USER MOD reduce.3.24.130724 H: found=0, std=0, add=195, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 196 hydrogens (14 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 1 PSO H3 : B 1 PSO C3 : B 12 DT C6 :(H bumps) USER MOD Single : A 1 DG O5' : rot 33:sc= 0.067 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.72! (180deg=-1.72!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : B 1 PSO O14 : rot 180:sc= -0.39 USER MOD Single : B 9 DG O5' : rot 50:sc= 0.993 USER MOD Single : B 12 DT C7 :methyl 150:sc= -1.69 (180deg=-1.69) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -1.221 -11.161 9.084 1.00 0.00 O ATOM 2 C5' DG A 1 -0.076 -11.621 9.767 1.00 0.00 C ATOM 3 C4' DG A 1 1.184 -11.264 8.973 1.00 0.00 C ATOM 4 O4' DG A 1 1.042 -11.732 7.638 1.00 0.00 O ATOM 5 C3' DG A 1 1.437 -9.751 8.913 1.00 0.00 C ATOM 6 O3' DG A 1 2.823 -9.541 9.111 1.00 0.00 O ATOM 7 C2' DG A 1 0.971 -9.406 7.501 1.00 0.00 C ATOM 8 C1' DG A 1 1.322 -10.677 6.734 1.00 0.00 C ATOM 9 N9 DG A 1 0.516 -10.856 5.503 1.00 0.00 N ATOM 10 C8 DG A 1 -0.849 -10.827 5.371 1.00 0.00 C ATOM 11 N7 DG A 1 -1.280 -11.093 4.172 1.00 0.00 N ATOM 12 C5 DG A 1 -0.116 -11.333 3.448 1.00 0.00 C ATOM 13 C6 DG A 1 0.061 -11.662 2.070 1.00 0.00 C ATOM 14 O6 DG A 1 -0.801 -11.829 1.211 1.00 0.00 O ATOM 15 N1 DG A 1 1.394 -11.798 1.718 1.00 0.00 N ATOM 16 C2 DG A 1 2.443 -11.625 2.588 1.00 0.00 C ATOM 17 N2 DG A 1 3.680 -11.767 2.125 1.00 0.00 N ATOM 18 N3 DG A 1 2.292 -11.308 3.880 1.00 0.00 N ATOM 19 C4 DG A 1 0.989 -11.182 4.250 1.00 0.00 C ATOM 0 H5' DG A 1 -0.135 -12.700 9.907 1.00 0.00 H new ATOM 0 H5'' DG A 1 -0.030 -11.173 10.760 1.00 0.00 H new ATOM 0 H4' DG A 1 2.025 -11.734 9.483 1.00 0.00 H new ATOM 0 H3' DG A 1 0.928 -9.140 9.659 1.00 0.00 H new ATOM 0 H2' DG A 1 -0.097 -9.189 7.465 1.00 0.00 H new ATOM 0 H2'' DG A 1 1.487 -8.533 7.102 1.00 0.00 H new ATOM 0 HO5' DG A 1 -1.068 -11.212 8.117 1.00 0.00 H new ATOM 0 H1' DG A 1 2.360 -10.643 6.403 1.00 0.00 H new ATOM 0 H8 DG A 1 -1.511 -10.602 6.194 1.00 0.00 H new ATOM 0 H1 DG A 1 1.610 -12.042 0.752 1.00 0.00 H new ATOM 0 H21 DG A 1 4.476 -11.644 2.751 1.00 0.00 H new ATOM 0 H22 DG A 1 3.834 -11.999 1.144 1.00 0.00 H new ATOM 32 P DC A 2 3.495 -8.076 9.150 1.00 0.00 P ATOM 33 OP1 DC A 2 4.438 -8.033 10.287 1.00 0.00 O ATOM 34 OP2 DC A 2 2.426 -7.059 9.040 1.00 0.00 O ATOM 35 O5' DC A 2 4.337 -8.073 7.778 1.00 0.00 O ATOM 36 C5' DC A 2 5.417 -8.968 7.605 1.00 0.00 C ATOM 37 C4' DC A 2 6.078 -8.772 6.239 1.00 0.00 C ATOM 38 O4' DC A 2 5.180 -9.111 5.203 1.00 0.00 O ATOM 39 C3' DC A 2 6.531 -7.326 6.010 1.00 0.00 C ATOM 40 O3' DC A 2 7.883 -7.419 5.605 1.00 0.00 O ATOM 41 C2' DC A 2 5.548 -6.805 4.948 1.00 0.00 C ATOM 42 C1' DC A 2 5.152 -8.087 4.225 1.00 0.00 C ATOM 43 N1 DC A 2 3.768 -8.057 3.682 1.00 0.00 N ATOM 44 C2 DC A 2 3.550 -8.415 2.356 1.00 0.00 C ATOM 45 O2 DC A 2 4.488 -8.621 1.591 1.00 0.00 O ATOM 46 N3 DC A 2 2.273 -8.541 1.893 1.00 0.00 N ATOM 47 C4 DC A 2 1.242 -8.288 2.708 1.00 0.00 C ATOM 48 N4 DC A 2 0.016 -8.516 2.256 1.00 0.00 N ATOM 49 C5 DC A 2 1.429 -7.952 4.083 1.00 0.00 C ATOM 50 C6 DC A 2 2.703 -7.860 4.521 1.00 0.00 C ATOM 0 H5' DC A 2 5.062 -9.994 7.697 1.00 0.00 H new ATOM 0 H5'' DC A 2 6.152 -8.813 8.394 1.00 0.00 H new ATOM 0 H4' DC A 2 6.952 -9.423 6.228 1.00 0.00 H new ATOM 0 H3' DC A 2 6.509 -6.640 6.857 1.00 0.00 H new ATOM 0 H2' DC A 2 4.688 -6.308 5.397 1.00 0.00 H new ATOM 0 H2'' DC A 2 6.017 -6.086 4.276 1.00 0.00 H new ATOM 0 H1' DC A 2 5.834 -8.232 3.387 1.00 0.00 H new ATOM 0 H41 DC A 2 -0.790 -8.333 2.854 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.121 -8.874 1.311 1.00 0.00 H new ATOM 0 H5 DC A 2 0.591 -7.780 4.742 1.00 0.00 H new ATOM 0 