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 -69:sc= 0.7 USER MOD Single : A 5 DG O3' : rot 180:sc= 0 USER MOD Single : B 1 DG O5' : rot -73:sc= 0.591 USER MOD Single : B 5 DG O3' : rot 180:sc= 0 USER MOD Single : C 1 DG O5' : rot -75:sc= 0.614 USER MOD Single : C 5 DG O3' : rot 180:sc= 0 USER MOD Single : D 1 DG O5' : rot -18:sc= 0.704 USER MOD Single : D 5 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -7.701 -2.653 -1.080 1.00 1.00 O ATOM 2 C5' DG A 1 -8.497 -3.628 -1.749 1.00 1.00 C ATOM 3 C4' DG A 1 -8.260 -3.586 -3.240 1.00 1.00 C ATOM 4 O4' DG A 1 -7.016 -2.889 -3.495 1.00 1.00 O ATOM 5 C3' DG A 1 -8.104 -4.951 -3.911 1.00 1.00 C ATOM 6 O3' DG A 1 -8.571 -4.883 -5.264 1.00 1.00 O ATOM 7 C2' DG A 1 -6.601 -5.153 -3.872 1.00 1.00 C ATOM 8 C1' DG A 1 -6.130 -3.752 -4.194 1.00 1.00 C ATOM 9 N9 DG A 1 -4.762 -3.426 -3.800 1.00 1.00 N ATOM 10 C8 DG A 1 -3.762 -2.992 -4.637 1.00 1.00 C ATOM 11 N7 DG A 1 -2.649 -2.719 -4.015 1.00 1.00 N ATOM 12 C5 DG A 1 -2.927 -2.993 -2.684 1.00 1.00 C ATOM 13 C6 DG A 1 -2.095 -2.884 -1.542 1.00 1.00 C ATOM 14 O6 DG A 1 -0.916 -2.503 -1.487 1.00 1.00 O ATOM 15 N1 DG A 1 -2.755 -3.261 -0.378 1.00 1.00 N ATOM 16 C2 DG A 1 -4.061 -3.690 -0.330 1.00 1.00 C ATOM 17 N2 DG A 1 -4.538 -3.999 0.885 1.00 1.00 N ATOM 18 N3 DG A 1 -4.852 -3.797 -1.390 1.00 1.00 N ATOM 19 C4 DG A 1 -4.225 -3.434 -2.530 1.00 1.00 C ATOM 0 H5' DG A 1 -9.551 -3.449 -1.539 1.00 1.00 H new ATOM 0 H5'' DG A 1 -8.260 -4.621 -1.367 1.00 1.00 H new ATOM 0 H4' DG A 1 -9.146 -3.102 -3.650 1.00 1.00 H new ATOM 0 H3' DG A 1 -8.664 -5.755 -3.433 1.00 1.00 H new ATOM 0 H2' DG A 1 -6.253 -5.494 -2.897 1.00 1.00 H new ATOM 0 H2'' DG A 1 -6.261 -5.884 -4.605 1.00 1.00 H new ATOM 0 HO5' DG A 1 -6.757 -2.911 -1.130 1.00 1.00 H new ATOM 0 H1' DG A 1 -6.132 -3.646 -5.279 1.00 1.00 H new ATOM 0 H8 DG A 1 -3.886 -2.887 -5.705 1.00 1.00 H new ATOM 0 H1 DG A 1 -2.236 -3.217 0.499 1.00 1.00 H new ATOM 0 H21 DG A 1 -5.500 -4.323 0.988 1.00 1.00 H new ATOM 0 H22 DG A 1 -3.939 -3.910 1.706 1.00 1.00 H new ATOM 32 P DG A 2 -8.829 -6.223 -6.110 1.00 1.00 P ATOM 33 OP1 DG A 2 -9.760 -5.873 -7.207 1.00 1.00 O ATOM 34 OP2 DG A 2 -9.191 -7.309 -5.167 1.00 1.00 O ATOM 35 O5' DG A 2 -7.413 -6.567 -6.751 1.00 1.00 O ATOM 36 C5' DG A 2 -6.877 -5.779 -7.816 1.00 1.00 C ATOM 37 C4' DG A 2 -5.435 -6.147 -8.082 1.00 1.00 C ATOM 38 O4' DG A 2 -4.604 -5.738 -6.964 1.00 1.00 O ATOM 39 C3' DG A 2 -5.158 -7.643 -8.253 1.00 1.00 C ATOM 40 O3' DG A 2 -4.100 -7.835 -9.194 1.00 1.00 O ATOM 41 C2' DG A 2 -4.651 -8.031 -6.877 1.00 1.00 C ATOM 42 C1' DG A 2 -3.764 -6.832 -6.639 1.00 1.00 C ATOM 43 N9 DG A 2 -3.228 -6.660 -5.293 1.00 1.00 N ATOM 44 C8 DG A 2 -3.780 -7.060 -4.099 1.00 1.00 C ATOM 45 N7 DG A 2 -3.012 -6.818 -3.070 1.00 1.00 N ATOM 46 C5 DG A 2 -1.885 -6.219 -3.618 1.00 1.00 C ATOM 47 C6 DG A 2 -0.705 -5.732 -2.996 1.00 1.00 C ATOM 48 O6 DG A 2 -0.420 -5.728 -1.790 1.00 1.00 O ATOM 49 N1 DG A 2 0.193 -5.197 -3.918 1.00 1.00 N ATOM 50 C2 DG A 2 -0.034 -5.140 -5.275 1.00 1.00 C ATOM 51 N2 DG A 2 0.924 -4.577 -6.025 1.00 1.00 N ATOM 52 N3 DG A 2 -1.129 -5.588 -5.866 1.00 1.00 N ATOM 53 C4 DG A 2 -2.005 -6.111 -4.986 1.00 1.00 C ATOM 0 H5' DG A 2 -6.946 -4.721 -7.562 1.00 1.00 H new ATOM 0 H5'' DG A 2 -7.468 -5.930 -8.719 1.00 1.00 H new ATOM 0 H4' DG A 2 -5.210 -5.639 -9.020 1.00 1.00 H new ATOM 0 H3' DG A 2 -6.021 -8.210 -8.601 1.00 1.00 H new ATOM 0 H2' DG A 2 -5.448 -8.124 -6.140 1.00 1.00 H new ATOM 0 H2'' DG A 2 -4.103 -8.973 -6.875 1.00 1.00 H new ATOM 0 H1' DG A 2 -2.858 -6.939 -7.236 1.00 1.00 H new ATOM 0 H8 DG A 2 -4.751 -7.527 -4.020 1.00 1.00 H new ATOM 0 H1 DG A 2 1.074 -4.824 -3.565 1.00 1.00 H new ATOM 0 H21 DG A 2 0.806 -4.509 -7.036 1.00 1.00 H new ATOM 0 H22 DG A 2 1.770 -4.216 -5.585 1.00 1.00 H new HETATM 65 P AZW A 3 -4.371 -7.949 -10.769 1.00 1.00 P HETATM 66 OP1 AZW A 3 -4.656 -6.598 -11.308 1.00 1.00 O HETATM 67 OP2 AZW A 3 -5.343 -9.046 -10.980 1.00 1.00 O HETATM 68 O5' AZW A 3 -2.955 -8.423 -11.314 1.00 1.00 O HETATM 69 C5' AZW A 3 -2.246 -9.443 -10.616 1.00 1.00 C HETATM 