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 Set 1.1: A 1 DG O5' : rot 180:sc= 0 USER MOD Set 1.2: D 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 5 DG O3' : rot 180:sc= 0 USER MOD Single : B 1 DG O5' : rot -12:sc= 0.681 USER MOD Single : B 5 DG O3' : rot 180:sc= 0 USER MOD Single : C 1 DG O5' : rot -28:sc= 0.642 USER MOD Single : C 5 DG O3' : rot 180:sc= 0 USER MOD Single : D 5 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -9.265 -4.772 0.103 1.00 1.00 O ATOM 2 C5' DG A 1 -7.981 -4.800 -0.532 1.00 1.00 C ATOM 3 C4' DG A 1 -8.095 -4.889 -2.034 1.00 1.00 C ATOM 4 O4' DG A 1 -7.190 -3.929 -2.629 1.00 1.00 O ATOM 5 C3' DG A 1 -7.716 -6.247 -2.630 1.00 1.00 C ATOM 6 O3' DG A 1 -8.520 -6.544 -3.777 1.00 1.00 O ATOM 7 C2' DG A 1 -6.265 -6.064 -3.033 1.00 1.00 C ATOM 8 C1' DG A 1 -6.194 -4.591 -3.394 1.00 1.00 C ATOM 9 N9 DG A 1 -4.903 -3.974 -3.105 1.00 1.00 N ATOM 10 C8 DG A 1 -4.055 -3.382 -4.008 1.00 1.00 C ATOM 11 N7 DG A 1 -2.945 -2.953 -3.471 1.00 1.00 N ATOM 12 C5 DG A 1 -3.068 -3.283 -2.129 1.00 1.00 C ATOM 13 C6 DG A 1 -2.174 -3.067 -1.052 1.00 1.00 C ATOM 14 O6 DG A 1 -1.066 -2.508 -1.077 1.00 1.00 O ATOM 15 N1 DG A 1 -2.677 -3.556 0.150 1.00 1.00 N ATOM 16 C2 DG A 1 -3.902 -4.172 0.285 1.00 1.00 C ATOM 17 N2 DG A 1 -4.238 -4.582 1.515 1.00 1.00 N ATOM 18 N3 DG A 1 -4.745 -4.375 -0.711 1.00 1.00 N ATOM 19 C4 DG A 1 -4.270 -3.910 -1.885 1.00 1.00 C ATOM 0 H5' DG A 1 -7.411 -5.652 -0.161 1.00 1.00 H new ATOM 0 H5'' DG A 1 -7.424 -3.902 -0.263 1.00 1.00 H new ATOM 0 H4' DG A 1 -9.148 -4.706 -2.250 1.00 1.00 H new ATOM 0 H3' DG A 1 -7.868 -7.071 -1.933 1.00 1.00 H new ATOM 0 H2' DG A 1 -5.585 -6.313 -2.218 1.00 1.00 H new ATOM 0 H2'' DG A 1 -5.997 -6.700 -3.877 1.00 1.00 H new ATOM 0 HO5' DG A 1 -9.148 -4.716 1.074 1.00 1.00 H new ATOM 0 H1' DG A 1 -6.344 -4.501 -4.470 1.00 1.00 H new ATOM 0 H8 DG A 1 -4.284 -3.281 -5.059 1.00 1.00 H new ATOM 0 H1 DG A 1 -2.101 -3.452 0.985 1.00 1.00 H new ATOM 0 H21 DG A 1 -5.134 -5.044 1.672 1.00 1.00 H new ATOM 0 H22 DG A 1 -3.598 -4.432 2.295 1.00 1.00 H new ATOM 32 P DG A 2 -8.525 -8.031 -4.384 1.00 1.00 P ATOM 33 OP1 DG A 2 -9.851 -8.263 -4.999 1.00 1.00 O ATOM 34 OP2 DG A 2 -8.031 -8.967 -3.346 1.00 1.00 O ATOM 35 O5' DG A 2 -7.444 -7.989 -5.552 1.00 1.00 O ATOM 36 C5' DG A 2 -7.424 -6.923 -6.503 1.00 1.00 C ATOM 37 C4' DG A 2 -6.107 -6.905 -7.242 1.00 1.00 C ATOM 38 O4' DG A 2 -5.080 -6.344 -6.387 1.00 1.00 O ATOM 39 C3' DG A 2 -5.586 -8.281 -7.671 1.00 1.00 C ATOM 40 O3' DG A 2 -5.040 -8.206 -8.992 1.00 1.00 O ATOM 41 C2' DG A 2 -4.487 -8.570 -6.662 1.00 1.00 C ATOM 42 C1' DG A 2 -3.936 -7.179 -6.438 1.00 1.00 C ATOM 43 N9 DG A 2 -3.175 -7.005 -5.203 1.00 1.00 N ATOM 44 C8 DG A 2 -3.486 -7.492 -3.957 1.00 1.00 C ATOM 45 N7 DG A 2 -2.610 -7.175 -3.043 1.00 1.00 N ATOM 46 C5 DG A 2 -1.659 -6.432 -3.731 1.00 1.00 C ATOM 47 C6 DG A 2 -0.467 -5.820 -3.267 1.00 1.00 C ATOM 48 O6 DG A 2 -0.021 -5.792 -2.111 1.00 1.00 O ATOM 49 N1 DG A 2 0.217 -5.167 -4.288 1.00 1.00 N ATOM 50 C2 DG A 2 -0.210 -5.112 -5.597 1.00 1.00 C ATOM 51 N2 DG A 2 0.562 -4.426 -6.453 1.00 1.00 N ATOM 52 N3 DG A 2 -1.321 -5.678 -6.042 1.00 1.00 N ATOM 53 C4 DG A 2 -1.992 -6.319 -5.063 1.00 1.00 C ATOM 0 H5' DG A 2 -7.577 -5.971 -5.995 1.00 1.00 H new ATOM 0 H5'' DG A 2 -8.244 -7.042 -7.211 1.00 1.00 H new ATOM 0 H4' DG A 2 -6.305 -6.318 -8.139 1.00 1.00 H new ATOM 0 H3' DG A 2 -6.359 -9.049 -7.692 1.00 1.00 H new ATOM 0 H2' DG A 2 -4.874 -9.014 -5.745 1.00 1.00 H new ATOM 0 H2'' DG A 2 -3.735 -9.254 -7.055 1.00 1.00 H new ATOM 0 H1' DG A 2 -3.229 -6.949 -7.235 1.00 1.00 H new ATOM 0 H8 DG A 2 -4.369 -8.080 -3.754 1.00 1.00 H new ATOM 0 H1 DG A 2 1.092 -4.698 -4.052 1.00 1.00 H new ATOM 0 H21 DG A 2 0.294 -4.352 -7.434 1.00 1.00 H new ATOM 0 H22 DG A 2 1.417 -3.978 -6.122 1.00 1.00 H new HETATM 65 P AZW A 3 -4.918 -9.525 -9.899 1.00 1.00 P HETATM 66 OP1 AZW A 3 -5.627 -9.279 -11.176 1.00 1.00 O HETATM 67 OP2 AZW A 3 -5.302 -10.688 -9.066 1.00 1.00 O HETATM 68 O5' AZW A 3 -3.362 -9.645 -10.208 1.00 1.00 O HETATM 69 C5' AZW A 3 -2.602 -8.518 -10.635 