USER MOD reduce.3.24.130724 H: found=0, std=0, add=321, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 349 hydrogens (99 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: A 101 PYB HN2 : A 101 PYB N : A 100 9U2 C81 :(H bumps) USER MOD NoAdj-H: A 102 PYB HN2 : A 102 PYB N : A 101 PYB C :(H bumps) USER MOD NoAdj-H: A 103 PYB HN2 : A 103 PYB N : A 102 PYB C :(H bumps) USER MOD NoAdj-H: A 105 IMT H : A 105 IMT N : A 104 ABU CD :(H bumps) USER MOD NoAdj-H: A 106 PYB HN2 : A 106 PYB N : A 105 IMT C :(H bumps) USER MOD NoAdj-H: A 107 PYB HN2 : A 107 PYB N : A 106 PYB C :(H bumps) USER MOD NoAdj-H: A 108 PYB HN2 : A 108 PYB N : A 107 PYB C :(H bumps) USER MOD Single : A 1 DCZ O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl -30:sc= -0.0196 (180deg=-0.0612) USER MOD Single : A 6 DT C7 :methyl 150:sc= -0.0244 (180deg=-0.0244) USER MOD Single : A 10 DT C7 :methyl 150:sc= -0.65 (180deg=-0.65) USER MOD Single : A 12 DG O3' : rot 180:sc= 0 USER MOD Single : B 13 DCZ O5' : rot 180:sc= 0 USER MOD Single : B 16 DT C7 :methyl -30:sc= -0.368 (180deg=-0.547) USER MOD Single : B 18 DT C7 :methyl -30:sc= -0.617 (180deg=-0.626) USER MOD Single : B 22 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 N1 DCZ A 1 26.979 9.271 28.953 1.00 0.00 N HETATM 2 C2 DCZ A 1 25.795 8.558 29.165 1.00 0.00 C HETATM 3 N3 DCZ A 1 25.072 8.730 30.294 1.00 0.00 N HETATM 4 C4 DCZ A 1 25.491 9.603 31.183 1.00 0.00 C HETATM 5 C5 DCZ A 1 26.678 10.373 31.027 1.00 0.00 C HETATM 6 C6 DCZ A 1 27.401 10.184 29.891 1.00 0.00 C HETATM 7 O2 DCZ A 1 25.349 7.766 28.333 1.00 0.00 O HETATM 8 N4 DCZ A 1 24.732 9.715 32.236 1.00 0.00 N HETATM 9 C1' DCZ A 1 27.733 9.042 27.688 1.00 0.00 C HETATM 10 C2' DCZ A 1 27.545 10.185 26.688 1.00 0.00 C HETATM 11 C3' DCZ A 1 28.955 10.581 26.253 1.00 0.00 C HETATM 12 C4' DCZ A 1 29.809 9.432 26.802 1.00 0.00 C HETATM 13 O4' DCZ A 1 29.122 8.952 27.948 1.00 0.00 O HETATM 14 O3' DCZ A 1 29.075 10.686 24.839 1.00 0.00 O HETATM 15 C5' DCZ A 1 31.249 9.842 27.161 1.00 0.00 C HETATM 16 O5' DCZ A 1 31.312 10.880 28.142 1.00 0.00 O HETATM 0 HO51 DCZ A 1 32.249 11.096 28.330 1.00 0.00 H new HETATM 0 HN42 DCZ A 1 24.982 10.370 32.977 1.00 0.00 H new HETATM 0 HN41 DCZ A 1 23.888 9.148 32.319 1.00 0.00 H new HETATM 0 H5'2 DCZ A 1 31.787 8.969 27.530 1.00 0.00 H new HETATM 0 H5'1 DCZ A 1 31.761 10.173 26.258 1.00 0.00 H new HETATM 0 H2'2 DCZ A 1 26.946 9.866 25.835 1.00 0.00 H new HETATM 0 H2'1 DCZ A 1 27.025 11.026 27.146 1.00 0.00 H new HETATM 0 H6 DCZ A 1 28.314 10.755 29.724 1.00 0.00 H new HETATM 0 H5 DCZ A 1 26.995 11.086 31.788 1.00 0.00 H new HETATM 0 H4' DCZ A 1 29.928 8.669 26.033 1.00 0.00 H new HETATM 0 H3' DCZ A 1 29.251 11.563 26.622 1.00 0.00 H new HETATM 0 H1' DCZ A 1 27.343 8.115 27.268 1.00 0.00 H new ATOM 29 P DG A 2 28.551 11.975 24.024 1.00 0.00 P ATOM 30 OP1 DG A 2 29.228 11.977 22.703 1.00 0.00 O ATOM 31 OP2 DG A 2 28.684 13.172 24.890 1.00 0.00 O ATOM 32 O5' DG A 2 26.975 11.709 23.793 1.00 0.00 O ATOM 33 C5' DG A 2 26.502 10.695 22.911 1.00 0.00 C ATOM 34 C4' DG A 2 25.032 10.876 22.482 1.00 0.00 C ATOM 35 O4' DG A 2 24.117 10.567 23.533 1.00 0.00 O ATOM 36 C3' DG A 2 24.719 12.299 22.001 1.00 0.00 C ATOM 37 O3' DG A 2 23.796 12.262 20.915 1.00 0.00 O ATOM 38 C2' DG A 2 24.140 12.924 23.270 1.00 0.00 C ATOM 39 C1' DG A 2 23.440 11.745 23.957 1.00 0.00 C ATOM 40 N9 DG A 2 23.504 11.798 25.440 1.00 0.00 N ATOM 41 C8 DG A 2 24.619 11.948 26.227 1.00 0.00 C ATOM 42 N7 DG A 2 24.402 11.833 27.510 1.00 0.00 N ATOM 43 C5 DG A 2 23.017 11.639 27.587 1.00 0.00 C ATOM 44 C6 DG A 2 22.142 11.477 28.720 1.00 0.00 C ATOM 45 O6 DG A 2 22.417 11.422 29.919 1.00 0.00 O ATOM 46 N1 DG A 2 20.811 11.380 28.377 1.00 0.00 N ATOM 47 C2 DG A 2 20.361 11.359 27.101 1.00 0.00 C ATOM 48 N2 DG A 2 19.069 11.279 26.936 1.00 0.00 N ATOM 49 N3 DG A 2 21.129 11.476 26.018 1.00 0.00 N ATOM 50 C4 DG A 2 22.457 11.624 26.324 1.00 0.00 C ATOM 0 H5' DG A 2 26.612 9.725 23.396 1.00 0.00 H new ATOM 0 H5'' DG A 2 27.131 10.679 22.021 1.00 0.00 H new ATOM 0 H4' DG A 2 24.904 10.177 21.656 1.00 0.00 H new ATOM 0 H3' DG A 2 25.566 12.860 21.607 1.00 0.00 H new ATOM 0 H2' DG A 2 24.920 13.351 23.900 1.00 0.00 H new ATOM 0 H2'' DG A 2 23.441 13.728 23.040 1.00 0.00 H new ATOM 0 H1' DG A 2 22.385 11.770 23.684 1.00 0.00 H new ATOM 0 H8 DG A 2 25.599 12.146 25.817 1.00 0.00 H new ATOM 0 H1 DG A 2 20.125 11.321 29.129 1.00 0.00 H new ATOM 0 H21 DG A 2 18.675 11.260 25.995 1.00 0.00 H new ATOM 0 H22 DG A 2 18.453 11.236 27.748 1.00 0.00 H new ATOM 62 P DA A 3 23.588 13.523 19.927 1.00 0.00 P ATOM 63 OP1 DA A 3 22.927 13.032 18.691 1.00 0.00 O ATOM 64 OP2 DA A 3 24.871 14.260 19.803 1.00 0.00 O ATOM 65 O5' DA A 3 22.551 14.447 20.739 1.00 0.00 O ATOM 66 C5' DA A 3 21.156 14.170 20.740 1.00 0.00 C ATOM 67 C4' DA A 3 20.419 14.811 21.926 1.00 0.00 C ATOM 68 O4' DA A 3 20.790 14.202 23.158 1.00 0.00 O ATOM 69 C3' DA A 3 20.691 16.311 22.122 1.00 0.00 C ATOM 70 O3' DA A 3 19.824 17.155 21.369 1.00 0.00 O ATOM 71 C2' DA A 3 20.459 16.465 23.624 1.00 0.00 C ATOM 72 C1' DA A 3 20.296 15.052 24.173 1.00 0.00 C ATOM 73 N9 DA A 3 21.004 14.910 25.459 1.00 0.00 N ATOM 74 C8 DA A 3 22.354 14.986 25.702 1.00 0.00 C ATOM 75 N7 DA A 3 22.677 14.915 26.968 1.00 0.00 N ATOM 76 C5 DA A 3 21.430 14.803 27.602 1.00 0.00 C ATOM 77 C6 DA A 3 21.000 14.693 28.946 1.00 0.00 C ATOM 78 N6 DA A 3 21.809 14.639 29.982 1.00 0.00 N ATOM 79 N1 DA A 3 19.707 14.630 29.256 1.00 0.00 N ATOM 80 C2 DA A 3 18.823 14.663 28.267 1.00 0.00 C ATOM 81 N3 DA A 3 19.068 14.766 26.964 1.00 0.00 N ATOM 82 C4 DA A 3 20.405 14.821 26.695 1.00 0.00 C ATOM 0 H5' DA A 3 21.005 13.091 20.766 1.00 0.00 H new ATOM 0 H5'' DA A 3 20.719 14.531 19.809 1.00 0.00 H new ATOM 0 H4' DA A 3 19.369 14.661 21.673 1.00 0.00 H new ATOM 0 H3' DA A 3 21.681 16.610 21.776 1.00 0.00 H new ATOM 0 H2' DA A 3 21.299 16.973 24.098 1.00 0.00 H new ATOM 0 H2'' DA A 3 19.571 17.065 23.822 1.00 0.00 H new ATOM 0 H1' DA A 3 19.261 14.799 24.401 1.00 0.00 H new ATOM 0 H8 DA A 3 23.086 15.095 24.915 1.00 0.00 H new ATOM 0 H61 DA A 3 21.426 14.560 30.924 1.00 0.00 H new ATOM 0 H62 DA A 3 22.819 14.676 29.843 1.00 0.00 H new ATOM 0 H2 DA A 3 17.784 14.599 28.554 1.00 0.00 H new ATOM 94 P DT A 4 19.956 18.771 21.398 1.00 0.00 P ATOM 95 OP1 DT A 4 19.195 19.305 20.242 1.00 0.00 O ATOM 96 OP2 