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= -0.0117 USER MOD Single : A 4 DT C7 :methyl -30:sc= -1.57! (180deg=-4.32!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot 180:sc= 0.346 USER MOD Single : B 9 DG O5' : rot -29:sc= 0.0819 USER MOD Single : B 12 DT C7 :methyl 150:sc= -3.77! (180deg=-3.77!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -3.306 -11.875 8.797 1.00 0.00 O ATOM 2 C5' DG A 1 -2.542 -12.714 9.637 1.00 0.00 C ATOM 3 C4' DG A 1 -1.036 -12.412 9.574 1.00 0.00 C ATOM 4 O4' DG A 1 -0.399 -12.999 8.436 1.00 0.00 O ATOM 5 C3' DG A 1 -0.711 -10.934 9.548 1.00 0.00 C ATOM 6 O3' DG A 1 0.468 -10.705 10.299 1.00 0.00 O ATOM 7 C2' DG A 1 -0.561 -10.697 8.067 1.00 0.00 C ATOM 8 C1' DG A 1 -0.037 -11.996 7.488 1.00 0.00 C ATOM 9 N9 DG A 1 -0.650 -12.272 6.164 1.00 0.00 N ATOM 10 C8 DG A 1 -1.942 -12.661 5.922 1.00 0.00 C ATOM 11 N7 DG A 1 -2.247 -12.796 4.667 1.00 0.00 N ATOM 12 C5 DG A 1 -1.060 -12.499 4.013 1.00 0.00 C ATOM 13 C6 DG A 1 -0.772 -12.516 2.620 1.00 0.00 C ATOM 14 O6 DG A 1 -1.545 -12.744 1.694 1.00 0.00 O ATOM 15 N1 DG A 1 0.552 -12.235 2.342 1.00 0.00 N ATOM 16 C2 DG A 1 1.494 -11.938 3.295 1.00 0.00 C ATOM 17 N2 DG A 1 2.733 -11.705 2.869 1.00 0.00 N ATOM 18 N3 DG A 1 1.231 -11.885 4.612 1.00 0.00 N ATOM 19 C4 DG A 1 -0.065 -12.189 4.912 1.00 0.00 C ATOM 0 H5' DG A 1 -2.711 -13.753 9.355 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.887 -12.602 10.665 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.655 -12.853 10.495 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.444 -10.261 9.993 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.516 -10.426 7.616 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.129 -9.876 7.871 1.00 0.00 H new ATOM 0 HO5' DG A 1 -4.254 -12.111 8.874 1.00 0.00 H new ATOM 0 H1' DG A 1 1.040 -11.962 7.323 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.652 -12.842 6.715 1.00 0.00 H new ATOM 0 H1 DG A 1 0.848 -12.249 1.366 1.00 0.00 H new ATOM 0 H21 DG A 1 3.469 -11.480 3.539 1.00 0.00 H new ATOM 0 H22 DG A 1 2.947 -11.751 1.873 1.00 0.00 H new ATOM 32 P DC A 2 1.058 -9.230 10.567 1.00 0.00 P ATOM 33 OP1 DC A 2 1.713 -9.232 11.893 1.00 0.00 O ATOM 34 OP2 DC A 2 0.002 -8.238 10.269 1.00 0.00 O ATOM 35 O5' DC A 2 2.201 -9.114 9.442 1.00 0.00 O ATOM 36 C5' DC A 2 3.246 -10.058 9.387 1.00 0.00 C ATOM 37 C4' DC A 2 4.332 -9.654 8.387 1.00 0.00 C ATOM 38 O4' DC A 2 3.909 -9.749 7.029 1.00 0.00 O ATOM 39 C3' DC A 2 4.810 -8.218 8.582 1.00 0.00 C ATOM 40 O3' DC A 2 6.196 -8.300 8.324 1.00 0.00 O ATOM 41 C2' DC A 2 3.948 -7.472 7.559 1.00 0.00 C ATOM 42 C1' DC A 2 3.842 -8.471 6.399 1.00 0.00 C ATOM 43 N1 DC A 2 2.548 -8.449 5.635 1.00 0.00 N ATOM 44 C2 DC A 2 2.564 -8.783 4.284 1.00 0.00 C ATOM 45 O2 DC A 2 3.626 -9.006 3.707 1.00 0.00 O ATOM 46 N3 DC A 2 1.391 -8.869 3.582 1.00 0.00 N ATOM 47 C4 DC A 2 0.224 -8.645 4.202 1.00 0.00 C ATOM 48 N4 DC A 2 -0.908 -8.838 3.533 1.00 0.00 N ATOM 49 C5 DC A 2 0.160 -8.326 5.591 1.00 0.00 C ATOM 50 C6 DC A 2 1.336 -8.267 6.254 1.00 0.00 C ATOM 0 H5' DC A 2 2.841 -11.031 9.109 1.00 0.00 H new ATOM 0 H5'' DC A 2 3.688 -10.168 10.377 1.00 0.00 H new ATOM 0 H4' DC A 2 5.136 -10.362 8.586 1.00 0.00 H new ATOM 0 H3' DC A 2 4.706 -7.715 9.543 1.00 0.00 H new ATOM 0 H2' DC A 2 2.968 -7.220 7.965 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.413 -6.537 7.245 1.00 0.00 H new ATOM 0 H1' DC A 2 4.622 -8.230 5.677 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.805 -8.672 3.990 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.880 -9.152 2.563 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.781 -8.141 6.088 1.00 0.00 H new ATOM 0 H6 DC A 2 1.322 -8.068 7.315 1.00 0.00 H new ATOM 62 P DG A 3 7.138 -7.019 8.219 1.00 0.00 P ATOM 63 OP1 DG A 3 8.526 -7.423 8.530 1.00 0.00 O ATOM 64 