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 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.59! (180deg=-1.59!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : B 1 PSO O14 : rot 180:sc= -0.343 USER MOD Single : B 9 DG O5' : rot -29:sc= 0.0322 USER MOD Single : B 12 DT C7 :methyl 150:sc= -1.44 (180deg=-1.44) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -1.877 -9.874 8.940 1.00 0.00 O ATOM 2 C5' DG A 1 -0.859 -10.462 9.720 1.00 0.00 C ATOM 3 C4' DG A 1 0.530 -10.218 9.114 1.00 0.00 C ATOM 4 O4' DG A 1 0.617 -10.839 7.838 1.00 0.00 O ATOM 5 C3' DG A 1 0.844 -8.729 8.931 1.00 0.00 C ATOM 6 O3' DG A 1 2.214 -8.541 9.234 1.00 0.00 O ATOM 7 C2' DG A 1 0.499 -8.519 7.459 1.00 0.00 C ATOM 8 C1' DG A 1 0.845 -9.869 6.829 1.00 0.00 C ATOM 9 N9 DG A 1 0.003 -10.186 5.649 1.00 0.00 N ATOM 10 C8 DG A 1 -1.366 -10.142 5.562 1.00 0.00 C ATOM 11 N7 DG A 1 -1.848 -10.541 4.422 1.00 0.00 N ATOM 12 C5 DG A 1 -0.719 -10.901 3.697 1.00 0.00 C ATOM 13 C6 DG A 1 -0.614 -11.426 2.377 1.00 0.00 C ATOM 14 O6 DG A 1 -1.523 -11.682 1.593 1.00 0.00 O ATOM 15 N1 DG A 1 0.695 -11.657 1.988 1.00 0.00 N ATOM 16 C2 DG A 1 1.786 -11.413 2.784 1.00 0.00 C ATOM 17 N2 DG A 1 2.988 -11.687 2.284 1.00 0.00 N ATOM 18 N3 DG A 1 1.705 -10.920 4.029 1.00 0.00 N ATOM 19 C4 DG A 1 0.423 -10.688 4.432 1.00 0.00 C ATOM 0 H5' DG A 1 -1.037 -11.534 9.803 1.00 0.00 H new ATOM 0 H5'' DG A 1 -0.893 -10.054 10.730 1.00 0.00 H new ATOM 0 H4' DG A 1 1.250 -10.641 9.815 1.00 0.00 H new ATOM 0 H3' DG A 1 0.305 -8.025 9.565 1.00 0.00 H new ATOM 0 H2' DG A 1 -0.553 -8.268 7.323 1.00 0.00 H new ATOM 0 H2'' DG A 1 1.080 -7.708 7.020 1.00 0.00 H new ATOM 0 HO5' DG A 1 -2.748 -10.050 9.353 1.00 0.00 H new ATOM 0 H1' DG A 1 1.876 -9.853 6.475 1.00 0.00 H new ATOM 0 H8 DG A 1 -1.992 -9.804 6.374 1.00 0.00 H new ATOM 0 H1 DG A 1 0.858 -12.031 1.053 1.00 0.00 H new ATOM 0 H21 DG A 1 3.824 -11.520 2.844 1.00 0.00 H new ATOM 0 H22 DG A 1 3.074 -12.065 1.340 1.00 0.00 H new ATOM 32 P DC A 2 2.960 -7.116 9.118 1.00 0.00 P ATOM 33 OP1 DC A 2 3.868 -6.977 10.276 1.00 0.00 O ATOM 34 OP2 DC A 2 1.952 -6.070 8.841 1.00 0.00 O ATOM 35 O5' DC A 2 3.853 -7.342 7.798 1.00 0.00 O ATOM 36 C5' DC A 2 4.844 -8.350 7.784 1.00 0.00 C ATOM 37 C4' DC A 2 5.495 -8.461 6.407 1.00 0.00 C ATOM 38 O4' DC A 2 4.530 -8.777 5.430 1.00 0.00 O ATOM 39 C3' DC A 2 6.188 -7.172 5.957 1.00 0.00 C ATOM 40 O3' DC A 2 7.479 -7.594 5.560 1.00 0.00 O ATOM 41 C2' DC A 2 5.294 -6.637 4.826 1.00 0.00 C ATOM 42 C1' DC A 2 4.702 -7.936 4.305 1.00 0.00 C ATOM 43 N1 DC A 2 3.361 -7.769 3.697 1.00 0.00 N ATOM 44 C2 DC A 2 3.134 -8.304 2.439 1.00 0.00 C ATOM 45 O2 DC A 2 4.072 -8.687 1.749 1.00 0.00 O ATOM 46 N3 DC A 2 1.862 -8.406 1.968 1.00 0.00 N ATOM 47 C4 DC A 2 0.842 -7.945 2.699 1.00 0.00 C ATOM 48 N4 DC A 2 -0.385 -8.160 2.241 1.00 0.00 N ATOM 49 C5 DC A 2 1.036 -7.394 4.006 1.00 0.00 C ATOM 50 C6 DC A 2 2.311 -7.330 4.457 1.00 0.00 C ATOM 0 H5' DC A 2 4.398 -9.306 8.057 1.00 0.00 H new ATOM 0 H5'' DC A 2 5.604 -8.127 8.532 1.00 0.00 H new ATOM 0 H4' DC A 2 6.244 -9.247 6.504 1.00 0.00 H new ATOM 0 H3' DC A 2 6.311 -6.372 6.687 1.00 0.00 H new ATOM 0 H2' DC A 2 4.530 -5.950 5.191 1.00 0.00 H new ATOM 0 H2'' DC A 2 5.863 -6.105 4.064 1.00 0.00 H new ATOM 0 H1' DC A 2 5.372 -8.328 3.540 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.192 -7.825 2.768 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.521 -8.660 1.362 1.00 0.00 H new ATOM 0 H5 DC A 2 0.206 -7.046 4.603 1.00 0.00 H new ATOM 0 H6 DC A 2 2.504 -6.923 5.439 1.00 0.00 H new ATOM 62 P DG A 3 8.691 -6.578 5.325 1.00 0.00 P ATOM 63 OP1 DG A 3 9.928 -7.365 5.136 1.00 0.00 O ATOM 64 OP2 DG A 3 8.628 -5.530 6.366 1.00 0.00 O ATOM 65 O5' DG A 3 8.258 -5.948 3.924 1.00 0.00 O ATOM 66 C5' DG A 3 8.324 -6.681 2.719 1.00 0.00 C ATOM 67 C4' DG A 3 7.829 -5.791 1.575 1.00 0.00 C ATOM 68 O4' DG A 3 6.503 -5.993 1.177 1.00 0.00 O ATOM 69 C3' DG A 3 7.966 -4.299 1.846 1.00 0.00 C ATOM 70 O3' DG A 3 8.692 -3.810 0.752 1.00 0.00 O ATOM 71 C2' DG A 3 6.514 -3.907 2.016 1.00 0.00 C ATOM 72 C1' DG A 3 5.933 -4.730 0.887 1.00 0.00 C ATOM 73 N9 DG A 3 4.507 -4.980 0.909 1.00 0.00 N ATOM 74 C8 DG A 3 3.711 -4.755 1.960 1.00 0.00 C ATOM 75 N7 DG A 3 2.487 -5.176 1.831 1.00 0.00 N ATOM 76 C5 DG A 3 2.483 -5.684 0.529 1.00 0.00 C ATOM 77 C6 DG A 3 1.419 -6.194 -0.265 1.00 0.00 C ATOM 78 O6 DG A 3 0.274 -6.464 0.077 1.00 0.00 O ATOM 79 N1 DG A 3 1.784 -6.387 -1.584 1.00 0.00 N ATOM 80 C2 DG A 3 3.067 -6.293 -2.059 1.00 0.00 C ATOM 81 N2 DG A 3 3.275 -6.550 -3.345 1.00 0.00 N ATOM 82 N3 DG A 3 4.100 -5.909 -1.306 1.00 0.00 N ATOM 83 C4 DG A 3 3.727 -5.577 -0.042 1.00 0.00 C ATOM 0 H5' DG A 3 7.712 -7.580 2.790 1.00 0.00 H new ATOM 0 H5'' DG A 3 9.347 -7.006 2.530 1.00 0.00 H new ATOM 0 H4' DG A 3 8.497 -6.109 0.775 1.00 0.00 H new ATOM 0 H3' DG A 3 8.509 -3.919 2.711 1.00 0.00 H new ATOM 0 H2' DG A 3 6.112 -4.181 2.991 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.346 -2.837 1.891 1.00 0.00 H new ATOM 0 H1' DG A 3 6.127 -4.221 -0.057 1.00 0.00 H new ATOM 0 H8 DG A 3 4.060 -4.258 2.853 1.00 0.00 H new ATOM 0 H1 DG A 3 1.047 -6.615 -2.251 1.00 0.00 H new ATOM 0 H21 DG A 3 4.217 -6.489 -3.731 1.00 0.00 H new ATOM 0 H22 DG A 3 2.493 -6.808 -3.947 1.00 0.00 H new ATOM 95 P DT A 4 10.235 -3.429 0.938 1.00 0.00 P ATOM 96 OP1 DT A 4 10.816 -3.170 -0.397 1.00 0.00 O ATOM 97 OP2 DT A 4 10.846 -4.433 1.836 1.00 0.00 O ATOM 98 O5' DT A 4 10.066 -2.028 1.724 1.00 0.00 O ATOM 99 C5' DT A 4 8.867 -1.259 1.674 1.00 0.00 C ATOM 100 C4' DT A 4 8.259 -1.164 0.256 1.00 0.00 C ATOM 101 O4' DT A 4 7.069 -1.938 -0.036 1.00 0.00 O ATOM 102 C3' DT A 4 7.856 0.256 -0.031 1.00 0.00 C ATOM 103 O3' DT A 4 8.159 0.372 -1.400 1.00 0.00 O ATOM 104 C2' DT A 4 6.429 0.085 0.299 1.00 0.00 C ATOM 105 C1' DT A 4 5.889 -1.151 -0.250 1.00 0.00 C ATOM 106 N1 DT A 4 4.654 -1.534 0.541 1.00 0.00 N ATOM 107 C2 DT A 4 3.672 -2.273 -0.101 1.00 0.00 C ATOM 108 O2 DT A 4 3.859 -2.752 -1.213 1.00 0.00 O ATOM 109 N3 DT A 4 2.466 -2.467 0.540 1.00 0.00 N ATOM 110 C4 DT A 4 2.100 -2.064 1.803 1.00 0.00 C ATOM 111 O4 DT A 4 1.047 -2.464 2.292 1.00 0.00 O ATOM 112 C5 DT A 4 3.021 -1.118 2.579 1.00 0.00 C ATOM 113 C7 DT A 4 3.291 -1.578 4.018 1.00 0.00 C ATOM 114 C6 DT A 4 4.314 -0.788 1.816 1.00 0.00 C ATOM 0 H5' DT A 4 9.073 -0.254 2.041 1.00 0.00 H new ATOM 0 H5'' DT A 4 8.132 -1.700 2.348 1.00 0.00 H new ATOM 0 H4' DT A 4 9.067 -1.569 -0.354 1.00 0.00 H new ATOM 0 H3' DT A 4 8.287 1.126 0.466 1.00 0.00 H new ATOM 0 H2' DT A 4 6.304 0.086 1.382 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.863 0.932 -0.088 1.00 0.00 H new ATOM 0 H1' DT A 4 5.519 -1.197 -1.274 1.00 0.00 H new ATOM 0 H3 DT A 4 1.756 -2.973 0.010 1.00 0.00 H new ATOM 0 H71 DT A 4 4.279 -1.239 4.329 1.00 0.00 H new ATOM 0 H72 DT A 4 2.537 -1.156 4.682 1.00 0.00 H new ATOM 0 H73 DT A 4 3.249 -2.666 4.066 1.00 0.00 H new ATOM 0 H6 DT A 4 4.981 -0.024 2.189 1.00 0.00 H new ATOM 127 P DA A 5 9.594 0.907 -1.894 1.00 0.00 P ATOM 128 OP1 DA A 5 9.917 0.255 -3.180 1.00 0.00 O ATOM 129 OP2 DA A 5 10.527 0.829 -0.749 1.00 0.00 O ATOM 130 O5' DA A 5 9.193 2.433 -2.156 1.00 0.00 O ATOM 131 C5' DA A 5 7.897 2.881 -1.819 1.00 0.00 C ATOM 132 C4' DA A 5 6.814 2.292 -2.774 1.00 0.00 C ATOM 133 O4' DA A 5 5.589 1.928 -2.132 1.00 0.00 O ATOM 134 C3' DA A 5 6.534 3.335 -3.821 1.00 0.00 