USER MOD reduce.3.24.130724 H: found=0, std=0, add=100, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 100 hydrogens (8 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 DC O5' : rot 180:sc= 0 USER MOD Single : A 3 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 8 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 9 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -4.163 -9.058 11.346 1.00 0.00 O ATOM 2 C5' DC A 1 -3.919 -8.479 10.077 1.00 0.00 C ATOM 3 C4' DC A 1 -4.590 -7.099 9.928 1.00 0.00 C ATOM 4 O4' DC A 1 -4.121 -6.210 10.940 1.00 0.00 O ATOM 5 C3' DC A 1 -4.218 -6.467 8.584 1.00 0.00 C ATOM 6 O3' DC A 1 -5.270 -5.608 8.170 1.00 0.00 O ATOM 7 C2' DC A 1 -2.944 -5.717 8.950 1.00 0.00 C ATOM 8 C1' DC A 1 -3.283 -5.225 10.358 1.00 0.00 C ATOM 9 N1 DC A 1 -2.054 -5.017 11.166 1.00 0.00 N ATOM 10 C2 DC A 1 -1.581 -3.713 11.354 1.00 0.00 C ATOM 11 O2 DC A 1 -2.247 -2.741 11.007 1.00 0.00 O ATOM 12 N3 DC A 1 -0.354 -3.497 11.894 1.00 0.00 N ATOM 13 C4 DC A 1 0.396 -4.540 12.219 1.00 0.00 C ATOM 14 N4 DC A 1 1.600 -4.286 12.673 1.00 0.00 N ATOM 15 C5 DC A 1 -0.044 -5.888 12.054 1.00 0.00 C ATOM 16 C6 DC A 1 -1.282 -6.086 11.541 1.00 0.00 C ATOM 0 H5' DC A 1 -4.288 -9.146 9.298 1.00 0.00 H new ATOM 0 H5'' DC A 1 -2.844 -8.377 9.927 1.00 0.00 H new ATOM 0 H4' DC A 1 -5.667 -7.250 10.005 1.00 0.00 H new ATOM 0 H3' DC A 1 -4.070 -7.156 7.752 1.00 0.00 H new ATOM 0 H2' DC A 1 -2.068 -6.365 8.940 1.00 0.00 H new ATOM 0 H2'' DC A 1 -2.739 -4.894 8.265 1.00 0.00 H new ATOM 0 HO5' DC A 1 -3.722 -9.931 11.397 1.00 0.00 H new ATOM 0 H1' DC A 1 -3.788 -4.260 10.321 1.00 0.00 H new ATOM 0 H41 DC A 1 2.218 -5.053 12.937 1.00 0.00 H new ATOM 0 H42 DC A 1 1.919 -3.321 12.762 1.00 0.00 H new ATOM 0 H5 DC A 1 0.587 -6.720 12.328 1.00 0.00 H new ATOM 0 H6 DC A 1 -1.662 -7.090 11.427 1.00 0.00 H new ATOM 29 P DC A 2 -5.349 -5.023 6.679 1.00 0.00 P ATOM 30 OP1 DC A 2 -6.752 -4.669 6.385 1.00 0.00 O ATOM 31 OP2 DC A 2 -4.763 -6.006 5.742 1.00 0.00 O ATOM 32 O5' DC A 2 -4.467 -3.687 6.672 1.00 0.00 O ATOM 33 C5' DC A 2 -4.435 -2.839 5.535 1.00 0.00 C ATOM 34 C4' DC A 2 -3.799 -1.472 5.832 1.00 0.00 C ATOM 35 O4' DC A 2 -4.587 -0.783 6.798 1.00 0.00 O ATOM 36 C3' DC A 2 -2.367 -1.546 6.373 1.00 0.00 C ATOM 37 O3' DC A 2 -1.658 -0.422 5.870 1.00 0.00 O ATOM 38 C2' DC A 2 -2.613 -1.453 7.874 1.00 0.00 C ATOM 39 C1' DC A 2 -3.753 -0.444 7.894 1.00 0.00 C ATOM 40 N1 DC A 2 -4.480 -0.503 9.183 1.00 0.00 N ATOM 41 C2 DC A 2 -4.177 0.442 10.167 1.00 0.00 