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 -24:sc= 0.545 USER MOD Single : A 5 DG O3' : rot 180:sc= 0 USER MOD Single : B 1 DG O5' : rot -23:sc= 0.556 USER MOD Single : B 5 DG O3' : rot 180:sc= 0 USER MOD Single : C 1 DG O5' : rot -72:sc= 0.845 USER MOD Single : C 5 DG O3' : rot 180:sc= 0 USER MOD Single : D 1 DG O5' : rot -17:sc= 0.661 USER MOD Single : D 5 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -7.861 -2.504 -1.127 1.00 1.00 O ATOM 2 C5' DG A 1 -8.606 -3.633 -1.576 1.00 1.00 C ATOM 3 C4' DG A 1 -8.426 -3.827 -3.063 1.00 1.00 C ATOM 4 O4' DG A 1 -7.227 -3.125 -3.468 1.00 1.00 O ATOM 5 C3' DG A 1 -8.238 -5.278 -3.509 1.00 1.00 C ATOM 6 O3' DG A 1 -8.866 -5.490 -4.780 1.00 1.00 O ATOM 7 C2' DG A 1 -6.730 -5.415 -3.620 1.00 1.00 C ATOM 8 C1' DG A 1 -6.325 -4.029 -4.084 1.00 1.00 C ATOM 9 N9 DG A 1 -4.969 -3.620 -3.729 1.00 1.00 N ATOM 10 C8 DG A 1 -4.011 -3.148 -4.593 1.00 1.00 C ATOM 11 N7 DG A 1 -2.893 -2.831 -4.000 1.00 1.00 N ATOM 12 C5 DG A 1 -3.125 -3.114 -2.662 1.00 1.00 C ATOM 13 C6 DG A 1 -2.273 -2.971 -1.540 1.00 1.00 C ATOM 14 O6 DG A 1 -1.115 -2.528 -1.510 1.00 1.00 O ATOM 15 N1 DG A 1 -2.888 -3.376 -0.359 1.00 1.00 N ATOM 16 C2 DG A 1 -4.177 -3.850 -0.279 1.00 1.00 C ATOM 17 N2 DG A 1 -4.617 -4.182 0.945 1.00 1.00 N ATOM 18 N3 DG A 1 -4.985 -3.985 -1.320 1.00 1.00 N ATOM 19 C4 DG A 1 -4.400 -3.601 -2.474 1.00 1.00 C ATOM 0 H5' DG A 1 -9.662 -3.494 -1.347 1.00 1.00 H new ATOM 0 H5'' DG A 1 -8.279 -4.527 -1.044 1.00 1.00 H new ATOM 0 H4' DG A 1 -9.344 -3.457 -3.519 1.00 1.00 H new ATOM 0 H3' DG A 1 -8.680 -6.004 -2.826 1.00 1.00 H new ATOM 0 H2' DG A 1 -6.272 -5.677 -2.666 1.00 1.00 H new ATOM 0 H2'' DG A 1 -6.441 -6.186 -4.334 1.00 1.00 H new ATOM 0 HO5' DG A 1 -7.117 -2.337 -1.743 1.00 1.00 H new ATOM 0 H1' DG A 1 -6.353 -4.033 -5.174 1.00 1.00 H new ATOM 0 H8 DG A 1 -4.168 -3.049 -5.657 1.00 1.00 H new ATOM 0 H1 DG A 1 -2.347 -3.318 0.504 1.00 1.00 H new ATOM 0 H21 DG A 1 -5.565 -4.539 1.067 1.00 1.00 H new ATOM 0 H22 DG A 1 -4.004 -4.077 1.753 1.00 1.00 H new ATOM 32 P DG A 2 -9.027 -6.976 -5.367 1.00 1.00 P ATOM 33 OP1 DG A 2 -10.183 -6.966 -6.298 1.00 1.00 O ATOM 34 OP2 DG A 2 -9.014 -7.935 -4.234 1.00 1.00 O ATOM 35 O5' DG A 2 -7.706 -7.192 -6.225 1.00 1.00 O ATOM 36 C5' DG A 2 -7.427 -6.354 -7.345 1.00 1.00 C ATOM 37 C4' DG A 2 -6.030 -6.610 -7.855 1.00 1.00 C ATOM 38 O4' DG A 2 -5.066 -6.095 -6.902 1.00 1.00 O ATOM 39 C3' DG A 2 -5.681 -8.090 -8.044 1.00 1.00 C ATOM 40 O3' DG A 2 -4.951 -8.272 -9.262 1.00 1.00 O ATOM 41 C2' DG A 2 -4.802 -8.389 -6.843 1.00 1.00 C ATOM 42 C1' DG A 2 -4.065 -7.076 -6.708 1.00 1.00 C ATOM 43 N9 DG A 2 -3.418 -6.855 -5.418 1.00 1.00 N ATOM 44 C8 DG A 2 -3.882 -7.226 -4.181 1.00 1.00 C ATOM 45 N7 DG A 2 -3.058 -6.937 -3.210 1.00 1.00 N ATOM 46 C5 DG A 2 -1.982 -6.332 -3.847 1.00 1.00 C ATOM 47 C6 DG A 2 -0.780 -5.804 -3.312 1.00 1.00 C ATOM 48 O6 DG A 2 -0.430 -5.749 -2.124 1.00 1.00 O ATOM 49 N1 DG A 2 0.049 -5.281 -4.302 1.00 1.00 N ATOM 50 C2 DG A 2 -0.258 -5.272 -5.647 1.00 1.00 C ATOM 51 N2 DG A 2 0.644 -4.717 -6.470 1.00 1.00 N ATOM 52 N3 DG A 2 -1.377 -5.760 -6.156 1.00 1.00 N ATOM 53 C4 DG A 2 -2.189 -6.273 -5.208 1.00 1.00 C ATOM 0 H5' DG A 2 -7.531 -5.307 -7.060 1.00 1.00 H new ATOM 0 H5'' DG A 2 -8.151 -6.542 -8.138 1.00 1.00 H new ATOM 0 H4' DG A 2 -5.993 -6.118 -8.827 1.00 1.00 H new ATOM 0 H3' DG A 2 -6.553 -8.740 -8.109 1.00 1.00 H new ATOM 0 H2' DG A 2 -5.384 -8.631 -5.954 1.00 1.00 H new ATOM 0 H2'' DG A 2 -4.128 -9.227 -7.021 1.00 1.00 H new ATOM 0 H1' DG A 2 -3.245 -7.050 -7.425 1.00 1.00 H new ATOM 0 H8 DG A 2 -4.835 -7.710 -4.026 1.00 1.00 H new ATOM 0 H1 DG A 2 0.941 -4.879 -4.014 1.00 1.00 H new ATOM 0 H21 DG A 2 0.466 -4.684 -7.474 1.00 1.00 H new ATOM 0 H22 DG A 2 1.508 -4.328 -6.092 1.00 1.00 H new HETATM 65 P AZW A 3 -4.678 -9.749 -9.832 1.00 1.00 P HETATM 66 OP1 AZW A 3 -4.981 -9.752 -11.283 1.00 1.00 O HETATM 67 OP2 AZW A 3 -5.372 -10.713 -8.944 1.00 1.00 O HETATM 68 O5' AZW A 3 -3.111 -9.955 -9.644 1.00 1.00 O HETATM 69 C5' AZW A 3 -2.170 -9.097 -10.288 1.00 1.00 C HETATM 