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 Set 1.1: A 1 DC O5' : rot 180:sc= 1.06 USER MOD Set 1.2: A 9 DG O3' : rot 147:sc= 1.2 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 ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -4.766 -9.005 11.688 1.00 0.00 O ATOM 2 C5' DC A 1 -3.971 -8.509 10.614 1.00 0.00 C ATOM 3 C4' DC A 1 -4.394 -7.082 10.238 1.00 0.00 C ATOM 4 O4' DC A 1 -3.757 -6.207 11.149 1.00 0.00 O ATOM 5 C3' DC A 1 -3.983 -6.651 8.823 1.00 0.00 C ATOM 6 O3' DC A 1 -5.001 -5.815 8.291 1.00 0.00 O ATOM 7 C2' DC A 1 -2.679 -5.900 9.069 1.00 0.00 C ATOM 8 C1' DC A 1 -2.931 -5.308 10.453 1.00 0.00 C ATOM 9 N1 DC A 1 -1.669 -5.061 11.191 1.00 0.00 N ATOM 10 C2 DC A 1 -1.252 -3.743 11.371 1.00 0.00 C ATOM 11 O2 DC A 1 -1.972 -2.811 11.028 1.00 0.00 O ATOM 12 N3 DC A 1 -0.028 -3.469 11.891 1.00 0.00 N ATOM 13 C4 DC A 1 0.765 -4.476 12.230 1.00 0.00 C ATOM 14 N4 DC A 1 1.952 -4.156 12.689 1.00 0.00 N ATOM 15 C5 DC A 1 0.380 -5.843 12.060 1.00 0.00 C ATOM 16 C6 DC A 1 -0.842 -6.095 11.540 1.00 0.00 C ATOM 0 H5' DC A 1 -4.072 -9.163 9.748 1.00 0.00 H new ATOM 0 H5'' DC A 1 -2.919 -8.518 10.899 1.00 0.00 H new ATOM 0 H4' DC A 1 -5.483 -7.049 10.274 1.00 0.00 H new ATOM 0 H3' DC A 1 -3.852 -7.461 8.106 1.00 0.00 H new ATOM 0 H2' DC A 1 -1.814 -6.563 9.057 1.00 0.00 H new ATOM 0 H2'' DC A 1 -2.500 -5.130 8.319 1.00 0.00 H new ATOM 0 HO5' DC A 1 -4.482 -9.916 11.912 1.00 0.00 H new ATOM 0 H1' DC A 1 -3.415 -4.336 10.356 1.00 0.00 H new ATOM 0 H41 DC A 1 2.606 -4.888 12.966 1.00 0.00 H new ATOM 0 H42 DC A 1 2.221 -3.175 12.769 1.00 0.00 H new ATOM 0 H5 DC A 1 1.044 -6.648 12.338 1.00 0.00 H new ATOM 0 H6 DC A 1 -1.167 -7.115 11.399 1.00 0.00 H new ATOM 29 P DC A 2 -5.018 -5.355 6.751 1.00 0.00 P ATOM 30 OP1 DC A 2 -6.419 -5.129 6.339 1.00 0.00 O ATOM 31 OP2 DC A 2 -4.301 -6.357 5.934 1.00 0.00 O ATOM 32 O5' DC A 2 -4.230 -3.963 6.705 1.00 0.00 O ATOM 33 C5' DC A 2 -4.291 -3.115 5.570 1.00 0.00 C ATOM 34 C4' DC A 2 -3.720 -1.717 5.854 1.00 0.00 C ATOM 35 O4' DC A 2 -4.501 -1.088 6.868 1.00 0.00 O ATOM 36 C3' DC A 2 -2.262 -1.695 6.335 1.00 0.00 C ATOM 37 O3' DC A 2 -1.670 -0.509 5.824 1.00 0.00 O ATOM 38 C2' DC A 2 -2.449 -1.655 7.844 1.00 0.00 C ATOM 39 C1' DC A 2 -3.622 -0.693 7.908 1.00 0.00 C ATOM 40 N1 DC A 2 -4.259 -0.727 9.241 1.00 0.00 N ATOM 41 C2 DC A 2 -3.873 0.230 10.184 1.00 0.00 C ATOM 42 O2 DC A 2 -3.101 1.163 9.929 1.00 0.00 O ATOM 43 N3 DC A 2 -4.272 0.112 11.467 1.00 0.00 N ATOM 44 C4 DC A 