USER MOD reduce.3.24.130724 H: found=0, std=0, add=184, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 232 hydrogens (48 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 DG O5' : rot -45:sc= 0.539 USER MOD Single : A 5 DG O3' : rot 180:sc= 0 USER MOD Single : B 1 DG O5' : rot 38:sc= 1 USER MOD Single : B 5 DG O3' : rot 180:sc= 0 USER MOD Single : C 1 DG O5' : rot -20:sc= 0.724 USER MOD Single : C 5 DG O3' : rot 180:sc= 0 USER MOD Single : D 1 DG O5' : rot -71:sc= 0.52 USER MOD Single : D 5 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -7.765 -3.033 -1.390 1.00 1.00 O ATOM 2 C5' DG A 1 -8.508 -4.087 -2.001 1.00 1.00 C ATOM 3 C4' DG A 1 -8.155 -4.208 -3.463 1.00 1.00 C ATOM 4 O4' DG A 1 -6.930 -3.470 -3.701 1.00 1.00 O ATOM 5 C3' DG A 1 -7.880 -5.633 -3.943 1.00 1.00 C ATOM 6 O3' DG A 1 -8.298 -5.774 -5.309 1.00 1.00 O ATOM 7 C2' DG A 1 -6.369 -5.733 -3.821 1.00 1.00 C ATOM 8 C1' DG A 1 -5.957 -4.342 -4.255 1.00 1.00 C ATOM 9 N9 DG A 1 -4.640 -3.895 -3.808 1.00 1.00 N ATOM 10 C8 DG A 1 -3.630 -3.436 -4.617 1.00 1.00 C ATOM 11 N7 DG A 1 -2.571 -3.055 -3.958 1.00 1.00 N ATOM 12 C5 DG A 1 -2.895 -3.283 -2.629 1.00 1.00 C ATOM 13 C6 DG A 1 -2.129 -3.064 -1.455 1.00 1.00 C ATOM 14 O6 DG A 1 -0.985 -2.589 -1.358 1.00 1.00 O ATOM 15 N1 DG A 1 -2.819 -3.435 -0.305 1.00 1.00 N ATOM 16 C2 DG A 1 -4.097 -3.943 -0.298 1.00 1.00 C ATOM 17 N2 DG A 1 -4.616 -4.230 0.903 1.00 1.00 N ATOM 18 N3 DG A 1 -4.825 -4.150 -1.387 1.00 1.00 N ATOM 19 C4 DG A 1 -4.168 -3.802 -2.515 1.00 1.00 C ATOM 0 H5' DG A 1 -9.576 -3.896 -1.894 1.00 1.00 H new ATOM 0 H5'' DG A 1 -8.300 -5.028 -1.492 1.00 1.00 H new ATOM 0 H4' DG A 1 -9.024 -3.831 -4.002 1.00 1.00 H new ATOM 0 H3' DG A 1 -8.406 -6.406 -3.383 1.00 1.00 H new ATOM 0 H2' DG A 1 -6.051 -5.960 -2.804 1.00 1.00 H new ATOM 0 H2'' DG A 1 -5.953 -6.507 -4.465 1.00 1.00 H new ATOM 0 HO5' DG A 1 -6.828 -3.087 -1.672 1.00 1.00 H new ATOM 0 H1' DG A 1 -5.895 -4.344 -5.343 1.00 1.00 H new ATOM 0 H8 DG A 1 -3.705 -3.395 -5.694 1.00 1.00 H new ATOM 0 H1 DG A 1 -2.346 -3.323 0.592 1.00 1.00 H new ATOM 0 H21 DG A 1 -5.560 -4.610 0.973 1.00 1.00 H new ATOM 0 H22 DG A 1 -4.067 -4.069 1.747 1.00 1.00 H new ATOM 32 P DG A 2 -8.363 -7.220 -6.007 1.00 1.00 P ATOM 33 OP1 DG A 2 -9.308 -7.116 -7.147 1.00 1.00 O ATOM 34 OP2 DG A 2 -8.583 -8.253 -4.965 1.00 1.00 O ATOM 35 O5' DG A 2 -6.904 -7.423 -6.606 1.00 1.00 O ATOM 36 C5' DG A 2 -6.489 -6.689 -7.756 1.00 1.00 C ATOM 37 C4' DG A 2 -5.015 -6.905 -8.012 1.00 1.00 C ATOM 38 O4' DG A 2 -4.254 -6.370 -6.900 1.00 1.00 O ATOM 39 C3' DG A 2 -4.581 -8.371 -8.137 1.00 1.00 C ATOM 40 O3' DG A 2 -3.542 -8.518 -9.110 1.00 1.00 O ATOM 41 C2' DG A 2 -3.998 -8.654 -6.765 1.00 1.00 C ATOM 42 C1' DG A 2 -3.294 -7.340 -6.533 1.00 1.00 C ATOM 43 N9 DG A 2 -2.831 -7.079 -5.174 1.00 1.00 N ATOM 44 C8 DG A 2 -3.397 -7.473 -3.985 1.00 1.00 C ATOM 45 N7 DG A 2 -2.693 -7.122 -2.940 1.00 1.00 N ATOM 46 C5 DG A 2 -1.598 -6.455 -3.477 1.00 1.00 C ATOM 47 C6 DG A 2 -0.484 -5.845 -2.841 1.00 1.00 C ATOM 48 O6 DG A 2 -0.239 -5.766 -1.631 1.00 1.00 O ATOM 49 N1 DG A 2 0.398 -5.281 -3.760 1.00 1.00 N ATOM 50 C2 DG A 2 0.215 -5.306 -5.125 1.00 1.00 C ATOM 51 N2 DG A 2 1.144 -4.704 -5.871 1.00 1.00 N ATOM 52 N3 DG A 2 -0.814 -5.870 -5.727 1.00 1.00 N ATOM 53 C4 DG A 2 -1.675 -6.422 -4.850 1.00 1.00 C ATOM 0 H5' DG A 2 -6.688 -5.627 -7.610 1.00 1.00 H new ATOM 0 H5'' DG A 2 -7.066 -7.005 -8.625 1.00 1.00 H new ATOM 0 H4' DG A 2 -4.828 -6.410 -8.965 1.00 1.00 H new ATOM 0 H3' DG A 2 -5.397 -9.028 -8.438 1.00 1.00 H new ATOM 0 H2' DG A 2 -4.763 -8.860 -6.016 1.00 1.00 H new ATOM 0 H2'' DG A 2 -3.315 -9.504 -6.765 1.00 1.00 H new ATOM 0 H1' DG A 2 -2.370 -7.334 -7.111 1.00 1.00 H new ATOM 0 H8 DG A 2 -4.328 -8.017 -3.920 1.00 1.00 H new ATOM 0 H1 DG A 2 1.233 -4.820 -3.399 1.00 1.00 H new ATOM 0 H21 DG A 2 1.055 -4.695 -6.887 1.00 1.00 H new ATOM 0 H22 DG A 2 1.943 -4.254 -5.425 1.00 1.00 H new HETATM 65 P AZW A 3 -3.851 -8.621 -10.679 1.00 1.00 P HETATM 66 OP1 AZW A 3 -4.972 -7.709 -11.009 1.00 1.00 O HETATM 67 OP2 AZW A 3 -3.958 -10.061 -11.014 1.00 1.00 O