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=-0.00996 USER MOD Single : A 4 DT C7 :methyl -30:sc= -1.5! (180deg=-4.12!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot 180:sc= 0.103 USER MOD Single : B 9 DG O5' : rot -25:sc= 0.0787 USER MOD Single : B 12 DT C7 :methyl 150:sc= -3.51! (180deg=-3.51!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -3.387 -11.850 8.846 1.00 0.00 O ATOM 2 C5' DG A 1 -2.632 -12.710 9.672 1.00 0.00 C ATOM 3 C4' DG A 1 -1.118 -12.459 9.576 1.00 0.00 C ATOM 4 O4' DG A 1 -0.529 -13.065 8.424 1.00 0.00 O ATOM 5 C3' DG A 1 -0.744 -10.992 9.543 1.00 0.00 C ATOM 6 O3' DG A 1 0.460 -10.803 10.265 1.00 0.00 O ATOM 7 C2' DG A 1 -0.623 -10.759 8.060 1.00 0.00 C ATOM 8 C1' DG A 1 -0.150 -12.072 7.472 1.00 0.00 C ATOM 9 N9 DG A 1 -0.797 -12.318 6.158 1.00 0.00 N ATOM 10 C8 DG A 1 -2.107 -12.656 5.938 1.00 0.00 C ATOM 11 N7 DG A 1 -2.444 -12.749 4.688 1.00 0.00 N ATOM 12 C5 DG A 1 -1.262 -12.478 4.014 1.00 0.00 C ATOM 13 C6 DG A 1 -1.006 -12.467 2.614 1.00 0.00 C ATOM 14 O6 DG A 1 -1.808 -12.635 1.700 1.00 0.00 O ATOM 15 N1 DG A 1 0.323 -12.237 2.314 1.00 0.00 N ATOM 16 C2 DG A 1 1.297 -12.001 3.252 1.00 0.00 C ATOM 17 N2 DG A 1 2.538 -11.821 2.806 1.00 0.00 N ATOM 18 N3 DG A 1 1.064 -11.968 4.575 1.00 0.00 N ATOM 19 C4 DG A 1 -0.237 -12.228 4.896 1.00 0.00 C ATOM 0 H5' DG A 1 -2.841 -13.744 9.398 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.951 -12.583 10.707 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.730 -12.913 10.488 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.443 -10.296 10.007 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.580 -10.461 7.632 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.085 -9.958 7.847 1.00 0.00 H new ATOM 0 HO5' DG A 1 -4.340 -12.055 8.945 1.00 0.00 H new ATOM 0 H1' DG A 1 0.925 -12.078 7.291 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.805 -12.831 6.743 1.00 0.00 H new ATOM 0 H1 DG A 1 0.598 -12.243 1.332 1.00 0.00 H new ATOM 0 H21 DG A 1 3.296 -11.643 3.465 1.00 0.00 H new ATOM 0 H22 DG A 1 2.731 -11.862 1.805 1.00 0.00 H new ATOM 32 P DC A 2 1.094 -9.347 10.534 1.00 0.00 P ATOM 33 OP1 DC A 2 1.774 -9.377 11.846 1.00 0.00 O ATOM 34 OP2 DC A 2 0.061 -8.324 10.262 1.00 0.00 O ATOM 35 O5' DC A 2 2.211 -9.248 9.381 1.00 0.00 O ATOM 36 C5' DC A 2 3.229 -10.219 9.287 1.00 0.00 C ATOM 37 C4' DC A 2 4.316 -9.810 8.292 1.00 0.00 C ATOM 38 O4' DC A 2 3.892 -9.888 6.934 1.00 0.00 O ATOM 39 C3' DC A 2 4.799 -8.380 8.513 1.00 0.00 C ATOM 40 O3' DC A 2 6.191 -8.461 8.288 1.00 0.00 O ATOM 41 C2' DC A 2 3.969 -7.613 7.478 1.00 0.00 C ATOM 42 C1' DC A 2 3.839 -8.605 6.313 1.00 0.00 C ATOM 43 N1 DC A 2 2.536 -8.559 5.565 1.00 0.00 N ATOM 44 C2 DC A 2 2.527 -8.867 4.207 1.00 0.00 C ATOM 45 O2 DC A 2 3.576 -9.088 3.606 1.00 0.00 O ATOM 46 N3 DC A 2 1.342 -8.928 3.523 1.00 0.00 N ATOM 47 C4 DC A 2 0.187 -8.701 4.165 1.00 0.00 C ATOM 48 N4 DC A 2 -0.958 -8.865 3.510 1.00 0.00 N ATOM 49 C5 DC A 2 0.148 -8.406 5.559 1.00 0.00 C ATOM 50 C6 DC A 2 1.335 -8.376 6.206 1.00 0.00 C ATOM 0 H5' DC A 2 2.796 -11.171 8.980 1.00 0.00 H new ATOM 0 H5'' DC A 2 3.675 -10.374 10.269 1.00 0.00 H new ATOM 0 H4' DC A 2 5.119 -10.524 8.475 1.00 0.00 H new ATOM 0 H3' DC A 2 4.673 -7.892 9.480 1.00 0.00 H new ATOM 0 H2' DC A 2 2.994 -7.331 7.875 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.465 -6.693 7.168 1.00 0.00 H new ATOM 0 H1' DC A 2 4.617 -8.372 5.586 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.845 -8.696 3.984 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.949 -9.159 2.533 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.783 -8.216 6.073 1.00 0.00 H new ATOM 0 H6 DC A 2 1.339 -8.201 7.272 1.00 0.00 H new ATOM 62 P DG A 3 7.142 -7.180 8.248 1.00 0.00 P ATOM 63 OP1 DG A 3 8.520 -7.604 8.577 1.00 0.00 O ATOM 64 