H8 DA A 6 10.421 -4.393 -10.728 1.00 0.60 H new ATOM 0 H61 DA A 6 6.303 -8.553 -8.677 1.00 0.73 H new ATOM 0 H62 DA A 6 7.944 -7.925 -8.492 1.00 0.73 H new ATOM 0 H2 DA A 6 4.378 -6.162 -11.939 1.00 0.60 H new ATOM 96 P DG A 7 10.590 0.646 -11.400 1.00 1.31 P ATOM 97 OP1 DG A 7 11.301 1.872 -11.845 1.00 1.62 O ATOM 98 OP2 DG A 7 11.051 -0.067 -10.182 1.00 1.36 O ATOM 99 O5' DG A 7 9.048 1.004 -11.218 1.00 1.31 O ATOM 100 C5' DG A 7 8.483 2.161 -11.835 1.00 0.78 C ATOM 101 C4' DG A 7 6.972 2.087 -11.799 1.00 0.59 C ATOM 102 O4' DG A 7 6.572 0.764 -11.360 1.00 0.50 O ATOM 103 C3' DG A 7 6.301 3.061 -10.831 1.00 0.50 C ATOM 104 O3' DG A 7 5.016 3.453 -11.328 1.00 0.48 O ATOM 105 C2' DG A 7 6.157 2.237 -9.566 1.00 0.47 C ATOM 106 C1' DG A 7 5.893 0.844 -10.114 1.00 0.42 C ATOM 107 N9 DG A 7 6.383 -0.241 -9.265 1.00 0.42 N ATOM 108 C8 DG A 7 7.670 -0.434 -8.827 1.00 0.50 C ATOM 109 N7 DG A 7 7.806 -1.491 -8.076 1.00 0.50 N ATOM 110 C5 DG A 7 6.529 -2.031 -8.012 1.00 0.42 C ATOM 111 C6 DG A 7 6.055 -3.186 -7.339 1.00 0.41 C ATOM 112 O6 DG A 7 6.694 -3.982 -6.642 1.00 0.49 O ATOM 113 N1 DG A 7 4.688 -3.378 -7.534 1.00 0.38 N ATOM 114 C2 DG A 7 3.887 -2.550 -8.287 1.00 0.37 C ATOM 115 N2 DG A 7 2.590 -2.890 -8.365 1.00 0.44 N ATOM 116 N3 DG A 7 4.318 -1.470 -8.919 1.00 0.36 N ATOM 117 C4 DG A 7 5.639 -1.272 -8.740 1.00 0.38 C ATOM 0 H5' DG A 7 8.826 2.236 -12.867 1.00 0.78 H new ATOM 0 H5'' DG A 7 8.823 3.059 -11.320 1.00 0.78 H new ATOM 0 H4' DG A 7 6.657 2.338 -12.812 1.00 0.59 H new ATOM 0 H3' DG A 7 6.863 3.983 -10.682 1.00 0.50 H new ATOM 0 H2' DG A 7 7.059 2.269 -8.955 1.00 0.47 H new ATOM 0 H2'' DG A 7 5.336 2.591 -8.942 1.00 0.47 H new ATOM 0 H1' DG A 7 4.813 0.715 -10.185 1.00 0.42 H new ATOM 0 H8 DG A 7 8.488 0.224 -9.079 1.00 0.50 H new ATOM 0 H1 DG A 7 4.252 -4.186 -7.089 1.00 0.38 H new ATOM 0 H21 DG A 7 1.944 -2.317 -8.908 1.00 0.44 H new ATOM 0 H22 DG A 7 2.251 -3.721 -7.881 1.00 0.44 H new ATOM 129 P DG A 8 4.182 4.605 -10.576 1.00 0.53 P ATOM 130 OP1 DG A 8 3.668 5.532 -11.617 1.00 0.58 O ATOM 131 OP2 DG A 8 5.013 5.137 -9.467 1.00 0.69 O ATOM 132 O5' DG A 8 2.940 3.831 -9.944 1.00 0.58 O ATOM 133 C5' DG A 8 1.927 3.265 -10.776 1.00 0.59 C ATOM 134 C4' DG A 8 0.823 2.675 -9.929 1.00 0.57 C ATOM 135 O4' DG A 8 1.353 1.554 -9.174 1.00 0.55 O ATOM 136 C3' DG A 8 0.218 3.634 -8.896 1.00 0.58 C ATOM 137 O3' DG A 8 -1.201 3.454 -8.824 1.00 0.78 O ATOM 138 C2' DG A 8 0.877 3.215 -7.594 1.00 0.51 C ATOM 139 C1' DG A 8 1.068 1.724 -7.797 1.00 0.48 C ATOM 140 N9 DG A 8 2.167 1.142 -7.029 1.00 0.47 N ATOM 141 C8 DG A 8 3.470 1.575 -6.988 1.00 0.54 C ATOM 142 N7 DG A 8 4.228 0.854 -6.209 1.00 0.57 N ATOM 143 C5 DG A 8 3.373 -0.116 -5.703 1.00 0.50 C ATOM 144 C6 DG A 8 3.627 -1.181 -4.803 1.00 0.56 C ATOM 145 O6 DG A 8 4.695 -1.483 -4.258 1.00 0.65 O ATOM 146 N1 DG A 8 2.481 -1.933 -4.551 1.00 0.55 N ATOM 147 C2 DG A 8 1.248 -1.680 -5.105 1.00 0.50 C ATOM 148 N2 DG A 8 0.256 -2.512 -4.751 1.00 0.57 N ATOM 149 N3 DG A 8 1.000 -0.689 -5.947 1.00 0.44 N ATOM 150 C4 DG A 8 2.099 0.047 -6.199 1.00 0.44 C ATOM 0 H5' DG A 8 2.359 2.493 -11.412 1.00 0.59 H new ATOM 0 H5'' DG A 8 1.519 4.031 -11.436 1.00 0.59 H new ATOM 0 H4' DG A 8 0.040 2.403 -10.636 1.00 0.57 H new ATOM 0 H3' DG A 8 0.384 4.684 -9.136 1.00 0.58 H new ATOM 0 H2' DG A 8 1.825 3.729 -7.434 1.00 0.51 H new ATOM 0 H2'' DG A 8 0.247 3.431 -6.731 1.00 0.51 H new ATOM 0 H1' DG A 8 0.166 1.217 -7.456 1.00 0.48 H new ATOM 0 H8 DG A 8 3.831 2.427 -7.545 1.00 0.54 H new ATOM 0 H1 DG A 8 2.562 -2.724 -3.913 1.00 0.55 H new ATOM 0 H21 DG A 8 -0.682 -2.377 -5.128 1.00 0.57 H new ATOM 0 H22 DG A 8 0.440 -3.279 -4.105 1.00 0.57 H new ATOM 162 P DG A 9 -2.109 4.523 -8.036 1.00 0.81 P ATOM 163 OP1 DG A 9 -3.519 4.288 -8.439 1.00 1.07 O ATOM 164 OP2 DG A 9 -1.510 5.870 -8.217 1.00 1.02 O ATOM 165 O5' DG A 9 -1.953 4.107 -6.504 1.00 0.62 O ATOM 166 C5' DG A 9 -3.054 4.193 -5.599 1.00 0.56 C ATOM 167 C4' DG A 9 -3.301 2.851 -4.949 1.00 0.51 C ATOM 168 O4' DG A 9 -2.035 2.158 -4.791 1.00 0.46 O ATOM 169 C3' DG A 9 -3.928 2.917 -3.547 1.00 0.55 C ATOM 170 O3' DG A 9 -4.988 1.961 -3.431 1.00 0.62 O ATOM 171 C2' DG A 9 -2.781 2.553 -2.618 1.00 0.52 C ATOM 172 C1' DG A 9 -1.949 1.628 -3.482 1.00 0.44 C ATOM 173 N9 DG A 9 -0.537 1.551 -3.108 1.00 0.39 N ATOM 174 C8 DG A 9 0.490 2.334 -3.576 1.00 0.38 C ATOM 175 N7 DG A 9 1.647 2.030 -3.056 1.00 0.39 N ATOM 