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 -21:sc= 0.0496 USER MOD Single : A 4 DT C7 :methyl -30:sc= -1.5! (180deg=-4.09!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot 180:sc= 0.248 USER MOD Single : B 9 DG O5' : rot -25:sc= 0.0792 USER MOD Single : B 12 DT C7 :methyl 150:sc= -3.52! (180deg=-3.52!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.951 -13.971 9.323 1.00 0.00 O ATOM 2 C5' DG A 1 -2.672 -12.604 9.526 1.00 0.00 C ATOM 3 C4' DG A 1 -1.152 -12.410 9.559 1.00 0.00 C ATOM 4 O4' DG A 1 -0.515 -13.014 8.431 1.00 0.00 O ATOM 5 C3' DG A 1 -0.773 -10.946 9.542 1.00 0.00 C ATOM 6 O3' DG A 1 0.427 -10.767 10.271 1.00 0.00 O ATOM 7 C2' DG A 1 -0.650 -10.710 8.060 1.00 0.00 C ATOM 8 C1' DG A 1 -0.165 -12.020 7.468 1.00 0.00 C ATOM 9 N9 DG A 1 -0.820 -12.275 6.159 1.00 0.00 N ATOM 10 C8 DG A 1 -2.136 -12.598 5.938 1.00 0.00 C ATOM 11 N7 DG A 1 -2.469 -12.702 4.688 1.00 0.00 N ATOM 12 C5 DG A 1 -1.282 -12.453 4.014 1.00 0.00 C ATOM 13 C6 DG A 1 -1.022 -12.459 2.615 1.00 0.00 C ATOM 14 O6 DG A 1 -1.822 -12.634 1.701 1.00 0.00 O ATOM 15 N1 DG A 1 0.309 -12.236 2.316 1.00 0.00 N ATOM 16 C2 DG A 1 1.282 -11.996 3.256 1.00 0.00 C ATOM 17 N2 DG A 1 2.524 -11.821 2.812 1.00 0.00 N ATOM 18 N3 DG A 1 1.045 -11.953 4.578 1.00 0.00 N ATOM 19 C4 DG A 1 -0.257 -12.203 4.897 1.00 0.00 C ATOM 0 H5' DG A 1 -3.116 -12.263 10.461 1.00 0.00 H new ATOM 0 H5'' DG A 1 -3.112 -12.006 8.727 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.820 -12.881 10.484 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.466 -10.247 10.010 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.608 -10.419 7.630 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.052 -9.903 7.850 1.00 0.00 H new ATOM 0 HO5' DG A 1 -2.169 -14.409 8.927 1.00 0.00 H new ATOM 0 H1' DG A 1 0.907 -12.015 7.272 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.840 -12.754 6.742 1.00 0.00 H new ATOM 0 H1 DG A 1 0.587 -12.251 1.335 1.00 0.00 H new ATOM 0 H21 DG A 1 3.281 -11.640 3.472 1.00 0.00 H new ATOM 0 H22 DG A 1 2.719 -11.868 1.812 1.00 0.00 H new ATOM 32 P DC A 2 1.068 -9.314 10.544 1.00 0.00 P ATOM 33 OP1 DC A 2 1.745 -9.349 11.858 1.00 0.00 O ATOM 34 OP2 DC A 2 0.038 -8.288 10.272 1.00 0.00 O ATOM 35 O5' DC A 2 2.186 -9.217 9.392 1.00 0.00 O ATOM 36 C5' DC A 2 3.205 -10.188 9.303 1.00 0.00 C ATOM 37 C4' DC A 2 4.292 -9.782 8.307 1.00 0.00 C ATOM 38 O4' DC A 2 3.867 -9.861 6.950 1.00 0.00 O ATOM 39 C3' DC A 2 4.778 -8.352 8.526 1.00 0.00 C ATOM 40 O3' DC A 2 6.170 -8.436 8.303 1.00 0.00 O ATOM 41 C2' DC A 2 3.951 -7.585 7.490 1.00 0.00 C ATOM 42 C1' DC A 2 3.818 -8.579 6.326 1.00 0.00 C ATOM 43 N1 DC A 2 2.516 -8.533 5.576 1.00 0.00 N ATOM 44 C2 DC A 2 2.509 -8.860 4.222 1.00 0.00 C ATOM 45 O2 DC A 2 3.558 -9.095 3.627 1.00 0.00 O ATOM 46 N3 DC A 2 1.325 -8.925 3.536 1.00 0.00 N ATOM 47 C4 DC A 2 0.170 -8.685 4.172 1.00 0.00 C ATOM 48 N4 DC A 2 -0.974 -8.853 3.516 1.00 0.00 N ATOM 49 C5 DC A 2 0.128 -8.372 5.562 1.00 0.00 C ATOM 50 C6 DC A 2 1.314 -8.335 6.212 1.00 0.00 C ATOM 0 H5' DC A 2 2.773 -11.142 9.000 1.00 0.00 H new ATOM 0 H5'' DC A 2 3.651 -10.338 10.286 1.00 0.00 H new ATOM 0 H4' DC A 2 5.094 -10.497 8.490 1.00 0.00 H new ATOM 0 H3' DC A 2 4.652 -7.862 9.492 1.00 0.00 H new ATOM 0 H2' DC A 2 2.977 -7.299 7.887 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.450 -6.667 7.179 1.00 0.00 H new ATOM 0 H1' DC A 2 4.596 -8.348 5.599 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.862 -8.675 3.985 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.964 -9.160 2.543 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.804 -8.174 6.071 1.00 0.00 H new ATOM 0 H6 DC A 2 1.316 -8.142 7.275 1.00 0.00 H new ATOM 62 P DG A 3 7.124 -7.157 8.264 1.00 0.00 P ATOM 63 OP1 DG A 3 8.500 -7.583 8.596 1.00 0.00 O ATOM 64 OP2 DG A 