USER MOD reduce.3.24.130724 H: found=0, std=0, add=196, rem=0, adj=6 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 Single : A 1 DG O5' : rot 180:sc= -0.0093 USER MOD Single : A 4 DT C7 :methyl -30:sc= -1.58! (180deg=-3.34!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot -55:sc= 0.96 USER MOD Single : B 9 DG O5' : rot 180:sc= -0.0484 USER MOD Single : B 12 DT C7 :methyl 150:sc= -2.33! (180deg=-2.33!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.923 -11.791 9.181 1.00 0.00 O ATOM 2 C5' DG A 1 -2.107 -12.571 10.028 1.00 0.00 C ATOM 3 C4' DG A 1 -0.614 -12.227 9.899 1.00 0.00 C ATOM 4 O4' DG A 1 -0.004 -12.831 8.757 1.00 0.00 O ATOM 5 C3' DG A 1 -0.337 -10.741 9.818 1.00 0.00 C ATOM 6 O3' DG A 1 0.857 -10.448 10.522 1.00 0.00 O ATOM 7 C2' DG A 1 -0.240 -10.546 8.327 1.00 0.00 C ATOM 8 C1' DG A 1 0.302 -11.847 7.771 1.00 0.00 C ATOM 9 N9 DG A 1 -0.343 -12.172 6.474 1.00 0.00 N ATOM 10 C8 DG A 1 -1.631 -12.601 6.281 1.00 0.00 C ATOM 11 N7 DG A 1 -1.974 -12.761 5.039 1.00 0.00 N ATOM 12 C5 DG A 1 -0.818 -12.440 4.342 1.00 0.00 C ATOM 13 C6 DG A 1 -0.576 -12.468 2.940 1.00 0.00 C ATOM 14 O6 DG A 1 -1.374 -12.718 2.042 1.00 0.00 O ATOM 15 N1 DG A 1 0.734 -12.170 2.616 1.00 0.00 N ATOM 16 C2 DG A 1 1.700 -11.836 3.533 1.00 0.00 C ATOM 17 N2 DG A 1 2.923 -11.600 3.067 1.00 0.00 N ATOM 18 N3 DG A 1 1.476 -11.765 4.857 1.00 0.00 N ATOM 19 C4 DG A 1 0.198 -12.093 5.202 1.00 0.00 C ATOM 0 H5' DG A 1 -2.254 -13.626 9.796 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.421 -12.426 11.062 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.183 -12.627 10.817 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.078 -10.080 10.267 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.216 -10.315 7.899 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.420 -9.713 8.084 1.00 0.00 H new ATOM 0 HO5' DG A 1 -3.861 -12.050 9.300 1.00 0.00 H new ATOM 0 H1' DG A 1 1.373 -11.794 7.575 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.309 -12.791 7.100 1.00 0.00 H new ATOM 0 H1 DG A 1 1.001 -12.200 1.632 1.00 0.00 H new ATOM 0 H21 DG A 1 3.674 -11.348 3.710 1.00 0.00 H new ATOM 0 H22 DG A 1 3.110 -11.671 2.067 1.00 0.00 H new ATOM 32 P DC A 2 1.394 -8.944 10.738 1.00 0.00 P ATOM 33 OP1 DC A 2 2.085 -8.887 12.044 1.00 0.00 O ATOM 34 OP2 DC A 2 0.291 -8.003 10.447 1.00 0.00 O ATOM 35 O5' DC A 2 2.500 -8.808 9.579 1.00 0.00 O ATOM 36 C5' DC A 2 3.587 -9.704 9.522 1.00 0.00 C ATOM 37 C4' DC A 2 4.623 -9.278 8.479 1.00 0.00 C ATOM 38 O4' DC A 2 4.164 -9.446 7.140 1.00 0.00 O ATOM 39 C3' DC A 2 5.028 -7.813 8.619 1.00 0.00 C ATOM 40 O3' DC A 2 6.418 -7.826 8.366 1.00 0.00 O ATOM 41 C2' DC A 2 4.136 -7.147 7.568 1.00 0.00 C ATOM 42 C1' DC A 2 4.045 -8.201 6.456 1.00 0.00 C ATOM 43 N1 DC A 2 2.733 -8.248 5.724 1.00 0.00 N ATOM 44 C2 DC A 2 2.725 -8.600 4.376 1.00 0.00 C ATOM 45 O2 DC A 2 3.778 -8.790 3.772 1.00 0.00 O ATOM 46 N3 DC A 2 1.537 -8.740 3.709 1.00 0.00 N ATOM 47 C4 DC A 2 0.379 -8.549 4.358 1.00 0.00 C ATOM 48 N4 DC A 2 -0.764 -8.784 3.722 1.00 0.00 N ATOM 49 C5 DC A 2 0.341 -8.220 5.746 1.00 0.00 C ATOM 50 C6 DC A 2 1.532 -8.110 6.375 1.00 0.00 C ATOM 0 H5' DC A 2 3.222 -10.703 9.284 1.00 0.00 H new ATOM 0 H5'' DC A 2 4.061 -9.763 10.502 1.00 0.00 H new ATOM 0 H4' DC A 2 5.474 -9.932 8.672 1.00 0.00 H new ATOM 0 H3' DC A 2 4.894 -7.286 9.564 1.00 0.00 H new ATOM 0 H2' DC A 2 3.153 -6.903 7.972 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.571 -6.216 7.204 1.00 0.00 H new ATOM 0 H1' DC A 2 4.805 -7.974 5.709 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.653 -8.643 4.202 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.752 -9.105 2.754 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.592 -8.067 6.267 1.00 0.00 H new ATOM 0 H6 DC A 2 1.539 -7.905 7.435 1.00 0.00 H new