DT A 4 21.392 19.124 21.529 1.00 0.00 O ATOM 97 O5' DT A 4 19.204 19.221 22.760 1.00 0.00 O ATOM 98 C5' DT A 4 17.789 19.105 22.886 1.00 0.00 C ATOM 99 C4' DT A 4 17.277 19.165 24.336 1.00 0.00 C ATOM 100 O4' DT A 4 17.849 18.129 25.130 1.00 0.00 O ATOM 101 C3' DT A 4 17.583 20.455 25.107 1.00 0.00 C ATOM 102 O3' DT A 4 16.853 21.611 24.676 1.00 0.00 O ATOM 103 C2' DT A 4 17.312 19.951 26.522 1.00 0.00 C ATOM 104 C1' DT A 4 17.848 18.522 26.496 1.00 0.00 C ATOM 105 N1 DT A 4 19.198 18.431 27.126 1.00 0.00 N ATOM 106 C2 DT A 4 19.234 18.183 28.506 1.00 0.00 C ATOM 107 O2 DT A 4 18.230 18.138 29.221 1.00 0.00 O ATOM 108 N3 DT A 4 20.472 18.000 29.068 1.00 0.00 N ATOM 109 C4 DT A 4 21.681 18.114 28.423 1.00 0.00 C ATOM 110 O4 DT A 4 22.704 17.900 29.075 1.00 0.00 O ATOM 111 C5 DT A 4 21.586 18.476 27.006 1.00 0.00 C ATOM 112 C7 DT A 4 22.848 18.692 26.192 1.00 0.00 C ATOM 113 C6 DT A 4 20.366 18.627 26.413 1.00 0.00 C ATOM 0 H5' DT A 4 17.472 18.163 22.439 1.00 0.00 H new ATOM 0 H5'' DT A 4 17.318 19.904 22.313 1.00 0.00 H new ATOM 0 H4' DT A 4 16.199 19.078 24.200 1.00 0.00 H new ATOM 0 H3' DT A 4 18.583 20.867 24.967 1.00 0.00 H new ATOM 0 H2' DT A 4 17.822 20.558 27.270 1.00 0.00 H new ATOM 0 H2'' DT A 4 16.249 19.977 26.761 1.00 0.00 H new ATOM 0 H1' DT A 4 17.224 17.848 27.083 1.00 0.00 H new ATOM 0 H3 DT A 4 20.498 17.756 30.058 1.00 0.00 H new ATOM 0 H71 DT A 4 23.642 19.061 26.842 1.00 0.00 H new ATOM 0 H72 DT A 4 23.157 17.748 25.742 1.00 0.00 H new ATOM 0 H73 DT A 4 22.654 19.422 25.406 1.00 0.00 H new ATOM 0 H6 DT A 4 20.312 18.904 25.370 1.00 0.00 H new ATOM 126 P DG A 5 15.291 21.921 24.978 1.00 0.00 P ATOM 127 OP1 DG A 5 14.513 20.671 24.783 1.00 0.00 O ATOM 128 OP2 DG A 5 14.921 23.117 24.185 1.00 0.00 O ATOM 129 O5' DG A 5 15.174 22.328 26.536 1.00 0.00 O ATOM 130 C5' DG A 5 14.141 21.771 27.337 1.00 0.00 C ATOM 131 C4' DG A 5 13.892 22.390 28.717 1.00 0.00 C ATOM 132 O4' DG A 5 14.976 22.159 29.602 1.00 0.00 O ATOM 133 C3' DG A 5 13.636 23.898 28.696 1.00 0.00 C ATOM 134 O3' DG A 5 12.699 24.194 29.728 1.00 0.00 O ATOM 135 C2' DG A 5 15.052 24.435 28.910 1.00 0.00 C ATOM 136 C1' DG A 5 15.705 23.362 29.790 1.00 0.00 C ATOM 137 N9 DG A 5 17.126 23.049 29.491 1.00 0.00 N ATOM 138 C8 DG A 5 17.798 23.008 28.291 1.00 0.00 C ATOM 139 N7 DG A 5 18.990 22.470 28.357 1.00 0.00 N ATOM 140 C5 DG A 5 19.129 22.144 29.713 1.00 0.00 C ATOM 141 C6 DG A 5 20.189 21.500 30.449 1.00 0.00 C ATOM 142 O6 DG A 5 21.241 21.000 30.047 1.00 0.00 O ATOM 143 N1 DG A 5 19.972 21.472 31.812 1.00 0.00 N ATOM 144 C2 DG A 5 18.874 21.993 32.403 1.00 0.00 C ATOM 145 N2 DG A 5 18.898 22.103 33.696 1.00 0.00 N ATOM 146 N3 DG A 5 17.829 22.503 31.767 1.00 0.00 N ATOM 147 C4 DG A 5 18.018 22.558 30.415 1.00 0.00 C ATOM 0 H5' DG A 5 14.362 20.713 27.480 1.00 0.00 H new ATOM 0 H5'' DG A 5 13.211 21.829 26.772 1.00 0.00 H new ATOM 0 H4' DG A 5 12.987 21.891 29.063 1.00 0.00 H new ATOM 0 H3' DG A 5 13.192 24.333 27.801 1.00 0.00 H new ATOM 0 H2' DG A 5 15.582 24.559 27.966 1.00 0.00 H new ATOM 0 H2'' DG A 5 15.044 25.408 29.401 1.00 0.00 H new ATOM 0 H1' DG A 5 15.686 23.763 30.804 1.00 0.00 H new ATOM 0 H8 DG A 5 17.377 23.388 27.372 1.00 0.00 H new ATOM 0 H1 DG A 5 20.678 21.035 32.405 1.00 0.00 H new ATOM 0 H21 DG A 5 18.094 22.490 34.190 1.00 0.00 H new ATOM 0 H22 DG A 5 19.721 21.802 34.218 1.00 0.00 H new ATOM 159 P DT A 6 12.091 25.665 29.977 1.00 0.00 P ATOM 160 OP1 DT A 6 10.671 25.511 30.386 1.00 0.00 O ATOM 161 OP2 DT A 6 12.412 26.535 28.819 1.00 0.00 O ATOM 162 O5' DT A 6 12.944 26.166 31.245 1.00 0.00 O ATOM 163 C5' DT A 6 12.675 25.660 32.549 1.00 0.00 C ATOM 164 C4' DT A 6 13.810 25.956 33.532 1.00 0.00 C ATOM 165 O4' DT A 6 15.000 25.313 33.101 1.00 0.00 O ATOM 166 C3' DT A 6 14.172 27.439 33.657 1.00 0.00 C ATOM 167 O3' DT A 6 13.345 28.146 34.576 1.00 0.00 O ATOM 168 C2' DT A 6 15.587 27.314 34.197 1.00 0.00 C ATOM 169 C1' DT A 6 16.095 25.973 33.708 1.00 0.00 C ATOM 170 N1 DT A 6 17.249 26.011 32.786 1.00 0.00 N ATOM 171 C2 DT A 6 18.456 25.457 33.238 1.00 0.00 C ATOM 172 O2 DT A 6 18.679 25.153 34.410 1.00 0.00 O ATOM 173 N3 DT A 6 19.426 25.246 32.293 1.00 0.00 N ATOM 174 C4 DT A 6 19.284 25.490 30.946 1.00 0.00 C ATOM 175 O4 DT A 6 20.159 25.078 30.195 1.00 0.00 O ATOM 176 C5 DT A 6 18.073 26.227 30.569 1.00 0.00 C ATOM 177 C7 DT A 6 17.883 26.730 29.149 1.00 0.00 C ATOM 178 C6 DT A 6 17.105 26.461 31.492 1.00 0.00 C ATOM 0 H5' DT A 6 12.517 24.583 32.493 1.00 0.00 H new ATOM 0 H5'' DT A 6 11.750 26.099 32.923 1.00 0.00 H new ATOM 0 H4' DT A 6 13.440 25.598 34.493 1.00 0.00 H new ATOM 0 H3' DT A 6 14.057 27.999 32.729 1.00 0.00 H new ATOM 0 H2' DT A 6 16.217 28.127 33.836 1.00 0.00 H new ATOM 0 H2'' DT A 6 15.596 27.363 35.286 1.00 0.00 H new ATOM 0 H1' DT A 6 16.485 25.444 34.577 1.00 0.00 H new ATOM 0 H3 DT A 6 20.323 24.880 32.613 1.00 0.00 H new ATOM 0 H71 DT A 6 16.820 26.754 28.911 1.00 0.00 H new ATOM 0 H72 DT A 6 18.297 27.734 29.060 1.00 0.00 H new ATOM 0 H73 DT A 6 18.396 26.064 28.455 1.00 0.00 H new ATOM 0 H6 DT A 6 16.215 27.004 31.209 1.00 0.00 H new ATOM 191 P DA A 7 13.482 29.744 34.794 1.00 0.00 P ATOM 192 OP1 DA A 7 12.364 30.178 35.668 1.00 0.00 O ATOM 193 OP2 DA A 7 13.637 30.387 33.466 1.00 0.00 O ATOM 194 O5' DA A 7 14.866 29.947 35.605 1.00 0.00 O ATOM 195 C5' DA A 7 15.037 29.439 36.925 1.00 0.00 C ATOM 196 C4' DA A 7 16.505 29.459 37.394 1.00 0.00 C ATOM 197 O4' DA A 7 17.344 28.777 36.458 1.00 0.00 O ATOM 198 C3' DA A 7 17.069 30.877 37.578 1.00 0.00 C ATOM 199 O3' DA A 7 17.763 30.964 38.818 1.00 0.00 O ATOM 200 C2' DA A 7 17.967 31.023 36.354 1.00 0.00 C ATOM 201 C1' DA A 7 18.449 29.594 36.106 1.00 0.00 C ATOM 202 N9 DA A 7 18.809 29.370 34.684 1.00 0.00 N ATOM 203 C8 DA A 7 18.089 29.737 33.568 1.00 0.00 C ATOM 204 N7 DA A 7 18.616 29.368 32.433 1.00 0.00 N ATOM 205 C5 DA A 7 19.809 28.752 32.836 1.00 0.00 C ATOM 206 C6 DA A 7 20.889 28.155 32.146 1.00 0.00 C ATOM 207 N6 DA A 7 20.951 28.044 30.836 1.00 0.00 N ATOM 208 N1 DA A 7 21.927 27.629 32.792 1.00 0.00 N ATOM 209 C2 DA A 7 21.918 27.698 34.115 1.00 0.00 C ATOM 210 N3 DA A 7 20.985 28.219 34.912 1.00 0.00 N ATOM 211 C4 DA A 7 19.940 28.740 34.201 1.00 0.00 C ATOM 0 H5' DA A 7 14.663 28.416 36.966 1.00 0.00 H new ATOM 0 H5'' DA A 7 14.433 30.027 37.616 1.00 0.00 H new ATOM 0 H4' DA A 7 16.504 