USER MOD reduce.3.24.130724 H: found=0, std=0, add=248, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 248 hydrogens (25 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 DG O5' : rot 27:sc= 1.34 USER MOD Single : A 20 DT C7 :methyl -30:sc= -4.63! (180deg=-9!) USER MOD Single : A 20 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -7.976 -1.968 -6.195 1.00 0.00 O ATOM 2 C5' DG A 1 -8.612 -3.154 -6.675 1.00 0.00 C ATOM 3 C4' DG A 1 -7.651 -4.339 -6.661 1.00 0.00 C ATOM 4 O4' DG A 1 -6.522 -4.090 -7.497 1.00 0.00 O ATOM 5 C3' DG A 1 -7.109 -4.677 -5.282 1.00 0.00 C ATOM 6 O3' DG A 1 -7.982 -5.635 -4.646 1.00 0.00 O ATOM 7 C2' DG A 1 -5.724 -5.252 -5.548 1.00 0.00 C ATOM 8 C1' DG A 1 -5.409 -4.834 -6.982 1.00 0.00 C ATOM 9 N9 DG A 1 -4.202 -3.995 -7.109 1.00 0.00 N ATOM 10 C8 DG A 1 -2.926 -4.369 -7.425 1.00 0.00 C ATOM 11 N7 DG A 1 -2.031 -3.429 -7.321 1.00 0.00 N ATOM 12 C5 DG A 1 -2.778 -2.327 -6.902 1.00 0.00 C ATOM 13 C6 DG A 1 -2.363 -0.997 -6.617 1.00 0.00 C ATOM 14 O6 DG A 1 -1.230 -0.525 -6.671 1.00 0.00 O ATOM 15 N1 DG A 1 -3.434 -0.200 -6.230 1.00 0.00 N ATOM 16 C2 DG A 1 -4.742 -0.627 -6.129 1.00 0.00 C ATOM 17 N2 DG A 1 -5.637 0.281 -5.748 1.00 0.00 N ATOM 18 N3 DG A 1 -5.134 -1.876 -6.393 1.00 0.00 N ATOM 19 C4 DG A 1 -4.106 -2.668 -6.771 1.00 0.00 C ATOM 0 H5' DG A 1 -8.976 -2.990 -7.689 1.00 0.00 H new ATOM 0 H5'' DG A 1 -9.481 -3.380 -6.057 1.00 0.00 H new ATOM 0 H4' DG A 1 -8.247 -5.178 -7.020 1.00 0.00 H new ATOM 0 H3' DG A 1 -7.055 -3.820 -4.611 1.00 0.00 H new ATOM 0 H2' DG A 1 -4.988 -4.856 -4.848 1.00 0.00 H new ATOM 0 H2'' DG A 1 -5.716 -6.337 -5.439 1.00 0.00 H new ATOM 0 HO5' DG A 1 -7.013 -2.021 -6.366 1.00 0.00 H new ATOM 0 H1' DG A 1 -5.224 -5.752 -7.540 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.678 -5.372 -7.738 1.00 0.00 H new ATOM 0 H1 DG A 1 -3.238 0.775 -6.003 1.00 0.00 H new ATOM 0 H21 DG A 1 -6.619 0.022 -5.656 1.00 0.00 H new ATOM 0 H22 DG A 1 -5.341 1.236 -5.548 1.00 0.00 H new ATOM 32 P DG A 2 -8.013 -5.785 -3.038 1.00 0.00 P ATOM 33 OP1 DG A 2 -9.132 -6.682 -2.676 1.00 0.00 O ATOM 34 OP2 DG A 2 -7.912 -4.437 -2.436 1.00 0.00 O ATOM 35 O5' DG A 2 -6.634 -6.564 -2.781 1.00 0.00 O ATOM 36 C5' DG A 2 -6.462 -7.879 -3.312 1.00 0.00 C ATOM 37 C4' DG A 2 -5.012 -8.330 -3.221 1.00 0.00 C ATOM 38 O4' DG A 2 -4.196 -7.437 -3.969 1.00 0.00 O ATOM 39 C3' DG A 2 -4.404 -8.417 -1.831 1.00 0.00 C ATOM 40 O3' DG A 2 -4.664 -9.736 -1.305 1.00 0.00 O ATOM 41 C2' DG A 2 -2.928 -8.157 -2.084 1.00 0.00 C ATOM 42 C1' DG A 2 -2.943 -7.239 -3.302 1.00 0.00 C ATOM 43 N9 DG A 2 -2.872 -5.813 -2.958 1.00 0.00 N ATOM 44 C8 DG A 2 -3.885 -4.985 -2.588 1.00 0.00 C ATOM 45 N7 DG A 2 -3.535 -3.775 -2.304 1.00 0.00 N ATOM 46 C5 DG A 2 -2.165 -3.786 -2.493 1.00 0.00 C ATOM 47 C6 DG A 2 -1.232 -2.738 -2.337 1.00 0.00 C ATOM 48 O6 DG A 2 -1.448 -1.574 -1.990 1.00 0.00 O ATOM 49 N1 DG A 2 0.055 -3.160 -2.632 1.00 0.00 N ATOM 50 C2 DG A 2 0.406 -4.434 -3.028 1.00 0.00 C ATOM 51 N2 DG A 2 1.704 -4.641 -3.268 1.00 0.00 N ATOM 52 N3 DG A 2 -0.476 -5.431 -3.175 1.00 0.00 N ATOM 53 C4 DG A 2 -1.740 -5.034 -2.891 1.00 0.00 C ATOM 0 H5' DG A 2 -6.786 -7.898 -4.353 1.00 0.00 H new ATOM 0 H5'' DG A 2 -7.097 -8.578 -2.768 1.00 0.00 H new ATOM 0 H4' DG A 2 -5.036 -9.349 -3.608 1.00 0.00 H new ATOM 0 H3' DG A 2 -4.804 -7.716 -1.098 1.00 0.00 H new ATOM 0 H2' DG A 2 -2.450 -7.682 -1.227 1.00 0.00 H new ATOM 0 H2'' DG A 2 -2.384 -9.081 -2.282 1.00 0.00 H new ATOM 0 H1' DG A 2 -2.071 -7.486 -3.908 1.00 0.00 H new ATOM 0 H8 DG A 2 -4.912 -5.316 -2.535 1.00 0.00 H new ATOM 0 H1 DG A 2 0.804 -2.472 -2.550 1.00 0.00 H new ATOM 0 H21 DG A 2 2.027 -5.562 -3.564 1.00 0.00 H new ATOM 0 H22 DG A 2 2.371 -3.878 -3.155 1.00 0.00 H new ATOM 65 P DG A 3 -4.500 -10.131 0.258 1.00 0.00 P ATOM 66 OP1 DG A 3 -5.122 -11.458 0.472 1.00 0.00 O ATOM 67 OP2 DG A 3 -4.911 -8.971 1.078 1.00 0.00 O ATOM 68 O5' DG A 3 -2.899 -10.288 0.357 1.00 0.00 O ATOM 69 C5' DG A 3 -2.283 -11.237 -0.515 1.00 0.00 C ATOM 70 C4' DG A 3 -0.754 -11.171 -0.526 1.00 0.00 C ATOM 71 O4' DG A 3 -0.378 -9.811 -0.796 1.00 0.00 O ATOM 72 C3' DG A 3 0.015 -11.562 0.738 1.00 0.00 C ATOM 73 O3' DG A 3 1.201 -12.181 0.248 1.00 0.00 O ATOM 74 C2' DG A 3 0.375 -10.261 1.424 1.00 0.00 C ATOM 75 C1' DG A 3 0.435 -9.279 0.273 1.00 0.00 C ATOM 76 N9 DG A 3 -0.075 -7.945 0.621 1.00 0.00 N ATOM 77 C8 DG A 3 -1.344 -7.567 0.957 1.00 0.00 C ATOM 78 N7 DG A 3 -1.479 -6.322 1.297 1.00 0.00 N ATOM 79 C5 DG A 3 -0.185 -5.821 1.181 1.00 0.00 C ATOM 80 C6 DG A 3 0.305 -4.512 1.420 1.00 0.00 C ATOM 81 O6 DG A 3 -0.317 -3.522 1.789 1.00 0.00 O ATOM 82 N1 DG A 3 1.666 -4.426 1.186 1.00 0.00 N ATOM 83 C2 DG A 3 2.474 -5.458 0.775 1.00 0.00 C ATOM 84 N2 DG A 3 3.773 -5.161 