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=-0.00876 USER MOD Single : A 4 DT C7 :methyl -30:sc= -3.59! (180deg=-6.2!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot 180:sc= -0.243 USER MOD Single : B 9 DG O5' : rot 180:sc= 0 USER MOD Single : B 12 DT C7 :methyl 150:sc= -3! (180deg=-3!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.949 -12.056 9.101 1.00 0.00 O ATOM 2 C5' DG A 1 -2.134 -12.846 9.940 1.00 0.00 C ATOM 3 C4' DG A 1 -0.643 -12.489 9.830 1.00 0.00 C ATOM 4 O4' DG A 1 -0.020 -13.064 8.680 1.00 0.00 O ATOM 5 C3' DG A 1 -0.375 -11.000 9.783 1.00 0.00 C ATOM 6 O3' DG A 1 0.813 -10.716 10.500 1.00 0.00 O ATOM 7 C2' DG A 1 -0.270 -10.773 8.297 1.00 0.00 C ATOM 8 C1' DG A 1 0.287 -12.056 7.718 1.00 0.00 C ATOM 9 N9 DG A 1 -0.344 -12.358 6.408 1.00 0.00 N ATOM 10 C8 DG A 1 -1.626 -12.794 6.195 1.00 0.00 C ATOM 11 N7 DG A 1 -1.957 -12.928 4.946 1.00 0.00 N ATOM 12 C5 DG A 1 -0.799 -12.579 4.267 1.00 0.00 C ATOM 13 C6 DG A 1 -0.545 -12.571 2.866 1.00 0.00 C ATOM 14 O6 DG A 1 -1.333 -12.808 1.956 1.00 0.00 O ATOM 15 N1 DG A 1 0.764 -12.251 2.560 1.00 0.00 N ATOM 16 C2 DG A 1 1.718 -11.928 3.494 1.00 0.00 C ATOM 17 N2 DG A 1 2.943 -11.667 3.043 1.00 0.00 N ATOM 18 N3 DG A 1 1.484 -11.891 4.817 1.00 0.00 N ATOM 19 C4 DG A 1 0.206 -12.242 5.144 1.00 0.00 C ATOM 0 H5' DG A 1 -2.271 -13.897 9.687 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.457 -12.723 10.974 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.217 -12.906 10.743 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.123 -10.353 10.242 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.245 -10.542 7.868 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.384 -9.929 8.076 1.00 0.00 H new ATOM 0 HO5' DG A 1 -3.886 -12.324 9.208 1.00 0.00 H new ATOM 0 H1' DG A 1 1.359 -11.990 7.532 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.309 -13.010 7.004 1.00 0.00 H new ATOM 0 H1 DG A 1 1.039 -12.255 1.578 1.00 0.00 H new ATOM 0 H21 DG A 1 3.686 -11.422 3.698 1.00 0.00 H new ATOM 0 H22 DG A 1 3.139 -11.712 2.043 1.00 0.00 H new ATOM 32 P DC A 2 1.342 -9.214 10.750 1.00 0.00 P ATOM 33 OP1 DC A 2 2.027 -9.181 12.060 1.00 0.00 O ATOM 34 OP2 DC A 2 0.235 -8.272 10.474 1.00 0.00 O ATOM 35 O5' DC A 2 2.452 -9.048 9.599 1.00 0.00 O ATOM 36 C5' DC A 2 3.544 -9.938 9.527 1.00 0.00 C ATOM 37 C4' DC A 2 4.584 -9.483 8.500 1.00 0.00 C ATOM 38 O4' DC A 2 4.135 -9.616 7.155 1.00 0.00 O ATOM 39 C3' DC A 2 4.986 -8.022 8.678 1.00 0.00 C ATOM 40 O3' DC A 2 6.374 -8.026 8.415 1.00 0.00 O ATOM 41 C2' DC A 2 4.084 -7.332 7.651 1.00 0.00 C ATOM 42 C1' DC A 2 4.008 -8.351 6.507 1.00 0.00 C ATOM 43 N1 DC A 2 2.701 -8.389 5.765 1.00 0.00 N ATOM 44 C2 DC A 2 2.707 -8.707 4.410 1.00 0.00 C ATOM 45 O2 DC A 2 3.767 -8.871 3.810 1.00 0.00 O ATOM 46 N3 DC A 2 1.525 -8.841 3.730 1.00 0.00 N ATOM 47 C4 DC A 2 0.361 -8.675 4.373 1.00 0.00 C ATOM 48 N4 DC A 2 -0.774 -8.906 3.722 1.00 0.00 N ATOM 49 C5 DC A 2 0.309 -8.383 5.768 1.00 0.00 C ATOM 50 C6 DC A 2 1.494 -8.277 6.410 1.00 0.00 C ATOM 0 H5' DC A 2 3.185 -10.933 9.264 1.00 0.00 H new ATOM 0 H5'' DC A 2 4.013 -10.018 10.508 1.00 0.00 H new ATOM 0 H4' DC A 2 5.433 -10.142 8.682 1.00 0.00 H new ATOM 0 H3' DC A 2 4.858 -7.520 9.637 1.00 0.00 H new ATOM 0 H2' DC A 2 3.098 -7.115 8.063 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.506 -6.384 7.318 1.00 0.00 H new ATOM 0 H1' DC A 2 4.769 -8.093 5.771 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.668 -8.784 4.197 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.751 -9.205 2.747 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.630 -8.253 6.286 1.00 0.00 H new ATOM 0 H6 DC A 2 1.491 -8.097 7.475 1.00 0.00 H new ATOM 62 P DG A 3 7.244 -6.692 8.309 1.00 0.00 P ATOM 63 OP1 DG A 3 8.652 -7.018 8.625 1.00 0.00 O ATOM 64 