OP2 DG A 3 6.500 -6.080 8.999 1.00 0.00 O ATOM 65 O5' DG A 3 7.038 -6.871 6.682 1.00 0.00 O ATOM 66 C5' DG A 3 7.502 -7.800 5.723 1.00 0.00 C ATOM 67 C4' DG A 3 7.660 -7.123 4.363 1.00 0.00 C ATOM 68 O4' DG A 3 6.382 -7.050 3.773 1.00 0.00 O ATOM 69 C3' DG A 3 8.214 -5.702 4.522 1.00 0.00 C ATOM 70 O3' DG A 3 9.109 -5.422 3.464 1.00 0.00 O ATOM 71 C2' DG A 3 6.913 -4.902 4.494 1.00 0.00 C ATOM 72 C1' DG A 3 6.060 -5.704 3.529 1.00 0.00 C ATOM 73 N9 DG A 3 4.608 -5.539 3.724 1.00 0.00 N ATOM 74 C8 DG A 3 3.895 -5.265 4.862 1.00 0.00 C ATOM 75 N7 DG A 3 2.611 -5.455 4.740 1.00 0.00 N ATOM 76 C5 DG A 3 2.449 -5.800 3.399 1.00 0.00 C ATOM 77 C6 DG A 3 1.272 -6.028 2.621 1.00 0.00 C ATOM 78 O6 DG A 3 0.101 -6.063 2.998 1.00 0.00 O ATOM 79 N1 DG A 3 1.556 -6.225 1.279 1.00 0.00 N ATOM 80 C2 DG A 3 2.825 -6.239 0.743 1.00 0.00 C ATOM 81 N2 DG A 3 2.992 -6.424 -0.559 1.00 0.00 N ATOM 82 N3 DG A 3 3.929 -6.048 1.464 1.00 0.00 N ATOM 83 C4 DG A 3 3.669 -5.826 2.773 1.00 0.00 C ATOM 0 H5' DG A 3 6.802 -8.632 5.644 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.457 -8.217 6.043 1.00 0.00 H new ATOM 0 H4' DG A 3 8.354 -7.695 3.747 1.00 0.00 H new ATOM 0 H3' DG A 3 8.807 -5.492 5.412 1.00 0.00 H new ATOM 0 H2' DG A 3 6.456 -4.835 5.481 1.00 0.00 H new ATOM 0 H2'' DG A 3 7.071 -3.881 4.145 1.00 0.00 H new ATOM 0 H1' DG A 3 6.268 -5.362 2.515 1.00 0.00 H new ATOM 0 H8 DG A 3 4.355 -4.923 5.777 1.00 0.00 H new ATOM 0 H1 DG A 3 0.771 -6.370 0.644 1.00 0.00 H new ATOM 0 H21 DG A 3 3.931 -6.434 -0.956 1.00 0.00 H new ATOM 0 H22 DG A 3 2.181 -6.556 -1.163 1.00 0.00 H new ATOM 95 P DT A 4 10.022 -4.089 3.446 1.00 0.00 P ATOM 96 OP1 DT A 4 11.317 -4.427 2.817 1.00 0.00 O ATOM 97 OP2 DT A 4 9.992 -3.481 4.794 1.00 0.00 O ATOM 98 O5' DT A 4 9.192 -3.152 2.447 1.00 0.00 O ATOM 99 C5' DT A 4 9.155 -3.445 1.068 1.00 0.00 C ATOM 100 C4' DT A 4 7.878 -2.873 0.465 1.00 0.00 C ATOM 101 O4' DT A 4 6.729 -3.328 1.168 1.00 0.00 O ATOM 102 C3' DT A 4 7.759 -1.357 0.559 1.00 0.00 C ATOM 103 O3' DT A 4 8.536 -0.631 -0.368 1.00 0.00 O ATOM 104 C2' DT A 4 6.267 -1.262 0.272 1.00 0.00 C ATOM 105 C1' DT A 4 5.637 -2.592 0.648 1.00 0.00 C ATOM 106 N1 DT A 4 4.483 -2.470 1.585 1.00 0.00 N ATOM 107 C2 DT A 4 3.235 -2.960 1.224 1.00 0.00 C ATOM 108 O2 DT A 4 2.972 -3.349 0.091 1.00 0.00 O ATOM 109 N3 DT A 4 2.269 -3.001 2.199 1.00 0.00 N ATOM 110 C4 DT A 4 2.346 -2.489 3.467 1.00 0.00 C ATOM 111 O4 DT A 4 1.495 -2.774 4.305 1.00 0.00 O ATOM 112 C5 DT A 4 3.505 -1.558 3.797 1.00 0.00 C ATOM 113 C7 DT A 4 4.126 -1.789 5.175 1.00 0.00 C ATOM 114 C6 DT A 4 4.613 -1.537 2.737 1.00 0.00 C ATOM 0 H5' DT A 4 9.193 -4.523 0.913 1.00 0.00 H new ATOM 0 H5'' DT A 4 10.027 -3.021 0.571 1.00 0.00 H new ATOM 0 H4' DT A 4 7.931 -3.200 -0.574 1.00 0.00 H new ATOM 0 H3' DT A 4 8.121 -0.927 1.493 1.00 0.00 H new ATOM 0 H2' DT A 4 5.818 -0.451 0.846 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.094 -1.041 -0.781 1.00 0.00 H new ATOM 0 H1' DT A 4 5.169 -3.089 -0.202 1.00 0.00 H new ATOM 0 H3 DT A 4 1.395 -3.465 1.951 1.00 0.00 H new ATOM 0 H71 DT A 4 3.365 -2.165 5.859 1.00 0.00 H new ATOM 0 H72 DT A 4 4.932 -2.518 5.093 1.00 0.00 H new ATOM 0 H73 DT A 4 4.524 -0.849 5.557 1.00 0.00 H new ATOM 0 H6 DT A 4 5.457 -0.869 2.823 1.00 0.00 H new ATOM 127 P DA A 5 8.466 0.985 -0.408 1.00 0.00 P ATOM 128 OP1 DA A 5 9.684 1.469 -1.092 1.00 0.00 O ATOM 129 OP2 DA A 5 8.161 1.467 0.956 1.00 0.00 O ATOM 130 O5' DA A 5 7.182 1.297 -1.347 1.00 0.00 O ATOM 131 C5' DA A 5 7.355 1.360 -2.746 1.00 0.00 C ATOM 132 C4' DA A 5 6.097 1.472 -3.616 1.00 0.00 C ATOM 133 O4' DA A 5 4.926 1.358 -2.811 1.00 0.00 O ATOM 134 C3' DA A 5 6.108 2.838 -4.291 1.00 0.00 C ATOM 135 O3' DA A 5 5.337 2.876 -5.474 1.00 0.00 O ATOM 136 C2' DA A 5 5.479 3.547 -3.120 1.00 0.00 C ATOM 137 C1' DA A 5 4.324 