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 -21:sc= 0.0494 USER MOD Single : A 4 DT C7 :methyl -30:sc= -1.53! (180deg=-4.14!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot 180:sc= 0.0996 USER MOD Single : B 9 DG O5' : rot -25:sc= 0.078 USER MOD Single : B 12 DT C7 :methyl 150:sc= -3.52! (180deg=-3.52!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.961 -13.997 9.288 1.00 0.00 O ATOM 2 C5' DG A 1 -2.683 -12.630 9.496 1.00 0.00 C ATOM 3 C4' DG A 1 -1.163 -12.436 9.532 1.00 0.00 C ATOM 4 O4' DG A 1 -0.524 -13.037 8.403 1.00 0.00 O ATOM 5 C3' DG A 1 -0.784 -10.972 9.521 1.00 0.00 C ATOM 6 O3' DG A 1 0.414 -10.795 10.253 1.00 0.00 O ATOM 7 C2' DG A 1 -0.658 -10.732 8.040 1.00 0.00 C ATOM 8 C1' DG A 1 -0.173 -12.039 7.445 1.00 0.00 C ATOM 9 N9 DG A 1 -0.826 -12.290 6.134 1.00 0.00 N ATOM 10 C8 DG A 1 -2.141 -12.613 5.910 1.00 0.00 C ATOM 11 N7 DG A 1 -2.472 -12.714 4.659 1.00 0.00 N ATOM 12 C5 DG A 1 -1.284 -12.464 3.988 1.00 0.00 C ATOM 13 C6 DG A 1 -1.021 -12.466 2.589 1.00 0.00 C ATOM 14 O6 DG A 1 -1.819 -12.640 1.673 1.00 0.00 O ATOM 15 N1 DG A 1 0.310 -12.242 2.293 1.00 0.00 N ATOM 16 C2 DG A 1 1.281 -12.004 3.235 1.00 0.00 C ATOM 17 N2 DG A 1 2.524 -11.826 2.793 1.00 0.00 N ATOM 18 N3 DG A 1 1.042 -11.964 4.557 1.00 0.00 N ATOM 19 C4 DG A 1 -0.260 -12.215 4.873 1.00 0.00 C ATOM 0 H5' DG A 1 -3.129 -12.292 10.431 1.00 0.00 H new ATOM 0 H5'' DG A 1 -3.121 -12.030 8.699 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.832 -12.910 10.456 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.478 -10.274 9.990 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.615 -10.439 7.609 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.045 -9.925 7.834 1.00 0.00 H new ATOM 0 HO5' DG A 1 -2.178 -14.433 8.892 1.00 0.00 H new ATOM 0 H1' DG A 1 0.900 -12.033 7.251 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.846 -12.771 6.713 1.00 0.00 H new ATOM 0 H1 DG A 1 0.589 -12.254 1.312 1.00 0.00 H new ATOM 0 H21 DG A 1 3.280 -11.646 3.454 1.00 0.00 H new ATOM 0 H22 DG A 1 2.721 -11.869 1.793 1.00 0.00 H new ATOM 32 P DC A 2 1.055 -9.343 10.531 1.00 0.00 P ATOM 33 OP1 DC A 2 1.730 -9.383 11.846 1.00 0.00 O ATOM 34 OP2 DC A 2 0.026 -8.316 10.261 1.00 0.00 O ATOM 35 O5' DC A 2 2.176 -9.244 9.382 1.00 0.00 O ATOM 36 C5' DC A 2 3.194 -10.215 9.292 1.00 0.00 C ATOM 37 C4' DC A 2 4.283 -9.808 8.298 1.00 0.00 C ATOM 38 O4' DC A 2 3.859 -9.882 6.940 1.00 0.00 O ATOM 39 C3' DC A 2 4.770 -8.379 8.522 1.00 0.00 C ATOM 40 O3' DC A 2 6.162 -8.464 8.299 1.00 0.00 O ATOM 41 C2' DC A 2 3.945 -7.608 7.487 1.00 0.00 C ATOM 42 C1' DC A 2 3.812 -8.598 6.321 1.00 0.00 C ATOM 43 N1 DC A 2 2.511 -8.549 5.569 1.00 0.00 N ATOM 44 C2 DC A 2 2.506 -8.872 4.214 1.00 0.00 C ATOM 45 O2 DC A 2 3.555 -9.106 3.619 1.00 0.00 O ATOM 46 N3 DC A 2 1.323 -8.933 3.526 1.00 0.00 N ATOM 47 C4 DC A 2 0.167 -8.694 4.161 1.00 0.00 C ATOM 48 N4 DC A 2 -0.976 -8.858 3.503 1.00 0.00 N ATOM 49 C5 DC A 2 0.124 -8.384 5.553 1.00 0.00 C ATOM 50 C6 DC A 2 1.308 -8.351 6.204 1.00 0.00 C ATOM 0 H5' DC A 2 2.761 -11.168 8.987 1.00 0.00 H new ATOM 0 H5'' DC A 2 3.639 -10.367 10.275 1.00 0.00 H new ATOM 0 H4' DC A 2 5.084 -10.525 8.480 1.00 0.00 H new ATOM 0 H3' DC A 2 4.644 -7.892 9.489 1.00 0.00 H new ATOM 0 H2' DC A 2 2.971 -7.322 7.883 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.445 -6.690 7.179 1.00 0.00 H new ATOM 0 H1' DC A 2 4.592 -8.365 5.596 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.864 -8.680 3.972 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.965 -9.162 2.529 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.808 -8.186 6.061 1.00 0.00 H new ATOM 0 H6 DC A 2 1.309 -8.161 7.267 1.00 0.00 H new ATOM 62 P DG A 3 7.118 -7.186 8.264 1.00 0.00 P ATOM 63 OP1 DG A 3 8.493 -7.615 8.596 1.00 0.00 O ATOM 64 OP2 DG A 