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 -60:sc= 1.01 USER MOD Set 1.2: A 9 DG O3' : rot 38:sc= 0.921 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 -5.648 -8.681 11.656 1.00 0.00 O ATOM 2 C5' DC A 1 -4.643 -8.238 10.748 1.00 0.00 C ATOM 3 C4' DC A 1 -4.881 -6.779 10.326 1.00 0.00 C ATOM 4 O4' DC A 1 -4.145 -5.982 11.237 1.00 0.00 O ATOM 5 C3' DC A 1 -4.407 -6.423 8.905 1.00 0.00 C ATOM 6 O3' DC A 1 -5.337 -5.527 8.309 1.00 0.00 O ATOM 7 C2' DC A 1 -3.056 -5.764 9.154 1.00 0.00 C ATOM 8 C1' DC A 1 -3.265 -5.142 10.529 1.00 0.00 C ATOM 9 N1 DC A 1 -1.979 -4.963 11.247 1.00 0.00 N ATOM 10 C2 DC A 1 -1.475 -3.670 11.395 1.00 0.00 C ATOM 11 O2 DC A 1 -2.121 -2.703 11.005 1.00 0.00 O ATOM 12 N3 DC A 1 -0.248 -3.464 11.941 1.00 0.00 N ATOM 13 C4 DC A 1 0.471 -4.512 12.316 1.00 0.00 C ATOM 14 N4 DC A 1 1.658 -4.258 12.814 1.00 0.00 N ATOM 15 C5 DC A 1 0.009 -5.855 12.153 1.00 0.00 C ATOM 16 C6 DC A 1 -1.217 -6.041 11.612 1.00 0.00 C ATOM 0 H5' DC A 1 -4.638 -8.878 9.866 1.00 0.00 H new ATOM 0 H5'' DC A 1 -3.662 -8.329 11.214 1.00 0.00 H new ATOM 0 H4' DC A 1 -5.958 -6.609 10.332 1.00 0.00 H new ATOM 0 H3' DC A 1 -4.330 -7.271 8.224 1.00 0.00 H new ATOM 0 H2' DC A 1 -2.241 -6.488 9.152 1.00 0.00 H new ATOM 0 H2'' DC A 1 -2.820 -5.015 8.398 1.00 0.00 H new ATOM 0 HO5' DC A 1 -5.634 -8.120 12.459 1.00 0.00 H new ATOM 0 H1' DC A 1 -3.692 -4.144 10.434 1.00 0.00 H new ATOM 0 H41 DC A 1 2.257 -5.025 13.120 1.00 0.00 H new ATOM 0 H42 DC A 1 1.981 -3.294 12.895 1.00 0.00 H new ATOM 0 H5 DC A 1 0.619 -6.694 12.452 1.00 0.00 H new ATOM 0 H6 DC A 1 -1.596 -7.042 11.468 1.00 0.00 H new ATOM 29 P DC A 2 -5.259 -5.110 6.755 1.00 0.00 P ATOM 30 OP1 DC A 2 -6.622 -4.795 6.278 1.00 0.00 O ATOM 31 OP2 DC A 2 -4.583 -6.180 5.990 1.00 0.00 O ATOM 32 O5' DC A 2 -4.372 -3.777 6.709 1.00 0.00 O ATOM 33 C5' DC A 2 -4.346 -2.936 5.565 1.00 0.00 C ATOM 34 C4' DC A 2 -3.739 -1.555 5.866 1.00 0.00 C ATOM 35 O4' DC A 2 -4.542 -0.904 6.845 1.00 0.00 O ATOM 36 C3' DC A 2 -2.298 -1.577 6.400 1.00 0.00 C ATOM 37 O3' DC A 2 -1.636 -0.418 5.909 1.00 0.00 O ATOM 38 C2' DC A 2 -2.542 -1.527 7.901 1.00 0.00 C ATOM 39 C1' DC A 2 -3.703 -0.546 7.928 1.00 0.00 C ATOM 40 N1 DC A 2 -4.396 -0.581 9.235 1.00 0.00 N ATOM 41 C2 DC A 2 -4.027 0.359 10.201 1.00 0.00 C ATOM 42 O2 DC A 2 -3.259 1.303 9.971 1.00 0.00 O ATOM 43 N3 DC A 2 -4.441 0.217 11.477 1.00 0.00 N ATOM 44 C4 DC A 2 -5.236 -0.782 11.796 1.00 0.00 C ATOM 45 N4 DC A 2 -5.662 -0.742 