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= -0.527 (180deg=-0.527) USER MOD Single : A 9 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -5.043 -9.414 9.373 1.00 0.00 O ATOM 2 C5' DC A 1 -4.325 -8.603 10.288 1.00 0.00 C ATOM 3 C4' DC A 1 -4.620 -7.118 10.046 1.00 0.00 C ATOM 4 O4' DC A 1 -3.952 -6.363 11.049 1.00 0.00 O ATOM 5 C3' DC A 1 -4.124 -6.628 8.677 1.00 0.00 C ATOM 6 O3' DC A 1 -5.094 -5.761 8.109 1.00 0.00 O ATOM 7 C2' DC A 1 -2.834 -5.902 9.040 1.00 0.00 C ATOM 8 C1' DC A 1 -3.174 -5.359 10.425 1.00 0.00 C ATOM 9 N1 DC A 1 -1.939 -5.073 11.197 1.00 0.00 N ATOM 10 C2 DC A 1 -1.487 -3.753 11.282 1.00 0.00 C ATOM 11 O2 DC A 1 -2.163 -2.827 10.842 1.00 0.00 O ATOM 12 N3 DC A 1 -0.272 -3.471 11.823 1.00 0.00 N ATOM 13 C4 DC A 1 0.480 -4.470 12.260 1.00 0.00 C ATOM 14 N4 DC A 1 1.652 -4.159 12.762 1.00 0.00 N ATOM 15 C5 DC A 1 0.064 -5.834 12.185 1.00 0.00 C ATOM 16 C6 DC A 1 -1.152 -6.097 11.653 1.00 0.00 C ATOM 0 H5' DC A 1 -3.256 -8.788 10.184 1.00 0.00 H new ATOM 0 H5'' DC A 1 -4.597 -8.871 11.309 1.00 0.00 H new ATOM 0 H4' DC A 1 -5.702 -6.988 10.077 1.00 0.00 H new ATOM 0 H3' DC A 1 -3.961 -7.410 7.935 1.00 0.00 H new ATOM 0 H2' DC A 1 -1.976 -6.574 9.062 1.00 0.00 H new ATOM 0 H2'' DC A 1 -2.598 -5.106 8.333 1.00 0.00 H new ATOM 0 HO5' DC A 1 -4.840 -10.358 9.543 1.00 0.00 H new ATOM 0 H1' DC A 1 -3.719 -4.417 10.367 1.00 0.00 H new ATOM 0 H41 DC A 1 2.268 -4.893 13.112 1.00 0.00 H new ATOM 0 H42 DC A 1 1.947 -3.183 12.802 1.00 0.00 H new ATOM 0 H5 DC A 1 0.700 -6.631 12.542 1.00 0.00 H new ATOM 0 H6 DC A 1 -1.503 -7.116 11.588 1.00 0.00 H new ATOM 29 P DC A 2 -5.042 -5.327 6.564 1.00 0.00 P ATOM 30 OP1 DC A 2 -6.425 -5.134 6.083 1.00 0.00 O ATOM 31 OP2 DC A 2 -4.265 -6.327 5.800 1.00 0.00 O ATOM 32 O5' DC A 2 -4.273 -3.926 6.539 1.00 0.00 O ATOM 33 C5' DC A 2 -4.338 -3.061 5.418 1.00 0.00 C ATOM 34 C4' DC A 2 -3.772 -1.671 5.741 1.00 0.00 C ATOM 35 O4' DC A 2 -4.577 -1.067 6.750 1.00 0.00 O ATOM 36 C3' DC A 2 -2.324 -1.672 6.259 1.00 0.00 C ATOM 37 O3' DC A 2 -1.691 -0.492 5.781 1.00 0.00 O ATOM 38 C2' DC A 2 -2.548 -1.646 7.764 1.00 0.00 C ATOM 39 C1' DC A 2 -3.719 -0.682 7.807 1.00 0.00 C ATOM 40 N1 DC A 2 -4.371 -0.699 9.135 1.00 0.00 N ATOM 41 C2 DC A 2 -3.972 0.262 10.065 1.00 0.00 C ATOM 42 O2 DC A 2 -3.164 1.161 9.799 1.00 0.00 O ATOM 43 N3 DC A 2 -4.391 0.178 11.345 1.00 0.00 N ATOM 44 C4 DC A 2 -5.195 -0.797 11.707 1.00 0.00 C ATOM 45 N4 DC A 2 -5.616 -0.685 12.944 1.00 