OP2 DG A 3 6.506 -5.898 8.948 1.00 0.00 O ATOM 65 O5' DG A 3 7.006 -6.773 6.644 1.00 0.00 O ATOM 66 C5' DG A 3 7.507 -7.709 5.709 1.00 0.00 C ATOM 67 C4' DG A 3 7.673 -7.028 4.351 1.00 0.00 C ATOM 68 O4' DG A 3 6.403 -6.957 3.744 1.00 0.00 O ATOM 69 C3' DG A 3 8.222 -5.607 4.526 1.00 0.00 C ATOM 70 O3' DG A 3 9.156 -5.330 3.503 1.00 0.00 O ATOM 71 C2' DG A 3 6.923 -4.805 4.462 1.00 0.00 C ATOM 72 C1' DG A 3 6.078 -5.612 3.493 1.00 0.00 C ATOM 73 N9 DG A 3 4.624 -5.456 3.684 1.00 0.00 N ATOM 74 C8 DG A 3 3.908 -5.201 4.825 1.00 0.00 C ATOM 75 N7 DG A 3 2.627 -5.409 4.703 1.00 0.00 N ATOM 76 C5 DG A 3 2.470 -5.747 3.361 1.00 0.00 C ATOM 77 C6 DG A 3 1.295 -5.988 2.586 1.00 0.00 C ATOM 78 O6 DG A 3 0.129 -6.051 2.971 1.00 0.00 O ATOM 79 N1 DG A 3 1.574 -6.165 1.241 1.00 0.00 N ATOM 80 C2 DG A 3 2.839 -6.140 0.697 1.00 0.00 C ATOM 81 N2 DG A 3 2.996 -6.303 -0.610 1.00 0.00 N ATOM 82 N3 DG A 3 3.944 -5.943 1.415 1.00 0.00 N ATOM 83 C4 DG A 3 3.688 -5.744 2.730 1.00 0.00 C ATOM 0 H5' DG A 3 6.825 -8.555 5.623 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.464 -8.104 6.050 1.00 0.00 H new ATOM 0 H4' DG A 3 8.371 -7.598 3.738 1.00 0.00 H new ATOM 0 H3' DG A 3 8.786 -5.395 5.434 1.00 0.00 H new ATOM 0 H2' DG A 3 6.450 -4.723 5.440 1.00 0.00 H new ATOM 0 H2'' DG A 3 7.092 -3.790 4.103 1.00 0.00 H new ATOM 0 H1' DG A 3 6.290 -5.270 2.480 1.00 0.00 H new ATOM 0 H8 DG A 3 4.364 -4.859 5.742 1.00 0.00 H new ATOM 0 H1 DG A 3 0.789 -6.325 0.610 1.00 0.00 H new ATOM 0 H21 DG A 3 3.931 -6.285 -1.017 1.00 0.00 H new ATOM 0 H22 DG A 3 2.182 -6.446 -1.207 1.00 0.00 H new ATOM 95 P DT A 4 10.050 -3.986 3.505 1.00 0.00 P ATOM 96 OP1 DT A 4 11.343 -4.290 2.855 1.00 0.00 O ATOM 97 OP2 DT A 4 10.024 -3.404 4.865 1.00 0.00 O ATOM 98 O5' DT A 4 9.194 -3.057 2.523 1.00 0.00 O ATOM 99 C5' DT A 4 9.119 -3.372 1.152 1.00 0.00 C ATOM 100 C4' DT A 4 7.840 -2.792 0.563 1.00 0.00 C ATOM 101 O4' DT A 4 6.684 -3.220 1.260 1.00 0.00 O ATOM 102 C3' DT A 4 7.734 -1.269 0.649 1.00 0.00 C ATOM 103 O3' DT A 4 8.591 -0.514 -0.188 1.00 0.00 O ATOM 104 C2' DT A 4 6.235 -1.149 0.369 1.00 0.00 C ATOM 105 C1' DT A 4 5.615 -2.483 0.696 1.00 0.00 C ATOM 106 N1 DT A 4 4.444 -2.369 1.615 1.00 0.00 N ATOM 107 C2 DT A 4 3.207 -2.869 1.233 1.00 0.00 C ATOM 108 O2 DT A 4 2.968 -3.244 0.090 1.00 0.00 O ATOM 109 N3 DT A 4 2.229 -2.933 2.197 1.00 0.00 N ATOM 110 C4 DT A 4 2.292 -2.442 3.474 1.00 0.00 C ATOM 111 O4 DT A 4 1.439 -2.751 4.302 1.00 0.00 O ATOM 112 C5 DT A 4 3.437 -1.500 3.831 1.00 0.00 C ATOM 113 C7 DT A 4 4.061 -1.753 5.201 1.00 0.00 C ATOM 114 C6 DT A 4 4.553 -1.444 2.785 1.00 0.00 C ATOM 0 H5' DT A 4 9.136 -4.453 1.016 1.00 0.00 H new ATOM 0 H5'' DT A 4 9.987 -2.971 0.628 1.00 0.00 H new ATOM 0 H4' DT A 4 7.891 -3.137 -0.470 1.00 0.00 H new ATOM 0 H3' DT A 4 8.079 -0.835 1.587 1.00 0.00 H new ATOM 0 H2' DT A 4 5.792 -0.359 0.976 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.058 -0.887 -0.674 1.00 0.00 H new ATOM 0 H1' DT A 4 5.193 -2.970 -0.183 1.00 0.00 H new ATOM 0 H3 DT A 4 1.360 -3.397 1.932 1.00 0.00 H new ATOM 0 H71 DT A 4 3.306 -2.158 5.875 1.00 0.00 H new ATOM 0 H72 DT A 4 4.880 -2.466 5.102 1.00 0.00 H new ATOM 0 H73 DT A 4 4.443 -0.816 5.605 1.00 0.00 H new ATOM 0 H6 DT A 4 5.386 -0.764 2.888 1.00 0.00 H new ATOM 127 P DA A 5 8.591 -0.593 -1.796 1.00 0.00 P ATOM 128 OP1 DA A 5 8.775 -1.999 -2.212 1.00 0.00 O ATOM 129 OP2 DA A 5 9.548 0.429 -2.273 1.00 0.00 O ATOM 130 O5' DA A 5 7.100 -0.114 -2.202 1.00 0.00 O ATOM 131 C5' DA A 5 6.937 0.812 -3.227 1.00 0.00 C ATOM 132 C4' DA A 5 5.534 1.066 -3.792 1.00 0.00 C ATOM 133 O4' DA A 5 4.567 1.221 -2.761 1.00 0.00 O ATOM 134 C3' DA A 5 5.594 2.403 -4.549 1.00 0.00 C ATOM 135 O3' DA A 5 4.820 2.456 -5.758 1.00 0.00 O ATOM 136 C2' DA A 5 5.245 3.318 -3.378 1.00 0.00 C ATOM 137 C1' DA A 5 4.095 