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 28:sc= 0.0699 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.43 (180deg=-1.43) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : B 1 PSO O14 : rot 180:sc= -0.699 USER MOD Single : B 9 DG O5' : rot 180:sc= 0 USER MOD Single : B 12 DT C7 :methyl 150:sc= -1.68 (180deg=-1.68) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.883 -9.376 8.682 1.00 0.00 O ATOM 2 C5' DG A 1 -1.908 -9.584 9.678 1.00 0.00 C ATOM 3 C4' DG A 1 -0.504 -9.445 9.080 1.00 0.00 C ATOM 4 O4' DG A 1 -0.397 -10.278 7.932 1.00 0.00 O ATOM 5 C3' DG A 1 -0.185 -8.007 8.648 1.00 0.00 C ATOM 6 O3' DG A 1 1.145 -7.735 9.051 1.00 0.00 O ATOM 7 C2' DG A 1 -0.373 -8.089 7.136 1.00 0.00 C ATOM 8 C1' DG A 1 0.070 -9.517 6.830 1.00 0.00 C ATOM 9 N9 DG A 1 -0.521 -10.044 5.578 1.00 0.00 N ATOM 10 C8 DG A 1 -1.847 -10.087 5.229 1.00 0.00 C ATOM 11 N7 DG A 1 -2.088 -10.681 4.097 1.00 0.00 N ATOM 12 C5 DG A 1 -0.829 -11.073 3.657 1.00 0.00 C ATOM 13 C6 DG A 1 -0.449 -11.778 2.478 1.00 0.00 C ATOM 14 O6 DG A 1 -1.180 -12.246 1.609 1.00 0.00 O ATOM 15 N1 DG A 1 0.922 -11.923 2.352 1.00 0.00 N ATOM 16 C2 DG A 1 1.828 -11.510 3.298 1.00 0.00 C ATOM 17 N2 DG A 1 3.118 -11.726 3.062 1.00 0.00 N ATOM 18 N3 DG A 1 1.484 -10.875 4.427 1.00 0.00 N ATOM 19 C4 DG A 1 0.141 -10.681 4.548 1.00 0.00 C ATOM 0 H5' DG A 1 -2.029 -10.575 10.114 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.041 -8.862 10.484 1.00 0.00 H new ATOM 0 H4' DG A 1 0.202 -9.735 9.858 1.00 0.00 H new ATOM 0 H3' DG A 1 -0.793 -7.208 9.073 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.409 -7.913 6.845 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.235 -7.353 6.610 1.00 0.00 H new ATOM 0 HO5' DG A 1 -2.517 -9.627 7.808 1.00 0.00 H new ATOM 0 H1' DG A 1 1.150 -9.563 6.690 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.627 -9.662 5.844 1.00 0.00 H new ATOM 0 H1 DG A 1 1.281 -12.363 1.505 1.00 0.00 H new ATOM 0 H21 DG A 1 3.817 -11.432 3.744 1.00 0.00 H new ATOM 0 H22 DG A 1 3.409 -12.186 2.199 1.00 0.00 H new ATOM 32 P DC A 2 1.919 -6.365 8.704 1.00 0.00 P ATOM 33 OP1 DC A 2 2.734 -5.986 9.878 1.00 0.00 O ATOM 34 OP2 DC A 2 0.954 -5.400 8.134 1.00 0.00 O ATOM 35 O5' DC A 2 2.912 -6.862 7.538 1.00 0.00 O ATOM 36 C5' DC A 2 3.850 -7.887 7.800 1.00 0.00 C ATOM 37 C4' DC A 2 4.717 -8.182 6.576 1.00 0.00 C ATOM 38 O4' DC A 2 3.940 -8.671 5.506 1.00 0.00 O ATOM 39 C3' DC A 2 5.455 -6.948 6.059 1.00 0.00 C ATOM 40 O3' DC A 2 6.774 -7.409 5.830 1.00 0.00 O ATOM 41 C2' DC A 2 4.678 -6.548 4.797 1.00 0.00 C ATOM 42 C1' DC A 2 4.201 -7.916 4.336 1.00 0.00 C ATOM 43 N1 DC A 2 2.931 -7.877 3.572 1.00 0.00 N ATOM 44 C2 DC A 2 2.863 -8.549 2.362 1.00 0.00 C ATOM 45 O2 DC A 2 3.882 -8.995 1.843 1.00 0.00 O ATOM 46 N3 DC A 2 1.659 -8.717 1.745 1.00 0.00 N ATOM 47 C4 DC A 2 0.549 -8.226 2.309 1.00 0.00 C ATOM 48 N4 DC A 2 -0.618 -8.548 1.760 1.00 0.00 N ATOM 49 C5 DC A 2 0.581 -7.547 3.570 1.00 0.00 C ATOM 50 C6 DC A 2 1.791 -7.401 4.159 1.00 0.00 C ATOM 0 H5' DC A 2 3.325 -8.793 8.102 1.00 0.00 H new ATOM 0 H5'' DC A 2 4.486 -7.594 8.635 1.00 0.00 H new ATOM 0 H4' DC A 2 5.439 -8.925 6.913 1.00 0.00 H new ATOM 0 H3' DC A 2 5.513 -6.073 6.706 1.00 0.00 H new ATOM 0 H2' DC A 2 3.852 -5.870 5.013 1.00 0.00 H new ATOM 0 H2'' DC A 2 5.309 -6.056 4.057 1.00 0.00 H new ATOM 0 H1' DC A 2 4.971 -8.332 3.686 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.486 -8.193 2.162 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.646 -9.150 0.937 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.320 -7.169 4.030 1.00 0.00 H new ATOM 0 H6 DC A 2 1.858 -6.898 5.112 1.00 0.00 H new ATOM 62 P DG A 3 8.014 -6.422 5.624 1.00 0.00 P ATOM 