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 USER MOD Single : A 4 DT C7 :methyl -30:sc= -1.74! (180deg=-3.17!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot -59:sc= 0.882 USER MOD Single : B 9 DG O5' : rot -28:sc= 0.0779 USER MOD Single : B 12 DT C7 :methyl 150:sc= -2.87! (180deg=-2.87!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -3.299 -12.204 10.783 1.00 0.00 O ATOM 2 C5' DG A 1 -2.716 -12.494 9.530 1.00 0.00 C ATOM 3 C4' DG A 1 -1.196 -12.294 9.596 1.00 0.00 C ATOM 4 O4' DG A 1 -0.523 -12.913 8.499 1.00 0.00 O ATOM 5 C3' DG A 1 -0.815 -10.831 9.563 1.00 0.00 C ATOM 6 O3' DG A 1 0.378 -10.641 10.301 1.00 0.00 O ATOM 7 C2' DG A 1 -0.673 -10.619 8.078 1.00 0.00 C ATOM 8 C1' DG A 1 -0.184 -11.939 7.513 1.00 0.00 C ATOM 9 N9 DG A 1 -0.845 -12.224 6.214 1.00 0.00 N ATOM 10 C8 DG A 1 -2.161 -12.552 6.008 1.00 0.00 C ATOM 11 N7 DG A 1 -2.504 -12.673 4.761 1.00 0.00 N ATOM 12 C5 DG A 1 -1.322 -12.433 4.075 1.00 0.00 C ATOM 13 C6 DG A 1 -1.071 -12.456 2.675 1.00 0.00 C ATOM 14 O6 DG A 1 -1.877 -12.641 1.767 1.00 0.00 O ATOM 15 N1 DG A 1 0.258 -12.239 2.364 1.00 0.00 N ATOM 16 C2 DG A 1 1.238 -11.989 3.293 1.00 0.00 C ATOM 17 N2 DG A 1 2.477 -11.825 2.839 1.00 0.00 N ATOM 18 N3 DG A 1 1.010 -11.927 4.616 1.00 0.00 N ATOM 19 C4 DG A 1 -0.291 -12.171 4.947 1.00 0.00 C ATOM 0 H5' DG A 1 -3.143 -11.847 8.763 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.943 -13.521 9.243 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.894 -12.751 10.538 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.513 -10.125 10.014 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.625 -10.332 7.632 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.034 -9.817 7.864 1.00 0.00 H new ATOM 0 HO5' DG A 1 -4.269 -12.333 10.730 1.00 0.00 H new ATOM 0 H1' DG A 1 0.887 -11.934 7.312 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.858 -12.698 6.820 1.00 0.00 H new ATOM 0 H1 DG A 1 0.528 -12.266 1.381 1.00 0.00 H new ATOM 0 H21 DG A 1 3.238 -11.637 3.491 1.00 0.00 H new ATOM 0 H22 DG A 1 2.666 -11.887 1.839 1.00 0.00 H new ATOM 32 P DC A 2 1.020 -9.185 10.554 1.00 0.00 P ATOM 33 OP1 DC A 2 1.695 -9.202 11.869 1.00 0.00 O ATOM 34 OP2 DC A 2 -0.007 -8.161 10.265 1.00 0.00 O ATOM 35 O5' DC A 2 2.141 -9.106 9.403 1.00 0.00 O ATOM 36 C5' DC A 2 3.158 -10.081 9.330 1.00 0.00 C ATOM 37 C4' DC A 2 4.250 -9.690 8.333 1.00 0.00 C ATOM 38 O4' DC A 2 3.832 -9.795 6.975 1.00 0.00 O ATOM 39 C3' DC A 2 4.731 -8.255 8.532 1.00 0.00 C ATOM 40 O3' DC A 2 6.128 -8.342 8.341 1.00 0.00 O ATOM 41 C2' DC A 2 3.927 -7.507 7.463 1.00 0.00 C ATOM 42 C1' DC A 2 3.797 -8.528 6.322 1.00 0.00 C ATOM 43 N1 DC A 2 2.496 -8.491 5.567 1.00 0.00 N ATOM 44 C2 DC A 2 2.489 -8.843 4.218 1.00 0.00 C ATOM 45 O2 DC A 2 3.537 -9.094 3.627 1.00 0.00 O ATOM 46 N3 DC A 2 1.305 -8.913 3.533 1.00 0.00 N ATOM 47 C4 DC A 2 0.150 -8.656 4.164 1.00 0.00 C ATOM 48 N4 DC A 2 -0.995 -8.828 3.511 1.00 0.00 N ATOM 49 C5 DC A 2 0.110 -8.318 5.548 1.00 0.00 C ATOM 50 C6 DC A 2 1.295 -8.277 6.198 1.00 0.00 C ATOM 0 H5' DC A 2 2.724 -11.037 9.037 1.00 0.00 H new ATOM 0 H5'' DC A 2 3.600 -10.220 10.317 1.00 0.00 H new ATOM 0 H4' DC A 2 5.054 -10.399 8.531 1.00 0.00 H new ATOM 0 H3' DC A 2 4.583 -7.747 9.485 1.00 0.00 H new ATOM 0 H2' DC A 2 2.951 -7.200 7.838 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.441 -6.604 7.135 1.00 0.00 H new ATOM 0 H1' DC A 2 4.583 -8.320 5.595 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.882 -8.637 3.977 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.987 -9.151 2.544 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.821 -8.105 6.053 1.00 0.00 H new ATOM 0 H6 DC A 2 1.297 -8.067 7.257 1.00 0.00 H new ATOM 62 P DG A 3 7.081 -7.062 8.298 1.00 0.00 P ATOM 63 OP1 DG A 3 8.453 -7.480 8.656 1.00 0.00 O ATOM 64 