28.959 38.363 1.00 0.00 H new ATOM 0 H3' DA A 7 16.329 31.676 37.631 1.00 0.00 H new ATOM 0 H2' DA A 7 17.420 31.418 35.498 1.00 0.00 H new ATOM 0 H2'' DA A 7 18.799 31.702 36.543 1.00 0.00 H new ATOM 0 H1' DA A 7 19.347 29.375 36.684 1.00 0.00 H new ATOM 0 H8 DA A 7 17.161 30.287 33.628 1.00 0.00 H new ATOM 0 H61 DA A 7 21.760 27.602 30.399 1.00 0.00 H new ATOM 0 H62 DA A 7 20.190 28.400 30.257 1.00 0.00 H new ATOM 0 H2 DA A 7 22.779 27.277 34.613 1.00 0.00 H new ATOM 223 P DC A 8 18.418 32.339 39.359 1.00 0.00 P ATOM 224 OP1 DC A 8 18.372 32.314 40.844 1.00 0.00 O ATOM 225 OP2 DC A 8 17.806 33.488 38.646 1.00 0.00 O ATOM 226 O5' DC A 8 19.952 32.216 38.894 1.00 0.00 O ATOM 227 C5' DC A 8 20.776 31.187 39.424 1.00 0.00 C ATOM 228 C4' DC A 8 22.147 31.092 38.749 1.00 0.00 C ATOM 229 O4' DC A 8 21.977 30.811 37.362 1.00 0.00 O ATOM 230 C3' DC A 8 22.987 32.366 38.894 1.00 0.00 C ATOM 231 O3' DC A 8 24.268 32.052 39.438 1.00 0.00 O ATOM 232 C2' DC A 8 23.035 32.866 37.451 1.00 0.00 C ATOM 233 C1' DC A 8 22.889 31.590 36.615 1.00 0.00 C ATOM 234 N1 DC A 8 22.335 31.748 35.232 1.00 0.00 N ATOM 235 C2 DC A 8 22.965 31.106 34.151 1.00 0.00 C ATOM 236 O2 DC A 8 24.055 30.545 34.262 1.00 0.00 O ATOM 237 N3 DC A 8 22.395 31.082 32.917 1.00 0.00 N ATOM 238 C4 DC A 8 21.232 31.676 32.755 1.00 0.00 C ATOM 239 N4 DC A 8 20.721 31.611 31.560 1.00 0.00 N ATOM 240 C5 DC A 8 20.551 32.360 33.799 1.00 0.00 C ATOM 241 C6 DC A 8 21.133 32.380 35.025 1.00 0.00 C ATOM 0 H5' DC A 8 20.262 30.231 39.320 1.00 0.00 H new ATOM 0 H5'' DC A 8 20.917 31.359 40.491 1.00 0.00 H new ATOM 0 H4' DC A 8 22.685 30.290 39.254 1.00 0.00 H new ATOM 0 H3' DC A 8 22.591 33.118 39.577 1.00 0.00 H new ATOM 0 H2' DC A 8 22.231 33.572 37.246 1.00 0.00 H new ATOM 0 H2'' DC A 8 23.972 33.379 37.237 1.00 0.00 H new ATOM 0 H1' DC A 8 23.882 31.172 36.452 1.00 0.00 H new ATOM 0 H41 DC A 8 19.821 32.050 31.365 1.00 0.00 H new ATOM 0 H42 DC A 8 21.220 31.121 30.818 1.00 0.00 H new ATOM 0 H5 DC A 8 19.603 32.847 33.623 1.00 0.00 H new ATOM 0 H6 DC A 8 20.649 32.895 35.842 1.00 0.00 H new ATOM 253 P DA A 9 25.243 33.176 40.078 1.00 0.00 P ATOM 254 OP1 DA A 9 26.167 32.499 41.024 1.00 0.00 O ATOM 255 OP2 DA A 9 24.424 34.309 40.577 1.00 0.00 O ATOM 256 O5' DA A 9 26.099 33.696 38.817 1.00 0.00 O ATOM 257 C5' DA A 9 27.086 32.857 38.234 1.00 0.00 C ATOM 258 C4' DA A 9 27.393 33.193 36.770 1.00 0.00 C ATOM 259 O4' DA A 9 26.210 33.092 35.972 1.00 0.00 O ATOM 260 C3' DA A 9 27.992 34.589 36.538 1.00 0.00 C ATOM 261 O3' DA A 9 29.123 34.460 35.681 1.00 0.00 O ATOM 262 C2' DA A 9 26.804 35.307 35.903 1.00 0.00 C ATOM 263 C1' DA A 9 26.190 34.184 35.073 1.00 0.00 C ATOM 264 N9 DA A 9 24.807 34.482 34.625 1.00 0.00 N ATOM 265 C8 DA A 9 23.808 35.118 35.323 1.00 0.00 C ATOM 266 N7 DA A 9 22.693 35.274 34.661 1.00 0.00 N ATOM 267 C5 DA A 9 23.006 34.744 33.402 1.00 0.00 C ATOM 268 C6 DA A 9 22.317 34.644 32.171 1.00 0.00 C ATOM 269 N6 DA A 9 21.093 35.083 31.943 1.00 0.00 N ATOM 270 N1 DA A 9 22.879 34.069 31.112 1.00 0.00 N ATOM 271 C2 DA A 9 24.099 33.571 31.253 1.00 0.00 C ATOM 272 N3 DA A 9 24.875 33.589 32.331 1.00 0.00 N ATOM 273 C4 DA A 9 24.272 34.219 33.381 1.00 0.00 C ATOM 0 H5' DA A 9 26.753 31.821 38.298 1.00 0.00 H new ATOM 0 H5'' DA A 9 28.005 32.933 38.816 1.00 0.00 H new ATOM 0 H4' DA A 9 28.147 32.461 36.479 1.00 0.00 H new ATOM 0 H3' DA A 9 28.369 35.122 37.411 1.00 0.00 H new ATOM 0 H2' DA A 9 26.110 35.694 36.649 1.00 0.00 H new ATOM 0 H2'' DA A 9 27.114 36.152 35.288 1.00 0.00 H new ATOM 0 H1' DA A 9 26.735 34.010 34.145 1.00 0.00 H new ATOM 0 H8 DA A 9 23.935 35.462 36.339 1.00 0.00 H new ATOM 0 H61 DA A 9 20.673 34.968 31.020 1.00 0.00 H new ATOM 0 H62 DA A 9 20.567 35.537 32.689 1.00 0.00 H new ATOM 0 H2 DA A 9 24.515 33.089 30.381 1.00 0.00 H new ATOM 285 P DT A 10 29.991 35.721 35.184 1.00 0.00 P ATOM 286 OP1 DT A 10 31.327 35.222 34.769 1.00 0.00 O ATOM 287 OP2 DT A 10 29.914 36.792 36.209 1.00 0.00 O ATOM 288 O5' DT A 10 29.178 36.193 33.875 1.00 0.00 O ATOM 289 C5' DT A 10 29.141 35.370 32.720 1.00 0.00 C ATOM 290 C4' DT A 10 28.428 35.985 31.510 1.00 0.00 C ATOM 291 O4' DT A 10 27.020 35.819 31.519 1.00 0.00 O ATOM 292 C3' DT A 10 28.585 37.496 31.373 1.00 0.00 C ATOM 293 O3' DT A 10 29.918 37.895 31.080 1.00 0.00 O ATOM 294 C2' DT A 10 27.607 37.717 30.225 1.00 0.00 C ATOM 295 C1' DT A 10 26.505 36.685 30.512 1.00 0.00 C ATOM 296 N1 DT A 10 25.208 37.298 30.917 1.00 0.00 N ATOM 297 C2 DT A 10 24.311 37.615 29.893 1.00 0.00 C ATOM 298 O2 DT A 10 24.617 37.624 28.703 1.00 0.00 O ATOM 299 N3 DT A 10 23.031 37.943 30.270 1.00 0.00 N ATOM 300 C4 DT A 10 22.591 38.098 31.561 1.00 0.00 C ATOM 301 O4 DT A 10 21.394 38.320 31.753 1.00 0.00 O ATOM 302 C5 DT A 10 23.639 37.982 32.576 1.00 0.00 C ATOM 303 C7 DT A 10 23.325 38.318 34.024 1.00 0.00 C ATOM 304 C6 DT A 10 24.890 37.561 32.236 1.00 0.00 C ATOM 0 H5' DT A 10 28.648 34.432 32.976 1.00 0.00 H new ATOM 0 H5'' DT A 10 30.164 35.124 32.434 1.00 0.00 H new ATOM 0 H4' DT A 10 28.916 35.443 30.700 1.00 0.00 H new ATOM 0 H3' DT A 10 28.386 38.080 32.272 1.00 0.00 H new ATOM 0 H2' DT A 10 27.216 38.734 30.217 1.00 0.00 H new ATOM 0 H2'' DT A 10 28.076 37.548 29.256 1.00 0.00 H new ATOM 0 H1' DT A 10 26.265 36.138 29.600 1.00 0.00 H new ATOM 0 H3 DT A 10 22.348 38.084 29.525 1.00 0.00 H new ATOM 0 H71 DT A 10 23.953 37.717 34.681 1.00 0.00 H new ATOM 0 H72 DT A 10 23.521 39.375 34.203 1.00 0.00 H new ATOM 0 H73 DT A 10 22.276 38.103 34.228 1.00 0.00 H new ATOM 0 H6 DT A 10 25.639 37.432 33.004 1.00 0.00 H new ATOM 317 P DC A 11 30.527 39.285 31.637 1.00 0.00 P ATOM 318 OP1 DC A 11 32.002 39.241 31.471 1.00 0.00 O ATOM 319 OP2 DC A 11 29.967 39.581 32.977 1.00 0.00 O ATOM 320 O5' DC A 11 29.934 40.377 30.618 1.00 0.00 O ATOM 321 C5' DC A 11 30.397 40.461 29.277 1.00 0.00 C ATOM 322 C4' DC A 11 29.492 41.337 28.398 1.00 0.00 C ATOM 323 O4' DC A 11 28.164 40.810 28.444 1.00 0.00 O ATOM 324 C3' DC A 11 29.422 42.808 28.850 1.00 0.00 C ATOM 325 O3' DC A 11 29.260 43.690 27.753 1.00 0.00 O ATOM 326 C2' DC A 11 28.132 42.829 29.646 1.00 0.00 C ATOM 327 C1' DC A 11 27.285 41.856 28.815 1.00 0.00 C ATOM 328 N1 DC A 11 26.089 41.361 29.550 1.00 0.00 N ATOM 329 C2 DC A 11 24.851 41.382 28.898 1.00 0.00 C ATOM 330 O2 DC A 11 24.739 41.450 27.671 1.00 0.00 O ATOM 331 N3 DC A 11 