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 -6:sc= 0.57 USER MOD Single : A 5 DG O3' : rot 180:sc= 0 USER MOD Single : B 1 DG O5' : rot -11:sc= 0.55 USER MOD Single : B 5 DG O3' : rot 180:sc= 0 USER MOD Single : C 1 DG O5' : rot -15:sc= 0.511 USER MOD Single : C 5 DG O3' : rot 180:sc= 0 USER MOD Single : D 1 DG O5' : rot -11:sc= 0.654 USER MOD Single : D 5 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -7.713 -2.606 -0.924 1.00 1.00 O ATOM 2 C5' DG A 1 -8.477 -3.699 -1.421 1.00 1.00 C ATOM 3 C4' DG A 1 -8.231 -3.878 -2.899 1.00 1.00 C ATOM 4 O4' DG A 1 -7.046 -3.125 -3.252 1.00 1.00 O ATOM 5 C3' DG A 1 -7.969 -5.319 -3.335 1.00 1.00 C ATOM 6 O3' DG A 1 -8.592 -5.565 -4.600 1.00 1.00 O ATOM 7 C2' DG A 1 -6.457 -5.383 -3.449 1.00 1.00 C ATOM 8 C1' DG A 1 -6.108 -3.975 -3.890 1.00 1.00 C ATOM 9 N9 DG A 1 -4.764 -3.527 -3.530 1.00 1.00 N ATOM 10 C8 DG A 1 -3.810 -3.038 -4.389 1.00 1.00 C ATOM 11 N7 DG A 1 -2.692 -2.721 -3.797 1.00 1.00 N ATOM 12 C5 DG A 1 -2.918 -3.020 -2.462 1.00 1.00 C ATOM 13 C6 DG A 1 -2.060 -2.888 -1.340 1.00 1.00 C ATOM 14 O6 DG A 1 -0.902 -2.444 -1.310 1.00 1.00 O ATOM 15 N1 DG A 1 -2.669 -3.308 -0.162 1.00 1.00 N ATOM 16 C2 DG A 1 -3.957 -3.791 -0.085 1.00 1.00 C ATOM 17 N2 DG A 1 -4.395 -4.138 1.135 1.00 1.00 N ATOM 18 N3 DG A 1 -4.768 -3.916 -1.124 1.00 1.00 N ATOM 19 C4 DG A 1 -4.190 -3.518 -2.277 1.00 1.00 C ATOM 0 H5' DG A 1 -9.537 -3.523 -1.240 1.00 1.00 H new ATOM 0 H5'' DG A 1 -8.210 -4.611 -0.887 1.00 1.00 H new ATOM 0 H4' DG A 1 -9.142 -3.543 -3.395 1.00 1.00 H new ATOM 0 H3' DG A 1 -8.367 -6.064 -2.646 1.00 1.00 H new ATOM 0 H2' DG A 1 -5.988 -5.640 -2.499 1.00 1.00 H new ATOM 0 H2'' DG A 1 -6.135 -6.129 -4.176 1.00 1.00 H new ATOM 0 HO5' DG A 1 -7.124 -2.270 -1.631 1.00 1.00 H new ATOM 0 H1' DG A 1 -6.138 -3.950 -4.979 1.00 1.00 H new ATOM 0 H8 DG A 1 -3.970 -2.927 -5.451 1.00 1.00 H new ATOM 0 H1 DG A 1 -2.127 -3.255 0.700 1.00 1.00 H new ATOM 0 H21 DG A 1 -5.341 -4.502 1.253 1.00 1.00 H new ATOM 0 H22 DG A 1 -3.782 -4.038 1.944 1.00 1.00 H new ATOM 32 P DG A 2 -8.668 -7.058 -5.185 1.00 1.00 P ATOM 33 OP1 DG A 2 -9.861 -7.125 -6.061 1.00 1.00 O ATOM 34 OP2 DG A 2 -8.543 -8.014 -4.057 1.00 1.00 O ATOM 35 O5' DG A 2 -7.369 -7.182 -6.094 1.00 1.00 O ATOM 36 C5' DG A 2 -7.113 -6.245 -7.141 1.00 1.00 C ATOM 37 C4' DG A 2 -5.706 -6.411 -7.665 1.00 1.00 C ATOM 38 O4' DG A 2 -4.758 -5.906 -6.690 1.00 1.00 O ATOM 39 C3' DG A 2 -5.288 -7.859 -7.935 1.00 1.00 C ATOM 40 O3' DG A 2 -4.490 -7.917 -9.121 1.00 1.00 O ATOM 41 C2' DG A 2 -4.450 -8.200 -6.718 1.00 1.00 C ATOM 42 C1' DG A 2 -3.746 -6.880 -6.504 1.00 1.00 C ATOM 43 N9 DG A 2 -3.133 -6.688 -5.193 1.00 1.00 N ATOM 44 C8 DG A 2 -3.597 -7.113 -3.972 1.00 1.00 C ATOM 45 N7 DG A 2 -2.789 -6.831 -2.986 1.00 1.00 N ATOM 46 C5 DG A 2 -1.725 -6.177 -3.593 1.00 1.00 C ATOM 47 C6 DG A 2 -0.538 -5.633 -3.035 1.00 1.00 C ATOM 48 O6 DG A 2 -0.189 -5.616 -1.846 1.00 1.00 O ATOM 49 N1 DG A 2 0.279 -5.056 -4.003 1.00 1.00 N ATOM 50 C2 DG A 2 -0.023 -5.016 -5.348 1.00 1.00 C ATOM 51 N2 DG A 2 0.870 -4.419 -6.149 1.00 1.00 N ATOM 52 N3 DG A 2 -1.125 -5.518 -5.879 1.00 1.00 N ATOM 53 C4 DG A 2 -1.925 -6.080 -4.952 1.00 1.00 C ATOM 0 H5' DG A 2 -7.252 -5.229 -6.771 1.00 1.00 H new ATOM 0 H5'' DG A 2 -7.829 -6.390 -7.950 1.00 1.00 H new ATOM 0 H4' DG A 2 -5.700 -5.865 -8.608 1.00 1.00 H new ATOM 0 H3' DG A 2 -6.126 -8.540 -8.085 1.00 1.00 H new ATOM 0 H2' DG A 2 -5.058 -8.491 -5.862 1.00 1.00 H new ATOM 0 H2'' DG A 2 -3.754 -9.017 -6.907 1.00 1.00 H new ATOM 0 H1' DG A 2 -2.905 -6.820 -7.195 1.00 1.00 H new ATOM 0 H8 DG A 2 -4.537 -7.629 -3.841 1.00 1.00 H new ATOM 0 H1 DG A 2 1.157 -4.636 -3.698 1.00 1.00 H new ATOM 0 H21 DG A 2 0.697 -4.361 -7.153 1.00 1.00 H new ATOM 0 H22 DG A 2 1.723 -4.022 -5.755 1.00 1.00 H new HETATM 65 P AZW A 3 -4.486 -9.235 -10.036 1.00 1.00 P HETATM 66 OP1 AZW A 3 -5.374 -8.995 -11.198 1.00 1.00 O HETATM 67 OP2 AZW A 3 -4.738 -10.397 -9.150 1.00 1.00 O HETATM 68 O5' AZW A 3 -2.985 -9.331 -10.555 1.00 1.00 O HETATM 69 C5' AZW A 3 -2.263 -8.161 -10.934 1.00 1.00 C HETATM 