2.634 -2.737 1.00 0.00 C ATOM 138 N9 DA A 5 3.775 2.935 -1.397 1.00 0.00 N ATOM 139 C8 DA A 5 4.459 3.070 -0.219 1.00 0.00 C ATOM 140 N7 DA A 5 3.702 3.258 0.827 1.00 0.00 N ATOM 141 C5 DA A 5 2.414 3.248 0.297 1.00 0.00 C ATOM 142 C6 DA A 5 1.132 3.354 0.871 1.00 0.00 C ATOM 143 N6 DA A 5 0.969 3.431 2.188 1.00 0.00 N ATOM 144 N1 DA A 5 0.045 3.318 0.075 1.00 0.00 N ATOM 145 C2 DA A 5 0.234 3.178 -1.233 1.00 0.00 C ATOM 146 N3 DA A 5 1.379 3.063 -1.897 1.00 0.00 N ATOM 147 C4 DA A 5 2.448 3.094 -1.062 1.00 0.00 C ATOM 0 H5' DA A 5 7.899 0.468 -3.057 1.00 0.00 H new ATOM 0 H5'' DA A 5 7.993 2.216 -2.967 1.00 0.00 H new ATOM 0 H4' DA A 5 6.090 0.673 -4.357 1.00 0.00 H new ATOM 0 H3' DA A 5 7.055 3.227 -4.665 1.00 0.00 H new ATOM 0 H2' DA A 5 6.184 3.670 -2.298 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.131 4.543 -3.393 1.00 0.00 H new ATOM 0 H1' DA A 5 3.452 2.741 -3.382 1.00 0.00 H new ATOM 0 H8 DA A 5 5.536 3.025 -0.160 1.00 0.00 H new ATOM 0 H61 DA A 5 0.031 3.507 2.582 1.00 0.00 H new ATOM 0 H62 DA A 5 1.782 3.414 2.804 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.662 3.155 -1.836 1.00 0.00 H new ATOM 159 P DC A 6 5.219 4.233 -6.351 1.00 0.00 P ATOM 160 OP1 DC A 6 5.243 3.856 -7.781 1.00 0.00 O ATOM 161 OP2 DC A 6 6.193 5.218 -5.833 1.00 0.00 O ATOM 162 O5' DC A 6 3.742 4.739 -5.968 1.00 0.00 O ATOM 163 C5' DC A 6 2.645 3.941 -6.338 1.00 0.00 C ATOM 164 C4' DC A 6 1.287 4.569 -6.043 1.00 0.00 C ATOM 165 O4' DC A 6 1.015 4.624 -4.638 1.00 0.00 O ATOM 166 C3' DC A 6 1.137 6.000 -6.583 1.00 0.00 C ATOM 167 O3' DC A 6 -0.121 6.126 -7.232 1.00 0.00 O ATOM 168 C2' DC A 6 1.198 6.843 -5.308 1.00 0.00 C ATOM 169 C1' DC A 6 0.648 5.942 -4.215 1.00 0.00 C ATOM 170 N1 DC A 6 1.140 6.252 -2.845 1.00 0.00 N ATOM 171 C2 DC A 6 0.204 6.457 -1.832 1.00 0.00 C ATOM 172 O2 DC A 6 -0.994 6.579 -2.061 1.00 0.00 O ATOM 173 N3 DC A 6 0.611 6.525 -0.542 1.00 0.00 N ATOM 174 C4 DC A 6 1.908 6.476 -0.243 1.00 0.00 C ATOM 175 N4 DC A 6 2.233 6.393 1.040 1.00 0.00 N ATOM 176 C5 DC A 6 2.904 6.343 -1.262 1.00 0.00 C ATOM 177 C6 DC A 6 2.472 6.235 -2.541 1.00 0.00 C ATOM 0 H5' DC A 6 2.712 2.986 -5.816 1.00 0.00 H new ATOM 0 H5'' DC A 6 2.709 3.727 -7.405 1.00 0.00 H new ATOM 0 H4' DC A 6 0.580 3.915 -6.554 1.00 0.00 H new ATOM 0 H3' DC A 6 1.889 6.293 -7.315 1.00 0.00 H new ATOM 0 H2' DC A 6 2.220 7.152 -5.088 1.00 0.00 H new ATOM 0 H2'' DC A 6 0.604 7.752 -5.407 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.428 6.077 -4.108 1.00 0.00 H new ATOM 0 H41 DC A 6 3.214 6.353 1.316 1.00 0.00 H new ATOM 0 H42 DC A 6 1.502 6.369 1.751 1.00 0.00 H new ATOM 0 H5 DC A 6 3.957 6.329 -1.021 1.00 0.00 H new ATOM 0 H6 DC A 6 3.195 6.133 -3.337 1.00 0.00 H new ATOM 189 P DG A 7 -0.619 7.519 -7.899 1.00 0.00 P ATOM 190 OP1 DG A 7 -1.527 7.184 -9.017 1.00 0.00 O ATOM 191 OP2 DG A 7 0.575 8.353 -8.156 1.00 0.00 O ATOM 192 O5' DG A 7 -1.486 8.237 -6.729 1.00 0.00 O ATOM 193 C5' DG A 7 -2.762 7.740 -6.378 1.00 0.00 C ATOM 194 C4' DG A 7 -3.557 8.626 -5.409 1.00 0.00 C ATOM 195 O4' DG A 7 -2.949 8.657 -4.132 1.00 0.00 O ATOM 196 C3' DG A 7 -3.689 10.076 -5.886 1.00 0.00 C ATOM 197 O3' DG A 7 -5.019 10.484 -5.601 1.00 0.00 O ATOM 198 C2' DG A 7 -2.609 10.769 -5.072 1.00 0.00 C ATOM 199 C1' DG A 7 -2.666 9.996 -3.764 1.00 0.00 C ATOM 200 N9 DG A 7 -1.446 9.971 -2.938 1.00 0.00 N ATOM 201 C8 DG A 7 -0.139 9.880 -3.329 1.00 0.00 C ATOM 202 N7 DG A 7 0.699 9.687 -2.348 1.00 0.00 N ATOM 203 C5 DG A 7 -0.116 9.651 -1.214 1.00 0.00 C ATOM 204 C6 DG A 7 0.202 9.491 0.171 1.00 0.00 C ATOM 205 O6 DG A 7 1.308 9.364 0.687 1.00 0.00 O ATOM 206 N1 DG A 7 -0.920 9.485 0.987 1.00 0.00 N ATOM 207 C2 DG A 7 -2.201 9.658 0.534 1.00 0.00 C ATOM 208 N2 DG A 7 -3.188 9.652 1.421 1.00 0.00 N ATOM 209 N3 DG A 7 -2.511 9.839 -0.753 1.00 0.00 N ATOM 210 