OP2 DG A 3 6.549 -5.607 9.034 1.00 0.00 O ATOM 65 O5' DG A 3 7.105 -6.457 6.733 1.00 0.00 O ATOM 66 C5' DG A 3 7.633 -7.387 5.807 1.00 0.00 C ATOM 67 C4' DG A 3 7.743 -6.734 4.430 1.00 0.00 C ATOM 68 O4' DG A 3 6.458 -6.771 3.846 1.00 0.00 O ATOM 69 C3' DG A 3 8.199 -5.273 4.552 1.00 0.00 C ATOM 70 O3' DG A 3 9.101 -4.949 3.514 1.00 0.00 O ATOM 71 C2' DG A 3 6.848 -4.567 4.471 1.00 0.00 C ATOM 72 C1' DG A 3 6.042 -5.462 3.547 1.00 0.00 C ATOM 73 N9 DG A 3 4.583 -5.371 3.752 1.00 0.00 N ATOM 74 C8 DG A 3 3.870 -5.107 4.892 1.00 0.00 C ATOM 75 N7 DG A 3 2.592 -5.340 4.784 1.00 0.00 N ATOM 76 C5 DG A 3 2.432 -5.709 3.449 1.00 0.00 C ATOM 77 C6 DG A 3 1.255 -5.987 2.689 1.00 0.00 C ATOM 78 O6 DG A 3 0.092 -6.058 3.083 1.00 0.00 O ATOM 79 N1 DG A 3 1.529 -6.193 1.346 1.00 0.00 N ATOM 80 C2 DG A 3 2.791 -6.164 0.794 1.00 0.00 C ATOM 81 N2 DG A 3 2.943 -6.345 -0.511 1.00 0.00 N ATOM 82 N3 DG A 3 3.896 -5.920 1.498 1.00 0.00 N ATOM 83 C4 DG A 3 3.646 -5.697 2.810 1.00 0.00 C ATOM 0 H5' DG A 3 6.991 -8.266 5.753 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.614 -7.728 6.138 1.00 0.00 H new ATOM 0 H4' DG A 3 8.476 -7.267 3.824 1.00 0.00 H new ATOM 0 H3' DG A 3 8.760 -5.005 5.447 1.00 0.00 H new ATOM 0 H2' DG A 3 6.381 -4.477 5.452 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.945 -3.558 4.070 1.00 0.00 H new ATOM 0 H1' DG A 3 6.216 -5.161 2.514 1.00 0.00 H new ATOM 0 H8 DG A 3 4.326 -4.739 5.799 1.00 0.00 H new ATOM 0 H1 DG A 3 0.742 -6.379 0.724 1.00 0.00 H new ATOM 0 H21 DG A 3 3.876 -6.324 -0.924 1.00 0.00 H new ATOM 0 H22 DG A 3 2.127 -6.505 -1.102 1.00 0.00 H new ATOM 95 P DT A 4 9.775 -3.485 3.391 1.00 0.00 P ATOM 96 OP1 DT A 4 11.136 -3.649 2.839 1.00 0.00 O ATOM 97 OP2 DT A 4 9.575 -2.765 4.668 1.00 0.00 O ATOM 98 O5' DT A 4 8.846 -2.823 2.264 1.00 0.00 O ATOM 99 C5' DT A 4 8.842 -3.373 0.966 1.00 0.00 C ATOM 100 C4' DT A 4 7.520 -3.090 0.261 1.00 0.00 C ATOM 101 O4' DT A 4 6.401 -3.262 1.102 1.00 0.00 O ATOM 102 C3' DT A 4 7.384 -1.659 -0.274 1.00 0.00 C ATOM 103 O3' DT A 4 7.833 -1.567 -1.622 1.00 0.00 O ATOM 104 C2' DT A 4 5.886 -1.401 -0.150 1.00 0.00 C ATOM 105 C1' DT A 4 5.311 -2.659 0.431 1.00 0.00 C ATOM 106 N1 DT A 4 4.194 -2.387 1.362 1.00 0.00 N ATOM 107 C2 DT A 4 2.939 -2.915 1.136 1.00 0.00 C ATOM 108 O2 DT A 4 2.596 -3.346 0.041 1.00 0.00 O ATOM 109 N3 DT A 4 2.072 -2.942 2.198 1.00 0.00 N ATOM 110 C4 DT A 4 2.248 -2.387 3.437 1.00 0.00 C ATOM 111 O4 DT A 4 1.459 -2.641 4.343 1.00 0.00 O ATOM 112 C5 DT A 4 3.437 -1.451 3.639 1.00 0.00 C ATOM 113 C7 DT A 4 4.151 -1.569 4.974 1.00 0.00 C ATOM 114 C6 DT A 4 4.472 -1.486 2.510 1.00 0.00 C ATOM 0 H5' DT A 4 9.006 -4.449 1.022 1.00 0.00 H new ATOM 0 H5'' DT A 4 9.665 -2.955 0.387 1.00 0.00 H new ATOM 0 H4' DT A 4 7.537 -3.810 -0.557 1.00 0.00 H new ATOM 0 H3' DT A 4 7.988 -0.929 0.265 1.00 0.00 H new ATOM 0 H2' DT A 4 5.687 -0.544 0.494 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.444 -1.179 -1.121 1.00 0.00 H new ATOM 0 H1' DT A 4 4.882 -3.300 -0.339 1.00 0.00 H new ATOM 0 H3 DT A 4 1.191 -3.434 2.047 1.00 0.00 H new ATOM 0 H71 DT A 4 3.441 -1.881 5.740 1.00 0.00 H new ATOM 0 H72 DT A 4 4.949 -2.307 4.896 1.00 0.00 H new ATOM 0 H73 DT A 4 4.576 -0.603 5.246 1.00 0.00 H new ATOM 0 H6 DT A 4 5.366 -0.881 2.547 1.00 0.00 H new ATOM 127 P DA A 5 7.030 -2.203 -2.904 1.00 0.00 P ATOM 128 OP1 DA A 5 6.390 -3.480 -2.525 1.00 0.00 O ATOM 129 OP2 DA A 5 7.962 -2.190 -4.052 1.00 0.00 O ATOM 130 O5' DA A 5 5.854 -1.122 -3.184 1.00 0.00 O ATOM 131 C5' DA A 5 6.187 0.199 -3.541 1.00 0.00 C ATOM 132 C4' DA A 5 5.044 0.913 -4.273 1.00 0.00 C ATOM 133 O4' DA A 5 4.010 1.142 -3.318 1.00 0.00 O ATOM 134 C3' DA A 5 5.444 2.308 -4.790 1.00 0.00 C ATOM 135 O3' DA A 5 4.813 2.687 -6.026 1.00 0.00 O ATOM 136 C2' DA A 5 5.150 3.156 -3.557 