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= 0.062 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.34 (180deg=-1.34) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : B 1 PSO O14 : rot 180:sc= -0.642 USER MOD Single : B 9 DG O5' : rot -31:sc= 0.0166 USER MOD Single : B 12 DT C7 :methyl 150:sc= -1.75 (180deg=-1.75) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 1.240 -12.331 9.491 1.00 0.00 O ATOM 2 C5' DG A 1 2.556 -12.838 9.523 1.00 0.00 C ATOM 3 C4' DG A 1 3.388 -12.212 8.399 1.00 0.00 C ATOM 4 O4' DG A 1 2.704 -12.388 7.166 1.00 0.00 O ATOM 5 C3' DG A 1 3.610 -10.705 8.593 1.00 0.00 C ATOM 6 O3' DG A 1 4.953 -10.418 8.245 1.00 0.00 O ATOM 7 C2' DG A 1 2.596 -10.114 7.616 1.00 0.00 C ATOM 8 C1' DG A 1 2.637 -11.145 6.491 1.00 0.00 C ATOM 9 N9 DG A 1 1.465 -11.126 5.583 1.00 0.00 N ATOM 10 C8 DG A 1 0.159 -10.796 5.851 1.00 0.00 C ATOM 11 N7 DG A 1 -0.652 -10.955 4.844 1.00 0.00 N ATOM 12 C5 DG A 1 0.167 -11.441 3.829 1.00 0.00 C ATOM 13 C6 DG A 1 -0.139 -11.799 2.480 1.00 0.00 C ATOM 14 O6 DG A 1 -1.219 -11.729 1.898 1.00 0.00 O ATOM 15 N1 DG A 1 0.961 -12.282 1.790 1.00 0.00 N ATOM 16 C2 DG A 1 2.224 -12.374 2.320 1.00 0.00 C ATOM 17 N2 DG A 1 3.186 -12.886 1.562 1.00 0.00 N ATOM 18 N3 DG A 1 2.536 -11.994 3.564 1.00 0.00 N ATOM 19 C4 DG A 1 1.463 -11.550 4.272 1.00 0.00 C ATOM 0 H5' DG A 1 2.539 -13.922 9.413 1.00 0.00 H new ATOM 0 H5'' DG A 1 3.014 -12.622 10.488 1.00 0.00 H new ATOM 0 H4' DG A 1 4.359 -12.707 8.408 1.00 0.00 H new ATOM 0 H3' DG A 1 3.471 -10.315 9.601 1.00 0.00 H new ATOM 0 H2' DG A 1 1.603 -10.024 8.057 1.00 0.00 H new ATOM 0 H2'' DG A 1 2.884 -9.120 7.274 1.00 0.00 H new ATOM 0 HO5' DG A 1 1.014 -12.064 8.575 1.00 0.00 H new ATOM 0 H1' DG A 1 3.480 -10.937 5.832 1.00 0.00 H new ATOM 0 H8 DG A 1 -0.168 -10.435 6.815 1.00 0.00 H new ATOM 0 H1 DG A 1 0.824 -12.589 0.827 1.00 0.00 H new ATOM 0 H21 DG A 1 4.135 -12.967 1.928 1.00 0.00 H new ATOM 0 H22 DG A 1 2.976 -13.198 0.614 1.00 0.00 H new ATOM 32 P DC A 2 5.623 -8.964 8.443 1.00 0.00 P ATOM 33 OP1 DC A 2 6.898 -9.140 9.172 1.00 0.00 O ATOM 34 OP2 DC A 2 4.594 -8.041 8.968 1.00 0.00 O ATOM 35 O5' DC A 2 5.956 -8.551 6.926 1.00 0.00 O ATOM 36 C5' DC A 2 7.006 -9.180 6.216 1.00 0.00 C ATOM 37 C4' DC A 2 6.856 -8.888 4.721 1.00 0.00 C ATOM 38 O4' DC A 2 5.598 -9.382 4.300 1.00 0.00 O ATOM 39 C3' DC A 2 6.863 -7.379 4.413 1.00 0.00 C ATOM 40 O3' DC A 2 7.546 -7.033 3.220 1.00 0.00 O ATOM 41 C2' DC A 2 5.412 -7.076 4.142 1.00 0.00 C ATOM 42 C1' DC A 2 5.013 -8.387 3.495 1.00 0.00 C ATOM 43 N1 DC A 2 3.552 -8.538 3.390 1.00 0.00 N ATOM 44 C2 DC A 2 3.038 -9.003 2.195 1.00 0.00 C ATOM 45 O2 DC A 2 3.767 -9.452 1.318 1.00 0.00 O ATOM 46 N3 DC A 2 1.702 -8.963 1.987 1.00 0.00 N ATOM 47 C4 DC A 2 0.889 -8.483 2.928 1.00 0.00 C ATOM 48 N4 DC A 2 -0.403 -8.484 2.631 1.00 0.00 N ATOM 49 C5 DC A 2 1.382 -8.102 4.223 1.00 0.00 C ATOM 50 C6 DC A 2 2.726 -8.148 4.402 1.00 0.00 C ATOM 0 H5' DC A 2 6.985 -10.256 6.391 1.00 0.00 H new ATOM 0 H5'' DC A 2 7.970 -8.817 6.574 1.00 0.00 H new ATOM 0 H4' DC A 2 7.696 -9.358 4.209 1.00 0.00 H new ATOM 0 H3' DC A 2 7.347 -6.846 5.232 1.00 0.00 H new ATOM 0 H2' DC A 2 4.849 -6.867 5.051 1.00 0.00 H new ATOM 0 H2'' DC A 2 5.277 -6.221 3.479 1.00 0.00 H new ATOM 0 H1' DC A 2 5.361 -8.449 2.464 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.082 -8.131 3.306 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.718 -8.838 1.728 1.00 0.00 H new ATOM 0 H5 DC A 2 0.715 -7.794 5.015 1.00 0.00 H new ATOM 0 H6 DC A 2 3.147 -7.872 5.358 1.00 0.00 H new ATOM 62 P DG A 3 9.126 -7.233 3.014 1.00 0.00 P ATOM 63 OP1 DG A 3 9.321 -8.334 2.047 1.00 0.00 O ATOM 