13.036 1.00 0.00 N ATOM 46 C5 DC A 2 -5.656 -1.772 10.854 1.00 0.00 C ATOM 47 C6 DC A 2 -5.216 -1.633 9.574 1.00 0.00 C ATOM 0 H5' DC A 2 -5.361 -2.809 5.187 1.00 0.00 H new ATOM 0 H5'' DC A 2 -3.770 -3.419 4.776 1.00 0.00 H new ATOM 0 H4' DC A 2 -3.715 -1.036 4.908 1.00 0.00 H new ATOM 0 H3' DC A 2 -1.676 -2.424 6.111 1.00 0.00 H new ATOM 0 H2' DC A 2 -2.805 -2.500 8.316 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.675 -1.167 8.456 1.00 0.00 H new ATOM 0 H1' DC A 2 -3.370 0.486 7.815 1.00 0.00 H new ATOM 0 H41 DC A 2 -6.284 -1.471 13.385 1.00 0.00 H new ATOM 0 H42 DC A 2 -5.371 0.018 13.651 1.00 0.00 H new ATOM 0 H5 DC A 2 -6.294 -2.593 11.145 1.00 0.00 H new ATOM 0 H6 DC A 2 -5.511 -2.350 8.822 1.00 0.00 H new ATOM 59 P DT A 3 -0.054 -0.198 6.080 1.00 0.00 P ATOM 60 OP1 DT A 3 0.346 0.922 5.195 1.00 0.00 O ATOM 61 OP2 DT A 3 0.625 -1.502 5.968 1.00 0.00 O ATOM 62 O5' DT A 3 0.059 0.293 7.608 1.00 0.00 O ATOM 63 C5' DT A 3 0.747 1.466 8.022 1.00 0.00 C ATOM 64 C4' DT A 3 2.223 1.219 8.362 1.00 0.00 C ATOM 65 O4' DT A 3 2.320 0.120 9.248 1.00 0.00 O ATOM 66 C3' DT A 3 3.156 0.981 7.165 1.00 0.00 C ATOM 67 O3' DT A 3 4.205 1.943 7.102 1.00 0.00 O ATOM 68 C2' DT A 3 3.726 -0.408 7.433 1.00 0.00 C ATOM 69 C1' DT A 3 3.445 -0.659 8.917 1.00 0.00 C ATOM 70 N1 DT A 3 3.135 -2.085 9.198 1.00 0.00 N ATOM 71 C2 DT A 3 4.091 -2.852 9.871 1.00 0.00 C ATOM 72 O2 DT A 3 5.172 -2.414 10.250 1.00 0.00 O ATOM 73 N3 DT A 3 3.786 -4.182 10.073 1.00 0.00 N ATOM 74 C4 DT A 3 2.641 -4.825 9.644 1.00 0.00 C ATOM 75 O4 DT A 3 2.515 -6.021 9.888 1.00 0.00 O ATOM 76 C5 DT A 3 1.693 -3.972 8.928 1.00 0.00 C ATOM 77 C7 DT A 3 0.402 -4.551 8.376 1.00 0.00 C ATOM 78 C6 DT A 3 1.962 -2.653 8.741 1.00 0.00 C ATOM 0 H5' DT A 3 0.246 1.883 8.895 1.00 0.00 H new ATOM 0 H5'' DT A 3 0.684 2.213 7.231 1.00 0.00 H new ATOM 0 H4' DT A 3 2.568 2.149 8.814 1.00 0.00 H new ATOM 0 H3' DT A 3 2.631 1.065 6.214 1.00 0.00 H new ATOM 0 H2' DT A 3 3.248 -1.161 6.806 1.00 0.00 H new ATOM 0 H2'' DT A 3 4.794 -0.447 7.219 1.00 0.00 H new ATOM 0 H1' DT A 3 4.328 -0.399 9.501 1.00 0.00 H new ATOM 0 H3 DT A 3 4.468 -4.741 10.586 1.00 0.00 H new ATOM 0 H71 DT A 3 -0.369 -3.781 8.371 1.00 0.00 H new ATOM 0 H72 DT A 3 0.568 -4.905 7.358 1.00 0.00 H new ATOM 0 H73 DT A 3 0.080 -5.383 9.002 1.00 0.00 H new ATOM 0 H6 DT A 3 1.243 -2.035 8.224 1.00 0.00 H new ATOM 91 P DG A 4 3.993 3.389 6.417 1.00 0.00 P ATOM 92 OP1 DG A 4 3.259 3.206 5.144 1.00 0.00 O ATOM 