1.00 0.00 C ATOM 137 C1' DA A 5 3.847 2.537 -3.096 1.00 0.00 C ATOM 138 N9 DA A 5 3.420 2.877 -1.721 1.00 0.00 N ATOM 139 C8 DA A 5 4.160 2.973 -0.569 1.00 0.00 C ATOM 140 N7 DA A 5 3.451 3.178 0.508 1.00 0.00 N ATOM 141 C5 DA A 5 2.142 3.208 0.033 1.00 0.00 C ATOM 142 C6 DA A 5 0.884 3.302 0.662 1.00 0.00 C ATOM 143 N6 DA A 5 0.776 3.341 1.985 1.00 0.00 N ATOM 144 N1 DA A 5 -0.236 3.251 -0.086 1.00 0.00 N ATOM 145 C2 DA A 5 -0.100 3.141 -1.404 1.00 0.00 C ATOM 146 N3 DA A 5 1.016 3.063 -2.120 1.00 0.00 N ATOM 147 C4 DA A 5 2.117 3.078 -1.327 1.00 0.00 C ATOM 0 H5' DA A 5 7.072 0.188 -4.178 1.00 0.00 H new ATOM 0 H5'' DA A 5 6.447 0.760 -2.644 1.00 0.00 H new ATOM 0 H4' DA A 5 4.753 0.288 -5.117 1.00 0.00 H new ATOM 0 H3' DA A 5 6.478 2.408 -5.121 1.00 0.00 H new ATOM 0 H2' DA A 5 5.934 3.078 -2.804 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.043 4.214 -3.798 1.00 0.00 H new ATOM 0 H1' DA A 5 3.015 2.952 -3.664 1.00 0.00 H new ATOM 0 H8 DA A 5 5.236 2.886 -0.555 1.00 0.00 H new ATOM 0 H61 DA A 5 -0.144 3.409 2.420 1.00 0.00 H new ATOM 0 H62 DA A 5 1.613 3.303 2.566 1.00 0.00 H new ATOM 0 H2 DA A 5 -1.020 3.111 -1.968 1.00 0.00 H new ATOM 159 P DC A 6 3.229 2.558 -6.457 1.00 0.00 P ATOM 160 OP1 DC A 6 2.700 1.256 -6.003 1.00 0.00 O ATOM 161 OP2 DC A 6 3.151 2.906 -7.892 1.00 0.00 O ATOM 162 O5' DC A 6 2.476 3.737 -5.635 1.00 0.00 O ATOM 163 C5' DC A 6 2.925 5.070 -5.706 1.00 0.00 C ATOM 164 C4' DC A 6 1.758 5.831 -6.315 1.00 0.00 C ATOM 165 O4' DC A 6 0.776 5.745 -5.288 1.00 0.00 O ATOM 166 C3' DC A 6 1.954 7.328 -6.552 1.00 0.00 C ATOM 167 O3' DC A 6 0.953 7.738 -7.476 1.00 0.00 O ATOM 168 C2' DC A 6 1.730 7.887 -5.147 1.00 0.00 C ATOM 169 C1' DC A 6 0.902 6.845 -4.392 1.00 0.00 C ATOM 170 N1 DC A 6 1.344 6.558 -2.978 1.00 0.00 N ATOM 171 C2 DC A 6 0.332 6.354 -2.037 1.00 0.00 C ATOM 172 O2 DC A 6 -0.843 6.229 -2.369 1.00 0.00 O ATOM 173 N3 DC A 6 0.634 6.291 -0.712 1.00 0.00 N ATOM 174 C4 DC A 6 1.895 6.406 -0.295 1.00 0.00 C ATOM 175 N4 DC A 6 2.146 6.259 0.998 1.00 0.00 N ATOM 176 C5 DC A 6 2.968 6.573 -1.220 1.00 0.00 C ATOM 177 C6 DC A 6 2.646 6.665 -2.530 1.00 0.00 C ATOM 0 H5' DC A 6 3.820 5.155 -6.322 1.00 0.00 H new ATOM 0 H5'' DC A 6 3.180 5.457 -4.719 1.00 0.00 H new ATOM 0 H4' DC A 6 1.549 5.406 -7.297 1.00 0.00 H new ATOM 0 H3' DC A 6 2.910 7.646 -6.967 1.00 0.00 H new ATOM 0 H2' DC A 6 2.681 8.066 -4.644 1.00 0.00 H new ATOM 0 H2'' DC A 6 1.207 8.842 -5.188 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.091 7.220 -4.145 1.00 0.00 H new ATOM 0 H41 DC A 6 3.102 6.342 1.345 1.00 0.00 H new ATOM 0 H42 DC A 6 1.383 6.063 1.646 1.00 0.00 H new ATOM 0 H5 DC A 6 3.994 6.624 -0.888 1.00 0.00 H new ATOM 0 H6 DC A 6 3.434 6.828 -3.251 1.00 0.00 H new ATOM 189 P DG A 7 0.664 9.286 -7.852 1.00 0.00 P ATOM 190 OP1 DG A 7 0.050 9.322 -9.196 1.00 0.00 O ATOM 191 OP2 DG A 7 1.900 10.057 -7.592 1.00 0.00 O ATOM 192 O5' DG A 7 -0.460 9.741 -6.773 1.00 0.00 O ATOM 193 C5' DG A 7 -1.743 9.145 -6.780 1.00 0.00 C ATOM 194 C4' DG A 7 -2.723 9.759 -5.769 1.00 0.00 C ATOM 195 O4' DG A 7 -2.303 9.534 -4.435 1.00 0.00 O ATOM 196 C3' DG A 7 -2.889 11.270 -5.940 1.00 0.00 C ATOM 197 O3' DG A 7 -4.266 11.554 -5.746 1.00 0.00 O ATOM 198 C2' DG A 7 -1.955 11.806 -4.867 1.00 0.00 C ATOM 199 C1' DG A 7 -2.112 10.770 -3.761 1.00 0.00 C ATOM 200 N9 DG A 7 -0.984 10.581 -2.824 1.00 0.00 N ATOM 201 C8 DG A 7 0.361 10.635 -3.073 1.00 0.00 C ATOM 202 N7 DG A 7 1.104 10.216 -2.087 1.00 0.00 N ATOM 203 C5 DG A 7 0.186 9.895 -1.088 1.00 0.00 C ATOM 204 C6 DG A 7 0.385 9.465 0.261 1.00 0.00 C ATOM 205 O6 DG A 7 1.442 9.199 0.824 1.00 0.00 O ATOM 206 N1 DG A 7 -0.797 9.353 0.976 1.00 0.00 N ATOM 207 C2 DG A 7 -2.040 9.580 0.445 1.00 0.00 C ATOM 208 N2 DG A 7 -3.090 9.446 1.248 1.00 0.00 N ATOM 209 N3 DG A 7 -2.243 