70 C1A AZW A 3 -1.089 -7.946 -10.003 1.00 1.00 C HETATM 71 C2A AZW A 3 -0.019 -7.143 -10.418 1.00 1.00 C HETATM 72 C6A AZW A 3 -1.067 -8.532 -8.727 1.00 1.00 C HETATM 73 C3A AZW A 3 1.067 -6.922 -9.564 1.00 1.00 C HETATM 74 C5A AZW A 3 0.022 -8.310 -7.874 1.00 1.00 C HETATM 75 C4A AZW A 3 1.089 -7.501 -8.292 1.00 1.00 C HETATM 76 N5A AZW A 3 2.174 -7.241 -7.422 1.00 1.00 N HETATM 77 C1B AZW A 3 6.319 -7.181 -4.583 1.00 1.00 C HETATM 78 C2B AZW A 3 6.571 -7.558 -5.912 1.00 1.00 C HETATM 79 C6B AZW A 3 5.001 -7.130 -4.112 1.00 1.00 C HETATM 80 C3B AZW A 3 5.504 -7.876 -6.764 1.00 1.00 C HETATM 81 C5B AZW A 3 3.936 -7.448 -4.963 1.00 1.00 C HETATM 82 C4B AZW A 3 4.186 -7.818 -6.290 1.00 1.00 C HETATM 83 N5B AZW A 3 3.110 -8.105 -7.157 1.00 1.00 N HETATM 84 C3' AZW A 3 7.461 -6.804 -3.660 1.00 1.00 C HETATM 85 O3' AZW A 3 8.695 -7.347 -4.119 1.00 1.00 O ATOM 98 P DG A 4 9.845 -6.377 -4.681 1.00 1.00 P ATOM 99 OP1 DG A 4 10.753 -7.196 -5.517 1.00 1.00 O ATOM 100 OP2 DG A 4 10.399 -5.620 -3.533 1.00 1.00 O ATOM 101 O5' DG A 4 9.075 -5.358 -5.631 1.00 1.00 O ATOM 102 C5' DG A 4 9.497 -3.999 -5.742 1.00 1.00 C ATOM 103 C4' DG A 4 8.803 -3.339 -6.911 1.00 1.00 C ATOM 104 O4' DG A 4 7.411 -3.736 -6.911 1.00 1.00 O ATOM 105 C3' DG A 4 8.786 -1.811 -6.890 1.00 1.00 C ATOM 106 O3' DG A 4 8.744 -1.314 -8.233 1.00 1.00 O ATOM 107 C2' DG A 4 7.489 -1.514 -6.158 1.00 1.00 C ATOM 108 C1' DG A 4 6.585 -2.595 -6.719 1.00 1.00 C ATOM 109 N9 DG A 4 5.457 -2.993 -5.880 1.00 1.00 N ATOM 110 C8 DG A 4 4.170 -3.192 -6.308 1.00 1.00 C ATOM 111 N7 DG A 4 3.364 -3.586 -5.362 1.00 1.00 N ATOM 112 C5 DG A 4 4.168 -3.648 -4.235 1.00 1.00 C ATOM 113 C6 DG A 4 3.839 -4.012 -2.908 1.00 1.00 C ATOM 114 O6 DG A 4 2.737 -4.363 -2.466 1.00 1.00 O ATOM 115 N1 DG A 4 4.937 -3.943 -2.058 1.00 1.00 N ATOM 116 C2 DG A 4 6.198 -3.566 -2.454 1.00 1.00 C ATOM 117 N2 DG A 4 7.141 -3.560 -1.501 1.00 1.00 N ATOM 118 N3 DG A 4 6.521 -3.222 -3.691 1.00 1.00 N ATOM 119 C4 DG A 4 5.463 -3.283 -4.529 1.00 1.00 C ATOM 0 H5' DG A 4 10.578 -3.955 -5.877 1.00 1.00 H new ATOM 0 H5'' DG A 4 9.268 -3.462 -4.822 1.00 1.00 H new ATOM 0 H4' DG A 4 9.372 -3.659 -7.784 1.00 1.00 H new ATOM 0 H3' DG A 4 9.658 -1.354 -6.421 1.00 1.00 H new ATOM 0 H2' DG A 4 7.600 -1.589 -5.076 1.00 1.00 H new ATOM 0 H2'' DG A 4 7.115 -0.512 -6.371 1.00 1.00 H new ATOM 0 H1' DG A 4 6.132 -2.190 -7.624 1.00 1.00 H new ATOM 0 H8 DG A 4 3.854 -3.037 -7.329 1.00 1.00 H new ATOM 0 H1 DG A 4 4.798 -4.188 -1.078 1.00 1.00 H new ATOM 0 H21 DG A 4 8.097 -3.290 -1.731 1.00 1.00 H new ATOM 0 H22 DG A 4 6.902 -3.826 -0.546 1.00 1.00 H new ATOM 131 P DG A 5 8.784 0.263 -8.528 1.00 1.00 P ATOM 132 OP1 DG A 5 9.303 0.456 -9.904 1.00 1.00 O ATOM 133 OP2 DG A 5 9.480 0.913 -7.393 1.00 1.00 O ATOM 134 O5' DG A 5 7.255 0.701 -8.499 1.00 1.00 O ATOM 135 C5' DG A 5 6.372 0.319 -9.554 1.00 1.00 C ATOM 136 C4' DG A 5 4.941 0.656 -9.202 1.00 1.00 C ATOM 137 O4' DG A 5 4.573 -0.012 -7.972 1.00 1.00 O ATOM 138 C3' DG A 5 4.666 2.144 -8.962 1.00 1.00 C ATOM 139 O3' DG A 5 3.728 2.648 -9.921 1.00 1.00 O ATOM 140 C2' DG A 5 4.073 2.204 -7.564 1.00 1.00 C ATOM 141 C1' DG A 5 3.591 0.784 -7.344 1.00 1.00 C ATOM 142 N9 DG A 5 3.461 0.375 -5.948 1.00 1.00 N ATOM 143 C8 DG A 5 4.394 0.506 -4.948 1.00 1.00 C ATOM 144 N7 DG A 5 3.976 0.066 -3.791 1.00 1.00 N ATOM 145 C5 DG A 5 2.686 -0.383 -4.042 1.00 1.00 C ATOM 146 C6 DG A 5 1.728 -0.967 -3.169 1.00 1.00 C ATOM 147 O6 DG A 5 1.829 -1.191 -1.952 1.00 1.00 O ATOM 148 N1 DG A 5 0.543 -1.281 -3.829 1.00 1.00 N ATOM 149 C2 DG A 5 0.315 -1.053 -5.166 1.00 1.00 C ATOM 150 N2 DG A 5 -0.889 -1.417 -5.637 1.00 1.00 N ATOM 151 N3 DG A 5 1.196 -0.510 -5.988 1.00 1.00 N ATOM 152 C4 DG A 5 2.353 -0.200 -5.366 1.00 1.00 C ATOM 0 H5' DG A 5 6.463 -0.751 -9.742 1.00 1.00 H new ATOM 0 H5'' DG A 5 6.655 0.829 -10.475 1.00 1.00 H new ATOM 0 H4' DG A 5 4.366 0.334 -10.070 1.00 1.00 H new ATOM 0 H3' DG A 5 5.568 2.748 -9.060 1.00 1.00 H new ATOM 0 H2' DG A 5 4.815 2.499 -6.822 1.00 1.00 H new ATOM 0 H2'' DG A 5 3.256 2.923 -7.501 1.00 1.00 H new ATOM 0 HO3' DG A 