C ATOM 42 O2 DC A 2 -3.393 1.383 9.987 1.00 0.00 O ATOM 43 N3 DC A 2 -4.665 0.297 11.416 1.00 0.00 N ATOM 44 C4 DC A 2 -5.462 -0.716 11.694 1.00 0.00 C ATOM 45 N4 DC A 2 -5.956 -0.703 12.909 1.00 0.00 N ATOM 46 C5 DC A 2 -5.792 -1.723 10.738 1.00 0.00 C ATOM 47 C6 DC A 2 -5.279 -1.582 9.487 1.00 0.00 C ATOM 0 H5' DC A 2 -5.451 -2.691 5.169 1.00 0.00 H new ATOM 0 H5'' DC A 2 -3.877 -3.329 4.737 1.00 0.00 H new ATOM 0 H4' DC A 2 -3.762 -0.953 4.874 1.00 0.00 H new ATOM 0 H3' DC A 2 -1.784 -2.426 6.101 1.00 0.00 H new ATOM 0 H2' DC A 2 -2.897 -2.411 8.310 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.737 -1.102 8.419 1.00 0.00 H new ATOM 0 H1' DC A 2 -3.394 0.581 7.802 1.00 0.00 H new ATOM 0 H41 DC A 2 -6.583 -1.448 13.213 1.00 0.00 H new ATOM 0 H42 DC A 2 -5.713 0.052 13.550 1.00 0.00 H new ATOM 0 H5 DC A 2 -6.422 -2.561 10.997 1.00 0.00 H new ATOM 0 H6 DC A 2 -5.499 -2.319 8.729 1.00 0.00 H new ATOM 59 P DT A 3 -0.071 -0.262 6.046 1.00 0.00 P ATOM 60 OP1 DT A 3 0.370 0.826 5.141 1.00 0.00 O ATOM 61 OP2 DT A 3 0.554 -1.596 5.954 1.00 0.00 O ATOM 62 O5' DT A 3 0.068 0.248 7.568 1.00 0.00 O ATOM 63 C5' DT A 3 0.695 1.467 7.949 1.00 0.00 C ATOM 64 C4' DT A 3 2.183 1.295 8.287 1.00 0.00 C ATOM 65 O4' DT A 3 2.347 0.227 9.201 1.00 0.00 O ATOM 66 C3' DT A 3 3.119 1.077 7.088 1.00 0.00 C ATOM 67 O3' DT A 3 4.150 2.056 7.025 1.00 0.00 O ATOM 68 C2' DT A 3 3.716 -0.300 7.348 1.00 0.00 C ATOM 69 C1' DT A 3 3.476 -0.539 8.840 1.00 0.00 C ATOM 70 N1 DT A 3 3.197 -1.969 9.131 1.00 0.00 N ATOM 71 C2 DT A 3 4.193 -2.728 9.751 1.00 0.00 C ATOM 72 O2 DT A 3 5.286 -2.280 10.079 1.00 0.00 O ATOM 73 N3 DT A 3 3.908 -4.061 9.967 1.00 0.00 N ATOM 74 C4 DT A 3 2.750 -4.713 9.594 1.00 0.00 C ATOM 75 O4 DT A 3 2.633 -5.903 9.869 1.00 0.00 O ATOM 76 C5 DT A 3 1.773 -3.873 8.901 1.00 0.00 C ATOM 77 C7 DT A 3 0.477 -4.467 8.376 1.00 0.00 C ATOM 78 C6 DT A 3 2.018 -2.550 8.711 1.00 0.00 C ATOM 0 H5' DT A 3 0.177 1.881 8.814 1.00 0.00 H new ATOM 0 H5'' DT A 3 0.593 2.190 7.140 1.00 0.00 H new ATOM 0 H4' DT A 3 2.480 2.251 8.719 1.00 0.00 H new ATOM 0 H3' DT A 3 2.588 1.155 6.139 1.00 0.00 H new ATOM 0 H2' DT A 3 3.233 -1.065 6.740 1.00 0.00 H new ATOM 0 H2'' DT A 3 4.779 -0.325 7.107 1.00 0.00 H new ATOM 0 H1' DT A 3 4.367 -0.257 9.401 1.00 0.00 H new ATOM 0 H3 DT A 3 4.618 -4.615 10.446 1.00 0.00 H new ATOM 0 H71 DT A 3 -0.304 -3.707 8.391 1.00 0.00 H new ATOM 0 H72 DT A 3 0.625 -4.816 7.354 1.00 0.00 H new ATOM 0 H73 DT A 3 0.179 -5.305 9.006 1.00 0.00 H new ATOM 0 