9.969 -0.820 1.00 0.00 N ATOM 210 C4 DG A 7 -1.093 10.121 -1.530 1.00 0.00 C ATOM 0 H5' DG A 7 -1.639 8.081 -6.569 1.00 0.00 H new ATOM 0 H5'' DG A 7 -2.167 9.232 -7.780 1.00 0.00 H new ATOM 0 H4' DG A 7 -3.674 9.265 -5.967 1.00 0.00 H new ATOM 0 H3' DG A 7 -2.639 11.710 -6.905 1.00 0.00 H new ATOM 0 H2' DG A 7 -0.926 11.873 -5.219 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.245 12.803 -4.536 1.00 0.00 H new ATOM 0 H1' DG A 7 -2.927 11.124 -3.130 1.00 0.00 H new ATOM 0 H8 DG A 7 0.771 10.994 -4.005 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.738 9.085 1.958 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.031 9.607 0.888 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.955 9.182 2.224 1.00 0.00 H new ATOM 222 P DC A 8 -4.899 13.021 -5.948 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.312 12.862 -6.355 1.00 0.00 O ATOM 224 OP2 DC A 8 -3.973 13.806 -6.792 1.00 0.00 O ATOM 225 O5' DC A 8 -4.865 13.616 -4.457 1.00 0.00 O ATOM 226 C5' DC A 8 -5.859 13.303 -3.500 1.00 0.00 C ATOM 227 C4' DC A 8 -5.420 13.804 -2.116 1.00 0.00 C ATOM 228 O4' DC A 8 -4.318 13.017 -1.678 1.00 0.00 O ATOM 229 C3' DC A 8 -4.946 15.272 -2.151 1.00 0.00 C ATOM 230 O3' DC A 8 -5.346 15.987 -0.999 1.00 0.00 O ATOM 231 C2' DC A 8 -3.436 15.080 -2.174 1.00 0.00 C ATOM 232 C1' DC A 8 -3.341 13.911 -1.191 1.00 0.00 C ATOM 233 N1 DC A 8 -1.991 13.343 -0.994 1.00 0.00 N ATOM 234 C2 DC A 8 -1.621 12.875 0.266 1.00 0.00 C ATOM 235 O2 DC A 8 -2.461 12.631 1.128 1.00 0.00 O ATOM 236 N3 DC A 8 -0.296 12.685 0.545 1.00 0.00 N ATOM 237 C4 DC A 8 0.637 13.005 -0.362 1.00 0.00 C ATOM 238 N4 DC A 8 1.913 12.791 -0.073 1.00 0.00 N ATOM 239 C5 DC A 8 0.271 13.528 -1.640 1.00 0.00 C ATOM 240 C6 DC A 8 -1.035 13.648 -1.897 1.00 0.00 C ATOM 0 H5' DC A 8 -6.024 12.226 -3.472 1.00 0.00 H new ATOM 0 H5'' DC A 8 -6.806 13.764 -3.781 1.00 0.00 H new ATOM 0 H4' DC A 8 -6.280 13.726 -1.450 1.00 0.00 H new ATOM 0 H3' DC A 8 -5.352 15.849 -2.982 1.00 0.00 H new ATOM 0 H2' DC A 8 -3.056 14.831 -3.165 1.00 0.00 H new ATOM 0 H2'' DC A 8 -2.892 15.962 -1.836 1.00 0.00 H new ATOM 0 HO3' DC A 8 -5.025 16.911 -1.060 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.532 14.217 -0.162 1.00 0.00 H new ATOM 0 H41 DC A 8 2.636 13.029 -0.752 1.00 0.00 H new ATOM 0 H42 DC A 8 2.171 12.389 0.828 1.00 0.00 H new ATOM 0 H5 DC A 8 1.017 13.814 -2.367 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.339 14.005 -2.870 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.140 10.897 9.515 1.00 0.00 O ATOM 255 C5' DG B 9 3.412 11.585 10.501 1.00 0.00 C ATOM 256 C4' DG B 9 1.904 11.535 10.225 1.00 0.00 C ATOM 257 O4' DG B 9 1.595 11.990 8.915 1.00 0.00 O ATOM 258 C3' DG B 9 1.271 10.171 10.423 1.00 0.00 C ATOM 259 O3' DG B 9 0.152 10.327 11.286 1.00 0.00 O ATOM 260 C2' DG B 9 0.907 9.715 9.015 1.00 0.00 C ATOM 261 C1' DG B 9 0.921 10.980 8.173 1.00 0.00 C ATOM 262 N9 DG B 9 1.562 10.836 6.843 1.00 0.00 N ATOM 263 C8 DG B 9 2.858 10.498 6.526 1.00 0.00 C ATOM 264 N7 DG B 9 3.153 10.629 5.265 1.00 0.00 N ATOM 265 C5 DG B 9 1.973 11.088 4.693 1.00 0.00 C ATOM 266 C6 DG B 9 1.681 11.455 3.346 1.00 0.00 C ATOM 267 O6 DG B 9 2.443 11.477 2.384 1.00 0.00 O ATOM 268 N1 DG B 9 0.358 11.822 3.164 1.00 0.00 N ATOM 269 C2 DG B 9 -0.575 11.867 4.169 1.00 0.00 C ATOM 270 N2 DG B 9 -1.822 12.203 3.860 1.00 0.00 N ATOM 271 N3 DG B 9 -0.304 11.568 5.444 1.00 0.00 N ATOM 272 C4 DG B 9 0.987 11.190 5.643 1.00 0.00 C ATOM 0 H5' DG B 9 3.741 12.623 10.540 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.619 11.148 11.478 1.00 0.00 H new ATOM 0 H4' DG B 9 1.478 12.204 10.973 1.00 0.00 H new ATOM 0 H3' DG B 9 1.911 9.425 10.893 1.00 0.00 H new ATOM 0 H2' DG B 9 1.623 8.984 8.640 1.00 0.00 H new ATOM 0 H2'' DG B 9 -0.074 9.239 8.996 1.00 0.00 H new ATOM 