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 -36:sc= 0.0348 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.74! (180deg=-1.74!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : B 1 PSO O14 : rot 180:sc= -0.399 USER MOD Single : B 9 DG O5' : rot -32:sc= 0.0333 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 -0.731 -12.711 9.382 1.00 0.00 O ATOM 2 C5' DG A 1 -0.480 -11.324 9.406 1.00 0.00 C ATOM 3 C4' DG A 1 0.969 -11.082 8.972 1.00 0.00 C ATOM 4 O4' DG A 1 1.153 -11.619 7.669 1.00 0.00 O ATOM 5 C3' DG A 1 1.295 -9.589 8.894 1.00 0.00 C ATOM 6 O3' DG A 1 2.680 -9.423 9.138 1.00 0.00 O ATOM 7 C2' DG A 1 0.896 -9.287 7.454 1.00 0.00 C ATOM 8 C1' DG A 1 1.319 -10.566 6.731 1.00 0.00 C ATOM 9 N9 DG A 1 0.508 -10.841 5.521 1.00 0.00 N ATOM 10 C8 DG A 1 -0.858 -10.904 5.409 1.00 0.00 C ATOM 11 N7 DG A 1 -1.286 -11.206 4.217 1.00 0.00 N ATOM 12 C5 DG A 1 -0.120 -11.383 3.480 1.00 0.00 C ATOM 13 C6 DG A 1 0.062 -11.720 2.105 1.00 0.00 C ATOM 14 O6 DG A 1 -0.799 -11.927 1.252 1.00 0.00 O ATOM 15 N1 DG A 1 1.396 -11.811 1.746 1.00 0.00 N ATOM 16 C2 DG A 1 2.444 -11.583 2.606 1.00 0.00 C ATOM 17 N2 DG A 1 3.682 -11.697 2.139 1.00 0.00 N ATOM 18 N3 DG A 1 2.289 -11.245 3.891 1.00 0.00 N ATOM 19 C4 DG A 1 0.984 -11.167 4.270 1.00 0.00 C ATOM 0 H5' DG A 1 -0.646 -10.927 10.407 1.00 0.00 H new ATOM 0 H5'' DG A 1 -1.167 -10.804 8.738 1.00 0.00 H new ATOM 0 H4' DG A 1 1.618 -11.555 9.708 1.00 0.00 H new ATOM 0 H3' DG A 1 0.796 -8.935 9.609 1.00 0.00 H new ATOM 0 H2' DG A 1 -0.173 -9.099 7.358 1.00 0.00 H new ATOM 0 H2'' DG A 1 1.410 -8.409 7.064 1.00 0.00 H new ATOM 0 HO5' DG A 1 -0.245 -13.119 8.635 1.00 0.00 H new ATOM 0 H1' DG A 1 2.348 -10.467 6.384 1.00 0.00 H new ATOM 0 H8 DG A 1 -1.523 -10.719 6.240 1.00 0.00 H new ATOM 0 H1 DG A 1 1.615 -12.063 0.782 1.00 0.00 H new ATOM 0 H21 DG A 1 4.477 -11.533 2.756 1.00 0.00 H new ATOM 0 H22 DG A 1 3.838 -11.949 1.163 1.00 0.00 H new ATOM 32 P DC A 2 3.397 -7.978 9.156 1.00 0.00 P ATOM 33 OP1 DC A 2 4.346 -7.952 10.289 1.00 0.00 O ATOM 34 OP2 DC A 2 2.354 -6.935 9.047 1.00 0.00 O ATOM 35 O5' DC A 2 4.234 -7.996 7.781 1.00 0.00 O ATOM 36 C5' DC A 2 5.314 -8.892 7.616 1.00 0.00 C ATOM 37 C4' DC A 2 5.983 -8.702 6.253 1.00 0.00 C ATOM 38 O4' DC A 2 5.084 -9.029 5.214 1.00 0.00 O ATOM 39 C3' DC A 2 6.458 -7.263 6.021 1.00 0.00 C ATOM 40 O3' DC A 2 7.813 -7.373 5.630 1.00 0.00 O ATOM 41 C2' DC A 2 5.496 -6.732 4.944 1.00 0.00 C ATOM 42 C1' DC A 2 5.083 -8.014 4.228 1.00 0.00 C ATOM 43 N1 DC A 2 3.706 -7.975 3.668 1.00 0.00 N ATOM 44 C2 DC A 2 3.498 -8.383 2.355 1.00 0.00 C ATOM 45 O2 DC A 2 4.442 -8.601 1.601 1.00 0.00 O ATOM 46 N3 DC A 2 2.226 -8.544 1.892 1.00 0.00 N ATOM 47 C4 DC A 2 1.187 -8.280 2.693 1.00 0.00 C ATOM 48 N4 DC A 2 -0.033 -8.550 2.248 1.00 0.00 N ATOM 49 C5 DC A 2 1.362 -7.879 4.053 1.00 0.00 C ATOM 50 C6 DC A 2 2.634 -7.749 4.491 1.00 0.00 C ATOM 0 H5' DC A 2 4.957 -9.918 7.710 1.00 0.00 H new ATOM 0 H5'' DC A 2 6.045 -8.735 8.409 1.00 0.00 H new ATOM 0 H4' DC A 2 6.849 -9.363 6.249 1.00 0.00 H new ATOM 0 H3' DC A 2 6.435 -6.575 6.866 1.00 0.00 H new ATOM 0 H2' DC A 2 4.641 -6.215 5.380 1.00 0.00 H new ATOM 0 H2'' DC A 2 5.986 -6.028 4.271 1.00 0.00 H new ATOM 0 H1' DC A 2 5.771 -8.171 3.398 1.00 0.00 H new ATOM 0 H41 DC A 2 -0.844 -8.359 2.836 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.160 -8.948 1.318 1.00 0.00 H new ATOM 0 H5 DC A 2 0.518 -7.689 4.700 1.00 0.00 H new ATOM 0 H6 DC A 2 2.810 -7.459 5.516 1.00 0.00 H new ATOM 62 P DG A 3 8.778 -6.102 5.485 1.00 0.00 P ATOM 63 OP1 DG A 3 10.172 -6.584 5.396 1.00 0.00 O ATOM 64 OP2 DG A 3 8.400 -5.106 6.510 1.00 0.00 O ATOM 65 O5' DG A 3 8.318 -5.561 4.053 1.00 0.00 