63 OP1 DG A 3 9.253 -7.227 5.611 1.00 0.00 O ATOM 64 OP2 DG A 3 7.871 -5.294 6.569 1.00 0.00 O ATOM 65 O5' DG A 3 7.720 -5.899 4.144 1.00 0.00 O ATOM 66 C5' DG A 3 7.925 -6.704 3.002 1.00 0.00 C ATOM 67 C4' DG A 3 7.608 -5.878 1.750 1.00 0.00 C ATOM 68 O4' DG A 3 6.330 -6.080 1.197 1.00 0.00 O ATOM 69 C3' DG A 3 7.752 -4.377 1.966 1.00 0.00 C ATOM 70 O3' DG A 3 8.542 -3.900 0.912 1.00 0.00 O ATOM 71 C2' DG A 3 6.297 -3.988 2.029 1.00 0.00 C ATOM 72 C1' DG A 3 5.778 -4.816 0.875 1.00 0.00 C ATOM 73 N9 DG A 3 4.347 -5.029 0.823 1.00 0.00 N ATOM 74 C8 DG A 3 3.517 -4.905 1.865 1.00 0.00 C ATOM 75 N7 DG A 3 2.316 -5.363 1.680 1.00 0.00 N ATOM 76 C5 DG A 3 2.356 -5.753 0.342 1.00 0.00 C ATOM 77 C6 DG A 3 1.322 -6.221 -0.507 1.00 0.00 C ATOM 78 O6 DG A 3 0.204 -6.605 -0.187 1.00 0.00 O ATOM 79 N1 DG A 3 1.688 -6.216 -1.842 1.00 0.00 N ATOM 80 C2 DG A 3 2.955 -5.953 -2.304 1.00 0.00 C ATOM 81 N2 DG A 3 3.172 -5.995 -3.614 1.00 0.00 N ATOM 82 N3 DG A 3 3.976 -5.641 -1.501 1.00 0.00 N ATOM 83 C4 DG A 3 3.592 -5.515 -0.205 1.00 0.00 C ATOM 0 H5' DG A 3 7.287 -7.587 3.043 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.956 -7.057 2.970 1.00 0.00 H new ATOM 0 H4' DG A 3 8.357 -6.252 1.052 1.00 0.00 H new ATOM 0 H3' DG A 3 8.262 -3.979 2.843 1.00 0.00 H new ATOM 0 H2' DG A 3 5.832 -4.252 2.979 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.141 -2.919 1.884 1.00 0.00 H new ATOM 0 H1' DG A 3 6.030 -4.330 -0.068 1.00 0.00 H new ATOM 0 H8 DG A 3 3.825 -4.454 2.797 1.00 0.00 H new ATOM 0 H1 DG A 3 0.966 -6.422 -2.532 1.00 0.00 H new ATOM 0 H21 DG A 3 4.103 -5.804 -3.983 1.00 0.00 H new ATOM 0 H22 DG A 3 2.407 -6.219 -4.251 1.00 0.00 H new ATOM 95 P DT A 4 10.046 -3.421 1.209 1.00 0.00 P ATOM 96 OP1 DT A 4 10.733 -3.225 -0.085 1.00 0.00 O ATOM 97 OP2 DT A 4 10.618 -4.333 2.223 1.00 0.00 O ATOM 98 O5' DT A 4 9.762 -1.974 1.881 1.00 0.00 O ATOM 99 C5' DT A 4 8.544 -1.254 1.700 1.00 0.00 C ATOM 100 C4' DT A 4 8.015 -1.278 0.246 1.00 0.00 C ATOM 101 O4' DT A 4 6.850 -2.079 -0.042 1.00 0.00 O ATOM 102 C3' DT A 4 7.614 0.106 -0.236 1.00 0.00 C ATOM 103 O3' DT A 4 7.845 0.031 -1.628 1.00 0.00 O ATOM 104 C2' DT A 4 6.207 -0.053 0.202 1.00 0.00 C ATOM 105 C1' DT A 4 5.667 -1.312 -0.289 1.00 0.00 C ATOM 106 N1 DT A 4 4.439 -1.685 0.512 1.00 0.00 N ATOM 107 C2 DT A 4 3.386 -2.292 -0.165 1.00 0.00 C ATOM 108 O2 DT A 4 3.473 -2.599 -1.348 1.00 0.00 O ATOM 109 N3 DT A 4 2.221 -2.549 0.526 1.00 0.00 N ATOM 110 C4 DT A 4 1.929 -2.224 1.830 1.00 0.00 C ATOM 111 O4 DT A 4 0.916 -2.676 2.359 1.00 0.00 O ATOM 112 C5 DT A 4 2.882 -1.297 2.597 1.00 0.00 C ATOM 113 C7 DT A 4 3.173 -1.767 4.029 1.00 0.00 C ATOM 114 C6 DT A 4 4.165 -0.964 1.818 1.00 0.00 C ATOM 0 H5' DT A 4 8.696 -0.218 2.004 1.00 0.00 H new ATOM 0 H5'' DT A 4 7.784 -1.672 2.360 1.00 0.00 H new ATOM 0 H4' DT A 4 8.878 -1.717 -0.254 1.00 0.00 H new ATOM 0 H3' DT A 4 8.070 1.041 0.089 1.00 0.00 H new ATOM 0 H2' DT A 4 6.152 -0.025 1.290 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.607 0.778 -0.169 1.00 0.00 H new ATOM 0 H1' DT A 4 5.289 -1.393 -1.308 1.00 0.00 H new ATOM 0 H3 DT A 4 1.490 -3.038 0.009 1.00 0.00 H new ATOM 0 H71 DT A 4 4.172 -1.445 4.322 1.00 0.00 H new ATOM 0 H72 DT A 4 2.439 -1.336 4.710 1.00 0.00 H new ATOM 0 H73 DT A 4 3.114 -2.854 4.074 1.00 0.00 H new ATOM 0 H6 DT A 4 4.860 -0.228 2.195 1.00 0.00 H new ATOM 127 P DA A 5 9.340 -0.062 -2.243 1.00 0.00 P ATOM 128 OP1 DA A 5 9.431 -1.282 -3.072 1.00 0.00 O ATOM 129 OP2 DA A 5 10.294 0.162 -1.134 1.00 0.00 O ATOM 130 O5' DA A 5 9.355 1.210 -3.170 1.00 0.00 O ATOM 131 C5' DA A 5 8.569 2.309 -2.815 1.00 0.00 C ATOM 132 C4' DA A 5 7.173 2.176 -3.435 1.00 0.00 C ATOM 133 O4' DA A 5 6.159 1.728 -2.537 1.00 0.00 O ATOM 134 C3' DA A 5 6.825 3.572 -3.898 1.00 0.00 C ATOM 135 O3' DA A 5 6.876 3.826 -5.300 1.00 0.00 O ATOM 136 C2' DA A 5 5.476 3.709 -3.292 1.00 0.00 C ATOM 137 C1' DA A 5 4.951 2.435 -2.739 1.00 0.00 C ATOM 138 N9 DA A 5 4.311 2.750 -1.430 1.00 0.00 N ATOM 139 C8 DA A 5 4.989 3.338 -0.395 1.00 0.00 C ATOM 140 N7 DA A 5 4.264 3.944 0.491 1.00 0.00 N ATOM 141 C5 DA A 5 2.981 3.642 0.064 1.00 0.00 C ATOM 142 C6 DA A 5 1.711 3.893 0.604 1.00 0.00 C ATOM 143 N6 DA A 5 1.528 4.354 1.835 1.00 0.00 N ATOM 144 N1 DA A 5 0.643 3.683 -0.165 1.00 0.00 N ATOM 145 C2 DA A 5 0.835 3.190 -1.378 1.00 0.00 C ATOM 146 N3 DA A 5 1.953 2.848 -1.990 1.00 0.00 N ATOM 147 C4 DA A 5 3.007 3.078 -1.186 1.00 0.00 C ATOM 0 H5' DA A 5 9.041 3.230 -3.156 1.00 0.00 H new ATOM 0 H5'' DA A 5 8.489 2.375 -1.730 1.00 0.00 H new ATOM 0 H4' DA A 5 7.206 1.423 -4.222 1.00 0.00 H new ATOM 0 H3' DA A 5 7.558 4.318 -3.591 1.00 0.00 H new ATOM 0 H2' DA A 5 5.516 4.454 -2.497 1.00 0.00 H new ATOM 0 H2'' DA A 5 4.783 4.084 -4.045 1.00 0.00 H new ATOM 0 H1' DA A 5 4.221 1.901 -3.347 1.00 0.00 H new ATOM 0 H8 DA A 5 6.066 3.299 -0.322 1.00 0.00 H new ATOM 0 H61 DA A 5 0.583 4.521 2.182 1.00 0.00 H new ATOM 0 H62 DA A 5 2.332 4.542 2.434 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.064 3.045 -1.958 1.00 0.00 H new ATOM 159 P DC A 6 5.937 3.100 -6.423 1.00 0.00 P ATOM 160 OP1 DC A 6 6.032 1.635 -6.250 1.00 0.00 O ATOM 161 OP2 DC A 6 6.292 3.692 -7.731 1.00 0.00 O ATOM 162 O5' DC A 6 4.422 3.536 -6.079 1.00 0.00 O ATOM 163 C5' DC A 6 3.966 4.847 -6.336 1.00 0.00 C ATOM 164 C4' DC A 6 2.507 5.017 -5.892 1.00 0.00 C ATOM 165 O4' DC A 6 2.356 4.822 -4.482 1.00 0.00 O ATOM 166 C3' DC A 6 2.060 6.457 -6.192 1.00 0.00 C ATOM 167 O3' DC A 6 0.764 6.466 -6.768 1.00 0.00 O ATOM 168 C2' DC A 6 2.070 7.019 -4.781 1.00 0.00 C ATOM 169 C1' DC A 6 1.505 5.852 -4.003 1.00 0.00 C ATOM 170 N1 DC A 6 1.605 6.164 -2.556 1.00 0.00 N ATOM 171 C2 DC A 6 0.454 6.486 -1.836 1.00 0.00 C ATOM 172 O2 DC A 6 -0.662 6.446 -2.351 1.00 0.00 O ATOM 173 N3 DC A 6 0.568 6.855 -0.529 1.00 0.00 N ATOM 174 C4 DC A 6 1.771 6.951 0.044 1.00 0.00 C ATOM 175 N4 DC A 6 1.843 7.269 1.328 1.00 0.00 N ATOM 176 C5 DC A 6 2.960 6.599 -0.668 1.00 0.00 C ATOM 177 C6 DC A 6 2.825 6.231 -1.949 1.00 0.00 C ATOM 0 H5' DC A 6 4.054 5.065 -7.400 1.00 0.00 H new ATOM 0 H5'' DC A 6 4.596 5.565 -5.811 1.00 0.00 H new ATOM 0 H4' DC A 6 1.912 4.278 -6.429 1.00 0.00 H new ATOM 0 H3' DC A 6 2.671 7.012 -6.904 1.00 0.00 H new ATOM 0 H2' DC A 6 3.073 7.288 -4.451 1.00 0.00 H new ATOM 0 H2'' DC A 6 1.454 7.913 -4.689 1.00 0.00 H new ATOM 0 H1' DC A 6 0.454 5.593 -4.128 1.00 0.00 H new ATOM 0 H41 DC A 6 2.752 7.347 1.784 1.00 0.00 H new ATOM 0 H42 DC A 6 0.989 7.436 1.861 1.00 0.00 H new ATOM 0 H5 DC A 6 3.929 6.629 -0.192 1.00 0.00 H new ATOM 0 H6 DC A 6 3.708 5.980 -2.518 1.00 0.00 H new ATOM 189 P DG A 7 0.023 7.836 -7.206 1.00 0.00 P ATOM 190 OP1 DG A 7 -0.606 7.606 -8.524 1.00 0.00 O ATOM 191 OP2 DG A 7 0.985 8.949 -7.046 1.00 0.00 O ATOM 192 O5' DG A 7 -1.153 8.030 -6.111 1.00 0.00 O ATOM 193 C5' DG A 7 -2.293 7.192 -6.117 1.00 0.00 C ATOM 194 C4' DG A 7 -3.455 7.730 -5.269 1.00 0.00 C ATOM 195 O4' DG A 7 -3.064 7.819 -3.910 1.00 0.00 O ATOM 196 C3' DG A 7 -3.919 9.127 -5.699 1.00 0.00 C ATOM 197 O3' DG A 7 -5.324 9.215 -5.515 1.00 0.00 O ATOM 198 C2' DG A 7 -3.121 9.997 -4.747 1.00 0.00 C ATOM 199 C1' DG A 7 -3.181 9.161 -3.468 1.00 0.00 C ATOM 200 N9 DG A 7 -2.079 9.450 -2.531 1.00 0.00 N ATOM 201 C8 DG A 7 -0.742 9.538 -2.818 1.00 0.00 C ATOM 202 N7 DG A 7 0.017 9.712 -1.774 1.00 0.00 N ATOM 203 C5 DG A 7 -0.878 9.672 -0.705 1.00 0.00 C ATOM 204 C6 DG A 7 -0.645 9.707 0.702 1.00 