C ATOM 135 O3' DA A 5 6.367 2.956 -5.182 1.00 0.00 O ATOM 136 C2' DA A 5 5.359 3.917 -3.130 1.00 0.00 C ATOM 137 C1' DA A 5 4.581 2.890 -2.388 1.00 0.00 C ATOM 138 N9 DA A 5 4.023 3.440 -1.123 1.00 0.00 N ATOM 139 C8 DA A 5 4.673 4.150 -0.150 1.00 0.00 C ATOM 140 N7 DA A 5 3.946 4.562 0.842 1.00 0.00 N ATOM 141 C5 DA A 5 2.685 4.128 0.466 1.00 0.00 C ATOM 142 C6 DA A 5 1.416 4.312 1.029 1.00 0.00 C ATOM 143 N6 DA A 5 1.238 4.828 2.239 1.00 0.00 N ATOM 144 N1 DA A 5 0.352 4.049 0.268 1.00 0.00 N ATOM 145 C2 DA A 5 0.550 3.516 -0.927 1.00 0.00 C ATOM 146 N3 DA A 5 1.668 3.206 -1.544 1.00 0.00 N ATOM 147 C4 DA A 5 2.714 3.544 -0.774 1.00 0.00 C ATOM 0 H5' DA A 5 7.866 3.970 -1.862 1.00 0.00 H new ATOM 0 H5'' DA A 5 7.670 2.596 -0.792 1.00 0.00 H new ATOM 0 H4' DA A 5 7.209 1.365 -3.189 1.00 0.00 H new ATOM 0 H3' DA A 5 7.371 3.991 -4.059 1.00 0.00 H new ATOM 0 H2' DA A 5 5.692 4.689 -2.437 1.00 0.00 H new ATOM 0 H2'' DA A 5 4.713 4.402 -3.861 1.00 0.00 H new ATOM 0 H1' DA A 5 3.714 2.505 -2.924 1.00 0.00 H new ATOM 0 H8 DA A 5 5.732 4.356 -0.205 1.00 0.00 H new ATOM 0 H61 DA A 5 0.295 4.944 2.610 1.00 0.00 H new ATOM 0 H62 DA A 5 2.044 5.108 2.798 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.350 3.302 -1.484 1.00 0.00 H new ATOM 159 P DC A 6 5.151 2.053 -5.758 1.00 0.00 P ATOM 160 OP1 DC A 6 5.044 0.844 -4.914 1.00 0.00 O ATOM 161 OP2 DC A 6 5.362 1.906 -7.214 1.00 0.00 O ATOM 162 O5' DC A 6 3.823 2.946 -5.535 1.00 0.00 O ATOM 163 C5' DC A 6 3.658 4.222 -6.126 1.00 0.00 C ATOM 164 C4' DC A 6 2.339 4.829 -5.625 1.00 0.00 C ATOM 165 O4' DC A 6 2.264 4.817 -4.201 1.00 0.00 O ATOM 166 C3' DC A 6 2.145 6.301 -6.044 1.00 0.00 C ATOM 167 O3' DC A 6 0.929 6.412 -6.772 1.00 0.00 O ATOM 168 C2' DC A 6 2.079 6.996 -4.683 1.00 0.00 C ATOM 169 C1' DC A 6 1.437 5.909 -3.850 1.00 0.00 C ATOM 170 N1 DC A 6 1.475 6.317 -2.428 1.00 0.00 N ATOM 171 C2 DC A 6 0.282 6.690 -1.804 1.00 0.00 C ATOM 172 O2 DC A 6 -0.809 6.593 -2.363 1.00 0.00 O ATOM 173 N3 DC A 6 0.316 7.178 -0.537 1.00 0.00 N ATOM 174 C4 DC A 6 1.486 7.362 0.075 1.00 0.00 C ATOM 175 N4 DC A 6 1.483 7.737 1.343 1.00 0.00 N ATOM 176 C5 DC A 6 2.717 6.986 -0.539 1.00 0.00 C ATOM 177 C6 DC A 6 2.672 6.458 -1.776 1.00 0.00 C ATOM 0 H5' DC A 6 3.646 4.137 -7.213 1.00 0.00 H new ATOM 0 H5'' DC A 6 4.495 4.870 -5.866 1.00 0.00 H new ATOM 0 H4' DC A 6 1.569 4.206 -6.079 1.00 0.00 H new ATOM 0 H3' DC A 6 2.915 6.721 -6.691 1.00 0.00 H new ATOM 0 H2' DC A 6 3.065 7.275 -4.312 1.00 0.00 H new ATOM 0 H2'' DC A 6 1.479 7.906 -4.711 1.00 0.00 H new ATOM 0 H1' DC A 6 0.384 5.683 -4.015 1.00 0.00 H new ATOM 0 H41 DC A 6 2.365 7.884 1.833 1.00 0.00 H new ATOM 0 H42 DC A 6 0.598 7.879 1.831 1.00 0.00 H new ATOM 0 H5 DC A 6 3.658 7.121 -0.026 1.00 0.00 H new ATOM 0 H6 DC A 6 3.586 6.143 -2.258 1.00 0.00 H new ATOM 189 P DG A 7 0.309 7.830 -7.247 1.00 0.00 P ATOM 190 OP1 DG A 7 -0.284 7.634 -8.587 1.00 0.00 O ATOM 191 OP2 DG A 7 1.338 8.874 -7.053 1.00 0.00 O ATOM 192 O5' DG A 7 -0.897 8.095 -6.194 1.00 0.00 O ATOM 193 C5' DG A 7 -2.094 7.343 -6.272 1.00 0.00 C ATOM 194 C4' DG A 7 -3.249 7.826 -5.376 1.00 0.00 C ATOM 195 O4' DG A 7 -2.830 7.972 -4.030 1.00 0.00 O ATOM 196 C3' DG A 7 -3.848 9.180 -5.775 1.00 0.00 C ATOM 197 O3' DG A 7 -5.189 9.149 -5.284 1.00 0.00 O ATOM 198 C2' DG A 7 -2.926 10.092 -4.970 1.00 0.00 C ATOM 199 C1' DG A 7 -2.976 9.331 -3.645 1.00 0.00 C ATOM 200 N9 DG A 7 -1.916 9.678 -2.686 1.00 0.00 N ATOM 201 C8 DG A 7 -0.581 9.825 -2.933 1.00 0.00 C ATOM 202 N7 DG A 7 0.130 10.074 -1.866 1.00 0.00 N ATOM 203 C5 DG A 7 -0.800 10.020 -0.823 1.00 0.00 C ATOM 204 C6 DG A 7 -0.636 10.124 0.595 1.00 0.00 C ATOM 205 O6 DG A 7 0.360 10.460 