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= -0.352 (180deg=-0.352) USER MOD Single : A 9 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -5.717 -9.134 9.601 1.00 0.00 O ATOM 2 C5' DC A 1 -4.700 -8.514 10.369 1.00 0.00 C ATOM 3 C4' DC A 1 -4.694 -6.996 10.153 1.00 0.00 C ATOM 4 O4' DC A 1 -3.848 -6.390 11.119 1.00 0.00 O ATOM 5 C3' DC A 1 -4.185 -6.592 8.763 1.00 0.00 C ATOM 6 O3' DC A 1 -5.111 -5.680 8.197 1.00 0.00 O ATOM 7 C2' DC A 1 -2.838 -5.943 9.079 1.00 0.00 C ATOM 8 C1' DC A 1 -3.102 -5.381 10.472 1.00 0.00 C ATOM 9 N1 DC A 1 -1.841 -5.092 11.202 1.00 0.00 N ATOM 10 C2 DC A 1 -1.408 -3.768 11.305 1.00 0.00 C ATOM 11 O2 DC A 1 -2.100 -2.845 10.883 1.00 0.00 O ATOM 12 N3 DC A 1 -0.192 -3.475 11.840 1.00 0.00 N ATOM 13 C4 DC A 1 0.576 -4.471 12.258 1.00 0.00 C ATOM 14 N4 DC A 1 1.751 -4.150 12.750 1.00 0.00 N ATOM 15 C5 DC A 1 0.178 -5.839 12.167 1.00 0.00 C ATOM 16 C6 DC A 1 -1.036 -6.112 11.635 1.00 0.00 C ATOM 0 H5' DC A 1 -3.730 -8.927 10.095 1.00 0.00 H new ATOM 0 H5'' DC A 1 -4.853 -8.734 11.426 1.00 0.00 H new ATOM 0 H4' DC A 1 -5.727 -6.661 10.248 1.00 0.00 H new ATOM 0 H3' DC A 1 -4.081 -7.404 8.043 1.00 0.00 H new ATOM 0 H2' DC A 1 -2.022 -6.665 9.074 1.00 0.00 H new ATOM 0 H2'' DC A 1 -2.578 -5.163 8.363 1.00 0.00 H new ATOM 0 HO5' DC A 1 -5.699 -10.102 9.755 1.00 0.00 H new ATOM 0 H1' DC A 1 -3.631 -4.429 10.433 1.00 0.00 H new ATOM 0 H41 DC A 1 2.380 -4.880 13.085 1.00 0.00 H new ATOM 0 H42 DC A 1 2.034 -3.171 12.797 1.00 0.00 H new ATOM 0 H5 DC A 1 0.826 -6.631 12.512 1.00 0.00 H new ATOM 0 H6 DC A 1 -1.371 -7.136 11.552 1.00 0.00 H new ATOM 29 P DC A 2 -5.091 -5.302 6.637 1.00 0.00 P ATOM 30 OP1 DC A 2 -6.473 -4.998 6.209 1.00 0.00 O ATOM 31 OP2 DC A 2 -4.440 -6.385 5.870 1.00 0.00 O ATOM 32 O5' DC A 2 -4.208 -3.974 6.544 1.00 0.00 O ATOM 33 C5' DC A 2 -4.274 -3.109 5.421 1.00 0.00 C ATOM 34 C4' DC A 2 -3.698 -1.722 5.740 1.00 0.00 C ATOM 35 O4' DC A 2 -4.501 -1.118 6.750 1.00 0.00 O ATOM 36 C3' DC A 2 -2.249 -1.724 6.254 1.00 0.00 C ATOM 37 O3' DC A 2 -1.622 -0.540 5.776 1.00 0.00 O ATOM 38 C2' DC A 2 -2.468 -1.702 7.761 1.00 0.00 C ATOM 39 C1' DC A 2 -3.642 -0.741 7.809 1.00 0.00 C ATOM 40 N1 DC A 2 -4.298 -0.765 9.134 1.00 0.00 N ATOM 41 C2 DC A 2 -3.912 0.201 10.064 1.00 0.00 C ATOM 42 O2 DC A 2 -3.114 1.110 9.802 1.00 0.00 O ATOM 43 N3 DC A 2 -4.335 0.115 11.342 1.00 0.00 N ATOM 44 C4 DC A 2 -5.128 -0.871 11.702 1.00 0.00 C ATOM 45 N4 DC A 2 -5.553 -0.770 12.939 1.00 