23.705 41.330 29.610 1.00 0.00 N ATOM 332 C4 DC A 11 23.780 41.204 30.916 1.00 0.00 C ATOM 333 N4 DC A 11 22.646 41.216 31.547 1.00 0.00 N ATOM 334 C5 DC A 11 24.998 40.980 31.612 1.00 0.00 C ATOM 335 C6 DC A 11 26.142 41.054 30.891 1.00 0.00 C ATOM 0 H5' DC A 11 30.452 39.459 28.851 1.00 0.00 H new ATOM 0 H5'' DC A 11 31.409 40.867 29.270 1.00 0.00 H new ATOM 0 H4' DC A 11 29.922 41.319 27.396 1.00 0.00 H new ATOM 0 H3' DC A 11 30.322 43.120 29.381 1.00 0.00 H new ATOM 0 H2' DC A 11 28.271 42.488 30.672 1.00 0.00 H new ATOM 0 H2'' DC A 11 27.691 43.825 29.698 1.00 0.00 H new ATOM 0 H1' DC A 11 26.867 42.351 27.939 1.00 0.00 H new ATOM 0 H41 DC A 11 22.626 41.123 32.563 1.00 0.00 H new ATOM 0 H42 DC A 11 21.774 41.319 31.027 1.00 0.00 H new ATOM 0 H5 DC A 11 25.011 40.760 32.669 1.00 0.00 H new ATOM 0 H6 DC A 11 27.094 40.872 31.367 1.00 0.00 H new ATOM 347 P DG A 12 30.334 44.833 27.424 1.00 0.00 P ATOM 348 OP1 DG A 12 31.666 44.205 27.254 1.00 0.00 O ATOM 349 OP2 DG A 12 30.164 45.932 28.406 1.00 0.00 O ATOM 350 O5' DG A 12 29.812 45.347 25.992 1.00 0.00 O ATOM 351 C5' DG A 12 29.738 44.467 24.873 1.00 0.00 C ATOM 352 C4' DG A 12 28.348 44.466 24.210 1.00 0.00 C ATOM 353 O4' DG A 12 27.364 43.943 25.106 1.00 0.00 O ATOM 354 C3' DG A 12 27.874 45.868 23.777 1.00 0.00 C ATOM 355 O3' DG A 12 27.206 45.825 22.517 1.00 0.00 O ATOM 356 C2' DG A 12 26.888 46.220 24.886 1.00 0.00 C ATOM 357 C1' DG A 12 26.271 44.849 25.158 1.00 0.00 C ATOM 358 N9 DG A 12 25.560 44.779 26.458 1.00 0.00 N ATOM 359 C8 DG A 12 26.022 45.102 27.711 1.00 0.00 C ATOM 360 N7 DG A 12 25.127 44.987 28.661 1.00 0.00 N ATOM 361 C5 DG A 12 23.974 44.560 27.980 1.00 0.00 C ATOM 362 C6 DG A 12 22.635 44.270 28.437 1.00 0.00 C ATOM 363 O6 DG A 12 22.157 44.341 29.574 1.00 0.00 O ATOM 364 N1 DG A 12 21.781 43.878 27.426 1.00 0.00 N ATOM 365 C2 DG A 12 22.151 43.775 26.127 1.00 0.00 C ATOM 366 N2 DG A 12 21.233 43.422 25.268 1.00 0.00 N ATOM 367 N3 DG A 12 23.362 44.046 25.651 1.00 0.00 N ATOM 368 C4 DG A 12 24.239 44.429 26.631 1.00 0.00 C ATOM 0 H5' DG A 12 29.983 43.455 25.195 1.00 0.00 H new ATOM 0 H5'' DG A 12 30.487 44.758 24.137 1.00 0.00 H new ATOM 0 H4' DG A 12 28.454 43.843 23.322 1.00 0.00 H new ATOM 0 H3' DG A 12 28.688 46.582 23.651 1.00 0.00 H new ATOM 0 H2' DG A 12 27.383 46.633 25.765 1.00 0.00 H new ATOM 0 H2'' DG A 12 26.147 46.952 24.564 1.00 0.00 H new ATOM 0 HO3' DG A 12 26.916 46.728 22.270 1.00 0.00 H new ATOM 0 H1' DG A 12 25.501 44.613 24.424 1.00 0.00 H new ATOM 0 H8 DG A 12 27.036 45.423 27.897 1.00 0.00 H new ATOM 0 H1 DG A 12 20.817 43.653 27.671 1.00 0.00 H new ATOM 0 H21 DG A 12 21.467 43.332 24.279 1.00 0.00 H new ATOM 0 H22 DG A 12 20.282 43.236 25.586 1.00 0.00 H new TER 381 DG A 12 HETATM 382 N1 DCZ B 13 16.728 43.386 27.570 1.00 0.00 N HETATM 383 C2 DCZ B 13 18.110 43.396 27.332 1.00 0.00 C HETATM 384 N3 DCZ B 13 18.994 43.507 28.350 1.00 0.00 N HETATM 385 C4 DCZ B 13 18.525 43.539 29.580 1.00 0.00 C HETATM 386 C5 DCZ B 13 17.141 43.450 29.897 1.00 0.00 C HETATM 387 C6 DCZ B 13 16.263 43.372 28.863 1.00 0.00 C HETATM 388 O2 DCZ B 13 18.578 43.324 26.196 1.00 0.00 O HETATM 389 N4 DCZ B 13 19.416 43.733 30.510 1.00 0.00 N HETATM 390 C1' DCZ B 13 15.811 43.502 26.401 1.00 0.00 C HETATM 391 C2' DCZ B 13 15.424 42.160 25.794 1.00 0.00 C HETATM 392 C3' DCZ B 13 14.331 42.636 24.835 1.00 0.00 C HETATM 393 C4' DCZ B 13 13.616 43.683 25.705 1.00 0.00 C HETATM 394 O4' DCZ B 13 14.555 44.099 26.702 1.00 0.00 O HETATM 395 O3' DCZ B 13 14.910 43.243 23.681 1.00 0.00 O HETATM 396 C5' DCZ B 13 12.352 43.088 26.351 1.00 0.00 C HETATM 397 O5' DCZ B 13 11.726 44.002 27.246 1.00 0.00 O HETATM 0 HO51 DCZ B 13 10.927 43.586 27.633 1.00 0.00 H new HETATM 0 HN42 DCZ B 13 19.132 43.771 31.489 1.00 0.00 H new HETATM 0 HN41 DCZ B 13 20.398 43.847 30.259 1.00 0.00 H new HETATM 0 H5'2 DCZ B 13 11.646 42.805 25.571 1.00 0.00 H new HETATM 0 H5'1 DCZ B 13 12.615 42.177 26.889 1.00 0.00 H new HETATM 0 H2'2 DCZ B 13 16.254 41.676 25.279 1.00 0.00 H new HETATM 0 H2'1 DCZ B 13 15.054 41.453 26.537 1.00 0.00 H new HETATM 0 H6 DCZ B 13 15.193 43.299 29.059 1.00 0.00 H new HETATM 0 H5 DCZ B 13 16.798 43.445 30.931 1.00 0.00 H new HETATM 0 H4' DCZ B 13 13.289 44.531 25.104 1.00 0.00 H new HETATM 0 H3' DCZ B 13 13.681 41.848 24.455 1.00 0.00 H new HETATM 0 H1' DCZ B 13 16.404 44.115 25.722 1.00 0.00 H new ATOM 410 P DG B 14 15.010 42.451 22.284 1.00 0.00 P ATOM 411 OP1 DG B 14 15.818 43.279 21.354 1.00 0.00 O ATOM 412 OP2 DG B 14 13.646 42.027 21.881 1.00 0.00 O ATOM 413 O5' DG B 14 15.850 41.152 22.712 1.00 0.00 O ATOM 414 C5' DG B 14 16.687 40.445 21.810 1.00 0.00 C ATOM 415 C4' DG B 14 17.298 39.215 22.498 1.00 0.00 C ATOM 416 O4' DG B 14 18.097 39.620 23.613 1.00 0.00 O ATOM 417 C3' DG B 14 16.220 38.248 23.032 1.00 0.00 C ATOM 418 O3' DG B 14 16.478 36.899 22.682 1.00 0.00 O ATOM 419 C2' DG B 14 16.375 38.415 24.534 1.00 0.00 C ATOM 420 C1' DG B 14 17.876 38.690 24.659 1.00 0.00 C ATOM 421 N9 DG B 14 18.246 39.202 26.008 1.00 0.00 N ATOM 422 C8 DG B 14 17.426 39.372 27.102 1.00 0.00 C ATOM 423 N7 DG B 14 18.024 39.840 28.163 1.00 0.00 N ATOM 424 C5 DG B 14 19.353 39.983 27.749 1.00 0.00 C ATOM 425 C6 DG B 14 20.510 40.440 28.466 1.00 0.00 C ATOM 426 O6 DG B 14 20.596 40.815 29.633 1.00 0.00 O ATOM 427 N1 DG B 14 21.661 40.445 27.708 1.00 0.00 N ATOM 428 C2 DG B 14 21.715 40.047 26.416 1.00 0.00 C ATOM 429 N2 DG B 14 22.879 40.142 25.831 1.00 0.00 N ATOM 430 N3 DG B 14 20.675 39.591 25.715 1.00 0.00 N ATOM 431 C4 DG B 14 19.504 39.590 26.434 1.00 0.00 C ATOM 0 H5' DG B 14 17.481 41.100 21.451 1.00 0.00 H new ATOM 0 H5'' DG B 14 16.112 40.134 20.938 1.00 0.00 H new ATOM 0 H4' DG B 14 17.897 38.705 21.743 1.00 0.00 H new ATOM 0 H3' DG B 14 15.229 38.465 22.633 1.00 0.00 H new ATOM 0 H2' DG B 14 15.774 39.239 24.919 1.00 0.00 H new ATOM 0 H2'' DG B 14 16.075 37.520 25.079 1.00 0.00 H new ATOM 0 H1' DG B 14 18.500 37.801 24.566 1.00 0.00 H new ATOM 0 H8 DG B 14 16.372 39.137 27.083 1.00 0.00 H new ATOM 0 H1 DG B 14 22.523 40.768 28.147 1.00 0.00 H new ATOM 0 H21 DG B 14 22.985 39.858 24.857 1.00 0.00 H new ATOM 0 H22 DG B 14 23.682 40.500 26.348 1.00 0.00 H new ATOM 443 P DA B 15 15.881 36.260 21.333 1.00 0.00 P ATOM 444 OP1 DA B 15 15.882 37.292 20.267 1.00 0.00 O ATOM 445 OP2 DA B 15 14.601 35.592 21.680 1.00 0.00 