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= -0.0537 (180deg=-0.0537) USER MOD Single : A 9 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -5.828 -9.045 9.492 1.00 0.00 O ATOM 2 C5' DC A 1 -4.903 -8.415 10.362 1.00 0.00 C ATOM 3 C4' DC A 1 -4.854 -6.900 10.126 1.00 0.00 C ATOM 4 O4' DC A 1 -4.004 -6.311 11.097 1.00 0.00 O ATOM 5 C3' DC A 1 -4.318 -6.521 8.737 1.00 0.00 C ATOM 6 O3' DC A 1 -5.225 -5.610 8.136 1.00 0.00 O ATOM 7 C2' DC A 1 -2.968 -5.884 9.058 1.00 0.00 C ATOM 8 C1' DC A 1 -3.227 -5.324 10.453 1.00 0.00 C ATOM 9 N1 DC A 1 -1.960 -5.092 11.188 1.00 0.00 N ATOM 10 C2 DC A 1 -1.494 -3.783 11.328 1.00 0.00 C ATOM 11 O2 DC A 1 -2.158 -2.833 10.925 1.00 0.00 O ATOM 12 N3 DC A 1 -0.283 -3.542 11.893 1.00 0.00 N ATOM 13 C4 DC A 1 0.461 -4.565 12.286 1.00 0.00 C ATOM 14 N4 DC A 1 1.627 -4.283 12.818 1.00 0.00 N ATOM 15 C5 DC A 1 0.033 -5.920 12.145 1.00 0.00 C ATOM 16 C6 DC A 1 -1.183 -6.145 11.597 1.00 0.00 C ATOM 0 H5' DC A 1 -3.911 -8.840 10.210 1.00 0.00 H new ATOM 0 H5'' DC A 1 -5.181 -8.615 11.397 1.00 0.00 H new ATOM 0 H4' DC A 1 -5.879 -6.536 10.200 1.00 0.00 H new ATOM 0 H3' DC A 1 -4.212 -7.347 8.034 1.00 0.00 H new ATOM 0 H2' DC A 1 -2.157 -6.613 9.051 1.00 0.00 H new ATOM 0 H2'' DC A 1 -2.701 -5.104 8.345 1.00 0.00 H new ATOM 0 HO5' DC A 1 -5.835 -10.010 9.665 1.00 0.00 H new ATOM 0 H1' DC A 1 -3.730 -4.358 10.413 1.00 0.00 H new ATOM 0 H41 DC A 1 2.238 -5.035 13.137 1.00 0.00 H new ATOM 0 H42 DC A 1 1.923 -3.311 12.913 1.00 0.00 H new ATOM 0 H5 DC A 1 0.660 -6.739 12.466 1.00 0.00 H new ATOM 0 H6 DC A 1 -1.543 -7.157 11.481 1.00 0.00 H new ATOM 29 P DC A 2 -5.129 -5.210 6.585 1.00 0.00 P ATOM 30 OP1 DC A 2 -6.491 -4.946 6.078 1.00 0.00 O ATOM 31 OP2 DC A 2 -4.399 -6.263 5.847 1.00 0.00 O ATOM 32 O5' DC A 2 -4.284 -3.853 6.564 1.00 0.00 O ATOM 33 C5' DC A 2 -4.246 -3.018 5.419 1.00 0.00 C ATOM 34 C4' DC A 2 -3.630 -1.645 5.726 1.00 0.00 C ATOM 35 O4' DC A 2 -4.438 -0.971 6.688 1.00 0.00 O ATOM 36 C3' DC A 2 -2.204 -1.689 6.292 1.00 0.00 C ATOM 37 O3' DC A 2 -1.525 -0.535 5.818 1.00 0.00 O ATOM 38 C2' DC A 2 -2.474 -1.640 7.790 1.00 0.00 C ATOM 39 C1' DC A 2 -3.620 -0.643 7.798 1.00 0.00 C ATOM 40 N1 DC A 2 -4.356 -0.693 9.080 1.00 0.00 N ATOM 41 C2 DC A 2 -4.058 0.258 10.060 1.00 0.00 C ATOM 42 O2 DC A 2 -3.279 1.204 9.875 1.00 0.00 O ATOM 43 N3 DC A 2 -4.549 0.120 11.308 1.00 0.00 N ATOM 44 C4 DC A 2 -5.355 -0.889 11.579 1.00 0.00 C ATOM 45 N4 DC A 2 -5.850 -0.872 12.792 