0.00 N ATOM 46 C5 DC A 2 -5.532 -1.907 10.805 1.00 0.00 C ATOM 47 C6 DC A 2 -5.098 -1.815 9.518 1.00 0.00 C ATOM 0 H5' DC A 2 -5.311 -3.008 5.100 1.00 0.00 H new ATOM 0 H5'' DC A 2 -3.724 -3.549 4.589 1.00 0.00 H new ATOM 0 H4' DC A 2 -3.702 -1.178 4.795 1.00 0.00 H new ATOM 0 H3' DC A 2 -1.617 -2.555 5.941 1.00 0.00 H new ATOM 0 H2' DC A 2 -2.710 -2.684 8.167 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.600 -1.336 8.309 1.00 0.00 H new ATOM 0 H1' DC A 2 -3.328 0.295 7.678 1.00 0.00 H new ATOM 0 H41 DC A 2 -6.175 -1.481 13.324 1.00 0.00 H new ATOM 0 H42 DC A 2 -5.262 0.019 13.515 1.00 0.00 H new ATOM 0 H5 DC A 2 -6.154 -2.727 11.133 1.00 0.00 H new ATOM 0 H6 DC A 2 -5.383 -2.568 8.798 1.00 0.00 H new ATOM 59 P DT A 3 -0.044 -0.282 5.929 1.00 0.00 P ATOM 60 OP1 DT A 3 0.308 0.862 5.055 1.00 0.00 O ATOM 61 OP2 DT A 3 0.664 -1.568 5.776 1.00 0.00 O ATOM 62 O5' DT A 3 0.098 0.183 7.466 1.00 0.00 O ATOM 63 C5' DT A 3 0.676 1.415 7.885 1.00 0.00 C ATOM 64 C4' DT A 3 2.173 1.310 8.204 1.00 0.00 C ATOM 65 O4' DT A 3 2.379 0.236 9.101 1.00 0.00 O ATOM 66 C3' DT A 3 3.107 1.139 6.999 1.00 0.00 C ATOM 67 O3' DT A 3 4.085 2.175 6.932 1.00 0.00 O ATOM 68 C2' DT A 3 3.767 -0.213 7.249 1.00 0.00 C ATOM 69 C1' DT A 3 3.529 -0.490 8.736 1.00 0.00 C ATOM 70 N1 DT A 3 3.272 -1.926 9.029 1.00 0.00 N ATOM 71 C2 DT A 3 4.218 -2.632 9.777 1.00 0.00 C ATOM 72 O2 DT A 3 5.278 -2.151 10.163 1.00 0.00 O ATOM 73 N3 DT A 3 3.928 -3.952 10.055 1.00 0.00 N ATOM 74 C4 DT A 3 2.808 -4.642 9.632 1.00 0.00 C ATOM 75 O4 DT A 3 2.687 -5.819 9.955 1.00 0.00 O ATOM 76 C5 DT A 3 1.875 -3.856 8.828 1.00 0.00 C ATOM 77 C7 DT A 3 0.614 -4.495 8.272 1.00 0.00 C ATOM 78 C6 DT A 3 2.128 -2.546 8.566 1.00 0.00 C ATOM 0 H5' DT A 3 0.148 1.773 8.769 1.00 0.00 H new ATOM 0 H5'' DT A 3 0.530 2.160 7.103 1.00 0.00 H new ATOM 0 H4' DT A 3 2.439 2.275 8.636 1.00 0.00 H new ATOM 0 H3' DT A 3 2.572 1.190 6.051 1.00 0.00 H new ATOM 0 H2' DT A 3 3.326 -0.991 6.625 1.00 0.00 H new ATOM 0 H2'' DT A 3 4.832 -0.183 7.017 1.00 0.00 H new ATOM 0 H1' DT A 3 4.423 -0.202 9.288 1.00 0.00 H new ATOM 0 H3 DT A 3 4.601 -4.465 10.624 1.00 0.00 H new ATOM 0 H71 DT A 3 -0.169 -3.741 8.188 1.00 0.00 H new ATOM 0 H72 DT A 3 0.822 -4.914 7.287 1.00 0.00 H new ATOM 0 H73 DT A 3 0.283 -5.289 8.941 1.00 0.00 H new ATOM 0 H6 DT A 3 1.419 -1.978 7.983 1.00 0.00 H new ATOM 91 P DG A 4 3.749 3.620 6.286 1.00 0.00 P ATOM 92 OP1 DG A 4 3.011 3.405 5.021 1.00 0.00 O ATOM 93 OP2 DG