0 HO5' DG B 9 5.097 10.949 9.719 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.118 11.235 7.966 1.00 0.00 H new ATOM 0 H8 DG B 9 3.570 10.153 7.261 1.00 0.00 H new ATOM 0 H1 DG B 9 0.058 12.075 2.223 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.535 12.244 4.589 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.067 12.420 2.894 1.00 0.00 H new ATOM 285 P DC B 10 -0.785 9.104 11.767 1.00 0.00 P ATOM 286 OP1 DC B 10 -1.479 9.517 13.005 1.00 0.00 O ATOM 287 OP2 DC B 10 0.022 7.865 11.749 1.00 0.00 O ATOM 288 O5' DC B 10 -1.869 9.042 10.579 1.00 0.00 O ATOM 289 C5' DC B 10 -2.681 10.161 10.284 1.00 0.00 C ATOM 290 C4' DC B 10 -3.344 9.989 8.915 1.00 0.00 C ATOM 291 O4' DC B 10 -2.375 9.991 7.873 1.00 0.00 O ATOM 292 C3' DC B 10 -4.114 8.667 8.804 1.00 0.00 C ATOM 293 O3' DC B 10 -5.423 8.978 8.364 1.00 0.00 O ATOM 294 C2' DC B 10 -3.275 7.903 7.769 1.00 0.00 C ATOM 295 C1' DC B 10 -2.772 9.040 6.904 1.00 0.00 C ATOM 296 N1 DC B 10 -1.690 8.669 5.956 1.00 0.00 N ATOM 297 C2 DC B 10 -1.831 8.892 4.584 1.00 0.00 C ATOM 298 O2 DC B 10 -2.899 9.266 4.100 1.00 0.00 O ATOM 299 N3 DC B 10 -0.760 8.693 3.757 1.00 0.00 N ATOM 300 C4 DC B 10 0.379 8.193 4.256 1.00 0.00 C ATOM 301 N4 DC B 10 1.453 8.154 3.475 1.00 0.00 N ATOM 302 C5 DC B 10 0.516 7.875 5.644 1.00 0.00 C ATOM 303 C6 DC B 10 -0.536 8.144 6.441 1.00 0.00 C ATOM 0 H5' DC B 10 -2.078 11.069 10.292 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.444 10.278 11.053 1.00 0.00 H new ATOM 0 H4' DC B 10 -4.031 10.829 8.814 1.00 0.00 H new ATOM 0 H3' DC B 10 -4.237 8.083 9.716 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.460 7.345 8.230 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.871 7.187 7.203 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.530 9.407 6.212 1.00 0.00 H new ATOM 0 H41 DC B 10 2.331 7.778 3.833 1.00 0.00 H new ATOM 0 H42 DC B 10 1.400 8.500 2.517 1.00 0.00 H new ATOM 0 H5 DC B 10 1.423 7.438 6.036 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.459 7.936 7.498 1.00 0.00 H new ATOM 315 P DG B 11 -6.520 7.843 8.072 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.860 8.410 8.334 1.00 0.00 O ATOM 317 OP2 DG B 11 -6.101 6.605 8.764 1.00 0.00 O ATOM 318 O5' DG B 11 -6.359 7.618 6.483 1.00 0.00 O ATOM 319 C5' DG B 11 -6.832 8.562 5.539 1.00 0.00 C ATOM 320 C4' DG B 11 -7.463 7.854 4.327 1.00 0.00 C ATOM 321 O4' DG B 11 -6.469 7.569 3.366 1.00 0.00 O ATOM 322 C3' DG B 11 -8.137 6.526 4.685 1.00 0.00 C ATOM 323 O3' DG B 11 -9.262 6.348 3.845 1.00 0.00 O ATOM 324 C2' DG B 11 -7.002 5.533 4.454 1.00 0.00 C ATOM 325 C1' DG B 11 -6.219 6.180 3.310 1.00 0.00 C ATOM 326 N9 DG B 11 -4.759 6.001 3.399 1.00 0.00 N ATOM 327 C8 DG B 11 -3.990 5.798 4.510 1.00 0.00 C ATOM 328 N7 DG B 11 -2.707 5.838 4.297 1.00 0.00 N ATOM 329 C5 DG B 11 -2.617 6.059 2.925 1.00 0.00 C ATOM 330 C6 DG B 11 -1.478 6.094 2.069 1.00 0.00 C ATOM 331 O6 DG B 11 -0.296 5.999 2.383 1.00 0.00 O ATOM 332 N1 DG B 11 -1.811 6.255 0.735 1.00 0.00 N ATOM 333 C2 DG B 11 -3.097 6.376 0.268 1.00 0.00 C ATOM 334 N2 DG B 11 -3.291 6.503 -1.038 1.00 0.00 N ATOM 335 N3 DG B 11 -4.177 6.312 1.054 1.00 0.00 N ATOM 336 C4 DG B 11 -3.867 6.155 2.368 1.00 0.00 C ATOM 0 H5' DG B 11 -6.009 9.196 5.208 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.568 9.215 6.008 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.220 8.538 3.944 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.538 6.433 5.694 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.387 5.406 5.345 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.376 4.546 4.182 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.548 5.702 2.387 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.413 5.619 5.487 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.052 6.286 