1.00 0.00 N ATOM 46 C5 DC A 2 -5.695 -1.892 10.620 1.00 0.00 C ATOM 47 C6 DC A 2 -5.167 -1.762 9.377 1.00 0.00 C ATOM 0 H5' DC A 2 -5.257 -2.884 5.035 1.00 0.00 H new ATOM 0 H5'' DC A 2 -3.669 -3.506 4.634 1.00 0.00 H new ATOM 0 H4' DC A 2 -3.586 -1.133 4.765 1.00 0.00 H new ATOM 0 H3' DC A 2 -1.588 -2.545 6.016 1.00 0.00 H new ATOM 0 H2' DC A 2 -2.758 -2.610 8.198 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.612 -1.294 8.361 1.00 0.00 H new ATOM 0 H1' DC A 2 -3.263 0.383 7.711 1.00 0.00 H new ATOM 0 H41 DC A 2 -6.484 -1.611 13.094 1.00 0.00 H new ATOM 0 H42 DC A 2 -5.601 -0.119 13.434 1.00 0.00 H new ATOM 0 H5 DC A 2 -6.344 -2.717 10.873 1.00 0.00 H new ATOM 0 H6 DC A 2 -5.385 -2.500 8.619 1.00 0.00 H new ATOM 59 P DT A 3 0.048 -0.322 6.034 1.00 0.00 P ATOM 60 OP1 DT A 3 0.473 0.783 5.141 1.00 0.00 O ATOM 61 OP2 DT A 3 0.724 -1.632 5.959 1.00 0.00 O ATOM 62 O5' DT A 3 0.120 0.189 7.559 1.00 0.00 O ATOM 63 C5' DT A 3 0.716 1.413 7.963 1.00 0.00 C ATOM 64 C4' DT A 3 2.199 1.269 8.328 1.00 0.00 C ATOM 65 O4' DT A 3 2.350 0.203 9.244 1.00 0.00 O ATOM 66 C3' DT A 3 3.165 1.056 7.154 1.00 0.00 C ATOM 67 O3' DT A 3 4.166 2.067 7.104 1.00 0.00 O ATOM 68 C2' DT A 3 3.785 -0.305 7.444 1.00 0.00 C ATOM 69 C1' DT A 3 3.502 -0.543 8.928 1.00 0.00 C ATOM 70 N1 DT A 3 3.230 -1.973 9.235 1.00 0.00 N ATOM 71 C2 DT A 3 4.187 -2.688 9.958 1.00 0.00 C ATOM 72 O2 DT A 3 5.243 -2.205 10.353 1.00 0.00 O ATOM 73 N3 DT A 3 3.915 -4.019 10.197 1.00 0.00 N ATOM 74 C4 DT A 3 2.800 -4.710 9.762 1.00 0.00 C ATOM 75 O4 DT A 3 2.704 -5.901 10.041 1.00 0.00 O ATOM 76 C5 DT A 3 1.844 -3.908 9.000 1.00 0.00 C ATOM 77 C7 DT A 3 0.577 -4.541 8.446 1.00 0.00 C ATOM 78 C6 DT A 3 2.081 -2.587 8.777 1.00 0.00 C ATOM 0 H5' DT A 3 0.173 1.808 8.822 1.00 0.00 H new ATOM 0 H5'' DT A 3 0.615 2.142 7.159 1.00 0.00 H new ATOM 0 H4' DT A 3 2.477 2.232 8.756 1.00 0.00 H new ATOM 0 H3' DT A 3 2.661 1.103 6.189 1.00 0.00 H new ATOM 0 H2' DT A 3 3.341 -1.084 6.825 1.00 0.00 H new ATOM 0 H2'' DT A 3 4.855 -0.306 7.238 1.00 0.00 H new ATOM 0 H1' DT A 3 4.377 -0.247 9.507 1.00 0.00 H new ATOM 0 H3 DT A 3 4.599 -4.541 10.745 1.00 0.00 H new ATOM 0 H71 DT A 3 -0.214 -3.792 8.400 1.00 0.00 H new ATOM 0 H72 DT A 3 0.770 -4.926 7.445 1.00 0.00 H new ATOM 0 H73 DT A 3 0.265 -5.359 9.095 1.00 0.00 H new ATOM 0 H6 DT A 3 1.354 -2.005 8.229 1.00 0.00 H new ATOM 91 P DG A 4 3.887 3.503 6.418 1.00 0.00 P ATOM 92 OP1 DG A 4 3.166 3.286 5.144 1.00 0.00 O ATOM 93 OP2 