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=-0.000989 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 -2.799 -8.679 9.997 1.00 0.00 O ATOM 2 C5' DC A 1 -4.169 -8.476 10.308 1.00 0.00 C ATOM 3 C4' DC A 1 -4.709 -7.062 9.999 1.00 0.00 C ATOM 4 O4' DC A 1 -4.247 -6.152 10.993 1.00 0.00 O ATOM 5 C3' DC A 1 -4.309 -6.499 8.629 1.00 0.00 C ATOM 6 O3' DC A 1 -5.352 -5.666 8.137 1.00 0.00 O ATOM 7 C2' DC A 1 -3.062 -5.707 8.985 1.00 0.00 C ATOM 8 C1' DC A 1 -3.408 -5.186 10.380 1.00 0.00 C ATOM 9 N1 DC A 1 -2.170 -4.986 11.168 1.00 0.00 N ATOM 10 C2 DC A 1 -1.645 -3.700 11.297 1.00 0.00 C ATOM 11 O2 DC A 1 -2.267 -2.725 10.885 1.00 0.00 O ATOM 12 N3 DC A 1 -0.423 -3.510 11.861 1.00 0.00 N ATOM 13 C4 DC A 1 0.278 -4.567 12.249 1.00 0.00 C ATOM 14 N4 DC A 1 1.450 -4.326 12.787 1.00 0.00 N ATOM 15 C5 DC A 1 -0.209 -5.903 12.103 1.00 0.00 C ATOM 16 C6 DC A 1 -1.438 -6.067 11.572 1.00 0.00 C ATOM 0 H5' DC A 1 -4.319 -8.682 11.368 1.00 0.00 H new ATOM 0 H5'' DC A 1 -4.763 -9.204 9.755 1.00 0.00 H new ATOM 0 H4' DC A 1 -5.794 -7.167 9.993 1.00 0.00 H new ATOM 0 H3' DC A 1 -4.136 -7.239 7.848 1.00 0.00 H new ATOM 0 H2' DC A 1 -2.169 -6.332 8.992 1.00 0.00 H new ATOM 0 H2'' DC A 1 -2.878 -4.896 8.280 1.00 0.00 H new ATOM 0 HO5' DC A 1 -2.544 -9.597 10.226 1.00 0.00 H new ATOM 0 H1' DC A 1 -3.919 -4.225 10.324 1.00 0.00 H new ATOM 0 H41 DC A 1 2.034 -5.100 13.104 1.00 0.00 H new ATOM 0 H42 DC A 1 1.777 -3.365 12.888 1.00 0.00 H new ATOM 0 H5 DC A 1 0.386 -6.751 12.407 1.00 0.00 H new ATOM 0 H6 DC A 1 -1.847 -7.061 11.465 1.00 0.00 H new ATOM 29 P DC A 2 -5.352 -5.088 6.637 1.00 0.00 P ATOM 30 OP1 DC A 2 -6.743 -4.763 6.258 1.00 0.00 O ATOM 31 OP2 DC A 2 -4.699 -6.068 5.743 1.00 0.00 O ATOM 32 O5' DC A 2 -4.498 -3.729 6.653 1.00 0.00 O ATOM 33 C5' DC A 2 -4.390 -2.919 5.490 1.00 0.00 C ATOM 34 C4' DC A 2 -3.800 -1.524 5.762 1.00 0.00 C ATOM 35 O4' DC A 2 -4.613 -0.841 6.713 1.00 0.00 O ATOM 36 C3' DC A 2 -2.364 -1.508 6.306 1.00 0.00 C ATOM 37 O3' DC A 2 -1.724 -0.344 5.803 1.00 0.00 O ATOM 38 C2' DC A 2 -2.620 -1.435 7.801 1.00 0.00 C ATOM 39 C1' DC A 2 -3.792 -0.466 7.807 1.00 0.00 C ATOM 40 N1 DC A 2 -4.498 -0.533 9.105 1.00 0.00 N ATOM 41 C2 DC A 2 -4.147 0.388 10.096 1.00 0.00 C ATOM 42 O2 DC A 2 -3.369 1.333 9.903 1.00 0.00 O ATOM 43 N3 DC A 2 -4.586 0.215 11.361 1.00 0.00 N ATOM 44 C4 DC A 2 -5.383 -0.796 11.639 1.00 0.00 C ATOM 45 N4 DC A 2 -5.836 -0.795 12.868 1.00 0.00 N ATOM 46 C5 DC A 2 -5.771 -1.773 10.673 1.00 0.00 C ATOM 47 C6 DC A 2 -5.302 -1.607 9.409 1.00 0.00 C ATOM 0 H5' DC A 2 -5.378 -2.805 5.044 1.00 0.00 H new ATOM 0 H5'' DC A 2 -3.766 -3.431 4.757 1.00 0.00 H new ATOM 0 H4' DC A 2 -3.778 -1.042 4.785 1.00 0.00 H new ATOM 0 H3' DC A 2 -1.724 -2.348 6.035 1.00 0.00 H new ATOM 0 H2' DC A 2 -2.875 -2.404 8.230 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.761 -1.057 8.355 1.00 0.00 H new ATOM 0 H1' DC A 2 -3.479 0.572 7.695 1.00 0.00 H new ATOM 0 H41 DC A 2 -6.462 -1.537 13.182 1.00 0.00 H new ATOM 0 H42 DC A 2 -5.563 -0.052 13.511 1.00 0.00 H new ATOM 0 H5 DC A 2 -6.408 -2.605 10.935 1.00 0.00 H new ATOM 0 H6 DC A 2 -5.561 -2.320 8.641 1.00 0.00 H new ATOM 59 P DT A 3 -0.155 -0.077 6.008 1.00 0.00 P ATOM 60 OP1 DT A 3 0.226 1.052 5.126 1.00 0.00 O ATOM 61 OP2 DT A 3 0.564 -1.362 5.913 1.00 0.00 O ATOM 62 O5' DT A 3 -0.083 0.422 7.534 1.00 0.00 O ATOM 63 C5' DT A 3 0.636 1.567 7.969 1.00 0.00 C ATOM 64 C4' DT A 3 2.107 1.288 8.307 1.00 0.00 C ATOM 65 O4' DT A 3 2.191 0.182 9.184 1.00 0.00 O ATOM 66 C3' DT A 3 3.049 1.049 7.117 1.00 0.00 C ATOM 67 O3' DT A 3 4.101 2.008 7.070 1.00 0.00 O ATOM 68 C2' DT A 3 3.622 -0.338 7.391 1.00 0.00 C ATOM 69 C1' DT A 3 3.332 -0.585 8.874 1.00 0.00 C ATOM 70 N1 DT A 3 3.034 -2.010 9.168 1.00 0.00 N ATOM 71 C2 DT A 3 3.962 -2.743 9.912 1.00 0.00 C ATOM 72 O2 DT A 3 5.022 -2.281 10.324 1.00 0.00 O ATOM 73 N3 DT A 3 3.660 -4.067 10.145 1.00 0.00 N ATOM 74 C4 DT A 3 2.555 -4.743 9.669 1.00 0.00 C ATOM 75 O4 DT A 3 2.439 -5.937 9.930 1.00 0.00 O ATOM 76 C5 DT A 3 1.633 -3.923 8.883 1.00 0.00 C ATOM 77 C7 DT A 3 0.379 -4.539 8.290 1.00 0.00 C ATOM 78 C6 DT A 3 1.891 -2.606 8.674 1.00 0.00 C ATOM 0 H5' DT A 3 0.143 1.980 8.849 1.00 0.00 H new ATOM 0 H5'' DT A 3 0.591 2.329 7.191 1.00 0.00 H new ATOM 0 H4' DT A 3 2.457 2.213 8.765 1.00 0.00 H new ATOM 0 H3' DT A 3 2.530 1.132 6.162 1.00 0.00 H new ATOM 0 H2' DT A 3 3.150 -1.094 6.763 1.00 0.00 H new ATOM 0 H2'' DT A 3 4.692 -0.374 7.184 1.00 0.00 H new ATOM 0 H1' DT A 3 4.209 -0.314 9.462 1.00 0.00 H new ATOM 0 H3 DT A 3 4.313 -4.596 10.722 1.00 0.00 H new ATOM 0 H71 DT A 3 -0.402 -3.782 8.224 1.00 0.00 H new ATOM 0 H72 DT A 3 0.598 -4.922 7.293 1.00 0.00 H new ATOM 0 H73 DT A 3 0.039 -5.357 8.926 1.00 0.00 H new ATOM 0 H6 DT A 3 1.187 -2.013 8.109 1.00 0.00 H new ATOM 91 P DG A 4 3.893 3.468 6.414 1.00 0.00 P ATOM 92 OP1 DG A 4 3.156 3.315 5.139 1.00 0.00 O ATOM 93 OP2 DG A 4 5.189 4.195 6.446 