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 -31:sc= 0.0644 USER MOD Single : A 4 DT C7 :methyl -30:sc= -1.67! (180deg=-4.4!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot 180:sc= 0.174 USER MOD Single : B 9 DG O5' : rot -30:sc= 0.0789 USER MOD Single : B 12 DT C7 :methyl 150:sc= -2.95! (180deg=-2.95!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.633 -14.136 9.361 1.00 0.00 O ATOM 2 C5' DG A 1 -2.436 -12.756 9.575 1.00 0.00 C ATOM 3 C4' DG A 1 -0.931 -12.472 9.631 1.00 0.00 C ATOM 4 O4' DG A 1 -0.244 -13.032 8.509 1.00 0.00 O ATOM 5 C3' DG A 1 -0.640 -10.988 9.627 1.00 0.00 C ATOM 6 O3' DG A 1 0.534 -10.740 10.378 1.00 0.00 O ATOM 7 C2' DG A 1 -0.502 -10.737 8.148 1.00 0.00 C ATOM 8 C1' DG A 1 0.060 -12.015 7.555 1.00 0.00 C ATOM 9 N9 DG A 1 -0.564 -12.301 6.237 1.00 0.00 N ATOM 10 C8 DG A 1 -1.855 -12.700 5.999 1.00 0.00 C ATOM 11 N7 DG A 1 -2.163 -12.829 4.744 1.00 0.00 N ATOM 12 C5 DG A 1 -0.983 -12.514 4.087 1.00 0.00 C ATOM 13 C6 DG A 1 -0.701 -12.514 2.692 1.00 0.00 C ATOM 14 O6 DG A 1 -1.475 -12.741 1.767 1.00 0.00 O ATOM 15 N1 DG A 1 0.619 -12.216 2.411 1.00 0.00 N ATOM 16 C2 DG A 1 1.561 -11.911 3.363 1.00 0.00 C ATOM 17 N2 DG A 1 2.796 -11.663 2.936 1.00 0.00 N ATOM 18 N3 DG A 1 1.302 -11.874 4.681 1.00 0.00 N ATOM 19 C4 DG A 1 0.012 -12.200 4.983 1.00 0.00 C ATOM 0 H5' DG A 1 -2.913 -12.447 10.505 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.899 -12.180 8.773 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.583 -12.927 10.558 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.383 -10.335 10.085 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.466 -10.492 7.703 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.161 -9.894 7.956 1.00 0.00 H new ATOM 0 HO5' DG A 1 -1.890 -14.494 8.832 1.00 0.00 H new ATOM 0 H1' DG A 1 1.132 -11.948 7.371 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.561 -12.892 6.794 1.00 0.00 H new ATOM 0 H1 DG A 1 0.912 -12.223 1.434 1.00 0.00 H new ATOM 0 H21 DG A 1 3.530 -11.432 3.605 1.00 0.00 H new ATOM 0 H22 DG A 1 3.009 -11.704 1.939 1.00 0.00 H new ATOM 32 P DC A 2 1.085 -9.252 10.664 1.00 0.00 P ATOM 33 OP1 DC A 2 1.742 -9.252 11.988 1.00 0.00 O ATOM 34 OP2 DC A 2 0.000 -8.289 10.378 1.00 0.00 O ATOM 35 O5' DC A 2 2.222 -9.090 9.538 1.00 0.00 O ATOM 36 C5' DC A 2 3.301 -9.995 9.478 1.00 0.00 C ATOM 37 C4' DC A 2 4.366 -9.548 8.475 1.00 0.00 C ATOM 38 O4' DC A 2 3.936 -9.658 7.121 1.00 0.00 O ATOM 39 C3' DC A 2 4.791 -8.096 8.676 1.00 0.00 C ATOM 40 O3' DC A 2 6.184 -8.123 8.442 1.00 0.00 O ATOM 41 C2' DC A 2 3.924 -7.378 7.639 1.00 0.00 C ATOM 42 C1' DC A 2 3.846 -8.386 6.483 1.00 0.00 C ATOM 43 N1 DC A 2 2.552 -8.392 5.718 1.00 0.00 N ATOM 44 C2 DC A 2 2.575 -8.717 4.364 1.00 0.00 C ATOM 45 O2 DC A 2 3.641 -8.911 3.785 1.00 0.00 O ATOM 46 N3 DC A 2 1.404 -8.825 3.663 1.00 0.00 N ATOM 47 C4 DC A 2 0.232 -8.633 4.285 1.00 0.00 C ATOM 48 N4 DC A 2 -0.896 -8.839 3.613 1.00 0.00 N ATOM 49 C5 DC A 2 0.160 -8.333 5.677 1.00 0.00 C ATOM 50 C6 DC A 2 1.336 -8.249 6.341 1.00 0.00 C ATOM 0 H5' DC A 2 2.932 -10.982 9.200 1.00 0.00 H new ATOM 0 H5'' DC A 2 3.750 -10.090 10.466 1.00 0.00 H new ATOM 0 H4' DC A 2 5.201 -10.223 8.664 1.00 0.00 H new ATOM 0 H3' DC A 2 4.652 -7.602 9.637 1.00 0.00 H new ATOM 0 H2' DC A 2 2.936 -7.143 8.035 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.373 -6.437 7.322 1.00 0.00 H new ATOM 0 H1' DC A 2 4.625 -8.136 5.762 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.796 -8.697 4.072 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.862 -9.139 2.639 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.785 -8.180 6.176 1.00 0.00 H new ATOM 0 H6 DC A 2 1.318 -8.062 7.405 1.00 0.00 H new ATOM 62 P DG A 3 7.080 -6.805 8.367 1.00 0.00 P ATOM 63 OP1 DG A 3 8.475 -7.159 8.705 1.00 0.00 O ATOM 64 OP2 DG