USER MOD reduce.3.24.130724 H: found=0, std=0, add=321, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 346 hydrogens (96 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 102 PYB HN2 : A 102 PYB N : A 101 9TK C81 :(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 104 PYB HN2 : A 104 PYB N : A 103 PYB C :(H bumps) USER MOD NoAdj-H: A 106 IMT H : A 106 IMT N : A 105 ABU CD :(H bumps) USER MOD NoAdj-H: A 107 PYB HN2 : A 107 PYB N : A 106 IMT C :(H bumps) USER MOD NoAdj-H: A 108 PYB HN2 : A 108 PYB N : A 107 PYB C :(H bumps) USER MOD NoAdj-H: A 109 PYB HN2 : A 109 PYB N : A 108 PYB C :(H bumps) USER MOD Single : A 1 DCZ O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl 150:sc= -0.518 (180deg=-0.518) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) 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 150:sc= -0.177 (180deg=-0.177) USER MOD Single : B 18 DT C7 :methyl -30:sc= -1.65! (180deg=-2.56!) USER MOD Single : B 22 DT C7 :methyl 150:sc= -0.162 (180deg=-0.162) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 N1 DCZ A 1 30.983 13.064 28.239 1.00 0.00 N HETATM 2 C2 DCZ A 1 31.877 12.523 29.184 1.00 0.00 C HETATM 3 N3 DCZ A 1 32.564 13.326 30.038 1.00 0.00 N HETATM 4 C4 DCZ A 1 32.350 14.622 29.987 1.00 0.00 C HETATM 5 C5 DCZ A 1 31.435 15.234 29.090 1.00 0.00 C HETATM 6 C6 DCZ A 1 30.774 14.427 28.223 1.00 0.00 C HETATM 7 O2 DCZ A 1 32.067 11.306 29.291 1.00 0.00 O HETATM 8 N4 DCZ A 1 33.038 15.345 30.827 1.00 0.00 N HETATM 9 C1' DCZ A 1 30.323 12.123 27.274 1.00 0.00 C HETATM 10 C2' DCZ A 1 29.313 12.730 26.293 1.00 0.00 C HETATM 11 C3' DCZ A 1 29.151 11.600 25.281 1.00 0.00 C HETATM 12 C4' DCZ A 1 30.550 10.957 25.301 1.00 0.00 C HETATM 13 O4' DCZ A 1 31.267 11.564 26.374 1.00 0.00 O HETATM 14 O3' DCZ A 1 28.159 10.684 25.728 1.00 0.00 O HETATM 15 C5' DCZ A 1 31.322 11.121 23.979 1.00 0.00 C HETATM 16 O5' DCZ A 1 31.601 12.484 23.660 1.00 0.00 O HETATM 0 HO51 DCZ A 1 32.093 12.528 22.814 1.00 0.00 H new HETATM 0 HN42 DCZ A 1 32.922 16.358 30.842 1.00 0.00 H new HETATM 0 HN41 DCZ A 1 33.692 14.897 31.469 1.00 0.00 H new HETATM 0 H5'2 DCZ A 1 32.260 10.569 24.042 1.00 0.00 H new HETATM 0 H5'1 DCZ A 1 30.744 10.675 23.170 1.00 0.00 H new HETATM 0 H2'2 DCZ A 1 28.371 12.983 26.779 1.00 0.00 H new HETATM 0 H2'1 DCZ A 1 29.688 13.643 25.831 1.00 0.00 H new HETATM 0 H6 DCZ A 1 30.073 14.859 27.509 1.00 0.00 H new HETATM 0 H5 DCZ A 1 31.270 16.311 29.098 1.00 0.00 H new HETATM 0 H4' DCZ A 1 30.442 9.881 25.436 1.00 0.00 H new HETATM 0 H3' DCZ A 1 28.833 11.921 24.289 1.00 0.00 H new HETATM 0 H1' DCZ A 1 29.835 11.435 27.964 1.00 0.00 H new ATOM 29 P DG A 2 26.794 10.463 24.899 1.00 0.00 P ATOM 30 OP1 DG A 2 26.012 9.413 25.598 1.00 0.00 O ATOM 31 OP2 DG A 2 27.128 10.281 23.466 1.00 0.00 O ATOM 32 O5' DG A 2 26.045 11.874 25.081 1.00 0.00 O ATOM 33 C5' DG A 2 24.668 12.048 24.764 1.00 0.00 C ATOM 34 C4' DG A 2 24.143 13.418 25.226 1.00 0.00 C ATOM 35 O4' DG A 2 24.333 13.526 26.635 1.00 0.00 O ATOM 36 C3' DG A 2 24.872 14.617 24.583 1.00 0.00 C ATOM 37 O3' DG A 2 24.023 15.736 24.394 1.00 0.00 O ATOM 38 C2' DG A 2 25.857 14.997 25.679 1.00 0.00 C ATOM 39 C1' DG A 2 24.978 14.759 26.911 1.00 0.00 C ATOM 40 N9 DG A 2 25.740 14.716 28.183 1.00 0.00 N ATOM 41 C8 DG A 2 27.073 14.975 28.403 1.00 0.00 C ATOM 42 N7 DG A 2 27.458 14.830 29.642 1.00 0.00 N ATOM 43 C5 DG A 2 26.279 14.463 30.305 1.00 0.00 C ATOM 44 C6 DG A 2 26.013 14.192 31.694 1.00 0.00 C ATOM 45 O6 DG A 2 26.782 14.218 32.653 1.00 0.00 O ATOM 46 N1 DG A 2 24.699 13.868 31.952 1.00 0.00 N ATOM 47 C2 DG A 2 23.732 13.824 31.008 1.00 0.00 C ATOM 48 N2 DG A 2 22.532 13.491 31.404 1.00 0.00 N ATOM 49 N3 DG A 2 23.922 14.082 29.719 1.00 0.00 N ATOM 50 C4 DG A 2 25.223 14.395 29.422 1.00 0.00 C ATOM 0 H5' DG A 2 24.084 11.257 25.235 1.00 0.00 H new ATOM 0 H5'' DG A 2 24.528 11.949 23.688 1.00 0.00 H new ATOM 0 H4' DG A 2 23.096 13.460 24.926 1.00 0.00 H new ATOM 0 H3' DG A 2 25.285 14.362 23.607 1.00 0.00 H new ATOM 0 H2' DG A 2 26.749 14.371 25.675 1.00 0.00 H new ATOM 0 H2'' DG A 2 26.193 16.031 25.599 1.00 0.00 H new ATOM 0 H1' DG A 2 24.278 15.580 27.067 1.00 0.00 H new ATOM 0 H8 DG A 2 27.747 15.274 27.614 1.00 0.00 H new ATOM 0 H1 DG A 2 24.440 13.648 32.914 1.00 0.00 H new ATOM 0 H21 DG A 2 21.768 13.443 30.730 1.00 0.00 H new ATOM 0 H22 DG A 2 22.360 13.279 32.387 1.00 0.00 H new ATOM 62 P DA A 3 23.087 15.900 23.104 1.00 0.00 P ATOM 63 OP1 DA A 3 22.446 14.601 22.784 1.00 0.00 O ATOM 64 OP2 DA A 3 23.859 16.607 22.052 1.00 0.00 O ATOM 65 O5' DA A 3 21.970 16.907 23.678 1.00 0.00 O ATOM 66 C5' DA A 3 21.074 16.520 24.720 1.00 0.00 C ATOM 67 C4' DA A 3 21.239 17.319 26.026 1.00 0.00 C ATOM 68 O4' DA A 3 22.380 16.970 26.793 1.00 0.00 O ATOM 69 C3' DA A 3 21.325 18.853 25.844 1.00 0.00 C ATOM 70 O3' DA A 3 20.116 19.624 25.888 1.00 0.00 O ATOM 71 C2' DA A 3 22.332 19.274 26.925 1.00 0.00 C ATOM 72 C1' DA A 3 22.498 18.000 27.755 1.00 0.00 C ATOM 73 N9 DA A 3 23.759 17.916 28.531 1.00 0.00 N ATOM 74 C8 DA A 3 25.058 18.090 28.115 1.00 0.00 C ATOM 75 N7 DA A 3 25.946 18.023 29.077 1.00 0.00 N ATOM 76 C5 DA A 3 25.161 17.792 30.220 1.00 0.00 C ATOM 77 C6 DA A 3 25.413 17.657 31.611 1.00 0.00 C ATOM 78 N6 DA A 3 26.587 17.749 32.204 1.00 0.00 N ATOM 79 N1 DA A 3 24.419 17.455 32.474 1.00 0.00 N ATOM 80 C2 DA A 3 23.184 17.370 32.001 1.00 0.00 C ATOM 81 N3 DA A 3 22.792 17.474 30.739 1.00 0.00 N ATOM 82 C4 DA A 3 23.835 17.700 29.890 1.00 0.00 C ATOM 0 H5' DA A 3 21.220 15.461 24.934 1.00 0.00 H new ATOM 0 H5'' DA A 3 20.050 16.635 24.364 1.00 0.00 H new ATOM 0 H4' DA A 3 20.321 17.043 26.544 1.00 0.00 H new ATOM 0 H3' DA A 3 21.618 19.070 24.817 1.00 0.00 H new ATOM 0 H2' DA A 3 23.278 19.599 26.491 1.00 0.00 H new ATOM 0 H2'' DA A 3 21.956 20.102 27.527 1.00 0.00 H new ATOM 0 H1' DA A 3 21.752 17.946 28.548 1.00 0.00 H new ATOM 0 H8 DA A 3 25.324 18.267 27.083 1.00 0.00 H new ATOM 0 H61 DA A 3 26.658 17.635 33.215 1.00 0.00 H new ATOM 0 H62 DA A 3 27.424 17.934 31.652 1.00 0.00 H new ATOM 0 H2 DA A 3 22.406 17.196 32.729 1.00 0.00 H new ATOM 94 P DT A 4 18.821 19.267 26.795 1.00 0.00 P ATOM 95 OP1 DT A 4 18.214 18.020 26.269 1.00 0.00 O ATOM 96 OP2 DT A 4 17.970 20.478 26.869 1.00 0.00 O ATOM 97 O5' DT A 4 19.463 18.940 28.244 1.00 0.00 O ATOM 98 C5' DT A 4 18.974 