H6 DC A 2 2.887 -7.625 5.559 1.00 0.00 H new ATOM 62 P DG A 3 8.832 -6.136 5.464 1.00 0.00 P ATOM 63 OP1 DG A 3 10.230 -6.602 5.353 1.00 0.00 O ATOM 64 OP2 DG A 3 8.456 -5.155 6.504 1.00 0.00 O ATOM 65 O5' DG A 3 8.348 -5.589 4.044 1.00 0.00 O ATOM 66 C5' DG A 3 8.587 -6.318 2.859 1.00 0.00 C ATOM 67 C4' DG A 3 7.912 -5.605 1.689 1.00 0.00 C ATOM 68 O4' DG A 3 6.564 -5.936 1.495 1.00 0.00 O ATOM 69 C3' DG A 3 7.959 -4.085 1.817 1.00 0.00 C ATOM 70 O3' DG A 3 8.341 -3.580 0.575 1.00 0.00 O ATOM 71 C2' DG A 3 6.514 -3.778 2.138 1.00 0.00 C ATOM 72 C1' DG A 3 5.889 -4.745 1.143 1.00 0.00 C ATOM 73 N9 DG A 3 4.478 -5.038 1.272 1.00 0.00 N ATOM 74 C8 DG A 3 3.755 -4.865 2.381 1.00 0.00 C ATOM 75 N7 DG A 3 2.512 -5.237 2.297 1.00 0.00 N ATOM 76 C5 DG A 3 2.410 -5.647 0.964 1.00 0.00 C ATOM 77 C6 DG A 3 1.276 -6.020 0.188 1.00 0.00 C ATOM 78 O6 DG A 3 0.132 -6.241 0.569 1.00 0.00 O ATOM 79 N1 DG A 3 1.570 -6.128 -1.160 1.00 0.00 N ATOM 80 C2 DG A 3 2.833 -6.052 -1.692 1.00 0.00 C ATOM 81 N2 DG A 3 2.981 -6.242 -2.997 1.00 0.00 N ATOM 82 N3 DG A 3 3.922 -5.800 -0.965 1.00 0.00 N ATOM 83 C4 DG A 3 3.629 -5.560 0.337 1.00 0.00 C ATOM 0 H5' DG A 3 8.198 -7.332 2.956 1.00 0.00 H new ATOM 0 H5'' DG A 3 9.659 -6.403 2.680 1.00 0.00 H new ATOM 0 H4' DG A 3 8.497 -5.955 0.838 1.00 0.00 H new ATOM 0 H3' DG A 3 8.647 -3.669 2.553 1.00 0.00 H new ATOM 0 H2' DG A 3 6.249 -3.996 3.172 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.245 -2.738 1.952 1.00 0.00 H new ATOM 0 H1' DG A 3 5.977 -4.330 0.139 1.00 0.00 H new ATOM 0 H8 DG A 3 4.173 -4.446 3.284 1.00 0.00 H new ATOM 0 H1 DG A 3 0.793 -6.275 -1.804 1.00 0.00 H new ATOM 0 H21 DG A 3 3.909 -6.191 -3.418 1.00 0.00 H new ATOM 0 H22 DG A 3 2.167 -6.439 -3.579 1.00 0.00 H new ATOM 95 P DT A 4 9.851 -3.608 0.058 1.00 0.00 P ATOM 96 OP1 DT A 4 10.005 -4.746 -0.872 1.00 0.00 O ATOM 97 OP2 DT A 4 10.745 -3.462 1.226 1.00 0.00 O ATOM 98 O5' DT A 4 9.798 -2.233 -0.746 1.00 0.00 O ATOM 99 C5' DT A 4 8.665 -1.899 -1.522 1.00 0.00 C ATOM 100 C4' DT A 4 7.499 -1.261 -0.724 1.00 0.00 C ATOM 101 O4' DT A 4 6.375 -2.137 -0.591 1.00 0.00 O ATOM 102 C3' DT A 4 7.736 -0.767 0.733 1.00 0.00 C ATOM 103 O3' DT A 4 8.999 -0.101 0.922 1.00 0.00 O ATOM 104 C2' DT A 4 6.232 -0.426 0.789 1.00 0.00 C ATOM 105 C1' DT A 4 5.357 -1.326 -0.044 1.00 0.00 C ATOM 106 N1 DT A 4 4.163 -1.867 0.737 1.00 0.00 N ATOM 107 C2 DT A 4 3.151 -2.496 0.023 1.00 0.00 C ATOM 108 O2 DT A 4 3.316 -2.867 -1.133 1.00 0.00 O ATOM 109 N3 DT A 4 1.933 -2.704 0.644 1.00 0.00 N ATOM 110 C4 DT A 4 1.549 -2.361 1.920 1.00 0.00 C ATOM 111 O4 DT A 4 0.489 -2.773 2.381 1.00 0.00 O ATOM 112 C5 DT A 4 2.462 -1.461 2.745 1.00 0.00 C ATOM 113 C7 DT A 4 2.699 -1.965 4.171 1.00 0.00 C ATOM 114 C6 DT A 4 3.778 -1.165 2.027 1.00 0.00 C ATOM 0 H5' DT A 4 8.300 -2.800 -2.014 1.00 0.00 H new ATOM 0 H5'' DT A 4 8.970 -1.208 -2.308 1.00 0.00 H new ATOM 0 H4' DT A 4 7.352 -0.388 -1.360 1.00 0.00 H new ATOM 0 H3' DT A 4 8.043 -1.217 1.677 1.00 0.00 H new ATOM 0 H2' DT A 4 5.899 -0.475 1.826 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.093 0.603 0.458 1.00 0.00 H new ATOM 0 H1' DT A 4 4.739 -0.931 -0.850 1.00 0.00 H new ATOM 0 H3 DT A 4 1.225 -3.175 0.081 1.00 0.00 H new ATOM 0 H71 DT A 4 3.685 -1.648 4.510 1.00 0.00 H new ATOM 0 H72 DT A 4 1.938 -1.553 4.834 1.00 0.00 H new ATOM 0 H73 DT A 4 2.642 -3.053 4.186 1.00 0.00 H new ATOM 0 H6 DT A 4 4.453 -0.436 2.449 1.00 0.00 H new ATOM 127 P DA A 5 9.788 0.971 -0.038 1.00 0.00 P ATOM 128 OP1 DA A 5 11.021 0.313 -0.516 1.00 0.00 O ATOM 129 OP2 DA A 5 9.892 2.235 0.722 1.00 0.00 O ATOM 130 O5' DA A 5 8.870 1.266 -1.321 1.00 0.00 O ATOM 131 C5' DA A 5 7.726 2.063 -1.173 1.00 0.00 C ATOM 132 C4' DA A 5 6.693 