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= 0.0503 USER MOD Single : A 4 DT C7 :methyl -30:sc= -1.48! (180deg=-4.1!) 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 -25:sc= 0.0797 USER MOD Single : B 12 DT C7 :methyl 150:sc= -3.51! (180deg=-3.51!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.959 -13.944 9.352 1.00 0.00 O ATOM 2 C5' DG A 1 -2.673 -12.577 9.550 1.00 0.00 C ATOM 3 C4' DG A 1 -1.153 -12.390 9.577 1.00 0.00 C ATOM 4 O4' DG A 1 -0.523 -12.998 8.447 1.00 0.00 O ATOM 5 C3' DG A 1 -0.767 -10.928 9.557 1.00 0.00 C ATOM 6 O3' DG A 1 0.437 -10.753 10.280 1.00 0.00 O ATOM 7 C2' DG A 1 -0.649 -10.695 8.073 1.00 0.00 C ATOM 8 C1' DG A 1 -0.173 -12.007 7.482 1.00 0.00 C ATOM 9 N9 DG A 1 -0.834 -12.260 6.175 1.00 0.00 N ATOM 10 C8 DG A 1 -2.151 -12.578 5.960 1.00 0.00 C ATOM 11 N7 DG A 1 -2.490 -12.679 4.711 1.00 0.00 N ATOM 12 C5 DG A 1 -1.305 -12.433 4.032 1.00 0.00 C ATOM 13 C6 DG A 1 -1.050 -12.437 2.632 1.00 0.00 C ATOM 14 O6 DG A 1 -1.854 -12.606 1.720 1.00 0.00 O ATOM 15 N1 DG A 1 0.281 -12.221 2.329 1.00 0.00 N ATOM 16 C2 DG A 1 1.258 -11.987 3.264 1.00 0.00 C ATOM 17 N2 DG A 1 2.499 -11.818 2.816 1.00 0.00 N ATOM 18 N3 DG A 1 1.027 -11.945 4.588 1.00 0.00 N ATOM 19 C4 DG A 1 -0.275 -12.189 4.911 1.00 0.00 C ATOM 0 H5' DG A 1 -3.113 -12.231 10.486 1.00 0.00 H new ATOM 0 H5'' DG A 1 -3.113 -11.980 8.751 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.819 -12.862 10.501 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.455 -10.225 10.027 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.608 -10.400 7.647 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.056 -9.892 7.859 1.00 0.00 H new ATOM 0 HO5' DG A 1 -2.181 -14.387 8.954 1.00 0.00 H new ATOM 0 H1' DG A 1 0.899 -12.008 7.283 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.852 -12.732 6.767 1.00 0.00 H new ATOM 0 H1 DG A 1 0.555 -12.237 1.347 1.00 0.00 H new ATOM 0 H21 DG A 1 3.259 -11.641 3.473 1.00 0.00 H new ATOM 0 H22 DG A 1 2.691 -11.865 1.815 1.00 0.00 H new ATOM 32 P DC A 2 1.086 -9.302 10.548 1.00 0.00 P ATOM 33 OP1 DC A 2 1.770 -9.340 11.858 1.00 0.00 O ATOM 34 OP2 DC A 2 0.059 -8.272 10.281 1.00 0.00 O ATOM 35 O5' DC A 2 2.198 -9.211 9.390 1.00 0.00 O ATOM 36 C5' DC A 2 3.212 -10.186 9.296 1.00 0.00 C ATOM 37 C4' DC A 2 4.298 -9.784 8.296 1.00 0.00 C ATOM 38 O4' DC A 2 3.868 -9.860 6.940 1.00 0.00 O ATOM 39 C3' DC A 2 4.790 -8.356 8.514 1.00 0.00 C ATOM 40 O3' DC A 2 6.181 -8.447 8.282 1.00 0.00 O ATOM 41 C2' DC A 2 3.961 -7.586 7.483 1.00 0.00 C ATOM 42 C1' DC A 2 3.821 -8.578 6.318 1.00 0.00 C ATOM 43 N1 DC A 2 2.517 -8.528 5.573 1.00 0.00 N ATOM 44 C2 DC A 2 2.505 -8.855 4.218 1.00 0.00 C ATOM 45 O2 DC A 2 3.552 -9.091 3.620 1.00 0.00 O ATOM 46 N3 DC A 2 1.319 -8.917 3.536 1.00 0.00 N ATOM 47 C4 DC A 2 0.166 -8.674 4.176 1.00 0.00 C ATOM 48 N4 DC A 2 -0.980 -8.840 3.523 1.00 0.00 N ATOM 49 C5 DC A 2 0.129 -8.362 5.567 1.00 0.00 C ATOM 50 C6 DC A 2 1.317 -8.328 6.212 1.00 0.00 C ATOM 0 H5' DC A 2 2.774 -11.137 8.994 1.00 0.00 H new ATOM 0 H5'' DC A 2 3.661 -10.339 10.277 1.00 0.00 H new ATOM 0 H4' DC A 2 5.097 -10.503 8.476 1.00 0.00 H new ATOM 0 H3' DC A 2 4.671 -7.866 9.480 1.00 0.00 H new ATOM 0 H2' DC A 2 2.989 -7.299 7.884 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.461 -6.669 7.171 1.00 0.00 H new ATOM 0 H1' DC A 2 4.598 -8.348 5.588 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.866 -8.660 3.994 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.973 -9.148 2.551 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.801 -8.163 6.079 1.00 0.00 H new ATOM 0 H6 DC A 2 1.323 -8.135 7.275 1.00 0.00 H new ATOM 62 P DG A 3 7.140 -7.172 8.242 1.00 0.00 P ATOM 63 OP1 DG A 3 8.516 -7.604 8.569 1.00 0.00 O ATOM 64 OP2 DG A 3 6.506 -6.068 8.994 1.00 0.00 O ATOM 65 O5' DG