O ATOM 66 C5' DG A 3 8.567 -6.302 2.877 1.00 0.00 C ATOM 67 C4' DG A 3 7.916 -5.594 1.690 1.00 0.00 C ATOM 68 O4' DG A 3 6.571 -5.923 1.472 1.00 0.00 O ATOM 69 C3' DG A 3 7.965 -4.073 1.807 1.00 0.00 C ATOM 70 O3' DG A 3 8.351 -3.573 0.565 1.00 0.00 O ATOM 71 C2' DG A 3 6.520 -3.763 2.116 1.00 0.00 C ATOM 72 C1' DG A 3 5.899 -4.731 1.119 1.00 0.00 C ATOM 73 N9 DG A 3 4.487 -5.024 1.243 1.00 0.00 N ATOM 74 C8 DG A 3 3.762 -4.853 2.352 1.00 0.00 C ATOM 75 N7 DG A 3 2.521 -5.232 2.268 1.00 0.00 N ATOM 76 C5 DG A 3 2.422 -5.645 0.936 1.00 0.00 C ATOM 77 C6 DG A 3 1.291 -6.033 0.163 1.00 0.00 C ATOM 78 O6 DG A 3 0.150 -6.264 0.547 1.00 0.00 O ATOM 79 N1 DG A 3 1.584 -6.144 -1.185 1.00 0.00 N ATOM 80 C2 DG A 3 2.847 -6.059 -1.717 1.00 0.00 C ATOM 81 N2 DG A 3 2.996 -6.252 -3.022 1.00 0.00 N ATOM 82 N3 DG A 3 3.934 -5.795 -0.992 1.00 0.00 N ATOM 83 C4 DG A 3 3.640 -5.552 0.310 1.00 0.00 C ATOM 0 H5' DG A 3 8.168 -7.311 2.977 1.00 0.00 H new ATOM 0 H5'' DG A 3 9.640 -6.399 2.714 1.00 0.00 H new ATOM 0 H4' DG A 3 8.517 -5.952 0.854 1.00 0.00 H new ATOM 0 H3' DG A 3 8.652 -3.656 2.543 1.00 0.00 H new ATOM 0 H2' DG A 3 6.247 -3.978 3.149 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.255 -2.723 1.926 1.00 0.00 H new ATOM 0 H1' DG A 3 5.992 -4.316 0.116 1.00 0.00 H new ATOM 0 H8 DG A 3 4.177 -4.430 3.255 1.00 0.00 H new ATOM 0 H1 DG A 3 0.808 -6.300 -1.828 1.00 0.00 H new ATOM 0 H21 DG A 3 3.923 -6.195 -3.443 1.00 0.00 H new ATOM 0 H22 DG A 3 2.183 -6.458 -3.603 1.00 0.00 H new ATOM 95 P DT A 4 9.863 -3.602 0.052 1.00 0.00 P ATOM 96 OP1 DT A 4 10.020 -4.741 -0.876 1.00 0.00 O ATOM 97 OP2 DT A 4 10.753 -3.456 1.224 1.00 0.00 O ATOM 98 O5' DT A 4 9.814 -2.228 -0.754 1.00 0.00 O ATOM 99 C5' DT A 4 8.685 -1.895 -1.537 1.00 0.00 C ATOM 100 C4' DT A 4 7.518 -1.249 -0.748 1.00 0.00 C ATOM 101 O4' DT A 4 6.394 -2.125 -0.611 1.00 0.00 O ATOM 102 C3' DT A 4 7.755 -0.744 0.706 1.00 0.00 C ATOM 103 O3' DT A 4 9.012 -0.064 0.887 1.00 0.00 O ATOM 104 C2' DT A 4 6.249 -0.410 0.761 1.00 0.00 C ATOM 105 C1' DT A 4 5.375 -1.312 -0.069 1.00 0.00 C ATOM 106 N1 DT A 4 4.182 -1.853 0.715 1.00 0.00 N ATOM 107 C2 DT A 4 3.169 -2.485 0.005 1.00 0.00 C ATOM 108 O2 DT A 4 3.332 -2.855 -1.152 1.00 0.00 O ATOM 109 N3 DT A 4 1.954 -2.696 0.629 1.00 0.00 N ATOM 110 C4 DT A 4 1.572 -2.352 1.905 1.00 0.00 C ATOM 111 O4 DT A 4 0.513 -2.765 2.369 1.00 0.00 O ATOM 112 C5 DT A 4 2.485 -1.450 2.728 1.00 0.00 C ATOM 113 C7 DT A 4 2.725 -1.951 4.155 1.00 0.00 C ATOM 114 C6 DT A 4 3.799 -1.151 2.006 1.00 0.00 C ATOM 0 H5' DT A 4 8.319 -2.798 -2.026 1.00 0.00 H new ATOM 0 H5'' DT A 4 8.996 -1.210 -2.326 1.00 0.00 H new ATOM 0 H4' DT A 4 7.370 -0.380 -1.390 1.00 0.00 H new ATOM 0 H3' DT A 4 8.067 -1.189 1.651 1.00 0.00 H new ATOM 0 H2' DT A 4 5.917 -0.459 1.798 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.106 0.618 0.429 1.00 0.00 H new ATOM 0 H1' DT A 4 4.757 -0.919 -0.877 1.00 0.00 H new ATOM 0 H3 DT A 4 1.246 -3.170 0.069 1.00 0.00 H new ATOM 0 H71 DT A 4 3.712 -1.632 4.491 1.00 0.00 H new ATOM 0 H72 DT A 4 1.965 -1.538 4.818 1.00 0.00 H new ATOM 0 H73 DT A 4 2.670 -3.039 4.173 1.00 0.00 H new ATOM 0 H6 DT A 4 4.474 -0.420 2.426 1.00 0.00 H new ATOM 127 P DA A 5 9.800 0.991 -0.092 1.00 0.00 P ATOM 128 OP1 DA A 5 11.021 0.316 -0.580 1.00 0.00 O ATOM 129 OP2 DA A 5 9.926 2.260 0.654 1.00 0.00 O ATOM 130 O5' DA A 5 8.869 1.283 -1.366 1.00 0.00 O ATOM 131 C5' DA A 5 7.725 2.078 -1.208 1.00 0.00 C ATOM 132 C4' DA A 5 6.685 1.793 -2.308 1.00 0.00 C ATOM 133 O4' DA A 5 5.391 1.540 -1.776 1.00 0.00 O ATOM 134 C3' DA A 5 6.611 2.942 -3.281 1.00 0.00 C ATOM 135 O3' DA A 5 6.399 2.554 -4.628 1.00 0.00 O ATOM 136 C2' DA A 5 5.439 3.627 -2.681 1.00 0.00 C ATOM 137 C1' DA A 5 4.521 2.604 -2.100 1.00 0.00 C ATOM 138 N9 DA A 5 3.920 3.162 -0.867 1.00 0.00 N ATOM 139 C8 DA A 5 4.568 3.760 0.178 1.00 0.00 C ATOM 140 N7 DA A 5 3.809 4.177 1.146 1.00 0.00 N ATOM 141 C5 DA A 5 2.542 3.857 0.679 1.00 0.00 C ATOM 142 C6 DA A 5 1.256 4.058 1.198 1.00 0.00 C ATOM 143 N6 DA A 5 1.052 4.475 2.441 1.00 0.00 N ATOM 144 N1 DA A 5 0.209 3.882 0.386 1.00 0.00 N ATOM 145 C2 DA A 5 0.439 3.428 -0.836 1.00 0.00 C ATOM 146 N3 DA A 5 1.573 3.113 -1.426 1.00 0.00 N ATOM 147 C4 DA A 5 2.601 3.349 -0.592 1.00 0.00 C ATOM 0 H5' DA A 5 8.006 3.131 -1.235 1.00 0.00 H new ATOM 0 H5'' DA A 5 7.282 1.891 -0.230 1.00 0.00 H new ATOM 0 H4' DA A 5 7.017 0.893 -2.826 1.00 0.00 H new ATOM 0 H3' DA A 5 7.523 3.530 -3.383 1.00 0.00 H new ATOM 0 H2' DA A 5 5.765 4.322 -1.908 1.00 0.00 H new ATOM 0 H2'' DA A 5 4.918 4.213 -3.438 1.00 0.00 H new ATOM 0 H1' DA A 5 3.710 2.300 -2.761 1.00 0.00 H new ATOM 0 H8 DA A 5 5.641 3.878 0.197 1.00 0.00 H new ATOM 0 H61 DA A 5 0.101 4.610 2.784 1.00 0.00 H new ATOM 0 H62 DA A 5 1.846 4.660 3.053 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.443 3.295 -1.445 1.00 0.00 H new ATOM 159 P DC A 6 6.410 3.634 -5.836 1.00 0.00 P ATOM 160 OP1 DC A 6 6.314 2.888 -7.109 1.00 0.00 O ATOM 161 OP2 DC A 6 7.554 4.542 -5.605 1.00 0.00 O ATOM 162 O5' DC A 6 5.048 4.487 -5.643 1.00 0.00 O ATOM 163 C5' DC A 6 3.787 3.945 -5.982 1.00 0.00 C ATOM 164 C4' DC A 6 2.624 4.818 -5.483 1.00 0.00 C ATOM 165 O4' DC A 6 2.484 4.780 -4.067 1.00 0.00 O ATOM 166 C3' DC A 6 2.708 6.312 -5.863 1.00 0.00 C ATOM 167 O3' DC A 6 1.640 6.605 -6.753 1.00 0.00 O ATOM 168 C2' DC A 6 2.554 6.980 -4.494 1.00 0.00 C ATOM 169 C1' DC A 6 1.746 5.943 -3.738 1.00 0.00 C ATOM 170 N1 DC A 6 1.697 6.286 -2.294 1.00 0.00 N ATOM 171 C2 DC A 6 0.473 6.642 -1.717 1.00 0.00 C ATOM 172 O2 DC A 6 -0.580 6.620 -2.352 1.00 0.00 O ATOM 173 N3 DC A 6 0.434 7.026 -0.412 1.00 0.00 N ATOM 174 C4 DC A 6 1.565 7.118 0.289 1.00 0.00 C ATOM 175 N4 DC A 6 1.498 7.416 1.577 1.00 0.00 N ATOM 176 C5 DC A 6 2.819 6.733 -0.267 1.00 0.00 C ATOM 177 C6 DC A 6 2.845 6.319 -1.547 1.00 0.00 C ATOM 0 H5' DC A 6 3.697 2.946 -5.556 1.00 0.00 H new ATOM 0 H5'' DC A 6 3.719 3.837 -7.065 1.00 0.00 H new ATOM 0 H4' DC A 6 1.770 4.371 -5.991 1.00 0.00 H new ATOM 0 H3' DC A 6 3.613 6.637 -6.376 1.00 0.00 H new ATOM 0 H2' DC A 6 3.517 7.173 -4.022 1.00 0.00 H new ATOM 0 H2'' DC A 6 2.034 7.936 -4.561 1.00 0.00 H new ATOM 0 H1' DC A 6 0.689 5.846 -3.988 1.00 0.00 H new ATOM 0 H41 DC A 6 2.353 7.490 2.128 1.00 0.00 H new ATOM 0 H42 DC A 6 0.591 7.571 2.018 1.00 0.00 H new ATOM 0 H5 DC A 6 3.723 6.772 0.322 1.00 0.00 H new ATOM 0 H6 DC A 6 3.780 6.010 -1.990 1.00 0.00 H new ATOM 189 P DG A 7 1.271 8.102 -7.246 1.00 0.00 P ATOM 190 OP1 DG A 7 0.921 8.029 -8.681 1.00 0.00 O ATOM 191 OP2 DG A 7 2.341 9.021 -6.802 1.00 0.00 O ATOM 192 O5' DG A 7 -0.073 8.437 -6.406 1.00 0.00 O ATOM 193 C5' DG A 7 -1.266 7.723 -6.674 1.00 0.00 C ATOM 194 C4' DG A 7 -2.501 8.222 -5.912 1.00 0.00 C ATOM 195 O4' DG A 7 -2.244 8.197 -4.519 1.00 0.00 O ATOM 196 C3' DG A 7 -2.917 9.654 -6.274 1.00 0.00 C ATOM 197 O3' DG A 7 -4.333 9.736 -6.225 1.00 0.00 O ATOM 198 C2' DG A 7 -2.220 10.432 -5.176 1.00 0.00 C ATOM 199 C1' DG A 7 -2.432 9.496 -3.988 1.00 0.00 C ATOM 200 N9 DG A 7 -1.465 9.725 -2.901 1.00 0.00 N ATOM 201 C8 DG A 7 -0.106 9.844 -3.000 1.00 0.00 C ATOM 202 N7 DG A 7 0.501 9.993 -1.856 1.00 0.00 N ATOM 203 C5 DG A 7 -0.534 9.928 -0.921 1.00 0.00 C ATOM 204 C6 DG A 7 -0.511 9.978 0.506 1.00 0.00 C ATOM 205 O6 DG A 7 0.442 10.207 1.245 1.00 0.00 O ATOM 206 N1 DG A 7 -1.750 9.727 1.076 1.00 0.00 N ATOM 207 C2 DG A 7 -2.908 9.578 0.360 