ATOM 62 P DG A 3 7.292 -6.496 8.236 1.00 0.00 P ATOM 63 OP1 DG A 3 8.698 -6.820 8.557 1.00 0.00 O ATOM 64 OP2 DG A 3 6.599 -5.396 8.941 1.00 0.00 O ATOM 65 O5' DG A 3 7.153 -6.289 6.655 1.00 0.00 O ATOM 66 C5' DG A 3 7.662 -7.246 5.748 1.00 0.00 C ATOM 67 C4' DG A 3 7.754 -6.641 4.349 1.00 0.00 C ATOM 68 O4' DG A 3 6.459 -6.683 3.788 1.00 0.00 O ATOM 69 C3' DG A 3 8.224 -5.181 4.411 1.00 0.00 C ATOM 70 O3' DG A 3 9.088 -4.901 3.329 1.00 0.00 O ATOM 71 C2' DG A 3 6.876 -4.467 4.350 1.00 0.00 C ATOM 72 C1' DG A 3 6.052 -5.379 3.460 1.00 0.00 C ATOM 73 N9 DG A 3 4.597 -5.269 3.673 1.00 0.00 N ATOM 74 C8 DG A 3 3.895 -4.955 4.807 1.00 0.00 C ATOM 75 N7 DG A 3 2.613 -5.176 4.715 1.00 0.00 N ATOM 76 C5 DG A 3 2.441 -5.595 3.397 1.00 0.00 C ATOM 77 C6 DG A 3 1.257 -5.892 2.653 1.00 0.00 C ATOM 78 O6 DG A 3 0.096 -5.941 3.056 1.00 0.00 O ATOM 79 N1 DG A 3 1.522 -6.148 1.317 1.00 0.00 N ATOM 80 C2 DG A 3 2.781 -6.160 0.760 1.00 0.00 C ATOM 81 N2 DG A 3 2.927 -6.385 -0.539 1.00 0.00 N ATOM 82 N3 DG A 3 3.892 -5.904 1.449 1.00 0.00 N ATOM 83 C4 DG A 3 3.651 -5.624 2.752 1.00 0.00 C ATOM 0 H5' DG A 3 7.016 -8.124 5.732 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.647 -7.581 6.074 1.00 0.00 H new ATOM 0 H4' DG A 3 8.472 -7.203 3.751 1.00 0.00 H new ATOM 0 H3' DG A 3 8.816 -4.889 5.278 1.00 0.00 H new ATOM 0 H2' DG A 3 6.431 -4.358 5.339 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.967 -3.466 3.929 1.00 0.00 H new ATOM 0 H1' DG A 3 6.218 -5.106 2.418 1.00 0.00 H new ATOM 0 H8 DG A 3 4.362 -4.560 5.697 1.00 0.00 H new ATOM 0 H1 DG A 3 0.730 -6.341 0.704 1.00 0.00 H new ATOM 0 H21 DG A 3 3.859 -6.394 -0.953 1.00 0.00 H new ATOM 0 H22 DG A 3 2.107 -6.549 -1.123 1.00 0.00 H new ATOM 95 P DT A 4 9.822 -3.470 3.164 1.00 0.00 P ATOM 96 OP1 DT A 4 11.184 -3.709 2.642 1.00 0.00 O ATOM 97 OP2 DT A 4 9.632 -2.697 4.411 1.00 0.00 O ATOM 98 O5' DT A 4 8.943 -2.804 1.999 1.00 0.00 O ATOM 99 C5' DT A 4 8.943 -3.379 0.710 1.00 0.00 C ATOM 100 C4' DT A 4 7.617 -3.097 0.012 1.00 0.00 C ATOM 101 O4' DT A 4 6.518 -3.280 0.878 1.00 0.00 O ATOM 102 C3' DT A 4 7.469 -1.663 -0.508 1.00 0.00 C ATOM 103 O3' DT A 4 7.960 -1.555 -1.838 1.00 0.00 O ATOM 104 C2' DT A 4 5.959 -1.445 -0.403 1.00 0.00 C ATOM 105 C1' DT A 4 5.410 -2.692 0.229 1.00 0.00 C ATOM 106 N1 DT A 4 4.301 -2.440 1.171 1.00 0.00 N ATOM 107 C2 DT A 4 3.031 -2.927 0.928 1.00 0.00 C ATOM 108 O2 DT A 4 2.691 -3.376 -0.161 1.00 0.00 O ATOM 109 N3 DT A 4 2.146 -2.890 1.974 1.00 0.00 N ATOM 110 C4 DT A 4 2.311 -2.277 3.187 1.00 0.00 C ATOM 111 O4 DT A 4 1.504 -2.478 4.091 1.00 0.00 O ATOM 112 C5 DT A 4 3.509 -1.346 3.369 1.00 0.00 C ATOM 113 C7 DT A 4 4.161 -1.441 4.743 1.00 0.00 C ATOM 114 C6 DT A 4 4.554 -1.462 2.253 1.00 0.00 C ATOM 0 H5' DT A 4 9.103 -4.455 0.783 1.00 0.00 H new ATOM 0 H5'' DT A 4 9.766 -2.973 0.122 1.00 0.00 H new ATOM 0 H4' DT A 4 7.624 -3.802 -0.819 1.00 0.00 H new ATOM 0 H3' DT A 4 8.038 -0.914 0.043 1.00 0.00 H new ATOM 0 H2' DT A 4 5.732 -0.567 0.202 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.518 -1.278 -1.386 1.00 0.00 H new ATOM 0 H1' DT A 4 4.966 -3.343 -0.524 1.00 0.00 H new ATOM 0 H3 DT A 4 1.261 -3.376 1.832 1.00 0.00 H new ATOM 0 H71 DT A 4 3.410 -1.713 5.484 1.00 0.00 H new ATOM 0 H72 DT A 4 4.942 -2.201 4.723 1.00 0.00 H new ATOM 0 H73 DT A 4 4.598 -0.478 5.006 1.00 0.00 H new ATOM 0 H6 DT A 4 5.444 -0.851 2.256 1.00 0.00 H new ATOM 127 P DA A 5 7.160 -2.102 -3.157 1.00 0.00 P ATOM 128 OP1 DA A 5 6.454 -3.359 -2.831 1.00 0.00 O ATOM 129 OP2 DA A 5 8.112 -2.078 -4.289 1.00 0.00 O ATOM 130 O5' DA A 5 6.066 -0.937 -3.397 1.00 0.00 O ATOM 131 C5' DA A 5 6.480 0.411 -3.367 1.00 0.00 C ATOM 132 C4' DA A 5 5.572 1.303 -4.199 1.00 0.00 C ATOM 133 O4' DA A 5 4.338 1.321 -3.468 1.00 0.00 O ATOM 134 C3' DA A 5 6.116 2.742 -4.301 1.00 