2 -5.062 -0.883 11.816 1.00 0.00 C ATOM 45 N4 DC A 2 -5.494 -0.815 13.050 1.00 0.00 N ATOM 46 C5 DC A 2 -5.469 -1.904 10.904 1.00 0.00 C ATOM 47 C6 DC A 2 -5.049 -1.788 9.617 1.00 0.00 C ATOM 0 H5' DC A 2 -5.327 -3.022 5.244 1.00 0.00 H new ATOM 0 H5'' DC A 2 -3.738 -3.571 4.749 1.00 0.00 H new ATOM 0 H4' DC A 2 -3.755 -1.198 4.896 1.00 0.00 H new ATOM 0 H3' DC A 2 -1.622 -2.521 6.024 1.00 0.00 H new ATOM 0 H2' DC A 2 -2.682 -2.633 8.266 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.569 -1.283 8.368 1.00 0.00 H new ATOM 0 H1' DC A 2 -3.313 0.343 7.768 1.00 0.00 H new ATOM 0 H41 DC A 2 -6.112 -1.540 13.415 1.00 0.00 H new ATOM 0 H42 DC A 2 -5.212 -0.037 13.647 1.00 0.00 H new ATOM 0 H5 DC A 2 -6.084 -2.732 11.223 1.00 0.00 H new ATOM 0 H6 DC A 2 -5.336 -2.531 8.888 1.00 0.00 H new ATOM 59 P DT A 3 -0.100 -0.208 5.950 1.00 0.00 P ATOM 60 OP1 DT A 3 0.208 0.928 5.049 1.00 0.00 O ATOM 61 OP2 DT A 3 0.638 -1.477 5.810 1.00 0.00 O ATOM 62 O5' DT A 3 0.042 0.287 7.473 1.00 0.00 O ATOM 63 C5' DT A 3 0.615 1.530 7.859 1.00 0.00 C ATOM 64 C4' DT A 3 2.123 1.443 8.136 1.00 0.00 C ATOM 65 O4' DT A 3 2.369 0.376 9.029 1.00 0.00 O ATOM 66 C3' DT A 3 3.026 1.280 6.907 1.00 0.00 C ATOM 67 O3' DT A 3 3.973 2.340 6.805 1.00 0.00 O ATOM 68 C2' DT A 3 3.725 -0.055 7.152 1.00 0.00 C ATOM 69 C1' DT A 3 3.527 -0.327 8.644 1.00 0.00 C ATOM 70 N1 DT A 3 3.308 -1.768 8.946 1.00 0.00 N ATOM 71 C2 DT A 3 4.308 -2.465 9.629 1.00 0.00 C ATOM 72 O2 DT A 3 5.379 -1.968 9.961 1.00 0.00 O ATOM 73 N3 DT A 3 4.057 -3.794 9.903 1.00 0.00 N ATOM 74 C4 DT A 3 2.928 -4.499 9.533 1.00 0.00 C ATOM 75 O4 DT A 3 2.851 -5.685 9.838 1.00 0.00 O ATOM 76 C5 DT A 3 1.932 -3.718 8.801 1.00 0.00 C ATOM 77 C7 DT A 3 0.648 -4.370 8.316 1.00 0.00 C ATOM 78 C6 DT A 3 2.147 -2.401 8.547 1.00 0.00 C ATOM 0 H5' DT A 3 0.109 1.894 8.753 1.00 0.00 H new ATOM 0 H5'' DT A 3 0.439 2.264 7.072 1.00 0.00 H new ATOM 0 H4' DT A 3 2.387 2.413 8.557 1.00 0.00 H new ATOM 0 H3' DT A 3 2.466 1.306 5.972 1.00 0.00 H new ATOM 0 H2' DT A 3 3.290 -0.848 6.544 1.00 0.00 H new ATOM 0 H2'' DT A 3 4.783 -0.001 6.896 1.00 0.00 H new ATOM 0 H1' DT A 3 4.425 -0.016 9.178 1.00 0.00 H new ATOM 0 H3 DT A 3 4.770 -4.302 10.426 1.00 0.00 H new ATOM 0 H71 DT A 3 -0.150 -3.628 8.293 1.00 0.00 H new ATOM 0 H72 DT A 3 0.800 -4.771 7.314 1.00 0.00 H new ATOM 0 H73 DT A 3 0.373 -5.179 8.993 1.00 0.00 H new ATOM 0 H6 DT A 3 1.392 -1.835 8.021 1.00 0.00 H new ATOM 91 P DG A 4 3.578 3.768 6.160 1.00 0.00 P