93 OP2 DG A 4 5.284 4.126 6.437 1.00 0.00 O ATOM 94 O5' DG A 4 3.014 4.141 7.439 1.00 0.00 O ATOM 95 C5' DG A 4 3.558 4.951 8.461 1.00 0.00 C ATOM 96 C4' DG A 4 2.571 5.301 9.566 1.00 0.00 C ATOM 97 O4' DG A 4 1.740 4.206 9.931 1.00 0.00 O ATOM 98 C3' DG A 4 3.339 5.710 10.825 1.00 0.00 C ATOM 99 O3' DG A 4 3.692 7.079 10.871 1.00 0.00 O ATOM 100 C2' DG A 4 2.286 5.405 11.867 1.00 0.00 C ATOM 101 C1' DG A 4 1.627 4.141 11.339 1.00 0.00 C ATOM 102 N9 DG A 4 2.258 2.882 11.808 1.00 0.00 N ATOM 103 C8 DG A 4 3.526 2.621 12.266 1.00 0.00 C ATOM 104 N7 DG A 4 3.745 1.369 12.562 1.00 0.00 N ATOM 105 C5 DG A 4 2.526 0.741 12.287 1.00 0.00 C ATOM 106 C6 DG A 4 2.095 -0.633 12.384 1.00 0.00 C ATOM 107 O6 DG A 4 2.694 -1.641 12.754 1.00 0.00 O ATOM 108 N1 DG A 4 0.793 -0.816 11.967 1.00 0.00 N ATOM 109 C2 DG A 4 0.017 0.179 11.469 1.00 0.00 C ATOM 110 N2 DG A 4 -1.144 -0.145 10.971 1.00 0.00 N ATOM 111 N3 DG A 4 0.321 1.467 11.459 1.00 0.00 N ATOM 112 C4 DG A 4 1.612 1.678 11.847 1.00 0.00 C ATOM 0 H5' DG A 4 3.934 5.873 8.018 1.00 0.00 H new ATOM 0 H5'' DG A 4 4.413 4.438 8.901 1.00 0.00 H new ATOM 0 H4' DG A 4 1.949 6.107 9.177 1.00 0.00 H new ATOM 0 H3' DG A 4 4.299 5.205 10.927 1.00 0.00 H new ATOM 0 H2' DG A 4 2.728 5.247 12.851 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.570 6.221 11.966 1.00 0.00 H new ATOM 0 H1' DG A 4 0.600 4.109 11.703 1.00 0.00 H new ATOM 0 H8 DG A 4 4.279 3.388 12.372 1.00 0.00 H new ATOM 0 H1 DG A 4 0.392 -1.751 12.037 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.754 0.577 10.588 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.442 -1.120 10.965 1.00 0.00 H new HETATM 124 O5' 3DR A 5 6.043 6.813 11.734 1.00 0.00 O HETATM 125 P 3DR A 5 5.197 7.566 10.584 1.00 0.00 P HETATM 126 OP1 3DR A 5 5.215 9.020 10.861 1.00 0.00 O HETATM 127 OP2 3DR A 5 5.637 7.035 9.268 1.00 0.00 O HETATM 128 C2' 3DR A 5 5.536 6.459 16.203 1.00 0.00 C HETATM 129 C5' 3DR A 5 6.091 7.250 13.088 1.00 0.00 C HETATM 130 C4' 3DR A 5 4.858 6.821 13.914 1.00 0.00 C HETATM 131 O4' 3DR A 5 4.877 5.424 14.175 1.00 0.00 O HETATM 132 C1' 3DR A 5 5.662 5.206 15.334 1.00 0.00 C HETATM 133 C3' 3DR A 5 4.820 7.475 15.310 1.00 0.00 C HETATM 134 O3' 3DR A 5 3.506 7.676 15.830 1.00 0.00 O HETATM 0 H5'' 3DR A 5 6.991 6.853 13.559 1.00 0.00 H new HETATM 0 H4'1 3DR A 5 4.003 7.127 13.311 1.00 0.00 H new HETATM 0 H2'' 3DR A 5 4.966 6.257 17.110 1.00 0.00 H new HETATM 0 H1'2 3DR A 5 6.703 5.026 15.066 1.00 0.00 H new