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 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl -30:sc= -0.737 (180deg=-1.33!) USER MOD Single : A 10 DT C7 :methyl 150:sc= -0.356 (180deg=-0.356) 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= -0.32 (180deg=-0.447) USER MOD Single : B 18 DT C7 :methyl -30:sc= -1.01 (180deg=-1.12) 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 27.438 8.215 28.389 1.00 0.00 N HETATM 2 C2 DCZ A 1 26.140 7.772 28.669 1.00 0.00 C HETATM 3 N3 DCZ A 1 25.543 8.067 29.845 1.00 0.00 N HETATM 4 C4 DCZ A 1 26.200 8.800 30.716 1.00 0.00 C HETATM 5 C5 DCZ A 1 27.516 9.296 30.492 1.00 0.00 C HETATM 6 C6 DCZ A 1 28.109 8.985 29.310 1.00 0.00 C HETATM 7 O2 DCZ A 1 25.481 7.119 27.859 1.00 0.00 O HETATM 8 N4 DCZ A 1 25.554 9.055 31.818 1.00 0.00 N HETATM 9 C1' DCZ A 1 28.010 7.933 27.041 1.00 0.00 C HETATM 10 C2' DCZ A 1 27.845 9.136 26.116 1.00 0.00 C HETATM 11 C3' DCZ A 1 29.256 9.635 25.850 1.00 0.00 C HETATM 12 C4' DCZ A 1 30.079 8.364 26.098 1.00 0.00 C HETATM 13 O4' DCZ A 1 29.396 7.649 27.122 1.00 0.00 O HETATM 14 O3' DCZ A 1 29.398 10.110 24.516 1.00 0.00 O HETATM 15 C5' DCZ A 1 31.532 8.631 26.509 1.00 0.00 C HETATM 16 O5' DCZ A 1 31.641 9.394 27.715 1.00 0.00 O HETATM 0 HO51 DCZ A 1 32.587 9.533 27.930 1.00 0.00 H new HETATM 0 HN42 DCZ A 1 25.992 9.618 32.547 1.00 0.00 H new HETATM 0 HN41 DCZ A 1 24.610 8.692 31.952 1.00 0.00 H new HETATM 0 H5'2 DCZ A 1 32.047 7.680 26.640 1.00 0.00 H new HETATM 0 H5'1 DCZ A 1 32.040 9.161 25.703 1.00 0.00 H new HETATM 0 H2'2 DCZ A 1 27.347 8.854 25.189 1.00 0.00 H new HETATM 0 H2'1 DCZ A 1 27.236 9.910 26.582 1.00 0.00 H new HETATM 0 H6 DCZ A 1 29.114 9.345 29.092 1.00 0.00 H new HETATM 0 H5 DCZ A 1 28.028 9.902 31.240 1.00 0.00 H new HETATM 0 H4' DCZ A 1 30.156 7.801 25.168 1.00 0.00 H new HETATM 0 H3' DCZ A 1 29.556 10.481 26.468 1.00 0.00 H new HETATM 0 H1' DCZ A 1 27.471 7.072 26.647 1.00 0.00 H new ATOM 29 P DG A 2 28.802 11.531 24.042 1.00 0.00 P ATOM 30 OP1 DG A 2 29.417 11.861 22.731 1.00 0.00 O ATOM 31 OP2 DG A 2 28.950 12.499 25.156 1.00 0.00 O ATOM 32 O5' DG A 2 27.221 11.285 23.815 1.00 0.00 O ATOM 33 C5' DG A 2 26.721 10.474 22.755 1.00 0.00 C ATOM 34 C4' DG A 2 25.241 10.745 22.420 1.00 0.00 C ATOM 35 O4' DG