64 OP2 DG A 3 9.735 -7.323 4.358 1.00 0.00 O ATOM 65 O5' DG A 3 9.601 -5.846 2.328 1.00 0.00 O ATOM 66 C5' DG A 3 9.085 -5.374 1.089 1.00 0.00 C ATOM 67 C4' DG A 3 7.840 -4.472 1.229 1.00 0.00 C ATOM 68 O4' DG A 3 6.618 -5.128 0.968 1.00 0.00 O ATOM 69 C3' DG A 3 7.639 -3.839 2.588 1.00 0.00 C ATOM 70 O3' DG A 3 8.571 -2.822 2.840 1.00 0.00 O ATOM 71 C2' DG A 3 6.130 -3.615 2.685 1.00 0.00 C ATOM 72 C1' DG A 3 5.598 -4.222 1.362 1.00 0.00 C ATOM 73 N9 DG A 3 4.290 -4.865 1.529 1.00 0.00 N ATOM 74 C8 DG A 3 3.421 -4.564 2.517 1.00 0.00 C ATOM 75 N7 DG A 3 2.227 -5.058 2.388 1.00 0.00 N ATOM 76 C5 DG A 3 2.293 -5.682 1.146 1.00 0.00 C ATOM 77 C6 DG A 3 1.249 -6.221 0.343 1.00 0.00 C ATOM 78 O6 DG A 3 0.080 -6.427 0.654 1.00 0.00 O ATOM 79 N1 DG A 3 1.672 -6.526 -0.937 1.00 0.00 N ATOM 80 C2 DG A 3 2.975 -6.474 -1.360 1.00 0.00 C ATOM 81 N2 DG A 3 3.243 -6.837 -2.609 1.00 0.00 N ATOM 82 N3 DG A 3 3.968 -5.976 -0.619 1.00 0.00 N ATOM 83 C4 DG A 3 3.553 -5.564 0.606 1.00 0.00 C ATOM 0 H5' DG A 3 8.832 -6.230 0.463 1.00 0.00 H new ATOM 0 H5'' DG A 3 9.866 -4.819 0.570 1.00 0.00 H new ATOM 0 H4' DG A 3 8.071 -3.714 0.480 1.00 0.00 H new ATOM 0 H3' DG A 3 7.891 -4.442 3.460 1.00 0.00 H new ATOM 0 H2' DG A 3 5.704 -4.112 3.556 1.00 0.00 H new ATOM 0 H2'' DG A 3 5.884 -2.556 2.770 1.00 0.00 H new ATOM 0 H1' DG A 3 5.410 -3.466 0.600 1.00 0.00 H new ATOM 0 H8 DG A 3 3.701 -3.951 3.361 1.00 0.00 H new ATOM 0 H1 DG A 3 0.965 -6.810 -1.615 1.00 0.00 H new ATOM 0 H21 DG A 3 4.203 -6.809 -2.953 1.00 0.00 H new ATOM 0 H22 DG A 3 2.489 -7.144 -3.224 1.00 0.00 H new ATOM 95 P DT A 4 8.740 -2.191 4.303 1.00 0.00 P ATOM 96 OP1 DT A 4 10.091 -1.599 4.396 1.00 0.00 O ATOM 97 OP2 DT A 4 8.292 -3.183 5.306 1.00 0.00 O ATOM 98 O5' DT A 4 7.665 -1.017 4.194 1.00 0.00 O ATOM 99 C5' DT A 4 7.877 0.053 3.305 1.00 0.00 C ATOM 100 C4' DT A 4 7.839 -0.363 1.799 1.00 0.00 C ATOM 101 O4' DT A 4 6.859 -1.320 1.304 1.00 0.00 O ATOM 102 C3' DT A 4 7.488 0.843 0.945 1.00 0.00 C ATOM 103 O3' DT A 4 7.983 0.526 -0.335 1.00 0.00 O ATOM 104 C2' DT A 4 6.018 0.635 1.038 1.00 0.00 C ATOM 105 C1' DT A 4 5.700 -0.735 0.662 1.00 0.00 C ATOM 106 N1 DT A 4 4.378 -1.130 1.284 1.00 0.00 N ATOM 107 C2 DT A 4 3.428 -1.825 0.537 1.00 0.00 C ATOM 108 O2 DT A 4 3.630 -2.140 -0.629 1.00 0.00 O ATOM 109 N3 DT A 4 2.237 -2.160 1.147 1.00 0.00 N ATOM 110 C4 DT A 4 1.816 -1.823 2.413 1.00 0.00 C ATOM 111 O4 DT A 4 0.789 -2.318 2.869 1.00 0.00 O ATOM 112 C5 DT A 4 2.648 -0.828 3.232 1.00 0.00 C ATOM 113 C7 DT A 4 2.879 -1.261 4.680 1.00 0.00 C ATOM 114 C6 DT A 4 3.969 -0.445 2.560 1.00 0.00 C ATOM 0 H5' DT A 4 8.843 0.508 3.523 1.00 0.00 H new ATOM 0 H5'' DT A 4 7.118 0.816 3.481 1.00 0.00 H new ATOM 0 H4' DT A 4 8.828 -0.816 1.730 1.00 0.00 H new ATOM 0 H3' DT A 4 7.839 1.845 1.191 1.00 0.00 H new ATOM 0 H2' DT A 4 5.675 0.834 2.053 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.498 1.334 0.383 1.00 0.00 H new ATOM 0 H1' DT A 4 5.563 -0.996 -0.388 1.00 0.00 H new ATOM 0 H3 DT A 4 1.592 -2.724 0.594 1.00 0.00 H new ATOM 0 H71 DT A 4 3.832 -0.865 5.031 1.00 0.00 H new ATOM 0 H72 DT A 4 2.074 -0.878 5.307 1.00 0.00 H new ATOM 0 H73 DT A 4 2.896 -2.349 4.736 1.00 0.00 H new ATOM 0 H6 DT A 4 4.603 0.311 2.999 1.00 0.00 H new ATOM 127 P DA A 5 9.549 0.435 -0.655 1.00 0.00 P ATOM 128 OP1 DA A 5 9.858 -0.931 -1.128 1.00 0.00 O ATOM 129 OP2 DA A 5 10.285 1.019 0.488 1.00 0.00 O ATOM 130 O5' DA A 5 9.563 1.459 -1.854 1.00 0.00 O ATOM 131 C5' DA A 5 8.799 2.630 -1.742 1.00 0.00 C ATOM 132 C4' DA A 5 7.434 2.491 -2.425 1.00 0.00 C ATOM 133 O4' DA A 5 6.349 2.124 -1.575 1.00 0.00 O ATOM 134 C3' DA A 5 7.159 3.883 -2.947 1.00 0.00 C ATOM 