A 3 7.036 -6.862 6.676 1.00 0.00 O ATOM 66 C5' DG A 3 7.493 -7.793 5.716 1.00 0.00 C ATOM 67 C4' DG A 3 7.660 -7.115 4.358 1.00 0.00 C ATOM 68 O4' DG A 3 6.385 -7.040 3.762 1.00 0.00 O ATOM 69 C3' DG A 3 8.216 -5.694 4.518 1.00 0.00 C ATOM 70 O3' DG A 3 9.111 -5.414 3.461 1.00 0.00 O ATOM 71 C2' DG A 3 6.916 -4.893 4.490 1.00 0.00 C ATOM 72 C1' DG A 3 6.064 -5.692 3.523 1.00 0.00 C ATOM 73 N9 DG A 3 4.612 -5.528 3.717 1.00 0.00 N ATOM 74 C8 DG A 3 3.899 -5.251 4.854 1.00 0.00 C ATOM 75 N7 DG A 3 2.614 -5.441 4.731 1.00 0.00 N ATOM 76 C5 DG A 3 2.454 -5.791 3.391 1.00 0.00 C ATOM 77 C6 DG A 3 1.278 -6.021 2.611 1.00 0.00 C ATOM 78 O6 DG A 3 0.106 -6.054 2.986 1.00 0.00 O ATOM 79 N1 DG A 3 1.564 -6.226 1.271 1.00 0.00 N ATOM 80 C2 DG A 3 2.834 -6.245 0.738 1.00 0.00 C ATOM 81 N2 DG A 3 3.003 -6.440 -0.563 1.00 0.00 N ATOM 82 N3 DG A 3 3.937 -6.051 1.459 1.00 0.00 N ATOM 83 C4 DG A 3 3.674 -5.820 2.767 1.00 0.00 C ATOM 0 H5' DG A 3 6.785 -8.618 5.634 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.444 -8.219 6.037 1.00 0.00 H new ATOM 0 H4' DG A 3 8.357 -7.688 3.747 1.00 0.00 H new ATOM 0 H3' DG A 3 8.809 -5.486 5.408 1.00 0.00 H new ATOM 0 H2' DG A 3 6.458 -4.827 5.477 1.00 0.00 H new ATOM 0 H2'' DG A 3 7.075 -3.872 4.144 1.00 0.00 H new ATOM 0 H1' DG A 3 6.274 -5.347 2.511 1.00 0.00 H new ATOM 0 H8 DG A 3 4.359 -4.907 5.769 1.00 0.00 H new ATOM 0 H1 DG A 3 0.780 -6.373 0.635 1.00 0.00 H new ATOM 0 H21 DG A 3 3.943 -6.454 -0.959 1.00 0.00 H new ATOM 0 H22 DG A 3 2.193 -6.576 -1.168 1.00 0.00 H new ATOM 95 P DT A 4 10.025 -4.082 3.444 1.00 0.00 P ATOM 96 OP1 DT A 4 11.322 -4.422 2.821 1.00 0.00 O ATOM 97 OP2 DT A 4 9.991 -3.471 4.791 1.00 0.00 O ATOM 98 O5' DT A 4 9.201 -3.144 2.441 1.00 0.00 O ATOM 99 C5' DT A 4 9.171 -3.437 1.061 1.00 0.00 C ATOM 100 C4' DT A 4 7.895 -2.866 0.453 1.00 0.00 C ATOM 101 O4' DT A 4 6.744 -3.322 1.154 1.00 0.00 O ATOM 102 C3' DT A 4 7.774 -1.350 0.544 1.00 0.00 C ATOM 103 O3' DT A 4 8.551 -0.624 -0.383 1.00 0.00 O ATOM 104 C2' DT A 4 6.283 -1.256 0.257 1.00 0.00 C ATOM 105 C1' DT A 4 5.653 -2.585 0.633 1.00 0.00 C ATOM 106 N1 DT A 4 4.498 -2.465 1.569 1.00 0.00 N ATOM 107 C2 DT A 4 3.251 -2.959 1.209 1.00 0.00 C ATOM 108 O2 DT A 4 2.991 -3.354 0.078 1.00 0.00 O ATOM 109 N3 DT A 4 2.284 -2.995 2.183 1.00 0.00 N ATOM 110 C4 DT A 4 2.359 -2.478 3.449 1.00 0.00 C ATOM 111 O4 DT A 4 1.506 -2.760 4.287 1.00 0.00 O ATOM 112 C5 DT A 4 3.518 -1.547 3.778 1.00 0.00 C ATOM 113 C7 DT A 4 4.136 -1.773 5.157 1.00 0.00 C ATOM 114 C6 DT A 4 4.627 -1.530 2.719 1.00 0.00 C ATOM 0 H5' DT A 4 9.211 -4.515 0.905 1.00 0.00 H new ATOM 0 H5'' DT A 4 10.045 -3.011 0.568 1.00 0.00 H new ATOM 0 H4' DT A 4 7.951 -3.193 -0.585 1.00 0.00 H new ATOM 0 H3' DT A 4 8.135 -0.918 1.478 1.00 0.00 H new ATOM 0 H2' DT A 4 5.834 -0.445 0.830 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.110 -1.036 -0.796 1.00 0.00 H new ATOM 0 H1' DT A 4 5.185 -3.080 -0.218 1.00 0.00 H new ATOM 0 H3 DT A 4 1.410 -3.460 1.936 1.00 0.00 H new ATOM 0 H71 DT A 4 3.373 -2.146 5.841 1.00 0.00 H new ATOM 0 H72 DT A 4 4.942 -2.503 5.079 1.00 0.00 H new ATOM 0 H73 DT A 4 4.534 -0.832 5.536 1.00 0.00 H new ATOM 0 H6 DT A 4 5.472 -0.863 2.805 1.00 0.00 H new ATOM 127 P DA A 5 8.479 0.992 -0.423 1.00 0.00 P ATOM 128 OP1 DA A 5 9.695 1.477 -1.111 1.00 0.00 O ATOM 129 OP2 DA A 5 8.178 1.475 0.942 1.00 0.00 O ATOM 130 O5' DA A 5 7.193 1.305 -1.359 1.00 0.00 O ATOM 131 C5' DA A 5 7.363 1.373 -2.758 1.00 0.00 C ATOM 132 C4' DA A 5 6.102 1.488 -3.626 1.00 0.00 C ATOM 133 O4' DA A 5 4.932 1.374 -2.820 1.00 0.00 O ATOM 134 C3' DA A 5 6.114 2.854 -4.300 1.00 0.00 C ATOM 135 O3' DA A 5 5.342 2.894 -5.482 1.00 0.00 O ATOM 136 C2' DA A 5 5.488 3.563 -3.127 1.00 0.00 C ATOM 137 C1' DA A 5 4.332 2.651 -2.743 1.00 0.00 C ATOM 138 N9 DA A 