0.00 N ATOM 46 C5 DC A 2 -5.611 -1.829 10.812 1.00 0.00 C ATOM 47 C6 DC A 2 -5.177 -1.743 9.524 1.00 0.00 C ATOM 0 H5' DC A 2 -5.374 -2.966 5.091 1.00 0.00 H new ATOM 0 H5'' DC A 2 -3.781 -3.497 4.589 1.00 0.00 H new ATOM 0 H4' DC A 2 -3.781 -1.126 4.797 1.00 0.00 H new ATOM 0 H3' DC A 2 -1.692 -2.504 5.949 1.00 0.00 H new ATOM 0 H2' DC A 2 -2.794 -2.627 8.171 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.680 -1.281 8.314 1.00 0.00 H new ATOM 0 H1' DC A 2 -3.409 0.354 7.669 1.00 0.00 H new ATOM 0 H41 DC A 2 -6.246 -1.386 13.334 1.00 0.00 H new ATOM 0 H42 DC A 2 -5.313 0.103 13.516 1.00 0.00 H new ATOM 0 H5 DC A 2 -6.242 -2.641 11.142 1.00 0.00 H new ATOM 0 H6 DC A 2 -5.467 -2.496 8.806 1.00 0.00 H new ATOM 59 P DT A 3 -0.114 -0.242 5.940 1.00 0.00 P ATOM 60 OP1 DT A 3 0.253 0.894 5.062 1.00 0.00 O ATOM 61 OP2 DT A 3 0.591 -1.532 5.806 1.00 0.00 O ATOM 62 O5' DT A 3 0.017 0.234 7.474 1.00 0.00 O ATOM 63 C5' DT A 3 0.614 1.459 7.884 1.00 0.00 C ATOM 64 C4' DT A 3 2.112 1.334 8.197 1.00 0.00 C ATOM 65 O4' DT A 3 2.307 0.258 9.092 1.00 0.00 O ATOM 66 C3' DT A 3 3.047 1.154 6.991 1.00 0.00 C ATOM 67 O3' DT A 3 4.050 2.166 6.935 1.00 0.00 O ATOM 68 C2' DT A 3 3.678 -0.213 7.238 1.00 0.00 C ATOM 69 C1' DT A 3 3.456 -0.470 8.730 1.00 0.00 C ATOM 70 N1 DT A 3 3.210 -1.904 9.040 1.00 0.00 N ATOM 71 C2 DT A 3 4.176 -2.602 9.771 1.00 0.00 C ATOM 72 O2 DT A 3 5.239 -2.111 10.136 1.00 0.00 O ATOM 73 N3 DT A 3 3.901 -3.923 10.056 1.00 0.00 N ATOM 74 C4 DT A 3 2.782 -4.623 9.652 1.00 0.00 C ATOM 75 O4 DT A 3 2.679 -5.803 9.976 1.00 0.00 O ATOM 76 C5 DT A 3 1.827 -3.845 8.865 1.00 0.00 C ATOM 77 C7 DT A 3 0.559 -4.495 8.337 1.00 0.00 C ATOM 78 C6 DT A 3 2.062 -2.533 8.601 1.00 0.00 C ATOM 0 H5' DT A 3 0.095 1.829 8.769 1.00 0.00 H new ATOM 0 H5'' DT A 3 0.475 2.202 7.099 1.00 0.00 H new ATOM 0 H4' DT A 3 2.389 2.297 8.626 1.00 0.00 H new ATOM 0 H3' DT A 3 2.515 1.226 6.042 1.00 0.00 H new ATOM 0 H2' DT A 3 3.208 -0.984 6.628 1.00 0.00 H new ATOM 0 H2'' DT A 3 4.739 -0.212 6.988 1.00 0.00 H new ATOM 0 H1' DT A 3 4.351 -0.172 9.275 1.00 0.00 H new ATOM 0 H3 DT A 3 4.587 -4.429 10.616 1.00 0.00 H new ATOM 0 H71 DT A 3 -0.231 -3.747 8.267 1.00 0.00 H new ATOM 0 H72 DT A 3 0.750 -4.915 7.349 1.00 0.00 H new ATOM 0 H73 DT A 3 0.248 -5.289 9.015 1.00 0.00 H new ATOM 0 H6 DT A 3 1.335 -1.970 8.035 1.00 0.00 H new ATOM 91 P DG A 4 3.756 3.618 6.289 1.00 0.00 P ATOM 92 OP1 DG A 4 3.008 3.425 5.025 1.00 0.00 O ATOM 93 OP2 DG