1.00 1.00 C HETATM 70 C1A AZW A 3 -1.329 -8.416 -9.820 1.00 1.00 C HETATM 71 C2A AZW A 3 -0.360 -7.464 -10.169 1.00 1.00 C HETATM 72 C6A AZW A 3 -1.105 -9.273 -8.726 1.00 1.00 C HETATM 73 C3A AZW A 3 0.826 -7.369 -9.434 1.00 1.00 C HETATM 74 C5A AZW A 3 0.084 -9.175 -7.994 1.00 1.00 C HETATM 75 C4A AZW A 3 1.050 -8.225 -8.348 1.00 1.00 C HETATM 76 N5A AZW A 3 2.249 -8.131 -7.612 1.00 1.00 N HETATM 77 C1B AZW A 3 6.134 -6.826 -4.679 1.00 1.00 C HETATM 78 C2B AZW A 3 6.101 -6.481 -6.037 1.00 1.00 C HETATM 79 C6B AZW A 3 4.965 -7.269 -4.046 1.00 1.00 C HETATM 80 C3B AZW A 3 4.907 -6.573 -6.756 1.00 1.00 C HETATM 81 C5B AZW A 3 3.769 -7.364 -4.769 1.00 1.00 C HETATM 82 C4B AZW A 3 3.738 -7.015 -6.125 1.00 1.00 C HETATM 83 N5B AZW A 3 2.538 -7.112 -6.858 1.00 1.00 N HETATM 84 C3' AZW A 3 7.424 -6.708 -3.893 1.00 1.00 C HETATM 85 O3' AZW A 3 8.547 -7.045 -4.699 1.00 1.00 O ATOM 98 P DG A 4 9.618 -5.909 -5.073 1.00 1.00 P ATOM 99 OP1 DG A 4 10.407 -6.378 -6.238 1.00 1.00 O ATOM 100 OP2 DG A 4 10.319 -5.522 -3.826 1.00 1.00 O ATOM 101 O5' DG A 4 8.712 -4.691 -5.549 1.00 1.00 O ATOM 102 C5' DG A 4 9.285 -3.434 -5.910 1.00 1.00 C ATOM 103 C4' DG A 4 8.618 -2.916 -7.161 1.00 1.00 C ATOM 104 O4' DG A 4 7.267 -3.439 -7.228 1.00 1.00 O ATOM 105 C3' DG A 4 8.449 -1.400 -7.262 1.00 1.00 C ATOM 106 O3' DG A 4 8.356 -1.027 -8.646 1.00 1.00 O ATOM 107 C2' DG A 4 7.127 -1.194 -6.547 1.00 1.00 C ATOM 108 C1' DG A 4 6.334 -2.376 -7.079 1.00 1.00 C ATOM 109 N9 DG A 4 5.241 -2.845 -6.231 1.00 1.00 N ATOM 110 C8 DG A 4 3.964 -3.130 -6.649 1.00 1.00 C ATOM 111 N7 DG A 4 3.197 -3.581 -5.695 1.00 1.00 N ATOM 112 C5 DG A 4 4.015 -3.590 -4.576 1.00 1.00 C ATOM 113 C6 DG A 4 3.727 -3.980 -3.246 1.00 1.00 C ATOM 114 O6 DG A 4 2.659 -4.404 -2.793 1.00 1.00 O ATOM 115 N1 DG A 4 4.830 -3.839 -2.408 1.00 1.00 N ATOM 116 C2 DG A 4 6.058 -3.374 -2.818 1.00 1.00 C ATOM 117 N2 DG A 4 7.012 -3.299 -1.879 1.00 1.00 N ATOM 118 N3 DG A 4 6.339 -3.006 -4.057 1.00 1.00 N ATOM 119 C4 DG A 4 5.280 -3.138 -4.883 1.00 1.00 C ATOM 0 H5' DG A 4 10.357 -3.545 -6.076 1.00 1.00 H new ATOM 0 H5'' DG A 4 9.161 -2.719 -5.097 1.00 1.00 H new ATOM 0 H4' DG A 4 9.287 -3.237 -7.960 1.00 1.00 H new ATOM 0 H3' DG A 4 9.264 -0.811 -6.841 1.00 1.00 H new ATOM 0 H2' DG A 4 7.234 -1.222 -5.463 1.00 1.00 H new ATOM 0 H2'' DG A 4 6.665 -0.239 -6.798 1.00 1.00 H new ATOM 0 H1' DG A 4 5.854 -2.051 -8.002 1.00 1.00 H new ATOM 0 H8 DG A 4 3.628 -2.994 -7.666 1.00 1.00 H new ATOM 0 H1 DG A 4 4.720 -4.097 -1.427 1.00 1.00 H new ATOM 0 H21 DG A 4 7.943 -2.962 -2.124 1.00 1.00 H new ATOM 0 H22 DG A 4 6.807 -3.579 -0.920 1.00 1.00 H new ATOM 131 P DG A 5 8.159 0.502 -9.092 1.00 1.00 P ATOM 132 OP1 DG A 5 8.512 0.599 -10.526 1.00 1.00 O ATOM 133 OP2 DG A 5 8.864 1.357 -8.112 1.00 1.00 O ATOM 134 O5' DG A 5 6.595 0.759 -8.951 1.00 1.00 O ATOM 135 C5' DG A 5 5.692 0.264 -9.938 1.00 1.00 C ATOM 136 C4' DG A 5 4.260 0.466 -9.496 1.00 1.00 C ATOM 137 O4' DG A 5 4.054 -0.158 -8.209 1.00 1.00 O ATOM 138 C3' DG A 5 3.839 1.926 -9.306 1.00 1.00 C ATOM 139 O3' DG A 5 2.903 2.324 -10.317 1.00 1.00 O ATOM 140 C2' DG A 5 3.195 1.973 -7.926 1.00 1.00 C ATOM 141 C1' DG A 5 2.967 0.509 -7.602 1.00 1.00 C ATOM 142 N9 DG A 5 2.937 0.185 -6.179 1.00 1.00 N ATOM 143 C8 DG A 5 3.917 0.408 -5.241 1.00 1.00 C ATOM 144 N7 DG A 5 3.585 0.005 -4.044 1.00 1.00 N ATOM 145 C5 DG A 5 2.307 -0.516 -4.198 1.00 1.00 C ATOM 146 C6 DG A 5 1.427 -1.102 -3.247 1.00 1.00 C ATOM 147 O6 DG A 5 1.606 -1.271 -2.028 1.00 1.00 O ATOM 148 N1 DG A 5 0.224 -1.499 -3.827 1.00 1.00 N ATOM 149 C2 DG A 5 -0.085 -1.344 -5.160 1.00 1.00 C ATOM 150 N2 DG A 5 -1.292 -1.775 -5.550 1.00 1.00 N ATOM 151 N3 DG A 5 0.724 -0.800 -6.053 1.00 1.00 N ATOM 152 C4 DG A 5 1.895 -0.411 -5.509 1.00 1.00 C ATOM 0 H5' DG A 5 5.879 -0.796 -10.111 1.00 1.00 H new ATOM 0 H5'' DG A 5 5.862 0.777 -10.885 1.00 1.00 H new ATOM 0 H4' DG A 5 3.669 0.033 -10.303 1.00 1.00 H new ATOM 0 H3' DG A 5 4.685 2.608 -9.387 1.00 1.00 H new ATOM 0 H2' DG A 5 3.846 2.451 -7.194 1.00 1.00 H new ATOM 0 H2'' DG A 5 2.260 2.534 -7.936 1.00 1.00 H