70 C1A AZW A 3 -1.045 -8.741 -9.337 1.00 1.00 C HETATM 71 C2A AZW A 3 0.009 -7.935 -9.789 1.00 1.00 C HETATM 72 C6A AZW A 3 -1.043 -9.214 -8.013 1.00 1.00 C HETATM 73 C3A AZW A 3 1.059 -7.600 -8.926 1.00 1.00 C HETATM 74 C5A AZW A 3 0.011 -8.876 -7.151 1.00 1.00 C HETATM 75 C4A AZW A 3 1.060 -8.071 -7.608 1.00 1.00 C HETATM 76 N5A AZW A 3 2.126 -7.738 -6.743 1.00 1.00 N HETATM 77 C1B AZW A 3 6.599 -7.058 -4.477 1.00 1.00 C HETATM 78 C2B AZW A 3 6.775 -7.080 -5.869 1.00 1.00 C HETATM 79 C6B AZW A 3 5.339 -7.352 -3.930 1.00 1.00 C HETATM 80 C3B AZW A 3 5.701 -7.394 -6.708 1.00 1.00 C HETATM 81 C5B AZW A 3 4.264 -7.667 -4.772 1.00 1.00 C HETATM 82 C4B AZW A 3 4.445 -7.689 -6.161 1.00 1.00 C HETATM 83 N5B AZW A 3 3.367 -8.016 -7.015 1.00 1.00 N HETATM 84 C3' AZW A 3 7.759 -6.717 -3.562 1.00 1.00 C HETATM 85 O3' AZW A 3 8.993 -7.180 -4.103 1.00 1.00 O ATOM 98 P DG A 4 10.070 -6.133 -4.668 1.00 1.00 P ATOM 99 OP1 DG A 4 10.892 -6.825 -5.688 1.00 1.00 O ATOM 100 OP2 DG A 4 10.732 -5.501 -3.504 1.00 1.00 O ATOM 101 O5' DG A 4 9.196 -5.027 -5.406 1.00 1.00 O ATOM 102 C5' DG A 4 9.652 -3.682 -5.523 1.00 1.00 C ATOM 103 C4' DG A 4 8.966 -3.011 -6.691 1.00 1.00 C ATOM 104 O4' DG A 4 7.632 -3.559 -6.829 1.00 1.00 O ATOM 105 C3' DG A 4 8.788 -1.498 -6.563 1.00 1.00 C ATOM 106 O3' DG A 4 8.909 -0.882 -7.850 1.00 1.00 O ATOM 107 C2' DG A 4 7.375 -1.365 -6.024 1.00 1.00 C ATOM 108 C1' DG A 4 6.667 -2.525 -6.705 1.00 1.00 C ATOM 109 N9 DG A 4 5.509 -3.068 -6.000 1.00 1.00 N ATOM 110 C8 DG A 4 4.282 -3.347 -6.554 1.00 1.00 C ATOM 111 N7 DG A 4 3.419 -3.815 -5.695 1.00 1.00 N ATOM 112 C5 DG A 4 4.116 -3.847 -4.496 1.00 1.00 C ATOM 113 C6 DG A 4 3.694 -4.261 -3.208 1.00 1.00 C ATOM 114 O6 DG A 4 2.583 -4.694 -2.873 1.00 1.00 O ATOM 115 N1 DG A 4 4.704 -4.135 -2.259 1.00 1.00 N ATOM 116 C2 DG A 4 5.969 -3.665 -2.533 1.00 1.00 C ATOM 117 N2 DG A 4 6.824 -3.601 -1.500 1.00 1.00 N ATOM 118 N3 DG A 4 6.376 -3.278 -3.730 1.00 1.00 N ATOM 119 C4 DG A 4 5.407 -3.391 -4.663 1.00 1.00 C ATOM 0 H5' DG A 4 10.733 -3.665 -5.665 1.00 1.00 H new ATOM 0 H5'' DG A 4 9.443 -3.136 -4.603 1.00 1.00 H new ATOM 0 H4' DG A 4 9.619 -3.199 -7.543 1.00 1.00 H new ATOM 0 H3' DG A 4 9.530 -1.018 -5.925 1.00 1.00 H new ATOM 0 H2' DG A 4 7.343 -1.449 -4.938 1.00 1.00 H new ATOM 0 H2'' DG A 4 6.928 -0.405 -6.283 1.00 1.00 H new ATOM 0 H1' DG A 4 6.273 -2.148 -7.649 1.00 1.00 H new ATOM 0 H8 DG A 4 4.055 -3.194 -7.599 1.00 1.00 H new ATOM 0 H1 DG A 4 4.494 -4.408 -1.299 1.00 1.00 H new ATOM 0 H21 DG A 4 7.775 -3.261 -1.645 1.00 1.00 H new ATOM 0 H22 DG A 4 6.523 -3.893 -0.570 1.00 1.00 H new ATOM 131 P DG A 5 8.864 0.717 -8.004 1.00 1.00 P ATOM 132 OP1 DG A 5 9.631 1.076 -9.219 1.00 1.00 O ATOM 133 OP2 DG A 5 9.248 1.313 -6.705 1.00 1.00 O ATOM 134 O5' DG A 5 7.327 1.037 -8.264 1.00 1.00 O ATOM 135 C5' DG A 5 6.646 0.489 -9.393 1.00 1.00 C ATOM 136 C4' DG A 5 5.150 0.627 -9.226 1.00 1.00 C ATOM 137 O4' DG A 5 4.693 -0.223 -8.155 1.00 1.00 O ATOM 138 C3' DG A 5 4.663 2.014 -8.812 1.00 1.00 C ATOM 139 O3' DG A 5 4.431 2.838 -9.961 1.00 1.00 O ATOM 140 C2' DG A 5 3.362 1.732 -8.078 1.00 1.00 C ATOM 141 C1' DG A 5 3.411 0.240 -7.760 1.00 1.00 C ATOM 142 N9 DG A 5 3.220 -0.062 -6.344 1.00 1.00 N ATOM 143 C8 DG A 5 4.106 0.167 -5.323 1.00 1.00 C ATOM 144 N7 DG A 5 3.651 -0.200 -4.153 1.00 1.00 N ATOM 145 C5 DG A 5 2.383 -0.697 -4.422 1.00 1.00 C ATOM 146 C6 DG A 5 1.403 -1.239 -3.545 1.00 1.00 C ATOM 147 O6 DG A 5 1.464 -1.377 -2.312 1.00 1.00 O ATOM 148 N1 DG A 5 0.252 -1.627 -4.228 1.00 1.00 N ATOM 149 C2 DG A 5 0.077 -1.501 -5.589 1.00 1.00 C ATOM 150 N2 DG A 5 -1.097 -1.918 -6.083 1.00 1.00 N ATOM 151 N3 DG A 5 0.981 -0.997 -6.413 1.00 1.00 N ATOM 152 C4 DG A 5 2.103 -0.619 -5.769 1.00 1.00 C ATOM 0 H5' DG A 5 6.910 -0.562 -9.509 1.00 1.00 H new ATOM 0 H5'' DG A 5 6.965 1.000 -10.301 1.00 1.00 H new ATOM 0 H4' DG A 5 4.763 0.378 -10.214 1.00 1.00 H new ATOM 0 H3' DG A 5 5.387 2.552 -8.200 1.00 1.00 H new ATOM 0 H2' DG A 5 3.283 2.328 -7.169 1.00 1.00 H new ATOM 0 H2'' DG A 5 2.498 1.977 -8.696 1.00 1.00 H new ATOM 0 HO3' DG A 