70 C1A AZW A 3 -1.135 -8.849 -9.779 1.00 1.00 C HETATM 71 C2A AZW A 3 -0.272 -7.882 -10.312 1.00 1.00 C HETATM 72 C6A AZW A 3 -0.947 -9.303 -8.468 1.00 1.00 C HETATM 73 C3A AZW A 3 0.782 -7.377 -9.530 1.00 1.00 C HETATM 74 C5A AZW A 3 0.099 -8.803 -7.691 1.00 1.00 C HETATM 75 C4A AZW A 3 0.968 -7.842 -8.219 1.00 1.00 C HETATM 76 N5A AZW A 3 2.048 -7.375 -7.433 1.00 1.00 N HETATM 77 C1B AZW A 3 6.135 -7.078 -4.405 1.00 1.00 C HETATM 78 C2B AZW A 3 6.308 -7.220 -5.791 1.00 1.00 C HETATM 79 C6B AZW A 3 4.870 -7.277 -3.838 1.00 1.00 C HETATM 80 C3B AZW A 3 5.220 -7.569 -6.601 1.00 1.00 C HETATM 81 C5B AZW A 3 3.784 -7.625 -4.649 1.00 1.00 C HETATM 82 C4B AZW A 3 3.956 -7.776 -6.028 1.00 1.00 C HETATM 83 N5B AZW A 3 2.867 -8.190 -6.830 1.00 1.00 N HETATM 84 C3' AZW A 3 7.312 -6.737 -3.516 1.00 1.00 C HETATM 85 O3' AZW A 3 8.524 -7.275 -4.038 1.00 1.00 O ATOM 98 P DG A 4 9.719 -6.296 -4.476 1.00 1.00 P ATOM 99 OP1 DG A 4 10.527 -6.990 -5.507 1.00 1.00 O ATOM 100 OP2 DG A 4 10.377 -5.809 -3.241 1.00 1.00 O ATOM 101 O5' DG A 4 8.983 -5.069 -5.172 1.00 1.00 O ATOM 102 C5' DG A 4 9.631 -3.809 -5.331 1.00 1.00 C ATOM 103 C4' DG A 4 9.085 -3.108 -6.553 1.00 1.00 C ATOM 104 O4' DG A 4 7.722 -3.546 -6.776 1.00 1.00 O ATOM 105 C3' DG A 4 9.014 -1.585 -6.460 1.00 1.00 C ATOM 106 O3' DG A 4 9.157 -1.010 -7.765 1.00 1.00 O ATOM 107 C2' DG A 4 7.616 -1.351 -5.916 1.00 1.00 C ATOM 108 C1' DG A 4 6.826 -2.457 -6.600 1.00 1.00 C ATOM 109 N9 DG A 4 5.651 -2.945 -5.878 1.00 1.00 N ATOM 110 C8 DG A 4 4.420 -3.204 -6.428 1.00 1.00 C ATOM 111 N7 DG A 4 3.545 -3.640 -5.563 1.00 1.00 N ATOM 112 C5 DG A 4 4.239 -3.671 -4.363 1.00 1.00 C ATOM 113 C6 DG A 4 3.803 -4.058 -3.073 1.00 1.00 C ATOM 114 O6 DG A 4 2.681 -4.456 -2.735 1.00 1.00 O ATOM 115 N1 DG A 4 4.811 -3.945 -2.120 1.00 1.00 N ATOM 116 C2 DG A 4 6.087 -3.506 -2.394 1.00 1.00 C ATOM 117 N2 DG A 4 6.937 -3.451 -1.359 1.00 1.00 N ATOM 118 N3 DG A 4 6.506 -3.141 -3.595 1.00 1.00 N ATOM 119 C4 DG A 4 5.539 -3.245 -4.533 1.00 1.00 C ATOM 0 H5' DG A 4 10.707 -3.952 -5.432 1.00 1.00 H new ATOM 0 H5'' DG A 4 9.473 -3.193 -4.445 1.00 1.00 H new ATOM 0 H4' DG A 4 9.782 -3.365 -7.350 1.00 1.00 H new ATOM 0 H3' DG A 4 9.794 -1.140 -5.842 1.00 1.00 H new ATOM 0 H2' DG A 4 7.581 -1.435 -4.830 1.00 1.00 H new ATOM 0 H2'' DG A 4 7.238 -0.361 -6.171 1.00 1.00 H new ATOM 0 H1' DG A 4 6.434 -2.035 -7.526 1.00 1.00 H new ATOM 0 H8 DG A 4 4.197 -3.061 -7.475 1.00 1.00 H new ATOM 0 H1 DG A 4 4.591 -4.204 -1.158 1.00 1.00 H new ATOM 0 H21 DG A 4 7.896 -3.133 -1.503 1.00 1.00 H new ATOM 0 H22 DG A 4 6.625 -3.727 -0.428 1.00 1.00 H new ATOM 131 P DG A 5 9.274 0.580 -7.944 1.00 1.00 P ATOM 132 OP1 DG A 5 10.000 0.841 -9.208 1.00 1.00 O ATOM 133 OP2 DG A 5 9.800 1.142 -6.678 1.00 1.00 O ATOM 134 O5' DG A 5 7.767 1.060 -8.122 1.00 1.00 O ATOM 135 C5' DG A 5 6.961 0.540 -9.179 1.00 1.00 C ATOM 136 C4' DG A 5 5.511 0.924 -8.995 1.00 1.00 C ATOM 137 O4' DG A 5 4.847 0.004 -8.104 1.00 1.00 O ATOM 138 C3' DG A 5 5.254 2.274 -8.336 1.00 1.00 C ATOM 139 O3' DG A 5 5.405 3.343 -9.275 1.00 1.00 O ATOM 140 C2' DG A 5 3.809 2.129 -7.887 1.00 1.00 C ATOM 141 C1' DG A 5 3.658 0.628 -7.634 1.00 1.00 C ATOM 142 N9 DG A 5 3.475 0.279 -6.229 1.00 1.00 N ATOM 143 C8 DG A 5 4.366 0.483 -5.203 1.00 1.00 C ATOM 144 N7 DG A 5 3.923 0.073 -4.045 1.00 1.00 N ATOM 145 C5 DG A 5 2.659 -0.431 -4.322 1.00 1.00 C ATOM 146 C6 DG A 5 1.693 -1.014 -3.457 1.00 1.00 C ATOM 147 O6 DG A 5 1.765 -1.199 -2.232 1.00 1.00 O ATOM 148 N1 DG A 5 0.542 -1.396 -4.141 1.00 1.00 N ATOM 149 C2 DG A 5 0.354 -1.229 -5.493 1.00 1.00 C ATOM 150 N2 DG A 5 -0.812 -1.664 -5.986 1.00 1.00 N ATOM 151 N3 DG A 5 1.243 -0.686 -6.311 1.00 1.00 N ATOM 152 C4 DG A 5 2.368 -0.312 -5.663 1.00 1.00 C ATOM 0 H5' DG A 5 7.052 -0.546 -9.210 1.00 1.00 H new ATOM 0 H5'' DG A 5 7.322 0.917 -10.136 1.00 1.00 H new ATOM 0 H4' DG A 5 5.145 0.931 -10.022 1.00 1.00 H new ATOM 0 H3' DG A 5 5.944 2.513 -7.527 1.00 1.00 H new ATOM 0 H2' DG A 5 3.609 2.709 -6.986 1.00 1.00 H new ATOM 0 H2'' DG A 5 3.115 2.478 -8.651 1.00 1.00 H new ATOM 0 HO3' DG A 