1.782 -2.280 1.00 0.00 C ATOM 133 O4' DA A 5 5.395 1.525 -1.756 1.00 0.00 O ATOM 134 C3' DA A 5 6.622 2.933 -3.250 1.00 0.00 C ATOM 135 O3' DA A 5 6.420 2.548 -4.599 1.00 0.00 O ATOM 136 C2' DA A 5 5.443 3.614 -2.657 1.00 0.00 C ATOM 137 C1' DA A 5 4.525 2.589 -2.080 1.00 0.00 C ATOM 138 N9 DA A 5 3.920 3.146 -0.849 1.00 0.00 N ATOM 139 C8 DA A 5 4.563 3.745 0.199 1.00 0.00 C ATOM 140 N7 DA A 5 3.801 4.164 1.163 1.00 0.00 N ATOM 141 C5 DA A 5 2.536 3.846 0.690 1.00 0.00 C ATOM 142 C6 DA A 5 1.248 4.050 1.205 1.00 0.00 C ATOM 143 N6 DA A 5 1.039 4.466 2.447 1.00 0.00 N ATOM 144 N1 DA A 5 0.205 3.875 0.387 1.00 0.00 N ATOM 145 C2 DA A 5 0.439 3.422 -0.834 1.00 0.00 C ATOM 146 N3 DA A 5 1.575 3.104 -1.419 1.00 0.00 N ATOM 147 C4 DA A 5 2.600 3.337 -0.580 1.00 0.00 C ATOM 0 H5' DA A 5 8.009 3.115 -1.197 1.00 0.00 H new ATOM 0 H5'' DA A 5 7.275 1.877 -0.198 1.00 0.00 H new ATOM 0 H4' DA A 5 7.031 0.885 -2.799 1.00 0.00 H new ATOM 0 H3' DA A 5 7.533 3.524 -3.343 1.00 0.00 H new ATOM 0 H2' DA A 5 5.762 4.311 -1.882 1.00 0.00 H new ATOM 0 H2'' DA A 5 4.924 4.198 -3.417 1.00 0.00 H new ATOM 0 H1' DA A 5 3.716 2.284 -2.743 1.00 0.00 H new ATOM 0 H8 DA A 5 5.636 3.862 0.223 1.00 0.00 H new ATOM 0 H61 DA A 5 0.087 4.603 2.786 1.00 0.00 H new ATOM 0 H62 DA A 5 1.831 4.649 3.064 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.440 3.293 -1.447 1.00 0.00 H new ATOM 159 P DC A 6 6.435 3.631 -5.805 1.00 0.00 P ATOM 160 OP1 DC A 6 6.349 2.887 -7.080 1.00 0.00 O ATOM 161 OP2 DC A 6 7.575 4.542 -5.565 1.00 0.00 O ATOM 162 O5' DC A 6 5.070 4.480 -5.619 1.00 0.00 O ATOM 163 C5' DC A 6 3.812 3.933 -5.961 1.00 0.00 C ATOM 164 C4' DC A 6 2.644 4.802 -5.468 1.00 0.00 C ATOM 165 O4' DC A 6 2.498 4.769 -4.053 1.00 0.00 O ATOM 166 C3' DC A 6 2.724 6.296 -5.853 1.00 0.00 C ATOM 167 O3' DC A 6 1.658 6.581 -6.748 1.00 0.00 O ATOM 168 C2' DC A 6 2.563 6.968 -4.486 1.00 0.00 C ATOM 169 C1' DC A 6 1.756 5.931 -3.730 1.00 0.00 C ATOM 170 N1 DC A 6 1.704 6.278 -2.287 1.00 0.00 N ATOM 171 C2 DC A 6 0.479 6.636 -1.713 1.00 0.00 C ATOM 172 O2 DC A 6 -0.572 6.616 -2.351 1.00 0.00 O ATOM 173 N3 DC A 6 0.437 7.019 -0.407 1.00 0.00 N ATOM 174 C4 DC A 6 1.566 7.108 0.297 1.00 0.00 C ATOM 175 N4 DC A 6 1.497 7.406 1.585 1.00 0.00 N ATOM 176 C5 DC A 6 2.821 6.723 -0.256 1.00 0.00 C ATOM 177 C6 DC A 6 2.850 6.310 -1.536 1.00 0.00 C ATOM 0 H5' DC A 6 3.724 2.934 -5.533 1.00 0.00 H new ATOM 0 H5'' DC A 6 3.748 3.823 -7.044 1.00 0.00 H new ATOM 0 H4' DC A 6 1.794 4.348 -5.977 1.00 0.00 H new ATOM 0 H3' DC A 6 3.630 6.623 -6.364 1.00 0.00 H new ATOM 0 H2' DC A 6 3.524 7.166 -4.011 1.00 0.00 H new ATOM 0 H2'' DC A 6 2.040 7.922 -4.557 1.00 0.00 H new ATOM 0 H1' DC A 6 0.701 5.831 -3.983 1.00 0.00 H new ATOM 0 H41 DC A 6 2.351 7.478 2.138 1.00 0.00 H new ATOM 0 H42 DC A 6 0.590 7.564 2.024 1.00 0.00 H new ATOM 0 H5 DC A 6 3.724 6.762 0.336 1.00 0.00 H new ATOM 0 H6 DC A 6 3.786 6.000 -1.976 1.00 0.00 H new ATOM 189 P DG A 7 1.286 8.075 -7.249 1.00 0.00 P ATOM 190 OP1 DG A 7 0.944 7.995 -8.686 1.00 0.00 O ATOM 191 OP2 DG A 7 2.351 9.000 -6.804 1.00 0.00 O ATOM 192 O5' DG A 7 -0.063 8.410 -6.418 1.00 0.00 O ATOM 193 C5' DG A 7 -1.251 7.689 -6.685 1.00 0.00 C ATOM 194 C4' DG A 7 -2.491 8.187 -5.930 1.00 0.00 C ATOM 195 O4' DG A 7 -2.237 8.172 -4.536 1.00 0.00 O ATOM 196 C3' DG A 7 -2.912 9.615 -6.301 1.00 0.00 C ATOM 197 O3' DG A 7 -4.328 9.690 -6.255 1.00 0.00 O ATOM 198 C2' DG A 7 -2.220 10.403 -5.207 1.00 0.00 C ATOM 199 C1' DG A 7 -2.431 9.474 -4.013 1.00 0.00 C ATOM 200 N9 DG A 7 -1.465 9.712 -2.926 1.00 0.00 N ATOM 201 C8 DG A 7 -0.106 9.832 -3.024 1.00 0.00 C ATOM 202 N7 DG A 7 0.500 9.983 -1.880 1.00 0.00 N ATOM 203 C5 DG A 7 -0.536 9.919 -0.946 1.00 0.00 C