1.229 1.00 0.00 O ATOM 206 N1 DG A 7 -1.784 9.789 1.301 1.00 0.00 N ATOM 207 C2 DG A 7 -2.999 9.553 0.719 1.00 0.00 C ATOM 208 N2 DG A 7 -4.031 9.289 1.513 1.00 0.00 N ATOM 209 N3 DG A 7 -3.193 9.550 -0.604 1.00 0.00 N ATOM 210 C4 DG A 7 -2.048 9.738 -1.317 1.00 0.00 C ATOM 0 H5' DG A 7 -1.868 6.308 -6.015 1.00 0.00 H new ATOM 0 H5'' DG A 7 -2.436 7.347 -7.307 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.005 7.050 -5.500 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.900 9.465 -6.826 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.921 10.155 -5.387 1.00 0.00 H new ATOM 0 H2'' DG A 7 -3.302 11.112 -4.889 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.900 9.572 -3.120 1.00 0.00 H new ATOM 0 H8 DG A 7 -0.152 9.743 -3.921 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.717 9.714 2.316 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.951 9.108 1.111 1.00 0.00 H new ATOM 0 H22 DG A 7 -3.903 9.267 2.525 1.00 0.00 H new ATOM 222 P DC A 8 -6.484 9.798 -6.018 1.00 0.00 P ATOM 223 OP1 DC A 8 -7.682 9.177 -5.415 1.00 0.00 O ATOM 224 OP2 DC A 8 -6.270 9.698 -7.477 1.00 0.00 O ATOM 225 O5' DC A 8 -6.508 11.366 -5.614 1.00 0.00 O ATOM 226 C5' DC A 8 -6.014 11.825 -4.373 1.00 0.00 C ATOM 227 C4' DC A 8 -6.907 11.664 -3.140 1.00 0.00 C ATOM 228 O4' DC A 8 -6.134 10.972 -2.171 1.00 0.00 O ATOM 229 C3' DC A 8 -7.308 13.008 -2.508 1.00 0.00 C ATOM 230 O3' DC A 8 -8.620 13.395 -2.859 1.00 0.00 O ATOM 231 C2' DC A 8 -7.203 12.716 -1.022 1.00 0.00 C ATOM 232 C1' DC A 8 -6.062 11.702 -0.956 1.00 0.00 C ATOM 233 N1 DC A 8 -4.721 12.325 -0.704 1.00 0.00 N ATOM 234 C2 DC A 8 -4.344 12.547 0.620 1.00 0.00 C ATOM 235 O2 DC A 8 -5.155 12.418 1.533 1.00 0.00 O ATOM 236 N3 DC A 8 -3.059 12.911 0.908 1.00 0.00 N ATOM 237 C4 DC A 8 -2.173 13.090 -0.078 1.00 0.00 C ATOM 238 N4 DC A 8 -0.917 13.379 0.234 1.00 0.00 N ATOM 239 C5 DC A 8 -2.524 12.885 -1.446 1.00 0.00 C ATOM 240 C6 DC A 8 -3.794 12.505 -1.698 1.00 0.00 C ATOM 0 H5' DC A 8 -5.778 12.884 -4.479 1.00 0.00 H new ATOM 0 H5'' DC A 8 -5.075 11.308 -4.175 1.00 0.00 H new ATOM 0 H4' DC A 8 -7.818 11.148 -3.443 1.00 0.00 H new ATOM 0 H3' DC A 8 -6.682 13.835 -2.842 1.00 0.00 H new ATOM 0 H2' DC A 8 -6.979 13.615 -0.448 1.00 0.00 H new ATOM 0 H2'' DC A 8 -8.131 12.307 -0.624 1.00 0.00 H new ATOM 0 HO3' DC A 8 -8.833 14.252 -2.435 1.00 0.00 H new ATOM 0 H1' DC A 8 -6.175 11.039 -0.098 1.00 0.00 H new ATOM 0 H41 DC A 8 -0.227 13.519 -0.504 1.00 0.00 H new ATOM 0 H42 DC A 8 -0.641 13.461 1.212 1.00 0.00 H new ATOM 0 H5 DC A 8 -1.807 13.027 -2.241 1.00 0.00 H new ATOM 0 H6 DC A 8 -4.092 12.336 -2.722 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 -0.867 13.276 10.920 1.00 0.00 O ATOM 255 C5' DG B 9 -0.480 11.923 10.999 1.00 0.00 C ATOM 256 C4' DG B 9 -1.576 11.063 10.362 1.00 0.00 C ATOM 257 O4' DG B 9 -1.727 11.446 9.008 1.00 0.00 O ATOM 258 C3' DG B 9 -1.188 9.578 10.332 1.00 0.00 C ATOM 259 O3' DG B 9 -2.293 8.722 10.119 1.00 0.00 O ATOM 260 C2' DG B 9 -0.365 9.515 9.050 1.00 0.00 C ATOM 261 C1' DG B 9 -1.245 10.405 8.170 1.00 0.00 C ATOM 262 N9 DG B 9 -0.606 11.013 6.985 1.00 0.00 N ATOM 263 C8 DG B 9 0.704 11.352 6.757 1.00 0.00 C ATOM 264 N7 DG B 9 0.910 11.940 5.612 1.00 0.00 N ATOM 265 C5 DG B 9 -0.358 12.010 5.038 1.00 0.00 C ATOM 266 C6 DG B 9 -0.788 12.535 3.782 1.00 0.00 C ATOM 267 O6 DG B 9 -0.118 13.112 2.930 1.00 0.00 O ATOM 268 N1 DG B 9 -2.141 12.340 3.549 1.00 0.00 N ATOM 269 C2 DG B 9 -3.003 11.775 4.457 1.00 0.00 C ATOM 270 N2 DG B 9 -4.278 11.633 4.116 1.00 0.00 N ATOM 271 N3 DG B 9 -2.623 11.321 5.655 1.00 0.00 N ATOM 272 C4 DG B 9 -1.289 11.455 5.878 1.00 0.00 C ATOM 0 H5' DG B 9 -0.328 11.633 