ATOM 92 OP1 DG A 4 2.808 3.525 4.918 1.00 0.00 O ATOM 93 OP2 DG A 4 4.786 4.633 6.128 1.00 0.00 O ATOM 94 O5' DG A 4 2.578 4.404 7.245 1.00 0.00 O ATOM 95 C5' DG A 4 3.093 5.263 8.243 1.00 0.00 C ATOM 96 C4' DG A 4 2.182 5.494 9.445 1.00 0.00 C ATOM 97 O4' DG A 4 1.466 4.328 9.835 1.00 0.00 O ATOM 98 C3' DG A 4 3.034 5.900 10.654 1.00 0.00 C ATOM 99 O3' DG A 4 3.315 7.283 10.774 1.00 0.00 O ATOM 100 C2' DG A 4 2.115 5.474 11.778 1.00 0.00 C ATOM 101 C1' DG A 4 1.503 4.187 11.244 1.00 0.00 C ATOM 102 N9 DG A 4 2.259 2.955 11.588 1.00 0.00 N ATOM 103 C8 DG A 4 3.575 2.760 11.925 1.00 0.00 C ATOM 104 N7 DG A 4 3.887 1.521 12.199 1.00 0.00 N ATOM 105 C5 DG A 4 2.688 0.826 12.015 1.00 0.00 C ATOM 106 C6 DG A 4 2.342 -0.570 12.136 1.00 0.00 C ATOM 107 O6 DG A 4 3.011 -1.541 12.482 1.00 0.00 O ATOM 108 N1 DG A 4 1.035 -0.830 11.783 1.00 0.00 N ATOM 109 C2 DG A 4 0.182 0.117 11.326 1.00 0.00 C ATOM 110 N2 DG A 4 -0.984 -0.264 10.887 1.00 0.00 N ATOM 111 N3 DG A 4 0.400 1.423 11.328 1.00 0.00 N ATOM 112 C4 DG A 4 1.694 1.710 11.645 1.00 0.00 C ATOM 0 H5' DG A 4 3.316 6.228 7.788 1.00 0.00 H new ATOM 0 H5'' DG A 4 4.038 4.852 8.599 1.00 0.00 H new ATOM 0 H4' DG A 4 1.473 6.265 9.145 1.00 0.00 H new ATOM 0 H3' DG A 4 4.029 5.456 10.613 1.00 0.00 H new ATOM 0 H2' DG A 4 2.662 5.307 12.706 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.355 6.227 11.987 1.00 0.00 H new ATOM 0 H1' DG A 4 0.522 4.058 11.701 1.00 0.00 H new ATOM 0 H8 DG A 4 4.294 3.565 11.961 1.00 0.00 H new ATOM 0 H1 DG A 4 0.692 -1.787 11.871 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.648 0.427 10.537 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.233 -1.253 10.894 1.00 0.00 H new HETATM 124 O5' 3DR A 5 5.809 7.004 11.015 1.00 0.00 O HETATM 125 P 3DR A 5 4.708 7.910 10.270 1.00 0.00 P HETATM 126 OP1 3DR A 5 4.772 9.282 10.826 1.00 0.00 O HETATM 127 OP2 3DR A 5 4.863 7.673 8.814 1.00 0.00 O HETATM 128 C2' 3DR A 5 6.534 5.922 15.337 1.00 0.00 C HETATM 129 C5' 3DR A 5 6.229 7.212 12.358 1.00 0.00 C HETATM 130 C4' 3DR A 5 5.253 6.627 13.405 1.00 0.00 C HETATM 131 O4' 3DR A 5 5.310 5.208 13.423 1.00 0.00 O HETATM 132 C1' 3DR A 5 6.362 4.815 14.291 1.00 0.00 C HETATM 133 C3' 3DR A 5 5.601 7.033 14.850 1.00 0.00 C HETATM 134 O3' 3DR A 5 4.470 7.059 15.717 1.00 0.00 O HETATM 0 H5'' 3DR A 5 7.212 6.762 12.497 1.00 0.00 H new HETATM 0 H4'1 3DR A 5 4.279 7.015 13.108 1.00 0.00 H new HETATM 0 H2'' 3DR A 5 6.259 5.577 16.334 1.00 0.00 H new HETATM 0 H1'2 3DR A 