0.054 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.238 6.594 -1.406 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.493 6.509 -1.674 1.00 0.00 H new ATOM 348 P DT B 12 -10.247 5.085 4.001 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.572 5.460 3.465 1.00 0.00 O ATOM 350 OP2 DT B 12 -10.127 4.574 5.384 1.00 0.00 O ATOM 351 O5' DT B 12 -9.567 4.032 2.997 1.00 0.00 O ATOM 352 C5' DT B 12 -9.872 4.048 1.620 1.00 0.00 C ATOM 353 C4' DT B 12 -8.903 3.153 0.847 1.00 0.00 C ATOM 354 O4' DT B 12 -7.654 3.776 0.594 1.00 0.00 O ATOM 355 C3' DT B 12 -8.633 1.794 1.490 1.00 0.00 C ATOM 356 O3' DT B 12 -9.622 0.829 1.173 1.00 0.00 O ATOM 357 C2' DT B 12 -7.338 1.516 0.744 1.00 0.00 C ATOM 358 C1' DT B 12 -6.773 2.781 0.084 1.00 0.00 C ATOM 359 N1 DT B 12 -5.433 2.991 0.641 1.00 0.00 N ATOM 360 C2 DT B 12 -4.261 3.231 -0.078 1.00 0.00 C ATOM 361 O2 DT B 12 -4.248 3.417 -1.290 1.00 0.00 O ATOM 362 N3 DT B 12 -3.089 3.246 0.684 1.00 0.00 N ATOM 363 C4 DT B 12 -3.016 3.061 2.058 1.00 0.00 C ATOM 364 O4 DT B 12 -1.943 3.126 2.645 1.00 0.00 O ATOM 365 C5 DT B 12 -4.298 2.795 2.680 1.00 0.00 C ATOM 366 C7 DT B 12 -4.524 2.505 4.121 1.00 0.00 C ATOM 367 C6 DT B 12 -5.411 2.773 1.960 1.00 0.00 C ATOM 0 H5' DT B 12 -9.815 5.068 1.241 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.895 3.706 1.464 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.433 2.984 -0.090 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.611 1.769 2.579 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.601 1.108 1.436 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.514 0.757 -0.018 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.705 2.764 -1.004 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.212 3.407 0.188 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.512 2.860 4.413 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.460 1.430 4.290 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.766 3.012 4.717 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.345 2.569 2.463 1.00 0.00 H new ATOM 380 P DA B 13 -9.414 -0.741 1.518 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.552 -1.489 0.943 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.116 -0.847 2.962 1.00 0.00 O ATOM 383 O5' DA B 13 -8.080 -1.137 0.689 1.00 0.00 O ATOM 384 C5' DA B 13 -8.045 -1.065 -0.726 1.00 0.00 C ATOM 385 C4' DA B 13 -6.625 -0.825 -1.306 1.00 0.00 C ATOM 386 O4' DA B 13 -5.537 -1.047 -0.447 1.00 0.00 O ATOM 387 C3' DA B 13 -6.525 -1.831 -2.444 1.00 0.00 C ATOM 388 O3' DA B 13 -5.746 -1.294 -3.502 1.00 0.00 O ATOM 389 C2' DA B 13 -5.876 -2.959 -1.612 1.00 0.00 C ATOM 390 C1' DA B 13 -4.799 -2.158 -0.903 1.00 0.00 C ATOM 391 N9 DA B 13 -4.268 -2.740 0.328 1.00 0.00 N ATOM 392 C8 DA B 13 -4.895 -2.750 1.541 1.00 0.00 C ATOM 393 N7 DA B 13 -4.115 -3.037 2.550 1.00 0.00 N ATOM 394 C5 DA B 13 -2.863 -3.173 1.948 1.00 0.00 C ATOM 395 C6 DA B 13 -1.562 -3.375 2.443 1.00 0.00 C ATOM 396 N6 DA B 13 -1.282 -3.511 3.738 1.00 0.00 N ATOM 397 N1 DA B 13 -0.537 -3.343 1.581 1.00 0.00 N ATOM 398 C2 DA B 13 -0.766 -3.124 0.293 1.00 0.00 C ATOM 399 N3 DA B 13 -1.930 -2.928 -0.300 1.00 0.00 N ATOM 400 C4 DA B 13 -2.946 -2.960 0.598 1.00 0.00 C ATOM 0 H5' DA B 13 -8.703 -0.261 -1.056 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.444 -1.992 -1.138 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.545 0.231 -1.564 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.422 -2.138 -2.981 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.577 -3.425 -0.919 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.466 -3.755 -2.233 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.956 -2.024 -1.581 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.948 -2.538 1.657 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.318 -3.656 4.039 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.031 -3.471 4.429 1.00 0.00 H new ATOM 0 H2 DA B 13 0.103 -3.103 -0.348 1.00 0.00 H new ATOM 412 P DC B 14 -5.862 -1.846 -5.023 1.00 0.00 P ATOM 413 OP1 DC B 14 -6.081 -0.686 -5.912 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.828 -2.967 -5.029 1.00 0.00 O ATOM 415 O5' DC B 14 -4.403 -2.458 -5.316 1.00 0.00 O ATOM 416 C5' DC B 14 -3.865 -3.404 -4.426 1.00 0.00 C ATOM 417 C4' DC B 14 -2.414 -3.758 -4.731 1.00 0.00 C ATOM 418 O4' DC B 14 -1.760 -3.862 -3.475 1.00 0.00 O ATOM 419 C3' DC B 14 -2.308 -5.106 -5.443 1.00 0.00 C ATOM 420 O3' DC B 14 -1.214 -5.095 -6.348 1.00 0.00 O ATOM 421 C2' DC B 14 -2.094 -6.043 -4.272 1.00 0.00 C ATOM 422 C1' DC B 14 -1.393 -5.201 -3.223 1.00 0.00 C ATOM 423 N1 DC B 14 -1.773 -5.683 -1.883 1.00 0.00 N ATOM 424 C2 DC B 14 -0.793 -6.147 -1.024 1.00 0.00 C ATOM 425 O2 DC B 14 0.356 -6.344 -1.402 1.00 0.00 O ATOM 426 N3 DC B 14 -1.110 -6.390 0.271 1.00 0.00 N ATOM 427 C4 DC B 14 -2.370 -6.254 0.692 1.00 0.00 C ATOM 428 N4 DC B 14 -2.565 -6.353 2.000 1.00 0.00 N ATOM 429 C5 DC B 14 -3.432 -5.877 -0.207 1.00 0.00 C ATOM 430 C6 DC B 14 -3.070 -5.621 -1.482 1.00 0.00 C ATOM 0 H5' DC B 14 -4.469 -4.311 -4.461 1.00 0.00 H new ATOM 0 H5'' DC B 14 -3.932 -3.016 -3.410 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.972 -3.001 -5.379 1.00 0.00 H new ATOM 0 H3' DC B 14 -3.166 -5.382 -6.056 1.00 0.00 H new ATOM 0 H2' DC B 14 -3.041 -6.432 -3.898 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.488 -6.902 -4.559 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.306 -5.275 -3.266 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.505 -6.258 2.384 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.775 -6.524 2.622 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.458 -5.804 0.121 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.831 -5.360 -2.202 1.00 0.00 H new ATOM 442 P DG B 15 -0.799 -6.392 -7.226 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.237 -5.910 -8.506 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.948 -7.323 -7.238 1.00 0.00 O ATOM 445 O5' DG B 15 0.393 -7.080 -6.370 1.00 0.00 O ATOM 446 C5' DG B 15 1.654 -6.449 -6.272 1.00 0.00 C ATOM 447 C4' DG B 15 2.721 -7.289 -5.559 1.00 0.00 C ATOM 448 O4' DG B 15 2.333 -7.565 -4.227 1.00 0.00 O ATOM 449 C3' DG B 15 2.995 -8.634 -6.240 1.00 0.00 C ATOM 450 O3' DG B 15 4.400 -8.836 -6.190 1.00 0.00 O ATOM 451 C2' DG B 15 2.172 -9.589 -5.393 1.00 0.00 C ATOM 452 C1' DG B 15 2.313 -8.966 -4.012 1.00 0.00 C ATOM 453 N9 DG B 15 1.232 -9.249 -3.049 1.00 0.00 N ATOM 454 C8 DG B 15 -0.124 -9.262 -3.244 1.00 0.00 C ATOM 455 N7 DG B 15 -0.822 -9.340 -2.144 1.00 0.00 N ATOM 456 C5 DG B 15 0.144 -9.369 -1.136 1.00 0.00 C ATOM 457 C6 DG B 15 0.025 -9.423 0.288 1.00 0.00 C ATOM 458 O6 DG B 15 -0.995 -9.527 0.964 1.00 0.00 O ATOM 459 N1 DG B 15 1.251 -9.344 0.937 1.00 0.00 N ATOM 460 C2 DG B 15 2.460 -9.315 0.292 1.00 0.00 C ATOM 461 N2 DG B 15 3.567 -9.289 1.022 1.00 0.00 N ATOM 462 N3 DG B 15 2.588 -9.311 -1.037 1.00 0.00 N ATOM 463 C4 DG B 15 1.398 -9.310 -1.688 1.00 0.00 C ATOM 0 H5' DG B 15 1.535 -5.505 -5.741 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.007 -6.208 -7.275 1.00 0.00 H new ATOM 0 H4' DG B 15 3.629 -6.686 -5.596 1.00 0.00 H new ATOM 0 H3' DG B 15 2.723 -8.742 -7.290 1.00 0.00 H new ATOM 0 H2' DG B 15 1.133 -9.635 -5.718 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.561 -10.607 -5.426 1.00 0.00 H new ATOM 0 H1' DG B 15 3.209 -9.394 -3.563 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.576 -9.212 -4.223 1.00 0.00 H new ATOM 0 H1 DG B 15 1.251 -9.305 1.956 1.00 0.00 H new ATOM 0 H21 DG B 15 4.479 -9.267 0.565 1.00 0.00 H new ATOM 0 H22 DG B 15 3.507 -9.291 2.040 1.00 0.00 H