5 3.564 3.599 -9.750 1.00 1.00 H new ATOM 0 H1' DG A 5 2.582 0.683 -7.743 1.00 1.00 H new ATOM 0 H8 DG A 5 5.375 0.930 -5.103 1.00 1.00 H new ATOM 0 H1 DG A 5 -0.206 -1.709 -3.285 1.00 1.00 H new ATOM 0 H21 DG A 5 -1.117 -1.273 -6.621 1.00 1.00 H new ATOM 0 H22 DG A 5 -1.576 -1.838 -5.011 1.00 1.00 H new TER 165 DG A 5 ATOM 166 O5' DG B 1 7.420 2.507 1.407 1.00 1.00 O ATOM 167 C5' DG B 1 8.751 2.070 1.685 1.00 1.00 C ATOM 168 C4' DG B 1 8.813 1.358 3.015 1.00 1.00 C ATOM 169 O4' DG B 1 7.466 0.994 3.404 1.00 1.00 O ATOM 170 C3' DG B 1 9.617 0.057 3.010 1.00 1.00 C ATOM 171 O3' DG B 1 10.286 -0.109 4.265 1.00 1.00 O ATOM 172 C2' DG B 1 8.544 -1.001 2.826 1.00 1.00 C ATOM 173 C1' DG B 1 7.397 -0.408 3.620 1.00 1.00 C ATOM 174 N9 DG B 1 6.066 -0.867 3.235 1.00 1.00 N ATOM 175 C8 DG B 1 5.132 -1.446 4.061 1.00 1.00 C ATOM 176 N7 DG B 1 4.011 -1.730 3.457 1.00 1.00 N ATOM 177 C5 DG B 1 4.216 -1.316 2.148 1.00 1.00 C ATOM 178 C6 DG B 1 3.348 -1.372 1.030 1.00 1.00 C ATOM 179 O6 DG B 1 2.180 -1.786 0.987 1.00 1.00 O ATOM 180 N1 DG B 1 3.940 -0.854 -0.116 1.00 1.00 N ATOM 181 C2 DG B 1 5.217 -0.340 -0.166 1.00 1.00 C ATOM 182 N2 DG B 1 5.625 0.136 -1.351 1.00 1.00 N ATOM 183 N3 DG B 1 6.037 -0.280 0.870 1.00 1.00 N ATOM 184 C4 DG B 1 5.478 -0.783 1.992 1.00 1.00 C ATOM 0 H5' DG B 1 9.426 2.926 1.694 1.00 1.00 H new ATOM 0 H5'' DG B 1 9.093 1.403 0.894 1.00 1.00 H new ATOM 0 H4' DG B 1 9.305 2.054 3.695 1.00 1.00 H new ATOM 0 H3' DG B 1 10.391 0.019 2.243 1.00 1.00 H new ATOM 0 H2' DG B 1 8.286 -1.145 1.777 1.00 1.00 H new ATOM 0 H2'' DG B 1 8.854 -1.971 3.214 1.00 1.00 H new ATOM 0 HO5' DG B 1 6.802 2.104 2.052 1.00 1.00 H new ATOM 0 H1' DG B 1 7.515 -0.719 4.658 1.00 1.00 H new ATOM 0 H8 DG B 1 5.309 -1.646 5.107 1.00 1.00 H new ATOM 0 H1 DG B 1 3.393 -0.855 -0.977 1.00 1.00 H new ATOM 0 H21 DG B 1 6.561 0.529 -1.448 1.00 1.00 H new ATOM 0 H22 DG B 1 4.999 0.105 -2.156 1.00 1.00 H new ATOM 197 P DG B 2 11.463 -1.190 4.427 1.00 1.00 P ATOM 198 OP1 DG B 2 12.347 -0.700 5.510 1.00 1.00 O ATOM 199 OP2 DG B 2 12.037 -1.477 3.092 1.00 1.00 O ATOM 200 O5' DG B 2 10.715 -2.498 4.940 1.00 1.00 O ATOM 201 C5' DG B 2 9.951 -2.484 6.146 1.00 1.00 C ATOM 202 C4' DG B 2 9.174 -3.773 6.288 1.00 1.00 C ATOM 203 O4' DG B 2 7.998 -3.713 5.441 1.00 1.00 O ATOM 204 C3' DG B 2 9.935 -5.034 5.863 1.00 1.00 C ATOM 205 O3' DG B 2 9.689 -6.097 6.793 1.00 1.00 O ATOM 206 C2' DG B 2 9.331 -5.361 4.510 1.00 1.00 C ATOM 207 C1' DG B 2 7.896 -4.933 4.729 1.00 1.00 C ATOM 208 N9 DG B 2 7.112 -4.717 3.515 1.00 1.00 N ATOM 209 C8 DG B 2 7.560 -4.272 2.294 1.00 1.00 C ATOM 210 N7 DG B 2 6.629 -4.245 1.379 1.00 1.00 N ATOM 211 C5 DG B 2 5.493 -4.698 2.037 1.00 1.00 C ATOM 212 C6 DG B 2 4.170 -4.884 1.560 1.00 1.00 C ATOM 213 O6 DG B 2 3.727 -4.673 0.422 1.00 1.00 O ATOM 214 N1 DG B 2 3.318 -5.361 2.552 1.00 1.00 N ATOM 215 C2 DG B 2 3.707 -5.620 3.849 1.00 1.00 C ATOM 216 N2 DG B 2 2.760 -6.071 4.684 1.00 1.00 N ATOM 217 N3 DG B 2 4.937 -5.450 4.307 1.00 1.00 N ATOM 218 C4 DG B 2 5.774 -4.990 3.355 1.00 1.00 C ATOM 0 H5' DG B 2 9.265 -1.637 6.141 1.00 1.00 H new ATOM 0 H5'' DG B 2 10.613 -2.354 7.002 1.00 1.00 H new ATOM 0 H4' DG B 2 8.952 -3.853 7.352 1.00 1.00 H new ATOM 0 H3' DG B 2 11.016 -4.898 5.828 1.00 1.00 H new ATOM 0 H2' DG B 2 9.808 -4.809 3.700 1.00 1.00 H new ATOM 0 H2'' DG B 2 9.414 -6.420 4.266 1.00 1.00 H new ATOM 0 H1' DG B 2 7.365 -5.731 5.248 1.00 1.00 H new ATOM 0 H8 DG B 2 8.582 -3.974 2.110 1.00 1.00 H new ATOM 0 H1 DG B 2 2.343 -5.530 2.303 1.00 1.00 H new ATOM 0 H21 DG B 2 2.993 -6.279 5.655 1.00 1.00 H new ATOM 0 H22 DG B 2 1.806 -6.206 4.348 1.00 1.00 H new HETATM 230 P AZW B 3 10.596 -7.423 6.760 1.00 1.00 P HETATM 231 OP1 AZW B 3 11.022 -7.722 8.147 1.00 1.00 O HETATM 232 OP2 AZW B 3 11.621 -7.249 5.704 1.00 1.00 O HETATM 233 O5' AZW B 3 9.594 -8.566 6.285 1.00 1.00 O HETATM 234 C5' AZW B 3 8.504 -8.967 7.110 1.00 1.00 C HETATM 235 C1A AZW B 3 7.249 -9.118 6.277 1.00 1.00 C HETATM 236 C2A AZW B 3 6.124 -9.747 6.826 1.00 1.00 C HETATM 237 C6A AZW B 3 7.196 -8.616 4.964 1.00 1.00 C HETATM 