5 5.233 4.198 -8.828 1.00 1.00 H new ATOM 0 H1' DG A 5 2.760 0.291 -8.152 1.00 1.00 H new ATOM 0 H8 DG A 5 5.336 0.937 -5.341 1.00 1.00 H new ATOM 0 H1 DG A 5 -0.211 -1.828 -3.605 1.00 1.00 H new ATOM 0 H21 DG A 5 -1.012 -1.569 -6.982 1.00 1.00 H new ATOM 0 H22 DG A 5 -1.500 -2.091 -5.366 1.00 1.00 H new TER 165 DG A 5 ATOM 166 O5' DG B 1 7.508 2.422 0.919 1.00 1.00 O ATOM 167 C5' DG B 1 8.826 1.935 1.168 1.00 1.00 C ATOM 168 C4' DG B 1 8.906 1.317 2.543 1.00 1.00 C ATOM 169 O4' DG B 1 7.560 1.014 2.985 1.00 1.00 O ATOM 170 C3' DG B 1 9.677 -0.001 2.617 1.00 1.00 C ATOM 171 O3' DG B 1 10.359 -0.106 3.875 1.00 1.00 O ATOM 172 C2' DG B 1 8.575 -1.040 2.505 1.00 1.00 C ATOM 173 C1' DG B 1 7.448 -0.373 3.267 1.00 1.00 C ATOM 174 N9 DG B 1 6.102 -0.808 2.903 1.00 1.00 N ATOM 175 C8 DG B 1 5.162 -1.346 3.749 1.00 1.00 C ATOM 176 N7 DG B 1 4.035 -1.632 3.156 1.00 1.00 N ATOM 177 C5 DG B 1 4.243 -1.262 1.835 1.00 1.00 C ATOM 178 C6 DG B 1 3.371 -1.338 0.719 1.00 1.00 C ATOM 179 O6 DG B 1 2.201 -1.750 0.690 1.00 1.00 O ATOM 180 N1 DG B 1 3.966 -0.862 -0.445 1.00 1.00 N ATOM 181 C2 DG B 1 5.251 -0.366 -0.512 1.00 1.00 C ATOM 182 N2 DG B 1 5.660 0.083 -1.708 1.00 1.00 N ATOM 183 N3 DG B 1 6.073 -0.290 0.522 1.00 1.00 N ATOM 184 C4 DG B 1 5.511 -0.752 1.659 1.00 1.00 C ATOM 0 H5' DG B 1 9.544 2.751 1.087 1.00 1.00 H new ATOM 0 H5'' DG B 1 9.096 1.196 0.414 1.00 1.00 H new ATOM 0 H4' DG B 1 9.433 2.047 3.158 1.00 1.00 H new ATOM 0 H3' DG B 1 10.444 -0.108 1.850 1.00 1.00 H new ATOM 0 H2' DG B 1 8.306 -1.241 1.468 1.00 1.00 H new ATOM 0 H2'' DG B 1 8.863 -1.992 2.950 1.00 1.00 H new ATOM 0 HO5' DG B 1 6.903 1.666 0.766 1.00 1.00 H new ATOM 0 H1' DG B 1 7.557 -0.637 4.319 1.00 1.00 H new ATOM 0 H8 DG B 1 5.338 -1.515 4.801 1.00 1.00 H new ATOM 0 H1 DG B 1 3.416 -0.881 -1.304 1.00 1.00 H new ATOM 0 H21 DG B 1 6.601 0.461 -1.816 1.00 1.00 H new ATOM 0 H22 DG B 1 5.030 0.046 -2.509 1.00 1.00 H new ATOM 197 P DG B 2 11.361 -1.330 4.156 1.00 1.00 P ATOM 198 OP1 DG B 2 12.367 -0.861 5.139 1.00 1.00 O ATOM 199 OP2 DG B 2 11.816 -1.884 2.859 1.00 1.00 O ATOM 200 O5' DG B 2 10.446 -2.418 4.869 1.00 1.00 O ATOM 201 C5' DG B 2 9.741 -2.102 6.067 1.00 1.00 C ATOM 202 C4' DG B 2 8.782 -3.216 6.414 1.00 1.00 C ATOM 203 O4' DG B 2 7.676 -3.214 5.475 1.00 1.00 O ATOM 204 C3' DG B 2 9.380 -4.625 6.342 1.00 1.00 C ATOM 205 O3' DG B 2 8.863 -5.420 7.420 1.00 1.00 O ATOM 206 C2' DG B 2 8.883 -5.120 4.995 1.00 1.00 C ATOM 207 C1' DG B 2 7.491 -4.537 5.001 1.00 1.00 C ATOM 208 N9 DG B 2 6.809 -4.493 3.711 1.00 1.00 N ATOM 209 C8 DG B 2 7.339 -4.171 2.485 1.00 1.00 C ATOM 210 N7 DG B 2 6.466 -4.233 1.515 1.00 1.00 N ATOM 211 C5 DG B 2 5.288 -4.623 2.140 1.00 1.00 C ATOM 212 C6 DG B 2 3.997 -4.860 1.600 1.00 1.00 C ATOM 213 O6 DG B 2 3.624 -4.743 0.423 1.00 1.00 O ATOM 214 N1 DG B 2 3.087 -5.248 2.581 1.00 1.00 N ATOM 215 C2 DG B 2 3.396 -5.378 3.919 1.00 1.00 C ATOM 216 N2 DG B 2 2.400 -5.744 4.736 1.00 1.00 N ATOM 217 N3 DG B 2 4.593 -5.159 4.432 1.00 1.00 N ATOM 218 C4 DG B 2 5.486 -4.787 3.492 1.00 1.00 C ATOM 0 H5' DG B 2 9.195 -1.167 5.941 1.00 1.00 H new ATOM 0 H5'' DG B 2 10.446 -1.951 6.884 1.00 1.00 H new ATOM 0 H4' DG B 2 8.489 -3.015 7.444 1.00 1.00 H new ATOM 0 H3' DG B 2 10.466 -4.665 6.432 1.00 1.00 H new ATOM 0 H2' DG B 2 9.487 -4.750 4.166 1.00 1.00 H new ATOM 0 H2'' DG B 2 8.879 -6.208 4.926 1.00 1.00 H new ATOM 0 H1' DG B 2 6.847 -5.172 5.609 1.00 1.00 H new ATOM 0 H8 DG B 2 8.373 -3.895 2.338 1.00 1.00 H new ATOM 0 H1 DG B 2 2.130 -5.449 2.291 1.00 1.00 H new ATOM 0 H21 DG B 2 2.574 -5.855 5.735 1.00 1.00 H new ATOM 0 H22 DG B 2 1.467 -5.912 4.359 1.00 1.00 H new HETATM 230 P AZW B 3 9.214 -6.983 7.554 1.00 1.00 P HETATM 231 OP1 AZW B 3 9.230 -7.323 8.996 1.00 1.00 O HETATM 232 OP2 AZW B 3 10.419 -7.251 6.738 1.00 1.00 O HETATM 233 O5' AZW B 3 7.975 -7.725 6.880 1.00 1.00 O HETATM 234 C5' AZW B 3 6.653 -7.560 7.393 1.00 1.00 C HETATM 235 C1A AZW B 3 5.630 -8.068 6.397 1.00 1.00 C HETATM 236 C2A AZW B 3 4.285 -8.146 6.781 1.00 1.00 C HETATM 237 C6A AZW B 3 6.010 -8.454 5.100 1.00 1.00 C HETATM 