A 4 5.010 4.415 6.303 1.00 0.00 O ATOM 94 O5' DG A 4 2.759 4.298 7.353 1.00 0.00 O ATOM 95 C5' DG A 4 3.280 5.114 8.385 1.00 0.00 C ATOM 96 C4' DG A 4 2.305 5.418 9.523 1.00 0.00 C ATOM 97 O4' DG A 4 1.488 4.307 9.874 1.00 0.00 O ATOM 98 C3' DG A 4 3.089 5.796 10.784 1.00 0.00 C ATOM 99 O3' DG A 4 3.457 7.160 10.889 1.00 0.00 O ATOM 100 C2' DG A 4 2.073 5.433 11.850 1.00 0.00 C ATOM 101 C1' DG A 4 1.452 4.159 11.283 1.00 0.00 C ATOM 102 N9 DG A 4 2.163 2.904 11.651 1.00 0.00 N ATOM 103 C8 DG A 4 3.461 2.681 12.042 1.00 0.00 C ATOM 104 N7 DG A 4 3.741 1.436 12.320 1.00 0.00 N ATOM 105 C5 DG A 4 2.537 0.766 12.092 1.00 0.00 C ATOM 106 C6 DG A 4 2.165 -0.622 12.208 1.00 0.00 C ATOM 107 O6 DG A 4 2.805 -1.603 12.582 1.00 0.00 O ATOM 108 N1 DG A 4 0.865 -0.863 11.816 1.00 0.00 N ATOM 109 C2 DG A 4 0.038 0.093 11.335 1.00 0.00 C ATOM 110 N2 DG A 4 -1.111 -0.292 10.852 1.00 0.00 N ATOM 111 N3 DG A 4 0.278 1.397 11.336 1.00 0.00 N ATOM 112 C4 DG A 4 1.570 1.668 11.687 1.00 0.00 C ATOM 0 H5' DG A 4 3.612 6.057 7.950 1.00 0.00 H new ATOM 0 H5'' DG A 4 4.162 4.627 8.802 1.00 0.00 H new ATOM 0 H4' DG A 4 1.670 6.227 9.164 1.00 0.00 H new ATOM 0 H3' DG A 4 4.056 5.296 10.832 1.00 0.00 H new ATOM 0 H2' DG A 4 2.543 5.261 12.818 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.332 6.220 11.991 1.00 0.00 H new ATOM 0 H1' DG A 4 0.449 4.053 11.697 1.00 0.00 H new ATOM 0 H8 DG A 4 4.192 3.473 12.114 1.00 0.00 H new ATOM 0 H1 DG A 4 0.507 -1.815 11.893 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.764 0.397 10.479 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.356 -1.282 10.847 1.00 0.00 H new HETATM 124 O5' 3DR A 5 5.870 6.741 11.489 1.00 0.00 O HETATM 125 P 3DR A 5 4.947 7.652 10.531 1.00 0.00 P HETATM 126 OP1 3DR A 5 5.040 9.058 10.982 1.00 0.00 O HETATM 127 OP2 3DR A 5 5.268 7.284 9.131 1.00 0.00 O HETATM 128 C2' 3DR A 5 5.931 5.874 15.911 1.00 0.00 C HETATM 129 C5' 3DR A 5 6.100 7.022 12.864 1.00 0.00 C HETATM 130 C4' 3DR A 5 4.963 6.546 13.797 1.00 0.00 C HETATM 131 O4' 3DR A 5 4.930 5.128 13.890 1.00 0.00 O HETATM 132 C1' 3DR A 5 5.851 4.733 14.893 1.00 0.00 C HETATM 133 C3' 3DR A 5 5.174 7.027 15.248 1.00 0.00 C HETATM 134 O3' 3DR A 5 3.976 7.238 15.992 1.00 0.00 O HETATM 0 H5'' 3DR A 5 7.032 6.548 13.171 1.00 0.00 H new HETATM 0 H4'1 3DR A 5 4.049 6.953 13.364 1.00 0.00 H new HETATM 0 H2'' 3DR A 5 5.475 5.593 16.860 1.00 0.00 H new HETATM 0 H1'2 3DR A 5 6.831 4.536 14.459 1.00 0.00 H new HETATM 0 