238 C3A AZW B 3 4.952 -9.871 6.074 1.00 1.00 C HETATM 239 C5A AZW B 3 6.023 -8.741 4.214 1.00 1.00 C HETATM 240 C4A AZW B 3 4.901 -9.369 4.768 1.00 1.00 C HETATM 241 N5A AZW B 3 3.714 -9.479 4.021 1.00 1.00 N HETATM 242 C1B AZW B 3 -0.149 -10.775 1.076 1.00 1.00 C HETATM 243 C2B AZW B 3 -0.190 -10.650 2.470 1.00 1.00 C HETATM 244 C6B AZW B 3 1.085 -10.817 0.415 1.00 1.00 C HETATM 245 C3B AZW B 3 0.998 -10.568 3.203 1.00 1.00 C HETATM 246 C5B AZW B 3 2.277 -10.734 1.150 1.00 1.00 C HETATM 247 C4B AZW B 3 2.232 -10.607 2.544 1.00 1.00 C HETATM 248 N5B AZW B 3 3.427 -10.511 3.286 1.00 1.00 N HETATM 249 C3' AZW B 3 -1.435 -10.848 0.282 1.00 1.00 C HETATM 250 O3' AZW B 3 -2.058 -12.115 0.447 1.00 1.00 O ATOM 263 P DG B 4 -3.529 -12.212 1.085 1.00 1.00 P ATOM 264 OP1 DG B 4 -3.816 -13.645 1.319 1.00 1.00 O ATOM 265 OP2 DG B 4 -4.438 -11.411 0.228 1.00 1.00 O ATOM 266 O5' DG B 4 -3.406 -11.487 2.496 1.00 1.00 O ATOM 267 C5' DG B 4 -4.527 -10.819 3.076 1.00 1.00 C ATOM 268 C4' DG B 4 -4.244 -10.485 4.522 1.00 1.00 C ATOM 269 O4' DG B 4 -2.884 -10.003 4.644 1.00 1.00 O ATOM 270 C3' DG B 4 -5.114 -9.377 5.113 1.00 1.00 C ATOM 271 O3' DG B 4 -5.260 -9.574 6.526 1.00 1.00 O ATOM 272 C2' DG B 4 -4.297 -8.133 4.819 1.00 1.00 C ATOM 273 C1' DG B 4 -2.888 -8.644 5.058 1.00 1.00 C ATOM 274 N9 DG B 4 -1.829 -7.946 4.334 1.00 1.00 N ATOM 275 C8 DG B 4 -0.645 -7.509 4.870 1.00 1.00 C ATOM 276 N7 DG B 4 0.142 -6.943 3.998 1.00 1.00 N ATOM 277 C5 DG B 4 -0.569 -7.008 2.809 1.00 1.00 C ATOM 278 C6 DG B 4 -0.215 -6.549 1.516 1.00 1.00 C ATOM 279 O6 DG B 4 0.830 -5.986 1.166 1.00 1.00 O ATOM 280 N1 DG B 4 -1.212 -6.804 0.580 1.00 1.00 N ATOM 281 C2 DG B 4 -2.405 -7.428 0.869 1.00 1.00 C ATOM 282 N2 DG B 4 -3.256 -7.591 -0.159 1.00 1.00 N ATOM 283 N3 DG B 4 -2.746 -7.861 2.072 1.00 1.00 N ATOM 284 C4 DG B 4 -1.788 -7.621 2.994 1.00 1.00 C ATOM 0 H5' DG B 4 -5.412 -11.452 3.008 1.00 1.00 H new ATOM 0 H5'' DG B 4 -4.744 -9.907 2.520 1.00 1.00 H new ATOM 0 H4' DG B 4 -4.446 -11.411 5.060 1.00 1.00 H new ATOM 0 H3' DG B 4 -6.125 -9.334 4.707 1.00 1.00 H new ATOM 0 H2' DG B 4 -4.439 -7.779 3.798 1.00 1.00 H new ATOM 0 H2'' DG B 4 -4.553 -7.306 5.481 1.00 1.00 H new ATOM 0 H1' DG B 4 -2.664 -8.485 6.113 1.00 1.00 H new ATOM 0 H8 DG B 4 -0.389 -7.623 5.913 1.00 1.00 H new ATOM 0 H1 DG B 4 -1.049 -6.510 -0.383 1.00 1.00 H new ATOM 0 H21 DG B 4 -4.156 -8.046 -0.009 1.00 1.00 H new ATOM 0 H22 DG B 4 -3.001 -7.259 -1.089 1.00 1.00 H new ATOM 296 P DG B 5 -6.348 -8.742 7.365 1.00 1.00 P ATOM 297 OP1 DG B 5 -6.546 -9.456 8.649 1.00 1.00 O ATOM 298 OP2 DG B 5 -7.518 -8.489 6.494 1.00 1.00 O ATOM 299 O5' DG B 5 -5.631 -7.353 7.669 1.00 1.00 O ATOM 300 C5' DG B 5 -4.430 -7.312 8.441 1.00 1.00 C ATOM 301 C4' DG B 5 -3.806 -5.935 8.411 1.00 1.00 C ATOM 302 O4' DG B 5 -2.863 -5.836 7.324 1.00 1.00 O ATOM 303 C3' DG B 5 -4.740 -4.759 8.142 1.00 1.00 C ATOM 304 O3' DG B 5 -5.479 -4.391 9.313 1.00 1.00 O ATOM 305 C2' DG B 5 -3.753 -3.673 7.745 1.00 1.00 C ATOM 306 C1' DG B 5 -2.578 -4.451 7.147 1.00 1.00 C ATOM 307 N9 DG B 5 -2.352 -4.193 5.727 1.00 1.00 N ATOM 308 C8 DG B 5 -3.260 -4.319 4.703 1.00 1.00 C ATOM 309 N7 DG B 5 -2.778 -3.967 3.541 1.00 1.00 N ATOM 310 C5 DG B 5 -1.471 -3.583 3.815 1.00 1.00 C ATOM 311 C6 DG B 5 -0.454 -3.101 2.948 1.00 1.00 C ATOM 312 O6 DG B 5 -0.515 -2.899 1.723 1.00 1.00 O ATOM 313 N1 DG B 5 0.729 -2.828 3.632 1.00 1.00 N ATOM 314 C2 DG B 5 0.898 -3.001 4.988 1.00 1.00 C ATOM 315 N2 DG B 5 2.106 -2.686 5.483 1.00 1.00 N ATOM 316 N3 DG B 5 -0.041 -3.448 5.805 1.00 1.00 N ATOM 317 C4 DG B 5 -1.194 -3.718 5.158 1.00 1.00 C ATOM 0 H5' DG B 5 -3.721 -8.044 8.054 1.00 1.00 H new ATOM 0 H5'' DG B 5 -4.647 -7.593 9.471 1.00 1.00 H new ATOM 0 H4' DG B 5 -3.395 -5.856 9.418 1.00 1.00 H new ATOM 0 H3' DG B 5 -5.504 -4.964 7.392 1.00 1.00 H new ATOM 0 H2' DG B 5 -4.187 -2.983 7.021 1.00 1.00 H new ATOM 0 H2'' DG B 5 -3.444 -3.079 8.605 1.00 1.00 H new ATOM 0 HO3' DG B 5 -6.066 -3.634 9.105 1.00 1.00 H new ATOM 0 H1' DG B 5 -1.670 -4.130 7.658 1.00 1.00 H new ATOM 0 H8 DG B 5 -4.270 -4.673 4.845 