5 4.118 3.721 -9.673 1.00 1.00 H new ATOM 0 H1' DG A 5 2.595 -0.250 -8.292 1.00 1.00 H new ATOM 0 H8 DG A 5 5.082 0.606 -5.470 1.00 1.00 H new ATOM 0 H1 DG A 5 -0.511 -2.031 -3.685 1.00 1.00 H new ATOM 0 H21 DG A 5 -1.283 -1.849 -7.084 1.00 1.00 H new ATOM 0 H22 DG A 5 -1.805 -2.304 -5.458 1.00 1.00 H new TER 165 DG A 5 ATOM 166 O5' DG B 1 7.409 2.652 1.104 1.00 1.00 O ATOM 167 C5' DG B 1 8.676 2.021 1.281 1.00 1.00 C ATOM 168 C4' DG B 1 8.703 1.242 2.573 1.00 1.00 C ATOM 169 O4' DG B 1 7.335 0.974 2.966 1.00 1.00 O ATOM 170 C3' DG B 1 9.406 -0.115 2.499 1.00 1.00 C ATOM 171 O3' DG B 1 10.205 -0.319 3.670 1.00 1.00 O ATOM 172 C2' DG B 1 8.265 -1.114 2.445 1.00 1.00 C ATOM 173 C1' DG B 1 7.177 -0.410 3.231 1.00 1.00 C ATOM 174 N9 DG B 1 5.815 -0.799 2.877 1.00 1.00 N ATOM 175 C8 DG B 1 4.861 -1.287 3.737 1.00 1.00 C ATOM 176 N7 DG B 1 3.738 -1.587 3.145 1.00 1.00 N ATOM 177 C5 DG B 1 3.961 -1.278 1.811 1.00 1.00 C ATOM 178 C6 DG B 1 3.099 -1.397 0.691 1.00 1.00 C ATOM 179 O6 DG B 1 1.928 -1.806 0.664 1.00 1.00 O ATOM 180 N1 DG B 1 3.709 -0.977 -0.487 1.00 1.00 N ATOM 181 C2 DG B 1 4.998 -0.497 -0.564 1.00 1.00 C ATOM 182 N2 DG B 1 5.422 -0.113 -1.777 1.00 1.00 N ATOM 183 N3 DG B 1 5.812 -0.382 0.474 1.00 1.00 N ATOM 184 C4 DG B 1 5.236 -0.789 1.625 1.00 1.00 C ATOM 0 H5' DG B 1 9.465 2.773 1.286 1.00 1.00 H new ATOM 0 H5'' DG B 1 8.877 1.354 0.443 1.00 1.00 H new ATOM 0 H4' DG B 1 9.262 1.859 3.276 1.00 1.00 H new ATOM 0 H3' DG B 1 10.078 -0.204 1.645 1.00 1.00 H new ATOM 0 H2' DG B 1 7.956 -1.322 1.421 1.00 1.00 H new ATOM 0 H2'' DG B 1 8.539 -2.068 2.896 1.00 1.00 H new ATOM 0 HO5' DG B 1 6.730 2.175 1.626 1.00 1.00 H new ATOM 0 H1' DG B 1 7.292 -0.681 4.280 1.00 1.00 H new ATOM 0 H8 DG B 1 5.025 -1.410 4.797 1.00 1.00 H new ATOM 0 H1 DG B 1 3.167 -1.028 -1.349 1.00 1.00 H new ATOM 0 H21 DG B 1 6.368 0.251 -1.895 1.00 1.00 H new ATOM 0 H22 DG B 1 4.799 -0.185 -2.581 1.00 1.00 H new ATOM 197 P DG B 2 11.233 -1.551 3.740 1.00 1.00 P ATOM 198 OP1 DG B 2 12.358 -1.148 4.613 1.00 1.00 O ATOM 199 OP2 DG B 2 11.516 -2.016 2.359 1.00 1.00 O ATOM 200 O5' DG B 2 10.418 -2.691 4.493 1.00 1.00 O ATOM 201 C5' DG B 2 9.819 -2.437 5.763 1.00 1.00 C ATOM 202 C4' DG B 2 8.839 -3.533 6.108 1.00 1.00 C ATOM 203 O4' DG B 2 7.693 -3.444 5.223 1.00 1.00 O ATOM 204 C3' DG B 2 9.387 -4.951 5.929 1.00 1.00 C ATOM 205 O3' DG B 2 8.905 -5.804 6.969 1.00 1.00 O ATOM 206 C2' DG B 2 8.802 -5.370 4.594 1.00 1.00 C ATOM 207 C1' DG B 2 7.436 -4.734 4.698 1.00 1.00 C ATOM 208 N9 DG B 2 6.706 -4.613 3.439 1.00 1.00 N ATOM 209 C8 DG B 2 7.202 -4.278 2.202 1.00 1.00 C ATOM 210 N7 DG B 2 6.304 -4.319 1.255 1.00 1.00 N ATOM 211 C5 DG B 2 5.140 -4.702 1.908 1.00 1.00 C ATOM 212 C6 DG B 2 3.832 -4.919 1.402 1.00 1.00 C ATOM 213 O6 DG B 2 3.430 -4.788 0.236 1.00 1.00 O ATOM 214 N1 DG B 2 2.941 -5.305 2.401 1.00 1.00 N ATOM 215 C2 DG B 2 3.283 -5.456 3.727 1.00 1.00 C ATOM 216 N2 DG B 2 2.302 -5.811 4.567 1.00 1.00 N ATOM 217 N3 DG B 2 4.498 -5.257 4.211 1.00 1.00 N ATOM 218 C4 DG B 2 5.372 -4.887 3.252 1.00 1.00 C ATOM 0 H5' DG B 2 9.308 -1.475 5.746 1.00 1.00 H new ATOM 0 H5'' DG B 2 10.590 -2.374 6.531 1.00 1.00 H new ATOM 0 H4' DG B 2 8.600 -3.380 7.160 1.00 1.00 H new ATOM 0 H3' DG B 2 10.475 -5.004 5.965 1.00 1.00 H new ATOM 0 H2' DG B 2 9.376 -4.990 3.749 1.00 1.00 H new ATOM 0 H2'' DG B 2 8.751 -6.453 4.483 1.00 1.00 H new ATOM 0 H1' DG B 2 6.792 -5.363 5.313 1.00 1.00 H new ATOM 0 H8 DG B 2 8.233 -4.007 2.030 1.00 1.00 H new ATOM 0 H1 DG B 2 1.974 -5.487 2.134 1.00 1.00 H new ATOM 0 H21 DG B 2 2.501 -5.936 5.560 1.00 1.00 H new ATOM 0 H22 DG B 2 1.356 -5.956 4.214 1.00 1.00 H new HETATM 230 P AZW B 3 9.888 -6.873 7.650 1.00 1.00 P HETATM 231 OP1 AZW B 3 10.509 -6.239 8.836 1.00 1.00 O HETATM 232 OP2 AZW B 3 10.759 -7.429 6.587 1.00 1.00 O HETATM 233 O5' AZW B 3 8.918 -8.036 8.142 1.00 1.00 O HETATM 234 C5' AZW B 3 7.597 -7.755 8.600 1.00 1.00 C HETATM 235 C1A AZW B 3 6.588 -8.044 7.505 1.00 1.00 C HETATM 236 C2A AZW B 3 5.255 -7.650 7.676 1.00 1.00 C HETATM 237 C6A AZW B 3 6.972 -8.717 6.332 1.00 1.00 C