19.483 29.466 1.00 0.00 C ATOM 99 C4' DT A 4 19.863 20.573 30.091 1.00 0.00 C ATOM 100 O4' DT A 4 21.205 20.152 30.303 1.00 0.00 O ATOM 101 C3' DT A 4 20.044 21.862 29.288 1.00 0.00 C ATOM 102 O3' DT A 4 18.901 22.703 29.362 1.00 0.00 O ATOM 103 C2' DT A 4 21.255 22.471 30.013 1.00 0.00 C ATOM 104 C1' DT A 4 21.883 21.301 30.779 1.00 0.00 C ATOM 105 N1 DT A 4 23.373 21.205 30.715 1.00 0.00 N ATOM 106 C2 DT A 4 24.066 21.108 31.931 1.00 0.00 C ATOM 107 O2 DT A 4 23.526 21.106 33.033 1.00 0.00 O ATOM 108 N3 DT A 4 25.432 21.036 31.879 1.00 0.00 N ATOM 109 C4 DT A 4 26.198 21.072 30.739 1.00 0.00 C ATOM 110 O4 DT A 4 27.418 20.962 30.855 1.00 0.00 O ATOM 111 C5 DT A 4 25.433 21.233 29.499 1.00 0.00 C ATOM 112 C7 DT A 4 26.161 21.350 28.171 1.00 0.00 C ATOM 113 C6 DT A 4 24.069 21.285 29.523 1.00 0.00 C ATOM 0 H5' DT A 4 18.857 18.673 30.186 1.00 0.00 H new ATOM 0 H5'' DT A 4 17.982 19.900 29.291 1.00 0.00 H new ATOM 0 H4' DT A 4 19.298 20.761 31.004 1.00 0.00 H new ATOM 0 H3' DT A 4 20.182 21.714 28.217 1.00 0.00 H new ATOM 0 H2' DT A 4 21.962 22.906 29.306 1.00 0.00 H new ATOM 0 H2'' DT A 4 20.950 23.269 30.690 1.00 0.00 H new ATOM 0 H1' DT A 4 21.750 21.438 31.852 1.00 0.00 H new ATOM 0 H3 DT A 4 25.926 20.948 32.767 1.00 0.00 H new ATOM 0 H71 DT A 4 25.537 20.941 27.377 1.00 0.00 H new ATOM 0 H72 DT A 4 26.372 22.399 27.963 1.00 0.00 H new ATOM 0 H73 DT A 4 27.097 20.794 28.219 1.00 0.00 H new ATOM 0 H6 DT A 4 23.525 21.390 28.596 1.00 0.00 H new ATOM 126 P DG A 5 18.734 23.987 28.396 1.00 0.00 P ATOM 127 OP1 DG A 5 17.381 24.558 28.617 1.00 0.00 O ATOM 128 OP2 DG A 5 19.157 23.647 27.015 1.00 0.00 O ATOM 129 O5' DG A 5 19.827 25.002 28.987 1.00 0.00 O ATOM 130 C5' DG A 5 19.627 25.676 30.217 1.00 0.00 C ATOM 131 C4' DG A 5 20.875 26.451 30.655 1.00 0.00 C ATOM 132 O4' DG A 5 21.952 25.604 31.039 1.00 0.00 O ATOM 133 C3' DG A 5 21.485 27.326 29.551 1.00 0.00 C ATOM 134 O3' DG A 5 20.841 28.554 29.183 1.00 0.00 O ATOM 135 C2' DG A 5 22.922 27.503 30.039 1.00 0.00 C ATOM 136 C1' DG A 5 23.104 26.430 31.123 1.00 0.00 C ATOM 137 N9 DG A 5 24.361 25.639 30.999 1.00 0.00 N ATOM 138 C8 DG A 5 24.810 24.869 29.954 1.00 0.00 C ATOM 139 N7 DG A 5 25.986 24.325 30.153 1.00 0.00 N ATOM 140 C5 DG A 5 26.349 24.757 31.439 1.00 0.00 C ATOM 141 C6 DG A 5 27.516 24.517 32.264 1.00 0.00 C ATOM 142 O6 DG A 5 28.526 23.851 32.035 1.00 0.00 O ATOM 143 N1 DG A 5 27.461 25.140 33.497 1.00 0.00 N ATOM 144 C2 DG A 5 26.425 25.903 33.901 1.00 0.00 C ATOM 145 N2 DG A 5 26.483 26.417 35.097 1.00 0.00 N ATOM 146 N3 DG A 5 25.348 26.167 33.171 1.00 0.00 N ATOM 147 C4 DG A 5 25.355 25.561 31.952 1.00 0.00 C ATOM 0 H5' DG A 5 19.360 24.953 30.988 1.00 0.00 H new ATOM 0 H5'' DG A 5 18.787 26.364 30.121 1.00 0.00 H new ATOM 0 H4' DG A 5 20.492 27.048 31.482 1.00 0.00 H new ATOM 0 H3' DG A 5 21.369 26.831 28.587 1.00 0.00 H new ATOM 0 H2' DG A 5 23.635 27.368 29.226 1.00 0.00 H new ATOM 0 H2'' DG A 5 23.083 28.503 30.442 1.00 0.00 H new ATOM 0 H1' DG A 5 23.203 26.906 32.098 1.00 0.00 H new ATOM 0 H8 DG A 5 24.243 24.724 29.046 1.00 0.00 H new ATOM 0 H1 DG A 5 28.247 25.016 34.136 1.00 0.00 H new ATOM 0 H21 DG A 5 25.719 27.000 35.439 1.00 0.00 H new ATOM 0 H22 DG A 5 27.292 26.236 35.691 1.00 0.00 H new ATOM 159 P DT A 6 20.031 29.545 30.182 1.00 0.00 P ATOM 160 OP1 DT A 6 18.832 28.838 30.693 1.00 0.00 O ATOM 161 OP2 DT A 6 19.836 30.823 29.455 1.00 0.00 O ATOM 162 O5' DT A 6 21.028 29.845 31.406 1.00 0.00 O ATOM 163 C5' DT A 6 20.711 29.524 32.756 1.00 0.00 C ATOM 164 C4' DT A 6 21.839 29.970 33.679 1.00 0.00 C ATOM 165 O4' DT A 6 23.064 29.380 33.280 1.00 0.00 O ATOM 166 C3' DT A 6 22.032 31.490 33.682 1.00 0.00 C ATOM 167 O3' DT A 6 21.642 31.978 34.960 1.00 0.00 O ATOM 168 C2' DT A 6 23.522 31.650 33.358 1.00 0.00 C ATOM 169 C1' DT A 6 24.106 30.266 33.633 1.00 0.00 C ATOM 170 N1 DT A 6 25.319 29.872 32.862 1.00 0.00 N ATOM 171 C2 DT A 6 26.442 29.439 33.581 1.00 0.00 C ATOM 172 O2 DT A 6 26.627 29.667 34.776 1.00 0.00 O ATOM 173 N3 DT A 6 27.391 28.732 32.880 1.00 0.00 N ATOM 174 C4 DT A 6 27.315 28.394 31.550 1.00 0.00 C ATOM 175 O4 DT A 6 28.143 27.610 31.092 1.00 0.00 O ATOM 176 C5 DT A 6 26.219 29.027 30.819 1.00 0.00 C ATOM 177 C7 DT A 6 26.119 28.851 29.313 1.00 0.00 C ATOM 178 C6 DT A 6 25.273 29.742 31.486 1.00 0.00 C ATOM 0 H5' DT A 6 20.553 28.450 32.855 1.00 0.00 H new ATOM 0 H5'' DT A 6 19.780 30.012 33.045 1.00 0.00 H new ATOM 0 H4' DT A 6 21.555 29.649 34.681 1.00 0.00 H new ATOM 0 H3' DT A 6 21.436 32.058 32.968 1.00 0.00 H new ATOM 0 H2' DT A 6 23.676 31.950 32.322 1.00 0.00 H new ATOM 0 H2'' DT A 6 23.988 32.412 33.983 1.00 0.00 H new ATOM 0 H1' DT A 6 24.441 30.250 34.670 1.00 0.00 H new ATOM 0 H3 DT A 6 28.222 28.433 33.391 1.00 0.00 H new ATOM 0 H71 DT A 6 25.073 28.891 29.011 1.00 0.00 H new ATOM 0 H72 DT A 6 26.671 29.649 28.816 1.00 0.00 H new ATOM 0 H73 DT A 6 26.542 27.887 29.031 1.00 0.00 H new ATOM 0 H6 DT A 6 24.475 30.215 30.933 1.00 0.00 H new ATOM 191 P DA A 7 21.295 33.531 35.228 1.00 0.00 P ATOM 192 OP1 DA A 7 20.416 33.609 36.421 1.00 0.00 O ATOM 193 OP2 DA A 7 20.841 34.162 33.963 1.00 0.00 O ATOM 194 O5' DA A 7 22.733 34.135 35.608 1.00 0.00 O ATOM 195 C5' DA A 7 23.350 33.785 36.839 1.00 0.00 C ATOM 196 C4' DA A 7 24.851 34.077 36.846 1.00 0.00 C ATOM 197 O4' DA A 7 25.529 33.249 35.913 1.00 0.00 O ATOM 198 C3' DA A 7 25.226 35.534 36.548 1.00 0.00 C ATOM 199 O3' DA A 7 25.800 36.103 37.719 1.00 0.00 O ATOM 200 C2' DA A 7 26.191 35.381 35.368 1.00 0.00 C ATOM 201 C1' DA A 7 26.674 33.935 35.462 1.00 0.00 C ATOM 202 N9 DA A 7 27.065 33.348 34.160 1.00 0.00 N ATOM 203 C8 DA A 7 26.331 33.340 32.998 1.00 0.00 C ATOM 204 N7 DA A 7 26.853 32.646 32.025 1.00 0.00 N ATOM 205 C5 DA A 7 28.055 32.188 32.587 1.00 0.00 C ATOM 206 C6 DA A 7 29.127 31.399 32.112 1.00 0.00 C ATOM 207 N6 DA A 7 29.179 30.871 30.905 1.00 0.00 N ATOM 208 N1 DA A 7 30.173 31.108 32.885 1.00 0.00 N ATOM 209 C2 DA A 7 30.179 31.597 34.118 1.00 0.00 C ATOM 210 N3 DA A 7 29.252 32.342 34.716 1.00 0.00 N ATOM 211 C4 DA A 7 28.199 32.609 33.885 1.00 0.00 C ATOM 0 H5' DA A 7 23.189 32.725 37.034 1.00 0.00 H new ATOM 0 H5'' DA A 7 22.872 34.335 37.650 1.00 0.00 H new ATOM 0 H4' DA A 7 25.161 33.867 37.870 1.00 0.00 H new ATOM 0 H3' DA A 7 24.408 36.208 36.292 1.00 0.00 H new