3 6.481 -6.056 9.013 1.00 0.00 O ATOM 65 O5' DG A 3 7.023 -6.849 6.697 1.00 0.00 O ATOM 66 C5' DG A 3 7.485 -7.781 5.740 1.00 0.00 C ATOM 67 C4' DG A 3 7.646 -7.107 4.379 1.00 0.00 C ATOM 68 O4' DG A 3 6.369 -7.035 3.788 1.00 0.00 O ATOM 69 C3' DG A 3 8.202 -5.686 4.534 1.00 0.00 C ATOM 70 O3' DG A 3 9.096 -5.409 3.474 1.00 0.00 O ATOM 71 C2' DG A 3 6.901 -4.885 4.505 1.00 0.00 C ATOM 72 C1' DG A 3 6.048 -5.689 3.542 1.00 0.00 C ATOM 73 N9 DG A 3 4.596 -5.523 3.737 1.00 0.00 N ATOM 74 C8 DG A 3 3.884 -5.243 4.875 1.00 0.00 C ATOM 75 N7 DG A 3 2.600 -5.434 4.754 1.00 0.00 N ATOM 76 C5 DG A 3 2.437 -5.787 3.415 1.00 0.00 C ATOM 77 C6 DG A 3 1.260 -6.018 2.637 1.00 0.00 C ATOM 78 O6 DG A 3 0.090 -6.051 3.014 1.00 0.00 O ATOM 79 N1 DG A 3 1.545 -6.224 1.297 1.00 0.00 N ATOM 80 C2 DG A 3 2.814 -6.242 0.762 1.00 0.00 C ATOM 81 N2 DG A 3 2.982 -6.434 -0.540 1.00 0.00 N ATOM 82 N3 DG A 3 3.918 -6.047 1.481 1.00 0.00 N ATOM 83 C4 DG A 3 3.657 -5.816 2.789 1.00 0.00 C ATOM 0 H5' DG A 3 6.783 -8.611 5.662 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.439 -8.200 6.061 1.00 0.00 H new ATOM 0 H4' DG A 3 8.341 -7.681 3.766 1.00 0.00 H new ATOM 0 H3' DG A 3 8.797 -5.475 5.423 1.00 0.00 H new ATOM 0 H2' DG A 3 6.444 -4.815 5.492 1.00 0.00 H new ATOM 0 H2'' DG A 3 7.059 -3.865 4.154 1.00 0.00 H new ATOM 0 H1' DG A 3 6.257 -5.350 2.527 1.00 0.00 H new ATOM 0 H8 DG A 3 4.345 -4.896 5.788 1.00 0.00 H new ATOM 0 H1 DG A 3 0.760 -6.373 0.662 1.00 0.00 H new ATOM 0 H21 DG A 3 3.922 -6.447 -0.936 1.00 0.00 H new ATOM 0 H22 DG A 3 2.171 -6.568 -1.144 1.00 0.00 H new ATOM 95 P DT A 4 10.009 -4.076 3.451 1.00 0.00 P ATOM 96 OP1 DT A 4 11.305 -4.418 2.828 1.00 0.00 O ATOM 97 OP2 DT A 4 9.976 -3.461 4.796 1.00 0.00 O ATOM 98 O5' DT A 4 9.182 -3.143 2.446 1.00 0.00 O ATOM 99 C5' DT A 4 9.149 -3.443 1.067 1.00 0.00 C ATOM 100 C4' DT A 4 7.872 -2.875 0.459 1.00 0.00 C ATOM 101 O4' DT A 4 6.723 -3.327 1.164 1.00 0.00 O ATOM 102 C3' DT A 4 7.752 -1.358 0.544 1.00 0.00 C ATOM 103 O3' DT A 4 8.527 -0.635 -0.388 1.00 0.00 O ATOM 104 C2' DT A 4 6.260 -1.264 0.260 1.00 0.00 C ATOM 105 C1' DT A 4 5.631 -2.593 0.642 1.00 0.00 C ATOM 106 N1 DT A 4 4.478 -2.468 1.580 1.00 0.00 N ATOM 107 C2 DT A 4 3.229 -2.959 1.223 1.00 0.00 C ATOM 108 O2 DT A 4 2.966 -3.354 0.092 1.00 0.00 O ATOM 109 N3 DT A 4 2.264 -2.993 2.199 1.00 0.00 N ATOM 110 C4 DT A 4 2.342 -2.474 3.463 1.00 0.00 C ATOM 111 O4 DT A 4 1.491 -2.753 4.303 1.00 0.00 O ATOM 112 C5 DT A 4 3.502 -1.542 3.787 1.00 0.00 C ATOM 113 C7 DT A 4 4.122 -1.764 5.167 1.00 0.00 C ATOM 114 C6 DT A 4 4.609 -1.529 2.727 1.00 0.00 C ATOM 0 H5' DT A 4 9.189 -4.522 0.917 1.00 0.00 H new ATOM 0 H5'' DT A 4 10.022 -3.020 0.570 1.00 0.00 H new ATOM 0 H4' DT A 4 7.925 -3.207 -0.578 1.00 0.00 H new ATOM 0 H3' DT A 4 8.116 -0.923 1.475 1.00 0.00 H new ATOM 0 H2' DT A 4 5.813 -0.451 0.832 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.084 -1.047 -0.794 1.00 0.00 H new ATOM 0 H1' DT A 4 5.162 -3.093 -0.206 1.00 0.00 H new ATOM 0 H3 DT A 4 1.390 -3.458 1.954 1.00 0.00 H new ATOM 0 H71 DT A 4 3.360 -2.134 5.853 1.00 0.00 H new ATOM 0 H72 DT A 4 4.927 -2.495 5.091 1.00 0.00 H new ATOM 0 H73 DT A 4 4.521 -0.822 5.542 1.00 0.00 H new ATOM 0 H6 DT A 4 5.454 -0.862 2.810 1.00 0.00 H new ATOM 127 P DA A 5 8.456 0.980 -0.434 1.00 0.00 P ATOM 128 OP1 DA A 5 9.671 1.462 -1.124 1.00 0.00 O ATOM 129 OP2 DA A 5 8.156 1.468 0.930 1.00 0.00 O ATOM 130 O5' DA A 5 7.168 1.290 -1.369 1.00 0.00 O ATOM 131 C5' DA A 5 7.336 1.351 -2.769 1.00 0.00 C ATOM 132 C4' DA A 5 6.075 1.466 -3.635 1.00 0.00 C ATOM 133 O4' DA A 5 4.906 1.356 -2.828 1.00 0.00 O ATOM 134 C3' DA A 5 6.088 2.831 -4.313 1.00 0.00 C ATOM 135 O3' DA A 5 5.314 2.869 -5.493 1.00 0.00 O ATOM 136 C2' DA A 5 5.465 3.544 -3.140 1.00 0.00 C ATOM 137 C1' DA A 5 4.308 2.634 -2.752 1.00 0.00 C ATOM 138 N9 DA A 5 3.765 2.937 -1.410 1.00 0.00 N ATOM 139 C8 DA A 5 4.453 3.064 -0.234 1.00 0.00 C ATOM 140 N7 DA A 5 3.700 3.240 0.817 1.00 0.00 N ATOM 141 C5 DA A 5 2.409 3.233 0.292 1.00 0.00 C ATOM 142 C6 DA A 5 1.128 3.330 0.872 1.00 0.00 C ATOM 143 N6 DA A 5 0.963 3.366 2.191 1.00 0.00 N ATOM 144 N1 DA A 5 0.039 3.309 0.078 1.00 0.00 N ATOM 145 C2 DA A 5 0.225 3.184 -1.232 1.00 0.00 C ATOM 146 N3 DA A 5 1.367 3.074 -1.901 1.00 0.00 N ATOM 147 C4 DA A 5 2.439 3.095 -1.069 1.00 0.00 C ATOM 0 H5' DA A 5 7.877 0.457 -3.081 1.00 0.00 H new ATOM 0 H5'' DA A 5 7.975 2.205 -2.993 1.00 0.00 H new ATOM 0 H4' DA A 5 6.064 0.665 -4.374 1.00 0.00 H new ATOM 0 H3' DA A 5 7.035 3.217 -4.691 1.00 0.00 H new ATOM 0 H2' DA A 5 6.173 3.666 -2.321 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.119 4.541 -3.413 1.00 0.00 H new ATOM 0 H1' DA A 5 3.434 2.743 -3.393 1.00 0.00 H new ATOM 0 H8 DA A 5 5.531 3.022 -0.180 1.00 0.00 H new ATOM 0 H61 DA A 5 0.025 3.436 2.586 1.00 0.00 H new ATOM 0 H62 DA A 5 1.774 3.323 2.808 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.672 3.170 -1.833 1.00 0.00 H new ATOM 159 P DC A 6 5.200 4.225 -6.373 1.00 0.00 P ATOM 160 OP1 DC A 6 5.218 3.846 -7.802 1.00 0.00 O ATOM 161 OP2 DC A 6 6.179 5.207 -5.860 1.00 0.00 O ATOM 162 O5' DC A 6 3.726 4.737 -5.986 1.00 0.00 O ATOM 163 C5' DC A 6 2.625 3.944 -6.353 1.00 0.00 C ATOM 164 C4' DC A 6 1.270 4.578 -6.056 1.00 0.00 C ATOM 165 O4' DC A 6 0.999 4.632 -4.650 1.00 0.00 O ATOM 166 C3' DC A 6 1.126 6.011 -6.593 1.00 0.00 C ATOM 167 O3' DC A 6 -0.130 6.144 -7.242 1.00 0.00 O ATOM 168 C2' DC A 6 1.191 6.851 -5.316 1.00 0.00 C ATOM 169 C1' DC A 6 0.638 5.950 -4.225 1.00 0.00 C ATOM 170 N1 DC A 6 1.132 6.256 -2.855 1.00 0.00 N ATOM 171 C2 DC A 6 0.198 6.459 -1.840 1.00 0.00 C ATOM 172 O2 DC A 6 -1.000 6.589 -2.068 1.00 0.00 O ATOM 173 N3 DC A 6 0.605 6.519 -0.550 1.00 0.00 N ATOM 174 C4 DC A 6 1.902 6.463 -0.252 1.00 0.00 C ATOM 175 N4 DC A 6 2.227 6.369 1.030 1.00 0.00 N ATOM 176 C5 DC A 6 2.898 6.334 -1.273 1.00 0.00 C ATOM 177 C6 DC A 6 2.465 6.234 -2.551 1.00 0.00 C ATOM 0 H5' DC A 6 2.689 2.989 -5.831 1.00 0.00 H new ATOM 0 H5'' DC A 6 2.686 3.728 -7.420 1.00 0.00 H new ATOM 0 H4' DC A 6 0.560 3.928 -6.568 1.00 0.00 H new ATOM 0 H3' DC A 6 1.879 6.302 -7.325 1.00 0.00 H new ATOM 0 H2' DC A 6 2.214 7.156 -5.096 1.00 0.00 H new ATOM 0 H2'' DC A 6 0.601 7.762 -5.412 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.438 6.089 -4.118 1.00 0.00 H new ATOM 0 H41 DC A 6 3.208 6.323 1.305 1.00 0.00 H new ATOM 0 H42 DC A 6 1.496 6.342 1.741 1.00 0.00 H new ATOM 0 H5 DC A 6 3.951 6.317 -1.033 1.00 0.00 H new ATOM 0 H6 DC A 6 3.187 6.135 -3.348 1.00 0.00 H new ATOM 189 P DG A 7 -0.623 7.540 -7.906 1.00 0.00 P ATOM 190 OP1 DG A 7 -1.532 7.212 -9.025 1.00 0.00 O ATOM 191 OP2 DG A 7 0.575 8.370 -8.161 1.00 0.00 O ATOM 192 O5' DG A 7 -1.487 8.260 -6.735 1.00 0.00 O ATOM 193 C5' DG A 7 -2.765 7.766 -6.385 1.00 0.00 C ATOM 194 C4' DG A 7 -3.557 8.653 -5.415 1.00 0.00 C ATOM 195 O4' DG A 7 -2.951 8.678 -4.137 1.00 0.00 O ATOM 196 C3' DG A 7 -3.683 10.105 -5.888 1.00 0.00 C ATOM 197 O3' DG A 7 -5.010 10.518 -5.602 1.00 0.00 O ATOM 198 C2' DG A 7 -2.599 10.791 -5.073 1.00 0.00 C ATOM 199 C1' DG A 7 -2.661 10.015 -3.767 1.00 0.00 C ATOM 200 N9 DG A 7 -1.440 9.982 -2.941 1.00 0.00 N ATOM 201 C8 DG A 7 -0.133 9.888 -3.332 1.00 0.00 C ATOM 202 N7 DG A 7 0.704 9.688 -2.351 1.00 0.00 N ATOM 203 C5 DG A 7 -0.111 9.651 -1.218 1.00 0.00 C ATOM 204 C6 DG A 7 0.205 9.484 0.166 1.00 0.00 C ATOM 205 O6 DG A 7 1.311 9.351 0.683 1.00 0.00 O ATOM 206 N1 DG A 7 -0.917 9.479 0.983 1.00 0.00 N ATOM 207 C2 DG A 7 -2.197 9.658 0.530 1.00 0.00 C ATOM 208 N2 DG A 7 -3.185 9.652 1.416 1.00 0.00 N ATOM 209 N3 DG A 7 -2.506 9.845 -0.757 1.00 0.00 N ATOM 210 C4 DG A 