135 O3' DA A 5 7.382 4.125 -4.334 1.00 0.00 O ATOM 136 C2' DA A 5 5.746 4.051 -2.519 1.00 0.00 C ATOM 137 C1' DA A 5 5.164 2.816 -1.935 1.00 0.00 C ATOM 138 N9 DA A 5 4.392 3.220 -0.723 1.00 0.00 N ATOM 139 C8 DA A 5 4.957 3.873 0.342 1.00 0.00 C ATOM 140 N7 DA A 5 4.127 4.447 1.156 1.00 0.00 N ATOM 141 C5 DA A 5 2.898 4.094 0.614 1.00 0.00 C ATOM 142 C6 DA A 5 1.574 4.312 1.025 1.00 0.00 C ATOM 143 N6 DA A 5 1.265 4.791 2.223 1.00 0.00 N ATOM 144 N1 DA A 5 0.588 4.057 0.161 1.00 0.00 N ATOM 145 C2 DA A 5 0.907 3.550 -1.020 1.00 0.00 C ATOM 146 N3 DA A 5 2.092 3.230 -1.510 1.00 0.00 N ATOM 147 C4 DA A 5 3.059 3.506 -0.613 1.00 0.00 C ATOM 0 H5' DA A 5 9.344 3.463 -2.187 1.00 0.00 H new ATOM 0 H5'' DA A 5 8.655 2.870 -0.689 1.00 0.00 H new ATOM 0 H4' DA A 5 7.489 1.691 -3.163 1.00 0.00 H new ATOM 0 H3' DA A 5 7.864 4.617 -2.556 1.00 0.00 H new ATOM 0 H2' DA A 5 5.688 4.855 -1.785 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.147 4.358 -3.376 1.00 0.00 H new ATOM 0 H1' DA A 5 4.494 2.236 -2.570 1.00 0.00 H new ATOM 0 H8 DA A 5 6.026 3.907 0.493 1.00 0.00 H new ATOM 0 H61 DA A 5 0.288 4.933 2.479 1.00 0.00 H new ATOM 0 H62 DA A 5 2.005 5.017 2.888 1.00 0.00 H new ATOM 0 H2 DA A 5 0.073 3.371 -1.683 1.00 0.00 H new ATOM 159 P DC A 6 6.590 3.385 -5.557 1.00 0.00 P ATOM 160 OP1 DC A 6 6.710 1.922 -5.381 1.00 0.00 O ATOM 161 OP2 DC A 6 7.072 3.996 -6.814 1.00 0.00 O ATOM 162 O5' DC A 6 5.030 3.774 -5.388 1.00 0.00 O ATOM 163 C5' DC A 6 4.557 5.062 -5.729 1.00 0.00 C ATOM 164 C4' DC A 6 3.051 5.194 -5.458 1.00 0.00 C ATOM 165 O4' DC A 6 2.741 5.052 -4.067 1.00 0.00 O ATOM 166 C3' DC A 6 2.595 6.604 -5.869 1.00 0.00 C ATOM 167 O3' DC A 6 1.364 6.542 -6.571 1.00 0.00 O ATOM 168 C2' DC A 6 2.447 7.228 -4.491 1.00 0.00 C ATOM 169 C1' DC A 6 1.826 6.084 -3.723 1.00 0.00 C ATOM 170 N1 DC A 6 1.773 6.455 -2.286 1.00 0.00 N ATOM 171 C2 DC A 6 0.547 6.765 -1.693 1.00 0.00 C ATOM 172 O2 DC A 6 -0.512 6.668 -2.310 1.00 0.00 O ATOM 173 N3 DC A 6 0.523 7.186 -0.397 1.00 0.00 N ATOM 174 C4 DC A 6 1.662 7.342 0.284 1.00 0.00 C ATOM 175 N4 DC A 6 1.601 7.703 1.557 1.00 0.00 N ATOM 176 C5 DC A 6 2.924 7.003 -0.294 1.00 0.00 C ATOM 177 C6 DC A 6 2.926 6.581 -1.567 1.00 0.00 C ATOM 0 H5' DC A 6 4.758 5.258 -6.782 1.00 0.00 H new ATOM 0 H5'' DC A 6 5.099 5.814 -5.156 1.00 0.00 H new ATOM 0 H4' DC A 6 2.549 4.409 -6.024 1.00 0.00 H new ATOM 0 H3' DC A 6 3.257 7.149 -6.542 1.00 0.00 H new ATOM 0 H2' DC A 6 3.405 7.534 -4.072 1.00 0.00 H new ATOM 0 H2'' DC A 6 1.808 8.111 -4.504 1.00 0.00 H new ATOM 0 H1' DC A 6 0.797 5.800 -3.943 1.00 0.00 H new ATOM 0 H41 DC A 6 2.460 7.827 2.094 1.00 0.00 H new ATOM 0 H42 DC A 6 0.695 7.857 2.001 1.00 0.00 H new ATOM 0 H5 DC A 6 3.840 7.083 0.272 1.00 0.00 H new ATOM 0 H6 DC A 6 3.867 6.334 -2.036 1.00 0.00 H new ATOM 189 P DG A 7 0.623 7.865 -7.136 1.00 0.00 P ATOM 190 OP1 DG A 7 0.123 7.556 -8.493 1.00 0.00 O ATOM 191 OP2 DG A 7 1.530 9.017 -6.942 1.00 0.00 O ATOM 192 O5' DG A 7 -0.654 8.061 -6.160 1.00 0.00 O ATOM 193 C5' DG A 7 -1.756 7.176 -6.223 1.00 0.00 C ATOM 194 C4' DG A 7 -3.010 7.705 -5.512 1.00 0.00 C ATOM 195 O4' DG A 7 -2.751 7.878 -4.130 1.00 0.00 O ATOM 196 C3' DG A 7 -3.487 9.058 -6.055 1.00 0.00 C ATOM 197 O3' DG A 7 -4.904 9.093 -6.003 1.00 0.00 O ATOM 198 C2' DG A 7 -2.813 10.007 -5.082 1.00 0.00 C ATOM 199 C1' DG A 7 -2.958 9.233 -3.772 1.00 0.00 C ATOM 200 N9 DG A 7 -1.959 9.614 -2.755 1.00 0.00 N ATOM 201 C8 DG A 7 -0.605 9.736 -2.923 1.00 0.00 C ATOM 202 N7 DG A 7 0.049 9.984 -1.825 1.00 0.00 N ATOM 203 C5 DG A 7 -0.940 9.964 -0.841 1.00 0.00 C ATOM 204 C6 DG A 7 -0.838 10.072 0.578 1.00 0.00 C ATOM 205 O6 DG A 7 0.148 10.352 1.251 