A 3 6.391 -5.714 9.090 1.00 0.00 O ATOM 65 O5' DG A 3 6.973 -6.552 6.790 1.00 0.00 O ATOM 66 C5' DG A 3 7.500 -7.482 5.865 1.00 0.00 C ATOM 67 C4' DG A 3 7.648 -6.819 4.496 1.00 0.00 C ATOM 68 O4' DG A 3 6.372 -6.825 3.893 1.00 0.00 O ATOM 69 C3' DG A 3 8.130 -5.369 4.643 1.00 0.00 C ATOM 70 O3' DG A 3 9.052 -5.044 3.623 1.00 0.00 O ATOM 71 C2' DG A 3 6.796 -4.635 4.550 1.00 0.00 C ATOM 72 C1' DG A 3 5.985 -5.504 3.606 1.00 0.00 C ATOM 73 N9 DG A 3 4.525 -5.387 3.790 1.00 0.00 N ATOM 74 C8 DG A 3 3.800 -5.112 4.920 1.00 0.00 C ATOM 75 N7 DG A 3 2.520 -5.319 4.792 1.00 0.00 N ATOM 76 C5 DG A 3 2.372 -5.684 3.455 1.00 0.00 C ATOM 77 C6 DG A 3 1.202 -5.942 2.678 1.00 0.00 C ATOM 78 O6 DG A 3 0.033 -5.997 3.056 1.00 0.00 O ATOM 79 N1 DG A 3 1.490 -6.146 1.338 1.00 0.00 N ATOM 80 C2 DG A 3 2.760 -6.140 0.804 1.00 0.00 C ATOM 81 N2 DG A 3 2.926 -6.314 -0.500 1.00 0.00 N ATOM 82 N3 DG A 3 3.860 -5.921 1.525 1.00 0.00 N ATOM 83 C4 DG A 3 3.595 -5.694 2.834 1.00 0.00 C ATOM 0 H5' DG A 3 6.843 -8.348 5.791 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.468 -7.845 6.211 1.00 0.00 H new ATOM 0 H4' DG A 3 8.380 -7.359 3.895 1.00 0.00 H new ATOM 0 H3' DG A 3 8.684 -5.128 5.551 1.00 0.00 H new ATOM 0 H2' DG A 3 6.317 -4.545 5.525 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.919 -3.624 4.161 1.00 0.00 H new ATOM 0 H1' DG A 3 6.179 -5.193 2.579 1.00 0.00 H new ATOM 0 H8 DG A 3 4.250 -4.755 5.835 1.00 0.00 H new ATOM 0 H1 DG A 3 0.709 -6.312 0.704 1.00 0.00 H new ATOM 0 H21 DG A 3 3.864 -6.310 -0.900 1.00 0.00 H new ATOM 0 H22 DG A 3 2.115 -6.452 -1.103 1.00 0.00 H new ATOM 95 P DT A 4 9.773 -3.597 3.552 1.00 0.00 P ATOM 96 OP1 DT A 4 11.144 -3.791 3.032 1.00 0.00 O ATOM 97 OP2 DT A 4 9.562 -2.902 4.841 1.00 0.00 O ATOM 98 O5' DT A 4 8.898 -2.876 2.418 1.00 0.00 O ATOM 99 C5' DT A 4 8.931 -3.376 1.100 1.00 0.00 C ATOM 100 C4' DT A 4 7.625 -3.076 0.373 1.00 0.00 C ATOM 101 O4' DT A 4 6.487 -3.273 1.182 1.00 0.00 O ATOM 102 C3' DT A 4 7.496 -1.634 -0.135 1.00 0.00 C ATOM 103 O3' DT A 4 8.010 -1.520 -1.456 1.00 0.00 O ATOM 104 C2' DT A 4 5.987 -1.401 -0.067 1.00 0.00 C ATOM 105 C1' DT A 4 5.409 -2.669 0.493 1.00 0.00 C ATOM 106 N1 DT A 4 4.272 -2.420 1.407 1.00 0.00 N ATOM 107 C2 DT A 4 3.011 -2.907 1.127 1.00 0.00 C ATOM 108 O2 DT A 4 2.693 -3.318 0.017 1.00 0.00 O ATOM 109 N3 DT A 4 2.108 -2.914 2.159 1.00 0.00 N ATOM 110 C4 DT A 4 2.254 -2.358 3.402 1.00 0.00 C ATOM 111 O4 DT A 4 1.430 -2.598 4.282 1.00 0.00 O ATOM 112 C5 DT A 4 3.450 -1.441 3.650 1.00 0.00 C ATOM 113 C7 DT A 4 4.113 -1.627 5.013 1.00 0.00 C ATOM 114 C6 DT A 4 4.512 -1.501 2.546 1.00 0.00 C ATOM 0 H5' DT A 4 9.103 -4.452 1.119 1.00 0.00 H new ATOM 0 H5'' DT A 4 9.765 -2.930 0.558 1.00 0.00 H new ATOM 0 H4' DT A 4 7.665 -3.776 -0.462 1.00 0.00 H new ATOM 0 H3' DT A 4 8.059 -0.899 0.440 1.00 0.00 H new ATOM 0 H2' DT A 4 5.750 -0.548 0.569 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.578 -1.186 -1.054 1.00 0.00 H new ATOM 0 H1' DT A 4 5.001 -3.301 -0.296 1.00 0.00 H new ATOM 0 H3 DT A 4 1.223 -3.389 1.980 1.00 0.00 H new ATOM 0 H71 DT A 4 3.368 -1.952 5.739 1.00 0.00 H new ATOM 0 H72 DT A 4 4.898 -2.380 4.936 1.00 0.00 H new ATOM 0 H73 DT A 4 4.548 -0.682 5.338 1.00 0.00 H new ATOM 0 H6 DT A 4 5.404 -0.895 2.596 1.00 0.00 H new ATOM 127 P DA A 5 7.259 -2.112 -2.788 1.00 0.00 P ATOM 128 OP1 DA A 5 6.580 -3.386 -2.471 1.00 0.00 O ATOM 129 OP2 DA A 5 8.238 -2.078 -3.896 1.00 0.00 O ATOM 130 O5' DA A 5 6.128 -0.995 -3.075 1.00 0.00 O ATOM 131 C5' DA A 5 6.515 0.349 -3.239 1.00 0.00 C ATOM 132 C4' DA A 5 5.486 1.146 -4.036 1.00 0.00 C ATOM 133 O4' DA A 5 4.322 1.241 -3.210 1.00 0.00 O ATOM 134 C3' DA A 5 5.967 2.578 -4.333 1.00 0.00 C ATOM 135 O3' DA A 5 5.455 2.994 -5.585 1.00 0.00 O ATOM 136 C2' DA A 5 5.380 3.285 -3.133 1.00 0.00 C ATOM 137 C1' DA A 5 