1.00 1.00 H new ATOM 0 H1 DG B 5 1.521 -2.477 3.094 1.00 1.00 H new ATOM 0 H21 DG B 5 2.292 -2.793 6.480 1.00 1.00 H new ATOM 0 H22 DG B 5 2.837 -2.340 4.862 1.00 1.00 H new TER 330 DG B 5 ATOM 331 O5' DG C 1 7.073 2.611 -2.736 1.00 1.00 O ATOM 332 C5' DG C 1 7.481 3.913 -3.161 1.00 1.00 C ATOM 333 C4' DG C 1 6.794 4.290 -4.452 1.00 1.00 C ATOM 334 O4' DG C 1 5.566 3.527 -4.555 1.00 1.00 O ATOM 335 C3' DG C 1 6.386 5.760 -4.576 1.00 1.00 C ATOM 336 O3' DG C 1 6.544 6.198 -5.933 1.00 1.00 O ATOM 337 C2' DG C 1 4.922 5.746 -4.174 1.00 1.00 C ATOM 338 C1' DG C 1 4.463 4.406 -4.712 1.00 1.00 C ATOM 339 N9 DG C 1 3.308 3.830 -4.030 1.00 1.00 N ATOM 340 C8 DG C 1 2.112 3.477 -4.607 1.00 1.00 C ATOM 341 N7 DG C 1 1.255 2.978 -3.761 1.00 1.00 N ATOM 342 C5 DG C 1 1.924 3.003 -2.544 1.00 1.00 C ATOM 343 C6 DG C 1 1.494 2.587 -1.259 1.00 1.00 C ATOM 344 O6 DG C 1 0.408 2.077 -0.942 1.00 1.00 O ATOM 345 N1 DG C 1 2.474 2.786 -0.290 1.00 1.00 N ATOM 346 C2 DG C 1 3.721 3.317 -0.545 1.00 1.00 C ATOM 347 N2 DG C 1 4.554 3.419 0.501 1.00 1.00 N ATOM 348 N3 DG C 1 4.133 3.708 -1.741 1.00 1.00 N ATOM 349 C4 DG C 1 3.191 3.525 -2.691 1.00 1.00 C ATOM 0 H5' DG C 1 8.562 3.935 -3.298 1.00 1.00 H new ATOM 0 H5'' DG C 1 7.243 4.645 -2.389 1.00 1.00 H new ATOM 0 H4' DG C 1 7.526 4.085 -5.233 1.00 1.00 H new ATOM 0 H3' DG C 1 6.984 6.436 -3.965 1.00 1.00 H new ATOM 0 H2' DG C 1 4.794 5.818 -3.094 1.00 1.00 H new ATOM 0 H2'' DG C 1 4.369 6.575 -4.616 1.00 1.00 H new ATOM 0 HO5' DG C 1 6.271 2.342 -3.231 1.00 1.00 H new ATOM 0 H1' DG C 1 4.143 4.549 -5.744 1.00 1.00 H new ATOM 0 H8 DG C 1 1.902 3.601 -5.659 1.00 1.00 H new ATOM 0 H1 DG C 1 2.255 2.522 0.671 1.00 1.00 H new ATOM 0 H21 DG C 1 5.490 3.804 0.372 1.00 1.00 H new ATOM 0 H22 DG C 1 4.252 3.111 1.425 1.00 1.00 H new ATOM 362 P DG C 2 6.396 7.753 -6.316 1.00 1.00 P ATOM 363 OP1 DG C 2 7.153 7.995 -7.568 1.00 1.00 O ATOM 364 OP2 DG C 2 6.717 8.547 -5.104 1.00 1.00 O ATOM 365 O5' DG C 2 4.848 7.928 -6.637 1.00 1.00 O ATOM 366 C5' DG C 2 4.248 7.207 -7.713 1.00 1.00 C ATOM 367 C4' DG C 2 2.755 7.438 -7.730 1.00 1.00 C ATOM 368 O4' DG C 2 2.145 6.707 -6.637 1.00 1.00 O ATOM 369 C3' DG C 2 2.327 8.897 -7.549 1.00 1.00 C ATOM 370 O3' DG C 2 1.247 9.197 -8.441 1.00 1.00 O ATOM 371 C2' DG C 2 1.875 8.939 -6.101 1.00 1.00 C ATOM 372 C1' DG C 2 1.247 7.569 -5.962 1.00 1.00 C ATOM 373 N9 DG C 2 1.075 7.101 -4.591 1.00 1.00 N ATOM 374 C8 DG C 2 1.932 7.278 -3.530 1.00 1.00 C ATOM 375 N7 DG C 2 1.484 6.771 -2.414 1.00 1.00 N ATOM 376 C5 DG C 2 0.256 6.224 -2.758 1.00 1.00 C ATOM 377 C6 DG C 2 -0.694 5.539 -1.960 1.00 1.00 C ATOM 378 O6 DG C 2 -0.624 5.264 -0.753 1.00 1.00 O ATOM 379 N1 DG C 2 -1.811 5.152 -2.696 1.00 1.00 N ATOM 380 C2 DG C 2 -1.977 5.397 -4.041 1.00 1.00 C ATOM 381 N2 DG C 2 -3.113 4.947 -4.597 1.00 1.00 N ATOM 382 N3 DG C 2 -1.097 6.035 -4.796 1.00 1.00 N ATOM 383 C4 DG C 2 -0.011 6.419 -4.095 1.00 1.00 C ATOM 0 H5' DG C 2 4.457 6.142 -7.608 1.00 1.00 H new ATOM 0 H5'' DG C 2 4.683 7.525 -8.660 1.00 1.00 H new ATOM 0 H4' DG C 2 2.433 7.108 -8.718 1.00 1.00 H new ATOM 0 H3' DG C 2 3.111 9.623 -7.765 1.00 1.00 H new ATOM 0 H2' DG C 2 2.707 9.084 -5.412 1.00 1.00 H new ATOM 0 H2'' DG C 2 1.162 9.742 -5.913 1.00 1.00 H new ATOM 0 H1' DG C 2 0.235 7.595 -6.366 1.00 1.00 H new ATOM 0 H8 DG C 2 2.881 7.786 -3.612 1.00 1.00 H new ATOM 0 H1 DG C 2 -2.555 4.654 -2.207 1.00 1.00 H new ATOM 0 H21 DG C 2 -3.290 5.100 -5.590 1.00 1.00 H new ATOM 0 H22 DG C 2 -3.799 4.452 -4.027 1.00 1.00 H new HETATM 395 P AZW C 3 0.554 10.645 -8.431 1.00 1.00 P HETATM 396 OP1 AZW C 3 0.021 10.908 -9.789 1.00 1.00 O HETATM 397 OP2 AZW C 3 1.510 11.604 -7.821 1.00 1.00 O HETATM 398 O5' AZW C 3 -0.674 10.472 -7.435 1.00 1.00 O HETATM 399 C5' AZW C 3 -1.869 9.822 -7.858 1.00 1.00 C HETATM 400 C1A AZW C 3 -2.678 9.404 -6.652 1.00 1.00 C HETATM 401 C2A AZW C 3 -3.518 8.282 -6.732 1.00 1.00 C HETATM 402 C6A AZW C 3 -2.607 10.144 -5.463 1.00 1.00 C HETATM 403 C3A AZW C 3 -4.284 7.903 -5.625 1.00 1.00 C HETATM 404 C5A AZW C 3 -3.378 9.764 -4.355 1.00 1.00 C HETATM 405 C4A