HETATM 238 C3A AZW B 3 4.305 -7.927 6.684 1.00 1.00 C HETATM 239 C5A AZW B 3 6.022 -8.994 5.341 1.00 1.00 C HETATM 240 C4A AZW B 3 4.688 -8.599 5.517 1.00 1.00 C HETATM 241 N5A AZW B 3 3.731 -8.887 4.518 1.00 1.00 N HETATM 242 C1B AZW B 3 -0.097 -10.665 1.709 1.00 1.00 C HETATM 243 C2B AZW B 3 -0.161 -11.284 2.968 1.00 1.00 C HETATM 244 C6B AZW B 3 0.923 -9.744 1.440 1.00 1.00 C HETATM 245 C3B AZW B 3 0.791 -10.978 3.949 1.00 1.00 C HETATM 246 C5B AZW B 3 1.876 -9.440 2.421 1.00 1.00 C HETATM 247 C4B AZW B 3 1.812 -10.058 3.679 1.00 1.00 C HETATM 248 N5B AZW B 3 2.774 -9.759 4.675 1.00 1.00 N HETATM 249 C3' AZW B 3 -1.125 -10.975 0.636 1.00 1.00 C HETATM 250 O3' AZW B 3 -1.679 -12.276 0.807 1.00 1.00 O ATOM 263 P DG B 4 -3.158 -12.443 1.412 1.00 1.00 P ATOM 264 OP1 DG B 4 -3.196 -13.697 2.198 1.00 1.00 O ATOM 265 OP2 DG B 4 -4.123 -12.254 0.302 1.00 1.00 O ATOM 266 O5' DG B 4 -3.303 -11.217 2.415 1.00 1.00 O ATOM 267 C5' DG B 4 -4.511 -10.979 3.133 1.00 1.00 C ATOM 268 C4' DG B 4 -4.184 -10.592 4.558 1.00 1.00 C ATOM 269 O4' DG B 4 -2.863 -9.997 4.593 1.00 1.00 O ATOM 270 C3' DG B 4 -5.101 -9.542 5.184 1.00 1.00 C ATOM 271 O3' DG B 4 -5.088 -9.686 6.611 1.00 1.00 O ATOM 272 C2' DG B 4 -4.425 -8.252 4.761 1.00 1.00 C ATOM 273 C1' DG B 4 -2.965 -8.624 4.952 1.00 1.00 C ATOM 274 N9 DG B 4 -1.997 -7.877 4.152 1.00 1.00 N ATOM 275 C8 DG B 4 -0.812 -7.357 4.610 1.00 1.00 C ATOM 276 N7 DG B 4 -0.098 -6.795 3.675 1.00 1.00 N ATOM 277 C5 DG B 4 -0.857 -6.949 2.526 1.00 1.00 C ATOM 278 C6 DG B 4 -0.588 -6.534 1.200 1.00 1.00 C ATOM 279 O6 DG B 4 0.411 -5.938 0.778 1.00 1.00 O ATOM 280 N1 DG B 4 -1.611 -6.880 0.323 1.00 1.00 N ATOM 281 C2 DG B 4 -2.756 -7.544 0.697 1.00 1.00 C ATOM 282 N2 DG B 4 -3.641 -7.796 -0.279 1.00 1.00 N ATOM 283 N3 DG B 4 -3.021 -7.937 1.933 1.00 1.00 N ATOM 284 C4 DG B 4 -2.035 -7.611 2.797 1.00 1.00 C ATOM 0 H5' DG B 4 -5.135 -11.873 3.122 1.00 1.00 H new ATOM 0 H5'' DG B 4 -5.082 -10.185 2.651 1.00 1.00 H new ATOM 0 H4' DG B 4 -4.289 -11.521 5.119 1.00 1.00 H new ATOM 0 H3' DG B 4 -6.146 -9.605 4.881 1.00 1.00 H new ATOM 0 H2' DG B 4 -4.652 -7.985 3.729 1.00 1.00 H new ATOM 0 H2'' DG B 4 -4.721 -7.407 5.382 1.00 1.00 H new ATOM 0 H1' DG B 4 -2.711 -8.391 5.986 1.00 1.00 H new ATOM 0 H8 DG B 4 -0.502 -7.408 5.643 1.00 1.00 H new ATOM 0 H1 DG B 4 -1.505 -6.625 -0.659 1.00 1.00 H new ATOM 0 H21 DG B 4 -4.510 -8.285 -0.066 1.00 1.00 H new ATOM 0 H22 DG B 4 -3.445 -7.498 -1.235 1.00 1.00 H new ATOM 296 P DG B 5 -5.937 -8.701 7.555 1.00 1.00 P ATOM 297 OP1 DG B 5 -6.078 -9.388 8.862 1.00 1.00 O ATOM 298 OP2 DG B 5 -7.152 -8.279 6.824 1.00 1.00 O ATOM 299 O5' DG B 5 -4.999 -7.431 7.756 1.00 1.00 O ATOM 300 C5' DG B 5 -3.893 -7.482 8.657 1.00 1.00 C ATOM 301 C4' DG B 5 -3.083 -6.208 8.590 1.00 1.00 C ATOM 302 O4' DG B 5 -2.603 -5.994 7.240 1.00 1.00 O ATOM 303 C3' DG B 5 -3.844 -4.931 8.967 1.00 1.00 C ATOM 304 O3' DG B 5 -3.181 -4.244 10.037 1.00 1.00 O ATOM 305 C2' DG B 5 -3.817 -4.095 7.697 1.00 1.00 C ATOM 306 C1' DG B 5 -2.554 -4.598 7.033 1.00 1.00 C ATOM 307 N9 DG B 5 -2.434 -4.316 5.605 1.00 1.00 N ATOM 308 C8 DG B 5 -3.374 -4.513 4.620 1.00 1.00 C ATOM 309 N7 DG B 5 -2.964 -4.140 3.435 1.00 1.00 N ATOM 310 C5 DG B 5 -1.675 -3.671 3.651 1.00 1.00 C ATOM 311 C6 DG B 5 -0.725 -3.132 2.738 1.00 1.00 C ATOM 312 O6 DG B 5 -0.843 -2.956 1.514 1.00 1.00 O ATOM 313 N1 DG B 5 0.463 -2.778 3.371 1.00 1.00 N ATOM 314 C2 DG B 5 0.697 -2.925 4.720 1.00 1.00 C ATOM 315 N2 DG B 5 1.898 -2.528 5.161 1.00 1.00 N ATOM 316 N3 DG B 5 -0.178 -3.421 5.579 1.00 1.00 N ATOM 317 C4 DG B 5 -1.336 -3.772 4.982 1.00 1.00 C ATOM 0 H5' DG B 5 -3.259 -8.334 8.412 1.00 1.00 H new ATOM 0 H5'' DG B 5 -4.254 -7.635 9.674 1.00 1.00 H new ATOM 0 H4' DG B 5 -2.287 -6.364 9.318 1.00 1.00 H new ATOM 0 H3' DG B 5 -4.857 -5.135 9.314 1.00 1.00 H new ATOM 0 H2' DG B 5 -4.699 -4.260 7.079 1.00 1.00 H new ATOM 0 H2'' DG B 5 -3.771 -3.027 7.910 1.00 1.00 H new ATOM 0 HO3' DG B 5 -3.680 -3.431 10.263 1.00 1.00 H new ATOM 0 H1' DG B 5 -1.691 -4.090 7.463 1.00 1.00 H new ATOM 0 H8 DG B 5 -4.351 -4.933 4.806 