USER MOD reduce.3.24.130724 H: found=0, std=0, add=195, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 196 hydrogens (14 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 NoAdj-H: B 1 PSO H3 : B 1 PSO C3 : B 12 DT C6 :(H bumps) USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.42 (180deg=-1.42) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : B 1 PSO O14 : rot 180:sc= -0.688 USER MOD Single : B 9 DG O5' : rot -25:sc= 0.02 USER MOD Single : B 12 DT C7 :methyl 150:sc= -1.67 (180deg=-1.67) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.453 -10.950 9.548 1.00 0.00 O ATOM 2 C5' DG A 1 -2.137 -9.628 9.168 1.00 0.00 C ATOM 3 C4' DG A 1 -0.622 -9.492 8.967 1.00 0.00 C ATOM 4 O4' DG A 1 -0.193 -10.344 7.911 1.00 0.00 O ATOM 5 C3' DG A 1 -0.238 -8.067 8.564 1.00 0.00 C ATOM 6 O3' DG A 1 1.081 -7.825 9.018 1.00 0.00 O ATOM 7 C2' DG A 1 -0.363 -8.162 7.047 1.00 0.00 C ATOM 8 C1' DG A 1 0.149 -9.576 6.767 1.00 0.00 C ATOM 9 N9 DG A 1 -0.461 -10.175 5.557 1.00 0.00 N ATOM 10 C8 DG A 1 -1.795 -10.322 5.270 1.00 0.00 C ATOM 11 N7 DG A 1 -2.041 -10.927 4.145 1.00 0.00 N ATOM 12 C5 DG A 1 -0.777 -11.230 3.652 1.00 0.00 C ATOM 13 C6 DG A 1 -0.399 -11.916 2.460 1.00 0.00 C ATOM 14 O6 DG A 1 -1.130 -12.417 1.611 1.00 0.00 O ATOM 15 N1 DG A 1 0.974 -11.997 2.295 1.00 0.00 N ATOM 16 C2 DG A 1 1.885 -11.536 3.212 1.00 0.00 C ATOM 17 N2 DG A 1 3.177 -11.711 2.951 1.00 0.00 N ATOM 18 N3 DG A 1 1.546 -10.904 4.344 1.00 0.00 N ATOM 19 C4 DG A 1 0.199 -10.779 4.507 1.00 0.00 C ATOM 0 H5' DG A 1 -2.476 -8.929 9.933 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.660 -9.370 8.247 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.151 -9.756 9.914 1.00 0.00 H new ATOM 0 H3' DG A 1 -0.833 -7.250 8.972 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.392 -8.029 6.714 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.236 -7.405 6.541 1.00 0.00 H new ATOM 0 HO5' DG A 1 -3.421 -11.031 9.676 1.00 0.00 H new ATOM 0 H1' DG A 1 1.223 -9.553 6.580 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.576 -9.965 5.924 1.00 0.00 H new ATOM 0 H1 DG A 1 1.329 -12.425 1.440 1.00 0.00 H new ATOM 0 H21 DG A 1 3.880 -11.380 3.612 1.00 0.00 H new ATOM 0 H22 DG A 1 3.465 -12.176 2.090 1.00 0.00 H new ATOM 32 P DC A 2 1.886 -6.463 8.707 1.00 0.00 P ATOM 33 OP1 DC A 2 2.699 -6.127 9.896 1.00 0.00 O ATOM 34 OP2 DC A 2 0.937 -5.469 8.160 1.00 0.00 O ATOM 35 O5' DC A 2 2.881 -6.933 7.532 1.00 0.00 O ATOM 36 C5' DC A 2 3.833 -7.948 7.776 1.00 0.00 C ATOM 37 C4' DC A 2 4.703 -8.209 6.545 1.00 0.00 C ATOM 38 O4' DC A 2 3.927 -8.676 5.465 1.00 0.00 O ATOM 39 C3' DC A 2 5.439 -6.960 6.053 1.00 0.00 C ATOM 40 O3' DC A 2 6.764 -7.406 5.831 1.00 0.00 O ATOM 41 C2' DC A 2 4.673 -6.546 4.788 1.00 0.00 C ATOM 42 C1' DC A 2 4.200 -7.908 4.306 1.00 0.00 C ATOM 43 N1 DC A 2 2.938 -7.867 3.530 1.00 0.00 N ATOM 44 C2 DC A 2 2.880 -8.548 2.324 1.00 0.00 C ATOM 45 O2 DC A 2 3.907 -8.973 1.802 1.00 0.00 O ATOM 46 N3 DC A 2 1.677 -8.748 1.713 1.00 0.00 N ATOM 47 C4 DC A 2 0.559 -8.277 2.280 1.00 0.00 C ATOM 48 N4 DC A 2 -0.605 -8.626 1.740 1.00 0.00 N ATOM 49 C5 DC A 2 0.584 -7.568 3.524 1.00 0.00 C ATOM 50 C6 DC A 2 1.793 -7.391 4.106 1.00 0.00 C ATOM 0 H5' DC A 2 3.321 -8.867 8.063 1.00 0.00 H new ATOM 0 H5'' DC A 2 4.466 -7.660 8.616 1.00 0.00 H new ATOM 0 H4' DC A 2 5.430 -8.955 6.867 1.00 0.00 H new ATOM 0 H3' DC A 2 5.483 -6.095 6.715 1.00 0.00 H new ATOM 0 H2' DC A 2 3.845 -5.870 5.005 1.00 0.00 H new ATOM 0 H2'' DC A 2 5.311 -6.045 4.060 1.00 0.00 H new ATOM 0 H1' DC A 2 4.977 -8.313 3.658 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.477 -8.286 2.145 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.625 -9.233 0.921 