176 C5 DG A 9 1.368 0.981 -2.191 1.00 0.37 C ATOM 177 C6 DG A 9 2.230 0.237 -1.346 1.00 0.41 C ATOM 178 O6 DG A 9 3.449 0.365 -1.194 1.00 0.45 O ATOM 179 N1 DG A 9 1.541 -0.741 -0.631 1.00 0.45 N ATOM 180 C2 DG A 9 0.187 -0.965 -0.728 1.00 0.50 C ATOM 181 N2 DG A 9 -0.305 -1.953 0.037 1.00 0.61 N ATOM 182 N3 DG A 9 -0.627 -0.277 -1.512 1.00 0.48 N ATOM 183 C4 DG A 9 0.026 0.674 -2.210 1.00 0.40 C ATOM 0 H5' DG A 9 -3.948 4.517 -6.132 1.00 0.56 H new ATOM 0 H5'' DG A 9 -2.849 4.943 -4.835 1.00 0.56 H new ATOM 0 H4' DG A 9 -4.003 2.343 -5.610 1.00 0.51 H new ATOM 0 H3' DG A 9 -4.361 3.891 -3.321 1.00 0.55 H new ATOM 0 H2' DG A 9 -2.218 3.432 -2.303 1.00 0.52 H new ATOM 0 H2'' DG A 9 -3.132 2.058 -1.713 1.00 0.52 H new ATOM 0 H1' DG A 9 -2.335 0.614 -3.374 1.00 0.44 H new ATOM 0 H8 DG A 9 0.353 3.122 -4.302 1.00 0.38 H new ATOM 0 H1 DG A 9 2.076 -1.330 0.007 1.00 0.45 H new ATOM 0 H21 DG A 9 -1.301 -2.170 0.011 1.00 0.61 H new ATOM 0 H22 DG A 9 0.318 -2.487 0.644 1.00 0.61 H new ATOM 195 P DT A 10 -6.461 2.326 -3.966 1.00 0.72 P ATOM 196 OP1 DT A 10 -6.319 3.429 -4.950 1.00 0.92 O ATOM 197 OP2 DT A 10 -7.352 2.501 -2.791 1.00 1.17 O ATOM 198 O5' DT A 10 -6.919 1.018 -4.752 1.00 0.70 O ATOM 199 C5' DT A 10 -6.093 0.442 -5.763 1.00 0.66 C ATOM 200 C4' DT A 10 -6.649 -0.895 -6.192 1.00 0.69 C ATOM 201 O4' DT A 10 -7.964 -0.701 -6.767 1.00 0.72 O ATOM 202 C3' DT A 10 -5.836 -1.612 -7.267 1.00 0.76 C ATOM 203 O3' DT A 10 -4.886 -2.500 -6.667 1.00 0.85 O ATOM 204 C2' DT A 10 -6.892 -2.390 -8.027 1.00 0.88 C ATOM 205 C1' DT A 10 -8.102 -1.470 -7.957 1.00 0.71 C ATOM 206 N1 DT A 10 -8.224 -0.535 -9.094 1.00 0.66 N ATOM 207 C2 DT A 10 -8.535 -1.055 -10.331 1.00 0.75 C ATOM 208 O2 DT A 10 -8.713 -2.247 -10.528 1.00 0.85 O ATOM 209 N3 DT A 10 -8.631 -0.126 -11.335 1.00 0.92 N ATOM 210 C4 DT A 10 -8.451 1.238 -11.227 1.00 0.88 C ATOM 211 O4 DT A 10 -8.570 1.950 -12.221 1.00 1.09 O ATOM 212 C5 DT A 10 -8.128 1.716 -9.902 1.00 0.78 C ATOM 213 C7 DT A 10 -7.916 3.184 -9.692 1.00 0.95 C ATOM 214 C6 DT A 10 -8.030 0.819 -8.909 1.00 0.77 C ATOM 0 H5' DT A 10 -5.078 0.318 -5.386 1.00 0.66 H new ATOM 0 H5'' DT A 10 -6.035 1.112 -6.621 1.00 0.66 H new ATOM 0 H4' DT A 10 -6.641 -1.503 -5.288 1.00 0.69 H new ATOM 0 H3' DT A 10 -5.260 -0.937 -7.900 1.00 0.76 H new ATOM 0 H2' DT A 10 -6.590 -2.583 -9.056 1.00 0.88 H new ATOM 0 H2'' DT A 10 -7.092 -3.357 -7.566 1.00 0.88 H new ATOM 0 H1' DT A 10 -8.994 -2.096 -7.979 1.00 0.71 H new ATOM 0 H3 DT A 10 -8.860 -0.482 -12.263 1.00 0.92 H new ATOM 0 H71 DT A 10 -8.207 3.452 -8.676 1.00 0.95 H new ATOM 0 H72 DT A 10 -6.864 3.425 -9.843 1.00 0.95 H new ATOM 0 H73 DT A 10 -8.523 3.745 -10.403 1.00 0.95 H new ATOM 0 H6 DT A 10 -7.788 1.173 -7.918 1.00 0.77 H new ATOM 227 P DG A 11 -3.411 -2.642 -7.292 1.00 0.72 P ATOM 228 OP1 DG A 11 -2.447 -2.150 -6.275 1.00 0.99 O ATOM 229 OP2 DG A 11 -3.416 -2.039 -8.650 1.00 0.78 O ATOM 230 O5' DG A 11 -3.203 -4.214 -7.444 1.00 0.75 O ATOM 231 C5' DG A 11 -4.174 -5.027 -8.103 1.00 0.61 C ATOM 232 C4' DG A 11 -4.064 -6.456 -7.625 1.00 0.40 C ATOM 233 O4' DG A 11 -2.709 -6.925 -7.839 1.00 0.34 O ATOM 234 C3' DG A 11 -4.338 -6.657 -6.135 1.00 0.47 C ATOM 235 O3' DG A 11 -4.920 -7.945 -5.903 1.00 0.49 O ATOM 236 C2' DG A 11 -2.955 -6.574 -5.518 1.00 0.44 C ATOM 237 C1' DG A 11 -2.074 -7.188 -6.594 1.00 0.34 C ATOM 238 N9 DG A 11 -0.722 -6.636 -6.653 1.00 0.33 N ATOM 239 C8 DG A 11 -0.297 -5.563 -7.397 1.00 0.37 C ATOM 240 N7 DG A 11 0.972 -5.300 -7.246 1.00 0.39 N ATOM 241 C5 DG A 11 1.413 -6.260 -6.344 1.00 0.35 C ATOM 242 C6 DG A 11 2.702 -6.478 -5.797 1.00 0.38 C ATOM 243 O6 DG A 11 3.741 -5.844 -6.011 1.00 0.43 O ATOM 244 N1 DG A 11 2.719 -7.560 -4.919 1.00 0.38 N ATOM 245 C2 DG A 11 1.620 -8.329 -4.613 1.00 0.37 C ATOM 246 N2 DG A 11 1.823 -9.331 -3.742 1.00 0.43 N ATOM 247 N3 DG A 11 0.412 -8.135 -5.117 1.00 0.35 N ATOM 248 C4 DG A 11 0.381 -7.091 -5.969 1.00 0.33 C ATOM 0 H5' DG A 11 -4.025 -4.984 -9.182 1.00 0.61 H new ATOM 0 H5'' DG A 11 -5.175 -4.645 -7.904 1.00 0.61 H new ATOM 0 H4' DG A 11 -4.820 -7.000 -8.191 1.00 0.40 H new ATOM 0 H3' DG A 11 -5.036 -5.930 -5.721 1.00 0.47 H new ATOM 0 H2' DG A 11 -2.670 -5.545 -5.299 1.00 0.44 H new ATOM 0 H2'' DG A 11 -2.895 -7.127 -4.581 1.00 0.44 H new ATOM 0 H1' DG A 11 -1.963 -8.248 -6.366 1.00 0.34 H new ATOM 0 H8 DG A 11 -0.948 -4.993 -8.043 1.00 0.37 H new ATOM 0 H1 DG A 11 3.605 -7.798 -4.474 1.00 0.38 H new ATOM 0 H21 DG A 11 1.049 -9.938 -3.473 1.00 0.43 H new ATOM 0 H22 DG A 11 2.752 -9.485 -3.349 1.00 0.43 H new ATOM 260 P DG A 12 -5.727 -8.227 -4.541 1.00 0.54 P ATOM 261 OP1 DG A 12 -6.483 -9.491 -4.727 1.00 0.75 O ATOM 262 OP2 DG A 12 -6.453 -6.988 -4.161 1.00 0.61 O ATOM 263 O5' DG A 12 -4.583 -8.489 -3.463 1.00 0.60 O ATOM 264 C5' DG A 12 -4.533 -7.746 -2.245 1.00 0.56 C ATOM 265 C4' DG A 12 -3.500 -8.341 -1.317 1.00 0.39 C ATOM 266 O4' DG A 12 -2.179 -8.056 -1.840 1.00 0.38 O ATOM 267 C3' DG A 12 -3.525 -7.789 0.114 1.00 0.36 C ATOM 268 O3' DG A 12 -3.400 -8.858 1.059 1.00 0.50 O ATOM 269 C2' DG A 12 -2.315 -6.872 0.180 1.00 0.38 C ATOM 270 C1' DG A 12 -1.366 -7.498 -0.825 1.00 0.36 C ATOM 271 N9 DG A 12 -0.443 -6.556 -1.455 1.00 0.36 N ATOM 272 C8 DG A 12 -0.737 -5.631 -2.428 1.00 0.40 C ATOM 273 N7 DG A 12 0.296 -4.925 -2.798 1.00 0.43 N ATOM 274 C5 DG A 12 1.338 -5.414 -2.023 1.00 0.40 C ATOM 275 C6 DG A 12 2.704 -5.036 -1.981 1.00 0.44 C ATOM 276 O6 DG A 12 3.276 -4.163 -2.643 1.00 0.49 O ATOM 277 N1 DG A 12 3.424 -5.784 -1.052 1.00 0.45 N ATOM 278 C2 DG A 12 2.882 -6.775 -0.265 1.00 0.45 C ATOM 279 N2 DG A 12 3.728 -7.394 0.574 1.00 0.53 N ATOM 280 N3 DG A 12 1.609 -7.136 -0.294 1.00 0.42 N ATOM 281 C4 DG A 12 0.900 -6.419 -1.189 1.00 0.38 C ATOM 0 H5' DG A 12 -5.512 -7.753 -1.765 1.00 0.56 H new ATOM 0 H5'' DG A 12 -4.288 -6.705 -2.455 1.00 0.56 H new ATOM 0 H4' DG A 12 -3.737 -9.404 -1.270 1.00 0.39 H new ATOM 0 H3' DG A 12 -4.454 -7.270 0.351 1.00 0.36 H new ATOM 0 H2' DG A 12 -2.569 -5.846 -0.088 1.00 0.38 H new ATOM 0 H2'' DG A 12 -1.883 -6.843 1.180 1.00 0.38 H new ATOM 0 H1' DG A 12 -0.746 -8.221 -0.295 1.00 0.36 H new ATOM 0 H8 DG A 12 -1.725 -5.501 -2.845 1.00 0.40 H new ATOM 0 H1 DG A 12 4.419 -5.584 -0.948 1.00 0.45 H new ATOM 0 H21 DG A 12 3.388 -8.137 1.184 1.00 0.53 H new ATOM 0 H22 DG A 12 4.710 -7.121 0.601 1.00 0.53 H new ATOM 293 P DG A 13 -3.689 -8.590 2.618 1.00 0.60 P ATOM 294 OP1 DG A 13 -4.152 -9.871 3.210 1.00 0.74 O ATOM 295 OP2 DG A 13 -4.540 -7.378 2.736 1.00 0.64 O ATOM 296 O5' DG A 13 -2.254 -8.255 3.223 1.00 0.68 O ATOM 297 C5' DG A 13 -2.116 -7.739 4.546 1.00 0.54 C ATOM 298 C4' DG A 13 -0.693 -7.911 5.025 1.00 0.42 C ATOM 299 O4' DG A 13 0.211 -7.384 4.021 1.00 0.44 O ATOM 300 C3' DG A 13 -0.359 -7.175 6.328 1.00 0.48 C ATOM 301 O3' DG A 13 0.466 -7.995 7.163 1.00 0.68 O ATOM 302 C2' DG A 13 0.406 -5.949 5.861 1.00 0.45 C ATOM 303 C1' DG A 13 1.103 -6.457 4.615 1.00 0.40 C ATOM 304 N9 DG A 13 1.409 -5.423 3.628 1.00 0.36 N ATOM 305 C8 DG A 13 0.526 -4.790 2.787 1.00 0.39 C ATOM 306 N7 DG A 13 1.093 -3.903 2.016 1.00 0.41 N ATOM 307 C5 DG A 13 2.435 -3.953 2.370 1.00 0.40 C ATOM 308 C6 DG A 13 3.540 -3.217 1.874 1.00 0.47 C ATOM 309 O6 DG A 13 3.548 -2.345 0.998 1.00 0.50 O ATOM 310 N1 DG A 13 4.730 -3.574 2.505 1.00 0.53 N ATOM 311 C2 DG A 13 4.829 -4.528 3.493 1.00 0.52 C ATOM 312 N2 DG A 13 6.058 -4.743 3.988 1.00 0.64 N ATOM 313 N3 DG A 13 3.805 -5.220 3.964 1.00 0.45 N ATOM 314 C4 DG A 13 2.647 -4.884 3.361 1.00 0.38 C ATOM 0 H5' DG A 13 -2.800 -8.256 5.219 1.00 0.54 H new ATOM 0 H5'' DG A 13 -2.389 -6.684 4.563 1.00 0.54 H new ATOM 0 H4' DG A 13 -0.581 -8.980 5.203 1.00 0.42 H new ATOM 0 H3' DG A 13 -1.242 -6.924 6.916 1.00 0.48 H new ATOM 0 H2' DG A 13 -0.259 -5.114 5.643 1.00 0.45 H new ATOM 0 H2'' DG A 13 1.116 -5.603 6.612 1.00 0.45 H new ATOM 0 H1' DG A 13 2.063 -6.880 4.912 1.00 0.40 H new ATOM 0 H8 DG A 13 -0.532 -5.005 2.766 1.00 0.39 H new ATOM 0 H1 DG A 13 5.584 -3.097 2.216 1.00 0.53 H new ATOM 0 H21 DG A 13 6.198 -5.437 4.722 1.00 0.64 H new ATOM 0 H22 DG A 13 6.852 -4.212 3.630 1.00 0.64 H new ATOM 326 P DT A 14 0.549 -7.703 8.742 1.00 1.33 P ATOM 327 OP1 DT A 14 -0.841 -7.698 9.267 1.00 1.60 O ATOM 328 OP2 DT A 14 1.416 -6.515 8.952 1.00 1.93 O ATOM 329 O5' DT A 14 1.298 -8.980 9.332 1.00 1.42 O ATOM 330 C5' DT A 14 0.657 -10.255 9.371 1.00 1.33 C ATOM 331 C4' DT A 14 1.664 -11.352 9.113 1.00 1.10 C ATOM 332 O4' DT A 14 2.842 -11.117 9.921 1.00 1.33 O ATOM 333 C3' DT A 14 1.194 -12.755 9.482 1.00 0.53 C ATOM 334 O3' DT A 14 0.575 -13.389 8.357 1.00 0.83 O ATOM 335 C2' DT A 14 2.487 -13.457 9.849 1.00 0.59 C ATOM 336 C1' DT A 14 3.308 -12.341 10.480 1.00 1.13 C ATOM 337 N1 DT A 14 3.183 -12.249 11.948 1.00 1.35 N ATOM 338 C2 DT A 14 3.997 -13.048 12.721 1.00 1.71 C ATOM 339 O2 DT A 14 4.812 -13.824 