1.00 1.00 H new ATOM 0 H1 DG B 5 1.209 -2.384 2.798 1.00 1.00 H new ATOM 0 H21 DG B 5 2.131 -2.611 6.150 1.00 1.00 H new ATOM 0 H22 DG B 5 2.579 -2.142 4.507 1.00 1.00 H new TER 330 DG B 5 ATOM 331 O5' DG C 1 6.807 2.231 -3.021 1.00 1.00 O ATOM 332 C5' DG C 1 7.425 3.333 -3.689 1.00 1.00 C ATOM 333 C4' DG C 1 6.739 3.619 -5.003 1.00 1.00 C ATOM 334 O4' DG C 1 5.428 3.011 -4.975 1.00 1.00 O ATOM 335 C3' DG C 1 6.502 5.100 -5.302 1.00 1.00 C ATOM 336 O3' DG C 1 6.554 5.321 -6.720 1.00 1.00 O ATOM 337 C2' DG C 1 5.099 5.315 -4.762 1.00 1.00 C ATOM 338 C1' DG C 1 4.440 4.009 -5.165 1.00 1.00 C ATOM 339 N9 DG C 1 3.257 3.619 -4.402 1.00 1.00 N ATOM 340 C8 DG C 1 2.006 3.371 -4.913 1.00 1.00 C ATOM 341 N7 DG C 1 1.152 2.965 -4.015 1.00 1.00 N ATOM 342 C5 DG C 1 1.880 2.946 -2.836 1.00 1.00 C ATOM 343 C6 DG C 1 1.477 2.590 -1.525 1.00 1.00 C ATOM 344 O6 DG C 1 0.364 2.193 -1.147 1.00 1.00 O ATOM 345 N1 DG C 1 2.514 2.712 -0.608 1.00 1.00 N ATOM 346 C2 DG C 1 3.787 3.126 -0.928 1.00 1.00 C ATOM 347 N2 DG C 1 4.667 3.174 0.080 1.00 1.00 N ATOM 348 N3 DG C 1 4.178 3.459 -2.149 1.00 1.00 N ATOM 349 C4 DG C 1 3.181 3.349 -3.052 1.00 1.00 C ATOM 0 H5' DG C 1 8.478 3.113 -3.864 1.00 1.00 H new ATOM 0 H5'' DG C 1 7.385 4.218 -3.053 1.00 1.00 H new ATOM 0 H4' DG C 1 7.408 3.224 -5.768 1.00 1.00 H new ATOM 0 H3' DG C 1 7.237 5.775 -4.864 1.00 1.00 H new ATOM 0 H2' DG C 1 5.090 5.467 -3.683 1.00 1.00 H new ATOM 0 H2'' DG C 1 4.611 6.180 -5.210 1.00 1.00 H new ATOM 0 HO5' DG C 1 5.936 2.509 -2.669 1.00 1.00 H new ATOM 0 H1' DG C 1 4.083 4.132 -6.188 1.00 1.00 H new ATOM 0 H8 DG C 1 1.755 3.500 -5.955 1.00 1.00 H new ATOM 0 H1 DG C 1 2.319 2.480 0.366 1.00 1.00 H new ATOM 0 H21 DG C 1 5.626 3.473 -0.094 1.00 1.00 H new ATOM 0 H22 DG C 1 4.378 2.911 1.022 1.00 1.00 H new ATOM 362 P DG C 2 6.657 6.808 -7.320 1.00 1.00 P ATOM 363 OP1 DG C 2 7.193 6.714 -8.699 1.00 1.00 O ATOM 364 OP2 DG C 2 7.356 7.657 -6.328 1.00 1.00 O ATOM 365 O5' DG C 2 5.144 7.291 -7.420 1.00 1.00 O ATOM 366 C5' DG C 2 4.235 6.636 -8.303 1.00 1.00 C ATOM 367 C4' DG C 2 2.825 7.121 -8.065 1.00 1.00 C ATOM 368 O4' DG C 2 2.312 6.528 -6.847 1.00 1.00 O ATOM 369 C3' DG C 2 2.677 8.637 -7.890 1.00 1.00 C ATOM 370 O3' DG C 2 1.631 9.116 -8.745 1.00 1.00 O ATOM 371 C2' DG C 2 2.310 8.799 -6.423 1.00 1.00 C ATOM 372 C1' DG C 2 1.562 7.510 -6.158 1.00 1.00 C ATOM 373 N9 DG C 2 1.446 7.117 -4.756 1.00 1.00 N ATOM 374 C8 DG C 2 2.362 7.298 -3.749 1.00 1.00 C ATOM 375 N7 DG C 2 1.956 6.846 -2.593 1.00 1.00 N ATOM 376 C5 DG C 2 0.694 6.331 -2.851 1.00 1.00 C ATOM 377 C6 DG C 2 -0.240 5.703 -1.983 1.00 1.00 C ATOM 378 O6 DG C 2 -0.123 5.456 -0.773 1.00 1.00 O ATOM 379 N1 DG C 2 -1.402 5.330 -2.652 1.00 1.00 N ATOM 380 C2 DG C 2 -1.625 5.544 -3.997 1.00 1.00 C ATOM 381 N2 DG C 2 -2.787 5.109 -4.495 1.00 1.00 N ATOM 382 N3 DG C 2 -0.764 6.124 -4.813 1.00 1.00 N ATOM 383 C4 DG C 2 0.366 6.492 -4.179 1.00 1.00 C ATOM 0 H5' DG C 2 4.285 5.558 -8.152 1.00 1.00 H new ATOM 0 H5'' DG C 2 4.522 6.827 -9.337 1.00 1.00 H new ATOM 0 H4' DG C 2 2.281 6.830 -8.963 1.00 1.00 H new ATOM 0 H3' DG C 2 3.574 9.199 -8.150 1.00 1.00 H new ATOM 0 H2' DG C 2 3.190 8.901 -5.788 1.00 1.00 H new ATOM 0 H2'' DG C 2 1.689 9.678 -6.250 1.00 1.00 H new ATOM 0 H1' DG C 2 0.529 7.632 -6.484 1.00 1.00 H new ATOM 0 H8 DG C 2 3.323 7.768 -3.898 1.00 1.00 H new ATOM 0 H1 DG C 2 -2.136 4.869 -2.114 1.00 1.00 H new ATOM 0 H21 DG C 2 -3.000 5.243 -5.483 1.00 1.00 H new ATOM 0 H22 DG C 2 -3.460 4.643 -3.886 1.00 1.00 H new HETATM 395 P AZW C 3 1.370 10.688 -8.942 1.00 1.00 P HETATM 396 OP1 AZW C 3 0.928 10.905 -10.340 1.00 1.00 O HETATM 397 OP2 AZW C 3 2.553 11.422 -8.430 1.00 1.00 O HETATM 398 O5' AZW C 3 0.144 10.989 -7.973 1.00 1.00 O HETATM 399 C5' AZW C 3 -1.162 10.513 -8.286 1.00 1.00 C HETATM 400 C1A AZW C 3 -1.828 9.983 -7.034 1.00 1.00 C HETATM 401 C2A AZW C 3 -2.609 8.819 -7.101 1.00 1.00 C HETATM 402 C6A AZW C 3 -1.686 10.662 -5.815 1.00 1.00 C HETATM 403 C3A AZW C 3 -3.245 8.335 -5.951 1.00 1.00 C HETATM 404 C5A AZW C 3 -2.325 10.176 -4.666 1.00 1.00 C HETATM 405 