0.00 C ATOM 135 O3' DA A 5 6.082 3.406 -5.561 1.00 0.00 O ATOM 136 C2' DA A 5 5.315 3.405 -3.205 1.00 0.00 C ATOM 137 C1' DA A 5 4.010 2.635 -3.043 1.00 0.00 C ATOM 138 N9 DA A 5 3.435 2.780 -1.665 1.00 0.00 N ATOM 139 C8 DA A 5 4.064 2.923 -0.443 1.00 0.00 C ATOM 140 N7 DA A 5 3.278 3.151 0.571 1.00 0.00 N ATOM 141 C5 DA A 5 2.022 3.161 -0.015 1.00 0.00 C ATOM 142 C6 DA A 5 0.736 3.339 0.518 1.00 0.00 C ATOM 143 N6 DA A 5 0.574 3.499 1.826 1.00 0.00 N ATOM 144 N1 DA A 5 -0.333 3.301 -0.301 1.00 0.00 N ATOM 145 C2 DA A 5 -0.109 3.091 -1.597 1.00 0.00 C ATOM 146 N3 DA A 5 1.050 2.923 -2.224 1.00 0.00 N ATOM 147 C4 DA A 5 2.098 2.961 -1.366 1.00 0.00 C ATOM 0 H5' DA A 5 7.502 0.485 -3.740 1.00 0.00 H new ATOM 0 H5'' DA A 5 6.490 0.765 -2.336 1.00 0.00 H new ATOM 0 H4' DA A 5 5.480 0.933 -5.220 1.00 0.00 H new ATOM 0 H3' DA A 5 7.200 2.776 -4.190 1.00 0.00 H new ATOM 0 H2' DA A 5 5.876 3.405 -2.270 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.114 4.446 -3.457 1.00 0.00 H new ATOM 0 H1' DA A 5 3.184 3.015 -3.644 1.00 0.00 H new ATOM 0 H8 DA A 5 5.136 2.851 -0.335 1.00 0.00 H new ATOM 0 H61 DA A 5 -0.361 3.628 2.212 1.00 0.00 H new ATOM 0 H62 DA A 5 1.385 3.493 2.445 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.988 3.052 -2.223 1.00 0.00 H new ATOM 159 P DC A 6 4.856 3.464 -6.604 1.00 0.00 P ATOM 160 OP1 DC A 6 4.382 2.086 -6.850 1.00 0.00 O ATOM 161 OP2 DC A 6 5.304 4.278 -7.754 1.00 0.00 O ATOM 162 O5' DC A 6 3.668 4.279 -5.886 1.00 0.00 O ATOM 163 C5' DC A 6 2.351 3.940 -6.244 1.00 0.00 C ATOM 164 C4' DC A 6 1.257 4.944 -5.889 1.00 0.00 C ATOM 165 O4' DC A 6 0.924 4.951 -4.495 1.00 0.00 O ATOM 166 C3' DC A 6 1.507 6.406 -6.301 1.00 0.00 C ATOM 167 O3' DC A 6 0.447 6.808 -7.158 1.00 0.00 O ATOM 168 C2' DC A 6 1.496 7.155 -4.965 1.00 0.00 C ATOM 169 C1' DC A 6 0.738 6.276 -3.981 1.00 0.00 C ATOM 170 N1 DC A 6 1.204 6.379 -2.571 1.00 0.00 N ATOM 171 C2 DC A 6 0.255 6.592 -1.573 1.00 0.00 C ATOM 172 O2 DC A 6 -0.924 6.813 -1.823 1.00 0.00 O ATOM 173 N3 DC A 6 0.625 6.558 -0.271 1.00 0.00 N ATOM 174 C4 DC A 6 1.903 6.389 0.062 1.00 0.00 C ATOM 175 N4 DC A 6 2.173 6.240 1.352 1.00 0.00 N ATOM 176 C5 DC A 6 2.914 6.193 -0.936 1.00 0.00 C ATOM 177 C6 DC A 6 2.514 6.193 -2.229 1.00 0.00 C ATOM 0 H5' DC A 6 2.105 2.989 -5.771 1.00 0.00 H new ATOM 0 H5'' DC A 6 2.324 3.776 -7.321 1.00 0.00 H new ATOM 0 H4' DC A 6 0.432 4.565 -6.492 1.00 0.00 H new ATOM 0 H3' DC A 6 2.434 6.586 -6.845 1.00 0.00 H new ATOM 0 H2' DC A 6 2.512 7.340 -4.616 1.00 0.00 H new ATOM 0 H2'' DC A 6 1.013 8.126 -5.069 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.306 6.584 -3.917 1.00 0.00 H new ATOM 0 H41 DC A 6 3.136 6.107 1.659 1.00 0.00 H new ATOM 0 H42 DC A 6 1.417 6.258 2.037 1.00 0.00 H new ATOM 0 H5 DC A 6 3.950 6.051 -0.667 1.00 0.00 H new ATOM 0 H6 DC A 6 3.247 6.043 -3.008 1.00 0.00 H new ATOM 189 P DG A 7 0.280 8.323 -7.709 1.00 0.00 P ATOM 190 OP1 DG A 7 -0.444 8.260 -8.997 1.00 0.00 O ATOM 191 OP2 DG A 7 1.601 8.983 -7.642 1.00 0.00 O ATOM 192 O5' DG A 7 -0.697 9.014 -6.614 1.00 0.00 O ATOM 193 C5' DG A 7 -2.031 8.569 -6.471 1.00 0.00 C ATOM 194 C4' DG A 7 -2.873 9.396 -5.491 1.00 0.00 C ATOM 195 O4' DG A 7 -2.398 9.255 -4.166 1.00 0.00 O ATOM 196 C3' DG A 7 -2.877 10.890 -5.820 1.00 0.00 C ATOM 197 O3' DG A 7 -4.207 11.347 -5.628 1.00 0.00 O ATOM 198 C2' DG A 7 -1.852 11.427 -4.833 1.00 0.00 C ATOM 199 C1' DG A 7 -2.076 10.527 -3.627 1.00 0.00 C ATOM 200 N9 DG A 7 -0.942 10.334 -2.701 1.00 0.00 N ATOM 201 C8 DG A 7 0.392 10.208 -2.983 1.00 0.00 C ATOM 202 N7 DG A 7 1.124 9.880 -1.954 1.00 0.00 N ATOM 203 C5 DG A 7 0.208 9.786 -0.905 1.00 0.00 C ATOM 204 C6 DG A 7 0.396 9.501 0.484 1.00 0.00 C ATOM 205 O6 DG A 7 1.447 9.284 1.079 1.00 0.00 O ATOM 206 N1 DG A 7 -0.793 9.480 1.200 1.00 0.00 N ATOM 207 C2 DG