238 C3A AZW B 3 3.321 -8.606 5.879 1.00 1.00 C HETATM 239 C5A AZW B 3 5.043 -8.914 4.197 1.00 1.00 C HETATM 240 C4A AZW B 3 3.697 -8.990 4.585 1.00 1.00 C HETATM 241 N5A AZW B 3 2.718 -9.429 3.666 1.00 1.00 N HETATM 242 C1B AZW B 3 -1.274 -11.430 1.292 1.00 1.00 C HETATM 243 C2B AZW B 3 -0.980 -12.209 2.425 1.00 1.00 C HETATM 244 C6B AZW B 3 -0.568 -10.243 1.061 1.00 1.00 C HETATM 245 C3B AZW B 3 0.017 -11.794 3.320 1.00 1.00 C HETATM 246 C5B AZW B 3 0.429 -9.832 1.954 1.00 1.00 C HETATM 247 C4B AZW B 3 0.720 -10.604 3.086 1.00 1.00 C HETATM 248 N5B AZW B 3 1.703 -10.171 4.003 1.00 1.00 N HETATM 249 C3' AZW B 3 -2.360 -11.849 0.319 1.00 1.00 C HETATM 250 O3' AZW B 3 -3.110 -12.953 0.815 1.00 1.00 O ATOM 263 P DG B 4 -4.380 -12.693 1.763 1.00 1.00 P ATOM 264 OP1 DG B 4 -4.561 -13.882 2.627 1.00 1.00 O ATOM 265 OP2 DG B 4 -5.500 -12.245 0.902 1.00 1.00 O ATOM 266 O5' DG B 4 -3.938 -11.473 2.681 1.00 1.00 O ATOM 267 C5' DG B 4 -4.894 -10.742 3.449 1.00 1.00 C ATOM 268 C4' DG B 4 -4.324 -10.418 4.809 1.00 1.00 C ATOM 269 O4' DG B 4 -2.974 -9.919 4.645 1.00 1.00 O ATOM 270 C3' DG B 4 -5.068 -9.333 5.588 1.00 1.00 C ATOM 271 O3' DG B 4 -4.947 -9.580 6.997 1.00 1.00 O ATOM 272 C2' DG B 4 -4.309 -8.081 5.186 1.00 1.00 C ATOM 273 C1' DG B 4 -2.890 -8.613 5.194 1.00 1.00 C ATOM 274 N9 DG B 4 -1.919 -7.846 4.420 1.00 1.00 N ATOM 275 C8 DG B 4 -0.749 -7.314 4.901 1.00 1.00 C ATOM 276 N7 DG B 4 -0.034 -6.724 3.986 1.00 1.00 N ATOM 277 C5 DG B 4 -0.776 -6.871 2.825 1.00 1.00 C ATOM 278 C6 DG B 4 -0.497 -6.430 1.511 1.00 1.00 C ATOM 279 O6 DG B 4 0.495 -5.807 1.111 1.00 1.00 O ATOM 280 N1 DG B 4 -1.505 -6.780 0.616 1.00 1.00 N ATOM 281 C2 DG B 4 -2.645 -7.470 0.965 1.00 1.00 C ATOM 282 N2 DG B 4 -3.520 -7.716 -0.024 1.00 1.00 N ATOM 283 N3 DG B 4 -2.919 -7.887 2.192 1.00 1.00 N ATOM 284 C4 DG B 4 -1.946 -7.557 3.070 1.00 1.00 C ATOM 0 H5' DG B 4 -5.808 -11.326 3.558 1.00 1.00 H new ATOM 0 H5'' DG B 4 -5.163 -9.822 2.930 1.00 1.00 H new ATOM 0 H4' DG B 4 -4.399 -11.350 5.369 1.00 1.00 H new ATOM 0 H3' DG B 4 -6.137 -9.276 5.381 1.00 1.00 H new ATOM 0 H2' DG B 4 -4.608 -7.710 4.206 1.00 1.00 H new ATOM 0 H2'' DG B 4 -4.451 -7.264 5.893 1.00 1.00 H new ATOM 0 H1' DG B 4 -2.523 -8.564 6.219 1.00 1.00 H new ATOM 0 H8 DG B 4 -0.450 -7.378 5.937 1.00 1.00 H new ATOM 0 H1 DG B 4 -1.392 -6.508 -0.361 1.00 1.00 H new ATOM 0 H21 DG B 4 -4.383 -8.223 0.173 1.00 1.00 H new ATOM 0 H22 DG B 4 -3.322 -7.396 -0.972 1.00 1.00 H new ATOM 296 P DG B 5 -5.805 -8.738 8.063 1.00 1.00 P ATOM 297 OP1 DG B 5 -5.723 -9.453 9.358 1.00 1.00 O ATOM 298 OP2 DG B 5 -7.136 -8.446 7.481 1.00 1.00 O ATOM 299 O5' DG B 5 -5.010 -7.370 8.217 1.00 1.00 O ATOM 300 C5' DG B 5 -3.696 -7.345 8.771 1.00 1.00 C ATOM 301 C4' DG B 5 -3.083 -5.971 8.634 1.00 1.00 C ATOM 302 O4' DG B 5 -2.463 -5.825 7.342 1.00 1.00 O ATOM 303 C3' DG B 5 -4.055 -4.792 8.684 1.00 1.00 C ATOM 304 O3' DG B 5 -4.304 -4.393 10.036 1.00 1.00 O ATOM 305 C2' DG B 5 -3.324 -3.702 7.914 1.00 1.00 C ATOM 306 C1' DG B 5 -2.211 -4.441 7.170 1.00 1.00 C ATOM 307 N9 DG B 5 -2.127 -4.147 5.741 1.00 1.00 N ATOM 308 C8 DG B 5 -3.099 -4.327 4.784 1.00 1.00 C ATOM 309 N7 DG B 5 -2.718 -3.960 3.588 1.00 1.00 N ATOM 310 C5 DG B 5 -1.416 -3.513 3.764 1.00 1.00 C ATOM 311 C6 DG B 5 -0.483 -2.990 2.823 1.00 1.00 C ATOM 312 O6 DG B 5 -0.633 -2.805 1.602 1.00 1.00 O ATOM 313 N1 DG B 5 0.730 -2.659 3.424 1.00 1.00 N ATOM 314 C2 DG B 5 0.999 -2.812 4.766 1.00 1.00 C ATOM 315 N2 DG B 5 2.220 -2.447 5.175 1.00 1.00 N ATOM 316 N3 DG B 5 0.141 -3.293 5.649 1.00 1.00 N ATOM 317 C4 DG B 5 -1.038 -3.622 5.085 1.00 1.00 C ATOM 0 H5' DG B 5 -3.069 -8.080 8.266 1.00 1.00 H new ATOM 0 H5'' DG B 5 -3.734 -7.628 9.823 1.00 1.00 H new ATOM 0 H4' DG B 5 -2.408 -5.930 9.489 1.00 1.00 H new ATOM 0 H3' DG B 5 -5.033 -5.024 8.263 1.00 1.00 H new ATOM 0 H2' DG B 5 -3.992 -3.189 7.222 1.00 1.00 H new ATOM 0 H2'' DG B 5 -2.918 -2.945 8.586 1.00 1.00 H new ATOM 0 HO3' DG B 5 -4.927 -3.636 10.044 1.00 1.00 H new ATOM 0 H1' DG B 5 -1.258 -4.113 7.586 1.00 1.00 H new ATOM 0 H8 DG B 5 -4.078 -4.731 4.999 