USER MOD reduce.3.24.130724 H: found=0, std=0, add=195, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 217 hydrogens (22 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 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 29:sc= 0.00157 USER MOD Single : A 2 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 9 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 13 DT C7 :methyl -30:sc= 0 (180deg=-0.000994) USER MOD Single : A 17 DT C7 :methyl 150:sc= -3.4! (180deg=-3.4!) USER MOD Single : A 17 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -4.747 8.365 6.466 1.00 0.00 O ATOM 2 C5' DT A 1 -4.774 7.171 7.251 1.00 0.00 C ATOM 3 C4' DT A 1 -3.802 6.126 6.705 1.00 0.00 C ATOM 4 O4' DT A 1 -4.160 5.794 5.363 1.00 0.00 O ATOM 5 C3' DT A 1 -2.340 6.590 6.680 1.00 0.00 C ATOM 6 O3' DT A 1 -1.546 5.706 7.478 1.00 0.00 O ATOM 7 C2' DT A 1 -1.915 6.482 5.215 1.00 0.00 C ATOM 8 C1' DT A 1 -2.962 5.544 4.641 1.00 0.00 C ATOM 9 N1 DT A 1 -3.242 5.761 3.210 1.00 0.00 N ATOM 10 C2 DT A 1 -2.930 4.736 2.337 1.00 0.00 C ATOM 11 O2 DT A 1 -2.443 3.675 2.721 1.00 0.00 O ATOM 12 N3 DT A 1 -3.199 4.974 1.003 1.00 0.00 N ATOM 13 C4 DT A 1 -3.745 6.131 0.474 1.00 0.00 C ATOM 14 O4 DT A 1 -3.942 6.236 -0.734 1.00 0.00 O ATOM 15 C5 DT A 1 -4.039 7.145 1.462 1.00 0.00 C ATOM 16 C7 DT A 1 -4.645 8.472 1.017 1.00 0.00 C ATOM 17 C6 DT A 1 -3.785 6.937 2.769 1.00 0.00 C ATOM 0 H5' DT A 1 -5.784 6.762 7.260 1.00 0.00 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DT A 2 1.475 3.028 10.998 1.00 0.00 C ATOM 39 O3' DT A 2 1.889 1.835 11.691 1.00 0.00 O ATOM 40 C2' DT A 2 2.696 3.848 10.595 1.00 0.00 C ATOM 41 C1' DT A 2 2.951 3.365 9.179 1.00 0.00 C ATOM 42 N1 DT A 2 3.594 4.365 8.305 1.00 0.00 N ATOM 43 C2 DT A 2 4.926 4.176 7.994 1.00 0.00 C ATOM 44 O2 DT A 2 5.569 3.220 8.424 1.00 0.00 O ATOM 45 N3 DT A 2 5.497 5.126 7.168 1.00 0.00 N ATOM 46 C4 DT A 2 4.858 6.232 6.634 1.00 0.00 C ATOM 47 O4 DT A 2 5.464 7.017 5.908 1.00 0.00 O ATOM 48 C5 DT A 2 3.468 6.346 7.013 1.00 0.00 C ATOM 49 C7 DT A 2 2.642 7.518 6.493 1.00 0.00 C ATOM 50 C6 DT A 2 2.889 5.433 7.819 1.00 0.00 C ATOM 0 H5' DT A 2 -0.975 3.090 8.509 1.00 0.00 H new ATOM 0 H5'' DT A 2 -1.256 3.047 10.239 1.00 0.00 H new ATOM 0 H4' DT A 2 0.570 1.607 9.678 1.00 0.00 H new ATOM 0 H3' DT A 2 0.810 3.569 11.671 1.00 0.00 H new ATOM 0 H2' DT A 2 2.497 4.919 10.631 1.00 0.00 H new ATOM 0 H2'' DT A 2 3.547 3.660 11.249 1.00 0.00 H new ATOM 0 H1' DT A 2 3.634 2.517 9.238 1.00 0.00 H new ATOM 0 H3 DT A 2 6.481 5.000 6.930 1.00 0.00 H new ATOM 0 H71 DT A 2 1.599 7.214 6.398 1.00 0.00 H new ATOM 0 H72 DT A 2 2.715 8.352 7.191 1.00 0.00 H new ATOM 0 H73 DT A 2 3.021 7.826 5.518 1.00 0.00 H new ATOM 0 H6 DT A 2 1.849 5.547 8.086 1.00 0.00 H new ATOM 63 P DG A 3 2.439 0.529 10.914 1.00 0.00 P ATOM 64 OP1 DG A 3 2.948 -0.429 11.923 1.00 0.00 O ATOM 65 OP2 DG A 3 3.320 0.970 9.812 1.00 0.00 O ATOM 66 O5' DG A 3 1.097 -0.088 10.273 1.00 0.00 O ATOM 67 C5' DG A 3 -0.009 -0.444 11.108 1.00 0.00 C ATOM 68 C4' DG A 3 -1.079 -1.205 10.329 1.00 0.00 C ATOM 69 O4' DG A 3 -1.477 -0.433 9.189 1.00 0.00 O ATOM 70 C3' DG A 3 -0.617 -2.568 9.817 1.00 0.00 C ATOM 71 O3' DG A 3 -1.672 -3.524 9.973 1.00 0.00 O ATOM 72 C2' DG A 3 -0.341 -2.337 8.340 1.00 0.00 C ATOM 73 C1' DG A 3 -1.323 -1.224 8.007 1.00 0.00 C ATOM 74 N9 DG A 3 -0.863 -0.328 6.930 1.00 0.00 N ATOM 75 C8 DG A 3 0.355 0.285 6.793 1.00 0.00 C ATOM 76 N7 DG A 3 0.459 1.023 5.725 1.00 0.00 N ATOM 77 C5 DG A 3 -0.779 0.891 5.105 1.00 0.00 C ATOM 78 C6 DG A 3 -1.256 1.467 3.897 1.00 0.00 C ATOM 79 O6 DG A 3 -0.664 2.218 3.125 1.00 0.00 O ATOM 80 N1 DG A 3 -2.560 1.077 3.629 1.00 0.00 N ATOM 81 C2 DG A 3 -3.315 0.237 4.421 1.00 0.00 C ATOM 82 N2 DG A 3 -4.550 -0.026 3.995 1.00 0.00 N ATOM 83 N3 DG A 3 -2.868 -0.305 5.558 1.00 0.00 N ATOM 84 