1.00 0.00 C ATOM 208 N2 DG A 7 -4.042 9.393 1.028 1.00 0.00 N ATOM 209 N3 DG A 7 -2.960 9.605 -0.974 1.00 0.00 N ATOM 210 C4 DG A 7 -1.738 9.741 -1.554 1.00 0.00 C ATOM 0 H5' DG A 7 -1.106 6.673 -6.430 1.00 0.00 H new ATOM 0 H5'' DG A 7 -1.471 7.775 -7.743 1.00 0.00 H new ATOM 0 H4' DG A 7 -3.312 7.552 -6.197 1.00 0.00 H new ATOM 0 H3' DG A 7 -2.651 10.015 -7.267 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.164 10.595 -5.391 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.668 11.413 -5.015 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.417 9.654 -3.548 1.00 0.00 H new ATOM 0 H8 DG A 7 0.418 9.817 -3.944 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.802 9.648 2.092 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.920 9.279 0.521 1.00 0.00 H new ATOM 0 H22 DG A 7 -4.034 9.365 2.048 1.00 0.00 H new ATOM 222 P DC A 8 -5.147 11.070 -6.635 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.296 10.664 -7.473 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.178 12.063 -7.149 1.00 0.00 O ATOM 225 O5' DC A 8 -5.703 11.601 -5.219 1.00 0.00 O ATOM 226 C5' DC A 8 -6.864 11.039 -4.638 1.00 0.00 C ATOM 227 C4' DC A 8 -7.037 11.545 -3.204 1.00 0.00 C ATOM 228 O4' DC A 8 -5.914 11.196 -2.424 1.00 0.00 O ATOM 229 C3' DC A 8 -7.128 13.063 -3.079 1.00 0.00 C ATOM 230 O3' DC A 8 -8.420 13.546 -3.375 1.00 0.00 O ATOM 231 C2' DC A 8 -6.768 13.256 -1.611 1.00 0.00 C ATOM 232 C1' DC A 8 -5.877 12.047 -1.288 1.00 0.00 C ATOM 233 N1 DC A 8 -4.475 12.458 -1.006 1.00 0.00 N ATOM 234 C2 DC A 8 -4.083 12.625 0.319 1.00 0.00 C ATOM 235 O2 DC A 8 -4.897 12.549 1.236 1.00 0.00 O ATOM 236 N3 DC A 8 -2.775 12.878 0.603 1.00 0.00 N ATOM 237 C4 DC A 8 -1.888 13.014 -0.388 1.00 0.00 C ATOM 238 N4 DC A 8 -0.611 13.177 -0.069 1.00 0.00 N ATOM 239 C5 DC A 8 -2.268 12.903 -1.764 1.00 0.00 C ATOM 240 C6 DC A 8 -3.567 12.620 -2.019 1.00 0.00 C ATOM 0 H5' DC A 8 -6.791 9.951 -4.641 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.740 11.301 -5.232 1.00 0.00 H new ATOM 0 H4' DC A 8 -7.969 11.087 -2.872 1.00 0.00 H new ATOM 0 H3' DC A 8 -6.487 13.607 -3.773 1.00 0.00 H new ATOM 0 H2' DC A 8 -6.240 14.196 -1.449 1.00 0.00 H new ATOM 0 H2'' DC A 8 -7.657 13.277 -0.981 1.00 0.00 H new ATOM 0 HO3' DC A 8 -8.434 14.521 -3.281 1.00 0.00 H new ATOM 0 H1' DC A 8 -6.243 11.542 -0.394 1.00 0.00 H new ATOM 0 H41 DC A 8 0.089 13.283 -0.804 1.00 0.00 H new ATOM 0 H42 DC A 8 -0.329 13.196 0.911 1.00 0.00 H new ATOM 0 H5 DC A 8 -1.552 13.039 -2.561 1.00 0.00 H new ATOM 0 H6 DC A 8 -3.895 12.520 -3.043 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 0.059 13.600 9.822 1.00 0.00 O ATOM 255 C5' DG B 9 0.258 12.245 10.157 1.00 0.00 C ATOM 256 C4' DG B 9 -1.101 11.539 10.165 1.00 0.00 C ATOM 257 O4' DG B 9 -1.745 11.679 8.908 1.00 0.00 O ATOM 258 C3' DG B 9 -0.984 10.032 10.379 1.00 0.00 C ATOM 259 O3' DG B 9 -2.239 9.625 10.894 1.00 0.00 O ATOM 260 C2' DG B 9 -0.675 9.562 8.954 1.00 0.00 C ATOM 261 C1' DG B 9 -1.467 10.550 8.089 1.00 0.00 C ATOM 262 N9 DG B 9 -0.786 11.028 6.859 1.00 0.00 N ATOM 263 C8 DG B 9 0.548 11.246 6.614 1.00 0.00 C ATOM 264 N7 DG B 9 0.804 11.767 5.449 1.00 0.00 N ATOM 265 C5 DG B 9 -0.450 11.916 4.867 1.00 0.00 C ATOM 266 C6 DG B 9 -0.822 12.411 3.580 1.00 0.00 C ATOM 267 O6 DG B 9 -0.099 12.881 2.707 1.00 0.00 O ATOM 268 N1 DG B 9 -2.184 12.324 3.344 1.00 0.00 N ATOM 269 C2 DG B 9 -3.098 11.880 4.269 1.00 0.00 C ATOM 270 N2 DG B 9 -4.381 11.855 3.927 1.00 0.00 N ATOM 271 N3 DG B 9 -2.767 11.440 5.489 1.00 0.00 N ATOM 272 C4 DG B 9 -1.428 11.473 5.723 1.00 0.00 C ATOM 0 H5' DG B 9 0.733 12.163 11.135 1.00 0.00 H new ATOM 0 H5'' DG B 9 0.926 11.772 9.437 1.00 0.00 H new ATOM 0 