O ATOM 446 O5' DA B 15 16.942 35.113 20.928 1.00 0.00 O ATOM 447 C5' DA B 15 18.276 35.425 20.526 1.00 0.00 C ATOM 448 C4' DA B 15 19.325 35.114 21.606 1.00 0.00 C ATOM 449 O4' DA B 15 19.130 35.866 22.794 1.00 0.00 O ATOM 450 C3' DA B 15 19.319 33.643 22.041 1.00 0.00 C ATOM 451 O3' DA B 15 20.148 32.861 21.185 1.00 0.00 O ATOM 452 C2' DA B 15 19.820 33.724 23.484 1.00 0.00 C ATOM 453 C1' DA B 15 19.847 35.210 23.818 1.00 0.00 C ATOM 454 N9 DA B 15 19.280 35.486 25.156 1.00 0.00 N ATOM 455 C8 DA B 15 17.982 35.394 25.603 1.00 0.00 C ATOM 456 N7 DA B 15 17.822 35.751 26.856 1.00 0.00 N ATOM 457 C5 DA B 15 19.129 36.076 27.263 1.00 0.00 C ATOM 458 C6 DA B 15 19.743 36.542 28.457 1.00 0.00 C ATOM 459 N6 DA B 15 19.139 36.804 29.601 1.00 0.00 N ATOM 460 N1 DA B 15 21.053 36.779 28.509 1.00 0.00 N ATOM 461 C2 DA B 15 21.776 36.540 27.424 1.00 0.00 C ATOM 462 N3 DA B 15 21.360 36.098 26.250 1.00 0.00 N ATOM 463 C4 DA B 15 20.015 35.899 26.235 1.00 0.00 C ATOM 0 H5' DA B 15 18.332 36.483 20.268 1.00 0.00 H new ATOM 0 H5'' DA B 15 18.517 34.864 19.623 1.00 0.00 H new ATOM 0 H4' DA B 15 20.269 35.374 21.127 1.00 0.00 H new ATOM 0 H3' DA B 15 18.349 33.151 21.978 1.00 0.00 H new ATOM 0 H2' DA B 15 19.160 33.181 24.160 1.00 0.00 H new ATOM 0 H2'' DA B 15 20.811 33.281 23.582 1.00 0.00 H new ATOM 0 H1' DA B 15 20.873 35.576 23.863 1.00 0.00 H new ATOM 0 H8 DA B 15 17.167 35.058 24.979 1.00 0.00 H new ATOM 0 H61 DA B 15 19.680 37.136 30.399 1.00 0.00 H new ATOM 0 H62 DA B 15 18.131 36.675 29.687 1.00 0.00 H new ATOM 0 H2 DA B 15 22.836 36.730 27.510 1.00 0.00 H new ATOM 475 P DT B 16 20.426 31.287 21.428 1.00 0.00 P ATOM 476 OP1 DT B 16 20.859 30.701 20.134 1.00 0.00 O ATOM 477 OP2 DT B 16 19.260 30.695 22.129 1.00 0.00 O ATOM 478 O5' DT B 16 21.684 31.289 22.438 1.00 0.00 O ATOM 479 C5' DT B 16 22.944 31.816 22.030 1.00 0.00 C ATOM 480 C4' DT B 16 23.893 32.094 23.206 1.00 0.00 C ATOM 481 O4' DT B 16 23.303 32.997 24.130 1.00 0.00 O ATOM 482 C3' DT B 16 24.291 30.844 23.995 1.00 0.00 C ATOM 483 O3' DT B 16 25.395 30.220 23.346 1.00 0.00 O ATOM 484 C2' DT B 16 24.690 31.484 25.325 1.00 0.00 C ATOM 485 C1' DT B 16 23.826 32.749 25.425 1.00 0.00 C ATOM 486 N1 DT B 16 22.709 32.679 26.417 1.00 0.00 N ATOM 487 C2 DT B 16 22.896 33.340 27.637 1.00 0.00 C ATOM 488 O2 DT B 16 23.965 33.839 27.986 1.00 0.00 O ATOM 489 N3 DT B 16 21.810 33.437 28.472 1.00 0.00 N ATOM 490 C4 DT B 16 20.550 32.951 28.214 1.00 0.00 C ATOM 491 O4 DT B 16 19.658 33.175 29.033 1.00 0.00 O ATOM 492 C5 DT B 16 20.425 32.217 26.952 1.00 0.00 C ATOM 493 C7 DT B 16 19.087 31.605 26.568 1.00 0.00 C ATOM 494 C6 DT B 16 21.493 32.092 26.112 1.00 0.00 C ATOM 0 H5' DT B 16 22.782 32.741 21.476 1.00 0.00 H new ATOM 0 H5'' DT B 16 23.420 31.114 21.346 1.00 0.00 H new ATOM 0 H4' DT B 16 24.787 32.512 22.743 1.00 0.00 H new ATOM 0 H3' DT B 16 23.534 30.066 24.094 1.00 0.00 H new ATOM 0 H2' DT B 16 24.503 30.810 26.161 1.00 0.00 H new ATOM 0 H2'' DT B 16 25.752 31.728 25.344 1.00 0.00 H new ATOM 0 H1' DT B 16 24.465 33.554 25.789 1.00 0.00 H new ATOM 0 H3 DT B 16 21.951 33.912 29.363 1.00 0.00 H new ATOM 0 H71 DT B 16 18.539 31.333 27.470 1.00 0.00 H new ATOM 0 H72 DT B 16 18.507 32.329 25.996 1.00 0.00 H new ATOM 0 H73 DT B 16 19.255 30.714 25.963 1.00 0.00 H new ATOM 0 H6 DT B 16 21.388 31.528 25.197 1.00 0.00 H new ATOM 507 P DG B 17 25.493 28.634 23.061 1.00 0.00 P ATOM 508 OP1 DG B 17 26.343 28.442 21.861 1.00 0.00 O ATOM 509 OP2 DG B 17 24.132 28.046 23.063 1.00 0.00 O ATOM 510 O5' DG B 17 26.280 28.040 24.332 1.00 0.00 O ATOM 511 C5' DG B 17 27.645 28.344 24.569 1.00 0.00 C ATOM 512 C4' DG B 17 28.265 27.594 25.762 1.00 0.00 C ATOM 513 O4' DG B 17 27.713 27.989 27.012 1.00 0.00 O ATOM 514 C3' DG B 17 28.144 26.069 25.722 1.00 0.00 C ATOM 515 O3' DG B 17 29.369 25.558 26.247 1.00 0.00 O ATOM 516 C2' DG B 17 26.854 25.852 26.531 1.00 0.00 C ATOM 517 C1' DG B 17 26.736 27.065 27.466 1.00 0.00 C ATOM 518 N9 DG B 17 25.391 27.731 27.545 1.00 0.00 N ATOM 519 C8 DG B 17 24.369 27.811 26.621 1.00 0.00 C ATOM 520 N7 DG B 17 23.350 28.548 26.988 1.00 0.00 N ATOM 521 C5 DG B 17 23.691 28.967 28.280 1.00 0.00 C ATOM 522 C6 DG B 17 22.997 29.781 29.253 1.00 0.00 C ATOM 523 O6 DG B 17 21.922 30.373 29.164 1.00 0.00 O ATOM 524 N1 DG B 17 23.650 29.882 30.464 1.00 0.00 N ATOM 525 C2 DG B 17 24.832 29.287 30.719 1.00 0.00 C ATOM 526 N2 DG B 17 25.330 29.427 31.910 1.00 0.00 N ATOM 527 N3 DG B 17 25.537 28.588 29.837 1.00 0.00 N ATOM 528 C4 DG B 17 24.918 28.446 28.630 1.00 0.00 C ATOM 0 H5' DG B 17 27.742 29.416 24.739 1.00 0.00 H new ATOM 0 H5'' DG B 17 28.218 28.111 23.671 1.00 0.00 H new ATOM 0 H4' DG B 17 29.314 27.873 25.668 1.00 0.00 H new ATOM 0 H3' DG B 17 28.042 25.553 24.767 1.00 0.00 H new ATOM 0 H2' DG B 17 25.988 25.780 25.873 1.00 0.00 H new ATOM 0 H2'' DG B 17 26.901 24.923 27.100 1.00 0.00 H new ATOM 0 H1' DG B 17 26.887 26.711 28.486 1.00 0.00 H new ATOM 0 H8 DG B 17 24.406 27.305 25.668 1.00 0.00 H new ATOM 0 H1 DG B 17 23.216 30.435 31.204 1.00 0.00 H new ATOM 0 H21 DG B 17 26.223 28.992 32.144 1.00 0.00 H new ATOM 0 H22 DG B 17 24.828 29.972 32.612 1.00 0.00 H new ATOM 540 P DT B 18 29.624 24.042 26.730 1.00 0.00 P ATOM 541 OP1 DT B 18 31.053 23.719 26.489 1.00 0.00 O ATOM 542 OP2 DT B 18 28.583 23.150 26.164 1.00 0.00 O ATOM 543 O5' DT B 18 29.395 24.182 28.315 1.00 0.00 O ATOM 544 C5' DT B 18 30.250 25.019 29.093 1.00 0.00 C ATOM 545 C4' DT B 18 29.781 25.143 30.545 1.00 0.00 C ATOM 546 O4' DT B 18 28.486 25.716 30.563 1.00 0.00 O ATOM 547 C3' DT B 18 29.733 23.789 31.270 1.00 0.00 C ATOM 548 O3' DT B 18 30.654 23.772 32.355 1.00 0.00 O ATOM 549 C2' DT B 18 28.274 23.679 31.708 1.00 0.00 C ATOM 550 C1' DT B 18 27.705 25.089 31.559 1.00 0.00 C ATOM 551 N1 DT B 18 26.287 25.169 31.117 1.00 0.00 N ATOM 552 C2 DT B 18 25.396 25.962 31.856 1.00 0.00 C ATOM 553 O2 DT B 18 25.634 26.409 32.976 1.00 0.00 O ATOM 554 N3 DT B 18 24.177 26.227 31.281 1.00 0.00 N ATOM 555 C4 DT B 18 23.784 25.807 30.032 1.00 0.00 C ATOM 556 O4 DT B 18 22.748 26.264 29.561 1.00 0.00 O ATOM 557 C5 DT B 18 24.676 24.842 29.392 1.00 0.00 C ATOM 558 C7 DT B 18 24.259 24.143 28.109 1.00 0.00 C ATOM 559 C6 DT B 18 25.888 24.568 29.938 1.00 0.00 C ATOM 0 H5' DT B 18 30.292 26.010 28.642 1.00 0.00 H new ATOM 0 H5'' DT B 18 31.263 24.617 29.074 1.00 0.00 H