0.618 1.00 0.00 N ATOM 85 N3 DG A 3 2.022 -6.700 0.542 1.00 0.00 N ATOM 86 C4 DG A 3 0.683 -6.807 0.768 1.00 0.00 C ATOM 0 H5' DG A 3 -2.651 -11.076 -1.528 1.00 0.00 H new ATOM 0 H5'' DG A 3 -2.591 -12.240 -0.220 1.00 0.00 H new ATOM 0 H4' DG A 3 -0.483 -11.919 -1.271 1.00 0.00 H new ATOM 0 H3' DG A 3 -0.528 -12.213 1.424 1.00 0.00 H new ATOM 0 H2' DG A 3 -0.373 -9.973 2.163 1.00 0.00 H new ATOM 0 H2'' DG A 3 1.329 -10.330 1.947 1.00 0.00 H new ATOM 0 H1' DG A 3 1.481 -9.159 -0.010 1.00 0.00 H new ATOM 0 H8 DG A 3 -2.176 -8.256 0.941 1.00 0.00 H new ATOM 0 H1 DG A 3 2.107 -3.518 1.331 1.00 0.00 H new ATOM 0 H21 DG A 3 4.428 -5.882 0.315 1.00 0.00 H new ATOM 0 H22 DG A 3 4.106 -4.214 0.802 1.00 0.00 H new ATOM 98 P DG A 4 1.426 -13.769 0.176 1.00 0.00 P ATOM 99 OP1 DG A 4 0.190 -14.399 -0.340 1.00 0.00 O ATOM 100 OP2 DG A 4 2.026 -14.227 1.448 1.00 0.00 O ATOM 101 O5' DG A 4 2.551 -13.818 -0.976 1.00 0.00 O ATOM 102 C5' DG A 4 2.138 -13.410 -2.288 1.00 0.00 C ATOM 103 C4' DG A 4 3.271 -13.234 -3.295 1.00 0.00 C ATOM 104 O4' DG A 4 4.050 -12.103 -2.937 1.00 0.00 O ATOM 105 C3' DG A 4 4.214 -14.418 -3.434 1.00 0.00 C ATOM 106 O3' DG A 4 4.579 -14.544 -4.817 1.00 0.00 O ATOM 107 C2' DG A 4 5.445 -14.026 -2.605 1.00 0.00 C ATOM 108 C1' DG A 4 5.260 -12.526 -2.318 1.00 0.00 C ATOM 109 N9 DG A 4 5.157 -12.156 -0.886 1.00 0.00 N ATOM 110 C8 DG A 4 4.710 -12.889 0.182 1.00 0.00 C ATOM 111 N7 DG A 4 4.731 -12.272 1.324 1.00 0.00 N ATOM 112 C5 DG A 4 5.232 -11.015 1.001 1.00 0.00 C ATOM 113 C6 DG A 4 5.477 -9.894 1.839 1.00 0.00 C ATOM 114 O6 DG A 4 5.300 -9.794 3.052 1.00 0.00 O ATOM 115 N1 DG A 4 5.977 -8.818 1.117 1.00 0.00 N ATOM 116 C2 DG A 4 6.213 -8.817 -0.241 1.00 0.00 C ATOM 117 N2 DG A 4 6.690 -7.683 -0.754 1.00 0.00 N ATOM 118 N3 DG A 4 5.987 -9.871 -1.034 1.00 0.00 N ATOM 119 C4 DG A 4 5.497 -10.932 -0.348 1.00 0.00 C ATOM 0 H5' DG A 4 1.596 -12.468 -2.205 1.00 0.00 H new ATOM 0 H5'' DG A 4 1.437 -14.148 -2.678 1.00 0.00 H new ATOM 0 H4' DG A 4 2.771 -13.120 -4.257 1.00 0.00 H new ATOM 0 H3' DG A 4 3.780 -15.361 -3.103 1.00 0.00 H new ATOM 0 H2' DG A 4 5.500 -14.602 -1.681 1.00 0.00 H new ATOM 0 H2'' DG A 4 6.368 -14.213 -3.154 1.00 0.00 H new ATOM 0 H1' DG A 4 6.158 -12.045 -2.705 1.00 0.00 H new ATOM 0 H8 DG A 4 4.365 -13.907 0.081 1.00 0.00 H new ATOM 0 H1 DG A 4 6.186 -7.962 1.632 1.00 0.00 H new ATOM 0 H21 DG A 4 6.886 -7.618 -1.753 1.00 0.00 H new ATOM 0 H22 DG A 4 6.859 -6.880 -0.148 1.00 0.00 H new ATOM 131 P DC A 5 3.762 -15.554 -5.780 1.00 0.00 P ATOM 132 OP1 DC A 5 3.403 -16.753 -4.989 1.00 0.00 O ATOM 133 OP2 DC A 5 4.523 -15.708 -7.040 1.00 0.00 O ATOM 134 O5' DC A 5 2.403 -14.750 -6.113 1.00 0.00 O ATOM 135 C5' DC A 5 2.378 -13.632 -7.007 1.00 0.00 C ATOM 136 C4' DC A 5 1.044 -12.897 -6.913 1.00 0.00 C ATOM 137 O4' DC A 5 0.899 -12.347 -5.608 1.00 0.00 O ATOM 138 C3' DC A 5 0.884 -11.751 -7.905 1.00 0.00 C ATOM 139 O3' DC A 5 0.138 -12.155 -9.060 1.00 0.00 O ATOM 140 C2' DC A 5 0.078 -10.700 -7.151 1.00 0.00 C ATOM 141 C1' DC A 5 0.161 -11.128 -5.688 1.00 0.00 C ATOM 142 N1 DC A 5 0.821 -10.145 -4.803 1.00 0.00 N ATOM 143 C2 DC A 5 2.085 -9.702 -5.157 1.00 0.00 C ATOM 144 O2 DC A 5 2.638 -10.158 -6.155 1.00 0.00 O ATOM 145 N3 DC A 5 2.691 -8.772 -4.360 1.00 0.00 N ATOM 146 C4 DC A 5 2.076 -8.300 -3.265 1.00 0.00 C ATOM 147 N4 DC A 5 2.695 -7.397 -2.495 1.00 0.00 N ATOM 148 C5 DC A 5 0.772 -8.753 -2.907 1.00 0.00 C ATOM 149 C6 DC A 5 0.188 -9.674 -3.696 1.00 0.00 C ATOM 0 H5' DC A 5 2.540 -13.974 -8.029 1.00 0.00 H new ATOM 0 H5'' DC A 5 3.193 -12.949 -6.767 1.00 0.00 H new ATOM 0 H4' DC A 5 0.285 -13.644 -7.145 1.00 0.00 H new ATOM 0 H3' DC A 5 1.854 -11.397 -8.254 1.00 0.00 H new ATOM 0 H2' DC A 5 0.493 -9.703 -7.296 1.00 0.00 H new ATOM 0 H2'' DC A 5 -0.955 -10.669 -7.497 1.00 0.00 H new ATOM 0 H1' DC A 5 -0.868 -11.231 -5.344 1.00 0.00 H new ATOM 0 H41 DC A 5 2.232 -7.035 -1.661 1.00 0.00 H new ATOM 0 H42 DC A 5 3.630 -7.071 -2.742 1.00 0.00 H new ATOM 0 H5 DC A 5 0.269 -8.370 -2.031 1.00 0.00 H new ATOM 0 H6 DC A 5 -0.796 -10.043 -3.446 1.00 0.00 H new ATOM 161 P DG A 6 0.775 -12.044 -10.533 1.00 0.00 P ATOM 162 OP1 DG A 6 -0.279 -12.350 -11.525 1.00 0.00 O ATOM 163 OP2 DG A 6 2.052 -12.793 -10.548 1.00 0.00 O ATOM 164 O5' DG A 6 1.105 -10.472 -10.607 1.00 0.00 O ATOM 165 C5' DG A 6 0.098 -9.473 -10.438 1.00 0.00 C ATOM 166 C4' DG A 6 0.746 -8.088 -10.423 1.00 0.00 C ATOM 167 O4' DG A 6 0.546 -7.436 -11.678 1.00 0.00 O ATOM 168 C3' DG A 6 0.226 -7.130 -9.358 1.00 0.00 C ATOM 169 O3' DG A 6 1.348 -6.404 -8.889 1.00 0.00 O ATOM 170 C2' DG A 6 -0.741 -6.200 -10.062 1.00 0.00 C ATOM 171 C1' DG A 6 -0.490 -6.450 -11.540 1.00 0.00 C ATOM 172 N9 DG A 6 -1.662 -6.964 -12.270 1.00 0.00 N ATOM 173 