1.00 1.00 H new ATOM 0 H1 DG B 5 1.467 -2.278 2.831 1.00 1.00 H new ATOM 0 H21 DG B 5 2.477 -2.537 6.158 1.00 1.00 H new ATOM 0 H22 DG B 5 2.894 -2.078 4.504 1.00 1.00 H new TER 330 DG B 5 ATOM 331 O5' DG C 1 6.828 2.745 -3.176 1.00 1.00 O ATOM 332 C5' DG C 1 7.315 4.033 -3.551 1.00 1.00 C ATOM 333 C4' DG C 1 6.617 4.516 -4.798 1.00 1.00 C ATOM 334 O4' DG C 1 5.410 3.736 -4.965 1.00 1.00 O ATOM 335 C3' DG C 1 6.181 5.982 -4.774 1.00 1.00 C ATOM 336 O3' DG C 1 6.346 6.572 -6.068 1.00 1.00 O ATOM 337 C2' DG C 1 4.711 5.911 -4.411 1.00 1.00 C ATOM 338 C1' DG C 1 4.283 4.594 -5.029 1.00 1.00 C ATOM 339 N9 DG C 1 3.168 3.940 -4.349 1.00 1.00 N ATOM 340 C8 DG C 1 1.948 3.622 -4.892 1.00 1.00 C ATOM 341 N7 DG C 1 1.128 3.077 -4.036 1.00 1.00 N ATOM 342 C5 DG C 1 1.851 3.031 -2.853 1.00 1.00 C ATOM 343 C6 DG C 1 1.479 2.546 -1.575 1.00 1.00 C ATOM 344 O6 DG C 1 0.401 2.038 -1.234 1.00 1.00 O ATOM 345 N1 DG C 1 2.504 2.684 -0.642 1.00 1.00 N ATOM 346 C2 DG C 1 3.739 3.225 -0.922 1.00 1.00 C ATOM 347 N2 DG C 1 4.625 3.259 0.087 1.00 1.00 N ATOM 348 N3 DG C 1 4.096 3.683 -2.112 1.00 1.00 N ATOM 349 C4 DG C 1 3.112 3.558 -3.027 1.00 1.00 C ATOM 0 H5' DG C 1 8.390 3.986 -3.723 1.00 1.00 H new ATOM 0 H5'' DG C 1 7.153 4.741 -2.738 1.00 1.00 H new ATOM 0 H4' DG C 1 7.344 4.406 -5.603 1.00 1.00 H new ATOM 0 H3' DG C 1 6.763 6.588 -4.079 1.00 1.00 H new ATOM 0 H2' DG C 1 4.559 5.921 -3.332 1.00 1.00 H new ATOM 0 H2'' DG C 1 4.151 6.752 -4.820 1.00 1.00 H new ATOM 0 HO5' DG C 1 5.935 2.835 -2.782 1.00 1.00 H new ATOM 0 H1' DG C 1 3.937 4.798 -6.042 1.00 1.00 H new ATOM 0 H8 DG C 1 1.692 3.805 -5.925 1.00 1.00 H new ATOM 0 H1 DG C 1 2.328 2.364 0.310 1.00 1.00 H new ATOM 0 H21 DG C 1 5.555 3.649 -0.064 1.00 1.00 H new ATOM 0 H22 DG C 1 4.367 2.895 1.004 1.00 1.00 H new ATOM 362 P DG C 2 6.185 8.158 -6.260 1.00 1.00 P ATOM 363 OP1 DG C 2 7.104 8.583 -7.341 1.00 1.00 O ATOM 364 OP2 DG C 2 6.296 8.793 -4.926 1.00 1.00 O ATOM 365 O5' DG C 2 4.689 8.349 -6.765 1.00 1.00 O ATOM 366 C5' DG C 2 4.171 7.566 -7.838 1.00 1.00 C ATOM 367 C4' DG C 2 2.664 7.658 -7.866 1.00 1.00 C ATOM 368 O4' DG C 2 2.111 6.887 -6.767 1.00 1.00 O ATOM 369 C3' DG C 2 2.103 9.074 -7.706 1.00 1.00 C ATOM 370 O3' DG C 2 0.990 9.256 -8.591 1.00 1.00 O ATOM 371 C2' DG C 2 1.660 9.095 -6.254 1.00 1.00 C ATOM 372 C1' DG C 2 1.145 7.683 -6.100 1.00 1.00 C ATOM 373 N9 DG C 2 1.005 7.218 -4.722 1.00 1.00 N ATOM 374 C8 DG C 2 1.876 7.420 -3.677 1.00 1.00 C ATOM 375 N7 DG C 2 1.466 6.897 -2.553 1.00 1.00 N ATOM 376 C5 DG C 2 0.246 6.319 -2.873 1.00 1.00 C ATOM 377 C6 DG C 2 -0.670 5.608 -2.057 1.00 1.00 C ATOM 378 O6 DG C 2 -0.565 5.323 -0.855 1.00 1.00 O ATOM 379 N1 DG C 2 -1.792 5.194 -2.769 1.00 1.00 N ATOM 380 C2 DG C 2 -1.991 5.434 -4.110 1.00 1.00 C ATOM 381 N2 DG C 2 -3.116 4.940 -4.646 1.00 1.00 N ATOM 382 N3 DG C 2 -1.144 6.094 -4.884 1.00 1.00 N ATOM 383 C4 DG C 2 -0.053 6.507 -4.204 1.00 1.00 C ATOM 0 H5' DG C 2 4.478 6.527 -7.721 1.00 1.00 H new ATOM 0 H5'' DG C 2 4.582 7.915 -8.785 1.00 1.00 H new ATOM 0 H4' DG C 2 2.383 7.286 -8.851 1.00 1.00 H new ATOM 0 H3' DG C 2 2.813 9.867 -7.943 1.00 1.00 H new ATOM 0 H2' DG C 2 2.483 9.312 -5.573 1.00 1.00 H new ATOM 0 H2'' DG C 2 0.887 9.840 -6.068 1.00 1.00 H new ATOM 0 H1' DG C 2 0.135 7.623 -6.505 1.00 1.00 H new ATOM 0 H8 DG C 2 2.807 7.958 -3.776 1.00 1.00 H new ATOM 0 H1 DG C 2 -2.514 4.679 -2.264 1.00 1.00 H new ATOM 0 H21 DG C 2 -3.317 5.087 -5.635 1.00 1.00 H new ATOM 0 H22 DG C 2 -3.771 4.417 -4.065 1.00 1.00 H new HETATM 395 P AZW C 3 0.212 10.660 -8.671 1.00 1.00 P HETATM 396 OP1 AZW C 3 -0.136 10.914 -10.089 1.00 1.00 O HETATM 397 OP2 AZW C 3 1.001 11.669 -7.926 1.00 1.00 O HETATM 398 O5' AZW C 3 -1.136 10.394 -7.869 1.00 1.00 O HETATM 399 C5' AZW C 3 -2.099 9.460 -8.350 1.00 1.00 C HETATM 400 C1A AZW C 3 -2.938 8.946 -7.200 1.00 1.00 C HETATM 401 C2A AZW C 3 -3.756 7.822 -7.390 1.00 1.00 C HETATM 402 C6A AZW C 3 -2.900 9.583 -5.947 1.00 1.00 C HETATM 403 C3A AZW C 3 -4.532 7.335 -6.333 1.00 1.00 C HETATM 404 C5A AZW C 3 -3.678 9.095 -4.892 1.00 1.00 C HETATM 405 