7 -1.424 9.818 -1.577 1.00 0.00 C ATOM 0 H5' DG A 7 -2.647 6.779 -5.938 1.00 0.00 H new ATOM 0 H5'' DG A 7 -3.350 7.636 -7.295 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.551 8.207 -5.372 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.541 10.313 -6.949 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.621 10.717 -5.548 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.804 11.852 -4.929 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.399 10.521 -3.145 1.00 0.00 H new ATOM 0 H8 DG A 7 0.179 9.972 -4.362 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.780 9.333 1.983 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.148 9.783 1.107 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.981 9.516 2.406 1.00 0.00 H new ATOM 222 P DC A 8 -5.588 11.965 -6.005 1.00 0.00 P ATOM 223 OP1 DC A 8 -7.038 11.829 -6.257 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.708 12.535 -7.049 1.00 0.00 O ATOM 225 O5' DC A 8 -5.375 12.808 -4.653 1.00 0.00 O ATOM 226 C5' DC A 8 -6.290 12.740 -3.576 1.00 0.00 C ATOM 227 C4' DC A 8 -5.718 13.477 -2.356 1.00 0.00 C ATOM 228 O4' DC A 8 -4.614 12.734 -1.848 1.00 0.00 O ATOM 229 C3' DC A 8 -5.193 14.883 -2.718 1.00 0.00 C ATOM 230 O3' DC A 8 -5.474 15.830 -1.708 1.00 0.00 O ATOM 231 C2' DC A 8 -3.698 14.608 -2.804 1.00 0.00 C ATOM 232 C1' DC A 8 -3.573 13.657 -1.613 1.00 0.00 C ATOM 233 N1 DC A 8 -2.231 13.077 -1.390 1.00 0.00 N ATOM 234 C2 DC A 8 -1.788 12.846 -0.088 1.00 0.00 C ATOM 235 O2 DC A 8 -2.573 12.809 0.856 1.00 0.00 O ATOM 236 N3 DC A 8 -0.453 12.657 0.140 1.00 0.00 N ATOM 237 C4 DC A 8 0.421 12.754 -0.870 1.00 0.00 C ATOM 238 N4 DC A 8 1.706 12.531 -0.632 1.00 0.00 N ATOM 239 C5 DC A 8 -0.018 13.021 -2.204 1.00 0.00 C ATOM 240 C6 DC A 8 -1.335 13.147 -2.398 1.00 0.00 C ATOM 0 H5' DC A 8 -6.489 11.699 -3.322 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.241 13.185 -3.867 1.00 0.00 H new ATOM 0 H4' DC A 8 -6.523 13.575 -1.628 1.00 0.00 H new ATOM 0 H3' DC A 8 -5.639 15.307 -3.617 1.00 0.00 H new ATOM 0 H2' DC A 8 -3.407 14.145 -3.747 1.00 0.00 H new ATOM 0 H2'' DC A 8 -3.095 15.509 -2.691 1.00 0.00 H new ATOM 0 HO3' DC A 8 -5.124 16.706 -1.974 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.679 14.168 -0.656 1.00 0.00 H new ATOM 0 H41 DC A 8 2.385 12.601 -1.390 1.00 0.00 H new ATOM 0 H42 DC A 8 2.016 12.290 0.309 1.00 0.00 H new ATOM 0 H5 DC A 8 0.683 13.117 -3.020 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.697 13.312 -3.402 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.227 12.915 8.839 1.00 0.00 O ATOM 255 C5' DG B 9 3.733 11.769 9.498 1.00 0.00 C ATOM 256 C4' DG B 9 2.224 11.922 9.715 1.00 0.00 C ATOM 257 O4' DG B 9 1.555 12.360 8.539 1.00 0.00 O ATOM 258 C3' DG B 9 1.578 10.613 10.114 1.00 0.00 C ATOM 259 O3' DG B 9 0.513 10.891 11.009 1.00 0.00 O ATOM 260 C2' DG B 9 1.127 10.041 8.774 1.00 0.00 C ATOM 261 C1' DG B 9 0.985 11.252 7.853 1.00 0.00 C ATOM 262 N9 DG B 9 1.599 11.125 6.504 1.00 0.00 N ATOM 263 C8 DG B 9 2.903 10.860 6.155 1.00 0.00 C ATOM 264 N7 DG B 9 3.161 10.996 4.887 1.00 0.00 N ATOM 265 C5 DG B 9 1.944 11.383 4.340 1.00 0.00 C ATOM 266 C6 DG B 9 1.606 11.721 2.996 1.00 0.00 C ATOM 267 O6 DG B 9 2.350 11.781 2.022 1.00 0.00 O ATOM 268 N1 DG B 9 0.261 12.009 2.834 1.00 0.00 N ATOM 269 C2 DG B 9 -0.651 12.013 3.860 1.00 0.00 C ATOM 270 N2 DG B 9 -1.921 12.271 3.569 1.00 0.00 N ATOM 271 N3 DG B 9 -0.338 11.746 5.135 1.00 0.00 N ATOM 272 C4 DG B 9 0.977 11.439 5.312 1.00 0.00 C ATOM 0 H5' DG B 9 4.239 11.639 10.455 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.938 10.878 8.905 1.00 0.00 H new ATOM 0 H4' DG B 9 2.125 12.662 10.509 1.00 0.00 H new ATOM 0 H3' DG B 9 2.217 9.905 10.642 1.00 0.00 H new ATOM 0 H2' DG B 9 1.856 9.331 8.383 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.182 