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=-0.00904 USER MOD Single : A 4 DT C7 :methyl -30:sc= -3.54! (180deg=-6.35!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot 180:sc= -0.246 USER MOD Single : B 9 DG O5' : rot -22:sc= 0.0725 USER MOD Single : B 12 DT C7 :methyl 150:sc= -2.98! (180deg=-2.98!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -3.113 -11.931 9.023 1.00 0.00 O ATOM 2 C5' DG A 1 -2.317 -12.734 9.868 1.00 0.00 C ATOM 3 C4' DG A 1 -0.819 -12.403 9.769 1.00 0.00 C ATOM 4 O4' DG A 1 -0.198 -12.988 8.623 1.00 0.00 O ATOM 5 C3' DG A 1 -0.526 -10.918 9.724 1.00 0.00 C ATOM 6 O3' DG A 1 0.662 -10.655 10.450 1.00 0.00 O ATOM 7 C2' DG A 1 -0.407 -10.693 8.239 1.00 0.00 C ATOM 8 C1' DG A 1 0.133 -11.985 7.664 1.00 0.00 C ATOM 9 N9 DG A 1 -0.493 -12.276 6.349 1.00 0.00 N ATOM 10 C8 DG A 1 -1.781 -12.691 6.126 1.00 0.00 C ATOM 11 N7 DG A 1 -2.105 -12.819 4.875 1.00 0.00 N ATOM 12 C5 DG A 1 -0.936 -12.489 4.204 1.00 0.00 C ATOM 13 C6 DG A 1 -0.671 -12.485 2.806 1.00 0.00 C ATOM 14 O6 DG A 1 -1.457 -12.708 1.890 1.00 0.00 O ATOM 15 N1 DG A 1 0.645 -12.188 2.510 1.00 0.00 N ATOM 16 C2 DG A 1 1.598 -11.882 3.450 1.00 0.00 C ATOM 17 N2 DG A 1 2.830 -11.641 3.009 1.00 0.00 N ATOM 18 N3 DG A 1 1.354 -11.842 4.771 1.00 0.00 N ATOM 19 C4 DG A 1 0.068 -12.171 5.089 1.00 0.00 C ATOM 0 H5' DG A 1 -2.470 -13.783 9.614 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.645 -12.605 10.899 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.406 -12.827 10.684 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.266 -10.258 10.177 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.375 -10.446 7.803 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.262 -9.860 8.023 1.00 0.00 H new ATOM 0 HO5' DG A 1 -4.055 -12.183 9.124 1.00 0.00 H new ATOM 0 H1' DG A 1 1.207 -11.937 7.487 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.473 -12.896 6.929 1.00 0.00 H new ATOM 0 H1 DG A 1 0.927 -12.197 1.530 1.00 0.00 H new ATOM 0 H21 DG A 1 3.572 -11.409 3.670 1.00 0.00 H new ATOM 0 H22 DG A 1 3.032 -11.688 2.010 1.00 0.00 H new ATOM 32 P DC A 2 1.215 -9.163 10.703 1.00 0.00 P ATOM 33 OP1 DC A 2 1.893 -9.142 12.016 1.00 0.00 O ATOM 34 OP2 DC A 2 0.127 -8.202 10.420 1.00 0.00 O ATOM 35 O5' DC A 2 2.336 -9.017 9.558 1.00 0.00 O ATOM 36 C5' DC A 2 3.412 -9.926 9.491 1.00 0.00 C ATOM 37 C4' DC A 2 4.467 -9.488 8.474 1.00 0.00 C ATOM 38 O4' DC A 2 4.027 -9.609 7.124 1.00 0.00 O ATOM 39 C3' DC A 2 4.893 -8.034 8.656 1.00 0.00 C ATOM 40 O3' DC A 2 6.282 -8.061 8.399 1.00 0.00 O ATOM 41 C2' DC A 2 4.008 -7.327 7.628 1.00 0.00 C ATOM 42 C1' DC A 2 3.923 -8.341 6.479 1.00 0.00 C ATOM 43 N1 DC A 2 2.621 -8.358 5.729 1.00 0.00 N ATOM 44 C2 DC A 2 2.632 -8.678 4.374 1.00 0.00 C ATOM 45 O2 DC A 2 3.693 -8.858 3.782 1.00 0.00 O ATOM 46 N3 DC A 2 1.453 -8.796 3.685 1.00 0.00 N ATOM 47 C4 DC A 2 0.287 -8.612 4.320 1.00 0.00 C ATOM 48 N4 DC A 2 -0.847 -8.830 3.661 1.00 0.00 N ATOM 49 C5 DC A 2 0.228 -8.316 5.714 1.00 0.00 C ATOM 50 C6 DC A 2 1.411 -8.227 6.365 1.00 0.00 C ATOM 0 H5' DC A 2 3.037 -10.913 9.222 1.00 0.00 H new ATOM 0 H5'' DC A 2 3.872 -10.017 10.475 1.00 0.00 H new ATOM 0 H4' DC A 2 5.302 -10.163 8.663 1.00 0.00 H new ATOM 0 H3' DC A 2 4.769 -7.532 9.615 1.00 0.00 H new ATOM 0 H2' DC A 2 3.023 -7.097 8.035 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.446 -6.384 7.301 1.00 0.00 H new ATOM 0 H1' DC A 2 4.692 -8.091 5.748 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.743 -8.695 4.129 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.821 -9.132 2.687 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.713 -8.170 6.224 1.00 0.00 H new ATOM 0 H6 DC A 2 1.403 -8.045 7.430 1.00 0.00 H new ATOM 62 P DG A 3 7.176 -6.743 8.302 1.00 0.00 P ATOM 63 OP1 DG A 3 8.575 -7.095 8.623 1.00 0.00 O ATOM 64 OP2 