5 7.286 4.669 13.732 1.00 0.00 H new HETATM 0 H1'1 3DR A 5 6.127 3.866 14.772 1.00 0.00 H new HETATM 0 H5' 3DR A 5 6.341 8.282 12.534 1.00 0.00 H new HETATM 0 H3' 3DR A 5 6.025 8.037 14.862 1.00 0.00 H new HETATM 0 H2' 3DR A 5 7.568 6.263 15.392 1.00 0.00 H new ATOM 143 P DC A 6 3.248 8.089 15.545 1.00 0.00 P ATOM 144 OP1 DC A 6 3.683 9.214 14.680 1.00 0.00 O ATOM 145 OP2 DC A 6 2.646 8.344 16.877 1.00 0.00 O ATOM 146 O5' DC A 6 2.186 7.237 14.703 1.00 0.00 O ATOM 147 C5' DC A 6 0.998 7.833 14.203 1.00 0.00 C ATOM 148 C4' DC A 6 -0.231 6.977 14.538 1.00 0.00 C ATOM 149 O4' DC A 6 -0.127 5.680 13.954 1.00 0.00 O ATOM 150 C3' DC A 6 -0.394 6.826 16.048 1.00 0.00 C ATOM 151 O3' DC A 6 -1.654 7.284 16.507 1.00 0.00 O ATOM 152 C2' DC A 6 -0.187 5.343 16.305 1.00 0.00 C ATOM 153 C1' DC A 6 -0.385 4.692 14.936 1.00 0.00 C ATOM 154 N1 DC A 6 0.516 3.515 14.792 1.00 0.00 N ATOM 155 C2 DC A 6 -0.048 2.235 14.709 1.00 0.00 C ATOM 156 O2 DC A 6 -1.238 2.065 14.426 1.00 0.00 O ATOM 157 N3 DC A 6 0.712 1.134 14.926 1.00 0.00 N ATOM 158 C4 DC A 6 2.011 1.287 15.153 1.00 0.00 C ATOM 159 N4 DC A 6 2.720 0.202 15.330 1.00 0.00 N ATOM 160 C5 DC A 6 2.651 2.557 15.140 1.00 0.00 C ATOM 161 C6 DC A 6 1.875 3.652 14.956 1.00 0.00 C ATOM 0 H5' DC A 6 1.076 7.957 13.123 1.00 0.00 H new ATOM 0 H5'' DC A 6 0.879 8.829 14.630 1.00 0.00 H new ATOM 0 H4' DC A 6 -1.102 7.489 14.128 1.00 0.00 H new ATOM 0 H3' DC A 6 0.321 7.439 16.597 1.00 0.00 H new ATOM 0 H2' DC A 6 0.809 5.143 16.700 1.00 0.00 H new ATOM 0 H2'' DC A 6 -0.902 4.962 17.034 1.00 0.00 H new ATOM 0 H1' DC A 6 -1.404 4.322 14.819 1.00 0.00 H new ATOM 0 H41 DC A 6 3.722 0.271 15.507 1.00 0.00 H new ATOM 0 H42 DC A 6 2.271 -0.713 15.291 1.00 0.00 H new ATOM 0 H5 DC A 6 3.719 2.645 15.272 1.00 0.00 H new ATOM 0 H6 DC A 6 2.324 4.634 14.938 1.00 0.00 H new ATOM 173 P DC A 7 -1.968 7.384 18.090 1.00 0.00 P ATOM 174 OP1 DC A 7 -2.755 8.610 18.325 1.00 0.00 O ATOM 175 OP2 DC A 7 -0.680 7.192 18.811 1.00 0.00 O ATOM 176 O5' DC A 7 -2.903 6.085 18.298 1.00 0.00 O ATOM 177 C5' DC A 7 -4.304 6.209 18.504 1.00 0.00 C ATOM 178 C4' DC A 7 -5.093 4.937 18.159 1.00 0.00 C ATOM 179 O4' DC A 7 -5.347 4.909 16.762 1.00 0.00 O ATOM 180 C3' DC A 7 -4.392 3.625 18.539 1.00 0.00 C ATOM 181 O3' DC A 7 -5.348 2.751 19.122 1.00 0.00 O ATOM 182 C2' DC A 7 -3.918 3.095 17.192 1.00 0.00 C ATOM 183 C1' DC A 7 -4.972 3.649 16.237 1.00 0.00 C ATOM 184 N1 DC A 7 -4.454 3.764 14.845 1.00 0.00 N ATOM 185 C2 DC A 7 -4.415 