C4 DG A 3 -1.596 0.065 5.836 1.00 0.00 C ATOM 0 H5' DG A 3 -0.444 0.457 11.540 1.00 0.00 H new ATOM 0 H5'' DG A 3 0.343 -1.057 11.938 1.00 0.00 H new ATOM 0 H4' DG A 3 -1.898 -1.368 11.029 1.00 0.00 H new ATOM 0 H3' DG A 3 0.253 -2.950 10.352 1.00 0.00 H new ATOM 0 H2' DG A 3 0.692 -2.038 8.159 1.00 0.00 H new ATOM 0 H2'' DG A 3 -0.522 -3.233 7.746 1.00 0.00 H new ATOM 0 H1' DG A 3 -2.247 -1.690 7.665 1.00 0.00 H new ATOM 0 H8 DG A 3 1.157 0.167 7.507 1.00 0.00 H new ATOM 0 H1 DG A 3 -2.994 1.440 2.780 1.00 0.00 H new ATOM 0 H21 DG A 3 -5.157 -0.641 4.538 1.00 0.00 H new ATOM 0 H22 DG A 3 -4.889 0.387 3.126 1.00 0.00 H new ATOM 96 P DG A 4 -1.502 -5.025 9.415 1.00 0.00 P ATOM 97 OP1 DG A 4 -2.152 -5.953 10.367 1.00 0.00 O ATOM 98 OP2 DG A 4 -0.082 -5.222 9.047 1.00 0.00 O ATOM 99 O5' DG A 4 -2.373 -4.998 8.063 1.00 0.00 O ATOM 100 C5' DG A 4 -3.800 -4.926 8.119 1.00 0.00 C ATOM 101 C4' DG A 4 -4.419 -5.046 6.729 1.00 0.00 C ATOM 102 O4' DG A 4 -3.940 -3.981 5.904 1.00 0.00 O ATOM 103 C3' DG A 4 -4.086 -6.363 6.020 1.00 0.00 C ATOM 104 O3' DG A 4 -5.294 -6.977 5.554 1.00 0.00 O ATOM 105 C2' DG A 4 -3.219 -5.956 4.833 1.00 0.00 C ATOM 106 C1' DG A 4 -3.627 -4.509 4.619 1.00 0.00 C ATOM 107 N9 DG A 4 -2.567 -3.667 4.035 1.00 0.00 N ATOM 108 C8 DG A 4 -1.333 -3.365 4.548 1.00 0.00 C ATOM 109 N7 DG A 4 -0.618 -2.590 3.782 1.00 0.00 N ATOM 110 C5 DG A 4 -1.435 -2.359 2.681 1.00 0.00 C ATOM 111 C6 DG A 4 -1.195 -1.585 1.514 1.00 0.00 C ATOM 112 O6 DG A 4 -0.190 -0.940 1.221 1.00 0.00 O ATOM 113 N1 DG A 4 -2.280 -1.617 0.650 1.00 0.00 N ATOM 114 C2 DG A 4 -3.453 -2.307 0.877 1.00 0.00 C ATOM 115 N2 DG A 4 -4.385 -2.216 -0.071 1.00 0.00 N ATOM 116 N3 DG A 4 -3.681 -3.034 1.974 1.00 0.00 N ATOM 117 C4 DG A 4 -2.633 -3.015 2.828 1.00 0.00 C ATOM 0 H5' DG A 4 -4.101 -3.981 8.572 1.00 0.00 H new ATOM 0 H5'' DG A 4 -4.181 -5.722 8.759 1.00 0.00 H new ATOM 0 H4' DG A 4 -5.498 -5.005 6.874 1.00 0.00 H new ATOM 0 H3' DG A 4 -3.584 -7.076 6.674 1.00 0.00 H new ATOM 0 H2' DG A 4 -2.156 -6.051 5.054 1.00 0.00 H new ATOM 0 H2'' DG A 4 -3.418 -6.569 3.954 1.00 0.00 H new ATOM 0 H1' DG A 4 -4.460 -4.497 3.917 1.00 0.00 H new ATOM 0 H8 DG A 4 -0.984 -3.736 5.501 1.00 0.00 H new ATOM 0 H1 DG A 4 -2.205 -1.090 -0.220 1.00 0.00 H new ATOM 0 H21 DG A 4 -5.274 -2.704 0.039 1.00 0.00 H new ATOM 0 H22 DG A 4 -4.209 -1.658 -0.907 1.00 0.00 H new ATOM 129 P DT A 5 -6.233 -6.242 4.471 1.00 0.00 P ATOM 130 OP1 DT A 5 -5.393 -5.850 3.318 1.00 0.00 O ATOM 131 OP2 DT A 5 -7.043 -5.222 5.177 1.00 0.00 O ATOM 132 O5' DT A 5 -7.214 -7.429 4.001 1.00 0.00 O ATOM 133 C5' DT A 5 -7.988 -7.305 2.803 1.00 0.00 C ATOM 134 C4' DT A 5 -9.357 -6.687 3.077 1.00 0.00 C ATOM 135 O4' DT A 5 -10.067 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-4.493 5.261 1.00 0.00 H new ATOM 0 H1' DT A 5 -11.775 -6.319 4.478 1.00 0.00 H new ATOM 0 H3 DT A 5 -13.587 -8.401 7.916 1.00 0.00 H new ATOM 0 H71 DT A 5 -8.259 -9.083 8.312 1.00 0.00 H new ATOM 0 H72 DT A 5 -8.860 -8.086 9.658 1.00 0.00 H new ATOM 0 H73 DT A 5 -9.397 -9.774 9.493 1.00 0.00 H new ATOM 0 H6 DT A 5 -9.030 -7.568 6.637 1.00 0.00 H new ATOM 161 P DG A 6 -10.337 -2.867 3.268 1.00 0.00 P ATOM 162 OP1 DG A 6 -9.267 -2.463 4.207 1.00 0.00 O ATOM 163 OP2 DG A 6 -11.756 -2.754 3.671 1.00 0.00 O ATOM 164 O5' DG A 6 -10.137 -2.051 1.894 1.00 0.00 O ATOM 165 C5' DG A 6 -11.263 -1.500 1.204 1.00 0.00 C ATOM 166 C4' DG A 6 -10.839 -0.794 -0.081 1.00 0.00 C ATOM 167 O4' DG A 6 -9.820 0.163 0.221 1.00 0.00 O ATOM 168 C3' DG A 6 -10.281 -1.741 -1.148 1.00 0.00 C ATOM 169 O3' DG A 6 -10.895 -1.460 -2.412 1.00 0.00 O ATOM 170 C2' DG A 6 -8.795 -1.415 -1.213 1.00 0.00 C ATOM 171 C1' DG A 6 -8.764 0.025 -0.726 1.00 0.00 C ATOM 172 N9 DG A 6 -7.507 0.398 -0.054 1.00 0.00 N ATOM 173 C8 DG A 6 -7.064 0.045 1.193 1.00 0.00 C ATOM 174 