1.00 0.00 O ATOM 206 N1 DG A 7 -2.037 9.816 1.228 1.00 0.00 N ATOM 207 C2 DG A 7 -3.234 9.644 0.588 1.00 0.00 C ATOM 208 N2 DG A 7 -4.313 9.430 1.333 1.00 0.00 N ATOM 209 N3 DG A 7 -3.361 9.618 -0.744 1.00 0.00 N ATOM 210 C4 DG A 7 -2.172 9.733 -1.400 1.00 0.00 C ATOM 0 H5' DG A 7 -1.471 6.222 -5.778 1.00 0.00 H new ATOM 0 H5'' DG A 7 -1.996 6.981 -7.268 1.00 0.00 H new ATOM 0 H4' DG A 7 -3.786 6.961 -5.691 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.242 9.291 -7.091 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.770 10.190 -5.340 1.00 0.00 H new ATOM 0 H2'' DG A 7 -3.307 10.978 -5.044 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.932 9.436 -3.326 1.00 0.00 H new ATOM 0 H8 DG A 7 -0.122 9.635 -3.884 1.00 0.00 H new ATOM 0 H1 DG A 7 -2.025 9.752 2.246 1.00 0.00 H new ATOM 0 H21 DG A 7 -5.222 9.298 0.889 1.00 0.00 H new ATOM 0 H22 DG A 7 -4.233 9.398 2.349 1.00 0.00 H new ATOM 222 P DC A 8 -5.770 10.323 -6.594 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.908 9.758 -7.350 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.842 11.264 -7.259 1.00 0.00 O ATOM 225 O5' DC A 8 -6.343 11.026 -5.264 1.00 0.00 O ATOM 226 C5' DC A 8 -7.459 10.484 -4.583 1.00 0.00 C ATOM 227 C4' DC A 8 -7.622 11.147 -3.214 1.00 0.00 C ATOM 228 O4' DC A 8 -6.462 10.931 -2.441 1.00 0.00 O ATOM 229 C3' DC A 8 -7.776 12.665 -3.259 1.00 0.00 C ATOM 230 O3' DC A 8 -9.103 13.055 -3.540 1.00 0.00 O ATOM 231 C2' DC A 8 -7.353 13.049 -1.845 1.00 0.00 C ATOM 232 C1' DC A 8 -6.434 11.899 -1.404 1.00 0.00 C ATOM 233 N1 DC A 8 -5.036 12.359 -1.191 1.00 0.00 N ATOM 234 C2 DC A 8 -4.604 12.608 0.107 1.00 0.00 C ATOM 235 O2 DC A 8 -5.388 12.568 1.051 1.00 0.00 O ATOM 236 N3 DC A 8 -3.292 12.901 0.333 1.00 0.00 N ATOM 237 C4 DC A 8 -2.442 13.001 -0.694 1.00 0.00 C ATOM 238 N4 DC A 8 -1.160 13.210 -0.424 1.00 0.00 N ATOM 239 C5 DC A 8 -2.866 12.805 -2.048 1.00 0.00 C ATOM 240 C6 DC A 8 -4.166 12.481 -2.242 1.00 0.00 C ATOM 0 H5' DC A 8 -7.331 9.409 -4.460 1.00 0.00 H new ATOM 0 H5'' DC A 8 -8.362 10.632 -5.176 1.00 0.00 H new ATOM 0 H4' DC A 8 -8.527 10.701 -2.802 1.00 0.00 H new ATOM 0 H3' DC A 8 -7.194 13.148 -4.044 1.00 0.00 H new ATOM 0 H2' DC A 8 -6.830 14.005 -1.831 1.00 0.00 H new ATOM 0 H2'' DC A 8 -8.214 13.147 -1.184 1.00 0.00 H new ATOM 0 HO3' DC A 8 -9.160 14.033 -3.558 1.00 0.00 H new ATOM 0 H1' DC A 8 -6.784 11.492 -0.455 1.00 0.00 H new ATOM 0 H41 DC A 8 -0.485 13.291 -1.185 1.00 0.00 H new ATOM 0 H42 DC A 8 -0.849 13.290 0.544 1.00 0.00 H new ATOM 0 H5 DC A 8 -2.180 12.911 -2.876 1.00 0.00 H new ATOM 0 H6 DC A 8 -4.525 12.315 -3.247 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 -1.116 14.093 10.126 1.00 0.00 O ATOM 255 C5' DG B 9 -0.792 12.743 10.373 1.00 0.00 C ATOM 256 C4' DG B 9 -1.951 11.869 9.882 1.00 0.00 C ATOM 257 O4' DG B 9 -2.119 12.066 8.492 1.00 0.00 O ATOM 258 C3' DG B 9 -1.653 10.372 10.042 1.00 0.00 C ATOM 259 O3' DG B 9 -2.806 9.561 9.904 1.00 0.00 O ATOM 260 C2' DG B 9 -0.817 10.109 8.793 1.00 0.00 C ATOM 261 C1' DG B 9 -1.648 10.921 7.795 1.00 0.00 C ATOM 262 N9 DG B 9 -0.979 11.385 6.562 1.00 0.00 N ATOM 263 C8 DG B 9 0.336 11.689 6.314 1.00 0.00 C ATOM 264 N7 DG B 9 0.553 12.178 5.124 1.00 0.00 N ATOM 265 C5 DG B 9 -0.711 12.214 4.537 1.00 0.00 C ATOM 266 C6 DG B 9 -1.137 12.644 3.242 1.00 0.00 C ATOM 267 O6 DG B 9 -0.466 13.139 2.339 1.00 0.00 O ATOM 268 N1 DG B 9 -2.495 12.455 3.032 1.00 0.00 N ATOM 269 C2 DG B 9 -3.362 11.973 3.983 1.00 0.00 C ATOM 270 N2 DG B 9 -4.640 11.817 3.664 1.00 0.00 N ATOM 271 N3 DG B 9 -2.985 11.610 5.210 1.00 0.00 N ATOM 272 C4 DG B 9 -1.650 11.742 5.418 1.00 0.00 C ATOM 0 H5' DG B 9 -0.621 12.583 11.438 1.00 