HETATM 0 H1'1 3DR A 5 5.315 4.325 15.875 1.00 0.00 H new HETATM 0 H5' 3DR A 5 6.173 8.337 13.109 1.00 0.00 H new HETATM 0 H3' 3DR A 5 5.269 8.467 15.265 1.00 0.00 H new HETATM 0 H2' 3DR A 5 6.514 6.825 16.516 1.00 0.00 H new ATOM 143 P DC A 6 2.415 8.635 15.135 1.00 0.00 P ATOM 144 OP1 DC A 6 3.108 9.581 14.225 1.00 0.00 O ATOM 145 OP2 DC A 6 1.471 9.135 16.167 1.00 0.00 O ATOM 146 O5' DC A 6 1.616 7.596 14.220 1.00 0.00 O ATOM 147 C5' DC A 6 0.431 7.964 13.533 1.00 0.00 C ATOM 148 C4' DC A 6 -0.694 6.964 13.832 1.00 0.00 C ATOM 149 O4' DC A 6 -0.308 5.621 13.543 1.00 0.00 O ATOM 150 C3' DC A 6 -1.103 7.028 15.306 1.00 0.00 C ATOM 151 O3' DC A 6 -2.513 7.044 15.456 1.00 0.00 O ATOM 152 C2' DC A 6 -0.492 5.763 15.877 1.00 0.00 C ATOM 153 C1' DC A 6 -0.600 4.823 14.675 1.00 0.00 C ATOM 154 N1 DC A 6 0.299 3.638 14.798 1.00 0.00 N ATOM 155 C2 DC A 6 -0.256 2.352 14.720 1.00 0.00 C ATOM 156 O2 DC A 6 -1.420 2.170 14.343 1.00 0.00 O ATOM 157 N3 DC A 6 0.486 1.263 15.043 1.00 0.00 N ATOM 158 C4 DC A 6 1.753 1.430 15.401 1.00 0.00 C ATOM 159 N4 DC A 6 2.449 0.357 15.680 1.00 0.00 N ATOM 160 C5 DC A 6 2.380 2.708 15.439 1.00 0.00 C ATOM 161 C6 DC A 6 1.628 3.790 15.123 1.00 0.00 C ATOM 0 H5' DC A 6 0.621 7.997 12.460 1.00 0.00 H new ATOM 0 H5'' DC A 6 0.125 8.966 13.834 1.00 0.00 H new ATOM 0 H4' DC A 6 -1.529 7.245 13.191 1.00 0.00 H new ATOM 0 H3' DC A 6 -0.763 7.933 15.809 1.00 0.00 H new ATOM 0 H2' DC A 6 0.540 5.910 16.195 1.00 0.00 H new ATOM 0 H2'' DC A 6 -1.042 5.392 16.742 1.00 0.00 H new ATOM 0 H1' DC A 6 -1.596 4.388 14.597 1.00 0.00 H new ATOM 0 H41 DC A 6 3.426 0.441 15.959 1.00 0.00 H new ATOM 0 H42 DC A 6 2.014 -0.563 15.618 1.00 0.00 H new ATOM 0 H5 DC A 6 3.420 2.811 15.711 1.00 0.00 H new ATOM 0 H6 DC A 6 2.072 4.774 15.126 1.00 0.00 H new ATOM 173 P DC A 7 -3.208 7.618 16.791 1.00 0.00 P ATOM 174 OP1 DC A 7 -4.619 7.914 16.442 1.00 0.00 O ATOM 175 OP2 DC A 7 -2.326 8.678 17.340 1.00 0.00 O ATOM 176 O5' DC A 7 -3.203 6.374 17.818 1.00 0.00 O ATOM 177 C5' DC A 7 -4.318 6.068 18.649 1.00 0.00 C ATOM 178 C4' DC A 7 -5.098 4.823 18.183 1.00 0.00 C ATOM 179 O4' DC A 7 -5.542 4.944 16.826 1.00 0.00 O ATOM 180 C3' DC A 7 -4.247 3.555 18.293 1.00 0.00 C ATOM 181 O3' DC A 7 -5.038 2.491 18.798 1.00 0.00 O ATOM 182 C2' DC A 7 -3.879 3.299 16.844 1.00 0.00 C ATOM 183 C1' DC A 7 -5.148 3.759 16.135 1.00 0.00 C ATOM 184 N1 DC A 7 -4.873 3.928 14.681 1.00 0.00 N ATOM 185 C2 DC A 7 -4.718 2.771 13.905 1.00 0.00 C