C4 DG A 7 -1.429 9.813 -1.573 1.00 0.00 C ATOM 0 H5' DG A 7 -2.641 6.754 -5.929 1.00 0.00 H new ATOM 0 H5'' DG A 7 -3.347 7.607 -7.288 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.549 8.176 -5.363 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.548 10.282 -6.947 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.630 10.699 -5.547 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.820 11.829 -4.931 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.406 10.500 -3.142 1.00 0.00 H new ATOM 0 H8 DG A 7 0.172 9.961 -4.360 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.782 9.343 1.988 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.152 9.779 1.112 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.983 9.521 2.411 1.00 0.00 H new ATOM 222 P DC A 8 -5.603 11.928 -6.006 1.00 0.00 P ATOM 223 OP1 DC A 8 -7.052 11.785 -6.258 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.726 12.498 -7.052 1.00 0.00 O ATOM 225 O5' DC A 8 -5.393 12.775 -4.657 1.00 0.00 O ATOM 226 C5' DC A 8 -6.308 12.705 -3.579 1.00 0.00 C ATOM 227 C4' DC A 8 -5.739 13.448 -2.361 1.00 0.00 C ATOM 228 O4' DC A 8 -4.631 12.712 -1.851 1.00 0.00 O ATOM 229 C3' DC A 8 -5.220 14.855 -2.727 1.00 0.00 C ATOM 230 O3' DC A 8 -5.506 15.804 -1.720 1.00 0.00 O ATOM 231 C2' DC A 8 -3.724 14.588 -2.813 1.00 0.00 C ATOM 232 C1' DC A 8 -3.594 13.640 -1.619 1.00 0.00 C ATOM 233 N1 DC A 8 -2.250 13.068 -1.395 1.00 0.00 N ATOM 234 C2 DC A 8 -1.805 12.844 -0.091 1.00 0.00 C ATOM 235 O2 DC A 8 -2.589 12.807 0.854 1.00 0.00 O ATOM 236 N3 DC A 8 -0.469 12.661 0.136 1.00 0.00 N ATOM 237 C4 DC A 8 0.405 12.758 -0.875 1.00 0.00 C ATOM 238 N4 DC A 8 1.690 12.542 -0.637 1.00 0.00 N ATOM 239 C5 DC A 8 -0.037 13.018 -2.209 1.00 0.00 C ATOM 240 C6 DC A 8 -1.355 13.137 -2.403 1.00 0.00 C ATOM 0 H5' DC A 8 -6.502 11.664 -3.322 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.262 13.144 -3.871 1.00 0.00 H new ATOM 0 H4' DC A 8 -6.544 13.544 -1.633 1.00 0.00 H new ATOM 0 H3' DC A 8 -5.668 15.274 -3.628 1.00 0.00 H new ATOM 0 H2' DC A 8 -3.430 14.125 -3.755 1.00 0.00 H new ATOM 0 H2'' DC A 8 -3.126 15.492 -2.702 1.00 0.00 H new ATOM 0 HO3' DC A 8 -5.160 16.681 -1.989 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.702 14.153 -0.663 1.00 0.00 H new ATOM 0 H41 DC A 8 2.368 12.612 -1.396 1.00 0.00 H new ATOM 0 H42 DC A 8 2.001 12.306 0.305 1.00 0.00 H new ATOM 0 H5 DC A 8 0.663 13.114 -3.026 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.718 13.295 -3.408 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.212 12.952 8.833 1.00 0.00 O ATOM 255 C5' DG B 9 3.724 11.805 9.493 1.00 0.00 C ATOM 256 C4' DG B 9 2.215 11.951 9.711 1.00 0.00 C ATOM 257 O4' DG B 9 1.543 12.384 8.535 1.00 0.00 O ATOM 258 C3' DG B 9 1.576 10.639 10.112 1.00 0.00 C ATOM 259 O3' DG B 9 0.510 10.914 11.008 1.00 0.00 O ATOM 260 C2' DG B 9 1.126 10.063 8.773 1.00 0.00 C ATOM 261 C1' DG B 9 0.977 11.272 7.851 1.00 0.00 C ATOM 262 N9 DG B 9 1.591 11.146 6.502 1.00 0.00 N ATOM 263 C8 DG B 9 2.896 10.884 6.152 1.00 0.00 C ATOM 264 N7 DG B 9 3.153 11.020 4.884 1.00 0.00 N ATOM 265 C5 DG B 9 1.935 11.403 4.337 1.00 0.00 C ATOM 266 C6 DG B 9 1.595 11.739 2.993 1.00 0.00 C ATOM 267 O6 DG B 9 2.338 11.801 2.018 1.00 0.00 O ATOM 268 N1 DG B 9 0.248 12.022 2.831 1.00 0.00 N ATOM 269 C2 DG B 9 -0.663 12.024 3.858 1.00 0.00 C ATOM 270 N2 DG B 9 -1.934 12.278 3.567 1.00 0.00 N ATOM 271 N3 DG B 9 -0.348 11.760 5.133 1.00 0.00 N ATOM 272 C4 DG B 9 0.967 11.457 5.310 1.00 0.00 C ATOM 0 H5' DG B 9 4.231 11.678 10.450 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.933 10.914 8.901 1.00 0.00 H new ATOM 0 H4' DG B 9 2.113 12.692 10.504 1.00 0.00 H new ATOM 0 H3' DG B 9 2.219 9.935 10.639 1.00 0.00 H new ATOM 0 H2' DG B 9 1.858 9.356 8.382 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.184 