OP2 DG A 3 6.426 -5.950 9.020 1.00 0.00 O ATOM 65 O5' DG A 3 7.002 -6.779 6.725 1.00 0.00 O ATOM 66 C5' DG A 3 7.471 -7.730 5.791 1.00 0.00 C ATOM 67 C4' DG A 3 7.649 -7.084 4.418 1.00 0.00 C ATOM 68 O4' DG A 3 6.376 -7.039 3.816 1.00 0.00 O ATOM 69 C3' DG A 3 8.191 -5.655 4.552 1.00 0.00 C ATOM 70 O3' DG A 3 9.110 -5.374 3.515 1.00 0.00 O ATOM 71 C2' DG A 3 6.888 -4.865 4.477 1.00 0.00 C ATOM 72 C1' DG A 3 6.048 -5.703 3.530 1.00 0.00 C ATOM 73 N9 DG A 3 4.595 -5.531 3.708 1.00 0.00 N ATOM 74 C8 DG A 3 3.875 -5.208 4.829 1.00 0.00 C ATOM 75 N7 DG A 3 2.590 -5.384 4.702 1.00 0.00 N ATOM 76 C5 DG A 3 2.436 -5.774 3.373 1.00 0.00 C ATOM 77 C6 DG A 3 1.263 -6.018 2.593 1.00 0.00 C ATOM 78 O6 DG A 3 0.091 -6.038 2.964 1.00 0.00 O ATOM 79 N1 DG A 3 1.556 -6.253 1.260 1.00 0.00 N ATOM 80 C2 DG A 3 2.828 -6.300 0.735 1.00 0.00 C ATOM 81 N2 DG A 3 3.001 -6.517 -0.561 1.00 0.00 N ATOM 82 N3 DG A 3 3.929 -6.104 1.459 1.00 0.00 N ATOM 83 C4 DG A 3 3.661 -5.836 2.759 1.00 0.00 C ATOM 0 H5' DG A 3 6.767 -8.559 5.721 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.420 -8.145 6.130 1.00 0.00 H new ATOM 0 H4' DG A 3 8.359 -7.659 3.823 1.00 0.00 H new ATOM 0 H3' DG A 3 8.767 -5.433 5.451 1.00 0.00 H new ATOM 0 H2' DG A 3 6.418 -4.764 5.455 1.00 0.00 H new ATOM 0 H2'' DG A 3 7.046 -3.857 4.094 1.00 0.00 H new ATOM 0 H1' DG A 3 6.263 -5.398 2.506 1.00 0.00 H new ATOM 0 H8 DG A 3 4.332 -4.841 5.736 1.00 0.00 H new ATOM 0 H1 DG A 3 0.774 -6.402 0.622 1.00 0.00 H new ATOM 0 H21 DG A 3 3.943 -6.552 -0.951 1.00 0.00 H new ATOM 0 H22 DG A 3 2.192 -6.649 -1.168 1.00 0.00 H new ATOM 95 P DT A 4 10.018 -4.036 3.523 1.00 0.00 P ATOM 96 OP1 DT A 4 11.339 -4.374 2.952 1.00 0.00 O ATOM 97 OP2 DT A 4 9.931 -3.417 4.864 1.00 0.00 O ATOM 98 O5' DT A 4 9.231 -3.102 2.485 1.00 0.00 O ATOM 99 C5' DT A 4 9.296 -3.375 1.103 1.00 0.00 C ATOM 100 C4' DT A 4 8.037 -2.855 0.419 1.00 0.00 C ATOM 101 O4' DT A 4 6.865 -3.361 1.045 1.00 0.00 O ATOM 102 C3' DT A 4 7.844 -1.343 0.484 1.00 0.00 C ATOM 103 O3' DT A 4 8.691 -0.601 -0.368 1.00 0.00 O ATOM 104 C2' DT A 4 6.393 -1.355 0.002 1.00 0.00 C ATOM 105 C1' DT A 4 5.769 -2.668 0.471 1.00 0.00 C ATOM 106 N1 DT A 4 4.593 -2.559 1.386 1.00 0.00 N ATOM 107 C2 DT A 4 3.341 -3.037 1.018 1.00 0.00 C ATOM 108 O2 DT A 4 3.090 -3.458 -0.106 1.00 0.00 O ATOM 109 N3 DT A 4 2.358 -3.023 1.981 1.00 0.00 N ATOM 110 C4 DT A 4 2.418 -2.460 3.230 1.00 0.00 C ATOM 111 O4 DT A 4 1.548 -2.694 4.064 1.00 0.00 O ATOM 112 C5 DT A 4 3.583 -1.535 3.549 1.00 0.00 C ATOM 113 C7 DT A 4 4.139 -1.691 4.961 1.00 0.00 C ATOM 114 C6 DT A 4 4.702 -1.610 2.511 1.00 0.00 C ATOM 0 H5' DT A 4 9.395 -4.448 0.938 1.00 0.00 H new ATOM 0 H5'' DT A 4 10.178 -2.904 0.670 1.00 0.00 H new ATOM 0 H4' DT A 4 8.175 -3.180 -0.612 1.00 0.00 H new ATOM 0 H3' DT A 4 8.066 -0.871 1.441 1.00 0.00 H new ATOM 0 H2' DT A 4 5.846 -0.503 0.407 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.348 -1.275 -1.084 1.00 0.00 H new ATOM 0 H1' DT A 4 5.305 -3.191 -0.365 1.00 0.00 H new ATOM 0 H3 DT A 4 1.482 -3.486 1.737 1.00 0.00 H new ATOM 0 H71 DT A 4 3.341 -2.006 5.633 1.00 0.00 H new ATOM 0 H72 DT A 4 4.930 -2.441 4.960 1.00 0.00 H new ATOM 0 H73 DT A 4 4.544 -0.737 5.300 1.00 0.00 H new ATOM 0 H6 DT A 4 5.569 -0.972 2.600 1.00 0.00 H new ATOM 127 P DA A 5 8.605 1.014 -0.417 1.00 0.00 P ATOM 128 OP1 DA A 5 9.798 1.500 -1.142 1.00 0.00 O ATOM 129 OP2 DA A 5 8.343 1.507 0.952 1.00 0.00 O ATOM 130 O5' DA A 5 7.290 1.311 -1.322 1.00 0.00 O ATOM 131 C5' DA A 5 7.431 1.390 -2.724 1.00 0.00 C ATOM 132 C4' DA A 5 6.162 1.503 -3.579 1.00 0.00 C ATOM 133 O4' DA A 5 4.998 1.363 -2.770 1.00 0.00 O ATOM 134 C3' DA A 5 6.154 2.878 -4.236 1.00 0.00 C ATOM 135 O3' DA A 5 5.386 2.920 -5.419 1.00 0.00 O ATOM 136 C2' DA A 5 5.513 3.559 -3.055 1.00 0.00 C ATOM 137 C1' DA A 5 