N7 DG A 6 -5.887 0.519 1.492 1.00 0.00 N ATOM 175 C5 DG A 6 -5.522 1.243 0.360 1.00 0.00 C ATOM 176 C6 DG A 6 -4.338 1.983 0.096 1.00 0.00 C ATOM 177 O6 DG A 6 -3.362 2.147 0.825 1.00 0.00 O ATOM 178 N1 DG A 6 -4.370 2.560 -1.167 1.00 0.00 N ATOM 179 C2 DG A 6 -5.409 2.441 -2.065 1.00 0.00 C ATOM 180 N2 DG A 6 -5.258 3.071 -3.230 1.00 0.00 N ATOM 181 N3 DG A 6 -6.522 1.745 -1.819 1.00 0.00 N ATOM 182 C4 DG A 6 -6.508 1.175 -0.592 1.00 0.00 C ATOM 0 H5' DG A 6 -11.781 -0.795 1.854 1.00 0.00 H new ATOM 0 H5'' DG A 6 -11.971 -2.294 0.968 1.00 0.00 H new ATOM 0 H4' DG A 6 -11.740 -0.330 -0.483 1.00 0.00 H new ATOM 0 H3' DG A 6 -10.468 -2.789 -0.915 1.00 0.00 H new ATOM 0 H2' DG A 6 -8.205 -2.074 -0.576 1.00 0.00 H new ATOM 0 H2'' DG A 6 -8.400 -1.512 -2.224 1.00 0.00 H new ATOM 0 H1' DG A 6 -8.864 0.674 -1.596 1.00 0.00 H new ATOM 0 H8 DG A 6 -7.639 -0.571 1.869 1.00 0.00 H new ATOM 0 H1 DG A 6 -3.563 3.114 -1.452 1.00 0.00 H new ATOM 0 H21 DG A 6 -5.992 3.021 -3.936 1.00 0.00 H new ATOM 0 H22 DG A 6 -4.408 3.603 -3.415 1.00 0.00 H new ATOM 194 P DG A 7 -10.710 -2.477 -3.649 1.00 0.00 P ATOM 195 OP1 DG A 7 -11.938 -2.437 -4.474 1.00 0.00 O ATOM 196 OP2 DG A 7 -10.226 -3.769 -3.114 1.00 0.00 O ATOM 197 O5' DG A 7 -9.514 -1.804 -4.493 1.00 0.00 O ATOM 198 C5' DG A 7 -9.792 -0.806 -5.481 1.00 0.00 C ATOM 199 C4' DG A 7 -8.517 -0.339 -6.178 1.00 0.00 C ATOM 200 O4' DG A 7 -7.560 0.070 -5.201 1.00 0.00 O ATOM 201 C3' DG A 7 -7.850 -1.419 -7.039 1.00 0.00 C ATOM 202 O3' DG A 7 -7.775 -0.967 -8.396 1.00 0.00 O ATOM 203 C2' DG A 7 -6.441 -1.569 -6.467 1.00 0.00 C ATOM 204 C1' DG A 7 -6.269 -0.280 -5.680 1.00 0.00 C ATOM 205 N9 DG A 7 -5.370 -0.403 -4.517 1.00 0.00 N ATOM 206 C8 DG A 7 -5.581 -1.069 -3.338 1.00 0.00 C ATOM 207 N7 DG A 7 -4.581 -1.000 -2.506 1.00 0.00 N ATOM 208 C5 DG A 7 -3.636 -0.232 -3.179 1.00 0.00 C ATOM 209 C6 DG A 7 -2.339 0.180 -2.768 1.00 0.00 C ATOM 210 O6 DG A 7 -1.761 -0.060 -1.711 1.00 0.00 O ATOM 211 N1 DG A 7 -1.716 0.944 -3.745 1.00 0.00 N ATOM 212 C2 DG A 7 -2.268 1.274 -4.966 1.00 0.00 C ATOM 213 N2 DG A 7 -1.515 2.018 -5.775 1.00 0.00 N ATOM 214 N3 DG A 7 -3.489 0.887 -5.353 1.00 0.00 N ATOM 215 C4 DG A 7 -4.111 0.140 -4.411 1.00 0.00 C ATOM 0 H5' DG A 7 -10.284 0.046 -5.011 1.00 0.00 H new ATOM 0 H5'' DG A 7 -10.486 -1.207 -6.220 1.00 0.00 H new ATOM 0 H4' DG A 7 -8.822 0.478 -6.832 1.00 0.00 H new ATOM 0 H3' DG A 7 -8.401 -2.360 -7.027 1.00 0.00 H new ATOM 0 H2' DG A 7 -6.353 -2.449 -5.830 1.00 0.00 H new ATOM 0 H2'' DG A 7 -5.692 -1.668 -7.253 1.00 0.00 H new ATOM 0 H1' DG A 7 -5.821 0.463 -6.340 1.00 0.00 H new ATOM 0 H8 DG A 7 -6.494 -1.603 -3.118 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.777 1.288 -3.545 1.00 0.00 H new ATOM 0 H21 DG A 7 -1.869 2.294 -6.691 1.00 0.00 H new ATOM 0 H22 DG A 7 -0.584 2.312 -5.478 1.00 0.00 H new ATOM 227 P DG A 8 -7.147 -1.915 -9.537 1.00 0.00 P ATOM 228 OP1 DG A 8 -7.790 -1.581 -10.827 1.00 0.00 O ATOM 229 OP2 DG A 8 -7.170 -3.310 -9.042 1.00 0.00 O ATOM 230 O5' DG A 8 -5.613 -1.429 -9.598 1.00 0.00 O ATOM 231 C5' DG A 8 -5.269 -0.187 -10.220 1.00 0.00 C ATOM 232 C4' DG A 8 -3.764 0.063 -10.175 1.00 0.00 C ATOM 233 O4' DG A 8 -3.306 -0.022 -8.825 1.00 0.00 O ATOM 234 C3' DG A 8 -2.945 -0.944 -10.992 1.00 0.00 C ATOM 235 O3' DG A 8 -2.240 -0.263 -12.039 1.00 0.00 O ATOM 236 C2' DG A 8 -1.947 -1.546 -10.002 1.00 0.00 C ATOM 237 C1' DG A 8 -1.991 -0.562 -8.844 1.00 0.00 C ATOM 238 N9 DG A 8 -1.731 -1.172 -7.527 1.00 0.00 N ATOM 239 C8 DG A 8 -2.539 -1.996 -6.788 1.00 0.00 C ATOM 240 N7 DG A 8 -2.013 -2.381 -5.659 1.00 0.00 N ATOM 241 C5 DG A 8 -0.764 -1.766 -5.647 1.00 0.00 C ATOM 242 C6 DG A 8 0.265 -1.817 -4.667 1.00 0.00 C ATOM 243 O6 DG A 8 0.273 -2.426 -3.600 1.00 0.00 O ATOM 244 N1 DG A 8 1.363 -1.055 -5.044 1.00 0.00 N ATOM 245 C2 DG A 8 1.462 -0.334 -6.215 1.00 0.00 C ATOM 246 N2 DG A 8 2.598 0.338 -6.401 1.00 0.00 N ATOM 247 N3 DG A 8 0.496 -0.286 -7.137 1.00 0.00 N ATOM 248 C4 DG A 8 -0.583 -1.024 -6.787 1.00 0.00 C ATOM 0 H5' DG A 8 -5.790 0.629 -9.718 1.00 0.00 H new ATOM 0 H5'' DG A 8 -5.607 -0.192 -11.256 1.00 0.00 H new ATOM 0 H4' DG A 8 -3.616 1.053 -10.606 1.00 0.00 H new ATOM 0 H3' DG A 8 -3.574 -1.704 -11.456 1.00 0.00 H new ATOM 0 H2' DG A 8 -2.239 -2.549 -9.692 1.00 0.00 H new ATOM 0 H2'' DG A 8 -0.948 -1.623 -10.430 1.00 0.00 H new ATOM 0 H1' DG A 8 -1.208 0.179 -9.002 1.00 0.00 H new ATOM 0 H8 DG A 8 -3.524 -2.299 -7.112 1.00 0.00 H new ATOM 0 H1 DG A 8 2.158 -1.026 -4.405 1.00 0.00 H new ATOM 0 H21 DG A 8 2.731 0.890 -7.248 1.00 0.00 H new ATOM 0 H22 DG A 8 3.334 0.300 -5.696 1.00 0.00 H new ATOM 260 P DT A 9 -1.351 1.048 -11.738 1.00 0.00 P ATOM 261 OP1 DT A 9 -0.555 1.352 -12.948 1.00 0.00 O ATOM 262 OP2 DT A 9 -0.671 0.863 -10.438 1.00 0.00 O ATOM 263 O5' DT A 9 -2.464 2.199 -11.569 1.00 0.00 O ATOM 264 C5' DT A 9 -3.351 2.505 -12.647 1.00 0.00 C ATOM 265 C4' DT A 9 -4.016 3.865 -12.467 1.00 0.00 C ATOM 266 O4' DT A 9 -4.986 4.062 -13.500 1.00 0.00 O ATOM 267 C3' DT A 9 -4.749 4.021 -11.146 1.00 0.00 C ATOM 268 O3' DT A 9 -4.761 5.402 -10.766 1.00 0.00 O ATOM 269 C2' DT A 9 -6.157 3.562 -11.483 1.00 0.00 C ATOM 270 C1' DT A 9 -6.299 4.054 -12.919 1.00 0.00 C ATOM 271 N1 DT A 9 -7.153 3.202 -13.772 1.00 0.00 N ATOM 272 C2 DT A 9 -6.933 3.251 -15.135 1.00 0.00 C ATOM 273 O2 DT A 9 -6.066 3.967 -15.632 1.00 0.00 O ATOM 274 N3 DT A 9 -7.744 2.444 -15.912 1.00 0.00 N ATOM 275 C4 DT A 9 -8.743 1.606 -15.447 1.00 0.00 C ATOM 276 O4 DT A 9 -9.407 0.929 -16.229 1.00 0.00 O ATOM 277 C5 DT A 9 -8.901 1.621 -14.010 1.00 0.00 C ATOM 278 C7 DT A 9 -9.967 0.742 -13.365 1.00 0.00 C ATOM 279 C6 DT A 9 -8.123 2.399 -13.232 1.00 0.00 C ATOM 0 H5' DT A 9 -4.117 1.733 -12.717 1.00 0.00 H new ATOM 0 H5'' DT A 9 -2.799 2.492 -13.587 1.00 0.00 H new ATOM 0 H4' DT A 9 -3.206 4.594 -12.500 1.00 0.00 H new ATOM 0 H3' DT A 9 -4.299 3.465 -10.324 1.00 0.00 H new ATOM 0 H2' DT A 9 -6.265 2.480 -11.407 1.00 0.00 H new ATOM 0 H2'' DT A 9 -6.902 4.004 -10.822 1.00 0.00 H new ATOM 0 H1' DT A 9 -6.771 5.036 -12.875 1.00 0.00 H new ATOM 0 H3 DT A 9 -7.592 2.469 -16.920 1.00 0.00 H new ATOM 0 H71 DT A 9 -9.642 0.449 -12.367 1.00 0.00 H new ATOM 0 H72 DT A 9 -10.902 1.297 -13.294 1.00 0.00 H new ATOM 0 H73 DT A 9 -10.120 -0.150 -13.973 1.00 0.00 H new ATOM 0 H6 DT A 9 -8.267 2.389 -12.162 1.00 0.00 H new ATOM 292 P DG A 10 -5.155 5.849 -9.269 1.00 0.00 P ATOM 293 OP1 DG A 10 -5.775 4.695 -8.580 1.00 0.00 O ATOM 294 OP2 DG A 10 -5.883 7.134 -9.350 1.00 0.00 O ATOM 295 O5' DG A 10 -3.721 6.125 -8.592 1.00 0.00 O ATOM 296 C5' DG A 10 -3.058 7.379 -8.779 1.00 0.00 C ATOM 297 C4' DG A 10 -1.718 7.416 -8.050 1.00 0.00 C ATOM 298 O4' DG A 10 -1.927 7.190 -6.655 1.00 0.00 O ATOM 299 C3' DG A 10 -0.721 6.359 -8.539 1.00 0.00 C ATOM 300 O3' DG A 10 0.482 7.002 -8.973 1.00 0.00 O ATOM 301 C2' DG A 10 -0.432 5.493 -7.314 1.00 0.00 C ATOM 302 C1' DG A 10 -0.847 6.402 -6.169 1.00 0.00 C ATOM 303 N9 DG A 10 -1.319 5.683 -4.969 1.00 0.00 N ATOM 304 C8 DG A 10 -2.528 5.075 -4.756 1.00 0.00 C ATOM 305 N7 DG A 10 -2.638 4.512 -3.586 1.00 0.00 N ATOM 306 C5 DG A 10 -1.412 4.762 -2.977 1.00 0.00 C ATOM 307 C6 DG A 10 -0.944 4.391 -1.688 1.00 0.00 C ATOM 308 O6 DG A 10 -1.534 3.753 -0.817 1.00 0.00 O ATOM 309 N1 DG A 10 0.350 4.843 -1.466 1.00 0.00 N ATOM 310 C2 DG A 10 1.103 5.563 -2.370 1.00 0.00 C ATOM 311 N2 DG A 10 2.328 5.909 -1.976 1.00 0.00 N ATOM 312 N3 DG A 10 0.664 5.913 -3.584 1.00 0.00 N ATOM 313 C4 DG A 10 -0.598 5.480 -3.817 1.00 0.00 C ATOM 0 H5' DG A 10 -3.694 8.186 -8.415 1.00 0.00 H new ATOM 0 H5'' DG A 10 -2.900 7.553 -9.843 1.00 0.00 H new ATOM 0 H4' DG A 10 -1.296 8.400 -8.253 