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.321 -7.192 3.977 1.00 0.00 H new ATOM 0 H6 DC A 2 1.855 -6.862 5.046 1.00 0.00 H new ATOM 62 P DG A 3 7.994 -6.406 5.636 1.00 0.00 P ATOM 63 OP1 DG A 3 9.243 -7.197 5.633 1.00 0.00 O ATOM 64 OP2 DG A 3 7.831 -5.281 6.582 1.00 0.00 O ATOM 65 O5' DG A 3 7.710 -5.882 4.154 1.00 0.00 O ATOM 66 C5' DG A 3 7.924 -6.687 3.013 1.00 0.00 C ATOM 67 C4' DG A 3 7.614 -5.863 1.757 1.00 0.00 C ATOM 68 O4' DG A 3 6.339 -6.065 1.196 1.00 0.00 O ATOM 69 C3' DG A 3 7.756 -4.362 1.971 1.00 0.00 C ATOM 70 O3' DG A 3 8.544 -3.885 0.915 1.00 0.00 O ATOM 71 C2' DG A 3 6.301 -3.976 2.035 1.00 0.00 C ATOM 72 C1' DG A 3 5.783 -4.802 0.879 1.00 0.00 C ATOM 73 N9 DG A 3 4.352 -5.020 0.828 1.00 0.00 N ATOM 74 C8 DG A 3 3.523 -4.899 1.871 1.00 0.00 C ATOM 75 N7 DG A 3 2.323 -5.360 1.686 1.00 0.00 N ATOM 76 C5 DG A 3 2.364 -5.752 0.349 1.00 0.00 C ATOM 77 C6 DG A 3 1.332 -6.230 -0.498 1.00 0.00 C ATOM 78 O6 DG A 3 0.217 -6.622 -0.174 1.00 0.00 O ATOM 79 N1 DG A 3 1.695 -6.223 -1.833 1.00 0.00 N ATOM 80 C2 DG A 3 2.960 -5.952 -2.297 1.00 0.00 C ATOM 81 N2 DG A 3 3.173 -5.992 -3.607 1.00 0.00 N ATOM 82 N3 DG A 3 3.980 -5.635 -1.496 1.00 0.00 N ATOM 83 C4 DG A 3 3.598 -5.509 -0.200 1.00 0.00 C ATOM 0 H5' DG A 3 7.287 -7.571 3.051 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.955 -7.038 2.988 1.00 0.00 H new ATOM 0 H4' DG A 3 8.367 -6.239 1.065 1.00 0.00 H new ATOM 0 H3' DG A 3 8.267 -3.962 2.847 1.00 0.00 H new ATOM 0 H2' DG A 3 5.836 -4.243 2.984 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.143 -2.907 1.892 1.00 0.00 H new ATOM 0 H1' DG A 3 6.033 -4.312 -0.062 1.00 0.00 H new ATOM 0 H8 DG A 3 3.831 -4.449 2.803 1.00 0.00 H new ATOM 0 H1 DG A 3 0.973 -6.434 -2.522 1.00 0.00 H new ATOM 0 H21 DG A 3 4.102 -5.795 -3.979 1.00 0.00 H new ATOM 0 H22 DG A 3 2.407 -6.220 -4.241 1.00 0.00 H new ATOM 95 P DT A 4 10.048 -3.408 1.207 1.00 0.00 P ATOM 96 OP1 DT A 4 10.731 -3.209 -0.089 1.00 0.00 O ATOM 97 OP2 DT A 4 10.624 -4.324 2.216 1.00 0.00 O ATOM 98 O5' DT A 4 9.768 -1.964 1.884 1.00 0.00 O ATOM 99 C5' DT A 4 8.549 -1.243 1.710 1.00 0.00 C ATOM 100 C4' DT A 4 8.018 -1.259 0.257 1.00 0.00 C ATOM 101 O4' DT A 4 6.853 -2.059 -0.035 1.00 0.00 O ATOM 102 C3' DT A 4 7.618 0.127 -0.217 1.00 0.00 C ATOM 103 O3' DT A 4 7.855 0.060 -1.608 1.00 0.00 O ATOM 104 C2' DT A 4 6.209 -0.034 0.220 1.00 0.00 C ATOM 105 C1' DT A 4 5.668 -1.291 -0.273 1.00 0.00 C ATOM 106 N1 DT A 4 4.444 -1.670 0.531 1.00 0.00 N ATOM 107 C2 DT A 4 3.391 -2.281 -0.142 1.00 0.00 C ATOM 108 O2 DT A 4 3.475 -2.589 -1.325 1.00 0.00 O ATOM 109 N3 DT A 4 2.228 -2.542 0.552 1.00 0.00 N ATOM 110 C4 DT A 4 1.940 -2.220 1.858 1.00 0.00 C ATOM 111 O4 DT A 4 0.930 -2.674 2.389 1.00 0.00 O ATOM 112 C5 DT A 4 2.893 -1.292 2.624 1.00 0.00 C ATOM 113 C7 DT A 4 3.190 -1.765 4.053 1.00 0.00 C ATOM 114 C6 DT A 4 4.173 -0.954 1.841 1.00 0.00 C ATOM 0 H5' DT A 4 8.701 -0.209 2.020 1.00 0.00 H new ATOM 0 H5'' DT A 4 7.790 -1.665 2.369 1.00 0.00 H new ATOM 0 H4' DT A 4 8.880 -1.696 -0.246 1.00 0.00 H new ATOM 0 H3' DT A 4 8.071 1.062 0.114 1.00 0.00 H new ATOM 0 H2' DT A 4 6.153 -0.008 1.308 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.609 0.798 -0.150 1.00 0.00 H new ATOM 0 H1' DT A 4 5.285 -1.367 -1.291 1.00 0.00 H new ATOM 0 H3 DT A 4 1.496 -3.031 0.037 1.00 0.00 H new ATOM 0 H71 DT A 4 4.190 -1.441 4.343 1.00 0.00 H new ATOM 0 H72 DT A 4 2.457 -1.338 4.737 1.00 0.00 H new ATOM 0 H73 DT A 4 3.135 -2.853 4.095 1.00 0.00 H new ATOM 0 H6 DT A 4 4.868 -0.218 2.218 1.00 0.00 H new ATOM 127 P DA A 5 9.354 -0.011 -2.216 1.00 0.00 P ATOM 128 OP1 DA A 5 9.461 -1.221 -3.058 1.00 0.00 O ATOM 129 OP2 DA A 5 10.300 0.209 -1.099 1.00 0.00 O ATOM 130 O5' DA A 5 9.361 1.271 -3.130 