4.367 2.625 -2.696 1.00 0.00 C ATOM 138 N9 DA A 5 3.793 2.904 -1.361 1.00 0.00 N ATOM 139 C8 DA A 5 4.456 3.026 -0.172 1.00 0.00 C ATOM 140 N7 DA A 5 3.684 3.214 0.866 1.00 0.00 N ATOM 141 C5 DA A 5 2.405 3.226 0.310 1.00 0.00 C ATOM 142 C6 DA A 5 1.114 3.370 0.855 1.00 0.00 C ATOM 143 N6 DA A 5 0.924 3.485 2.165 1.00 0.00 N ATOM 144 N1 DA A 5 0.043 3.348 0.037 1.00 0.00 N ATOM 145 C2 DA A 5 0.254 3.185 -1.264 1.00 0.00 C ATOM 146 N3 DA A 5 1.409 3.044 -1.904 1.00 0.00 N ATOM 147 C4 DA A 5 2.462 3.066 -1.048 1.00 0.00 C ATOM 0 H5' DA A 5 7.976 0.505 -3.053 1.00 0.00 H new ATOM 0 H5'' DA A 5 8.059 2.252 -2.947 1.00 0.00 H new ATOM 0 H4' DA A 5 6.157 0.713 -4.330 1.00 0.00 H new ATOM 0 H3' DA A 5 7.095 3.288 -4.603 1.00 0.00 H new ATOM 0 H2' DA A 5 6.213 3.674 -2.228 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.155 4.556 -3.311 1.00 0.00 H new ATOM 0 H1' DA A 5 3.501 2.722 -3.351 1.00 0.00 H new ATOM 0 H8 DA A 5 5.532 2.971 -0.096 1.00 0.00 H new ATOM 0 H61 DA A 5 -0.020 3.588 2.536 1.00 0.00 H new ATOM 0 H62 DA A 5 1.723 3.470 2.799 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.631 3.164 -1.883 1.00 0.00 H new ATOM 159 P DC A 6 5.255 4.286 -6.283 1.00 0.00 P ATOM 160 OP1 DC A 6 5.290 3.926 -7.716 1.00 0.00 O ATOM 161 OP2 DC A 6 6.214 5.278 -5.749 1.00 0.00 O ATOM 162 O5' DC A 6 3.771 4.769 -5.901 1.00 0.00 O ATOM 163 C5' DC A 6 2.686 3.961 -6.283 1.00 0.00 C ATOM 164 C4' DC A 6 1.319 4.565 -5.981 1.00 0.00 C ATOM 165 O4' DC A 6 1.053 4.615 -4.574 1.00 0.00 O ATOM 166 C3' DC A 6 1.145 5.996 -6.518 1.00 0.00 C ATOM 167 O3' DC A 6 -0.120 6.108 -7.155 1.00 0.00 O ATOM 168 C2' DC A 6 1.205 6.836 -5.241 1.00 0.00 C ATOM 169 C1' DC A 6 0.668 5.927 -4.150 1.00 0.00 C ATOM 170 N1 DC A 6 1.153 6.249 -2.780 1.00 0.00 N ATOM 171 C2 DC A 6 0.215 6.472 -1.773 1.00 0.00 C ATOM 172 O2 DC A 6 -0.981 6.604 -2.008 1.00 0.00 O ATOM 173 N3 DC A 6 0.618 6.547 -0.482 1.00 0.00 N ATOM 174 C4 DC A 6 1.913 6.491 -0.177 1.00 0.00 C ATOM 175 N4 DC A 6 2.233 6.416 1.107 1.00 0.00 N ATOM 176 C5 DC A 6 2.913 6.348 -1.192 1.00 0.00 C ATOM 177 C6 DC A 6 2.484 6.232 -2.471 1.00 0.00 C ATOM 0 H5' DC A 6 2.766 3.000 -5.774 1.00 0.00 H new ATOM 0 H5'' DC A 6 2.755 3.762 -7.353 1.00 0.00 H new ATOM 0 H4' DC A 6 0.620 3.900 -6.489 1.00 0.00 H new ATOM 0 H3' DC A 6 1.886 6.300 -7.257 1.00 0.00 H new ATOM 0 H2' DC A 6 2.225 7.153 -5.024 1.00 0.00 H new ATOM 0 H2'' DC A 6 0.603 7.740 -5.334 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.411 6.042 -4.043 1.00 0.00 H new ATOM 0 H41 DC A 6 3.213 6.371 1.387 1.00 0.00 H new ATOM 0 H42 DC A 6 1.499 6.403 1.815 1.00 0.00 H new ATOM 0 H5 DC A 6 3.965 6.333 -0.948 1.00 0.00 H new ATOM 0 H6 DC A 6 3.209 6.124 -3.264 1.00 0.00 H new ATOM 189 P DG A 7 -0.639 7.494 -7.818 1.00 0.00 P ATOM 190 OP1 DG A 7 -1.558 7.149 -8.924 1.00 0.00 O ATOM 191 OP2 DG A 7 0.543 8.339 -8.090 1.00 0.00 O ATOM 192 O5' DG A 7 -1.500 8.208 -6.640 1.00 0.00 O ATOM 193 C5' DG A 7 -2.766 7.700 -6.270 1.00 0.00 C ATOM 194 C4' DG A 7 -3.564 8.589 -5.306 1.00 0.00 C ATOM 195 O4' DG A 7 -2.954 8.633 -4.030 1.00 0.00 O ATOM 196 C3' DG A 7 -3.706 10.034 -5.794 1.00 0.00 C ATOM 197 O3' DG A 7 -5.037 10.436 -5.509 1.00 0.00 O ATOM 198 C2' DG A 7 -2.628 10.740 -4.987 1.00 0.00 C ATOM 199 C1' DG A 7 -2.680 9.977 -3.673 1.00 0.00 C ATOM 200 N9 DG A 7 -1.460 9.967 -2.847 1.00 0.00 N ATOM 201 C8 DG A 7 -0.153 9.869 -3.237 1.00 0.00 C ATOM 202 N7 DG A 7 0.685 9.686 -2.254 1.00 0.00 N ATOM 203 C5 DG A 7 -0.130 9.662 -1.120 1.00 0.00 C ATOM 204 C6 DG A 7 0.186 9.509 0.266 1.00 0.00 C ATOM 205 O6 DG A 7 1.291 9.383 0.784 1.00 0.00 O ATOM 206 N1 DG A 7 -0.936 9.510 1.082 1.00 0.00 N ATOM 207 C2 DG A 7 -2.217 9.686 0.626 1.00 0.00 C ATOM 208 N2 DG A 7 -3.206 9.686 1.511 1.00 0.00 N ATOM 209 N3 DG A 7 -2.525 9.859 -0.662 1.00 0.00 N