AZW C 3 -4.215 8.645 -4.435 1.00 1.00 C HETATM 406 N5A AZW C 3 -5.000 8.264 -3.324 1.00 1.00 N HETATM 407 C1B AZW C 3 -8.692 6.886 -0.141 1.00 1.00 C HETATM 408 C2B AZW C 3 -9.205 7.764 -1.115 1.00 1.00 C HETATM 409 C6B AZW C 3 -7.377 6.422 -0.251 1.00 1.00 C HETATM 410 C3B AZW C 3 -8.401 8.166 -2.188 1.00 1.00 C HETATM 411 C5B AZW C 3 -6.574 6.825 -1.326 1.00 1.00 C HETATM 412 C4B AZW C 3 -7.086 7.696 -2.298 1.00 1.00 C HETATM 413 N5B AZW C 3 -6.287 8.085 -3.399 1.00 1.00 N HETATM 414 C3' AZW C 3 -9.552 6.425 1.020 1.00 1.00 C HETATM 415 O3' AZW C 3 -10.904 6.843 0.865 1.00 1.00 O ATOM 428 P DG C 4 -11.936 5.959 0.007 1.00 1.00 P ATOM 429 OP1 DG C 4 -12.732 6.902 -0.810 1.00 1.00 O ATOM 430 OP2 DG C 4 -12.638 5.036 0.931 1.00 1.00 O ATOM 431 O5' DG C 4 -11.014 5.106 -0.970 1.00 1.00 O ATOM 432 C5' DG C 4 -11.326 3.747 -1.279 1.00 1.00 C ATOM 433 C4' DG C 4 -10.959 3.452 -2.716 1.00 1.00 C ATOM 434 O4' DG C 4 -9.640 3.989 -2.982 1.00 1.00 O ATOM 435 C3' DG C 4 -10.883 1.968 -3.085 1.00 1.00 C ATOM 436 O3' DG C 4 -11.276 1.792 -4.452 1.00 1.00 O ATOM 437 C2' DG C 4 -9.407 1.667 -2.900 1.00 1.00 C ATOM 438 C1' DG C 4 -8.794 2.945 -3.439 1.00 1.00 C ATOM 439 N9 DG C 4 -7.428 3.235 -3.009 1.00 1.00 N ATOM 440 C8 DG C 4 -6.401 3.647 -3.823 1.00 1.00 C ATOM 441 N7 DG C 4 -5.289 3.872 -3.180 1.00 1.00 N ATOM 442 C5 DG C 4 -5.597 3.591 -1.857 1.00 1.00 C ATOM 443 C6 DG C 4 -4.781 3.656 -0.699 1.00 1.00 C ATOM 444 O6 DG C 4 -3.591 3.994 -0.623 1.00 1.00 O ATOM 445 N1 DG C 4 -5.472 3.288 0.451 1.00 1.00 N ATOM 446 C2 DG C 4 -6.793 2.903 0.471 1.00 1.00 C ATOM 447 N2 DG C 4 -7.300 2.568 1.670 1.00 1.00 N ATOM 448 N3 DG C 4 -7.567 2.840 -0.602 1.00 1.00 N ATOM 449 C4 DG C 4 -6.911 3.194 -1.729 1.00 1.00 C ATOM 0 H5' DG C 4 -12.389 3.563 -1.120 1.00 1.00 H new ATOM 0 H5'' DG C 4 -10.783 3.079 -0.611 1.00 1.00 H new ATOM 0 H4' DG C 4 -11.760 3.902 -3.303 1.00 1.00 H new ATOM 0 H3' DG C 4 -11.531 1.320 -2.495 1.00 1.00 H new ATOM 0 H2' DG C 4 -9.148 1.491 -1.856 1.00 1.00 H new ATOM 0 H2'' DG C 4 -9.090 0.787 -3.460 1.00 1.00 H new ATOM 0 H1' DG C 4 -8.721 2.843 -4.522 1.00 1.00 H new ATOM 0 H8 DG C 4 -6.504 3.772 -4.891 1.00 1.00 H new ATOM 0 H1 DG C 4 -4.967 3.305 1.337 1.00 1.00 H new ATOM 0 H21 DG C 4 -8.274 2.274 1.748 1.00 1.00 H new ATOM 0 H22 DG C 4 -6.711 2.608 2.502 1.00 1.00 H new ATOM 461 P DG C 5 -11.277 0.342 -5.147 1.00 1.00 P ATOM 462 OP1 DG C 5 -12.215 0.402 -6.293 1.00 1.00 O ATOM 463 OP2 DG C 5 -11.491 -0.679 -4.092 1.00 1.00 O ATOM 464 O5' DG C 5 -9.804 0.178 -5.727 1.00 1.00 O ATOM 465 C5' DG C 5 -9.388 0.942 -6.859 1.00 1.00 C ATOM 466 C4' DG C 5 -7.901 0.802 -7.088 1.00 1.00 C ATOM 467 O4' DG C 5 -7.184 1.131 -5.875 1.00 1.00 O ATOM 468 C3' DG C 5 -7.432 -0.603 -7.480 1.00 1.00 C ATOM 469 O3' DG C 5 -6.734 -0.570 -8.728 1.00 1.00 O ATOM 470 C2' DG C 5 -6.485 -1.005 -6.360 1.00 1.00 C ATOM 471 C1' DG C 5 -6.012 0.343 -5.866 1.00 1.00 C ATOM 472 N9 DG C 5 -5.424 0.352 -4.529 1.00 1.00 N ATOM 473 C8 DG C 5 -5.999 -0.076 -3.357 1.00 1.00 C ATOM 474 N7 DG C 5 -5.213 0.056 -2.321 1.00 1.00 N ATOM 475 C5 DG C 5 -4.050 0.606 -2.841 1.00 1.00 C ATOM 476 C6 DG C 5 -2.834 0.975 -2.199 1.00 1.00 C ATOM 477 O6 DG C 5 -2.535 0.880 -0.998 1.00 1.00 O ATOM 478 N1 DG C 5 -1.907 1.498 -3.096 1.00 1.00 N ATOM 479 C2 DG C 5 -2.130 1.641 -4.448 1.00 1.00 C ATOM 480 N2 DG C 5 -1.132 2.170 -5.171 1.00 1.00 N ATOM 481 N3 DG C 5 -3.253 1.300 -5.057 1.00 1.00 N ATOM 482 C4 DG C 5 -4.165 0.793 -4.201 1.00 1.00 C ATOM 0 H5' DG C 5 -9.639 1.992 -6.706 1.00 1.00 H new ATOM 0 H5'' DG C 5 -9.929 0.610 -7.745 1.00 1.00 H new ATOM 0 H4' DG C 5 -7.695 1.477 -7.918 1.00 1.00 H new ATOM 0 H3' DG C 5 -8.261 -1.299 -7.603 1.00 1.00 H new ATOM 0 H2' DG C 5 -6.991 -1.573 -5.579 1.00 1.00 H new ATOM 0 H2'' DG C 5 -5.662 -1.622 -6.721 1.00 1.00 H new ATOM 0 HO3' DG C 5 -6.440 -1.475 -8.962 1.00 1.00 H new ATOM 0 H1' DG C 5 -5.203 0.701 -6.502 1.00 1.00 H new ATOM 0 H8 DG C 5 -6.999 -0.480 -3.298 1.00 1.00 H new ATOM 0 H1 DG C 5 -1.003 1.795 -2.728 1.00 1.00 H new ATOM 0 H21 DG C 5 -1.243 2.298 -6.177 1.00 