new ATOM 0 H4' DT B 18 30.502 25.772 31.068 1.00 0.00 H new ATOM 0 H3' DT B 18 30.028 22.939 30.655 1.00 0.00 H new ATOM 0 H2' DT B 18 27.729 22.967 31.088 1.00 0.00 H new ATOM 0 H2'' DT B 18 28.197 23.330 32.738 1.00 0.00 H new ATOM 0 H1' DT B 18 27.735 25.552 32.545 1.00 0.00 H new ATOM 0 H3 DT B 18 23.511 26.778 31.823 1.00 0.00 H new ATOM 0 H71 DT B 18 23.174 24.038 28.088 1.00 0.00 H new ATOM 0 H72 DT B 18 24.583 24.733 27.251 1.00 0.00 H new ATOM 0 H73 DT B 18 24.720 23.156 28.066 1.00 0.00 H new ATOM 0 H6 DT B 18 26.549 23.871 29.445 1.00 0.00 H new ATOM 572 P DA B 19 31.111 22.396 33.076 1.00 0.00 P ATOM 573 OP1 DA B 19 32.423 22.635 33.727 1.00 0.00 O ATOM 574 OP2 DA B 19 30.992 21.277 32.108 1.00 0.00 O ATOM 575 O5' DA B 19 30.001 22.185 34.223 1.00 0.00 O ATOM 576 C5' DA B 19 29.969 23.046 35.354 1.00 0.00 C ATOM 577 C4' DA B 19 28.657 22.969 36.141 1.00 0.00 C ATOM 578 O4' DA B 19 27.575 23.390 35.320 1.00 0.00 O ATOM 579 C3' DA B 19 28.308 21.589 36.720 1.00 0.00 C ATOM 580 O3' DA B 19 28.158 21.709 38.132 1.00 0.00 O ATOM 581 C2' DA B 19 27.013 21.251 35.977 1.00 0.00 C ATOM 582 C1' DA B 19 26.431 22.616 35.610 1.00 0.00 C ATOM 583 N9 DA B 19 25.587 22.601 34.390 1.00 0.00 N ATOM 584 C8 DA B 19 25.907 22.049 33.172 1.00 0.00 C ATOM 585 N7 DA B 19 25.051 22.296 32.218 1.00 0.00 N ATOM 586 C5 DA B 19 24.056 23.028 32.880 1.00 0.00 C ATOM 587 C6 DA B 19 22.821 23.596 32.488 1.00 0.00 C ATOM 588 N6 DA B 19 22.326 23.528 31.271 1.00 0.00 N ATOM 589 N1 DA B 19 22.062 24.281 33.339 1.00 0.00 N ATOM 590 C2 DA B 19 22.496 24.391 34.585 1.00 0.00 C ATOM 591 N3 DA B 19 23.619 23.909 35.112 1.00 0.00 N ATOM 592 C4 DA B 19 24.371 23.227 34.198 1.00 0.00 C ATOM 0 H5' DA B 19 30.126 24.073 35.024 1.00 0.00 H new ATOM 0 H5'' DA B 19 30.797 22.794 36.017 1.00 0.00 H new ATOM 0 H4' DA B 19 28.814 23.628 36.995 1.00 0.00 H new ATOM 0 H3' DA B 19 29.054 20.805 36.587 1.00 0.00 H new ATOM 0 H2' DA B 19 27.207 20.648 35.090 1.00 0.00 H new ATOM 0 H2'' DA B 19 26.329 20.681 36.606 1.00 0.00 H new ATOM 0 H1' DA B 19 25.794 22.979 36.416 1.00 0.00 H new ATOM 0 H8 DA B 19 26.797 21.457 33.017 1.00 0.00 H new ATOM 0 H61 DA B 19 21.427 23.962 31.061 1.00 0.00 H new ATOM 0 H62 DA B 19 22.841 23.041 30.538 1.00 0.00 H new ATOM 0 H2 DA B 19 21.857 24.942 35.260 1.00 0.00 H new ATOM 604 P DC B 20 27.872 20.447 39.101 1.00 0.00 P ATOM 605 OP1 DC B 20 28.339 20.803 40.464 1.00 0.00 O ATOM 606 OP2 DC B 20 28.399 19.215 38.463 1.00 0.00 O ATOM 607 O5' DC B 20 26.264 20.365 39.118 1.00 0.00 O ATOM 608 C5' DC B 20 25.498 21.448 39.629 1.00 0.00 C ATOM 609 C4' DC B 20 24.016 21.381 39.243 1.00 0.00 C ATOM 610 O4' DC B 20 23.862 21.443 37.826 1.00 0.00 O ATOM 611 C3' DC B 20 23.291 20.117 39.736 1.00 0.00 C ATOM 612 O3' DC B 20 22.118 20.495 40.455 1.00 0.00 O ATOM 613 C2' DC B 20 22.983 19.398 38.420 1.00 0.00 C ATOM 614 C1' DC B 20 22.800 20.580 37.467 1.00 0.00 C ATOM 615 N1 DC B 20 22.879 20.268 36.007 1.00 0.00 N ATOM 616 C2 DC B 20 21.882 20.753 35.147 1.00 0.00 C ATOM 617 O2 DC B 20 20.882 21.333 35.569 1.00 0.00 O ATOM 618 N3 DC B 20 21.981 20.605 33.801 1.00 0.00 N ATOM 619 C4 DC B 20 23.050 20.006 33.317 1.00 0.00 C ATOM 620 N4 DC B 20 23.121 19.913 32.020 1.00 0.00 N ATOM 621 C5 DC B 20 24.089 19.480 34.132 1.00 0.00 C ATOM 622 C6 DC B 20 23.966 19.618 35.475 1.00 0.00 C ATOM 0 H5' DC B 20 25.919 22.385 39.264 1.00 0.00 H new ATOM 0 H5'' DC B 20 25.583 21.462 40.716 1.00 0.00 H new ATOM 0 H4' DC B 20 23.562 22.241 39.736 1.00 0.00 H new ATOM 0 H3' DC B 20 23.854 19.488 40.426 1.00 0.00 H new ATOM 0 H2' DC B 20 23.797 18.742 38.110 1.00 0.00 H new ATOM 0 H2'' DC B 20 22.086 18.783 38.488 1.00 0.00 H new ATOM 0 H1' DC B 20 21.794 20.985 37.576 1.00 0.00 H new ATOM 0 H41 DC B 20 23.924 19.460 31.584 1.00 0.00 H new ATOM 0 H42 DC B 20 22.373 20.293 31.440 1.00 0.00 H new ATOM 0 H5 DC B 20 24.946 18.988 33.697 1.00 0.00 H new ATOM 0 H6 DC B 20 24.725 19.215 36.129 1.00 0.00 H new ATOM 634 P DA B 21 21.391 19.514 41.516 1.00 0.00 P ATOM 635 OP1 DA B 21 20.594 20.357 42.443 1.00 0.00 O ATOM 636 OP2 DA B 21 22.398 18.588 42.092 1.00 0.00 O ATOM 637 O5' DA B 21 20.375 18.648 40.607 1.00 0.00 O ATOM 638 C5' DA B 21 19.167 19.230 40.136 1.00 0.00 C ATOM 639 C4' DA B 21 18.599 18.558 38.881 1.00 0.00 C ATOM 640 O4' DA B 21 19.517 18.632 37.801 1.00 0.00 O ATOM 641 C3' DA B 21 18.149 17.095 39.009 1.00 0.00 C ATOM 642 O3' DA B 21 16.723 17.059 39.029 1.00 0.00 O ATOM 643 C2' DA B 21 18.761 16.453 37.758 1.00 0.00 C ATOM 644 C1' DA B 21 19.119 17.650 36.875 1.00 0.00 C ATOM 645 N9 DA B 21 20.231 17.386 35.935 1.00 0.00 N ATOM 646 C8 DA B 21 21.477 16.875 36.209 1.00 0.00 C ATOM 647 N7 DA B 21 22.229 16.687 35.155 1.00 0.00 N ATOM 648 C5 DA B 21 21.412 17.136 34.105 1.00 0.00 C ATOM 649 C6 DA B 21 21.550 17.237 32.698 1.00 0.00 C ATOM 650 N6 DA B 21 22.615 16.880 32.004 1.00 0.00 N ATOM 651 N1 DA B 21 20.578 17.750 31.944 1.00 0.00 N ATOM 652 C2 DA B 21 19.475 18.164 32.547 1.00 0.00 C ATOM 653 N3 DA B 21 19.187 18.123 33.841 1.00 0.00 N ATOM 654 C4 DA B 21 20.207 17.592 34.574 1.00 0.00 C ATOM 0 H5' DA B 21 19.343 20.284 39.923 1.00 0.00 H new ATOM 0 H5'' DA B 21 18.421 19.185 40.929 1.00 0.00 H new ATOM 0 H4' DA B 21 17.692 19.136 38.704 1.00 0.00 H new ATOM 0 H3' DA B 21 18.463 16.575 39.914 1.00 0.00 H new ATOM 0 H2' DA B 21 19.641 15.858 38.003 1.00 0.00 H new ATOM 0 H2'' DA B 21 18.054 15.787 37.263 1.00 0.00 H new ATOM 0 H1' DA B 21 18.276 17.927 36.243 1.00 0.00 H new ATOM 0 H8 DA B 21 21.808 16.647 37.212 1.00 0.00 H new ATOM 0 H61 DA B 21 22.623 16.990 30.990 1.00 0.00 H new ATOM 0 H62 DA B 21 23.429 16.494 32.482 1.00 0.00 H new ATOM 0 H2 DA B 21 18.716 18.587 31.906 1.00 0.00 H new ATOM 666 P DT B 22 15.873 15.712 39.305 1.00 0.00 P ATOM 667 OP1 DT B 22 14.656 16.098 40.066 1.00 0.00 O ATOM 668 OP2 DT B 22 16.772 14.680 39.878 1.00 0.00 O ATOM 669 O5' DT B 22 15.425 15.228 37.829 1.00 0.00 O ATOM 670 C5' DT B 22 14.322 15.845 37.169 1.00 0.00 C ATOM 671 C4' DT B 22 14.253 15.564 35.664 1.00 0.00 C ATOM 672 O4' DT B 22 15.454 15.983 35.036 1.00 0.00 O ATOM 673 C3' DT B 22 14.085 14.083 35.315 1.00 0.00 C ATOM 674 O3' DT B 22 12.712 13.707 35.261 1.00 0.00 O ATOM 675 C2' DT B 22 14.716 14.032 33.926 1.00 0.00 C ATOM 676 C1' DT B 22 15.575 15.288 33.811 1.00 0.00 C ATOM 677 N1 DT B 22 16.999 