ATOM 210 C4 DG A 7 -1.443 9.824 -1.481 1.00 0.00 C ATOM 0 H5' DG A 7 -2.628 6.722 -5.809 1.00 0.00 H new ATOM 0 H5'' DG A 7 -3.357 7.546 -7.173 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.553 8.133 -5.254 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.568 10.232 -6.857 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.649 10.671 -5.462 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.844 11.800 -4.854 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.424 10.481 -3.055 1.00 0.00 H new ATOM 0 H8 DG A 7 0.158 9.937 -4.269 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.799 9.371 2.083 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.169 9.815 1.200 1.00 0.00 H new ATOM 0 H22 DG A 7 -3.003 9.557 2.502 1.00 0.00 H new ATOM 222 P DC A 8 -5.630 11.873 -5.927 1.00 0.00 P ATOM 223 OP1 DC A 8 -7.080 11.720 -6.172 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.760 12.439 -6.980 1.00 0.00 O ATOM 225 O5' DC A 8 -5.421 12.734 -4.586 1.00 0.00 O ATOM 226 C5' DC A 8 -6.336 12.675 -3.507 1.00 0.00 C ATOM 227 C4' DC A 8 -5.770 13.436 -2.299 1.00 0.00 C ATOM 228 O4' DC A 8 -4.662 12.708 -1.776 1.00 0.00 O ATOM 229 C3' DC A 8 -5.252 14.838 -2.684 1.00 0.00 C ATOM 230 O3' DC A 8 -5.541 15.801 -1.690 1.00 0.00 O ATOM 231 C2' DC A 8 -3.756 14.571 -2.762 1.00 0.00 C ATOM 232 C1' DC A 8 -3.627 13.641 -1.554 1.00 0.00 C ATOM 233 N1 DC A 8 -2.283 13.074 -1.318 1.00 0.00 N ATOM 234 C2 DC A 8 -1.843 12.864 -0.011 1.00 0.00 C ATOM 235 O2 DC A 8 -2.631 12.836 0.931 1.00 0.00 O ATOM 236 N3 DC A 8 -0.508 12.685 0.224 1.00 0.00 N ATOM 237 C4 DC A 8 0.370 12.773 -0.785 1.00 0.00 C ATOM 238 N4 DC A 8 1.655 12.560 -0.539 1.00 0.00 N ATOM 239 C5 DC A 8 -0.067 13.018 -2.123 1.00 0.00 C ATOM 240 C6 DC A 8 -1.384 13.134 -2.324 1.00 0.00 C ATOM 0 H5' DC A 8 -6.526 11.636 -3.237 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.291 13.107 -3.805 1.00 0.00 H new ATOM 0 H4' DC A 8 -6.577 13.542 -1.574 1.00 0.00 H new ATOM 0 H3' DC A 8 -5.698 15.244 -3.592 1.00 0.00 H new ATOM 0 H2' DC A 8 -3.460 14.094 -3.696 1.00 0.00 H new ATOM 0 H2'' DC A 8 -3.159 15.478 -2.663 1.00 0.00 H new ATOM 0 HO3' DC A 8 -5.196 16.674 -1.970 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.737 14.167 -0.606 1.00 0.00 H new ATOM 0 H41 DC A 8 2.336 12.623 -1.295 1.00 0.00 H new ATOM 0 H42 DC A 8 1.962 12.333 0.407 1.00 0.00 H new ATOM 0 H5 DC A 8 0.637 13.106 -2.938 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.743 13.282 -3.332 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.066 13.024 8.956 1.00 0.00 O ATOM 255 C5' DG B 9 3.605 11.859 9.605 1.00 0.00 C ATOM 256 C4' DG B 9 2.092 11.964 9.816 1.00 0.00 C ATOM 257 O4' DG B 9 1.415 12.386 8.638 1.00 0.00 O ATOM 258 C3' DG B 9 1.484 10.634 10.208 1.00 0.00 C ATOM 259 O3' DG B 9 0.412 10.877 11.106 1.00 0.00 O ATOM 260 C2' DG B 9 1.048 10.055 8.866 1.00 0.00 C ATOM 261 C1' DG B 9 0.882 11.263 7.946 1.00 0.00 C ATOM 262 N9 DG B 9 1.509 11.156 6.601 1.00 0.00 N ATOM 263 C8 DG B 9 2.819 10.906 6.260 1.00 0.00 C ATOM 264 N7 DG B 9 3.084 11.052 4.994 1.00 0.00 N ATOM 265 C5 DG B 9 1.868 11.429 4.441 1.00 0.00 C ATOM 266 C6 DG B 9 1.535 11.769 3.096 1.00 0.00 C ATOM 267 O6 DG B 9 2.285 11.840 2.127 1.00 0.00 O ATOM 268 N1 DG B 9 0.188 12.042 2.925 1.00 0.00 N ATOM 269 C2 DG B 9 -0.731 12.032 3.945 1.00 0.00 C ATOM 270 N2 DG B 9 -2.002 12.277 3.645 1.00 0.00 N ATOM 271 N3 DG B 9 -0.424 11.764 5.221 1.00 0.00 N ATOM 272 C4 DG B 9 0.893 11.470 5.406 1.00 0.00 C ATOM 0 H5' DG B 9 4.110 11.738 10.563 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.840 10.978 9.007 1.00 0.00 H new ATOM 0 H4' DG B 9 1.967 12.697 10.613 1.00 0.00 H new ATOM 0 H3' DG B 9 2.144 9.942 10.731 1.00 0.00 H new ATOM 0 H2' DG B 9 1.793 9.361 8.475 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.114 