C8 DG A 6 -2.605 -7.860 -11.849 1.00 0.00 C ATOM 174 N7 DG A 6 -3.477 -8.208 -12.748 1.00 0.00 N ATOM 175 C5 DG A 6 -3.083 -7.482 -13.872 1.00 0.00 C ATOM 176 C6 DG A 6 -3.651 -7.442 -15.174 1.00 0.00 C ATOM 177 O6 DG A 6 -4.626 -8.058 -15.600 1.00 0.00 O ATOM 178 N1 DG A 6 -2.951 -6.579 -16.008 1.00 0.00 N ATOM 179 C2 DG A 6 -1.843 -5.845 -15.639 1.00 0.00 C ATOM 180 N2 DG A 6 -1.308 -5.065 -16.581 1.00 0.00 N ATOM 181 N3 DG A 6 -1.304 -5.881 -14.416 1.00 0.00 N ATOM 182 C4 DG A 6 -1.973 -6.717 -13.587 1.00 0.00 C ATOM 0 H5' DG A 6 -0.444 -9.642 -9.507 1.00 0.00 H new ATOM 0 H5'' DG A 6 -0.630 -9.536 -11.247 1.00 0.00 H new ATOM 0 H4' DG A 6 1.793 -8.296 -10.204 1.00 0.00 H new ATOM 0 H3' DG A 6 -0.270 -7.628 -8.525 1.00 0.00 H new ATOM 0 H2' DG A 6 -1.774 -6.420 -9.791 1.00 0.00 H new ATOM 0 H2'' DG A 6 -0.556 -5.159 -9.797 1.00 0.00 H new ATOM 0 H1' DG A 6 -0.224 -5.482 -11.964 1.00 0.00 H new ATOM 0 H8 DG A 6 -2.624 -8.250 -10.842 1.00 0.00 H new ATOM 0 H1 DG A 6 -3.282 -6.481 -16.968 1.00 0.00 H new ATOM 0 H21 DG A 6 -0.487 -4.498 -16.368 1.00 0.00 H new ATOM 0 H22 DG A 6 -1.720 -5.036 -17.514 1.00 0.00 H new ATOM 194 P DG A 7 1.994 -6.761 -7.469 1.00 0.00 P ATOM 195 OP1 DG A 7 2.247 -8.215 -7.433 1.00 0.00 O ATOM 196 OP2 DG A 7 1.187 -6.120 -6.407 1.00 0.00 O ATOM 197 O5' DG A 7 3.404 -6.021 -7.548 1.00 0.00 O ATOM 198 C5' DG A 7 4.390 -6.504 -8.464 1.00 0.00 C ATOM 199 C4' DG A 7 5.594 -5.598 -8.482 1.00 0.00 C ATOM 200 O4' DG A 7 5.258 -4.316 -8.976 1.00 0.00 O ATOM 201 C3' DG A 7 6.168 -5.409 -7.101 1.00 0.00 C ATOM 202 O3' DG A 7 7.098 -6.456 -6.791 1.00 0.00 O ATOM 203 C2' DG A 7 6.865 -4.057 -7.212 1.00 0.00 C ATOM 204 C1' DG A 7 6.129 -3.364 -8.367 1.00 0.00 C ATOM 205 N9 DG A 7 5.299 -2.219 -7.960 1.00 0.00 N ATOM 206 C8 DG A 7 5.684 -0.945 -7.681 1.00 0.00 C ATOM 207 N7 DG A 7 4.727 -0.137 -7.337 1.00 0.00 N ATOM 208 C5 DG A 7 3.596 -0.949 -7.392 1.00 0.00 C ATOM 209 C6 DG A 7 2.239 -0.634 -7.122 1.00 0.00 C ATOM 210 O6 DG A 7 1.761 0.445 -6.775 1.00 0.00 O ATOM 211 N1 DG A 7 1.417 -1.739 -7.301 1.00 0.00 N ATOM 212 C2 DG A 7 1.841 -2.992 -7.689 1.00 0.00 C ATOM 213 N2 DG A 7 0.894 -3.925 -7.814 1.00 0.00 N ATOM 214 N3 DG A 7 3.120 -3.293 -7.941 1.00 0.00 N ATOM 215 C4 DG A 7 3.937 -2.227 -7.773 1.00 0.00 C ATOM 0 H5' DG A 7 3.963 -6.568 -9.465 1.00 0.00 H new ATOM 0 H5'' DG A 7 4.692 -7.512 -8.181 1.00 0.00 H new ATOM 0 H4' DG A 7 6.327 -6.079 -9.129 1.00 0.00 H new ATOM 0 H3' DG A 7 5.423 -5.441 -6.306 1.00 0.00 H new ATOM 0 H2' DG A 7 6.784 -3.487 -6.286 1.00 0.00 H new ATOM 0 H2'' DG A 7 7.928 -4.170 -7.425 1.00 0.00 H new ATOM 0 H1' DG A 7 6.901 -2.985 -9.036 1.00 0.00 H new ATOM 0 H8 DG A 7 6.714 -0.627 -7.741 1.00 0.00 H new ATOM 0 H1 DG A 7 0.419 -1.613 -7.132 1.00 0.00 H new ATOM 0 H21 DG A 7 1.145 -4.872 -8.098 1.00 0.00 H new ATOM 0 H22 DG A 7 -0.081 -3.691 -7.625 1.00 0.00 H new ATOM 227 P DG A 8 7.120 -7.051 -5.293 1.00 0.00 P ATOM 228 OP1 DG A 8 8.162 -8.100 -5.220 1.00 0.00 O ATOM 229 OP2 DG A 8 5.730 -7.354 -4.888 1.00 0.00 O ATOM 230 O5' DG A 8 7.620 -5.783 -4.461 1.00 0.00 O ATOM 231 C5' DG A 8 8.913 -5.241 -4.676 1.00 0.00 C ATOM 232 C4' DG A 8 9.047 -3.911 -3.968 1.00 0.00 C ATOM 233 O4' DG A 8 8.060 -3.017 -4.477 1.00 0.00 O ATOM 234 C3' DG A 8 8.827 -3.945 -2.474 1.00 0.00 C ATOM 235 O3' DG A 8 10.047 -4.286 -1.788 1.00 0.00 O ATOM 236 C2' DG A 8 8.398 -2.523 -2.175 1.00 0.00 C ATOM 237 C1' DG A 8 7.692 -2.081 -3.453 1.00 0.00 C ATOM 238 N9 DG A 8 6.214 -2.076 -3.337 1.00 0.00 N ATOM 239 C8 DG A 8 5.336 -3.116 -3.462 1.00 0.00 C ATOM 240 N7 DG A 8 4.090 -2.826 -3.231 1.00 0.00 N ATOM 241 C5 DG A 8 4.135 -1.469 -2.921 1.00 0.00 C ATOM 242 C6 DG A 8 3.081 -0.580 -2.584 1.00 0.00 C ATOM 243 O6 DG A 8 1.886 -0.816 -2.483 1.00 0.00 O ATOM 244 N1 DG A 8 3.543 0.699 -2.355 1.00 0.00 N ATOM 245 C2 DG A 8 4.859 1.094 -2.430 1.00 0.00 C ATOM 246 N2 DG A 8 5.102 2.380 -2.168 1.00 0.00 N ATOM 247 N3 DG A 8 5.864 0.264 -2.743 1.00 0.00 N ATOM 248 C4 DG A 8 5.430 -0.999 -2.979 1.00 0.00 C ATOM 0 H5' DG A 8 9.088 -5.112 -5.744 1.00 0.00 H new ATOM 0 H5'' DG A 8 9.671 -5.934 -4.310 1.00 0.00 H new ATOM 0 H4' DG A 8 10.077 -3.606 -4.150 1.00 0.00 H new ATOM 0 H3' DG A 8 8.099 -4.689 -2.150 1.00 0.00 H new ATOM 0 H2' DG A 8 7.731 -2.479 -1.314 1.00 0.00 H new ATOM 0 H2'' DG A 8 9.253 -1.886 -1.949 1.00 0.00 H new ATOM 0 H1' DG A 8 7.995 -1.057 -3.674 1.00 0.00 H new ATOM 0 H8 DG A 8 5.656 -4.111 -3.734 1.00 0.00 H new ATOM 0 H1 DG A 8 2.853 1.410 -2.110 1.00 0.00 H new ATOM 0 H21 DG A 8 6.057 2.737 -2.206 1.00 0.00 H new ATOM 0 H22 DG A 8 4.333 3.006 -1.929 1.00 0.00 H new ATOM 260 P DG A 9 10.001 -4.838 -0.268 1.00 0.00 P ATOM 261 OP1 DG A 9 11.336 -5.369 0.080 1.00 0.00 O ATOM 262 OP2 DG