new ATOM 0 HO3' DG A 5 2.646 3.259 -10.175 1.00 1.00 H new ATOM 0 H1' DG A 5 1.983 0.212 -7.965 1.00 1.00 H new ATOM 0 H8 DG A 5 4.866 0.870 -5.471 1.00 1.00 H new ATOM 0 H1 DG A 5 -0.475 -1.933 -3.224 1.00 1.00 H new ATOM 0 H21 DG A 5 -1.575 -1.686 -6.526 1.00 1.00 H new ATOM 0 H22 DG A 5 -1.928 -2.193 -4.871 1.00 1.00 H new TER 165 DG A 5 ATOM 166 O5' DG B 1 7.311 2.628 1.298 1.00 1.00 O ATOM 167 C5' DG B 1 8.652 2.194 1.517 1.00 1.00 C ATOM 168 C4' DG B 1 8.766 1.463 2.833 1.00 1.00 C ATOM 169 O4' DG B 1 7.435 1.077 3.262 1.00 1.00 O ATOM 170 C3' DG B 1 9.585 0.173 2.786 1.00 1.00 C ATOM 171 O3' DG B 1 10.312 0.009 4.010 1.00 1.00 O ATOM 172 C2' DG B 1 8.522 -0.899 2.634 1.00 1.00 C ATOM 173 C1' DG B 1 7.388 -0.328 3.461 1.00 1.00 C ATOM 174 N9 DG B 1 6.049 -0.798 3.110 1.00 1.00 N ATOM 175 C8 DG B 1 5.132 -1.353 3.970 1.00 1.00 C ATOM 176 N7 DG B 1 4.005 -1.670 3.394 1.00 1.00 N ATOM 177 C5 DG B 1 4.186 -1.306 2.069 1.00 1.00 C ATOM 178 C6 DG B 1 3.299 -1.413 0.965 1.00 1.00 C ATOM 179 O6 DG B 1 2.139 -1.852 0.950 1.00 1.00 O ATOM 180 N1 DG B 1 3.865 -0.935 -0.211 1.00 1.00 N ATOM 181 C2 DG B 1 5.136 -0.411 -0.299 1.00 1.00 C ATOM 182 N2 DG B 1 5.512 0.017 -1.511 1.00 1.00 N ATOM 183 N3 DG B 1 5.975 -0.304 0.722 1.00 1.00 N ATOM 184 C4 DG B 1 5.440 -0.767 1.872 1.00 1.00 C ATOM 0 H5' DG B 1 9.323 3.053 1.513 1.00 1.00 H new ATOM 0 H5'' DG B 1 8.966 1.540 0.703 1.00 1.00 H new ATOM 0 H4' DG B 1 9.272 2.156 3.505 1.00 1.00 H new ATOM 0 H3' DG B 1 10.327 0.150 1.988 1.00 1.00 H new ATOM 0 H2' DG B 1 8.235 -1.046 1.593 1.00 1.00 H new ATOM 0 H2'' DG B 1 8.858 -1.865 3.012 1.00 1.00 H new ATOM 0 HO5' DG B 1 6.717 2.197 1.948 1.00 1.00 H new ATOM 0 H1' DG B 1 7.538 -0.652 4.491 1.00 1.00 H new ATOM 0 H8 DG B 1 5.325 -1.511 5.021 1.00 1.00 H new ATOM 0 H1 DG B 1 3.304 -0.975 -1.062 1.00 1.00 H new ATOM 0 H21 DG B 1 6.441 0.416 -1.645 1.00 1.00 H new ATOM 0 H22 DG B 1 4.869 -0.056 -2.300 1.00 1.00 H new ATOM 197 P DG B 2 11.467 -1.099 4.126 1.00 1.00 P ATOM 198 OP1 DG B 2 12.367 -0.677 5.225 1.00 1.00 O ATOM 199 OP2 DG B 2 12.030 -1.345 2.776 1.00 1.00 O ATOM 200 O5' DG B 2 10.692 -2.403 4.605 1.00 1.00 O ATOM 201 C5' DG B 2 10.097 -2.446 5.901 1.00 1.00 C ATOM 202 C4' DG B 2 9.140 -3.607 6.016 1.00 1.00 C ATOM 203 O4' DG B 2 8.051 -3.434 5.076 1.00 1.00 O ATOM 204 C3' DG B 2 9.745 -4.980 5.704 1.00 1.00 C ATOM 205 O3' DG B 2 9.291 -5.932 6.672 1.00 1.00 O ATOM 206 C2' DG B 2 9.173 -5.297 4.335 1.00 1.00 C ATOM 207 C1' DG B 2 7.798 -4.692 4.483 1.00 1.00 C ATOM 208 N9 DG B 2 7.045 -4.513 3.246 1.00 1.00 N ATOM 209 C8 DG B 2 7.507 -4.067 2.032 1.00 1.00 C ATOM 210 N7 DG B 2 6.598 -4.088 1.094 1.00 1.00 N ATOM 211 C5 DG B 2 5.466 -4.576 1.734 1.00 1.00 C ATOM 212 C6 DG B 2 4.161 -4.826 1.234 1.00 1.00 C ATOM 213 O6 DG B 2 3.732 -4.640 0.088 1.00 1.00 O ATOM 214 N1 DG B 2 3.309 -5.326 2.218 1.00 1.00 N ATOM 215 C2 DG B 2 3.682 -5.549 3.525 1.00 1.00 C ATOM 216 N2 DG B 2 2.737 -6.011 4.353 1.00 1.00 N ATOM 217 N3 DG B 2 4.891 -5.318 4.003 1.00 1.00 N ATOM 218 C4 DG B 2 5.726 -4.840 3.059 1.00 1.00 C ATOM 0 H5' DG B 2 9.568 -1.513 6.094 1.00 1.00 H new ATOM 0 H5'' DG B 2 10.875 -2.534 6.660 1.00 1.00 H new ATOM 0 H4' DG B 2 8.828 -3.599 7.060 1.00 1.00 H new ATOM 0 H3' DG B 2 10.835 -5.002 5.727 1.00 1.00 H new ATOM 0 H2' DG B 2 9.745 -4.840 3.528 1.00 1.00 H new ATOM 0 H2'' DG B 2 9.138 -6.368 4.135 1.00 1.00 H new ATOM 0 H1' DG B 2 7.166 -5.365 5.062 1.00 1.00 H new ATOM 0 H8 DG B 2 8.521 -3.732 1.869 1.00 1.00 H new ATOM 0 H1 DG B 2 2.348 -5.540 1.953 1.00 1.00 H new ATOM 0 H21 DG B 2 2.961 -6.193 5.331 1.00 1.00 H new ATOM 0 H22 DG B 2 1.793 -6.181 4.005 1.00 1.00 H new HETATM 230 P AZW B 3 9.928 -7.402 6.738 1.00 1.00 P HETATM 231 OP1 AZW B 3 10.346 -7.653 8.138 1.00 1.00 O HETATM 232 OP2 AZW B 3 10.926 -7.510 5.650 1.00 1.00 O HETATM 233 O5' AZW B 3 8.715 -8.369 6.386 1.00 1.00 O HETATM 234 C5' AZW B 3 7.532 -8.382 7.181 1.00 1.00 C HETATM 235 C1A AZW B 3 6.328 -8.664 6.308 1.00 1.00 C HETATM 236 C2A AZW B 3 5.193 -9.263 6.864 1.00 1.00 C HETATM 237 C6A AZW B 3 6.342 -8.324 