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 -4.355 -8.966 11.412 1.00 0.00 O ATOM 2 C5' DC A 1 -4.134 -8.443 10.113 1.00 0.00 C ATOM 3 C4' DC A 1 -4.770 -7.051 9.929 1.00 0.00 C ATOM 4 O4' DC A 1 -4.273 -6.160 10.923 1.00 0.00 O ATOM 5 C3' DC A 1 -4.382 -6.460 8.566 1.00 0.00 C ATOM 6 O3' DC A 1 -5.390 -5.571 8.111 1.00 0.00 O ATOM 7 C2' DC A 1 -3.089 -5.737 8.916 1.00 0.00 C ATOM 8 C1' DC A 1 -3.415 -5.212 10.313 1.00 0.00 C ATOM 9 N1 DC A 1 -2.174 -5.019 11.101 1.00 0.00 N ATOM 10 C2 DC A 1 -1.666 -3.725 11.241 1.00 0.00 C ATOM 11 O2 DC A 1 -2.301 -2.752 10.845 1.00 0.00 O ATOM 12 N3 DC A 1 -0.442 -3.524 11.795 1.00 0.00 N ATOM 13 C4 DC A 1 0.273 -4.574 12.170 1.00 0.00 C ATOM 14 N4 DC A 1 1.447 -4.330 12.701 1.00 0.00 N ATOM 15 C5 DC A 1 -0.197 -5.913 12.026 1.00 0.00 C ATOM 16 C6 DC A 1 -1.430 -6.097 11.500 1.00 0.00 C ATOM 0 H5' DC A 1 -4.545 -9.129 9.372 1.00 0.00 H new ATOM 0 H5'' DC A 1 -3.062 -8.378 9.927 1.00 0.00 H new ATOM 0 H4' DC A 1 -5.851 -7.165 10.004 1.00 0.00 H new ATOM 0 H3' DC A 1 -4.267 -7.185 7.760 1.00 0.00 H new ATOM 0 H2' DC A 1 -2.230 -6.407 8.918 1.00 0.00 H new ATOM 0 H2'' DC A 1 -2.864 -4.933 8.216 1.00 0.00 H new ATOM 0 HO5' DC A 1 -3.937 -9.849 11.485 1.00 0.00 H new ATOM 0 H1' DC A 1 -3.905 -4.240 10.261 1.00 0.00 H new ATOM 0 H41 DC A 1 2.039 -5.102 13.007 1.00 0.00 H new ATOM 0 H42 DC A 1 1.768 -3.368 12.808 1.00 0.00 H new ATOM 0 H5 DC A 1 0.412 -6.753 12.327 1.00 0.00 H new ATOM 0 H6 DC A 1 -1.828 -7.096 11.395 1.00 0.00 H new ATOM 29 P DC A 2 -5.400 -4.998 6.609 1.00 0.00 P ATOM 30 OP1 DC A 2 -6.787 -4.637 6.252 1.00 0.00 O ATOM 31 OP2 DC A 2 -4.787 -5.998 5.709 1.00 0.00 O ATOM 32 O5' DC A 2 -4.507 -3.667 6.606 1.00 0.00 O ATOM 33 C5' DC A 2 -4.433 -2.833 5.458 1.00 0.00 C ATOM 34 C4' DC A 2 -3.775 -1.472 5.743 1.00 0.00 C ATOM 35 O4' DC A 2 -4.558 -0.768 6.703 1.00 0.00 O ATOM 36 C3' DC A 2 -2.343 -1.545 6.289 1.00 0.00 C ATOM 37 O3' DC A 2 -1.628 -0.418 5.797 1.00 0.00 O ATOM 38 C2' DC A 2 -2.597 -1.472 7.788 1.00 0.00 C ATOM 39 C1' DC A 2 -3.732 -0.459 7.812 1.00 0.00 C ATOM 40 N1 DC A 2 -4.468 -0.536 9.096 1.00 0.00 N ATOM 41 C2 DC A 2 -4.149 0.375 10.105 1.00 0.00 C ATOM 42 O2 DC A 2 -3.370 1.324 9.943 1.00 0.00 O ATOM 43 N3 DC A 2 -4.622 0.193 11.356 1.00 0.00 N ATOM 44 C4 DC A 2 -5.430 -0.819 11.606 1.00 0.00 C ATOM 45 N4 DC A 2 -5.919 -0.835 12.821 1.00 0.00 N ATOM 46 C5 DC A 2 -5.792 -1.782 10.616 1.00 0.00 C ATOM 47 C6 DC A 2 -5.288 -1.606 9.367 1.00 0.00 C ATOM 0 H5' DC A 2 -5.438 -2.670 5.069 1.00 0.00 H new ATOM 0 H5'' DC A 2 -3.870 -3.346 4.679 1.00 0.00 H new ATOM 0 H4' DC A 2 -3.725 -0.970 4.777 1.00 0.00 H new ATOM 0 H3' DC A 2 -1.755 -2.419 6.010 1.00 0.00 H new ATOM 0 H2' DC A 2 -2.888 -2.434 8.209 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.723 -1.132 8.343 1.00 0.00 H new ATOM 0 H1' DC A 2 -3.367 0.565 7.738 1.00 0.00 H new ATOM 0 H41 DC A 2 -6.554 -1.581 13.105 1.00 0.00 H new ATOM 0 H42 DC A 2 -5.665 -0.102 13.483 1.00 0.00 H new ATOM 0 H5 DC A 2 -6.439 -2.615 10.850 1.00 0.00 H new ATOM 0 H6 DC A 2 -5.532 -2.309 8.584 1.00 0.00 H new ATOM 59 P DT A 3 -0.041 -0.259 5.995 1.00 0.00 P ATOM 60 OP1 DT A 3 0.421 0.834 5.105 1.00 0.00 O ATOM 61 OP2 DT A 3 0.585 -1.591 5.903 1.00 0.00 O ATOM 62 O5' DT A 3 0.071 0.239 7.523 1.00 0.00 O ATOM 63 C5' DT A 3 0.740 1.424 7.935 1.00 0.00 C ATOM 64 C4' DT A 3 2.207 1.187 8.319 1.00 0.00 C ATOM 65 O4' DT A 3 2.289 0.095 9.215 1.00 0.00 O ATOM 66 C3' DT A 3 3.172 0.946 7.150 1.00 0.00 C ATOM 67 O3' DT A 3 4.226 1.904 7.117 1.00 0.00 O ATOM 68 C2' DT A 3 3.727 -0.446 7.428 1.00 0.00 C ATOM 69 C1' DT A 3 3.412 -0.697 8.904 1.00 0.00 C ATOM 70 N1 DT A 3 3.076 -2.121 9.170 1.00 0.00 N ATOM 71 C2 DT A 3 4.006 -2.909 9.854 1.00 0.00 C ATOM 72 O2 DT A 3 5.086 -2.490 10.257 1.00 0.00 O ATOM 73 N3 DT A 3 3.676 -4.235 10.040 1.00 0.00 N ATOM 74 C4 DT A 3 2.534 -4.858 9.578 1.00 0.00 C ATOM 75 O4 DT A 3 2.383 -6.054 9.809 1.00 0.00 O ATOM 76 C5 DT A 3 1.617 -3.984 8.848 1.00 0.00 C ATOM 77 C7 DT A 3 0.335 -4.540 8.257 1.00 0.00 C ATOM 78 C6 DT A 3 1.906 -2.666 8.683 1.00 0.00 C ATOM 0 H5' DT A 3 0.213 1.854 8.787 1.00 0.00 H new ATOM 0 H5'' DT A 3 0.696 2.157 7.130 1.00 0.00 H new ATOM 0 H4' DT A 3 2.532 2.122 8.776 1.00 0.00 H new ATOM 0 H3' DT A 3 2.674 1.034 6.185 1.00 0.00 H new ATOM 0 H2' DT A 3 3.258 -1.195 6.789 1.00 0.00 H new ATOM 0 H2'' DT A 3 4.799 -0.491 7.238 1.00 0.00 H new ATOM 0 H1' DT A 3 4.285 -0.450 9.508 1.00 0.00 H new ATOM 0 H3 DT A 3 4.336 -4.807 10.567 1.00 0.00 H new ATOM 0 H71 DT A 3 -0.426 -3.760 8.241 1.00 0.00 H new ATOM 0 H72 DT A 3 0.523 -4.885 7.240 1.00 0.00 H new ATOM 0 H73 DT A 3 -0.014 -5.375 8.865 1.00 0.00 H new ATOM 0 H6 DT A 3 1.205 -2.032 8.160 1.00 0.00 H new ATOM 91 P DG A 4 4.031 3.355 6.436 1.00 0.00 P ATOM 92 OP1 DG A 4 3.329 3.172 5.145 1.00 0.00 O ATOM 93 OP2 DG A 4 5.322 4.088 6.490 1.00 0.00 O ATOM 94 O5' DG A 4 3.029 4.101 