12.250 1.00 1.82 O ATOM 340 N3 DT A 14 3.820 -12.906 14.074 1.00 2.04 N ATOM 341 C4 DT A 14 2.933 -12.065 14.715 1.00 2.02 C ATOM 342 O4 DT A 14 2.888 -12.045 15.942 1.00 2.40 O ATOM 343 C5 DT A 14 2.110 -11.255 13.844 1.00 1.68 C ATOM 344 C7 DT A 14 1.118 -10.314 14.453 1.00 1.81 C ATOM 345 C6 DT A 14 2.271 -11.383 12.518 1.00 1.41 C ATOM 0 H5' DT A 14 -0.135 -10.295 8.623 1.00 1.33 H new ATOM 0 H5'' DT A 14 0.186 -10.404 10.343 1.00 1.33 H new ATOM 0 H4' DT A 14 1.842 -11.317 8.038 1.00 1.10 H new ATOM 0 H3' DT A 14 0.453 -12.770 10.281 1.00 0.53 H new ATOM 0 H2' DT A 14 2.318 -14.278 10.545 1.00 0.59 H new ATOM 0 H2'' DT A 14 2.982 -13.878 8.974 1.00 0.59 H new ATOM 0 H1' DT A 14 4.358 -12.549 10.273 1.00 1.13 H new ATOM 0 H3 DT A 14 4.409 -13.486 14.672 1.00 2.04 H new ATOM 0 H71 DT A 14 0.981 -9.455 13.796 1.00 1.81 H new ATOM 0 H72 DT A 14 0.165 -10.826 14.585 1.00 1.81 H new ATOM 0 H73 DT A 14 1.485 -9.975 15.422 1.00 1.81 H new ATOM 0 H6 DT A 14 1.658 -10.780 11.865 1.00 1.41 H new ATOM 358 P DA A 15 -1.026 -13.513 8.289 1.00 1.02 P ATOM 359 OP1 DA A 15 -1.554 -12.208 7.818 1.00 1.55 O ATOM 360 OP2 DA A 15 -1.506 -14.076 9.577 1.00 1.13 O ATOM 361 O5' DA A 15 -1.281 -14.593 7.145 1.00 1.28 O ATOM 362 C5' DA A 15 -0.890 -14.343 5.794 1.00 1.28 C ATOM 363 C4' DA A 15 0.485 -14.915 5.536 1.00 1.21 C ATOM 364 O4' DA A 15 0.538 -16.272 6.036 1.00 1.25 O ATOM 365 C3' DA A 15 0.874 -15.011 4.064 1.00 1.35 C ATOM 366 O3' DA A 15 1.556 -13.822 3.648 1.00 1.17 O ATOM 367 C2' DA A 15 1.812 -16.203 4.040 1.00 1.65 C ATOM 368 C1' DA A 15 1.239 -17.108 5.122 1.00 1.41 C ATOM 369 N9 DA A 15 0.304 -18.120 4.628 1.00 1.35 N ATOM 370 C8 DA A 15 -1.057 -18.007 4.479 1.00 1.40 C ATOM 371 N7 DA A 15 -1.629 -19.090 4.009 1.00 1.47 N ATOM 372 C5 DA A 15 -0.574 -19.976 3.837 1.00 1.41 C ATOM 373 C6 DA A 15 -0.519 -21.300 3.367 1.00 1.51 C ATOM 374 N6 DA A 15 -1.589 -21.991 2.969 1.00 1.60 N ATOM 375 N1 DA A 15 0.691 -21.899 3.320 1.00 1.70 N ATOM 376 C2 DA A 15 1.766 -21.206 3.719 1.00 1.82 C ATOM 377 N3 DA A 15 1.840 -19.959 4.179 1.00 1.70 N ATOM 378 C4 DA A 15 0.622 -19.392 4.214 1.00 1.44 C ATOM 0 H5' DA A 15 -0.888 -13.270 5.601 1.00 1.28 H new ATOM 0 H5'' DA A 15 -1.612 -14.789 5.110 1.00 1.28 H new ATOM 0 H4' DA A 15 1.169 -14.227 6.032 1.00 1.21 H new ATOM 0 H3' DA A 15 0.021 -15.120 3.395 1.00 1.35 H new ATOM 0 H2' DA A 15 1.819 -16.692 3.066 1.00 1.65 H new ATOM 0 H2'' DA A 15 2.840 -15.913 4.258 1.00 1.65 H new ATOM 0 H1' DA A 15 2.072 -17.649 5.570 1.00 1.41 H new ATOM 0 H8 DA A 15 -1.605 -17.110 4.726 1.00 1.40 H new ATOM 0 H61 DA A 15 -1.483 -22.950 2.638 1.00 1.60 H new ATOM 0 H62 DA A 15 -2.513 -21.560 2.996 1.00 1.60 H new ATOM 0 H2 DA A 15 2.706 -21.734 3.659 1.00 1.82 H new ATOM 390 P DG A 16 1.459 -13.335 2.118 1.00 0.98 P ATOM 391 OP1 DG A 16 0.742 -12.035 2.111 1.00 1.26 O ATOM 392 OP2 DG A 16 0.944 -14.462 1.299 1.00 1.01 O ATOM 393 O5' DG A 16 2.974 -13.067 1.703 1.00 0.67 O ATOM 394 C5' DG A 16 3.912 -14.139 1.613 1.00 0.65 C ATOM 395 C4' DG A 16 5.325 -13.604 1.659 1.00 0.58 C ATOM 396 O4' DG A 16 5.649 -13.013 0.373 1.00 0.54 O ATOM 397 C3' DG A 16 5.565 -12.507 2.703 1.00 0.59 C ATOM 398 O3' DG A 16 6.836 -12.694 3.336 1.00 0.77 O ATOM 399 C2' DG A 16 5.559 -11.228 1.884 1.00 0.51 C ATOM 400 C1' DG A 16 6.128 -11.693 0.559 1.00 0.45 C ATOM 401 N9 DG A 16 5.717 -10.893 -0.593 1.00 0.36 N ATOM 402 C8 DG A 16 4.498 -10.913 -1.226 1.00 0.37 C ATOM 403 N7 DG A 16 4.423 -10.080 -2.227 1.00 0.38 N ATOM 404 C5 DG A 16 5.671 -9.472 -2.259 1.00 0.33 C ATOM 405 C6 DG A 16 6.184 -8.478 -3.130 1.00 0.39 C ATOM 406 O6 DG A 16 5.614 -7.919 -4.073 1.00 0.52 O ATOM 407 N1 DG A 16 7.499 -8.138 -2.815 1.00 0.38 N ATOM 408 C2 DG A 16 8.220 -8.696 -1.784 1.00 0.36 C ATOM 409 N2 DG A 16 9.473 -8.243 -1.623 1.00 0.44 N ATOM 410 N3 DG A 16 7.750 -9.623 -0.965 1.00 0.35 N ATOM 411 C4 DG A 16 6.480 -9.961 -1.258 1.00 0.32 C ATOM 0 H5' DG A 16 3.755 -14.692 0.687 1.00 0.65 H new ATOM 0 H5'' DG A 16 3.754 -14.839 2.433 1.00 0.65 H new ATOM 0 H4' DG A 16 5.944 -14.462 1.922 1.00 0.58 H new ATOM 0 H3' DG A 16 4.821 -12.503 3.499 1.00 0.59 H new ATOM 0 H2' DG A 16 4.554 -10.819 1.775 1.00 0.51 H new ATOM 0 H2'' DG A 16 6.172 -10.450 2.340 1.00 0.51 H new ATOM 0 H1' DG A 16 7.214 -11.608 0.608 1.00 0.45 H new ATOM 0 H8 DG A 16 3.683 -11.554 -0.925 1.00 0.37 H new ATOM 0 H1 DG A 16 7.957 -7.428 -3.387 1.00 