1.00 0.00 O ATOM 131 C5' DA A 5 8.555 2.356 -2.774 1.00 0.00 C ATOM 132 C4' DA A 5 7.157 2.198 -3.390 1.00 0.00 C ATOM 133 O4' DA A 5 6.154 1.753 -2.479 1.00 0.00 O ATOM 134 C3' DA A 5 6.786 3.582 -3.871 1.00 0.00 C ATOM 135 O3' DA A 5 6.819 3.816 -5.278 1.00 0.00 O ATOM 136 C2' DA A 5 5.439 3.712 -3.259 1.00 0.00 C ATOM 137 C1' DA A 5 4.936 2.437 -2.689 1.00 0.00 C ATOM 138 N9 DA A 5 4.294 2.761 -1.383 1.00 0.00 N ATOM 139 C8 DA A 5 4.971 3.365 -0.357 1.00 0.00 C ATOM 140 N7 DA A 5 4.246 3.971 0.530 1.00 0.00 N ATOM 141 C5 DA A 5 2.964 3.658 0.108 1.00 0.00 C ATOM 142 C6 DA A 5 1.695 3.906 0.650 1.00 0.00 C ATOM 143 N6 DA A 5 1.513 4.369 1.880 1.00 0.00 N ATOM 144 N1 DA A 5 0.625 3.687 -0.115 1.00 0.00 N ATOM 145 C2 DA A 5 0.815 3.187 -1.325 1.00 0.00 C ATOM 146 N3 DA A 5 1.934 2.844 -1.937 1.00 0.00 N ATOM 147 C4 DA A 5 2.989 3.086 -1.138 1.00 0.00 C ATOM 0 H5' DA A 5 9.010 3.285 -3.118 1.00 0.00 H new ATOM 0 H5'' DA A 5 8.478 2.421 -1.689 1.00 0.00 H new ATOM 0 H4' DA A 5 7.199 1.436 -4.168 1.00 0.00 H new ATOM 0 H3' DA A 5 7.514 4.339 -3.579 1.00 0.00 H new ATOM 0 H2' DA A 5 5.474 4.466 -2.473 1.00 0.00 H new ATOM 0 H2'' DA A 5 4.737 4.069 -4.012 1.00 0.00 H new ATOM 0 H1' DA A 5 4.214 1.883 -3.289 1.00 0.00 H new ATOM 0 H8 DA A 5 6.049 3.338 -0.291 1.00 0.00 H new ATOM 0 H61 DA A 5 0.569 4.533 2.229 1.00 0.00 H new ATOM 0 H62 DA A 5 2.318 4.561 2.477 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.085 3.036 -1.902 1.00 0.00 H new ATOM 159 P DC A 6 5.884 3.056 -6.381 1.00 0.00 P ATOM 160 OP1 DC A 6 6.022 1.596 -6.199 1.00 0.00 O ATOM 161 OP2 DC A 6 6.202 3.648 -7.698 1.00 0.00 O ATOM 162 O5' DC A 6 4.360 3.451 -6.018 1.00 0.00 O ATOM 163 C5' DC A 6 3.858 4.742 -6.295 1.00 0.00 C ATOM 164 C4' DC A 6 2.401 4.877 -5.830 1.00 0.00 C ATOM 165 O4' DC A 6 2.278 4.737 -4.411 1.00 0.00 O ATOM 166 C3' DC A 6 1.899 6.288 -6.177 1.00 0.00 C ATOM 167 O3' DC A 6 0.587 6.226 -6.713 1.00 0.00 O ATOM 168 C2' DC A 6 1.932 6.911 -4.792 1.00 0.00 C ATOM 169 C1' DC A 6 1.411 5.766 -3.955 1.00 0.00 C ATOM 170 N1 DC A 6 1.536 6.141 -2.525 1.00 0.00 N ATOM 171 C2 DC A 6 0.397 6.488 -1.798 1.00 0.00 C ATOM 172 O2 DC A 6 -0.724 6.457 -2.302 1.00 0.00 O ATOM 173 N3 DC A 6 0.530 6.870 -0.497 1.00 0.00 N ATOM 174 C4 DC A 6 1.742 6.961 0.060 1.00 0.00 C ATOM 175 N4 DC A 6 1.829 7.275 1.344 1.00 0.00 N ATOM 176 C5 DC A 6 2.922 6.611 -0.668 1.00 0.00 C ATOM 177 C6 DC A 6 2.766 6.227 -1.943 1.00 0.00 C ATOM 0 H5' DC A 6 3.922 4.939 -7.365 1.00 0.00 H new ATOM 0 H5'' DC A 6 4.474 5.490 -5.796 1.00 0.00 H new ATOM 0 H4' DC A 6 1.827 4.094 -6.325 1.00 0.00 H new ATOM 0 H3' DC A 6 2.469 6.834 -6.929 1.00 0.00 H new ATOM 0 H2' DC A 6 2.937 7.214 -4.499 1.00 0.00 H new ATOM 0 H2'' DC A 6 1.299 7.796 -4.722 1.00 0.00 H new ATOM 0 H1' DC A 6 0.364 5.478 -4.045 1.00 0.00 H new ATOM 0 H41 DC A 6 2.743 7.350 1.790 1.00 0.00 H new ATOM 0 H42 DC A 6 0.982 7.442 1.887 1.00 0.00 H new ATOM 0 H5 DC A 6 3.899 6.654 -0.209 1.00 0.00 H new ATOM 0 H6 DC A 6 3.640 5.978 -2.526 1.00 0.00 H new ATOM 189 P DG A 7 -0.215 7.551 -7.177 1.00 0.00 P ATOM 190 OP1 DG A 7 -0.915 7.235 -8.440 1.00 0.00 O ATOM 191 OP2 DG A 7 0.726 8.692 -7.137 1.00 0.00 O ATOM 192 O5' DG A 7 -1.327 7.785 -6.022 1.00 0.00 O ATOM 193 C5' DG A 7 -2.507 7.007 -5.975 1.00 0.00 C ATOM 194 C4' DG A 7 -3.628 7.579 -5.088 1.00 0.00 C ATOM 195 O4' DG A 7 -3.175 7.797 -3.763 1.00 0.00 O ATOM 196 C3' DG A 7 -4.199 8.927 -5.548 1.00 0.00 C ATOM 197 O3' DG A 7 -5.515 8.971 -4.996 1.00 0.00 O ATOM 198 C2' DG A 7 -3.215 9.859 -4.842 1.00 0.00 C ATOM 199 C1' DG A 7 -3.231 9.186 -3.470 1.00 0.00 C ATOM 200 N9 DG A 7 -2.104 9.510 -2.581 1.00 0.00 N ATOM 201 C8 DG A 7 -0.777 9.572 -2.904 1.00 0.00 C ATOM 202 N7 DG A 