5 3.786 2.950 -1.401 1.00 0.00 N ATOM 139 C8 DA A 5 4.472 3.075 -0.224 1.00 0.00 C ATOM 140 N7 DA A 5 3.717 3.248 0.826 1.00 0.00 N ATOM 141 C5 DA A 5 2.427 3.241 0.299 1.00 0.00 C ATOM 142 C6 DA A 5 1.146 3.337 0.877 1.00 0.00 C ATOM 143 N6 DA A 5 0.978 3.370 2.196 1.00 0.00 N ATOM 144 N1 DA A 5 0.058 3.316 0.081 1.00 0.00 N ATOM 145 C2 DA A 5 0.246 3.194 -1.229 1.00 0.00 C ATOM 146 N3 DA A 5 1.389 3.086 -1.896 1.00 0.00 N ATOM 147 C4 DA A 5 2.460 3.107 -1.062 1.00 0.00 C ATOM 0 H5' DA A 5 7.907 0.483 -3.073 1.00 0.00 H new ATOM 0 H5'' DA A 5 8.000 2.230 -2.977 1.00 0.00 H new ATOM 0 H4' DA A 5 6.093 0.689 -4.367 1.00 0.00 H new ATOM 0 H3' DA A 5 7.061 3.242 -4.675 1.00 0.00 H new ATOM 0 H2' DA A 5 6.195 3.684 -2.306 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.141 4.560 -3.398 1.00 0.00 H new ATOM 0 H1' DA A 5 3.459 2.761 -3.386 1.00 0.00 H new ATOM 0 H8 DA A 5 5.550 3.034 -0.168 1.00 0.00 H new ATOM 0 H61 DA A 5 0.039 3.440 2.589 1.00 0.00 H new ATOM 0 H62 DA A 5 1.788 3.325 2.814 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.650 3.181 -1.831 1.00 0.00 H new ATOM 159 P DC A 6 5.226 4.252 -6.358 1.00 0.00 P ATOM 160 OP1 DC A 6 5.249 3.876 -7.788 1.00 0.00 O ATOM 161 OP2 DC A 6 6.202 5.235 -5.840 1.00 0.00 O ATOM 162 O5' DC A 6 3.750 4.760 -5.974 1.00 0.00 O ATOM 163 C5' DC A 6 2.652 3.964 -6.344 1.00 0.00 C ATOM 164 C4' DC A 6 1.295 4.592 -6.048 1.00 0.00 C ATOM 165 O4' DC A 6 1.022 4.643 -4.642 1.00 0.00 O ATOM 166 C3' DC A 6 1.145 6.025 -6.584 1.00 0.00 C ATOM 167 O3' DC A 6 -0.111 6.153 -7.234 1.00 0.00 O ATOM 168 C2' DC A 6 1.204 6.864 -5.306 1.00 0.00 C ATOM 169 C1' DC A 6 0.654 5.959 -4.216 1.00 0.00 C ATOM 170 N1 DC A 6 1.146 6.266 -2.845 1.00 0.00 N ATOM 171 C2 DC A 6 0.210 6.469 -1.832 1.00 0.00 C ATOM 172 O2 DC A 6 -0.988 6.597 -2.062 1.00 0.00 O ATOM 173 N3 DC A 6 0.616 6.530 -0.541 1.00 0.00 N ATOM 174 C4 DC A 6 1.912 6.476 -0.242 1.00 0.00 C ATOM 175 N4 DC A 6 2.236 6.382 1.041 1.00 0.00 N ATOM 176 C5 DC A 6 2.909 6.347 -1.261 1.00 0.00 C ATOM 177 C6 DC A 6 2.478 6.246 -2.540 1.00 0.00 C ATOM 0 H5' DC A 6 2.719 3.009 -5.823 1.00 0.00 H new ATOM 0 H5'' DC A 6 2.716 3.751 -7.411 1.00 0.00 H new ATOM 0 H4' DC A 6 0.589 3.940 -6.562 1.00 0.00 H new ATOM 0 H3' DC A 6 1.898 6.320 -7.315 1.00 0.00 H new ATOM 0 H2' DC A 6 2.225 7.174 -5.084 1.00 0.00 H new ATOM 0 H2'' DC A 6 0.609 7.772 -5.402 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.423 6.092 -4.110 1.00 0.00 H new ATOM 0 H41 DC A 6 3.217 6.338 1.317 1.00 0.00 H new ATOM 0 H42 DC A 6 1.504 6.354 1.751 1.00 0.00 H new ATOM 0 H5 DC A 6 3.961 6.331 -1.019 1.00 0.00 H new ATOM 0 H6 DC A 6 3.201 6.148 -3.336 1.00 0.00 H new ATOM 189 P DG A 7 -0.610 7.547 -7.897 1.00 0.00 P ATOM 190 OP1 DG A 7 -1.515 7.216 -9.018 1.00 0.00 O ATOM 191 OP2 DG A 7 0.584 8.384 -8.147 1.00 0.00 O ATOM 192 O5' DG A 7 -1.481 8.259 -6.726 1.00 0.00 O ATOM 193 C5' DG A 7 -2.756 7.757 -6.379 1.00 0.00 C ATOM 194 C4' DG A 7 -3.553 8.636 -5.406 1.00 0.00 C ATOM 195 O4' DG A 7 -2.946 8.665 -4.130 1.00 0.00 O ATOM 196 C3' DG A 7 -3.692 10.087 -5.878 1.00 0.00 C ATOM 197 O3' DG A 7 -5.023 10.488 -5.591 1.00 0.00 O ATOM 198 C2' DG A 7 -2.613 10.782 -5.063 1.00 0.00 C ATOM 199 C1' DG A 7 -2.668 10.004 -3.758 1.00 0.00 C ATOM 200 N9 DG A 7 -1.448 9.982 -2.931 1.00 0.00 N ATOM 201 C8 DG A 7 -0.140 9.895 -3.322 1.00 0.00 C ATOM 202 N7 DG A 7 0.699 9.700 -2.341 1.00 0.00 N ATOM 203 C5 DG A 7 -0.117 9.659 -1.208 1.00 0.00 C ATOM 204 C6 DG A 7 0.201 9.493 0.176 1.00 0.00 C ATOM 205 O6 DG A 7 1.306 9.365 0.693 1.00 0.00 O ATOM 206 N1 DG A 7 -0.921 9.484 0.993 1.00 0.00 N ATOM 207 C2 DG A 7 -2.203 9.658 0.539 1.00 0.00 C ATOM 208 N2 DG A 7 -3.190 9.648 1.426 1.00 0.00 N ATOM 209 N3 DG A 7 -2.513 9.842 -0.747 1.00 0.00 N ATOM 210 C4 DG A 7 -1.430 9.820 -1.567 