A 7 -2.023 9.734 0.653 1.00 0.00 C ATOM 208 N2 DG A 7 -3.081 9.702 1.454 1.00 0.00 N ATOM 209 N3 DG A 7 -2.210 10.037 -0.637 1.00 0.00 N ATOM 210 C4 DG A 7 -1.060 10.040 -1.362 1.00 0.00 C ATOM 0 H5' DG A 7 -2.021 7.531 -6.137 1.00 0.00 H new ATOM 0 H5'' DG A 7 -2.513 8.585 -7.448 1.00 0.00 H new ATOM 0 H4' DG A 7 -3.887 9.008 -5.586 1.00 0.00 H new ATOM 0 H3' DG A 7 -2.613 11.196 -6.832 1.00 0.00 H new ATOM 0 H2' DG A 7 -0.835 11.349 -5.217 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.024 12.477 -4.597 1.00 0.00 H new ATOM 0 H1' DG A 7 -2.841 11.012 -3.020 1.00 0.00 H new ATOM 0 H8 DG A 7 0.802 10.366 -3.970 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.748 9.262 2.195 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.011 9.887 1.078 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.964 9.493 2.445 1.00 0.00 H new ATOM 222 P DC A 8 -4.677 12.851 -5.958 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.102 12.813 -6.351 1.00 0.00 O ATOM 224 OP2 DC A 8 -3.678 13.454 -6.866 1.00 0.00 O ATOM 225 O5' DC A 8 -4.565 13.563 -4.523 1.00 0.00 O ATOM 226 C5' DC A 8 -5.576 13.434 -3.541 1.00 0.00 C ATOM 227 C4' DC A 8 -5.079 14.016 -2.210 1.00 0.00 C ATOM 228 O4' DC A 8 -4.059 13.167 -1.693 1.00 0.00 O ATOM 229 C3' DC A 8 -4.460 15.418 -2.384 1.00 0.00 C ATOM 230 O3' DC A 8 -4.785 16.280 -1.313 1.00 0.00 O ATOM 231 C2' DC A 8 -2.977 15.075 -2.374 1.00 0.00 C ATOM 232 C1' DC A 8 -3.000 14.004 -1.282 1.00 0.00 C ATOM 233 N1 DC A 8 -1.712 13.331 -1.012 1.00 0.00 N ATOM 234 C2 DC A 8 -1.394 12.956 0.293 1.00 0.00 C ATOM 235 O2 DC A 8 -2.260 12.868 1.160 1.00 0.00 O ATOM 236 N3 DC A 8 -0.093 12.683 0.610 1.00 0.00 N ATOM 237 C4 DC A 8 0.870 12.828 -0.310 1.00 0.00 C ATOM 238 N4 DC A 8 2.119 12.524 0.011 1.00 0.00 N ATOM 239 C5 DC A 8 0.559 13.240 -1.643 1.00 0.00 C ATOM 240 C6 DC A 8 -0.730 13.450 -1.930 1.00 0.00 C ATOM 0 H5' DC A 8 -5.842 12.385 -3.414 1.00 0.00 H new ATOM 0 H5'' DC A 8 -6.478 13.954 -3.863 1.00 0.00 H new ATOM 0 H4' DC A 8 -5.938 14.088 -1.543 1.00 0.00 H new ATOM 0 H3' DC A 8 -4.807 15.948 -3.271 1.00 0.00 H new ATOM 0 H2' DC A 8 -2.624 14.695 -3.333 1.00 0.00 H new ATOM 0 H2'' DC A 8 -2.347 15.927 -2.118 1.00 0.00 H new ATOM 0 HO3' DC A 8 -4.372 17.156 -1.462 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.164 14.424 -0.290 1.00 0.00 H new ATOM 0 H41 DC A 8 2.863 12.629 -0.679 1.00 0.00 H new ATOM 0 H42 DC A 8 2.337 12.185 0.948 1.00 0.00 H new ATOM 0 H5 DC A 8 1.331 13.376 -2.386 1.00 0.00 H new ATOM 0 H6 DC A 8 -0.997 13.727 -2.939 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 3.711 10.040 9.851 1.00 0.00 O ATOM 255 C5' DG B 9 3.317 11.309 10.327 1.00 0.00 C ATOM 256 C4' DG B 9 1.790 11.495 10.342 1.00 0.00 C ATOM 257 O4' DG B 9 1.281 12.018 9.121 1.00 0.00 O ATOM 258 C3' DG B 9 1.013 10.226 10.620 1.00 0.00 C ATOM 259 O3' DG B 9 -0.111 10.564 11.419 1.00 0.00 O ATOM 260 C2' DG B 9 0.652 9.735 9.222 1.00 0.00 C ATOM 261 C1' DG B 9 0.667 10.989 8.354 1.00 0.00 C ATOM 262 N9 DG B 9 1.365 10.867 7.049 1.00 0.00 N ATOM 263 C8 DG B 9 2.684 10.575 6.793 1.00 0.00 C ATOM 264 N7 DG B 9 3.041 10.721 5.550 1.00 0.00 N ATOM 265 C5 DG B 9 1.880 11.155 4.923 1.00 0.00 C ATOM 266 C6 DG B 9 1.656 11.531 3.567 1.00 0.00 C ATOM 267 O6 DG B 9 2.472 11.573 2.651 1.00 0.00 O ATOM 268 N1 DG B 9 0.340 11.882 3.315 1.00 0.00 N ATOM 269 C2 DG B 9 -0.646 11.898 4.270 1.00 0.00 C ATOM 270 N2 DG B 9 -1.879 12.219 3.894 1.00 0.00 N ATOM 271 N3 DG B 9 -0.441 11.587 5.556 1.00 0.00 N ATOM 272 C4 DG B 9 0.845 11.227 5.822 1.00 0.00 C ATOM 0 H5' DG B 9 3.766 12.081 9.702 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.705 11.450 11.336 1.00 0.00 H new ATOM 0 H4' DG B 9 1.645 12.201 11.159 1.00 0.00 H new ATOM 0 H3' DG B 9 1.543 9.450 11.173 1.00 0.00 H new ATOM 0 H2' DG B 9 1.370 