A 4 4.978 4.455 6.301 1.00 0.00 O ATOM 94 O5' DG A 4 2.732 4.267 7.351 1.00 0.00 O ATOM 95 C5' DG A 4 3.230 5.116 8.368 1.00 0.00 C ATOM 96 C4' DG A 4 2.262 5.418 9.511 1.00 0.00 C ATOM 97 O4' DG A 4 1.474 4.296 9.889 1.00 0.00 O ATOM 98 C3' DG A 4 3.050 5.849 10.757 1.00 0.00 C ATOM 99 O3' DG A 4 3.308 7.237 10.845 1.00 0.00 O ATOM 100 C2' DG A 4 2.089 5.438 11.855 1.00 0.00 C ATOM 101 C1' DG A 4 1.473 4.158 11.299 1.00 0.00 C ATOM 102 N9 DG A 4 2.203 2.912 11.651 1.00 0.00 N ATOM 103 C8 DG A 4 3.507 2.707 12.030 1.00 0.00 C ATOM 104 N7 DG A 4 3.801 1.466 12.310 1.00 0.00 N ATOM 105 C5 DG A 4 2.602 0.781 12.092 1.00 0.00 C ATOM 106 C6 DG A 4 2.242 -0.610 12.216 1.00 0.00 C ATOM 107 O6 DG A 4 2.893 -1.582 12.593 1.00 0.00 O ATOM 108 N1 DG A 4 0.942 -0.865 11.833 1.00 0.00 N ATOM 109 C2 DG A 4 0.105 0.082 11.352 1.00 0.00 C ATOM 110 N2 DG A 4 -1.044 -0.313 10.876 1.00 0.00 N ATOM 111 N3 DG A 4 0.334 1.387 11.345 1.00 0.00 N ATOM 112 C4 DG A 4 1.624 1.670 11.689 1.00 0.00 C ATOM 0 H5' DG A 4 3.532 6.059 7.913 1.00 0.00 H new ATOM 0 H5'' DG A 4 4.128 4.662 8.787 1.00 0.00 H new ATOM 0 H4' DG A 4 1.602 6.204 9.145 1.00 0.00 H new ATOM 0 H3' DG A 4 4.045 5.406 10.782 1.00 0.00 H new ATOM 0 H2' DG A 4 2.604 5.262 12.799 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.335 6.203 12.041 1.00 0.00 H new ATOM 0 H1' DG A 4 0.480 4.049 11.736 1.00 0.00 H new ATOM 0 H8 DG A 4 4.230 3.507 12.091 1.00 0.00 H new ATOM 0 H1 DG A 4 0.593 -1.820 11.917 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.704 0.370 10.504 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.282 -1.305 10.876 1.00 0.00 H new HETATM 124 O5' 3DR A 5 5.771 7.130 11.370 1.00 0.00 O HETATM 125 P 3DR A 5 4.721 7.866 10.400 1.00 0.00 P HETATM 126 OP1 3DR A 5 4.666 9.299 10.770 1.00 0.00 O HETATM 127 OP2 3DR A 5 5.043 7.455 9.011 1.00 0.00 O HETATM 128 C2' 3DR A 5 5.994 6.072 15.835 1.00 0.00 C HETATM 129 C5' 3DR A 5 5.979 7.490 12.731 1.00 0.00 C HETATM 130 C4' 3DR A 5 5.048 6.744 13.712 1.00 0.00 C HETATM 131 O4' 3DR A 5 5.348 5.352 13.682 1.00 0.00 O HETATM 132 C1' 3DR A 5 5.510 4.886 15.009 1.00 0.00 C HETATM 133 C3' 3DR A 5 5.228 7.219 15.176 1.00 0.00 C HETATM 134 O3' 3DR A 5 4.018 7.355 15.918 1.00 0.00 O HETATM 0 H5'' 3DR A 5 7.016 7.285 12.999 1.00 0.00 H new HETATM 0 H4'1 3DR A 5 4.026 6.951 13.395 1.00 0.00 H new HETATM 0 H2'' 3DR A 5 5.749 5.966 16.892 1.00 0.00 H new HETATM 0 H1'2 3DR A 5 6.230 4.069 15.047 1.00 0.00 H new HETATM 0 