A 9 8.799 -5.689 -0.117 1.00 0.00 O ATOM 263 O5' DG A 9 9.766 -3.467 0.544 1.00 0.00 O ATOM 264 C5' DG A 9 10.792 -2.466 0.520 1.00 0.00 C ATOM 265 C4' DG A 9 10.195 -1.087 0.264 1.00 0.00 C ATOM 266 O4' DG A 9 8.791 -1.215 0.056 1.00 0.00 O ATOM 267 C3' DG A 9 10.367 -0.017 1.337 1.00 0.00 C ATOM 268 O3' DG A 9 10.480 1.223 0.623 1.00 0.00 O ATOM 269 C2' DG A 9 9.042 -0.065 2.086 1.00 0.00 C ATOM 270 C1' DG A 9 8.096 -0.350 0.939 1.00 0.00 C ATOM 271 N9 DG A 9 6.818 -1.010 1.273 1.00 0.00 N ATOM 272 C8 DG A 9 6.454 -2.318 1.096 1.00 0.00 C ATOM 273 N7 DG A 9 5.186 -2.577 1.286 1.00 0.00 N ATOM 274 C5 DG A 9 4.662 -1.325 1.630 1.00 0.00 C ATOM 275 C6 DG A 9 3.328 -0.944 1.957 1.00 0.00 C ATOM 276 O6 DG A 9 2.325 -1.648 2.021 1.00 0.00 O ATOM 277 N1 DG A 9 3.238 0.411 2.236 1.00 0.00 N ATOM 278 C2 DG A 9 4.298 1.297 2.211 1.00 0.00 C ATOM 279 N2 DG A 9 4.027 2.562 2.511 1.00 0.00 N ATOM 280 N3 DG A 9 5.547 0.945 1.908 1.00 0.00 N ATOM 281 C4 DG A 9 5.658 -0.370 1.628 1.00 0.00 C ATOM 0 H5' DG A 9 11.519 -2.703 -0.257 1.00 0.00 H new ATOM 0 H5'' DG A 9 11.328 -2.465 1.469 1.00 0.00 H new ATOM 0 H4' DG A 9 10.766 -0.739 -0.597 1.00 0.00 H new ATOM 0 H3' DG A 9 11.219 -0.140 2.005 1.00 0.00 H new ATOM 0 H2' DG A 9 9.022 -0.846 2.846 1.00 0.00 H new ATOM 0 H2'' DG A 9 8.814 0.875 2.589 1.00 0.00 H new ATOM 0 H1' DG A 9 7.817 0.623 0.535 1.00 0.00 H new ATOM 0 H8 DG A 9 7.164 -3.083 0.819 1.00 0.00 H new ATOM 0 H1 DG A 9 2.319 0.782 2.478 1.00 0.00 H new ATOM 0 H21 DG A 9 4.773 3.258 2.508 1.00 0.00 H new ATOM 0 H22 DG A 9 3.073 2.838 2.745 1.00 0.00 H new ATOM 293 P DC A 10 11.878 1.933 0.245 1.00 0.00 P ATOM 294 OP1 DC A 10 12.833 0.878 -0.153 1.00 0.00 O ATOM 295 OP2 DC A 10 12.233 2.900 1.309 1.00 0.00 O ATOM 296 O5' DC A 10 11.433 2.756 -1.073 1.00 0.00 O ATOM 297 C5' DC A 10 11.094 2.014 -2.259 1.00 0.00 C ATOM 298 C4' DC A 10 10.103 2.728 -3.176 1.00 0.00 C ATOM 299 O4' DC A 10 8.841 2.783 -2.520 1.00 0.00 O ATOM 300 C3' DC A 10 10.463 4.145 -3.610 1.00 0.00 C ATOM 301 O3' DC A 10 10.035 4.315 -4.967 1.00 0.00 O ATOM 302 C2' DC A 10 9.651 5.040 -2.692 1.00 0.00 C ATOM 303 C1' DC A 10 8.524 4.131 -2.189 1.00 0.00 C ATOM 304 N1 DC A 10 8.284 4.193 -0.729 1.00 0.00 N ATOM 305 C2 DC A 10 6.967 4.326 -0.317 1.00 0.00 C ATOM 306 O2 DC A 10 6.065 4.366 -1.148 1.00 0.00 O ATOM 307 N3 DC A 10 6.712 4.416 1.014 1.00 0.00 N ATOM 308 C4 DC A 10 7.706 4.377 1.909 1.00 0.00 C ATOM 309 N4 DC A 10 7.415 4.472 3.206 1.00 0.00 N ATOM 310 C5 DC A 10 9.067 4.237 1.494 1.00 0.00 C ATOM 311 C6 DC A 10 9.312 4.146 0.174 1.00 0.00 C ATOM 0 H5' DC A 10 10.674 1.052 -1.966 1.00 0.00 H new ATOM 0 H5'' DC A 10 12.006 1.806 -2.818 1.00 0.00 H new ATOM 0 H4' DC A 10 10.105 2.138 -4.092 1.00 0.00 H new ATOM 0 H3' DC A 10 11.529 4.365 -3.553 1.00 0.00 H new ATOM 0 H2' DC A 10 10.255 5.420 -1.868 1.00 0.00 H new ATOM 0 H2'' DC A 10 9.258 5.906 -3.224 1.00 0.00 H new ATOM 0 H1' DC A 10 7.615 4.487 -2.675 1.00 0.00 H new ATOM 0 H41 DC A 10 8.162 4.444 3.900 1.00 0.00 H new ATOM 0 H42 DC A 10 6.445 4.573 3.505 1.00 0.00 H new ATOM 0 H5 DC A 10 9.871 4.205 2.215 1.00 0.00 H new ATOM 0 H6 DC A 10 10.328 4.035 -0.176 1.00 0.00 H new ATOM 323 P DG A 11 10.397 5.626 -5.833 1.00 0.00 P ATOM 324 OP1 DG A 11 10.223 5.297 -7.267 1.00 0.00 O ATOM 325 OP2 DG A 11 11.689 6.160 -5.350 1.00 0.00 O ATOM 326 O5' DG A 11 9.230 6.658 -5.410 1.00 0.00 O ATOM 327 C5' DG A 11 7.859 6.288 -5.597 1.00 0.00 C ATOM 328 C4' DG A 11 6.880 7.411 -5.229 1.00 0.00 C ATOM 329 O4' DG A 11 5.674 7.257 -5.976 1.00 0.00 O ATOM 330 C3' DG A 11 6.454 7.469 -3.762 1.00 0.00 C ATOM 331 O3' DG A 11 7.345 8.299 -2.988 1.00 0.00 O ATOM 332 C2' DG A 11 5.073 8.114 -3.818 1.00 0.00 C ATOM 333 C1' DG A 11 4.614 7.898 -5.258 1.00 0.00 C ATOM 334 N9 DG A 11 3.392 7.075 -5.369 1.00 0.00 N ATOM 335 C8 DG A 11 2.099 7.443 -5.125 1.00 0.00 C ATOM 336 N7 DG A 11 1.217 6.498 -5.244 1.00 0.00 N ATOM 337 C5 DG A 11 1.986 5.393 -5.601 1.00 0.00 C ATOM 338 C6 DG A 11 1.580 4.059 -5.872 1.00 0.00 C ATOM 339 O6 DG A 11 0.441 3.591 -5.839 1.00 0.00 O ATOM 340 N1 DG A 11 2.662 3.252 -6.199 1.00 0.00 N ATOM 341 C2 DG A 11 3.977 3.674 -6.259 1.00 0.00 C ATOM 342 N2 DG A 11 4.880 2.752 -6.595 1.00 0.00 N ATOM 343 N3 DG A 11 4.364 4.932 -6.004 1.00 0.00 N ATOM 344 C4 DG A 11 3.321 5.733 -5.684 1.00 0.00 C ATOM 0 H5' DG A 11 7.640 5.409 -4.991 1.00 0.00 H new ATOM 0 H5'' DG A 11 7.704 6.004 -6.638 1.00 0.00 H new ATOM 0 H4' DG A 11 7.433 8.323 -5.452 1.00 0.00 H new ATOM 0 H3' DG A 11 6.463 6.486 -3.291 1.00 0.00 H new ATOM 0 H2' DG A 11 4.388 7.650 -3.108 1.00 0.00 H new ATOM 0 H2'' DG A 11 5.119 9.174 -3.570 1.00 0.00 H new ATOM 0 H1' DG A 11 4.372 8.876 -5.673 1.00 0.00 H new ATOM 0 H8 DG A 11 1.829 8.452 -4.852 1.00 0.00 H new ATOM 0 H1 DG A 11 2.472 2.273 -6.411 1.00 0.00 H new ATOM 0 H21 DG A 11 5.867 3.003 -6.656 1.00 0.00 H new ATOM 0 H22 DG A 11 4.584 1.796 -6.791 1.00 0.00 H new ATOM 356 P DG A 12 7.654 7.929 -1.444 1.00 0.00 P ATOM 357 OP1 DG A 12 8.599 8.933 -0.908 1.00 0.00 O ATOM 358 OP2 DG A 12 7.976 6.503 -1.358 1.00 0.00 O ATOM 359 O5' DG A 12 6.229 8.156 -0.738 1.00 0.00 O ATOM 360 C5' DG A 12 5.647 9.452 -0.642 1.00 0.00 C ATOM 361 C4' DG A 12 4.204 9.369 -0.160 1.00 0.00 C ATOM 362 O4' DG A 12 3.435 8.611 -1.089 1.00 0.00 O ATOM 363 C3' DG A 12 3.997 8.709 1.190 1.00 0.00 C ATOM 364 O3' DG A 12 4.163 9.685 2.231 1.00 0.00 O ATOM 365 C2' DG A 12 2.556 8.214 1.106 1.00 0.00 C ATOM 366 C1' DG A 12 2.357 7.966 -0.396 1.00 0.00 C ATOM 367 N9 DG A 12 2.368 6.538 -0.781 1.00 0.00 N ATOM 368 C8 DG A 12 3.423 5.743 -1.134 1.00 0.00 C ATOM 369 N7 DG A 12 3.123 4.502 -1.389 1.00 0.00 N ATOM 370 C5 DG A 12 1.742 4.462 -1.191 1.00 0.00 C ATOM 371 C6 DG A 12 0.831 3.375 -1.320 1.00 0.00 C ATOM 372 O6 DG A 12 1.072 2.213 -1.639 1.00 0.00 O ATOM 373 N1 DG A 12 -0.472 3.762 -1.032 1.00 0.00 N ATOM 374 C2 DG A 12 -0.854 5.038 -0.665 1.00 0.00 C ATOM 375 N2 DG A 12 -2.152 5.224 -0.429 1.00 0.00 N ATOM 376 N3 DG A 12 -0.002 6.060 -0.542 1.00 0.00 N ATOM 377 C4 DG A 12 1.273 5.703 -0.818 1.00 0.00 C ATOM 0 H5' DG A 12 5.681 9.943 -1.615 1.00 0.00 H new ATOM 0 H5'' DG A 12 6.229 10.066 0.046 1.00 0.00 H new ATOM 0 H4' DG A 12 3.895 10.410 -0.070 1.00 0.00 H new ATOM 0 H3' DG A 12 4.700 7.907 1.414 1.00 0.00 H new ATOM 0 H2' DG A 12 2.408 7.304 1.687 1.00 0.00 H new ATOM 0 H2'' DG A 12 1.853 8.954 1.488 1.00 0.00 H new ATOM 0 H1' DG A 12 1.374 8.358 -0.656 1.00 0.00 H new ATOM 0 H8 DG A 12 4.434 6.118 -1.197 1.00 0.00 H new ATOM 0 H1 DG A 12 -1.201 3.051 -1.096 1.00 0.00 H new ATOM 0 H21 DG A 12 -2.494 6.145 -0.154 1.00 0.00 H new ATOM 0 H22 DG A 12 -2.804 4.445 -0.523 1.00 0.00 H new ATOM 389 P DG A 13 4.562 9.239 3.730 1.00 0.00 P ATOM 390 OP1 DG A 13 4.898 10.456 4.502 1.00 0.00 O ATOM 391 OP2 DG A 13 5.531 8.124 3.642 1.00 0.00 O ATOM 392 O5' DG A 13 3.172 8.657 4.289 1.00 0.00 O ATOM 393 C5' DG A 13 2.054 9.537 4.397 1.00 0.00 C ATOM 394 C4' DG A 13 0.778 8.819 4.821 1.00 0.00 C ATOM 395 O4' DG A 13 0.448 7.819 3.873 1.00 0.00 O ATOM 396 C3' DG A 13 0.818 8.120 6.169 1.00 0.00 C ATOM 397 O3' DG A 13 0.478 9.090 7.168 1.00 0.00 O ATOM 398 C2' DG A 13 -0.274 7.061 6.030 1.00 0.00 C ATOM 399 C1' DG A 13 -0.367 6.833 4.515 1.00 0.00 C ATOM 400 N9 DG A 13 0.119 5.514 4.072 1.00 0.00 N ATOM 401 C8 DG A 13 1.368 5.153 3.672 1.00 0.00 C ATOM 402 N7 DG A 13 1.500 3.914 3.318 1.00 0.00 N ATOM 403 C5 DG A 13 0.227 3.393 3.499 1.00 0.00 C ATOM 404 C6 DG A 13 -0.251 2.075 3.276 1.00 0.00 C ATOM 405 O6 DG A 13 0.373 1.098 2.852 1.00 0.00 O ATOM 406 N1 DG A 13 -1.597 1.966 3.598 1.00 0.00 N ATOM 407 C2 DG A 13 -2.380 3.000 4.079 1.00 0.00 C ATOM 408 N2 DG A 13 -3.635 2.702 4.384 1.00 0.00 N ATOM 409 N3 DG A 13 -1.934 4.242 4.271 1.00 0.00 N ATOM 410 C4 DG A 13 -0.627 4.366 3.966 1.00 0.00 C ATOM 0 H5' DG A 13 1.889 10.027 3.437 1.00 0.00 H new ATOM 0 H5'' DG A 13 2.282 10.321 5.120 1.00 0.00 H new ATOM 0 H4' DG A 13 0.047 9.625 4.890 1.00 0.00 H new ATOM 0 H3' DG A 13 1.778 7.685 6.445 1.00 0.00 H new ATOM 0 H2' DG A 13 -0.012 6.144 6.558 1.00 0.00 H new ATOM 0 H2'' DG A 13 -1.222 7.407 6.442 1.00 0.00 H new ATOM 0 H1' DG A 13 -1.423 6.896 4.253 1.00 0.00 H new ATOM 0 H8 DG A 13 2.192 5.851 3.651 1.00 0.00 H new ATOM 0 H1 DG A 13 -2.041 1.057 3.471 1.00 0.00 H new ATOM 0 H21 DG A 13 -4.258 3.425 4.743 1.00 0.00 H new ATOM 0 H22 DG A 13 -3.978 1.749 4.260 1.00 0.00 H new ATOM 422 P DG A 14 0.922 8.984 8.719 1.00 0.00 P ATOM 423 OP1 DG A 14 0.620 10.279 9.371 1.00 0.00 O ATOM 424 OP2 DG A 14 2.295 8.439 8.765 1.00 0.00 O ATOM 425 O5' DG A 14 -0.081 7.874 9.317 1.00 0.00 O ATOM 426 C5' DG A 14 -1.465 7.987 9.009 1.00 0.00 C ATOM 427 C4' DG A 14 -2.381 8.202 10.211 1.00 0.00 C ATOM 428 O4' DG A 14 -2.399 7.016 11.016 1.00 0.00 O ATOM 429 C3' DG A 14 -2.011 9.377 11.123 1.00 0.00 C ATOM 430 O3' DG A 14 -3.231 10.026 11.480 1.00 0.00 O ATOM 431 C2' DG A 14 -1.410 8.723 12.359 1.00 0.00 C ATOM 432 C1' DG A 14 -2.020 7.331 12.359 1.00 0.00 C ATOM 433 N9 DG A 14 -1.099 6.277 12.820 1.00 0.00 N ATOM 434 C8 DG A 14 -0.274 5.478 12.083 1.00 0.00 C ATOM 435 N7 DG A 14 0.421 4.619 12.766 1.00 0.00 N ATOM 436 C5 DG A 14 0.026 4.865 14.081 1.00 0.00 C ATOM 437 C6 DG A 14 0.442 4.239 15.287 1.00 0.00 C ATOM 438 O6 DG A 14 1.255 3.329 15.432 1.00 0.00 O ATOM 439 N1 DG A 14 -0.199 4.785 16.390 1.00 0.00 N ATOM 440 C2 DG A 14 -1.126 5.807 16.343 1.00 0.00 C ATOM 441 N2 DG A 14 -1.633 6.199 17.512 1.00 0.00 N ATOM 442 N3 DG A 14 -1.521 6.396 