1.00 0.00 O ATOM 94 O5' DG A 4 2.922 4.205 7.455 1.00 0.00 O ATOM 95 C5' DG A 4 3.473 4.987 8.494 1.00 0.00 C ATOM 96 C4' DG A 4 2.501 5.293 9.626 1.00 0.00 C ATOM 97 O4' DG A 4 1.671 4.187 9.958 1.00 0.00 O ATOM 98 C3' DG A 4 3.283 5.648 10.894 1.00 0.00 C ATOM 99 O3' DG A 4 3.665 7.008 10.987 1.00 0.00 O ATOM 100 C2' DG A 4 2.224 5.325 11.927 1.00 0.00 C ATOM 101 C1' DG A 4 1.548 4.086 11.365 1.00 0.00 C ATOM 102 N9 DG A 4 2.156 2.809 11.811 1.00 0.00 N ATOM 103 C8 DG A 4 3.416 2.524 12.278 1.00 0.00 C ATOM 104 N7 DG A 4 3.613 1.264 12.561 1.00 0.00 N ATOM 105 C5 DG A 4 2.389 0.659 12.259 1.00 0.00 C ATOM 106 C6 DG A 4 1.941 -0.709 12.329 1.00 0.00 C ATOM 107 O6 DG A 4 2.522 -1.728 12.696 1.00 0.00 O ATOM 108 N1 DG A 4 0.643 -0.871 11.893 1.00 0.00 N ATOM 109 C2 DG A 4 -0.125 0.141 11.417 1.00 0.00 C ATOM 110 N2 DG A 4 -1.294 -0.161 10.923 1.00 0.00 N ATOM 111 N3 DG A 4 0.198 1.426 11.430 1.00 0.00 N ATOM 112 C4 DG A 4 1.490 1.615 11.827 1.00 0.00 C ATOM 0 H5' DG A 4 3.833 5.927 8.075 1.00 0.00 H new ATOM 0 H5'' DG A 4 4.339 4.468 8.904 1.00 0.00 H new ATOM 0 H4' DG A 4 1.878 6.116 9.275 1.00 0.00 H new ATOM 0 H3' DG A 4 4.236 5.125 10.975 1.00 0.00 H new ATOM 0 H2' DG A 4 2.663 5.134 12.906 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.518 6.147 12.049 1.00 0.00 H new ATOM 0 H1' DG A 4 0.517 4.058 11.718 1.00 0.00 H new ATOM 0 H8 DG A 4 4.179 3.278 12.401 1.00 0.00 H new ATOM 0 H1 DG A 4 0.237 -1.806 11.931 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.898 0.574 10.556 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.604 -1.133 10.904 1.00 0.00 H new HETATM 124 O5' 3DR A 5 6.046 6.636 11.737 1.00 0.00 O HETATM 125 P 3DR A 5 5.171 7.484 10.680 1.00 0.00 P HETATM 126 OP1 3DR A 5 5.236 8.915 11.060 1.00 0.00 O HETATM 127 OP2 3DR A 5 5.556 7.043 9.317 1.00 0.00 O HETATM 128 C2' 3DR A 5 5.667 5.983 16.187 1.00 0.00 C HETATM 129 C5' 3DR A 5 6.153 6.970 13.117 1.00 0.00 C HETATM 130 C4' 3DR A 5 4.933 6.520 13.950 1.00 0.00 C HETATM 131 O4' 3DR A 5 4.912 5.109 14.113 1.00 0.00 O HETATM 132 C1' 3DR A 5 5.713 4.784 15.237 1.00 0.00 C HETATM 133 C3' 3DR A 5 4.954 7.075 15.387 1.00 0.00 C HETATM 134 O3' 3DR A 5 3.658 7.266 15.951 1.00 0.00 O HETATM 0 H5'' 3DR A 5 7.053 6.511 13.526 1.00 0.00 H new HETATM 0 H4'1 3DR A 5 4.072 6.893 13.395 1.00 0.00 H new HETATM 0 H2'' 3DR A 5 5.126 5.744 17.103 1.00 0.00 H new HETATM 0 H1'2 3DR A 5 6.738 4.574 14.931 1.00 0.00 H new HETATM 0 H1'1 3DR A 5 5.338 