0.00 H new ATOM 0 H5'' DG B 9 0.130 12.474 9.858 1.00 0.00 H new ATOM 0 H4' DG B 9 -2.826 12.148 10.469 1.00 0.00 H new ATOM 0 H3' DG B 9 -1.214 10.152 11.015 1.00 0.00 H new ATOM 0 H2' DG B 9 0.207 10.470 8.885 1.00 0.00 H new ATOM 0 H2'' DG B 9 -0.760 9.051 8.536 1.00 0.00 H new ATOM 0 HO5' DG B 9 -1.676 14.154 9.324 1.00 0.00 H new ATOM 0 H1' DG B 9 -2.418 10.237 7.438 1.00 0.00 H new ATOM 0 H8 DG B 9 1.122 11.537 7.039 1.00 0.00 H new ATOM 0 H1 DG B 9 -2.874 12.688 2.114 1.00 0.00 H new ATOM 0 H21 DG B 9 -5.299 11.460 4.356 1.00 0.00 H new ATOM 0 H22 DG B 9 -4.964 12.054 2.726 1.00 0.00 H new ATOM 285 P DC B 10 -4.158 9.784 10.754 1.00 0.00 P ATOM 286 OP1 DC B 10 -5.145 10.465 9.889 1.00 0.00 O ATOM 287 OP2 DC B 10 -3.773 10.399 12.043 1.00 0.00 O ATOM 288 O5' DC B 10 -4.676 8.292 11.056 1.00 0.00 O ATOM 289 C5' DC B 10 -4.431 7.205 10.184 1.00 0.00 C ATOM 290 C4' DC B 10 -5.177 7.285 8.837 1.00 0.00 C ATOM 291 O4' DC B 10 -4.581 8.216 7.921 1.00 0.00 O ATOM 292 C3' DC B 10 -5.100 5.900 8.174 1.00 0.00 C ATOM 293 O3' DC B 10 -6.314 5.665 7.506 1.00 0.00 O ATOM 294 C2' DC B 10 -3.914 6.167 7.258 1.00 0.00 C ATOM 295 C1' DC B 10 -4.262 7.540 6.709 1.00 0.00 C ATOM 296 N1 DC B 10 -3.115 8.095 5.934 1.00 0.00 N ATOM 297 C2 DC B 10 -3.263 8.607 4.641 1.00 0.00 C ATOM 298 O2 DC B 10 -4.372 8.743 4.124 1.00 0.00 O ATOM 299 N3 DC B 10 -2.144 8.968 3.930 1.00 0.00 N ATOM 300 C4 DC B 10 -0.925 8.755 4.451 1.00 0.00 C ATOM 301 N4 DC B 10 0.148 9.212 3.818 1.00 0.00 N ATOM 302 C5 DC B 10 -0.752 8.164 5.736 1.00 0.00 C ATOM 303 C6 DC B 10 -1.868 7.867 6.414 1.00 0.00 C ATOM 0 H5' DC B 10 -4.714 6.281 10.687 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.360 7.146 9.989 1.00 0.00 H new ATOM 0 H4' DC B 10 -6.196 7.612 9.047 1.00 0.00 H new ATOM 0 H3' DC B 10 -4.969 5.018 8.801 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.969 6.169 7.800 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.827 5.419 6.470 1.00 0.00 H new ATOM 0 H1' DC B 10 -5.073 7.600 5.983 1.00 0.00 H new ATOM 0 H41 DC B 10 1.077 9.053 4.209 1.00 0.00 H new ATOM 0 H42 DC B 10 0.044 9.722 2.941 1.00 0.00 H new ATOM 0 H5 DC B 10 0.229 7.966 6.142 1.00 0.00 H new ATOM 0 H6 DC B 10 -1.769 7.423 7.394 1.00 0.00 H new ATOM 315 P DG B 11 -6.848 4.184 7.208 1.00 0.00 P ATOM 316 OP1 DG B 11 -8.043 3.942 8.044 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.703 3.250 7.258 1.00 0.00 O ATOM 318 O5' DG B 11 -7.301 4.352 5.685 1.00 0.00 O ATOM 319 C5' DG B 11 -8.274 5.300 5.308 1.00 0.00 C ATOM 320 C4' DG B 11 -8.446 5.265 3.787 1.00 0.00 C ATOM 321 O4' DG B 11 -7.346 5.933 3.196 1.00 0.00 O ATOM 322 C3' DG B 11 -8.472 3.829 3.250 1.00 0.00 C ATOM 323 O3' DG B 11 -9.440 3.734 2.222 1.00 0.00 O ATOM 324 C2' DG B 11 -7.034 3.626 2.781 1.00 0.00 C ATOM 325 C1' DG B 11 -6.576 5.037 2.418 1.00 0.00 C ATOM 326 N9 DG B 11 -5.147 5.263 2.714 1.00 0.00 N ATOM 327 C8 DG B 11 -4.496 5.078 3.906 1.00 0.00 C ATOM 328 N7 DG B 11 -3.261 5.484 3.911 1.00 0.00 N ATOM 329 C5 DG B 11 -3.060 5.932 2.611 1.00 0.00 C ATOM 330 C6 DG B 11 -1.874 6.403 1.982 1.00 0.00 C ATOM 331 O6 DG B 11 -0.780 6.611 2.495 1.00 0.00 O ATOM 332 N1 DG B 11 -2.036 6.634 0.630 1.00 0.00 N ATOM 333 C2 DG B 11 -3.217 6.471 -0.048 1.00 0.00 C ATOM 334 N2 DG B 11 -3.206 6.668 -1.360 1.00 0.00 N ATOM 335 N3 DG B 11 -4.345 6.036 0.530 1.00 0.00 N ATOM 336 C4 DG B 11 -4.198 5.777 1.859 1.00 0.00 C ATOM 0 H5' DG B 11 -7.972 6.297 5.629 1.00 0.00 H new ATOM 0 H5'' DG B 11 -9.222 5.081 5.799 1.00 0.00 H new ATOM 0 H4' DG B 11 -9.393 5.745 3.542 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.760 3.058 3.965 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.414 