4.043 2.600 -2.912 1.00 0.00 C ATOM 138 N9 DA A 5 3.514 2.851 -1.542 1.00 0.00 N ATOM 139 C8 DA A 5 4.190 2.974 -0.346 1.00 0.00 C ATOM 140 N7 DA A 5 3.435 3.213 0.687 1.00 0.00 N ATOM 141 C5 DA A 5 2.159 3.236 0.144 1.00 0.00 C ATOM 142 C6 DA A 5 0.889 3.379 0.723 1.00 0.00 C ATOM 143 N6 DA A 5 0.765 3.470 2.042 1.00 0.00 N ATOM 144 N1 DA A 5 -0.204 3.338 -0.064 1.00 0.00 N ATOM 145 C2 DA A 5 -0.019 3.174 -1.372 1.00 0.00 C ATOM 146 N3 DA A 5 1.121 3.042 -2.042 1.00 0.00 N ATOM 147 C4 DA A 5 2.192 3.062 -1.211 1.00 0.00 C ATOM 0 H5' DA A 5 7.478 0.390 -3.747 1.00 0.00 H new ATOM 0 H5'' DA A 5 6.651 0.809 -2.260 1.00 0.00 H new ATOM 0 H4' DA A 5 5.304 0.648 -4.988 1.00 0.00 H new ATOM 0 H3' DA A 5 7.039 2.748 -4.436 1.00 0.00 H new ATOM 0 H2' DA A 5 6.025 3.189 -2.260 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.255 4.351 -3.321 1.00 0.00 H new ATOM 0 H1' DA A 5 3.237 2.977 -3.541 1.00 0.00 H new ATOM 0 H8 DA A 5 5.263 2.879 -0.272 1.00 0.00 H new ATOM 0 H61 DA A 5 -0.159 3.574 2.461 1.00 0.00 H new ATOM 0 H62 DA A 5 1.594 3.436 2.636 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.918 3.144 -1.970 1.00 0.00 H new ATOM 159 P DC A 6 5.585 4.511 -6.133 1.00 0.00 P ATOM 160 OP1 DC A 6 5.791 4.453 -7.596 1.00 0.00 O ATOM 161 OP2 DC A 6 6.544 5.248 -5.282 1.00 0.00 O ATOM 162 O5' DC A 6 4.093 5.048 -5.848 1.00 0.00 O ATOM 163 C5' DC A 6 3.015 4.369 -6.451 1.00 0.00 C ATOM 164 C4' DC A 6 1.640 4.968 -6.176 1.00 0.00 C ATOM 165 O4' DC A 6 1.280 4.890 -4.790 1.00 0.00 O ATOM 166 C3' DC A 6 1.527 6.443 -6.587 1.00 0.00 C ATOM 167 O3' DC A 6 0.308 6.629 -7.292 1.00 0.00 O ATOM 168 C2' DC A 6 1.514 7.160 -5.236 1.00 0.00 C ATOM 169 C1' DC A 6 0.898 6.167 -4.264 1.00 0.00 C ATOM 170 N1 DC A 6 1.329 6.342 -2.849 1.00 0.00 N ATOM 171 C2 DC A 6 0.356 6.531 -1.867 1.00 0.00 C ATOM 172 O2 DC A 6 -0.830 6.687 -2.140 1.00 0.00 O ATOM 173 N3 DC A 6 0.710 6.545 -0.558 1.00 0.00 N ATOM 174 C4 DC A 6 1.994 6.451 -0.210 1.00 0.00 C ATOM 175 N4 DC A 6 2.269 6.343 1.083 1.00 0.00 N ATOM 176 C5 DC A 6 3.024 6.287 -1.192 1.00 0.00 C ATOM 177 C6 DC A 6 2.644 6.238 -2.489 1.00 0.00 C ATOM 0 H5' DC A 6 3.019 3.335 -6.107 1.00 0.00 H new ATOM 0 H5'' DC A 6 3.176 4.348 -7.529 1.00 0.00 H new ATOM 0 H4' DC A 6 0.964 4.366 -6.783 1.00 0.00 H new ATOM 0 H3' DC A 6 2.320 6.804 -7.242 1.00 0.00 H new ATOM 0 H2' DC A 6 2.522 7.439 -4.928 1.00 0.00 H new ATOM 0 H2'' DC A 6 0.930 8.079 -5.283 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.182 6.302 -4.200 1.00 0.00 H new ATOM 0 H41 DC A 6 3.238 6.269 1.394 1.00 0.00 H new ATOM 0 H42 DC A 6 1.512 6.334 1.766 1.00 0.00 H new ATOM 0 H5 DC A 6 4.063 6.206 -0.908 1.00 0.00 H new ATOM 0 H6 DC A 6 3.394 6.114 -3.256 1.00 0.00 H new ATOM 189 P DG A 7 -0.165 8.075 -7.852 1.00 0.00 P ATOM 190 OP1 DG A 7 -1.010 7.845 -9.043 1.00 0.00 O ATOM 191 OP2 DG A 7 1.035 8.932 -7.965 1.00 0.00 O ATOM 192 O5' DG A 7 -1.106 8.672 -6.672 1.00 0.00 O ATOM 193 C5' DG A 7 -2.381 8.115 -6.422 1.00 0.00 C ATOM 194 C4' DG A 7 -3.236 8.913 -5.427 1.00 0.00 C ATOM 195 O4' DG A 7 -2.681 8.870 -4.126 1.00 0.00 O ATOM 196 C3' DG A 7 -3.382 10.389 -5.809 1.00 0.00 C ATOM 197 O3' DG A 7 -4.729 10.751 -5.546 1.00 0.00 O ATOM 198 C2' DG A 7 -2.346 11.046 -4.912 1.00 0.00 C ATOM 199 C1' DG A 7 -2.434 10.186 -3.660 1.00 0.00 C ATOM 200 N9 DG A 7 -1.243 10.124 -2.792 1.00 0.00 N ATOM 201 C8 DG A 7 0.079 10.069 -3.140 1.00 0.00 C ATOM 202 N7 DG A 7 0.884 9.825 -2.143 1.00 0.00 N ATOM 203 C5 DG A 7 0.031 9.719 -1.044 1.00 0.00 C ATOM 204 C6 DG A 7 0.305 9.493 0.341 1.00 0.00 C ATOM 205 O6 DG A 7 1.394 9.330 0.883 1.00 0.00 O ATOM 206 N1 DG A 7 -0.841 9.464 1.122 1.00 0.00 N ATOM 207 C2 DG A 7 -2.108 9.649 0.635 1.00 0.00 C ATOM 208 N2 DG A 7 -3.123 9.608 1.489 1.00 0.00 N ATOM 209 N3 DG A 7 -2.379 9.878 -0.653 1.00 0.00 N ATOM 210 