9.524 8.872 1.00 0.00 H new ATOM 0 HO5' DG B 9 3.487 13.368 8.320 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.087 11.383 7.643 1.00 0.00 H new ATOM 0 H8 DG B 9 3.646 10.589 6.871 1.00 0.00 H new ATOM 0 H1 DG B 9 -0.086 12.242 1.893 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.635 12.287 4.308 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.209 12.464 2.603 1.00 0.00 H new ATOM 285 P DC B 10 -0.345 9.755 11.737 1.00 0.00 P ATOM 286 OP1 DC B 10 -0.975 10.337 12.941 1.00 0.00 O ATOM 287 OP2 DC B 10 0.512 8.555 11.859 1.00 0.00 O ATOM 288 O5' DC B 10 -1.493 9.453 10.652 1.00 0.00 O ATOM 289 C5' DC B 10 -2.446 10.443 10.323 1.00 0.00 C ATOM 290 C4' DC B 10 -3.140 10.095 9.005 1.00 0.00 C ATOM 291 O4' DC B 10 -2.217 10.111 7.927 1.00 0.00 O ATOM 292 C3' DC B 10 -3.793 8.705 9.008 1.00 0.00 C ATOM 293 O3' DC B 10 -5.161 8.899 8.706 1.00 0.00 O ATOM 294 C2' DC B 10 -3.003 7.973 7.911 1.00 0.00 C ATOM 295 C1' DC B 10 -2.617 9.122 7.001 1.00 0.00 C ATOM 296 N1 DC B 10 -1.562 8.797 6.005 1.00 0.00 N ATOM 297 C2 DC B 10 -1.779 9.035 4.648 1.00 0.00 C ATOM 298 O2 DC B 10 -2.878 9.399 4.233 1.00 0.00 O ATOM 299 N3 DC B 10 -0.753 8.863 3.759 1.00 0.00 N ATOM 300 C4 DC B 10 0.424 8.388 4.189 1.00 0.00 C ATOM 301 N4 DC B 10 1.452 8.371 3.348 1.00 0.00 N ATOM 302 C5 DC B 10 0.648 8.070 5.564 1.00 0.00 C ATOM 303 C6 DC B 10 -0.365 8.304 6.421 1.00 0.00 C ATOM 0 H5' DC B 10 -1.958 11.414 10.239 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.185 10.525 11.120 1.00 0.00 H new ATOM 0 H4' DC B 10 -3.913 10.854 8.887 1.00 0.00 H new ATOM 0 H3' DC B 10 -3.765 8.138 9.939 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.131 7.454 8.310 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.609 7.228 7.396 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.436 9.429 6.351 1.00 0.00 H new ATOM 0 H41 DC B 10 2.357 8.014 3.655 1.00 0.00 H new ATOM 0 H42 DC B 10 1.337 8.715 2.395 1.00 0.00 H new ATOM 0 H5 DC B 10 1.588 7.660 5.902 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.222 8.094 7.471 1.00 0.00 H new ATOM 315 P DG B 11 -6.187 7.678 8.529 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.530 8.134 8.949 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.593 6.473 9.148 1.00 0.00 O ATOM 318 O5' DG B 11 -6.181 7.480 6.930 1.00 0.00 O ATOM 319 C5' DG B 11 -6.720 8.457 6.060 1.00 0.00 C ATOM 320 C4' DG B 11 -7.349 7.806 4.818 1.00 0.00 C ATOM 321 O4' DG B 11 -6.363 7.597 3.829 1.00 0.00 O ATOM 322 C3' DG B 11 -7.985 6.444 5.112 1.00 0.00 C ATOM 323 O3' DG B 11 -9.120 6.292 4.281 1.00 0.00 O ATOM 324 C2' DG B 11 -6.833 5.494 4.804 1.00 0.00 C ATOM 325 C1' DG B 11 -6.105 6.216 3.672 1.00 0.00 C ATOM 326 N9 DG B 11 -4.642 6.042 3.689 1.00 0.00 N ATOM 327 C8 DG B 11 -3.821 5.814 4.756 1.00 0.00 C ATOM 328 N7 DG B 11 -2.549 5.869 4.480 1.00 0.00 N ATOM 329 C5 DG B 11 -2.525 6.128 3.110 1.00 0.00 C ATOM 330 C6 DG B 11 -1.432 6.204 2.195 1.00 0.00 C ATOM 331 O6 DG B 11 -0.232 6.098 2.436 1.00 0.00 O ATOM 332 N1 DG B 11 -1.842 6.423 0.890 1.00 0.00 N ATOM 333 C2 DG B 11 -3.156 6.534 0.497 1.00 0.00 C ATOM 334 N2 DG B 11 -3.436 6.724 -0.785 1.00 0.00 N ATOM 335 N3 DG B 11 -4.188 6.422 1.335 1.00 0.00 N ATOM 336 C4 DG B 11 -3.804 6.228 2.622 1.00 0.00 C ATOM 0 H5' DG B 11 -5.935 9.148 5.754 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.473 9.043 6.588 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.125 8.494 4.482 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.364 6.281 6.121 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.189 5.343 5.670 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.189 4.511 4.496 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.468 5.797 2.734 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.195 5.605 5.747 