4.946 1.00 1.00 C HETATM 238 C3A AZW B 3 4.071 -9.522 6.068 1.00 1.00 C HETATM 239 C5A AZW B 3 5.220 -8.583 4.148 1.00 1.00 C HETATM 240 C4A AZW B 3 4.083 -9.182 4.710 1.00 1.00 C HETATM 241 N5A AZW B 3 2.943 -9.430 3.910 1.00 1.00 N HETATM 242 C1B AZW B 3 -0.599 -11.269 0.798 1.00 1.00 C HETATM 243 C2B AZW B 3 -0.359 -12.035 1.952 1.00 1.00 C HETATM 244 C6B AZW B 3 0.292 -10.245 0.446 1.00 1.00 C HETATM 245 C3B AZW B 3 0.768 -11.774 2.744 1.00 1.00 C HETATM 246 C5B AZW B 3 1.418 -9.987 1.240 1.00 1.00 C HETATM 247 C4B AZW B 3 1.658 -10.751 2.388 1.00 1.00 C HETATM 248 N5B AZW B 3 2.801 -10.500 3.182 1.00 1.00 N HETATM 249 C3' AZW B 3 -1.811 -11.545 -0.073 1.00 1.00 C HETATM 250 O3' AZW B 3 -2.464 -12.754 0.310 1.00 1.00 O ATOM 263 P DG B 4 -3.800 -12.687 1.197 1.00 1.00 P ATOM 264 OP1 DG B 4 -3.966 -13.989 1.884 1.00 1.00 O ATOM 265 OP2 DG B 4 -4.892 -12.181 0.330 1.00 1.00 O ATOM 266 O5' DG B 4 -3.477 -11.583 2.295 1.00 1.00 O ATOM 267 C5' DG B 4 -4.505 -11.052 3.131 1.00 1.00 C ATOM 268 C4' DG B 4 -3.944 -10.726 4.496 1.00 1.00 C ATOM 269 O4' DG B 4 -2.582 -10.250 4.351 1.00 1.00 O ATOM 270 C3' DG B 4 -4.679 -9.620 5.256 1.00 1.00 C ATOM 271 O3' DG B 4 -4.591 -9.859 6.667 1.00 1.00 O ATOM 272 C2' DG B 4 -3.893 -8.382 4.870 1.00 1.00 C ATOM 273 C1' DG B 4 -2.482 -8.933 4.874 1.00 1.00 C ATOM 274 N9 DG B 4 -1.520 -8.189 4.070 1.00 1.00 N ATOM 275 C8 DG B 4 -0.337 -7.656 4.515 1.00 1.00 C ATOM 276 N7 DG B 4 0.340 -7.053 3.579 1.00 1.00 N ATOM 277 C5 DG B 4 -0.446 -7.195 2.444 1.00 1.00 C ATOM 278 C6 DG B 4 -0.219 -6.740 1.125 1.00 1.00 C ATOM 279 O6 DG B 4 0.752 -6.100 0.697 1.00 1.00 O ATOM 280 N1 DG B 4 -1.258 -7.089 0.266 1.00 1.00 N ATOM 281 C2 DG B 4 -2.377 -7.794 0.649 1.00 1.00 C ATOM 282 N2 DG B 4 -3.283 -8.042 -0.310 1.00 1.00 N ATOM 283 N3 DG B 4 -2.599 -8.226 1.882 1.00 1.00 N ATOM 284 C4 DG B 4 -1.598 -7.893 2.725 1.00 1.00 C ATOM 0 H5' DG B 4 -5.317 -11.773 3.225 1.00 1.00 H new ATOM 0 H5'' DG B 4 -4.926 -10.155 2.678 1.00 1.00 H new ATOM 0 H4' DG B 4 -4.041 -11.654 5.059 1.00 1.00 H new ATOM 0 H3' DG B 4 -5.741 -9.547 5.023 1.00 1.00 H new ATOM 0 H2' DG B 4 -4.183 -7.995 3.893 1.00 1.00 H new ATOM 0 H2'' DG B 4 -4.022 -7.570 5.586 1.00 1.00 H new ATOM 0 H1' DG B 4 -2.104 -8.874 5.895 1.00 1.00 H new ATOM 0 H8 DG B 4 -0.000 -7.729 5.539 1.00 1.00 H new ATOM 0 H1 DG B 4 -1.185 -6.804 -0.711 1.00 1.00 H new ATOM 0 H21 DG B 4 -4.133 -8.560 -0.087 1.00 1.00 H new ATOM 0 H22 DG B 4 -3.122 -7.712 -1.262 1.00 1.00 H new ATOM 296 P DG B 5 -5.531 -9.060 7.694 1.00 1.00 P ATOM 297 OP1 DG B 5 -5.471 -9.781 8.991 1.00 1.00 O ATOM 298 OP2 DG B 5 -6.848 -8.830 7.054 1.00 1.00 O ATOM 299 O5' DG B 5 -4.807 -7.655 7.879 1.00 1.00 O ATOM 300 C5' DG B 5 -3.774 -7.502 8.850 1.00 1.00 C ATOM 301 C4' DG B 5 -3.132 -6.138 8.745 1.00 1.00 C ATOM 302 O4' DG B 5 -2.465 -5.996 7.475 1.00 1.00 O ATOM 303 C3' DG B 5 -4.091 -4.950 8.780 1.00 1.00 C ATOM 304 O3' DG B 5 -4.293 -4.499 10.126 1.00 1.00 O ATOM 305 C2' DG B 5 -3.386 -3.880 7.954 1.00 1.00 C ATOM 306 C1' DG B 5 -2.213 -4.615 7.304 1.00 1.00 C ATOM 307 N9 DG B 5 -2.039 -4.345 5.880 1.00 1.00 N ATOM 308 C8 DG B 5 -2.962 -4.528 4.880 1.00 1.00 C ATOM 309 N7 DG B 5 -2.529 -4.158 3.705 1.00 1.00 N ATOM 310 C5 DG B 5 -1.237 -3.707 3.942 1.00 1.00 C ATOM 311 C6 DG B 5 -0.269 -3.178 3.046 1.00 1.00 C ATOM 312 O6 DG B 5 -0.372 -2.992 1.821 1.00 1.00 O ATOM 313 N1 DG B 5 0.915 -2.841 3.697 1.00 1.00 N ATOM 314 C2 DG B 5 1.127 -2.994 5.050 1.00 1.00 C ATOM 315 N2 DG B 5 2.328 -2.626 5.515 1.00 1.00 N ATOM 316 N3 DG B 5 0.233 -3.483 5.894 1.00 1.00 N ATOM 317 C4 DG B 5 -0.921 -3.816 5.279 1.00 1.00 C ATOM 0 H5' DG B 5 -3.019 -8.275 8.708 1.00 1.00 H new ATOM 0 H5'' DG B 5 -4.186 -7.638 9.850 1.00 1.00 H new ATOM 0 H4' DG B 5 -2.479 -6.109 9.617 1.00 1.00 H new ATOM 0 H3' DG B 5 -5.079 -5.198 8.391 1.00 1.00 H new ATOM 0 H2' DG B 5 -4.052 -3.453 7.204 1.00 1.00 H new ATOM 0 H2'' DG B 5 -3.042 -3.057 8.580 1.00 1.00 H new ATOM 0 HO3' DG B 5 -4.909 -3.737 10.127 1.00 1.00 H new ATOM 0 H1' DG B 5 -1.296 -4.270 7.781 1.00 1.00 H new ATOM 0 H8 DG B 5 -3.947 -4.937 5.048 1.00 1.00 H new ATOM 0 H1 DG B 5 1.675 -2.456 3.136 1.00 1.00 H new ATOM 0 H21 DG B 5 2.540 -2.717 6.509 1.00 1.00 H new ATOM 0 H22 DG B 5 3.030 -2.254 4.876 1.00 1.00 H new TER 330 DG B 5 ATOM 331 O5' DG C 1 6.861 1.979 -2.921 1.00 1.00 O ATOM 332 C5' DG C 1 7.528 3.197 -3.235 1.00 1.00 C ATOM 333 C4' DG C 1 6.965 3.791 -4.503 1.00 1.00 C ATOM 334 O4' DG C 1 5.654 3.219 -4.724 1.00 1.00 O ATOM 335 C3' DG C 1 6.767 5.308 -4.492 1.00 1.00 C ATOM 336 O3' DG C 1 7.008 5.839 -5.799 1.00 1.00 O ATOM 337 C2' DG C 1 5.307 5.463 -4.110 1.00 1.00 C ATOM 338 C1' DG C 1 4.670 4.242 -4.749 1.00 1.00 C ATOM 339 N9 DG C 1 3.473 3.739 -4.080 1.00 1.00 N ATOM 340 C8 DG C 1 2.266 3.463 -4.673 1.00 1.00 C ATOM 341 N7 DG C 1 1.371 3.000 -3.843 1.00 1.00 N ATOM 342 C5 DG C 1 2.024 2.974 -2.620 1.00 1.00 C ATOM 343 C6 DG C 1 1.555 2.569 -1.344 1.00 1.00 C ATOM 344 O6 DG C 1 0.442 2.110 -1.045 1.00 1.00 O ATOM 345 N1 DG C 1 2.529 2.704 -0.361 1.00 1.00 N ATOM 346 C2 DG C 1 3.803 3.169 -0.593 1.00 1.00 C ATOM 347 N2 DG C 1 4.617 3.229 0.472 1.00 1.00 N ATOM 348 N3 DG C 1 4.256 3.546 -1.780 1.00 1.00 N ATOM 349 C4 DG C 1 3.321 3.426 -2.744 1.00 1.00 C ATOM 0 H5' DG C 1 8.596 3.014 -3.354 1.00 1.00 H new ATOM 0 H5'' DG C 1 7.415 3.904 -2.413 1.00 1.00 H new ATOM 0 H4' DG C 1 7.701 3.566 -5.275 1.00 1.00 H new ATOM 0 H3' DG C 1 7.440 5.833 -3.815 1.00 1.00 H new ATOM 0 H2' DG C 1 5.169 5.474 -3.029 1.00 1.00 H new ATOM 0 H2'' DG C 1 4.883 6.390 -4.495 1.00 1.00 H new ATOM 0 HO5' DG C 1 5.951 2.002 -3.283 1.00 1.00 H new ATOM 0 H1' DG C 1 4.343 4.532 -5.748 1.00 1.00 H new ATOM 0 H8 DG C 1 2.075 3.614 -5.725 1.00 1.00 H new ATOM 0 H1 DG C 1 2.283 2.441 0.594 1.00 1.00 H new ATOM 0 H21 DG C 1 5.574 3.565 0.364 1.00 1.00 H new ATOM 0 H22 DG C 1 4.279 2.938 1.389 1.00 1.00 H new ATOM 362 P DG C 2 7.198 7.419 -6.013 1.00 1.00 P ATOM 363 OP1 DG C 2 8.066 7.618 -7.198 1.00 1.00 O ATOM 364 OP2 DG C 2 7.593 8.020 -4.716 1.00 1.00 O ATOM 365 O5' DG C 2 5.739 7.944 -6.368 1.00 1.00 O ATOM 366 C5' DG C 2 5.038 7.439 -7.504 1.00 1.00 C ATOM 367 C4' DG C 2 3.566 7.752 -7.396 1.00 1.00 C ATOM 368 O4' DG C 2 2.978 6.940 -6.348 1.00 1.00 O ATOM 369 C3' DG C 2 3.236 9.206 -7.038 1.00 1.00 C ATOM 370 O3' DG C 2 2.210 9.706 -7.906 1.00 1.00 O ATOM 371 C2' DG C 2 2.736 9.111 -5.608 1.00 1.00 C ATOM 372 C1' DG C 2 2.075 7.750 -5.623 1.00 1.00 C ATOM 373 N9 DG C 2 1.836 7.169 -4.307 1.00 1.00 N ATOM 374 C8 DG C 2 2.646 7.245 -3.200 1.00 1.00 C ATOM 375 N7 DG C 2 2.109 6.726 -2.130 1.00 1.00 N ATOM 376 C5 DG C 2 0.868 6.274 -2.555 1.00 1.00 C ATOM 377 C6 DG C 2 -0.162 5.622 -1.836 1.00 1.00 C ATOM 378 O6 DG C 2 -0.180 5.311 -0.636 1.00 1.00 O ATOM 379 N1 DG C 2 -1.259 5.331 -2.642 1.00 1.00 N ATOM 380 C2 DG C 2 -1.339 5.637 -3.983 1.00 1.00 C ATOM 381 N2 DG C 2 -2.465 5.271 -4.614 1.00 1.00 N ATOM 382 N3 DG C 2 -0.383 6.246 -4.667 1.00 1.00 N ATOM 383 C4 DG C 2 0.685 6.535 -3.896 1.00 1.00 C ATOM 0 H5' DG C 2 5.183 6.361 -7.579 1.00 1.00 H new ATOM 0 H5'' DG C 2 5.444 7.879 -8.415 1.00 1.00 H new ATOM 0 H4' DG C 2 3.167 7.549 -8.390 1.00 1.00 H new ATOM 0 H3' DG C 2 4.084 9.883 -7.144 1.00 1.00 H new ATOM 0 H2' DG C 2 3.548 9.167 -4.883 1.00 1.00 H new ATOM 0 H2'' DG C 2 2.034 9.908 -5.363 1.00 1.00 H new ATOM 0 H1' DG C 2 1.079 7.829 -6.059 1.00 1.00 H new ATOM 0 H8 DG C 2 3.630 7.690 -3.214 1.00 1.00 H new ATOM 0 H1 DG C 2 -2.055 4.861 -2.212 1.00 1.00 H new ATOM 0 H21 DG C 2 -2.581 5.471 -5.607 1.00 1.00 H new ATOM 0 H22 DG C 2 -3.205 4.793 -4.100 1.00 1.00 H new HETATM 395 P AZW C 3 1.723 11.235 -7.808 1.00 1.00 P HETATM 396 OP1 AZW C 3 1.609 11.776 -9.181 1.00 1.00 O HETATM 397 OP2 AZW C 3 2.592 11.927 -6.824 1.00 1.00 O HETATM 398 O5' AZW C 3 0.260 11.134 -7.187 1.00 1.00 O HETATM 399 C5' AZW C 3 -0.751 10.338 -7.802 1.00 1.00 C HETATM 400 C1A AZW C 3 -1.670 9.755 -6.747 1.00 1.00 C HETATM 401 C2A AZW C 3 -2.649 8.827 -7.125 1.00 1.00 C HETATM 402 C6A AZW C 3 -1.552 10.135 -5.400 1.00 1.00 C HETATM 403 C3A AZW C 3 -3.505 8.278 -6.165 1.00 1.00 C HETATM 404 C5A AZW C 3 -2.413 9.585 -4.439 1.00 1.00 