0.00 C ATOM 205 O6 DG A 7 0.407 9.928 1.293 1.00 0.00 O ATOM 206 N1 DG A 7 -1.787 9.452 1.448 1.00 0.00 N ATOM 207 C2 DG A 7 -3.043 9.345 0.913 1.00 0.00 C ATOM 208 N2 DG A 7 -4.056 9.125 1.744 1.00 0.00 N ATOM 209 N3 DG A 7 -3.291 9.390 -0.401 1.00 0.00 N ATOM 210 C4 DG A 7 -2.163 9.505 -1.158 1.00 0.00 C ATOM 0 H5' DG A 7 -2.011 6.206 -5.748 1.00 0.00 H new ATOM 0 H5'' DG A 7 -2.633 7.063 -7.144 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.277 7.028 -5.411 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.757 9.403 -6.741 1.00 0.00 H new ATOM 0 H2' DG A 7 -2.098 10.153 -5.090 1.00 0.00 H new ATOM 0 H2'' DG A 7 -3.567 10.983 -4.617 1.00 0.00 H new ATOM 0 H1' DG A 7 -4.101 9.377 -2.925 1.00 0.00 H new ATOM 0 H8 DG A 7 -0.352 9.469 -3.823 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.685 9.337 2.456 1.00 0.00 H new ATOM 0 H21 DG A 7 -5.005 9.040 1.380 1.00 0.00 H new ATOM 0 H22 DG A 7 -3.885 9.041 2.746 1.00 0.00 H new ATOM 222 P DC A 8 -6.183 10.508 -5.965 1.00 0.00 P ATOM 223 OP1 DC A 8 -7.411 10.031 -6.635 1.00 0.00 O ATOM 224 OP2 DC A 8 -5.278 11.442 -6.670 1.00 0.00 O ATOM 225 O5' DC A 8 -6.598 11.167 -4.555 1.00 0.00 O ATOM 226 C5' DC A 8 -7.670 10.638 -3.798 1.00 0.00 C ATOM 227 C4' DC A 8 -7.678 11.236 -2.391 1.00 0.00 C ATOM 228 O4' DC A 8 -6.466 10.930 -1.738 1.00 0.00 O ATOM 229 C3' DC A 8 -7.762 12.760 -2.349 1.00 0.00 C ATOM 230 O3' DC A 8 -9.087 13.222 -2.490 1.00 0.00 O ATOM 231 C2' DC A 8 -7.198 13.050 -0.962 1.00 0.00 C ATOM 232 C1' DC A 8 -6.302 11.839 -0.662 1.00 0.00 C ATOM 233 N1 DC A 8 -4.870 12.225 -0.551 1.00 0.00 N ATOM 234 C2 DC A 8 -4.316 12.387 0.714 1.00 0.00 C ATOM 235 O2 DC A 8 -5.015 12.323 1.721 1.00 0.00 O ATOM 236 N3 DC A 8 -2.978 12.618 0.836 1.00 0.00 N ATOM 237 C4 DC A 8 -2.218 12.744 -0.256 1.00 0.00 C ATOM 238 N4 DC A 8 -0.909 12.891 -0.091 1.00 0.00 N ATOM 239 C5 DC A 8 -2.766 12.635 -1.575 1.00 0.00 C ATOM 240 C6 DC A 8 -4.091 12.369 -1.668 1.00 0.00 C ATOM 0 H5' DC A 8 -7.580 9.553 -3.738 1.00 0.00 H new ATOM 0 H5'' DC A 8 -8.615 10.853 -4.296 1.00 0.00 H new ATOM 0 H4' DC A 8 -8.564 10.809 -1.921 1.00 0.00 H new ATOM 0 H3' DC A 8 -7.229 13.258 -3.159 1.00 0.00 H new ATOM 0 H2' DC A 8 -6.629 13.980 -0.949 1.00 0.00 H new ATOM 0 H2'' DC A 8 -7.992 13.152 -0.222 1.00 0.00 H new ATOM 0 HO3' DC A 8 -9.097 14.201 -2.456 1.00 0.00 H new ATOM 0 H1' DC A 8 -6.588 11.397 0.292 1.00 0.00 H new ATOM 0 H41 DC A 8 -0.300 12.990 -0.904 1.00 0.00 H new ATOM 0 H42 DC A 8 -0.512 12.905 0.848 1.00 0.00 H new ATOM 0 H5 DC A 8 -2.151 12.759 -2.454 1.00 0.00 H new ATOM 0 H6 DC A 8 -4.543 12.268 -2.644 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 0.570 11.592 12.038 1.00 0.00 O ATOM 255 C5' DG B 9 0.312 11.877 10.679 1.00 0.00 C ATOM 256 C4' DG B 9 -0.890 11.062 10.185 1.00 0.00 C ATOM 257 O4' DG B 9 -1.128 11.352 8.822 1.00 0.00 O ATOM 258 C3' DG B 9 -0.627 9.548 10.231 1.00 0.00 C ATOM 259 O3' DG B 9 -1.813 8.780 10.142 1.00 0.00 O ATOM 260 C2' DG B 9 0.108 9.340 8.911 1.00 0.00 C ATOM 261 C1' DG B 9 -0.770 10.229 8.030 1.00 0.00 C ATOM 262 N9 DG B 9 -0.192 10.728 6.765 1.00 0.00 N ATOM 263 C8 DG B 9 1.107 11.005 6.419 1.00 0.00 C ATOM 264 N7 DG B 9 1.239 11.540 5.236 1.00 0.00 N ATOM 265 C5 DG B 9 -0.068 11.642 4.762 1.00 0.00 C ATOM 266 C6 DG B 9 -0.587 12.144 3.529 1.00 0.00 C ATOM 267 O6 DG B 9 0.022 12.661 2.594 1.00 0.00 O ATOM 268 N1 DG B 9 -1.963 12.005 3.427 1.00 0.00 N ATOM 269 C2 DG B 9 -2.762 11.502 4.426 1.00 0.00 C ATOM 270 N2 DG B 9 -4.067 11.398 4.211 1.00 0.00 N ATOM 271 N3 DG B 9 -2.296 11.071 5.599 1.00 0.00 N ATOM 272 C4 DG B 9 -0.945 11.156 5.699 1.00 0.00 C ATOM 0 H5' DG B 9 1.191 11.643 10.078 1.00 0.00 H new ATOM 0 H5'' DG B 9 0.115 