new ATOM 475 P DC B 16 5.130 -10.131 -6.806 1.00 0.00 P ATOM 476 OP1 DC B 16 6.489 -9.735 -7.234 1.00 0.00 O ATOM 477 OP2 DC B 16 4.206 -10.759 -7.775 1.00 0.00 O ATOM 478 O5' DC B 16 5.263 -11.094 -5.524 1.00 0.00 O ATOM 479 C5' DC B 16 6.295 -10.934 -4.568 1.00 0.00 C ATOM 480 C4' DC B 16 6.053 -11.870 -3.375 1.00 0.00 C ATOM 481 O4' DC B 16 4.899 -11.423 -2.668 1.00 0.00 O ATOM 482 C3' DC B 16 5.785 -13.323 -3.818 1.00 0.00 C ATOM 483 O3' DC B 16 6.408 -14.256 -2.960 1.00 0.00 O ATOM 484 C2' DC B 16 4.269 -13.378 -3.697 1.00 0.00 C ATOM 485 C1' DC B 16 4.116 -12.567 -2.407 1.00 0.00 C ATOM 486 N1 DC B 16 2.727 -12.320 -1.972 1.00 0.00 N ATOM 487 C2 DC B 16 2.391 -12.368 -0.617 1.00 0.00 C ATOM 488 O2 DC B 16 3.244 -12.320 0.267 1.00 0.00 O ATOM 489 N3 DC B 16 1.074 -12.471 -0.267 1.00 0.00 N ATOM 490 C4 DC B 16 0.129 -12.584 -1.211 1.00 0.00 C ATOM 491 N4 DC B 16 -1.141 -12.660 -0.843 1.00 0.00 N ATOM 492 C5 DC B 16 0.467 -12.562 -2.598 1.00 0.00 C ATOM 493 C6 DC B 16 1.758 -12.405 -2.904 1.00 0.00 C ATOM 0 H5' DC B 16 6.330 -9.899 -4.228 1.00 0.00 H new ATOM 0 H5'' DC B 16 7.261 -11.153 -5.023 1.00 0.00 H new ATOM 0 H4' DC B 16 6.951 -11.850 -2.757 1.00 0.00 H new ATOM 0 H3' DC B 16 6.172 -13.572 -4.806 1.00 0.00 H new ATOM 0 H2' DC B 16 3.760 -12.922 -4.546 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.888 -14.395 -3.605 1.00 0.00 H new ATOM 0 HO3' DC B 16 6.215 -15.165 -3.270 1.00 0.00 H new ATOM 0 H1' DC B 16 4.460 -13.107 -1.525 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.872 -12.746 -1.549 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.388 -12.632 0.146 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.286 -12.667 -3.365 1.00 0.00 H new ATOM 0 H6 DC B 16 2.037 -12.343 -3.945 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.945 0.175 -0.488 1.00 0.00 O HETATM 508 C2 PSO A 9 -2.193 0.236 -0.210 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.696 0.171 1.098 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.794 0.046 2.147 1.00 0.00 C HETATM 511 C5 PSO A 9 0.560 0.095 2.819 1.00 0.00 C HETATM 512 C6 PSO A 9 1.907 0.205 2.446 1.00 0.00 C HETATM 513 C7 PSO A 9 2.274 0.181 1.145 1.00 0.00 C HETATM 514 C8 PSO A 9 1.283 0.069 0.140 1.00 0.00 C HETATM 515 C9 PSO A 9 -0.090 0.125 0.479 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.435 0.094 1.823 1.00 0.00 C HETATM 517 C4' PSO A 9 3.089 0.017 3.352 1.00 0.00 C HETATM 518 C5' PSO A 9 4.171 -0.004 2.256 1.00 0.00 C HETATM 519 O6' PSO A 9 3.528 0.193 0.967 1.00 0.00 O HETATM 520 O11 PSO A 9 -2.992 0.358 -1.135 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.263 -0.131 3.571 1.00 0.00 C HETATM 522 C13 PSO A 9 3.153 1.019 4.523 1.00 0.00 C HETATM 523 O14 PSO A 9 1.958 1.729 4.769 1.00 0.00 O HETATM 524 C15 PSO A 9 5.461 0.774 2.582 1.00 0.00 C HETATM 525 C16 PSO A 9 1.656 -0.119 -1.315 1.00 0.00 C HETATM 0 H163 PSO A 9 2.256 0.727 -1.649 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.231 -1.038 -1.427 1.00 0.00 H new HETATM 0 H161 PSO A 9 0.750 -0.182 -1.918 1.00 0.00 H new HETATM 0 H153 PSO A 9 5.220 1.823 2.755 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.922 0.355 3.477 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.155 0.695 1.745 1.00 0.00 H new HETATM 0 H132 PSO A 9 3.429 0.479 5.428 1.00 0.00 H new HETATM 0 H131 PSO A 9 3.949 1.736 4.324 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.868 0.727 3.864 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.861 -1.039 3.647 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.399 -0.208 4.232 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.286 0.011 3.871 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.769 0.217 1.287 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.089 2.337 5.526 1.00 0.00 H new