3.192 3.565 1.00 0.00 H new ATOM 0 H2'' DG B 11 -6.982 2.954 1.924 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.710 5.186 1.347 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.969 4.632 4.768 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.223 6.947 0.100 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.064 6.556 -1.900 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.339 6.931 -1.829 1.00 0.00 H new ATOM 348 P DT B 12 -9.869 2.318 1.578 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.179 2.496 0.915 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.703 1.271 2.609 1.00 0.00 O ATOM 351 O5' DT B 12 -8.755 2.107 0.441 1.00 0.00 O ATOM 352 C5' DT B 12 -8.738 2.938 -0.699 1.00 0.00 C ATOM 353 C4' DT B 12 -7.473 2.713 -1.527 1.00 0.00 C ATOM 354 O4' DT B 12 -6.303 3.024 -0.807 1.00 0.00 O ATOM 355 C3' DT B 12 -7.274 1.258 -1.989 1.00 0.00 C ATOM 356 O3' DT B 12 -7.848 0.987 -3.266 1.00 0.00 O ATOM 357 C2' DT B 12 -5.761 1.023 -1.856 1.00 0.00 C ATOM 358 C1' DT B 12 -5.236 2.419 -1.514 1.00 0.00 C ATOM 359 N1 DT B 12 -4.026 2.456 -0.668 1.00 0.00 N ATOM 360 C2 DT B 12 -2.980 3.340 -0.874 1.00 0.00 C ATOM 361 O2 DT B 12 -2.818 3.945 -1.928 1.00 0.00 O ATOM 362 N3 DT B 12 -2.111 3.509 0.185 1.00 0.00 N ATOM 363 C4 DT B 12 -2.170 2.878 1.403 1.00 0.00 C ATOM 364 O4 DT B 12 -1.528 3.314 2.354 1.00 0.00 O ATOM 365 C5 DT B 12 -3.044 1.627 1.550 1.00 0.00 C ATOM 366 C7 DT B 12 -3.983 1.633 2.751 1.00 0.00 C ATOM 367 C6 DT B 12 -3.913 1.392 0.334 1.00 0.00 C ATOM 0 H5' DT B 12 -8.794 3.982 -0.392 1.00 0.00 H new ATOM 0 H5'' DT B 12 -9.617 2.738 -1.311 1.00 0.00 H new ATOM 0 H4' DT B 12 -7.624 3.370 -2.384 1.00 0.00 H new ATOM 0 H3' DT B 12 -7.817 0.536 -1.379 1.00 0.00 H new ATOM 0 H2' DT B 12 -5.530 0.300 -1.074 1.00 0.00 H new ATOM 0 H2'' DT B 12 -5.327 0.642 -2.780 1.00 0.00 H new ATOM 0 H1' DT B 12 -4.935 2.918 -2.435 1.00 0.00 H new ATOM 0 H3 DT B 12 -1.347 4.170 0.049 1.00 0.00 H new ATOM 0 H71 DT B 12 -4.876 1.052 2.518 1.00 0.00 H new ATOM 0 H72 DT B 12 -3.478 1.192 3.610 1.00 0.00 H new ATOM 0 H73 DT B 12 -4.268 2.659 2.985 1.00 0.00 H new ATOM 0 H6 DT B 12 -4.440 0.458 0.207 1.00 0.00 H new ATOM 380 P DA B 13 -7.352 1.603 -4.694 1.00 0.00 P ATOM 381 OP1 DA B 13 -6.964 3.019 -4.527 1.00 0.00 O ATOM 382 OP2 DA B 13 -8.379 1.251 -5.698 1.00 0.00 O ATOM 383 O5' DA B 13 -6.024 0.773 -5.027 1.00 0.00 O ATOM 384 C5' DA B 13 -6.096 -0.610 -5.265 1.00 0.00 C ATOM 385 C4' DA B 13 -4.693 -1.155 -5.522 1.00 0.00 C ATOM 386 O4' DA B 13 -3.899 -1.162 -4.351 1.00 0.00 O ATOM 387 C3' DA B 13 -4.812 -2.605 -5.988 1.00 0.00 C ATOM 388 O3' DA B 13 -3.840 -2.917 -6.957 1.00 0.00 O ATOM 389 C2' DA B 13 -4.488 -3.312 -4.687 1.00 0.00 C ATOM 390 C1' DA B 13 -3.340 -2.448 -4.162 1.00 0.00 C ATOM 391 N9 DA B 13 -3.054 -2.686 -2.729 1.00 0.00 N ATOM 392 C8 DA B 13 -3.971 -2.619 -1.719 1.00 0.00 C ATOM 393 N7 DA B 13 -3.525 -3.043 -0.566 1.00 0.00 N ATOM 394 C5 DA B 13 -2.165 -3.245 -0.801 1.00 0.00 C ATOM 395 C6 DA B 13 -1.080 -3.536 0.053 1.00 0.00 C ATOM 396 N6 DA B 13 -1.218 -3.849 1.339 1.00 0.00 N ATOM 397 N1 DA B 13 0.168 -3.352 -0.393 1.00 0.00 N ATOM 398 C2 DA B 13 0.345 -3.025 -1.664 1.00 0.00 C ATOM 399 N3 DA B 13 -0.580 -2.819 -2.605 1.00 0.00 N ATOM 400 C4 DA B 13 -1.843 -2.928 -2.098 1.00 0.00 C ATOM 0 H5' DA B 13 -6.738 -0.809 -6.123 1.00 0.00 H new ATOM 0 H5'' DA B 13 -6.543 -1.115 -4.408 1.00 0.00 H new ATOM 0 H4' DA B 13 -4.224 -0.512 -6.266 1.00 0.00 H new ATOM 0 H3' DA B 13 -5.766 -2.859 -6.449 1.00 0.00 H new ATOM 0 H2' DA B 13 -5.337 -3.328 -4.004 1.00 0.00 H new ATOM 0 H2'' DA B 13 -4.186 -4.347 -4.845 1.00 0.00 H new ATOM 