1.00 0.00 H new ATOM 0 H3' DG A 10 -1.108 5.775 -9.374 1.00 0.00 H new ATOM 0 H2' DG A 10 -1.006 4.567 -7.326 1.00 0.00 H new ATOM 0 H2'' DG A 10 0.620 5.215 -7.252 1.00 0.00 H new ATOM 0 H1' DG A 10 0.026 6.978 -5.863 1.00 0.00 H new ATOM 0 H8 DG A 10 -3.319 5.063 -5.492 1.00 0.00 H new ATOM 0 H1 DG A 10 0.776 4.626 -0.565 1.00 0.00 H new ATOM 0 H21 DG A 10 2.933 6.442 -2.600 1.00 0.00 H new ATOM 0 H22 DG A 10 2.661 5.640 -1.050 1.00 0.00 H new ATOM 325 P DG A 11 1.654 6.144 -9.669 1.00 0.00 P ATOM 326 OP1 DG A 11 2.388 7.027 -10.603 1.00 0.00 O ATOM 327 OP2 DG A 11 1.067 4.879 -10.162 1.00 0.00 O ATOM 328 O5' DG A 11 2.625 5.799 -8.433 1.00 0.00 O ATOM 329 C5' DG A 11 3.523 6.786 -7.916 1.00 0.00 C ATOM 330 C4' DG A 11 4.466 6.189 -6.874 1.00 0.00 C ATOM 331 O4' DG A 11 3.703 5.656 -5.790 1.00 0.00 O ATOM 332 C3' DG A 11 5.345 5.059 -7.417 1.00 0.00 C ATOM 333 O3' DG A 11 6.716 5.324 -7.097 1.00 0.00 O ATOM 334 C2' DG A 11 4.873 3.811 -6.676 1.00 0.00 C ATOM 335 C1' DG A 11 4.268 4.403 -5.415 1.00 0.00 C ATOM 336 N9 DG A 11 3.193 3.588 -4.819 1.00 0.00 N ATOM 337 C8 DG A 11 1.961 3.286 -5.337 1.00 0.00 C ATOM 338 N7 DG A 11 1.226 2.545 -4.556 1.00 0.00 N ATOM 339 C5 DG A 11 2.028 2.339 -3.438 1.00 0.00 C ATOM 340 C6 DG A 11 1.762 1.604 -2.251 1.00 0.00 C ATOM 341 O6 DG A 11 0.744 0.983 -1.951 1.00 0.00 O ATOM 342 N1 DG A 11 2.837 1.647 -1.374 1.00 0.00 N ATOM 343 C2 DG A 11 4.022 2.313 -1.607 1.00 0.00 C ATOM 344 N2 DG A 11 4.942 2.238 -0.645 1.00 0.00 N ATOM 345 N3 DG A 11 4.274 3.005 -2.723 1.00 0.00 N ATOM 346 C4 DG A 11 3.235 2.973 -3.591 1.00 0.00 C ATOM 0 H5' DG A 11 2.953 7.600 -7.469 1.00 0.00 H new ATOM 0 H5'' DG A 11 4.104 7.214 -8.732 1.00 0.00 H new ATOM 0 H4' DG A 11 5.119 7.003 -6.559 1.00 0.00 H new ATOM 0 H3' DG A 11 5.270 4.952 -8.499 1.00 0.00 H new ATOM 0 H2' DG A 11 4.141 3.246 -7.253 1.00 0.00 H new ATOM 0 H2'' DG A 11 5.697 3.132 -6.454 1.00 0.00 H new ATOM 0 H1' DG A 11 5.057 4.471 -4.667 1.00 0.00 H new ATOM 0 H8 DG A 11 1.629 3.631 -6.305 1.00 0.00 H new ATOM 0 H1 DG A 11 2.743 1.148 -0.489 1.00 0.00 H new ATOM 0 H21 DG A 11 5.839 2.710 -0.759 1.00 0.00 H new ATOM 0 H22 DG A 11 4.749 1.709 0.205 1.00 0.00 H new ATOM 358 P DG A 12 7.880 4.351 -7.638 1.00 0.00 P ATOM 359 OP1 DG A 12 9.093 5.164 -7.878 1.00 0.00 O ATOM 360 OP2 DG A 12 7.319 3.526 -8.731 1.00 0.00 O ATOM 361 O5' DG A 12 8.157 3.393 -6.376 1.00 0.00 O ATOM 362 C5' DG A 12 8.934 3.855 -5.268 1.00 0.00 C ATOM 363 C4' DG A 12 9.106 2.766 -4.213 1.00 0.00 C ATOM 364 O4' DG A 12 7.825 2.358 -3.739 1.00 0.00 O ATOM 365 C3' DG A 12 9.815 1.512 -4.734 1.00 0.00 C ATOM 366 O3' DG A 12 11.062 1.340 -4.046 1.00 0.00 O ATOM 367 C2' DG A 12 8.875 0.350 -4.402 1.00 0.00 C ATOM 368 C1' DG A 12 7.899 0.975 -3.416 1.00 0.00 C ATOM 369 N9 DG A 12 6.535 0.420 -3.486 1.00 0.00 N ATOM 370 C8 DG A 12 5.589 0.587 -4.464 1.00 0.00 C ATOM 371 N7 DG A 12 4.474 -0.048 -4.235 1.00 0.00 N ATOM 372 C5 DG A 12 4.695 -0.684 -3.017 1.00 0.00 C ATOM 373 C6 DG A 12 3.834 -1.524 -2.260 1.00 0.00 C ATOM 374 O6 DG A 12 2.688 -1.878 -2.525 1.00 0.00 O ATOM 375 N1 DG A 12 4.445 -1.956 -1.091 1.00 0.00 N ATOM 376 C2 DG A 12 5.724 -1.622 -0.695 1.00 0.00 C ATOM 377 N2 DG A 12 6.137 -2.135 0.463 1.00 0.00 N ATOM 378 N3 DG A 12 6.533 -0.832 -1.406 1.00 0.00 N ATOM 379 C4 DG A 12 5.954 -0.401 -2.551 1.00 0.00 C ATOM 0 H5' DG A 12 8.451 4.724 -4.820 1.00 0.00 H new ATOM 0 H5'' DG A 12 9.913 4.181 -5.619 1.00 0.00 H new ATOM 0 H4' DG A 12 9.722 3.205 -3.428 1.00 0.00 H new ATOM 0 H3' DG A 12 10.029 1.574 -5.801 1.00 0.00 H new ATOM 0 H2' DG A 12 8.367 -0.026 -5.290 1.00 0.00 H new ATOM 0 H2'' DG A 12 9.411 -0.491 -3.962 1.00 0.00 H new ATOM 0 H1' DG A 12 8.265 0.773 -2.410 1.00 0.00 H new ATOM 0 H8 DG A 12 5.753 1.190 -5.345 1.00 0.00 H new ATOM 0 H1 DG A 12 3.907 -2.568 -0.477 