H4' DG B 9 -1.655 12.003 10.981 1.00 0.00 H new ATOM 0 H3' DG B 9 -0.237 9.646 11.073 1.00 0.00 H new ATOM 0 H2' DG B 9 0.393 9.602 8.738 1.00 0.00 H new ATOM 0 H2'' DG B 9 -0.996 8.533 8.789 1.00 0.00 H new ATOM 0 HO5' DG B 9 -0.700 13.677 9.206 1.00 0.00 H new ATOM 0 H1' DG B 9 -2.350 10.016 7.736 1.00 0.00 H new ATOM 0 H8 DG B 9 1.321 11.005 7.329 1.00 0.00 H new ATOM 0 H1 DG B 9 -2.530 12.607 2.427 1.00 0.00 H new ATOM 0 H21 DG B 9 -5.080 11.530 4.594 1.00 0.00 H new ATOM 0 H22 DG B 9 -4.667 12.161 2.997 1.00 0.00 H new ATOM 285 P DC B 10 -2.640 8.092 11.147 1.00 0.00 P ATOM 286 OP1 DC B 10 -3.482 8.026 12.360 1.00 0.00 O ATOM 287 OP2 DC B 10 -1.418 7.264 11.048 1.00 0.00 O ATOM 288 O5' DC B 10 -3.557 7.804 9.859 1.00 0.00 O ATOM 289 C5' DC B 10 -4.831 8.404 9.723 1.00 0.00 C ATOM 290 C4' DC B 10 -5.471 8.020 8.383 1.00 0.00 C ATOM 291 O4' DC B 10 -4.753 8.629 7.313 1.00 0.00 O ATOM 292 C3' DC B 10 -5.453 6.499 8.159 1.00 0.00 C ATOM 293 O3' DC B 10 -6.676 6.137 7.571 1.00 0.00 O ATOM 294 C2' DC B 10 -4.244 6.395 7.234 1.00 0.00 C ATOM 295 C1' DC B 10 -4.389 7.640 6.367 1.00 0.00 C ATOM 296 N1 DC B 10 -3.136 7.987 5.647 1.00 0.00 N ATOM 297 C2 DC B 10 -3.167 8.571 4.382 1.00 0.00 C ATOM 298 O2 DC B 10 -4.231 8.780 3.802 1.00 0.00 O ATOM 299 N3 DC B 10 -1.988 8.917 3.774 1.00 0.00 N ATOM 300 C4 DC B 10 -0.820 8.636 4.373 1.00 0.00 C ATOM 301 N4 DC B 10 0.311 9.052 3.818 1.00 0.00 N ATOM 302 C5 DC B 10 -0.769 7.980 5.639 1.00 0.00 C ATOM 303 C6 DC B 10 -1.939 7.683 6.212 1.00 0.00 C ATOM 0 H5' DC B 10 -4.737 9.488 9.789 1.00 0.00 H new ATOM 0 H5'' DC B 10 -5.476 8.089 10.543 1.00 0.00 H new ATOM 0 H4' DC B 10 -6.505 8.365 8.408 1.00 0.00 H new ATOM 0 H3' DC B 10 -5.364 5.845 9.026 1.00 0.00 H new ATOM 0 H2' DC B 10 -3.306 6.393 7.789 1.00 0.00 H new ATOM 0 H2'' DC B 10 -4.264 5.481 6.640 1.00 0.00 H new ATOM 0 H1' DC B 10 -5.116 7.517 5.564 1.00 0.00 H new ATOM 0 H41 DC B 10 1.204 8.844 4.264 1.00 0.00 H new ATOM 0 H42 DC B 10 0.287 9.579 2.945 1.00 0.00 H new ATOM 0 H5 DC B 10 0.171 7.735 6.112 1.00 0.00 H new ATOM 0 H6 DC B 10 -1.932 7.179 7.167 1.00 0.00 H new ATOM 315 P DG B 11 -7.109 4.608 7.358 1.00 0.00 P ATOM 316 OP1 DG B 11 -8.346 4.364 8.130 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.926 3.744 7.554 1.00 0.00 O ATOM 318 O5' DG B 11 -7.455 4.647 5.797 1.00 0.00 O ATOM 319 C5' DG B 11 -8.419 5.547 5.296 1.00 0.00 C ATOM 320 C4' DG B 11 -8.526 5.392 3.781 1.00 0.00 C ATOM 321 O4' DG B 11 -7.359 5.918 3.179 1.00 0.00 O ATOM 322 C3' DG B 11 -8.649 3.922 3.372 1.00 0.00 C ATOM 323 O3' DG B 11 -9.628 3.857 2.355 1.00 0.00 O ATOM 324 C2' DG B 11 -7.223 3.566 2.944 1.00 0.00 C ATOM 325 C1' DG B 11 -6.661 4.910 2.473 1.00 0.00 C ATOM 326 N9 DG B 11 -5.224 5.078 2.768 1.00 0.00 N ATOM 327 C8 DG B 11 -4.590 4.894 3.970 1.00 0.00 C ATOM 328 N7 DG B 11 -3.353 5.292 3.992 1.00 0.00 N ATOM 329 C5 DG B 11 -3.133 5.734 2.693 1.00 0.00 C ATOM 330 C6 DG B 11 -1.941 6.211 2.084 1.00 0.00 C ATOM 331 O6 DG B 11 -0.853 6.397 2.615 1.00 0.00 O ATOM 332 N1 DG B 11 -2.087 6.477 0.738 1.00 0.00 N ATOM 333 C2 DG B 11 -3.265 6.350 0.049 1.00 0.00 C ATOM 334 N2 DG B 11 -3.233 6.582 -1.258 1.00 0.00 N ATOM 335 N3 DG B 11 -4.401 5.904 0.607 1.00 0.00 N ATOM 336 C4 DG B 11 -4.266 5.605 1.929 1.00 0.00 C ATOM 0 H5' DG B 11 -8.141 6.570 5.548 1.00 0.00 H new ATOM 0 H5'' DG B 11 -9.386 5.355 5.761 1.00 0.00 H new ATOM 0 H4' DG B 11 -9.418 5.925 3.453 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.980 3.214 4.132 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.644 3.154 3.771 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.214 2.823 2.147 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.782 