12.942 10.554 1.00 0.00 H new ATOM 0 H4' DG B 9 -1.725 11.326 10.835 1.00 0.00 H new ATOM 0 H3' DG B 9 -0.121 9.254 11.151 1.00 0.00 H new ATOM 0 H2' DG B 9 1.146 9.670 8.947 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.116 8.299 8.589 1.00 0.00 H new ATOM 0 HO5' DG B 9 1.340 12.116 12.342 1.00 0.00 H new ATOM 0 H1' DG B 9 -1.596 9.595 7.708 1.00 0.00 H new ATOM 0 H8 DG B 9 1.945 10.799 7.068 1.00 0.00 H new ATOM 0 H1 DG B 9 -2.410 12.294 2.557 1.00 0.00 H new ATOM 0 H21 DG B 9 -4.676 11.027 4.940 1.00 0.00 H new ATOM 0 H22 DG B 9 -4.461 11.689 3.316 1.00 0.00 H new ATOM 285 P DC B 10 -3.084 8.996 11.111 1.00 0.00 P ATOM 286 OP1 DC B 10 -4.118 9.741 10.362 1.00 0.00 O ATOM 287 OP2 DC B 10 -2.577 9.544 12.389 1.00 0.00 O ATOM 288 O5' DC B 10 -3.620 7.505 11.387 1.00 0.00 O ATOM 289 C5' DC B 10 -3.476 6.454 10.452 1.00 0.00 C ATOM 290 C4' DC B 10 -4.321 6.614 9.173 1.00 0.00 C ATOM 291 O4' DC B 10 -3.778 7.580 8.260 1.00 0.00 O ATOM 292 C3' DC B 10 -4.321 5.262 8.438 1.00 0.00 C ATOM 293 O3' DC B 10 -5.588 5.073 7.860 1.00 0.00 O ATOM 294 C2' DC B 10 -3.210 5.559 7.442 1.00 0.00 C ATOM 295 C1' DC B 10 -3.575 6.963 6.994 1.00 0.00 C ATOM 296 N1 DC B 10 -2.486 7.538 6.150 1.00 0.00 N ATOM 297 C2 DC B 10 -2.734 8.112 4.899 1.00 0.00 C ATOM 298 O2 DC B 10 -3.880 8.297 4.490 1.00 0.00 O ATOM 299 N3 DC B 10 -1.673 8.478 4.106 1.00 0.00 N ATOM 300 C4 DC B 10 -0.419 8.214 4.506 1.00 0.00 C ATOM 301 N4 DC B 10 0.605 8.673 3.798 1.00 0.00 N ATOM 302 C5 DC B 10 -0.149 7.564 5.745 1.00 0.00 C ATOM 303 C6 DC B 10 -1.208 7.263 6.507 1.00 0.00 C ATOM 0 H5' DC B 10 -3.746 5.515 10.936 1.00 0.00 H new ATOM 0 H5'' DC B 10 -2.426 6.377 10.171 1.00 0.00 H new ATOM 0 H4' DC B 10 -5.314 6.946 9.477 1.00 0.00 H new ATOM 0 H3' DC B 10 -4.155 4.349 9.010 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.223 5.519 7.904 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.203 4.852 6.612 1.00 0.00 H new ATOM 0 H1' DC B 10 -4.443 7.074 6.344 1.00 0.00 H new ATOM 0 H41 DC B 10 1.560 8.476 4.096 1.00 0.00 H new ATOM 0 H42 DC B 10 0.437 9.223 2.955 1.00 0.00 H new ATOM 0 H5 DC B 10 0.858 7.326 6.054 1.00 0.00 H new ATOM 0 H6 DC B 10 -1.035 6.776 7.455 1.00 0.00 H new ATOM 315 P DG B 11 -6.169 3.613 7.543 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.292 3.348 8.467 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.038 2.665 7.453 1.00 0.00 O ATOM 318 O5' DG B 11 -6.748 3.854 6.073 1.00 0.00 O ATOM 319 C5' DG B 11 -7.730 4.834 5.821 1.00 0.00 C ATOM 320 C4' DG B 11 -8.034 4.872 4.321 1.00 0.00 C ATOM 321 O4' DG B 11 -6.983 5.561 3.669 1.00 0.00 O ATOM 322 C3' DG B 11 -8.120 3.465 3.717 1.00 0.00 C ATOM 323 O3' DG B 11 -9.163 3.435 2.760 1.00 0.00 O ATOM 324 C2' DG B 11 -6.726 3.271 3.126 1.00 0.00 C ATOM 325 C1' DG B 11 -6.289 4.696 2.791 1.00 0.00 C ATOM 326 N9 DG B 11 -4.839 4.899 2.978 1.00 0.00 N ATOM 327 C8 DG B 11 -4.092 4.653 4.100 1.00 0.00 C ATOM 328 N7 DG B 11 -2.854 5.040 4.015 1.00 0.00 N ATOM 329 C5 DG B 11 -2.757 5.541 2.721 1.00 0.00 C ATOM 330 C6 DG B 11 -1.621 6.016 2.007 1.00 0.00 C ATOM 331 O6 DG B 11 -0.477 6.175 2.422 1.00 0.00 O ATOM 332 N1 DG B 11 -1.903 6.315 0.688 1.00 0.00 N ATOM 333 C2 DG B 11 -3.145 6.203 0.114 1.00 0.00 C ATOM 334 N2 DG B 11 -3.254 6.462 -1.183 1.00 0.00 N ATOM 335 N3 DG B 11 -4.223 5.758 0.772 1.00 0.00 N ATOM 336 C4 DG B 11 -3.960 5.438 2.068 1.00 0.00 C ATOM 0 H5' DG B 11 -7.381 5.810 6.158 1.00 0.00 H new ATOM 0 H5'' DG B 11 -8.637 4.609 6.382 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.995 5.367 4.185 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.362 2.663 4.415 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.049 2.799 3.838 1.00 0.00 