12.039 1.00 0.00 H new ATOM 0 H5'' DG B 9 0.468 11.770 10.484 1.00 0.00 H new ATOM 0 H4' DG B 9 -2.482 11.205 10.951 1.00 0.00 H new ATOM 0 H3' DG B 9 -0.714 9.271 11.264 1.00 0.00 H new ATOM 0 H2' DG B 9 0.644 9.909 9.175 1.00 0.00 H new ATOM 0 H2'' DG B 9 -0.265 8.502 8.661 1.00 0.00 H new ATOM 0 HO5' DG B 9 -1.437 13.408 10.133 1.00 0.00 H new ATOM 0 H1' DG B 9 -2.015 9.757 7.752 1.00 0.00 H new ATOM 0 H8 DG B 9 1.495 11.149 7.464 1.00 0.00 H new ATOM 0 H1 DG B 9 -2.519 12.634 2.648 1.00 0.00 H new ATOM 0 H21 DG B 9 -4.938 11.216 4.772 1.00 0.00 H new ATOM 0 H22 DG B 9 -4.598 11.941 3.197 1.00 0.00 H new ATOM 285 P DC B 10 -3.600 8.710 11.061 1.00 0.00 P ATOM 286 OP1 DC B 10 -4.685 9.430 10.360 1.00 0.00 O ATOM 287 OP2 DC B 10 -3.179 9.157 12.407 1.00 0.00 O ATOM 288 O5' DC B 10 -3.985 7.150 11.149 1.00 0.00 O ATOM 289 C5' DC B 10 -3.716 6.238 10.102 1.00 0.00 C ATOM 290 C4' DC B 10 -4.528 6.496 8.818 1.00 0.00 C ATOM 291 O4' DC B 10 -4.011 7.581 8.026 1.00 0.00 O ATOM 292 C3' DC B 10 -4.438 5.246 7.926 1.00 0.00 C ATOM 293 O3' DC B 10 -5.629 5.167 7.190 1.00 0.00 O ATOM 294 C2' DC B 10 -3.269 5.692 7.073 1.00 0.00 C ATOM 295 C1' DC B 10 -3.709 7.100 6.717 1.00 0.00 C ATOM 296 N1 DC B 10 -2.631 7.803 5.966 1.00 0.00 N ATOM 297 C2 DC B 10 -2.867 8.417 4.731 1.00 0.00 C ATOM 298 O2 DC B 10 -4.005 8.553 4.283 1.00 0.00 O ATOM 299 N3 DC B 10 -1.803 8.881 3.996 1.00 0.00 N ATOM 300 C4 DC B 10 -0.552 8.674 4.432 1.00 0.00 C ATOM 301 N4 DC B 10 0.466 9.213 3.770 1.00 0.00 N ATOM 302 C5 DC B 10 -0.288 7.974 5.648 1.00 0.00 C ATOM 303 C6 DC B 10 -1.354 7.575 6.356 1.00 0.00 C ATOM 0 H5' DC B 10 -3.923 5.227 10.453 1.00 0.00 H new ATOM 0 H5'' DC B 10 -2.654 6.280 9.862 1.00 0.00 H new ATOM 0 H4' DC B 10 -5.542 6.739 9.137 1.00 0.00 H new ATOM 0 H3' DC B 10 -4.312 4.271 8.397 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.327 5.678 7.621 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.135 5.064 6.192 1.00 0.00 H new ATOM 0 H1' DC B 10 -4.551 7.225 6.036 1.00 0.00 H new ATOM 0 H41 DC B 10 1.422 9.062 4.093 1.00 0.00 H new ATOM 0 H42 DC B 10 0.292 9.778 2.939 1.00 0.00 H new ATOM 0 H5 DC B 10 0.720 7.776 5.981 1.00 0.00 H new ATOM 0 H6 DC B 10 -1.187 7.046 7.283 1.00 0.00 H new ATOM 315 P DG B 11 -6.867 4.265 7.645 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.785 5.092 8.456 1.00 0.00 O ATOM 317 OP2 DG B 11 -6.351 2.981 8.166 1.00 0.00 O ATOM 318 O5' DG B 11 -7.473 4.047 6.184 1.00 0.00 O ATOM 319 C5' DG B 11 -8.094 5.131 5.523 1.00 0.00 C ATOM 320 C4' DG B 11 -8.279 4.868 4.023 1.00 0.00 C ATOM 321 O4' DG B 11 -7.214 5.489 3.328 1.00 0.00 O ATOM 322 C3' DG B 11 -8.293 3.382 3.638 1.00 0.00 C ATOM 323 O3' DG B 11 -9.315 3.178 2.682 1.00 0.00 O ATOM 324 C2' DG B 11 -6.872 3.170 3.120 1.00 0.00 C ATOM 325 C1' DG B 11 -6.478 4.546 2.578 1.00 0.00 C ATOM 326 N9 DG B 11 -5.046 4.854 2.760 1.00 0.00 N ATOM 327 C8 DG B 11 -4.305 4.709 3.904 1.00 0.00 C ATOM 328 N7 DG B 11 -3.110 5.213 3.830 1.00 0.00 N ATOM 329 C5 DG B 11 -3.036 5.708 2.539 1.00 0.00 C ATOM 330 C6 DG B 11 -1.941 6.313 1.867 1.00 0.00 C ATOM 331 O6 DG B 11 -0.848 6.616 2.334 1.00 0.00 O ATOM 332 N1 DG B 11 -2.203 6.559 0.535 1.00 0.00 N ATOM 333 C2 DG B 11 -3.416 6.344 -0.070 1.00 0.00 C ATOM 334 N2 DG B 11 -3.502 6.602 -1.370 1.00 0.00 N ATOM 335 N3 DG B 11 -4.469 5.801 0.561 1.00 0.00 N ATOM 336 C4 DG B 11 -4.209 5.488 1.862 1.00 0.00 C ATOM 0 H5' DG B 11 -7.493 6.030 5.661 1.00 0.00 H new ATOM 0 H5'' DG B 11 -9.065 5.323 5.979 1.00 0.00 H new ATOM 0 H4' DG B 11 -9.255 5.272 3.756 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.518 2.670 4.432 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.200 2.844 