8.997 8.864 1.00 0.00 H new ATOM 0 H2'' DG B 9 -0.328 9.258 9.211 1.00 0.00 H new ATOM 0 HO5' DG B 9 4.689 9.976 9.861 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.369 11.199 8.088 1.00 0.00 H new ATOM 0 H8 DG B 9 3.369 10.250 7.562 1.00 0.00 H new ATOM 0 H1 DG B 9 0.088 12.145 2.362 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.633 12.239 4.581 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.072 12.445 2.918 1.00 0.00 H new ATOM 285 P DC B 10 -1.110 9.460 12.038 1.00 0.00 P ATOM 286 OP1 DC B 10 -1.839 10.081 13.165 1.00 0.00 O ATOM 287 OP2 DC B 10 -0.350 8.210 12.251 1.00 0.00 O ATOM 288 O5' DC B 10 -2.146 9.242 10.829 1.00 0.00 O ATOM 289 C5' DC B 10 -2.994 10.292 10.411 1.00 0.00 C ATOM 290 C4' DC B 10 -3.595 9.970 9.043 1.00 0.00 C ATOM 291 O4' DC B 10 -2.598 9.973 8.032 1.00 0.00 O ATOM 292 C3' DC B 10 -4.269 8.591 8.996 1.00 0.00 C ATOM 293 O3' DC B 10 -5.615 8.805 8.622 1.00 0.00 O ATOM 294 C2' DC B 10 -3.429 7.854 7.939 1.00 0.00 C ATOM 295 C1' DC B 10 -2.957 9.003 7.070 1.00 0.00 C ATOM 296 N1 DC B 10 -1.845 8.670 6.142 1.00 0.00 N ATOM 297 C2 DC B 10 -1.952 8.941 4.777 1.00 0.00 C ATOM 298 O2 DC B 10 -3.007 9.340 4.285 1.00 0.00 O ATOM 299 N3 DC B 10 -0.864 8.762 3.966 1.00 0.00 N ATOM 300 C4 DC B 10 0.264 8.247 4.474 1.00 0.00 C ATOM 301 N4 DC B 10 1.351 8.213 3.711 1.00 0.00 N ATOM 302 C5 DC B 10 0.376 7.903 5.857 1.00 0.00 C ATOM 303 C6 DC B 10 -0.693 8.147 6.639 1.00 0.00 C ATOM 0 H5' DC B 10 -2.432 11.225 10.359 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.790 10.439 11.141 1.00 0.00 H new ATOM 0 H4' DC B 10 -4.339 10.747 8.870 1.00 0.00 H new ATOM 0 H3' DC B 10 -4.302 8.018 9.922 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.597 7.308 8.384 1.00 0.00 H new ATOM 0 H2'' DC B 10 -4.020 7.131 7.377 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.725 9.331 6.370 1.00 0.00 H new ATOM 0 H41 DC B 10 2.220 7.825 4.078 1.00 0.00 H new ATOM 0 H42 DC B 10 1.317 8.575 2.758 1.00 0.00 H new ATOM 0 H5 DC B 10 1.279 7.466 6.257 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.633 7.920 7.693 1.00 0.00 H new ATOM 315 P DG B 11 -6.649 7.597 8.410 1.00 0.00 P ATOM 316 OP1 DG B 11 -8.005 8.079 8.749 1.00 0.00 O ATOM 317 OP2 DG B 11 -6.108 6.393 9.077 1.00 0.00 O ATOM 318 O5' DG B 11 -6.566 7.387 6.816 1.00 0.00 O ATOM 319 C5' DG B 11 -7.027 8.375 5.915 1.00 0.00 C ATOM 320 C4' DG B 11 -7.623 7.737 4.650 1.00 0.00 C ATOM 321 O4' DG B 11 -6.604 7.543 3.695 1.00 0.00 O ATOM 322 C3' DG B 11 -8.268 6.370 4.905 1.00 0.00 C ATOM 323 O3' DG B 11 -9.371 6.219 4.031 1.00 0.00 O ATOM 324 C2' DG B 11 -7.103 5.425 4.632 1.00 0.00 C ATOM 325 C1' DG B 11 -6.326 6.166 3.544 1.00 0.00 C ATOM 326 N9 DG B 11 -4.865 6.003 3.633 1.00 0.00 N ATOM 327 C8 DG B 11 -4.094 5.749 4.731 1.00 0.00 C ATOM 328 N7 DG B 11 -2.810 5.814 4.519 1.00 0.00 N ATOM 329 C5 DG B 11 -2.722 6.109 3.159 1.00 0.00 C ATOM 330 C6 DG B 11 -1.587 6.204 2.299 1.00 0.00 C ATOM 331 O6 DG B 11 -0.400 6.080 2.591 1.00 0.00 O ATOM 332 N1 DG B 11 -1.935 6.469 0.984 1.00 0.00 N ATOM 333 C2 DG B 11 -3.230 6.593 0.533 1.00 0.00 C ATOM 334 N2 DG B 11 -3.451 6.836 -0.752 1.00 0.00 N ATOM 335 N3 DG B 11 -4.300 6.453 1.317 1.00 0.00 N ATOM 336 C4 DG B 11 -3.976 6.222 2.614 1.00 0.00 C ATOM 0 H5' DG B 11 -6.203 9.033 5.640 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.780 8.994 6.403 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.394 8.424 4.301 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.686 6.200 5.897 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.497 5.260 5.523 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.444 4.447 4.293 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.639 5.752 2.585 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.515 5.513 5.697 