ATOM 0 H2' DA A 7 25.692 35.573 34.418 1.00 0.00 H new ATOM 0 H2'' DA A 7 27.021 36.083 35.439 1.00 0.00 H new ATOM 0 H1' DA A 7 27.558 33.870 36.096 1.00 0.00 H new ATOM 0 H8 DA A 7 25.394 33.868 32.898 1.00 0.00 H new ATOM 0 H61 DA A 7 29.985 30.311 30.628 1.00 0.00 H new ATOM 0 H62 DA A 7 28.413 31.023 30.249 1.00 0.00 H new ATOM 0 H2 DA A 7 31.048 31.360 34.714 1.00 0.00 H new ATOM 223 P DC A 8 26.278 37.642 37.807 1.00 0.00 P ATOM 224 OP1 DC A 8 26.254 38.051 39.234 1.00 0.00 O ATOM 225 OP2 DC A 8 25.519 38.447 36.816 1.00 0.00 O ATOM 226 O5' DC A 8 27.808 37.553 37.326 1.00 0.00 O ATOM 227 C5' DC A 8 28.750 36.776 38.056 1.00 0.00 C ATOM 228 C4' DC A 8 30.078 36.606 37.312 1.00 0.00 C ATOM 229 O4' DC A 8 29.880 35.860 36.113 1.00 0.00 O ATOM 230 C3' DC A 8 30.738 37.941 36.931 1.00 0.00 C ATOM 231 O3' DC A 8 32.096 37.957 37.364 1.00 0.00 O ATOM 232 C2' DC A 8 30.583 37.935 35.411 1.00 0.00 C ATOM 233 C1' DC A 8 30.678 36.439 35.099 1.00 0.00 C ATOM 234 N1 DC A 8 30.151 36.003 33.773 1.00 0.00 N ATOM 235 C2 DC A 8 30.902 35.115 32.983 1.00 0.00 C ATOM 236 O2 DC A 8 32.038 34.752 33.294 1.00 0.00 O ATOM 237 N3 DC A 8 30.402 34.624 31.820 1.00 0.00 N ATOM 238 C4 DC A 8 29.188 34.983 31.462 1.00 0.00 C ATOM 239 N4 DC A 8 28.741 34.481 30.348 1.00 0.00 N ATOM 240 C5 DC A 8 28.371 35.865 32.218 1.00 0.00 C ATOM 241 C6 DC A 8 28.892 36.367 33.363 1.00 0.00 C ATOM 0 H5' DC A 8 28.324 35.794 38.260 1.00 0.00 H new ATOM 0 H5'' DC A 8 28.936 37.249 39.020 1.00 0.00 H new ATOM 0 H4' DC A 8 30.739 36.083 38.003 1.00 0.00 H new ATOM 0 H3' DC A 8 30.303 38.830 37.388 1.00 0.00 H new ATOM 0 H2' DC A 8 29.631 38.360 35.094 1.00 0.00 H new ATOM 0 H2'' DC A 8 31.368 38.508 34.917 1.00 0.00 H new ATOM 0 H1' DC A 8 31.727 36.144 35.065 1.00 0.00 H new ATOM 0 H41 DC A 8 27.806 34.723 30.019 1.00 0.00 H new ATOM 0 H42 DC A 8 29.325 33.846 29.804 1.00 0.00 H new ATOM 0 H5 DC A 8 27.374 36.125 31.893 1.00 0.00 H new ATOM 0 H6 DC A 8 28.313 37.058 33.958 1.00 0.00 H new ATOM 253 P DA A 9 32.930 39.334 37.530 1.00 0.00 P ATOM 254 OP1 DA A 9 34.050 39.081 38.473 1.00 0.00 O ATOM 255 OP2 DA A 9 31.986 40.440 37.835 1.00 0.00 O ATOM 256 O5' DA A 9 33.540 39.588 36.057 1.00 0.00 O ATOM 257 C5' DA A 9 34.665 38.847 35.602 1.00 0.00 C ATOM 258 C4' DA A 9 34.680 38.626 34.084 1.00 0.00 C ATOM 259 O4' DA A 9 33.493 37.983 33.638 1.00 0.00 O ATOM 260 C3' DA A 9 34.795 39.884 33.216 1.00 0.00 C ATOM 261 O3' DA A 9 36.148 40.298 33.048 1.00 0.00 O ATOM 262 C2' DA A 9 34.178 39.393 31.902 1.00 0.00 C ATOM 263 C1' DA A 9 33.541 38.052 32.231 1.00 0.00 C ATOM 264 N9 DA A 9 32.236 37.905 31.564 1.00 0.00 N ATOM 265 C8 DA A 9 31.065 38.589 31.791 1.00 0.00 C ATOM 266 N7 DA A 9 30.127 38.346 30.911 1.00 0.00 N ATOM 267 C5 DA A 9 30.746 37.443 30.029 1.00 0.00 C ATOM 268 C6 DA A 9 30.365 36.771 28.840 1.00 0.00 C ATOM 269 N6 DA A 9 29.189 36.875 28.252 1.00 0.00 N ATOM 270 N1 DA A 9 31.203 35.954 28.202 1.00 0.00 N ATOM 271 C2 DA A 9 32.413 35.787 28.718 1.00 0.00 C ATOM 272 N3 DA A 9 32.923 36.338 29.813 1.00 0.00 N ATOM 273 C4 DA A 9 32.025 37.164 30.427 1.00 0.00 C ATOM 0 H5' DA A 9 34.678 37.879 36.102 1.00 0.00 H new ATOM 0 H5'' DA A 9 35.576 39.369 35.894 1.00 0.00 H new ATOM 0 H4' DA A 9 35.581 38.026 33.956 1.00 0.00 H new ATOM 0 H3' DA A 9 34.308 40.763 33.639 1.00 0.00 H new ATOM 0 H2' DA A 9 33.436 40.099 31.528 1.00 0.00 H new ATOM 0 H2'' DA A 9 34.937 39.288 31.127 1.00 0.00 H new ATOM 0 H1' DA A 9 34.118 37.208 31.852 1.00 0.00 H new ATOM 0 H8 DA A 9 30.931 39.266 32.621 1.00 0.00 H new ATOM 0 H61 DA A 9 28.999 36.354 27.396 1.00 0.00 H new ATOM 0 H62 DA A 9 28.470 37.476 28.653 1.00 0.00 H new ATOM 0 H2 DA A 9 33.067 35.118 28.179 1.00 0.00 H new ATOM 285 P DT A 10 36.554 41.558 32.116 1.00 0.00 P ATOM 286 OP1 DT A 10 37.951 41.934 32.450 1.00 0.00 O ATOM 287 OP2 DT A 10 35.491 42.590 32.234 1.00 0.00 O ATOM 288 O5' DT A 10 36.523 40.967 30.611 1.00 0.00 O ATOM 289 C5' DT A 10 37.480 40.010 30.170 1.00 0.00 C ATOM 290 C4' DT A 10 37.225 39.495 28.744 1.00 0.00 C ATOM 291 O4' DT A 10 36.058 38.688 28.635 1.00 0.00 O ATOM 292 C3' DT A 10 36.985 40.598 27.714 1.00 0.00 C ATOM 293 O3' DT A 10 38.152 41.320 27.357 1.00 0.00 O ATOM 294 C2' DT A 10 36.486 39.745 26.553 1.00 0.00 C ATOM 295 C1' DT A 10 35.677 38.652 27.259 1.00 0.00 C ATOM 296 N1 DT A 10 34.214 38.851 27.086 1.00 0.00 N ATOM 297 C2 DT A 10 33.626 38.315 25.933 1.00 0.00 C ATOM 298 O2 DT A 10 34.255 37.735 25.049 1.00 0.00 O ATOM 299 N3 DT A 10 32.273 38.490 25.795 1.00 0.00 N ATOM 300 C4 DT A 10 31.455 39.175 26.658 1.00 0.00 C ATOM 301 O4 DT A 10 30.250 39.204 26.416 1.00 0.00 O ATOM 302 C5 DT A 10 32.145 39.800 27.790 1.00 0.00 C ATOM 303 C7 DT A 10 31.383 40.650 28.792 1.00 0.00 C ATOM 304 C6 DT A 10 33.479 39.610 27.974 1.00 0.00 C ATOM 0 H5' DT A 10 37.479 39.165 30.858 1.00 0.00 H new ATOM 0 H5'' DT A 10 38.474 40.456 30.214 1.00 0.00 H new ATOM 0 H4' DT A 10 38.142 38.941 28.544 1.00 0.00 H new ATOM 0 H3' DT A 10 36.318 41.387 28.061 1.00 0.00 H new ATOM 0 H2' DT A 10 35.871 40.322 25.863 1.00 0.00 H new ATOM 0 H2'' DT A 10 37.310 39.328 25.974 1.00 0.00 H new ATOM 0 H1' DT A 10 35.889 37.674 26.826 1.00 0.00 H new ATOM 0 H3 DT A 10 31.834 38.072 24.975 1.00 0.00 H new ATOM 0 H71 DT A 10 31.864 40.581 29.768 1.00 0.00 H new ATOM 0 H72 DT A 10 31.381 41.689 28.461 1.00 0.00 H new ATOM 0 H73 DT A 10 30.357 40.291 28.867 1.00 0.00 H new ATOM 0 H6 DT A 10 33.969 40.059 28.825 1.00 0.00 H new ATOM 317 P DC A 11 38.086 42.908 27.098 1.00 0.00 P ATOM 318 OP1 DC A 11 39.453 43.367 26.741 1.00 0.00 O ATOM 319 OP2 DC A 11 37.392 43.555 28.238 1.00 0.00 O ATOM 320 O5' DC A 11 37.131 43.032 25.802 1.00 0.00 O ATOM 321 C5' DC A 11 37.626 42.823 24.486 1.00 0.00 C ATOM 322 C4' DC A 11 36.533 42.940 23.409 1.00 0.00 C ATOM 323 O4' DC A 11 35.574 41.888 23.494 1.00 0.00 O ATOM 324 C3' DC A 11 35.679 44.209 23.524 1.00 0.00 C ATOM 325 O3' DC A 11 36.237 45.479 23.161 1.00 0.00 O ATOM 326 C2' DC A 11 34.443 43.816 22.723 1.00 0.00 C ATOM 327 C1' DC A 11 34.430 42.277 22.741 1.00 0.00 C ATOM 328 N1 DC A 11 33.159 41.775 23.342 1.00 0.00 N ATOM 329 C2 DC A 11 32.183 41.186 22.517 1.00 0.00 C ATOM 330 O2 DC A 11 32.441 40.747 21.395 1.00 0.00 O ATOM 331 N3 DC A 11 30.895 41.083 22.930 1.00 0.00 N ATOM 332 C4 DC A 11 30.596 