C4 DG A 7 -1.271 9.894 -1.438 1.00 0.00 C ATOM 0 H5' DG A 7 -2.253 7.101 -6.042 1.00 0.00 H new ATOM 0 H5'' DG A 7 -2.921 8.036 -7.365 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.217 8.438 -5.452 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.208 10.669 -6.848 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.350 11.025 -5.354 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.583 12.090 -4.709 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.203 10.637 -3.033 1.00 0.00 H new ATOM 0 H8 DG A 7 0.426 10.215 -4.152 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.734 9.294 2.122 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.077 9.742 1.154 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.949 9.442 2.480 1.00 0.00 H new ATOM 222 P DC A 8 -5.332 12.204 -5.886 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.776 12.050 -6.167 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.451 12.841 -6.889 1.00 0.00 O ATOM 225 O5' DC A 8 -5.168 12.982 -4.490 1.00 0.00 O ATOM 226 C5' DC A 8 -6.107 12.845 -3.440 1.00 0.00 C ATOM 227 C4' DC A 8 -5.575 13.532 -2.173 1.00 0.00 C ATOM 228 O4' DC A 8 -4.474 12.781 -1.672 1.00 0.00 O ATOM 229 C3' DC A 8 -5.062 14.959 -2.457 1.00 0.00 C ATOM 230 O3' DC A 8 -5.383 15.856 -1.413 1.00 0.00 O ATOM 231 C2' DC A 8 -3.561 14.710 -2.515 1.00 0.00 C ATOM 232 C1' DC A 8 -3.454 13.706 -1.365 1.00 0.00 C ATOM 233 N1 DC A 8 -2.110 13.136 -1.133 1.00 0.00 N ATOM 234 C2 DC A 8 -1.694 12.859 0.170 1.00 0.00 C ATOM 235 O2 DC A 8 -2.500 12.778 1.093 1.00 0.00 O ATOM 236 N3 DC A 8 -0.363 12.675 0.422 1.00 0.00 N ATOM 237 C4 DC A 8 0.534 12.820 -0.564 1.00 0.00 C ATOM 238 N4 DC A 8 1.815 12.600 -0.304 1.00 0.00 N ATOM 239 C5 DC A 8 0.122 13.138 -1.894 1.00 0.00 C ATOM 240 C6 DC A 8 -1.192 13.257 -2.114 1.00 0.00 C ATOM 0 H5' DC A 8 -6.293 11.789 -3.242 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.060 13.287 -3.732 1.00 0.00 H new ATOM 0 H4' DC A 8 -6.398 13.586 -1.461 1.00 0.00 H new ATOM 0 H3' DC A 8 -5.491 15.416 -3.348 1.00 0.00 H new ATOM 0 H2' DC A 8 -3.237 14.296 -3.470 1.00 0.00 H new ATOM 0 H2'' DC A 8 -2.975 15.613 -2.344 1.00 0.00 H new ATOM 0 HO3' DC A 8 -5.039 16.748 -1.631 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.594 14.169 -0.388 1.00 0.00 H new ATOM 0 H41 DC A 8 2.511 12.706 -1.042 1.00 0.00 H new ATOM 0 H42 DC A 8 2.105 12.325 0.634 1.00 0.00 H new ATOM 0 H5 DC A 8 0.841 13.276 -2.688 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.532 13.458 -3.119 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.201 12.656 9.252 1.00 0.00 O ATOM 255 C5' DG B 9 3.657 11.502 9.854 1.00 0.00 C ATOM 256 C4' DG B 9 2.148 11.689 10.037 1.00 0.00 C ATOM 257 O4' DG B 9 1.524 12.180 8.857 1.00 0.00 O ATOM 258 C3' DG B 9 1.458 10.385 10.376 1.00 0.00 C ATOM 259 O3' DG B 9 0.367 10.662 11.239 1.00 0.00 O ATOM 260 C2' DG B 9 1.044 9.865 9.004 1.00 0.00 C ATOM 261 C1' DG B 9 0.944 11.108 8.123 1.00 0.00 C ATOM 262 N9 DG B 9 1.582 11.009 6.783 1.00 0.00 N ATOM 263 C8 DG B 9 2.889 10.737 6.452 1.00 0.00 C ATOM 264 N7 DG B 9 3.170 10.889 5.190 1.00 0.00 N ATOM 265 C5 DG B 9 1.967 11.299 4.629 1.00 0.00 C ATOM 266 C6 DG B 9 1.654 11.660 3.285 1.00 0.00 C ATOM 267 O6 DG B 9 2.412 11.718 2.322 1.00 0.00 O ATOM 268 N1 DG B 9 0.317 11.974 3.108 1.00 0.00 N ATOM 269 C2 DG B 9 -0.610 11.982 4.121 1.00 0.00 C ATOM 270 N2 DG B 9 -1.870 12.273 3.817 1.00 0.00 N ATOM 271 N3 DG B 9 -0.321 11.688 5.395 1.00 0.00 N ATOM 272 C4 DG B 9 0.985 11.355 5.587 1.00 0.00 C ATOM 0 H5' DG B 9 4.132 11.323 10.818 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.854 10.627 9.234 1.00 0.00 H new ATOM 0 H4' DG B 9 2.046 12.406 10.852 1.00 0.00 H new ATOM 0 H3' DG B 9 2.060 9.648 10.907 1.00 0.00 H new ATOM 0 H2' DG B 9 1.778 9.161 8.611 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.091 