ATOM 186 O2 DC A 7 -4.933 1.640 14.346 1.00 0.00 O ATOM 187 N3 DC A 7 -4.279 2.881 12.629 1.00 0.00 N ATOM 188 C4 DC A 7 -4.126 4.062 12.073 1.00 0.00 C ATOM 189 N4 DC A 7 -3.690 4.033 10.836 1.00 0.00 N ATOM 190 C5 DC A 7 -4.341 5.274 12.792 1.00 0.00 C ATOM 191 C6 DC A 7 -4.672 5.164 14.107 1.00 0.00 C ATOM 0 H5' DC A 7 -4.992 6.924 18.671 1.00 0.00 H new ATOM 0 H5'' DC A 7 -3.970 5.910 19.670 1.00 0.00 H new ATOM 0 H4' DC A 7 -5.963 4.749 18.842 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.387 3.644 18.956 1.00 0.00 H new ATOM 0 H2' DC A 7 -3.004 3.870 16.534 1.00 0.00 H new ATOM 0 H2'' DC A 7 -3.658 2.249 16.654 1.00 0.00 H new ATOM 0 H1' DC A 7 -5.971 3.045 16.165 1.00 0.00 H new ATOM 0 H41 DC A 7 -3.542 4.904 10.327 1.00 0.00 H new ATOM 0 H42 DC A 7 -3.499 3.139 10.384 1.00 0.00 H new ATOM 0 H5 DC A 7 -4.245 6.238 12.314 1.00 0.00 H new ATOM 0 H6 DC A 7 -4.778 6.055 14.707 1.00 0.00 H new ATOM 203 P DT A 8 -4.362 1.231 19.537 1.00 0.00 P ATOM 204 OP1 DT A 8 -5.446 0.384 20.089 1.00 0.00 O ATOM 205 OP2 DT A 8 -3.296 1.736 20.423 1.00 0.00 O ATOM 206 O5' DT A 8 -3.640 0.432 18.339 1.00 0.00 O ATOM 207 C5' DT A 8 -4.220 -0.656 17.633 1.00 0.00 C ATOM 208 C4' DT A 8 -3.446 -1.956 17.909 1.00 0.00 C ATOM 209 O4' DT A 8 -2.078 -1.771 17.572 1.00 0.00 O ATOM 210 C3' DT A 8 -3.511 -2.396 19.377 1.00 0.00 C ATOM 211 O3' DT A 8 -3.795 -3.780 19.520 1.00 0.00 O ATOM 212 C2' DT A 8 -2.123 -2.079 19.915 1.00 0.00 C ATOM 213 C1' DT A 8 -1.243 -2.105 18.667 1.00 0.00 C ATOM 214 N1 DT A 8 -0.106 -1.143 18.759 1.00 0.00 N ATOM 215 C2 DT A 8 1.189 -1.655 18.892 1.00 0.00 C ATOM 216 O2 DT A 8 1.442 -2.846 19.029 1.00 0.00 O ATOM 217 N3 DT A 8 2.220 -0.737 18.903 1.00 0.00 N ATOM 218 C4 DT A 8 2.085 0.636 18.839 1.00 0.00 C ATOM 219 O4 DT A 8 3.098 1.328 18.829 1.00 0.00 O ATOM 220 C5 DT A 8 0.701 1.108 18.792 1.00 0.00 C ATOM 221 C7 DT A 8 0.397 2.597 18.788 1.00 0.00 C ATOM 222 C6 DT A 8 -0.328 0.220 18.756 1.00 0.00 C ATOM 0 H5' DT A 8 -4.217 -0.445 16.564 1.00 0.00 H new ATOM 0 H5'' DT A 8 -5.261 -0.776 17.932 1.00 0.00 H new ATOM 0 H4' DT A 8 -3.915 -2.730 17.301 1.00 0.00 H new ATOM 0 H3' DT A 8 -4.313 -1.886 19.911 1.00 0.00 H new ATOM 0 H2' DT A 8 -2.095 -1.106 20.406 1.00 0.00 H new ATOM 0 H2'' DT A 8 -1.799 -2.816 20.650 1.00 0.00 H new ATOM 0 H1' DT A 8 -0.799 -3.093 18.550 1.00 0.00 H new ATOM 0 H3 DT A 8 3.169 -1.107 18.964 1.00 0.00 H new ATOM 0 H71 DT A 8 -0.529 2.778 18.242 1.00 0.00 H new ATOM 0 H72 