7 0.012 9.733 -1.878 1.00 0.00 N ATOM 203 C5 DG A 7 -0.855 9.710 -0.782 1.00 0.00 C ATOM 204 C6 DG A 7 -0.594 9.736 0.623 1.00 0.00 C ATOM 205 O6 DG A 7 0.467 9.952 1.200 1.00 0.00 O ATOM 206 N1 DG A 7 -1.722 9.475 1.391 1.00 0.00 N ATOM 207 C2 DG A 7 -2.986 9.363 0.880 1.00 0.00 C ATOM 208 N2 DG A 7 -3.982 9.133 1.729 1.00 0.00 N ATOM 209 N3 DG A 7 -3.262 9.426 -0.427 1.00 0.00 N ATOM 210 C4 DG A 7 -2.151 9.551 -1.206 1.00 0.00 C ATOM 0 H5' DG A 7 -2.253 6.010 -5.616 1.00 0.00 H new ATOM 0 H5'' DG A 7 -2.889 6.892 -6.989 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.406 6.818 -5.156 1.00 0.00 H new ATOM 0 H3' DG A 7 -4.286 9.147 -6.612 1.00 0.00 H new ATOM 0 H2' DG A 7 -2.227 9.862 -5.303 1.00 0.00 H new ATOM 0 H2'' DG A 7 -3.556 10.894 -4.812 1.00 0.00 H new ATOM 0 H1' DG A 7 -4.113 9.529 -2.929 1.00 0.00 H new ATOM 0 H8 DG A 7 -0.414 9.495 -3.918 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.600 9.360 2.397 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.937 9.044 1.382 1.00 0.00 H new ATOM 0 H22 DG A 7 -3.791 9.046 2.727 1.00 0.00 H new ATOM 222 P DC A 8 -6.829 9.578 -5.730 1.00 0.00 P ATOM 223 OP1 DC A 8 -8.011 9.020 -5.039 1.00 0.00 O ATOM 224 OP2 DC A 8 -6.670 9.368 -7.185 1.00 0.00 O ATOM 225 O5' DC A 8 -6.813 11.169 -5.438 1.00 0.00 O ATOM 226 C5' DC A 8 -6.255 11.702 -4.255 1.00 0.00 C ATOM 227 C4' DC A 8 -7.074 11.595 -2.969 1.00 0.00 C ATOM 228 O4' DC A 8 -6.264 10.891 -2.043 1.00 0.00 O ATOM 229 C3' DC A 8 -7.384 12.964 -2.341 1.00 0.00 C ATOM 230 O3' DC A 8 -8.697 13.400 -2.620 1.00 0.00 O ATOM 231 C2' DC A 8 -7.202 12.691 -0.859 1.00 0.00 C ATOM 232 C1' DC A 8 -6.104 11.631 -0.844 1.00 0.00 C ATOM 233 N1 DC A 8 -4.727 12.196 -0.664 1.00 0.00 N ATOM 234 C2 DC A 8 -4.254 12.346 0.638 1.00 0.00 C ATOM 235 O2 DC A 8 -5.009 12.216 1.599 1.00 0.00 O ATOM 236 N3 DC A 8 -2.937 12.638 0.855 1.00 0.00 N ATOM 237 C4 DC A 8 -2.113 12.825 -0.181 1.00 0.00 C ATOM 238 N4 DC A 8 -0.825 13.034 0.056 1.00 0.00 N ATOM 239 C5 DC A 8 -2.568 12.721 -1.530 1.00 0.00 C ATOM 240 C6 DC A 8 -3.868 12.405 -1.713 1.00 0.00 C ATOM 0 H5' DC A 8 -6.043 12.757 -4.430 1.00 0.00 H new ATOM 0 H5'' DC A 8 -5.298 11.209 -4.084 1.00 0.00 H new ATOM 0 H4' DC A 8 -8.022 11.110 -3.200 1.00 0.00 H new ATOM 0 H3' DC A 8 -6.748 13.760 -2.728 1.00 0.00 H new ATOM 0 H2' DC A 8 -6.906 13.588 -0.316 1.00 0.00 H new ATOM 0 H2'' DC A 8 -8.121 12.328 -0.398 1.00 0.00 H new ATOM 0 HO3' DC A 8 -8.848 14.272 -2.200 1.00 0.00 H new ATOM 0 H1' DC A 8 -6.206 10.981 0.025 1.00 0.00 H new ATOM 0 H41 DC A 8 -0.180 13.179 -0.721 1.00 0.00 H new ATOM 0 H42 DC A 8 -0.479 13.050 1.015 1.00 0.00 H new ATOM 0 H5 DC A 8 -1.904 12.887 -2.365 1.00 0.00 H new ATOM 0 H6 DC A 8 -4.245 12.314 -2.721 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 -0.155 13.355 10.540 1.00 0.00 O ATOM 255 C5' DG B 9 0.157 11.991 10.713 1.00 0.00 C ATOM 256 C4' DG B 9 -1.036 11.155 10.236 1.00 0.00 C ATOM 257 O4' DG B 9 -1.262 11.419 8.866 1.00 0.00 O ATOM 258 C3' DG B 9 -0.753 9.649 10.316 1.00 0.00 C ATOM 259 O3' DG B 9 -1.923 8.861 10.206 1.00 0.00 O ATOM 260 C2' DG B 9 0.009 9.427 9.014 1.00 0.00 C ATOM 261 C1' DG B 9 -0.858 10.294 8.099 1.00 0.00 C ATOM 262 N9 DG B 9 -0.241 10.787 6.852 1.00 0.00 N ATOM 263 C8 DG B 9 1.069 11.063 6.552 1.00 0.00 C ATOM 264 N7 DG B 9 1.243 11.591 5.372 1.00 0.00 N ATOM 265 C5 DG B 9 -0.046 11.685 4.852 1.00 0.00 C ATOM 266 C6 DG B 9 -0.517 12.180 3.598 1.00 0.00 C ATOM 267 O6 DG B 9 0.131 12.697 2.693 1.00 0.00 O ATOM 268 N1 DG B 9 -1.888 12.031 3.439 1.00 0.00 N ATOM 269 C2 DG B 9 -2.724 11.527 4.405 1.00 0.00 C ATOM 270 N2 DG B 9 -4.017 11.412 4.130 1.00 0.00 N ATOM 271 N3 DG B 9 -2.302 11.106 5.600 1.00 0.00 N ATOM 272 C4 DG B 9 -0.956 