2.558 -2.761 1.00 0.00 C ATOM 138 N9 DA A 5 3.672 2.981 -1.421 1.00 0.00 N ATOM 139 C8 DA A 5 4.426 3.019 -0.287 1.00 0.00 C ATOM 140 N7 DA A 5 3.728 3.192 0.807 1.00 0.00 N ATOM 141 C5 DA A 5 2.406 3.251 0.351 1.00 0.00 C ATOM 142 C6 DA A 5 1.142 3.326 0.982 1.00 0.00 C ATOM 143 N6 DA A 5 0.991 3.310 2.303 1.00 0.00 N ATOM 144 N1 DA A 5 0.025 3.304 0.228 1.00 0.00 N ATOM 145 C2 DA A 5 0.155 3.231 -1.090 1.00 0.00 C ATOM 146 N3 DA A 5 1.270 3.170 -1.807 1.00 0.00 N ATOM 147 C4 DA A 5 2.372 3.165 -1.014 1.00 0.00 C ATOM 0 H5' DA A 5 7.572 0.499 -4.056 1.00 0.00 H new ATOM 0 H5'' DA A 5 7.325 1.767 -2.871 1.00 0.00 H new ATOM 0 H4' DA A 5 5.249 0.220 -4.418 1.00 0.00 H new ATOM 0 H3' DA A 5 6.531 2.674 -5.035 1.00 0.00 H new ATOM 0 H2' DA A 5 6.078 3.441 -2.686 1.00 0.00 H new ATOM 0 H2'' DA A 5 4.953 4.316 -3.705 1.00 0.00 H new ATOM 0 H1' DA A 5 3.183 2.729 -3.332 1.00 0.00 H new ATOM 0 H8 DA A 5 5.501 2.916 -0.290 1.00 0.00 H new ATOM 0 H61 DA A 5 0.058 3.367 2.710 1.00 0.00 H new ATOM 0 H62 DA A 5 1.809 3.241 2.909 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.767 3.220 -1.653 1.00 0.00 H new ATOM 159 P DC A 6 3.242 2.071 -5.993 1.00 0.00 P ATOM 160 OP1 DC A 6 2.940 0.822 -5.264 1.00 0.00 O ATOM 161 OP2 DC A 6 2.997 2.137 -7.450 1.00 0.00 O ATOM 162 O5' DC A 6 2.423 3.292 -5.303 1.00 0.00 O ATOM 163 C5' DC A 6 2.775 4.637 -5.546 1.00 0.00 C ATOM 164 C4' DC A 6 1.530 5.252 -6.160 1.00 0.00 C ATOM 165 O4' DC A 6 0.634 5.223 -5.057 1.00 0.00 O ATOM 166 C3' DC A 6 1.618 6.722 -6.575 1.00 0.00 C ATOM 167 O3' DC A 6 0.529 6.992 -7.449 1.00 0.00 O ATOM 168 C2' DC A 6 1.470 7.420 -5.227 1.00 0.00 C ATOM 169 C1' DC A 6 0.728 6.436 -4.321 1.00 0.00 C ATOM 170 N1 DC A 6 1.208 6.375 -2.895 1.00 0.00 N ATOM 171 C2 DC A 6 0.230 6.293 -1.903 1.00 0.00 C ATOM 172 O2 DC A 6 -0.962 6.183 -2.172 1.00 0.00 O ATOM 173 N3 DC A 6 0.582 6.333 -0.591 1.00 0.00 N ATOM 174 C4 DC A 6 1.859 6.457 -0.234 1.00 0.00 C ATOM 175 N4 DC A 6 2.158 6.363 1.054 1.00 0.00 N ATOM 176 C5 DC A 6 2.893 6.578 -1.210 1.00 0.00 C ATOM 177 C6 DC A 6 2.520 6.554 -2.510 1.00 0.00 C ATOM 0 H5' DC A 6 3.627 4.708 -6.222 1.00 0.00 H new ATOM 0 H5'' DC A 6 3.056 5.146 -4.624 1.00 0.00 H new ATOM 0 H4' DC A 6 1.281 4.714 -7.075 1.00 0.00 H new ATOM 0 H3' DC A 6 2.520 7.029 -7.105 1.00 0.00 H new ATOM 0 H2' DC A 6 2.445 7.675 -4.811 1.00 0.00 H new ATOM 0 H2'' DC A 6 0.914 8.352 -5.329 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.282 6.779 -4.098 1.00 0.00 H new ATOM 0 H41 DC A 6 3.127 6.453 1.361 1.00 0.00 H new ATOM 0 H42 DC A 6 1.419 6.200 1.738 1.00 0.00 H new ATOM 0 H5 DC A 6 3.929 6.684 -0.923 1.00 0.00 H new ATOM 0 H6 DC A 6 3.275 6.679 -3.272 1.00 0.00 H new ATOM 189 P DG A 7 0.161 8.480 -7.976 1.00 0.00 P ATOM 190 OP1 DG A 7 -0.556 8.343 -9.262 1.00 0.00 O ATOM 191 OP2 DG A 7 1.388 9.302 -7.907 1.00 0.00 O ATOM 192 O5' DG A 7 -0.891 9.040 -6.872 1.00 0.00 O ATOM 193 C5' DG A 7 -2.175 8.461 -6.748 1.00 0.00 C ATOM 194 C4' DG A 7 -3.090 9.164 -5.733 1.00 0.00 C ATOM 195 O4' DG A 7 -2.579 9.054 -4.417 1.00 0.00 O ATOM 196 C3' DG A 7 -3.276 10.655 -6.024 1.00 0.00 C ATOM 197 O3' DG A 7 -4.645 10.953 -5.792 1.00 0.00 O ATOM 198 C2' DG A 7 -2.300 11.285 -5.044 1.00 0.00 C ATOM 199 C1' DG A 7 -2.397 10.343 -3.854 1.00 0.00 C ATOM 200 N9 DG A 7 -1.230 10.262 -2.952 1.00 0.00 N ATOM 201 C8 DG A 7 0.101 10.294 -3.267 1.00 0.00 C ATOM 202 N7 DG A 7 0.892 9.987 -2.276 1.00 0.00 N ATOM 203 C5 DG A 7 0.021 9.765 -1.209 1.00 0.00 C ATOM 204 C6 DG A 7 0.280 9.468 0.165 1.00 0.00 C ATOM 205 O6 DG A 7 1.364 9.287 0.709 1.00 0.00 O ATOM 206 N1 DG A 7 -0.873 9.387 0.931 1.00 0.00 N ATOM 207 C2 DG A 7 -2.138 9.564 0.435 1.00 0.00 C ATOM 208 N2 DG A 7 -3.156 9.486 1.285 1.00 0.00 N ATOM 209 N3 DG A 7 -2.397 9.847 -0.848 1.00 0.00 N ATOM 210 C4 DG A 7 -1.278 9.936 -1.615 1.00 0.00 C ATOM 0 H5' DG A 7 -2.063 7.417 -6.456 1.00 0.00 H new ATOM 0 H5'' DG A 7 -2.660 8.469 -7.724 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.051 8.658 -5.824 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.073 11.009 -7.035 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.288 11.330 -5.447 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.585 12.304 -4.782 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.201 10.724 -3.224 1.00 0.00 H new ATOM 0 H8 DG A 7 0.465 10.551 -4.251 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.773 9.183 1.925 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.111 9.613 0.950 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.983 9.299 2.273 1.00 0.00 H new ATOM 222 P DC A 8 -5.289 12.403 -6.065 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.716 12.218 -6.402 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.399 13.130 -6.996 1.00 0.00 O ATOM 225 O5' DC A 8 -5.196 13.099 -4.619 1.00 0.00 O ATOM 226 C5' DC A 8 -6.153 12.854 -3.605 1.00 0.00 C ATOM 227 C4' DC A 8 -5.671 13.466 -2.282 1.00 0.00 C ATOM 228 O4' DC A 8 -4.542 12.728 -1.823 1.00 0.00 O ATOM 229 C3' DC A 8 -5.223 14.933 -2.447 1.00 0.00 C ATOM 230 O3' DC A 8 -5.623 15.725 -1.348 1.00 0.00 O ATOM 231 C2' DC A 8 -3.711 14.762 -2.491 1.00 0.00 C ATOM 232 C1' DC A 8 -3.574 13.673 -1.424 1.00 0.00 C ATOM 233 N1 DC A 8 -2.209 13.148 -1.213 1.00 0.00 N ATOM 234 C2 DC A 8 -1.787 12.812 0.074 1.00 0.00 C ATOM 235 O2 DC A 8 -2.591 12.651 0.988 1.00 0.00 O ATOM 236 N3 DC A 8 -0.451 12.661 0.319 1.00 0.00 N ATOM 237 C4 DC A 8 0.443 12.895 -0.651 1.00 0.00 C ATOM 238 N4 DC A 8 1.731 12.713 -0.396 1.00 0.00 N ATOM 239 C5 DC A 8 0.024 13.283 -1.960 1.00 0.00 C ATOM 240 C6 DC A 8 -1.292 13.366 -2.178 1.00 0.00 C ATOM 0 H5' DC A 8 -6.306 11.781 -3.487 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.114 13.283 -3.887 1.00 0.00 H new ATOM 0 H4' DC A 8 -6.505 13.429 -1.581 1.00 0.00 H new ATOM 0 H3' DC A 8 -5.647 15.441 -3.313 1.00 0.00 H new ATOM 0 H2' DC A 8 -3.350 14.444 -3.469 1.00 0.00 H new ATOM 0 H2'' DC A 8 -3.174 15.675 -2.235 1.00 0.00 H new ATOM 0 HO3' DC A 8 -5.322 16.648 -1.483 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.752 14.051 -0.417 1.00 0.00 H new ATOM 0 H41 DC A 8 2.424 12.887 -1.124 1.00 0.00 H new ATOM 0 H42 DC A 8 2.029 12.399 0.528 1.00 0.00 H new ATOM 0 H5 DC A 8 0.739 13.500 -2.740 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.636 13.619 -3.170 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.316 12.539 9.055 1.00 0.00 O ATOM 255 C5' DG B 9 3.723 11.424 9.684 1.00 0.00 C ATOM 256 C4' DG B 9 2.227 11.689 9.881 1.00 0.00 C ATOM 257 O4' DG B 9 1.610 12.200 8.706 1.00 0.00 O ATOM 258 C3' DG B 9 1.478 10.424 10.237 1.00 0.00 C ATOM 259 O3' DG B 9 0.400 10.773 11.091 1.00 0.00 O ATOM 260 C2' DG B 9 1.045 9.905 8.870 1.00 0.00 C ATOM 261 C1' DG B 9 0.973 11.148 7.989 1.00 0.00 C ATOM 262 N9 DG B 9 1.587 11.019 6.642 1.00 0.00 N ATOM 263 C8 DG B 9 2.888 10.738 6.297 1.00 0.00 C ATOM 264 N7 DG B 9 3.150 10.868 5.029 1.00 0.00 N ATOM 265 C5 DG B 9 1.940 11.272 4.480 1.00 0.00 C ATOM 266 C6 DG B 9 1.607 11.614 3.136 1.00 0.00 C ATOM 267 O6 DG B 9 2.350 11.657 2.160 1.00 0.00 O ATOM 268 N1 DG B 9 0.268 11.930 2.976 1.00 0.00 N ATOM 269 C2 DG B 9 -0.644 11.952 4.001 1.00 0.00 C ATOM 270 N2 DG B 9 -1.908 12.240 3.714 1.00 0.00 N ATOM 271 N3 DG B 9 -0.336 11.674 5.274 1.00 0.00 N ATOM 272 C4 DG B 9 0.972 11.344 5.450 1.00 0.00 C ATOM 0 H5' DG B 9 4.201 11.238 10.646 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.869 10.530 9.078 1.00 0.00 H new ATOM 0 H4' DG B 9 2.174 12.419 10.689 1.00 0.00 H new ATOM 0 H3' DG B 9 2.040 9.664 10.780 1.00 0.00 H new ATOM 0 H2' DG B 9 1.759 9.182 8.477 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.080 