14.969 33.545 1.00 0.00 N ATOM 678 C2 DT B 22 17.474 15.115 32.236 1.00 0.00 C ATOM 679 O2 DT B 22 16.774 15.467 31.285 1.00 0.00 O ATOM 680 N3 DT B 22 18.800 14.830 32.029 1.00 0.00 N ATOM 681 C4 DT B 22 19.687 14.392 32.987 1.00 0.00 C ATOM 682 O4 DT B 22 20.857 14.220 32.659 1.00 0.00 O ATOM 683 C5 DT B 22 19.107 14.168 34.311 1.00 0.00 C ATOM 684 C7 DT B 22 19.927 13.547 35.427 1.00 0.00 C ATOM 685 C6 DT B 22 17.800 14.453 34.544 1.00 0.00 C ATOM 0 H5' DT B 22 14.377 16.923 37.324 1.00 0.00 H new ATOM 0 H5'' DT B 22 13.397 15.503 37.634 1.00 0.00 H new ATOM 0 H4' DT B 22 13.377 16.111 35.315 1.00 0.00 H new ATOM 0 H3' DT B 22 14.531 13.405 36.043 1.00 0.00 H new ATOM 0 H2' DT B 22 15.320 13.133 33.804 1.00 0.00 H new ATOM 0 H2'' DT B 22 13.951 14.010 33.150 1.00 0.00 H new ATOM 0 H1' DT B 22 15.232 15.891 32.970 1.00 0.00 H new ATOM 0 H3 DT B 22 19.160 14.953 31.083 1.00 0.00 H new ATOM 0 H71 DT B 22 19.579 13.925 36.388 1.00 0.00 H new ATOM 0 H72 DT B 22 19.815 12.463 35.401 1.00 0.00 H new ATOM 0 H73 DT B 22 20.977 13.806 35.294 1.00 0.00 H new ATOM 0 H6 DT B 22 17.382 14.274 35.523 1.00 0.00 H new ATOM 698 P DC B 23 12.246 12.163 35.323 1.00 0.00 P ATOM 699 OP1 DC B 23 10.763 12.138 35.278 1.00 0.00 O ATOM 700 OP2 DC B 23 12.935 11.509 36.463 1.00 0.00 O ATOM 701 O5' DC B 23 12.809 11.517 33.957 1.00 0.00 O ATOM 702 C5' DC B 23 12.250 11.852 32.692 1.00 0.00 C ATOM 703 C4' DC B 23 13.106 11.344 31.521 1.00 0.00 C ATOM 704 O4' DC B 23 14.426 11.890 31.548 1.00 0.00 O ATOM 705 C3' DC B 23 13.231 9.809 31.483 1.00 0.00 C ATOM 706 O3' DC B 23 12.618 9.324 30.292 1.00 0.00 O ATOM 707 C2' DC B 23 14.746 9.609 31.553 1.00 0.00 C ATOM 708 C1' DC B 23 15.304 10.923 31.005 1.00 0.00 C ATOM 709 N1 DC B 23 16.726 11.166 31.399 1.00 0.00 N ATOM 710 C2 DC B 23 17.692 11.349 30.398 1.00 0.00 C ATOM 711 O2 DC B 23 17.393 11.514 29.216 1.00 0.00 O ATOM 712 N3 DC B 23 19.015 11.342 30.695 1.00 0.00 N ATOM 713 C4 DC B 23 19.371 11.208 31.954 1.00 0.00 C ATOM 714 N4 DC B 23 20.652 11.186 32.179 1.00 0.00 N ATOM 715 C5 DC B 23 18.445 11.122 33.028 1.00 0.00 C ATOM 716 C6 DC B 23 17.124 11.105 32.714 1.00 0.00 C ATOM 0 H5' DC B 23 12.145 12.934 32.619 1.00 0.00 H new ATOM 0 H5'' DC B 23 11.248 11.429 32.617 1.00 0.00 H new ATOM 0 H4' DC B 23 12.577 11.679 30.629 1.00 0.00 H new ATOM 0 H3' DC B 23 12.731 9.261 32.282 1.00 0.00 H new ATOM 0 H2' DC B 23 15.080 9.426 32.574 1.00 0.00 H new ATOM 0 H2'' DC B 23 15.067 8.756 30.955 1.00 0.00 H new ATOM 0 H1' DC B 23 15.342 10.937 29.916 1.00 0.00 H new ATOM 0 H41 DC B 23 21.001 11.085 33.132 1.00 0.00 H new ATOM 0 H42 DC B 23 21.308 11.270 31.402 1.00 0.00 H new ATOM 0 H5 DC B 23 18.779 11.072 34.054 1.00 0.00 H new ATOM 0 H6 DC B 23 16.384 11.043 33.499 1.00 0.00 H new ATOM 728 P DG B 24 12.607 7.767 29.865 1.00 0.00 P ATOM 729 OP1 DG B 24 11.421 7.534 29.004 1.00 0.00 O ATOM 730 OP2 DG B 24 12.797 6.924 31.071 1.00 0.00 O ATOM 731 O5' DG B 24 13.929 7.661 28.952 1.00 0.00 O ATOM 732 C5' DG B 24 14.056 8.452 27.776 1.00 0.00 C ATOM 733 C4' DG B 24 15.446 8.371 27.131 1.00 0.00 C ATOM 734 O4' DG B 24 16.442 8.831 28.045 1.00 0.00 O ATOM 735 C3' DG B 24 15.841 6.945 26.700 1.00 0.00 C ATOM 736 O3' DG B 24 16.457 6.950 25.411 1.00 0.00 O ATOM 737 C2' DG B 24 16.861 6.567 27.768 1.00 0.00 C ATOM 738 C1' DG B 24 17.526 7.922 27.985 1.00 0.00 C ATOM 739 N9 DG B 24 18.363 7.958 29.204 1.00 0.00 N ATOM 740 C8 DG B 24 17.992 7.830 30.520 1.00 0.00 C ATOM 741 N7 DG B 24 18.989 7.878 31.368 1.00 0.00 N ATOM 742 C5 DG B 24 20.116 8.015 30.542 1.00 0.00 C ATOM 743 C6 DG B 24 21.527 8.093 30.836 1.00 0.00 C ATOM 744 O6 DG B 24 22.109 8.114 31.924 1.00 0.00 O ATOM 745 N1 DG B 24 22.315 8.130 29.704 1.00 0.00 N ATOM 746 C2 DG B 24 21.832 8.148 28.440 1.00 0.00 C ATOM 747 N2 DG B 24 22.697 8.204 27.465 1.00 0.00 N ATOM 748 N3 DG B 24 20.547 8.116 28.118 1.00 0.00 N ATOM 749 C4 DG B 24 19.734 8.041 29.216 1.00 0.00 C ATOM 0 H5' DG B 24 13.838 9.491 28.022 1.00 0.00 H new ATOM 0 H5'' DG B 24 13.308 8.132 27.050 1.00 0.00 H new ATOM 0 H4' DG B 24 15.391 8.998 26.241 1.00 0.00 H new ATOM 0 H3' DG B 24 14.995 6.262 26.622 1.00 0.00 H new ATOM 0 H2' DG B 24 16.393 6.182 28.674 1.00 0.00 H new ATOM 0 H2'' DG B 24 17.563 5.808 27.424 1.00 0.00 H new ATOM 0 HO3' DG B 24 16.700 6.034 25.161 1.00 0.00 H new ATOM 0 H1' DG B 24 18.227 8.167 27.187 1.00 0.00 H new ATOM 0 H8 DG B 24 16.965 7.701 30.829 1.00 0.00 H new ATOM 0 H1 DG B 24 23.327 8.145 29.828 1.00 0.00 H new ATOM 0 H21 DG B 24 22.375 8.219 26.497 1.00 0.00 H new ATOM 0 H22 DG B 24 23.696 8.232 27.670 1.00 0.00 H new TER 762 DG B 24 HETATM 763 O81 9U2 A 100 15.300 25.323 38.249 1.00 0.00 O HETATM 764 C81 9U2 A 100 15.920 24.811 37.329 1.00 0.00 C HETATM 765 C82 9U2 A 100 15.326 23.841 36.341 1.00 0.00 C HETATM 766 C84 9U2 A 100 13.998 23.406 36.310 1.00 0.00 C HETATM 767 C85 9U2 A 100 12.850 23.712 37.265 1.00 0.00 C HETATM 768 S81 9U2 A 100 13.679 22.391 34.923 1.00 0.00 S HETATM 769 C83 9U2 A 100 15.358 22.544 34.497 1.00 0.00 C HETATM 770 N81 9U2 A 100 16.084 23.295 35.305 1.00 0.00 N HETATM 771 CM8 9U2 A 100 12.302 25.156 37.162 1.00 0.00 C HETATM 772 CM9 9U2 A 100 13.065 23.253 38.728 1.00 0.00 C HETATM 781 N PYB A 101 17.256 25.142 37.094 1.00 0.00 N HETATM 782 CA PYB A 101 18.073 25.972 37.864 1.00 0.00 C HETATM 783 CB1 PYB A 101 19.397 26.376 37.535 1.00 0.00 C HETATM 784 CB PYB A 101 17.755 26.494 39.090 1.00 0.00 C HETATM 785 CG1 PYB A 101 19.886 27.105 38.598 1.00 0.00 C HETATM 786 NG2 PYB A 101 18.854 27.207 39.542 1.00 0.00 N HETATM 787 CD PYB A 101 18.838 27.951 40.810 1.00 0.00 C HETATM 788 C PYB A 101 21.251 27.640 38.888 1.00 0.00 C HETATM 789 O PYB A 101 21.567 28.016 40.010 1.00 0.00 O HETATM 0 HD3 PYB A 101 18.056 28.709 40.777 1.00 0.00 H new HETATM 0 HD2 PYB A 101 18.642 27.263 41.633 1.00 0.00 H new HETATM 0 HD1 PYB A 101 19.804 28.432 40.962 1.00 0.00 H new HETATM 0 HB1 PYB A 101 19.928 26.150 36.610 1.00 0.00 H new HETATM 0 HB PYB A 101 16.808 26.371 39.615 1.00 0.00 H new HETATM 0 H PYB A 101 17.598 24.769 36.209 1.00 0.00 H new HETATM 796 N PYB A 102 22.153 27.708 37.832 1.00 0.00 N HETATM 797 CA PYB A 102 23.501 28.079 37.948 1.00 0.00 C HETATM 798 CB1 PYB A 102 24.319 28.598 36.912 1.00 0.00 C HETATM 799 CB PYB A 102 24.251 28.033 39.096 1.00 0.00 C HETATM 800 CG1 PYB A 102 25.552 28.907 