2.612 14.052 1.00 0.00 C ATOM 186 O2 DC A 7 -4.797 1.511 14.457 1.00 0.00 O ATOM 187 N3 DC A 7 -3.906 2.683 12.798 1.00 0.00 N ATOM 188 C4 DC A 7 -3.498 3.834 12.304 1.00 0.00 C ATOM 189 N4 DC A 7 -2.982 3.768 11.097 1.00 0.00 N ATOM 190 C5 DC A 7 -3.529 5.039 13.061 1.00 0.00 C ATOM 191 C6 DC A 7 -4.000 4.964 14.335 1.00 0.00 C ATOM 0 H5' DC A 7 -4.680 7.034 17.899 1.00 0.00 H new ATOM 0 H5'' DC A 7 -4.488 6.468 19.547 1.00 0.00 H new ATOM 0 H4' DC A 7 -6.007 4.990 18.750 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.578 3.733 19.256 1.00 0.00 H new ATOM 0 H2' DC A 7 -2.918 3.450 16.944 1.00 0.00 H new ATOM 0 H2'' DC A 7 -3.884 2.006 17.173 1.00 0.00 H new ATOM 0 H1' DC A 7 -5.829 2.979 16.168 1.00 0.00 H new ATOM 0 H41 DC A 7 -2.641 4.614 10.641 1.00 0.00 H new ATOM 0 H42 DC A 7 -2.922 2.870 10.616 1.00 0.00 H new ATOM 0 H5 DC A 7 -3.192 5.975 12.641 1.00 0.00 H new ATOM 0 H6 DC A 7 -4.019 5.850 14.952 1.00 0.00 H new ATOM 203 P DT A 8 -4.978 1.741 20.313 1.00 0.00 P ATOM 204 OP1 DT A 8 -6.221 1.415 21.043 1.00 0.00 O ATOM 205 OP2 DT A 8 -3.940 2.381 21.147 1.00 0.00 O ATOM 206 O5' DT A 8 -4.368 0.409 19.656 1.00 0.00 O ATOM 207 C5' DT A 8 -5.117 -0.413 18.770 1.00 0.00 C ATOM 208 C4' DT A 8 -4.370 -1.720 18.435 1.00 0.00 C ATOM 209 O4' DT A 8 -3.116 -1.418 17.835 1.00 0.00 O ATOM 210 C3' DT A 8 -4.096 -2.567 19.690 1.00 0.00 C ATOM 211 O3' DT A 8 -4.186 -3.968 19.461 1.00 0.00 O ATOM 212 C2' DT A 8 -2.654 -2.216 20.018 1.00 0.00 C ATOM 213 C1' DT A 8 -2.078 -1.978 18.625 1.00 0.00 C ATOM 214 N1 DT A 8 -0.896 -1.077 18.663 1.00 0.00 N ATOM 215 C2 DT A 8 0.369 -1.649 18.519 1.00 0.00 C ATOM 216 O2 DT A 8 0.558 -2.858 18.461 1.00 0.00 O ATOM 217 N3 DT A 8 1.440 -0.781 18.457 1.00 0.00 N ATOM 218 C4 DT A 8 1.377 0.590 18.600 1.00 0.00 C ATOM 219 O4 DT A 8 2.414 1.240 18.519 1.00 0.00 O ATOM 220 C5 DT A 8 0.034 1.114 18.849 1.00 0.00 C ATOM 221 C7 DT A 8 -0.174 2.599 19.078 1.00 0.00 C ATOM 222 C6 DT A 8 -1.038 0.278 18.877 1.00 0.00 C ATOM 0 H5' DT A 8 -5.321 0.135 17.850 1.00 0.00 H new ATOM 0 H5'' DT A 8 -6.081 -0.650 19.221 1.00 0.00 H new ATOM 0 H4' DT A 8 -5.009 -2.285 17.756 1.00 0.00 H new ATOM 0 H3' DT A 8 -4.824 -2.357 20.473 1.00 0.00 H new ATOM 0 H2' DT A 8 -2.580 -1.331 20.650 1.00 0.00 H new ATOM 0 H2'' DT A 8 -2.143 -3.024 20.541 1.00 0.00 H new ATOM 0 H1' DT A 8 -1.729 -2.919 18.200 1.00 0.00 H new ATOM 0 H3 DT A 8 2.360 -1.189 18.291 1.00 0.00 H new ATOM 0 H71 DT A 8 -1.165 2.886 18.725 1.00 0.00 H new