3 6.477 -6.086 9.016 1.00 0.00 O ATOM 65 O5' DG A 3 7.018 -6.874 6.698 1.00 0.00 O ATOM 66 C5' DG A 3 7.480 -7.803 5.739 1.00 0.00 C ATOM 67 C4' DG A 3 7.643 -7.125 4.380 1.00 0.00 C ATOM 68 O4' DG A 3 6.366 -7.049 3.789 1.00 0.00 O ATOM 69 C3' DG A 3 8.200 -5.706 4.541 1.00 0.00 C ATOM 70 O3' DG A 3 9.096 -5.426 3.483 1.00 0.00 O ATOM 71 C2' DG A 3 6.901 -4.903 4.513 1.00 0.00 C ATOM 72 C1' DG A 3 6.047 -5.702 3.548 1.00 0.00 C ATOM 73 N9 DG A 3 4.595 -5.534 3.743 1.00 0.00 N ATOM 74 C8 DG A 3 3.883 -5.257 4.881 1.00 0.00 C ATOM 75 N7 DG A 3 2.599 -5.446 4.759 1.00 0.00 N ATOM 76 C5 DG A 3 2.436 -5.794 3.419 1.00 0.00 C ATOM 77 C6 DG A 3 1.258 -6.022 2.641 1.00 0.00 C ATOM 78 O6 DG A 3 0.088 -6.054 3.018 1.00 0.00 O ATOM 79 N1 DG A 3 1.543 -6.224 1.300 1.00 0.00 N ATOM 80 C2 DG A 3 2.812 -6.241 0.765 1.00 0.00 C ATOM 81 N2 DG A 3 2.979 -6.428 -0.538 1.00 0.00 N ATOM 82 N3 DG A 3 3.916 -6.050 1.485 1.00 0.00 N ATOM 83 C4 DG A 3 3.656 -5.823 2.793 1.00 0.00 C ATOM 0 H5' DG A 3 6.777 -8.632 5.658 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.433 -8.224 6.060 1.00 0.00 H new ATOM 0 H4' DG A 3 8.337 -7.698 3.765 1.00 0.00 H new ATOM 0 H3' DG A 3 8.793 -5.499 5.432 1.00 0.00 H new ATOM 0 H2' DG A 3 6.444 -4.835 5.500 1.00 0.00 H new ATOM 0 H2'' DG A 3 7.061 -3.883 4.165 1.00 0.00 H new ATOM 0 H1' DG A 3 6.257 -5.360 2.535 1.00 0.00 H new ATOM 0 H8 DG A 3 4.344 -4.913 5.795 1.00 0.00 H new ATOM 0 H1 DG A 3 0.758 -6.370 0.665 1.00 0.00 H new ATOM 0 H21 DG A 3 3.918 -6.441 -0.935 1.00 0.00 H new ATOM 0 H22 DG A 3 2.168 -6.559 -1.142 1.00 0.00 H new ATOM 95 P DT A 4 10.010 -4.094 3.465 1.00 0.00 P ATOM 96 OP1 DT A 4 11.306 -4.434 2.840 1.00 0.00 O ATOM 97 OP2 DT A 4 9.977 -3.484 4.812 1.00 0.00 O ATOM 98 O5' DT A 4 9.183 -3.157 2.464 1.00 0.00 O ATOM 99 C5' DT A 4 9.150 -3.451 1.085 1.00 0.00 C ATOM 100 C4' DT A 4 7.874 -2.879 0.478 1.00 0.00 C ATOM 101 O4' DT A 4 6.723 -3.332 1.180 1.00 0.00 O ATOM 102 C3' DT A 4 7.756 -1.363 0.568 1.00 0.00 C ATOM 103 O3' DT A 4 8.535 -0.639 -0.361 1.00 0.00 O ATOM 104 C2' DT A 4 6.265 -1.266 0.281 1.00 0.00 C ATOM 105 C1' DT A 4 5.633 -2.594 0.659 1.00 0.00 C ATOM 106 N1 DT A 4 4.479 -2.470 1.595 1.00 0.00 N ATOM 107 C2 DT A 4 3.230 -2.960 1.235 1.00 0.00 C ATOM 108 O2 DT A 4 2.968 -3.351 0.103 1.00 0.00 O ATOM 109 N3 DT A 4 2.264 -2.997 2.211 1.00 0.00 N ATOM 110 C4 DT A 4 2.342 -2.483 3.477 1.00 0.00 C ATOM 111 O4 DT A 4 1.490 -2.765 4.316 1.00 0.00 O ATOM 112 C5 DT A 4 3.502 -1.553 3.806 1.00 0.00 C ATOM 113 C7 DT A 4 4.123 -1.783 5.184 1.00 0.00 C ATOM 114 C6 DT A 4 4.610 -1.535 2.746 1.00 0.00 C ATOM 0 H5' DT A 4 9.188 -4.529 0.930 1.00 0.00 H new ATOM 0 H5'' DT A 4 10.024 -3.027 0.590 1.00 0.00 H new ATOM 0 H4' DT A 4 7.928 -3.208 -0.560 1.00 0.00 H new ATOM 0 H3' DT A 4 8.118 -0.931 1.501 1.00 0.00 H new ATOM 0 H2' DT A 4 5.818 -0.453 0.853 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.092 -1.047 -0.773 1.00 0.00 H new ATOM 0 H1' DT A 4 5.164 -3.090 -0.191 1.00 0.00 H new ATOM 0 H3 DT A 4 1.389 -3.460 1.964 1.00 0.00 H new ATOM 0 H71 DT A 4 3.362 -2.157 5.868 1.00 0.00 H new ATOM 0 H72 DT A 4 4.928 -2.513 5.103 1.00 0.00 H new ATOM 0 H73 DT A 4 4.522 -0.843 5.565 1.00 0.00 H new ATOM 0 H6 DT A 4 5.455 -0.868 2.831 1.00 0.00 H new ATOM 127 P DA A 5 8.466 0.977 -0.404 1.00 0.00 P ATOM 128 OP1 DA A 5 9.684 1.458 -1.091 1.00 0.00 O ATOM 129 OP2 DA A 5 8.163 1.462 0.960 1.00 0.00 O ATOM 130 O5' DA A 5 7.182 1.289 -1.342 1.00 0.00 O ATOM 131 C5' DA A 5 7.354 1.350 -2.741 1.00 0.00 C ATOM 132 C4' DA A 5 6.094 1.461 -3.610 1.00 0.00 C ATOM 133 O4' DA A 5 4.924 1.348 -2.803 1.00 0.00 O ATOM 134 C3' DA A 5 6.104 2.824 -4.289 1.00 0.00 C ATOM 135 O3' DA A 5 5.331 2.859 -5.471 1.00 0.00 O ATOM 136 C2' DA A 5 5.477 3.537 -3.119 1.00 0.00 C ATOM 137 C1' DA A 5 4.322 2.624 -2.732 1.00 0.00 C ATOM 138 N9 DA A 5 3.775 2.930 -1.393 1.00 0.00 N ATOM 139 C8 DA A 5 4.460 3.068 -0.215 1.00 0.00 C ATOM 140 N7 DA A 5 3.703 3.260 0.830 1.00 0.00 N ATOM 141 C5 DA A 5 2.415 3.249 0.301 1.00 0.00 C ATOM 142 C6 DA A 5 1.134 3.358 0.875 1.00 0.00 C ATOM 143 N6 DA A 5 0.971 3.441 2.192 1.00 0.00 N ATOM 144 N1 DA A 5 0.046 3.321 0.080 1.00 0.00 N ATOM 145 C2 DA A 5 0.234 3.176 -1.228 1.00 0.00 C ATOM 146 N3 DA A 5 1.378 3.058 -1.892 1.00 0.00 N ATOM 147 C4 DA A 5 2.448 3.091 -1.058 1.00 0.00 C ATOM 0 H5' DA A 5 7.898 0.458 -3.051 1.00 0.00 H new ATOM 0 H5'' DA A 5 7.992 2.206 -2.964 1.00 0.00 H new ATOM 0 H4' DA A 5 6.086 0.660 -4.349 1.00 0.00 H new ATOM 0 H3' DA A 5 7.051 3.212 -4.665 1.00 0.00 H new ATOM 0 H2' DA A 5 6.183 3.662 -2.298 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.128 4.532 -3.394 1.00 0.00 H new ATOM 0 H1' DA A 5 3.449 2.727 -3.376 1.00 0.00 H new ATOM 0 H8 DA A 5 5.537 3.022 -0.156 1.00 0.00 H new ATOM 0 H61 DA A 5 0.033 3.519 2.586 1.00 0.00 H new ATOM 0 H62 DA A 5 1.784 3.426 2.808 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.662 3.151 -1.830 1.00 0.00 H new ATOM 159 P DC A 6 5.211 4.214 -6.351 1.00 0.00 P ATOM 160 OP1 DC A 6 5.234 3.835 -7.779 1.00 0.00 O ATOM 161 OP2 DC A 6 6.184 5.202 -5.836 1.00 0.00 O ATOM 162 O5' DC A 6 3.734 4.720 -5.967 1.00 0.00 O ATOM 163 C5' DC A 6 2.637 3.921 -6.335 1.00 0.00 C ATOM 164 C4' DC A 6 1.278 4.545 -6.039 1.00 0.00 C ATOM 165 O4' DC A 6 1.009 4.605 -4.633 1.00 0.00 O ATOM 166 C3' DC A 6 1.122 5.975 -6.583 1.00 0.00 C ATOM 167 O3' DC A 6 -0.138 6.095 -7.229 1.00 0.00 O ATOM 168 C2' DC A 6 1.183 6.822 -5.311 1.00 0.00 C ATOM 169 C1' DC A 6 0.638 5.923 -4.214 1.00 0.00 C ATOM 170 N1 DC A 6 1.132 6.241 -2.847 1.00 0.00 N ATOM 171 C2 DC A 6 0.199 6.454 -1.834 1.00 0.00 C ATOM 172 O2 DC A 6 -1.000 6.579 -2.062 1.00 0.00 O ATOM 173 N3 DC A 6 0.607 6.529 -0.544 1.00 0.00 N ATOM 174 C4 DC A 6 1.904 6.479 -0.247 1.00 0.00 C ATOM 175 N4 DC A 6 2.231 6.401 1.036 1.00 0.00 N ATOM 176 C5 DC A 6 2.899 6.339 -1.268 1.00 0.00 C ATOM 177 C6 DC A 6 2.465 6.224 -2.544 1.00 0.00 C ATOM 0 H5' DC A 6 2.707 2.967 -5.813 1.00 0.00 H new ATOM 0 H5'' DC A 6 2.700 3.707 -7.402 1.00 0.00 H new ATOM 0 H4' DC A 6 0.573 3.887 -6.546 1.00 0.00 H new ATOM 0 H3' DC A 6 1.872 6.268 -7.318 1.00 0.00 H new ATOM 0 H2' DC A 6 2.204 7.135 -5.094 1.00 0.00 H new ATOM 0 H2'' DC A 6 0.586 7.729 -5.411 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.439 6.053 -4.105 1.00 0.00 H new ATOM 0 H41 DC A 6 3.213 6.360 1.311 1.00 0.00 H new ATOM 0 H42 DC A 6 1.501 6.382 1.748 1.00 0.00 H new ATOM 0 H5 DC A 6 3.952 6.326 -1.029 1.00 0.00 H new ATOM 0 H6 DC A 6 3.187 6.116 -3.340 1.00 0.00 H new ATOM 189 P DG A 7 -0.642 7.483 -7.900 1.00 0.00 P ATOM 190 OP1 DG A 7 -1.554 7.141 -9.013 1.00 0.00 O ATOM 191 OP2 DG A 7 0.548 8.319 -8.164 1.00 0.00 O ATOM 192 O5' DG A 7 -1.508 8.204 -6.730 1.00 0.00 O ATOM 193 C5' DG A 7 -2.782 7.707 -6.373 1.00 0.00 C ATOM 194 C4' DG A 7 -3.574 8.595 -5.404 1.00 0.00 C ATOM 195 O4' DG A 7 -2.961 8.631 -4.130 1.00 0.00 O ATOM 196 C3' DG A 7 -3.711 10.042 -5.886 1.00 0.00 C ATOM 197 O3' DG A 7 -5.041 10.449 -5.602 1.00 0.00 O ATOM 198 C2' DG A 7 -2.632 10.742 -5.076 1.00 0.00 C ATOM 199 C1' DG A 7 -2.685 9.972 -3.766 1.00 0.00 C ATOM 200 N9 DG A 7 -1.463 9.957 -2.941 1.00 0.00 N ATOM 201 C8 DG A 7 -0.156 9.865 -3.335 1.00 0.00 C ATOM 202 N7 DG A 7 0.685 9.680 -2.354 1.00 0.00 N ATOM 203 C5 DG A 7 -0.127 9.649 -1.219 1.00 0.00 C ATOM 204 C6 DG A 7 0.194 9.496 0.166 1.00 0.00 C ATOM 205 O6 DG A 7 1.301 9.372 0.680 1.00 0.00 O ATOM 206 N1 DG A 7 -0.926 9.493 0.985 1.00 0.00 N ATOM 207 C2 DG A 7 -2.209 9.663 0.534 1.00 0.00 C ATOM 208 N2 DG A 7 -3.194 9.661 1.423 1.00 0.00 N ATOM 209 N3 DG A 7 -2.522 9.837 -0.753 1.00 0.00 N ATOM 210 C4 DG A 