1.00 0.00 H new ATOM 0 H21 DG A 12 7.073 -1.924 0.809 1.00 0.00 H new ATOM 0 H22 DG A 12 5.517 -2.738 1.003 1.00 0.00 H new ATOM 391 P DT A 13 11.139 1.344 -2.437 1.00 0.00 P ATOM 392 OP1 DT A 13 12.453 0.795 -2.036 1.00 0.00 O ATOM 393 OP2 DT A 13 9.898 0.737 -1.907 1.00 0.00 O ATOM 394 O5' DT A 13 11.124 2.915 -2.083 1.00 0.00 O ATOM 395 C5' DT A 13 11.451 3.362 -0.764 1.00 0.00 C ATOM 396 C4' DT A 13 11.972 4.798 -0.772 1.00 0.00 C ATOM 397 O4' DT A 13 13.106 4.892 -1.643 1.00 0.00 O ATOM 398 C3' DT A 13 10.949 5.827 -1.256 1.00 0.00 C ATOM 399 O3' DT A 13 11.086 7.027 -0.489 1.00 0.00 O ATOM 400 C2' DT A 13 11.359 6.088 -2.695 1.00 0.00 C ATOM 401 C1' DT A 13 12.867 5.928 -2.598 1.00 0.00 C ATOM 402 N1 DT A 13 13.520 5.536 -3.861 1.00 0.00 N ATOM 403 C2 DT A 13 14.502 6.372 -4.356 1.00 0.00 C ATOM 404 O2 DT A 13 14.829 7.409 -3.784 1.00 0.00 O ATOM 405 N3 DT A 13 15.100 5.972 -5.538 1.00 0.00 N ATOM 406 C4 DT A 13 14.803 4.826 -6.255 1.00 0.00 C ATOM 407 O4 DT A 13 15.398 4.566 -7.298 1.00 0.00 O ATOM 408 C5 DT A 13 13.763 4.015 -5.660 1.00 0.00 C ATOM 409 C7 DT A 13 13.338 2.721 -6.345 1.00 0.00 C ATOM 410 C6 DT A 13 13.166 4.384 -4.509 1.00 0.00 C ATOM 0 H5' DT A 13 12.204 2.703 -0.332 1.00 0.00 H new ATOM 0 H5'' DT A 13 10.568 3.298 -0.128 1.00 0.00 H new ATOM 0 H4' DT A 13 12.219 5.026 0.265 1.00 0.00 H new ATOM 0 H3' DT A 13 9.917 5.490 -1.161 1.00 0.00 H new ATOM 0 H2' DT A 13 10.912 5.375 -3.387 1.00 0.00 H new ATOM 0 H2'' DT A 13 11.070 7.083 -3.032 1.00 0.00 H new ATOM 0 H1' DT A 13 13.285 6.896 -2.323 1.00 0.00 H new ATOM 0 H3 DT A 13 15.828 6.578 -5.916 1.00 0.00 H new ATOM 0 H71 DT A 13 13.477 2.817 -7.422 1.00 0.00 H new ATOM 0 H72 DT A 13 13.945 1.896 -5.973 1.00 0.00 H new ATOM 0 H73 DT A 13 12.288 2.524 -6.131 1.00 0.00 H new ATOM 0 H6 DT A 13 12.393 3.758 -4.090 1.00 0.00 H new ATOM 423 P DG A 14 9.890 8.103 -0.420 1.00 0.00 P ATOM 424 OP1 DG A 14 9.149 8.061 -1.700 1.00 0.00 O ATOM 425 OP2 DG A 14 10.450 9.382 0.066 1.00 0.00 O ATOM 426 O5' DG A 14 8.941 7.497 0.732 1.00 0.00 O ATOM 427 C5' DG A 14 9.269 7.681 2.111 1.00 0.00 C ATOM 428 C4' DG A 14 8.683 6.571 2.978 1.00 0.00 C ATOM 429 O4' DG A 14 7.263 6.548 2.832 1.00 0.00 O ATOM 430 C3' DG A 14 9.197 5.171 2.621 1.00 0.00 C ATOM 431 O3' DG A 14 9.881 4.610 3.748 1.00 0.00 O ATOM 432 C2' DG A 14 7.942 4.352 2.317 1.00 0.00 C ATOM 433 C1' DG A 14 6.839 5.196 2.936 1.00 0.00 C ATOM 434 N9 DG A 14 5.534 5.074 2.259 1.00 0.00 N ATOM 435 C8 DG A 14 5.151 5.570 1.040 1.00 0.00 C ATOM 436 N7 DG A 14 3.924 5.276 0.711 1.00 0.00 N ATOM 437 C5 DG A 14 3.458 4.532 1.791 1.00 0.00 C ATOM 438 C6 DG A 14 2.185 3.936 2.004 1.00 0.00 C ATOM 439 O6 DG A 14 1.204 3.948 1.264 1.00 0.00 O ATOM 440 N1 DG A 14 2.131 3.275 3.223 1.00 0.00 N ATOM 441 C2 DG A 14 3.169 3.195 4.128 1.00 0.00 C ATOM 442 N2 DG A 14 2.926 2.515 5.248 1.00 0.00 N ATOM 443 N3 DG A 14 4.366 3.754 3.928 1.00 0.00 N ATOM 444 C4 DG A 14 4.437 4.404 2.743 1.00 0.00 C ATOM 0 H5' DG A 14 8.892 8.646 2.450 1.00 0.00 H new ATOM 0 H5'' DG A 14 10.352 7.702 2.229 1.00 0.00 H new ATOM 0 H4' DG A 14 8.994 6.798 3.998 1.00 0.00 H new ATOM 0 H3' DG A 14 9.892 5.186 1.781 1.00 0.00 H new ATOM 0 H2' DG A 14 7.796 4.216 1.245 1.00 0.00 H new ATOM 0 H2'' DG A 14 7.989 3.358 2.761 1.00 0.00 H new ATOM 0 H1' DG A 14 6.687 4.854 3.960 1.00 0.00 H new ATOM 0 H8 DG A 14 5.806 6.152 0.409 1.00 0.00 H new ATOM 0 H1 DG A 14 1.256 2.812 3.469 1.00 0.00 H new ATOM 0 H21 DG A 14 3.655 2.421 5.956 1.00 0.00 H new ATOM 0 H22 DG A 14 2.011 2.089 5.398 1.00 0.00 H new ATOM 456 P DG A 15 10.682 3.220 3.601 1.00 0.00 P ATOM 457 OP1 DG A 15 11.854 3.260 4.503 1.00 0.00 O ATOM 458 OP2 DG A 15 10.872 2.947 2.159 1.00 0.00 O ATOM 459 O5' DG A 15 9.636 2.143 4.181 1.00 0.00 O ATOM 460 C5' DG A 15 9.504 1.943 5.592 1.00 0.00 C ATOM 461 