11.201 5.755 1.00 0.00 C ATOM 0 H5' DG B 9 0.372 11.781 11.761 1.00 0.00 H new ATOM 0 H5'' DG B 9 1.052 11.732 10.147 1.00 0.00 H new ATOM 0 H4' DG B 9 -1.880 11.417 10.873 1.00 0.00 H new ATOM 0 H3' DG B 9 -0.265 9.383 11.254 1.00 0.00 H new ATOM 0 H2' DG B 9 1.043 9.767 9.065 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.032 8.381 8.709 1.00 0.00 H new ATOM 0 HO5' DG B 9 -0.823 13.450 9.829 1.00 0.00 H new ATOM 0 H1' DG B 9 -1.667 9.647 7.760 1.00 0.00 H new ATOM 0 H8 DG B 9 1.883 10.861 7.232 1.00 0.00 H new ATOM 0 H1 DG B 9 -2.300 12.313 2.550 1.00 0.00 H new ATOM 0 H21 DG B 9 -4.657 11.040 4.832 1.00 0.00 H new ATOM 0 H22 DG B 9 -4.371 11.695 3.216 1.00 0.00 H new ATOM 285 P DC B 10 -3.220 9.055 11.142 1.00 0.00 P ATOM 286 OP1 DC B 10 -4.249 9.781 10.368 1.00 0.00 O ATOM 287 OP2 DC B 10 -2.755 9.606 12.434 1.00 0.00 O ATOM 288 O5' DC B 10 -3.729 7.552 11.398 1.00 0.00 O ATOM 289 C5' DC B 10 -3.519 6.505 10.470 1.00 0.00 C ATOM 290 C4' DC B 10 -4.318 6.645 9.159 1.00 0.00 C ATOM 291 O4' DC B 10 -3.766 7.616 8.257 1.00 0.00 O ATOM 292 C3' DC B 10 -4.268 5.290 8.435 1.00 0.00 C ATOM 293 O3' DC B 10 -5.520 5.069 7.840 1.00 0.00 O ATOM 294 C2' DC B 10 -3.157 5.610 7.446 1.00 0.00 C ATOM 295 C1' DC B 10 -3.552 7.003 6.990 1.00 0.00 C ATOM 296 N1 DC B 10 -2.476 7.596 6.140 1.00 0.00 N ATOM 297 C2 DC B 10 -2.738 8.151 4.883 1.00 0.00 C ATOM 298 O2 DC B 10 -3.888 8.311 4.476 1.00 0.00 O ATOM 299 N3 DC B 10 -1.688 8.528 4.079 1.00 0.00 N ATOM 300 C4 DC B 10 -0.427 8.299 4.481 1.00 0.00 C ATOM 301 N4 DC B 10 0.585 8.764 3.757 1.00 0.00 N ATOM 302 C5 DC B 10 -0.141 7.669 5.727 1.00 0.00 C ATOM 303 C6 DC B 10 -1.192 7.350 6.496 1.00 0.00 C ATOM 0 H5' DC B 10 -3.783 5.559 10.943 1.00 0.00 H new ATOM 0 H5'' DC B 10 -2.457 6.456 10.230 1.00 0.00 H new ATOM 0 H4' DC B 10 -5.325 6.964 9.427 1.00 0.00 H new ATOM 0 H3' DC B 10 -4.080 4.388 9.017 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.173 5.595 7.915 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.127 4.901 6.619 1.00 0.00 H new ATOM 0 H1' DC B 10 -4.421 7.097 6.339 1.00 0.00 H new ATOM 0 H41 DC B 10 1.546 8.595 4.055 1.00 0.00 H new ATOM 0 H42 DC B 10 0.401 9.290 2.903 1.00 0.00 H new ATOM 0 H5 DC B 10 0.872 7.459 6.036 1.00 0.00 H new ATOM 0 H6 DC B 10 -1.006 6.873 7.447 1.00 0.00 H new ATOM 315 P DG B 11 -6.105 3.597 7.606 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.189 3.364 8.584 1.00 0.00 O ATOM 317 OP2 DG B 11 -4.975 2.649 7.504 1.00 0.00 O ATOM 318 O5' DG B 11 -6.739 3.797 6.154 1.00 0.00 O ATOM 319 C5' DG B 11 -7.710 4.789 5.908 1.00 0.00 C ATOM 320 C4' DG B 11 -8.028 4.825 4.411 1.00 0.00 C ATOM 321 O4' DG B 11 -6.988 5.524 3.753 1.00 0.00 O ATOM 322 C3' DG B 11 -8.106 3.418 3.805 1.00 0.00 C ATOM 323 O3' DG B 11 -9.158 3.376 2.859 1.00 0.00 O ATOM 324 C2' DG B 11 -6.715 3.239 3.204 1.00 0.00 C ATOM 325 C1' DG B 11 -6.289 4.668 2.871 1.00 0.00 C ATOM 326 N9 DG B 11 -4.839 4.881 3.051 1.00 0.00 N ATOM 327 C8 DG B 11 -4.081 4.636 4.166 1.00 0.00 C ATOM 328 N7 DG B 11 -2.845 5.030 4.069 1.00 0.00 N ATOM 329 C5 DG B 11 -2.762 5.536 2.777 1.00 0.00 C ATOM 330 C6 DG B 11 -1.636 6.022 2.056 1.00 0.00 C ATOM 331 O6 DG B 11 -0.490 6.190 2.462 1.00 0.00 O ATOM 332 N1 DG B 11 -1.931 6.323 0.740 1.00 0.00 N ATOM 333 C2 DG B 11 -3.178 6.206 0.179 1.00 0.00 C ATOM 334 N2 DG B 11 -3.304 6.478 -1.113 1.00 0.00 N ATOM 335 N3 DG B 11 -4.248 5.754 0.844 1.00 0.00 N ATOM 336 C4 DG B 11 -3.971 5.429 2.135 1.00 0.00 C ATOM 0 H5' DG B 11 -7.344 5.762 6.237 1.00 0.00 H new ATOM 0 H5'' DG B 11 -8.614 4.578 6.479 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.996 5.310 4.283 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.335 2.613 4.503 