41.517 24.138 1.00 0.00 C ATOM 333 N4 DC A 11 29.345 41.445 24.481 1.00 0.00 N ATOM 334 C5 DC A 11 31.554 42.027 25.055 1.00 0.00 C ATOM 335 C6 DC A 11 32.836 42.128 24.628 1.00 0.00 C ATOM 0 H5' DC A 11 38.082 41.835 24.428 1.00 0.00 H new ATOM 0 H5'' DC A 11 38.412 43.549 24.279 1.00 0.00 H new ATOM 0 H4' DC A 11 37.109 42.925 22.484 1.00 0.00 H new ATOM 0 H3' DC A 11 35.513 44.454 24.573 1.00 0.00 H new ATOM 0 H2' DC A 11 33.537 44.224 23.170 1.00 0.00 H new ATOM 0 H2'' DC A 11 34.495 44.198 21.704 1.00 0.00 H new ATOM 0 H1' DC A 11 34.473 41.851 21.738 1.00 0.00 H new ATOM 0 H41 DC A 11 29.050 41.765 25.403 1.00 0.00 H new ATOM 0 H42 DC A 11 28.658 41.068 23.828 1.00 0.00 H new ATOM 0 H5 DC A 11 31.271 42.323 26.054 1.00 0.00 H new ATOM 0 H6 DC A 11 33.603 42.486 25.299 1.00 0.00 H new ATOM 347 P DG A 12 37.123 45.808 21.839 1.00 0.00 P ATOM 348 OP1 DG A 12 38.354 44.982 21.881 1.00 0.00 O ATOM 349 OP2 DG A 12 37.271 47.283 21.792 1.00 0.00 O ATOM 350 O5' DG A 12 36.250 45.389 20.547 1.00 0.00 O ATOM 351 C5' DG A 12 36.558 44.253 19.743 1.00 0.00 C ATOM 352 C4' DG A 12 35.486 43.959 18.677 1.00 0.00 C ATOM 353 O4' DG A 12 34.282 43.515 19.304 1.00 0.00 O ATOM 354 C3' DG A 12 35.125 45.175 17.803 1.00 0.00 C ATOM 355 O3' DG A 12 34.849 44.789 16.456 1.00 0.00 O ATOM 356 C2' DG A 12 33.852 45.671 18.480 1.00 0.00 C ATOM 357 C1' DG A 12 33.210 44.340 18.869 1.00 0.00 C ATOM 358 N9 DG A 12 32.153 44.456 19.906 1.00 0.00 N ATOM 359 C8 DG A 12 32.074 45.298 20.993 1.00 0.00 C ATOM 360 N7 DG A 12 30.980 45.168 21.699 1.00 0.00 N ATOM 361 C5 DG A 12 30.261 44.179 21.011 1.00 0.00 C ATOM 362 C6 DG A 12 28.953 43.610 21.230 1.00 0.00 C ATOM 363 O6 DG A 12 28.127 43.846 22.115 1.00 0.00 O ATOM 364 N1 DG A 12 28.589 42.684 20.273 1.00 0.00 N ATOM 365 C2 DG A 12 29.377 42.318 19.238 1.00 0.00 C ATOM 366 N2 DG A 12 28.881 41.467 18.381 1.00 0.00 N ATOM 367 N3 DG A 12 30.589 42.806 18.992 1.00 0.00 N ATOM 368 C4 DG A 12 30.977 43.739 19.916 1.00 0.00 C ATOM 0 H5' DG A 12 36.671 43.380 20.386 1.00 0.00 H new ATOM 0 H5'' DG A 12 37.517 44.413 19.251 1.00 0.00 H new ATOM 0 H4' DG A 12 35.921 43.195 18.033 1.00 0.00 H new ATOM 0 H3' DG A 12 35.924 45.914 17.734 1.00 0.00 H new ATOM 0 H2' DG A 12 34.060 46.300 19.346 1.00 0.00 H new ATOM 0 H2'' DG A 12 33.224 46.254 17.806 1.00 0.00 H new ATOM 0 HO3' DG A 12 34.622 45.583 15.928 1.00 0.00 H new ATOM 0 H1' DG A 12 32.682 43.919 18.013 1.00 0.00 H new ATOM 0 H8 DG A 12 32.850 46.006 21.242 1.00 0.00 H new ATOM 0 H1 DG A 12 27.669 42.250 20.352 1.00 0.00 H new ATOM 0 H21 DG A 12 29.439 41.162 17.584 1.00 0.00 H new ATOM 0 H22 DG A 12 27.935 41.107 18.509 1.00 0.00 H new TER 381 DG A 12 HETATM 382 N1 DCZ B 13 24.445 39.774 19.601 1.00 0.00 N HETATM 383 C2 DCZ B 13 25.509 40.670 19.417 1.00 0.00 C HETATM 384 N3 DCZ B 13 25.984 41.408 20.451 1.00 0.00 N HETATM 385 C4 DCZ B 13 25.449 41.238 21.643 1.00 0.00 C HETATM 386 C5 DCZ B 13 24.428 40.290 21.913 1.00 0.00 C HETATM 387 C6 DCZ B 13 23.948 39.570 20.866 1.00 0.00 C HETATM 388 O2 DCZ B 13 26.065 40.814 18.328 1.00 0.00 O HETATM 389 N4 DCZ B 13 25.913 42.002 22.591 1.00 0.00 N HETATM 390 C1' DCZ B 13 23.842 39.080 18.423 1.00 0.00 C HETATM 391 C2' DCZ B 13 24.140 37.582 18.426 1.00 0.00 C HETATM 392 C3' DCZ B 13 22.906 36.950 17.796 1.00 0.00 C HETATM 393 C4' DCZ B 13 21.808 37.976 18.097 1.00 0.00 C HETATM 394 O4' DCZ B 13 22.427 39.205 18.475 1.00 0.00 O HETATM 395 O3' DCZ B 13 23.076 36.724 16.404 1.00 0.00 O HETATM 396 C5' DCZ B 13 20.837 37.483 19.188 1.00 0.00 C HETATM 397 O5' DCZ B 13 21.487 37.015 20.377 1.00 0.00 O HETATM 0 HO51 DCZ B 13 20.813 36.720 21.024 1.00 0.00 H new HETATM 0 HN42 DCZ B 13 25.542 41.922 23.538 1.00 0.00 H new HETATM 0 HN41 DCZ B 13 26.647 42.680 22.386 1.00 0.00 H new HETATM 0 H5'2 DCZ B 13 20.160 38.295 19.452 1.00 0.00 H new HETATM 0 H5'1 DCZ B 13 20.226 36.678 18.780 1.00 0.00 H new HETATM 0 H2'2 DCZ B 13 25.039 37.354 17.854 1.00 0.00 H new HETATM 0 H2'1 DCZ B 13 24.304 37.211 19.438 1.00 0.00 H new HETATM 0 H6 DCZ B 13 23.166 38.828 21.030 1.00 0.00 H new HETATM 0 H5 DCZ B 13 24.043 40.145 22.923 1.00 0.00 H new HETATM 0 H4' DCZ B 13 21.207 38.124 17.200 1.00 0.00 H new HETATM 0 H3' DCZ B 13 22.678 35.960 18.192 1.00 0.00 H new HETATM 0 H1' DCZ B 13 24.269 39.541 17.533 1.00 0.00 H new ATOM 410 P DG B 14 22.942 35.225 15.826 1.00 0.00 P ATOM 411 OP1 DG B 14 23.198 35.250 14.363 1.00 0.00 O ATOM 412 OP2 DG B 14 21.672 34.641 16.327 1.00 0.00 O ATOM 413 O5' DG B 14 24.167 34.492 16.574 1.00 0.00 O ATOM 414 C5' DG B 14 25.494 34.542 16.064 1.00 0.00 C ATOM 415 C4' DG B 14 26.555 34.286 17.144 1.00 0.00 C ATOM 416 O4' DG B 14 26.734 35.445 17.957 1.00 0.00 O ATOM 417 C3' DG B 14 26.226 33.108 18.084 1.00 0.00 C ATOM 418 O3' DG B 14 27.308 32.201 18.208 1.00 0.00 O ATOM 419 C2' DG B 14 26.015 33.832 19.407 1.00 0.00 C ATOM 420 C1' DG B 14 27.005 34.994 19.269 1.00 0.00 C ATOM 421 N9 DG B 14 26.839 36.050 20.307 1.00 0.00 N ATOM 422 C8 DG B 14 25.864 36.150 21.276 1.00 0.00 C ATOM 423 N7 DG B 14 26.026 37.141 22.108 1.00 0.00 N ATOM 424 C5 DG B 14 27.209 37.746 21.672 1.00 0.00 C ATOM 425 C6 DG B 14 27.953 38.857 22.205 1.00 0.00 C ATOM 426 O6 DG B 14 27.706 39.555 23.186 1.00 0.00 O ATOM 427 N1 DG B 14 29.108 39.141 21.509 1.00 0.00 N ATOM 428 C2 DG B 14 29.522 38.442 20.427 1.00 0.00 C ATOM 429 N2 DG B 14 30.672 38.796 19.914 1.00 0.00 N ATOM 430 N3 DG B 14 28.874 37.402 19.899 1.00 0.00 N ATOM 431 C4 DG B 14 27.713 37.094 20.565 1.00 0.00 C ATOM 0 H5' DG B 14 25.669 35.519 15.613 1.00 0.00 H new ATOM 0 H5'' DG B 14 25.602 33.801 15.272 1.00 0.00 H new ATOM 0 H4' DG B 14 27.460 34.036 16.591 1.00 0.00 H new ATOM 0 H3' DG B 14 25.386 32.507 17.736 1.00 0.00 H new ATOM 0 H2' DG B 14 24.988 34.178 19.528 1.00 0.00 H new ATOM 0 H2'' DG B 14 26.241 33.198 20.264 1.00 0.00 H new ATOM 0 H1' DG B 14 28.043 34.699 19.424 1.00 0.00 H new ATOM 0 H8 DG B 14 25.033 35.463 21.341 1.00 0.00 H new ATOM 0 H1 DG B 14 29.683 39.921 21.827 1.00 0.00 H new ATOM 0 H21 DG B 14 31.038 38.307 19.097 1.00 0.00 H new ATOM 0 H22 DG B 14 31.202 39.561 20.331 1.00 0.00 H new ATOM 443 P DA B 15 27.472 30.976 17.180 1.00 0.00 P ATOM 444 OP1 DA B 15 27.138 31.437 15.810 1.00 0.00 O ATOM 445 OP2 DA B 15 26.751 29.806 17.741 1.00 0.00 O ATOM 446 O5' DA B 15 29.046 