37.455 1.00 0.00 C HETATM 801 NG2 PYB A 102 25.517 28.526 38.803 1.00 0.00 N HETATM 802 CD PYB A 102 26.586 28.615 39.805 1.00 0.00 C HETATM 803 C PYB A 102 26.776 29.502 36.835 1.00 0.00 C HETATM 804 O PYB A 102 27.848 29.618 37.414 1.00 0.00 O HETATM 0 HD3 PYB A 102 26.265 29.261 40.623 1.00 0.00 H new HETATM 0 HD2 PYB A 102 26.805 27.620 40.193 1.00 0.00 H new HETATM 0 HD1 PYB A 102 27.483 29.030 39.345 1.00 0.00 H new HETATM 0 HB1 PYB A 102 24.027 28.730 35.870 1.00 0.00 H new HETATM 0 HB PYB A 102 23.913 27.673 40.068 1.00 0.00 H new HETATM 0 H PYB A 102 21.673 27.803 36.937 1.00 0.00 H new HETATM 811 N PYB A 103 26.614 29.968 35.542 1.00 0.00 N HETATM 812 CA PYB A 103 27.580 30.551 34.725 1.00 0.00 C HETATM 813 CB1 PYB A 103 27.260 31.265 33.555 1.00 0.00 C HETATM 814 CB PYB A 103 28.946 30.566 34.885 1.00 0.00 C HETATM 815 CG1 PYB A 103 28.434 31.659 32.965 1.00 0.00 C HETATM 816 NG2 PYB A 103 29.478 31.275 33.808 1.00 0.00 N HETATM 817 CD PYB A 103 30.908 31.567 33.630 1.00 0.00 C HETATM 818 C PYB A 103 28.639 32.299 31.643 1.00 0.00 C HETATM 819 O PYB A 103 29.714 32.559 31.130 1.00 0.00 O HETATM 0 HD3 PYB A 103 31.268 32.153 34.476 1.00 0.00 H new HETATM 0 HD2 PYB A 103 31.466 30.632 33.573 1.00 0.00 H new HETATM 0 HD1 PYB A 103 31.052 32.133 32.709 1.00 0.00 H new HETATM 0 HB1 PYB A 103 26.256 31.469 33.183 1.00 0.00 H new HETATM 0 HB PYB A 103 29.507 30.110 35.700 1.00 0.00 H new HETATM 0 H PYB A 103 25.626 30.049 35.302 1.00 0.00 H new HETATM 826 N ABU A 104 27.454 32.574 31.008 1.00 0.00 N HETATM 827 CA ABU A 104 27.313 33.014 29.619 1.00 0.00 C HETATM 828 CB ABU A 104 26.733 31.888 28.743 1.00 0.00 C HETATM 829 CG ABU A 104 27.785 30.938 28.125 1.00 0.00 C HETATM 830 CD ABU A 104 28.762 30.221 29.078 1.00 0.00 C HETATM 831 OE1 ABU A 104 29.966 30.298 28.891 1.00 0.00 O HETATM 0 H ABU A 104 26.555 32.486 31.483 1.00 0.00 H new HETATM 0 HB1 ABU A 104 26.041 31.299 29.345 1.00 0.00 H new HETATM 0 HB2 ABU A 104 26.152 32.337 27.937 1.00 0.00 H new HETATM 0 HG1 ABU A 104 27.282 30.179 27.526 1.00 0.00 H new HETATM 0 HG2 ABU A 104 28.464 31.509 27.492 1.00 0.00 H new HETATM 0 HE2 ABU A 104 28.352 30.455 28.921 1.00 0.00 H new HETATM 839 N IMT A 105 28.208 29.510 30.123 1.00 0.00 N HETATM 840 CA IMT A 105 28.819 28.894 31.193 1.00 0.00 C HETATM 841 NB1 IMT A 105 28.158 28.297 32.243 1.00 0.00 N HETATM 842 CB IMT A 105 30.173 28.844 31.388 1.00 0.00 C HETATM 843 CG1 IMT A 105 29.112 27.892 33.087 1.00 0.00 C HETATM 844 NG2 IMT A 105 30.378 28.198 32.585 1.00 0.00 N HETATM 845 CD IMT A 105 31.707 27.936 33.158 1.00 0.00 C HETATM 846 C IMT A 105 28.981 27.217 34.440 1.00 0.00 C HETATM 847 O IMT A 105 29.943 26.946 35.152 1.00 0.00 O HETATM 0 HN2 IMT A 105 27.190 29.547 30.069 1.00 0.00 H new HETATM 0 HD3 IMT A 105 32.285 27.320 32.469 1.00 0.00 H new HETATM 0 HD2 IMT A 105 32.225 28.881 33.322 1.00 0.00 H new HETATM 0 HD1 IMT A 105 31.597 27.413 34.108 1.00 0.00 H new HETATM 0 HB IMT A 105 30.941 29.240 30.723 1.00 0.00 H new HETATM 853 N PYB A 106 27.688 26.897 34.858 1.00 0.00 N HETATM 854 CA PYB A 106 27.302 26.343 36.085 1.00 0.00 C HETATM 855 CB1 PYB A 106 25.991 25.897 36.401 1.00 0.00 C HETATM 856 CB PYB A 106 28.093 26.162 37.191 1.00 0.00 C HETATM 857 CG1 PYB A 106 25.998 25.448 37.704 1.00 0.00 C HETATM 858 NG2 PYB A 106 27.305 25.584 38.183 1.00 0.00 N HETATM 859 CD PYB A 106 27.842 25.144 39.481 1.00 0.00 C HETATM 860 C PYB A 106 24.885 24.974 38.584 1.00 0.00 C HETATM 861 O PYB A 106 25.010 24.817 39.792 1.00 0.00 O HETATM 0 HD3 PYB A 106 28.606 24.384 39.320 1.00 0.00 H new HETATM 0 HD2 PYB A 106 28.281 25.996 40.001 1.00 0.00 H new HETATM 0 HD1 PYB A 106 27.037 24.726 40.085 1.00 0.00 H new HETATM 0 HB1 PYB A 106 25.131 25.908 35.731 1.00 0.00 H new HETATM 0 HB PYB A 106 29.148 26.423 37.278 1.00 0.00 H new HETATM 0 H PYB A 106 27.004 27.005 34.109 1.00 0.00 H new HETATM 868 N PYB A 107 23.684 24.704 37.951 1.00 0.00 N HETATM 869 CA PYB A 107 22.474 24.381 38.565 1.00 0.00 C HETATM 870 CB1 PYB A 107 21.408 23.685 37.948 1.00 0.00 C HETATM 871 CB PYB A 107 22.119 24.660 39.859 1.00 0.00 C HETATM 872 CG1 PYB A 107 20.418 23.511 38.886 1.00 0.00 C HETATM 873 NG2 PYB A 107 20.837 24.159 40.056 1.00 0.00 N HETATM 874 CD PYB A 107 20.101 24.312 41.321 1.00 0.00 C HETATM 875 C PYB A 107 19.108 22.799 38.798 1.00 0.00 C HETATM 876 O PYB A 107 18.286 22.798 39.705 1.00 0.00 O HETATM 0 HD3 PYB A 107 20.661 23.839 42.128 1.00 0.00 H new HETATM 0 HD2 PYB A 107 19.972 25.372 41.541 1.00 0.00 H new HETATM 0 HD1 PYB A 107 19.123 23.839 41.233 1.00 0.00 H new HETATM 0 HB1 PYB A 107 21.377 23.347 36.912 1.00 0.00 H new HETATM 0 HB PYB A 107 22.729 25.179 40.598 1.00 0.00 H new HETATM 0 H PYB A 107 23.852 24.435 36.982 1.00 0.00 H new HETATM 883 N PYB A 108 18.886 22.098 37.622 1.00 0.00 N HETATM 884 CA PYB A 108 17.750 21.359 37.288 1.00 0.00 C HETATM 885 CB1 PYB A 108 17.631 20.552 36.130 1.00 0.00 C HETATM 886 CB PYB A 108 16.572 21.277 37.988 1.00 0.00 C HETATM 887 CG1 PYB A 108 16.357 20.039 36.097 1.00 0.00 C HETATM 888 NG2 PYB A 108 15.737 20.405 37.295 1.00 0.00 N HETATM 889 CD PYB A 108 14.447 19.939 37.814 1.00 0.00 C HETATM 890 C PYB A 108 15.636 19.331 35.002 1.00 0.00 C HETATM 891 O PYB A 108 14.470 18.972 35.057 1.00 0.00 O HETATM 0 HD3 PYB A 108 14.603 19.408 38.753 1.00 0.00 H new HETATM 0 HD2 PYB A 108 13.793 20.794 37.985 1.00 0.00 H new HETATM 0 HD1 PYB A 108 13.985 19.268 37.090 1.00 0.00 H new HETATM 0 HB1 PYB A 108 18.414 20.370 35.394 1.00 0.00 H new HETATM 0 HB PYB A 108 16.334 21.798 38.915 1.00 0.00 H new HETATM 0 H PYB A 108 19.704 22.079 37.013 1.00 0.00 H new HETATM 898 C01 9T8 A 109 11.269 20.081 26.154 1.00 0.00 C HETATM 899 N02 9T8 A 109 15.317 18.306 29.386 1.00 0.00 N HETATM 900 C03 9T8 A 109 12.871 18.525 27.269 1.00 0.00 C HETATM 901 C05 9T8 A 109 14.659 17.231 28.615 1.00 0.00 C HETATM 902 C06 9T8 A 109 14.687 19.008 30.391 1.00 0.00 C HETATM 903 C07 9T8 A 109 15.583 19.598 31.480 1.00 0.00 C HETATM 904 C04 9T8 A 109 14.145 17.658 27.217 1.00 0.00 C HETATM 905 N01 9T8 A 109 12.469 19.157 25.932 1.00 0.00 N HETATM 906 C02 9T8 A 109 12.063 18.091 24.914 1.00 0.00 C HETATM 907 N03 9T8 A 109 16.371 19.180 33.845 1.00 0.00 N HETATM 908 C08 9T8 A 109 15.851 18.576 32.604 1.00 0.00 C HETATM 909 O01 9T8 A 109 13.470 19.081 30.440 1.00 0.00 O