DG A 4 5.144 4.296 6.440 1.00 0.00 O ATOM 94 O5' DG A 4 2.874 4.212 7.440 1.00 0.00 O ATOM 95 C5' DG A 4 3.381 5.038 8.468 1.00 0.00 C ATOM 96 C4' DG A 4 2.392 5.325 9.590 1.00 0.00 C ATOM 97 O4' DG A 4 1.591 4.199 9.928 1.00 0.00 O ATOM 98 C3' DG A 4 3.159 5.707 10.859 1.00 0.00 C ATOM 99 O3' DG A 4 3.509 7.076 10.960 1.00 0.00 O ATOM 100 C2' DG A 4 2.110 5.359 11.895 1.00 0.00 C ATOM 101 C1' DG A 4 1.477 4.096 11.335 1.00 0.00 C ATOM 102 N9 DG A 4 2.130 2.842 11.781 1.00 0.00 N ATOM 103 C8 DG A 4 3.401 2.600 12.242 1.00 0.00 C ATOM 104 N7 DG A 4 3.639 1.351 12.543 1.00 0.00 N ATOM 105 C5 DG A 4 2.434 0.705 12.254 1.00 0.00 C ATOM 106 C6 DG A 4 2.032 -0.675 12.345 1.00 0.00 C ATOM 107 O6 DG A 4 2.648 -1.667 12.730 1.00 0.00 O ATOM 108 N1 DG A 4 0.741 -0.888 11.911 1.00 0.00 N ATOM 109 C2 DG A 4 -0.055 0.090 11.413 1.00 0.00 C ATOM 110 N2 DG A 4 -1.206 -0.261 10.905 1.00 0.00 N ATOM 111 N3 DG A 4 0.223 1.385 11.405 1.00 0.00 N ATOM 112 C4 DG A 4 1.505 1.624 11.807 1.00 0.00 C ATOM 0 H5' DG A 4 3.702 5.984 8.032 1.00 0.00 H new ATOM 0 H5'' DG A 4 4.267 4.566 8.893 1.00 0.00 H new ATOM 0 H4' DG A 4 1.748 6.126 9.228 1.00 0.00 H new ATOM 0 H3' DG A 4 4.126 5.209 10.934 1.00 0.00 H new ATOM 0 H2' DG A 4 2.554 5.187 12.876 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.379 6.159 12.012 1.00 0.00 H new ATOM 0 H1' DG A 4 0.449 4.032 11.691 1.00 0.00 H new ATOM 0 H8 DG A 4 4.143 3.378 12.347 1.00 0.00 H new ATOM 0 H1 DG A 4 0.364 -1.834 11.968 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.831 0.447 10.521 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.479 -1.244 10.892 1.00 0.00 H new HETATM 124 O5' 3DR A 5 5.923 6.712 11.599 1.00 0.00 O HETATM 125 P 3DR A 5 4.996 7.598 10.624 1.00 0.00 P HETATM 126 OP1 3DR A 5 5.049 9.007 11.077 1.00 0.00 O HETATM 127 OP2 3DR A 5 5.343 7.234 9.228 1.00 0.00 O HETATM 128 C2' 3DR A 5 5.804 5.935 16.048 1.00 0.00 C HETATM 129 C5' 3DR A 5 6.108 6.993 12.981 1.00 0.00 C HETATM 130 C4' 3DR A 5 4.937 6.505 13.864 1.00 0.00 C HETATM 131 O4' 3DR A 5 4.945 5.091 13.994 1.00 0.00 O HETATM 132 C1' 3DR A 5 5.801 4.752 15.074 1.00 0.00 C HETATM 133 C3' 3DR A 5 5.014 7.020 15.313 1.00 0.00 C HETATM 134 O3' 3DR A 5 3.739 7.136 15.940 1.00 0.00 O HETATM 0 H5'' 3DR A 5 7.031 6.523 13.320 1.00 0.00 H new HETATM 0 H4'1 3DR A 5 4.048 6.883 13.360 1.00 0.00 H new HETATM 0 H2'' 3DR A 5 5.335 5.673 16.996 1.00 0.00 H new HETATM 0 H1'2 3DR A 5 6.810 4.549 14.715 1.00 0.00 H new HETATM 