HETATM 68 O5' AZW A 3 -2.521 -8.053 -11.345 1.00 1.00 O HETATM 69 C5' AZW A 3 -2.084 -6.719 -11.077 1.00 1.00 C HETATM 70 C1A AZW A 3 -0.741 -6.732 -10.363 1.00 1.00 C HETATM 71 C2A AZW A 3 0.175 -5.701 -10.607 1.00 1.00 C HETATM 72 C6A AZW A 3 -0.420 -7.745 -9.444 1.00 1.00 C HETATM 73 C3A AZW A 3 1.404 -5.674 -9.938 1.00 1.00 C HETATM 74 C5A AZW A 3 0.811 -7.718 -8.773 1.00 1.00 C HETATM 75 C4A AZW A 3 1.724 -6.680 -9.018 1.00 1.00 C HETATM 76 N5A AZW A 3 2.959 -6.636 -8.330 1.00 1.00 N HETATM 77 C1B AZW A 3 6.782 -6.852 -5.019 1.00 1.00 C HETATM 78 C2B AZW A 3 6.774 -6.971 -6.419 1.00 1.00 C HETATM 79 C6B AZW A 3 5.572 -6.792 -4.319 1.00 1.00 C HETATM 80 C3B AZW A 3 5.555 -7.032 -7.111 1.00 1.00 C HETATM 81 C5B AZW A 3 4.356 -6.850 -5.010 1.00 1.00 C HETATM 82 C4B AZW A 3 4.343 -6.970 -6.404 1.00 1.00 C HETATM 83 N5B AZW A 3 3.108 -7.022 -7.094 1.00 1.00 N HETATM 84 C3' AZW A 3 8.091 -6.794 -4.250 1.00 1.00 C HETATM 85 O3' AZW A 3 9.196 -7.158 -5.071 1.00 1.00 O ATOM 98 P DG A 4 10.197 -6.025 -5.612 1.00 1.00 P ATOM 99 OP1 DG A 4 10.805 -6.511 -6.875 1.00 1.00 O ATOM 100 OP2 DG A 4 11.074 -5.631 -4.485 1.00 1.00 O ATOM 101 O5' DG A 4 9.240 -4.802 -5.959 1.00 1.00 O ATOM 102 C5' DG A 4 9.776 -3.529 -6.321 1.00 1.00 C ATOM 103 C4' DG A 4 8.905 -2.896 -7.381 1.00 1.00 C ATOM 104 O4' DG A 4 7.548 -3.382 -7.222 1.00 1.00 O ATOM 105 C3' DG A 4 8.802 -1.370 -7.327 1.00 1.00 C ATOM 106 O3' DG A 4 8.638 -0.856 -8.657 1.00 1.00 O ATOM 107 C2' DG A 4 7.549 -1.165 -6.492 1.00 1.00 C ATOM 108 C1' DG A 4 6.673 -2.286 -7.015 1.00 1.00 C ATOM 109 N9 DG A 4 5.579 -2.723 -6.152 1.00 1.00 N ATOM 110 C8 DG A 4 4.314 -3.042 -6.583 1.00 1.00 C ATOM 111 N7 DG A 4 3.526 -3.443 -5.627 1.00 1.00 N ATOM 112 C5 DG A 4 4.313 -3.389 -4.487 1.00 1.00 C ATOM 113 C6 DG A 4 3.985 -3.715 -3.147 1.00 1.00 C ATOM 114 O6 DG A 4 2.905 -4.132 -2.701 1.00 1.00 O ATOM 115 N1 DG A 4 5.060 -3.523 -2.286 1.00 1.00 N ATOM 116 C2 DG A 4 6.298 -3.072 -2.683 1.00 1.00 C ATOM 117 N2 DG A 4 7.216 -2.937 -1.714 1.00 1.00 N ATOM 118 N3 DG A 4 6.618 -2.765 -3.933 1.00 1.00 N ATOM 119 C4 DG A 4 5.584 -2.946 -4.786 1.00 1.00 C ATOM 0 H5' DG A 4 10.794 -3.644 -6.693 1.00 1.00 H new ATOM 0 H5'' DG A 4 9.828 -2.883 -5.445 1.00 1.00 H new ATOM 0 H4' DG A 4 9.380 -3.167 -8.324 1.00 1.00 H new ATOM 0 H3' DG A 4 9.675 -0.865 -6.914 1.00 1.00 H new ATOM 0 H2' DG A 4 7.745 -1.257 -5.424 1.00 1.00 H new ATOM 0 H2'' DG A 4 7.103 -0.183 -6.651 1.00 1.00 H new ATOM 0 H1' DG A 4 6.170 -1.911 -7.906 1.00 1.00 H new ATOM 0 H8 DG A 4 4.003 -2.967 -7.615 1.00 1.00 H new ATOM 0 H1 DG A 4 4.922 -3.730 -1.297 1.00 1.00 H new ATOM 0 H21 DG A 4 8.154 -2.607 -1.942 1.00 1.00 H new ATOM 0 H22 DG A 4 6.976 -3.165 -0.749 1.00 1.00 H new ATOM 131 P DG A 5 8.513 0.723 -8.929 1.00 1.00 P ATOM 132 OP1 DG A 5 8.887 0.981 -10.339 1.00 1.00 O ATOM 133 OP2 DG A 5 9.247 1.429 -7.853 1.00 1.00 O ATOM 134 O5' DG A 5 6.962 1.023 -8.758 1.00 1.00 O ATOM 135 C5' DG A 5 6.013 0.507 -9.689 1.00 1.00 C ATOM 136 C4' DG A 5 4.610 0.894 -9.279 1.00 1.00 C ATOM 137 O4' DG A 5 4.237 0.167 -8.086 1.00 1.00 O ATOM 138 C3' DG A 5 4.427 2.376 -8.938 1.00 1.00 C ATOM 139 O3' DG A 5 3.499 2.994 -9.835 1.00 1.00 O ATOM 140 C2' DG A 5 3.886 2.384 -7.517 1.00 1.00 C ATOM 141 C1' DG A 5 3.339 0.979 -7.358 1.00 1.00 C ATOM 142 N9 DG A 5 3.252 0.495 -5.983 1.00 1.00 N ATOM 143 C8 DG A 5 4.178 0.640 -4.974 1.00 1.00 C ATOM 144 N7 DG A 5 3.777 0.150 -3.830 1.00 1.00 N ATOM 145 C5 DG A 5 2.511 -0.353 -4.098 1.00 1.00 C ATOM 146 C6 DG A 5 1.580 -1.007 -3.246 1.00 1.00 C ATOM 147 O6 DG A 5 1.690 -1.267 -2.035 1.00 1.00 O ATOM 148 N1 DG A 5 0.413 -1.356 -3.920 1.00 1.00 N ATOM 149 C2 DG A 5 0.181 -1.105 -5.253 1.00 1.00 C ATOM 150 N2 DG A 5 -1.002 -1.505 -5.740 1.00 1.00 N ATOM 151 N3 DG A 5 1.038 -0.499 -6.057 1.00 1.00 N ATOM 152 C4 DG A 5 2.176 -0.151 -5.420 1.00 1.00 C ATOM 0 H5' DG A 5 6.097 -0.578 -9.741 1.00 1.00 H new ATOM 0 H5'' DG A 5 6.226 0.891 -10.687 1.00 1.00 H new ATOM 0 H4' DG A 5 3.994 0.660 -10.148 1.00 1.00 H new ATOM 0 H3' DG A 5 5.359 2.935 -9.028 1.00 1.00 H new ATOM 0 H2' DG A 5 4.667 