ATOM 0 H72 DT A 8 -0.090 2.818 20.142 1.00 0.00 H new ATOM 0 H73 DT A 8 0.583 3.161 18.531 1.00 0.00 H new ATOM 0 H6 DT A 8 -2.020 0.683 19.071 1.00 0.00 H new ATOM 235 P DG A 9 -5.596 -4.699 19.209 1.00 0.00 P ATOM 236 OP1 DG A 9 -6.678 -3.767 19.593 1.00 0.00 O ATOM 237 OP2 DG A 9 -5.619 -5.986 19.936 1.00 0.00 O ATOM 238 O5' DG A 9 -5.710 -4.982 17.636 1.00 0.00 O ATOM 239 C5' DG A 9 -5.030 -6.061 17.015 1.00 0.00 C ATOM 240 C4' DG A 9 -5.375 -6.050 15.521 1.00 0.00 C ATOM 241 O4' DG A 9 -4.649 -5.001 14.904 1.00 0.00 O ATOM 242 C3' DG A 9 -4.998 -7.338 14.771 1.00 0.00 C ATOM 243 O3' DG A 9 -5.902 -7.614 13.711 1.00 0.00 O ATOM 244 C2' DG A 9 -3.625 -7.039 14.213 1.00 0.00 C ATOM 245 C1' DG A 9 -3.496 -5.514 14.263 1.00 0.00 C ATOM 246 N9 DG A 9 -2.226 -5.037 14.873 1.00 0.00 N ATOM 247 C8 DG A 9 -1.138 -5.756 15.314 1.00 0.00 C ATOM 248 N7 DG A 9 -0.071 -5.046 15.534 1.00 0.00 N ATOM 249 C5 DG A 9 -0.484 -3.741 15.264 1.00 0.00 C ATOM 250 C6 DG A 9 0.226 -2.494 15.292 1.00 0.00 C ATOM 251 O6 DG A 9 1.408 -2.261 15.528 1.00 0.00 O ATOM 252 N1 DG A 9 -0.571 -1.406 15.005 1.00 0.00 N ATOM 253 C2 DG A 9 -1.888 -1.495 14.682 1.00 0.00 C ATOM 254 N2 DG A 9 -2.532 -0.363 14.526 1.00 0.00 N ATOM 255 N3 DG A 9 -2.561 -2.632 14.563 1.00 0.00 N ATOM 256 C4 DG A 9 -1.811 -3.727 14.890 1.00 0.00 C ATOM 0 H5' DG A 9 -5.327 -7.008 17.467 1.00 0.00 H new ATOM 0 H5'' DG A 9 -3.954 -5.964 17.157 1.00 0.00 H new ATOM 0 H4' DG A 9 -6.457 -5.935 15.465 1.00 0.00 H new ATOM 0 H3' DG A 9 -5.025 -8.211 15.423 1.00 0.00 H new ATOM 0 H2' DG A 9 -2.846 -7.520 14.805 1.00 0.00 H new ATOM 0 H2'' DG A 9 -3.525 -7.410 13.193 1.00 0.00 H new ATOM 0 HO3' DG A 9 -5.420 -8.045 12.974 1.00 0.00 H new ATOM 0 H1' DG A 9 -3.441 -5.130 13.244 1.00 0.00 H new ATOM 0 H8 DG A 9 -1.168 -6.825 15.465 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.147 -0.479 15.037 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.523 -0.369 14.283 1.00 0.00 H new ATOM 0 H22 DG A 9 -2.042 0.523 14.648 1.00 0.00 H new TER 269 DG A 9 HETATM 270 NA NA A 101 1.074 2.605 3.949 1.00 0.00 NA HETATM 271 NA NA A 102 3.863 10.088 12.662 1.00 0.00 NA HETATM 272 NA NA A 103 -5.458 2.631 22.858 1.00 0.00 NA HETATM 273 NA NA A 104 5.624 6.434 7.128 1.00 0.00 NA HETATM 274 NA NA A 105 -2.251 1.050 12.485 1.00 0.00 NA HETATM 275 NA NA A 106 -7.477 -5.300 21.098 1.00 0.00 NA HETATM 276 NA NA A 107 -6.209 -6.687 4.669 1.00 0.00 NA HETATM 277 NA NA A 108 1.415 7.895 18.676 1.00 0.00 NA