4.965 1.391 1.00 0.00 H new ATOM 0 H8 DG B 11 -5.078 4.455 4.827 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.264 6.789 0.222 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.086 6.500 -1.812 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.356 6.843 -1.708 1.00 0.00 H new ATOM 348 P DT B 12 -10.214 2.462 1.813 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.532 2.724 1.195 1.00 0.00 O ATOM 350 OP2 DT B 12 -10.088 1.453 2.886 1.00 0.00 O ATOM 351 O5' DT B 12 -9.160 2.120 0.660 1.00 0.00 O ATOM 352 C5' DT B 12 -9.138 2.861 -0.542 1.00 0.00 C ATOM 353 C4' DT B 12 -7.905 2.470 -1.354 1.00 0.00 C ATOM 354 O4' DT B 12 -6.712 2.848 -0.703 1.00 0.00 O ATOM 355 C3' DT B 12 -7.783 0.960 -1.561 1.00 0.00 C ATOM 356 O3' DT B 12 -8.509 0.612 -2.723 1.00 0.00 O ATOM 357 C2' DT B 12 -6.263 0.762 -1.631 1.00 0.00 C ATOM 358 C1' DT B 12 -5.678 2.157 -1.372 1.00 0.00 C ATOM 359 N1 DT B 12 -4.443 2.205 -0.551 1.00 0.00 N ATOM 360 C2 DT B 12 -3.451 3.154 -0.756 1.00 0.00 C ATOM 361 O2 DT B 12 -3.387 3.828 -1.778 1.00 0.00 O ATOM 362 N3 DT B 12 -2.522 3.310 0.256 1.00 0.00 N ATOM 363 C4 DT B 12 -2.480 2.625 1.444 1.00 0.00 C ATOM 364 O4 DT B 12 -1.777 3.020 2.369 1.00 0.00 O ATOM 365 C5 DT B 12 -3.319 1.363 1.597 1.00 0.00 C ATOM 366 C7 DT B 12 -4.238 1.393 2.823 1.00 0.00 C ATOM 367 C6 DT B 12 -4.241 1.119 0.422 1.00 0.00 C ATOM 0 H5' DT B 12 -9.120 3.929 -0.324 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.043 2.668 -1.118 1.00 0.00 H new ATOM 0 H4' DT B 12 -8.036 2.984 -2.306 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.202 0.314 -0.789 1.00 0.00 H new ATOM 0 H2' DT B 12 -5.922 0.044 -0.885 1.00 0.00 H new ATOM 0 H2'' DT B 12 -5.958 0.379 -2.605 1.00 0.00 H new ATOM 0 H1' DT B 12 -5.366 2.587 -2.324 1.00 0.00 H new ATOM 0 H3 DT B 12 -1.792 4.006 0.104 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.132 0.803 2.622 1.00 0.00 H new ATOM 0 H72 DT B 12 -3.713 0.975 3.682 1.00 0.00 H new ATOM 0 H73 DT B 12 -4.524 2.423 3.039 1.00 0.00 H new ATOM 0 H6 DT B 12 -4.740 0.169 0.300 1.00 0.00 H new ATOM 380 P DA B 13 -8.844 -0.916 -3.108 1.00 0.00 P ATOM 381 OP1 DA B 13 -9.909 -0.902 -4.133 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.037 -1.679 -1.856 1.00 0.00 O ATOM 383 O5' DA B 13 -7.484 -1.410 -3.796 1.00 0.00 O ATOM 384 C5' DA B 13 -6.986 -0.770 -4.952 1.00 0.00 C ATOM 385 C4' DA B 13 -5.659 -1.416 -5.340 1.00 0.00 C ATOM 386 O4' DA B 13 -4.763 -1.381 -4.247 1.00 0.00 O ATOM 387 C3' DA B 13 -5.838 -2.877 -5.762 1.00 0.00 C ATOM 388 O3' DA B 13 -5.050 -3.127 -6.908 1.00 0.00 O ATOM 389 C2' DA B 13 -5.300 -3.587 -4.530 1.00 0.00 C ATOM 390 C1' DA B 13 -4.167 -2.651 -4.107 1.00 0.00 C ATOM 391 N9 DA B 13 -3.784 -2.877 -2.702 1.00 0.00 N ATOM 392 C8 DA B 13 -4.622 -2.857 -1.624 1.00 0.00 C ATOM 393 N7 DA B 13 -4.086 -3.304 -0.522 1.00 0.00 N ATOM 394 C5 DA B 13 -2.747 -3.456 -0.870 1.00 0.00 C ATOM 395 C6 DA B 13 -1.599 -3.727 -0.108 1.00 0.00 C ATOM 396 N6 DA B 13 -1.656 -4.070 1.175 1.00 0.00 N ATOM 397 N1 DA B 13 -0.396 -3.495 -0.647 1.00 0.00 N ATOM 398 C2 DA B 13 -0.323 -3.128 -1.917 1.00 0.00 C ATOM 399 N3 DA B 13 -1.319 -2.934 -2.781 1.00 0.00 N ATOM 400 C4 DA B 13 -2.529 -3.098 -2.176 1.00 0.00 C ATOM 0 H5' DA B 13 -6.846 0.294 -4.763 1.00 0.00 H new ATOM 0 H5'' DA B 13 -7.702 -0.858 -5.770 1.00 0.00 H new ATOM 0 H4' DA B 13 -5.264 -0.849 -6.183 1.00 0.00 H new ATOM 0 H3' DA B 13 -6.849 -3.182 -6.032 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.058 -3.691 -3.753 1.00 0.00 H new ATOM 0 H2'' DA B 13 -4.939 -4.590 -4.759 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.256 -2.788 -4.689 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.640 -2.502 -1.679 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.797 -4.258 1.691 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.559 -4.145 1.643 1.00 0.00 H new ATOM 0 H2 DA B 13 0.672 -2.965 -2.303 1.00 0.00 H new ATOM 412 P DC B 14 -5.289 -4.418 -7.844 1.00 0.00 P ATOM 413 OP1 DC B 14 -6.651 -4.301 -8.407 1.00 0.00 O ATOM 414 OP2 DC B 14 -4.929 -5.631 -7.079 1.00 0.00 O ATOM 415 O5' DC B 14 -4.230 -4.237 -9.048 1.00 0.00 O ATOM 416 C5' DC B 14 -2.985 -3.581 -8.883 1.00 0.00 C ATOM 417 C4' DC B 14 -1.948 -4.347 -8.049 1.00 0.00 C ATOM 418 O4' DC B 14 -2.267 -4.461 -6.671 1.00 0.00 O ATOM 419 C3' DC B 14 -1.664 -5.777 -8.548 1.00 0.00 C ATOM 420 O3' DC B 14 -0.370 -5.773 -9.131 1.00 0.00 O ATOM 421 C2' DC B 14 -1.738 -6.585 -7.247 1.00 0.00 C ATOM 422 C1' DC B 14 -1.432 -5.509 -6.212 1.00 0.00 C ATOM 423 N1 DC B 14 -1.680 -5.938 -4.806 1.00 0.00 N ATOM 424 C2 DC B 14 -0.599 -6.007 -3.929 1.00 0.00 C ATOM 425 O2 DC B 14 0.553 -5.812 -4.309 1.00 0.00 O ATOM 426 N3 DC B 14 -0.818 -6.299 -2.619 1.00 0.00 N ATOM 427 C4 DC B 14 -2.040 -6.616 -2.192 1.00 0.00 C ATOM 428 N4 DC B 14 -2.208 -6.845 -0.897 1.00 0.00 N ATOM 429 C5 DC B 14 -3.162 -6.617 -3.076 1.00 0.00 C ATOM 430 C6 DC B 14 -2.929 -6.280 -4.364 1.00 0.00 C ATOM 0 H5' DC B 14 -3.162 -2.613 -8.414 1.00 0.00 H new ATOM 0 H5'' DC B 14 -2.562 -3.385 -9.868 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.066 -3.719 -8.177 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.339 -6.178 -9.304 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.720 -7.033 -7.096 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.010 -7.396 -7.225 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.380 -5.230 -6.146 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.131 -7.090 -0.538 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.414 -6.776 -0.260 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.152 -6.875 -2.731 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.752 -6.281 -5.064 1.00 0.00 H new ATOM 442 P DG B 15 0.156 -6.901 -10.164 1.00 0.00 P ATOM 443 OP1 DG B 15 1.159 -6.257 -11.038 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.021 -7.560 -10.769 1.00 0.00 O ATOM 445 O5' DG B 15 0.926 -7.989 -9.254 1.00 0.00 O ATOM 446 C5' DG B 15 1.777 -7.596 -8.194 1.00 0.00 C ATOM 447 C4' DG B 15 2.874 -8.633 -7.886 1.00 0.00 C ATOM 448 O4' DG B 15 3.051 -8.622 -6.479 1.00 0.00 O ATOM 449 C3' DG B 15 2.568 -10.093 -8.266 1.00 0.00 C ATOM 450 O3' DG B 15 3.755 -10.865 -8.224 1.00 0.00 O ATOM 451 C2' DG B 15 1.607 -10.342 -7.126 1.00 0.00 C ATOM 452 C1' DG B 15 2.401 -9.761 -5.954 1.00 0.00 C ATOM 453 N9 DG B 15 1.538 -9.468 -4.796 1.00 0.00 N ATOM 454 C8 DG B 15 0.180 -9.377 -4.789 1.00 0.00 C ATOM 455 N7 DG B 15 -0.356 -9.237 -3.613 1.00 0.00 N ATOM 456 C5 DG B 15 0.746 -9.229 -2.760 1.00 0.00 C ATOM 457 C6 DG B 15 0.813 -9.154 -1.337 1.00 0.00 C ATOM 458 O6 DG B 15 -0.114 -9.053 -0.539 1.00 0.00 O ATOM 459 N1 DG B 15 2.114 -9.206 -0.860 1.00 0.00 N ATOM 460 C2 DG B 15 3.222 -9.375 -1.654 1.00 0.00 C ATOM 461 N2 DG B 15 4.413 -9.462 -1.075 1.00 0.00 N ATOM 462 N3 DG B 15 3.168 -9.505 -2.982 1.00 0.00 N ATOM 463 C4 DG B 15 1.908 -9.394 -3.475 1.00 0.00 C ATOM 0 H5' DG B 15 1.179 -7.431 -7.298 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.245 -6.644 -8.445 1.00 0.00 H new ATOM 0 H4' DG B 15 3.736 -8.339 -8.484 1.00 0.00 H new ATOM 0 H3' DG B 15 2.182 -10.323 -9.259 1.00 0.00 H new ATOM 0 H2' DG B 15 0.653 -9.835 -7.271 1.00 0.00 H new ATOM 0 H2'' DG B 15 1.388 -11.402 -6.993 1.00 0.00 H new ATOM 0 H1' DG B 15 3.129 -10.468 -5.556 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.409 -9.418 -5.694 1.00 