2.599 -6.788 1.00 1.00 H new ATOM 0 H2'' DG A 5 3.110 3.138 -7.384 1.00 1.00 H new ATOM 0 HO3' DG A 5 3.396 3.939 -9.598 1.00 1.00 H new ATOM 0 H1' DG A 5 2.308 0.956 -7.712 1.00 1.00 H new ATOM 0 H8 DG A 5 5.140 1.111 -5.114 1.00 1.00 H new ATOM 0 H1 DG A 5 -0.319 -1.829 -3.390 1.00 1.00 H new ATOM 0 H21 DG A 5 -1.230 -1.346 -6.721 1.00 1.00 H new ATOM 0 H22 DG A 5 -1.674 -1.969 -5.129 1.00 1.00 H new TER 165 DG A 5 ATOM 166 O5' DG B 1 8.294 3.826 2.461 1.00 1.00 O ATOM 167 C5' DG B 1 8.698 2.504 2.075 1.00 1.00 C ATOM 168 C4' DG B 1 8.737 1.563 3.256 1.00 1.00 C ATOM 169 O4' DG B 1 7.389 1.120 3.544 1.00 1.00 O ATOM 170 C3' DG B 1 9.567 0.294 3.048 1.00 1.00 C ATOM 171 O3' DG B 1 10.300 -0.008 4.243 1.00 1.00 O ATOM 172 C2' DG B 1 8.520 -0.771 2.770 1.00 1.00 C ATOM 173 C1' DG B 1 7.367 -0.295 3.629 1.00 1.00 C ATOM 174 N9 DG B 1 6.043 -0.761 3.224 1.00 1.00 N ATOM 175 C8 DG B 1 5.113 -1.356 4.039 1.00 1.00 C ATOM 176 N7 DG B 1 3.996 -1.644 3.430 1.00 1.00 N ATOM 177 C5 DG B 1 4.200 -1.216 2.126 1.00 1.00 C ATOM 178 C6 DG B 1 3.332 -1.270 1.004 1.00 1.00 C ATOM 179 O6 DG B 1 2.171 -1.710 0.951 1.00 1.00 O ATOM 180 N1 DG B 1 3.919 -0.738 -0.138 1.00 1.00 N ATOM 181 C2 DG B 1 5.190 -0.212 -0.181 1.00 1.00 C ATOM 182 N2 DG B 1 5.595 0.266 -1.367 1.00 1.00 N ATOM 183 N3 DG B 1 6.010 -0.152 0.858 1.00 1.00 N ATOM 184 C4 DG B 1 5.457 -0.669 1.976 1.00 1.00 C ATOM 0 H5' DG B 1 9.683 2.546 1.611 1.00 1.00 H new ATOM 0 H5'' DG B 1 8.008 2.117 1.325 1.00 1.00 H new ATOM 0 H4' DG B 1 9.200 2.135 4.060 1.00 1.00 H new ATOM 0 H3' DG B 1 10.301 0.378 2.247 1.00 1.00 H new ATOM 0 H2' DG B 1 8.253 -0.817 1.714 1.00 1.00 H new ATOM 0 H2'' DG B 1 8.861 -1.766 3.056 1.00 1.00 H new ATOM 0 HO5' DG B 1 8.686 4.047 3.331 1.00 1.00 H new ATOM 0 H1' DG B 1 7.510 -0.699 4.631 1.00 1.00 H new ATOM 0 H8 DG B 1 5.289 -1.566 5.084 1.00 1.00 H new ATOM 0 H1 DG B 1 3.373 -0.737 -0.999 1.00 1.00 H new ATOM 0 H21 DG B 1 6.527 0.669 -1.463 1.00 1.00 H new ATOM 0 H22 DG B 1 4.971 0.227 -2.173 1.00 1.00 H new ATOM 197 P DG B 2 11.496 -1.077 4.218 1.00 1.00 P ATOM 198 OP1 DG B 2 12.423 -0.724 5.320 1.00 1.00 O ATOM 199 OP2 DG B 2 12.020 -1.170 2.834 1.00 1.00 O ATOM 200 O5' DG B 2 10.790 -2.452 4.589 1.00 1.00 O ATOM 201 C5' DG B 2 10.182 -2.629 5.867 1.00 1.00 C ATOM 202 C4' DG B 2 9.392 -3.914 5.901 1.00 1.00 C ATOM 203 O4' DG B 2 8.170 -3.743 5.139 1.00 1.00 O ATOM 204 C3' DG B 2 10.105 -5.126 5.291 1.00 1.00 C ATOM 205 O3' DG B 2 9.950 -6.269 6.140 1.00 1.00 O ATOM 206 C2' DG B 2 9.382 -5.333 3.972 1.00 1.00 C ATOM 207 C1' DG B 2 7.980 -4.891 4.331 1.00 1.00 C ATOM 208 N9 DG B 2 7.131 -4.559 3.191 1.00 1.00 N ATOM 209 C8 DG B 2 7.521 -4.008 1.994 1.00 1.00 C ATOM 210 N7 DG B 2 6.561 -3.949 1.111 1.00 1.00 N ATOM 211 C5 DG B 2 5.465 -4.490 1.767 1.00 1.00 C ATOM 212 C6 DG B 2 4.139 -4.690 1.314 1.00 1.00 C ATOM 213 O6 DG B 2 3.667 -4.424 0.201 1.00 1.00 O ATOM 214 N1 DG B 2 3.329 -5.266 2.290 1.00 1.00 N ATOM 215 C2 DG B 2 3.762 -5.606 3.554 1.00 1.00 C ATOM 216 N2 DG B 2 2.855 -6.160 4.374 1.00 1.00 N ATOM 217 N3 DG B 2 5.001 -5.423 3.990 1.00 1.00 N ATOM 218 C4 DG B 2 5.796 -4.866 3.051 1.00 1.00 C ATOM 0 H5' DG B 2 9.526 -1.786 6.085 1.00 1.00 H new ATOM 0 H5'' DG B 2 10.948 -2.645 6.642 1.00 1.00 H new ATOM 0 H4' DG B 2 9.228 -4.114 6.960 1.00 1.00 H new ATOM 0 H3' DG B 2 11.178 -4.979 5.166 1.00 1.00 H new ATOM 0 H2' DG B 2 9.810 -4.732 3.170 1.00 1.00 H new ATOM 0 H2'' DG B 2 9.414 -6.372 3.644 1.00 1.00 H new ATOM 0 H1' DG B 2 7.454 -5.710 4.823 1.00 1.00 H new ATOM 0 H8 DG B 2 8.524 -3.658 1.802 1.00 1.00 H new ATOM 0 H1 DG B 2 2.353 -5.448 2.054 1.00 1.00 H new ATOM 0 H21 DG B 2 3.121 -6.431 5.321 1.00 1.00 H new ATOM 0 H22 DG B 2 1.899 -6.310 4.050 1.00 1.00 H new HETATM 230 P AZW B 3 10.773 -7.617 5.850 1.00 1.00 P HETATM 231 OP1 AZW B 3 11.463 -8.007 7.101 1.00 1.00 O HETATM 232 OP2 AZW B 3 11.571 -7.416 4.617 1.00 1.00 O HETATM 233 O5' AZW B 3 9.642 -8.692 5.542 1.00 1.00 O HETATM 234 C5' AZW B 3 8.644 -9.001 6.513 1.00 1.00 C HETATM 235 C1A AZW B 3 7.338 -9.333 5.825 1.00 1.00 C HETATM 236 C2A AZW B 3 