C4A AZW C 3 -4.494 7.970 -5.084 1.00 1.00 C HETATM 406 N5A AZW C 3 -5.267 7.469 -4.013 1.00 1.00 N HETATM 407 C1B AZW C 3 -8.183 6.727 0.042 1.00 1.00 C HETATM 408 C2B AZW C 3 -8.821 7.305 -1.068 1.00 1.00 C HETATM 409 C6B AZW C 3 -6.784 6.657 0.081 1.00 1.00 C HETATM 410 C3B AZW C 3 -8.058 7.804 -2.133 1.00 1.00 C HETATM 411 C5B AZW C 3 -6.025 7.157 -0.984 1.00 1.00 C HETATM 412 C4B AZW C 3 -6.661 7.730 -2.093 1.00 1.00 C HETATM 413 N5B AZW C 3 -5.891 8.235 -3.166 1.00 1.00 N HETATM 414 C3' AZW C 3 -8.992 6.174 1.200 1.00 1.00 C HETATM 415 O3' AZW C 3 -10.349 6.597 1.134 1.00 1.00 O ATOM 428 P DG C 4 -11.480 5.575 0.636 1.00 1.00 P ATOM 429 OP1 DG C 4 -12.607 6.387 0.121 1.00 1.00 O ATOM 430 OP2 DG C 4 -11.725 4.588 1.711 1.00 1.00 O ATOM 431 O5' DG C 4 -10.815 4.825 -0.598 1.00 1.00 O ATOM 432 C5' DG C 4 -11.209 3.500 -0.952 1.00 1.00 C ATOM 433 C4' DG C 4 -10.960 3.271 -2.424 1.00 1.00 C ATOM 434 O4' DG C 4 -9.719 3.925 -2.789 1.00 1.00 O ATOM 435 C3' DG C 4 -10.800 1.809 -2.841 1.00 1.00 C ATOM 436 O3' DG C 4 -11.320 1.611 -4.163 1.00 1.00 O ATOM 437 C2' DG C 4 -9.295 1.619 -2.812 1.00 1.00 C ATOM 438 C1' DG C 4 -8.812 2.967 -3.313 1.00 1.00 C ATOM 439 N9 DG C 4 -7.458 3.334 -2.910 1.00 1.00 N ATOM 440 C8 DG C 4 -6.454 3.755 -3.745 1.00 1.00 C ATOM 441 N7 DG C 4 -5.328 3.986 -3.129 1.00 1.00 N ATOM 442 C5 DG C 4 -5.605 3.703 -1.800 1.00 1.00 C ATOM 443 C6 DG C 4 -4.762 3.769 -0.666 1.00 1.00 C ATOM 444 O6 DG C 4 -3.570 4.106 -0.620 1.00 1.00 O ATOM 445 N1 DG C 4 -5.422 3.397 0.500 1.00 1.00 N ATOM 446 C2 DG C 4 -6.742 3.009 0.553 1.00 1.00 C ATOM 447 N2 DG C 4 -7.223 2.698 1.767 1.00 1.00 N ATOM 448 N3 DG C 4 -7.542 2.942 -0.500 1.00 1.00 N ATOM 449 C4 DG C 4 -6.913 3.298 -1.641 1.00 1.00 C ATOM 0 H5' DG C 4 -12.265 3.351 -0.724 1.00 1.00 H new ATOM 0 H5'' DG C 4 -10.650 2.774 -0.362 1.00 1.00 H new ATOM 0 H4' DG C 4 -11.845 3.664 -2.924 1.00 1.00 H new ATOM 0 H3' DG C 4 -11.333 1.105 -2.202 1.00 1.00 H new ATOM 0 H2' DG C 4 -8.928 1.398 -1.810 1.00 1.00 H new ATOM 0 H2'' DG C 4 -8.972 0.802 -3.457 1.00 1.00 H new ATOM 0 H1' DG C 4 -8.779 2.925 -4.402 1.00 1.00 H new ATOM 0 H8 DG C 4 -6.584 3.883 -4.810 1.00 1.00 H new ATOM 0 H1 DG C 4 -4.894 3.413 1.373 1.00 1.00 H new ATOM 0 H21 DG C 4 -8.194 2.403 1.871 1.00 1.00 H new ATOM 0 H22 DG C 4 -6.617 2.756 2.586 1.00 1.00 H new ATOM 461 P DG C 5 -11.330 0.147 -4.827 1.00 1.00 P ATOM 462 OP1 DG C 5 -12.404 0.112 -5.844 1.00 1.00 O ATOM 463 OP2 DG C 5 -11.339 -0.847 -3.728 1.00 1.00 O ATOM 464 O5' DG C 5 -9.931 0.049 -5.580 1.00 1.00 O ATOM 465 C5' DG C 5 -9.630 0.939 -6.654 1.00 1.00 C ATOM 466 C4' DG C 5 -8.163 0.869 -7.006 1.00 1.00 C ATOM 467 O4' DG C 5 -7.372 1.216 -5.851 1.00 1.00 O ATOM 468 C3' DG C 5 -7.668 -0.516 -7.433 1.00 1.00 C ATOM 469 O3' DG C 5 -7.409 -0.545 -8.839 1.00 1.00 O ATOM 470 C2' DG C 5 -6.383 -0.738 -6.647 1.00 1.00 C ATOM 471 C1' DG C 5 -6.105 0.612 -6.011 1.00 1.00 C ATOM 472 N9 DG C 5 -5.443 0.551 -4.712 1.00 1.00 N ATOM 473 C8 DG C 5 -5.944 0.058 -3.530 1.00 1.00 C ATOM 474 N7 DG C 5 -5.099 0.145 -2.537 1.00 1.00 N ATOM 475 C5 DG C 5 -3.971 0.729 -3.097 1.00 1.00 C ATOM 476 C6 DG C 5 -2.723 1.075 -2.510 1.00 1.00 C ATOM 477 O6 DG C 5 -2.355 0.920 -1.334 1.00 1.00 O ATOM 478 N1 DG C 5 -1.855 1.650 -3.434 1.00 1.00 N ATOM 479 C2 DG C 5 -2.160 1.860 -4.762 1.00 1.00 C ATOM 480 N2 DG C 5 -1.213 2.447 -5.510 1.00 1.00 N ATOM 481 N3 DG C 5 -3.315 1.540 -5.320 1.00 1.00 N ATOM 482 C4 DG C 5 -4.169 0.985 -4.436 1.00 1.00 C ATOM 0 H5' DG C 5 -9.894 1.959 -6.374 1.00 1.00 H new ATOM 0 H5'' DG C 5 -10.232 0.682 -7.526 1.00 1.00 H new ATOM 0 H4' DG C 5 -8.052 1.555 -7.845 1.00 1.00 H new ATOM 0 H3' DG C 5 -8.407 -1.293 -7.235 1.00 1.00 H new ATOM 0 H2' DG C 5 -6.505 -1.517 -5.894 1.00 1.00 H new ATOM 0 H2'' DG C 5 -5.566 -1.049 -7.298 1.00 1.00 H new ATOM 0 HO3' DG C 5 -7.092 -1.436 -9.095 1.00 1.00 H new ATOM 0 H1' DG C 5 -5.418 1.164 -6.652 1.00 1.00 H new ATOM 0 H8 DG C 5 -6.935 -0.359 -3.432 1.00 1.00 H new ATOM 0 H1 DG C 5 -0.932 1.935 -3.107 1.00 1.00 H new ATOM 0 H21 DG C 5 -1.383 2.627 -6.499 1.00 