9.338 9.053 1.00 0.00 H new ATOM 0 HO5' DG B 9 3.529 13.069 8.670 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.112 11.257 7.898 1.00 0.00 H new ATOM 0 H8 DG B 9 3.622 10.423 7.180 1.00 0.00 H new ATOM 0 H1 DG B 9 0.002 12.214 2.168 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.581 12.287 4.548 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.126 12.483 2.852 1.00 0.00 H new ATOM 285 P DC B 10 -0.547 9.504 11.898 1.00 0.00 P ATOM 286 OP1 DC B 10 -1.216 10.068 13.090 1.00 0.00 O ATOM 287 OP2 DC B 10 0.277 8.282 12.024 1.00 0.00 O ATOM 288 O5' DC B 10 -1.662 9.266 10.762 1.00 0.00 O ATOM 289 C5' DC B 10 -2.577 10.289 10.430 1.00 0.00 C ATOM 290 C4' DC B 10 -3.228 10.005 9.076 1.00 0.00 C ATOM 291 O4' DC B 10 -2.261 10.019 8.037 1.00 0.00 O ATOM 292 C3' DC B 10 -3.930 8.640 9.007 1.00 0.00 C ATOM 293 O3' DC B 10 -5.272 8.893 8.635 1.00 0.00 O ATOM 294 C2' DC B 10 -3.107 7.908 7.934 1.00 0.00 C ATOM 295 C1' DC B 10 -2.654 9.066 7.071 1.00 0.00 C ATOM 296 N1 DC B 10 -1.578 8.732 6.103 1.00 0.00 N ATOM 297 C2 DC B 10 -1.752 8.990 4.744 1.00 0.00 C ATOM 298 O2 DC B 10 -2.834 9.374 4.302 1.00 0.00 O ATOM 299 N3 DC B 10 -0.702 8.817 3.885 1.00 0.00 N ATOM 300 C4 DC B 10 0.453 8.314 4.341 1.00 0.00 C ATOM 301 N4 DC B 10 1.505 8.294 3.529 1.00 0.00 N ATOM 302 C5 DC B 10 0.630 7.967 5.716 1.00 0.00 C ATOM 303 C6 DC B 10 -0.404 8.207 6.547 1.00 0.00 C ATOM 0 H5' DC B 10 -2.062 11.249 10.399 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.344 10.363 11.201 1.00 0.00 H new ATOM 0 H4' DC B 10 -3.969 10.795 8.952 1.00 0.00 H new ATOM 0 H3' DC B 10 -3.974 8.049 9.922 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.267 7.360 8.362 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.706 7.188 7.376 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.438 9.417 6.400 1.00 0.00 H new ATOM 0 H41 DC B 10 2.394 7.916 3.856 1.00 0.00 H new ATOM 0 H42 DC B 10 1.423 8.657 2.579 1.00 0.00 H new ATOM 0 H5 DC B 10 1.551 7.532 6.074 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.297 7.976 7.597 1.00 0.00 H new ATOM 315 P DG B 11 -6.324 7.715 8.351 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.677 8.205 8.691 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.816 6.475 8.975 1.00 0.00 O ATOM 318 O5' DG B 11 -6.221 7.565 6.749 1.00 0.00 O ATOM 319 C5' DG B 11 -6.733 8.549 5.870 1.00 0.00 C ATOM 320 C4' DG B 11 -7.357 7.899 4.623 1.00 0.00 C ATOM 321 O4' DG B 11 -6.361 7.661 3.651 1.00 0.00 O ATOM 322 C3' DG B 11 -8.023 6.553 4.924 1.00 0.00 C ATOM 323 O3' DG B 11 -9.152 6.406 4.083 1.00 0.00 O ATOM 324 C2' DG B 11 -6.886 5.577 4.641 1.00 0.00 C ATOM 325 C1' DG B 11 -6.119 6.274 3.518 1.00 0.00 C ATOM 326 N9 DG B 11 -4.659 6.081 3.571 1.00 0.00 N ATOM 327 C8 DG B 11 -3.869 5.847 4.661 1.00 0.00 C ATOM 328 N7 DG B 11 -2.589 5.898 4.421 1.00 0.00 N ATOM 329 C5 DG B 11 -2.526 6.158 3.052 1.00 0.00 C ATOM 330 C6 DG B 11 -1.405 6.230 2.171 1.00 0.00 C ATOM 331 O6 DG B 11 -0.214 6.136 2.450 1.00 0.00 O ATOM 332 N1 DG B 11 -1.772 6.430 0.850 1.00 0.00 N ATOM 333 C2 DG B 11 -3.072 6.536 0.415 1.00 0.00 C ATOM 334 N2 DG B 11 -3.305 6.712 -0.879 1.00 0.00 N ATOM 335 N3 DG B 11 -4.131 6.440 1.224 1.00 0.00 N ATOM 336 C4 DG B 11 -3.789 6.257 2.525 1.00 0.00 C ATOM 0 H5' DG B 11 -5.933 9.226 5.570 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.483 9.149 6.386 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.114 8.598 4.267 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.418 6.414 5.930 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.261 5.417 5.520 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.258 4.600 4.332 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.465 5.846 2.577 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.272 5.637 5.641 