DG A 3 6.496 -5.648 9.029 1.00 0.00 O ATOM 65 O5' DG A 3 7.048 -6.498 6.726 1.00 0.00 O ATOM 66 C5' DG A 3 7.567 -7.430 5.798 1.00 0.00 C ATOM 67 C4' DG A 3 7.699 -6.770 4.426 1.00 0.00 C ATOM 68 O4' DG A 3 6.421 -6.786 3.828 1.00 0.00 O ATOM 69 C3' DG A 3 8.172 -5.316 4.561 1.00 0.00 C ATOM 70 O3' DG A 3 9.086 -5.000 3.532 1.00 0.00 O ATOM 71 C2' DG A 3 6.831 -4.592 4.475 1.00 0.00 C ATOM 72 C1' DG A 3 6.024 -5.469 3.535 1.00 0.00 C ATOM 73 N9 DG A 3 4.564 -5.364 3.725 1.00 0.00 N ATOM 74 C8 DG A 3 3.843 -5.101 4.861 1.00 0.00 C ATOM 75 N7 DG A 3 2.564 -5.322 4.739 1.00 0.00 N ATOM 76 C5 DG A 3 2.413 -5.680 3.402 1.00 0.00 C ATOM 77 C6 DG A 3 1.240 -5.944 2.630 1.00 0.00 C ATOM 78 O6 DG A 3 0.074 -6.007 3.014 1.00 0.00 O ATOM 79 N1 DG A 3 1.524 -6.145 1.288 1.00 0.00 N ATOM 80 C2 DG A 3 2.791 -6.127 0.747 1.00 0.00 C ATOM 81 N2 DG A 3 2.951 -6.307 -0.557 1.00 0.00 N ATOM 82 N3 DG A 3 3.892 -5.898 1.462 1.00 0.00 N ATOM 83 C4 DG A 3 3.632 -5.677 2.773 1.00 0.00 C ATOM 0 H5' DG A 3 6.911 -8.298 5.733 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.539 -7.790 6.134 1.00 0.00 H new ATOM 0 H4' DG A 3 8.431 -7.309 3.825 1.00 0.00 H new ATOM 0 H3' DG A 3 8.729 -5.059 5.462 1.00 0.00 H new ATOM 0 H2' DG A 3 6.356 -4.506 5.452 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.944 -3.580 4.085 1.00 0.00 H new ATOM 0 H1' DG A 3 6.212 -5.160 2.507 1.00 0.00 H new ATOM 0 H8 DG A 3 4.294 -4.743 5.775 1.00 0.00 H new ATOM 0 H1 DG A 3 0.741 -6.318 0.658 1.00 0.00 H new ATOM 0 H21 DG A 3 3.887 -6.295 -0.963 1.00 0.00 H new ATOM 0 H22 DG A 3 2.138 -6.458 -1.154 1.00 0.00 H new ATOM 95 P DT A 4 9.790 -3.549 3.425 1.00 0.00 P ATOM 96 OP1 DT A 4 11.154 -3.737 2.887 1.00 0.00 O ATOM 97 OP2 DT A 4 9.590 -2.832 4.704 1.00 0.00 O ATOM 98 O5' DT A 4 8.888 -2.864 2.291 1.00 0.00 O ATOM 99 C5' DT A 4 8.884 -3.407 0.990 1.00 0.00 C ATOM 100 C4' DT A 4 7.576 -3.086 0.278 1.00 0.00 C ATOM 101 O4' DT A 4 6.447 -3.251 1.108 1.00 0.00 O ATOM 102 C3' DT A 4 7.472 -1.643 -0.229 1.00 0.00 C ATOM 103 O3' DT A 4 7.971 -1.532 -1.556 1.00 0.00 O ATOM 104 C2' DT A 4 5.972 -1.372 -0.135 1.00 0.00 C ATOM 105 C1' DT A 4 5.375 -2.629 0.428 1.00 0.00 C ATOM 106 N1 DT A 4 4.243 -2.359 1.341 1.00 0.00 N ATOM 107 C2 DT A 4 2.989 -2.880 1.092 1.00 0.00 C ATOM 108 O2 DT A 4 2.662 -3.303 -0.011 1.00 0.00 O ATOM 109 N3 DT A 4 2.104 -2.909 2.140 1.00 0.00 N ATOM 110 C4 DT A 4 2.263 -2.363 3.385 1.00 0.00 C ATOM 111 O4 DT A 4 1.458 -2.618 4.277 1.00 0.00 O ATOM 112 C5 DT A 4 3.453 -1.438 3.614 1.00 0.00 C ATOM 113 C7 DT A 4 4.146 -1.571 4.959 1.00 0.00 C ATOM 114 C6 DT A 4 4.506 -1.470 2.502 1.00 0.00 C ATOM 0 H5' DT A 4 9.021 -4.487 1.041 1.00 0.00 H new ATOM 0 H5'' DT A 4 9.722 -3.006 0.420 1.00 0.00 H new ATOM 0 H4' DT A 4 7.587 -3.790 -0.554 1.00 0.00 H new ATOM 0 H3' DT A 4 8.063 -0.924 0.338 1.00 0.00 H new ATOM 0 H2' DT A 4 5.767 -0.517 0.509 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.552 -1.142 -1.114 1.00 0.00 H new ATOM 0 H1' DT A 4 4.952 -3.257 -0.356 1.00 0.00 H new ATOM 0 H3 DT A 4 1.223 -3.395 1.971 1.00 0.00 H new ATOM 0 H71 DT A 4 3.423 -1.885 5.711 1.00 0.00 H new ATOM 0 H72 DT A 4 4.941 -2.314 4.887 1.00 0.00 H new ATOM 0 H73 DT A 4 4.573 -0.610 5.245 1.00 0.00 H new ATOM 0 H6 DT A 4 5.403 -0.871 2.560 1.00 0.00 H new ATOM 127 P DA A 5 7.196 -2.103 -2.882 1.00 0.00 P ATOM 128 OP1 DA A 5 6.502 -3.368 -2.564 1.00 0.00 O ATOM 129 OP2 DA A 5 8.162 -2.077 -4.001 1.00 0.00 O ATOM 130 O5' DA A 5 6.077 -0.967 -3.155 1.00 0.00 O ATOM 131 C5' DA A 5 6.477 0.375 -3.301 1.00 0.00 C ATOM 132 C4' DA A 5 5.463 1.186 -4.105 1.00 0.00 C ATOM 133 O4' DA A 5 4.291 1.284 -3.291 1.00 0.00 O ATOM 134 C3' DA A 5 5.955 2.617 -4.388 1.00 0.00 C ATOM 135 O3' DA A 5 5.455 3.048 -5.639 1.00 0.00 O ATOM 136 C2' DA A 5 5.365 3.319 -3.187 1.00 0.00 C ATOM 137 