A 2 24.359 10.325 23.465 1.00 0.00 O ATOM 36 C3' DG A 2 24.974 12.232 22.149 1.00 0.00 C ATOM 37 O3' DG A 2 24.069 12.378 21.059 1.00 0.00 O ATOM 38 C2' DG A 2 24.405 12.686 23.492 1.00 0.00 C ATOM 39 C1' DG A 2 23.671 11.446 24.012 1.00 0.00 C ATOM 40 N9 DG A 2 23.713 11.356 25.495 1.00 0.00 N ATOM 41 C8 DG A 2 24.836 11.359 26.285 1.00 0.00 C ATOM 42 N7 DG A 2 24.606 11.267 27.566 1.00 0.00 N ATOM 43 C5 DG A 2 23.207 11.230 27.636 1.00 0.00 C ATOM 44 C6 DG A 2 22.326 11.182 28.771 1.00 0.00 C ATOM 45 O6 DG A 2 22.609 11.145 29.966 1.00 0.00 O ATOM 46 N1 DG A 2 20.988 11.187 28.438 1.00 0.00 N ATOM 47 C2 DG A 2 20.532 11.194 27.163 1.00 0.00 C ATOM 48 N2 DG A 2 19.233 11.193 27.014 1.00 0.00 N ATOM 49 N3 DG A 2 21.306 11.243 26.075 1.00 0.00 N ATOM 50 C4 DG A 2 22.646 11.266 26.373 1.00 0.00 C ATOM 0 H5' DG A 2 26.838 9.424 23.025 1.00 0.00 H new ATOM 0 H5'' DG A 2 27.324 10.643 21.863 1.00 0.00 H new ATOM 0 H4' DG A 2 25.043 10.162 21.520 1.00 0.00 H new ATOM 0 H3' DG A 2 25.839 12.822 21.848 1.00 0.00 H new ATOM 0 H2' DG A 2 25.194 13.001 24.175 1.00 0.00 H new ATOM 0 H2'' DG A 2 23.728 13.532 23.375 1.00 0.00 H new ATOM 0 H1' DG A 2 22.621 11.486 23.721 1.00 0.00 H new ATOM 0 H8 DG A 2 25.833 11.432 25.877 1.00 0.00 H new ATOM 0 H1 DG A 2 20.304 11.185 29.194 1.00 0.00 H new ATOM 0 H21 DG A 2 18.827 11.198 26.078 1.00 0.00 H new ATOM 0 H22 DG A 2 18.626 11.187 27.833 1.00 0.00 H new ATOM 62 P DA A 3 23.832 13.796 20.326 1.00 0.00 P ATOM 63 OP1 DA A 3 23.230 13.532 18.994 1.00 0.00 O ATOM 64 OP2 DA A 3 25.079 14.599 20.401 1.00 0.00 O ATOM 65 O5' DA A 3 22.727 14.484 21.268 1.00 0.00 O ATOM 66 C5' DA A 3 21.382 14.025 21.272 1.00 0.00 C ATOM 67 C4' DA A 3 20.602 14.485 22.510 1.00 0.00 C ATOM 68 O4' DA A 3 21.089 13.881 23.704 1.00 0.00 O ATOM 69 C3' DA A 3 20.689 15.987 22.793 1.00 0.00 C ATOM 70 O3' DA A 3 19.823 16.782 21.991 1.00 0.00 O ATOM 71 C2' DA A 3 20.259 16.002 24.256 1.00 0.00 C ATOM 72 C1' DA A 3 20.495 14.590 24.779 1.00 0.00 C ATOM 73 N9 DA A 3 21.317 14.601 26.009 1.00 0.00 N ATOM 74 C8 DA A 3 22.682 14.674 26.141 1.00 0.00 C ATOM 75 N7 DA A 3 23.103 14.667 27.381 1.00 0.00 N ATOM 76 C5 DA A 3 21.909 14.625 28.119 1.00 0.00 C ATOM 77 C6 DA A 3 21.577 14.604 29.497 1.00 0.00 C ATOM 78 N6 DA