1.00 H new ATOM 0 H22 DG C 5 -0.262 2.444 -4.715 1.00 1.00 H new TER 495 DG C 5 ATOM 496 O5' DG D 1 -6.830 -3.728 3.206 1.00 1.00 O ATOM 497 C5' DG D 1 -7.977 -3.541 4.033 1.00 1.00 C ATOM 498 C4' DG D 1 -7.570 -3.073 5.408 1.00 1.00 C ATOM 499 O4' DG D 1 -6.161 -2.731 5.374 1.00 1.00 O ATOM 500 C3' DG D 1 -8.299 -1.823 5.898 1.00 1.00 C ATOM 501 O3' DG D 1 -8.532 -1.911 7.307 1.00 1.00 O ATOM 502 C2' DG D 1 -7.320 -0.709 5.571 1.00 1.00 C ATOM 503 C1' DG D 1 -5.987 -1.393 5.810 1.00 1.00 C ATOM 504 N9 DG D 1 -4.843 -0.831 5.096 1.00 1.00 N ATOM 505 C8 DG D 1 -3.634 -0.484 5.648 1.00 1.00 C ATOM 506 N7 DG D 1 -2.775 -0.031 4.776 1.00 1.00 N ATOM 507 C5 DG D 1 -3.458 -0.082 3.570 1.00 1.00 C ATOM 508 C6 DG D 1 -3.033 0.283 2.270 1.00 1.00 C ATOM 509 O6 DG D 1 -1.926 0.718 1.917 1.00 1.00 O ATOM 510 N1 DG D 1 -4.029 0.085 1.320 1.00 1.00 N ATOM 511 C2 DG D 1 -5.281 -0.413 1.599 1.00 1.00 C ATOM 512 N2 DG D 1 -6.122 -0.525 0.561 1.00 1.00 N ATOM 513 N3 DG D 1 -5.690 -0.763 2.810 1.00 1.00 N ATOM 514 C4 DG D 1 -4.735 -0.571 3.746 1.00 1.00 C ATOM 0 H5' DG D 1 -8.532 -4.476 4.111 1.00 1.00 H new ATOM 0 H5'' DG D 1 -8.645 -2.810 3.577 1.00 1.00 H new ATOM 0 H4' DG D 1 -7.817 -3.892 6.084 1.00 1.00 H new ATOM 0 H3' DG D 1 -9.277 -1.674 5.440 1.00 1.00 H new ATOM 0 H2' DG D 1 -7.424 -0.361 4.543 1.00 1.00 H new ATOM 0 H2'' DG D 1 -7.457 0.159 6.216 1.00 1.00 H new ATOM 0 HO5' DG D 1 -6.043 -3.346 3.647 1.00 1.00 H new ATOM 0 H1' DG D 1 -5.745 -1.273 6.866 1.00 1.00 H new ATOM 0 H8 DG D 1 -3.415 -0.577 6.702 1.00 1.00 H new ATOM 0 H1 DG D 1 -3.817 0.325 0.352 1.00 1.00 H new ATOM 0 H21 DG D 1 -7.064 -0.888 0.705 1.00 1.00 H new ATOM 0 H22 DG D 1 -5.819 -0.247 -0.373 1.00 1.00 H new ATOM 527 P DG D 2 -9.417 -0.795 8.047 1.00 1.00 P ATOM 528 OP1 DG D 2 -9.987 -1.410 9.270 1.00 1.00 O ATOM 529 OP2 DG D 2 -10.321 -0.165 7.057 1.00 1.00 O ATOM 530 O5' DG D 2 -8.352 0.293 8.505 1.00 1.00 O ATOM 531 C5' DG D 2 -7.305 -0.043 9.411 1.00 1.00 C ATOM 532 C4' DG D 2 -6.394 1.147 9.591 1.00 1.00 C ATOM 533 O4' DG D 2 -5.596 1.314 8.390 1.00 1.00 O ATOM 534 C3' DG D 2 -7.126 2.476 9.795 1.00 1.00 C ATOM 535 O3' DG D 2 -6.455 3.249 10.796 1.00 1.00 O ATOM 536 C2' DG D 2 -7.027 3.134 8.430 1.00 1.00 C ATOM 537 C1' DG D 2 -5.656 2.672 7.991 1.00 1.00 C ATOM 538 N9 DG D 2 -5.403 2.767 6.556 1.00 1.00 N ATOM 539 C8 DG D 2 -6.298 2.585 5.529 1.00 1.00 C ATOM 540 N7 DG D 2 -5.783 2.807 4.350 1.00 1.00 N ATOM 541 C5 DG D 2 -4.465 3.154 4.614 1.00 1.00 C ATOM 542 C6 DG D 2 -3.415 3.504 3.728 1.00 1.00 C ATOM 543 O6 DG D 2 -3.444 3.562 2.489 1.00 1.00 O ATOM 544 N1 DG D 2 -2.231 3.788 4.407 1.00 1.00 N ATOM 545 C2 DG D 2 -2.091 3.732 5.776 1.00 1.00 C ATOM 546 N2 DG D 2 -0.879 4.015 6.271 1.00 1.00 N ATOM 547 N3 DG D 2 -3.062 3.405 6.611 1.00 1.00 N ATOM 548 C4 DG D 2 -4.215 3.131 5.967 1.00 1.00 C ATOM 0 H5' DG D 2 -6.739 -0.893 9.030 1.00 1.00 H new ATOM 0 H5'' DG D 2 -7.723 -0.343 10.372 1.00 1.00 H new ATOM 0 H4' DG D 2 -5.809 0.933 10.485 1.00 1.00 H new ATOM 0 H3' DG D 2 -8.156 2.369 10.134 1.00 1.00 H new ATOM 0 H2' DG D 2 -7.812 2.800 7.752 1.00 1.00 H new ATOM 0 H2'' DG D 2 -7.098 4.220 8.489 1.00 1.00 H new ATOM 0 H1' DG D 2 -4.900 3.315 8.440 1.00 1.00 H new ATOM 0 H8 DG D 2 -7.325 2.288 5.682 1.00 1.00 H new ATOM 0 H1 DG D 2 -1.416 4.054 3.854 1.00 1.00 H new ATOM 0 H21 DG D 2 -0.721 3.988 7.278 1.00 1.00 H new ATOM 0 H22 DG D 2 -0.115 4.257 5.641 1.00 1.00 H new HETATM 560 P AZW D 3 -6.999 4.702 11.208 1.00 1.00 P HETATM 561 OP1 AZW D 3 -6.826 4.827 12.672 1.00 1.00 O HETATM 562 OP2 AZW D 3 -8.344 4.896 10.615 1.00 1.00 O HETATM 563 O5' AZW D 3 -5.982 5.701 10.504 1.00 1.00 O HETATM 564 C5' AZW D 3 -4.576 5.556 10.697 1.00 1.00 C HETATM 565 C1A AZW D 3 -3.812 6.295 9.617 1.00 1.00 C HETATM 566 C2A AZW D 3 -2.417 6.186 9.569 1.00 1.00 C HETATM 567 C6A AZW D 3 -4.485 7.092 8.676 1.00 1.00 C HETATM 568 C3A AZW D 3 -1.693 6.871 8.586 1.00 1.00 C HETATM 569 C5A AZW D 3 -3.757 7.778 7.693 1.00 1.00 C HETATM 570 C4A AZW D 3 -2.361 7.668 7.649 1.00 1.00 C HETATM 571 N5A AZW D 3 -1.621 8.378 6.683 