C1' DA A 5 4.021 2.643 -2.986 1.00 0.00 C ATOM 138 N9 DA A 5 3.480 2.887 -1.619 1.00 0.00 N ATOM 139 C8 DA A 5 4.146 3.008 -0.417 1.00 0.00 C ATOM 140 N7 DA A 5 3.383 3.243 0.611 1.00 0.00 N ATOM 141 C5 DA A 5 2.112 3.264 0.057 1.00 0.00 C ATOM 142 C6 DA A 5 0.837 3.398 0.627 1.00 0.00 C ATOM 143 N6 DA A 5 0.710 3.490 1.944 1.00 0.00 N ATOM 144 N1 DA A 5 -0.252 3.347 -0.165 1.00 0.00 N ATOM 145 C2 DA A 5 -0.057 3.185 -1.472 1.00 0.00 C ATOM 146 N3 DA A 5 1.088 3.065 -2.135 1.00 0.00 N ATOM 147 C4 DA A 5 2.155 3.092 -1.298 1.00 0.00 C ATOM 0 H5' DA A 5 7.447 0.413 -3.796 1.00 0.00 H new ATOM 0 H5'' DA A 5 6.604 0.825 -2.317 1.00 0.00 H new ATOM 0 H4' DA A 5 5.291 0.695 -5.063 1.00 0.00 H new ATOM 0 H3' DA A 5 7.029 2.779 -4.483 1.00 0.00 H new ATOM 0 H2' DA A 5 6.001 3.210 -2.309 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.251 4.388 -3.367 1.00 0.00 H new ATOM 0 H1' DA A 5 3.226 3.032 -3.622 1.00 0.00 H new ATOM 0 H8 DA A 5 5.219 2.915 -0.335 1.00 0.00 H new ATOM 0 H61 DA A 5 -0.216 3.588 2.362 1.00 0.00 H new ATOM 0 H62 DA A 5 1.538 3.463 2.539 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.952 3.146 -2.076 1.00 0.00 H new ATOM 159 P DC A 6 5.604 4.569 -6.173 1.00 0.00 P ATOM 160 OP1 DC A 6 5.816 4.522 -7.636 1.00 0.00 O ATOM 161 OP2 DC A 6 6.568 5.286 -5.311 1.00 0.00 O ATOM 162 O5' DC A 6 4.118 5.122 -5.889 1.00 0.00 O ATOM 163 C5' DC A 6 3.035 4.469 -6.512 1.00 0.00 C ATOM 164 C4' DC A 6 1.664 5.079 -6.232 1.00 0.00 C ATOM 165 O4' DC A 6 1.295 4.978 -4.850 1.00 0.00 O ATOM 166 C3' DC A 6 1.568 6.563 -6.615 1.00 0.00 C ATOM 167 O3' DC A 6 0.358 6.774 -7.329 1.00 0.00 O ATOM 168 C2' DC A 6 1.547 7.254 -5.250 1.00 0.00 C ATOM 169 C1' DC A 6 0.918 6.247 -4.302 1.00 0.00 C ATOM 170 N1 DC A 6 1.340 6.393 -2.881 1.00 0.00 N ATOM 171 C2 DC A 6 0.360 6.565 -1.901 1.00 0.00 C ATOM 172 O2 DC A 6 -0.825 6.721 -2.179 1.00 0.00 O ATOM 173 N3 DC A 6 0.708 6.563 -0.590 1.00 0.00 N ATOM 174 C4 DC A 6 1.989 6.466 -0.237 1.00 0.00 C ATOM 175 N4 DC A 6 2.257 6.350 1.057 1.00 0.00 N ATOM 176 C5 DC A 6 3.025 6.312 -1.215 1.00 0.00 C ATOM 177 C6 DC A 6 2.653 6.281 -2.515 1.00 0.00 C ATOM 0 H5' DC A 6 3.025 3.428 -6.190 1.00 0.00 H new ATOM 0 H5'' DC A 6 3.202 4.468 -7.589 1.00 0.00 H new ATOM 0 H4' DC A 6 0.985 4.497 -6.855 1.00 0.00 H new ATOM 0 H3' DC A 6 2.371 6.929 -7.254 1.00 0.00 H new ATOM 0 H2' DC A 6 2.554 7.521 -4.929 1.00 0.00 H new ATOM 0 H2'' DC A 6 0.968 8.177 -5.285 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.161 6.387 -4.243 1.00 0.00 H new ATOM 0 H41 DC A 6 3.224 6.273 1.373 1.00 0.00 H new ATOM 0 H42 DC A 6 1.496 6.338 1.736 1.00 0.00 H new ATOM 0 H5 DC A 6 4.062 6.224 -0.925 1.00 0.00 H new ATOM 0 H6 DC A 6 3.408 6.166 -3.279 1.00 0.00 H new ATOM 189 P DG A 7 -0.095 8.236 -7.865 1.00 0.00 P ATOM 190 OP1 DG A 7 -0.932 8.037 -9.068 1.00 0.00 O ATOM 191 OP2 DG A 7 1.114 9.083 -7.950 1.00 0.00 O ATOM 192 O5' DG A 7 -1.042 8.819 -6.682 1.00 0.00 O ATOM 193 C5' DG A 7 -2.326 8.272 -6.457 1.00 0.00 C ATOM 194 C4' DG A 7 -3.179 9.055 -5.449 1.00 0.00 C ATOM 195 O4' DG A 7 -2.636 8.974 -4.146 1.00 0.00 O ATOM 196 C3' DG A 7 -3.308 10.541 -5.797 1.00 0.00 C ATOM 197 O3' DG A 7 -4.654 10.910 -5.540 1.00 0.00 O ATOM 198 C2' DG A 7 -2.275 11.165 -4.872 1.00 0.00 C ATOM 199 C1' DG A 7 -2.384 10.275 -3.644 1.00 0.00 C ATOM 200 N9 DG A 7 -1.203 10.184 -2.765 1.00 0.00 N ATOM 201 C8 DG A 7 0.121 10.129 -3.100 1.00 0.00 C ATOM 202 N7 DG A 7 0.916 9.865 -2.100 1.00 0.00 N ATOM 203 C5 DG A 7 0.052 9.741 -1.012 1.00 0.00 C ATOM 204 C6 DG A 7 0.312 9.493 0.372 1.00 0.00 C ATOM 205 O6 DG A 7 1.395 9.323 0.923 1.00 0.00 O ATOM 206 N1 DG A 7 -0.842 9.452 1.141 1.00 0.00 N ATOM 207 C2 DG A 7 -2.105 9.642 0.644 1.00 0.00 C ATOM 208 N2 DG A 7 -3.129 9.584 1.486 1.00 0.00 N ATOM 209 N3 DG A 7 -2.362 9.894 -0.643 1.00 0.00 