9.402 8.925 1.00 0.00 H new ATOM 0 HO5' DG B 9 3.653 12.987 8.490 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.081 11.337 7.786 1.00 0.00 H new ATOM 0 H8 DG B 9 3.631 10.434 7.019 1.00 0.00 H new ATOM 0 H1 DG B 9 -0.060 12.161 2.038 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.607 12.263 4.456 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.180 12.438 2.751 1.00 0.00 H new ATOM 285 P DC B 10 -0.572 9.679 11.769 1.00 0.00 P ATOM 286 OP1 DC B 10 -1.244 10.313 12.924 1.00 0.00 O ATOM 287 OP2 DC B 10 0.199 8.431 11.958 1.00 0.00 O ATOM 288 O5' DC B 10 -1.668 9.446 10.615 1.00 0.00 O ATOM 289 C5' DC B 10 -2.531 10.491 10.221 1.00 0.00 C ATOM 290 C4' DC B 10 -3.207 10.148 8.891 1.00 0.00 C ATOM 291 O4' DC B 10 -2.262 10.117 7.831 1.00 0.00 O ATOM 292 C3' DC B 10 -3.900 8.778 8.906 1.00 0.00 C ATOM 293 O3' DC B 10 -5.253 8.998 8.557 1.00 0.00 O ATOM 294 C2' DC B 10 -3.097 8.001 7.850 1.00 0.00 C ATOM 295 C1' DC B 10 -2.669 9.117 6.919 1.00 0.00 C ATOM 296 N1 DC B 10 -1.610 8.748 5.944 1.00 0.00 N ATOM 297 C2 DC B 10 -1.797 8.961 4.577 1.00 0.00 C ATOM 298 O2 DC B 10 -2.887 9.311 4.125 1.00 0.00 O ATOM 299 N3 DC B 10 -0.749 8.778 3.717 1.00 0.00 N ATOM 300 C4 DC B 10 0.416 8.306 4.183 1.00 0.00 C ATOM 301 N4 DC B 10 1.467 8.287 3.372 1.00 0.00 N ATOM 302 C5 DC B 10 0.602 7.996 5.566 1.00 0.00 C ATOM 303 C6 DC B 10 -0.429 8.248 6.395 1.00 0.00 C ATOM 0 H5' DC B 10 -1.968 11.419 10.122 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.287 10.657 10.989 1.00 0.00 H new ATOM 0 H4' DC B 10 -3.951 10.931 8.741 1.00 0.00 H new ATOM 0 H3' DC B 10 -3.917 8.235 9.851 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.244 7.479 8.284 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.704 7.252 7.341 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.469 9.426 6.246 1.00 0.00 H new ATOM 0 H41 DC B 10 2.363 7.932 3.706 1.00 0.00 H new ATOM 0 H42 DC B 10 1.379 8.627 2.415 1.00 0.00 H new ATOM 0 H5 DC B 10 1.529 7.578 5.930 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.314 8.047 7.450 1.00 0.00 H new ATOM 315 P DG B 11 -6.303 7.796 8.392 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.647 8.299 8.747 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.761 6.603 9.078 1.00 0.00 O ATOM 318 O5' DG B 11 -6.256 7.542 6.802 1.00 0.00 O ATOM 319 C5' DG B 11 -6.766 8.490 5.883 1.00 0.00 C ATOM 320 C4' DG B 11 -7.398 7.794 4.666 1.00 0.00 C ATOM 321 O4' DG B 11 -6.412 7.541 3.689 1.00 0.00 O ATOM 322 C3' DG B 11 -8.045 6.449 5.013 1.00 0.00 C ATOM 323 O3' DG B 11 -9.181 6.276 4.189 1.00 0.00 O ATOM 324 C2' DG B 11 -6.898 5.479 4.746 1.00 0.00 C ATOM 325 C1' DG B 11 -6.150 6.156 3.597 1.00 0.00 C ATOM 326 N9 DG B 11 -4.687 5.988 3.648 1.00 0.00 N ATOM 327 C8 DG B 11 -3.887 5.781 4.735 1.00 0.00 C ATOM 328 N7 DG B 11 -2.610 5.825 4.486 1.00 0.00 N ATOM 329 C5 DG B 11 -2.558 6.055 3.112 1.00 0.00 C ATOM 330 C6 DG B 11 -1.445 6.100 2.221 1.00 0.00 C ATOM 331 O6 DG B 11 -0.253 5.993 2.492 1.00 0.00 O ATOM 332 N1 DG B 11 -1.823 6.289 0.902 1.00 0.00 N ATOM 333 C2 DG B 11 -3.124 6.417 0.478 1.00 0.00 C ATOM 334 N2 DG B 11 -3.364 6.577 -0.817 1.00 0.00 N ATOM 335 N3 DG B 11 -4.177 6.335 1.295 1.00 0.00 N ATOM 336 C4 DG B 11 -3.825 6.157 2.594 1.00 0.00 C ATOM 0 H5' DG B 11 -5.964 9.150 5.553 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.510 9.115 6.376 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.169 8.472 4.301 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.427 6.326 6.027 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.263 5.350 5.623 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.260 4.490 4.467 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.496 5.695 2.672 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.282 5.596 5.723 