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.182 6.580 0.305 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.407 6.930 -1.096 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.665 6.929 -1.396 1.00 0.00 H new ATOM 348 P DT B 12 -10.328 4.926 4.086 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.656 5.310 3.563 1.00 0.00 O ATOM 350 OP2 DT B 12 -10.212 4.324 5.432 1.00 0.00 O ATOM 351 O5' DT B 12 -9.618 3.954 3.022 1.00 0.00 O ATOM 352 C5' DT B 12 -9.967 3.998 1.655 1.00 0.00 C ATOM 353 C4' DT B 12 -8.993 3.159 0.828 1.00 0.00 C ATOM 354 O4' DT B 12 -7.774 3.833 0.561 1.00 0.00 O ATOM 355 C3' DT B 12 -8.662 1.791 1.420 1.00 0.00 C ATOM 356 O3' DT B 12 -9.626 0.806 1.093 1.00 0.00 O ATOM 357 C2' DT B 12 -7.365 1.579 0.650 1.00 0.00 C ATOM 358 C1' DT B 12 -6.864 2.884 0.019 1.00 0.00 C ATOM 359 N1 DT B 12 -5.533 3.134 0.578 1.00 0.00 N ATOM 360 C2 DT B 12 -4.367 3.375 -0.151 1.00 0.00 C ATOM 361 O2 DT B 12 -4.363 3.574 -1.361 1.00 0.00 O ATOM 362 N3 DT B 12 -3.188 3.374 0.597 1.00 0.00 N ATOM 363 C4 DT B 12 -3.111 3.173 1.968 1.00 0.00 C ATOM 364 O4 DT B 12 -2.044 3.243 2.557 1.00 0.00 O ATOM 365 C5 DT B 12 -4.378 2.883 2.599 1.00 0.00 C ATOM 366 C7 DT B 12 -4.564 2.522 4.031 1.00 0.00 C ATOM 367 C6 DT B 12 -5.499 2.883 1.893 1.00 0.00 C ATOM 0 H5' DT B 12 -9.957 5.030 1.304 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.983 3.626 1.520 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.543 2.998 -0.099 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.618 1.732 2.507 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.603 1.183 1.321 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.522 0.834 -0.130 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.810 2.896 -1.070 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.314 3.534 0.096 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.542 2.865 4.369 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.500 1.440 4.145 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.787 2.997 4.630 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.428 2.671 2.401 1.00 0.00 H new ATOM 380 P DA B 13 -9.372 -0.758 1.428 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.489 -1.536 0.850 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.065 -0.866 2.870 1.00 0.00 O ATOM 383 O5' DA B 13 -8.032 -1.094 0.587 1.00 0.00 O ATOM 384 C5' DA B 13 -8.016 -1.009 -0.825 1.00 0.00 C ATOM 385 C4' DA B 13 -6.601 -0.769 -1.418 1.00 0.00 C ATOM 386 O4' DA B 13 -5.505 -0.978 -0.566 1.00 0.00 O ATOM 387 C3' DA B 13 -6.504 -1.790 -2.543 1.00 0.00 C ATOM 388 O3' DA B 13 -5.728 -1.272 -3.612 1.00 0.00 O ATOM 389 C2' DA B 13 -5.855 -2.908 -1.696 1.00 0.00 C ATOM 390 C1' DA B 13 -4.771 -2.096 -1.011 1.00 0.00 C ATOM 391 N9 DA B 13 -4.226 -2.659 0.223 1.00 0.00 N ATOM 392 C8 DA B 13 -4.840 -2.643 1.442 1.00 0.00 C ATOM 393 N7 DA B 13 -4.051 -2.907 2.449 1.00 0.00 N ATOM 394 C5 DA B 13 -2.807 -3.063 1.837 1.00 0.00 C ATOM 395 C6 DA B 13 -1.504 -3.261 2.324 1.00 0.00 C ATOM 396 N6 DA B 13 -1.215 -3.361 3.620 1.00 0.00 N ATOM 397 N1 DA B 13 -0.488 -3.267 1.450 1.00 0.00 N ATOM 398 C2 DA B 13 -0.728 -3.082 0.159 1.00 0.00 C ATOM 399 N3 DA B 13 -1.897 -2.885 -0.426 1.00 0.00 N ATOM 400 C4 DA B 13 -2.903 -2.883 0.482 1.00 0.00 C ATOM 0 H5' DA B 13 -8.674 -0.199 -1.139 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.423 -1.931 -1.241 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.529 0.285 -1.688 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.403 -2.101 -3.074 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.552 -3.358 -0.990 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.452 -3.717 -2.306 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.934 -1.973 -1.699 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.892 -2.430 