3.887 15.731 1.00 0.00 H new HETATM 0 H5' 3DR A 5 6.273 8.049 13.214 1.00 0.00 H new HETATM 0 H3' 3DR A 5 5.430 8.056 15.402 1.00 0.00 H new HETATM 0 H2' 3DR A 5 6.669 6.296 16.481 1.00 0.00 H new ATOM 143 P DC A 6 2.583 8.311 15.363 1.00 0.00 P ATOM 144 OP1 DC A 6 3.281 9.294 14.498 1.00 0.00 O ATOM 145 OP2 DC A 6 1.703 8.769 16.467 1.00 0.00 O ATOM 146 O5' DC A 6 1.708 7.372 14.407 1.00 0.00 O ATOM 147 C5' DC A 6 0.556 7.854 13.731 1.00 0.00 C ATOM 148 C4' DC A 6 -0.644 6.924 13.976 1.00 0.00 C ATOM 149 O4' DC A 6 -0.357 5.560 13.657 1.00 0.00 O ATOM 150 C3' DC A 6 -1.044 6.987 15.448 1.00 0.00 C ATOM 151 O3' DC A 6 -2.435 7.199 15.596 1.00 0.00 O ATOM 152 C2' DC A 6 -0.588 5.644 15.992 1.00 0.00 C ATOM 153 C1' DC A 6 -0.723 4.749 14.760 1.00 0.00 C ATOM 154 N1 DC A 6 0.117 3.517 14.855 1.00 0.00 N ATOM 155 C2 DC A 6 -0.497 2.261 14.741 1.00 0.00 C ATOM 156 O2 DC A 6 -1.667 2.146 14.365 1.00 0.00 O ATOM 157 N3 DC A 6 0.192 1.121 15.016 1.00 0.00 N ATOM 158 C4 DC A 6 1.472 1.216 15.351 1.00 0.00 C ATOM 159 N4 DC A 6 2.131 0.104 15.571 1.00 0.00 N ATOM 160 C5 DC A 6 2.161 2.462 15.414 1.00 0.00 C ATOM 161 C6 DC A 6 1.457 3.591 15.156 1.00 0.00 C ATOM 0 H5' DC A 6 0.757 7.923 12.662 1.00 0.00 H new ATOM 0 H5'' DC A 6 0.320 8.860 14.076 1.00 0.00 H new ATOM 0 H4' DC A 6 -1.448 7.268 13.325 1.00 0.00 H new ATOM 0 H3' DC A 6 -0.592 7.820 15.987 1.00 0.00 H new ATOM 0 H2' DC A 6 0.437 5.679 16.362 1.00 0.00 H new ATOM 0 H2'' DC A 6 -1.214 5.303 16.817 1.00 0.00 H new ATOM 0 H1' DC A 6 -1.742 4.375 14.658 1.00 0.00 H new ATOM 0 H41 DC A 6 3.117 0.138 15.831 1.00 0.00 H new ATOM 0 H42 DC A 6 1.658 -0.795 15.483 1.00 0.00 H new ATOM 0 H5 DC A 6 3.212 2.505 15.660 1.00 0.00 H new ATOM 0 H6 DC A 6 1.950 4.552 15.187 1.00 0.00 H new ATOM 173 P DC A 7 -3.062 7.623 17.020 1.00 0.00 P ATOM 174 OP1 DC A 7 -4.198 8.524 16.750 1.00 0.00 O ATOM 175 OP2 DC A 7 -1.943 8.070 17.894 1.00 0.00 O ATOM 176 O5' DC A 7 -3.618 6.203 17.538 1.00 0.00 O ATOM 177 C5' DC A 7 -4.842 6.076 18.250 1.00 0.00 C ATOM 178 C4' DC A 7 -5.467 4.678 18.087 1.00 0.00 C ATOM 179 O4' DC A 7 -5.975 4.555 16.763 1.00 0.00 O ATOM 180 C3' DC A 7 -4.489 3.518 18.320 1.00 0.00 C ATOM 181 O3' DC A 7 -5.180 2.406 18.875 1.00 0.00 O ATOM 182 C2' DC A 7 -4.036 3.206 16.900 1.00 0.00 C ATOM 183 C1' DC A 7 -5.314 3.481 16.115 1.00 0.00 C ATOM 184 N1 DC A 7 -4.995 3.777 14.696 1.00 0.00 N ATOM 185 C2 DC A 7 -4.824 2.694 13.830 1.00 0.00 C ATOM 186 O2 DC A 