C4' DG A 15 8.567 0.779 5.905 1.00 0.00 C ATOM 462 O4' DG A 15 7.286 1.028 5.325 1.00 0.00 O ATOM 463 C3' DG A 15 9.057 -0.569 5.364 1.00 0.00 C ATOM 464 O3' DG A 15 9.187 -1.500 6.445 1.00 0.00 O ATOM 465 C2' DG A 15 7.957 -1.036 4.412 1.00 0.00 C ATOM 466 C1' DG A 15 6.764 -0.213 4.866 1.00 0.00 C ATOM 467 N9 DG A 15 5.788 0.072 3.797 1.00 0.00 N ATOM 468 C8 DG A 15 5.959 0.816 2.659 1.00 0.00 C ATOM 469 N7 DG A 15 4.904 0.865 1.896 1.00 0.00 N ATOM 470 C5 DG A 15 3.962 0.100 2.577 1.00 0.00 C ATOM 471 C6 DG A 15 2.618 -0.210 2.232 1.00 0.00 C ATOM 472 O6 DG A 15 1.988 0.137 1.235 1.00 0.00 O ATOM 473 N1 DG A 15 2.018 -1.011 3.193 1.00 0.00 N ATOM 474 C2 DG A 15 2.629 -1.459 4.345 1.00 0.00 C ATOM 475 N2 DG A 15 1.887 -2.220 5.149 1.00 0.00 N ATOM 476 N3 DG A 15 3.892 -1.170 4.671 1.00 0.00 N ATOM 477 C4 DG A 15 4.495 -0.389 3.744 1.00 0.00 C ATOM 0 H5' DG A 15 9.124 2.853 6.056 1.00 0.00 H new ATOM 0 H5'' DG A 15 10.485 1.750 6.027 1.00 0.00 H new ATOM 0 H4' DG A 15 8.526 0.714 6.992 1.00 0.00 H new ATOM 0 H3' DG A 15 10.025 -0.491 4.870 1.00 0.00 H new ATOM 0 H2' DG A 15 8.212 -0.842 3.370 1.00 0.00 H new ATOM 0 H2'' DG A 15 7.770 -2.106 4.501 1.00 0.00 H new ATOM 0 H1' DG A 15 6.231 -0.782 5.627 1.00 0.00 H new ATOM 0 H8 DG A 15 6.885 1.317 2.416 1.00 0.00 H new ATOM 0 H1 DG A 15 1.050 -1.290 3.035 1.00 0.00 H new ATOM 0 H21 DG A 15 2.283 -2.582 6.017 1.00 0.00 H new ATOM 0 H22 DG A 15 0.924 -2.440 4.897 1.00 0.00 H new ATOM 489 P DG A 16 9.677 -3.009 6.164 1.00 0.00 P ATOM 490 OP1 DG A 16 10.544 -3.434 7.285 1.00 0.00 O ATOM 491 OP2 DG A 16 10.182 -3.079 4.775 1.00 0.00 O ATOM 492 O5' DG A 16 8.304 -3.847 6.243 1.00 0.00 O ATOM 493 C5' DG A 16 7.667 -4.084 7.501 1.00 0.00 C ATOM 494 C4' DG A 16 6.562 -5.127 7.380 1.00 0.00 C ATOM 495 O4' DG A 16 5.576 -4.676 6.443 1.00 0.00 O ATOM 496 C3' DG A 16 7.054 -6.493 6.895 1.00 0.00 C ATOM 497 O3' DG A 16 6.396 -7.529 7.630 1.00 0.00 O ATOM 498 C2' DG A 16 6.617 -6.542 5.440 1.00 0.00 C ATOM 499 C1' DG A 16 5.347 -5.712 5.489 1.00 0.00 C ATOM 500 N9 DG A 16 4.989 -5.076 4.208 1.00 0.00 N ATOM 501 C8 DG A 16 5.734 -4.222 3.438 1.00 0.00 C ATOM 502 N7 DG A 16 5.131 -3.826 2.352 1.00 0.00 N ATOM 503 C5 DG A 16 3.895 -4.463 2.404 1.00 0.00 C ATOM 504 C6 DG A 16 2.807 -4.414 1.490 1.00 0.00 C ATOM 505 O6 DG A 16 2.723 -3.785 0.438 1.00 0.00 O ATOM 506 N1 DG A 16 1.749 -5.204 1.918 1.00 0.00 N ATOM 507 C2 DG A 16 1.735 -5.948 3.079 1.00 0.00 C ATOM 508 N2 DG A 16 0.624 -6.644 3.321 1.00 0.00 N ATOM 509 N3 DG A 16 2.757 -5.995 3.938 1.00 0.00 N ATOM 510 C4 DG A 16 3.799 -5.230 3.537 1.00 0.00 C ATOM 0 H5' DG A 16 7.249 -3.151 7.880 1.00 0.00 H new ATOM 0 H5'' DG A 16 8.407 -4.419 8.227 1.00 0.00 H new ATOM 0 H4' DG A 16 6.158 -5.247 8.385 1.00 0.00 H new ATOM 0 H3' DG A 16 8.128 -6.630 7.022 1.00 0.00 H new ATOM 0 H2' DG A 16 7.363 -6.114 4.771 1.00 0.00 H new ATOM 0 H2'' DG A 16 6.431 -7.561 5.100 1.00 0.00 H new ATOM 0 H1' DG A 16 4.523 -6.379 5.743 1.00 0.00 H new ATOM 0 H8 DG A 16 6.731 -3.905 3.706 1.00 0.00 H new ATOM 0 H1 DG A 16 0.918 -5.237 1.328 1.00 0.00 H new ATOM 0 H21 DG A 16 0.553 -7.214 4.164 1.00 0.00 H new ATOM 0 H22 DG A 16 -0.155 -6.606 2.663 1.00 0.00 H new ATOM 522 P DT A 17 6.863 -9.062 7.472 1.00 0.00 P ATOM 523 OP1 DT A 17 7.692 -9.170 6.250 1.00 0.00 O ATOM 524 OP2 DT A 17 5.673 -9.928 7.635 1.00 0.00 O ATOM 525 O5' DT A 17 7.819 -9.275 8.749 1.00 0.00 O ATOM 526 C5' DT A 17 8.947 -8.423 8.967 1.00 0.00 C ATOM 527 C4' DT A 17 9.802 -8.915 10.131 1.00 0.00 C ATOM 528 O4' DT A 17 10.860 -7.978 10.377 1.00 0.00 O ATOM 529 C3' DT A 17 9.033 -9.066 11.441 1.00 0.00 C ATOM 530 O3' DT A 17 9.537 -10.159 12.216 1.00 0.00 O ATOM 531 C2' DT A 17 9.290 -7.738 12.130 1.00 0.00 C ATOM 532 C1' DT A 17 10.725 -7.474 11.710 1.00 0.00 C ATOM 533 N1 DT A 17 11.099 -6.046 