7 -1.442 9.808 -1.576 1.00 0.00 C ATOM 0 H5' DG A 7 -2.658 6.722 -5.922 1.00 0.00 H new ATOM 0 H5'' DG A 7 -3.370 7.570 -7.281 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.565 8.144 -5.352 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.572 10.242 -6.948 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.654 10.674 -5.552 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.846 11.802 -4.937 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.428 10.472 -3.145 1.00 0.00 H new ATOM 0 H8 DG A 7 0.153 9.939 -4.367 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.786 9.356 1.986 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.159 9.785 1.116 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.987 9.535 2.414 1.00 0.00 H new ATOM 222 P DC A 8 -5.627 11.891 -6.013 1.00 0.00 P ATOM 223 OP1 DC A 8 -7.077 11.745 -6.264 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.751 12.459 -7.060 1.00 0.00 O ATOM 225 O5' DC A 8 -5.418 12.743 -4.666 1.00 0.00 O ATOM 226 C5' DC A 8 -6.332 12.676 -3.588 1.00 0.00 C ATOM 227 C4' DC A 8 -5.760 13.421 -2.374 1.00 0.00 C ATOM 228 O4' DC A 8 -4.647 12.687 -1.869 1.00 0.00 O ATOM 229 C3' DC A 8 -5.251 14.830 -2.742 1.00 0.00 C ATOM 230 O3' DC A 8 -5.561 15.774 -1.737 1.00 0.00 O ATOM 231 C2' DC A 8 -3.752 14.573 -2.820 1.00 0.00 C ATOM 232 C1' DC A 8 -3.620 13.622 -1.628 1.00 0.00 C ATOM 233 N1 DC A 8 -2.272 13.060 -1.401 1.00 0.00 N ATOM 234 C2 DC A 8 -1.822 12.846 -0.098 1.00 0.00 C ATOM 235 O2 DC A 8 -2.603 12.815 0.850 1.00 0.00 O ATOM 236 N3 DC A 8 -0.485 12.669 0.127 1.00 0.00 N ATOM 237 C4 DC A 8 0.385 12.760 -0.889 1.00 0.00 C ATOM 238 N4 DC A 8 1.672 12.548 -0.653 1.00 0.00 N ATOM 239 C5 DC A 8 -0.062 13.009 -2.223 1.00 0.00 C ATOM 240 C6 DC A 8 -1.381 13.123 -2.413 1.00 0.00 C ATOM 0 H5' DC A 8 -6.527 11.635 -3.329 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.286 13.116 -3.880 1.00 0.00 H new ATOM 0 H4' DC A 8 -6.561 13.515 -1.641 1.00 0.00 H new ATOM 0 H3' DC A 8 -5.690 15.248 -3.648 1.00 0.00 H new ATOM 0 H2' DC A 8 -3.450 14.115 -3.762 1.00 0.00 H new ATOM 0 H2'' DC A 8 -3.161 15.481 -2.704 1.00 0.00 H new ATOM 0 HO3' DC A 8 -5.223 16.655 -2.001 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.737 14.130 -0.671 1.00 0.00 H new ATOM 0 H41 DC A 8 2.348 12.613 -1.414 1.00 0.00 H new ATOM 0 H42 DC A 8 1.987 12.320 0.290 1.00 0.00 H new ATOM 0 H5 DC A 8 0.635 13.101 -3.043 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.748 13.272 -3.418 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.215 12.980 8.812 1.00 0.00 O ATOM 255 C5' DG B 9 3.733 11.831 9.474 1.00 0.00 C ATOM 256 C4' DG B 9 2.224 11.973 9.696 1.00 0.00 C ATOM 257 O4' DG B 9 1.547 12.403 8.521 1.00 0.00 O ATOM 258 C3' DG B 9 1.589 10.659 10.100 1.00 0.00 C ATOM 259 O3' DG B 9 0.526 10.932 10.999 1.00 0.00 O ATOM 260 C2' DG B 9 1.137 10.081 8.763 1.00 0.00 C ATOM 261 C1' DG B 9 0.983 11.289 7.840 1.00 0.00 C ATOM 262 N9 DG B 9 1.593 11.163 6.489 1.00 0.00 N ATOM 263 C8 DG B 9 2.897 10.902 6.135 1.00 0.00 C ATOM 264 N7 DG B 9 3.150 11.038 4.866 1.00 0.00 N ATOM 265 C5 DG B 9 1.930 11.420 4.323 1.00 0.00 C ATOM 266 C6 DG B 9 1.586 11.755 2.980 1.00 0.00 C ATOM 267 O6 DG B 9 2.327 11.818 2.003 1.00 0.00 O ATOM 268 N1 DG B 9 0.239 12.036 2.822 1.00 0.00 N ATOM 269 C2 DG B 9 -0.670 12.038 3.851 1.00 0.00 C ATOM 270 N2 DG B 9 -1.942 12.290 3.563 1.00 0.00 N ATOM 271 N3 DG B 9 -0.351 11.775 5.125 1.00 0.00 N ATOM 272 C4 DG B 9 0.966 11.473 5.299 1.00 0.00 C ATOM 0 H5' DG B 9 4.243 11.706 10.429 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.943 10.940 8.882 1.00 0.00 H new ATOM 0 H4' DG B 9 2.123 12.714 10.489 1.00 0.00 H new ATOM 0 H3' DG B 9 2.235 9.956 10.626 1.00 0.00 H new ATOM 0 H2' DG B 9 1.869 9.376 8.370 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.196 