7 -5.024 1.527 14.183 1.00 0.00 O ATOM 187 N3 DC A 7 -4.371 2.911 12.571 1.00 0.00 N ATOM 188 C4 DC A 7 -4.174 4.139 12.138 1.00 0.00 C ATOM 189 N4 DC A 7 -3.726 4.208 10.908 1.00 0.00 N ATOM 190 C5 DC A 7 -4.365 5.284 12.969 1.00 0.00 C ATOM 191 C6 DC A 7 -4.754 5.060 14.255 1.00 0.00 C ATOM 0 H5' DC A 7 -5.546 6.830 17.897 1.00 0.00 H new ATOM 0 H5'' DC A 7 -4.667 6.273 19.308 1.00 0.00 H new ATOM 0 H4' DC A 7 -6.244 4.604 18.848 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.673 3.746 19.006 1.00 0.00 H new ATOM 0 H2' DC A 7 -3.212 3.844 16.581 1.00 0.00 H new ATOM 0 H2'' DC A 7 -3.701 2.175 16.792 1.00 0.00 H new ATOM 0 H1' DC A 7 -5.971 2.611 16.097 1.00 0.00 H new ATOM 0 H41 DC A 7 -3.542 5.117 10.482 1.00 0.00 H new ATOM 0 H42 DC A 7 -3.561 3.353 10.377 1.00 0.00 H new ATOM 0 H5 DC A 7 -4.208 6.285 12.594 1.00 0.00 H new ATOM 0 H6 DC A 7 -4.874 5.892 14.933 1.00 0.00 H new ATOM 203 P DT A 8 -4.419 1.306 19.769 1.00 0.00 P ATOM 204 OP1 DT A 8 -5.407 0.315 20.264 1.00 0.00 O ATOM 205 OP2 DT A 8 -3.542 2.006 20.725 1.00 0.00 O ATOM 206 O5' DT A 8 -3.460 0.555 18.723 1.00 0.00 O ATOM 207 C5' DT A 8 -3.899 -0.477 17.852 1.00 0.00 C ATOM 208 C4' DT A 8 -2.921 -1.650 17.956 1.00 0.00 C ATOM 209 O4' DT A 8 -1.634 -1.216 17.544 1.00 0.00 O ATOM 210 C3' DT A 8 -2.798 -2.163 19.397 1.00 0.00 C ATOM 211 O3' DT A 8 -2.870 -3.578 19.461 1.00 0.00 O ATOM 212 C2' DT A 8 -1.430 -1.674 19.850 1.00 0.00 C ATOM 213 C1' DT A 8 -0.668 -1.497 18.540 1.00 0.00 C ATOM 214 N1 DT A 8 0.326 -0.393 18.631 1.00 0.00 N ATOM 215 C2 DT A 8 1.678 -0.733 18.747 1.00 0.00 C ATOM 216 O2 DT A 8 2.085 -1.887 18.825 1.00 0.00 O ATOM 217 N3 DT A 8 2.578 0.311 18.801 1.00 0.00 N ATOM 218 C4 DT A 8 2.257 1.654 18.780 1.00 0.00 C ATOM 219 O4 DT A 8 3.169 2.471 18.782 1.00 0.00 O ATOM 220 C5 DT A 8 0.824 1.939 18.753 1.00 0.00 C ATOM 221 C7 DT A 8 0.330 3.373 18.810 1.00 0.00 C ATOM 222 C6 DT A 8 -0.081 0.926 18.677 1.00 0.00 C ATOM 0 H5' DT A 8 -3.945 -0.112 16.826 1.00 0.00 H new ATOM 0 H5'' DT A 8 -4.905 -0.798 18.122 1.00 0.00 H new ATOM 0 H4' DT A 8 -3.300 -2.453 17.324 1.00 0.00 H new ATOM 0 H3' DT A 8 -3.610 -1.801 20.028 1.00 0.00 H new ATOM 0 H2' DT A 8 -1.501 -0.738 20.404 1.00 0.00 H new ATOM 0 H2'' DT A 8 -0.942 -2.396 20.505 1.00 0.00 H new ATOM 0 H1' DT A 8 -0.105 -2.400 18.303 1.00 0.00 H new ATOM 0 H3 DT A 8 3.567 0.070 18.862 1.00 0.00 H new ATOM 0 H71 DT A 8 -0.615 3.454 18.272 1.00 0.00 H new ATOM 0 H72 DT A 8 