1.00 1.00 N HETATM 572 C1B AZW D 3 1.643 9.933 3.155 1.00 1.00 C HETATM 573 C2B AZW D 3 1.843 10.166 4.526 1.00 1.00 C HETATM 574 C6B AZW D 3 0.671 9.013 2.740 1.00 1.00 C HETATM 575 C3B AZW D 3 1.076 9.478 5.471 1.00 1.00 C HETATM 576 C5B AZW D 3 -0.094 8.326 3.689 1.00 1.00 C HETATM 577 C4B AZW D 3 0.110 8.556 5.055 1.00 1.00 C HETATM 578 N5B AZW D 3 -0.642 7.848 6.012 1.00 1.00 N HETATM 579 C3' AZW D 3 2.481 10.650 2.115 1.00 1.00 C HETATM 580 O3' AZW D 3 3.200 11.738 2.689 1.00 1.00 O ATOM 593 P DG D 4 4.762 11.569 3.025 1.00 1.00 P ATOM 594 OP1 DG D 4 5.160 12.644 3.965 1.00 1.00 O ATOM 595 OP2 DG D 4 5.482 11.424 1.738 1.00 1.00 O ATOM 596 O5' DG D 4 4.836 10.184 3.802 1.00 1.00 O ATOM 597 C5' DG D 4 5.876 9.244 3.536 1.00 1.00 C ATOM 598 C4' DG D 4 6.026 8.301 4.706 1.00 1.00 C ATOM 599 O4' DG D 4 4.718 7.797 5.072 1.00 1.00 O ATOM 600 C3' DG D 4 6.900 7.074 4.437 1.00 1.00 C ATOM 601 O3' DG D 4 7.713 6.781 5.582 1.00 1.00 O ATOM 602 C2' DG D 4 5.887 5.968 4.194 1.00 1.00 C ATOM 603 C1' DG D 4 4.743 6.381 5.099 1.00 1.00 C ATOM 604 N9 DG D 4 3.423 5.897 4.704 1.00 1.00 N ATOM 605 C8 DG D 4 2.505 5.292 5.529 1.00 1.00 C ATOM 606 N7 DG D 4 1.403 4.957 4.917 1.00 1.00 N ATOM 607 C5 DG D 4 1.604 5.364 3.607 1.00 1.00 C ATOM 608 C6 DG D 4 0.749 5.260 2.485 1.00 1.00 C ATOM 609 O6 DG D 4 -0.383 4.764 2.433 1.00 1.00 O ATOM 610 N1 DG D 4 1.325 5.792 1.334 1.00 1.00 N ATOM 611 C2 DG D 4 2.579 6.355 1.286 1.00 1.00 C ATOM 612 N2 DG D 4 2.982 6.822 0.094 1.00 1.00 N ATOM 613 N3 DG D 4 3.388 6.459 2.328 1.00 1.00 N ATOM 614 C4 DG D 4 2.843 5.946 3.453 1.00 1.00 C ATOM 0 H5' DG D 4 6.815 9.768 3.357 1.00 1.00 H new ATOM 0 H5'' DG D 4 5.647 8.681 2.631 1.00 1.00 H new ATOM 0 H4' DG D 4 6.508 8.889 5.487 1.00 1.00 H new ATOM 0 H3' DG D 4 7.588 7.208 3.602 1.00 1.00 H new ATOM 0 H2' DG D 4 5.582 5.917 3.149 1.00 1.00 H new ATOM 0 H2'' DG D 4 6.283 4.987 4.459 1.00 1.00 H new ATOM 0 H1' DG D 4 4.928 5.943 6.080 1.00 1.00 H new ATOM 0 H8 DG D 4 2.679 5.112 6.580 1.00 1.00 H new ATOM 0 H1 DG D 4 0.782 5.762 0.471 1.00 1.00 H new ATOM 0 H21 DG D 4 3.903 7.250 -0.001 1.00 1.00 H new ATOM 0 H22 DG D 4 2.367 6.749 -0.717 1.00 1.00 H new ATOM 626 P DG D 5 8.798 5.597 5.522 1.00 1.00 P ATOM 627 OP1 DG D 5 9.880 5.936 6.474 1.00 1.00 O ATOM 628 OP2 DG D 5 9.138 5.338 4.103 1.00 1.00 O ATOM 629 O5' DG D 5 8.029 4.328 6.093 1.00 1.00 O ATOM 630 C5' DG D 5 7.481 4.337 7.412 1.00 1.00 C ATOM 631 C4' DG D 5 6.465 3.230 7.575 1.00 1.00 C ATOM 632 O4' DG D 5 5.353 3.445 6.682 1.00 1.00 O ATOM 633 C3' DG D 5 6.958 1.832 7.213 1.00 1.00 C ATOM 634 O3' DG D 5 7.511 1.172 8.356 1.00 1.00 O ATOM 635 C2' DG D 5 5.707 1.112 6.729 1.00 1.00 C ATOM 636 C1' DG D 5 4.663 2.212 6.563 1.00 1.00 C ATOM 637 N9 DG D 5 3.975 2.188 5.276 1.00 1.00 N ATOM 638 C8 DG D 5 4.500 2.512 4.049 1.00 1.00 C ATOM 639 N7 DG D 5 3.645 2.377 3.071 1.00 1.00 N ATOM 640 C5 DG D 5 2.484 1.933 3.690 1.00 1.00 C ATOM 641 C6 DG D 5 1.215 1.610 3.139 1.00 1.00 C ATOM 642 O6 DG D 5 0.857 1.654 1.950 1.00 1.00 O ATOM 643 N1 DG D 5 0.312 1.199 4.115 1.00 1.00 N ATOM 644 C2 DG D 5 0.606 1.115 5.458 1.00 1.00 C ATOM 645 N2 DG D 5 -0.389 0.718 6.263 1.00 1.00 N ATOM 646 N3 DG D 5 1.784 1.411 5.983 1.00 1.00 N ATOM 647 C4 DG D 5 2.670 1.811 5.050 1.00 1.00 C ATOM 0 H5' DG D 5 7.011 5.301 7.610 1.00 1.00 H new ATOM 0 H5'' DG D 5 8.279 4.215 8.144 1.00 1.00 H new ATOM 0 H4' DG D 5 6.218 3.268 8.636 1.00 1.00 H new ATOM 0 H3' DG D 5 7.749 1.851 6.464 1.00 1.00 H new ATOM 0 H2' DG D 5 5.888 0.594 5.787 1.00 1.00 H new ATOM 0 H2'' DG D 5 5.380 0.361 7.448 1.00 1.00 H new ATOM 0 HO3' DG D 5 7.819 0.277 8.100 1.00 1.00 H new ATOM 0 H1' DG D 5 3.893 2.067 7.321 1.00 1.00 H new ATOM 0 H8 DG D 5 5.518 2.845 3.907 1.00 1.00 H new ATOM 0 H1 DG D 5 -0.629 0.943 3.816 1.00 1.00 H new ATOM 0 H21 DG D 5 -0.231 0.637 7.267 1.00 1.00 H new ATOM 0 H22 DG D 5 -1.304 0.497 5.871 1.00 1.00 H new TER 660 DG D 5 HETATM 661 K K A 101 1.270 -3.914 -0.368 1.00 1.00 K HETATM 662 K K A 102 -0.079 -0.367 0.240 1.00 1.00 K HETATM 663 K K C 101 -1.503 3.180 0.693 1.00 1.00 K