0.00 H new ATOM 0 H1 DG B 15 2.257 -9.113 0.146 1.00 0.00 H new ATOM 0 H21 DG B 15 5.249 -9.588 -1.645 1.00 0.00 H new ATOM 0 H22 DG B 15 4.492 -9.403 -0.060 1.00 0.00 H new ATOM 475 P DC B 16 3.764 -12.462 -8.461 1.00 0.00 P ATOM 476 OP1 DC B 16 4.811 -12.770 -9.459 1.00 0.00 O ATOM 477 OP2 DC B 16 2.373 -12.908 -8.694 1.00 0.00 O ATOM 478 O5' DC B 16 4.237 -13.016 -7.024 1.00 0.00 O ATOM 479 C5' DC B 16 5.560 -12.794 -6.579 1.00 0.00 C ATOM 480 C4' DC B 16 5.721 -13.145 -5.102 1.00 0.00 C ATOM 481 O4' DC B 16 4.891 -12.300 -4.338 1.00 0.00 O ATOM 482 C3' DC B 16 5.305 -14.564 -4.723 1.00 0.00 C ATOM 483 O3' DC B 16 6.326 -15.503 -4.979 1.00 0.00 O ATOM 484 C2' DC B 16 5.047 -14.393 -3.230 1.00 0.00 C ATOM 485 C1' DC B 16 4.652 -12.915 -3.086 1.00 0.00 C ATOM 486 N1 DC B 16 3.218 -12.764 -2.725 1.00 0.00 N ATOM 487 C2 DC B 16 2.887 -12.642 -1.379 1.00 0.00 C ATOM 488 O2 DC B 16 3.746 -12.694 -0.504 1.00 0.00 O ATOM 489 N3 DC B 16 1.585 -12.462 -1.026 1.00 0.00 N ATOM 490 C4 DC B 16 0.631 -12.436 -1.961 1.00 0.00 C ATOM 491 N4 DC B 16 -0.612 -12.187 -1.573 1.00 0.00 N ATOM 492 C5 DC B 16 0.935 -12.573 -3.354 1.00 0.00 C ATOM 493 C6 DC B 16 2.239 -12.728 -3.687 1.00 0.00 C ATOM 0 H5' DC B 16 5.827 -11.749 -6.737 1.00 0.00 H new ATOM 0 H5'' DC B 16 6.250 -13.393 -7.173 1.00 0.00 H new ATOM 0 H4' DC B 16 6.788 -13.035 -4.907 1.00 0.00 H new ATOM 0 H3' DC B 16 4.456 -14.950 -5.287 1.00 0.00 H new ATOM 0 H2' DC B 16 4.252 -15.054 -2.884 1.00 0.00 H new ATOM 0 H2'' DC B 16 5.935 -14.628 -2.642 1.00 0.00 H new ATOM 0 HO3' DC B 16 6.020 -16.398 -4.721 1.00 0.00 H new ATOM 0 H1' DC B 16 5.236 -12.454 -2.289 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.365 -12.160 -2.260 1.00 0.00 H new ATOM 0 H42 DC B 16 -0.815 -12.023 -0.587 1.00 0.00 H new ATOM 0 H5 DC B 16 0.159 -12.554 -4.105 1.00 0.00 H new ATOM 0 H6 DC B 16 2.513 -12.825 -4.727 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO B 1 -1.441 0.187 -1.442 1.00 0.00 O HETATM 508 C2 PSO B 1 -2.691 0.103 -1.363 1.00 0.00 C HETATM 509 C3 PSO B 1 -3.445 -0.074 -0.057 1.00 0.00 C HETATM 510 C4 PSO B 1 -2.620 0.046 1.188 1.00 0.00 C HETATM 511 C5 PSO B 1 -0.382 0.289 2.014 1.00 0.00 C HETATM 512 C6 PSO B 1 1.006 0.425 1.804 1.00 0.00 C HETATM 513 C7 PSO B 1 1.504 0.439 0.551 1.00 0.00 C HETATM 514 C8 PSO B 1 0.652 0.186 -0.528 1.00 0.00 C HETATM 515 C9 PSO B 1 -0.751 0.224 -0.372 1.00 0.00 C HETATM 516 C10 PSO B 1 -1.256 0.206 0.922 1.00 0.00 C HETATM 517 C4' PSO B 1 2.114 0.053 2.740 1.00 0.00 C HETATM 518 C5' PSO B 1 3.289 0.285 1.801 1.00 0.00 C HETATM 519 O6' PSO B 1 2.764 0.445 0.473 1.00 0.00 O HETATM 520 O11 PSO B 1 -3.333 0.166 -2.404 1.00 0.00 O HETATM 521 C12 PSO B 1 -2.919 -1.018 2.258 1.00 0.00 C HETATM 522 C13 PSO B 1 2.113 0.803 4.082 1.00 0.00 C HETATM 523 O14 PSO B 1 1.749 2.164 4.018 1.00 0.00 O HETATM 524 C15 PSO B 1 4.091 1.448 2.363 1.00 0.00 C HETATM 525 C16 PSO B 1 1.274 -0.140 -1.857 1.00 0.00 C HETATM 0 H163 PSO B 1 1.900 0.692 -2.180 1.00 0.00 H new HETATM 0 H162 PSO B 1 1.885 -1.038 -1.762 1.00 0.00 H new HETATM 0 H161 PSO B 1 0.489 -0.311 -2.594 1.00 0.00 H new HETATM 0 H153 PSO B 1 3.459 2.335 2.413 1.00 0.00 H new HETATM 0 H152 PSO B 1 4.444 1.197 3.363 1.00 0.00 H new HETATM 0 H151 PSO B 1 4.946 1.647 1.716 1.00 0.00 H new HETATM 0 H132 PSO B 1 1.430 0.294 4.762 1.00 0.00 H new HETATM 0 H131 PSO B 1 3.109 0.732 4.519 1.00 0.00 H new HETATM 0 H123 PSO B 1 -3.963 -0.945 2.562 1.00 0.00 H new HETATM 0 H122 PSO B 1 -2.730 -2.010 1.848 1.00 0.00 H new HETATM 0 H121 PSO B 1 -2.276 -0.855 3.123 1.00 0.00 H new HETATM 0 H5 PSO B 1 -0.776 0.248 3.029 1.00 0.00 H new HETATM 0 H14 PSO B 1 1.776 2.553 4.917 1.00 0.00 H new