1.00 0.00 C ATOM 0 H5' DG A 7 -2.633 6.769 -5.936 1.00 0.00 H new ATOM 0 H5'' DG A 7 -3.340 7.627 -7.290 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.542 8.181 -5.361 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.553 10.297 -6.938 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.634 10.717 -5.538 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.827 11.841 -4.918 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.411 10.502 -3.135 1.00 0.00 H new ATOM 0 H8 DG A 7 0.171 9.980 -4.353 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.783 9.339 1.993 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.154 9.775 1.118 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.985 9.513 2.416 1.00 0.00 H new ATOM 222 P DC A 8 -5.613 11.931 -5.993 1.00 0.00 P ATOM 223 OP1 DC A 8 -7.062 11.782 -6.244 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.739 12.508 -7.037 1.00 0.00 O ATOM 225 O5' DC A 8 -5.407 12.775 -4.641 1.00 0.00 O ATOM 226 C5' DC A 8 -6.321 12.698 -3.563 1.00 0.00 C ATOM 227 C4' DC A 8 -5.754 13.441 -2.344 1.00 0.00 C ATOM 228 O4' DC A 8 -4.644 12.708 -1.836 1.00 0.00 O ATOM 229 C3' DC A 8 -5.241 14.851 -2.707 1.00 0.00 C ATOM 230 O3' DC A 8 -5.530 15.797 -1.698 1.00 0.00 O ATOM 231 C2' DC A 8 -3.744 14.589 -2.794 1.00 0.00 C ATOM 232 C1' DC A 8 -3.610 13.640 -1.601 1.00 0.00 C ATOM 233 N1 DC A 8 -2.264 13.071 -1.378 1.00 0.00 N ATOM 234 C2 DC A 8 -1.818 12.845 -0.076 1.00 0.00 C ATOM 235 O2 DC A 8 -2.602 12.804 0.869 1.00 0.00 O ATOM 236 N3 DC A 8 -0.482 12.666 0.151 1.00 0.00 N ATOM 237 C4 DC A 8 0.391 12.769 -0.860 1.00 0.00 C ATOM 238 N4 DC A 8 1.678 12.555 -0.622 1.00 0.00 N ATOM 239 C5 DC A 8 -0.051 13.031 -2.193 1.00 0.00 C ATOM 240 C6 DC A 8 -1.369 13.147 -2.386 1.00 0.00 C ATOM 0 H5' DC A 8 -6.510 11.655 -3.309 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.277 13.134 -3.853 1.00 0.00 H new ATOM 0 H4' DC A 8 -6.559 13.533 -1.615 1.00 0.00 H new ATOM 0 H3' DC A 8 -5.691 15.271 -3.607 1.00 0.00 H new ATOM 0 H2' DC A 8 -3.449 14.128 -3.737 1.00 0.00 H new ATOM 0 H2'' DC A 8 -3.149 15.495 -2.683 1.00 0.00 H new ATOM 0 HO3' DC A 8 -5.188 16.675 -1.965 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.719 14.151 -0.644 1.00 0.00 H new ATOM 0 H41 DC A 8 2.356 12.629 -1.380 1.00 0.00 H new ATOM 0 H42 DC A 8 1.990 12.316 0.319 1.00 0.00 H new ATOM 0 H5 DC A 8 0.649 13.131 -3.009 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.733 13.308 -3.390 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.201 12.940 8.848 1.00 0.00 O ATOM 255 C5' DG B 9 3.715 11.791 9.505 1.00 0.00 C ATOM 256 C4' DG B 9 2.205 11.934 9.723 1.00 0.00 C ATOM 257 O4' DG B 9 1.533 12.370 8.548 1.00 0.00 O ATOM 258 C3' DG B 9 1.567 10.621 10.122 1.00 0.00 C ATOM 259 O3' DG B 9 0.501 10.893 11.018 1.00 0.00 O ATOM 260 C2' DG B 9 1.118 10.048 8.781 1.00 0.00 C ATOM 261 C1' DG B 9 0.968 11.258 7.862 1.00 0.00 C ATOM 262 N9 DG B 9 1.581 11.136 6.512 1.00 0.00 N ATOM 263 C8 DG B 9 2.886 10.878 6.161 1.00 0.00 C ATOM 264 N7 DG B 9 3.143 11.016 4.893 1.00 0.00 N ATOM 265 C5 DG B 9 1.924 11.399 4.348 1.00 0.00 C ATOM 266 C6 DG B 9 1.583 11.738 3.005 1.00 0.00 C ATOM 267 O6 DG B 9 2.326 11.803 2.030 1.00 0.00 O ATOM 268 N1 DG B 9 0.236 12.019 2.844 1.00 0.00 N ATOM 269 C2 DG B 9 -0.675 12.018 3.871 1.00 0.00 C ATOM 270 N2 DG B 9 -1.946 12.270 3.581 1.00 0.00 N ATOM 271 N3 DG B 9 -0.359 11.751 5.145 1.00 0.00 N ATOM 272 C4 DG B 9 0.957 11.449 5.321 1.00 0.00 C ATOM 0 H5' DG B 9 4.222 11.663 10.462 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.926 10.902 8.911 1.00 0.00 H new ATOM 0 H4' DG B 9 2.102 12.672 10.518 1.00 0.00 H new ATOM 0 H3' DG B 9 2.210 9.916 10.649 1.00 0.00 H new ATOM 0 H2' DG B 9 1.851 9.343 8.388 1.00 0.00 H new ATOM 0 H2'' DG B 9 0.176 9.508 8.878 1.00 