9.506 8.871 1.00 0.00 H new ATOM 0 HO5' DG B 9 3.505 13.334 8.326 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.078 11.368 7.644 1.00 0.00 H new ATOM 0 H8 DG B 9 3.652 10.563 6.875 1.00 0.00 H new ATOM 0 H1 DG B 9 -0.072 12.232 1.896 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.622 12.281 4.310 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.195 12.459 2.605 1.00 0.00 H new ATOM 285 P DC B 10 -0.348 9.735 11.735 1.00 0.00 P ATOM 286 OP1 DC B 10 -0.977 10.319 12.939 1.00 0.00 O ATOM 287 OP2 DC B 10 0.503 8.532 11.857 1.00 0.00 O ATOM 288 O5' DC B 10 -1.496 9.440 10.648 1.00 0.00 O ATOM 289 C5' DC B 10 -2.444 10.434 10.319 1.00 0.00 C ATOM 290 C4' DC B 10 -3.138 10.089 9.000 1.00 0.00 C ATOM 291 O4' DC B 10 -2.214 10.103 7.923 1.00 0.00 O ATOM 292 C3' DC B 10 -3.796 8.701 9.002 1.00 0.00 C ATOM 293 O3' DC B 10 -5.163 8.900 8.698 1.00 0.00 O ATOM 294 C2' DC B 10 -3.007 7.968 7.905 1.00 0.00 C ATOM 295 C1' DC B 10 -2.617 9.115 6.997 1.00 0.00 C ATOM 296 N1 DC B 10 -1.563 8.788 6.000 1.00 0.00 N ATOM 297 C2 DC B 10 -1.780 9.028 4.643 1.00 0.00 C ATOM 298 O2 DC B 10 -2.878 9.395 4.229 1.00 0.00 O ATOM 299 N3 DC B 10 -0.754 8.854 3.754 1.00 0.00 N ATOM 300 C4 DC B 10 0.421 8.375 4.184 1.00 0.00 C ATOM 301 N4 DC B 10 1.449 8.355 3.343 1.00 0.00 N ATOM 302 C5 DC B 10 0.644 8.055 5.558 1.00 0.00 C ATOM 303 C6 DC B 10 -0.368 8.291 6.416 1.00 0.00 C ATOM 0 H5' DC B 10 -1.951 11.403 10.236 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.183 10.519 11.115 1.00 0.00 H new ATOM 0 H4' DC B 10 -3.909 10.850 8.881 1.00 0.00 H new ATOM 0 H3' DC B 10 -3.771 8.133 9.932 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.137 7.447 8.304 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.615 7.225 7.389 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.436 9.424 6.347 1.00 0.00 H new ATOM 0 H41 DC B 10 2.352 7.994 3.650 1.00 0.00 H new ATOM 0 H42 DC B 10 1.335 8.700 2.390 1.00 0.00 H new ATOM 0 H5 DC B 10 1.583 7.642 5.895 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.225 8.079 7.465 1.00 0.00 H new ATOM 315 P DG B 11 -6.193 7.682 8.521 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.534 8.142 8.940 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.603 6.475 9.140 1.00 0.00 O ATOM 318 O5' DG B 11 -6.186 7.483 6.922 1.00 0.00 O ATOM 319 C5' DG B 11 -6.722 8.462 6.051 1.00 0.00 C ATOM 320 C4' DG B 11 -7.352 7.813 4.808 1.00 0.00 C ATOM 321 O4' DG B 11 -6.366 7.601 3.820 1.00 0.00 O ATOM 322 C3' DG B 11 -7.991 6.452 5.101 1.00 0.00 C ATOM 323 O3' DG B 11 -9.125 6.302 4.267 1.00 0.00 O ATOM 324 C2' DG B 11 -6.841 5.500 4.794 1.00 0.00 C ATOM 325 C1' DG B 11 -6.110 6.220 3.663 1.00 0.00 C ATOM 326 N9 DG B 11 -4.648 6.043 3.682 1.00 0.00 N ATOM 327 C8 DG B 11 -3.828 5.812 4.749 1.00 0.00 C ATOM 328 N7 DG B 11 -2.556 5.864 4.474 1.00 0.00 N ATOM 329 C5 DG B 11 -2.530 6.124 3.104 1.00 0.00 C ATOM 330 C6 DG B 11 -1.436 6.197 2.189 1.00 0.00 C ATOM 331 O6 DG B 11 -0.237 6.088 2.429 1.00 0.00 O ATOM 332 N1 DG B 11 -1.846 6.419 0.884 1.00 0.00 N ATOM 333 C2 DG B 11 -3.160 6.534 0.491 1.00 0.00 C ATOM 334 N2 DG B 11 -3.440 6.728 -0.791 1.00 0.00 N ATOM 335 N3 DG B 11 -4.192 6.424 1.329 1.00 0.00 N ATOM 336 C4 DG B 11 -3.809 6.228 2.616 1.00 0.00 C ATOM 0 H5' DG B 11 -5.935 9.151 5.745 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.473 9.050 6.578 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.126 8.503 4.472 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.372 6.290 6.109 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.198 5.348 5.661 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.199 4.518 4.486 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.472 5.801 2.724 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.203 5.603 5.740 