N ATOM 210 C4 DG A 7 -1.246 9.925 -1.416 1.00 0.00 C ATOM 0 H5' DG A 7 -2.214 7.247 -6.102 1.00 0.00 H new ATOM 0 H5'' DG A 7 -2.859 8.224 -7.407 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.164 8.591 -5.492 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.121 10.845 -6.827 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.274 11.146 -5.304 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.505 12.206 -4.645 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.157 10.714 -3.014 1.00 0.00 H new ATOM 0 H8 DG A 7 0.478 10.290 -4.106 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.744 9.269 2.140 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.080 9.722 1.143 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.965 9.402 2.476 1.00 0.00 H new ATOM 222 P DC A 8 -5.238 12.378 -5.851 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.679 12.246 -6.152 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.338 13.031 -6.826 1.00 0.00 O ATOM 225 O5' DC A 8 -5.083 13.118 -4.433 1.00 0.00 O ATOM 226 C5' DC A 8 -6.034 12.962 -3.397 1.00 0.00 C ATOM 227 C4' DC A 8 -5.511 13.613 -2.108 1.00 0.00 C ATOM 228 O4' DC A 8 -4.421 12.841 -1.614 1.00 0.00 O ATOM 229 C3' DC A 8 -4.984 15.043 -2.350 1.00 0.00 C ATOM 230 O3' DC A 8 -5.312 15.917 -1.289 1.00 0.00 O ATOM 231 C2' DC A 8 -3.485 14.784 -2.398 1.00 0.00 C ATOM 232 C1' DC A 8 -3.398 13.751 -1.273 1.00 0.00 C ATOM 233 N1 DC A 8 -2.061 13.166 -1.039 1.00 0.00 N ATOM 234 C2 DC A 8 -1.659 12.861 0.262 1.00 0.00 C ATOM 235 O2 DC A 8 -2.475 12.765 1.175 1.00 0.00 O ATOM 236 N3 DC A 8 -0.332 12.665 0.522 1.00 0.00 N ATOM 237 C4 DC A 8 0.575 12.823 -0.452 1.00 0.00 C ATOM 238 N4 DC A 8 1.852 12.589 -0.184 1.00 0.00 N ATOM 239 C5 DC A 8 0.178 13.169 -1.780 1.00 0.00 C ATOM 240 C6 DC A 8 -1.133 13.301 -2.009 1.00 0.00 C ATOM 0 H5' DC A 8 -6.230 11.903 -3.227 1.00 0.00 H new ATOM 0 H5'' DC A 8 -6.980 13.418 -3.688 1.00 0.00 H new ATOM 0 H4' DC A 8 -6.342 13.656 -1.404 1.00 0.00 H new ATOM 0 H3' DC A 8 -5.399 15.526 -3.234 1.00 0.00 H new ATOM 0 H2' DC A 8 -3.154 14.392 -3.359 1.00 0.00 H new ATOM 0 H2'' DC A 8 -2.894 15.678 -2.198 1.00 0.00 H new ATOM 0 HO3' DC A 8 -4.959 16.811 -1.480 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.546 14.191 -0.287 1.00 0.00 H new ATOM 0 H41 DC A 8 2.556 12.704 -0.913 1.00 0.00 H new ATOM 0 H42 DC A 8 2.131 12.294 0.752 1.00 0.00 H new ATOM 0 H5 DC A 8 0.905 13.318 -2.565 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.463 13.525 -3.013 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.165 12.492 9.424 1.00 0.00 O ATOM 255 C5' DG B 9 3.594 11.335 9.993 1.00 0.00 C ATOM 256 C4' DG B 9 2.085 11.541 10.159 1.00 0.00 C ATOM 257 O4' DG B 9 1.486 12.064 8.979 1.00 0.00 O ATOM 258 C3' DG B 9 1.372 10.242 10.463 1.00 0.00 C ATOM 259 O3' DG B 9 0.270 10.519 11.312 1.00 0.00 O ATOM 260 C2' DG B 9 0.973 9.753 9.075 1.00 0.00 C ATOM 261 C1' DG B 9 0.899 11.015 8.219 1.00 0.00 C ATOM 262 N9 DG B 9 1.550 10.933 6.884 1.00 0.00 N ATOM 263 C8 DG B 9 2.858 10.657 6.563 1.00 0.00 C ATOM 264 N7 DG B 9 3.151 10.817 5.305 1.00 0.00 N ATOM 265 C5 DG B 9 1.956 11.239 4.737 1.00 0.00 C ATOM 266 C6 DG B 9 1.657 11.612 3.392 1.00 0.00 C ATOM 267 O6 DG B 9 2.423 11.667 2.435 1.00 0.00 O ATOM 268 N1 DG B 9 0.324 11.941 3.207 1.00 0.00 N ATOM 269 C2 DG B 9 -0.610 11.951 4.213 1.00 0.00 C ATOM 270 N2 DG B 9 -1.864 12.258 3.902 1.00 0.00 N ATOM 271 N3 DG B 9 -0.335 11.641 5.486 1.00 0.00 N ATOM 272 C4 DG B 9 0.966 11.296 5.687 1.00 0.00 C ATOM 0 H5' DG B 9 4.052 11.128 10.960 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.786 10.471 9.357 1.00 0.00 H new ATOM 0 H4' DG B 9 1.981 12.243 10.986 1.00 0.00 H new ATOM 0 H3' DG B 9 1.956 9.488 10.991 1.00 0.00 H new ATOM 0 H2' DG B 9 1.705 9.049 8.679 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.014 