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.122 6.508 0.173 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.406 6.808 -1.088 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.681 6.786 -1.468 1.00 0.00 H new ATOM 348 P DT B 12 -10.053 4.984 4.342 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.403 5.355 3.865 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.886 4.359 5.672 1.00 0.00 O ATOM 351 O5' DT B 12 -9.352 4.042 3.245 1.00 0.00 O ATOM 352 C5' DT B 12 -9.676 4.158 1.876 1.00 0.00 C ATOM 353 C4' DT B 12 -8.739 3.298 1.025 1.00 0.00 C ATOM 354 O4' DT B 12 -7.492 3.919 0.763 1.00 0.00 O ATOM 355 C3' DT B 12 -8.456 1.909 1.594 1.00 0.00 C ATOM 356 O3' DT B 12 -9.458 0.962 1.265 1.00 0.00 O ATOM 357 C2' DT B 12 -7.185 1.640 0.802 1.00 0.00 C ATOM 358 C1' DT B 12 -6.627 2.938 0.201 1.00 0.00 C ATOM 359 N1 DT B 12 -5.277 3.122 0.741 1.00 0.00 N ATOM 360 C2 DT B 12 -4.112 3.370 0.013 1.00 0.00 C ATOM 361 O2 DT B 12 -4.111 3.575 -1.196 1.00 0.00 O ATOM 362 N3 DT B 12 -2.931 3.369 0.762 1.00 0.00 N ATOM 363 C4 DT B 12 -2.845 3.153 2.131 1.00 0.00 C ATOM 364 O4 DT B 12 -1.767 3.200 2.709 1.00 0.00 O ATOM 365 C5 DT B 12 -4.121 2.878 2.761 1.00 0.00 C ATOM 366 C7 DT B 12 -4.327 2.561 4.198 1.00 0.00 C ATOM 367 C6 DT B 12 -5.243 2.876 2.054 1.00 0.00 C ATOM 0 H5' DT B 12 -9.602 5.201 1.567 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.709 3.849 1.714 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.303 3.185 0.099 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.401 1.847 2.681 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.437 1.185 1.451 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.393 0.926 0.005 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.580 2.967 -0.888 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.060 3.541 0.261 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.310 2.912 4.511 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.263 1.483 4.346 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.559 3.055 4.793 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.172 2.666 2.563 1.00 0.00 H new ATOM 380 P DA B 13 -9.252 -0.620 1.560 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.401 -1.345 0.977 1.00 0.00 O ATOM 382 OP2 DA B 13 -8.939 -0.770 2.997 1.00 0.00 O ATOM 383 O5' DA B 13 -7.923 -0.996 0.714 1.00 0.00 O ATOM 384 C5' DA B 13 -7.899 -0.899 -0.699 1.00 0.00 C ATOM 385 C4' DA B 13 -6.483 -0.662 -1.292 1.00 0.00 C ATOM 386 O4' DA B 13 -5.384 -0.888 -0.446 1.00 0.00 O ATOM 387 C3' DA B 13 -6.395 -1.677 -2.429 1.00 0.00 C ATOM 388 O3' DA B 13 -5.660 -1.190 -3.530 1.00 0.00 O ATOM 389 C2' DA B 13 -5.686 -2.792 -1.639 1.00 0.00 C ATOM 390 C1' DA B 13 -4.621 -1.971 -0.934 1.00 0.00 C ATOM 391 N9 DA B 13 -4.081 -2.580 0.284 1.00 0.00 N ATOM 392 C8 DA B 13 -4.714 -2.632 1.495 1.00 0.00 C ATOM 393 N7 DA B 13 -3.945 -2.974 2.492 1.00 0.00 N ATOM 394 C5 DA B 13 -2.695 -3.111 1.890 1.00 0.00 C ATOM 395 C6 DA B 13 -1.406 -3.362 2.390 1.00 0.00 C ATOM 396 N6 DA B 13 -1.164 -3.552 3.685 1.00 0.00 N ATOM 397 N1 DA B 13 -0.366 -3.326 1.545 1.00 0.00 N ATOM 398 C2 DA B 13 -0.579 -3.062 0.262 1.00 0.00 C ATOM 399 N3 DA B 13 -1.734 -2.815 -0.336 1.00 0.00 N ATOM 400 C4 DA B 13 -2.764 -2.849 0.547 1.00 0.00 C ATOM 0 H5' DA B 13 -8.552 -0.083 -1.008 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.311 -1.815 -1.123 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.405 0.394 -1.550 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.329 -1.966 -2.911 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.353 -3.298 -0.941 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.261 -3.558 -2.288 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.788 -1.790 -1.614 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.764 -2.408 1.616 