H6 DT A 3 1.274 -1.940 8.221 1.00 0.00 H new ATOM 91 P DG A 4 3.911 3.495 6.334 1.00 0.00 P ATOM 92 OP1 DG A 4 3.165 3.297 5.070 1.00 0.00 O ATOM 93 OP2 DG A 4 5.192 4.246 6.342 1.00 0.00 O ATOM 94 O5' DG A 4 2.931 4.232 7.370 1.00 0.00 O ATOM 95 C5' DG A 4 3.472 5.028 8.405 1.00 0.00 C ATOM 96 C4' DG A 4 2.496 5.319 9.538 1.00 0.00 C ATOM 97 O4' DG A 4 1.680 4.204 9.878 1.00 0.00 O ATOM 98 C3' DG A 4 3.272 5.675 10.807 1.00 0.00 C ATOM 99 O3' DG A 4 3.678 7.029 10.896 1.00 0.00 O ATOM 100 C2' DG A 4 2.200 5.378 11.834 1.00 0.00 C ATOM 101 C1' DG A 4 1.532 4.127 11.285 1.00 0.00 C ATOM 102 N9 DG A 4 2.136 2.861 11.768 1.00 0.00 N ATOM 103 C8 DG A 4 3.395 2.592 12.255 1.00 0.00 C ATOM 104 N7 DG A 4 3.592 1.342 12.574 1.00 0.00 N ATOM 105 C5 DG A 4 2.372 0.726 12.278 1.00 0.00 C ATOM 106 C6 DG A 4 1.935 -0.643 12.384 1.00 0.00 C ATOM 107 O6 DG A 4 2.533 -1.642 12.778 1.00 0.00 O ATOM 108 N1 DG A 4 0.635 -0.828 11.958 1.00 0.00 N ATOM 109 C2 DG A 4 -0.141 0.165 11.454 1.00 0.00 C ATOM 110 N2 DG A 4 -1.311 -0.159 10.969 1.00 0.00 N ATOM 111 N3 DG A 4 0.181 1.451 11.420 1.00 0.00 N ATOM 112 C4 DG A 4 1.471 1.663 11.814 1.00 0.00 C ATOM 0 H5' DG A 4 3.814 5.973 7.982 1.00 0.00 H new ATOM 0 H5'' DG A 4 4.349 4.526 8.814 1.00 0.00 H new ATOM 0 H4' DG A 4 1.865 6.133 9.181 1.00 0.00 H new ATOM 0 H3' DG A 4 4.217 5.139 10.897 1.00 0.00 H new ATOM 0 H2' DG A 4 2.626 5.207 12.823 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.494 6.203 11.930 1.00 0.00 H new ATOM 0 H1' DG A 4 0.495 4.101 11.619 1.00 0.00 H new ATOM 0 H8 DG A 4 4.155 3.351 12.364 1.00 0.00 H new ATOM 0 H1 DG A 4 0.235 -1.764 12.026 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.920 0.562 10.582 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.615 -1.133 10.977 1.00 0.00 H new HETATM 124 O5' 3DR A 5 6.036 6.572 11.657 1.00 0.00 O HETATM 125 P 3DR A 5 5.199 7.467 10.610 1.00 0.00 P HETATM 126 OP1 3DR A 5 5.307 8.888 11.013 1.00 0.00 O HETATM 127 OP2 3DR A 5 5.581 7.039 9.241 1.00 0.00 O HETATM 128 C2' 3DR A 5 5.662 6.042 16.134 1.00 0.00 C HETATM 129 C5' 3DR A 5 6.174 6.895 13.036 1.00 0.00 C HETATM 130 C4' 3DR A 5 4.935 6.522 13.881 1.00 0.00 C HETATM 131 O4' 3DR A 5 4.863 5.118 14.094 1.00 0.00 O HETATM 132 C1' 3DR A 5 5.649 4.805 15.232 1.00 0.00 C HETATM 133 C3' 3DR A 5 4.970 7.122 15.299 1.00 0.00 C HETATM 134 O3' 3DR A 5 3.679 7.350 15.859 1.00 0.00 O HETATM 0 H5'' 3DR A 5 7.047 6.379 13.437 1.00 0.00 H new HETATM 0 H4'1 3DR A 5 4.092 6.911 13.310 1.00 0.00 H new HETATM 