30.656 17.228 1.00 0.00 O ATOM 447 C5' DA B 15 30.030 31.609 16.828 1.00 0.00 C ATOM 448 C4' DA B 15 30.776 32.264 18.005 1.00 0.00 C ATOM 449 O4' DA B 15 30.049 33.270 18.709 1.00 0.00 O ATOM 450 C3' DA B 15 31.209 31.259 19.080 1.00 0.00 C ATOM 451 O3' DA B 15 32.439 30.615 18.770 1.00 0.00 O ATOM 452 C2' DA B 15 31.307 32.154 20.313 1.00 0.00 C ATOM 453 C1' DA B 15 30.814 33.525 19.875 1.00 0.00 C ATOM 454 N9 DA B 15 30.098 34.180 20.992 1.00 0.00 N ATOM 455 C8 DA B 15 28.942 33.783 21.618 1.00 0.00 C ATOM 456 N7 DA B 15 28.617 34.504 22.661 1.00 0.00 N ATOM 457 C5 DA B 15 29.674 35.423 22.751 1.00 0.00 C ATOM 458 C6 DA B 15 30.014 36.482 23.632 1.00 0.00 C ATOM 459 N6 DA B 15 29.297 36.875 24.668 1.00 0.00 N ATOM 460 N1 DA B 15 31.130 37.188 23.460 1.00 0.00 N ATOM 461 C2 DA B 15 31.930 36.864 22.453 1.00 0.00 C ATOM 462 N3 DA B 15 31.753 35.905 21.551 1.00 0.00 N ATOM 463 C4 DA B 15 30.589 35.221 21.750 1.00 0.00 C ATOM 0 H5' DA B 15 29.549 32.388 16.237 1.00 0.00 H new ATOM 0 H5'' DA B 15 30.755 31.118 16.179 1.00 0.00 H new ATOM 0 H4' DA B 15 31.626 32.713 17.492 1.00 0.00 H new ATOM 0 H3' DA B 15 30.522 30.421 19.198 1.00 0.00 H new ATOM 0 H2' DA B 15 30.699 31.763 21.129 1.00 0.00 H new ATOM 0 H2'' DA B 15 32.333 32.206 20.677 1.00 0.00 H new ATOM 0 H1' DA B 15 31.598 34.241 19.628 1.00 0.00 H new ATOM 0 H8 DA B 15 28.350 32.946 21.278 1.00 0.00 H new ATOM 0 H61 DA B 15 29.621 37.649 25.248 1.00 0.00 H new ATOM 0 H62 DA B 15 28.419 36.405 24.888 1.00 0.00 H new ATOM 0 H2 DA B 15 32.832 37.449 22.355 1.00 0.00 H new ATOM 475 P DT B 16 33.042 29.439 19.701 1.00 0.00 P ATOM 476 OP1 DT B 16 34.132 28.777 18.942 1.00 0.00 O ATOM 477 OP2 DT B 16 31.920 28.612 20.213 1.00 0.00 O ATOM 478 O5' DT B 16 33.682 30.247 20.942 1.00 0.00 O ATOM 479 C5' DT B 16 34.779 31.137 20.757 1.00 0.00 C ATOM 480 C4' DT B 16 35.055 32.009 21.993 1.00 0.00 C ATOM 481 O4' DT B 16 33.963 32.853 22.329 1.00 0.00 O ATOM 482 C3' DT B 16 35.335 31.179 23.241 1.00 0.00 C ATOM 483 O3' DT B 16 36.694 30.766 23.231 1.00 0.00 O ATOM 484 C2' DT B 16 35.045 32.200 24.339 1.00 0.00 C ATOM 485 C1' DT B 16 34.007 33.144 23.717 1.00 0.00 C ATOM 486 N1 DT B 16 32.641 33.032 24.312 1.00 0.00 N ATOM 487 C2 DT B 16 32.287 33.969 25.292 1.00 0.00 C ATOM 488 O2 DT B 16 33.070 34.799 25.747 1.00 0.00 O ATOM 489 N3 DT B 16 30.993 33.941 25.756 1.00 0.00 N ATOM 490 C4 DT B 16 30.013 33.062 25.344 1.00 0.00 C ATOM 491 O4 DT B 16 28.878 33.184 25.806 1.00 0.00 O ATOM 492 C5 DT B 16 30.456 32.067 24.361 1.00 0.00 C ATOM 493 C7 DT B 16 29.475 31.026 23.845 1.00 0.00 C ATOM 494 C6 DT B 16 31.735 32.077 23.889 1.00 0.00 C ATOM 0 H5' DT B 16 34.578 31.781 19.901 1.00 0.00 H new ATOM 0 H5'' DT B 16 35.673 30.560 20.518 1.00 0.00 H new ATOM 0 H4' DT B 16 35.926 32.598 21.707 1.00 0.00 H new ATOM 0 H3' DT B 16 34.755 30.262 23.347 1.00 0.00 H new ATOM 0 H2' DT B 16 34.657 31.719 25.237 1.00 0.00 H new ATOM 0 H2'' DT B 16 35.947 32.738 24.630 1.00 0.00 H new ATOM 0 H1' DT B 16 34.315 34.170 23.917 1.00 0.00 H new ATOM 0 H3 DT B 16 30.736 34.628 26.465 1.00 0.00 H new ATOM 0 H71 DT B 16 29.743 30.747 22.826 1.00 0.00 H new ATOM 0 H72 DT B 16 29.511 30.144 24.484 1.00 0.00 H new ATOM 0 H73 DT B 16 28.467 31.440 23.854 1.00 0.00 H new ATOM 0 H6 DT B 16 32.045 31.329 23.175 1.00 0.00 H new ATOM 507 P DG B 17 37.114 29.217 23.361 1.00 0.00 P ATOM 508 OP1 DG B 17 38.559 29.099 23.037 1.00 0.00 O ATOM 509 OP2 DG B 17 36.143 28.368 22.629 1.00 0.00 O ATOM 510 O5' DG B 17 36.909 28.970 24.928 1.00 0.00 O ATOM 511 C5' DG B 17 37.817 29.498 25.883 1.00 0.00 C ATOM 512 C4' DG B 17 37.316 29.284 27.314 1.00 0.00 C ATOM 513 O4' DG B 17 36.192 30.117 27.574 1.00 0.00 O ATOM 514 C3' DG B 17 36.877 27.832 27.567 1.00 0.00 C ATOM 515 O3' DG B 17 37.303 27.367 28.837 1.00 0.00 O ATOM 516 C2' DG B 17 35.360 27.970 27.532 1.00 0.00 C ATOM 517 C1' DG B 17 35.178 29.344 28.181 1.00 0.00 C ATOM 518 N9 DG B 17 33.857 29.994 27.968 1.00 0.00 N ATOM 519 C8 DG B 17 32.972 29.858 26.924 1.00 0.00 C ATOM 520 N7 DG B 17 31.909 30.618 27.014 1.00 0.00 N ATOM 521 C5 DG B 17 32.097 31.313 28.217 1.00 0.00 C ATOM 522 C6 DG B 17 31.296 32.302 28.899 1.00 0.00 C ATOM 523 O6 DG B 17 30.210 32.785 28.589 1.00 0.00 O ATOM 524 N1 DG B 17 31.854 32.758 30.074 1.00 0.00 N ATOM 525 C2 DG B 17 33.024 32.308 30.567 1.00 0.00 C ATOM 526 N2 DG B 17 33.427 32.818 31.694 1.00 0.00 N ATOM 527 N3 DG B 17 33.802 31.410 29.973 1.00 0.00 N ATOM 528 C4 DG B 17 33.287 30.937 28.799 1.00 0.00 C ATOM 0 H5' DG B 17 37.958 30.563 25.702 1.00 0.00 H new ATOM 0 H5'' DG B 17 38.790 29.022 25.763 1.00 0.00 H new ATOM 0 H4' DG B 17 38.152 29.529 27.970 1.00 0.00 H new ATOM 0 H3' DG B 17 37.290 27.119 26.853 1.00 0.00 H new ATOM 0 H2' DG B 17 34.966 27.938 26.516 1.00 0.00 H new ATOM 0 H2'' DG B 17 34.861 27.180 28.092 1.00 0.00 H new ATOM 0 H1' DG B 17 35.234 29.250 29.266 1.00 0.00 H new ATOM 0 H8 DG B 17 33.139 29.181 26.099 1.00 0.00 H new ATOM 0 H1 DG B 17 31.354 33.475 30.599 1.00 0.00 H new ATOM 0 H21 DG B 17 34.307 32.509 32.108 1.00 0.00 H new ATOM 0 H22 DG B 17 32.863 33.526 32.164 1.00 0.00 H new ATOM 540 P DT B 18 38.780 26.763 29.041 1.00 0.00 P ATOM 541 OP1 DT B 18 39.724 27.417 28.102 1.00 0.00 O ATOM 542 OP2 DT B 18 38.676 25.282 29.041 1.00 0.00 O ATOM 543 O5' DT B 18 39.147 27.236 30.531 1.00 0.00 O ATOM 544 C5' DT B 18 39.245 28.616 30.876 1.00 0.00 C ATOM 545 C4' DT B 18 38.196 29.026 31.919 1.00 0.00 C ATOM 546 O4' DT B 18 36.874 29.070 31.401 1.00 0.00 O ATOM 547 C3' DT B 18 38.170 28.106 33.151 1.00 0.00 C ATOM 548 O3' DT B 18 38.697 28.806 34.274 1.00 0.00 O ATOM 549 C2' DT B 18 36.685 27.749 33.283 1.00 0.00 C ATOM 550 C1' DT B 18 36.011 28.872 32.505 1.00 0.00 C ATOM 551 N1 DT B 18 34.613 28.618 32.053 1.00 0.00 N ATOM 552 C2 DT B 18 33.609 29.464 32.544 1.00 0.00 C ATOM 553 O2 DT B 18 33.757 30.239 33.487 1.00 0.00 O ATOM 554 N3 DT B 18 32.387 29.407 31.920 1.00 0.00 N ATOM 555 C4 DT B 18 32.078 28.603 30.852 1.00 0.00 C ATOM 556 O4 DT B 18 31.011 28.783 30.272 1.00 0.00 O ATOM 557 C5 DT B 18 33.092 27.602 30.524 1.00 0.00 C ATOM 558 C7 DT B 18 32.769 26.514 29.511 1.00 0.00 C ATOM 559 C6 DT B 18 34.319 27.644 31.117 1.00 0.00 C ATOM 0 H5' DT B 18 39.121 29.223 29.979 1.00 0.00 H new ATOM 0 H5'' DT B 18 40.242 28.822 31.265 1.00 0.00 