3.914 1.00 0.00 H new ATOM 0 H2'' DG B 11 -6.838 2.408 2.342 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.681 4.570 1.507 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.682 4.219 4.789 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.444 6.926 -0.039 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.384 6.457 -1.861 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.686 6.945 -1.877 1.00 0.00 H new ATOM 348 P DT B 12 -9.703 1.712 2.137 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.080 1.770 1.602 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.356 0.719 3.177 1.00 0.00 O ATOM 351 O5' DT B 12 -8.688 1.557 0.906 1.00 0.00 O ATOM 352 C5' DT B 12 -8.809 2.399 -0.219 1.00 0.00 C ATOM 353 C4' DT B 12 -7.600 2.250 -1.139 1.00 0.00 C ATOM 354 O4' DT B 12 -6.392 2.591 -0.499 1.00 0.00 O ATOM 355 C3' DT B 12 -7.378 0.813 -1.640 1.00 0.00 C ATOM 356 O3' DT B 12 -8.089 0.513 -2.839 1.00 0.00 O ATOM 357 C2' DT B 12 -5.850 0.670 -1.688 1.00 0.00 C ATOM 358 C1' DT B 12 -5.367 2.072 -1.325 1.00 0.00 C ATOM 359 N1 DT B 12 -4.084 2.123 -0.595 1.00 0.00 N ATOM 360 C2 DT B 12 -3.169 3.145 -0.767 1.00 0.00 C ATOM 361 O2 DT B 12 -3.143 3.844 -1.773 1.00 0.00 O ATOM 362 N3 DT B 12 -2.273 3.345 0.262 1.00 0.00 N ATOM 363 C4 DT B 12 -2.165 2.619 1.420 1.00 0.00 C ATOM 364 O4 DT B 12 -1.480 3.028 2.353 1.00 0.00 O ATOM 365 C5 DT B 12 -2.907 1.294 1.532 1.00 0.00 C ATOM 366 C7 DT B 12 -3.787 1.197 2.783 1.00 0.00 C ATOM 367 C6 DT B 12 -3.827 1.037 0.356 1.00 0.00 C ATOM 0 H5' DT B 12 -8.900 3.436 0.105 1.00 0.00 H new ATOM 0 H5'' DT B 12 -9.720 2.155 -0.765 1.00 0.00 H new ATOM 0 H4' DT B 12 -7.837 2.921 -1.964 1.00 0.00 H new ATOM 0 H3' DT B 12 -7.802 0.054 -0.983 1.00 0.00 H new ATOM 0 H2' DT B 12 -5.491 -0.077 -0.980 1.00 0.00 H new ATOM 0 H2'' DT B 12 -5.503 0.366 -2.676 1.00 0.00 H new ATOM 0 H1' DT B 12 -5.180 2.635 -2.239 1.00 0.00 H new ATOM 0 H3 DT B 12 -1.618 4.119 0.149 1.00 0.00 H new ATOM 0 H71 DT B 12 -4.643 0.554 2.577 1.00 0.00 H new ATOM 0 H72 DT B 12 -3.207 0.776 3.604 1.00 0.00 H new ATOM 0 H73 DT B 12 -4.138 2.191 3.059 1.00 0.00 H new ATOM 0 H6 DT B 12 -4.286 0.069 0.220 1.00 0.00 H new ATOM 380 P DA B 13 -7.814 1.166 -4.309 1.00 0.00 P ATOM 381 OP1 DA B 13 -7.496 2.603 -4.174 1.00 0.00 O ATOM 382 OP2 DA B 13 -8.934 0.755 -5.182 1.00 0.00 O ATOM 383 O5' DA B 13 -6.490 0.421 -4.813 1.00 0.00 O ATOM 384 C5' DA B 13 -6.510 -0.962 -5.062 1.00 0.00 C ATOM 385 C4' DA B 13 -5.125 -1.416 -5.516 1.00 0.00 C ATOM 386 O4' DA B 13 -4.184 -1.400 -4.455 1.00 0.00 O ATOM 387 C3' DA B 13 -5.229 -2.859 -6.006 1.00 0.00 C ATOM 388 O3' DA B 13 -4.332 -3.121 -7.060 1.00 0.00 O ATOM 389 C2' DA B 13 -4.769 -3.576 -4.754 1.00 0.00 C ATOM 390 C1' DA B 13 -3.604 -2.685 -4.321 1.00 0.00 C ATOM 391 N9 DA B 13 -3.197 -2.922 -2.919 1.00 0.00 N ATOM 392 C8 DA B 13 -4.019 -2.896 -1.829 1.00 0.00 C ATOM 393 N7 DA B 13 -3.463 -3.323 -0.728 1.00 0.00 N ATOM 394 C5 DA B 13 -2.124 -3.462 -1.085 1.00 0.00 C ATOM 395 C6 DA B 13 -0.959 -3.701 -0.331 1.00 0.00 C ATOM 396 N6 DA B 13 -0.979 -4.023 0.960 1.00 0.00 N ATOM 397 N1 DA B 13 0.235 -3.460 -0.886 1.00 0.00 N ATOM 398 C2 DA B 13 0.282 -3.124 -2.167 1.00 0.00 C ATOM 399 N3 DA B 13 -0.728 -2.956 -3.021 1.00 0.00 N ATOM 400 C4 DA B 13 -1.930 -3.121 -2.401 1.00 0.00 C ATOM 0 H5' DA B 13 -7.250 -1.194 -5.828 1.00 0.00 H new ATOM 0 H5'' DA B 13 -6.804 -1.501 -4.161 1.00 0.00 H new ATOM 0 H4' DA B 13 -4.790 -0.732 -6.295 1.00 0.00 H new ATOM 0 H3' DA B 13 -6.209 -3.136 -6.394 1.00 0.00 H new ATOM 0 H2' DA B 13 -5.552 -3.628 -3.997 1.00 0.00 H new ATOM 0 H2'' DA B 13 -4.453 -4.599 -4.957 1.00 0.00 H new ATOM 0 H1' DA B 13 -2.695 -2.852 -4.899 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.042 -2.552 -1.874 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.104 -4.186 1.459 1.00 0.00 H new ATOM 0 H62 DA B 13 -1.869 -4.107 1.451 1.00 0.00 H new ATOM 0 H2 DA B 13 1.270 -2.965 -2.573 1.00 0.00 H new ATOM 412 P DC B 14 -4.694 -2.755 -8.581 1.00 0.00 P ATOM 413 OP1 DC B 14 -4.888 -1.292 -8.672 1.00 0.00 O ATOM 414 OP2 DC B 14 -5.780 -3.661 -9.011 1.00 0.00 O ATOM 415 O5' DC B 14 -3.351 -3.151 -9.371 1.00 0.00 O ATOM 416 C5' DC B 14 -2.900 -4.489 -9.429 1.00 0.00 C ATOM 417 C4' DC B 14 -1.634 -4.671 -8.582 1.00 0.00 C ATOM 418 O4' DC B 14 -1.885 -4.610 -7.175 1.00 0.00 O ATOM 419 C3' DC B 14 -1.029 -6.057 -8.865 1.00 0.00 C ATOM 420 O3' DC B 14 0.355 -5.889 -9.136 1.00 0.00 O ATOM 421 C2' DC B 14 -1.289 -6.739 -7.527 1.00 0.00 C ATOM 422 C1' DC B 14 -1.045 -5.585 -6.573 1.00 0.00 C ATOM 423 N1 DC B 14 -1.378 -5.951 -5.166 1.00 0.00 N ATOM 424 C2 DC B 14 -0.340 -6.089 -4.247 1.00 0.00 C ATOM 425 O2 DC B 14 0.838 -5.983 -4.583 1.00 0.00 O ATOM 426 N3 DC B 14 -0.635 -6.351 -2.946 1.00 0.00 N ATOM 427 C4 DC B 14 -1.891 -6.603 -2.571 1.00 0.00 C ATOM 428 N4 DC B 14 -2.137 -6.821 -1.287 1.00 0.00 N ATOM 429 C5 DC B 14 -2.965 -6.589 -3.510 1.00 0.00 C ATOM 430 C6 DC B 14 -2.654 -6.270 -4.787 1.00 0.00 C ATOM 0 H5' DC B 14 -2.694 -4.764 -10.463 1.00 0.00 H new ATOM 0 H5'' DC B 14 -3.683 -5.158 -9.071 1.00 0.00 H new ATOM 0 H4' DC B 14 -0.964 -3.856 -8.855 1.00 0.00 H new ATOM 0 H3' DC B 14 -1.429 -6.613 -9.713 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.303 -7.131 -7.452 1.00 0.00 H new ATOM 0 H2'' DC B 14 -0.611 -7.574 -7.349 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.015 -5.247 -6.458 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.089 -7.016 -0.976 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.375 -6.794 -0.610 1.00 0.00 H new ATOM 0 H5 DC B 14 -3.978 -6.822 -3.215 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.437 -6.267 -5.531 1.00 0.00 H new ATOM 442 P DG B 15 1.215 -6.889 -10.075 1.00 0.00 P ATOM 443 OP1 DG B 15 2.406 -6.142 -10.531 1.00 0.00 O ATOM 444 OP2 DG B 15 0.302 -7.482 -11.075 1.00 0.00 O ATOM 445 O5' DG B 15 1.722 -8.070 -9.098 1.00 0.00 O ATOM 446 C5' DG B 15 2.316 -7.783 -7.848 1.00 0.00 C ATOM 447 C4' DG B 15 3.279 -8.888 -7.378 1.00 0.00 C ATOM 448 O4' DG B 15 3.200 -8.917 -5.967 1.00 0.00 O ATOM 449 C3' DG B 15 2.992 -10.330 -7.834 1.00 0.00 C ATOM 450 O3' DG B 15 4.130 -11.112 -7.468 1.00 0.00 O ATOM 451 C2' DG B 15 1.779 -10.508 -6.936 1.00 0.00 C ATOM 452 C1' DG B 15 2.405 -10.031 -5.623 1.00 0.00 C ATOM 453 N9 DG B 15 1.431 -9.713 -4.578 1.00 0.00 N ATOM 454 C8 DG B 15 0.097 -9.527 -4.716 1.00 0.00 C ATOM 455 N7 DG B 15 -0.544 -9.348 -3.594 1.00 0.00 N ATOM 456 C5 DG B 15 0.467 -9.411 -2.629 1.00 0.00 C ATOM 457 C6 DG B 15 0.428 -9.313 -1.202 1.00 0.00 C ATOM 458 O6 DG B 15 -0.542 -9.135 -0.468 1.00 0.00 O ATOM 459 N1 DG B 15 1.685 -9.443 -0.627 1.00 0.00 N ATOM 460 C2 DG B 15 2.831 -9.737 -1.324 1.00 0.00 C ATOM 461 N2 DG B 15 3.953 -9.981 -0.663 1.00 0.00 N ATOM 462 N3 DG B 15 2.872 -9.879 -2.645 1.00 0.00 N ATOM 463 C4 DG B 15 1.672 -9.665 -3.235 1.00 0.00 C ATOM 0 H5' DG B 15 1.533 -7.648 -7.101 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.858 -6.840 -7.916 1.00 0.00 H new ATOM 0 H4' DG B 15 4.241 -8.623 -7.817 1.00 0.00 H new ATOM 0 H3' DG B 15 2.823 -10.579 -8.881 1.00 0.00 H new ATOM 0 H2' DG B 15 0.929 -9.900 -7.246 1.00 0.00 H new ATOM 0 H2'' DG B 15 1.433 -11.541 -6.890 1.00 0.00 H new ATOM 0 H1' DG B 15 2.994 -10.832 -5.176 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.396 -9.527 -5.677 1.00 0.00 H new ATOM 0 H1 DG B 15 