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.212 -3.731 4.005 1.00 0.00 H new ATOM 0 H62 DA B 13 -1.930 -3.518 4.357 1.00 0.00 H new ATOM 0 H2 DA B 13 0.296 -3.047 -0.371 1.00 0.00 H new ATOM 412 P DC B 14 -5.580 -2.035 -4.903 1.00 0.00 P ATOM 413 OP1 DC B 14 -5.406 -1.079 -6.017 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.712 -2.987 -4.927 1.00 0.00 O ATOM 415 O5' DC B 14 -4.223 -2.881 -4.726 1.00 0.00 O ATOM 416 C5' DC B 14 -2.982 -2.261 -4.969 1.00 0.00 C ATOM 417 C4' DC B 14 -1.798 -3.210 -4.784 1.00 0.00 C ATOM 418 O4' DC B 14 -1.620 -3.533 -3.397 1.00 0.00 O ATOM 419 C3' DC B 14 -1.948 -4.550 -5.526 1.00 0.00 C ATOM 420 O3' DC B 14 -0.921 -4.664 -6.502 1.00 0.00 O ATOM 421 C2' DC B 14 -1.834 -5.597 -4.422 1.00 0.00 C ATOM 422 C1' DC B 14 -1.220 -4.895 -3.225 1.00 0.00 C ATOM 423 N1 DC B 14 -1.680 -5.519 -1.962 1.00 0.00 N ATOM 424 C2 DC B 14 -0.739 -6.032 -1.081 1.00 0.00 C ATOM 425 O2 DC B 14 0.419 -6.252 -1.416 1.00 0.00 O ATOM 426 N3 DC B 14 -1.097 -6.302 0.194 1.00 0.00 N ATOM 427 C4 DC B 14 -2.366 -6.170 0.576 1.00 0.00 C ATOM 428 N4 DC B 14 -2.592 -6.286 1.878 1.00 0.00 N ATOM 429 C5 DC B 14 -3.399 -5.787 -0.353 1.00 0.00 C ATOM 430 C6 DC B 14 -2.994 -5.496 -1.613 1.00 0.00 C ATOM 0 H5' DC B 14 -2.868 -1.411 -4.297 1.00 0.00 H new ATOM 0 H5'' DC B 14 -2.971 -1.868 -5.985 1.00 0.00 H new ATOM 0 H4' DC B 14 -0.947 -2.669 -5.198 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.886 -4.659 -6.070 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.813 -6.006 -4.172 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.212 -6.433 -4.743 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.134 -4.970 -3.163 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.541 -6.196 2.241 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.817 -6.465 2.516 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.438 -5.735 -0.061 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.733 -5.240 -2.358 1.00 0.00 H new ATOM 442 P DG B 15 -0.723 -5.987 -7.420 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.146 -5.557 -8.712 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.989 -6.751 -7.403 1.00 0.00 O ATOM 445 O5' DG B 15 0.396 -6.845 -6.620 1.00 0.00 O ATOM 446 C5' DG B 15 1.719 -6.358 -6.514 1.00 0.00 C ATOM 447 C4' DG B 15 2.685 -7.307 -5.793 1.00 0.00 C ATOM 448 O4' DG B 15 2.262 -7.543 -4.463 1.00 0.00 O ATOM 449 C3' DG B 15 2.825 -8.670 -6.478 1.00 0.00 C ATOM 450 O3' DG B 15 4.206 -8.999 -6.443 1.00 0.00 O ATOM 451 C2' DG B 15 1.925 -9.544 -5.621 1.00 0.00 C ATOM 452 C1' DG B 15 2.132 -8.937 -4.241 1.00 0.00 C ATOM 453 N9 DG B 15 1.037 -9.133 -3.270 1.00 0.00 N ATOM 454 C8 DG B 15 -0.314 -9.015 -3.457 1.00 0.00 C ATOM 455 N7 DG B 15 -1.014 -9.081 -2.357 1.00 0.00 N ATOM 456 C5 DG B 15 -0.053 -9.233 -1.357 1.00 0.00 C ATOM 457 C6 DG B 15 -0.177 -9.333 0.065 1.00 0.00 C ATOM 458 O6 DG B 15 -1.202 -9.407 0.737 1.00 0.00 O ATOM 459 N1 DG B 15 1.051 -9.342 0.715 1.00 0.00 N ATOM 460 C2 DG B 15 2.260 -9.368 0.070 1.00 0.00 C ATOM 461 N2 DG B 15 3.364 -9.434 0.803 1.00 0.00 N ATOM 462 N3 DG B 15 2.390 -9.339 -1.259 1.00 0.00 N ATOM 463 C4 DG B 15 1.202 -9.241 -1.910 1.00 0.00 C ATOM 0 H5' DG B 15 1.702 -5.405 -5.985 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.102 -6.160 -7.515 1.00 0.00 H new ATOM 0 H4' DG B 15 3.651 -6.802 -5.819 1.00 0.00 H new ATOM 0 H3' DG B 15 2.533 -8.754 -7.525 1.00 0.00 H new ATOM 0 H2' DG B 15 0.883 -9.495 -5.938 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.219 -10.593 -5.655 1.00 0.00 H new ATOM 0 H1' DG B 15 2.994 -9.433 -3.796 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.762 -8.879 -4.430 1.00 0.00 H new ATOM 0 H1 DG B 15 1.053 -9.328 1.735 1.00 0.00 H new ATOM 0 H21 DG B 15 4.277 -9.455 0.349 1.00 0.00 H new ATOM 0 H22 DG B 15 3.299 -9.464 1.821 1.00 0.00 H new ATOM 475 P DC B 16 4.808 -10.354 -7.067 1.00 0.00 P ATOM 476 OP1 DC B 16 6.187 -10.079 -7.524 1.00 0.00 O ATOM 477 OP2 DC B 16 3.814 -10.904 -8.014 1.00 0.00 O ATOM 478 O5' DC B 16 4.871 -11.321 -5.784 1.00 0.00 O ATOM 479 C5' DC B 16 5.918 -11.239 -4.833 1.00 0.00 C ATOM 480 C4' DC B 16 5.615 -12.156 -3.639 1.00 0.00 C ATOM 481 O4' DC B 16 4.505 -11.624 -2.922 1.00 0.00 O ATOM 482 C3' DC B 16 5.227 -13.582 -4.086 1.00 0.00 C ATOM 483 O3' DC B 16 5.765 -14.574 -3.236 1.00 0.00 O ATOM 484 C2' DC B 16 3.713 -13.516 -3.960 1.00 0.00 C ATOM 485 C1' DC B 16 3.633 -12.703 -2.665 1.00 0.00 C ATOM 486 N1 DC B 16 2.271 -12.348 -2.221 1.00 0.00 N ATOM 487 C2 DC B 16 1.932 -12.397 -0.867 1.00 0.00 C ATOM 488 O2 DC B 16 2.786 -12.429 0.016 1.00 0.00 O ATOM 489 N3 DC B 16 0.612 -12.407 -0.518 1.00 0.00 N ATOM 490 C4 DC B 16 -0.339 -12.428 -1.461 1.00 0.00 C ATOM 491 N4 DC B 16 -1.612 -12.413 -1.093 1.00 0.00 N ATOM 492 C5 DC B 16 0.000 -12.401 -2.849 1.00 0.00 C ATOM 493 C6 DC B 16 1.298 -12.338 -3.153 1.00 0.00 C ATOM 0 H5' DC B 16 6.031 -10.210 -4.492 1.00 0.00 H new ATOM 0 H5'' DC B 16 6.863 -11.528 -5.294 1.00 0.00 H new ATOM 0 H4' DC B 16 6.517 -12.207 -3.029 1.00 0.00 H new ATOM 0 H3' DC B 16 5.596 -13.851 -5.076 1.00 0.00 H new ATOM 0 H2' DC B 16 3.239 -13.016 -4.804 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.252 -14.500 -3.872 1.00 0.00 H new ATOM 0 HO3' DC B 16 5.493 -15.460 -3.555 1.00 0.00 H new ATOM 0 H1' DC B 16 3.937 -13.275 -1.788 1.00 0.00 H new ATOM 0 H41 DC B 16 -2.347 -12.429 -1.800 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.856 -12.386 -0.103 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.759 -12.430 -3.617 1.00 0.00 H new ATOM 0 H6 DC B 16 1.581 -12.276 -4.193 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.756 0.264 -0.448 1.00 0.00 O HETATM 508 C2 PSO A 9 -2.010 0.365 -0.199 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.550 0.286 1.094 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.685 0.080 2.159 1.00 0.00 C HETATM 511 C5 PSO A 9 0.638 0.030 2.903 1.00 0.00 C HETATM 512 C6 PSO A 9 1.996 0.120 2.578 1.00 0.00 C HETATM 513 C7 PSO A 9 2.400 0.130 1.288 1.00 0.00 C HETATM 514 C8 PSO A 9 1.453 0.074 0.243 1.00 0.00 C HETATM 515 C9 PSO A 9 0.069 0.157 0.540 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.319 0.090 1.873 1.00 0.00 C HETATM 517 C4' PSO A 9 3.153 -0.080 3.517 1.00 0.00 C HETATM 518 C5' PSO A 9 4.236 -0.080 2.454 1.00 0.00 C HETATM 519 O6' PSO A 9 3.646 0.127 1.148 1.00 0.00 O HETATM 520 O11 PSO A 9 -2.779 0.539 -1.141 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.198 -0.145 3.562 1.00 0.00 C HETATM 522 C13 PSO A 9 3.183 0.927 4.690 1.00 0.00 C HETATM 523 O14 PSO A 9 2.377 2.068 4.470 1.00 0.00 O HETATM 524 C15 PSO A 9 5.333 0.836 2.930 1.00 0.00 C HETATM 525 C16 PSO A 9 1.911 -0.079 -1.196 1.00 0.00 C HETATM 0 H163 PSO A 9 2.548 0.763 -1.466 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.472 -1.007 -1.303 1.00 0.00 H new HETATM 0 H161 PSO A 9 1.042 -0.103 -1.854 1.00 0.00 H new HETATM 0 H153 PSO A 9 4.934 1.841 3.068 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.728 0.469 3.877 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.132 0.862 2.189 1.00 0.00 H new HETATM 0 H132 PSO A 9 2.850 0.425 5.599 1.00 0.00 H new HETATM 0 H131 PSO A 9 4.212 1.245 4.860 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.780 0.720 3.880 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.829 -1.033 3.581 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.356 -0.284 4.239 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.325 -0.085 3.941 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.623 0.384 1.258 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.436 2.665 5.245 1.00 0.00 H new