9.235 9.099 1.00 0.00 H new ATOM 0 HO5' DG B 9 3.474 12.996 8.945 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.153 11.184 7.988 1.00 0.00 H new ATOM 0 H8 DG B 9 3.583 10.334 7.295 1.00 0.00 H new ATOM 0 H1 DG B 9 0.018 12.191 2.267 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.580 12.274 4.628 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.111 12.478 2.937 1.00 0.00 H new ATOM 285 P DC B 10 -0.671 9.363 11.936 1.00 0.00 P ATOM 286 OP1 DC B 10 -1.355 9.918 13.123 1.00 0.00 O ATOM 287 OP2 DC B 10 0.135 8.129 12.058 1.00 0.00 O ATOM 288 O5' DC B 10 -1.766 9.157 10.776 1.00 0.00 O ATOM 289 C5' DC B 10 -2.662 10.197 10.443 1.00 0.00 C ATOM 290 C4' DC B 10 -3.297 9.937 9.075 1.00 0.00 C ATOM 291 O4' DC B 10 -2.316 9.956 8.050 1.00 0.00 O ATOM 292 C3' DC B 10 -4.010 8.579 8.978 1.00 0.00 C ATOM 293 O3' DC B 10 -5.342 8.847 8.583 1.00 0.00 O ATOM 294 C2' DC B 10 -3.172 7.852 7.914 1.00 0.00 C ATOM 295 C1' DC B 10 -2.702 9.016 7.069 1.00 0.00 C ATOM 296 N1 DC B 10 -1.617 8.685 6.109 1.00 0.00 N ATOM 297 C2 DC B 10 -1.776 8.958 4.751 1.00 0.00 C ATOM 298 O2 DC B 10 -2.852 9.348 4.301 1.00 0.00 O ATOM 299 N3 DC B 10 -0.717 8.792 3.902 1.00 0.00 N ATOM 300 C4 DC B 10 0.432 8.281 4.365 1.00 0.00 C ATOM 301 N4 DC B 10 1.493 8.269 3.565 1.00 0.00 N ATOM 302 C5 DC B 10 0.593 7.919 5.738 1.00 0.00 C ATOM 303 C6 DC B 10 -0.450 8.152 6.560 1.00 0.00 C ATOM 0 H5' DC B 10 -2.134 11.150 10.430 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.439 10.273 11.203 1.00 0.00 H new ATOM 0 H4' DC B 10 -4.029 10.735 8.952 1.00 0.00 H new ATOM 0 H3' DC B 10 -4.078 7.979 9.886 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.341 7.298 8.351 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.764 7.139 7.340 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.475 9.380 6.392 1.00 0.00 H new ATOM 0 H41 DC B 10 2.378 7.885 3.897 1.00 0.00 H new ATOM 0 H42 DC B 10 1.423 8.644 2.619 1.00 0.00 H new ATOM 0 H5 DC B 10 1.510 7.478 6.101 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.356 7.908 7.608 1.00 0.00 H new ATOM 315 P DG B 11 -6.397 7.681 8.265 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.753 8.178 8.581 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.912 6.431 8.888 1.00 0.00 O ATOM 318 O5' DG B 11 -6.261 7.543 6.664 1.00 0.00 O ATOM 319 C5' DG B 11 -6.770 8.525 5.780 1.00 0.00 C ATOM 320 C4' DG B 11 -7.393 7.868 4.536 1.00 0.00 C ATOM 321 O4' DG B 11 -6.396 7.626 3.566 1.00 0.00 O ATOM 322 C3' DG B 11 -8.058 6.522 4.842 1.00 0.00 C ATOM 323 O3' DG B 11 -9.185 6.368 3.998 1.00 0.00 O ATOM 324 C2' DG B 11 -6.919 5.547 4.567 1.00 0.00 C ATOM 325 C1' DG B 11 -6.148 6.240 3.444 1.00 0.00 C ATOM 326 N9 DG B 11 -4.687 6.054 3.507 1.00 0.00 N ATOM 327 C8 DG B 11 -3.902 5.824 4.601 1.00 0.00 C ATOM 328 N7 DG B 11 -2.621 5.887 4.370 1.00 0.00 N ATOM 329 C5 DG B 11 -2.550 6.148 3.002 1.00 0.00 C ATOM 330 C6 DG B 11 -1.424 6.234 2.128 1.00 0.00 C ATOM 331 O6 DG B 11 -0.234 6.157 2.415 1.00 0.00 O ATOM 332 N1 DG B 11 -1.784 6.427 0.805 1.00 0.00 N ATOM 333 C2 DG B 11 -3.082 6.520 0.361 1.00 0.00 C ATOM 334 N2 DG B 11 -3.308 6.695 -0.934 1.00 0.00 N ATOM 335 N3 DG B 11 -4.146 6.417 1.163 1.00 0.00 N ATOM 336 C4 DG B 11 -3.811 6.236 2.466 1.00 0.00 C ATOM 0 H5' DG B 11 -5.969 9.200 5.478 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.519 9.129 6.292 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.150 8.565 4.177 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.455 6.388 5.848 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.297 5.391 5.449 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.289 4.568 4.261 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.486 5.804 2.504 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.310 5.608 5.577 