H new ATOM 0 H2'' DG B 11 -6.749 2.638 2.239 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.512 4.895 1.743 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.498 4.178 4.981 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.136 6.641 0.100 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.161 6.389 -1.643 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.430 6.734 -1.720 1.00 0.00 H new ATOM 348 P DT B 12 -9.665 2.059 2.082 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.016 2.290 1.527 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.444 0.961 3.047 1.00 0.00 O ATOM 351 O5' DT B 12 -8.642 1.882 0.855 1.00 0.00 O ATOM 352 C5' DT B 12 -8.706 2.747 -0.258 1.00 0.00 C ATOM 353 C4' DT B 12 -7.527 2.517 -1.204 1.00 0.00 C ATOM 354 O4' DT B 12 -6.290 2.796 -0.590 1.00 0.00 O ATOM 355 C3' DT B 12 -7.393 1.066 -1.703 1.00 0.00 C ATOM 356 O3' DT B 12 -8.110 0.804 -2.907 1.00 0.00 O ATOM 357 C2' DT B 12 -5.877 0.822 -1.741 1.00 0.00 C ATOM 358 C1' DT B 12 -5.304 2.201 -1.413 1.00 0.00 C ATOM 359 N1 DT B 12 -4.015 2.191 -0.691 1.00 0.00 N ATOM 360 C2 DT B 12 -3.004 3.106 -0.933 1.00 0.00 C ATOM 361 O2 DT B 12 -2.941 3.768 -1.963 1.00 0.00 O ATOM 362 N3 DT B 12 -2.053 3.238 0.057 1.00 0.00 N ATOM 363 C4 DT B 12 -2.009 2.564 1.252 1.00 0.00 C ATOM 364 O4 DT B 12 -1.286 2.967 2.159 1.00 0.00 O ATOM 365 C5 DT B 12 -2.869 1.311 1.431 1.00 0.00 C ATOM 366 C7 DT B 12 -3.715 1.288 2.701 1.00 0.00 C ATOM 367 C6 DT B 12 -3.825 1.105 0.276 1.00 0.00 C ATOM 0 H5' DT B 12 -8.706 3.783 0.082 1.00 0.00 H new ATOM 0 H5'' DT B 12 -9.642 2.587 -0.793 1.00 0.00 H new ATOM 0 H4' DT B 12 -7.747 3.190 -2.033 1.00 0.00 H new ATOM 0 H3' DT B 12 -7.873 0.342 -1.044 1.00 0.00 H new ATOM 0 H2' DT B 12 -5.570 0.072 -1.012 1.00 0.00 H new ATOM 0 H2'' DT B 12 -5.548 0.469 -2.719 1.00 0.00 H new ATOM 0 H1' DT B 12 -5.088 2.731 -2.341 1.00 0.00 H new ATOM 0 H3 DT B 12 -1.303 3.907 -0.117 1.00 0.00 H new ATOM 0 H71 DT B 12 -4.624 0.714 2.522 1.00 0.00 H new ATOM 0 H72 DT B 12 -3.147 0.826 3.508 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.979 2.308 2.981 1.00 0.00 H new ATOM 0 H6 DT B 12 -4.359 0.173 0.166 1.00 0.00 H new ATOM 380 P DA B 13 -7.772 1.420 -4.379 1.00 0.00 P ATOM 381 OP1 DA B 13 -7.376 2.838 -4.251 1.00 0.00 O ATOM 382 OP2 DA B 13 -8.899 1.065 -5.267 1.00 0.00 O ATOM 383 O5' DA B 13 -6.484 0.596 -4.855 1.00 0.00 O ATOM 384 C5' DA B 13 -6.563 -0.792 -5.068 1.00 0.00 C ATOM 385 C4' DA B 13 -5.205 -1.303 -5.547 1.00 0.00 C ATOM 386 O4' DA B 13 -4.252 -1.356 -4.500 1.00 0.00 O ATOM 387 C3' DA B 13 -5.363 -2.730 -6.069 1.00 0.00 C ATOM 388 O3' DA B 13 -4.440 -3.013 -7.098 1.00 0.00 O ATOM 389 C2' DA B 13 -4.987 -3.491 -4.810 1.00 0.00 C ATOM 390 C1' DA B 13 -3.773 -2.681 -4.356 1.00 0.00 C ATOM 391 N9 DA B 13 -3.394 -2.934 -2.951 1.00 0.00 N ATOM 392 C8 DA B 13 -4.212 -2.846 -1.859 1.00 0.00 C ATOM 393 N7 DA B 13 -3.671 -3.285 -0.753 1.00 0.00 N ATOM 394 C5 DA B 13 -2.341 -3.501 -1.111 1.00 0.00 C ATOM 395 C6 DA B 13 -1.182 -3.798 -0.365 1.00 0.00 C ATOM 396 N6 DA B 13 -1.197 -4.146 0.920 1.00 0.00 N ATOM 397 N1 DA B 13 0.017 -3.618 -0.932 1.00 0.00 N ATOM 398 C2 DA B 13 0.070 -3.315 -2.221 1.00 0.00 C ATOM 399 N3 DA B 13 -0.937 -3.112 -3.069 1.00 0.00 N ATOM 400 C4 DA B 13 -2.139 -3.191 -2.433 1.00 0.00 C ATOM 0 H5' DA B 13 -7.331 -1.016 -5.808 1.00 0.00 H new ATOM 0 H5'' DA B 13 -6.851 -1.298 -4.147 1.00 0.00 H new ATOM 0 H4' DA B 13 -4.859 -0.613 -6.317 1.00 0.00 H new ATOM 0 H3' DA B 13 -6.339 -2.956 -6.498 1.00 0.00 H new ATOM 0 H2' DA B 13 -5.787 -3.491 -4.070 1.00 0.00 H new ATOM 0 H2'' DA B 13 -4.740 -4.533 -5.012 1.00 0.00 H new ATOM 0 H1' DA B 13 -2.874 -2.922 -4.923 