H1'1 3DR A 5 4.569 4.500 15.401 1.00 0.00 H new HETATM 0 H5' 3DR A 5 5.827 8.564 12.842 1.00 0.00 H new HETATM 0 H3' 3DR A 5 5.701 8.201 15.169 1.00 0.00 H new HETATM 0 H2' 3DR A 5 7.074 6.206 15.770 1.00 0.00 H new ATOM 143 P DC A 6 2.818 8.346 15.510 1.00 0.00 P ATOM 144 OP1 DC A 6 3.275 9.281 14.452 1.00 0.00 O ATOM 145 OP2 DC A 6 2.152 8.861 16.734 1.00 0.00 O ATOM 146 O5' DC A 6 1.793 7.324 14.839 1.00 0.00 O ATOM 147 C5' DC A 6 0.540 7.778 14.367 1.00 0.00 C ATOM 148 C4' DC A 6 -0.563 6.771 14.686 1.00 0.00 C ATOM 149 O4' DC A 6 -0.317 5.563 13.964 1.00 0.00 O ATOM 150 C3' DC A 6 -0.704 6.429 16.162 1.00 0.00 C ATOM 151 O3' DC A 6 -2.003 6.612 16.684 1.00 0.00 O ATOM 152 C2' DC A 6 -0.378 4.963 16.263 1.00 0.00 C ATOM 153 C1' DC A 6 -0.551 4.469 14.829 1.00 0.00 C ATOM 154 N1 DC A 6 0.345 3.298 14.646 1.00 0.00 N ATOM 155 C2 DC A 6 -0.240 2.025 14.634 1.00 0.00 C ATOM 156 O2 DC A 6 -1.431 1.864 14.347 1.00 0.00 O ATOM 157 N3 DC A 6 0.497 0.929 14.937 1.00 0.00 N ATOM 158 C4 DC A 6 1.784 1.075 15.212 1.00 0.00 C ATOM 159 N4 DC A 6 2.457 -0.008 15.500 1.00 0.00 N ATOM 160 C5 DC A 6 2.444 2.337 15.171 1.00 0.00 C ATOM 161 C6 DC A 6 1.695 3.426 14.874 1.00 0.00 C ATOM 0 H5' DC A 6 0.590 7.939 13.290 1.00 0.00 H new ATOM 0 H5'' DC A 6 0.302 8.739 14.823 1.00 0.00 H new ATOM 0 H4' DC A 6 -1.496 7.249 14.388 1.00 0.00 H new ATOM 0 H3' DC A 6 -0.052 7.091 16.732 1.00 0.00 H new ATOM 0 H2' DC A 6 0.637 4.800 16.626 1.00 0.00 H new ATOM 0 H2'' DC A 6 -1.049 4.448 16.950 1.00 0.00 H new ATOM 0 H1' DC A 6 -1.556 4.117 14.596 1.00 0.00 H new ATOM 0 H41 DC A 6 3.451 0.053 15.719 1.00 0.00 H new ATOM 0 H42 DC A 6 1.988 -0.914 15.506 1.00 0.00 H new ATOM 0 H5 DC A 6 3.502 2.422 15.369 1.00 0.00 H new ATOM 0 H6 DC A 6 2.160 4.399 14.816 1.00 0.00 H new ATOM 173 P DC A 7 -2.207 6.856 18.262 1.00 0.00 P ATOM 174 OP1 DC A 7 -1.467 8.105 18.568 1.00 0.00 O ATOM 175 OP2 DC A 7 -1.867 5.625 19.020 1.00 0.00 O ATOM 176 O5' DC A 7 -3.790 7.117 18.359 1.00 0.00 O ATOM 177 C5' DC A 7 -4.767 6.150 18.750 1.00 0.00 C ATOM 178 C4' DC A 7 -5.067 4.943 17.831 1.00 0.00 C ATOM 179 O4' DC A 7 -5.010 5.230 16.442 1.00 0.00 O ATOM 180 C3' DC A 7 -4.246 3.669 18.047 1.00 0.00 C ATOM 181 O3' DC A 7 -4.939 2.750 18.877 1.00 0.00 O ATOM 182 C2' DC A 7 -4.126 3.094 16.645 1.00 0.00 C ATOM 183 C1' DC A 7 -5.003 3.980 15.773 1.00 0.00 C ATOM 184 N1 DC A 7 -4.487 4.013 14.379 1.00 0.00 N ATOM 185 C2 DC A 7 -4.514 2.836 13.617 1.00 0.00 C ATOM 186 