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.037 6.505 0.114 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.265 6.766 -1.280 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.525 6.759 -1.584 1.00 0.00 H new ATOM 348 P DT B 12 -10.162 5.094 4.109 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.495 5.486 3.602 1.00 0.00 O ATOM 350 OP2 DT B 12 -10.027 4.527 5.468 1.00 0.00 O ATOM 351 O5' DT B 12 -9.491 4.082 3.056 1.00 0.00 O ATOM 352 C5' DT B 12 -9.845 4.119 1.691 1.00 0.00 C ATOM 353 C4' DT B 12 -8.890 3.253 0.868 1.00 0.00 C ATOM 354 O4' DT B 12 -7.652 3.894 0.609 1.00 0.00 O ATOM 355 C3' DT B 12 -8.601 1.875 1.460 1.00 0.00 C ATOM 356 O3' DT B 12 -9.584 0.913 1.118 1.00 0.00 O ATOM 357 C2' DT B 12 -7.307 1.632 0.699 1.00 0.00 C ATOM 358 C1' DT B 12 -6.765 2.922 0.070 1.00 0.00 C ATOM 359 N1 DT B 12 -5.428 3.134 0.633 1.00 0.00 N ATOM 360 C2 DT B 12 -4.255 3.366 -0.086 1.00 0.00 C ATOM 361 O2 DT B 12 -4.241 3.563 -1.297 1.00 0.00 O ATOM 362 N3 DT B 12 -3.081 3.360 0.672 1.00 0.00 N ATOM 363 C4 DT B 12 -3.013 3.158 2.044 1.00 0.00 C ATOM 364 O4 DT B 12 -1.947 3.215 2.638 1.00 0.00 O ATOM 365 C5 DT B 12 -4.291 2.883 2.664 1.00 0.00 C ATOM 366 C7 DT B 12 -4.499 2.547 4.098 1.00 0.00 C ATOM 367 C6 DT B 12 -5.406 2.887 1.948 1.00 0.00 C ATOM 0 H5' DT B 12 -9.817 5.147 1.329 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.868 3.764 1.564 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.438 3.108 -0.063 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.570 1.814 2.548 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.560 1.216 1.375 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.478 0.891 -0.082 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.705 2.934 -1.018 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.203 3.517 0.177 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.480 2.899 4.416 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.441 1.467 4.231 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.728 3.029 4.700 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.340 2.681 2.449 1.00 0.00 H new ATOM 380 P DA B 13 -9.366 -0.662 1.429 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.496 -1.406 0.833 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.073 -0.798 2.872 1.00 0.00 O ATOM 383 O5' DA B 13 -8.026 -1.025 0.597 1.00 0.00 O ATOM 384 C5' DA B 13 -7.990 -0.927 -0.816 1.00 0.00 C ATOM 385 C4' DA B 13 -6.567 -0.686 -1.389 1.00 0.00 C ATOM 386 O4' DA B 13 -5.481 -0.918 -0.530 1.00 0.00 O ATOM 387 C3' DA B 13 -6.466 -1.684 -2.534 1.00 0.00 C ATOM 388 O3' DA B 13 -5.677 -1.149 -3.586 1.00 0.00 O ATOM 389 C2' DA B 13 -5.829 -2.822 -1.705 1.00 0.00 C ATOM 390 C1' DA B 13 -4.749 -2.031 -0.990 1.00 0.00 C ATOM 391 N9 DA B 13 -4.224 -2.624 0.239 1.00 0.00 N ATOM 392 C8 DA B 13 -4.855 -2.640 1.449 1.00 0.00 C ATOM 393 N7 DA B 13 -4.082 -2.945 2.458 1.00 0.00 N ATOM 394 C5 DA B 13 -2.830 -3.086 1.859 1.00 0.00 C ATOM 395 C6 DA B 13 -1.534 -3.307 2.359 1.00 0.00 C ATOM 396 N6 DA B 13 -1.265 -3.458 3.654 1.00 0.00 N ATOM 397 N1 DA B 13 -0.505 -3.276 1.502 1.00 0.00 N ATOM 398 C2 DA B 13 -0.724 -3.041 0.216 1.00 0.00 C ATOM 399 N3 DA B 13 -1.884 -2.827 -0.381 1.00 0.00 N ATOM 400 C4 DA B 13 -2.905 -2.859 0.511 1.00 0.00 C ATOM 0 H5' DA B 13 -8.642 -0.112 -1.132 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.395 -1.844 -1.245 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.484 0.372 -1.637 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.363 -1.979 -3.079 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.535 -3.285 -1.016 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.423 -3.618 -2.328 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.903 -1.898 -1.665 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.906 -2.419 1.563 