9.540 8.865 1.00 0.00 H new ATOM 0 HO5' DG B 9 3.487 13.393 8.301 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.082 11.397 7.635 1.00 0.00 H new ATOM 0 H8 DG B 9 3.649 10.608 6.852 1.00 0.00 H new ATOM 0 H1 DG B 9 -0.098 12.255 1.884 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.641 12.299 4.306 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.220 12.475 2.599 1.00 0.00 H new ATOM 285 P DC B 10 -0.325 9.770 11.731 1.00 0.00 P ATOM 286 OP1 DC B 10 -0.952 10.351 12.938 1.00 0.00 O ATOM 287 OP2 DC B 10 0.535 8.573 11.849 1.00 0.00 O ATOM 288 O5' DC B 10 -1.477 9.468 10.649 1.00 0.00 O ATOM 289 C5' DC B 10 -2.432 10.456 10.324 1.00 0.00 C ATOM 290 C4' DC B 10 -3.129 10.108 9.007 1.00 0.00 C ATOM 291 O4' DC B 10 -2.208 10.124 7.927 1.00 0.00 O ATOM 292 C3' DC B 10 -3.782 8.718 9.012 1.00 0.00 C ATOM 293 O3' DC B 10 -5.151 8.912 8.712 1.00 0.00 O ATOM 294 C2' DC B 10 -2.994 7.986 7.913 1.00 0.00 C ATOM 295 C1' DC B 10 -2.610 9.135 7.003 1.00 0.00 C ATOM 296 N1 DC B 10 -1.556 8.810 6.004 1.00 0.00 N ATOM 297 C2 DC B 10 -1.776 9.048 4.647 1.00 0.00 C ATOM 298 O2 DC B 10 -2.876 9.411 4.235 1.00 0.00 O ATOM 299 N3 DC B 10 -0.752 8.876 3.757 1.00 0.00 N ATOM 300 C4 DC B 10 0.426 8.401 4.185 1.00 0.00 C ATOM 301 N4 DC B 10 1.452 8.383 3.342 1.00 0.00 N ATOM 302 C5 DC B 10 0.652 8.083 5.559 1.00 0.00 C ATOM 303 C6 DC B 10 -0.358 8.317 6.418 1.00 0.00 C ATOM 0 H5' DC B 10 -1.946 11.428 10.240 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.169 10.536 11.123 1.00 0.00 H new ATOM 0 H4' DC B 10 -3.902 10.867 8.890 1.00 0.00 H new ATOM 0 H3' DC B 10 -3.752 8.151 9.943 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.121 7.467 8.310 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.601 7.241 7.399 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.431 9.442 6.355 1.00 0.00 H new ATOM 0 H41 DC B 10 2.357 8.026 3.648 1.00 0.00 H new ATOM 0 H42 DC B 10 1.335 8.727 2.389 1.00 0.00 H new ATOM 0 H5 DC B 10 1.593 7.672 5.895 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.212 8.107 7.467 1.00 0.00 H new ATOM 315 P DG B 11 -6.177 7.691 8.537 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.519 8.147 8.959 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.582 6.486 9.154 1.00 0.00 O ATOM 318 O5' DG B 11 -6.173 7.493 6.938 1.00 0.00 O ATOM 319 C5' DG B 11 -6.714 8.471 6.068 1.00 0.00 C ATOM 320 C4' DG B 11 -7.344 7.820 4.826 1.00 0.00 C ATOM 321 O4' DG B 11 -6.359 7.610 3.837 1.00 0.00 O ATOM 322 C3' DG B 11 -7.980 6.458 5.122 1.00 0.00 C ATOM 323 O3' DG B 11 -9.116 6.307 4.291 1.00 0.00 O ATOM 324 C2' DG B 11 -6.829 5.507 4.812 1.00 0.00 C ATOM 325 C1' DG B 11 -6.102 6.229 3.679 1.00 0.00 C ATOM 326 N9 DG B 11 -4.640 6.054 3.694 1.00 0.00 N ATOM 327 C8 DG B 11 -3.817 5.826 4.760 1.00 0.00 C ATOM 328 N7 DG B 11 -2.546 5.880 4.483 1.00 0.00 N ATOM 329 C5 DG B 11 -2.523 6.138 3.112 1.00 0.00 C ATOM 330 C6 DG B 11 -1.431 6.213 2.196 1.00 0.00 C ATOM 331 O6 DG B 11 -0.232 6.108 2.435 1.00 0.00 O ATOM 332 N1 DG B 11 -1.844 6.431 0.891 1.00 0.00 N ATOM 333 C2 DG B 11 -3.158 6.541 0.499 1.00 0.00 C ATOM 334 N2 DG B 11 -3.439 6.728 -0.783 1.00 0.00 N ATOM 335 N3 DG B 11 -4.189 6.430 1.339 1.00 0.00 N ATOM 336 C4 DG B 11 -3.803 6.238 2.626 1.00 0.00 C ATOM 0 H5' DG B 11 -5.930 9.163 5.761 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.466 9.056 6.597 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.120 8.508 4.489 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.357 6.295 6.132 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.183 5.355 5.677 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.186 4.524 4.504 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.466 5.810 2.741 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.190 5.618 5.752 