O2 DC A 7 -4.969 1.769 14.042 1.00 0.00 O ATOM 187 N3 DC A 7 -3.961 2.835 12.382 1.00 0.00 N ATOM 188 C4 DC A 7 -3.459 3.938 11.870 1.00 0.00 C ATOM 189 N4 DC A 7 -2.915 3.791 10.685 1.00 0.00 N ATOM 190 C5 DC A 7 -3.412 5.159 12.595 1.00 0.00 C ATOM 191 C6 DC A 7 -3.924 5.153 13.857 1.00 0.00 C ATOM 0 H5' DC A 7 -5.706 6.681 18.905 1.00 0.00 H new ATOM 0 H5'' DC A 7 -4.462 5.753 19.718 1.00 0.00 H new ATOM 0 H4' DC A 7 -6.089 4.743 18.154 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.289 3.865 18.531 1.00 0.00 H new ATOM 0 H2' DC A 7 -3.091 3.105 16.302 1.00 0.00 H new ATOM 0 H2'' DC A 7 -4.461 2.057 16.615 1.00 0.00 H new ATOM 0 H1' DC A 7 -6.026 3.622 15.653 1.00 0.00 H new ATOM 0 H41 DC A 7 -2.500 4.593 10.211 1.00 0.00 H new ATOM 0 H42 DC A 7 -2.907 2.874 10.238 1.00 0.00 H new ATOM 0 H5 DC A 7 -2.988 6.054 12.164 1.00 0.00 H new ATOM 0 H6 DC A 7 -3.887 6.053 14.453 1.00 0.00 H new ATOM 203 P DT A 8 -4.163 1.583 19.663 1.00 0.00 P ATOM 204 OP1 DT A 8 -5.161 0.767 20.392 1.00 0.00 O ATOM 205 OP2 DT A 8 -3.052 2.238 20.397 1.00 0.00 O ATOM 206 O5' DT A 8 -3.506 0.666 18.513 1.00 0.00 O ATOM 207 C5' DT A 8 -4.204 -0.344 17.789 1.00 0.00 C ATOM 208 C4' DT A 8 -3.539 -1.719 17.961 1.00 0.00 C ATOM 209 O4' DT A 8 -2.197 -1.673 17.499 1.00 0.00 O ATOM 210 C3' DT A 8 -3.523 -2.181 19.424 1.00 0.00 C ATOM 211 O3' DT A 8 -3.925 -3.532 19.579 1.00 0.00 O ATOM 212 C2' DT A 8 -2.072 -1.998 19.836 1.00 0.00 C ATOM 213 C1' DT A 8 -1.304 -2.087 18.519 1.00 0.00 C ATOM 214 N1 DT A 8 -0.106 -1.204 18.546 1.00 0.00 N ATOM 215 C2 DT A 8 1.150 -1.775 18.766 1.00 0.00 C ATOM 216 O2 DT A 8 1.331 -2.975 18.939 1.00 0.00 O ATOM 217 N3 DT A 8 2.222 -0.906 18.834 1.00 0.00 N ATOM 218 C4 DT A 8 2.151 0.473 18.766 1.00 0.00 C ATOM 219 O4 DT A 8 3.188 1.124 18.843 1.00 0.00 O ATOM 220 C5 DT A 8 0.799 1.005 18.612 1.00 0.00 C ATOM 221 C7 DT A 8 0.548 2.502 18.587 1.00 0.00 C ATOM 222 C6 DT A 8 -0.258 0.164 18.495 1.00 0.00 C ATOM 0 H5' DT A 8 -4.232 -0.082 16.731 1.00 0.00 H new ATOM 0 H5'' DT A 8 -5.237 -0.392 18.133 1.00 0.00 H new ATOM 0 H4' DT A 8 -4.129 -2.426 17.378 1.00 0.00 H new ATOM 0 H3' DT A 8 -4.227 -1.615 20.034 1.00 0.00 H new ATOM 0 H2' DT A 8 -1.914 -1.038 20.327 1.00 0.00 H new ATOM 0 H2'' DT A 8 -1.755 -2.770 20.537 1.00 0.00 H new ATOM 0 H1' DT A 8 -0.951 -3.103 18.346 1.00 0.00 H new ATOM 0 H3 DT A 8 3.148 -1.319 18.944 1.00 0.00 H new ATOM 0 H71 DT A 8 -0.325 2.714 17.970 1.00 0.00 H new ATOM 0 H72 DT