9.500 8.961 1.00 0.00 H new ATOM 0 HO5' DG B 9 3.347 13.397 8.404 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.183 11.349 7.729 1.00 0.00 H new ATOM 0 H8 DG B 9 3.565 10.613 6.983 1.00 0.00 H new ATOM 0 H1 DG B 9 -0.141 12.264 1.985 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.709 12.277 4.380 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.271 12.465 2.679 1.00 0.00 H new ATOM 285 P DC B 10 -0.416 9.691 11.825 1.00 0.00 P ATOM 286 OP1 DC B 10 -1.054 10.247 13.038 1.00 0.00 O ATOM 287 OP2 DC B 10 0.467 8.510 11.932 1.00 0.00 O ATOM 288 O5' DC B 10 -1.561 9.376 10.741 1.00 0.00 O ATOM 289 C5' DC B 10 -2.537 10.348 10.426 1.00 0.00 C ATOM 290 C4' DC B 10 -3.219 10.005 9.100 1.00 0.00 C ATOM 291 O4' DC B 10 -2.291 10.048 8.028 1.00 0.00 O ATOM 292 C3' DC B 10 -3.852 8.606 9.082 1.00 0.00 C ATOM 293 O3' DC B 10 -5.224 8.786 8.787 1.00 0.00 O ATOM 294 C2' DC B 10 -3.055 7.903 7.972 1.00 0.00 C ATOM 295 C1' DC B 10 -2.676 9.071 7.084 1.00 0.00 C ATOM 296 N1 DC B 10 -1.610 8.773 6.090 1.00 0.00 N ATOM 297 C2 DC B 10 -1.819 9.028 4.736 1.00 0.00 C ATOM 298 O2 DC B 10 -2.918 9.392 4.320 1.00 0.00 O ATOM 299 N3 DC B 10 -0.787 8.872 3.851 1.00 0.00 N ATOM 300 C4 DC B 10 0.390 8.398 4.282 1.00 0.00 C ATOM 301 N4 DC B 10 1.423 8.394 3.447 1.00 0.00 N ATOM 302 C5 DC B 10 0.608 8.068 5.655 1.00 0.00 C ATOM 303 C6 DC B 10 -0.411 8.284 6.509 1.00 0.00 C ATOM 0 H5' DC B 10 -2.072 11.332 10.360 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.280 10.399 11.222 1.00 0.00 H new ATOM 0 H4' DC B 10 -4.003 10.754 8.987 1.00 0.00 H new ATOM 0 H3' DC B 10 -3.813 8.024 10.003 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.180 7.384 8.362 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.655 7.163 7.442 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.495 9.380 6.434 1.00 0.00 H new ATOM 0 H41 DC B 10 2.327 8.037 3.756 1.00 0.00 H new ATOM 0 H42 DC B 10 1.312 8.748 2.497 1.00 0.00 H new ATOM 0 H5 DC B 10 1.550 7.663 5.994 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.273 8.063 7.557 1.00 0.00 H new ATOM 315 P DG B 11 -6.234 7.553 8.594 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.581 7.984 9.025 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.622 6.346 9.190 1.00 0.00 O ATOM 318 O5' DG B 11 -6.230 7.384 6.992 1.00 0.00 O ATOM 319 C5' DG B 11 -6.768 8.379 6.141 1.00 0.00 C ATOM 320 C4' DG B 11 -7.384 7.756 4.877 1.00 0.00 C ATOM 321 O4' DG B 11 -6.387 7.583 3.891 1.00 0.00 O ATOM 322 C3' DG B 11 -8.009 6.380 5.129 1.00 0.00 C ATOM 323 O3' DG B 11 -9.137 6.239 4.285 1.00 0.00 O ATOM 324 C2' DG B 11 -6.847 5.449 4.803 1.00 0.00 C ATOM 325 C1' DG B 11 -6.119 6.209 3.695 1.00 0.00 C ATOM 326 N9 DG B 11 -4.656 6.041 3.715 1.00 0.00 N ATOM 327 C8 DG B 11 -3.839 5.794 4.780 1.00 0.00 C ATOM 328 N7 DG B 11 -2.566 5.861 4.512 1.00 0.00 N ATOM 329 C5 DG B 11 -2.537 6.145 3.147 1.00 0.00 C ATOM 330 C6 DG B 11 -1.441 6.236 2.238 1.00 0.00 C ATOM 331 O6 DG B 11 -0.242 6.138 2.485 1.00 0.00 O ATOM 332 N1 DG B 11 -1.846 6.461 0.933 1.00 0.00 N ATOM 333 C2 DG B 11 -3.158 6.572 0.534 1.00 0.00 C ATOM 334 N2 DG B 11 -3.431 6.766 -0.749 1.00 0.00 N ATOM 335 N3 DG B 11 -4.193 6.453 1.367 1.00 0.00 N ATOM 336 C4 DG B 11 -3.814 6.247 2.654 1.00 0.00 C ATOM 0 H5' DG B 11 -5.984 9.082 5.858 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.528 8.947 6.677 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.165 8.444 4.554 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.393 6.187 6.131 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.206 5.280 5.669 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.192 4.471 4.466 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.475 5.817 2.742 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.217 5.562 5.765 