1.564 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.250 -3.505 3.918 1.00 0.00 H new ATOM 0 H62 DA B 13 -1.959 -3.294 4.315 1.00 0.00 H new ATOM 0 H2 DA B 13 0.134 -3.094 -0.492 1.00 0.00 H new ATOM 412 P DC B 14 -5.850 -1.848 -5.124 1.00 0.00 P ATOM 413 OP1 DC B 14 -6.062 -0.701 -6.032 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.825 -2.961 -5.111 1.00 0.00 O ATOM 415 O5' DC B 14 -4.397 -2.476 -5.411 1.00 0.00 O ATOM 416 C5' DC B 14 -3.864 -3.414 -4.509 1.00 0.00 C ATOM 417 C4' DC B 14 -2.418 -3.786 -4.811 1.00 0.00 C ATOM 418 O4' DC B 14 -1.762 -3.875 -3.554 1.00 0.00 O ATOM 419 C3' DC B 14 -2.325 -5.147 -5.501 1.00 0.00 C ATOM 420 O3' DC B 14 -1.235 -5.162 -6.409 1.00 0.00 O ATOM 421 C2' DC B 14 -2.115 -6.065 -4.315 1.00 0.00 C ATOM 422 C1' DC B 14 -1.403 -5.212 -3.282 1.00 0.00 C ATOM 423 N1 DC B 14 -1.779 -5.671 -1.932 1.00 0.00 N ATOM 424 C2 DC B 14 -0.797 -6.126 -1.070 1.00 0.00 C ATOM 425 O2 DC B 14 0.347 -6.340 -1.452 1.00 0.00 O ATOM 426 N3 DC B 14 -1.108 -6.338 0.232 1.00 0.00 N ATOM 427 C4 DC B 14 -2.365 -6.185 0.657 1.00 0.00 C ATOM 428 N4 DC B 14 -2.555 -6.250 1.968 1.00 0.00 N ATOM 429 C5 DC B 14 -3.429 -5.821 -0.244 1.00 0.00 C ATOM 430 C6 DC B 14 -3.073 -5.593 -1.526 1.00 0.00 C ATOM 0 H5' DC B 14 -4.476 -4.316 -4.530 1.00 0.00 H new ATOM 0 H5'' DC B 14 -3.925 -3.011 -3.498 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.971 -3.044 -5.473 1.00 0.00 H new ATOM 0 H3' DC B 14 -3.187 -5.426 -6.107 1.00 0.00 H new ATOM 0 H2' DC B 14 -3.064 -6.439 -3.932 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.517 -6.934 -4.589 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.317 -5.294 -3.328 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.493 -6.141 2.353 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.763 -6.409 2.591 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.453 -5.735 0.088 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.837 -5.342 -2.247 1.00 0.00 H new ATOM 442 P DG B 15 -0.838 -6.477 -7.269 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.277 -6.022 -8.559 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.998 -7.395 -7.261 1.00 0.00 O ATOM 445 O5' DG B 15 0.350 -7.167 -6.409 1.00 0.00 O ATOM 446 C5' DG B 15 1.621 -6.552 -6.330 1.00 0.00 C ATOM 447 C4' DG B 15 2.681 -7.396 -5.611 1.00 0.00 C ATOM 448 O4' DG B 15 2.300 -7.643 -4.271 1.00 0.00 O ATOM 449 C3' DG B 15 2.932 -8.756 -6.270 1.00 0.00 C ATOM 450 O3' DG B 15 4.334 -8.975 -6.228 1.00 0.00 O ATOM 451 C2' DG B 15 2.104 -9.686 -5.398 1.00 0.00 C ATOM 452 C1' DG B 15 2.265 -9.040 -4.030 1.00 0.00 C ATOM 453 N9 DG B 15 1.188 -9.292 -3.054 1.00 0.00 N ATOM 454 C8 DG B 15 -0.169 -9.287 -3.238 1.00 0.00 C ATOM 455 N7 DG B 15 -0.859 -9.334 -2.131 1.00 0.00 N ATOM 456 C5 DG B 15 0.115 -9.360 -1.131 1.00 0.00 C ATOM 457 C6 DG B 15 0.006 -9.385 0.295 1.00 0.00 C ATOM 458 O6 DG B 15 -1.011 -9.460 0.980 1.00 0.00 O ATOM 459 N1 DG B 15 1.238 -9.311 0.933 1.00 0.00 N ATOM 460 C2 DG B 15 2.442 -9.316 0.278 1.00 0.00 C ATOM 461 N2 DG B 15 3.555 -9.293 0.999 1.00 0.00 N ATOM 462 N3 DG B 15 2.560 -9.341 -1.052 1.00 0.00 N ATOM 463 C4 DG B 15 1.365 -9.332 -1.694 1.00 0.00 C ATOM 0 H5' DG B 15 1.520 -5.598 -5.813 1.00 0.00 H new ATOM 0 H5'' DG B 15 1.970 -6.332 -7.339 1.00 0.00 H new ATOM 0 H4' DG B 15 3.597 -6.807 -5.666 1.00 0.00 H new ATOM 0 H3' DG B 15 2.650 -8.879 -7.316 1.00 0.00 H new ATOM 0 H2' DG B 15 1.061 -9.725 -5.714 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.480 -10.709 -5.416 1.00 0.00 H new ATOM 0 H1' DG B 15 3.160 -9.470 -3.580 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.629 -9.248 -4.215 1.00 0.00 H new ATOM 0 H1 DG B 15 1.247 -9.249 1.951 1.00 0.00 H new ATOM 0 H21 DG B 15 4.463 -9.296 0.535 1.00 0.00 H new ATOM 0 H22 DG B 15 3.503 -9.272 2.017 1.00 