H1'1 3DR A 5 5.524 3.811 15.374 1.00 0.00 H new HETATM 0 H5' 3DR A 5 6.233 8.097 12.988 1.00 0.00 H new HETATM 0 H3' 3DR A 5 5.681 7.992 15.233 1.00 0.00 H new HETATM 0 H2' 3DR A 5 6.965 6.147 16.122 1.00 0.00 H new ATOM 143 P DC A 6 2.831 8.273 15.547 1.00 0.00 P ATOM 144 OP1 DC A 6 3.378 9.212 14.537 1.00 0.00 O ATOM 145 OP2 DC A 6 2.128 8.789 16.749 1.00 0.00 O ATOM 146 O5' DC A 6 1.807 7.305 14.801 1.00 0.00 O ATOM 147 C5' DC A 6 0.568 7.798 14.330 1.00 0.00 C ATOM 148 C4' DC A 6 -0.557 6.817 14.655 1.00 0.00 C ATOM 149 O4' DC A 6 -0.330 5.599 13.942 1.00 0.00 O ATOM 150 C3' DC A 6 -0.711 6.489 16.134 1.00 0.00 C ATOM 151 O3' DC A 6 -2.011 6.680 16.649 1.00 0.00 O ATOM 152 C2' DC A 6 -0.391 5.024 16.245 1.00 0.00 C ATOM 153 C1' DC A 6 -0.565 4.512 14.816 1.00 0.00 C ATOM 154 N1 DC A 6 0.323 3.331 14.644 1.00 0.00 N ATOM 155 C2 DC A 6 -0.272 2.062 14.632 1.00 0.00 C ATOM 156 O2 DC A 6 -1.463 1.906 14.343 1.00 0.00 O ATOM 157 N3 DC A 6 0.454 0.960 14.936 1.00 0.00 N ATOM 158 C4 DC A 6 1.741 1.096 15.218 1.00 0.00 C ATOM 159 N4 DC A 6 2.410 0.010 15.511 1.00 0.00 N ATOM 160 C5 DC A 6 2.412 2.350 15.176 1.00 0.00 C ATOM 161 C6 DC A 6 1.674 3.447 14.878 1.00 0.00 C ATOM 0 H5' DC A 6 0.619 7.958 13.253 1.00 0.00 H new ATOM 0 H5'' DC A 6 0.358 8.765 14.786 1.00 0.00 H new ATOM 0 H4' DC A 6 -1.480 7.311 14.353 1.00 0.00 H new ATOM 0 H3' DC A 6 -0.062 7.155 16.703 1.00 0.00 H new ATOM 0 H2' DC A 6 0.623 4.861 16.609 1.00 0.00 H new ATOM 0 H2'' DC A 6 -1.063 4.518 16.938 1.00 0.00 H new ATOM 0 H1' DC A 6 -1.569 4.157 14.585 1.00 0.00 H new ATOM 0 H41 DC A 6 3.404 0.068 15.735 1.00 0.00 H new ATOM 0 H42 DC A 6 1.938 -0.894 15.516 1.00 0.00 H new ATOM 0 H5 DC A 6 3.471 2.425 15.374 1.00 0.00 H new ATOM 0 H6 DC A 6 2.148 4.416 14.824 1.00 0.00 H new ATOM 173 P DC A 7 -2.224 6.935 18.224 1.00 0.00 P ATOM 174 OP1 DC A 7 -1.487 8.185 18.530 1.00 0.00 O ATOM 175 OP2 DC A 7 -1.889 5.709 18.994 1.00 0.00 O ATOM 176 O5' DC A 7 -3.807 7.200 18.315 1.00 0.00 O ATOM 177 C5' DC A 7 -4.786 6.239 18.715 1.00 0.00 C ATOM 178 C4' DC A 7 -5.088 5.027 17.805 1.00 0.00 C ATOM 179 O4' DC A 7 -5.021 5.305 16.414 1.00 0.00 O ATOM 180 C3' DC A 7 -4.269 3.754 18.032 1.00 0.00 C ATOM 181 O3' DC A 7 -4.965 2.838 18.865 1.00 0.00 O ATOM 182 C2' DC A 7 -4.143 3.169 16.636 1.00 0.00 C ATOM 183 C1' DC A 7 -5.008 4.052 15.752 1.00 0.00 C ATOM 184 N1 DC A 7 -4.480 4.078 14.361 1.00 0.00 N ATOM 185 C2 DC A 7 -4.506 2.899 13.604 1.00 0.00 C ATOM 