0 H2'' 3DR A 5 5.131 5.859 17.068 1.00 0.00 H new HETATM 0 H1'2 3DR A 5 6.663 4.535 14.936 1.00 0.00 H new HETATM 0 H1'1 3DR A 5 5.233 3.948 15.762 1.00 0.00 H new HETATM 0 H5' 3DR A 5 6.363 7.964 13.134 1.00 0.00 H new HETATM 0 H3' 3DR A 5 5.464 8.093 15.281 1.00 0.00 H new HETATM 0 H2' 3DR A 5 6.679 6.333 16.397 1.00 0.00 H new ATOM 143 P DC A 6 2.631 8.413 15.258 1.00 0.00 P ATOM 144 OP1 DC A 6 3.357 9.383 14.403 1.00 0.00 O ATOM 145 OP2 DC A 6 1.754 8.890 16.358 1.00 0.00 O ATOM 146 O5' DC A 6 1.745 7.490 14.292 1.00 0.00 O ATOM 147 C5' DC A 6 0.616 7.994 13.591 1.00 0.00 C ATOM 148 C4' DC A 6 -0.617 7.109 13.843 1.00 0.00 C ATOM 149 O4' DC A 6 -0.369 5.731 13.553 1.00 0.00 O ATOM 150 C3' DC A 6 -1.025 7.214 15.313 1.00 0.00 C ATOM 151 O3' DC A 6 -2.414 7.452 15.455 1.00 0.00 O ATOM 152 C2' DC A 6 -0.583 5.875 15.882 1.00 0.00 C ATOM 153 C1' DC A 6 -0.752 4.948 14.672 1.00 0.00 C ATOM 154 N1 DC A 6 0.060 3.699 14.796 1.00 0.00 N ATOM 155 C2 DC A 6 -0.572 2.445 14.728 1.00 0.00 C ATOM 156 O2 DC A 6 -1.746 2.315 14.366 1.00 0.00 O ATOM 157 N3 DC A 6 0.109 1.307 15.033 1.00 0.00 N ATOM 158 C4 DC A 6 1.391 1.398 15.352 1.00 0.00 C ATOM 159 N4 DC A 6 2.041 0.285 15.590 1.00 0.00 N ATOM 160 C5 DC A 6 2.092 2.636 15.383 1.00 0.00 C ATOM 161 C6 DC A 6 1.402 3.765 15.091 1.00 0.00 C ATOM 0 H5' DC A 6 0.831 8.032 12.523 1.00 0.00 H new ATOM 0 H5'' DC A 6 0.409 9.015 13.911 1.00 0.00 H new ATOM 0 H4' DC A 6 -1.406 7.465 13.180 1.00 0.00 H new ATOM 0 H3' DC A 6 -0.570 8.055 15.837 1.00 0.00 H new ATOM 0 H2' DC A 6 0.448 5.901 16.236 1.00 0.00 H new ATOM 0 H2'' DC A 6 -1.201 5.565 16.724 1.00 0.00 H new ATOM 0 H1' DC A 6 -1.778 4.591 14.580 1.00 0.00 H new ATOM 0 H41 DC A 6 3.030 0.315 15.839 1.00 0.00 H new ATOM 0 H42 DC A 6 1.558 -0.611 15.527 1.00 0.00 H new ATOM 0 H5 DC A 6 3.142 2.675 15.632 1.00 0.00 H new ATOM 0 H6 DC A 6 1.907 4.720 15.090 1.00 0.00 H new ATOM 173 P DC A 7 -3.047 7.877 16.879 1.00 0.00 P ATOM 174 OP1 DC A 7 -4.203 8.754 16.617 1.00 0.00 O ATOM 175 OP2 DC A 7 -1.934 8.337 17.751 1.00 0.00 O ATOM 176 O5' DC A 7 -3.575 6.450 17.395 1.00 0.00 O ATOM 177 C5' DC A 7 -4.711 6.314 18.238 1.00 0.00 C ATOM 178 C4' DC A 7 -5.197 4.853 18.282 1.00 0.00 C ATOM 179 O4' DC A 7 -5.848 4.554 17.052 1.00 0.00 O ATOM 180 C3' DC A 7 -4.041 3.861 18.485 1.00 0.00 C ATOM 181 O3' DC A 7 -4.286 2.901 19.514 1.00 0.00 O ATOM 182 C2' DC A 7 -3.812 3.335 17.069 1.00 0.00 C ATOM 183 C1' DC A 7 -5.170 3.498 16.389 1.00 0.00 C ATOM 184 N1 DC A 7 -4.980 3.770 