0.38 H new ATOM 0 H21 DG A 16 10.059 -8.617 -0.876 1.00 0.44 H new ATOM 0 H22 DG A 16 9.840 -7.525 -2.247 1.00 0.44 H new ATOM 423 P DG A 17 7.240 -11.793 4.607 1.00 0.84 P ATOM 424 OP1 DG A 17 7.916 -12.683 5.585 1.00 1.13 O ATOM 425 OP2 DG A 17 6.048 -11.013 5.027 1.00 1.00 O ATOM 426 O5' DG A 17 8.325 -10.777 4.030 1.00 0.90 O ATOM 427 C5' DG A 17 9.568 -11.247 3.509 1.00 0.74 C ATOM 428 C4' DG A 17 10.532 -10.096 3.335 1.00 0.62 C ATOM 429 O4' DG A 17 10.122 -9.302 2.192 1.00 0.60 O ATOM 430 C3' DG A 17 10.599 -9.126 4.521 1.00 0.62 C ATOM 431 O3' DG A 17 11.948 -8.693 4.732 1.00 0.75 O ATOM 432 C2' DG A 17 9.727 -7.965 4.076 1.00 0.59 C ATOM 433 C1' DG A 17 9.957 -7.947 2.578 1.00 0.50 C ATOM 434 N9 DG A 17 8.855 -7.384 1.800 1.00 0.49 N ATOM 435 C8 DG A 17 7.554 -7.824 1.765 1.00 0.58 C ATOM 436 N7 DG A 17 6.792 -7.120 0.974 1.00 0.58 N ATOM 437 C5 DG A 17 7.643 -6.154 0.454 1.00 0.47 C ATOM 438 C6 DG A 17 7.384 -5.104 -0.463 1.00 0.48 C ATOM 439 O6 DG A 17 6.316 -4.815 -1.014 1.00 0.53 O ATOM 440 N1 DG A 17 8.526 -4.350 -0.727 1.00 0.46 N ATOM 441 C2 DG A 17 9.761 -4.588 -0.167 1.00 0.44 C ATOM 442 N2 DG A 17 10.749 -3.756 -0.532 1.00 0.53 N ATOM 443 N3 DG A 17 10.013 -5.564 0.690 1.00 0.40 N ATOM 444 C4 DG A 17 8.917 -6.302 0.953 1.00 0.42 C ATOM 0 H5' DG A 17 9.405 -11.742 2.552 1.00 0.74 H new ATOM 0 H5'' DG A 17 9.995 -11.990 4.183 1.00 0.74 H new ATOM 0 H4' DG A 17 11.511 -10.563 3.223 1.00 0.62 H new ATOM 0 H3' DG A 17 10.268 -9.570 5.460 1.00 0.62 H new ATOM 0 H2' DG A 17 8.678 -8.125 4.325 1.00 0.59 H new ATOM 0 H2'' DG A 17 10.026 -7.028 4.545 1.00 0.59 H new ATOM 0 H1' DG A 17 10.819 -7.311 2.377 1.00 0.50 H new ATOM 0 H8 DG A 17 7.197 -8.669 2.336 1.00 0.58 H new ATOM 0 H1 DG A 17 8.441 -3.570 -1.379 1.00 0.46 H new ATOM 0 H21 DG A 17 11.687 -3.880 -0.151 1.00 0.53 H new ATOM 0 H22 DG A 17 10.562 -2.999 -1.190 1.00 0.53 H new ATOM 456 P DG A 18 12.305 -7.761 5.994 1.00 0.66 P ATOM 457 OP1 DG A 18 13.539 -8.307 6.613 1.00 0.85 O ATOM 458 OP2 DG A 18 11.081 -7.599 6.819 1.00 0.73 O ATOM 459 O5' DG A 18 12.660 -6.350 5.342 1.00 0.73 O ATOM 460 C5' DG A 18 13.699 -6.232 4.370 1.00 0.48 C ATOM 461 C4' DG A 18 13.984 -4.776 4.082 1.00 0.31 C ATOM 462 O4' DG A 18 12.957 -4.258 3.197 1.00 0.38 O ATOM 463 C3' DG A 18 13.985 -3.862 5.314 1.00 0.45 C ATOM 464 O3' DG A 18 15.059 -2.918 5.232 1.00 0.60 O ATOM 465 C2' DG A 18 12.644 -3.152 5.238 1.00 0.56 C ATOM 466 C1' DG A 18 12.403 -3.074 3.743 1.00 0.37 C ATOM 467 N9 DG A 18 10.995 -3.013 3.355 1.00 0.33 N ATOM 468 C8 DG A 18 9.970 -3.797 3.826 1.00 0.43 C ATOM 469 N7 DG A 18 8.814 -3.510 3.294 1.00 0.48 N ATOM 470 C5 DG A 18 9.091 -2.470 2.417 1.00 0.36 C ATOM 471 C6 DG A 18 8.230 -1.743 1.557 1.00 0.37 C ATOM 472 O6 DG A 18 7.012 -1.883 1.398 1.00 0.47 O ATOM 473 N1 DG A 18 8.916 -0.768 0.835 1.00 0.42 N ATOM 474 C2 DG A 18 10.268 -0.533 0.939 1.00 0.51 C ATOM 475 N2 DG A 18 10.760 0.447 0.165 1.00 0.71 N ATOM 476 N3 DG A 18 11.082 -1.204 1.738 1.00 0.47 N ATOM 477 C4 DG A 18 10.431 -2.151 2.443 1.00 0.34 C ATOM 0 H5' DG A 18 13.407 -6.741 3.452 1.00 0.48 H new ATOM 0 H5'' DG A 18 14.603 -6.722 4.732 1.00 0.48 H new ATOM 0 H4' DG A 18 14.986 -4.764 3.653 1.00 0.31 H new ATOM 0 H3' DG A 18 14.122 -4.407 6.248 1.00 0.45 H new ATOM 0 H2' DG A 18 11.859 -3.710 5.748 1.00 0.56 H new ATOM 0 H2'' DG A 18 12.681 -2.164 5.696 1.00 0.56 H new ATOM 0 H1' DG A 18 12.854 -2.151 3.377 1.00 0.37 H new ATOM 0 H8 DG A 18 10.108 -4.574 4.564 1.00 0.43 H new ATOM 0 H1 DG A 18 8.381 -0.190 0.187 1.00 0.42 H new ATOM 0 H21 DG A 18 11.755 0.670 0.196 1.00 0.71 H new ATOM 0 H22 DG A 18 10.139 0.968 -0.454 1.00 0.71 H new ATOM 489 P DT A 19 16.263 -2.972 6.297 1.00 0.58 P ATOM 490 OP1 DT A 19 16.002 -4.111 7.214 1.00 0.69 O ATOM 491 OP2 DT A 19 16.451 -1.609 6.858 1.00 0.76 O ATOM 492 O5' DT A 19 17.541 -3.330 5.416 1.00 0.60 O ATOM 493 C5' DT A 19 17.963 -2.478 4.351 1.00 0.81 C ATOM 494 C4' DT A 19 19.196 -3.045 3.687 1.00 0.68 C ATOM 495 O4' DT A 19 20.234 -3.215 4.675 1.00 0.86 O ATOM 496 C3' DT A 19 19.015 -4.423 3.065 1.00 0.64 C ATOM 497 O3' DT A 19 18.573 -4.304 1.709 1.00 0.61 O ATOM 498 C2' DT A 19 20.414 -5.010 3.125 1.00 0.85 C ATOM 499 C1' DT A 19 21.034 -4.348 4.353 1.00 0.77 C ATOM 500 N1 DT A 19 21.092 -5.217 5.545 1.00 0.83 N ATOM 501 C2 DT A 19 22.064 -6.192 5.590 1.00 0.86 C ATOM 502 O2 DT A 19 22.874 -6.369 4.695 1.00 1.12 O ATOM 