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.305 -3.616 3.960 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.019 -3.416 4.340 1.00 0.00 H new ATOM 0 H2 DA B 13 0.149 -3.022 -0.420 1.00 0.00 H new ATOM 412 P DC B 14 -5.787 -1.696 -5.109 1.00 0.00 P ATOM 413 OP1 DC B 14 -5.992 -0.533 -5.996 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.762 -2.810 -5.124 1.00 0.00 O ATOM 415 O5' DC B 14 -4.332 -2.319 -5.396 1.00 0.00 O ATOM 416 C5' DC B 14 -3.807 -3.277 -4.510 1.00 0.00 C ATOM 417 C4' DC B 14 -2.359 -3.643 -4.809 1.00 0.00 C ATOM 418 O4' DC B 14 -1.712 -3.757 -3.550 1.00 0.00 O ATOM 419 C3' DC B 14 -2.260 -4.991 -5.524 1.00 0.00 C ATOM 420 O3' DC B 14 -1.158 -4.990 -6.419 1.00 0.00 O ATOM 421 C2' DC B 14 -2.064 -5.932 -4.353 1.00 0.00 C ATOM 422 C1' DC B 14 -1.360 -5.100 -3.299 1.00 0.00 C ATOM 423 N1 DC B 14 -1.751 -5.582 -1.962 1.00 0.00 N ATOM 424 C2 DC B 14 -0.779 -6.060 -1.100 1.00 0.00 C ATOM 425 O2 DC B 14 0.371 -6.263 -1.472 1.00 0.00 O ATOM 426 N3 DC B 14 -1.107 -6.308 0.191 1.00 0.00 N ATOM 427 C4 DC B 14 -2.369 -6.166 0.605 1.00 0.00 C ATOM 428 N4 DC B 14 -2.574 -6.272 1.911 1.00 0.00 N ATOM 429 C5 DC B 14 -3.421 -5.773 -0.298 1.00 0.00 C ATOM 430 C6 DC B 14 -3.049 -5.511 -1.569 1.00 0.00 C ATOM 0 H5' DC B 14 -4.419 -4.178 -4.555 1.00 0.00 H new ATOM 0 H5'' DC B 14 -3.875 -2.896 -3.491 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.909 -2.888 -5.453 1.00 0.00 H new ATOM 0 H3' DC B 14 -3.116 -5.257 -6.145 1.00 0.00 H new ATOM 0 H2' DC B 14 -3.018 -6.310 -3.986 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.466 -6.798 -4.637 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.274 -5.184 -3.337 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.516 -6.173 2.289 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.789 -6.452 2.537 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.449 -5.693 0.024 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.803 -5.238 -2.292 1.00 0.00 H new ATOM 442 P DG B 15 -0.749 -6.290 -7.296 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.166 -5.813 -8.567 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.911 -7.205 -7.325 1.00 0.00 O ATOM 445 O5' DG B 15 0.423 -6.999 -6.429 1.00 0.00 O ATOM 446 C5' DG B 15 1.694 -6.390 -6.319 1.00 0.00 C ATOM 447 C4' DG B 15 2.741 -7.249 -5.597 1.00 0.00 C ATOM 448 O4' DG B 15 2.339 -7.518 -4.268 1.00 0.00 O ATOM 449 C3' DG B 15 2.998 -8.598 -6.276 1.00 0.00 C ATOM 450 O3' DG B 15 4.399 -8.822 -6.217 1.00 0.00 O ATOM 451 C2' DG B 15 2.154 -9.540 -5.434 1.00 0.00 C ATOM 452 C1' DG B 15 2.297 -8.919 -4.053 1.00 0.00 C ATOM 453 N9 DG B 15 1.205 -9.186 -3.097 1.00 0.00 N ATOM 454 C8 DG B 15 -0.149 -9.178 -3.303 1.00 0.00 C ATOM 455 N7 DG B 15 -0.856 -9.247 -2.207 1.00 0.00 N ATOM 456 C5 DG B 15 0.102 -9.291 -1.192 1.00 0.00 C ATOM 457 C6 DG B 15 -0.030 -9.347 0.231 1.00 0.00 C ATOM 458 O6 DG B 15 -1.056 -9.438 0.899 1.00 0.00 O ATOM 459 N1 DG B 15 1.193 -9.287 0.889 1.00 0.00 N ATOM 460 C2 DG B 15 2.407 -9.274 0.253 1.00 0.00 C ATOM 461 N2 DG B 15 3.508 -9.266 0.991 1.00 0.00 N ATOM 462 N3 DG B 15 2.545 -9.270 -1.075 1.00 0.00 N ATOM 463 C4 DG B 15 1.360 -9.250 -1.735 1.00 0.00 C ATOM 0 H5' DG B 15 1.587 -5.444 -5.788 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.060 -6.155 -7.318 1.00 0.00 H new ATOM 0 H4' DG B 15 3.659 -6.662 -5.627 1.00 0.00 H new ATOM 0 H3' DG B 15 2.731 -8.702 -7.328 1.00 0.00 H new ATOM 0 H2' DG B 15 1.116 -9.569 -5.766 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.527 -10.564 -5.464 1.00 0.00 H new ATOM 0 H1' DG B 15 3.185 -9.359 -3.599 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.593 -9.120 -4.286 1.00 0.00 H new ATOM 0 H1 DG B 15 1.187 -9.250 1.908 1.00 0.00 H new ATOM 0 H21 DG B 15 4.423 -9.256 0.541 1.00 0.00 H new ATOM 0 H22 DG B 15 3.440 -9.270 