186 O2 DC A 7 -4.969 1.836 14.031 1.00 0.00 O ATOM 187 N3 DC A 7 -3.944 2.892 12.373 1.00 0.00 N ATOM 188 C4 DC A 7 -3.440 3.993 11.858 1.00 0.00 C ATOM 189 N4 DC A 7 -2.886 3.843 10.677 1.00 0.00 N ATOM 190 C5 DC A 7 -3.404 5.218 12.576 1.00 0.00 C ATOM 191 C6 DC A 7 -3.920 5.216 13.836 1.00 0.00 C ATOM 0 H5' DC A 7 -5.724 6.774 18.867 1.00 0.00 H new ATOM 0 H5'' DC A 7 -4.481 5.849 19.686 1.00 0.00 H new ATOM 0 H4' DC A 7 -6.112 4.832 18.124 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.315 3.955 18.519 1.00 0.00 H new ATOM 0 H2' DC A 7 -3.106 3.172 16.300 1.00 0.00 H new ATOM 0 H2'' DC A 7 -4.483 2.134 16.611 1.00 0.00 H new ATOM 0 H1' DC A 7 -6.030 3.694 15.625 1.00 0.00 H new ATOM 0 H41 DC A 7 -2.470 4.645 10.203 1.00 0.00 H new ATOM 0 H42 DC A 7 -2.872 2.925 10.233 1.00 0.00 H new ATOM 0 H5 DC A 7 -2.985 6.113 12.141 1.00 0.00 H new ATOM 0 H6 DC A 7 -3.888 6.119 14.428 1.00 0.00 H new ATOM 203 P DT A 8 -4.185 1.683 19.666 1.00 0.00 P ATOM 204 OP1 DT A 8 -5.182 0.855 20.384 1.00 0.00 O ATOM 205 OP2 DT A 8 -3.092 2.352 20.413 1.00 0.00 O ATOM 206 O5' DT A 8 -3.503 0.771 18.528 1.00 0.00 O ATOM 207 C5' DT A 8 -4.182 -0.249 17.801 1.00 0.00 C ATOM 208 C4' DT A 8 -3.486 -1.608 17.971 1.00 0.00 C ATOM 209 O4' DT A 8 -2.144 -1.528 17.514 1.00 0.00 O ATOM 210 C3' DT A 8 -3.462 -2.072 19.431 1.00 0.00 C ATOM 211 O3' DT A 8 -3.829 -3.433 19.570 1.00 0.00 O ATOM 212 C2' DT A 8 -2.017 -1.861 19.851 1.00 0.00 C ATOM 213 C1' DT A 8 -1.247 -1.934 18.535 1.00 0.00 C ATOM 214 N1 DT A 8 -0.064 -1.033 18.570 1.00 0.00 N ATOM 215 C2 DT A 8 1.200 -1.587 18.796 1.00 0.00 C ATOM 216 O2 DT A 8 1.397 -2.785 18.965 1.00 0.00 O ATOM 217 N3 DT A 8 2.259 -0.704 18.876 1.00 0.00 N ATOM 218 C4 DT A 8 2.169 0.673 18.813 1.00 0.00 C ATOM 219 O4 DT A 8 3.197 1.338 18.894 1.00 0.00 O ATOM 220 C5 DT A 8 0.811 1.186 18.659 1.00 0.00 C ATOM 221 C7 DT A 8 0.544 2.679 18.646 1.00 0.00 C ATOM 222 C6 DT A 8 -0.236 0.333 18.528 1.00 0.00 C ATOM 0 H5' DT A 8 -4.217 0.015 16.744 1.00 0.00 H new ATOM 0 H5'' DT A 8 -5.214 -0.320 18.146 1.00 0.00 H new ATOM 0 H4' DT A 8 -4.058 -2.327 17.385 1.00 0.00 H new ATOM 0 H3' DT A 8 -4.177 -1.523 20.043 1.00 0.00 H new ATOM 0 H2' DT A 8 -1.879 -0.898 20.343 1.00 0.00 H new ATOM 0 H2'' DT A 8 -1.687 -2.628 20.552 1.00 0.00 H new ATOM 0 H1' DT A 8 -0.880 -2.945 18.357 1.00 0.00 H new ATOM 0 H3 DT A 8 3.190 -1.104 18.992 1.00 0.00 H new ATOM 0 H71 DT A 8 -0.330 2.887 18.028 1.00 0.00 H new ATOM 0 H72 DT