7.444 1.00 0.00 O ATOM 95 C5' DG A 4 3.549 4.901 8.487 1.00 0.00 C ATOM 96 C4' DG A 4 2.544 5.239 9.583 1.00 0.00 C ATOM 97 O4' DG A 4 1.696 4.146 9.914 1.00 0.00 O ATOM 98 C3' DG A 4 3.288 5.616 10.868 1.00 0.00 C ATOM 99 O3' DG A 4 3.665 6.979 10.948 1.00 0.00 O ATOM 100 C2' DG A 4 2.208 5.306 11.886 1.00 0.00 C ATOM 101 C1' DG A 4 1.548 4.059 11.320 1.00 0.00 C ATOM 102 N9 DG A 4 2.156 2.789 11.783 1.00 0.00 N ATOM 103 C8 DG A 4 3.414 2.510 12.259 1.00 0.00 C ATOM 104 N7 DG A 4 3.616 1.251 12.544 1.00 0.00 N ATOM 105 C5 DG A 4 2.397 0.639 12.236 1.00 0.00 C ATOM 106 C6 DG A 4 1.957 -0.731 12.304 1.00 0.00 C ATOM 107 O6 DG A 4 2.549 -1.747 12.664 1.00 0.00 O ATOM 108 N1 DG A 4 0.655 -0.899 11.879 1.00 0.00 N ATOM 109 C2 DG A 4 -0.118 0.109 11.403 1.00 0.00 C ATOM 110 N2 DG A 4 -1.293 -0.201 10.923 1.00 0.00 N ATOM 111 N3 DG A 4 0.206 1.393 11.397 1.00 0.00 N ATOM 112 C4 DG A 4 1.495 1.589 11.798 1.00 0.00 C ATOM 0 H5' DG A 4 3.930 5.829 8.061 1.00 0.00 H new ATOM 0 H5'' DG A 4 4.398 4.385 8.936 1.00 0.00 H new ATOM 0 H4' DG A 4 1.940 6.059 9.194 1.00 0.00 H new ATOM 0 H3' DG A 4 4.238 5.094 10.981 1.00 0.00 H new ATOM 0 H2' DG A 4 2.627 5.126 12.876 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.499 6.128 11.984 1.00 0.00 H new ATOM 0 H1' DG A 4 0.512 4.032 11.656 1.00 0.00 H new ATOM 0 H8 DG A 4 4.173 3.268 12.387 1.00 0.00 H new ATOM 0 H1 DG A 4 0.251 -1.834 11.925 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.903 0.530 10.556 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.600 -1.174 10.915 1.00 0.00 H new HETATM 124 O5' 3DR A 5 6.024 6.628 11.776 1.00 0.00 O HETATM 125 P 3DR A 5 5.181 7.447 10.673 1.00 0.00 P HETATM 126 OP1 3DR A 5 5.234 8.887 11.017 1.00 0.00 O HETATM 127 OP2 3DR A 5 5.605 6.973 9.332 1.00 0.00 O HETATM 128 C2' 3DR A 5 5.528 6.086 16.232 1.00 0.00 C HETATM 129 C5' 3DR A 5 6.091 6.996 13.150 1.00 0.00 C HETATM 130 C4' 3DR A 5 4.852 6.557 13.961 1.00 0.00 C HETATM 131 O4' 3DR A 5 4.838 5.150 14.163 1.00 0.00 O HETATM 132 C1' 3DR A 5 5.611 4.864 15.316 1.00 0.00 C HETATM 133 C3' 3DR A 5 4.831 7.151 15.381 1.00 0.00 C HETATM 134 O3' 3DR A 5 3.518 7.345 15.902 1.00 0.00 O HETATM 0 H5'' 3DR A 5 6.983 6.554 13.594 1.00 0.00 H new HETATM 0 H4'1 3DR A 5 4.003 6.906 13.373 1.00 0.00 H new HETATM 0 H2'' 3DR A 5 4.962 5.867 17.137 1.00 0.00 H new HETATM 0 H1'2 3DR A 5 6.646 4.657 15.044 1.00 0.00 H new HETATM 0 H1'1 3DR A 5 5.232 3.977 15.823 1.00 0.00 H new