0.00 H new ATOM 0 HO5' DG B 9 3.476 13.356 8.336 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.097 11.368 7.655 1.00 0.00 H new ATOM 0 H8 DG B 9 3.637 10.585 6.880 1.00 0.00 H new ATOM 0 H1 DG B 9 -0.099 12.240 1.906 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.647 12.276 4.322 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.222 12.457 2.617 1.00 0.00 H new ATOM 285 P DC B 10 -0.353 9.731 11.744 1.00 0.00 P ATOM 286 OP1 DC B 10 -0.984 10.309 12.949 1.00 0.00 O ATOM 287 OP2 DC B 10 0.504 8.532 11.863 1.00 0.00 O ATOM 288 O5' DC B 10 -1.501 9.431 10.657 1.00 0.00 O ATOM 289 C5' DC B 10 -2.455 10.420 10.331 1.00 0.00 C ATOM 290 C4' DC B 10 -3.148 10.075 9.011 1.00 0.00 C ATOM 291 O4' DC B 10 -2.224 10.094 7.934 1.00 0.00 O ATOM 292 C3' DC B 10 -3.800 8.685 9.011 1.00 0.00 C ATOM 293 O3' DC B 10 -5.168 8.879 8.708 1.00 0.00 O ATOM 294 C2' DC B 10 -3.009 7.956 7.912 1.00 0.00 C ATOM 295 C1' DC B 10 -2.623 9.107 7.006 1.00 0.00 C ATOM 296 N1 DC B 10 -1.568 8.785 6.008 1.00 0.00 N ATOM 297 C2 DC B 10 -1.785 9.026 4.652 1.00 0.00 C ATOM 298 O2 DC B 10 -2.885 9.389 4.238 1.00 0.00 O ATOM 299 N3 DC B 10 -0.759 8.856 3.763 1.00 0.00 N ATOM 300 C4 DC B 10 0.418 8.381 4.192 1.00 0.00 C ATOM 301 N4 DC B 10 1.446 8.366 3.351 1.00 0.00 N ATOM 302 C5 DC B 10 0.642 8.061 5.567 1.00 0.00 C ATOM 303 C6 DC B 10 -0.371 8.292 6.424 1.00 0.00 C ATOM 0 H5' DC B 10 -1.968 11.392 10.251 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.194 10.499 11.128 1.00 0.00 H new ATOM 0 H4' DC B 10 -3.921 10.834 8.893 1.00 0.00 H new ATOM 0 H3' DC B 10 -3.772 8.116 9.940 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.137 7.437 8.310 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.615 7.212 7.395 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.442 9.415 6.356 1.00 0.00 H new ATOM 0 H41 DC B 10 2.351 8.008 3.658 1.00 0.00 H new ATOM 0 H42 DC B 10 1.331 8.712 2.398 1.00 0.00 H new ATOM 0 H5 DC B 10 1.583 7.652 5.904 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.228 8.079 7.473 1.00 0.00 H new ATOM 315 P DG B 11 -6.193 7.657 8.528 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.536 8.111 8.949 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.599 6.451 9.143 1.00 0.00 O ATOM 318 O5' DG B 11 -6.187 7.464 6.929 1.00 0.00 O ATOM 319 C5' DG B 11 -6.724 8.445 6.061 1.00 0.00 C ATOM 320 C4' DG B 11 -7.350 7.799 4.814 1.00 0.00 C ATOM 321 O4' DG B 11 -6.361 7.593 3.827 1.00 0.00 O ATOM 322 C3' DG B 11 -7.987 6.436 5.101 1.00 0.00 C ATOM 323 O3' DG B 11 -9.119 6.288 4.265 1.00 0.00 O ATOM 324 C2' DG B 11 -6.835 5.487 4.792 1.00 0.00 C ATOM 325 C1' DG B 11 -6.103 6.213 3.665 1.00 0.00 C ATOM 326 N9 DG B 11 -4.641 6.036 3.684 1.00 0.00 N ATOM 327 C8 DG B 11 -3.822 5.804 4.752 1.00 0.00 C ATOM 328 N7 DG B 11 -2.550 5.859 4.478 1.00 0.00 N ATOM 329 C5 DG B 11 -2.523 6.121 3.109 1.00 0.00 C ATOM 330 C6 DG B 11 -1.428 6.198 2.195 1.00 0.00 C ATOM 331 O6 DG B 11 -0.229 6.091 2.436 1.00 0.00 O ATOM 332 N1 DG B 11 -1.837 6.421 0.890 1.00 0.00 N ATOM 333 C2 DG B 11 -3.150 6.534 0.496 1.00 0.00 C ATOM 334 N2 DG B 11 -3.429 6.728 -0.786 1.00 0.00 N ATOM 335 N3 DG B 11 -4.183 6.422 1.333 1.00 0.00 N ATOM 336 C4 DG B 11 -3.801 6.224 2.619 1.00 0.00 C ATOM 0 H5' DG B 11 -5.938 9.138 5.760 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.478 9.029 6.589 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.125 8.489 4.478 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.369 6.269 6.108 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.193 5.332 5.659 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.191 4.505 4.479 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.463 5.798 2.723 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.198 5.592 5.742 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.116 