C4A AZW C 3 -3.106 9.015 -4.733 1.00 1.00 C HETATM 406 N5A AZW C 3 -3.771 8.548 -3.580 1.00 1.00 N HETATM 407 C1B AZW C 3 -7.188 7.065 -0.137 1.00 1.00 C HETATM 408 C2B AZW C 3 -7.865 7.354 -1.331 1.00 1.00 C HETATM 409 C6B AZW C 3 -5.796 7.215 -0.071 1.00 1.00 C HETATM 410 C3B AZW C 3 -7.154 7.791 -2.451 1.00 1.00 C HETATM 411 C5B AZW C 3 -5.082 7.653 -1.194 1.00 1.00 C HETATM 412 C4B AZW C 3 -5.763 7.943 -2.387 1.00 1.00 C HETATM 413 N5B AZW C 3 -5.062 8.404 -3.527 1.00 1.00 N HETATM 414 C3' AZW C 3 -7.953 6.596 1.086 1.00 1.00 C HETATM 415 O3' AZW C 3 -9.278 7.119 1.091 1.00 1.00 O ATOM 428 P DG C 4 -10.514 6.157 0.739 1.00 1.00 P ATOM 429 OP1 DG C 4 -11.566 7.003 0.128 1.00 1.00 O ATOM 430 OP2 DG C 4 -10.841 5.354 1.941 1.00 1.00 O ATOM 431 O5' DG C 4 -9.954 5.186 -0.391 1.00 1.00 O ATOM 432 C5' DG C 4 -10.686 4.036 -0.810 1.00 1.00 C ATOM 433 C4' DG C 4 -10.641 3.917 -2.317 1.00 1.00 C ATOM 434 O4' DG C 4 -9.397 4.482 -2.799 1.00 1.00 O ATOM 435 C3' DG C 4 -10.670 2.490 -2.865 1.00 1.00 C ATOM 436 O3' DG C 4 -11.254 2.480 -4.176 1.00 1.00 O ATOM 437 C2' DG C 4 -9.195 2.144 -2.920 1.00 1.00 C ATOM 438 C1' DG C 4 -8.597 3.461 -3.378 1.00 1.00 C ATOM 439 N9 DG C 4 -7.210 3.695 -2.983 1.00 1.00 N ATOM 440 C8 DG C 4 -6.196 4.122 -3.803 1.00 1.00 C ATOM 441 N7 DG C 4 -5.064 4.293 -3.181 1.00 1.00 N ATOM 442 C5 DG C 4 -5.343 3.955 -1.865 1.00 1.00 C ATOM 443 C6 DG C 4 -4.497 3.947 -0.730 1.00 1.00 C ATOM 444 O6 DG C 4 -3.296 4.244 -0.673 1.00 1.00 O ATOM 445 N1 DG C 4 -5.166 3.540 0.420 1.00 1.00 N ATOM 446 C2 DG C 4 -6.493 3.183 0.456 1.00 1.00 C ATOM 447 N2 DG C 4 -6.982 2.816 1.651 1.00 1.00 N ATOM 448 N3 DG C 4 -7.295 3.185 -0.597 1.00 1.00 N ATOM 449 C4 DG C 4 -6.661 3.580 -1.722 1.00 1.00 C ATOM 0 H5' DG C 4 -11.720 4.110 -0.473 1.00 1.00 H new ATOM 0 H5'' DG C 4 -10.265 3.140 -0.353 1.00 1.00 H new ATOM 0 H4' DG C 4 -11.540 4.433 -2.656 1.00 1.00 H new ATOM 0 H3' DG C 4 -11.257 1.789 -2.272 1.00 1.00 H new ATOM 0 H2' DG C 4 -8.809 1.833 -1.949 1.00 1.00 H new ATOM 0 H2'' DG C 4 -8.989 1.334 -3.619 1.00 1.00 H new ATOM 0 H1' DG C 4 -8.588 3.449 -4.468 1.00 1.00 H new ATOM 0 H8 DG C 4 -6.324 4.299 -4.861 1.00 1.00 H new ATOM 0 H1 DG C 4 -4.638 3.504 1.292 1.00 1.00 H new ATOM 0 H21 DG C 4 -7.960 2.541 1.739 1.00 1.00 H new ATOM 0 H22 DG C 4 -6.375 2.813 2.471 1.00 1.00 H new ATOM 461 P DG C 5 -11.667 1.100 -4.887 1.00 1.00 P ATOM 462 OP1 DG C 5 -12.572 1.423 -6.019 1.00 1.00 O ATOM 463 OP2 DG C 5 -12.128 0.163 -3.834 1.00 1.00 O ATOM 464 O5' DG C 5 -10.302 0.547 -5.492 1.00 1.00 O ATOM 465 C5' DG C 5 -9.635 1.256 -6.535 1.00 1.00 C ATOM 466 C4' DG C 5 -8.253 0.699 -6.781 1.00 1.00 C ATOM 467 O4' DG C 5 -7.303 1.286 -5.868 1.00 1.00 O ATOM 468 C3' DG C 5 -8.068 -0.796 -6.537 1.00 1.00 C ATOM 469 O3' DG C 5 -8.513 -1.561 -7.663 1.00 1.00 O ATOM 470 C2' DG C 5 -6.563 -0.915 -6.355 1.00 1.00 C ATOM 471 C1' DG C 5 -6.131 0.485 -5.908 1.00 1.00 C ATOM 472 N9 DG C 5 -5.491 0.525 -4.596 1.00 1.00 N ATOM 473 C8 DG C 5 -6.014 0.102 -3.397 1.00 1.00 C ATOM 474 N7 DG C 5 -5.186 0.243 -2.397 1.00 1.00 N ATOM 475 C5 DG C 5 -4.046 0.790 -2.970 1.00 1.00 C ATOM 476 C6 DG C 5 -2.807 1.163 -2.379 1.00 1.00 C ATOM 477 O6 DG C 5 -2.456 1.067 -1.192 1.00 1.00 O ATOM 478 N1 DG C 5 -1.918 1.681 -3.318 1.00 1.00 N ATOM 479 C2 DG C 5 -2.198 1.817 -4.660 1.00 1.00 C ATOM 480 N2 DG C 5 -1.224 2.326 -5.425 1.00 1.00 N ATOM 481 N3 DG C 5 -3.344 1.474 -5.221 1.00 1.00 N ATOM 482 C4 DG C 5 -4.218 0.971 -4.325 1.00 1.00 C ATOM 0 H5' DG C 5 -9.562 2.311 -6.272 1.00 1.00 H new ATOM 0 H5'' DG C 5 -10.222 1.196 -7.451 1.00 1.00 H new ATOM 0 H4' DG C 5 -8.104 0.924 -7.837 1.00 1.00 H new ATOM 0 H3' DG C 5 -8.640 -1.173 -5.689 1.00 1.00 H new ATOM 0 H2' DG C 5 -6.310 -1.668 -5.609 1.00 1.00 H new ATOM 0 H2'' DG C 5 -6.071 -1.207 -7.283 1.00 1.00 H new ATOM 0 HO3' DG C 5 -8.382 -2.515 -7.482 1.00 1.00 H new ATOM 0 H1' DG C 5 -5.385 0.845 -6.616 1.00 1.00 H new ATOM 0 H8 DG C 5 -7.009 -0.306 -3.293 1.00 1.00 H new ATOM 0 H1 DG C 5 -0.999 1.979 -2.990 1.00 1.00 H new ATOM 0 H21 DG C 5 -1.374 2.450 -6.426 1.00 