HETATM 0 H5' 3DR A 5 6.201 8.078 13.224 1.00 0.00 H new HETATM 0 H3' 3DR A 5 5.301 8.134 15.382 1.00 0.00 H new HETATM 0 H2' 3DR A 5 6.518 6.414 16.547 1.00 0.00 H new ATOM 143 P DC A 6 2.462 8.377 15.262 1.00 0.00 P ATOM 144 OP1 DC A 6 3.184 9.336 14.391 1.00 0.00 O ATOM 145 OP2 DC A 6 1.564 8.865 16.340 1.00 0.00 O ATOM 146 O5' DC A 6 1.607 7.416 14.308 1.00 0.00 O ATOM 147 C5' DC A 6 0.447 7.872 13.627 1.00 0.00 C ATOM 148 C4' DC A 6 -0.744 6.943 13.912 1.00 0.00 C ATOM 149 O4' DC A 6 -0.438 5.579 13.616 1.00 0.00 O ATOM 150 C3' DC A 6 -1.128 7.030 15.389 1.00 0.00 C ATOM 151 O3' DC A 6 -2.523 7.210 15.559 1.00 0.00 O ATOM 152 C2' DC A 6 -0.631 5.711 15.957 1.00 0.00 C ATOM 153 C1' DC A 6 -0.768 4.788 14.745 1.00 0.00 C ATOM 154 N1 DC A 6 0.087 3.567 14.841 1.00 0.00 N ATOM 155 C2 DC A 6 -0.514 2.308 14.701 1.00 0.00 C ATOM 156 O2 DC A 6 -1.680 2.191 14.316 1.00 0.00 O ATOM 157 N3 DC A 6 0.180 1.169 14.963 1.00 0.00 N ATOM 158 C4 DC A 6 1.458 1.268 15.304 1.00 0.00 C ATOM 159 N4 DC A 6 2.126 0.156 15.501 1.00 0.00 N ATOM 160 C5 DC A 6 2.136 2.519 15.397 1.00 0.00 C ATOM 161 C6 DC A 6 1.424 3.648 15.155 1.00 0.00 C ATOM 0 H5' DC A 6 0.639 7.909 12.555 1.00 0.00 H new ATOM 0 H5'' DC A 6 0.208 8.887 13.943 1.00 0.00 H new ATOM 0 H4' DC A 6 -1.565 7.269 13.274 1.00 0.00 H new ATOM 0 H3' DC A 6 -0.690 7.889 15.898 1.00 0.00 H new ATOM 0 H2' DC A 6 0.399 5.777 16.308 1.00 0.00 H new ATOM 0 H2'' DC A 6 -1.234 5.374 16.800 1.00 0.00 H new ATOM 0 H1' DC A 6 -1.783 4.398 14.677 1.00 0.00 H new ATOM 0 H41 DC A 6 3.111 0.192 15.764 1.00 0.00 H new ATOM 0 H42 DC A 6 1.661 -0.745 15.391 1.00 0.00 H new ATOM 0 H5 DC A 6 3.184 2.566 15.652 1.00 0.00 H new ATOM 0 H6 DC A 6 1.908 4.612 15.209 1.00 0.00 H new ATOM 173 P DC A 7 -3.139 7.627 16.991 1.00 0.00 P ATOM 174 OP1 DC A 7 -4.300 8.500 16.738 1.00 0.00 O ATOM 175 OP2 DC A 7 -2.017 8.101 17.845 1.00 0.00 O ATOM 176 O5' DC A 7 -3.658 6.199 17.528 1.00 0.00 O ATOM 177 C5' DC A 7 -4.849 6.063 18.291 1.00 0.00 C ATOM 178 C4' DC A 7 -5.442 4.642 18.217 1.00 0.00 C ATOM 179 O4' DC A 7 -5.991 4.431 16.920 1.00 0.00 O ATOM 180 C3' DC A 7 -4.432 3.516 18.467 1.00 0.00 C ATOM 181 O3' DC A 7 -5.109 2.411 19.053 1.00 0.00 O ATOM 182 C2' DC A 7 -3.985 3.179 17.051 1.00 0.00 C ATOM 183 C1' DC A 7 -5.290 3.372 16.285 1.00 0.00 C ATOM 184 N1 DC A 7 -5.022 3.661 14.854 1.00 0.00 N ATOM 185 C2 DC A 7 -4.884 2.582 13.975 1.00 0.00 C ATOM 186 O2 DC A 7 -5.089 1.412 14.318 