6.507 0.174 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.399 6.813 -1.090 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.673 6.792 -1.468 1.00 0.00 H new ATOM 348 P DT B 12 -10.053 4.979 4.317 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.401 5.352 3.837 1.00 0.00 O ATOM 350 OP2 DT B 12 -9.891 4.350 5.645 1.00 0.00 O ATOM 351 O5' DT B 12 -9.348 4.041 3.220 1.00 0.00 O ATOM 352 C5' DT B 12 -9.672 4.157 1.851 1.00 0.00 C ATOM 353 C4' DT B 12 -8.733 3.299 1.000 1.00 0.00 C ATOM 354 O4' DT B 12 -7.486 3.922 0.741 1.00 0.00 O ATOM 355 C3' DT B 12 -8.450 1.909 1.566 1.00 0.00 C ATOM 356 O3' DT B 12 -9.450 0.961 1.233 1.00 0.00 O ATOM 357 C2' DT B 12 -7.176 1.643 0.777 1.00 0.00 C ATOM 358 C1' DT B 12 -6.618 2.942 0.181 1.00 0.00 C ATOM 359 N1 DT B 12 -5.271 3.127 0.727 1.00 0.00 N ATOM 360 C2 DT B 12 -4.102 3.373 0.004 1.00 0.00 C ATOM 361 O2 DT B 12 -4.096 3.580 -1.205 1.00 0.00 O ATOM 362 N3 DT B 12 -2.924 3.369 0.758 1.00 0.00 N ATOM 363 C4 DT B 12 -2.846 3.150 2.126 1.00 0.00 C ATOM 364 O4 DT B 12 -1.770 3.194 2.710 1.00 0.00 O ATOM 365 C5 DT B 12 -4.124 2.877 2.751 1.00 0.00 C ATOM 366 C7 DT B 12 -4.333 2.553 4.187 1.00 0.00 C ATOM 367 C6 DT B 12 -5.243 2.879 2.040 1.00 0.00 C ATOM 0 H5' DT B 12 -9.600 5.200 1.542 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.704 3.847 1.689 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.295 3.187 0.073 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.398 1.845 2.653 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.430 1.187 1.427 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.381 0.930 -0.022 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.567 2.972 -0.907 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.050 3.541 0.261 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.315 2.906 4.500 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.273 1.474 4.329 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.564 3.041 4.786 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.175 2.671 2.545 1.00 0.00 H new ATOM 380 P DA B 13 -9.244 -0.621 1.528 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.389 -1.347 0.940 1.00 0.00 O ATOM 382 OP2 DA B 13 -8.935 -0.771 2.967 1.00 0.00 O ATOM 383 O5' DA B 13 -7.911 -0.994 0.686 1.00 0.00 O ATOM 384 C5' DA B 13 -7.883 -0.896 -0.726 1.00 0.00 C ATOM 385 C4' DA B 13 -6.466 -0.658 -1.316 1.00 0.00 C ATOM 386 O4' DA B 13 -5.369 -0.883 -0.468 1.00 0.00 O ATOM 387 C3' DA B 13 -6.375 -1.672 -2.453 1.00 0.00 C ATOM 388 O3' DA B 13 -5.637 -1.182 -3.552 1.00 0.00 O ATOM 389 C2' DA B 13 -5.667 -2.787 -1.662 1.00 0.00 C ATOM 390 C1' DA B 13 -4.604 -1.966 -0.955 1.00 0.00 C ATOM 391 N9 DA B 13 -4.065 -2.575 0.263 1.00 0.00 N ATOM 392 C8 DA B 13 -4.700 -2.626 1.473 1.00 0.00 C ATOM 393 N7 DA B 13 -3.932 -2.968 2.471 1.00 0.00 N ATOM 394 C5 DA B 13 -2.681 -3.104 1.870 1.00 0.00 C ATOM 395 C6 DA B 13 -1.392 -3.353 2.372 1.00 0.00 C ATOM 396 N6 DA B 13 -1.152 -3.540 3.668 1.00 0.00 N ATOM 397 N1 DA B 13 -0.352 -3.317 1.528 1.00 0.00 N ATOM 398 C2 DA B 13 -0.563 -3.054 0.245 1.00 0.00 C ATOM 399 N3 DA B 13 -1.718 -2.809 -0.354 1.00 0.00 N ATOM 400 C4 DA B 13 -2.748 -2.843 0.528 1.00 0.00 C ATOM 0 H5' DA B 13 -8.536 -0.080 -1.036 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.293 -1.812 -1.152 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.389 0.398 -1.574 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.307 -1.962 -2.938 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.335 -3.294 -0.966 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.241 -3.553 -2.310 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.770 -1.785 -1.633 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.750 -2.402 1.593 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.201 -3.718 3.990 1.00 0.00 H new ATOM 0 H62 DA B 13 -1.919 -3.505 4.339 1.00 0.00 H new ATOM 0 H2 DA B 13 0.313 -3.038 -0.387 1.00 0.00 H new ATOM 412 P DC B 14 -5.552 -2.024 -4.926 1.00 0.00 P ATOM 413 OP1 DC B 14 -5.375 -1.066 -6.038 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.685 -2.976 -4.956 1.00 0.00 O ATOM 415 O5' DC B 14 -4.197 -2.871 -4.746 1.00 0.00 O ATOM 416 C5' DC B 14 -2.954 -2.253 -4.987 1.00 0.00 C ATOM 417 C4' DC B 14 -1.772 -3.203 -4.800 1.00 0.00 C ATOM 418 O4' DC B 14 -1.597 -3.526 -3.413 1.00 0.00 O ATOM 419 C3' DC B 14 -1.925 -4.543 -5.543 1.00 0.00 C ATOM 420 O3' DC B 14 -0.900 -4.662 -6.520 1.00 0.00 O ATOM 421 C2' DC B 14 -1.811 -5.591 -4.439 1.00 0.00 C ATOM 422 C1' DC B 14 -1.199 -4.889 -3.239 1.00 0.00 C ATOM 423 N1 DC B 14 -1.662 -5.514 -1.977 1.00 0.00 N ATOM 424 C2 DC B 14 -0.723 -6.030 -1.096 1.00 0.00 C ATOM 425 O2 DC B 14 0.435 -6.253 -1.430 1.00 0.00 O ATOM 426 N3 DC B 14 -1.083 -6.300 0.179 1.00 0.00 N ATOM 427 C4 DC B 14 -2.352 -6.164 0.559 1.00 0.00 C ATOM 428 N4 DC B 14 -2.581 -6.278 1.861 1.00 0.00 N ATOM 429 C5 DC B 14 -3.383 -5.782 -0.372 1.00 0.00 C ATOM 430 C6 DC B 14 -2.977 -5.492 -1.630 1.00 0.00 C ATOM 0 H5' DC B 14 -2.840 -1.403 -4.315 1.00 0.00 H new ATOM 0 H5'' DC B 14 -2.940 -1.860 -6.003 1.00 0.00 H new ATOM 0 H4' DC B 14 -0.918 -2.665 -5.211 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.864 -4.648 -6.086 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.790 -6.001 -4.191 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.188 -6.426 -4.760 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.114 -4.964 -3.173 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.530 -6.185 2.222 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.808 -6.459 2.501 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.422 -5.730 -0.082 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.715 -5.237 -2.376 1.00 0.00 H new ATOM 442 P DG B 15 -0.710 -5.986 -7.438 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.120 -5.562 -8.725 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.984 -6.737 -7.430 1.00 0.00 O ATOM 445 O5' DG B 15 0.394 -6.858 -6.631 1.00 0.00 O ATOM 446 C5' DG B 15 1.723 -6.389 -6.521 1.00 0.00 C ATOM 447 C4' DG B 15 2.676 -7.347 -5.795 1.00 0.00 C ATOM 448 O4' DG B 15 2.250 -7.571 -4.464 1.00 0.00 O ATOM 449 C3' DG B 15 2.798 -8.714 -6.474 1.00 0.00 C ATOM 450 O3' DG B 15 4.174 -9.061 -6.443 1.00 0.00 O ATOM 451 C2' DG B 15 1.890 -9.574 -5.609 1.00 0.00 C ATOM 452 C1' DG B 15 2.109 -8.963 -4.233 1.00 0.00 C ATOM 453 N9 DG B 15 1.016 -9.145 -3.257 1.00 0.00 N ATOM 454 C8 DG B 15 -0.334 -9.014 -3.443 1.00 0.00 C ATOM 455 N7 DG B 15 -1.033 -9.073 -2.342 1.00 0.00 N ATOM 456 C5 DG B 15 -0.071 -9.232 -1.343 1.00 0.00 C ATOM 457 C6 DG B 15 -0.194 -9.328 0.079 1.00 0.00 C ATOM 458 O6 DG B 15 -1.219 -9.396 0.753 1.00 0.00 O ATOM 459 N1 DG B 15 1.034 -9.341 0.728 1.00 0.00 N ATOM 460 C2 DG B 15 2.242 -9.376 0.082 1.00 0.00 C ATOM 461 N2 DG B 15 3.346 -9.444 0.815 1.00 0.00 N ATOM 462 N3 DG B 15 2.371 -9.354 -1.248 1.00 0.00 N ATOM 463 C4 DG B 15 1.183 -9.250 -1.898 1.00 0.00 C ATOM 0 H5' DG B 15 1.716 -5.435 -5.994 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.112 -6.198 -7.521 1.00 0.00 H new ATOM 0 H4' DG B 15 3.648 -6.855 -5.822 1.00 0.00 H new ATOM 0 H3' DG B 15 2.502 -8.798 -7.520 1.00 0.00 H new ATOM 0 H2' DG B 15 0.848 -9.514 -5.923 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.172 -10.627 -5.639 1.00 0.00 H new ATOM 0 H1' DG B 15 2.969 -9.463 -3.788 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.782 -8.874 -4.416 1.00 0.00 H new ATOM 0 H1 DG B 15 1.037 -9.323 1.748 1.00 0.00 H new ATOM 0 H21 DG B 15 4.259 -9.471 0.361 1.00 0.00 H new ATOM 0 H22 DG B 15 3.282 -9.469 1.833 