14.943 1.00 0.00 N ATOM 185 C2 DC A 7 -4.900 2.678 14.073 1.00 0.00 C ATOM 186 O2 DC A 7 -5.165 1.523 14.422 1.00 0.00 O ATOM 187 N3 DC A 7 -4.480 2.872 12.799 1.00 0.00 N ATOM 188 C4 DC A 7 -4.241 4.090 12.360 1.00 0.00 C ATOM 189 N4 DC A 7 -3.819 4.143 11.120 1.00 0.00 N ATOM 190 C5 DC A 7 -4.344 5.243 13.190 1.00 0.00 C ATOM 191 C6 DC A 7 -4.704 5.041 14.485 1.00 0.00 C ATOM 0 H5' DC A 7 -5.514 6.957 17.878 1.00 0.00 H new ATOM 0 H5'' DC A 7 -4.462 6.648 19.245 1.00 0.00 H new ATOM 0 H4' DC A 7 -5.876 4.750 19.128 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.127 4.299 18.885 1.00 0.00 H new ATOM 0 H2' DC A 7 -3.037 3.902 16.553 1.00 0.00 H new ATOM 0 H2'' DC A 7 -3.492 2.293 17.077 1.00 0.00 H new ATOM 0 H1' DC A 7 -5.768 2.589 16.458 1.00 0.00 H new ATOM 0 H41 DC A 7 -3.607 5.044 10.691 1.00 0.00 H new ATOM 0 H42 DC A 7 -3.702 3.283 10.584 1.00 0.00 H new ATOM 0 H5 DC A 7 -4.145 6.233 12.808 1.00 0.00 H new ATOM 0 H6 DC A 7 -4.774 5.881 15.160 1.00 0.00 H new ATOM 203 P DT A 8 -5.083 1.510 19.342 1.00 0.00 P ATOM 204 OP1 DT A 8 -6.293 1.690 18.515 1.00 0.00 O ATOM 205 OP2 DT A 8 -5.342 0.931 20.675 1.00 0.00 O ATOM 206 O5' DT A 8 -4.039 0.563 18.592 1.00 0.00 O ATOM 207 C5' DT A 8 -4.429 -0.536 17.788 1.00 0.00 C ATOM 208 C4' DT A 8 -3.524 -1.741 18.078 1.00 0.00 C ATOM 209 O4' DT A 8 -2.172 -1.399 17.807 1.00 0.00 O ATOM 210 C3' DT A 8 -3.600 -2.162 19.562 1.00 0.00 C ATOM 211 O3' DT A 8 -3.589 -3.563 19.866 1.00 0.00 O ATOM 212 C2' DT A 8 -2.393 -1.464 20.181 1.00 0.00 C ATOM 213 C1' DT A 8 -1.424 -1.494 19.007 1.00 0.00 C ATOM 214 N1 DT A 8 -0.336 -0.491 19.011 1.00 0.00 N ATOM 215 C2 DT A 8 0.975 -0.968 18.882 1.00 0.00 C ATOM 216 O2 DT A 8 1.266 -2.165 18.806 1.00 0.00 O ATOM 217 N3 DT A 8 1.969 -0.016 18.820 1.00 0.00 N ATOM 218 C4 DT A 8 1.774 1.351 18.802 1.00 0.00 C ATOM 219 O4 DT A 8 2.753 2.076 18.670 1.00 0.00 O ATOM 220 C5 DT A 8 0.382 1.778 18.928 1.00 0.00 C ATOM 221 C7 DT A 8 0.038 3.256 18.916 1.00 0.00 C ATOM 222 C6 DT A 8 -0.613 0.859 19.038 1.00 0.00 C ATOM 0 H5' DT A 8 -4.365 -0.267 16.734 1.00 0.00 H new ATOM 0 H5'' DT A 8 -5.469 -0.794 17.989 1.00 0.00 H new ATOM 0 H4' DT A 8 -3.864 -2.561 17.446 1.00 0.00 H new ATOM 0 H3' DT A 8 -4.576 -1.878 19.957 1.00 0.00 H new ATOM 0 H2' DT A 8 -2.622 -0.448 20.504 1.00 0.00 H new ATOM 0 H2'' DT A 8 -2.007 -1.996 21.051 1.00 0.00 H new ATOM 0 H1' DT A 8 -0.892 -2.441 19.097 1.00 0.00 H new ATOM 0 H3 DT A 8 2.932 -0.350 18.784 1.00 0.00 H new ATOM 0 H71 DT A 8 -0.958 