1.00 0.00 O ATOM 187 N3 DC A 7 -4.472 2.808 12.703 1.00 0.00 N ATOM 188 C4 DC A 7 -4.301 4.041 12.274 1.00 0.00 C ATOM 189 N4 DC A 7 -3.910 4.129 11.027 1.00 0.00 N ATOM 190 C5 DC A 7 -4.467 5.181 13.115 1.00 0.00 C ATOM 191 C6 DC A 7 -4.806 4.948 14.411 1.00 0.00 C ATOM 0 H5' DC A 7 -5.588 6.780 17.934 1.00 0.00 H new ATOM 0 H5'' DC A 7 -4.640 6.312 19.331 1.00 0.00 H new ATOM 0 H4' DC A 7 -6.188 4.598 19.010 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.609 3.774 19.133 1.00 0.00 H new ATOM 0 H2' DC A 7 -3.196 3.843 16.698 1.00 0.00 H new ATOM 0 H2'' DC A 7 -3.605 2.161 16.969 1.00 0.00 H new ATOM 0 H1' DC A 7 -5.894 2.465 16.301 1.00 0.00 H new ATOM 0 H41 DC A 7 -3.751 5.044 10.606 1.00 0.00 H new ATOM 0 H42 DC A 7 -3.764 3.282 10.477 1.00 0.00 H new ATOM 0 H5 DC A 7 -4.330 6.184 12.739 1.00 0.00 H new ATOM 0 H6 DC A 7 -4.907 5.776 15.097 1.00 0.00 H new ATOM 203 P DT A 8 -4.336 1.324 19.949 1.00 0.00 P ATOM 204 OP1 DT A 8 -5.323 0.352 20.479 1.00 0.00 O ATOM 205 OP2 DT A 8 -3.435 2.035 20.874 1.00 0.00 O ATOM 206 O5' DT A 8 -3.409 0.540 18.900 1.00 0.00 O ATOM 207 C5' DT A 8 -3.898 -0.449 18.006 1.00 0.00 C ATOM 208 C4' DT A 8 -2.898 -1.608 17.979 1.00 0.00 C ATOM 209 O4' DT A 8 -1.647 -1.138 17.494 1.00 0.00 O ATOM 210 C3' DT A 8 -2.672 -2.172 19.388 1.00 0.00 C ATOM 211 O3' DT A 8 -2.746 -3.587 19.411 1.00 0.00 O ATOM 212 C2' DT A 8 -1.281 -1.681 19.757 1.00 0.00 C ATOM 213 C1' DT A 8 -0.610 -1.451 18.408 1.00 0.00 C ATOM 214 N1 DT A 8 0.375 -0.341 18.500 1.00 0.00 N ATOM 215 C2 DT A 8 1.730 -0.664 18.626 1.00 0.00 C ATOM 216 O2 DT A 8 2.150 -1.814 18.691 1.00 0.00 O ATOM 217 N3 DT A 8 2.614 0.393 18.708 1.00 0.00 N ATOM 218 C4 DT A 8 2.272 1.730 18.713 1.00 0.00 C ATOM 219 O4 DT A 8 3.171 2.562 18.743 1.00 0.00 O ATOM 220 C5 DT A 8 0.834 1.993 18.682 1.00 0.00 C ATOM 221 C7 DT A 8 0.317 3.417 18.768 1.00 0.00 C ATOM 222 C6 DT A 8 -0.051 0.967 18.579 1.00 0.00 C ATOM 0 H5' DT A 8 -4.021 -0.030 17.007 1.00 0.00 H new ATOM 0 H5'' DT A 8 -4.878 -0.801 18.328 1.00 0.00 H new ATOM 0 H4' DT A 8 -3.303 -2.388 17.335 1.00 0.00 H new ATOM 0 H3' DT A 8 -3.436 -1.843 20.092 1.00 0.00 H new ATOM 0 H2' DT A 8 -1.323 -0.764 20.345 1.00 0.00 H new ATOM 0 H2'' DT A 8 -0.741 -2.417 20.352 1.00 0.00 H new ATOM 0 H1' DT A 8 -0.059 -2.333 18.082 1.00 0.00 H new ATOM 0 H3 DT A 8 3.606 0.166 18.770 1.00 0.00 H new ATOM 0 H71 DT A 8 -0.625 3.495 18.225 1.00 0.00 H new ATOM 0 H72 DT A 8 0.157 3.684 