15.210 1.00 0.00 N ATOM 443 C4 DG A 14 -0.907 5.878 14.122 1.00 0.00 C ATOM 0 H5' DG A 14 -1.780 7.083 8.489 1.00 0.00 H new ATOM 0 H5'' DG A 14 -1.600 8.817 8.316 1.00 0.00 H new ATOM 0 H4' DG A 14 -3.353 8.438 9.778 1.00 0.00 H new ATOM 0 H3' DG A 14 -1.330 10.097 10.669 1.00 0.00 H new ATOM 0 H2' DG A 14 -0.322 8.684 12.303 1.00 0.00 H new ATOM 0 H2'' DG A 14 -1.663 9.272 13.266 1.00 0.00 H new ATOM 0 H1' DG A 14 -2.862 7.353 13.051 1.00 0.00 H new ATOM 0 H8 DG A 14 -0.204 5.554 11.008 1.00 0.00 H new ATOM 0 H1 DG A 14 0.033 4.402 17.306 1.00 0.00 H new ATOM 0 H21 DG A 14 -2.323 6.950 17.543 1.00 0.00 H new ATOM 0 H22 DG A 14 -1.331 5.748 18.376 1.00 0.00 H new ATOM 455 P DC A 15 -3.838 11.318 10.677 1.00 0.00 P ATOM 456 OP1 DC A 15 -3.086 12.509 11.128 1.00 0.00 O ATOM 457 OP2 DC A 15 -5.309 11.295 10.832 1.00 0.00 O ATOM 458 O5' DC A 15 -3.510 11.107 9.086 1.00 0.00 O ATOM 459 C5' DC A 15 -2.197 11.399 8.559 1.00 0.00 C ATOM 460 C4' DC A 15 -1.987 11.016 7.090 1.00 0.00 C ATOM 461 O4' DC A 15 -2.090 9.587 6.971 1.00 0.00 O ATOM 462 C3' DC A 15 -2.961 11.626 6.088 1.00 0.00 C ATOM 463 O3' DC A 15 -2.207 12.061 4.942 1.00 0.00 O ATOM 464 C2' DC A 15 -3.900 10.500 5.697 1.00 0.00 C ATOM 465 C1' DC A 15 -3.108 9.242 6.025 1.00 0.00 C ATOM 466 N1 DC A 15 -3.908 8.126 6.590 1.00 0.00 N ATOM 467 C2 DC A 15 -3.732 6.872 6.019 1.00 0.00 C ATOM 468 O2 DC A 15 -2.971 6.731 5.065 1.00 0.00 O ATOM 469 N3 DC A 15 -4.429 5.823 6.533 1.00 0.00 N ATOM 470 C4 DC A 15 -5.266 5.987 7.563 1.00 0.00 C ATOM 471 N4 DC A 15 -5.930 4.929 8.037 1.00 0.00 N ATOM 472 C5 DC A 15 -5.454 7.274 8.160 1.00 0.00 C ATOM 473 C6 DC A 15 -4.759 8.311 7.648 1.00 0.00 C ATOM 0 H5' DC A 15 -1.455 10.878 9.164 1.00 0.00 H new ATOM 0 H5'' DC A 15 -2.006 12.466 8.671 1.00 0.00 H new ATOM 0 H4' DC A 15 -1.005 11.415 6.837 1.00 0.00 H new ATOM 0 H3' DC A 15 -3.512 12.476 6.490 1.00 0.00 H new ATOM 0 H2' DC A 15 -4.833 10.544 6.258 1.00 0.00 H new ATOM 0 H2'' DC A 15 -4.161 10.545 4.640 1.00 0.00 H new ATOM 0 H1' DC A 15 -2.709 8.880 5.078 1.00 0.00 H new ATOM 0 H41 DC A 15 -6.572 5.039 8.822 1.00 0.00 H new ATOM 0 H42 DC A 15 -5.795 4.011 7.614 1.00 0.00 H new ATOM 0 H5 DC A 15 -6.129 7.411 8.992 1.00 0.00 H new ATOM 0 H6 DC A 15 -4.874 9.296 8.076 1.00 0.00 H new ATOM 485 P DG A 16 -2.928 12.816 3.718 1.00 0.00 P ATOM 486 OP1 DG A 16 -2.023 13.879 3.229 1.00 0.00 O ATOM 487 OP2 DG A 16 -4.309 13.149 4.130 1.00 0.00 O ATOM 488 O5' DG A 16 -3.007 11.663 2.593 1.00 0.00 O ATOM 489 C5' DG A 16 -1.777 11.137 2.067 1.00 0.00 C ATOM 490 C4' DG A 16 -1.989 9.999 1.069 1.00 0.00 C ATOM 491 O4' DG A 16 -2.506 8.862 1.761 1.00 0.00 O ATOM 492 C3' DG A 16 -2.953 10.334 -0.069 1.00 0.00 C ATOM 493 O3' DG A 16 -2.486 9.768 -1.303 1.00 0.00 O ATOM 494 C2' DG A 16 -4.240 9.643 0.349 1.00 0.00 C ATOM 495 C1' DG A 16 -3.729 8.456 1.158 1.00 0.00 C ATOM 496 N9 DG A 16 -4.623 8.007 2.243 1.00 0.00 N ATOM 497 C8 DG A 16 -5.373 8.749 3.112 1.00 0.00 C ATOM 498 N7 DG A 16 -6.043 8.061 3.987 1.00 0.00 N ATOM 499 C5 DG A 16 -5.718 6.744 3.674 1.00 0.00 C ATOM 500 C6 DG A 16 -6.144 5.533 4.283 1.00 0.00 C ATOM 501 O6 DG A 16 -6.895 5.386 5.245 1.00 0.00 O ATOM 502 N1 DG A 16 -5.585 4.424 3.659 1.00 0.00 N ATOM 503 C2 DG A 16 -4.721 4.474 2.580 1.00 0.00 C ATOM 504 N2 DG A 16 -4.292 3.306 2.104 1.00 0.00 N ATOM 505 N3 DG A 16 -4.317 5.613 2.009 1.00 0.00 N ATOM 506 C4 DG A 16 -4.852 6.702 2.605 1.00 0.00 C ATOM 0 H5' DG A 16 -1.160 10.779 2.891 1.00 0.00 H new ATOM 0 H5'' DG A 16 -1.224 11.940 1.580 1.00 0.00 H new ATOM 0 H4' DG A 16 -1.014 9.808 0.620 1.00 0.00 H new ATOM 0 H3' DG A 16 -3.062 11.407 -0.230 1.00 0.00 H new ATOM 0 H2' DG A 16 -4.876 10.297 0.945 1.00 0.00 H new ATOM 0 H2'' DG A 16 -4.828 9.325 -0.512 1.00 0.00 H new ATOM 0 H1' DG A 16 -3.639 7.619 0.466 1.00 0.00 H new ATOM 0 H8 DG A 16 -5.406 9.828 3.074 1.00 0.00 H new ATOM 0 H1 DG A 16 -5.830 3.504 4.024 1.00 0.00 H new ATOM 0 H21 DG A 16 -3.653 3.283 1.309 1.00 0.00 H new ATOM 0 H22 DG A 16 -4.602 2.435 2.534 1.00 0.00 H new ATOM 518 P DG A 17 -3.184 10.214 -2.686 1.00 0.00 P ATOM 519 OP1 DG A 17 -2.261 9.888 -3.800 1.00 0.00 O ATOM 520 OP2 DG A 17 -3.692 11.595 -2.528 1.00 0.00 O ATOM 521 O5' DG A 17 -4.445 9.218 -2.767 1.00 0.00 O ATOM 522 C5' DG A 17 -5.719 9.684 -3.208 1.00 0.00 C ATOM 523 C4' DG A 17 -6.711 8.537 -3.357 1.00 0.00 C ATOM 524 O4' DG A 17 -6.277 7.629 -4.359 1.00 0.00 O ATOM 525 C3' DG A 17 -6.923 7.700 -2.103 1.00 0.00 C ATOM 526 O3' DG A 17 -7.948 8.264 -1.264 1.00 0.00 O ATOM 527 C2' DG A 17 -7.364 6.348 -2.658 1.00 0.00 C ATOM 528 C1' DG A 17 -6.970 6.403 -4.136 1.00 0.00 C ATOM 529 N9 DG A 17 -6.110 5.282 -4.567 1.00 0.00 N ATOM 530 C8 DG A 17 -6.477 3.998 -4.848 1.00 0.00 C ATOM 531 