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.030 2.769 3.909 1.00 0.00 H new ATOM 0 H2'' DG B 11 -6.739 2.609 2.315 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.516 4.870 1.824 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.476 4.157 5.050 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.171 6.654 0.146 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.216 6.402 -1.564 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.489 6.763 -1.656 1.00 0.00 H new ATOM 348 P DT B 12 -9.648 1.995 2.183 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.008 2.209 1.643 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.403 0.898 3.144 1.00 0.00 O ATOM 351 O5' DT B 12 -8.636 1.835 0.945 1.00 0.00 O ATOM 352 C5' DT B 12 -8.717 2.709 -0.160 1.00 0.00 C ATOM 353 C4' DT B 12 -7.542 2.500 -1.115 1.00 0.00 C ATOM 354 O4' DT B 12 -6.304 2.783 -0.505 1.00 0.00 O ATOM 355 C3' DT B 12 -7.400 1.057 -1.633 1.00 0.00 C ATOM 356 O3' DT B 12 -8.109 0.814 -2.846 1.00 0.00 O ATOM 357 C2' DT B 12 -5.883 0.819 -1.669 1.00 0.00 C ATOM 358 C1' DT B 12 -5.317 2.200 -1.335 1.00 0.00 C ATOM 359 N1 DT B 12 -4.027 2.192 -0.617 1.00 0.00 N ATOM 360 C2 DT B 12 -3.018 3.109 -0.861 1.00 0.00 C ATOM 361 O2 DT B 12 -2.960 3.776 -1.888 1.00 0.00 O ATOM 362 N3 DT B 12 -2.064 3.240 0.126 1.00 0.00 N ATOM 363 C4 DT B 12 -2.012 2.560 1.318 1.00 0.00 C ATOM 364 O4 DT B 12 -1.286 2.961 2.223 1.00 0.00 O ATOM 365 C5 DT B 12 -2.867 1.303 1.494 1.00 0.00 C ATOM 366 C7 DT B 12 -3.704 1.268 2.771 1.00 0.00 C ATOM 367 C6 DT B 12 -3.829 1.101 0.343 1.00 0.00 C ATOM 0 H5' DT B 12 -8.726 3.742 0.189 1.00 0.00 H new ATOM 0 H5'' DT B 12 -9.655 2.543 -0.691 1.00 0.00 H new ATOM 0 H4' DT B 12 -7.772 3.181 -1.934 1.00 0.00 H new ATOM 0 H3' DT B 12 -7.879 0.321 -0.987 1.00 0.00 H new ATOM 0 H2' DT B 12 -5.574 0.068 -0.942 1.00 0.00 H new ATOM 0 H2'' DT B 12 -5.551 0.471 -2.647 1.00 0.00 H new ATOM 0 H1' DT B 12 -5.107 2.737 -2.260 1.00 0.00 H new ATOM 0 H3 DT B 12 -1.318 3.913 -0.048 1.00 0.00 H new ATOM 0 H71 DT B 12 -4.613 0.692 2.595 1.00 0.00 H new ATOM 0 H72 DT B 12 -3.128 0.802 3.571 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.969 2.285 3.060 1.00 0.00 H new ATOM 0 H6 DT B 12 -4.361 0.168 0.230 1.00 0.00 H new ATOM 380 P DA B 13 -7.757 1.451 -4.306 1.00 0.00 P ATOM 381 OP1 DA B 13 -7.348 2.862 -4.153 1.00 0.00 O ATOM 382 OP2 DA B 13 -8.882 1.119 -5.206 1.00 0.00 O ATOM 383 O5' DA B 13 -6.474 0.622 -4.787 1.00 0.00 O ATOM 384 C5' DA B 13 -6.562 -0.763 -5.012 1.00 0.00 C ATOM 385 C4' DA B 13 -5.206 -1.279 -5.491 1.00 0.00 C ATOM 386 O4' DA B 13 -4.255 -1.340 -4.443 1.00 0.00 O ATOM 387 C3' DA B 13 -5.370 -2.702 -6.019 1.00 0.00 C ATOM 388 O3' DA B 13 -4.452 -2.979 -7.056 1.00 0.00 O ATOM 389 C2' DA B 13 -4.990 -3.472 -4.767 1.00 0.00 C ATOM 390 C1' DA B 13 -3.774 -2.666 -4.310 1.00 0.00 C ATOM 391 N9 DA B 13 -3.392 -2.928 -2.907 1.00 0.00 N ATOM 392 C8 DA B 13 -4.206 -2.843 -1.813 1.00 0.00 C ATOM 393 N7 DA B 13 -3.662 -3.287 -0.710 1.00 0.00 N ATOM 394 C5 DA B 13 -2.334 -3.503 -1.073 1.00 0.00 C ATOM 395 C6 DA B 13 -1.172 -3.805 -0.332 1.00 0.00 C ATOM 396 N6 DA B 13 -1.183 -4.159 0.952 1.00 0.00 N ATOM 397 N1 DA B 13 0.025 -3.625 -0.902 1.00 0.00 N ATOM 398 C2 DA B 13 0.074 -3.318 -2.190 1.00 0.00 C ATOM 399 N3 DA B 13 -0.936 -3.110 -3.034 1.00 0.00 N ATOM 400 C4 DA B 13 -2.136 -3.189 -2.395 1.00 0.00 C ATOM 0 H5' DA B 13 -7.329 -0.975 -5.757 1.00 0.00 H new ATOM 0 H5'' DA B 13 -6.857 -1.275 -4.096 1.00 0.00 H new ATOM 0 H4' DA B 13 -4.855 -0.588 -6.258 1.00 0.00 H new ATOM 0 H3' DA B 13 -6.349 -2.924 -6.443 1.00 0.00 H new ATOM 0 H2' DA B 13 -5.788 -3.478 -4.024 1.00 0.00 H new ATOM 0 H2'' DA B 13 -4.743 -4.513 -4.978 1.00 0.00 H new ATOM 0 H1' DA B 13 -2.876 -2.903 -4.881 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.209 -2.445 -1.855 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.307 -4.365 1.432 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.068 -4.224 1.455 1.00 0.00 H new ATOM 0 H2 DA B 13 1.064 -3.224 -2.612 1.00 0.00 H new ATOM 412 P DC B 14 -4.691 -2.471 -8.565 1.00 0.00 P ATOM 413 OP1 DC B 14 -4.602 -0.995 -8.587 1.00 0.00 O ATOM 414 OP2 DC B 14 -5.913 -3.133 -9.070 1.00 0.00 O ATOM 415 O5' DC B 14 -3.421 -3.074 -9.345 1.00 0.00 O ATOM 416 C5' DC B 14 -3.235 -4.468 -9.457 1.00 0.00 C ATOM 417 C4' DC B 14 -2.017 -4.923 -8.647 1.00 0.00 C ATOM 418 O4' DC B 14 -2.156 -4.729 -7.240 1.00 0.00 O ATOM 419 C3' DC B 14 -1.821 -6.428 -8.860 1.00 0.00 C ATOM 420 O3' DC B 14 -0.671 -6.672 -9.643 1.00 0.00 O ATOM 421 C2' DC B 14 -1.713 -6.931 -7.426 1.00 0.00 C ATOM 422 C1' DC B 14 -1.331 -5.705 -6.620 1.00 0.00 C ATOM 423 N1 DC B 14 -1.624 -5.960 -5.181 1.00 0.00 N ATOM 424 C2 DC B 14 -0.566 -6.163 -4.303 1.00 0.00 C ATOM 425 O2 DC B 14 0.605 -6.090 -4.669 1.00 0.00 O ATOM 426 N3 DC B 14 -0.827 -6.454 -3.001 1.00 0.00 N ATOM 427 C4 DC B 14 -2.082 -6.628 -2.580 1.00 0.00 C ATOM 428 N4 DC B 14 -2.299 -6.870 -1.295 1.00 0.00 N ATOM 429 C5 DC B 14 -3.188 -6.524 -3.475 1.00 0.00 C ATOM 430 C6 DC B 14 -2.901 -6.204 -4.755 1.00 0.00 C ATOM 0 H5' DC B 14 -3.102 -4.738 -10.505 1.00 0.00 H new ATOM 0 H5'' DC B 14 -4.126 -4.987 -9.104 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.178 -4.321 -8.996 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.615 -6.931 -9.412 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.657 -7.354 -7.082 1.00 0.00 H new ATOM 0 H2'' DC B 14 -0.961 -7.715 -7.336 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.283 -5.407 -6.617 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.251 -7.006 -0.955 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.514 -6.921 -0.646 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.203 -6.693 -3.146 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.709 -6.138 -5.469 1.00 0.00 H new ATOM 442 P DG B 15 -0.218 -8.170 -10.030 1.00 0.00 P ATOM 443 OP1 DG B 15 0.457 -8.119 -11.345 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.374 -9.070 -9.834 1.00 0.00 O ATOM 445 O5' DG B 15 0.875 -8.499 -8.889 1.00 0.00 O ATOM 446 C5' DG B 15 2.149 -7.897 -8.933 1.00 0.00 C ATOM 447 C4' DG B 15 3.202 -8.400 -7.932 1.00 0.00 C ATOM 448 O4' DG B 15 2.722 -8.085 -6.642 1.00 0.00 O ATOM 449 C3' DG B 15 3.523 -9.915 -7.963 1.00 0.00 C ATOM 450 O3' DG B 15 4.828 -10.104 -7.416 1.00 0.00 O ATOM 451 C2' DG B 15 2.392 -10.352 -7.050 1.00 0.00 C ATOM 452 C1' DG B 15 2.590 -9.306 -5.962 1.00 0.00 C ATOM 453 N9 DG B 15 1.502 -9.290 -4.996 1.00 0.00 N ATOM 454 C8 DG B 15 0.212 -9.622 -5.218 1.00 0.00 C ATOM 455 N7 DG B 15 -0.521 -9.666 -4.136 1.00 0.00 N ATOM 456 C5 DG B 15 0.391 -9.384 -3.108 1.00 0.00 C ATOM 457 C6 DG B 15 0.272 -9.421 -1.679 1.00 0.00 C ATOM 458 O6 DG B 15 -0.737 -9.548 -0.989 1.00 0.00 O ATOM 459 N1 DG B 15 1.499 -9.294 -1.036 1.00 0.00 N ATOM 460 C2 DG B 15 2.699 -9.134 -1.681 1.00 0.00 C ATOM 461 N2 DG B 15 3.820 -9.077 -0.980 1.00 0.00 N ATOM 462 N3 DG B 15 2.822 -9.075 -3.000 1.00 0.00 N ATOM 463 C4 DG B 15 1.639 -9.197 -3.644 1.00 0.00 C ATOM 0 H5' DG B 15 2.021 -6.826 -8.778 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.549 -8.028 -9.938 1.00 0.00 H new ATOM 0 H4' DG B 15 4.136 -7.911 -8.209 1.00 0.00 H new ATOM 0 H3' DG B 15 3.559 -10.444 -8.915 1.00 0.00 H new ATOM 0 H2' DG B 15 1.413 -10.292 -7.526 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.508 -11.373 -6.686 1.00 0.00 H new ATOM 0 H1' DG B 15 3.472 -9.524 -5.360 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.180 -9.833 -6.202 1.00 0.00 H new ATOM 0 H1 DG B 15 1.507 -9.322 -0.016 1.00 0.00 H new ATOM 0 H21 DG B 15 4.714 -8.958 -1.457 1.00 0.00 H new ATOM 0 H22 DG B 15 3.790 -9.152 0.037 1.00 0.00 H new ATOM 475 P DC B 16 5.772 -11.401 -7.685 1.00 0.00 P ATOM 476 OP1 DC B 16 7.099 -11.100 -7.107 1.00 0.00 O ATOM 477 OP2 DC B 16 5.666 -11.737 -9.120 1.00 0.00 O ATOM 478 O5' DC B 16 5.150 -12.631 -6.834 1.00 0.00 O ATOM 479 C5' DC B 16 4.668 -12.464 -5.516 1.00 0.00 C ATOM 480 C4' DC B 16 5.687 -12.437 -4.373 1.00 0.00 C ATOM 481 O4' DC B 16 5.215 -11.489 -3.427 1.00 0.00 O ATOM 482 C3' DC B 16 5.805 -13.781 -3.638 1.00 0.00 C ATOM 483 O3' DC B 16 6.985 -14.475 -3.982 1.00 0.00 O ATOM 484 C2' DC B 16 5.801 -13.367 -2.174 1.00 0.00 C ATOM 485 C1' DC B 16 4.946 -12.098 -2.173 1.00 0.00 C ATOM 486 N1 DC B 16 3.494 -12.347 -1.903 1.00 0.00 N ATOM 487 C2 DC B 16 3.097 -12.600 -0.588 1.00 0.00 C ATOM 488 O2 DC B 16 3.915 -12.622 0.330 1.00 0.00 O ATOM 489 N3 DC B 16 1.779 -12.827 -0.313 1.00 0.00 N ATOM 490 C4 DC B 16 0.871 -12.793 -1.295 1.00 0.00 C ATOM 491 N4 DC B 16 -0.404 -13.006 -1.002 1.00 0.00 N ATOM 492 C5 DC B 16 1.225 -12.418 -2.625 1.00 0.00 C ATOM 493 C6 DC B 16 2.532 -12.190 -2.868 1.00 0.00 C ATOM 0 H5' DC B 16 3.962 -13.270 -5.315 1.00 0.00 H new ATOM 0 H5'' DC B 16 4.105 -11.531 -5.483 1.00 0.00 H new ATOM 0 H4' DC B 16 6.663 -12.199 -4.795 1.00 0.00 H new ATOM 0 H3' DC B 16 5.004 -14.475 -3.892 1.00 0.00 H new ATOM 0 H2' DC B 16 5.373 -14.142 -1.538 1.00 0.00 H new ATOM 0 H2'' DC B 16 6.809 -13.174 -1.807 1.00 0.00 H new ATOM 0 HO3' DC B 16 7.021 -15.323 -3.491 1.00 0.00 H new ATOM 0 H1' DC B 16 5.205 -11.434 -1.348 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.108 -12.983 -1.740 1.00 0.00 H new ATOM 0 H42 DC B 16 -0.681 -13.193 -0.038 1.00 0.00 H new ATOM 0 H5 DC B 16 0.481 -12.321 -3.402 1.00 0.00 H new ATOM 0 H6 DC B 16 2.831 -11.873 -3.856 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO B 1 -1.065 0.118 -1.594 1.00 0.00 O HETATM 508 C2 PSO B 1 -2.319 0.063 -1.501 1.00 0.00 C HETATM 509 C3 PSO B 1 -3.068 -0.098 -0.187 1.00 0.00 C HETATM 510 C4 PSO B 1 -2.218 -0.016 1.034 1.00 0.00 C HETATM 511 C5 PSO B 1 -0.003 0.290 1.862 1.00 0.00 C HETATM 512 C6 PSO B 1 1.369 0.497 1.648 1.00 0.00 C HETATM 513 C7 PSO B 1 1.864 0.503 0.393 1.00 0.00 C HETATM 514 C8 PSO B 1 1.028 0.204 -0.692 1.00 0.00 C HETATM 515 C9 PSO B 1 -0.369 0.164 -0.527 1.00 0.00 C HETATM 516 C10 PSO B 1 -0.863 0.140 0.767 1.00 0.00 C HETATM 517 C4' PSO B 1 2.482 0.199 2.599 1.00 0.00 C HETATM 518 C5' PSO B 1 3.637 0.471 1.653 1.00 0.00 C HETATM 519 O6' PSO B 1 3.112 0.592 0.324 1.00 0.00 O HETATM 520 O11 PSO B 1 -2.969 0.143 -2.535 1.00 0.00 O HETATM 521 C12 PSO B 1 -2.491 -1.159 2.021 1.00 0.00 C HETATM 522 C13 PSO B 1 2.450 0.980 3.921 1.00 0.00 C HETATM 523 O14 PSO B 1 2.073 2.334 3.812 1.00 0.00 O HETATM 524 C15 PSO B 1 4.412 1.666 2.205 1.00 0.00 C HETATM 525 C16 PSO B 1 1.623 -0.089 -2.046 1.00 0.00 C HETATM 0 H163 PSO B 1 2.196 0.774 -2.386 1.00 0.00 H new HETATM 0 H162 PSO B 1 2.280 -0.956 -1.975 1.00 0.00 H new HETATM 0 H161 PSO B 1 0.824 -0.297 -2.757 1.00 0.00 H new HETATM 0 H153 PSO B 1 3.753 2.533 2.260 1.00 0.00 H new HETATM 0 H152 PSO B 1 4.784 1.429 3.202 1.00 0.00 H new HETATM 0 H151 PSO B 1 5.252 1.890 1.548 1.00 0.00 H new HETATM 0 H132 PSO B 1 1.760 0.482 4.602 1.00 0.00 H new HETATM 0 H131 PSO B 1 3.439 0.931 4.377 1.00 0.00 H new HETATM 0 H123 PSO B 1 -3.534 -1.126 2.337 1.00 0.00 H new HETATM 0 H122 PSO B 1 -2.289 -2.114 1.536 1.00 0.00 H new HETATM 0 H121 PSO B 1 -1.845 -1.050 2.892 1.00 0.00 H new HETATM 0 H5 PSO B 1 -0.398 0.246 2.877 1.00 0.00 H new HETATM 0 H14 PSO B 1 2.080 2.748 4.700 1.00 0.00 H new