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.086 6.336 0.198 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.323 6.674 -1.150 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.589 6.603 -1.480 1.00 0.00 H new ATOM 348 P DT B 12 -10.126 4.980 4.303 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.472 5.341 3.809 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.963 4.407 5.656 1.00 0.00 O ATOM 351 O5' DT B 12 -9.433 4.002 3.235 1.00 0.00 O ATOM 352 C5' DT B 12 -9.720 4.118 1.859 1.00 0.00 C ATOM 353 C4' DT B 12 -8.772 3.244 1.037 1.00 0.00 C ATOM 354 O4' DT B 12 -7.513 3.854 0.795 1.00 0.00 O ATOM 355 C3' DT B 12 -8.521 1.854 1.621 1.00 0.00 C ATOM 356 O3' DT B 12 -9.522 0.913 1.267 1.00 0.00 O ATOM 357 C2' DT B 12 -7.240 1.590 0.854 1.00 0.00 C ATOM 358 C1' DT B 12 -6.651 2.866 0.239 1.00 0.00 C ATOM 359 N1 DT B 12 -5.301 3.023 0.792 1.00 0.00 N ATOM 360 C2 DT B 12 -4.132 3.292 0.080 1.00 0.00 C ATOM 361 O2 DT B 12 -4.122 3.509 -1.127 1.00 0.00 O ATOM 362 N3 DT B 12 -2.958 3.298 0.840 1.00 0.00 N ATOM 363 C4 DT B 12 -2.879 3.075 2.208 1.00 0.00 C ATOM 364 O4 DT B 12 -1.803 3.124 2.793 1.00 0.00 O ATOM 365 C5 DT B 12 -4.161 2.789 2.824 1.00 0.00 C ATOM 366 C7 DT B 12 -4.394 2.506 4.265 1.00 0.00 C ATOM 367 C6 DT B 12 -5.276 2.772 2.104 1.00 0.00 C ATOM 0 H5' DT B 12 -9.625 5.159 1.549 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.752 3.822 1.671 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.313 3.129 0.097 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.497 1.785 2.709 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.506 1.140 1.523 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.436 0.866 0.063 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.587 2.895 -0.849 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.084 3.482 0.347 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.391 2.844 4.546 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.311 1.434 4.443 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.651 3.032 4.864 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.207 2.545 2.602 1.00 0.00 H new ATOM 380 P DA B 13 -9.329 -0.675 1.545 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.467 -1.386 0.926 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.051 -0.844 2.988 1.00 0.00 O ATOM 383 O5' DA B 13 -7.987 -1.057 0.718 1.00 0.00 O ATOM 384 C5' DA B 13 -7.930 -0.942 -0.693 1.00 0.00 C ATOM 385 C4' DA B 13 -6.502 -0.687 -1.252 1.00 0.00 C ATOM 386 O4' DA B 13 -5.418 -0.952 -0.400 1.00 0.00 O ATOM 387 C3' DA B 13 -6.400 -1.647 -2.429 1.00 0.00 C ATOM 388 O3' DA B 13 -5.609 -1.075 -3.460 1.00 0.00 O ATOM 389 C2' DA B 13 -5.764 -2.812 -1.637 1.00 0.00 C ATOM 390 C1' DA B 13 -4.680 -2.047 -0.898 1.00 0.00 C ATOM 391 N9 DA B 13 -4.149 -2.676 0.311 1.00 0.00 N ATOM 392 C8 DA B 13 -4.785 -2.725 1.519 1.00 0.00 C ATOM 393 N7 DA B 13 -4.012 -3.049 2.521 1.00 0.00 N ATOM 394 C5 DA B 13 -2.757 -3.169 1.924 1.00 0.00 C ATOM 395 C6 DA B 13 -1.462 -3.393 2.426 1.00 0.00 C ATOM 396 N6 DA B 13 -1.214 -3.580 3.720 1.00 0.00 N ATOM 397 N1 DA B 13 -0.421 -3.344 1.580 1.00 0.00 N ATOM 398 C2 DA B 13 -0.639 -3.093 0.296 1.00 0.00 C ATOM 399 N3 DA B 13 -1.798 -2.871 -0.304 1.00 0.00 N ATOM 400 C4 DA B 13 -2.827 -2.915 0.580 1.00 0.00 C ATOM 0 H5' DA B 13 -8.582 -0.127 -1.007 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.325 -1.856 -1.137 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.416 0.379 -1.462 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.296 -1.925 -2.985 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.471 -3.295 -0.962 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.361 -3.589 -2.286 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.834 -1.894 -1.569 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.838 -2.514 