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.125 6.516 0.173 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.410 6.811 -1.086 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.685 6.789 -1.467 1.00 0.00 H new ATOM 348 P DT B 12 -10.050 4.998 4.351 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.399 5.369 3.875 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.881 4.373 5.680 1.00 0.00 O ATOM 351 O5' DT B 12 -9.348 4.058 3.253 1.00 0.00 O ATOM 352 C5' DT B 12 -9.672 4.174 1.885 1.00 0.00 C ATOM 353 C4' DT B 12 -8.737 3.313 1.033 1.00 0.00 C ATOM 354 O4' DT B 12 -7.490 3.933 0.770 1.00 0.00 O ATOM 355 C3' DT B 12 -8.455 1.924 1.601 1.00 0.00 C ATOM 356 O3' DT B 12 -9.459 0.978 1.273 1.00 0.00 O ATOM 357 C2' DT B 12 -7.185 1.653 0.810 1.00 0.00 C ATOM 358 C1' DT B 12 -6.626 2.950 0.208 1.00 0.00 C ATOM 359 N1 DT B 12 -5.276 3.133 0.747 1.00 0.00 N ATOM 360 C2 DT B 12 -4.111 3.378 0.018 1.00 0.00 C ATOM 361 O2 DT B 12 -4.109 3.581 -1.191 1.00 0.00 O ATOM 362 N3 DT B 12 -2.929 3.377 0.767 1.00 0.00 N ATOM 363 C4 DT B 12 -2.843 3.163 2.136 1.00 0.00 C ATOM 364 O4 DT B 12 -1.765 3.210 2.714 1.00 0.00 O ATOM 365 C5 DT B 12 -4.119 2.889 2.766 1.00 0.00 C ATOM 366 C7 DT B 12 -4.325 2.574 4.204 1.00 0.00 C ATOM 367 C6 DT B 12 -5.242 2.888 2.060 1.00 0.00 C ATOM 0 H5' DT B 12 -9.597 5.216 1.576 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.705 3.867 1.724 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.302 3.200 0.108 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.399 1.862 2.688 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.438 1.197 1.460 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.393 0.938 0.014 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.580 2.978 -0.881 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.058 3.548 0.265 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.308 2.925 4.516 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.261 1.496 4.353 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.557 3.069 4.799 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.171 2.680 2.570 1.00 0.00 H new ATOM 380 P DA B 13 -9.255 -0.604 1.569 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.404 -1.328 0.986 1.00 0.00 O ATOM 382 OP2 DA B 13 -8.942 -0.754 3.007 1.00 0.00 O ATOM 383 O5' DA B 13 -7.925 -0.982 0.723 1.00 0.00 O ATOM 384 C5' DA B 13 -7.902 -0.886 -0.690 1.00 0.00 C ATOM 385 C4' DA B 13 -6.486 -0.652 -1.283 1.00 0.00 C ATOM 386 O4' DA B 13 -5.387 -0.879 -0.436 1.00 0.00 O ATOM 387 C3' DA B 13 -6.398 -1.669 -2.418 1.00 0.00 C ATOM 388 O3' DA B 13 -5.663 -1.184 -3.520 1.00 0.00 O ATOM 389 C2' DA B 13 -5.690 -2.783 -1.627 1.00 0.00 C ATOM 390 C1' DA B 13 -4.625 -1.963 -0.923 1.00 0.00 C ATOM 391 N9 DA B 13 -4.085 -2.572 0.296 1.00 0.00 N ATOM 392 C8 DA B 13 -4.719 -2.620 1.506 1.00 0.00 C ATOM 393 N7 DA B 13 -3.950 -2.962 2.504 1.00 0.00 N ATOM 394 C5 DA B 13 -2.701 -3.101 1.902 1.00 0.00 C ATOM 395 C6 DA B 13 -1.412 -3.353 2.403 1.00 0.00 C ATOM 396 N6 DA B 13 -1.170 -3.540 3.699 1.00 0.00 N ATOM 397 N1 DA B 13 -0.372 -3.321 1.557 1.00 0.00 N ATOM 398 C2 DA B 13 -0.585 -3.059 0.275 1.00 0.00 C ATOM 399 N3 DA B 13 -1.739 -2.812 -0.324 1.00 0.00 N ATOM 400 C4 DA B 13 -2.769 -2.842 0.559 1.00 0.00 C ATOM 0 H5' DA B 13 -8.554 -0.069 -0.999 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.315 -1.802 -1.113 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.408 0.404 -1.543 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.332 -1.958 -2.900 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.357 -3.288 -0.929 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.266 -3.550 -2.275 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.792 -1.784 -1.603 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.768 -2.394 1.626 