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.126 6.503 0.167 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.410 6.815 -1.094 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.685 6.791 -1.474 1.00 0.00 H new ATOM 348 P DT B 12 -10.061 4.995 4.326 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.409 5.368 3.847 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.897 4.371 5.657 1.00 0.00 O ATOM 351 O5' DT B 12 -9.359 4.051 3.231 1.00 0.00 O ATOM 352 C5' DT B 12 -9.687 4.161 1.863 1.00 0.00 C ATOM 353 C4' DT B 12 -8.750 3.300 1.013 1.00 0.00 C ATOM 354 O4' DT B 12 -7.503 3.921 0.749 1.00 0.00 O ATOM 355 C3' DT B 12 -8.467 1.912 1.583 1.00 0.00 C ATOM 356 O3' DT B 12 -9.469 0.963 1.255 1.00 0.00 O ATOM 357 C2' DT B 12 -7.195 1.641 0.793 1.00 0.00 C ATOM 358 C1' DT B 12 -6.637 2.939 0.191 1.00 0.00 C ATOM 359 N1 DT B 12 -5.289 3.125 0.735 1.00 0.00 N ATOM 360 C2 DT B 12 -4.121 3.370 0.010 1.00 0.00 C ATOM 361 O2 DT B 12 -4.116 3.574 -1.199 1.00 0.00 O ATOM 362 N3 DT B 12 -2.942 3.367 0.761 1.00 0.00 N ATOM 363 C4 DT B 12 -2.861 3.151 2.130 1.00 0.00 C ATOM 364 O4 DT B 12 -1.785 3.195 2.712 1.00 0.00 O ATOM 365 C5 DT B 12 -4.138 2.880 2.758 1.00 0.00 C ATOM 366 C7 DT B 12 -4.346 2.560 4.195 1.00 0.00 C ATOM 367 C6 DT B 12 -5.259 2.880 2.048 1.00 0.00 C ATOM 0 H5' DT B 12 -9.617 5.203 1.549 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.719 3.849 1.705 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.314 3.186 0.087 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.413 1.852 2.670 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.448 1.187 1.444 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.402 0.926 -0.003 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.588 2.966 -0.898 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.069 3.538 0.262 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.328 2.914 4.508 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.286 1.481 4.340 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.576 3.049 4.792 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.190 2.672 2.555 1.00 0.00 H new ATOM 380 P DA B 13 -9.262 -0.618 1.555 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.409 -1.345 0.971 1.00 0.00 O ATOM 382 OP2 DA B 13 -8.951 -0.763 2.993 1.00 0.00 O ATOM 383 O5' DA B 13 -7.931 -0.995 0.711 1.00 0.00 O ATOM 384 C5' DA B 13 -7.906 -0.902 -0.702 1.00 0.00 C ATOM 385 C4' DA B 13 -6.490 -0.666 -1.295 1.00 0.00 C ATOM 386 O4' DA B 13 -5.392 -0.890 -0.448 1.00 0.00 O ATOM 387 C3' DA B 13 -6.401 -1.685 -2.428 1.00 0.00 C ATOM 388 O3' DA B 13 -5.667 -1.200 -3.531 1.00 0.00 O ATOM 389 C2' DA B 13 -5.692 -2.797 -1.635 1.00 0.00 C ATOM 390 C1' DA B 13 -4.628 -1.974 -0.933 1.00 0.00 C ATOM 391 N9 DA B 13 -4.087 -2.579 0.286 1.00 0.00 N ATOM 392 C8 DA B 13 -4.720 -2.627 1.498 1.00 0.00 C ATOM 393 N7 DA B 13 -3.950 -2.966 2.496 1.00 0.00 N ATOM 394 C5 DA B 13 -2.701 -3.104 1.893 1.00 0.00 C ATOM 395 C6 DA B 13 -1.411 -3.352 2.394 1.00 0.00 C ATOM 396 N6 DA B 13 -1.169 -3.536 3.690 1.00 0.00 N ATOM 397 N1 DA B 13 -0.372 -3.319 1.548 1.00 0.00 N ATOM 398 C2 DA B 13 -0.586 -3.060 0.265 1.00 0.00 C ATOM 399 N3 DA B 13 -1.741 -2.816 -0.334 1.00 0.00 N ATOM 400 C4 DA B 13 -2.770 -2.847 0.550 1.00 0.00 C ATOM 0 H5' DA B 13 -8.560 -0.087 -1.014 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.317 -1.819 -1.124 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.413 0.389 -1.556 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.334 -1.977 -2.909 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.359 -3.302 -0.936 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.267 -3.565 -2.281 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.795 -1.795 -1.613 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.770 -2.403 1.619 