1.636 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.258 -3.739 4.038 1.00 0.00 H new ATOM 0 H62 DA B 13 -1.980 -3.564 4.393 1.00 0.00 H new ATOM 0 H2 DA B 13 0.236 -3.066 -0.337 1.00 0.00 H new ATOM 412 P DC B 14 -5.723 -1.561 -5.003 1.00 0.00 P ATOM 413 OP1 DC B 14 -5.913 -0.361 -5.845 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.710 -2.661 -5.065 1.00 0.00 O ATOM 415 O5' DC B 14 -4.274 -2.189 -5.314 1.00 0.00 O ATOM 416 C5' DC B 14 -3.759 -3.181 -4.461 1.00 0.00 C ATOM 417 C4' DC B 14 -2.315 -3.555 -4.777 1.00 0.00 C ATOM 418 O4' DC B 14 -1.667 -3.710 -3.523 1.00 0.00 O ATOM 419 C3' DC B 14 -2.232 -4.884 -5.529 1.00 0.00 C ATOM 420 O3' DC B 14 -1.134 -4.870 -6.429 1.00 0.00 O ATOM 421 C2' DC B 14 -2.041 -5.860 -4.386 1.00 0.00 C ATOM 422 C1' DC B 14 -1.326 -5.063 -3.311 1.00 0.00 C ATOM 423 N1 DC B 14 -1.712 -5.575 -1.985 1.00 0.00 N ATOM 424 C2 DC B 14 -0.736 -6.062 -1.134 1.00 0.00 C ATOM 425 O2 DC B 14 0.414 -6.252 -1.513 1.00 0.00 O ATOM 426 N3 DC B 14 -1.057 -6.336 0.153 1.00 0.00 N ATOM 427 C4 DC B 14 -2.318 -6.209 0.574 1.00 0.00 C ATOM 428 N4 DC B 14 -2.518 -6.341 1.878 1.00 0.00 N ATOM 429 C5 DC B 14 -3.375 -5.805 -0.318 1.00 0.00 C ATOM 430 C6 DC B 14 -3.009 -5.517 -1.585 1.00 0.00 C ATOM 0 H5' DC B 14 -4.382 -4.072 -4.533 1.00 0.00 H new ATOM 0 H5'' DC B 14 -3.820 -2.832 -3.430 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.859 -2.788 -5.403 1.00 0.00 H new ATOM 0 H3' DC B 14 -3.093 -5.123 -6.153 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.997 -6.240 -4.026 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.452 -6.723 -4.697 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.241 -5.158 -3.357 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.459 -6.255 2.261 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.730 -6.529 2.498 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.402 -5.736 0.009 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.767 -5.233 -2.300 1.00 0.00 H new ATOM 442 P DG B 15 -0.739 -6.151 -7.339 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.154 -5.647 -8.600 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.909 -7.055 -7.387 1.00 0.00 O ATOM 445 O5' DG B 15 0.429 -6.892 -6.493 1.00 0.00 O ATOM 446 C5' DG B 15 1.707 -6.299 -6.377 1.00 0.00 C ATOM 447 C4' DG B 15 2.746 -7.177 -5.667 1.00 0.00 C ATOM 448 O4' DG B 15 2.339 -7.465 -4.343 1.00 0.00 O ATOM 449 C3' DG B 15 2.996 -8.517 -6.367 1.00 0.00 C ATOM 450 O3' DG B 15 4.395 -8.753 -6.306 1.00 0.00 O ATOM 451 C2' DG B 15 2.142 -9.466 -5.543 1.00 0.00 C ATOM 452 C1' DG B 15 2.284 -8.869 -4.151 1.00 0.00 C ATOM 453 N9 DG B 15 1.186 -9.144 -3.204 1.00 0.00 N ATOM 454 C8 DG B 15 -0.166 -9.136 -3.418 1.00 0.00 C ATOM 455 N7 DG B 15 -0.879 -9.222 -2.328 1.00 0.00 N ATOM 456 C5 DG B 15 0.072 -9.283 -1.308 1.00 0.00 C ATOM 457 C6 DG B 15 -0.067 -9.367 0.113 1.00 0.00 C ATOM 458 O6 DG B 15 -1.097 -9.475 0.773 1.00 0.00 O ATOM 459 N1 DG B 15 1.151 -9.312 0.779 1.00 0.00 N ATOM 460 C2 DG B 15 2.368 -9.281 0.151 1.00 0.00 C ATOM 461 N2 DG B 15 3.465 -9.283 0.897 1.00 0.00 N ATOM 462 N3 DG B 15 2.515 -9.252 -1.175 1.00 0.00 N ATOM 463 C4 DG B 15 1.334 -9.228 -1.843 1.00 0.00 C ATOM 0 H5' DG B 15 1.611 -5.359 -5.834 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.074 -6.056 -7.374 1.00 0.00 H new ATOM 0 H4' DG B 15 3.668 -6.595 -5.686 1.00 0.00 H new ATOM 0 H3' DG B 15 2.733 -8.602 -7.421 1.00 0.00 H new ATOM 0 H2' DG B 15 1.105 -9.482 -5.879 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.508 -10.492 -5.589 1.00 0.00 H new ATOM 0 H1' DG B 15 3.166 -9.323 -3.700 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.604 -9.065 -4.402 1.00 0.00 H new ATOM 0 H1 DG B 15 1.138 -9.294 1.799 1.00 0.00 H new ATOM 0 H21 DG B 15 4.383 -9.260 0.454 1.00 0.00 H new ATOM 0 H22 DG B 15 