503 N3 DT A 19 22.054 -6.958 6.728 1.00 0.97 N ATOM 504 C4 DT A 19 21.190 -6.848 7.799 1.00 1.33 C ATOM 505 O4 DT A 19 21.303 -7.610 8.756 1.00 1.60 O ATOM 506 C5 DT A 19 20.196 -5.805 7.686 1.00 1.54 C ATOM 507 C7 DT A 19 19.215 -5.613 8.801 1.00 2.22 C ATOM 508 C6 DT A 19 20.193 -5.047 6.579 1.00 1.22 C ATOM 0 H5' DT A 19 18.174 -1.480 4.736 1.00 0.81 H new ATOM 0 H5'' DT A 19 17.162 -2.374 3.619 1.00 0.81 H new ATOM 0 H4' DT A 19 19.434 -2.331 2.898 1.00 0.68 H new ATOM 0 H3' DT A 19 18.270 -5.035 3.573 1.00 0.64 H new ATOM 0 H2' DT A 19 20.389 -6.095 3.225 1.00 0.85 H new ATOM 0 H2'' DT A 19 20.981 -4.787 2.221 1.00 0.85 H new ATOM 0 H1' DT A 19 22.064 -4.097 4.099 1.00 0.77 H new ATOM 0 H3 DT A 19 22.763 -7.689 6.790 1.00 0.97 H new ATOM 0 H71 DT A 19 18.922 -4.564 8.851 1.00 2.22 H new ATOM 0 H72 DT A 19 18.334 -6.228 8.620 1.00 2.22 H new ATOM 0 H73 DT A 19 19.675 -5.906 9.745 1.00 2.22 H new ATOM 0 H6 DT A 19 19.452 -4.266 6.493 1.00 1.22 H new ATOM 521 P DG A 20 17.708 -5.484 1.043 1.00 0.90 P ATOM 522 OP1 DG A 20 16.472 -5.641 1.853 1.00 1.27 O ATOM 523 OP2 DG A 20 18.598 -6.653 0.830 1.00 1.46 O ATOM 524 O5' DG A 20 17.296 -4.902 -0.382 1.00 0.76 O ATOM 525 C5' DG A 20 16.276 -5.524 -1.163 1.00 0.66 C ATOM 526 C4' DG A 20 16.227 -4.907 -2.541 1.00 0.54 C ATOM 527 O4' DG A 20 15.149 -5.520 -3.295 1.00 0.52 O ATOM 528 C3' DG A 20 15.954 -3.399 -2.562 1.00 0.49 C ATOM 529 O3' DG A 20 16.740 -2.765 -3.577 1.00 0.46 O ATOM 530 C2' DG A 20 14.476 -3.308 -2.897 1.00 0.47 C ATOM 531 C1' DG A 20 14.268 -4.522 -3.781 1.00 0.47 C ATOM 532 N9 DG A 20 12.910 -5.063 -3.756 1.00 0.46 N ATOM 533 C8 DG A 20 12.469 -6.162 -3.061 1.00 0.49 C ATOM 534 N7 DG A 20 11.202 -6.415 -3.246 1.00 0.51 N ATOM 535 C5 DG A 20 10.780 -5.420 -4.118 1.00 0.46 C ATOM 536 C6 DG A 20 9.502 -5.176 -4.680 1.00 0.47 C ATOM 537 O6 DG A 20 8.458 -5.815 -4.511 1.00 0.50 O ATOM 538 N1 DG A 20 9.505 -4.061 -5.516 1.00 0.45 N ATOM 539 C2 DG A 20 10.611 -3.283 -5.770 1.00 0.45 C ATOM 540 N2 DG A 20 10.424 -2.238 -6.591 1.00 0.49 N ATOM 541 N3 DG A 20 11.809 -3.502 -5.252 1.00 0.45 N ATOM 542 C4 DG A 20 11.821 -4.578 -4.441 1.00 0.44 C ATOM 0 H5' DG A 20 15.310 -5.410 -0.671 1.00 0.66 H new ATOM 0 H5'' DG A 20 16.469 -6.594 -1.242 1.00 0.66 H new ATOM 0 H4' DG A 20 17.217 -5.078 -2.963 1.00 0.54 H new ATOM 0 H3' DG A 20 16.207 -2.906 -1.623 1.00 0.49 H new ATOM 0 H2' DG A 20 13.854 -3.345 -2.003 1.00 0.47 H new ATOM 0 H2'' DG A 20 14.233 -2.381 -3.416 1.00 0.47 H new ATOM 0 H1' DG A 20 14.454 -4.223 -4.813 1.00 0.47 H new ATOM 0 H8 DG A 20 13.107 -6.758 -2.425 1.00 0.49 H new ATOM 0 H1 DG A 20 8.628 -3.804 -5.970 1.00 0.45 H new ATOM 0 H21 DG A 20 11.205 -1.622 -6.819 1.00 0.49 H new ATOM 0 H22 DG A 20 9.501 -2.059 -6.987 1.00 0.49 H new ATOM 554 P DG A 21 17.041 -1.187 -3.491 1.00 0.54 P ATOM 555 OP1 DG A 21 18.139 -0.892 -4.447 1.00 0.59 O ATOM 556 OP2 DG A 21 17.197 -0.818 -2.061 1.00 0.73 O ATOM 557 O5' DG A 21 15.707 -0.507 -4.040 1.00 0.79 O ATOM 558 C5' DG A 21 15.473 -0.371 -5.443 1.00 0.69 C ATOM 559 C4' DG A 21 14.513 0.768 -5.706 1.00 0.59 C ATOM 560 O4' DG A 21 13.152 0.273 -5.611 1.00 0.65 O ATOM 561 C3' DG A 21 14.607 1.933 -4.714 1.00 0.56 C ATOM 562 O3' DG A 21 14.413 3.180 -5.393 1.00 0.84 O ATOM 563 C2' DG A 21 13.465 1.667 -3.752 1.00 0.53 C ATOM 564 C1' DG A 21 12.426 1.033 -4.658 1.00 0.58 C ATOM 565 N9 DG A 21 11.491 0.135 -3.981 1.00 0.59 N ATOM 566 C8 DG A 21 11.782 -0.777 -2.996 1.00 0.62 C ATOM 567 N7 DG A 21 10.738 -1.443 -2.585 1.00 0.63 N ATOM 568 C5 DG A 21 9.692 -0.940 -3.346 1.00 0.61 C ATOM 569 C6 DG A 21 8.315 -1.278 -3.346 1.00 0.65 C ATOM 570 O6 DG A 21 7.734 -2.119 -2.651 1.00 0.72 O ATOM 571 N1 DG A 21 7.594 -0.528 -4.273 1.00 0.65 N ATOM 572 C2 DG A 21 8.146 0.429 -5.095 1.00 0.61 C ATOM 573 N2 DG A 21 7.299 1.056 -5.926 1.00 0.64 N ATOM 574 N3 DG A 21 9.430 0.752 -5.104 1.00 0.58 N ATOM 575 C4 DG A 21 10.138 0.034 -4.211 1.00 0.58 C ATOM 0 H5' DG A 21 15.065 -1.299 -5.842 1.00 0.69 H new ATOM 0 H5'' DG A 21 16.415 -0.189 -5.960 1.00 0.69 H new ATOM 0 H4' DG A 21 14.783 1.140 -6.694 1.00 0.59 H new ATOM 0 H3' DG A 21 15.575 1.999 -4.218 1.00 0.56 H new ATOM 0 H2' DG A 21 13.761 1.000 -2.943 1.00 0.53 H new ATOM 0 H2'' DG A 21 13.098 2.584 -3.291 1.00 0.53 H new ATOM 0 H1' DG A 21 11.818 1.832 -5.082 1.00 0.58 H new ATOM 0 H8 DG A 21 12.776 -0.928 -2.601 1.00 0.62 H new ATOM 0 H1 DG A 21 