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.217 -3.713 4.011 1.00 0.00 H new ATOM 0 H62 DA B 13 -1.935 -3.500 4.362 1.00 0.00 H new ATOM 0 H2 DA B 13 0.289 -3.047 -0.368 1.00 0.00 H new ATOM 412 P DC B 14 -5.585 -2.050 -4.901 1.00 0.00 P ATOM 413 OP1 DC B 14 -5.411 -1.097 -6.019 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.715 -3.003 -4.923 1.00 0.00 O ATOM 415 O5' DC B 14 -4.227 -2.894 -4.720 1.00 0.00 O ATOM 416 C5' DC B 14 -2.986 -2.273 -4.962 1.00 0.00 C ATOM 417 C4' DC B 14 -1.801 -3.220 -4.773 1.00 0.00 C ATOM 418 O4' DC B 14 -1.625 -3.542 -3.387 1.00 0.00 O ATOM 419 C3' DC B 14 -1.949 -4.561 -5.515 1.00 0.00 C ATOM 420 O3' DC B 14 -0.919 -4.675 -6.488 1.00 0.00 O ATOM 421 C2' DC B 14 -1.838 -5.608 -4.410 1.00 0.00 C ATOM 422 C1' DC B 14 -1.225 -4.904 -3.212 1.00 0.00 C ATOM 423 N1 DC B 14 -1.687 -5.527 -1.949 1.00 0.00 N ATOM 424 C2 DC B 14 -0.747 -6.038 -1.067 1.00 0.00 C ATOM 425 O2 DC B 14 0.411 -6.261 -1.401 1.00 0.00 O ATOM 426 N3 DC B 14 -1.106 -6.304 0.209 1.00 0.00 N ATOM 427 C4 DC B 14 -2.375 -6.169 0.590 1.00 0.00 C ATOM 428 N4 DC B 14 -2.602 -6.278 1.892 1.00 0.00 N ATOM 429 C5 DC B 14 -3.407 -5.789 -0.342 1.00 0.00 C ATOM 430 C6 DC B 14 -3.001 -5.502 -1.601 1.00 0.00 C ATOM 0 H5' DC B 14 -2.875 -1.421 -4.291 1.00 0.00 H new ATOM 0 H5'' DC B 14 -2.973 -1.882 -5.979 1.00 0.00 H new ATOM 0 H4' DC B 14 -0.949 -2.678 -5.184 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.886 -4.671 -6.062 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.818 -6.016 -4.161 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.216 -6.445 -4.729 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.139 -4.979 -3.148 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.551 -6.185 2.254 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.827 -6.455 2.532 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.446 -5.736 -0.052 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.739 -5.247 -2.347 1.00 0.00 H new ATOM 442 P DG B 15 -0.717 -5.998 -7.404 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.139 -5.568 -8.696 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.981 -6.765 -7.389 1.00 0.00 O ATOM 445 O5' DG B 15 0.403 -6.853 -6.602 1.00 0.00 O ATOM 446 C5' DG B 15 1.725 -6.364 -6.496 1.00 0.00 C ATOM 447 C4' DG B 15 2.692 -7.312 -5.775 1.00 0.00 C ATOM 448 O4' DG B 15 2.269 -7.551 -4.446 1.00 0.00 O ATOM 449 C3' DG B 15 2.834 -8.674 -6.461 1.00 0.00 C ATOM 450 O3' DG B 15 4.215 -9.004 -6.422 1.00 0.00 O ATOM 451 C2' DG B 15 1.931 -9.550 -5.608 1.00 0.00 C ATOM 452 C1' DG B 15 2.136 -8.945 -4.226 1.00 0.00 C ATOM 453 N9 DG B 15 1.039 -9.141 -3.257 1.00 0.00 N ATOM 454 C8 DG B 15 -0.311 -9.024 -3.447 1.00 0.00 C ATOM 455 N7 DG B 15 -1.014 -9.089 -2.348 1.00 0.00 N ATOM 456 C5 DG B 15 -0.054 -9.241 -1.346 1.00 0.00 C ATOM 457 C6 DG B 15 -0.181 -9.339 0.076 1.00 0.00 C ATOM 458 O6 DG B 15 -1.208 -9.412 0.746 1.00 0.00 O ATOM 459 N1 DG B 15 1.046 -9.347 0.728 1.00 0.00 N ATOM 460 C2 DG B 15 2.256 -9.374 0.085 1.00 0.00 C ATOM 461 N2 DG B 15 3.358 -9.439 0.821 1.00 0.00 N ATOM 462 N3 DG B 15 2.388 -9.346 -1.244 1.00 0.00 N ATOM 463 C4 DG B 15 1.202 -9.249 -1.897 1.00 0.00 C ATOM 0 H5' DG B 15 1.706 -5.411 -5.967 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.108 -6.165 -7.497 1.00 0.00 H new ATOM 0 H4' DG B 15 3.656 -6.805 -5.800 1.00 0.00 H new ATOM 0 H3' DG B 15 2.545 -8.756 -7.509 1.00 0.00 H new ATOM 0 H2' DG B 15 0.890 -9.499 -5.927 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.225 -10.599 -5.644 1.00 0.00 H new ATOM 0 H1' DG B 15 2.997 -9.443 -3.779 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.757 -8.890 -4.421 1.00 0.00 H new ATOM 0 H1 DG B 15 1.046 -9.332 1.748 1.00 0.00 H new ATOM 0 H21 DG B 15 4.272 -9.460 0.369 1.00 0.00 H new ATOM 0 H22 DG B 15 3.291 -9.467 1.838 1.00 0.00 H new ATOM 475 P DC B 16 4.819 -10.357 -7.048 1.00 0.00 P ATOM 476 OP1 DC B 16 6.200 -10.081 -7.500 1.00 0.00 O ATOM 477 OP2 DC B 16 3.828 -10.905 -7.999 1.00 0.00 O ATOM 478 O5' DC B 16 4.879 -11.327 -5.767 1.00 0.00 O ATOM 479 C5' DC B 16 5.923 -11.248 -4.814 1.00 0.00 C ATOM 480 C4' DC B 16 5.616 -12.168 -3.622 1.00 0.00 C ATOM 481 O4' DC B 16 4.506 -11.635 -2.907 1.00 0.00 O ATOM 482 C3' DC B 16 5.228 -13.592 -4.073 1.00 0.00 C ATOM 483 O3' DC B 16 5.761 -14.586 -3.222 1.00 0.00 O ATOM 484 C2' DC B 16 3.713 -13.524 -3.950 1.00 0.00 C ATOM 485 C1' DC B 16 3.631 -12.713 -2.654 1.00 0.00 C ATOM 486 N1 DC B 16 2.268 -12.356 -2.214 1.00 0.00 N ATOM 487 C2 DC B 16 1.926 -12.403 -0.861 1.00 0.00 C ATOM 488 O2 DC B 16 2.779 -12.435 0.025 1.00 0.00 O ATOM 489 N3 DC B 16 0.605 -12.413 -0.514 1.00 0.00 N ATOM 490 C4 DC B 16 -0.344 -12.434 -1.459 1.00 0.00 C ATOM 491 N4 DC B 16 -1.617 -12.419 -1.093 1.00 0.00 N ATOM 492 C5 DC B 16 -0.002 -12.408 -2.846 1.00 0.00 C ATOM 493 C6 DC B 16 1.297 -12.346 -3.148 1.00 0.00 C ATOM 0 H5' DC B 16 6.036 -10.220 -4.471 1.00 0.00 H new ATOM 0 H5'' DC B 16 6.868 -11.537 -5.273 1.00 0.00 H new ATOM 0 H4' DC B 16 6.516 -12.222 -3.009 1.00 0.00 H new ATOM 0 H3' DC B 16 5.600 -13.860 -5.062 1.00 0.00 H new ATOM 0 H2' DC B 16 3.241 -13.022 -4.795 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.250 -14.507 -3.865 1.00 0.00 H new ATOM 0 HO3' DC B 16 5.490 -15.471 -3.543 1.00 0.00 H new ATOM 0 H1' DC B 16 3.932 -13.286 -1.777 1.00 0.00 H new ATOM 0 H41 DC B 16 -2.351 -12.435 -1.801 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.863 -12.392 -0.103 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.760 -12.437 -3.615 1.00 0.00 H new ATOM 0 H6 DC B 16 1.582 -12.285 -4.188 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.766 0.260 -0.460 1.00 0.00 O HETATM 508 C2 PSO A 9 -2.020 0.363 -0.209 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.558 0.291 1.086 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.689 0.089 2.149 1.00 0.00 C HETATM 511 C5 PSO A 9 0.636 0.055 2.890 1.00 0.00 C HETATM 512 C6 PSO A 9 1.994 0.129 2.559 1.00 0.00 C HETATM 513 C7 PSO A 9 2.394 0.129 1.269 1.00 0.00 C HETATM 514 C8 PSO A 9 1.444 0.075 0.227 1.00 0.00 C HETATM 515 C9 PSO A 9 0.061 0.158 0.526 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.324 0.102 1.861 1.00 0.00 C HETATM 517 C4' PSO A 9 3.151 -0.066 3.496 1.00 0.00 C HETATM 518 C5' PSO A 9 4.233 -0.074 2.433 1.00 0.00 C HETATM 519 O6' PSO A 9 3.641 0.124 1.127 1.00 0.00 O HETATM 520 O11 PSO A 9 -2.791 0.534 -1.150 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.200 -0.132 3.554 1.00 0.00 C HETATM 522 C13 PSO A 9 3.178 0.949 4.662 1.00 0.00 C HETATM 523 O14 PSO A 9 2.361 2.080 4.422 1.00 0.00 O HETATM 524 C15 PSO A 9 5.330 0.844 2.908 1.00 0.00 C HETATM 525 C16 PSO A 9 1.897 -0.079 -1.215 1.00 0.00 C HETATM 0 H163 PSO A 9 2.535 0.762 -1.488 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.456 -1.009 -1.324 1.00 0.00 H new HETATM 0 H161 PSO A 9 1.026 -0.101 -1.870 1.00 0.00 H new HETATM 0 H153 PSO A 9 4.931 1.849 3.041 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.723 0.481 3.858 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.131 0.867 2.169 1.00 0.00 H new HETATM 0 H132 PSO A 9 2.848 0.455 5.576 1.00 0.00 H new HETATM 0 H131 PSO A 9 4.204 1.276 4.829 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.782 0.734 3.870 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.831 -1.021 3.576 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.356 -0.269 4.231 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.326 -0.038 3.931 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.631 0.391 1.252 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.412 2.689 5.188 1.00 0.00 H new