1.00 0.00 H new ATOM 475 P DC B 16 4.756 -10.429 -7.059 1.00 0.00 P ATOM 476 OP1 DC B 16 6.135 -10.175 -7.526 1.00 0.00 O ATOM 477 OP2 DC B 16 3.748 -10.975 -7.994 1.00 0.00 O ATOM 478 O5' DC B 16 4.814 -11.384 -5.766 1.00 0.00 O ATOM 479 C5' DC B 16 5.873 -11.313 -4.828 1.00 0.00 C ATOM 480 C4' DC B 16 5.577 -12.228 -3.630 1.00 0.00 C ATOM 481 O4' DC B 16 4.483 -11.687 -2.895 1.00 0.00 O ATOM 482 C3' DC B 16 5.172 -13.649 -4.075 1.00 0.00 C ATOM 483 O3' DC B 16 5.739 -14.650 -3.252 1.00 0.00 O ATOM 484 C2' DC B 16 3.658 -13.572 -3.929 1.00 0.00 C ATOM 485 C1' DC B 16 3.585 -12.746 -2.643 1.00 0.00 C ATOM 486 N1 DC B 16 2.228 -12.365 -2.205 1.00 0.00 N ATOM 487 C2 DC B 16 1.888 -12.406 -0.852 1.00 0.00 C ATOM 488 O2 DC B 16 2.744 -12.443 0.031 1.00 0.00 O ATOM 489 N3 DC B 16 0.569 -12.404 -0.501 1.00 0.00 N ATOM 490 C4 DC B 16 -0.383 -12.423 -1.444 1.00 0.00 C ATOM 491 N4 DC B 16 -1.655 -12.397 -1.075 1.00 0.00 N ATOM 492 C5 DC B 16 -0.044 -12.407 -2.832 1.00 0.00 C ATOM 493 C6 DC B 16 1.255 -12.353 -3.138 1.00 0.00 C ATOM 0 H5' DC B 16 6.000 -10.285 -4.488 1.00 0.00 H new ATOM 0 H5'' DC B 16 6.809 -11.611 -5.301 1.00 0.00 H new ATOM 0 H4' DC B 16 6.486 -12.287 -3.031 1.00 0.00 H new ATOM 0 H3' DC B 16 5.514 -13.922 -5.073 1.00 0.00 H new ATOM 0 H2' DC B 16 3.178 -13.079 -4.774 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.194 -14.553 -3.827 1.00 0.00 H new ATOM 0 HO3' DC B 16 5.455 -15.533 -3.568 1.00 0.00 H new ATOM 0 H1' DC B 16 3.872 -13.318 -1.761 1.00 0.00 H new ATOM 0 H41 DC B 16 -2.391 -12.411 -1.781 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.898 -12.363 -0.085 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.804 -12.437 -3.599 1.00 0.00 H new ATOM 0 H6 DC B 16 1.538 -12.297 -4.179 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.744 0.268 -0.470 1.00 0.00 O HETATM 508 C2 PSO A 9 -1.998 0.370 -0.221 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.538 0.293 1.073 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.672 0.089 2.138 1.00 0.00 C HETATM 511 C5 PSO A 9 0.653 0.053 2.882 1.00 0.00 C HETATM 512 C6 PSO A 9 2.011 0.128 2.554 1.00 0.00 C HETATM 513 C7 PSO A 9 2.414 0.133 1.264 1.00 0.00 C HETATM 514 C8 PSO A 9 1.465 0.081 0.220 1.00 0.00 C HETATM 515 C9 PSO A 9 0.081 0.163 0.518 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.305 0.103 1.851 1.00 0.00 C HETATM 517 C4' PSO A 9 3.167 -0.070 3.492 1.00 0.00 C HETATM 518 C5' PSO A 9 4.251 -0.074 2.430 1.00 0.00 C HETATM 519 O6' PSO A 9 3.660 0.129 1.124 1.00 0.00 O HETATM 520 O11 PSO A 9 -2.768 0.543 -1.162 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.184 -0.136 3.541 1.00 0.00 C HETATM 522 C13 PSO A 9 3.191 0.941 4.661 1.00 0.00 C HETATM 523 O14 PSO A 9 2.374 2.072 4.425 1.00 0.00 O HETATM 524 C15 PSO A 9 5.346 0.844 2.911 1.00 0.00 C HETATM 525 C16 PSO A 9 1.920 -0.068 -1.221 1.00 0.00 C HETATM 0 H163 PSO A 9 2.557 0.774 -1.490 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.480 -0.997 -1.332 1.00 0.00 H new HETATM 0 H161 PSO A 9 1.050 -0.089 -1.877 1.00 0.00 H new HETATM 0 H153 PSO A 9 4.945 1.848 3.047 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.737 0.478 3.860 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.149 0.870 2.174 1.00 0.00 H new HETATM 0 H132 PSO A 9 2.860 0.443 5.573 1.00 0.00 H new HETATM 0 H131 PSO A 9 4.217 1.269 4.831 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.767 0.728 3.858 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.814 -1.026 3.560 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.341 -0.273 4.218 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.341 -0.043 3.922 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.611 0.391 1.237 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.424 2.678 5.194 1.00 0.00 H new