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.123 6.550 0.219 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.400 6.850 -1.057 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.672 6.831 -1.428 1.00 0.00 H new ATOM 348 P DT B 12 -10.065 4.926 4.314 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.413 5.300 3.834 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.904 4.277 5.633 1.00 0.00 O ATOM 351 O5' DT B 12 -9.352 4.006 3.205 1.00 0.00 O ATOM 352 C5' DT B 12 -9.689 4.122 1.840 1.00 0.00 C ATOM 353 C4' DT B 12 -8.739 3.289 0.978 1.00 0.00 C ATOM 354 O4' DT B 12 -7.506 3.938 0.720 1.00 0.00 O ATOM 355 C3' DT B 12 -8.428 1.900 1.528 1.00 0.00 C ATOM 356 O3' DT B 12 -9.418 0.942 1.194 1.00 0.00 O ATOM 357 C2' DT B 12 -7.151 1.662 0.733 1.00 0.00 C ATOM 358 C1' DT B 12 -6.622 2.979 0.150 1.00 0.00 C ATOM 359 N1 DT B 12 -5.281 3.183 0.700 1.00 0.00 N ATOM 360 C2 DT B 12 -4.113 3.422 -0.026 1.00 0.00 C ATOM 361 O2 DT B 12 -4.108 3.628 -1.236 1.00 0.00 O ATOM 362 N3 DT B 12 -2.934 3.412 0.724 1.00 0.00 N ATOM 363 C4 DT B 12 -2.855 3.190 2.091 1.00 0.00 C ATOM 364 O4 DT B 12 -1.783 3.238 2.676 1.00 0.00 O ATOM 365 C5 DT B 12 -4.128 2.906 2.718 1.00 0.00 C ATOM 366 C7 DT B 12 -4.321 2.547 4.148 1.00 0.00 C ATOM 367 C6 DT B 12 -5.250 2.920 2.011 1.00 0.00 C ATOM 0 H5' DT B 12 -9.642 5.168 1.536 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.716 3.790 1.684 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.304 3.174 0.053 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.366 1.824 2.614 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.394 1.213 1.377 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.345 0.954 -0.073 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.575 3.022 -0.938 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.060 3.582 0.226 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.299 2.895 4.482 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.262 1.465 4.263 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.544 3.018 4.750 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.181 2.710 2.517 1.00 0.00 H new ATOM 380 P DA B 13 -9.191 -0.636 1.490 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.329 -1.377 0.906 1.00 0.00 O ATOM 382 OP2 DA B 13 -8.873 -0.782 2.926 1.00 0.00 O ATOM 383 O5' DA B 13 -7.858 -0.983 0.640 1.00 0.00 O ATOM 384 C5' DA B 13 -7.842 -0.877 -0.772 1.00 0.00 C ATOM 385 C4' DA B 13 -6.428 -0.640 -1.368 1.00 0.00 C ATOM 386 O4' DA B 13 -5.328 -0.860 -0.522 1.00 0.00 O ATOM 387 C3' DA B 13 -6.339 -1.662 -2.498 1.00 0.00 C ATOM 388 O3' DA B 13 -5.602 -1.181 -3.602 1.00 0.00 O ATOM 389 C2' DA B 13 -5.630 -2.772 -1.700 1.00 0.00 C ATOM 390 C1' DA B 13 -4.565 -1.945 -1.004 1.00 0.00 C ATOM 391 N9 DA B 13 -4.022 -2.547 0.215 1.00 0.00 N ATOM 392 C8 DA B 13 -4.649 -2.585 1.429 1.00 0.00 C ATOM 393 N7 DA B 13 -3.877 -2.918 2.427 1.00 0.00 N ATOM 394 C5 DA B 13 -2.633 -3.067 1.818 1.00 0.00 C ATOM 395 C6 DA B 13 -1.344 -3.321 2.314 1.00 0.00 C ATOM 396 N6 DA B 13 -1.102 -3.493 3.611 1.00 0.00 N ATOM 397 N1 DA B 13 -0.309 -3.310 1.461 1.00 0.00 N ATOM 398 C2 DA B 13 -0.528 -3.059 0.177 1.00 0.00 C ATOM 399 N3 DA B 13 -1.683 -2.807 -0.417 1.00 0.00 N ATOM 400 C4 DA B 13 -2.706 -2.821 0.473 1.00 0.00 C ATOM 0 H5' DA B 13 -8.495 -0.057 -1.073 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.258 -1.789 -1.200 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.353 0.415 -1.633 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.272 -1.954 -2.979 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.296 -3.273 -0.997 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.206 -3.544 -2.343 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.734 -1.766 -1.686 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.698 -2.358 1.552 