1.00 H new ATOM 0 H22 DG C 5 -0.332 2.590 -5.006 1.00 1.00 H new TER 495 DG C 5 ATOM 496 O5' DG D 1 -6.865 -3.862 2.588 1.00 1.00 O ATOM 497 C5' DG D 1 -7.931 -3.572 3.484 1.00 1.00 C ATOM 498 C4' DG D 1 -7.400 -3.326 4.875 1.00 1.00 C ATOM 499 O4' DG D 1 -5.990 -3.014 4.778 1.00 1.00 O ATOM 500 C3' DG D 1 -8.042 -2.153 5.619 1.00 1.00 C ATOM 501 O3' DG D 1 -8.216 -2.494 6.998 1.00 1.00 O ATOM 502 C2' DG D 1 -7.028 -1.037 5.456 1.00 1.00 C ATOM 503 C1' DG D 1 -5.721 -1.802 5.462 1.00 1.00 C ATOM 504 N9 DG D 1 -4.606 -1.136 4.795 1.00 1.00 N ATOM 505 C8 DG D 1 -3.414 -0.767 5.369 1.00 1.00 C ATOM 506 N7 DG D 1 -2.590 -0.198 4.532 1.00 1.00 N ATOM 507 C5 DG D 1 -3.281 -0.188 3.329 1.00 1.00 C ATOM 508 C6 DG D 1 -2.891 0.306 2.057 1.00 1.00 C ATOM 509 O6 DG D 1 -1.814 0.835 1.734 1.00 1.00 O ATOM 510 N1 DG D 1 -3.884 0.125 1.100 1.00 1.00 N ATOM 511 C2 DG D 1 -5.104 -0.468 1.350 1.00 1.00 C ATOM 512 N2 DG D 1 -5.940 -0.581 0.308 1.00 1.00 N ATOM 513 N3 DG D 1 -5.479 -0.932 2.531 1.00 1.00 N ATOM 514 C4 DG D 1 -4.526 -0.762 3.471 1.00 1.00 C ATOM 0 H5' DG D 1 -8.637 -4.402 3.499 1.00 1.00 H new ATOM 0 H5'' DG D 1 -8.478 -2.695 3.137 1.00 1.00 H new ATOM 0 H4' DG D 1 -7.625 -4.235 5.433 1.00 1.00 H new ATOM 0 H3' DG D 1 -9.027 -1.879 5.242 1.00 1.00 H new ATOM 0 H2' DG D 1 -7.174 -0.484 4.528 1.00 1.00 H new ATOM 0 H2'' DG D 1 -7.082 -0.314 6.270 1.00 1.00 H new ATOM 0 HO5' DG D 1 -6.016 -3.576 2.986 1.00 1.00 H new ATOM 0 H1' DG D 1 -5.403 -1.919 6.498 1.00 1.00 H new ATOM 0 H8 DG D 1 -3.181 -0.932 6.411 1.00 1.00 H new ATOM 0 H1 DG D 1 -3.698 0.452 0.152 1.00 1.00 H new ATOM 0 H21 DG D 1 -6.856 -1.011 0.434 1.00 1.00 H new ATOM 0 H22 DG D 1 -5.660 -0.237 -0.610 1.00 1.00 H new ATOM 527 P DG D 2 -9.205 -1.633 7.921 1.00 1.00 P ATOM 528 OP1 DG D 2 -9.586 -2.479 9.076 1.00 1.00 O ATOM 529 OP2 DG D 2 -10.268 -1.051 7.068 1.00 1.00 O ATOM 530 O5' DG D 2 -8.286 -0.455 8.464 1.00 1.00 O ATOM 531 C5' DG D 2 -7.138 -0.742 9.261 1.00 1.00 C ATOM 532 C4' DG D 2 -6.247 0.473 9.357 1.00 1.00 C ATOM 533 O4' DG D 2 -5.564 0.662 8.094 1.00 1.00 O ATOM 534 C3' DG D 2 -6.983 1.784 9.643 1.00 1.00 C ATOM 535 O3' DG D 2 -6.541 2.406 10.872 1.00 1.00 O ATOM 536 C2' DG D 2 -6.714 2.641 8.416 1.00 1.00 C ATOM 537 C1' DG D 2 -5.426 2.050 7.876 1.00 1.00 C ATOM 538 N9 DG D 2 -5.182 2.301 6.457 1.00 1.00 N ATOM 539 C8 DG D 2 -6.068 2.168 5.417 1.00 1.00 C ATOM 540 N7 DG D 2 -5.571 2.524 4.263 1.00 1.00 N ATOM 541 C5 DG D 2 -4.271 2.914 4.560 1.00 1.00 C ATOM 542 C6 DG D 2 -3.242 3.401 3.712 1.00 1.00 C ATOM 543 O6 DG D 2 -3.279 3.581 2.487 1.00 1.00 O ATOM 544 N1 DG D 2 -2.074 3.680 4.416 1.00 1.00 N ATOM 545 C2 DG D 2 -1.929 3.511 5.775 1.00 1.00 C ATOM 546 N2 DG D 2 -0.740 3.837 6.302 1.00 1.00 N ATOM 547 N3 DG D 2 -2.879 3.057 6.575 1.00 1.00 N ATOM 548 C4 DG D 2 -4.017 2.780 5.906 1.00 1.00 C ATOM 0 H5' DG D 2 -6.584 -1.574 8.826 1.00 1.00 H new ATOM 0 H5'' DG D 2 -7.448 -1.053 10.259 1.00 1.00 H new ATOM 0 H4' DG D 2 -5.578 0.269 10.193 1.00 1.00 H new ATOM 0 H3' DG D 2 -8.050 1.632 9.803 1.00 1.00 H new ATOM 0 H2' DG D 2 -7.525 2.576 7.691 1.00 1.00 H new ATOM 0 H2'' DG D 2 -6.600 3.694 8.674 1.00 1.00 H new ATOM 0 H1' DG D 2 -4.575 2.510 8.378 1.00 1.00 H new ATOM 0 H8 DG D 2 -7.077 1.804 5.541 1.00 1.00 H new ATOM 0 H1 DG D 2 -1.274 4.033 3.891 1.00 1.00 H new ATOM 0 H21 DG D 2 -0.580 3.731 7.304 1.00 1.00 H new ATOM 0 H22 DG D 2 0.004 4.191 5.701 1.00 1.00 H new HETATM 560 P AZW D 3 -5.026 2.844 11.228 1.00 1.00 P HETATM 561 OP1 AZW D 3 -4.111 1.699 11.018 1.00 1.00 O HETATM 562 OP2 AZW D 3 -5.065 3.473 12.569 1.00 1.00 O HETATM 563 O5' AZW D 3 -4.638 3.964 10.168 1.00 1.00 O HETATM 564 C5' AZW D 3 -5.136 5.293 10.268 1.00 1.00 C HETATM 565 C1A AZW D 3 -4.389 6.163 9.286 1.00 1.00 C HETATM 566 C2A AZW D 3 -3.483 7.126 9.751 1.00 1.00 C HETATM 567 C6A AZW D 3 -4.566 5.975 7.908 1.00 1.00 C HETATM 568 C3A AZW D 3 -2.748 7.894 8.840 1.00 1.00 C HETATM 569 C5A AZW D 3 -3.830 6.743 6.998 1.00 1.00 C HETATM 570 C4A AZW D 3 -2.920 7.702 7.463 1.00 1.00 C HETATM 571 N5A AZW D 3 -2.156 8.448 6.543 1.00 