1.762 -9.311 0.381 1.00 0.00 H new ATOM 0 H21 DG B 15 4.808 -10.200 -1.174 1.00 0.00 H new ATOM 0 H22 DG B 15 3.961 -9.950 0.356 1.00 0.00 H new ATOM 475 P DC B 16 4.630 -12.458 -8.227 1.00 0.00 P ATOM 476 OP1 DC B 16 6.068 -12.617 -7.921 1.00 0.00 O ATOM 477 OP2 DC B 16 4.196 -12.369 -9.638 1.00 0.00 O ATOM 478 O5' DC B 16 3.864 -13.715 -7.544 1.00 0.00 O ATOM 479 C5' DC B 16 3.397 -13.673 -6.211 1.00 0.00 C ATOM 480 C4' DC B 16 4.447 -13.760 -5.099 1.00 0.00 C ATOM 481 O4' DC B 16 4.116 -12.734 -4.186 1.00 0.00 O ATOM 482 C3' DC B 16 4.416 -15.094 -4.330 1.00 0.00 C ATOM 483 O3' DC B 16 5.555 -15.883 -4.606 1.00 0.00 O ATOM 484 C2' DC B 16 4.398 -14.672 -2.869 1.00 0.00 C ATOM 485 C1' DC B 16 3.864 -13.242 -2.891 1.00 0.00 C ATOM 486 N1 DC B 16 2.437 -13.105 -2.458 1.00 0.00 N ATOM 487 C2 DC B 16 2.171 -12.932 -1.097 1.00 0.00 C ATOM 488 O2 DC B 16 3.061 -13.028 -0.254 1.00 0.00 O ATOM 489 N3 DC B 16 0.899 -12.648 -0.691 1.00 0.00 N ATOM 490 C4 DC B 16 -0.091 -12.547 -1.585 1.00 0.00 C ATOM 491 N4 DC B 16 -1.304 -12.218 -1.169 1.00 0.00 N ATOM 492 C5 DC B 16 0.151 -12.686 -2.984 1.00 0.00 C ATOM 493 C6 DC B 16 1.416 -12.960 -3.361 1.00 0.00 C ATOM 0 H5' DC B 16 2.691 -14.492 -6.074 1.00 0.00 H new ATOM 0 H5'' DC B 16 2.839 -12.746 -6.077 1.00 0.00 H new ATOM 0 H4' DC B 16 5.439 -13.672 -5.542 1.00 0.00 H new ATOM 0 H3' DC B 16 3.560 -15.709 -4.609 1.00 0.00 H new ATOM 0 H2' DC B 16 3.759 -15.325 -2.275 1.00 0.00 H new ATOM 0 H2'' DC B 16 5.395 -14.717 -2.431 1.00 0.00 H new ATOM 0 HO3' DC B 16 5.503 -16.721 -4.100 1.00 0.00 H new ATOM 0 H1' DC B 16 4.384 -12.647 -2.141 1.00 0.00 H new ATOM 0 H41 DC B 16 -2.069 -12.137 -1.839 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.474 -12.045 -0.178 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.643 -12.577 -3.708 1.00 0.00 H new ATOM 0 H6 DC B 16 1.633 -13.069 -4.413 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO B 1 -1.010 0.197 -1.598 1.00 0.00 O HETATM 508 C2 PSO B 1 -2.260 0.098 -1.493 1.00 0.00 C HETATM 509 C3 PSO B 1 -2.986 -0.107 -0.173 1.00 0.00 C HETATM 510 C4 PSO B 1 -2.140 0.046 1.048 1.00 0.00 C HETATM 511 C5 PSO B 1 0.086 0.456 1.839 1.00 0.00 C HETATM 512 C6 PSO B 1 1.462 0.661 1.605 1.00 0.00 C HETATM 513 C7 PSO B 1 1.944 0.633 0.344 1.00 0.00 C HETATM 514 C8 PSO B 1 1.097 0.273 -0.710 1.00 0.00 C HETATM 515 C9 PSO B 1 -0.305 0.273 -0.540 1.00 0.00 C HETATM 516 C10 PSO B 1 -0.793 0.289 0.761 1.00 0.00 C HETATM 517 C4' PSO B 1 2.598 0.371 2.539 1.00 0.00 C HETATM 518 C5' PSO B 1 3.748 0.623 1.574 1.00 0.00 C HETATM 519 O6' PSO B 1 3.199 0.699 0.249 1.00 0.00 O HETATM 520 O11 PSO B 1 -2.924 0.171 -2.520 1.00 0.00 O HETATM 521 C12 PSO B 1 -2.339 -1.089 2.061 1.00 0.00 C HETATM 522 C13 PSO B 1 2.588 1.161 3.855 1.00 0.00 C HETATM 523 O14 PSO B 1 2.165 2.503 3.760 1.00 0.00 O HETATM 524 C15 PSO B 1 4.504 1.850 2.077 1.00 0.00 C HETATM 525 C16 PSO B 1 1.725 -0.126 -2.020 1.00 0.00 C HETATM 0 H163 PSO B 1 2.319 0.702 -2.406 1.00 0.00 H new HETATM 0 H162 PSO B 1 2.368 -0.993 -1.866 1.00 0.00 H new HETATM 0 H161 PSO B 1 0.943 -0.377 -2.737 1.00 0.00 H new HETATM 0 H153 PSO B 1 3.831 2.707 2.101 1.00 0.00 H new HETATM 0 H152 PSO B 1 4.883 1.658 3.081 1.00 0.00 H new HETATM 0 H151 PSO B 1 5.338 2.063 1.409 1.00 0.00 H new HETATM 0 H132 PSO B 1 1.940 0.644 4.563 1.00 0.00 H new HETATM 0 H131 PSO B 1 3.594 1.145 4.274 1.00 0.00 H new HETATM 0 H123 PSO B 1 -3.381 -1.113 2.381 1.00 0.00 H new HETATM 0 H122 PSO B 1 -2.081 -2.041 1.597 1.00 0.00 H new HETATM 0 H121 PSO B 1 -1.697 -0.921 2.926 1.00 0.00 H new HETATM 0 H5 PSO B 1 -0.294 0.427 2.860 1.00 0.00 H new HETATM 0 H14 PSO B 1 2.192 2.918 4.647 1.00 0.00 H new