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.029 6.503 0.155 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.264 6.793 -1.218 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.526 6.767 -1.535 1.00 0.00 H new ATOM 348 P DT B 12 -10.128 5.131 4.183 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.461 5.526 3.680 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.992 4.551 5.537 1.00 0.00 O ATOM 351 O5' DT B 12 -9.456 4.130 3.121 1.00 0.00 O ATOM 352 C5' DT B 12 -9.800 4.189 1.753 1.00 0.00 C ATOM 353 C4' DT B 12 -8.853 3.320 0.925 1.00 0.00 C ATOM 354 O4' DT B 12 -7.608 3.950 0.669 1.00 0.00 O ATOM 355 C3' DT B 12 -8.576 1.936 1.511 1.00 0.00 C ATOM 356 O3' DT B 12 -9.567 0.984 1.163 1.00 0.00 O ATOM 357 C2' DT B 12 -7.284 1.686 0.749 1.00 0.00 C ATOM 358 C1' DT B 12 -6.729 2.972 0.125 1.00 0.00 C ATOM 359 N1 DT B 12 -5.390 3.169 0.687 1.00 0.00 N ATOM 360 C2 DT B 12 -4.215 3.395 -0.030 1.00 0.00 C ATOM 361 O2 DT B 12 -4.199 3.593 -1.241 1.00 0.00 O ATOM 362 N3 DT B 12 -3.042 3.381 0.729 1.00 0.00 N ATOM 363 C4 DT B 12 -2.974 3.176 2.100 1.00 0.00 C ATOM 364 O4 DT B 12 -1.906 3.224 2.693 1.00 0.00 O ATOM 365 C5 DT B 12 -4.254 2.908 2.719 1.00 0.00 C ATOM 366 C7 DT B 12 -4.468 2.574 4.153 1.00 0.00 C ATOM 367 C6 DT B 12 -5.370 2.919 2.002 1.00 0.00 C ATOM 0 H5' DT B 12 -9.754 5.221 1.405 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.827 3.851 1.615 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.403 3.186 -0.007 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.546 1.869 2.599 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.541 1.260 1.424 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.462 0.950 -0.035 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.668 2.988 -0.963 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.163 3.534 0.235 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.448 2.932 4.468 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.416 1.493 4.287 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.696 3.052 4.757 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.306 2.717 2.502 1.00 0.00 H new ATOM 380 P DA B 13 -9.361 -0.595 1.467 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.495 -1.327 0.864 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.073 -0.740 2.910 1.00 0.00 O ATOM 383 O5' DA B 13 -8.022 -0.966 0.637 1.00 0.00 O ATOM 384 C5' DA B 13 -7.981 -0.866 -0.775 1.00 0.00 C ATOM 385 C4' DA B 13 -6.556 -0.632 -1.345 1.00 0.00 C ATOM 386 O4' DA B 13 -5.473 -0.877 -0.486 1.00 0.00 O ATOM 387 C3' DA B 13 -6.459 -1.626 -2.495 1.00 0.00 C ATOM 388 O3' DA B 13 -5.666 -1.088 -3.543 1.00 0.00 O ATOM 389 C2' DA B 13 -5.828 -2.772 -1.673 1.00 0.00 C ATOM 390 C1' DA B 13 -4.745 -1.991 -0.951 1.00 0.00 C ATOM 391 N9 DA B 13 -4.226 -2.593 0.276 1.00 0.00 N ATOM 392 C8 DA B 13 -4.859 -2.606 1.486 1.00 0.00 C ATOM 393 N7 DA B 13 -4.090 -2.915 2.495 1.00 0.00 N ATOM 394 C5 DA B 13 -2.838 -3.066 1.899 1.00 0.00 C ATOM 395 C6 DA B 13 -1.545 -3.295 2.401 1.00 0.00 C ATOM 396 N6 DA B 13 -1.281 -3.444 3.697 1.00 0.00 N ATOM 397 N1 DA B 13 -0.513 -3.275 1.547 1.00 0.00 N ATOM 398 C2 DA B 13 -0.729 -3.042 0.259 1.00 0.00 C ATOM 399 N3 DA B 13 -1.885 -2.817 -0.340 1.00 0.00 N ATOM 400 C4 DA B 13 -2.909 -2.839 0.550 1.00 0.00 C ATOM 0 H5' DA B 13 -8.628 -0.047 -1.091 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.389 -1.780 -1.207 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.466 0.427 -1.588 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.357 -1.914 -3.041 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.537 -3.237 -0.988 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.424 -3.566 -2.301 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.897 -1.859 -1.623 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.909 -2.379 