0 H1'1 3DR A 5 5.451 3.847 15.571 1.00 0.00 H new HETATM 0 H5' 3DR A 5 6.231 8.068 13.113 1.00 0.00 H new HETATM 0 H3' 3DR A 5 5.457 8.016 15.335 1.00 0.00 H new HETATM 0 H2' 3DR A 5 6.818 6.264 16.274 1.00 0.00 H new ATOM 143 P DC A 6 2.618 8.188 15.465 1.00 0.00 P ATOM 144 OP1 DC A 6 3.258 9.234 14.630 1.00 0.00 O ATOM 145 OP2 DC A 6 1.788 8.560 16.637 1.00 0.00 O ATOM 146 O5' DC A 6 1.705 7.300 14.494 1.00 0.00 O ATOM 147 C5' DC A 6 0.558 7.840 13.850 1.00 0.00 C ATOM 148 C4' DC A 6 -0.675 6.953 14.095 1.00 0.00 C ATOM 149 O4' DC A 6 -0.437 5.597 13.713 1.00 0.00 O ATOM 150 C3' DC A 6 -1.040 6.976 15.579 1.00 0.00 C ATOM 151 O3' DC A 6 -2.424 7.187 15.794 1.00 0.00 O ATOM 152 C2' DC A 6 -0.570 5.615 16.064 1.00 0.00 C ATOM 153 C1' DC A 6 -0.738 4.752 14.811 1.00 0.00 C ATOM 154 N1 DC A 6 0.126 3.534 14.839 1.00 0.00 N ATOM 155 C2 DC A 6 -0.471 2.274 14.694 1.00 0.00 C ATOM 156 O2 DC A 6 -1.632 2.150 14.295 1.00 0.00 O ATOM 157 N3 DC A 6 0.222 1.137 14.971 1.00 0.00 N ATOM 158 C4 DC A 6 1.499 1.241 15.315 1.00 0.00 C ATOM 159 N4 DC A 6 2.160 0.135 15.549 1.00 0.00 N ATOM 160 C5 DC A 6 2.181 2.491 15.376 1.00 0.00 C ATOM 161 C6 DC A 6 1.468 3.617 15.128 1.00 0.00 C ATOM 0 H5' DC A 6 0.743 7.925 12.779 1.00 0.00 H new ATOM 0 H5'' DC A 6 0.367 8.847 14.222 1.00 0.00 H new ATOM 0 H4' DC A 6 -1.488 7.352 13.488 1.00 0.00 H new ATOM 0 H3' DC A 6 -0.576 7.801 16.120 1.00 0.00 H new ATOM 0 H2' DC A 6 0.465 5.639 16.406 1.00 0.00 H new ATOM 0 H2'' DC A 6 -1.172 5.248 16.895 1.00 0.00 H new ATOM 0 H1' DC A 6 -1.754 4.364 14.740 1.00 0.00 H new ATOM 0 H41 DC A 6 3.144 0.175 15.816 1.00 0.00 H new ATOM 0 H42 DC A 6 1.691 -0.767 15.464 1.00 0.00 H new ATOM 0 H5 DC A 6 3.234 2.540 15.613 1.00 0.00 H new ATOM 0 H6 DC A 6 1.955 4.581 15.157 1.00 0.00 H new ATOM 173 P DC A 7 -2.996 7.519 17.270 1.00 0.00 P ATOM 174 OP1 DC A 7 -4.102 8.483 17.114 1.00 0.00 O ATOM 175 OP2 DC A 7 -1.836 7.845 18.141 1.00 0.00 O ATOM 176 O5' DC A 7 -3.590 6.083 17.696 1.00 0.00 O ATOM 177 C5' DC A 7 -4.855 5.943 18.334 1.00 0.00 C ATOM 178 C4' DC A 7 -5.463 4.541 18.151 1.00 0.00 C ATOM 179 O4' DC A 7 -5.928 4.409 16.812 1.00 0.00 O ATOM 180 C3' DC A 7 -4.494 3.379 18.407 1.00 0.00 C ATOM 181 O3' DC A 7 -5.225 2.267 18.916 1.00 0.00 O ATOM 182 C2' DC A 7 -3.973 3.105 17.004 1.00 0.00 C ATOM 183 C1' DC A 7 -5.238 3.338 16.187 1.00 0.00 C ATOM 184 N1 DC A 7 -4.916 3.632 14.768 1.00 0.00 N ATOM 185 C2 DC A 7 -4.798 2.558 13.881 1.00 0.00 C ATOM 