A 3 22.447 14.597 30.487 1.00 0.00 N ATOM 79 N1 DA A 3 20.307 14.598 29.901 1.00 0.00 N ATOM 80 C2 DA A 3 19.355 14.589 28.978 1.00 0.00 C ATOM 81 N3 DA A 3 19.505 14.600 27.659 1.00 0.00 N ATOM 82 C4 DA A 3 20.818 14.611 27.291 1.00 0.00 C ATOM 0 H5' DA A 3 21.374 12.936 21.227 1.00 0.00 H new ATOM 0 H5'' DA A 3 20.877 14.385 20.375 1.00 0.00 H new ATOM 0 H4' DA A 3 19.580 14.195 22.266 1.00 0.00 H new ATOM 0 H3' DA A 3 21.668 16.413 22.575 1.00 0.00 H new ATOM 0 H2' DA A 3 20.837 16.730 24.825 1.00 0.00 H new ATOM 0 H2'' DA A 3 19.210 16.283 24.351 1.00 0.00 H new ATOM 0 H1' DA A 3 19.570 14.100 25.083 1.00 0.00 H new ATOM 0 H8 DA A 3 23.351 14.732 25.295 1.00 0.00 H new ATOM 0 H61 DA A 3 22.120 14.582 31.453 1.00 0.00 H new ATOM 0 H62 DA A 3 23.447 14.607 30.287 1.00 0.00 H new ATOM 0 H2 DA A 3 18.338 14.571 29.342 1.00 0.00 H new ATOM 94 P DT A 4 19.871 18.399 22.037 1.00 0.00 P ATOM 95 OP1 DT A 4 19.014 18.906 20.934 1.00 0.00 O ATOM 96 OP2 DT A 4 21.290 18.829 22.090 1.00 0.00 O ATOM 97 O5' DT A 4 19.176 18.782 23.445 1.00 0.00 O ATOM 98 C5' DT A 4 17.776 18.618 23.637 1.00 0.00 C ATOM 99 C4' DT A 4 17.334 18.696 25.106 1.00 0.00 C ATOM 100 O4' DT A 4 17.995 17.728 25.918 1.00 0.00 O ATOM 101 C3' DT A 4 17.606 20.030 25.813 1.00 0.00 C ATOM 102 O3' DT A 4 16.836 21.136 25.327 1.00 0.00 O ATOM 103 C2' DT A 4 17.367 19.568 27.252 1.00 0.00 C ATOM 104 C1' DT A 4 18.022 18.188 27.262 1.00 0.00 C ATOM 105 N1 DT A 4 19.405 18.227 27.821 1.00 0.00 N ATOM 106 C2 DT A 4 19.529 18.100 29.209 1.00 0.00 C ATOM 107 O2 DT A 4 18.573 18.085 29.984 1.00 0.00 O ATOM 108 N3 DT A 4 20.802 17.989 29.704 1.00 0.00 N ATOM 109 C4 DT A 4 21.967 18.047 28.980 1.00 0.00 C ATOM 110 O4 DT A 4 23.032 17.894 29.579 1.00 0.00 O ATOM 111 C5 DT A 4 21.778 18.270 27.544 1.00 0.00 C ATOM 112 C7 DT A 4 22.981 18.356 26.623 1.00 0.00 C ATOM 113 C6 DT A 4 20.523 18.359 27.018 1.00 0.00 C ATOM 0 H5' DT A 4 17.474 17.654 23.228 1.00 0.00 H new ATOM 0 H5'' DT A 4 17.249 19.385 23.069 1.00 0.00 H new ATOM 0 H4' DT A 4 16.259 18.534 25.020 1.00 0.00 H new ATOM 0 H3' DT A 4 18.586 20.480 25.655 1.00 0.00 H new ATOM 0 H2' DT A 4 17.825 20.241 27.977 1.00 0.00 H new ATOM 0 H2'' DT A 4 16.305 19.516 27.492 1.00 0.00 H new ATOM 0 H1' DT A 4 17.481 17.503 