6.354 -10.047 6.523 1.00 1.00 C HETATM 237 C6A AZW B 3 7.106 -8.938 4.497 1.00 1.00 C HETATM 238 C3A AZW B 3 5.145 -10.370 5.900 1.00 1.00 C HETATM 239 C5A AZW B 3 5.894 -9.265 3.872 1.00 1.00 C HETATM 240 C4A AZW B 3 4.913 -9.982 4.573 1.00 1.00 C HETATM 241 N5A AZW B 3 3.699 -10.329 3.944 1.00 1.00 N HETATM 242 C1B AZW B 3 -0.595 -10.617 1.347 1.00 1.00 C HETATM 243 C2B AZW B 3 -0.577 -10.202 2.686 1.00 1.00 C HETATM 244 C6B AZW B 3 0.600 -10.664 0.612 1.00 1.00 C HETATM 245 C3B AZW B 3 0.630 -9.832 3.289 1.00 1.00 C HETATM 246 C5B AZW B 3 1.808 -10.296 1.219 1.00 1.00 C HETATM 247 C4B AZW B 3 1.821 -9.880 2.558 1.00 1.00 C HETATM 248 N5B AZW B 3 3.035 -9.519 3.174 1.00 1.00 N HETATM 249 C3' AZW B 3 -1.898 -11.014 0.692 1.00 1.00 C HETATM 250 O3' AZW B 3 -2.470 -12.145 1.343 1.00 1.00 O ATOM 263 P DG B 4 -3.914 -12.023 2.036 1.00 1.00 P ATOM 264 OP1 DG B 4 -4.083 -13.177 2.953 1.00 1.00 O ATOM 265 OP2 DG B 4 -4.905 -11.797 0.960 1.00 1.00 O ATOM 266 O5' DG B 4 -3.817 -10.701 2.914 1.00 1.00 O ATOM 267 C5' DG B 4 -4.987 -10.095 3.461 1.00 1.00 C ATOM 268 C4' DG B 4 -4.717 -9.668 4.886 1.00 1.00 C ATOM 269 O4' DG B 4 -3.322 -9.297 5.019 1.00 1.00 O ATOM 270 C3' DG B 4 -5.503 -8.452 5.373 1.00 1.00 C ATOM 271 O3' DG B 4 -5.690 -8.539 6.793 1.00 1.00 O ATOM 272 C2' DG B 4 -4.574 -7.306 5.012 1.00 1.00 C ATOM 273 C1' DG B 4 -3.214 -7.910 5.314 1.00 1.00 C ATOM 274 N9 DG B 4 -2.096 -7.360 4.552 1.00 1.00 N ATOM 275 C8 DG B 4 -0.906 -6.912 5.072 1.00 1.00 C ATOM 276 N7 DG B 4 -0.076 -6.471 4.167 1.00 1.00 N ATOM 277 C5 DG B 4 -0.759 -6.634 2.972 1.00 1.00 C ATOM 278 C6 DG B 4 -0.357 -6.325 1.648 1.00 1.00 C ATOM 279 O6 DG B 4 0.714 -5.829 1.267 1.00 1.00 O ATOM 280 N1 DG B 4 -1.340 -6.643 0.716 1.00 1.00 N ATOM 281 C2 DG B 4 -2.562 -7.192 1.033 1.00 1.00 C ATOM 282 N2 DG B 4 -3.387 -7.445 0.006 1.00 1.00 N ATOM 283 N3 DG B 4 -2.949 -7.483 2.265 1.00 1.00 N ATOM 284 C4 DG B 4 -2.007 -7.181 3.184 1.00 1.00 C ATOM 0 H5' DG B 4 -5.820 -10.797 3.433 1.00 1.00 H new ATOM 0 H5'' DG B 4 -5.277 -9.233 2.861 1.00 1.00 H new ATOM 0 H4' DG B 4 -5.018 -10.530 5.482 1.00 1.00 H new ATOM 0 H3' DG B 4 -6.498 -8.350 4.940 1.00 1.00 H new ATOM 0 H2' DG B 4 -4.670 -7.014 3.966 1.00 1.00 H new ATOM 0 H2'' DG B 4 -4.769 -6.416 5.610 1.00 1.00 H new ATOM 0 H1' DG B 4 -2.983 -7.685 6.355 1.00 1.00 H new ATOM 0 H8 DG B 4 -0.679 -6.924 6.128 1.00 1.00 H new ATOM 0 H1 DG B 4 -1.142 -6.457 -0.267 1.00 1.00 H new ATOM 0 H21 DG B 4 -4.306 -7.852 0.179 1.00 1.00 H new ATOM 0 H22 DG B 4 -3.095 -7.231 -0.947 1.00 1.00 H new ATOM 296 P DG B 5 -6.611 -7.479 7.575 1.00 1.00 P ATOM 297 OP1 DG B 5 -7.020 -8.119 8.847 1.00 1.00 O ATOM 298 OP2 DG B 5 -7.650 -6.976 6.648 1.00 1.00 O ATOM 299 O5' DG B 5 -5.624 -6.281 7.927 1.00 1.00 O ATOM 300 C5' DG B 5 -4.635 -6.438 8.942 1.00 1.00 C ATOM 301 C4' DG B 5 -3.573 -5.370 8.827 1.00 1.00 C ATOM 302 O4' DG B 5 -3.072 -5.320 7.473 1.00 1.00 O ATOM 303 C3' DG B 5 -4.050 -3.947 9.138 1.00 1.00 C ATOM 304 O3' DG B 5 -3.482 -3.481 10.370 1.00 1.00 O ATOM 305 C2' DG B 5 -3.562 -3.103 7.968 1.00 1.00 C ATOM 306 C1' DG B 5 -2.571 -4.015 7.267 1.00 1.00 C ATOM 307 N9 DG B 5 -2.423 -3.784 5.833 1.00 1.00 N ATOM 308 C8 DG B 5 -3.389 -3.890 4.857 1.00 1.00 C ATOM 309 N7 DG B 5 -2.946 -3.604 3.662 1.00 1.00 N ATOM 310 C5 DG B 5 -1.608 -3.290 3.857 1.00 1.00 C ATOM 311 C6 DG B 5 -0.607 -2.898 2.926 1.00 1.00 C ATOM 312 O6 DG B 5 -0.715 -2.741 1.698 1.00 1.00 O ATOM 313 N1 DG B 5 0.620 -2.672 3.544 1.00 1.00 N ATOM 314 C2 DG B 5 0.846 -2.811 4.893 1.00 1.00 C ATOM 315 N2 DG B 5 2.093 -2.560 5.317 1.00 1.00 N ATOM 316 N3 DG B 5 -0.074 -3.173 5.771 1.00 1.00 N ATOM 317 C4 DG B 5 -1.272 -3.396 5.189 1.00 1.00 C ATOM 0 H5' DG B 5 -4.176 -7.423 8.860 1.00 1.00 H new ATOM 0 H5'' DG B 5 -5.104 -6.386 9.924 1.00 1.00 H new ATOM 0 H4' DG B 5 -2.824 -5.657 9.565 1.00 1.00 H new ATOM 0 H3' DG B 5 -5.132 -3.895 9.256 1.00 1.00 H new ATOM 0 H2' DG B 5 -4.382 -2.818 7.309 1.00 1.00 H new ATOM 0 H2'' DG B 5 -3.090 -2.181 8.307 1.00 1.00 H new ATOM 0 HO3' DG B 5 -3.796 -2.571 10.551 1.00 1.00 H new ATOM 0 H1' DG B 5 -1.578 -3.834 7.678 1.00 1.00 H new ATOM 0 H8 DG B 5 -4.409 -4.180 5.059 1.00 1.00 H new ATOM 0 H1 DG B 5 1.403 -2.384 2.957 1.00 1.00 H new ATOM 0 H21 DG B 5 2.322 -2.646 6.307 1.00 1.00 H new ATOM 0 H22 DG B 5 2.813 -2.283 4.649 1.00 1.00 H new TER 330 DG B 5 ATOM 331 O5' DG C 1 7.013 2.488 -2.423 1.00 1.00 O ATOM 332 C5' DG C 1 7.513 3.713 -2.956 1.00 1.00 C ATOM 333 C4' DG C 1 6.799 4.067 -4.236 1.00 1.00 C ATOM 334 O4' DG C 1 5.540 3.351 -4.265 1.00 1.00 O ATOM 335 C3' DG C 1 6.445 5.545 -4.402 1.00 1.00 C ATOM 336 O3' DG C 1 6.536 5.907 -5.785 1.00 1.00 O ATOM 337 C2' DG C 1 5.007 5.598 -3.918 1.00 1.00 C ATOM 338 C1' DG C 1 4.476 4.274 -4.428 1.00 1.00 C ATOM 339 N9 DG C 1 3.299 3.756 -3.738 1.00 1.00 N ATOM 340 C8 DG C 1 2.088 3.449 -4.313 1.00 1.00 C ATOM 341 N7 DG C 1 1.216 2.975 -3.467 1.00 1.00 N ATOM 342 C5 DG C 1 1.889 2.969 -2.254 1.00 1.00 C ATOM 343 C6 DG C 1 1.445 2.560 -0.974 1.00 1.00 C ATOM 344 O6 DG C 1 0.336 2.096 -0.661 1.00 1.00 O ATOM 345 N1 DG C 1 2.430 2.715 -0.004 1.00 1.00 N ATOM 346 C2 DG C 1 3.693 3.207 -0.255 1.00 1.00 C ATOM 347 N2 DG C 1 4.523 3.280 0.796 1.00 1.00 N ATOM 348 N3 DG C 1 4.121 3.592 -1.449 1.00 1.00 N ATOM 349 C4 DG C 1 3.174 3.449 -2.399 1.00 1.00 C ATOM 0 H5' DG C 1 8.583 3.624 -3.143 1.00 1.00 H new ATOM 0 H5'' DG C 1 7.382 4.513 -2.227 1.00 1.00 H new ATOM 0 H4' DG C 1 7.494 3.804 -5.034 1.00 1.00 H new ATOM 0 H3' DG C 1 7.100 6.228 -3.861 1.00 1.00 H new ATOM 0 H2' DG C 1 4.941 5.677 -2.833 1.00 1.00 H new ATOM 0 H2'' DG C 1 4.464 6.447 -4.334 1.00 1.00 H new ATOM 0 HO5' DG C 1 6.128 2.304 -2.801 1.00 1.00 H new ATOM 0 H1' DG C 1 4.148 4.421 -5.457 1.00 1.00 H new ATOM 0 H8 DG C 1 1.879 3.587 -5.364 1.00 1.00 H new ATOM 0 H1 DG C 1 2.203 2.448 0.954 1.00 1.00 H new ATOM 0 H21 DG C 1 5.471 3.636 0.673 1.00 1.00 H new ATOM 0 H22 DG C 1 4.206 2.980 1.718 1.00 1.00 H new ATOM 362 P DG C 2 6.349 7.431 -6.254 1.00 1.00 P ATOM 363 OP1 DG C 2 7.073 7.608 -7.535 1.00 1.00 O ATOM 364 OP2 DG C 2 6.678 8.307 -5.106 1.00 1.00 O ATOM 365 O5' DG C 2 4.789 7.547 -6.547 1.00 1.00 O ATOM 366 C5' DG C 2 4.177 6.728 -7.544 1.00 1.00 C ATOM 367 C4' DG C 2 2.679 6.925 -7.551 1.00 1.00 C ATOM 368 O4' DG C 2 2.114 6.312 -6.365 1.00 1.00 O ATOM 369 C3' DG C 2 2.231 8.391 -7.511 1.00 1.00 C ATOM 370 O3' DG C 2 1.045 8.679 -8.285 1.00 1.00 O ATOM 371 C2' DG C 2 1.927 8.591 -6.037 1.00 1.00 C ATOM 372 C1' DG C 2 1.277 7.261 -5.730 1.00 1.00 C ATOM 373 N9 DG C 2 1.141 6.910 -4.321 1.00 1.00 N ATOM 374 C8 DG C 2 2.013 7.163 -3.288 1.00 1.00 C ATOM 375 N7 DG C 2 1.583 6.728 -2.133 1.00 1.00 N ATOM 376 C5 DG C 2 0.352 6.154 -2.422 1.00 1.00 C ATOM 377 C6 DG C 2 -0.591 5.516 -1.574 1.00 1.00 C ATOM 378 O6 DG C 2 -0.512 5.310 -0.353 1.00 1.00 O ATOM 379 N1 DG C 2 -1.711 5.077 -2.278 1.00 1.00 N ATOM 380 C2 DG C 2 -1.888 5.239 -3.636 1.00 1.00 C ATOM 381 N2 DG C 2 -3.021 4.762 -4.163 1.00 1.00 N ATOM 382 N3 DG C 2 -1.017 5.826 -4.433 1.00 1.00 N ATOM 383 C4 DG C 2 0.070 6.259 -3.766 1.00 1.00 C ATOM 0 H5' DG C 2 4.410 5.680 -7.354 1.00 1.00 H new ATOM 0 H5'' DG C 2 4.586 6.973 -8.524 1.00 1.00 H new ATOM 0 H4' DG C 2 2.338 6.481 -8.486 1.00 1.00 H new ATOM 0 H3' DG C 2 2.992 9.044 -7.938 1.00 1.00 H new ATOM 0 H2' DG C 2 2.825 8.764 -5.444 1.00 1.00 H new ATOM 0 H2'' DG C 2 1.260 9.434 -5.858 1.00 1.00 H new ATOM 0 H1' DG C 2 0.245 7.296 -6.080 1.00 1.00 H new ATOM 0 H8 DG C 2 2.958 7.670 -3.418 1.00 1.00 H new ATOM 0 H1 DG C 2 -2.448 4.605 -1.754 1.00 1.00 H new ATOM 0 H21 DG C 2 -3.198 4.858 -5.163 1.00 1.00 H new ATOM 0 H22 DG C 2 -3.708 4.303 -3.565 1.00 1.00 H new HETATM 395 P AZW C 3 0.278 7.614 -9.224 1.00 1.00 P HETATM 396 OP1 AZW C 3 -0.187 6.479 -8.397 1.00 1.00 O HETATM 397 OP2 AZW C 3 1.146 7.348 -10.399 1.00 1.00 O HETATM 398 O5' AZW C 3 -1.009 8.394 -9.742 1.00 1.00 O HETATM 399 C5' AZW C 3 -1.618 9.434 -8.977 1.00 1.00 C HETATM 400 C1A AZW C 3 -2.418 8.837 -7.836 1.00 1.00 C HETATM 401 C2A AZW C 3 -3.579 8.095 -8.101 1.00 1.00 C HETATM 402 C6A AZW C 3 -2.031 9.076 -6.512 1.00 1.00 C HETATM 403 C3A AZW C 3 -4.354 7.603 -7.042 1.00 1.00 C HETATM 404 C5A AZW C 