H new ATOM 0 H4' DT B 18 38.513 30.027 32.211 1.00 0.00 H new ATOM 0 H3' DT B 18 38.781 27.206 33.074 1.00 0.00 H new ATOM 0 H2' DT B 18 36.463 26.770 32.859 1.00 0.00 H new ATOM 0 H2'' DT B 18 36.363 27.726 34.324 1.00 0.00 H new ATOM 0 H1' DT B 18 35.881 29.740 33.152 1.00 0.00 H new ATOM 0 H3 DT B 18 31.649 30.012 32.280 1.00 0.00 H new ATOM 0 H71 DT B 18 31.702 26.293 29.542 1.00 0.00 H new ATOM 0 H72 DT B 18 33.041 26.855 28.512 1.00 0.00 H new ATOM 0 H73 DT B 18 33.333 25.613 29.753 1.00 0.00 H new ATOM 0 H6 DT B 18 35.067 26.911 30.854 1.00 0.00 H new ATOM 572 P DA B 19 39.389 28.034 35.516 1.00 0.00 P ATOM 573 OP1 DA B 19 40.283 28.995 36.210 1.00 0.00 O ATOM 574 OP2 DA B 19 39.960 26.748 35.043 1.00 0.00 O ATOM 575 O5' DA B 19 38.143 27.703 36.476 1.00 0.00 O ATOM 576 C5' DA B 19 37.556 28.725 37.270 1.00 0.00 C ATOM 577 C4' DA B 19 36.131 28.392 37.717 1.00 0.00 C ATOM 578 O4' DA B 19 35.266 28.287 36.598 1.00 0.00 O ATOM 579 C3' DA B 19 35.961 27.117 38.555 1.00 0.00 C ATOM 580 O3' DA B 19 35.663 27.499 39.896 1.00 0.00 O ATOM 581 C2' DA B 19 34.817 26.398 37.826 1.00 0.00 C ATOM 582 C1' DA B 19 34.168 27.498 36.988 1.00 0.00 C ATOM 583 N9 DA B 19 33.488 27.012 35.767 1.00 0.00 N ATOM 584 C8 DA B 19 33.984 26.162 34.805 1.00 0.00 C ATOM 585 N7 DA B 19 33.177 25.946 33.801 1.00 0.00 N ATOM 586 C5 DA B 19 32.055 26.720 34.138 1.00 0.00 C ATOM 587 C6 DA B 19 30.802 26.968 33.527 1.00 0.00 C ATOM 588 N6 DA B 19 30.417 26.449 32.380 1.00 0.00 N ATOM 589 N1 DA B 19 29.906 27.781 34.085 1.00 0.00 N ATOM 590 C2 DA B 19 30.219 28.345 35.242 1.00 0.00 C ATOM 591 N3 DA B 19 31.342 28.214 35.941 1.00 0.00 N ATOM 592 C4 DA B 19 32.233 27.377 35.327 1.00 0.00 C ATOM 0 H5' DA B 19 37.545 29.656 36.703 1.00 0.00 H new ATOM 0 H5'' DA B 19 38.176 28.895 38.150 1.00 0.00 H new ATOM 0 H4' DA B 19 35.875 29.228 38.368 1.00 0.00 H new ATOM 0 H3' DA B 19 36.832 26.466 38.638 1.00 0.00 H new ATOM 0 H2' DA B 19 35.189 25.586 37.201 1.00 0.00 H new ATOM 0 H2'' DA B 19 34.108 25.960 38.529 1.00 0.00 H new ATOM 0 H1' DA B 19 33.393 28.005 37.563 1.00 0.00 H new ATOM 0 H8 DA B 19 34.962 25.710 34.875 1.00 0.00 H new ATOM 0 H61 DA B 19 29.497 26.674 32.001 1.00 0.00 H new ATOM 0 H62 DA B 19 31.039 25.821 31.870 1.00 0.00 H new ATOM 0 H2 DA B 19 29.468 28.992 35.671 1.00 0.00 H new ATOM 604 P DC B 20 35.458 26.435 41.092 1.00 0.00 P ATOM 605 OP1 DC B 20 35.750 27.125 42.374 1.00 0.00 O ATOM 606 OP2 DC B 20 36.196 25.189 40.767 1.00 0.00 O ATOM 607 O5' DC B 20 33.880 26.126 41.023 1.00 0.00 O ATOM 608 C5' DC B 20 32.928 27.145 41.308 1.00 0.00 C ATOM 609 C4' DC B 20 31.500 26.771 40.885 1.00 0.00 C ATOM 610 O4' DC B 20 31.392 26.594 39.476 1.00 0.00 O ATOM 611 C3' DC B 20 30.991 25.482 41.552 1.00 0.00 C ATOM 612 O3' DC B 20 29.989 25.794 42.515 1.00 0.00 O ATOM 613 C2' DC B 20 30.488 24.665 40.355 1.00 0.00 C ATOM 614 C1' DC B 20 30.316 25.703 39.242 1.00 0.00 C ATOM 615 N1 DC B 20 30.413 25.133 37.864 1.00 0.00 N ATOM 616 C2 DC B 20 29.339 25.251 36.964 1.00 0.00 C ATOM 617 O2 DC B 20 28.286 25.817 37.265 1.00 0.00 O ATOM 618 N3 DC B 20 29.421 24.741 35.706 1.00 0.00 N ATOM 619 C4 DC B 20 30.526 24.111 35.363 1.00 0.00 C ATOM 620 N4 DC B 20 30.584 23.646 34.147 1.00 0.00 N ATOM 621 C5 DC B 20 31.653 23.974 36.217 1.00 0.00 C ATOM 622 C6 DC B 20 31.563 24.499 37.463 1.00 0.00 C ATOM 0 H5' DC B 20 33.223 28.062 40.798 1.00 0.00 H new ATOM 0 H5'' DC B 20 32.940 27.356 42.377 1.00 0.00 H new ATOM 0 H4' DC B 20 30.888 27.612 41.213 1.00 0.00 H new ATOM 0 H3' DC B 20 31.734 24.925 42.123 1.00 0.00 H new ATOM 0 H2' DC B 20 31.202 23.891 40.072 1.00 0.00 H new ATOM 0 H2'' DC B 20 29.547 24.163 40.582 1.00 0.00 H new ATOM 0 H1' DC B 20 29.326 26.158 39.274 1.00 0.00 H new ATOM 0 H41 DC B 20 31.417 23.150 33.830 1.00 0.00 H new ATOM 0 H42 DC B 20 29.796 23.778 33.512 1.00 0.00 H new ATOM 0 H5 DC B 20 32.549 23.470 35.885 1.00 0.00 H new ATOM 0 H6 DC B 20 32.398 24.418 38.143 1.00 0.00 H new ATOM 634 P DA B 21 29.429 24.711 43.578 1.00 0.00 P ATOM 635 OP1 DA B 21 28.950 25.447 44.774 1.00 0.00 O ATOM 636 OP2 DA B 21 30.439 23.637 43.761 1.00 0.00 O ATOM 637 O5' DA B 21 28.155 24.079 42.822 1.00 0.00 O ATOM 638 C5' DA B 21 27.000 24.870 42.565 1.00 0.00 C ATOM 639 C4' DA B 21 26.166 24.333 41.395 1.00 0.00 C ATOM 640 O4' DA B 21 26.976 24.185 40.238 1.00 0.00 O ATOM 641 C3' DA B 21 25.538 22.953 41.628 1.00 0.00 C ATOM 642 O3' DA B 21 24.240 23.046 42.209 1.00 0.00 O ATOM 643 C2' DA B 21 25.482 22.368 40.213 1.00 0.00 C ATOM 644 C1' DA B 21 26.253 23.362 39.351 1.00 0.00 C ATOM 645 N9 DA B 21 27.116 22.741 38.325 1.00 0.00 N ATOM 646 C8 DA B 21 28.376 22.209 38.461 1.00 0.00 C ATOM 647 N7 DA B 21 28.887 21.749 37.346 1.00 0.00 N ATOM 648 C5 DA B 21 27.862 21.978 36.410 1.00 0.00 C ATOM 649 C6 DA B 21 27.683 21.730 35.024 1.00 0.00 C ATOM 650 N6 DA B 21 28.561 21.174 34.214 1.00 0.00 N ATOM 651 N1 DA B 21 26.553 22.060 34.399 1.00 0.00 N ATOM 652 C2 DA B 21 25.600 22.643 35.108 1.00 0.00 C ATOM 653 N3 DA B 21 25.612 22.948 36.400 1.00 0.00 N ATOM 654 C4 DA B 21 26.783 22.585 37.000 1.00 0.00 C ATOM 0 H5' DA B 21 27.306 25.894 42.349 1.00 0.00 H new ATOM 0 H5'' DA B 21 26.381 24.905 43.462 1.00 0.00 H new ATOM 0 H4' DA B 21 25.371 25.070 41.282 1.00 0.00 H new ATOM 0 H3' DA B 21 26.103 22.340 42.330 1.00 0.00 H new ATOM 0 H2' DA B 21 25.935 21.377 40.176 1.00 0.00 H new ATOM 0 H2'' DA B 21 24.453 22.261 39.869 1.00 0.00 H new ATOM 0 H1' DA B 21 25.549 23.943 38.756 1.00 0.00 H new ATOM 0 H8 DA B 21 28.899 22.173 39.405 1.00 0.00 H new ATOM 0 H61 DA B 21 28.333 21.040 33.229 1.00 0.00 H new ATOM 0 H62 DA B 21 29.469 20.878 34.572 1.00 0.00 H new ATOM 0 H2 DA B 21 24.701 22.903 34.569 1.00 0.00 H new ATOM 666 P DT B 22 23.454 21.742 42.753 1.00 0.00 P ATOM 667 OP1 DT B 22 22.333 22.221 43.601 1.00 0.00 O ATOM 668 OP2 DT B 22 24.444 20.813 43.351 1.00 0.00 O ATOM 669 O5' DT B 22 22.843 21.039 41.429 1.00 0.00 O ATOM 670 C5' DT B 22 21.576 21.419 40.898 1.00 0.00 C ATOM 671 C4' DT B 22 21.191 20.669 39.611 1.00 0.00 C ATOM 672 O4' DT B 22 21.983 21.063 38.497 1.00 0.00 O ATOM 673 C3' DT B 22 21.363 19.148 39.670 1.00 0.00 C ATOM 674 O3' DT B 22 20.366 18.477 40.430 1.00 0.00 O ATOM 675 C2' DT B 22 21.227 18.835 38.184 1.00 0.00 C ATOM 676 C1' DT B 22 21.857 20.054 37.500 1.00 0.00 