0.00 H new ATOM 475 P DC B 16 5.043 -10.291 -6.825 1.00 0.00 P ATOM 476 OP1 DC B 16 6.403 -9.921 -7.271 1.00 0.00 O ATOM 477 OP2 DC B 16 4.102 -10.924 -7.775 1.00 0.00 O ATOM 478 O5' DC B 16 5.173 -11.232 -5.527 1.00 0.00 O ATOM 479 C5' DC B 16 6.216 -11.069 -4.583 1.00 0.00 C ATOM 480 C4' DC B 16 5.972 -11.981 -3.371 1.00 0.00 C ATOM 481 O4' DC B 16 4.831 -11.507 -2.662 1.00 0.00 O ATOM 482 C3' DC B 16 5.681 -13.438 -3.787 1.00 0.00 C ATOM 483 O3' DC B 16 6.300 -14.364 -2.918 1.00 0.00 O ATOM 484 C2' DC B 16 4.165 -13.471 -3.651 1.00 0.00 C ATOM 485 C1' DC B 16 4.036 -12.636 -2.374 1.00 0.00 C ATOM 486 N1 DC B 16 2.654 -12.363 -1.930 1.00 0.00 N ATOM 487 C2 DC B 16 2.329 -12.382 -0.572 1.00 0.00 C ATOM 488 O2 DC B 16 3.191 -12.330 0.304 1.00 0.00 O ATOM 489 N3 DC B 16 1.015 -12.459 -0.209 1.00 0.00 N ATOM 490 C4 DC B 16 0.060 -12.576 -1.142 1.00 0.00 C ATOM 491 N4 DC B 16 -1.208 -12.627 -0.762 1.00 0.00 N ATOM 492 C5 DC B 16 0.386 -12.584 -2.533 1.00 0.00 C ATOM 493 C6 DC B 16 1.675 -12.451 -2.853 1.00 0.00 C ATOM 0 H5' DC B 16 6.268 -10.029 -4.262 1.00 0.00 H new ATOM 0 H5'' DC B 16 7.175 -11.309 -5.042 1.00 0.00 H new ATOM 0 H4' DC B 16 6.875 -11.961 -2.761 1.00 0.00 H new ATOM 0 H3' DC B 16 6.055 -13.709 -4.774 1.00 0.00 H new ATOM 0 H2' DC B 16 3.654 -13.023 -4.503 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.772 -14.481 -3.538 1.00 0.00 H new ATOM 0 HO3' DC B 16 6.093 -15.276 -3.211 1.00 0.00 H new ATOM 0 H1' DC B 16 4.382 -13.165 -1.486 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.946 -12.716 -1.460 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.446 -12.577 0.229 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.376 -12.693 -3.291 1.00 0.00 H new ATOM 0 H6 DC B 16 1.946 -12.412 -3.898 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.943 0.185 -0.766 1.00 0.00 O HETATM 508 C2 PSO A 9 -2.183 0.301 -0.450 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.651 0.287 0.874 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.714 0.175 1.894 1.00 0.00 C HETATM 511 C5 PSO A 9 0.659 0.222 2.498 1.00 0.00 C HETATM 512 C6 PSO A 9 1.998 0.243 2.081 1.00 0.00 C HETATM 513 C7 PSO A 9 2.326 0.137 0.776 1.00 0.00 C HETATM 514 C8 PSO A 9 1.308 0.034 -0.202 1.00 0.00 C HETATM 515 C9 PSO A 9 -0.057 0.142 0.174 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.364 0.185 1.529 1.00 0.00 C HETATM 517 C4' PSO A 9 3.210 0.109 2.958 1.00 0.00 C HETATM 518 C5' PSO A 9 4.243 -0.017 1.858 1.00 0.00 C HETATM 519 O6' PSO A 9 3.576 0.111 0.571 1.00 0.00 O HETATM 520 O11 PSO A 9 -3.003 0.430 -1.356 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.140 0.046 3.337 1.00 0.00 C HETATM 522 C13 PSO A 9 3.350 1.258 3.973 1.00 0.00 C HETATM 523 O14 PSO A 9 2.664 2.416 3.533 1.00 0.00 O HETATM 524 C15 PSO A 9 5.455 0.833 2.223 1.00 0.00 C HETATM 525 C16 PSO A 9 1.659 -0.197 -1.660 1.00 0.00 C HETATM 0 H163 PSO A 9 2.279 0.624 -2.020 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.206 -1.135 -1.758 1.00 0.00 H new HETATM 0 H161 PSO A 9 0.744 -0.247 -2.251 1.00 0.00 H new HETATM 0 H153 PSO A 9 5.151 1.875 2.327 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.875 0.482 3.166 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.207 0.751 1.438 1.00 0.00 H new HETATM 0 H132 PSO A 9 2.955 0.943 4.939 1.00 0.00 H new HETATM 0 H131 PSO A 9 4.405 1.491 4.120 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.721 0.922 3.625 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.750 -0.849 3.458 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.257 -0.029 3.972 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.412 0.234 3.560 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.716 0.362 1.095 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.979 2.663 2.639 1.00 0.00 H new