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.151 -3.676 3.933 1.00 0.00 H new ATOM 0 H62 DA B 13 -1.867 -3.442 4.284 1.00 0.00 H new ATOM 0 H2 DA B 13 0.343 -3.061 -0.462 1.00 0.00 H new ATOM 412 P DC B 14 -5.518 -2.034 -4.969 1.00 0.00 P ATOM 413 OP1 DC B 14 -5.337 -1.085 -6.088 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.653 -2.983 -4.993 1.00 0.00 O ATOM 415 O5' DC B 14 -4.165 -2.883 -4.783 1.00 0.00 O ATOM 416 C5' DC B 14 -2.920 -2.269 -5.026 1.00 0.00 C ATOM 417 C4' DC B 14 -1.741 -3.223 -4.833 1.00 0.00 C ATOM 418 O4' DC B 14 -1.571 -3.542 -3.445 1.00 0.00 O ATOM 419 C3' DC B 14 -1.895 -4.564 -5.572 1.00 0.00 C ATOM 420 O3' DC B 14 -0.866 -4.693 -6.544 1.00 0.00 O ATOM 421 C2' DC B 14 -1.792 -5.609 -4.464 1.00 0.00 C ATOM 422 C1' DC B 14 -1.180 -4.906 -3.266 1.00 0.00 C ATOM 423 N1 DC B 14 -1.650 -5.525 -2.003 1.00 0.00 N ATOM 424 C2 DC B 14 -0.716 -6.043 -1.118 1.00 0.00 C ATOM 425 O2 DC B 14 0.441 -6.276 -1.448 1.00 0.00 O ATOM 426 N3 DC B 14 -1.080 -6.302 0.159 1.00 0.00 N ATOM 427 C4 DC B 14 -2.350 -6.156 0.535 1.00 0.00 C ATOM 428 N4 DC B 14 -2.583 -6.256 1.838 1.00 0.00 N ATOM 429 C5 DC B 14 -3.376 -5.778 -0.401 1.00 0.00 C ATOM 430 C6 DC B 14 -2.965 -5.497 -1.660 1.00 0.00 C ATOM 0 H5' DC B 14 -2.804 -1.416 -4.358 1.00 0.00 H new ATOM 0 H5'' DC B 14 -2.904 -1.881 -6.044 1.00 0.00 H new ATOM 0 H4' DC B 14 -0.885 -2.688 -5.244 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.831 -4.665 -6.121 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.774 -6.012 -4.218 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.173 -6.449 -4.779 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.095 -4.986 -3.197 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.533 -6.155 2.195 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.812 -6.434 2.482 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.416 -5.722 -0.115 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.700 -5.244 -2.410 1.00 0.00 H new ATOM 442 P DG B 15 -0.680 -6.021 -7.458 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.078 -5.604 -8.742 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.961 -6.761 -7.457 1.00 0.00 O ATOM 445 O5' DG B 15 0.412 -6.902 -6.643 1.00 0.00 O ATOM 446 C5' DG B 15 1.745 -6.446 -6.528 1.00 0.00 C ATOM 447 C4' DG B 15 2.684 -7.413 -5.795 1.00 0.00 C ATOM 448 O4' DG B 15 2.251 -7.628 -4.465 1.00 0.00 O ATOM 449 C3' DG B 15 2.794 -8.784 -6.470 1.00 0.00 C ATOM 450 O3' DG B 15 4.168 -9.141 -6.442 1.00 0.00 O ATOM 451 C2' DG B 15 1.882 -9.634 -5.602 1.00 0.00 C ATOM 452 C1' DG B 15 2.103 -9.018 -4.228 1.00 0.00 C ATOM 453 N9 DG B 15 1.006 -9.188 -3.254 1.00 0.00 N ATOM 454 C8 DG B 15 -0.342 -9.041 -3.444 1.00 0.00 C ATOM 455 N7 DG B 15 -1.045 -9.089 -2.345 1.00 0.00 N ATOM 456 C5 DG B 15 -0.088 -9.257 -1.343 1.00 0.00 C ATOM 457 C6 DG B 15 -0.217 -9.346 0.079 1.00 0.00 C ATOM 458 O6 DG B 15 -1.245 -9.400 0.748 1.00 0.00 O ATOM 459 N1 DG B 15 1.009 -9.370 0.732 1.00 0.00 N ATOM 460 C2 DG B 15 2.219 -9.425 0.090 1.00 0.00 C ATOM 461 N2 DG B 15 3.319 -9.501 0.828 1.00 0.00 N ATOM 462 N3 DG B 15 2.351 -9.411 -1.240 1.00 0.00 N ATOM 463 C4 DG B 15 1.168 -9.294 -1.894 1.00 0.00 C ATOM 0 H5' DG B 15 1.745 -5.491 -6.003 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.141 -6.261 -7.527 1.00 0.00 H new ATOM 0 H4' DG B 15 3.662 -6.932 -5.820 1.00 0.00 H new ATOM 0 H3' DG B 15 2.495 -8.869 -7.515 1.00 0.00 H new ATOM 0 H2' DG B 15 0.840 -9.570 -5.917 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.158 -10.688 -5.627 1.00 0.00 H new ATOM 0 H1' DG B 15 2.959 -9.521 -3.779 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.785 -8.898 -4.418 1.00 0.00 H new ATOM 0 H1 DG B 15 1.009 -9.345 1.752 1.00 0.00 H new ATOM 0 H21 DG B 15 4.233 -9.543 0.378 1.00 0.00 H new ATOM 0 H22 DG