3.394 18.495 1.00 0.00 H new ATOM 0 H72 DT A 8 0.058 3.642 19.935 1.00 0.00 H new ATOM 0 H73 DT A 8 0.766 3.794 18.310 1.00 0.00 H new ATOM 0 H6 DT A 8 -1.635 1.191 19.148 1.00 0.00 H new ATOM 235 P DG A 9 -2.997 -4.764 18.941 1.00 0.00 P ATOM 236 OP1 DG A 9 -3.102 -6.015 19.715 1.00 0.00 O ATOM 237 OP2 DG A 9 -1.683 -4.385 18.364 1.00 0.00 O ATOM 238 O5' DG A 9 -4.075 -4.823 17.748 1.00 0.00 O ATOM 239 C5' DG A 9 -4.642 -6.046 17.323 1.00 0.00 C ATOM 240 C4' DG A 9 -5.513 -5.878 16.063 1.00 0.00 C ATOM 241 O4' DG A 9 -5.071 -4.875 15.155 1.00 0.00 O ATOM 242 C3' DG A 9 -5.494 -7.151 15.220 1.00 0.00 C ATOM 243 O3' DG A 9 -6.684 -7.272 14.466 1.00 0.00 O ATOM 244 C2' DG A 9 -4.308 -6.926 14.290 1.00 0.00 C ATOM 245 C1' DG A 9 -4.080 -5.403 14.288 1.00 0.00 C ATOM 246 N9 DG A 9 -2.733 -4.932 14.714 1.00 0.00 N ATOM 247 C8 DG A 9 -1.627 -5.654 15.116 1.00 0.00 C ATOM 248 N7 DG A 9 -0.594 -4.930 15.449 1.00 0.00 N ATOM 249 C5 DG A 9 -1.026 -3.630 15.191 1.00 0.00 C ATOM 250 C6 DG A 9 -0.333 -2.390 15.354 1.00 0.00 C ATOM 251 O6 DG A 9 0.778 -2.206 15.839 1.00 0.00 O ATOM 252 N1 DG A 9 -1.057 -1.294 14.946 1.00 0.00 N ATOM 253 C2 DG A 9 -2.342 -1.363 14.517 1.00 0.00 C ATOM 254 N2 DG A 9 -2.922 -0.199 14.322 1.00 0.00 N ATOM 255 N3 DG A 9 -3.038 -2.495 14.376 1.00 0.00 N ATOM 256 C4 DG A 9 -2.321 -3.612 14.728 1.00 0.00 C ATOM 0 H5' DG A 9 -5.247 -6.463 18.128 1.00 0.00 H new ATOM 0 H5'' DG A 9 -3.846 -6.762 17.119 1.00 0.00 H new ATOM 0 H4' DG A 9 -6.489 -5.616 16.472 1.00 0.00 H new ATOM 0 H3' DG A 9 -5.417 -8.058 15.819 1.00 0.00 H new ATOM 0 H2' DG A 9 -3.424 -7.456 14.644 1.00 0.00 H new ATOM 0 H2'' DG A 9 -4.519 -7.294 13.286 1.00 0.00 H new ATOM 0 HO3' DG A 9 -6.651 -8.093 13.932 1.00 0.00 H new ATOM 0 H1' DG A 9 -4.146 -5.058 13.256 1.00 0.00 H new ATOM 0 H8 DG A 9 -1.618 -6.733 15.152 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.603 -0.381 14.967 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.889 -0.159 13.999 1.00 0.00 H new ATOM 0 H22 DG A 9 -2.405 0.663 14.494 1.00 0.00 H new TER 269 DG A 9 HETATM 270 NA NA A 101 1.383 2.465 4.102 1.00 0.00 NA HETATM 271 NA NA A 102 4.155 10.062 12.471 1.00 0.00 NA HETATM 272 NA NA A 103 -7.590 0.845 20.216 1.00 0.00 NA HETATM 273 NA NA A 104 6.247 5.811 7.514 1.00 0.00 NA HETATM 274 NA NA A 105 -2.675 1.405 12.365 1.00 0.00 NA HETATM 275 NA NA A 106 0.391 -4.025 17.613 1.00 0.00 NA HETATM 276 NA NA A 107 -6.764 -6.120 4.605 1.00 0.00 NA HETATM 277 NA NA A 108 0.146 9.093 17.868 1.00 0.00 NA