186 O2 DC A 7 -5.029 1.392 14.220 1.00 0.00 O ATOM 187 N3 DC A 7 -4.367 2.781 12.615 1.00 0.00 N ATOM 188 C4 DC A 7 -4.152 4.012 12.197 1.00 0.00 C ATOM 189 N4 DC A 7 -3.734 4.098 10.957 1.00 0.00 N ATOM 190 C5 DC A 7 -4.296 5.148 13.048 1.00 0.00 C ATOM 191 C6 DC A 7 -4.656 4.916 14.339 1.00 0.00 C ATOM 0 H5' DC A 7 -5.543 6.688 17.934 1.00 0.00 H new ATOM 0 H5'' DC A 7 -4.745 6.150 19.398 1.00 0.00 H new ATOM 0 H4' DC A 7 -6.257 4.472 18.894 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.702 3.580 19.129 1.00 0.00 H new ATOM 0 H2' DC A 7 -3.167 3.782 16.722 1.00 0.00 H new ATOM 0 H2'' DC A 7 -3.590 2.090 16.895 1.00 0.00 H new ATOM 0 H1' DC A 7 -5.864 2.446 16.164 1.00 0.00 H new ATOM 0 H41 DC A 7 -3.541 5.011 10.546 1.00 0.00 H new ATOM 0 H42 DC A 7 -3.602 3.251 10.404 1.00 0.00 H new ATOM 0 H5 DC A 7 -4.126 6.150 12.683 1.00 0.00 H new ATOM 0 H6 DC A 7 -4.738 5.741 15.031 1.00 0.00 H new ATOM 203 P DT A 8 -4.502 0.982 19.561 1.00 0.00 P ATOM 204 OP1 DT A 8 -5.165 0.661 20.843 1.00 0.00 O ATOM 205 OP2 DT A 8 -3.042 1.170 19.520 1.00 0.00 O ATOM 206 O5' DT A 8 -4.906 -0.288 18.638 1.00 0.00 O ATOM 207 C5' DT A 8 -4.161 -0.758 17.516 1.00 0.00 C ATOM 208 C4' DT A 8 -2.904 -1.605 17.816 1.00 0.00 C ATOM 209 O4' DT A 8 -1.702 -0.911 17.475 1.00 0.00 O ATOM 210 C3' DT A 8 -2.714 -2.095 19.262 1.00 0.00 C ATOM 211 O3' DT A 8 -2.788 -3.510 19.346 1.00 0.00 O ATOM 212 C2' DT A 8 -1.325 -1.598 19.655 1.00 0.00 C ATOM 213 C1' DT A 8 -0.636 -1.311 18.332 1.00 0.00 C ATOM 214 N1 DT A 8 0.402 -0.258 18.493 1.00 0.00 N ATOM 215 C2 DT A 8 1.732 -0.654 18.662 1.00 0.00 C ATOM 216 O2 DT A 8 2.087 -1.826 18.744 1.00 0.00 O ATOM 217 N3 DT A 8 2.671 0.352 18.774 1.00 0.00 N ATOM 218 C4 DT A 8 2.401 1.705 18.788 1.00 0.00 C ATOM 219 O4 DT A 8 3.341 2.488 18.857 1.00 0.00 O ATOM 220 C5 DT A 8 0.980 2.044 18.724 1.00 0.00 C ATOM 221 C7 DT A 8 0.537 3.492 18.821 1.00 0.00 C ATOM 222 C6 DT A 8 0.046 1.067 18.578 1.00 0.00 C ATOM 0 H5' DT A 8 -3.855 0.106 16.926 1.00 0.00 H new ATOM 0 H5'' DT A 8 -4.828 -1.351 16.890 1.00 0.00 H new ATOM 0 H4' DT A 8 -3.089 -2.481 17.195 1.00 0.00 H new ATOM 0 H3' DT A 8 -3.494 -1.720 19.924 1.00 0.00 H new ATOM 0 H2' DT A 8 -1.384 -0.703 20.274 1.00 0.00 H new ATOM 0 H2'' DT A 8 -0.783 -2.348 20.230 1.00 0.00 H new ATOM 0 H1' DT A 8 -0.097 -2.167 17.927 1.00 0.00 H new ATOM 0 H3 DT A 8 3.648 0.071 18.853 1.00 0.00 H new ATOM 0 H71 DT A 8 -0.385 3.629 18.255 1.00 0.00 H new ATOM 0 H72 DT