ATOM 204 C6 DG A 7 -0.512 9.969 0.481 1.00 0.00 C ATOM 205 O6 DG A 7 0.441 10.194 1.219 1.00 0.00 O ATOM 206 N1 DG A 7 -1.753 9.724 1.051 1.00 0.00 N ATOM 207 C2 DG A 7 -2.911 9.576 0.335 1.00 0.00 C ATOM 208 N2 DG A 7 -4.045 9.394 1.002 1.00 0.00 N ATOM 209 N3 DG A 7 -2.962 9.600 -1.000 1.00 0.00 N ATOM 210 C4 DG A 7 -1.739 9.732 -1.579 1.00 0.00 C ATOM 0 H5' DG A 7 -1.087 6.641 -6.434 1.00 0.00 H new ATOM 0 H5'' DG A 7 -1.453 7.733 -7.755 1.00 0.00 H new ATOM 0 H4' DG A 7 -3.299 7.512 -6.213 1.00 0.00 H new ATOM 0 H3' DG A 7 -2.645 9.972 -7.296 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.164 10.569 -5.421 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.672 11.383 -5.054 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.417 9.632 -3.575 1.00 0.00 H new ATOM 0 H8 DG A 7 0.419 9.804 -3.967 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.806 9.649 2.067 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.923 9.281 0.495 1.00 0.00 H new ATOM 0 H22 DG A 7 -4.038 9.367 2.022 1.00 0.00 H new ATOM 222 P DC A 8 -5.148 11.018 -6.676 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.291 10.601 -7.517 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.183 12.013 -7.192 1.00 0.00 O ATOM 225 O5' DC A 8 -5.712 11.553 -5.265 1.00 0.00 O ATOM 226 C5' DC A 8 -6.872 10.986 -4.685 1.00 0.00 C ATOM 227 C4' DC A 8 -7.052 11.498 -3.254 1.00 0.00 C ATOM 228 O4' DC A 8 -5.928 11.160 -2.470 1.00 0.00 O ATOM 229 C3' DC A 8 -7.153 13.016 -3.137 1.00 0.00 C ATOM 230 O3' DC A 8 -8.448 13.488 -3.436 1.00 0.00 O ATOM 231 C2' DC A 8 -6.795 13.220 -1.669 1.00 0.00 C ATOM 232 C1' DC A 8 -5.897 12.018 -1.339 1.00 0.00 C ATOM 233 N1 DC A 8 -4.498 12.438 -1.058 1.00 0.00 N ATOM 234 C2 DC A 8 -4.108 12.612 0.267 1.00 0.00 C ATOM 235 O2 DC A 8 -4.922 12.537 1.184 1.00 0.00 O ATOM 236 N3 DC A 8 -2.800 12.868 0.551 1.00 0.00 N ATOM 237 C4 DC A 8 -1.912 13.002 -0.440 1.00 0.00 C ATOM 238 N4 DC A 8 -0.636 13.168 -0.121 1.00 0.00 N ATOM 239 C5 DC A 8 -2.292 12.887 -1.816 1.00 0.00 C ATOM 240 C6 DC A 8 -3.590 12.600 -2.071 1.00 0.00 C ATOM 0 H5' DC A 8 -6.792 9.899 -4.683 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.747 11.240 -5.283 1.00 0.00 H new ATOM 0 H4' DC A 8 -7.982 11.036 -2.922 1.00 0.00 H new ATOM 0 H3' DC A 8 -6.515 13.560 -3.834 1.00 0.00 H new ATOM 0 H2' DC A 8 -6.273 14.164 -1.512 1.00 0.00 H new ATOM 0 H2'' DC A 8 -7.685 13.239 -1.039 1.00 0.00 H new ATOM 0 HO3' DC A 8 -8.469 14.464 -3.347 1.00 0.00 H new ATOM 0 H1' DC A 8 -6.261 11.516 -0.443 1.00 0.00 H new ATOM 0 H41 DC A 8 0.064 13.273 -0.856 1.00 0.00 H new ATOM 0 H42 DC A 8 -0.354 13.191 0.859 1.00 0.00 H new ATOM 0 H5 DC A 8 -1.576 13.023 -2.613 1.00 0.00 H new ATOM 0 H6 DC A 8 -3.917 12.496 -3.095 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 1.066 12.052 9.550 1.00 0.00 O ATOM 255 C5' DG B 9 0.006 12.477 10.376 1.00 0.00 C ATOM 256 C4' DG B 9 -1.272 11.651 10.172 1.00 0.00 C ATOM 257 O4' DG B 9 -1.781 11.802 8.857 1.00 0.00 O ATOM 258 C3' DG B 9 -1.088 10.147 10.382 1.00 0.00 C ATOM 259 O3' DG B 9 -2.333 9.688 10.878 1.00 0.00 O ATOM 260 C2' DG B 9 -0.732 9.671 8.970 1.00 0.00 C ATOM 261 C1' DG B 9 -1.510 10.643 8.078 1.00 0.00 C ATOM 262 N9 DG B 9 -0.827 11.075 6.832 1.00 0.00 N ATOM 263 C8 DG B 9 0.510 11.258 6.575 1.00 0.00 C ATOM 264 N7 DG B 9 0.771 11.755 5.399 1.00 0.00 N ATOM 265 C5 DG B 9 -0.484 11.922 4.824 1.00 0.00 C ATOM 266 C6 DG B 9 -0.853 12.404 3.532 1.00 0.00 C ATOM 267 O6 DG B 9 -0.125 12.856 2.652 1.00 0.00 O ATOM 268 N1 DG B 9 -2.216 12.327 3.297 1.00 0.00 N ATOM 269 C2 DG B 9 -3.133 11.904 4.229 1.00 0.00 C ATOM 270 N2 DG B 9 -4.416 11.884 3.886 1.00 0.00 N ATOM 271 N3 DG B 9 -2.805 11.480 5.454 1.00 0.00 N ATOM 272 