11.696 1.00 0.00 N ATOM 534 C2 DT A 17 12.189 -5.667 12.457 1.00 0.00 C ATOM 535 O2 DT A 17 12.834 -6.473 13.123 1.00 0.00 O ATOM 536 N3 DT A 17 12.512 -4.323 12.426 1.00 0.00 N ATOM 537 C4 DT A 17 11.850 -3.341 11.710 1.00 0.00 C ATOM 538 O4 DT A 17 12.224 -2.172 11.754 1.00 0.00 O ATOM 539 C5 DT A 17 10.725 -3.831 10.944 1.00 0.00 C ATOM 540 C7 DT A 17 9.906 -2.855 10.106 1.00 0.00 C ATOM 541 C6 DT A 17 10.390 -5.137 10.959 1.00 0.00 C ATOM 0 H5' DT A 17 8.604 -7.408 9.169 1.00 0.00 H new ATOM 0 H5'' DT A 17 9.553 -8.380 8.062 1.00 0.00 H new ATOM 0 H4' DT A 17 10.168 -9.897 9.832 1.00 0.00 H new ATOM 0 H3' DT A 17 7.974 -9.283 11.299 1.00 0.00 H new ATOM 0 H2' DT A 17 8.609 -6.957 11.790 1.00 0.00 H new ATOM 0 H2'' DT A 17 9.182 -7.806 13.212 1.00 0.00 H new ATOM 0 HO3' DT A 17 9.027 -10.231 13.050 1.00 0.00 H new ATOM 0 H1' DT A 17 11.379 -7.957 12.436 1.00 0.00 H new ATOM 0 H3 DT A 17 13.314 -4.027 12.983 1.00 0.00 H new ATOM 0 H71 DT A 17 9.496 -3.374 9.240 1.00 0.00 H new ATOM 0 H72 DT A 17 9.091 -2.453 10.708 1.00 0.00 H new ATOM 0 H73 DT A 17 10.545 -2.039 9.770 1.00 0.00 H new ATOM 0 H6 DT A 17 9.544 -5.473 10.377 1.00 0.00 H new TER 555 DT A 17 HETATM 556 OAC 4BW A 101 0.241 -4.442 -0.738 1.00 0.00 O HETATM 557 CBC 4BW A 101 -0.890 -4.762 -1.060 1.00 0.00 C HETATM 558 NAT 4BW A 101 -1.505 -4.302 -2.219 1.00 0.00 N HETATM 559 CBA 4BW A 101 -2.802 -4.660 -2.584 1.00 0.00 C HETATM 560 NAA 4BW A 101 -3.268 -4.142 -3.767 1.00 0.00 N HETATM 561 NAS 4BW A 101 -3.579 -5.470 -1.853 1.00 0.00 N HETATM 562 CBG 4BW A 101 -3.018 -5.986 -0.678 1.00 0.00 C HETATM 563 CBE 4BW A 101 -1.742 -5.671 -0.270 1.00 0.00 C HETATM 564 NAR 4BW A 101 -1.442 -6.297 0.911 1.00 0.00 N HETATM 565 CAL 4BW A 101 -2.532 -6.985 1.215 1.00 0.00 C HETATM 566 NBQ 4BW A 101 -3.540 -6.833 0.276 1.00 0.00 N HETATM 567 CBO 4BW A 101 -4.898 -7.391 0.398 1.00 0.00 C HETATM 568 CBI 4BW A 101 -5.570 -7.788 -0.923 1.00 0.00 C HETATM 569 OAG 4BW A 101 -6.982 -7.741 -0.740 1.00 0.00 O HETATM 570 OAX 4BW A 101 -4.769 -8.623 1.135 1.00 0.00 O HETATM 571 CBK 4BW A 101 -4.867 -9.779 0.278 1.00 0.00 C HETATM 572 CAN 4BW A 101 -3.567 -10.600 0.367 1.00 0.00 C HETATM 573 OAV 4BW A 101 -2.532 -9.973 -0.403 1.00 0.00 O HETATM 574 PBR 4BW A 101 -1.250 -10.850 -0.843 1.00 0.00 P HETATM 575 O3' 4BW A 101 -2.038 -12.109 -1.476 1.00 0.00 O HETATM 576 OAH 4BW A 101 -0.434 -10.159 -1.876 1.00 0.00 O HETATM 577 OAD 4BW A 101 -0.412 -11.240 0.322 1.00 0.00 O HETATM 578 CBM 4BW A 101 -5.147 -9.233 -1.127 1.00 0.00 C HETATM 579 OAZ 4BW A 101 -6.211 -9.958 -1.753 1.00 0.00 O HETATM 580 PBS 4BW A 101 -6.559 -9.654 -3.299 1.00 0.00 P HETATM 581 OAI 4BW A 101 -6.084 -8.306 -3.708 1.00 0.00 O HETATM 582 OAE 4BW A 101 -8.023 -9.768 -3.532 1.00 0.00 O HETATM 583 O5' 4BW A 101 -5.750 -10.822 -4.072 1.00 0.00 O HETATM 584 C5' 4BW A 101 -4.321 -10.903 -4.001 1.00 0.00 C HETATM 585 C4' 4BW A 101 -3.924 -12.027 -3.025 1.00 0.00 C HETATM 586 O4' 4BW A 101 -4.352 -13.304 -3.532 1.00 0.00 O HETATM 587 C3' 4BW A 101 -2.397 -12.133 -2.868 1.00 0.00 C HETATM 588 C2' 4BW A 101 -1.986 -13.474 -3.488 1.00 0.00 C HETATM 589 O2' 4BW A 101 -1.544 -14.384 -2.484 1.00 0.00 O HETATM 590 C1' 4BW A 101 -3.262 -14.023 -4.135 1.00 0.00 C HETATM 591 N9 4BW A 101 -3.301 -13.811 -5.586 1.00 0.00 N HETATM 592 C8 4BW A 101 -4.280 -13.161 -6.343 1.00 0.00 C HETATM 593 N7 4BW A 101 -4.052 -13.221 -7.660 1.00 0.00 N HETATM 594 C5 4BW A 101 -2.903 -13.925 -7.730 1.00 0.00 C HETATM 595 C4 4BW A 101 -2.405 -14.308 -6.494 1.00 0.00 C HETATM 596 N3 4BW A 101 -1.257 -15.022 -6.353 1.00 0.00 N HETATM 597 C2 4BW A 101 -0.597 -15.356 -7.495 1.00 0.00 C HETATM 598 N1 4BW A 101 -1.010 -15.027 -8.749 1.00 0.00 N HETATM 599 C6 4BW A 101 -2.165 -14.314 -8.870 1.00 0.00 C HETATM 600 N6 4BW A 101 -2.577 -13.997 -10.155 1.00 0.00 N