0 H1' DA B 13 -2.385 -2.632 -4.654 1.00 0.00 H new ATOM 0 H8 DA B 13 -4.976 -2.249 -1.861 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.394 -4.050 1.906 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.147 -3.888 1.757 1.00 0.00 H new ATOM 0 H2 DA B 13 1.371 -2.910 -1.981 1.00 0.00 H new ATOM 412 P DC B 14 -4.033 -2.522 -8.503 1.00 0.00 P ATOM 413 OP1 DC B 14 -4.242 -1.061 -8.592 1.00 0.00 O ATOM 414 OP2 DC B 14 -5.044 -3.438 -9.075 1.00 0.00 O ATOM 415 O5' DC B 14 -2.596 -2.882 -9.122 1.00 0.00 O ATOM 416 C5' DC B 14 -2.144 -4.217 -9.181 1.00 0.00 C ATOM 417 C4' DC B 14 -0.989 -4.464 -8.200 1.00 0.00 C ATOM 418 O4' DC B 14 -1.377 -4.413 -6.820 1.00 0.00 O ATOM 419 C3' DC B 14 -0.458 -5.882 -8.458 1.00 0.00 C ATOM 420 O3' DC B 14 0.958 -5.849 -8.554 1.00 0.00 O ATOM 421 C2' DC B 14 -0.917 -6.564 -7.180 1.00 0.00 C ATOM 422 C1' DC B 14 -0.675 -5.463 -6.165 1.00 0.00 C ATOM 423 N1 DC B 14 -1.133 -5.837 -4.794 1.00 0.00 N ATOM 424 C2 DC B 14 -0.172 -6.050 -3.806 1.00 0.00 C ATOM 425 O2 DC B 14 1.030 -6.016 -4.059 1.00 0.00 O ATOM 426 N3 DC B 14 -0.569 -6.304 -2.531 1.00 0.00 N ATOM 427 C4 DC B 14 -1.860 -6.474 -2.245 1.00 0.00 C ATOM 428 N4 DC B 14 -2.195 -6.689 -0.981 1.00 0.00 N ATOM 429 C5 DC B 14 -2.865 -6.391 -3.258 1.00 0.00 C ATOM 430 C6 DC B 14 -2.448 -6.086 -4.510 1.00 0.00 C ATOM 0 H5' DC B 14 -1.817 -4.447 -10.195 1.00 0.00 H new ATOM 0 H5'' DC B 14 -2.969 -4.892 -8.951 1.00 0.00 H new ATOM 0 H4' DC B 14 -0.255 -3.676 -8.368 1.00 0.00 H new ATOM 0 H3' DC B 14 -0.798 -6.366 -9.374 1.00 0.00 H new ATOM 0 H2' DC B 14 -1.965 -6.862 -7.224 1.00 0.00 H new ATOM 0 H2'' DC B 14 -0.339 -7.462 -6.961 1.00 0.00 H new ATOM 0 H1' DC B 14 0.360 -5.206 -5.937 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.174 -6.823 -0.729 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.474 -6.720 -0.261 1.00 0.00 H new ATOM 0 H5 DC B 14 -3.908 -6.563 -3.036 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.175 -6.038 -5.307 1.00 0.00 H new ATOM 442 P DG B 15 1.794 -6.806 -9.556 1.00 0.00 P ATOM 443 OP1 DG B 15 3.181 -6.295 -9.599 1.00 0.00 O ATOM 444 OP2 DG B 15 1.025 -6.924 -10.814 1.00 0.00 O ATOM 445 O5' DG B 15 1.821 -8.259 -8.849 1.00 0.00 O ATOM 446 C5' DG B 15 2.356 -8.436 -7.551 1.00 0.00 C ATOM 447 C4' DG B 15 2.837 -9.876 -7.314 1.00 0.00 C ATOM 448 O4' DG B 15 2.807 -10.094 -5.921 1.00 0.00 O ATOM 449 C3' DG B 15 2.019 -11.024 -7.928 1.00 0.00 C ATOM 450 O3' DG B 15 2.806 -12.205 -7.797 1.00 0.00 O ATOM 451 C2' DG B 15 0.860 -10.908 -6.954 1.00 0.00 C ATOM 452 C1' DG B 15 1.640 -10.832 -5.636 1.00 0.00 C ATOM 453 N9 DG B 15 0.888 -10.228 -4.530 1.00 0.00 N ATOM 454 C8 DG B 15 -0.313 -9.604 -4.580 1.00 0.00 C ATOM 455 N7 DG B 15 -0.780 -9.219 -3.427 1.00 0.00 N ATOM 456 C5 DG B 15 0.221 -9.600 -2.531 1.00 0.00 C ATOM 457 C6 DG B 15 0.316 -9.479 -1.108 1.00 0.00 C ATOM 458 O6 DG B 15 -0.504 -9.020 -0.312 1.00 0.00 O ATOM 459 N1 DG B 15 1.521 -9.965 -0.626 1.00 0.00 N ATOM 460 C2 DG B 15 2.471 -10.605 -1.387 1.00 0.00 C ATOM 461 N2 DG B 15 3.547 -11.114 -0.805 1.00 0.00 N ATOM 462 N3 DG B 15 2.357 -10.793 -2.699 1.00 0.00 N ATOM 463 C4 DG B 15 1.236 -10.234 -3.209 1.00 0.00 C ATOM 0 H5' DG B 15 1.599 -8.181 -6.810 1.00 0.00 H new ATOM 0 H5'' DG B 15 3.189 -7.748 -7.406 1.00 0.00 H new ATOM 0 H4' DG B 15 3.811 -9.916 -7.802 1.00 0.00 H new ATOM 0 H3' DG B 15 1.722 -11.019 -8.977 1.00 0.00 H new ATOM 0 H2' DG B 15 0.251 -10.021 -7.132 1.00 0.00 H new ATOM 0 H2'' DG B 15 0.191 -11.768 -6.995 1.00 0.00 H new ATOM 0 H1' DG B 15 1.860 -11.840 -5.285 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.843 -9.438 -5.506 1.00 0.00 H new ATOM 0 H1 DG B 15 1.718 -9.839 0.367 1.00 0.00 H new ATOM 0 H21 DG B 15 4.254 -11.589 -1.366 1.00 0.00 H new ATOM 0 H22 DG B 15 3.669 -11.030 0.204 1.00 0.00 H new ATOM 475 P DC B 16 2.730 -13.485 -8.794 1.00 0.00 P ATOM 476 OP1 DC B 16 4.038 -14.171 -8.722 1.00 0.00 O ATOM 477 OP2 DC B 16 2.229 -13.014 -10.103 1.00 0.00 O ATOM 478 O5' DC B 16 1.629 -14.492 -8.162 1.00 0.00 O ATOM 479 C5' DC B 16 1.354 -14.509 -6.778 1.00 0.00 C ATOM 480 C4' DC B 16 2.443 -15.096 -5.877 1.00 0.00 C ATOM 481 O4' DC B 16 2.665 -14.116 -4.887 1.00 0.00 O ATOM 482 C3' DC B 16 2.022 -16.401 -5.174 1.00 0.00 C ATOM 483 O3' DC B 16 2.781 -17.503 -5.627 1.00 0.00 O ATOM 484 C2' DC B 16 2.293 -16.139 -3.700 1.00 0.00 C ATOM 485 C1' DC B 16 2.426 -14.621 -3.590 1.00 0.00 C ATOM 486 N1 DC B 16 1.275 -13.961 -2.898 1.00 0.00 N ATOM 487 C2 DC B 16 1.367 -13.738 -1.523 1.00 0.00 C ATOM 488 O2 DC B 16 2.334 -14.129 -0.873 1.00 0.00 O ATOM 489 N3 DC B 16 0.363 -13.070 -0.883 1.00 0.00 N ATOM 490 C4 DC B 16 -0.698 -12.627 -1.564 1.00 0.00 C ATOM 491 N4 DC B 16 -1.632 -11.950 -0.909 1.00 0.00 N ATOM 492 C5 DC B 16 -0.797 -12.788 -2.980 1.00 0.00 C ATOM 493 C6 DC B 16 0.201 -13.463 -3.588 1.00 0.00 C ATOM 0 H5' DC B 16 0.436 -15.075 -6.619 1.00 0.00 H new ATOM 0 H5'' DC B 16 1.158 -13.486 -6.456 1.00 0.00 H new ATOM 0 H4' DC B 16 3.318 -15.341 -6.479 1.00 0.00 H new ATOM 0 H3' DC B 16 0.981 -16.653 -5.376 1.00 0.00 H new ATOM 0 H2' DC B 16 1.480 -16.511 -3.076 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.203 -16.641 -3.370 1.00 0.00 H new ATOM 0 HO3' DC B 16 2.490 -18.314 -5.160 1.00 0.00 H new ATOM 0 H1' DC B 16 3.269 -14.382 -2.942 1.00 0.00 H new ATOM 0 H41 DC B 16 -2.452 -11.601 -1.406 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.530 -11.778 0.091 1.00 0.00 H new ATOM 0 H5 DC B 16 -1.631 -12.388 -3.538 1.00 0.00 H new ATOM 0 H6 DC B 16 0.151 -13.616 -4.656 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO B 1 -0.998 0.408 -1.339 1.00 0.00 O HETATM 508 C2 PSO B 1 -2.252 0.331 -1.349 1.00 0.00 C HETATM 509 C3 PSO B 1 -3.107 0.186 -0.099 1.00 0.00 C HETATM 510 C4 PSO B 1 -2.366 0.292 1.187 1.00 0.00 C HETATM 511 C5 PSO B 1 -0.235 0.623 2.188 1.00 0.00 C HETATM 512 C6 PSO B 1 1.140 0.868 2.086 1.00 0.00 C HETATM 513 C7 PSO B 1 1.740 0.890 0.877 1.00 0.00 C HETATM 514 C8 PSO B 1 1.007 0.571 -0.279 1.00 0.00 C HETATM 515 C9 PSO B 1 -0.395 0.478 -0.221 1.00 0.00 C HETATM 516 C10 PSO B 1 -0.994 0.443 1.028 1.00 0.00 C HETATM 517 C4' PSO B 1 2.169 0.639 3.142 1.00 0.00 C HETATM 518 C5' PSO B 1 3.391 0.958 2.304 1.00 0.00 C HETATM 519 O6' PSO B 1 2.982 1.045 0.925 1.00 0.00 O HETATM 520 O11 PSO B 1 -2.810 0.378 -2.436 1.00 0.00 O HETATM 521 C12 PSO B 1 -2.732 -0.821 2.179 1.00 0.00 C HETATM 522 C13 PSO B 1 1.966 1.432 4.440 1.00 0.00 C HETATM 523 O14 PSO B 1 1.525 2.761 4.267 1.00 0.00 O HETATM 524 C15 PSO B 1 4.050 2.197 2.917 1.00 0.00 C HETATM 525 C16 PSO B 1 1.700 0.315 -1.600 1.00 0.00 C HETATM 0 H163 PSO B 1 2.261 1.202 -1.895 1.00 0.00 H new HETATM 0 H162 PSO B 1 2.383 -0.528 -1.495 1.00 0.00 H new HETATM 0 H161 PSO B 1 0.956 0.086 -2.363 1.00 0.00 H new HETATM 0 H153 PSO B 1 3.346 3.029 2.900 1.00 0.00 H new HETATM 0 H152 PSO B 1 4.337 1.985 3.947 1.00 0.00 H new HETATM 0 H151 PSO B 1 4.937 2.460 2.341 1.00 0.00 H new HETATM 0 H132 PSO B 1 1.243 0.904 5.061 1.00 0.00 H new HETATM 0 H131 PSO B 1 2.907 1.447 4.989 1.00 0.00 H new HETATM 0 H123 PSO B 1 -3.797 -0.772 2.404 1.00 0.00 H new HETATM 0 H122 PSO B 1 -2.498 -1.791 1.740 1.00 0.00 H new HETATM 0 H121 PSO B 1 -2.160 -0.692 3.098 1.00 0.00 H new HETATM 0 H5 PSO B 1 -0.711 0.573 3.167 1.00 0.00 H new HETATM 0 H14 PSO B 1 1.422 3.188 5.143 1.00 0.00 H new