C4 DG B 9 -1.466 11.505 5.689 1.00 0.00 C ATOM 0 H5' DG B 9 -0.208 13.526 10.174 1.00 0.00 H new ATOM 0 H5'' DG B 9 0.314 12.410 11.419 1.00 0.00 H new ATOM 0 H4' DG B 9 -1.955 12.040 10.927 1.00 0.00 H new ATOM 0 H3' DG B 9 -0.329 9.802 11.084 1.00 0.00 H new ATOM 0 H2' DG B 9 0.341 9.722 8.784 1.00 0.00 H new ATOM 0 H2'' DG B 9 -1.035 8.638 8.803 1.00 0.00 H new ATOM 0 HO5' DG B 9 0.751 11.980 8.625 1.00 0.00 H new ATOM 0 H1' DG B 9 -2.398 10.105 7.746 1.00 0.00 H new ATOM 0 H8 DG B 9 1.282 11.010 7.289 1.00 0.00 H new ATOM 0 H1 DG B 9 -2.560 12.601 2.377 1.00 0.00 H new ATOM 0 H21 DG B 9 -5.119 11.575 4.558 1.00 0.00 H new ATOM 0 H22 DG B 9 -4.699 12.178 2.951 1.00 0.00 H new ATOM 285 P DC B 10 -2.677 8.141 11.132 1.00 0.00 P ATOM 286 OP1 DC B 10 -3.510 8.046 12.350 1.00 0.00 O ATOM 287 OP2 DC B 10 -1.430 7.353 11.025 1.00 0.00 O ATOM 288 O5' DC B 10 -3.593 7.833 9.849 1.00 0.00 O ATOM 289 C5' DC B 10 -4.875 8.415 9.714 1.00 0.00 C ATOM 290 C4' DC B 10 -5.506 8.033 8.370 1.00 0.00 C ATOM 291 O4' DC B 10 -4.790 8.656 7.306 1.00 0.00 O ATOM 292 C3' DC B 10 -5.473 6.514 8.139 1.00 0.00 C ATOM 293 O3' DC B 10 -6.691 6.147 7.545 1.00 0.00 O ATOM 294 C2' DC B 10 -4.260 6.427 7.217 1.00 0.00 C ATOM 295 C1' DC B 10 -4.414 7.675 6.356 1.00 0.00 C ATOM 296 N1 DC B 10 -3.162 8.034 5.642 1.00 0.00 N ATOM 297 C2 DC B 10 -3.190 8.592 4.365 1.00 0.00 C ATOM 298 O2 DC B 10 -4.252 8.789 3.777 1.00 0.00 O ATOM 299 N3 DC B 10 -2.009 8.927 3.753 1.00 0.00 N ATOM 300 C4 DC B 10 -0.843 8.657 4.361 1.00 0.00 C ATOM 301 N4 DC B 10 0.290 9.058 3.799 1.00 0.00 N ATOM 302 C5 DC B 10 -0.795 8.032 5.643 1.00 0.00 C ATOM 303 C6 DC B 10 -1.967 7.749 6.219 1.00 0.00 C ATOM 0 H5' DC B 10 -4.797 9.500 9.789 1.00 0.00 H new ATOM 0 H5'' DC B 10 -5.518 8.084 10.530 1.00 0.00 H new ATOM 0 H4' DC B 10 -6.543 8.368 8.392 1.00 0.00 H new ATOM 0 H3' DC B 10 -5.380 5.855 9.002 1.00 0.00 H new ATOM 0 H2' DC B 10 -3.324 6.432 7.775 1.00 0.00 H new ATOM 0 H2'' DC B 10 -4.269 5.516 6.618 1.00 0.00 H new ATOM 0 H1' DC B 10 -5.138 7.552 5.550 1.00 0.00 H new ATOM 0 H41 DC B 10 1.182 8.859 4.251 1.00 0.00 H new ATOM 0 H42 DC B 10 0.269 9.566 2.914 1.00 0.00 H new ATOM 0 H5 DC B 10 0.143 7.799 6.124 1.00 0.00 H new ATOM 0 H6 DC B 10 -1.963 7.272 7.188 1.00 0.00 H new ATOM 315 P DG B 11 -7.120 4.618 7.337 1.00 0.00 P ATOM 316 OP1 DG B 11 -8.351 4.370 8.116 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.932 3.757 7.524 1.00 0.00 O ATOM 318 O5' DG B 11 -7.475 4.658 5.778 1.00 0.00 O ATOM 319 C5' DG B 11 -8.437 5.563 5.282 1.00 0.00 C ATOM 320 C4' DG B 11 -8.542 5.415 3.766 1.00 0.00 C ATOM 321 O4' DG B 11 -7.374 5.942 3.168 1.00 0.00 O ATOM 322 C3' DG B 11 -8.667 3.947 3.352 1.00 0.00 C ATOM 323 O3' DG B 11 -9.645 3.888 2.333 1.00 0.00 O ATOM 324 C2' DG B 11 -7.241 3.591 2.925 1.00 0.00 C ATOM 325 C1' DG B 11 -6.675 4.936 2.460 1.00 0.00 C ATOM 326 N9 DG B 11 -5.238 5.099 2.761 1.00 0.00 N ATOM 327 C8 DG B 11 -4.609 4.916 3.966 1.00 0.00 C ATOM 328 N7 DG B 11 -3.370 5.309 3.990 1.00 0.00 N ATOM 329 C5 DG B 11 -3.144 5.745 2.690 1.00 0.00 C ATOM 330 C6 DG B 11 -1.948 6.215 2.085 1.00 0.00 C ATOM 331 O6 DG B 11 -0.860 6.397 2.619 1.00 0.00 O ATOM 332 N1 DG B 11 -2.088 6.478 0.737 1.00 0.00 N ATOM 333 C2 DG B 11 -3.264 6.353 0.044 1.00 0.00 C ATOM 334 N2 DG B 11 -3.227 6.580 -1.264 1.00 0.00 N ATOM 335 N3 DG B 11 -4.404 5.913 0.599 1.00 0.00 N ATOM 336 C4 DG B 11 -4.275 5.619 1.923 1.00 0.00 C ATOM 0 H5' DG B 11 -8.158 6.585 5.540 1.00 0.00 H new ATOM 0 H5'' DG B 11 -9.405 5.371 5.745 1.00 0.00 H new ATOM 0 H4' DG B 11 -9.432 5.951 3.438 1.00 0.00 H new ATOM 0 H3' DG B 11 -9.001 3.237 4.108 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.664 3.174 3.751 