2.009 1.00 0.00 H new ATOM 475 P DC B 16 5.112 -10.130 -6.827 1.00 0.00 P ATOM 476 OP1 DC B 16 6.480 -9.757 -7.246 1.00 0.00 O ATOM 477 OP2 DC B 16 4.184 -10.743 -7.802 1.00 0.00 O ATOM 478 O5' DC B 16 5.220 -11.095 -5.544 1.00 0.00 O ATOM 479 C5' DC B 16 6.248 -10.952 -4.581 1.00 0.00 C ATOM 480 C4' DC B 16 5.983 -11.883 -3.389 1.00 0.00 C ATOM 481 O4' DC B 16 4.831 -11.419 -2.691 1.00 0.00 O ATOM 482 C3' DC B 16 5.695 -13.333 -3.835 1.00 0.00 C ATOM 483 O3' DC B 16 6.298 -14.275 -2.972 1.00 0.00 O ATOM 484 C2' DC B 16 4.177 -13.364 -3.724 1.00 0.00 C ATOM 485 C1' DC B 16 4.029 -12.550 -2.434 1.00 0.00 C ATOM 486 N1 DC B 16 2.641 -12.281 -2.008 1.00 0.00 N ATOM 487 C2 DC B 16 2.294 -12.326 -0.656 1.00 0.00 C ATOM 488 O2 DC B 16 3.142 -12.292 0.234 1.00 0.00 O ATOM 489 N3 DC B 16 0.974 -12.408 -0.316 1.00 0.00 N ATOM 490 C4 DC B 16 0.034 -12.505 -1.266 1.00 0.00 C ATOM 491 N4 DC B 16 -1.240 -12.561 -0.908 1.00 0.00 N ATOM 492 C5 DC B 16 0.383 -12.486 -2.652 1.00 0.00 C ATOM 493 C6 DC B 16 1.678 -12.349 -2.948 1.00 0.00 C ATOM 0 H5' DC B 16 6.298 -9.918 -4.241 1.00 0.00 H new ATOM 0 H5'' DC B 16 7.213 -11.187 -5.029 1.00 0.00 H new ATOM 0 H4' DC B 16 6.876 -11.875 -2.764 1.00 0.00 H new ATOM 0 H3' DC B 16 6.084 -13.588 -4.821 1.00 0.00 H new ATOM 0 H2' DC B 16 3.681 -12.900 -4.576 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.780 -14.375 -3.635 1.00 0.00 H new ATOM 0 HO3' DC B 16 6.094 -15.182 -3.283 1.00 0.00 H new ATOM 0 H1' DC B 16 4.359 -13.095 -1.550 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.967 -12.635 -1.620 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.494 -12.530 0.079 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.366 -12.578 -3.424 1.00 0.00 H new ATOM 0 H6 DC B 16 1.966 -12.290 -3.987 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.868 0.264 -0.552 1.00 0.00 O HETATM 508 C2 PSO A 9 -2.120 0.341 -0.284 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.637 0.275 1.019 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.744 0.125 2.072 1.00 0.00 C HETATM 511 C5 PSO A 9 0.602 0.143 2.769 1.00 0.00 C HETATM 512 C6 PSO A 9 1.954 0.243 2.414 1.00 0.00 C HETATM 513 C7 PSO A 9 2.337 0.222 1.118 1.00 0.00 C HETATM 514 C8 PSO A 9 1.357 0.127 0.098 1.00 0.00 C HETATM 515 C9 PSO A 9 -0.021 0.198 0.422 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.382 0.161 1.762 1.00 0.00 C HETATM 517 C4' PSO A 9 3.121 0.035 3.335 1.00 0.00 C HETATM 518 C5' PSO A 9 4.219 0.015 2.255 1.00 0.00 C HETATM 519 O6' PSO A 9 3.595 0.224 0.957 1.00 0.00 O HETATM 520 O11 PSO A 9 -2.908 0.481 -1.216 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.227 -0.069 3.490 1.00 0.00 C HETATM 522 C13 PSO A 9 3.173 1.022 4.520 1.00 0.00 C HETATM 523 O14 PSO A 9 1.971 1.715 4.779 1.00 0.00 O HETATM 524 C15 PSO A 9 5.510 0.782 2.608 1.00 0.00 C HETATM 525 C16 PSO A 9 1.754 -0.059 -1.354 1.00 0.00 C HETATM 0 H163 PSO A 9 2.370 0.782 -1.673 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.320 -0.984 -1.461 1.00 0.00 H new HETATM 0 H161 PSO A 9 0.858 -0.108 -1.973 1.00 0.00 H new HETATM 0 H153 PSO A 9 5.273 1.831 2.786 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.954 0.353 3.506 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.216 0.705 1.782 1.00 0.00 H new HETATM 0 H132 PSO A 9 3.457 0.472 5.417 1.00 0.00 H new HETATM 0 H131 PSO A 9 3.960 1.751 4.330 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.826 0.790 3.791 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.834 -0.972 3.547 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.370 -0.165 4.156 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.314 0.052 3.816 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.710 0.340 1.200 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.097 2.314 5.544 1.00 0.00 H new