0.182 3.666 19.849 1.00 0.00 H new ATOM 0 H73 DT A 8 1.067 4.030 18.349 1.00 0.00 H new ATOM 0 H6 DT A 8 -1.136 1.157 18.652 1.00 0.00 H new ATOM 235 P DG A 9 -4.290 -4.327 19.599 1.00 0.00 P ATOM 236 OP1 DG A 9 -5.179 -3.491 20.437 1.00 0.00 O ATOM 237 OP2 DG A 9 -3.900 -5.681 20.047 1.00 0.00 O ATOM 238 O5' DG A 9 -4.911 -4.421 18.118 1.00 0.00 O ATOM 239 C5' DG A 9 -4.762 -5.597 17.339 1.00 0.00 C ATOM 240 C4' DG A 9 -5.627 -5.558 16.068 1.00 0.00 C ATOM 241 O4' DG A 9 -5.109 -4.698 15.066 1.00 0.00 O ATOM 242 C3' DG A 9 -5.686 -6.920 15.367 1.00 0.00 C ATOM 243 O3' DG A 9 -6.909 -7.066 14.672 1.00 0.00 O ATOM 244 C2' DG A 9 -4.532 -6.880 14.369 1.00 0.00 C ATOM 245 C1' DG A 9 -4.159 -5.394 14.268 1.00 0.00 C ATOM 246 N9 DG A 9 -2.778 -5.033 14.695 1.00 0.00 N ATOM 247 C8 DG A 9 -1.719 -5.820 15.097 1.00 0.00 C ATOM 248 N7 DG A 9 -0.648 -5.152 15.423 1.00 0.00 N ATOM 249 C5 DG A 9 -0.983 -3.825 15.142 1.00 0.00 C ATOM 250 C6 DG A 9 -0.216 -2.612 15.208 1.00 0.00 C ATOM 251 O6 DG A 9 0.933 -2.429 15.599 1.00 0.00 O ATOM 252 N1 DG A 9 -0.910 -1.499 14.777 1.00 0.00 N ATOM 253 C2 DG A 9 -2.216 -1.520 14.408 1.00 0.00 C ATOM 254 N2 DG A 9 -2.808 -0.356 14.286 1.00 0.00 N ATOM 255 N3 DG A 9 -2.959 -2.618 14.323 1.00 0.00 N ATOM 256 C4 DG A 9 -2.283 -3.749 14.692 1.00 0.00 C ATOM 0 H5' DG A 9 -5.036 -6.466 17.938 1.00 0.00 H new ATOM 0 H5'' DG A 9 -3.715 -5.718 17.062 1.00 0.00 H new ATOM 0 H4' DG A 9 -6.597 -5.223 16.436 1.00 0.00 H new ATOM 0 H3' DG A 9 -5.614 -7.750 16.070 1.00 0.00 H new ATOM 0 H2' DG A 9 -3.688 -7.478 14.714 1.00 0.00 H new ATOM 0 H2'' DG A 9 -4.831 -7.280 13.400 1.00 0.00 H new ATOM 0 HO3' DG A 9 -6.931 -7.940 14.228 1.00 0.00 H new ATOM 0 H1' DG A 9 -4.178 -5.121 13.213 1.00 0.00 H new ATOM 0 H8 DG A 9 -1.772 -6.898 15.138 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.413 -0.610 14.733 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.789 -0.309 14.011 1.00 0.00 H new ATOM 0 H22 DG A 9 -2.287 0.502 14.466 1.00 0.00 H new TER 269 DG A 9 HETATM 270 NA NA A 101 1.338 2.642 4.124 1.00 0.00 NA HETATM 271 NA NA A 102 4.035 10.001 12.551 1.00 0.00 NA HETATM 272 NA NA A 103 -6.239 -1.612 20.887 1.00 0.00 NA HETATM 273 NA NA A 104 6.225 5.783 7.611 1.00 0.00 NA HETATM 274 NA NA A 105 -2.630 1.338 12.359 1.00 0.00 NA HETATM 275 NA NA A 106 -1.682 -5.608 20.123 1.00 0.00 NA HETATM 276 NA NA A 107 -6.630 -6.226 4.495 1.00 0.00 NA HETATM 277 NA NA A 108 0.124 8.874 18.026 1.00 0.00 NA