6.591 -0.699 -4.348 1.00 0.65 H new ATOM 0 H21 DG A 21 7.646 1.775 -6.560 1.00 0.64 H new ATOM 0 H22 DG A 21 6.308 0.813 -5.923 1.00 0.64 H new ATOM 587 P DG A 22 14.849 4.557 -4.685 1.00 1.24 P ATOM 588 OP1 DG A 22 16.038 5.071 -5.411 1.00 2.21 O ATOM 589 OP2 DG A 22 14.929 4.326 -3.219 1.00 2.16 O ATOM 590 O5' DG A 22 13.629 5.542 -4.973 1.00 0.82 O ATOM 591 C5' DG A 22 12.773 5.989 -3.921 1.00 0.54 C ATOM 592 C4' DG A 22 11.366 6.176 -4.439 1.00 0.44 C ATOM 593 O4' DG A 22 10.767 4.882 -4.664 1.00 0.42 O ATOM 594 C3' DG A 22 10.417 6.889 -3.484 1.00 0.40 C ATOM 595 O3' DG A 22 10.468 8.304 -3.695 1.00 0.42 O ATOM 596 C2' DG A 22 9.058 6.336 -3.876 1.00 0.53 C ATOM 597 C1' DG A 22 9.371 4.933 -4.392 1.00 0.41 C ATOM 598 N9 DG A 22 9.059 3.861 -3.449 1.00 0.36 N ATOM 599 C8 DG A 22 9.943 3.161 -2.665 1.00 0.39 C ATOM 600 N7 DG A 22 9.369 2.256 -1.921 1.00 0.44 N ATOM 601 C5 DG A 22 8.021 2.364 -2.231 1.00 0.39 C ATOM 602 C6 DG A 22 6.908 1.640 -1.738 1.00 0.43 C ATOM 603 O6 DG A 22 6.897 0.731 -0.900 1.00 0.51 O ATOM 604 N1 DG A 22 5.713 2.064 -2.316 1.00 0.41 N ATOM 605 C2 DG A 22 5.616 3.066 -3.255 1.00 0.42 C ATOM 606 N2 DG A 22 4.381 3.341 -3.703 1.00 0.51 N ATOM 607 N3 DG A 22 6.649 3.749 -3.722 1.00 0.42 N ATOM 608 C4 DG A 22 7.812 3.349 -3.172 1.00 0.36 C ATOM 0 H5' DG A 22 13.146 6.928 -3.513 1.00 0.54 H new ATOM 0 H5'' DG A 22 12.776 5.264 -3.107 1.00 0.54 H new ATOM 0 H4' DG A 22 11.484 6.784 -5.336 1.00 0.44 H new ATOM 0 H3' DG A 22 10.658 6.730 -2.433 1.00 0.40 H new ATOM 0 H2' DG A 22 8.377 6.307 -3.025 1.00 0.53 H new ATOM 0 H2'' DG A 22 8.583 6.948 -4.643 1.00 0.53 H new ATOM 0 H1' DG A 22 8.747 4.767 -5.270 1.00 0.41 H new ATOM 0 H8 DG A 22 11.008 3.342 -2.664 1.00 0.39 H new ATOM 0 H1 DG A 22 4.852 1.601 -2.024 1.00 0.41 H new ATOM 0 H21 DG A 22 4.242 4.073 -4.400 1.00 0.51 H new ATOM 0 H22 DG A 22 3.581 2.818 -3.347 1.00 0.51 H new ATOM 620 P DT A 23 9.987 9.305 -2.532 1.00 0.44 P ATOM 621 OP1 DT A 23 10.131 10.689 -3.050 1.00 0.56 O ATOM 622 OP2 DT A 23 10.669 8.919 -1.271 1.00 0.75 O ATOM 623 O5' DT A 23 8.432 8.995 -2.376 1.00 0.48 O ATOM 624 C5' DT A 23 7.649 9.649 -1.377 1.00 0.55 C ATOM 625 C4' DT A 23 6.178 9.438 -1.650 1.00 0.46 C ATOM 626 O4' DT A 23 5.902 8.014 -1.686 1.00 0.45 O ATOM 627 C3' DT A 23 5.236 10.024 -0.592 1.00 0.48 C ATOM 628 O3' DT A 23 4.071 10.578 -1.216 1.00 0.55 O ATOM 629 C2' DT A 23 4.868 8.820 0.256 1.00 0.49 C ATOM 630 C1' DT A 23 4.875 7.696 -0.762 1.00 0.47 C ATOM 631 N1 DT A 23 5.157 6.362 -0.198 1.00 0.55 N ATOM 632 C2 DT A 23 4.095 5.514 0.027 1.00 0.69 C ATOM 633 O2 DT A 23 2.938 5.813 -0.221 1.00 0.76 O ATOM 634 N3 DT A 23 4.437 4.297 0.556 1.00 0.82 N ATOM 635 C4 DT A 23 5.703 3.852 0.875 1.00 0.85 C ATOM 636 O4 DT A 23 5.852 2.728 1.347 1.00 1.01 O ATOM 637 C5 DT A 23 6.771 4.791 0.614 1.00 0.74 C ATOM 638 C7 DT A 23 8.180 4.393 0.932 1.00 0.85 C ATOM 639 C6 DT A 23 6.453 5.987 0.096 1.00 0.59 C ATOM 0 H5' DT A 23 7.876 10.715 -1.366 1.00 0.55 H new ATOM 0 H5'' DT A 23 7.904 9.259 -0.391 1.00 0.55 H new ATOM 0 H4' DT A 23 5.990 9.950 -2.593 1.00 0.46 H new ATOM 0 H3' DT A 23 5.687 10.830 -0.013 1.00 0.48 H new ATOM 0 H2' DT A 23 5.589 8.650 1.055 1.00 0.49 H new ATOM 0 H2'' DT A 23 3.892 8.937 0.727 1.00 0.49 H new ATOM 0 H1' DT A 23 3.880 7.629 -1.201 1.00 0.47 H new ATOM 0 H3 DT A 23 3.670 3.648 0.734 1.00 0.82 H new ATOM 0 H71 DT A 23 8.863 4.896 0.248 1.00 0.85 H new ATOM 0 H72 DT A 23 8.417 4.680 1.957 1.00 0.85 H new ATOM 0 H73 DT A 23 8.287 3.314 0.823 1.00 0.85 H new ATOM 0 H6 DT A 23 7.249 6.690 -0.100 1.00 0.59 H new ATOM 652 P DA A 24 2.920 11.251 -0.315 1.00 0.70 P ATOM 653 OP1 DA A 24 2.262 12.294 -1.143 1.00 0.89 O ATOM 654 OP2 DA A 24 3.509 11.620 0.998 1.00 0.75 O ATOM 655 O5' DA A 24 1.875 10.070 -0.083 1.00 0.76 O ATOM 656 C5' DA A 24 1.025 10.051 1.065 1.00 0.67 C ATOM 657 C4' DA A 24 0.647 8.628 1.407 1.00 0.72 C ATOM 658 O4' DA A 24 1.845 7.897 1.774 1.00 0.69 O ATOM 659 C3' DA A 24 -0.311 8.482 2.593 1.00 0.74 C ATOM 660 O3' DA A 24 -1.211 7.389 2.375 1.00 0.91 O ATOM 661 C2' DA A 24 0.616 8.183 3.755 1.00 0.68 C ATOM 662 C1' DA A 24 1.714 7.375 3.087 1.00 0.66 C ATOM 663 N9 DA A 24 3.020 7.463 3.744 1.00 0.55 N ATOM 664 C8 DA A 24 3.988 8.423 3.571 1.00 0.49 C ATOM 665 N7 DA A 24 5.059 8.230 4.302 1.00 0.52 N ATOM 666 C5 DA A 24 4.779 7.066 5.004 1.00 0.56 C ATOM 667 C6 DA A 24 5.515 6.331 5.950 1.00 