A 8 0.371 2.858 19.602 1.00 0.00 H new ATOM 0 H73 DT A 8 1.418 3.010 18.171 1.00 0.00 H new ATOM 0 H6 DT A 8 -1.246 0.578 18.358 1.00 0.00 H new ATOM 235 P DG A 9 -5.468 -3.982 19.418 1.00 0.00 P ATOM 236 OP1 DG A 9 -6.306 -2.782 19.672 1.00 0.00 O ATOM 237 OP2 DG A 9 -5.685 -5.204 20.217 1.00 0.00 O ATOM 238 O5' DG A 9 -5.594 -4.367 17.857 1.00 0.00 O ATOM 239 C5' DG A 9 -4.993 -5.543 17.335 1.00 0.00 C ATOM 240 C4' DG A 9 -5.549 -5.840 15.934 1.00 0.00 C ATOM 241 O4' DG A 9 -4.973 -4.991 14.953 1.00 0.00 O ATOM 242 C3' DG A 9 -5.263 -7.281 15.477 1.00 0.00 C ATOM 243 O3' DG A 9 -6.402 -7.892 14.890 1.00 0.00 O ATOM 244 C2' DG A 9 -4.175 -7.145 14.413 1.00 0.00 C ATOM 245 C1' DG A 9 -3.888 -5.642 14.314 1.00 0.00 C ATOM 246 N9 DG A 9 -2.577 -5.187 14.858 1.00 0.00 N ATOM 247 C8 DG A 9 -1.524 -5.907 15.376 1.00 0.00 C ATOM 248 N7 DG A 9 -0.458 -5.202 15.630 1.00 0.00 N ATOM 249 C5 DG A 9 -0.817 -3.907 15.257 1.00 0.00 C ATOM 250 C6 DG A 9 -0.081 -2.671 15.272 1.00 0.00 C ATOM 251 O6 DG A 9 1.076 -2.441 15.614 1.00 0.00 O ATOM 252 N1 DG A 9 -0.822 -1.592 14.836 1.00 0.00 N ATOM 253 C2 DG A 9 -2.115 -1.676 14.426 1.00 0.00 C ATOM 254 N2 DG A 9 -2.754 -0.549 14.225 1.00 0.00 N ATOM 255 N3 DG A 9 -2.809 -2.805 14.334 1.00 0.00 N ATOM 256 C4 DG A 9 -2.114 -3.891 14.785 1.00 0.00 C ATOM 0 H5' DG A 9 -5.187 -6.386 17.998 1.00 0.00 H new ATOM 0 H5'' DG A 9 -3.911 -5.418 17.287 1.00 0.00 H new ATOM 0 H4' DG A 9 -6.623 -5.676 16.020 1.00 0.00 H new ATOM 0 H3' DG A 9 -4.975 -7.902 16.325 1.00 0.00 H new ATOM 0 H2' DG A 9 -3.279 -7.698 14.694 1.00 0.00 H new ATOM 0 H2'' DG A 9 -4.509 -7.545 13.456 1.00 0.00 H new ATOM 0 HO3' DG A 9 -6.177 -8.805 14.612 1.00 0.00 H new ATOM 0 H1' DG A 9 -3.800 -5.383 13.259 1.00 0.00 H new ATOM 0 H8 DG A 9 -1.577 -6.970 15.557 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.373 -0.676 14.820 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.726 -0.562 13.917 1.00 0.00 H new ATOM 0 H22 DG A 9 -2.279 0.341 14.377 1.00 0.00 H new TER 269 DG A 9 HETATM 270 NA NA A 101 1.276 2.522 4.012 1.00 0.00 NA HETATM 271 NA NA A 102 3.565 10.179 12.459 1.00 0.00 NA HETATM 272 NA NA A 103 -6.654 -0.836 20.637 1.00 0.00 NA HETATM 273 NA NA A 104 5.863 6.207 7.354 1.00 0.00 NA HETATM 274 NA NA A 105 -2.382 1.093 12.343 1.00 0.00 NA HETATM 275 NA NA A 106 -1.996 4.160 20.681 1.00 0.00 NA HETATM 276 NA NA A 107 -6.362 -6.669 4.641 1.00 0.00 NA HETATM 277 NA NA A 108 0.471 9.121 18.162 1.00 0.00 NA