3 -2.806 8.586 -5.453 1.00 1.00 C HETATM 405 C4A AZW C 3 -3.970 7.852 -5.716 1.00 1.00 C HETATM 406 N5A AZW C 3 -4.774 7.396 -4.645 1.00 1.00 N HETATM 407 C1B AZW C 3 -8.096 6.945 -0.827 1.00 1.00 C HETATM 408 C2B AZW C 3 -8.531 6.777 -2.150 1.00 1.00 C HETATM 409 C6B AZW C 3 -6.836 7.505 -0.573 1.00 1.00 C HETATM 410 C3B AZW C 3 -7.707 7.171 -3.216 1.00 1.00 C HETATM 411 C5B AZW C 3 -6.013 7.897 -1.639 1.00 1.00 C HETATM 412 C4B AZW C 3 -6.448 7.732 -2.960 1.00 1.00 C HETATM 413 N5B AZW C 3 -5.632 8.163 -4.032 1.00 1.00 N HETATM 414 C3' AZW C 3 -8.977 6.520 0.332 1.00 1.00 C HETATM 415 O3' AZW C 3 -10.351 6.785 0.063 1.00 1.00 O ATOM 428 P DG C 4 -11.381 5.563 -0.077 1.00 1.00 P ATOM 429 OP1 DG C 4 -12.539 6.033 -0.875 1.00 1.00 O ATOM 430 OP2 DG C 4 -11.611 4.984 1.270 1.00 1.00 O ATOM 431 O5' DG C 4 -10.585 4.507 -0.958 1.00 1.00 O ATOM 432 C5' DG C 4 -11.169 3.262 -1.324 1.00 1.00 C ATOM 433 C4' DG C 4 -10.868 2.971 -2.774 1.00 1.00 C ATOM 434 O4' DG C 4 -9.608 3.590 -3.126 1.00 1.00 O ATOM 435 C3' DG C 4 -10.712 1.491 -3.129 1.00 1.00 C ATOM 436 O3' DG C 4 -11.129 1.275 -4.484 1.00 1.00 O ATOM 437 C2' DG C 4 -9.217 1.281 -2.978 1.00 1.00 C ATOM 438 C1' DG C 4 -8.677 2.593 -3.515 1.00 1.00 C ATOM 439 N9 DG C 4 -7.361 2.983 -3.021 1.00 1.00 N ATOM 440 C8 DG C 4 -6.283 3.333 -3.794 1.00 1.00 C ATOM 441 N7 DG C 4 -5.227 3.644 -3.097 1.00 1.00 N ATOM 442 C5 DG C 4 -5.631 3.490 -1.779 1.00 1.00 C ATOM 443 C6 DG C 4 -4.904 3.686 -0.582 1.00 1.00 C ATOM 444 O6 DG C 4 -3.721 4.032 -0.457 1.00 1.00 O ATOM 445 N1 DG C 4 -5.674 3.422 0.545 1.00 1.00 N ATOM 446 C2 DG C 4 -6.990 3.018 0.510 1.00 1.00 C ATOM 447 N2 DG C 4 -7.583 2.811 1.695 1.00 1.00 N ATOM 448 N3 DG C 4 -7.681 2.831 -0.604 1.00 1.00 N ATOM 449 C4 DG C 4 -6.944 3.082 -1.709 1.00 1.00 C ATOM 0 H5' DG C 4 -12.247 3.293 -1.165 1.00 1.00 H new ATOM 0 H5'' DG C 4 -10.776 2.465 -0.693 1.00 1.00 H new ATOM 0 H4' DG C 4 -11.731 3.358 -3.316 1.00 1.00 H new ATOM 0 H3' DG C 4 -11.305 0.812 -2.516 1.00 1.00 H new ATOM 0 H2' DG C 4 -8.928 1.111 -1.941 1.00 1.00 H new ATOM 0 H2'' DG C 4 -8.862 0.425 -3.552 1.00 1.00 H new ATOM 0 H1' DG C 4 -8.554 2.476 -4.592 1.00 1.00 H new ATOM 0 H8 DG C 4 -6.307 3.349 -4.874 1.00 1.00 H new ATOM 0 H1 DG C 4 -5.235 3.535 1.459 1.00 1.00 H new ATOM 0 H21 DG C 4 -8.557 2.511 1.732 1.00 1.00 H new ATOM 0 H22 DG C 4 -7.060 2.954 2.559 1.00 1.00 H new ATOM 461 P DG C 5 -11.235 -0.211 -5.084 1.00 1.00 P ATOM 462 OP1 DG C 5 -12.198 -0.183 -6.209 1.00 1.00 O ATOM 463 OP2 DG C 5 -11.476 -1.131 -3.949 1.00 1.00 O ATOM 464 O5' DG C 5 -9.784 -0.497 -5.674 1.00 1.00 O ATOM 465 C5' DG C 5 -9.313 0.227 -6.808 1.00 1.00 C ATOM 466 C4' DG C 5 -7.821 0.043 -6.979 1.00 1.00 C ATOM 467 O4' DG C 5 -7.112 0.643 -5.876 1.00 1.00 O ATOM 468 C3' DG C 5 -7.330 -1.403 -6.972 1.00 1.00 C ATOM 469 O3' DG C 5 -7.385 -1.970 -8.285 1.00 1.00 O ATOM 470 C2' DG C 5 -5.891 -1.286 -6.489 1.00 1.00 C ATOM 471 C1' DG C 5 -5.795 0.118 -5.892 1.00 1.00 C ATOM 472 N9 DG C 5 -5.256 0.159 -4.536 1.00 1.00 N ATOM 473 C8 DG C 5 -5.849 -0.304 -3.386 1.00 1.00 C ATOM 474 N7 DG C 5 -5.112 -0.131 -2.319 1.00 1.00 N ATOM 475 C5 DG C 5 -3.960 0.482 -2.794 1.00 1.00 C ATOM 476 C6 DG C 5 -2.794 0.914 -2.106 1.00 1.00 C ATOM 477 O6 DG C 5 -2.537 0.830 -0.895 1.00 1.00 O ATOM 478 N1 DG C 5 -1.860 1.486 -2.967 1.00 1.00 N ATOM 479 C2 DG C 5 -2.040 1.620 -4.326 1.00 1.00 C ATOM 480 N2 DG C 5 -1.039 2.190 -5.009 1.00 1.00 N ATOM 481 N3 DG C 5 -3.119 1.221 -4.979 1.00 1.00 N ATOM 482 C4 DG C 5 -4.034 0.666 -4.159 1.00 1.00 C ATOM 0 H5' DG C 5 -9.543 1.286 -6.690 1.00 1.00 H new ATOM 0 H5'' DG C 5 -9.831 -0.114 -7.704 1.00 1.00 H new ATOM 0 H4' DG C 5 -7.630 0.494 -7.953 1.00 1.00 H new ATOM 0 H3' DG C 5 -7.938 -2.055 -6.344 1.00 1.00 H new ATOM 0 H2' DG C 5 -5.659 -2.049 -5.746 1.00 1.00 H new ATOM 0 H2'' DG C 5 -5.186 -1.416 -7.310 1.00 1.00 H new ATOM 0 HO3' DG C 5 -7.064 -2.896 -8.255 1.00 1.00 H new ATOM 0 H1' DG C 5 -5.103 0.697 -6.503 1.00 1.00 H new ATOM 0 H8 DG C 5 -6.826 -0.765 -3.365 1.00 1.00 H new ATOM 0 H1 DG C 5 -0.987 1.827 -2.565 1.00 1.00 H new ATOM 