0.66 C ATOM 668 N6 DA A 24 6.735 6.674 6.369 1.00 0.74 N ATOM 669 N1 DA A 24 4.947 5.215 6.457 1.00 0.75 N ATOM 670 C2 DA A 24 3.723 4.870 6.037 1.00 0.79 C ATOM 671 N3 DA A 24 2.934 5.478 5.156 1.00 0.74 N ATOM 672 C4 DA A 24 3.527 6.583 4.670 1.00 0.60 C ATOM 0 H5' DA A 24 0.127 10.638 0.872 1.00 0.67 H new ATOM 0 H5'' DA A 24 1.533 10.514 1.911 1.00 0.67 H new ATOM 0 H4' DA A 24 0.146 8.248 0.517 1.00 0.72 H new ATOM 0 H3' DA A 24 -0.931 9.363 2.756 1.00 0.74 H new ATOM 0 H2' DA A 24 1.002 9.094 4.213 1.00 0.68 H new ATOM 0 H2'' DA A 24 0.115 7.618 4.541 1.00 0.68 H new ATOM 0 H1' DA A 24 1.429 6.324 3.127 1.00 0.66 H new ATOM 0 H8 DA A 24 3.877 9.259 2.896 1.00 0.49 H new ATOM 0 H61 DA A 24 7.218 6.098 7.059 1.00 0.74 H new ATOM 0 H62 DA A 24 7.184 7.512 6.000 1.00 0.74 H new ATOM 0 H2 DA A 24 3.319 3.970 6.476 1.00 0.79 H new ATOM 684 P DA A 25 -2.600 7.631 1.602 1.00 0.83 P ATOM 685 OP1 DA A 25 -2.298 8.415 0.377 1.00 1.12 O ATOM 686 OP2 DA A 25 -3.593 8.147 2.577 1.00 1.28 O ATOM 687 O5' DA A 25 -3.050 6.169 1.154 1.00 0.79 O ATOM 688 C5' DA A 25 -2.112 5.249 0.595 1.00 0.68 C ATOM 689 C4' DA A 25 -2.398 3.848 1.084 1.00 0.61 C ATOM 690 O4' DA A 25 -1.446 2.932 0.504 1.00 0.60 O ATOM 691 C3' DA A 25 -2.256 3.648 2.585 1.00 0.66 C ATOM 692 O3' DA A 25 -3.472 3.977 3.262 1.00 0.87 O ATOM 693 C2' DA A 25 -1.957 2.163 2.697 1.00 0.60 C ATOM 694 C1' DA A 25 -1.213 1.848 1.399 1.00 0.58 C ATOM 695 N9 DA A 25 0.236 1.694 1.556 1.00 0.60 N ATOM 696 C8 DA A 25 1.231 2.446 0.981 1.00 0.66 C ATOM 697 N7 DA A 25 2.440 2.065 1.313 1.00 0.76 N ATOM 698 C5 DA A 25 2.230 0.990 2.164 1.00 0.75 C ATOM 699 C6 DA A 25 3.115 0.145 2.858 1.00 0.86 C ATOM 700 N6 DA A 25 4.445 0.260 2.807 1.00 1.01 N ATOM 701 N1 DA A 25 2.580 -0.831 3.623 1.00 0.89 N ATOM 702 C2 DA A 25 1.247 -0.943 3.680 1.00 0.82 C ATOM 703 N3 DA A 25 0.313 -0.212 3.076 1.00 0.72 N ATOM 704 C4 DA A 25 0.877 0.750 2.323 1.00 0.66 C ATOM 0 H5' DA A 25 -1.098 5.539 0.872 1.00 0.68 H new ATOM 0 H5'' DA A 25 -2.166 5.280 -0.493 1.00 0.68 H new ATOM 0 H4' DA A 25 -3.434 3.671 0.797 1.00 0.61 H new ATOM 0 H3' DA A 25 -1.490 4.280 3.036 1.00 0.66 H new ATOM 0 H2' DA A 25 -1.347 1.942 3.573 1.00 0.60 H new ATOM 0 H2'' DA A 25 -2.871 1.576 2.788 1.00 0.60 H new ATOM 0 HO3' DA A 25 -3.844 4.801 2.884 1.00 0.87 H new ATOM 0 H1' DA A 25 -1.589 0.892 1.035 1.00 0.58 H new ATOM 0 H8 DA A 25 1.035 3.275 0.317 1.00 0.66 H new ATOM 0 H61 DA A 25 5.033 -0.385 3.334 1.00 1.01 H new ATOM 0 H62 DA A 25 4.872 0.993 2.241 1.00 1.01 H new ATOM 0 H2 DA A 25 0.876 -1.741 4.306 1.00 0.82 H new TER 717 DA A 25 HETATM 718 C17 BO6 A 101 13.286 -7.609 -6.507 1.00 0.50 C HETATM 719 C18 BO6 A 101 14.283 -6.710 -6.875 1.00 0.52 C HETATM 720 N19 BO6 A 101 13.957 -5.562 -7.597 1.00 0.51 N HETATM 721 C31 BO6 A 101 15.017 -4.605 -7.989 1.00 0.57 C HETATM 722 C20 BO6 A 101 12.630 -5.319 -7.949 1.00 0.50 C HETATM 723 C21 BO6 A 101 11.634 -6.218 -7.580 1.00 0.50 C HETATM 724 C16 BO6 A 101 11.948 -7.372 -6.857 1.00 0.50 C HETATM 725 C15 BO6 A 101 10.980 -8.293 -6.470 1.00 0.53 C HETATM 726 C14 BO6 A 101 11.252 -9.792 -6.309 1.00 0.44 C HETATM 727 C7 BO6 A 101 10.467 -10.632 -5.525 1.00 0.39 C HETATM 728 C6 BO6 A 101 9.131 -10.805 -5.857 1.00 0.37 C HETATM 729 C8 BO6 A 101 10.966 -11.301 -4.430 1.00 0.40 C HETATM 730 C9 BO6 A 101 10.129 -12.122 -3.696 1.00 0.42 C HETATM 731 C2 BO6 A 101 8.845 -12.263 -4.049 1.00 0.39 C HETATM 732 N1 BO6 A 101 7.860 -12.981 -3.514 1.00 0.44 N HETATM 733 C3 BO6 A 101 8.348 -11.611 -5.120 1.00 0.35 C HETATM 734 C4 BO6 A 101 7.061 -11.934 -5.234 1.00 0.36 C HETATM 735 C10 BO6 A 101 6.126 -11.558 -6.123 1.00 0.38 C HETATM 736 C5 BO6 A 101 6.759 -12.786 -4.234 1.00 0.41 C HETATM 737 C13 BO6 A 101 5.520 -13.278 -4.105 1.00 0.45 C HETATM 738 C12 BO6 A 101 4.531 -12.914 -5.002 1.00 0.43 C HETATM 739 C11 BO6 A 101 4.829 -12.046 -6.023 1.00 0.40 C HETATM 740 C22 BO6 A 101 3.875 -11.650 -6.951 1.00 0.46 C HETATM 741 C23 BO6 A 101 3.654 -10.189 -7.365 1.00 0.49 C HETATM 742 C24 BO6 A 101 2.529 -9.745 -8.053 1.00 0.44 C HETATM 743 C25 BO6 A 101 1.289 -10.341 -7.778 1.00 0.48 C HETATM 744 C26 BO6 A 101 0.141 -9.925 -8.445 1.00 0.46 C HETATM 745 N27 BO6 A 101 0.215 -8.909 -9.396 1.00 0.41 N HETATM 746 C30 BO6 A 101 -1.006 -8.466 -10.108 1.00 0.44 C HETATM 747 C28 BO6 A 101 1.442 -8.310 -9.676 1.00 0.41 C HETATM 748 C29 BO6 A 101 2.590 -8.726 -9.008 1.00 0.44 C