B 15 3.250 -9.517 1.846 1.00 0.00 H new ATOM 475 P DC B 16 4.737 -10.514 -7.060 1.00 0.00 P ATOM 476 OP1 DC B 16 6.118 -10.271 -7.528 1.00 0.00 O ATOM 477 OP2 DC B 16 3.725 -11.050 -7.995 1.00 0.00 O ATOM 478 O5' DC B 16 4.789 -11.471 -5.769 1.00 0.00 O ATOM 479 C5' DC B 16 5.841 -11.400 -4.825 1.00 0.00 C ATOM 480 C4' DC B 16 5.522 -12.296 -3.619 1.00 0.00 C ATOM 481 O4' DC B 16 4.422 -11.734 -2.909 1.00 0.00 O ATOM 482 C3' DC B 16 5.111 -13.720 -4.048 1.00 0.00 C ATOM 483 O3' DC B 16 5.657 -14.703 -3.193 1.00 0.00 O ATOM 484 C2' DC B 16 3.598 -13.633 -3.907 1.00 0.00 C ATOM 485 C1' DC B 16 3.542 -12.797 -2.624 1.00 0.00 C ATOM 486 N1 DC B 16 2.188 -12.420 -2.174 1.00 0.00 N ATOM 487 C2 DC B 16 1.854 -12.456 -0.819 1.00 0.00 C ATOM 488 O2 DC B 16 2.711 -12.497 0.062 1.00 0.00 O ATOM 489 N3 DC B 16 0.535 -12.443 -0.464 1.00 0.00 N ATOM 490 C4 DC B 16 -0.420 -12.452 -1.404 1.00 0.00 C ATOM 491 N4 DC B 16 -1.690 -12.414 -1.029 1.00 0.00 N ATOM 492 C5 DC B 16 -0.086 -12.434 -2.792 1.00 0.00 C ATOM 493 C6 DC B 16 1.212 -12.394 -3.103 1.00 0.00 C ATOM 0 H5' DC B 16 5.978 -10.370 -4.497 1.00 0.00 H new ATOM 0 H5'' DC B 16 6.777 -11.715 -5.286 1.00 0.00 H new ATOM 0 H4' DC B 16 6.422 -12.356 -3.007 1.00 0.00 H new ATOM 0 H3' DC B 16 5.458 -14.009 -5.040 1.00 0.00 H new ATOM 0 H2' DC B 16 3.121 -13.141 -4.755 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.126 -14.609 -3.798 1.00 0.00 H new ATOM 0 HO3' DC B 16 5.374 -15.592 -3.494 1.00 0.00 H new ATOM 0 H1' DC B 16 3.850 -13.356 -1.740 1.00 0.00 H new ATOM 0 H41 DC B 16 -2.430 -12.420 -1.731 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.928 -12.379 -0.038 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.849 -12.452 -3.556 1.00 0.00 H new ATOM 0 H6 DC B 16 1.492 -12.338 -4.145 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.733 0.268 -0.626 1.00 0.00 O HETATM 508 C2 PSO A 9 -1.977 0.394 -0.336 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.477 0.340 0.975 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.572 0.157 2.013 1.00 0.00 C HETATM 511 C5 PSO A 9 0.782 0.137 2.680 1.00 0.00 C HETATM 512 C6 PSO A 9 2.128 0.140 2.297 1.00 0.00 C HETATM 513 C7 PSO A 9 2.483 0.071 0.998 1.00 0.00 C HETATM 514 C8 PSO A 9 1.496 0.042 -0.011 1.00 0.00 C HETATM 515 C9 PSO A 9 0.126 0.170 0.334 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.214 0.160 1.682 1.00 0.00 C HETATM 517 C4' PSO A 9 3.314 -0.060 3.192 1.00 0.00 C HETATM 518 C5' PSO A 9 4.365 -0.174 2.113 1.00 0.00 C HETATM 519 O6' PSO A 9 3.724 -0.004 0.820 1.00 0.00 O HETATM 520 O11 PSO A 9 -2.773 0.572 -1.255 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.036 -0.037 3.436 1.00 0.00 C HETATM 522 C13 PSO A 9 3.478 1.056 4.241 1.00 0.00 C HETATM 523 O14 PSO A 9 2.878 2.262 3.812 1.00 0.00 O HETATM 524 C15 PSO A 9 5.551 0.671 2.486 1.00 0.00 C HETATM 525 C16 PSO A 9 1.894 -0.133 -1.465 1.00 0.00 C HETATM 0 H163 PSO A 9 2.548 0.686 -1.764 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.419 -1.080 -1.587 1.00 0.00 H new HETATM 0 H161 PSO A 9 1.001 -0.130 -2.090 1.00 0.00 H new HETATM 0 H153 PSO A 9 5.240 1.711 2.585 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.962 0.324 3.434 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.312 0.592 1.710 1.00 0.00 H new HETATM 0 H132 PSO A 9 3.030 0.740 5.183 1.00 0.00 H new HETATM 0 H131 PSO A 9 4.538 1.224 4.433 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.607 0.835 3.755 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.666 -0.925 3.496 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.171 -0.162 4.087 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.507 0.117 3.735 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.544 0.439 1.173 1.00 0.00 H new HETATM 0 H14 PSO A 9 3.288 2.550 2.969 1.00 0.00 H new