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.215 -2.449 -1.906 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.322 -4.349 1.404 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.083 -4.210 1.421 1.00 0.00 H new ATOM 0 H2 DA B 13 1.061 -3.220 -2.639 1.00 0.00 H new ATOM 412 P DC B 14 -4.670 -2.516 -8.613 1.00 0.00 P ATOM 413 OP1 DC B 14 -4.579 -1.041 -8.645 1.00 0.00 O ATOM 414 OP2 DC B 14 -5.891 -3.180 -9.118 1.00 0.00 O ATOM 415 O5' DC B 14 -3.398 -3.127 -9.383 1.00 0.00 O ATOM 416 C5' DC B 14 -3.214 -4.522 -9.487 1.00 0.00 C ATOM 417 C4' DC B 14 -1.998 -4.973 -8.670 1.00 0.00 C ATOM 418 O4' DC B 14 -2.144 -4.768 -7.266 1.00 0.00 O ATOM 419 C3' DC B 14 -1.801 -6.480 -8.870 1.00 0.00 C ATOM 420 O3' DC B 14 -0.645 -6.731 -9.643 1.00 0.00 O ATOM 421 C2' DC B 14 -1.703 -6.972 -7.432 1.00 0.00 C ATOM 422 C1' DC B 14 -1.324 -5.739 -6.634 1.00 0.00 C ATOM 423 N1 DC B 14 -1.624 -5.982 -5.195 1.00 0.00 N ATOM 424 C2 DC B 14 -0.569 -6.173 -4.310 1.00 0.00 C ATOM 425 O2 DC B 14 0.602 -6.100 -4.670 1.00 0.00 O ATOM 426 N3 DC B 14 -0.837 -6.453 -3.006 1.00 0.00 N ATOM 427 C4 DC B 14 -2.093 -6.628 -2.590 1.00 0.00 C ATOM 428 N4 DC B 14 -2.314 -6.858 -1.303 1.00 0.00 N ATOM 429 C5 DC B 14 -3.194 -6.534 -3.491 1.00 0.00 C ATOM 430 C6 DC B 14 -2.903 -6.225 -4.773 1.00 0.00 C ATOM 0 H5' DC B 14 -3.078 -4.798 -10.533 1.00 0.00 H new ATOM 0 H5'' DC B 14 -4.107 -5.038 -9.134 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.157 -4.375 -9.022 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.592 -6.986 -9.424 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.650 -7.390 -7.090 1.00 0.00 H new ATOM 0 H2'' DC B 14 -0.953 -7.756 -7.331 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.275 -5.442 -6.628 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.267 -6.994 -0.966 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.531 -6.899 -0.650 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.210 -6.702 -3.165 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.708 -6.168 -5.491 1.00 0.00 H new ATOM 442 P DG B 15 -0.189 -8.233 -10.013 1.00 0.00 P ATOM 443 OP1 DG B 15 0.492 -8.194 -11.324 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.347 -9.132 -9.814 1.00 0.00 O ATOM 445 O5' DG B 15 0.898 -8.552 -8.864 1.00 0.00 O ATOM 446 C5' DG B 15 2.172 -7.951 -8.908 1.00 0.00 C ATOM 447 C4' DG B 15 3.220 -8.441 -7.895 1.00 0.00 C ATOM 448 O4' DG B 15 2.730 -8.113 -6.612 1.00 0.00 O ATOM 449 C3' DG B 15 3.546 -9.956 -7.907 1.00 0.00 C ATOM 450 O3' DG B 15 4.847 -10.133 -7.347 1.00 0.00 O ATOM 451 C2' DG B 15 2.409 -10.385 -6.997 1.00 0.00 C ATOM 452 C1' DG B 15 2.599 -9.327 -5.920 1.00 0.00 C ATOM 453 N9 DG B 15 1.506 -9.304 -4.960 1.00 0.00 N ATOM 454 C8 DG B 15 0.218 -9.641 -5.184 1.00 0.00 C ATOM 455 N7 DG B 15 -0.520 -9.677 -4.104 1.00 0.00 N ATOM 456 C5 DG B 15 0.388 -9.385 -3.075 1.00 0.00 C ATOM 457 C6 DG B 15 0.264 -9.408 -1.647 1.00 0.00 C ATOM 458 O6 DG B 15 -0.747 -9.526 -0.958 1.00 0.00 O ATOM 459 N1 DG B 15 1.490 -9.279 -1.001 1.00 0.00 N ATOM 460 C2 DG B 15 2.691 -9.123 -1.643 1.00 0.00 C ATOM 461 N2 DG B 15 3.811 -9.057 -0.942 1.00 0.00 N ATOM 462 N3 DG B 15 2.817 -9.074 -2.962 1.00 0.00 N ATOM 463 C4 DG B 15 1.637 -9.201 -3.609 1.00 0.00 C ATOM 0 H5' DG B 15 2.043 -6.878 -8.767 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.578 -8.095 -9.909 1.00 0.00 H new ATOM 0 H4' DG B 15 4.155 -7.954 -8.172 1.00 0.00 H new ATOM 0 H3' DG B 15 3.591 -10.496 -8.853 1.00 0.00 H new ATOM 0 H2' DG B 15 1.433 -10.332 -7.480 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.524 -11.402 -6.621 1.00 0.00 H new ATOM 0 H1' DG B 15 3.479 -9.536 -5.312 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.169 -9.861 -6.168 1.00 0.00 H new ATOM 0 H1 DG B 15 1.495 -9.302 0.019 1.00 0.00 H new ATOM 0 H21 DG B 15 4.705 -8.941 -1.419 1.00 0.00 H new ATOM 0 H22 DG B 15 3.780 -9.122 0.075 1.00 0.00 H new ATOM 475 P DC B 16 5.800 -11.428 -7.595 1.00 0.00 P ATOM 476 OP1 DC B 16 7.122 -11.112 -7.012 1.00 0.00 O ATOM 477 OP2 DC B 16 5.707 -11.778 -9.028 1.00 0.00 O ATOM 478 O5' DC B 16 5.178 -12.654 -6.739 1.00 0.00 O ATOM 479 C5' DC B 16 4.678 -12.478 -5.429 1.00 0.00 C ATOM 480 C4' DC B 16 5.677 -12.457 -4.270 1.00 0.00 C ATOM 481 O4' DC B 16 5.196 -11.498 -3.338 1.00 0.00 O ATOM 482 C3' DC B 16 5.769 -13.798 -3.527 1.00 0.00 C ATOM 483 O3' DC B 16 6.944 -14.503 -3.861 1.00 0.00 O ATOM 484 C2' DC B 16 5.768 -13.370 -2.067 1.00 0.00 C ATOM 485 C1' DC B 16 4.921 -12.096 -2.081 1.00 0.00 C ATOM 486 N1 DC B 16 3.465 -12.335 -1.820 1.00 0.00 N ATOM 487 C2 DC B 16 3.056 -12.574 -0.505 1.00 0.00 C ATOM 488 O2 DC B 16 3.863 -12.586 0.422 1.00 0.00 O ATOM 489 N3 DC B 16 1.735 -12.797 -0.241 1.00 0.00 N ATOM 490 C4 DC B 16 0.837 -12.776 -1.233 1.00 0.00 C ATOM 491 N4 DC B 16 -0.441 -12.988 -0.952 1.00 0.00 N ATOM 492 C5 DC B 16 1.205 -12.417 -2.564 1.00 0.00 C ATOM 493 C6 DC B 16 2.513 -12.191 -2.796 1.00 0.00 C ATOM 0 H5' DC B 16 3.961 -13.276 -5.236 1.00 0.00 H new ATOM 0 H5'' DC B 16 4.124 -11.540 -5.408 1.00 0.00 H new ATOM 0 H4' DC B 16 6.664 -12.232 -4.675 1.00 0.00 H new ATOM 0 H3' DC B 16 4.960 -14.484 -3.777 1.00 0.00 H new ATOM 0 H2' DC B 16 5.335 -14.135 -1.423 1.00 0.00 H new ATOM 0 H2'' DC B 16 6.777 -13.179 -1.702 1.00 0.00 H new ATOM 0 HO3' DC B 16 6.969 -15.350 -3.368 1.00 0.00 H new ATOM 0 H1' DC B 16 5.183 -11.429 -1.260 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.136 -12.975 -1.698 1.00 0.00 H new ATOM 0 H42 DC B 16 -0.729 -13.164 0.010 1.00 0.00 H new ATOM 0 H5 DC B 16 0.469 -12.330 -3.350 1.00 0.00 H new ATOM 0 H6 DC B 16 2.822 -11.886 -3.785 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO B 1 -1.054 0.113 -1.642 1.00 0.00 O HETATM 508 C2 PSO B 1 -2.309 0.055 -1.555 1.00 0.00 C HETATM 509 C3 PSO B 1 -3.063 -0.098 -0.244 1.00 0.00 C HETATM 510 C4 PSO B 1 -2.219 -0.013 0.982 1.00 0.00 C HETATM 511 C5 PSO B 1 -0.007 0.290 1.818 1.00 0.00 C HETATM 512 C6 PSO B 1 1.366 0.494 1.610 1.00 0.00 C HETATM 513 C7 PSO B 1 1.866 0.498 0.357 1.00 0.00 C HETATM 514 C8 PSO B 1 1.035 0.203 -0.732 1.00 0.00 C HETATM 515 C9 PSO B 1 -0.363 0.163 -0.573 1.00 0.00 C HETATM 516 C10 PSO B 1 -0.863 0.140 0.720 1.00 0.00 C HETATM 517 C4' PSO B 1 2.475 0.195 2.567 1.00 0.00 C HETATM 518 C5' PSO B 1 3.634 0.461 1.625 1.00 0.00 C HETATM 519 O6' PSO B 1 3.115 0.583 0.294 1.00 0.00 O HETATM 520 O11 PSO B 1 -2.955 0.127 -2.592 1.00 0.00 O HETATM 521 C12 PSO B 1 -2.500 -1.146 1.978 1.00 0.00 C HETATM 522 C13 PSO B 1 2.439 0.978 3.887 1.00 0.00 C HETATM 523 O14 PSO B 1 2.066 2.333 3.775 1.00 0.00 O HETATM 524 C15 PSO B 1 4.409 1.657 2.177 1.00 0.00 C HETATM 525 C16 PSO B 1 1.637 -0.086 -2.084 1.00 0.00 C HETATM 0 H163 PSO B 1 2.212 0.778 -2.418 1.00 0.00 H new HETATM 0 H162 PSO B 1 2.294 -0.953 -2.012 1.00 0.00 H new HETATM 0 H161 PSO B 1 0.841 -0.292 -2.800 1.00 0.00 H new HETATM 0 H153 PSO B 1 3.752 2.525 2.227 1.00 0.00 H new HETATM 0 H152 PSO B 1 4.776 1.423 3.176 1.00 0.00 H new HETATM 0 H151 PSO B 1 5.252 1.877 1.523 1.00 0.00 H new HETATM 0 H132 PSO B 1 1.745 0.482 4.565 1.00 0.00 H new HETATM 0 H131 PSO B 1 3.426 0.927 4.347 1.00 0.00 H new HETATM 0 H123 PSO B 1 -3.544 -1.106 2.290 1.00 0.00 H new HETATM 0 H122 PSO B 1 -2.300 -2.106 1.503 1.00 0.00 H new HETATM 0 H121 PSO B 1 -1.856 -1.032 2.850 1.00 0.00 H new HETATM 0 H5 PSO B 1 -0.406 0.248 2.832 1.00 0.00 H new HETATM 0 H14 PSO B 1 2.070 2.748 4.663 1.00 0.00 H new