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.219 -3.720 4.019 1.00 0.00 H new ATOM 0 H62 DA B 13 -1.936 -3.503 4.371 1.00 0.00 H new ATOM 0 H2 DA B 13 0.290 -3.045 -0.358 1.00 0.00 H new ATOM 412 P DC B 14 -5.582 -2.032 -4.891 1.00 0.00 P ATOM 413 OP1 DC B 14 -5.407 -1.078 -6.008 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.715 -2.983 -4.915 1.00 0.00 O ATOM 415 O5' DC B 14 -4.226 -2.878 -4.712 1.00 0.00 O ATOM 416 C5' DC B 14 -2.985 -2.258 -4.951 1.00 0.00 C ATOM 417 C4' DC B 14 -1.801 -3.207 -4.765 1.00 0.00 C ATOM 418 O4' DC B 14 -1.625 -3.532 -3.379 1.00 0.00 O ATOM 419 C3' DC B 14 -1.950 -4.546 -5.509 1.00 0.00 C ATOM 420 O3' DC B 14 -0.919 -4.659 -6.481 1.00 0.00 O ATOM 421 C2' DC B 14 -1.841 -5.596 -4.406 1.00 0.00 C ATOM 422 C1' DC B 14 -1.227 -4.895 -3.207 1.00 0.00 C ATOM 423 N1 DC B 14 -1.689 -5.520 -1.945 1.00 0.00 N ATOM 424 C2 DC B 14 -0.750 -6.034 -1.064 1.00 0.00 C ATOM 425 O2 DC B 14 0.408 -6.257 -1.398 1.00 0.00 O ATOM 426 N3 DC B 14 -1.109 -6.301 0.212 1.00 0.00 N ATOM 427 C4 DC B 14 -2.378 -6.165 0.593 1.00 0.00 C ATOM 428 N4 DC B 14 -2.605 -6.277 1.895 1.00 0.00 N ATOM 429 C5 DC B 14 -3.410 -5.781 -0.338 1.00 0.00 C ATOM 430 C6 DC B 14 -3.003 -5.493 -1.597 1.00 0.00 C ATOM 0 H5' DC B 14 -2.873 -1.409 -4.277 1.00 0.00 H new ATOM 0 H5'' DC B 14 -2.971 -1.863 -5.967 1.00 0.00 H new ATOM 0 H4' DC B 14 -0.949 -2.665 -5.176 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.887 -4.654 -6.056 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.822 -6.002 -4.158 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.221 -6.433 -4.726 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.142 -4.971 -3.143 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.554 -6.184 2.257 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.831 -6.456 2.534 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.449 -5.726 -0.048 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.740 -5.236 -2.343 1.00 0.00 H new ATOM 442 P DG B 15 -0.717 -5.980 -7.401 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.142 -5.547 -8.692 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.979 -6.750 -7.384 1.00 0.00 O ATOM 445 O5' DG B 15 0.406 -6.833 -6.601 1.00 0.00 O ATOM 446 C5' DG B 15 1.727 -6.342 -6.495 1.00 0.00 C ATOM 447 C4' DG B 15 2.697 -7.289 -5.777 1.00 0.00 C ATOM 448 O4' DG B 15 2.273 -7.533 -4.449 1.00 0.00 O ATOM 449 C3' DG B 15 2.842 -8.649 -6.467 1.00 0.00 C ATOM 450 O3' DG B 15 4.223 -8.975 -6.428 1.00 0.00 O ATOM 451 C2' DG B 15 1.940 -9.529 -5.619 1.00 0.00 C ATOM 452 C1' DG B 15 2.141 -8.929 -4.235 1.00 0.00 C ATOM 453 N9 DG B 15 1.044 -9.130 -3.268 1.00 0.00 N ATOM 454 C8 DG B 15 -0.307 -9.014 -3.459 1.00 0.00 C ATOM 455 N7 DG B 15 -1.010 -9.083 -2.361 1.00 0.00 N ATOM 456 C5 DG B 15 -0.051 -9.236 -1.358 1.00 0.00 C ATOM 457 C6 DG B 15 -0.180 -9.338 0.063 1.00 0.00 C ATOM 458 O6 DG B 15 -1.207 -9.414 0.732 1.00 0.00 O ATOM 459 N1 DG B 15 1.046 -9.347 0.717 1.00 0.00 N ATOM 460 C2 DG B 15 2.257 -9.371 0.075 1.00 0.00 C ATOM 461 N2 DG B 15 3.359 -9.436 0.812 1.00 0.00 N ATOM 462 N3 DG B 15 2.391 -9.339 -1.254 1.00 0.00 N ATOM 463 C4 DG B 15 1.205 -9.241 -1.908 1.00 0.00 C ATOM 0 H5' DG B 15 1.707 -5.390 -5.964 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.109 -6.140 -7.496 1.00 0.00 H new ATOM 0 H4' DG B 15 3.660 -6.779 -5.800 1.00 0.00 H new ATOM 0 H3' DG B 15 2.554 -8.729 -7.515 1.00 0.00 H new ATOM 0 H2' DG B 15 0.900 -9.479 -5.940 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.236 -10.577 -5.658 1.00 0.00 H new ATOM 0 H1' DG B 15 3.001 -9.428 -3.789 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.752 -8.877 -4.433 1.00 0.00 H new ATOM 0 H1 DG B 15 1.045 -9.335 1.737 1.00 0.00 H new ATOM 0 H21 DG B 15 4.274 -9.455 0.361 1.00 0.00 H new ATOM 0 H22 DG B 15 3.291 -9.467 1.829 1.00 0.00 H new ATOM 475 P DC B 16 4.832 -10.326 -7.057 1.00 0.00 P ATOM 476 OP1 DC B 16 6.212 -10.044 -7.506 1.00 0.00 O ATOM 477 OP2 DC B 16 3.843 -10.872 -8.012 1.00 0.00 O ATOM 478 O5' DC B 16 4.891 -11.300 -5.779 1.00 0.00 O ATOM 479 C5' DC B 16 5.934 -11.222 -4.825 1.00 0.00 C ATOM 480 C4' DC B 16 5.627 -12.146 -3.637 1.00 0.00 C ATOM 481 O4' DC B 16 4.514 -11.618 -2.921 1.00 0.00 O ATOM 482 C3' DC B 16 5.242 -13.570 -4.092 1.00 0.00 C ATOM 483 O3' DC B 16 5.775 -14.566 -3.244 1.00 0.00 O ATOM 484 C2' DC B 16 3.726 -13.505 -3.972 1.00 0.00 C ATOM 485 C1' DC B 16 3.641 -12.698 -2.674 1.00 0.00 C ATOM 486 N1 DC B 16 2.276 -12.345 -2.235 1.00 0.00 N ATOM 487 C2 DC B 16 1.933 -12.397 -0.882 1.00 0.00 C ATOM 488 O2 DC B 16 2.784 -12.431 0.004 1.00 0.00 O ATOM 489 N3 DC B 16 0.611 -12.410 -0.537 1.00 0.00 N ATOM 490 C4 DC B 16 -0.337 -12.430 -1.484 1.00 0.00 C ATOM 491 N4 DC B 16 -1.610 -12.418 -1.120 1.00 0.00 N ATOM 492 C5 DC B 16 0.007 -12.400 -2.870 1.00 0.00 C ATOM 493 C6 DC B 16 1.307 -12.334 -3.170 1.00 0.00 C ATOM 0 H5' DC B 16 6.045 -10.195 -4.478 1.00 0.00 H new ATOM 0 H5'' DC B 16 6.880 -11.508 -5.284 1.00 0.00 H new ATOM 0 H4' DC B 16 6.527 -12.200 -3.024 1.00 0.00 H new ATOM 0 H3' DC B 16 5.617 -13.834 -5.081 1.00 0.00 H new ATOM 0 H2' DC B 16 3.255 -13.001 -4.816 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.265 -14.489 -3.890 1.00 0.00 H new ATOM 0 HO3' DC B 16 5.505 -15.451 -3.568 1.00 0.00 H new ATOM 0 H1' DC B 16 3.942 -13.274 -1.799 1.00 0.00 H new ATOM 0 H41 DC B 16 -2.343 -12.433 -1.829 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.857 -12.394 -0.131 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.749 -12.429 -3.640 1.00 0.00 H new ATOM 0 H6 DC B 16 1.594 -12.269 -4.209 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.757 0.267 -0.441 1.00 0.00 O HETATM 508 C2 PSO A 9 -2.011 0.370 -0.192 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.551 0.294 1.101 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.686 0.088 2.166 1.00 0.00 C HETATM 511 C5 PSO A 9 0.638 0.037 2.910 1.00 0.00 C HETATM 512 C6 PSO A 9 1.995 0.125 2.585 1.00 0.00 C HETATM 513 C7 PSO A 9 2.399 0.133 1.295 1.00 0.00 C HETATM 514 C8 PSO A 9 1.452 0.076 0.251 1.00 0.00 C HETATM 515 C9 PSO A 9 0.068 0.160 0.547 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.320 0.097 1.880 1.00 0.00 C HETATM 517 C4' PSO A 9 3.152 -0.075 3.523 1.00 0.00 C HETATM 518 C5' PSO A 9 4.235 -0.078 2.460 1.00 0.00 C HETATM 519 O6' PSO A 9 3.645 0.128 1.155 1.00 0.00 O HETATM 520 O11 PSO A 9 -2.781 0.543 -1.134 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.199 -0.135 3.570 1.00 0.00 C HETATM 522 C13 PSO A 9 3.184 0.934 4.695 1.00 0.00 C HETATM 523 O14 PSO A 9 2.379 2.076 4.474 1.00 0.00 O HETATM 524 C15 PSO A 9 5.333 0.838 2.936 1.00 0.00 C HETATM 525 C16 PSO A 9 1.909 -0.082 -1.189 1.00 0.00 C HETATM 0 H163 PSO A 9 2.548 0.758 -1.462 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.468 -1.012 -1.293 1.00 0.00 H new HETATM 0 H161 PSO A 9 1.040 -0.106 -1.846 1.00 0.00 H new HETATM 0 H153 PSO A 9 4.934 1.843 3.073 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.727 0.472 3.884 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.133 0.862 2.196 1.00 0.00 H new HETATM 0 H132 PSO A 9 2.851 0.434 5.605 1.00 0.00 H new HETATM 0 H131 PSO A 9 4.213 1.251 4.864 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.780 0.731 3.887 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.831 -1.023 3.590 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.356 -0.275 4.247 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.326 -0.077 3.948 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.624 0.394 1.265 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.439 2.674 5.248 1.00 0.00 H new