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.232 2.851 2.125 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.792 4.997 1.378 1.00 0.00 H new ATOM 0 H8 DG B 11 -5.102 4.482 4.823 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.262 6.785 0.223 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.078 6.499 -1.820 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.347 6.836 -1.713 1.00 0.00 H new ATOM 348 P DT B 12 -10.237 2.497 1.788 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.550 2.767 1.164 1.00 0.00 O ATOM 350 OP2 DT B 12 -10.121 1.487 2.862 1.00 0.00 O ATOM 351 O5' DT B 12 -9.179 2.150 0.640 1.00 0.00 O ATOM 352 C5' DT B 12 -9.147 2.891 -0.561 1.00 0.00 C ATOM 353 C4' DT B 12 -7.912 2.495 -1.367 1.00 0.00 C ATOM 354 O4' DT B 12 -6.720 2.869 -0.712 1.00 0.00 O ATOM 355 C3' DT B 12 -7.795 0.984 -1.570 1.00 0.00 C ATOM 356 O3' DT B 12 -8.521 0.636 -2.732 1.00 0.00 O ATOM 357 C2' DT B 12 -6.275 0.781 -1.637 1.00 0.00 C ATOM 358 C1' DT B 12 -5.686 2.174 -1.378 1.00 0.00 C ATOM 359 N1 DT B 12 -4.453 2.219 -0.554 1.00 0.00 N ATOM 360 C2 DT B 12 -3.455 3.162 -0.762 1.00 0.00 C ATOM 361 O2 DT B 12 -3.386 3.831 -1.787 1.00 0.00 O ATOM 362 N3 DT B 12 -2.527 3.317 0.251 1.00 0.00 N ATOM 363 C4 DT B 12 -2.490 2.636 1.441 1.00 0.00 C ATOM 364 O4 DT B 12 -1.789 3.032 2.367 1.00 0.00 O ATOM 365 C5 DT B 12 -3.334 1.378 1.597 1.00 0.00 C ATOM 366 C7 DT B 12 -4.258 1.417 2.819 1.00 0.00 C ATOM 367 C6 DT B 12 -4.255 1.134 0.420 1.00 0.00 C ATOM 0 H5' DT B 12 -9.125 3.959 -0.342 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.050 2.703 -1.142 1.00 0.00 H new ATOM 0 H4' DT B 12 -8.037 3.009 -2.320 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.217 0.341 -0.797 1.00 0.00 H new ATOM 0 H2' DT B 12 -5.938 0.063 -0.890 1.00 0.00 H new ATOM 0 H2'' DT B 12 -5.969 0.396 -2.610 1.00 0.00 H new ATOM 0 H1' DT B 12 -5.370 2.602 -2.330 1.00 0.00 H new ATOM 0 H3 DT B 12 -1.794 4.009 0.098 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.153 0.829 2.617 1.00 0.00 H new ATOM 0 H72 DT B 12 -3.738 1.001 3.682 1.00 0.00 H new ATOM 0 H73 DT B 12 -4.541 2.449 3.028 1.00 0.00 H new ATOM 0 H6 DT B 12 -4.755 0.185 0.298 1.00 0.00 H new ATOM 380 P DA B 13 -8.861 -0.892 -3.115 1.00 0.00 P ATOM 381 OP1 DA B 13 -9.926 -0.876 -4.139 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.056 -1.652 -1.861 1.00 0.00 O ATOM 383 O5' DA B 13 -7.502 -1.391 -3.801 1.00 0.00 O ATOM 384 C5' DA B 13 -7.001 -0.752 -4.957 1.00 0.00 C ATOM 385 C4' DA B 13 -5.672 -1.397 -5.339 1.00 0.00 C ATOM 386 O4' DA B 13 -4.783 -1.361 -4.241 1.00 0.00 O ATOM 387 C3' DA B 13 -5.848 -2.857 -5.762 1.00 0.00 C ATOM 388 O3' DA B 13 -5.056 -3.105 -6.906 1.00 0.00 O ATOM 389 C2' DA B 13 -5.314 -3.568 -4.529 1.00 0.00 C ATOM 390 C1' DA B 13 -4.184 -2.631 -4.101 1.00 0.00 C ATOM 391 N9 DA B 13 -3.804 -2.859 -2.696 1.00 0.00 N ATOM 392 C8 DA B 13 -4.646 -2.841 -1.620 1.00 0.00 C ATOM 393 N7 DA B 13 -4.113 -3.289 -0.517 1.00 0.00 N ATOM 394 C5 DA B 13 -2.773 -3.442 -0.862 1.00 0.00 C ATOM 395 C6 DA B 13 -1.627 -3.714 -0.097 1.00 0.00 C ATOM 396 N6 DA B 13 -1.688 -4.059 1.185 1.00 0.00 N ATOM 397 N1 DA B 13 -0.423 -3.483 -0.633 1.00 0.00 N ATOM 398 C2 DA B 13 -0.346 -3.115 -1.903 1.00 0.00 C ATOM 399 N3 DA B 13 -1.340 -2.919 -2.768 1.00 0.00 N ATOM 400 C4 DA B 13 -2.551 -3.082 -2.167 1.00 0.00 C ATOM 0 H5' DA B 13 -6.864 0.313 -4.770 1.00 0.00 H new ATOM 0 H5'' DA B 13 -7.714 -0.842 -5.777 1.00 0.00 H new ATOM 0 H4' DA B 13 -5.272 -0.830 -6.180 1.00 0.00 H new ATOM 0 H3' DA B 13 -6.858 -3.163 -6.036 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.074 -3.674 -3.755 1.00 0.00 H new ATOM 0 H2'' DA B 13 -4.951 -4.570 -4.758 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.271 -2.765 -4.681 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.665 -2.487 -1.678 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.830 -4.248 1.704 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.593 -4.135 1.650 1.00 0.00 H new ATOM 0 H2 DA B 13 0.651 -2.953 -2.287 1.00 0.00 H new ATOM 412 P DC B 14 -5.289 -4.395 -7.845 1.00 0.00 P ATOM 413 OP1 DC B 14 -6.650 -4.282 -8.411 1.00 0.00 O ATOM 414 OP2 DC B 14 -4.926 -5.608 -7.080 1.00 0.00 O ATOM 415 O5' DC B 14 -4.227 -4.209 -9.045 1.00 0.00 O ATOM 416 C5' DC B 14 -2.987 -3.544 -8.877 1.00 0.00 C ATOM 417 C4' DC B 14 -1.947 -4.302 -8.040 1.00 0.00 C ATOM 418 O4' DC B 14 -2.272 -4.422 -6.663 1.00 0.00 O ATOM 419 C3' DC B 14 -1.648 -5.728 -8.541 1.00 0.00 C ATOM 420 O3' DC B 14 -0.350 -5.711 -9.114 1.00 0.00 O ATOM 421 C2' DC B 14 -1.724 -6.540 -7.242 1.00 0.00 C ATOM 422 C1' DC B 14 -1.431 -5.465 -6.203 1.00 0.00 C ATOM 423 N1 DC B 14 -1.680 -5.900 -4.800 1.00 0.00 N ATOM 424 C2 DC B 14 -0.602 -5.969 -3.920 1.00 0.00 C ATOM 425 O2 DC B 14 0.550 -5.765 -4.297 1.00 0.00 O ATOM 426 N3 DC B 14 -0.822 -6.269 -2.613 1.00 0.00 N ATOM 427 C4 DC B 14 -2.043 -6.596 -2.190 1.00 0.00 C ATOM 428 N4 DC B 14 -2.212 -6.832 -0.896 1.00 0.00 N ATOM 429 C5 DC B 14 -3.164 -6.597 -3.077 1.00 0.00 C ATOM 430 C6 DC B 14 -2.930 -6.250 -4.362 1.00 0.00 C ATOM 0 H5' DC B 14 -3.172 -2.577 -8.409 1.00 0.00 H new ATOM 0 H5'' DC B 14 -2.563 -3.346 -9.861 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.070 -3.666 -8.162 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.314 -6.133 -9.303 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.704 -6.995 -7.098 1.00 0.00 H new ATOM 0 H2'' DC B 14 -0.991 -7.347 -7.217 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.382 -5.177 -6.131 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.134 -7.085 -0.540 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.420 -6.761 -0.257 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.153 -6.863 -2.736 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.751 -6.249 -5.063 1.00 0.00 H new ATOM 442 P DG B 15 0.189 -6.827 -10.156 1.00 0.00 P ATOM 443 OP1 DG B 15 1.205 -6.172 -11.006 1.00 0.00 O ATOM 444 OP2 DG B 15 -0.981 -7.474 -10.787 1.00 0.00 O ATOM 445 O5' DG B 15 0.943 -7.929 -9.251 1.00 0.00 O ATOM 446 C5' DG B 15 1.795 -7.554 -8.186 1.00 0.00 C ATOM 447 C4' DG B 15 2.882 -8.603 -7.886 1.00 0.00 C ATOM 448 O4' DG B 15 3.064 -8.602 -6.480 1.00 0.00 O ATOM 449 C3' DG B 15 2.560 -10.058 -8.274 1.00 0.00 C ATOM 450 O3' DG B 15 3.739 -10.842 -8.241 1.00 0.00 O ATOM 451 C2' DG B 15 1.600 -10.304 -7.133 1.00 0.00 C ATOM 452 C1' DG B 15 2.404 -9.739 -5.960 1.00 0.00 C ATOM 453 N9 DG B 15 1.548 -9.443 -4.797 1.00 0.00 N ATOM 454 C8 DG B 15 0.191 -9.340 -4.784 1.00 0.00 C ATOM 455 N7 DG B 15 -0.338 -9.197 -3.606 1.00 0.00 N ATOM 456 C5 DG B 15 0.767 -9.202 -2.757 1.00 0.00 C ATOM 457 C6 DG B 15 0.842 -9.127 -1.334 1.00 0.00 C ATOM 458 O6 DG B 15 -0.081 -9.017 -0.532 1.00 0.00 O ATOM 459 N1 DG B 15 2.144 -9.192 -0.863 1.00 0.00 N ATOM 460 C2 DG B 15 3.247 -9.371 -1.662 1.00 0.00 C ATOM 461 N2 DG B 15 4.440 -9.469 -1.089 1.00 0.00 N ATOM 462 N3 DG B 15 3.186 -9.499 -2.990 1.00 0.00 N ATOM 463 C4 DG B 15 1.924 -9.376 -3.477 1.00 0.00 C ATOM 0 H5' DG B 15 1.197 -7.392 -7.289 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.272 -6.604 -8.427 1.00 0.00 H new ATOM 0 H4' DG B 15 3.746 -8.314 -8.485 1.00 0.00 H new ATOM 0 H3' DG B 15 2.168 -10.278 -9.267 1.00 0.00 H new ATOM 0 H2' DG B 15 0.651 -9.786 -7.272 1.00 0.00 H new ATOM 0 H2'' DG B 15 1.370 -11.362 -7.006 1.00 0.00 H new ATOM 0 H1' DG B 15 3.126 -10.457 -5.570 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.402 -9.375 -5.686 1.00 0.00 H new ATOM 0 H1 DG B 15 2.293 -9.101 0.142 1.00 0.00 H new ATOM 0 H21 DG B 15 5.272 -9.602 -1.663 1.00 0.00 H new ATOM 0 H22 DG B 15 4.525 -9.411 -0.074 1.00 0.00 H new ATOM 475 P DC B 16 3.730 -12.438 -8.491 1.00 0.00 P ATOM 476 OP1 DC B 16 4.772 -12.749 -9.494 1.00 0.00 O ATOM 477 OP2 DC B 16 2.334 -12.866 -8.725 1.00 0.00 O ATOM 478 O5' DC B 16 4.200 -13.009 -7.060 1.00 0.00 O ATOM 479 C5' DC B 16 5.527 -12.806 -6.616 1.00 0.00 C ATOM 480 C4' DC B 16 5.686 -13.168 -5.141 1.00 0.00 C ATOM 481 O4' DC B 16 4.867 -12.318 -4.373 1.00 0.00 O ATOM 482 C3' DC B 16 5.255 -14.584 -4.770 1.00 0.00 C ATOM 483 O3' DC B 16 6.268 -15.531 -5.028 1.00 0.00 O ATOM 484 C2' DC B 16 4.994 -14.419 -3.277 1.00 0.00 C ATOM 485 C1' DC B 16 4.621 -12.936 -3.123 1.00 0.00 C ATOM 486 N1 DC B 16 3.189 -12.766 -2.761 1.00 0.00 N ATOM 487 C2 DC B 16 2.861 -12.637 -1.415 1.00 0.00 C ATOM 488 O2 DC B 16 3.721 -12.699 -0.540 1.00 0.00 O ATOM 489 N3 DC B 16 1.563 -12.437 -1.061 1.00 0.00 N ATOM 490 C4 DC B 16 0.608 -12.401 -1.996 1.00 0.00 C ATOM 491 N4 DC B 16 -0.630 -12.129 -1.609 1.00 0.00 N ATOM 492 C5 DC B 16 0.909 -12.546 -3.388 1.00 0.00 C ATOM 493 C6 DC B 16 2.210 -12.719 -3.722 1.00 0.00 C ATOM 0 H5' DC B 16 5.807 -11.764 -6.768 1.00 0.00 H new ATOM 0 H5'' DC B 16 6.209 -13.410 -7.215 1.00 0.00 H new ATOM 0 H4' DC B 16 6.754 -13.072 -4.945 1.00 0.00 H new ATOM 0 H3' DC B 16 4.403 -14.959 -5.338 1.00 0.00 H new ATOM 0 H2' DC B 16 4.188 -15.070 -2.939 1.00 0.00 H new ATOM 0 H2'' DC B 16 5.876 -14.671 -2.688 1.00 0.00 H new ATOM 0 HO3' DC B 16 5.953 -16.424 -4.775 1.00 0.00 H new ATOM 0 H1' DC B 16 5.212 -12.488 -2.324 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.383 -12.094 -2.296 1.00 0.00 H new ATOM 0 H42 DC B 16 -0.830 -11.955 -0.624 1.00 0.00 H new ATOM 0 H5 DC B 16 0.133 -12.519 -4.139 1.00 0.00 H new ATOM 0 H6 DC B 16 2.482 -12.822 -4.762 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO B 1 -1.451 0.194 -1.434 1.00 0.00 O HETATM 508 C2 PSO B 1 -2.702 0.114 -1.358 1.00 0.00 C HETATM 509 C3 PSO B 1 -3.460 -0.061 -0.054 1.00 0.00 C HETATM 510 C4 PSO B 1 -2.639 0.057 1.193 1.00 0.00 C HETATM 511 C5 PSO B 1 -0.401 0.289 2.025 1.00 0.00 C HETATM 512 C6 PSO B 1 0.989 0.418 1.818 1.00 0.00 C HETATM 513 C7 PSO B 1 1.490 0.432 0.566 1.00 0.00 C HETATM 514 C8 PSO B 1 0.639 0.184 -0.515 1.00 0.00 C HETATM 515 C9 PSO B 1 -0.764 0.227 -0.362 1.00 0.00 C HETATM 516 C10 PSO B 1 -1.273 0.211 0.931 1.00 0.00 C HETATM 517 C4' PSO B 1 2.093 0.043 2.756 1.00 0.00 C HETATM 518 C5' PSO B 1 3.272 0.273 1.821 1.00 0.00 C HETATM 519 O6' PSO B 1 2.750 0.434 0.491 1.00 0.00 O HETATM 520 O11 PSO B 1 -3.341 0.180 -2.401 1.00 0.00 O HETATM 521 C12 PSO B 1 -2.946 -1.002 2.265 1.00 0.00 C HETATM 522 C13 PSO B 1 2.092 0.792 4.099 1.00 0.00 C HETATM 523 O14 PSO B 1 1.733 2.155 4.035 1.00 0.00 O HETATM 524 C15 PSO B 1 4.074 1.434 2.384 1.00 0.00 C HETATM 525 C16 PSO B 1 1.264 -0.143 -1.842 1.00 0.00 C HETATM 0 H163 PSO B 1 1.894 0.687 -2.162 1.00 0.00 H new HETATM 0 H162 PSO B 1 1.871 -1.043 -1.746 1.00 0.00 H new HETATM 0 H161 PSO B 1 0.481 -0.310 -2.582 1.00 0.00 H new HETATM 0 H153 PSO B 1 3.444 2.322 2.431 1.00 0.00 H new HETATM 0 H152 PSO B 1 4.423 1.183 3.386 1.00 0.00 H new HETATM 0 H151 PSO B 1 4.931 1.631 1.740 1.00 0.00 H new HETATM 0 H132 PSO B 1 1.405 0.285 4.777 1.00 0.00 H new HETATM 0 H131 PSO B 1 3.087 0.717 4.538 1.00 0.00 H new HETATM 0 H123 PSO B 1 -3.990 -0.923 2.566 1.00 0.00 H new HETATM 0 H122 PSO B 1 -2.760 -1.996 1.858 1.00 0.00 H new HETATM 0 H121 PSO B 1 -2.305 -0.839 3.131 1.00 0.00 H new HETATM 0 H5 PSO B 1 -0.798 0.250 3.040 1.00 0.00 H new HETATM 0 H14 PSO B 1 1.760 2.543 4.935 1.00 0.00 H new