C ATOM 677 N1 DT B 22 23.170 19.695 36.898 1.00 0.00 N ATOM 678 C2 DT B 22 23.157 19.204 35.586 1.00 0.00 C ATOM 679 O2 DT B 22 22.137 19.113 34.902 1.00 0.00 O ATOM 680 N3 DT B 22 24.355 18.763 35.079 1.00 0.00 N ATOM 681 C4 DT B 22 25.540 18.677 35.769 1.00 0.00 C ATOM 682 O4 DT B 22 26.519 18.202 35.196 1.00 0.00 O ATOM 683 C5 DT B 22 25.476 19.143 37.153 1.00 0.00 C ATOM 684 C7 DT B 22 26.704 19.046 38.041 1.00 0.00 C ATOM 685 C6 DT B 22 24.319 19.648 37.664 1.00 0.00 C ATOM 0 H5' DT B 22 21.584 22.490 40.695 1.00 0.00 H new ATOM 0 H5'' DT B 22 20.809 21.244 41.653 1.00 0.00 H new ATOM 0 H4' DT B 22 20.138 20.931 39.506 1.00 0.00 H new ATOM 0 H3' DT B 22 22.283 18.826 40.158 1.00 0.00 H new ATOM 0 H2' DT B 22 21.746 17.914 37.919 1.00 0.00 H new ATOM 0 H2'' DT B 22 20.184 18.708 37.895 1.00 0.00 H new ATOM 0 H1' DT B 22 21.238 20.417 36.679 1.00 0.00 H new ATOM 0 H3 DT B 22 24.366 18.473 34.101 1.00 0.00 H new ATOM 0 H71 DT B 22 26.686 19.851 38.775 1.00 0.00 H new ATOM 0 H72 DT B 22 26.706 18.085 38.556 1.00 0.00 H new ATOM 0 H73 DT B 22 27.603 19.132 37.430 1.00 0.00 H new ATOM 0 H6 DT B 22 24.299 20.016 38.679 1.00 0.00 H new ATOM 698 P DC B 23 20.564 16.952 40.925 1.00 0.00 P ATOM 699 OP1 DC B 23 19.487 16.653 41.901 1.00 0.00 O ATOM 700 OP2 DC B 23 21.974 16.765 41.346 1.00 0.00 O ATOM 701 O5' DC B 23 20.324 16.044 39.611 1.00 0.00 O ATOM 702 C5' DC B 23 19.047 15.949 38.989 1.00 0.00 C ATOM 703 C4' DC B 23 18.968 14.817 37.952 1.00 0.00 C ATOM 704 O4' DC B 23 19.847 15.063 36.856 1.00 0.00 O ATOM 705 C3' DC B 23 19.307 13.445 38.556 1.00 0.00 C ATOM 706 O3' DC B 23 18.287 12.501 38.246 1.00 0.00 O ATOM 707 C2' DC B 23 20.659 13.123 37.922 1.00 0.00 C ATOM 708 C1' DC B 23 20.649 13.917 36.613 1.00 0.00 C ATOM 709 N1 DC B 23 22.021 14.351 36.217 1.00 0.00 N ATOM 710 C2 DC B 23 22.594 13.874 35.029 1.00 0.00 C ATOM 711 O2 DC B 23 21.979 13.157 34.236 1.00 0.00 O ATOM 712 N3 DC B 23 23.862 14.207 34.689 1.00 0.00 N ATOM 713 C4 DC B 23 24.536 15.012 35.484 1.00 0.00 C ATOM 714 N4 DC B 23 25.738 15.313 35.093 1.00 0.00 N ATOM 715 C5 DC B 23 23.999 15.570 36.676 1.00 0.00 C ATOM 716 C6 DC B 23 22.736 15.210 37.017 1.00 0.00 C ATOM 0 H5' DC B 23 18.814 16.897 38.503 1.00 0.00 H new ATOM 0 H5'' DC B 23 18.287 15.788 39.754 1.00 0.00 H new ATOM 0 H4' DC B 23 17.935 14.798 37.604 1.00 0.00 H new ATOM 0 H3' DC B 23 19.362 13.425 39.644 1.00 0.00 H new ATOM 0 H2' DC B 23 21.485 13.425 38.566 1.00 0.00 H new ATOM 0 H2'' DC B 23 20.771 12.054 37.740 1.00 0.00 H new ATOM 0 H1' DC B 23 20.264 13.299 35.802 1.00 0.00 H new ATOM 0 H41 DC B 23 26.318 15.932 35.659 1.00 0.00 H new ATOM 0 H42 DC B 23 26.101 14.930 34.220 1.00 0.00 H new ATOM 0 H5 DC B 23 24.573 16.253 37.285 1.00 0.00 H new ATOM 0 H6 DC B 23 22.291 15.600 37.920 1.00 0.00 H new ATOM 728 P DG B 24 18.187 11.068 38.984 1.00 0.00 P ATOM 729 OP1 DG B 24 16.773 10.621 38.936 1.00 0.00 O ATOM 730 OP2 DG B 24 18.871 11.141 40.299 1.00 0.00 O ATOM 731 O5' DG B 24 19.058 10.118 38.022 1.00 0.00 O ATOM 732 C5' DG B 24 18.577 9.742 36.738 1.00 0.00 C ATOM 733 C4' DG B 24 19.654 9.065 35.881 1.00 0.00 C ATOM 734 O4' DG B 24 20.688 9.993 35.548 1.00 0.00 O ATOM 735 C3' DG B 24 20.319 7.862 36.583 1.00 0.00 C ATOM 736 O3' DG B 24 20.430 6.738 35.711 1.00 0.00 O ATOM 737 C2' DG B 24 21.703 8.417 36.898 1.00 0.00 C ATOM 738 C1' DG B 24 21.919 9.302 35.672 1.00 0.00 C ATOM 739 N9 DG B 24 23.087 10.209 35.791 1.00 0.00 N ATOM 740 C8 DG B 24 23.533 10.912 36.886 1.00 0.00 C ATOM 741 N7 DG B 24 24.691 11.495 36.715 1.00 0.00 N ATOM 742 C5 DG B 24 25.041 11.155 35.399 1.00 0.00 C ATOM 743 C6 DG B 24 26.221 11.433 34.616 1.00 0.00 C ATOM 744 O6 DG B 24 27.244 12.041 34.939 1.00 0.00 O ATOM 745 N1 DG B 24 26.178 10.903 33.339 1.00 0.00 N ATOM 746 C2 DG B 24 25.148 10.152 32.872 1.00 0.00 C ATOM 747 N2 DG B 24 25.251 9.658 31.665 1.00 0.00 N ATOM 748 N3 DG B 24 24.057 9.843 33.565 1.00 0.00 N ATOM 749 C4 DG B 24 24.054 10.382 34.824 1.00 0.00 C ATOM 0 H5' DG B 24 18.207 10.626 36.219 1.00 0.00 H new ATOM 0 H5'' DG B 24 17.731 9.064 36.855 1.00 0.00 H new ATOM 0 H4' DG B 24 19.137 8.709 34.990 1.00 0.00 H new ATOM 0 H3' DG B 24 19.760 7.504 37.448 1.00 0.00 H new ATOM 0 H2' DG B 24 21.723 8.983 37.829 1.00 0.00 H new ATOM 0 H2'' DG B 24 22.456 7.634 36.985 1.00 0.00 H new ATOM 0 HO3' DG B 24 20.857 5.995 36.187 1.00 0.00 H new ATOM 0 H1' DG B 24 22.168 8.722 34.784 1.00 0.00 H new ATOM 0 H8 DG B 24 22.975 10.977 37.808 1.00 0.00 H new ATOM 0 H1 DG B 24 26.963 11.086 32.714 1.00 0.00 H new ATOM 0 H21 DG B 24 24.497 9.089 31.281 1.00 0.00 H new ATOM 0 H22 DG B 24 26.086 9.842 31.108 1.00 0.00 H new TER 762 DG B 24 HETATM 763 O81 9TK A 101 23.323 30.338 38.582 1.00 0.00 O HETATM 764 C81 9TK A 101 23.966 29.768 37.704 1.00 0.00 C HETATM 765 C83 9TK A 101 21.928 27.289 35.972 1.00 0.00 C HETATM 766 N81 9TK A 101 22.089 28.269 36.924 1.00 0.00 N HETATM 767 C88 9TK A 101 21.015 28.743 37.805 1.00 0.00 C HETATM 768 C82 9TK A 101 23.418 28.678 36.829 1.00 0.00 C HETATM 769 N82 9TK A 101 24.072 27.996 35.892 1.00 0.00 N HETATM 770 C84 9TK A 101 23.141 27.135 35.364 1.00 0.00 C HETATM 776 N PYB A 102 25.289 30.102 37.420 1.00 0.00 N HETATM 777 CA PYB A 102 26.084 31.035 38.076 1.00 0.00 C HETATM 778 CB1 PYB A 102 27.379 31.441 37.661 1.00 0.00 C HETATM 779 CB PYB A 102 25.752 31.711 39.220 1.00 0.00 C HETATM 780 CG1 PYB A 102 27.822 32.382 38.564 1.00 0.00 C HETATM 781 NG2 PYB A 102 26.794 32.582 39.498 1.00 0.00 N HETATM 782 CD PYB A 102 26.699 33.604 40.551 1.00 0.00 C HETATM 783 C PYB A 102 29.128 33.088 38.693 1.00 0.00 C HETATM 784 O PYB A 102 29.382 33.770 39.677 1.00 0.00 O HETATM 0 HD3 PYB A 102 25.872 34.279 40.329 1.00 0.00 H new HETATM 0 HD2 PYB A 102 26.525 33.121 41.512 1.00 0.00 H new HETATM 0 HD1 PYB A 102 27.629 34.171 40.593 1.00 0.00 H new HETATM 0 HB1 PYB A 102 27.922 31.076 36.789 1.00 0.00 H new HETATM 0 HB PYB A 102 24.839 31.587 39.803 1.00 0.00 H new HETATM 0 H PYB A 102 25.628 29.651 36.570 1.00 0.00 H new HETATM 791 N PYB A 103 30.041 32.956 37.650 1.00 0.00 N HETATM 792 CA PYB A 103 31.339 33.475 37.660 1.00 0.00 C HETATM 793 CB1 PYB A 103 32.156 33.762 36.530 1.00 0.00 C HETATM 794 CB PYB A 103 32.027 33.836 38.788 1.00 0.00 C HETATM 795 CG1 PYB A 103 33.309 34.366 36.990 1.00 0.00 C HETATM 796 