N7 DG A 17 -5.507 3.199 -5.162 1.00 0.00 N ATOM 532 C5 DG A 17 -4.383 4.014 -5.090 1.00 0.00 C ATOM 533 C6 DG A 17 -3.019 3.696 -5.331 1.00 0.00 C ATOM 534 O6 DG A 17 -2.535 2.611 -5.654 1.00 0.00 O ATOM 535 N1 DG A 17 -2.198 4.801 -5.152 1.00 0.00 N ATOM 536 C2 DG A 17 -2.633 6.060 -4.786 1.00 0.00 C ATOM 537 N2 DG A 17 -1.690 6.997 -4.667 1.00 0.00 N ATOM 538 N3 DG A 17 -3.920 6.365 -4.555 1.00 0.00 N ATOM 539 C4 DG A 17 -4.737 5.297 -4.725 1.00 0.00 C ATOM 0 H5' DG A 17 -5.609 10.198 -4.163 1.00 0.00 H new ATOM 0 H5'' DG A 17 -6.108 10.413 -2.497 1.00 0.00 H new ATOM 0 H4' DG A 17 -7.647 9.037 -3.604 1.00 0.00 H new ATOM 0 H3' DG A 17 -6.032 7.642 -1.478 1.00 0.00 H new ATOM 0 H2' DG A 17 -6.867 5.525 -2.144 1.00 0.00 H new ATOM 0 H2'' DG A 17 -8.437 6.198 -2.537 1.00 0.00 H new ATOM 0 H1' DG A 17 -7.887 6.329 -4.721 1.00 0.00 H new ATOM 0 H8 DG A 17 -7.505 3.671 -4.811 1.00 0.00 H new ATOM 0 H1 DG A 17 -1.197 4.674 -5.302 1.00 0.00 H new ATOM 0 H21 DG A 17 -1.946 7.947 -4.399 1.00 0.00 H new ATOM 0 H22 DG A 17 -0.713 6.763 -4.844 1.00 0.00 H new ATOM 551 P DG A 18 -7.850 8.073 0.338 1.00 0.00 P ATOM 552 OP1 DG A 18 -8.935 8.859 0.965 1.00 0.00 O ATOM 553 OP2 DG A 18 -6.453 8.296 0.743 1.00 0.00 O ATOM 554 O5' DG A 18 -8.182 6.509 0.526 1.00 0.00 O ATOM 555 C5' DG A 18 -9.478 5.999 0.211 1.00 0.00 C ATOM 556 C4' DG A 18 -9.499 4.471 0.215 1.00 0.00 C ATOM 557 O4' DG A 18 -8.589 3.992 -0.761 1.00 0.00 O ATOM 558 C3' DG A 18 -9.112 3.784 1.515 1.00 0.00 C ATOM 559 O3' DG A 18 -10.268 3.655 2.359 1.00 0.00 O ATOM 560 C2' DG A 18 -8.606 2.423 1.053 1.00 0.00 C ATOM 561 C1' DG A 18 -8.122 2.693 -0.378 1.00 0.00 C ATOM 562 N9 DG A 18 -6.655 2.697 -0.527 1.00 0.00 N ATOM 563 C8 DG A 18 -5.776 3.735 -0.403 1.00 0.00 C ATOM 564 N7 DG A 18 -4.528 3.427 -0.598 1.00 0.00 N ATOM 565 C5 DG A 18 -4.576 2.063 -0.876 1.00 0.00 C ATOM 566 C6 DG A 18 -3.521 1.158 -1.183 1.00 0.00 C ATOM 567 O6 DG A 18 -2.314 1.395 -1.265 1.00 0.00 O ATOM 568 N1 DG A 18 -4.004 -0.131 -1.404 1.00 0.00 N ATOM 569 C2 DG A 18 -5.340 -0.494 -1.333 1.00 0.00 C ATOM 570 N2 DG A 18 -5.624 -1.771 -1.571 1.00 0.00 N ATOM 571 N3 DG A 18 -6.325 0.356 -1.045 1.00 0.00 N ATOM 572 C4 DG A 18 -5.874 1.610 -0.831 1.00 0.00 C ATOM 0 H5' DG A 18 -9.785 6.365 -0.769 1.00 0.00 H new ATOM 0 H5'' DG A 18 -10.203 6.375 0.933 1.00 0.00 H new ATOM 0 H4' DG A 18 -10.545 4.229 0.027 1.00 0.00 H new ATOM 0 H3' DG A 18 -8.369 4.327 2.099 1.00 0.00 H new ATOM 0 H2' DG A 18 -7.799 2.057 1.688 1.00 0.00 H new ATOM 0 H2'' DG A 18 -9.395 1.672 1.076 1.00 0.00 H new ATOM 0 H1' DG A 18 -8.511 1.886 -0.999 1.00 0.00 H new ATOM 0 H8 DG A 18 -6.094 4.738 -0.161 1.00 0.00 H new ATOM 0 H1 DG A 18 -3.327 -0.858 -1.634 1.00 0.00 H new ATOM 0 H21 DG A 18 -6.591 -2.094 -1.532 1.00 0.00 H new ATOM 0 H22 DG A 18 -4.875 -2.427 -1.792 1.00 0.00 H new ATOM 584 P DG A 19 -10.103 3.428 3.948 1.00 0.00 P ATOM 585 OP1 DG A 19 -11.429 3.599 4.581 1.00 0.00 O ATOM 586 OP2 DG A 19 -8.949 4.228 4.414 1.00 0.00 O ATOM 587 O5' DG A 19 -9.701 1.868 4.025 1.00 0.00 O ATOM 588 C5' DG A 19 -10.635 0.873 3.581 1.00 0.00 C ATOM 589 C4' DG A 19 -10.038 -0.538 3.581 1.00 0.00 C ATOM 590 O4' DG A 19 -8.892 -0.570 2.741 1.00 0.00 O ATOM 591 C3' DG A 19 -9.558 -1.053 4.924 1.00 0.00 C ATOM 592 O3' DG A 19 -10.637 -1.657 5.656 1.00 0.00 O ATOM 593 C2' DG A 19 -8.549 -2.129 4.516 1.00 0.00 C ATOM 594 C1' DG A 19 -8.051 -1.659 3.151 1.00 0.00 C ATOM 595 N9 DG A 19 -6.659 -1.176 3.167 1.00 0.00 N ATOM 596 C8 DG A 19 -6.195 0.079 3.425 1.00 0.00 C ATOM 597 N7 DG A 19 -4.908 0.209 3.384 1.00 0.00 N ATOM 598 C5 DG A 19 -4.463 -1.068 3.070 1.00 0.00 C ATOM 599 C6 DG A 19 -3.140 -1.541 2.881 1.00 0.00 C ATOM 600 O6 DG A 19 -2.086 -0.912 2.972 1.00 0.00 O ATOM 601 N1 DG A 19 -3.126 -2.892 2.567 1.00 0.00 N ATOM 602 C2 DG A 19 -4.241 -3.693 2.453 1.00 0.00 C ATOM 603 N2 DG A 19 -4.018 -4.973 2.142 1.00 0.00 N ATOM 604 N3 DG A 19 -5.493 -3.250 2.635 1.00 0.00 N ATOM 605 C4 DG A 19 -5.527 -1.930 2.937 1.00 0.00 C ATOM 0 H5' DG A 19 -10.973 1.121 2.575 1.00 0.00 H new ATOM 0 H5'' DG A 19 -11.514 0.892 4.226 1.00 0.00 H new ATOM 0 H4' DG A 19 -10.864 -1.167 3.249 1.00 0.00 H new ATOM 0 H3' DG A 19 -9.151 -0.271 5.565 1.00 0.00 H new ATOM 0 H2' DG A 19 -7.733 -2.206 5.235 1.00 0.00 H new ATOM 0 H2'' DG A 19 -9.015 -3.113 4.455 1.00 0.00 H new ATOM 0 H1' DG A 19 -8.087 -2.512 2.473 1.00 0.00 H new ATOM 0 H8 DG A 19 -6.854 0.905 3.648 1.00 0.00 H new ATOM 0 H1 DG A 19 -2.217 -3.327 2.408 1.00 0.00 H new ATOM 0 H21 DG A 19 -4.802 -5.618 2.043 1.00 0.00 H new ATOM 0 H22 DG A 19 -3.064 -5.305 2.004 1.00 0.00 H new ATOM 617 P DT A 20 -10.659 -1.599 7.270 1.00 0.00 P ATOM 618 OP1 DT A 20 -11.899 -2.260 7.735 1.00 0.00 O ATOM 619 OP2 DT