DT A 8 0.288 2.949 19.814 1.00 0.00 H new ATOM 0 H73 DT A 8 1.214 3.134 18.305 1.00 0.00 H new ATOM 0 H6 DT A 8 -1.342 0.589 18.724 1.00 0.00 H new ATOM 235 P DG A 9 -5.300 -4.360 19.395 1.00 0.00 P ATOM 236 OP1 DG A 9 -6.232 -3.261 19.749 1.00 0.00 O ATOM 237 OP2 DG A 9 -5.370 -5.639 20.128 1.00 0.00 O ATOM 238 O5' DG A 9 -5.480 -4.667 17.825 1.00 0.00 O ATOM 239 C5' DG A 9 -4.905 -5.815 17.218 1.00 0.00 C ATOM 240 C4' DG A 9 -5.419 -5.929 15.775 1.00 0.00 C ATOM 241 O4' DG A 9 -4.818 -4.930 14.971 1.00 0.00 O ATOM 242 C3' DG A 9 -5.079 -7.273 15.105 1.00 0.00 C ATOM 243 O3' DG A 9 -6.071 -7.714 14.183 1.00 0.00 O ATOM 244 C2' DG A 9 -3.812 -6.975 14.315 1.00 0.00 C ATOM 245 C1' DG A 9 -3.660 -5.449 14.340 1.00 0.00 C ATOM 246 N9 DG A 9 -2.401 -4.944 14.954 1.00 0.00 N ATOM 247 C8 DG A 9 -1.349 -5.632 15.521 1.00 0.00 C ATOM 248 N7 DG A 9 -0.298 -4.906 15.769 1.00 0.00 N ATOM 249 C5 DG A 9 -0.675 -3.628 15.360 1.00 0.00 C ATOM 250 C6 DG A 9 0.043 -2.385 15.362 1.00 0.00 C ATOM 251 O6 DG A 9 1.193 -2.142 15.717 1.00 0.00 O ATOM 252 N1 DG A 9 -0.706 -1.322 14.903 1.00 0.00 N ATOM 253 C2 DG A 9 -1.998 -1.427 14.496 1.00 0.00 C ATOM 254 N2 DG A 9 -2.642 -0.300 14.297 1.00 0.00 N ATOM 255 N3 DG A 9 -2.681 -2.566 14.420 1.00 0.00 N ATOM 256 C4 DG A 9 -1.968 -3.639 14.882 1.00 0.00 C ATOM 0 H5' DG A 9 -5.167 -6.710 17.782 1.00 0.00 H new ATOM 0 H5'' DG A 9 -3.818 -5.740 17.225 1.00 0.00 H new ATOM 0 H4' DG A 9 -6.502 -5.826 15.845 1.00 0.00 H new ATOM 0 H3' DG A 9 -4.991 -8.055 15.859 1.00 0.00 H new ATOM 0 H2' DG A 9 -2.946 -7.463 14.764 1.00 0.00 H new ATOM 0 H2'' DG A 9 -3.892 -7.344 13.293 1.00 0.00 H new ATOM 0 HO3' DG A 9 -6.430 -6.944 13.695 1.00 0.00 H new ATOM 0 H1' DG A 9 -3.574 -5.095 13.313 1.00 0.00 H new ATOM 0 H8 DG A 9 -1.394 -6.688 15.741 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.264 -0.403 14.867 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.615 -0.316 13.991 1.00 0.00 H new ATOM 0 H22 DG A 9 -2.169 0.591 14.449 1.00 0.00 H new TER 269 DG A 9 HETATM 270 NA NA A 101 1.439 2.505 4.152 1.00 0.00 NA HETATM 271 NA NA A 102 3.898 10.126 12.239 1.00 0.00 NA HETATM 272 NA NA A 103 -6.717 -1.316 20.643 1.00 0.00 NA HETATM 273 NA NA A 104 6.311 5.732 7.591 1.00 0.00 NA HETATM 274 NA NA A 105 -2.474 1.366 12.386 1.00 0.00 NA HETATM 275 NA NA A 106 -6.650 7.100 16.521 1.00 0.00 NA HETATM 276 NA NA A 107 -6.460 -6.413 4.664 1.00 0.00 NA HETATM 277 NA NA A 108 -0.238 9.449 17.550 1.00 0.00 NA