NG2 PYB A 103 33.227 34.397 38.391 1.00 0.00 N HETATM 797 CD PYB A 103 34.194 34.924 39.366 1.00 0.00 C HETATM 798 C PYB A 103 34.511 34.916 36.288 1.00 0.00 C HETATM 799 O PYB A 103 35.454 35.381 36.911 1.00 0.00 O HETATM 0 HD3 PYB A 103 33.729 35.722 39.945 1.00 0.00 H new HETATM 0 HD2 PYB A 103 34.507 34.124 40.037 1.00 0.00 H new HETATM 0 HD1 PYB A 103 35.064 35.317 38.840 1.00 0.00 H new HETATM 0 HB1 PYB A 103 31.915 33.544 35.490 1.00 0.00 H new HETATM 0 HB PYB A 103 31.689 33.704 39.816 1.00 0.00 H new HETATM 0 H PYB A 103 29.584 32.742 36.763 1.00 0.00 H new HETATM 806 N PYB A 104 34.527 34.891 34.895 1.00 0.00 N HETATM 807 CA PYB A 104 35.583 35.318 34.078 1.00 0.00 C HETATM 808 CB1 PYB A 104 35.573 35.352 32.658 1.00 0.00 C HETATM 809 CB PYB A 104 36.808 35.782 34.499 1.00 0.00 C HETATM 810 CG1 PYB A 104 36.785 35.862 32.237 1.00 0.00 C HETATM 811 NG2 PYB A 104 37.542 36.135 33.378 1.00 0.00 N HETATM 812 CD PYB A 104 38.908 36.678 33.452 1.00 0.00 C HETATM 813 C PYB A 104 37.343 36.068 30.873 1.00 0.00 C HETATM 814 O PYB A 104 38.433 36.569 30.638 1.00 0.00 O HETATM 0 HD3 PYB A 104 38.901 37.604 34.026 1.00 0.00 H new HETATM 0 HD2 PYB A 104 39.561 35.954 33.939 1.00 0.00 H new HETATM 0 HD1 PYB A 104 39.275 36.878 32.445 1.00 0.00 H new HETATM 0 HB1 PYB A 104 34.753 35.032 32.015 1.00 0.00 H new HETATM 0 HB PYB A 104 37.143 35.859 35.534 1.00 0.00 H new HETATM 0 H PYB A 104 33.656 34.568 34.475 1.00 0.00 H new HETATM 821 N ABU A 105 36.570 35.601 29.838 1.00 0.00 N HETATM 822 CA ABU A 105 37.109 35.516 28.471 1.00 0.00 C HETATM 823 CB ABU A 105 36.294 34.616 27.521 1.00 0.00 C HETATM 824 CG ABU A 105 36.279 33.105 27.885 1.00 0.00 C HETATM 825 CD ABU A 105 37.168 32.691 29.068 1.00 0.00 C HETATM 826 OE1 ABU A 105 38.384 32.625 28.974 1.00 0.00 O HETATM 0 H ABU A 105 35.603 35.291 29.936 1.00 0.00 H new HETATM 0 HB1 ABU A 105 35.266 34.977 27.498 1.00 0.00 H new HETATM 0 HB2 ABU A 105 36.693 34.726 26.513 1.00 0.00 H new HETATM 0 HG1 ABU A 105 35.679 32.561 27.155 1.00 0.00 H new HETATM 0 HG2 ABU A 105 37.298 32.719 27.877 1.00 0.00 H new HETATM 0 HE2 ABU A 105 35.849 32.974 28.878 1.00 0.00 H new HETATM 834 N IMT A 106 36.488 32.448 30.236 1.00 0.00 N HETATM 835 CA IMT A 106 36.960 32.406 31.520 1.00 0.00 C HETATM 836 NB1 IMT A 106 36.178 32.133 32.611 1.00 0.00 N HETATM 837 CB IMT A 106 38.237 32.720 31.894 1.00 0.00 C HETATM 838 CG1 IMT A 106 36.982 32.271 33.664 1.00 0.00 C HETATM 839 NG2 IMT A 106 38.273 32.618 33.266 1.00 0.00 N HETATM 840 CD IMT A 106 39.485 32.816 34.078 1.00 0.00 C HETATM 841 C IMT A 106 36.641 32.104 35.125 1.00 0.00 C HETATM 842 O IMT A 106 37.436 32.344 36.029 1.00 0.00 O HETATM 0 HN2 IMT A 106 35.501 32.270 30.049 1.00 0.00 H new HETATM 0 HD3 IMT A 106 40.243 32.091 33.783 1.00 0.00 H new HETATM 0 HD2 IMT A 106 39.867 33.825 33.921 1.00 0.00 H new HETATM 0 HD1 IMT A 106 39.243 32.679 35.132 1.00 0.00 H new HETATM 0 HB IMT A 106 39.062 32.996 31.237 1.00 0.00 H new HETATM 848 N PYB A 107 35.349 31.642 35.398 1.00 0.00 N HETATM 849 CA PYB A 107 34.777 31.425 36.656 1.00 0.00 C HETATM 850 CB1 PYB A 107 33.504 30.835 36.911 1.00 0.00 C HETATM 851 CB PYB A 107 35.348 31.752 37.857 1.00 0.00 C HETATM 852 CG1 PYB A 107 33.330 30.785 38.280 1.00 0.00 C HETATM 853 NG2 PYB A 107 34.483 31.342 38.858 1.00 0.00 N HETATM 854 CD PYB A 107 34.835 31.474 40.282 1.00 0.00 C HETATM 855 C PYB A 107 32.189 30.338 39.143 1.00 0.00 C HETATM 856 O PYB A 107 32.254 30.434 40.361 1.00 0.00 O HETATM 0 HD3 PYB A 107 35.740 30.903 40.488 1.00 0.00 H new HETATM 0 HD2 PYB A 107 35.007 32.524 40.518 1.00 0.00 H new HETATM 0 HD1 PYB A 107 34.018 31.093 40.895 1.00 0.00 H new HETATM 0 HB1 PYB A 107 32.795 30.486 36.160 1.00 0.00 H new HETATM 0 HB PYB A 107 36.309 32.246 37.999 1.00 0.00 H new HETATM 0 H PYB A 107 34.845 31.369 34.555 1.00 0.00 H new HETATM 863 N PYB A 108 31.042 29.807 38.549 1.00 0.00 N HETATM 864 CA PYB A 108 29.838 29.573 39.234 1.00 0.00 C HETATM 865 CB1 PYB A 108 28.757 28.726 38.851 1.00 0.00 C HETATM 866 CB PYB A 108 29.504 30.162 40.427 1.00 0.00 C HETATM 867 CG1 PYB A 108 27.821 28.749 39.872 1.00 0.00 C HETATM 868 NG2 PYB A 108 28.272 29.678 40.819 1.00 0.00 N HETATM 869 CD PYB A 108 27.587 30.183 42.020 1.00 0.00 C HETATM 870 C PYB A 108 26.518 28.037 40.086 1.00 0.00 C HETATM 871 O PYB A 108 25.893 28.142 41.132 1.00 0.00 O HETATM 0 HD3 PYB A 108 28.210 30.005 42.896 1.00 0.00 H new HETATM 0 HD2 PYB A 108 27.407 31.253 41.914 1.00 0.00 H new HETATM 0 HD1 PYB A 108 26.635 29.666 42.141 1.00 0.00 H new HETATM 0 HB1 PYB A 108 28.681 28.162 37.922 1.00 0.00 H new HETATM 0 HB PYB A 108 30.108 30.888 40.972 1.00 0.00 H new HETATM 0 H PYB A 108 31.222 29.340 37.660 1.00 0.00 H new HETATM 878 N PYB A 109 26.033 27.234 39.065 1.00 0.00 N HETATM 879 CA PYB A 109 24.772 26.621 39.037 1.00 0.00 C HETATM 880 CB1 PYB A 109 24.329 25.744 38.023 1.00 0.00 C HETATM 881 CB PYB A 109 23.743 26.775 39.937 1.00 0.00 C HETATM 882 CG1 PYB A 109 23.047 25.344 38.329 1.00 0.00 C HETATM 883 NG2 PYB A 109 22.683 25.979 39.517 1.00 0.00 N HETATM 884 CD PYB A 109 21.412 25.863 40.249 1.00 0.00 C HETATM 885 C PYB A 109 22.116 24.479 37.557 1.00 0.00 C HETATM 886 O PYB A 109 20.938 24.285 37.822 1.00 0.00 O HETATM 0 HD3 PYB A 109 21.603 25.477 41.250 1.00 0.00 H new HETATM 0 HD2 PYB A 109 20.943 26.844 40.322 1.00 0.00 H new HETATM 0 HD1 PYB A 109 20.747 25.182 39.718 1.00 0.00 H new HETATM 0 HB1 PYB A 109 24.903 25.436 37.149 1.00 0.00 H new HETATM 0 HB PYB A 109 23.756 27.409 40.823 1.00 0.00 H new HETATM 0 H PYB A 109 26.703 27.057 38.317 1.00 0.00 H new HETATM 893 C01 9T8 A 110 13.798 23.263 32.022 1.00 0.00 C HETATM 894 N02 9T8 A 110 19.424 23.282 33.848 1.00 0.00 N HETATM 895 C03 9T8 A 110 15.693 22.430 33.400 1.00 0.00 C HETATM 896 C05 9T8 A 110 17.995 23.542 33.660 1.00 0.00 C HETATM 897 C06 9T8 A 110 20.372 24.272 33.959 1.00 0.00 C HETATM 898 C07 9T8 A 110 21.791 23.755 34.127 1.00 0.00 C HETATM 899 C04 9T8 A 110 17.204 22.220 33.627 1.00 0.00 C HETATM 900 N01 9T8 A 110 15.316 23.076 32.067 1.00 0.00 N HETATM 901 C02 9T8 A 110 15.745 22.200 30.885 1.00 0.00 C HETATM 902 N03 9T8 A 110 22.705 23.912 36.454 1.00 0.00 N HETATM 903 C08 9T8 A 110 22.025 23.047 35.482 1.00 0.00 C HETATM 904 O01 9T8 A 110 20.083 25.455 33.906 1.00 0.00 O