C HETATM 405 C4A AZW C 3 -3.390 8.656 -4.821 1.00 1.00 C HETATM 406 N5A AZW C 3 -4.262 8.103 -3.858 1.00 1.00 N HETATM 407 C1B AZW C 3 -7.815 7.152 -0.396 1.00 1.00 C HETATM 408 C2B AZW C 3 -8.322 7.748 -1.559 1.00 1.00 C HETATM 409 C6B AZW C 3 -6.430 7.101 -0.188 1.00 1.00 C HETATM 410 C3B AZW C 3 -7.448 8.289 -2.508 1.00 1.00 C HETATM 411 C5B AZW C 3 -5.555 7.643 -1.140 1.00 1.00 C HETATM 412 C4B AZW C 3 -6.064 8.238 -2.299 1.00 1.00 C HETATM 413 N5B AZW C 3 -5.188 8.793 -3.259 1.00 1.00 N HETATM 414 C3' AZW C 3 -8.751 6.552 0.641 1.00 1.00 C HETATM 415 O3' AZW C 3 -10.045 7.145 0.584 1.00 1.00 O ATOM 428 P DG C 4 -11.285 6.296 0.019 1.00 1.00 P ATOM 429 OP1 DG C 4 -12.390 7.242 -0.254 1.00 1.00 O ATOM 430 OP2 DG C 4 -11.526 5.141 0.919 1.00 1.00 O ATOM 431 O5' DG C 4 -10.754 5.748 -1.377 1.00 1.00 O ATOM 432 C5' DG C 4 -10.924 4.381 -1.742 1.00 1.00 C ATOM 433 C4' DG C 4 -10.580 4.195 -3.200 1.00 1.00 C ATOM 434 O4' DG C 4 -9.251 4.718 -3.442 1.00 1.00 O ATOM 435 C3' DG C 4 -10.546 2.744 -3.680 1.00 1.00 C ATOM 436 O3' DG C 4 -10.967 2.676 -5.051 1.00 1.00 O ATOM 437 C2' DG C 4 -9.077 2.383 -3.541 1.00 1.00 C ATOM 438 C1' DG C 4 -8.416 3.687 -3.950 1.00 1.00 C ATOM 439 N9 DG C 4 -7.063 3.893 -3.440 1.00 1.00 N ATOM 440 C8 DG C 4 -5.962 4.245 -4.183 1.00 1.00 C ATOM 441 N7 DG C 4 -4.877 4.373 -3.473 1.00 1.00 N ATOM 442 C5 DG C 4 -5.281 4.087 -2.179 1.00 1.00 C ATOM 443 C6 DG C 4 -4.531 4.068 -0.978 1.00 1.00 C ATOM 444 O6 DG C 4 -3.324 4.306 -0.824 1.00 1.00 O ATOM 445 N1 DG C 4 -5.314 3.728 0.121 1.00 1.00 N ATOM 446 C2 DG C 4 -6.660 3.445 0.056 1.00 1.00 C ATOM 447 N2 DG C 4 -7.262 3.141 1.213 1.00 1.00 N ATOM 448 N3 DG C 4 -7.372 3.460 -1.060 1.00 1.00 N ATOM 449 C4 DG C 4 -6.627 3.788 -2.137 1.00 1.00 C ATOM 0 H5' DG C 4 -11.953 4.071 -1.559 1.00 1.00 H new ATOM 0 H5'' DG C 4 -10.286 3.748 -1.125 1.00 1.00 H new ATOM 0 H4' DG C 4 -11.373 4.713 -3.740 1.00 1.00 H new ATOM 0 H3' DG C 4 -11.203 2.074 -3.126 1.00 1.00 H new ATOM 0 H2' DG C 4 -8.819 2.092 -2.523 1.00 1.00 H new ATOM 0 H2'' DG C 4 -8.793 1.555 -4.191 1.00 1.00 H new ATOM 0 H1' DG C 4 -8.308 3.678 -5.035 1.00 1.00 H new ATOM 0 H8 DG C 4 -5.993 4.400 -5.251 1.00 1.00 H new ATOM 0 H1 DG C 4 -4.861 3.686 1.034 1.00 1.00 H new ATOM 0 H21 DG C 4 -8.258 2.922 1.228 1.00 1.00 H new ATOM 0 H22 DG C 4 -6.724 3.128 2.080 1.00 1.00 H new ATOM 461 P DG C 5 -11.357 1.268 -5.714 1.00 1.00 P ATOM 462 OP1 DG C 5 -12.050 1.542 -6.996 1.00 1.00 O ATOM 463 OP2 DG C 5 -12.042 0.463 -4.675 1.00 1.00 O ATOM 464 O5' DG C 5 -9.956 0.580 -6.030 1.00 1.00 O ATOM 465 C5' DG C 5 -9.135 1.065 -7.091 1.00 1.00 C ATOM 466 C4' DG C 5 -7.762 0.438 -7.053 1.00 1.00 C ATOM 467 O4' DG C 5 -6.990 0.973 -5.960 1.00 1.00 O ATOM 468 C3' DG C 5 -7.720 -1.072 -6.817 1.00 1.00 C ATOM 469 O3' DG C 5 -7.744 -1.779 -8.061 1.00 1.00 O ATOM 470 C2' DG C 5 -6.398 -1.292 -6.091 1.00 1.00 C ATOM 471 C1' DG C 5 -5.874 0.116 -5.814 1.00 1.00 C ATOM 472 N9 DG C 5 -5.297 0.304 -4.487 1.00 1.00 N ATOM 473 C8 DG C 5 -5.845 -0.056 -3.279 1.00 1.00 C ATOM 474 N7 DG C 5 -5.054 0.172 -2.265 1.00 1.00 N ATOM 475 C5 DG C 5 -3.914 0.718 -2.839 1.00 1.00 C ATOM 476 C6 DG C 5 -2.706 1.169 -2.238 1.00 1.00 C ATOM 477 O6 DG C 5 -2.389 1.150 -1.039 1.00 1.00 O ATOM 478 N1 DG C 5 -1.804 1.658 -3.179 1.00 1.00 N ATOM 479 C2 DG C 5 -2.046 1.706 -4.532 1.00 1.00 C ATOM 480 N2 DG C 5 -1.069 2.225 -5.290 1.00 1.00 N ATOM 481 N3 DG C 5 -3.163 1.290 -5.105 1.00 1.00 N ATOM 482 C4 DG C 5 -4.049 0.813 -4.206 1.00 1.00 C ATOM 0 H5' DG C 5 -9.044 2.149 -7.017 1.00 1.00 H new ATOM 0 H5'' DG C 5 -9.609 0.849 -8.048 1.00 1.00 H new ATOM 0 H4' DG C 5 -7.374 0.663 -8.047 1.00 1.00 H new ATOM 0 H3' DG C 5 -8.576 -1.435 -6.248 1.00 1.00 H new ATOM 0 H2' DG C 5 -6.541 -1.851 -5.166 1.00 1.00 H new ATOM 0 H2'' DG C 5 -5.699 -1.862 -6.703 1.00 1.00 H new ATOM 0 HO3' DG C 5 -7.715 -2.743 -7.890 1.00 1.00 H new ATOM 0 H1' DG C 5 -5.058 0.323 -6.506 1.00 1.00 H new ATOM 0 H8 DG C 5 -6.831 -0.485 -3.178 1.00 1.00 H new ATOM 0 H1 DG C 5 -0.905 2.003 -2.843 1.00 1.00 H new ATOM 0 H21 DG C 5 -1.187 2.289 -6.301 1.00 1.00 H new ATOM 0 H22 DG C 5 -0.208 2.556 -4.855 1.00 1.00 H new TER 495 DG C 5 ATOM 496 O5' DG D 1 -9.442 -3.861 3.789 1.00 1.00 O ATOM 497 C5' DG D 1 -8.200 -3.145 3.753 1.00 1.00 C ATOM 498 C4' DG D 1 -7.725 -2.797 5.142 1.00 1.00 C ATOM 499 O4' DG D 1 -6.310 -2.490 5.108 1.00 1.00 O ATOM 500 C3' DG D 1 -8.395 -1.568 5.755 1.00 1.00 C ATOM 501 O3' DG D 1 -8.532 -1.739 7.171 1.00 1.00 O ATOM 502 C2' DG D 1 -7.407 -0.464 5.434 1.00 1.00 C ATOM 503 C1' DG D 1 -6.097 -1.192 5.642 1.00 1.00 C ATOM 504 N9 DG D 1 -4.937 -0.601 4.986 1.00 1.00 N ATOM 505 C8 DG D 1 -3.781 -0.197 5.603 1.00 1.00 C ATOM 506 N7 DG D 1 -2.881 0.255 4.774 1.00 1.00 N ATOM 507 C5 DG D 1 -3.485 0.151 3.528 1.00 1.00 C ATOM 508 C6 DG D 1 -2.992 0.493 2.244 1.00 1.00 C ATOM 509 O6 DG D 1 -1.874 0.946 1.948 1.00 1.00 O ATOM 510 N1 DG D 1 -3.923 0.238 1.241 1.00 1.00 N ATOM 511 C2 DG D 1 -5.177 -0.291 1.463 1.00 1.00 C ATOM 512 N2 DG D 1 -5.956 -0.463 0.383 1.00 1.00 N ATOM 513 N3 DG D 1 -5.647 -0.619 2.656 1.00 1.00 N ATOM 514 C4 DG D 1 -4.756 -0.373 3.639 1.00 1.00 C ATOM 0 H5' DG D 1 -8.321 -2.233 3.169 1.00 1.00 H new ATOM 0 H5'' DG D 1 -7.445 -3.748 3.249 1.00 1.00 H new ATOM 0 H4' DG D 1 -7.974 -3.670 5.745 1.00 1.00 H new ATOM 0 H3' DG D 1 -9.398 -1.371 5.376 1.00 1.00 H new ATOM 0 H2' DG D 1 -7.517 -0.093 4.415 1.00 1.00 H new ATOM 0 H2'' DG D 1 -7.514 0.393 6.098 1.00 1.00 H new ATOM 0 HO5' DG D 1 -9.725 -4.071 2.875 1.00 1.00 H new ATOM 0 H1' DG D 1 -5.854 -1.161 6.704 1.00 1.00 H new ATOM 0 H8 DG D 1 -3.630 -0.248 6.671 1.00 1.00 H new ATOM 0 H1 DG D 1 -3.661 0.457 0.280 1.00 1.00 H new ATOM 0 H21 DG D 1 -6.894 -0.851 0.487 1.00 1.00 H new ATOM 0 H22 DG D 1 -5.610 -0.206 -0.541 1.00 1.00 H new ATOM 527 P DG D 2 -9.558 -0.823 7.999 1.00 1.00 P ATOM 528 OP1 DG D 2 -9.878 -1.536 9.255 1.00 1.00 O ATOM 529 OP2 DG D 2 -10.659 -0.421 7.091 1.00 1.00 O ATOM 530 O5' DG D 2 -8.711 0.472 8.364 1.00 1.00 O ATOM 531 C5' DG D 2 -7.520 0.375 9.146 1.00 1.00 C ATOM 532 C4' DG D 2 -6.806 1.705 9.183 1.00 1.00 C ATOM 533 O4' DG D 2 -5.968 1.830 8.006 1.00 1.00 O ATOM 534 C3' DG D 2 -7.727 2.932 9.159 1.00 1.00 C ATOM 535 O3' DG D 2 -7.174 4.002 9.932 1.00 1.00 O ATOM 536 C2' DG D 2 -7.685 3.330 7.696 1.00 1.00 C ATOM 537 C1' DG D 2 -6.210 3.104 7.442 1.00 1.00 C ATOM 538 N9 DG D 2 -5.785 3.102 6.046 1.00 1.00 N ATOM 539 C8 DG D 2 -6.565 2.887 4.937 1.00 1.00 C ATOM 540 N7 DG D 2 -5.924 3.064 3.814 1.00 1.00 N ATOM 541 C5 DG D 2 -4.637 3.405 4.207 1.00 1.00 C ATOM 542 C6 DG D 2 -3.496 3.713 3.428 1.00 1.00 C ATOM 543 O6 DG D 2 -3.400 3.756 2.195 1.00 1.00 O ATOM 544 N1 DG D 2 -2.384 3.998 4.215 1.00 1.00 N ATOM 545 C2 DG D 2 -2.387 3.991 5.592 1.00 1.00 C ATOM 546 N2 DG D 2 -1.223 4.278 6.198 1.00 1.00 N ATOM 547 N3 DG D 2 -3.449 3.710 6.333 1.00 1.00 N ATOM 548 C4 DG D 2 -4.533 3.428 5.579 1.00 1.00 C ATOM 0 H5' DG D 2 -6.863 -0.386 8.726 1.00 1.00 H new ATOM 0 H5'' DG D 2 -7.767 0.059 10.160 1.00 1.00 H new ATOM 0 H4' DG D 2 -6.258 1.699 10.125 1.00 1.00 H new ATOM 0 H3' DG D 2 -8.720 2.726 9.559 1.00 1.00 H new ATOM 0 H2' DG D 2 -8.322 2.706 7.070 1.00 1.00 H new ATOM 0 H2'' DG D 2 -7.989 4.364 7.530 1.00 1.00 H new ATOM 0 H1' DG D 2 -5.647 3.933 7.871 1.00 1.00 H new ATOM 0 H8 DG D 2 -7.605 2.600 4.989 1.00 1.00 H new ATOM 0 H1 DG D 2 -1.510 4.227 3.741 1.00 1.00 H new ATOM 0 H21 DG D 2 -1.167 4.287 7.216 1.00 1.00 H new ATOM 0 H22 DG D 2 -0.395 4.487 5.640 1.00 1.00 H new HETATM 560 P AZW D 3 -7.280 4.060 11.531 1.00 1.00 P HETATM 561 OP1 AZW D 3 -6.950 2.723 12.074 1.00 1.00 O HETATM 562 OP2 AZW D 3 -8.569 4.695 11.898 1.00 1.00 O HETATM 563 O5' AZW D 3 -6.106 5.066 11.902 1.00 1.00 O HETATM 564 C5' AZW D 3 -6.087 6.359 11.302 1.00 1.00 C HETATM 565 C1A AZW D 3 -4.972 6.475 10.283 1.00 1.00 C HETATM 566 C2A AZW D 3 -3.644 6.671 10.692 1.00 1.00 C HETATM 567 C6A AZW D 3 -5.288 6.465 8.919 1.00 1.00 C HETATM 568 C3A AZW D 3 -2.638 6.866 9.733 1.00 1.00 C HETATM 569 C5A AZW D 3 -4.284 6.659 7.965 1.00 1.00 C HETATM 570 C4A AZW D 3 -2.960 6.866 8.368 1.00 1.00 C HETATM 571 N5A AZW D 3 -1.974 7.138 