A 8 0.364 3.750 19.866 1.00 0.00 H new ATOM 0 H73 DT A 8 1.313 4.138 18.412 1.00 0.00 H new ATOM 0 H6 DT A 8 -0.998 1.338 18.528 1.00 0.00 H new ATOM 235 P DG A 9 -4.208 -4.257 19.530 1.00 0.00 P ATOM 236 OP1 DG A 9 -5.072 -3.404 20.375 1.00 0.00 O ATOM 237 OP2 DG A 9 -3.809 -5.606 19.987 1.00 0.00 O ATOM 238 O5' DG A 9 -4.865 -4.367 18.065 1.00 0.00 O ATOM 239 C5' DG A 9 -4.812 -5.584 17.339 1.00 0.00 C ATOM 240 C4' DG A 9 -5.628 -5.535 16.036 1.00 0.00 C ATOM 241 O4' DG A 9 -5.048 -4.688 15.062 1.00 0.00 O ATOM 242 C3' DG A 9 -5.669 -6.915 15.364 1.00 0.00 C ATOM 243 O3' DG A 9 -6.852 -7.111 14.605 1.00 0.00 O ATOM 244 C2' DG A 9 -4.470 -6.897 14.425 1.00 0.00 C ATOM 245 C1' DG A 9 -4.102 -5.411 14.289 1.00 0.00 C ATOM 246 N9 DG A 9 -2.726 -5.033 14.711 1.00 0.00 N ATOM 247 C8 DG A 9 -1.674 -5.811 15.140 1.00 0.00 C ATOM 248 N7 DG A 9 -0.603 -5.136 15.452 1.00 0.00 N ATOM 249 C5 DG A 9 -0.936 -3.815 15.140 1.00 0.00 C ATOM 250 C6 DG A 9 -0.174 -2.598 15.196 1.00 0.00 C ATOM 251 O6 DG A 9 0.968 -2.400 15.596 1.00 0.00 O ATOM 252 N1 DG A 9 -0.870 -1.492 14.751 1.00 0.00 N ATOM 253 C2 DG A 9 -2.171 -1.522 14.367 1.00 0.00 C ATOM 254 N2 DG A 9 -2.761 -0.358 14.234 1.00 0.00 N ATOM 255 N3 DG A 9 -2.908 -2.624 14.293 1.00 0.00 N ATOM 256 C4 DG A 9 -2.233 -3.748 14.681 1.00 0.00 C ATOM 0 H5' DG A 9 -5.186 -6.393 17.967 1.00 0.00 H new ATOM 0 H5'' DG A 9 -3.773 -5.817 17.104 1.00 0.00 H new ATOM 0 H4' DG A 9 -6.613 -5.177 16.337 1.00 0.00 H new ATOM 0 H3' DG A 9 -5.649 -7.715 16.104 1.00 0.00 H new ATOM 0 H2' DG A 9 -3.640 -7.475 14.832 1.00 0.00 H new ATOM 0 H2'' DG A 9 -4.718 -7.333 13.458 1.00 0.00 H new ATOM 0 HO3' DG A 9 -6.834 -8.001 14.195 1.00 0.00 H new ATOM 0 H1' DG A 9 -4.124 -5.175 13.225 1.00 0.00 H new ATOM 0 H8 DG A 9 -1.731 -6.887 15.212 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.377 -0.600 14.708 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.739 -0.312 13.948 1.00 0.00 H new ATOM 0 H22 DG A 9 -2.242 0.501 14.417 1.00 0.00 H new TER 269 DG A 9 HETATM 270 NA NA A 101 -2.568 1.288 12.288 1.00 0.00 NA HETATM 271 NA NA A 102 1.437 2.444 4.098 1.00 0.00 NA HETATM 272 NA NA A 103 -1.588 -5.510 20.060 1.00 0.00 NA HETATM 273 NA NA A 104 6.088 5.974 7.551 1.00 0.00 NA HETATM 274 NA NA A 105 -5.990 -1.400 20.563 1.00 0.00 NA HETATM 275 NA NA A 106 0.293 8.454 18.271 1.00 0.00 NA HETATM 276 NA NA A 107 -6.253 -6.627 4.530 1.00 0.00 NA HETATM 277 NA NA A 108 3.894 10.007 12.662 1.00 0.00 NA