1.00 H new ATOM 0 H22 DG C 5 -0.323 2.713 -5.089 1.00 1.00 H new TER 495 DG C 5 ATOM 496 O5' DG D 1 -6.676 -4.086 2.786 1.00 1.00 O ATOM 497 C5' DG D 1 -7.799 -3.761 3.595 1.00 1.00 C ATOM 498 C4' DG D 1 -7.358 -3.419 4.997 1.00 1.00 C ATOM 499 O4' DG D 1 -5.952 -3.073 4.958 1.00 1.00 O ATOM 500 C3' DG D 1 -8.065 -2.218 5.627 1.00 1.00 C ATOM 501 O3' DG D 1 -8.215 -2.428 7.037 1.00 1.00 O ATOM 502 C2' DG D 1 -7.108 -1.075 5.341 1.00 1.00 C ATOM 503 C1' DG D 1 -5.770 -1.770 5.487 1.00 1.00 C ATOM 504 N9 DG D 1 -4.650 -1.148 4.786 1.00 1.00 N ATOM 505 C8 DG D 1 -3.448 -0.786 5.343 1.00 1.00 C ATOM 506 N7 DG D 1 -2.616 -0.259 4.488 1.00 1.00 N ATOM 507 C5 DG D 1 -3.311 -0.275 3.287 1.00 1.00 C ATOM 508 C6 DG D 1 -2.916 0.169 2.000 1.00 1.00 C ATOM 509 O6 DG D 1 -1.829 0.666 1.661 1.00 1.00 O ATOM 510 N1 DG D 1 -3.913 -0.020 1.050 1.00 1.00 N ATOM 511 C2 DG D 1 -5.142 -0.579 1.317 1.00 1.00 C ATOM 512 N2 DG D 1 -5.977 -0.702 0.272 1.00 1.00 N ATOM 513 N3 DG D 1 -5.526 -1.001 2.514 1.00 1.00 N ATOM 514 C4 DG D 1 -4.568 -0.819 3.449 1.00 1.00 C ATOM 0 H5' DG D 1 -8.492 -4.602 3.620 1.00 1.00 H new ATOM 0 H5'' DG D 1 -8.336 -2.918 3.160 1.00 1.00 H new ATOM 0 H4' DG D 1 -7.596 -4.298 5.596 1.00 1.00 H new ATOM 0 H3' DG D 1 -9.067 -2.037 5.238 1.00 1.00 H new ATOM 0 H2' DG D 1 -7.249 -0.659 4.343 1.00 1.00 H new ATOM 0 H2'' DG D 1 -7.225 -0.254 6.048 1.00 1.00 H new ATOM 0 HO5' DG D 1 -5.858 -3.754 3.213 1.00 1.00 H new ATOM 0 H1' DG D 1 -5.498 -1.732 6.542 1.00 1.00 H new ATOM 0 H8 DG D 1 -3.214 -0.924 6.388 1.00 1.00 H new ATOM 0 H1 DG D 1 -3.721 0.275 0.093 1.00 1.00 H new ATOM 0 H21 DG D 1 -6.903 -1.109 0.404 1.00 1.00 H new ATOM 0 H22 DG D 1 -5.685 -0.389 -0.654 1.00 1.00 H new ATOM 527 P DG D 2 -9.093 -1.416 7.925 1.00 1.00 P ATOM 528 OP1 DG D 2 -9.585 -2.171 9.104 1.00 1.00 O ATOM 529 OP2 DG D 2 -10.068 -0.743 7.034 1.00 1.00 O ATOM 530 O5' DG D 2 -8.036 -0.344 8.434 1.00 1.00 O ATOM 531 C5' DG D 2 -6.902 -0.754 9.198 1.00 1.00 C ATOM 532 C4' DG D 2 -5.928 0.392 9.347 1.00 1.00 C ATOM 533 O4' DG D 2 -5.244 0.617 8.087 1.00 1.00 O ATOM 534 C3' DG D 2 -6.569 1.734 9.718 1.00 1.00 C ATOM 535 O3' DG D 2 -5.772 2.390 10.716 1.00 1.00 O ATOM 536 C2' DG D 2 -6.541 2.493 8.403 1.00 1.00 C ATOM 537 C1' DG D 2 -5.225 2.011 7.843 1.00 1.00 C ATOM 538 N9 DG D 2 -5.020 2.266 6.421 1.00 1.00 N ATOM 539 C8 DG D 2 -5.953 2.192 5.414 1.00 1.00 C ATOM 540 N7 DG D 2 -5.482 2.543 4.248 1.00 1.00 N ATOM 541 C5 DG D 2 -4.156 2.867 4.499 1.00 1.00 C ATOM 542 C6 DG D 2 -3.141 3.318 3.619 1.00 1.00 C ATOM 543 O6 DG D 2 -3.219 3.517 2.399 1.00 1.00 O ATOM 544 N1 DG D 2 -1.932 3.534 4.277 1.00 1.00 N ATOM 545 C2 DG D 2 -1.739 3.333 5.627 1.00 1.00 C ATOM 546 N2 DG D 2 -0.506 3.571 6.101 1.00 1.00 N ATOM 547 N3 DG D 2 -2.677 2.912 6.460 1.00 1.00 N ATOM 548 C4 DG D 2 -3.854 2.700 5.834 1.00 1.00 C ATOM 0 H5' DG D 2 -6.411 -1.596 8.710 1.00 1.00 H new ATOM 0 H5'' DG D 2 -7.223 -1.098 10.181 1.00 1.00 H new ATOM 0 H4' DG D 2 -5.266 0.087 10.158 1.00 1.00 H new ATOM 0 H3' DG D 2 -7.572 1.652 10.136 1.00 1.00 H new ATOM 0 H2' DG D 2 -7.384 2.241 7.760 1.00 1.00 H new ATOM 0 H2'' DG D 2 -6.561 3.573 8.546 1.00 1.00 H new ATOM 0 H1' DG D 2 -4.405 2.551 8.317 1.00 1.00 H new ATOM 0 H8 DG D 2 -6.973 1.875 5.572 1.00 1.00 H new ATOM 0 H1 DG D 2 -1.139 3.862 3.725 1.00 1.00 H new ATOM 0 H21 DG D 2 -0.306 3.439 7.093 1.00 1.00 H new ATOM 0 H22 DG D 2 0.231 3.884 5.470 1.00 1.00 H new HETATM 560 P AZW D 3 -6.110 3.885 11.198 1.00 1.00 P HETATM 561 OP1 AZW D 3 -5.675 3.998 12.612 1.00 1.00 O HETATM 562 OP2 AZW D 3 -7.514 4.200 10.843 1.00 1.00 O HETATM 563 O5' AZW D 3 -5.156 4.805 10.315 1.00 1.00 O HETATM 564 C5' AZW D 3 -3.742 4.620 10.324 1.00 1.00 C HETATM 565 C1A AZW D 3 -3.119 5.286 9.115 1.00 1.00 C HETATM 566 C2A AZW D 3 -1.732 5.463 9.066 1.00 1.00 C HETATM 567 C6A AZW D 3 -3.918 5.726 8.045 1.00 1.00 C HETATM 568 C3A AZW D 3 -1.139 6.076 7.960 1.00 1.00 C HETATM 569 C5A AZW D 3 -3.322 6.341 6.935 1.00 1.00 C HETATM 570 C4A AZW D 3 -1.932 6.516 6.891 1.00 1.00 C HETATM 571 N5A AZW D 3 -1.319 7.115 5.766 