A 8 0.360 3.024 19.663 1.00 0.00 H new ATOM 0 H73 DT A 8 1.410 3.200 18.237 1.00 0.00 H new ATOM 0 H6 DT A 8 -1.229 0.735 18.387 1.00 0.00 H new ATOM 235 P DG A 9 -5.366 -3.912 19.432 1.00 0.00 P ATOM 236 OP1 DG A 9 -6.225 -2.724 19.681 1.00 0.00 O ATOM 237 OP2 DG A 9 -5.548 -5.125 20.250 1.00 0.00 O ATOM 238 O5' DG A 9 -5.507 -4.318 17.880 1.00 0.00 O ATOM 239 C5' DG A 9 -4.885 -5.486 17.367 1.00 0.00 C ATOM 240 C4' DG A 9 -5.484 -5.836 15.997 1.00 0.00 C ATOM 241 O4' DG A 9 -4.987 -4.984 14.979 1.00 0.00 O ATOM 242 C3' DG A 9 -5.157 -7.273 15.557 1.00 0.00 C ATOM 243 O3' DG A 9 -6.311 -7.983 15.140 1.00 0.00 O ATOM 244 C2' DG A 9 -4.208 -7.119 14.369 1.00 0.00 C ATOM 245 C1' DG A 9 -3.928 -5.614 14.280 1.00 0.00 C ATOM 246 N9 DG A 9 -2.605 -5.162 14.797 1.00 0.00 N ATOM 247 C8 DG A 9 -1.551 -5.888 15.309 1.00 0.00 C ATOM 248 N7 DG A 9 -0.491 -5.183 15.582 1.00 0.00 N ATOM 249 C5 DG A 9 -0.855 -3.883 15.228 1.00 0.00 C ATOM 250 C6 DG A 9 -0.122 -2.648 15.267 1.00 0.00 C ATOM 251 O6 DG A 9 1.030 -2.423 15.625 1.00 0.00 O ATOM 252 N1 DG A 9 -0.860 -1.564 14.837 1.00 0.00 N ATOM 253 C2 DG A 9 -2.154 -1.641 14.429 1.00 0.00 C ATOM 254 N2 DG A 9 -2.789 -0.508 14.236 1.00 0.00 N ATOM 255 N3 DG A 9 -2.849 -2.769 14.322 1.00 0.00 N ATOM 256 C4 DG A 9 -2.149 -3.863 14.752 1.00 0.00 C ATOM 0 H5' DG A 9 -5.025 -6.317 18.058 1.00 0.00 H new ATOM 0 H5'' DG A 9 -3.811 -5.326 17.274 1.00 0.00 H new ATOM 0 H4' DG A 9 -6.560 -5.717 16.124 1.00 0.00 H new ATOM 0 H3' DG A 9 -4.729 -7.837 16.386 1.00 0.00 H new ATOM 0 H2' DG A 9 -3.288 -7.684 14.522 1.00 0.00 H new ATOM 0 H2'' DG A 9 -4.661 -7.492 13.450 1.00 0.00 H new ATOM 0 HO3' DG A 9 -6.057 -8.889 14.868 1.00 0.00 H new ATOM 0 H1' DG A 9 -3.878 -5.340 13.226 1.00 0.00 H new ATOM 0 H8 DG A 9 -1.600 -6.955 15.471 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.407 -0.650 14.825 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.762 -0.514 13.930 1.00 0.00 H new ATOM 0 H22 DG A 9 -2.309 0.378 14.393 1.00 0.00 H new TER 269 DG A 9 HETATM 270 NA NA A 101 1.242 2.565 4.052 1.00 0.00 NA HETATM 271 NA NA A 102 3.926 10.068 12.584 1.00 0.00 NA HETATM 272 NA NA A 103 -2.031 4.275 20.680 1.00 0.00 NA HETATM 273 NA NA A 104 5.996 6.044 7.447 1.00 0.00 NA HETATM 274 NA NA A 105 -2.423 1.104 12.345 1.00 0.00 NA HETATM 275 NA NA A 106 -6.632 -0.785 20.633 1.00 0.00 NA HETATM 276 NA NA A 107 -6.126 -6.810 4.542 1.00 0.00 NA HETATM 277 NA NA A 108 0.466 9.172 18.164 1.00 0.00 NA