1.00 N HETATM 572 C1B AZW D 3 1.226 10.053 3.134 1.00 1.00 C HETATM 573 C2B AZW D 3 1.389 10.261 4.514 1.00 1.00 C HETATM 574 C6B AZW D 3 0.262 9.145 2.675 1.00 1.00 C HETATM 575 C3B AZW D 3 0.593 9.561 5.426 1.00 1.00 C HETATM 576 C5B AZW D 3 -0.536 8.446 3.592 1.00 1.00 C HETATM 577 C4B AZW D 3 -0.369 8.654 4.967 1.00 1.00 C HETATM 578 N5B AZW D 3 -1.154 7.933 5.892 1.00 1.00 N HETATM 579 C3' AZW D 3 2.094 10.794 2.134 1.00 1.00 C HETATM 580 O3' AZW D 3 2.748 11.904 2.742 1.00 1.00 O ATOM 593 P DG D 4 4.291 11.788 3.171 1.00 1.00 P ATOM 594 OP1 DG D 4 4.535 12.751 4.273 1.00 1.00 O ATOM 595 OP2 DG D 4 5.101 11.873 1.932 1.00 1.00 O ATOM 596 O5' DG D 4 4.427 10.313 3.755 1.00 1.00 O ATOM 597 C5' DG D 4 5.698 9.667 3.837 1.00 1.00 C ATOM 598 C4' DG D 4 5.801 8.896 5.133 1.00 1.00 C ATOM 599 O4' DG D 4 4.505 8.323 5.443 1.00 1.00 O ATOM 600 C3' DG D 4 6.772 7.713 5.115 1.00 1.00 C ATOM 601 O3' DG D 4 7.316 7.506 6.425 1.00 1.00 O ATOM 602 C2' DG D 4 5.864 6.565 4.719 1.00 1.00 C ATOM 603 C1' DG D 4 4.615 6.909 5.506 1.00 1.00 C ATOM 604 N9 DG D 4 3.372 6.324 5.009 1.00 1.00 N ATOM 605 C8 DG D 4 2.450 5.629 5.753 1.00 1.00 C ATOM 606 N7 DG D 4 1.428 5.213 5.055 1.00 1.00 N ATOM 607 C5 DG D 4 1.691 5.661 3.769 1.00 1.00 C ATOM 608 C6 DG D 4 0.935 5.508 2.582 1.00 1.00 C ATOM 609 O6 DG D 4 -0.150 4.928 2.442 1.00 1.00 O ATOM 610 N1 DG D 4 1.546 6.109 1.486 1.00 1.00 N ATOM 611 C2 DG D 4 2.748 6.779 1.543 1.00 1.00 C ATOM 612 N2 DG D 4 3.183 7.323 0.395 1.00 1.00 N ATOM 613 N3 DG D 4 3.465 6.927 2.646 1.00 1.00 N ATOM 614 C4 DG D 4 2.884 6.348 3.719 1.00 1.00 C ATOM 0 H5' DG D 4 6.496 10.407 3.780 1.00 1.00 H new ATOM 0 H5'' DG D 4 5.828 8.992 2.991 1.00 1.00 H new ATOM 0 H4' DG D 4 6.163 9.624 5.859 1.00 1.00 H new ATOM 0 H3' DG D 4 7.626 7.842 4.450 1.00 1.00 H new ATOM 0 H2' DG D 4 5.681 6.534 3.645 1.00 1.00 H new ATOM 0 H2'' DG D 4 6.276 5.596 5.000 1.00 1.00 H new ATOM 0 H1' DG D 4 4.731 6.500 6.510 1.00 1.00 H new ATOM 0 H8 DG D 4 2.560 5.445 6.811 1.00 1.00 H new ATOM 0 H1 DG D 4 1.074 6.050 0.584 1.00 1.00 H new ATOM 0 H21 DG D 4 4.067 7.832 0.374 1.00 1.00 H new ATOM 0 H22 DG D 4 2.630 7.227 -0.456 1.00 1.00 H new ATOM 626 P DG D 5 8.488 6.432 6.673 1.00 1.00 P ATOM 627 OP1 DG D 5 9.074 6.730 8.004 1.00 1.00 O ATOM 628 OP2 DG D 5 9.366 6.403 5.478 1.00 1.00 O ATOM 629 O5' DG D 5 7.733 5.037 6.778 1.00 1.00 O ATOM 630 C5' DG D 5 6.889 4.750 7.892 1.00 1.00 C ATOM 631 C4' DG D 5 6.221 3.403 7.731 1.00 1.00 C ATOM 632 O4' DG D 5 5.127 3.493 6.801 1.00 1.00 O ATOM 633 C3' DG D 5 7.088 2.295 7.140 1.00 1.00 C ATOM 634 O3' DG D 5 7.847 1.642 8.166 1.00 1.00 O ATOM 635 C2' DG D 5 6.068 1.345 6.526 1.00 1.00 C ATOM 636 C1' DG D 5 4.779 2.163 6.458 1.00 1.00 C ATOM 637 N9 DG D 5 4.125 2.172 5.151 1.00 1.00 N ATOM 638 C8 DG D 5 4.647 2.606 3.954 1.00 1.00 C ATOM 639 N7 DG D 5 3.808 2.497 2.958 1.00 1.00 N ATOM 640 C5 DG D 5 2.664 1.958 3.530 1.00 1.00 C ATOM 641 C6 DG D 5 1.414 1.614 2.942 1.00 1.00 C ATOM 642 O6 DG D 5 1.064 1.716 1.753 1.00 1.00 O ATOM 643 N1 DG D 5 0.525 1.096 3.880 1.00 1.00 N ATOM 644 C2 DG D 5 0.811 0.930 5.217 1.00 1.00 C ATOM 645 N2 DG D 5 -0.164 0.404 5.975 1.00 1.00 N ATOM 646 N3 DG D 5 1.969 1.245 5.775 1.00 1.00 N ATOM 647 C4 DG D 5 2.843 1.751 4.881 1.00 1.00 C ATOM 0 H5' DG D 5 6.131 5.527 7.988 1.00 1.00 H new ATOM 0 H5'' DG D 5 7.476 4.762 8.810 1.00 1.00 H new ATOM 0 H4' DG D 5 5.945 3.152 8.755 1.00 1.00 H new ATOM 0 H3' DG D 5 7.819 2.659 6.418 1.00 1.00 H new ATOM 0 H2' DG D 5 6.380 1.013 5.536 1.00 1.00 H new ATOM 0 H2'' DG D 5 5.940 0.451 7.137 1.00 1.00 H new ATOM 0 HO3' DG D 5 8.395 0.934 7.767 1.00 1.00 H new ATOM 0 H1' DG D 5 4.061 1.705 7.138 1.00 1.00 H new ATOM 0 H8 DG D 5 5.648 2.997 3.848 1.00 1.00 H new ATOM 0 H1 DG D 5 -0.402 0.821 3.555 1.00 1.00 H new ATOM 0 H21 DG D 5 -0.011 0.257 6.973 1.00 1.00 H new ATOM 0 H22 DG D 5 -1.058 0.151 5.553 1.00 1.00 H new TER 660 DG D 5 HETATM 661 K K A 101 1.093 -3.970 -0.803 1.00 1.00 K HETATM 662 K K A 102 -0.217 -0.341 -0.131 1.00 1.00 K HETATM 663 K K C 101 -1.254 3.383 0.685 1.00 1.00 K