A 20 -10.366 -0.213 7.688 1.00 0.00 O ATOM 620 O5' DT A 20 -9.408 -2.531 7.684 1.00 0.00 O ATOM 621 C5' DT A 20 -9.383 -3.921 7.352 1.00 0.00 C ATOM 622 C4' DT A 20 -8.040 -4.561 7.695 1.00 0.00 C ATOM 623 O4' DT A 20 -7.029 -3.937 6.899 1.00 0.00 O ATOM 624 C3' DT A 20 -7.629 -4.421 9.159 1.00 0.00 C ATOM 625 O3' DT A 20 -7.019 -5.624 9.633 1.00 0.00 O ATOM 626 C2' DT A 20 -6.624 -3.275 9.178 1.00 0.00 C ATOM 627 C1' DT A 20 -6.187 -3.120 7.719 1.00 0.00 C ATOM 628 N1 DT A 20 -6.215 -1.731 7.185 1.00 0.00 N ATOM 629 C2 DT A 20 -5.163 -1.360 6.370 1.00 0.00 C ATOM 630 O2 DT A 20 -4.271 -2.145 6.064 1.00 0.00 O ATOM 631 N3 DT A 20 -5.175 -0.059 5.907 1.00 0.00 N ATOM 632 C4 DT A 20 -6.134 0.898 6.183 1.00 0.00 C ATOM 633 O4 DT A 20 -6.049 2.029 5.703 1.00 0.00 O ATOM 634 C5 DT A 20 -7.196 0.429 7.036 1.00 0.00 C ATOM 635 C7 DT A 20 -8.324 1.386 7.413 1.00 0.00 C ATOM 636 C6 DT A 20 -7.213 -0.841 7.501 1.00 0.00 C ATOM 0 H5' DT A 20 -9.583 -4.044 6.288 1.00 0.00 H new ATOM 0 H5'' DT A 20 -10.179 -4.437 7.888 1.00 0.00 H new ATOM 0 H4' DT A 20 -8.149 -5.627 7.495 1.00 0.00 H new ATOM 0 H3' DT A 20 -8.487 -4.231 9.804 1.00 0.00 H new ATOM 0 H2' DT A 20 -7.076 -2.358 9.556 1.00 0.00 H new ATOM 0 H2'' DT A 20 -5.776 -3.502 9.824 1.00 0.00 H new ATOM 0 HO3' DT A 20 -6.762 -5.512 10.572 1.00 0.00 H new ATOM 0 H1' DT A 20 -5.141 -3.426 7.694 1.00 0.00 H new ATOM 0 H3 DT A 20 -4.402 0.223 5.304 1.00 0.00 H new ATOM 0 H71 DT A 20 -7.943 2.407 7.435 1.00 0.00 H new ATOM 0 H72 DT A 20 -9.124 1.313 6.676 1.00 0.00 H new ATOM 0 H73 DT A 20 -8.712 1.122 8.397 1.00 0.00 H new ATOM 0 H6 DT A 20 -8.027 -1.162 8.133 1.00 0.00 H new TER 650 DT A 20 HETATM 651 O4 LOC A 101 6.448 5.231 7.133 1.00 0.00 O HETATM 652 C12 LOC A 101 5.284 4.879 6.949 1.00 0.00 C HETATM 653 C13 LOC A 101 4.115 5.774 7.363 1.00 0.00 C HETATM 654 N1 LOC A 101 4.937 3.746 6.323 1.00 0.00 N HETATM 655 C11 LOC A 101 3.727 2.988 6.673 1.00 0.00 C HETATM 656 C14 LOC A 101 3.999 1.633 6.540 1.00 0.00 C HETATM 657 C15 LOC A 101 5.376 1.599 6.730 1.00 0.00 C HETATM 658 C10 LOC A 101 2.616 3.378 5.711 1.00 0.00 C HETATM 659 C9 LOC A 101 1.255 3.063 6.311 1.00 0.00 C HETATM 660 C8 LOC A 101 0.926 1.737 6.060 1.00 0.00 C HETATM 661 C7 LOC A 101 -0.453 1.563 6.104 1.00 0.00 C HETATM 662 C5 LOC A 101 -0.987 0.281 6.160 1.00 0.00 C HETATM 663 C3 LOC A 101 -0.143 -0.822 6.189 1.00 0.00 C HETATM 664 C1 LOC A 101 1.230 -0.640 6.100 1.00 0.00 C HETATM 665 O1 LOC A 101 2.017 -1.658 6.538 1.00 0.00 O HETATM 666 C2 LOC A 101 1.923 -1.749 7.962 1.00 0.00 C HETATM 667 O2 LOC A 101 -0.649 -2.017 5.781 1.00 0.00 O HETATM 668 C4 LOC A 101 -1.591 -2.505 6.739 1.00 0.00 C HETATM 669 O3 LOC A 101 -2.326 0.045 6.194 1.00 0.00 O HETATM 670 C6 LOC A 101 -2.885 0.709 7.330 1.00 0.00 C HETATM 671 C22 LOC A 101 1.777 0.638 6.027 1.00 0.00 C HETATM 672 C21 LOC A 101 3.169 0.643 6.029 1.00 0.00 C HETATM 673 C20 LOC A 101 3.522 -0.407 5.190 1.00 0.00 C HETATM 674 C19 LOC A 101 4.788 -0.962 5.038 1.00 0.00 C HETATM 675 C17 LOC A 101 6.004 -0.471 5.497 1.00 0.00 C HETATM 676 C16 LOC A 101 6.287 0.710 6.175 1.00 0.00 C HETATM 677 O5 LOC A 101 7.471 0.975 6.372 1.00 0.00 O HETATM 678 O6 LOC A 101 7.102 -1.254 5.324 1.00 0.00 O HETATM 679 C18 LOC A 101 7.329 -1.998 6.525 1.00 0.00 C HETATM 0 H18B LOC A 101 7.493 -1.310 7.354 1.00 0.00 H new HETATM 0 H18A LOC A 101 6.460 -2.621 6.737 1.00 0.00 H new HETATM 0 H13B LOC A 101 4.158 5.955 8.437 1.00 0.00 H new HETATM 0 H13A LOC A 101 4.179 6.724 6.833 1.00 0.00 H new HETATM 0 H10A LOC A 101 2.682 4.442 5.483 1.00 0.00 H new HETATM 0 HN1 LOC A 101 5.536 3.396 5.575 1.00 0.00 H new HETATM 0 H9A LOC A 101 1.270 3.247 7.385 1.00 0.00 H new HETATM 0 H9 LOC A 101 0.498 3.722 5.885 1.00 0.00 H new HETATM 0 H7 LOC A 101 -1.114 2.430 6.095 1.00 0.00 H new HETATM 0 H6B LOC A 101 -2.421 0.327 8.239 1.00 0.00 H new HETATM 0 H6A LOC A 101 -2.702 1.781 7.252 1.00 0.00 H new HETATM 0 H6 LOC A 101 -3.959 0.526 7.366 1.00 0.00 H new HETATM 0 H4B LOC A 101 -1.096 -2.636 7.701 1.00 0.00 H new HETATM 0 H4A LOC A 101 -2.406 -1.789 6.845 1.00 0.00 H new HETATM 0 H4 LOC A 101 -1.990 -3.462 6.402 1.00 0.00 H new HETATM 0 H2B LOC A 101 2.256 -0.812 8.409 1.00 0.00 H new HETATM 0 H2A LOC A 101 0.888 -1.940 8.247 1.00 0.00 H new HETATM 0 H20 LOC A 101 2.723 -0.841 4.588 1.00 0.00 H new HETATM 0 H2 LOC A 101 2.553 -2.565 8.317 1.00 0.00 H new HETATM 0 H19 LOC A 101 4.832 -1.902 4.489 1.00 0.00 H new HETATM 0 H18 LOC A 101 8.208 -2.631 6.400 1.00 0.00 H new HETATM 0 H15 LOC A 101 5.789 2.360 7.393 1.00 0.00 H new HETATM 0 H13 LOC A 101 3.174 5.282 7.115 1.00 0.00 H new HETATM 0 H11 LOC A 101 3.422 3.204 7.697 1.00 0.00 H new HETATM 0 H10 LOC A 101 2.738 2.842 4.770 1.00 0.00 H new