0 H21 DG C 5 -1.117 2.315 -6.018 1.00 1.00 H new ATOM 0 H22 DG C 5 -0.199 2.499 -4.520 1.00 1.00 H new TER 495 DG C 5 ATOM 496 O5' DG D 1 -7.098 -3.517 3.438 1.00 1.00 O ATOM 497 C5' DG D 1 -8.234 -3.074 4.181 1.00 1.00 C ATOM 498 C4' DG D 1 -7.829 -2.649 5.573 1.00 1.00 C ATOM 499 O4' DG D 1 -6.402 -2.409 5.581 1.00 1.00 O ATOM 500 C3' DG D 1 -8.477 -1.354 6.067 1.00 1.00 C ATOM 501 O3' DG D 1 -8.718 -1.429 7.476 1.00 1.00 O ATOM 502 C2' DG D 1 -7.425 -0.305 5.759 1.00 1.00 C ATOM 503 C1' DG D 1 -6.143 -1.077 6.000 1.00 1.00 C ATOM 504 N9 DG D 1 -4.978 -0.593 5.266 1.00 1.00 N ATOM 505 C8 DG D 1 -3.786 -0.187 5.811 1.00 1.00 C ATOM 506 N7 DG D 1 -2.914 0.198 4.919 1.00 1.00 N ATOM 507 C5 DG D 1 -3.572 0.037 3.708 1.00 1.00 C ATOM 508 C6 DG D 1 -3.128 0.296 2.388 1.00 1.00 C ATOM 509 O6 DG D 1 -2.019 0.715 2.023 1.00 1.00 O ATOM 510 N1 DG D 1 -4.104 0.007 1.441 1.00 1.00 N ATOM 511 C2 DG D 1 -5.355 -0.483 1.743 1.00 1.00 C ATOM 512 N2 DG D 1 -6.167 -0.730 0.703 1.00 1.00 N ATOM 513 N3 DG D 1 -5.782 -0.732 2.971 1.00 1.00 N ATOM 514 C4 DG D 1 -4.846 -0.449 3.902 1.00 1.00 C ATOM 0 H5' DG D 1 -8.971 -3.875 4.240 1.00 1.00 H new ATOM 0 H5'' DG D 1 -8.710 -2.240 3.665 1.00 1.00 H new ATOM 0 H4' DG D 1 -8.155 -3.457 6.228 1.00 1.00 H new ATOM 0 H3' DG D 1 -9.440 -1.143 5.602 1.00 1.00 H new ATOM 0 H2' DG D 1 -7.497 0.059 4.734 1.00 1.00 H new ATOM 0 H2'' DG D 1 -7.509 0.563 6.412 1.00 1.00 H new ATOM 0 HO5' DG D 1 -6.529 -2.749 3.221 1.00 1.00 H new ATOM 0 H1' DG D 1 -5.890 -0.970 7.055 1.00 1.00 H new ATOM 0 H8 DG D 1 -3.589 -0.186 6.873 1.00 1.00 H new ATOM 0 H1 DG D 1 -3.879 0.168 0.459 1.00 1.00 H new ATOM 0 H21 DG D 1 -7.106 -1.094 0.864 1.00 1.00 H new ATOM 0 H22 DG D 1 -5.845 -0.554 -0.249 1.00 1.00 H new ATOM 527 P DG D 2 -9.631 -0.322 8.191 1.00 1.00 P ATOM 528 OP1 DG D 2 -10.267 -0.973 9.362 1.00 1.00 O ATOM 529 OP2 DG D 2 -10.482 0.327 7.164 1.00 1.00 O ATOM 530 O5' DG D 2 -8.589 0.755 8.726 1.00 1.00 O ATOM 531 C5' DG D 2 -7.591 0.386 9.676 1.00 1.00 C ATOM 532 C4' DG D 2 -6.486 1.415 9.717 1.00 1.00 C ATOM 533 O4' DG D 2 -5.855 1.502 8.415 1.00 1.00 O ATOM 534 C3' DG D 2 -6.934 2.843 10.047 1.00 1.00 C ATOM 535 O3' DG D 2 -5.938 3.487 10.854 1.00 1.00 O ATOM 536 C2' DG D 2 -6.985 3.485 8.672 1.00 1.00 C ATOM 537 C1' DG D 2 -5.735 2.873 8.085 1.00 1.00 C ATOM 538 N9 DG D 2 -5.560 3.017 6.645 1.00 1.00 N ATOM 539 C8 DG D 2 -6.508 2.907 5.656 1.00 1.00 C ATOM 540 N7 DG D 2 -6.031 3.128 4.461 1.00 1.00 N ATOM 541 C5 DG D 2 -4.687 3.401 4.675 1.00 1.00 C ATOM 542 C6 DG D 2 -3.651 3.719 3.759 1.00 1.00 C ATOM 543 O6 DG D 2 -3.718 3.818 2.527 1.00 1.00 O ATOM 544 N1 DG D 2 -2.430 3.926 4.397 1.00 1.00 N ATOM 545 C2 DG D 2 -2.243 3.830 5.758 1.00 1.00 C ATOM 546 N2 DG D 2 -1.006 4.055 6.213 1.00 1.00 N ATOM 547 N3 DG D 2 -3.196 3.534 6.621 1.00 1.00 N ATOM 548 C4 DG D 2 -4.383 3.334 6.016 1.00 1.00 C ATOM 0 H5' DG D 2 -7.178 -0.589 9.416 1.00 1.00 H new ATOM 0 H5'' DG D 2 -8.041 0.289 10.664 1.00 1.00 H new ATOM 0 H4' DG D 2 -5.827 1.067 10.512 1.00 1.00 H new ATOM 0 H3' DG D 2 -7.873 2.902 10.597 1.00 1.00 H new ATOM 0 H2' DG D 2 -7.885 3.221 8.116 1.00 1.00 H new ATOM 0 H2'' DG D 2 -6.943 4.573 8.713 1.00 1.00 H new ATOM 0 H1' DG D 2 -4.862 3.385 8.489 1.00 1.00 H new ATOM 0 H8 DG D 2 -7.542 2.663 5.848 1.00 1.00 H new ATOM 0 H1 DG D 2 -1.623 4.164 3.820 1.00 1.00 H new ATOM 0 H21 DG D 2 -0.812 3.997 7.213 1.00 1.00 H new ATOM 0 H22 DG D 2 -0.257 4.285 5.560 1.00 1.00 H new HETATM 560 P AZW D 3 -6.319 4.174 12.252 1.00 1.00 P HETATM 561 OP1 AZW D 3 -6.084 3.168 13.316 1.00 1.00 O HETATM 562 OP2 AZW D 3 -7.656 4.800 12.120 1.00 1.00 O HETATM 563 O5' AZW D 3 -5.240 5.334 12.418 1.00 1.00 O HETATM 564 C5' AZW D 3 -3.841 5.046 12.429 1.00 1.00 C HETATM 565 C1A AZW D 3 -3.146 5.798 11.313 1.00 1.00 C HETATM 566 C2A AZW D 3 -1.882 6.370 11.536 1.00 1.00 C HETATM 567 C6A AZW D 3 -3.748 5.910 10.049 1.00 1.00 C HETATM 568 C3A AZW D 3 -1.225 7.045 10.501 1.00 1.00 C HETATM 569 C5A AZW D 3 -3.090 6.588 9.016 1.00 1.00 C HETATM 570 C4A AZW D 3 -1.829 7.153 9.241 1.00 1.00 C HETATM 571 N5A AZW D 3 -1.167 7.828 8.197 1.00 1.00 N HETATM 572 C1B AZW D 3 1.361 9.260 4.093 1.00 1.00 C HETATM 573 C2B AZW D 3 1.838 9.372 5.409 1.00 1.00 C HETATM 574 C6B AZW D 3 0.238 8.466 3.825 1.00 1.00 C HETATM 575 C3B AZW D 3 1.195 8.687 6.446 1.00 1.00 C HETATM 576 C5B AZW D 3 -0.402 7.783 4.862 1.00 1.00 C HETATM 577 C4B AZW D 3 0.075 7.893 6.173 1.00 1.00 C HETATM 578 N5B AZW D 3 -0.579 7.211 7.218 1.00 1.00 N HETATM 579 C3' AZW D 3 2.057 9.971 2.954 1.00 1.00 C HETATM 580 O3' AZW D 3 2.836 11.068 3.421 1.00 1.00 O ATOM 593 P DG D 4 4.436 10.978 3.381 1.00 1.00 P ATOM 594 OP1 DG D 4 4.981 12.201 4.017 1.00 1.00 O ATOM 595 OP2 DG D 4 4.828 10.646 1.989 1.00 1.00 O ATOM 596 O5' DG D 4 4.767 9.733 4.314 1.00 1.00 O ATOM 597 C5' DG D 4 5.928 8.931 4.105 1.00 1.00 C ATOM 598 C4' DG D 4 6.129 8.020 5.293 1.00 1.00 C ATOM 599 O4' DG D 4 4.843 7.496 5.707 1.00 1.00 O ATOM 600 C3' DG D 4 7.007 6.793 5.043 1.00 1.00 C ATOM 601 O3' DG D 4 7.684 6.425 6.253 1.00 1.00 O ATOM 602 C2' DG D 4 5.987 5.743 4.644 1.00 1.00 C ATOM 603 C1' DG D 4 4.838 6.082 5.578 1.00 1.00 C ATOM 604 N9 DG D 4 3.511 5.660 5.137 1.00 1.00 N ATOM 605 C8 DG D 4 2.573 5.021 5.911 1.00 1.00 C ATOM 606 N7 DG D 4 1.474 4.738 5.268 1.00 1.00 N ATOM 607 C5 DG D 4 1.693 5.222 3.987 1.00 1.00 C ATOM 608 C6 DG D 4 0.845 5.196 2.850 1.00 1.00 C ATOM 609 O6 DG D 4 -0.301 4.733 2.760 1.00 1.00 O ATOM 610 N1 DG D 4 1.443 5.787 1.741 1.00 1.00 N ATOM 611 C2 DG D 4 2.704 6.335 1.742 1.00 1.00 C ATOM 612 N2 DG D 4 3.122 6.873 0.586 1.00 1.00 N ATOM 613 N3 DG D 4 3.504 6.366 2.797 1.00 1.00 N ATOM 614 C4 DG D 4 2.943 5.794 3.884 1.00 1.00 C ATOM 0 H5' DG D 4 6.803 9.567 3.968 1.00 1.00 H new ATOM 0 H5'' DG D 4 5.817 8.341 3.195 1.00 1.00 H new ATOM 0 H4' DG D 4 6.627 8.646 6.034 1.00 1.00 H new ATOM 0 H3' DG D 4 7.786 6.940 4.295 1.00 1.00 H new ATOM 0 H2' DG D 4 5.702 5.823 3.595 1.00 1.00 H new ATOM 0 H2'' DG D 4 6.357 4.729 4.798 1.00 1.00 H new ATOM 0 H1' DG D 4 5.005 5.538 6.507 1.00 1.00 H new ATOM 0 H8 DG D 4 2.730 4.777 6.951 1.00 1.00 H new ATOM 0 H1 DG D 4 0.911 5.815 0.871 1.00 1.00 H new ATOM 0 H21 DG D 4 4.049 7.295 0.525 1.00 1.00 H new ATOM 0 H22 DG D 4 2.513 6.860 -0.232 1.00 1.00 H new ATOM 626 P DG D 5 8.643 5.136 6.304 1.00 1.00 P ATOM 627 OP1 DG D 5 9.622 5.369 7.395 1.00 1.00 O ATOM 628 OP2 DG D 5 9.122 4.845 4.932 1.00 1.00 O ATOM 629 O5' DG D 5 7.677 3.959 6.760 1.00 1.00 O ATOM 630 C5' DG D 5 7.100 3.956 8.064 1.00 1.00 C ATOM 631 C4' DG D 5 6.043 2.883 8.166 1.00 1.00 C ATOM 632 O4' DG D 5 5.061 3.085 7.131 1.00 1.00 O ATOM 633 C3' DG D 5 6.553 1.454 7.966 1.00 1.00 C ATOM 634 O3' DG D 5 6.576 0.744 9.210 1.00 1.00 O ATOM 635 C2' DG D 5 5.565 0.814 6.999 1.00 1.00 C ATOM 636 C1' DG D 5 4.447 1.838 6.892 1.00 1.00 C ATOM 637 N9 DG D 5 3.790 1.892 5.591 1.00 1.00 N ATOM 638 C8 DG D 5 4.338 2.284 4.393 1.00 1.00 C ATOM 639 N7 DG D 5 3.499 2.213 3.395 1.00 1.00 N ATOM 640 C5 DG D 5 2.325 1.744 3.970 1.00 1.00 C ATOM 641 C6 DG D 5 1.062 1.465 3.385 1.00 1.00 C ATOM 642 O6 DG D 5 0.722 1.578 2.196 1.00 1.00 O ATOM 643 N1 DG D 5 0.144 1.006 4.326 1.00 1.00 N ATOM 644 C2 DG D 5 0.421 0.841 5.664 1.00 1.00 C ATOM 645 N2 DG D 5 -0.576 0.381 6.429 1.00 1.00 N ATOM 646 N3 DG D 5 1.591 1.099 6.222 1.00 1.00 N ATOM 647 C4 DG D 5 2.490 1.543 5.323 1.00 1.00 C ATOM 0 H5' DG D 5 6.661 4.930 8.277 1.00 1.00 H new ATOM 0 H5'' DG D 5 7.875 3.785 8.812 1.00 1.00 H new ATOM 0 H4' DG D 5 5.654 2.975 9.180 1.00 1.00 H new ATOM 0 H3' DG D 5 7.573 1.435 7.581 1.00 1.00 H new ATOM 0 H2' DG D 5 6.023 0.619 6.029 1.00 1.00 H new ATOM 0 H2'' DG D 5 5.198 -0.141 7.376 1.00 1.00 H new ATOM 0 HO3' DG D 5 6.903 -0.168 9.060 1.00 1.00 H new ATOM 0 H1' DG D 5 3.664 1.569 7.601 1.00 1.00 H new ATOM 0 H8 DG D 5 5.360 2.617 4.288 1.00 1.00 H new ATOM 0 H1 DG D 5 -0.796 0.777 4.002 1.00 1.00 H new ATOM 0 H21 DG D 5 -0.428 0.239 7.428 1.00 1.00 H new ATOM 0 H22 DG D 5 -1.484 0.172 6.013 1.00 1.00 H new TER 660 DG D 5 HETATM 661 K K A 101 1.271 -3.857 -0.563 1.00 1.00 K HETATM 662 K K A 102 -0.162 -0.408 0.239 1.00 1.00 K HETATM 663 K K C 101 -1.613 3.230 0.978 1.00 1.00 K