1.00 1.00 N HETATM 572 C1B AZW D 3 1.699 9.642 2.571 1.00 1.00 C HETATM 573 C2B AZW D 3 2.102 9.941 3.880 1.00 1.00 C HETATM 574 C6B AZW D 3 0.627 8.767 2.356 1.00 1.00 C HETATM 575 C3B AZW D 3 1.439 9.363 4.967 1.00 1.00 C HETATM 576 C5B AZW D 3 -0.039 8.189 3.444 1.00 1.00 C HETATM 577 C4B AZW D 3 0.368 8.485 4.753 1.00 1.00 C HETATM 578 N5B AZW D 3 -0.271 7.879 5.860 1.00 1.00 N HETATM 579 C3' AZW D 3 2.428 10.243 1.384 1.00 1.00 C HETATM 580 O3' AZW D 3 3.287 11.308 1.786 1.00 1.00 O ATOM 593 P DG D 4 4.857 11.042 1.988 1.00 1.00 P ATOM 594 OP1 DG D 4 5.395 12.121 2.851 1.00 1.00 O ATOM 595 OP2 DG D 4 5.453 10.810 0.649 1.00 1.00 O ATOM 596 O5' DG D 4 4.924 9.678 2.806 1.00 1.00 O ATOM 597 C5' DG D 4 6.132 8.924 2.885 1.00 1.00 C ATOM 598 C4' DG D 4 6.252 8.275 4.244 1.00 1.00 C ATOM 599 O4' DG D 4 4.940 7.834 4.672 1.00 1.00 O ATOM 600 C3' DG D 4 7.140 7.029 4.295 1.00 1.00 C ATOM 601 O3' DG D 4 7.745 6.910 5.591 1.00 1.00 O ATOM 602 C2' DG D 4 6.133 5.919 4.059 1.00 1.00 C ATOM 603 C1' DG D 4 4.960 6.429 4.872 1.00 1.00 C ATOM 604 N9 DG D 4 3.658 5.883 4.500 1.00 1.00 N ATOM 605 C8 DG D 4 2.783 5.228 5.331 1.00 1.00 C ATOM 606 N7 DG D 4 1.685 4.851 4.734 1.00 1.00 N ATOM 607 C5 DG D 4 1.847 5.283 3.425 1.00 1.00 C ATOM 608 C6 DG D 4 0.979 5.158 2.315 1.00 1.00 C ATOM 609 O6 DG D 4 -0.133 4.617 2.275 1.00 1.00 O ATOM 610 N1 DG D 4 1.514 5.733 1.165 1.00 1.00 N ATOM 611 C2 DG D 4 2.743 6.351 1.107 1.00 1.00 C ATOM 612 N2 DG D 4 3.107 6.855 -0.084 1.00 1.00 N ATOM 613 N3 DG D 4 3.563 6.474 2.137 1.00 1.00 N ATOM 614 C4 DG D 4 3.057 5.923 3.261 1.00 1.00 C ATOM 0 H5' DG D 4 6.988 9.575 2.708 1.00 1.00 H new ATOM 0 H5'' DG D 4 6.145 8.161 2.107 1.00 1.00 H new ATOM 0 H4' DG D 4 6.702 9.040 4.878 1.00 1.00 H new ATOM 0 H3' DG D 4 7.963 7.030 3.580 1.00 1.00 H new ATOM 0 H2' DG D 4 5.886 5.802 3.004 1.00 1.00 H new ATOM 0 H2'' DG D 4 6.492 4.952 4.412 1.00 1.00 H new ATOM 0 H1' DG D 4 5.106 6.119 5.907 1.00 1.00 H new ATOM 0 H8 DG D 4 2.983 5.043 6.376 1.00 1.00 H new ATOM 0 H1 DG D 4 0.959 5.694 0.310 1.00 1.00 H new ATOM 0 H21 DG D 4 4.007 7.324 -0.186 1.00 1.00 H new ATOM 0 H22 DG D 4 2.483 6.769 -0.886 1.00 1.00 H new ATOM 626 P DG D 5 8.805 5.742 5.904 1.00 1.00 P ATOM 627 OP1 DG D 5 9.572 6.159 7.103 1.00 1.00 O ATOM 628 OP2 DG D 5 9.538 5.417 4.659 1.00 1.00 O ATOM 629 O5' DG D 5 7.908 4.494 6.312 1.00 1.00 O ATOM 630 C5' DG D 5 7.133 4.510 7.510 1.00 1.00 C ATOM 631 C4' DG D 5 6.281 3.266 7.602 1.00 1.00 C ATOM 632 O4' DG D 5 5.241 3.328 6.602 1.00 1.00 O ATOM 633 C3' DG D 5 7.025 1.951 7.344 1.00 1.00 C ATOM 634 O3' DG D 5 7.119 1.175 8.542 1.00 1.00 O ATOM 635 C2' DG D 5 6.186 1.225 6.302 1.00 1.00 C ATOM 636 C1' DG D 5 4.882 2.002 6.275 1.00 1.00 C ATOM 637 N9 DG D 5 4.199 2.010 4.985 1.00 1.00 N ATOM 638 C8 DG D 5 4.708 2.426 3.779 1.00 1.00 C ATOM 639 N7 DG D 5 3.858 2.318 2.792 1.00 1.00 N ATOM 640 C5 DG D 5 2.715 1.796 3.383 1.00 1.00 C ATOM 641 C6 DG D 5 1.458 1.461 2.812 1.00 1.00 C ATOM 642 O6 DG D 5 1.101 1.548 1.625 1.00 1.00 O ATOM 643 N1 DG D 5 0.570 0.962 3.762 1.00 1.00 N ATOM 644 C2 DG D 5 0.870 0.805 5.096 1.00 1.00 C ATOM 645 N2 DG D 5 -0.104 0.310 5.871 1.00 1.00 N ATOM 646 N3 DG D 5 2.036 1.110 5.641 1.00 1.00 N ATOM 647 C4 DG D 5 2.908 1.599 4.734 1.00 1.00 C ATOM 0 H5' DG D 5 6.498 5.396 7.528 1.00 1.00 H new ATOM 0 H5'' DG D 5 7.792 4.572 8.376 1.00 1.00 H new ATOM 0 H4' DG D 5 5.914 3.257 8.628 1.00 1.00 H new ATOM 0 H3' DG D 5 8.047 2.121 7.006 1.00 1.00 H new ATOM 0 H2' DG D 5 6.672 1.227 5.326 1.00 1.00 H new ATOM 0 H2'' DG D 5 6.024 0.182 6.576 1.00 1.00 H new ATOM 0 HO3' DG D 5 7.596 0.340 8.354 1.00 1.00 H new ATOM 0 H1' DG D 5 4.181 1.532 6.964 1.00 1.00 H new ATOM 0 H8 DG D 5 5.712 2.805 3.658 1.00 1.00 H new ATOM 0 H1 DG D 5 -0.363 0.696 3.449 1.00 1.00 H new ATOM 0 H21 DG D 5 0.059 0.171 6.868 1.00 1.00 H new ATOM 0 H22 DG D 5 -1.008 0.072 5.464 1.00 1.00 H new TER 660 DG D 5 HETATM 661 K K A 101 1.241 -4.011 -0.583 1.00 1.00 K HETATM 662 K K A 102 -0.028 -0.384 -0.099 1.00 1.00 K HETATM 663 K K C 101 -1.395 3.165 0.496 1.00 1.00 K