27.915 1.00 0.00 H new ATOM 0 H3 DT A 4 20.893 17.849 30.710 1.00 0.00 H new ATOM 0 H71 DT A 4 22.706 17.996 25.631 1.00 0.00 H new ATOM 0 H72 DT A 4 23.313 19.392 26.554 1.00 0.00 H new ATOM 0 H73 DT A 4 23.789 17.742 27.021 1.00 0.00 H new ATOM 0 H6 DT A 4 20.401 18.535 25.960 1.00 0.00 H new ATOM 126 P DG A 5 15.267 21.389 25.623 1.00 0.00 P ATOM 127 OP1 DG A 5 14.556 20.093 25.511 1.00 0.00 O ATOM 128 OP2 DG A 5 14.826 22.522 24.775 1.00 0.00 O ATOM 129 O5' DG A 5 15.197 21.870 27.156 1.00 0.00 O ATOM 130 C5' DG A 5 14.070 21.593 27.980 1.00 0.00 C ATOM 131 C4' DG A 5 14.081 22.309 29.345 1.00 0.00 C ATOM 132 O4' DG A 5 15.299 22.026 30.024 1.00 0.00 O ATOM 133 C3' DG A 5 14.001 23.843 29.247 1.00 0.00 C ATOM 134 O3' DG A 5 13.544 24.468 30.441 1.00 0.00 O ATOM 135 C2' DG A 5 15.466 24.212 29.086 1.00 0.00 C ATOM 136 C1' DG A 5 16.099 23.203 30.051 1.00 0.00 C ATOM 137 N9 DG A 5 17.499 22.829 29.757 1.00 0.00 N ATOM 138 C8 DG A 5 18.172 22.731 28.560 1.00 0.00 C ATOM 139 N7 DG A 5 19.370 22.208 28.662 1.00 0.00 N ATOM 140 C5 DG A 5 19.509 21.967 30.037 1.00 0.00 C ATOM 141 C6 DG A 5 20.580 21.404 30.821 1.00 0.00 C ATOM 142 O6 DG A 5 21.666 20.952 30.458 1.00 0.00 O ATOM 143 N1 DG A 5 20.335 21.418 32.180 1.00 0.00 N ATOM 144 C2 DG A 5 19.219 21.937 32.734 1.00 0.00 C ATOM 145 N2 DG A 5 19.215 22.108 34.022 1.00 0.00 N ATOM 146 N3 DG A 5 18.175 22.397 32.059 1.00 0.00 N ATOM 147 C4 DG A 5 18.382 22.389 30.708 1.00 0.00 C ATOM 0 H5' DG A 5 14.016 20.518 28.149 1.00 0.00 H new ATOM 0 H5'' DG A 5 13.165 21.877 27.443 1.00 0.00 H new ATOM 0 H4' DG A 5 13.199 21.940 29.868 1.00 0.00 H new ATOM 0 H3' DG A 5 13.314 24.154 28.460 1.00 0.00 H new ATOM 0 H2' DG A 5 15.818 24.087 28.062 1.00 0.00 H new ATOM 0 H2'' DG A 5 15.670 25.245 29.369 1.00 0.00 H new ATOM 0 H1' DG A 5 16.131 23.688 31.026 1.00 0.00 H new ATOM 0 H8 DG A 5 17.751 23.056 27.620 1.00 0.00 H new ATOM 0 H1 DG A 5 21.037 21.013 32.800 1.00 0.00 H new ATOM 0 H21 DG A 5 18.392 22.497 34.482 1.00 0.00 H new ATOM 0 H22 DG A 5 20.035 21.853 34.573 1.00 0.00 H new ATOM 159 P DT A 6 11.984 24.657 30.768 1.00 0.00 P ATOM 160 OP1 DT A 6 11.387 23.328 31.053 1.00 0.00 O ATOM 161 OP2 DT A 6 11.387 25.493 29.697 1.00 0.00 O ATOM 162 O5' DT A 6 11.994 25.535 