19.813 1.00 0.00 H new ATOM 0 H73 DT A 8 1.047 4.096 18.328 1.00 0.00 H new ATOM 0 H6 DT A 8 -1.109 1.181 18.559 1.00 0.00 H new ATOM 235 P DG A 9 -4.164 -4.333 19.596 1.00 0.00 P ATOM 236 OP1 DG A 9 -5.018 -3.495 20.468 1.00 0.00 O ATOM 237 OP2 DG A 9 -3.765 -5.691 20.025 1.00 0.00 O ATOM 238 O5' DG A 9 -4.835 -4.415 18.137 1.00 0.00 O ATOM 239 C5' DG A 9 -4.695 -5.575 17.333 1.00 0.00 C ATOM 240 C4' DG A 9 -5.600 -5.528 16.090 1.00 0.00 C ATOM 241 O4' DG A 9 -5.116 -4.662 15.075 1.00 0.00 O ATOM 242 C3' DG A 9 -5.678 -6.885 15.382 1.00 0.00 C ATOM 243 O3' DG A 9 -6.917 -7.024 14.716 1.00 0.00 O ATOM 244 C2' DG A 9 -4.552 -6.840 14.352 1.00 0.00 C ATOM 245 C1' DG A 9 -4.183 -5.352 14.248 1.00 0.00 C ATOM 246 N9 DG A 9 -2.794 -4.987 14.642 1.00 0.00 N ATOM 247 C8 DG A 9 -1.724 -5.776 15.007 1.00 0.00 C ATOM 248 N7 DG A 9 -0.648 -5.109 15.317 1.00 0.00 N ATOM 249 C5 DG A 9 -0.993 -3.779 15.061 1.00 0.00 C ATOM 250 C6 DG A 9 -0.228 -2.565 15.126 1.00 0.00 C ATOM 251 O6 DG A 9 0.928 -2.378 15.492 1.00 0.00 O ATOM 252 N1 DG A 9 -0.934 -1.450 14.726 1.00 0.00 N ATOM 253 C2 DG A 9 -2.248 -1.470 14.391 1.00 0.00 C ATOM 254 N2 DG A 9 -2.837 -0.302 14.294 1.00 0.00 N ATOM 255 N3 DG A 9 -2.990 -2.569 14.306 1.00 0.00 N ATOM 256 C4 DG A 9 -2.304 -3.701 14.643 1.00 0.00 C ATOM 0 H5' DG A 9 -4.938 -6.458 17.925 1.00 0.00 H new ATOM 0 H5'' DG A 9 -3.656 -5.676 17.021 1.00 0.00 H new ATOM 0 H4' DG A 9 -6.557 -5.195 16.492 1.00 0.00 H new ATOM 0 H3' DG A 9 -5.588 -7.718 16.079 1.00 0.00 H new ATOM 0 H2' DG A 9 -3.699 -7.439 14.671 1.00 0.00 H new ATOM 0 H2'' DG A 9 -4.878 -7.236 13.390 1.00 0.00 H new ATOM 0 HO3' DG A 9 -6.951 -7.895 14.267 1.00 0.00 H new ATOM 0 H1' DG A 9 -4.227 -5.076 13.194 1.00 0.00 H new ATOM 0 H8 DG A 9 -1.773 -6.855 15.034 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.440 -0.559 14.679 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.825 -0.248 14.045 1.00 0.00 H new ATOM 0 H22 DG A 9 -2.307 0.552 14.467 1.00 0.00 H new TER 269 DG A 9 HETATM 270 NA NA A 101 1.646 2.305 4.039 1.00 0.00 NA HETATM 271 NA NA A 102 3.963 9.993 12.435 1.00 0.00 NA HETATM 272 NA NA A 103 -6.049 -1.634 21.047 1.00 0.00 NA HETATM 273 NA NA A 104 6.326 5.697 7.655 1.00 0.00 NA HETATM 274 NA NA A 105 -2.664 1.319 12.348 1.00 0.00 NA HETATM 275 NA NA A 106 -1.545 -5.614 20.056 1.00 0.00 NA HETATM 276 NA NA A 107 -6.732 -6.100 4.485 1.00 0.00 NA HETATM 277 NA NA A 108 0.028 8.960 17.939 1.00 0.00 NA