7.393 1.00 1.00 N HETATM 572 C1B AZW D 3 0.755 9.308 3.672 1.00 1.00 C HETATM 573 C2B AZW D 3 1.082 9.530 5.017 1.00 1.00 C HETATM 574 C6B AZW D 3 -0.465 8.709 3.343 1.00 1.00 C HETATM 575 C3B AZW D 3 0.182 9.158 6.028 1.00 1.00 C HETATM 576 C5B AZW D 3 -1.360 8.336 4.350 1.00 1.00 C HETATM 577 C4B AZW D 3 -1.042 8.562 5.693 1.00 1.00 C HETATM 578 N5B AZW D 3 -1.986 8.237 6.693 1.00 1.00 N HETATM 579 C3' AZW D 3 1.698 9.737 2.569 1.00 1.00 C HETATM 580 O3' AZW D 3 2.339 10.964 2.899 1.00 1.00 O ATOM 593 P DG D 4 3.935 11.014 3.047 1.00 1.00 P ATOM 594 OP1 DG D 4 4.284 12.185 3.886 1.00 1.00 O ATOM 595 OP2 DG D 4 4.518 10.886 1.690 1.00 1.00 O ATOM 596 O5' DG D 4 4.290 9.699 3.867 1.00 1.00 O ATOM 597 C5' DG D 4 5.617 9.177 3.883 1.00 1.00 C ATOM 598 C4' DG D 4 5.857 8.449 5.184 1.00 1.00 C ATOM 599 O4' DG D 4 4.604 7.895 5.650 1.00 1.00 O ATOM 600 C3' DG D 4 6.824 7.269 5.104 1.00 1.00 C ATOM 601 O3' DG D 4 7.505 7.117 6.356 1.00 1.00 O ATOM 602 C2' DG D 4 5.899 6.094 4.840 1.00 1.00 C ATOM 603 C1' DG D 4 4.668 6.475 5.649 1.00 1.00 C ATOM 604 N9 DG D 4 3.391 5.967 5.150 1.00 1.00 N ATOM 605 C8 DG D 4 2.393 5.402 5.907 1.00 1.00 C ATOM 606 N7 DG D 4 1.342 5.062 5.211 1.00 1.00 N ATOM 607 C5 DG D 4 1.662 5.421 3.910 1.00 1.00 C ATOM 608 C6 DG D 4 0.905 5.292 2.716 1.00 1.00 C ATOM 609 O6 DG D 4 -0.230 4.814 2.577 1.00 1.00 O ATOM 610 N1 DG D 4 1.589 5.777 1.606 1.00 1.00 N ATOM 611 C2 DG D 4 2.855 6.317 1.655 1.00 1.00 C ATOM 612 N2 DG D 4 3.374 6.735 0.491 1.00 1.00 N ATOM 613 N3 DG D 4 3.569 6.444 2.762 1.00 1.00 N ATOM 614 C4 DG D 4 2.922 5.980 3.850 1.00 1.00 C ATOM 0 H5' DG D 4 6.339 9.986 3.768 1.00 1.00 H new ATOM 0 H5'' DG D 4 5.762 8.499 3.042 1.00 1.00 H new ATOM 0 H4' DG D 4 6.294 9.199 5.844 1.00 1.00 H new ATOM 0 H3' DG D 4 7.598 7.377 4.345 1.00 1.00 H new ATOM 0 H2' DG D 4 5.672 5.983 3.780 1.00 1.00 H new ATOM 0 H2'' DG D 4 6.331 5.151 5.174 1.00 1.00 H new ATOM 0 H1' DG D 4 4.791 6.023 6.633 1.00 1.00 H new ATOM 0 H8 DG D 4 2.470 5.254 6.974 1.00 1.00 H new ATOM 0 H1 DG D 4 1.124 5.730 0.699 1.00 1.00 H new ATOM 0 H21 DG D 4 4.308 7.144 0.467 1.00 1.00 H new ATOM 0 H22 DG D 4 2.834 6.644 -0.370 1.00 1.00 H new ATOM 626 P DG D 5 8.760 6.122 6.482 1.00 1.00 P ATOM 627 OP1 DG D 5 9.536 6.544 7.674 1.00 1.00 O ATOM 628 OP2 DG D 5 9.438 6.047 5.166 1.00 1.00 O ATOM 629 O5' DG D 5 8.097 4.713 6.801 1.00 1.00 O ATOM 630 C5' DG D 5 7.234 4.569 7.928 1.00 1.00 C ATOM 631 C4' DG D 5 6.457 3.273 7.855 1.00 1.00 C ATOM 632 O4' DG D 5 5.274 3.433 7.046 1.00 1.00 O ATOM 633 C3' DG D 5 7.166 2.097 7.191 1.00 1.00 C ATOM 634 O3' DG D 5 8.052 1.442 8.112 1.00 1.00 O ATOM 635 C2' DG D 5 6.004 1.191 6.808 1.00 1.00 C ATOM 636 C1' DG D 5 4.799 2.132 6.732 1.00 1.00 C ATOM 637 N9 DG D 5 4.145 2.177 5.426 1.00 1.00 N ATOM 638 C8 DG D 5 4.705 2.547 4.227 1.00 1.00 C ATOM 639 N7 DG D 5 3.877 2.460 3.220 1.00 1.00 N ATOM 640 C5 DG D 5 2.695 2.005 3.787 1.00 1.00 C ATOM 641 C6 DG D 5 1.438 1.718 3.184 1.00 1.00 C ATOM 642 O6 DG D 5 1.117 1.800 1.984 1.00 1.00 O ATOM 643 N1 DG D 5 0.501 1.280 4.116 1.00 1.00 N ATOM 644 C2 DG D 5 0.755 1.137 5.463 1.00 1.00 C ATOM 645 N2 DG D 5 -0.267 0.703 6.215 1.00 1.00 N ATOM 646 N3 DG D 5 1.921 1.399 6.037 1.00 1.00 N ATOM 647 C4 DG D 5 2.841 1.826 5.147 1.00 1.00 C ATOM 0 H5' DG D 5 6.542 5.410 7.970 1.00 1.00 H new ATOM 0 H5'' DG D 5 7.822 4.593 8.846 1.00 1.00 H new ATOM 0 H4' DG D 5 6.281 3.055 8.908 1.00 1.00 H new ATOM 0 H3' DG D 5 7.792 2.384 6.346 1.00 1.00 H new ATOM 0 H2' DG D 5 6.183 0.696 5.853 1.00 1.00 H new ATOM 0 H2'' DG D 5 5.850 0.407 7.549 1.00 1.00 H new ATOM 0 HO3' DG D 5 8.493 0.691 7.663 1.00 1.00 H new ATOM 0 H1' DG D 5 4.046 1.761 7.428 1.00 1.00 H new ATOM 0 H8 DG D 5 5.728 2.877 4.127 1.00 1.00 H new ATOM 0 H1 DG D 5 -0.434 1.050 3.780 1.00 1.00 H new ATOM 0 H21 DG D 5 -0.143 0.576 7.220 1.00 1.00 H new ATOM 0 H22 DG D 5 -1.168 0.500 5.782 1.00 1.00 H new TER 660 DG D 5 HETATM 661 K K A 101 1.247 -3.927 -0.643 1.00 1.00 K HETATM 662 K K A 102 -0.068 -0.315 0.280 1.00 1.00 K HETATM 663 K K C 101 -1.337 3.302 0.636 1.00 1.00 K