1.599 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.323 -3.608 4.007 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.037 -3.394 4.380 1.00 0.00 H new ATOM 0 H2 DA B 13 0.145 -3.035 -0.376 1.00 0.00 H new ATOM 412 P DC B 14 -5.775 -1.629 -5.068 1.00 0.00 P ATOM 413 OP1 DC B 14 -5.977 -0.461 -5.951 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.751 -2.741 -5.090 1.00 0.00 O ATOM 415 O5' DC B 14 -4.320 -2.252 -5.355 1.00 0.00 O ATOM 416 C5' DC B 14 -3.800 -3.217 -4.474 1.00 0.00 C ATOM 417 C4' DC B 14 -2.349 -3.580 -4.767 1.00 0.00 C ATOM 418 O4' DC B 14 -1.708 -3.709 -3.507 1.00 0.00 O ATOM 419 C3' DC B 14 -2.249 -4.919 -5.497 1.00 0.00 C ATOM 420 O3' DC B 14 -1.143 -4.906 -6.388 1.00 0.00 O ATOM 421 C2' DC B 14 -2.059 -5.874 -4.336 1.00 0.00 C ATOM 422 C1' DC B 14 -1.359 -5.055 -3.268 1.00 0.00 C ATOM 423 N1 DC B 14 -1.760 -5.552 -1.939 1.00 0.00 N ATOM 424 C2 DC B 14 -0.795 -6.040 -1.075 1.00 0.00 C ATOM 425 O2 DC B 14 0.355 -6.246 -1.444 1.00 0.00 O ATOM 426 N3 DC B 14 -1.130 -6.295 0.213 1.00 0.00 N ATOM 427 C4 DC B 14 -2.393 -6.148 0.621 1.00 0.00 C ATOM 428 N4 DC B 14 -2.604 -6.258 1.926 1.00 0.00 N ATOM 429 C5 DC B 14 -3.439 -5.744 -0.284 1.00 0.00 C ATOM 430 C6 DC B 14 -3.060 -5.476 -1.552 1.00 0.00 C ATOM 0 H5' DC B 14 -4.411 -4.118 -4.531 1.00 0.00 H new ATOM 0 H5'' DC B 14 -3.875 -2.844 -3.452 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.893 -2.817 -5.398 1.00 0.00 H new ATOM 0 H3' DC B 14 -3.102 -5.178 -6.124 1.00 0.00 H new ATOM 0 H2' DC B 14 -3.015 -6.256 -3.978 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.460 -6.737 -4.628 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.273 -5.140 -3.299 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.547 -6.156 2.301 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.823 -6.445 2.555 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.468 -5.660 0.034 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.809 -5.194 -2.277 1.00 0.00 H new ATOM 442 P DG B 15 -0.727 -6.195 -7.276 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.141 -5.702 -8.541 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.884 -7.115 -7.317 1.00 0.00 O ATOM 445 O5' DG B 15 0.446 -6.905 -6.412 1.00 0.00 O ATOM 446 C5' DG B 15 1.709 -6.282 -6.279 1.00 0.00 C ATOM 447 C4' DG B 15 2.759 -7.143 -5.567 1.00 0.00 C ATOM 448 O4' DG B 15 2.351 -7.444 -4.246 1.00 0.00 O ATOM 449 C3' DG B 15 3.036 -8.476 -6.269 1.00 0.00 C ATOM 450 O3' DG B 15 4.439 -8.689 -6.195 1.00 0.00 O ATOM 451 C2' DG B 15 2.189 -9.442 -5.457 1.00 0.00 C ATOM 452 C1' DG B 15 2.312 -8.849 -4.062 1.00 0.00 C ATOM 453 N9 DG B 15 1.212 -9.140 -3.122 1.00 0.00 N ATOM 454 C8 DG B 15 -0.140 -9.133 -3.338 1.00 0.00 C ATOM 455 N7 DG B 15 -0.856 -9.219 -2.249 1.00 0.00 N ATOM 456 C5 DG B 15 0.094 -9.276 -1.228 1.00 0.00 C ATOM 457 C6 DG B 15 -0.049 -9.351 0.193 1.00 0.00 C ATOM 458 O6 DG B 15 -1.080 -9.453 0.852 1.00 0.00 O ATOM 459 N1 DG B 15 1.168 -9.297 0.862 1.00 0.00 N ATOM 460 C2 DG B 15 2.387 -9.275 0.236 1.00 0.00 C ATOM 461 N2 DG B 15 3.483 -9.274 0.984 1.00 0.00 N ATOM 462 N3 DG B 15 2.537 -9.253 -1.091 1.00 0.00 N ATOM 463 C4 DG B 15 1.357 -9.225 -1.760 1.00 0.00 C ATOM 0 H5' DG B 15 1.586 -5.349 -5.729 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.080 -6.021 -7.270 1.00 0.00 H new ATOM 0 H4' DG B 15 3.669 -6.544 -5.580 1.00 0.00 H new ATOM 0 H3' DG B 15 2.784 -8.562 -7.326 1.00 0.00 H new ATOM 0 H2' DG B 15 1.155 -9.471 -5.801 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.570 -10.462 -5.505 1.00 0.00 H new ATOM 0 H1' DG B 15 3.196 -9.296 -3.608 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.577 -9.062 -4.323 1.00 0.00 H new ATOM 0 H1 DG B 15 1.153 -9.272 1.882 1.00 0.00 H new ATOM 0 H21 DG B 15 4.402 -9.258 0.542 1.00 0.00 H new ATOM 0 H22 DG B 15 3.406 -9.289 2.001 1.00 0.00 H new ATOM 475 P DC B 16 5.174 -9.975 -6.824 1.00 0.00 P ATOM 476 OP1 DC B 16 6.544 -9.579 -7.212 1.00 0.00 O ATOM 477 OP2 DC B 16 4.267 -10.574 -7.827 1.00 0.00 O ATOM 478 O5' DC B 16 5.272 -10.967 -5.561 1.00 0.00 O ATOM 479 C5' DC B 16 6.287 -10.840 -4.582 1.00 0.00 C ATOM 480 C4' DC B 16 6.018 -11.805 -3.417 1.00 0.00 C ATOM 481 O4' DC B 16 4.861 -11.364 -2.713 1.00 0.00 O ATOM 482 C3' DC B 16 5.735 -13.243 -3.903 1.00 0.00 C ATOM 483 O3' DC B 16 6.311 -14.216 -3.056 1.00 0.00 O ATOM 484 C2' DC B 16 4.216 -13.274 -3.817 1.00 0.00 C ATOM 485 C1' DC B 16 4.051 -12.501 -2.505 1.00 0.00 C ATOM 486 N1 DC B 16 2.658 -12.242 -2.090 1.00 0.00 N ATOM 487 C2 DC B 16 2.299 -12.309 -0.742 1.00 0.00 C ATOM 488 O2 DC B 16 3.139 -12.285 0.157 1.00 0.00 O ATOM 489 N3 DC B 16 0.977 -12.403 -0.414 1.00 0.00 N ATOM 490 C4 DC B 16 0.045 -12.490 -1.374 1.00 0.00 C ATOM 491 N4 DC B 16 -1.232 -12.559 -1.027 1.00 0.00 N ATOM 492 C5 DC B 16 0.405 -12.449 -2.755 1.00 0.00 C ATOM 493 C6 DC B 16 1.702 -12.301 -3.039 1.00 0.00 C ATOM 0 H5' DC B 16 6.323 -9.814 -4.215 1.00 0.00 H new ATOM 0 H5'' DC B 16 7.260 -11.054 -5.025 1.00 0.00 H new ATOM 0 H4' DC B 16 6.909 -11.812 -2.789 1.00 0.00 H new ATOM 0 H3' DC B 16 6.148 -13.468 -4.886 1.00 0.00 H new ATOM 0 H2' DC B 16 3.734 -12.783 -4.662 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.815 -14.286 -3.766 1.00 0.00 H new ATOM 0 HO3' DC B 16 6.106 -15.111 -3.399 1.00 0.00 H new ATOM 0 H1' DC B 16 4.367 -13.075 -1.634 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.953 -12.626 -1.746 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.494 -12.546 -0.041 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.338 -12.534 -3.535 1.00 0.00 H new ATOM 0 H6 DC B 16 1.998 -12.225 -4.075 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.874 0.258 -0.535 1.00 0.00 O HETATM 508 C2 PSO A 9 -2.123 0.356 -0.258 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.632 0.299 1.049 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.733 0.143 2.097 1.00 0.00 C HETATM 511 C5 PSO A 9 0.616 0.158 2.779 1.00 0.00 C HETATM 512 C6 PSO A 9 1.966 0.224 2.411 1.00 0.00 C HETATM 513 C7 PSO A 9 2.337 0.184 1.112 1.00 0.00 C HETATM 514 C8 PSO A 9 1.353 0.097 0.100 1.00 0.00 C HETATM 515 C9 PSO A 9 -0.022 0.187 0.433 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.373 0.168 1.777 1.00 0.00 C HETATM 517 C4' PSO A 9 3.146 0.039 3.320 1.00 0.00 C HETATM 518 C5' PSO A 9 4.214 -0.030 2.239 1.00 0.00 C HETATM 519 O6' PSO A 9 3.589 0.167 0.942 1.00 0.00 O HETATM 520 O11 PSO A 9 -2.915 0.507 -1.184 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.209 -0.046 3.518 1.00 0.00 C HETATM 522 C13 PSO A 9 3.242 1.100 4.436 1.00 0.00 C HETATM 523 O14 PSO A 9 2.396 2.216 4.235 1.00 0.00 O HETATM 524 C15 PSO A 9 5.431 0.787 2.649 1.00 0.00 C HETATM 525 C16 PSO A 9 1.748 -0.097 -1.351 1.00 0.00 C HETATM 0 H163 PSO A 9 2.372 0.737 -1.673 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.305 -1.028 -1.455 1.00 0.00 H new HETATM 0 H161 PSO A 9 0.852 -0.139 -1.970 1.00 0.00 H new HETATM 0 H153 PSO A 9 5.139 1.827 2.795 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.839 0.391 3.579 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.188 0.729 1.867 1.00 0.00 H new HETATM 0 H132 PSO A 9 2.994 0.634 5.390 1.00 0.00 H new HETATM 0 H131 PSO A 9 4.273 1.446 4.509 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.800 0.818 3.822 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.823 -0.945 3.580 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.349 -0.148 4.179 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.334 0.100 3.830 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.703 0.375 1.237 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.505 2.847 4.977 1.00 0.00 H new