3.390 -9.307 1.914 1.00 0.00 H new ATOM 475 P DC B 16 5.101 -10.058 -6.930 1.00 0.00 P ATOM 476 OP1 DC B 16 6.473 -9.689 -7.340 1.00 0.00 O ATOM 477 OP2 DC B 16 4.173 -10.654 -7.915 1.00 0.00 O ATOM 478 O5' DC B 16 5.199 -11.037 -5.657 1.00 0.00 O ATOM 479 C5' DC B 16 6.222 -10.907 -4.687 1.00 0.00 C ATOM 480 C4' DC B 16 5.953 -11.855 -3.508 1.00 0.00 C ATOM 481 O4' DC B 16 4.800 -11.399 -2.806 1.00 0.00 O ATOM 482 C3' DC B 16 5.662 -13.298 -3.973 1.00 0.00 C ATOM 483 O3' DC B 16 6.238 -14.263 -3.116 1.00 0.00 O ATOM 484 C2' DC B 16 4.144 -13.322 -3.880 1.00 0.00 C ATOM 485 C1' DC B 16 3.988 -12.530 -2.578 1.00 0.00 C ATOM 486 N1 DC B 16 2.597 -12.260 -2.161 1.00 0.00 N ATOM 487 C2 DC B 16 2.238 -12.324 -0.813 1.00 0.00 C ATOM 488 O2 DC B 16 3.078 -12.304 0.085 1.00 0.00 O ATOM 489 N3 DC B 16 0.915 -12.412 -0.484 1.00 0.00 N ATOM 490 C4 DC B 16 -0.016 -12.493 -1.444 1.00 0.00 C ATOM 491 N4 DC B 16 -1.294 -12.556 -1.099 1.00 0.00 N ATOM 492 C5 DC B 16 0.344 -12.454 -2.826 1.00 0.00 C ATOM 493 C6 DC B 16 1.641 -12.314 -3.110 1.00 0.00 C ATOM 0 H5' DC B 16 6.270 -9.877 -4.333 1.00 0.00 H new ATOM 0 H5'' DC B 16 7.189 -11.135 -5.134 1.00 0.00 H new ATOM 0 H4' DC B 16 6.846 -11.857 -2.883 1.00 0.00 H new ATOM 0 H3' DC B 16 6.070 -13.537 -4.955 1.00 0.00 H new ATOM 0 H2' DC B 16 3.660 -12.840 -4.730 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.739 -14.332 -3.813 1.00 0.00 H new ATOM 0 HO3' DC B 16 6.028 -15.161 -3.447 1.00 0.00 H new ATOM 0 H1' DC B 16 4.306 -13.093 -1.700 1.00 0.00 H new ATOM 0 H41 DC B 16 -2.014 -12.618 -1.819 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.557 -12.543 -0.114 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.399 -12.534 -3.606 1.00 0.00 H new ATOM 0 H6 DC B 16 1.937 -12.241 -4.146 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.852 0.241 -0.358 1.00 0.00 O HETATM 508 C2 PSO A 9 -2.105 0.309 -0.109 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.640 0.214 1.184 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.772 0.032 2.250 1.00 0.00 C HETATM 511 C5 PSO A 9 0.555 0.066 2.992 1.00 0.00 C HETATM 512 C6 PSO A 9 1.911 0.178 2.657 1.00 0.00 C HETATM 513 C7 PSO A 9 2.308 0.185 1.364 1.00 0.00 C HETATM 514 C8 PSO A 9 1.354 0.104 0.329 1.00 0.00 C HETATM 515 C9 PSO A 9 -0.026 0.158 0.631 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.407 0.088 1.965 1.00 0.00 C HETATM 517 C4' PSO A 9 3.077 -0.021 3.582 1.00 0.00 C HETATM 518 C5' PSO A 9 4.156 0.012 2.517 1.00 0.00 C HETATM 519 O6' PSO A 9 3.556 0.201 1.215 1.00 0.00 O HETATM 520 O11 PSO A 9 -2.879 0.466 -1.051 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.284 -0.213 3.651 1.00 0.00 C HETATM 522 C13 PSO A 9 3.099 0.963 4.774 1.00 0.00 C HETATM 523 O14 PSO A 9 2.289 2.101 4.556 1.00 0.00 O HETATM 524 C15 PSO A 9 5.224 0.970 2.997 1.00 0.00 C HETATM 525 C16 PSO A 9 1.788 -0.048 -1.114 1.00 0.00 C HETATM 0 H163 PSO A 9 2.404 0.804 -1.400 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.365 -0.966 -1.226 1.00 0.00 H new HETATM 0 H161 PSO A 9 0.908 -0.092 -1.756 1.00 0.00 H new HETATM 0 H153 PSO A 9 4.789 1.960 3.135 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.630 0.617 3.945 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.023 1.024 2.258 1.00 0.00 H new HETATM 0 H132 PSO A 9 2.760 0.447 5.672 1.00 0.00 H new HETATM 0 H131 PSO A 9 4.125 1.282 4.958 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.894 0.633 3.969 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.888 -1.121 3.664 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.440 -0.328 4.332 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.250 -0.037 4.033 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.716 0.282 1.348 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.335 2.690 5.338 1.00 0.00 H new