32.127 1.00 0.00 O ATOM 163 C5' DT A 6 12.358 24.991 33.394 1.00 0.00 C ATOM 164 C4' DT A 6 13.661 25.565 33.979 1.00 0.00 C ATOM 165 O4' DT A 6 14.826 25.107 33.313 1.00 0.00 O ATOM 166 C3' DT A 6 13.795 27.090 33.975 1.00 0.00 C ATOM 167 O3' DT A 6 13.088 27.711 35.044 1.00 0.00 O ATOM 168 C2' DT A 6 15.307 27.251 34.129 1.00 0.00 C ATOM 169 C1' DT A 6 15.890 25.877 33.845 1.00 0.00 C ATOM 170 N1 DT A 6 17.081 25.878 32.965 1.00 0.00 N ATOM 171 C2 DT A 6 18.293 25.403 33.490 1.00 0.00 C ATOM 172 O2 DT A 6 18.471 25.111 34.672 1.00 0.00 O ATOM 173 N3 DT A 6 19.333 25.269 32.604 1.00 0.00 N ATOM 174 C4 DT A 6 19.256 25.528 31.254 1.00 0.00 C ATOM 175 O4 DT A 6 20.185 25.177 30.537 1.00 0.00 O ATOM 176 C5 DT A 6 18.037 26.206 30.817 1.00 0.00 C ATOM 177 C7 DT A 6 17.927 26.749 29.404 1.00 0.00 C ATOM 178 C6 DT A 6 16.993 26.347 31.673 1.00 0.00 C ATOM 0 H5' DT A 6 12.463 23.910 33.296 1.00 0.00 H new ATOM 0 H5'' DT A 6 11.547 25.170 34.100 1.00 0.00 H new ATOM 0 H4' DT A 6 13.586 25.204 35.005 1.00 0.00 H new ATOM 0 H3' DT A 6 13.374 27.563 33.088 1.00 0.00 H new ATOM 0 H2' DT A 6 15.696 27.994 33.433 1.00 0.00 H new ATOM 0 H2'' DT A 6 15.566 27.588 35.133 1.00 0.00 H new ATOM 0 H1' DT A 6 16.280 25.450 34.769 1.00 0.00 H new ATOM 0 H3 DT A 6 20.230 24.954 32.974 1.00 0.00 H new ATOM 0 H71 DT A 6 18.916 27.036 29.047 1.00 0.00 H new ATOM 0 H72 DT A 6 17.514 25.981 28.750 1.00 0.00 H new ATOM 0 H73 DT A 6 17.272 27.620 29.399 1.00 0.00 H new ATOM 0 H6 DT A 6 16.087 26.830 31.339 1.00 0.00 H new ATOM 191 P DA A 7 13.087 29.316 35.259 1.00 0.00 P ATOM 192 OP1 DA A 7 11.996 29.645 36.212 1.00 0.00 O ATOM 193 OP2 DA A 7 13.088 29.971 33.927 1.00 0.00 O ATOM 194 O5' DA A 7 14.499 29.642 35.975 1.00 0.00 O ATOM 195 C5' DA A 7 14.812 29.114 37.262 1.00 0.00 C ATOM 196 C4' DA A 7 16.289 29.284 37.658 1.00 0.00 C ATOM 197 O4' DA A 7 17.147 28.665 36.700 1.00 0.00 O ATOM 198 C3' DA A 7 16.734 30.749 37.805 1.00 0.00 C ATOM 199 O3' DA A 7 17.418 30.911 39.044 1.00 0.00 O ATOM 200 C2' DA A 7 17.621 30.934 36.577 1.00 0.00 C ATOM 201 C1' DA A 7 18.212 29.539 36.369 1.00 0.00 C ATOM 202 N9 DA A 7 18.614 29.307 34.961 1.00 0.00 N ATOM 203 C8 DA A 7 17.870 29.567 33.834 1.00 0.00 C ATOM 204 N7 DA A 7 18.455 29.257 32.710 1.00 0.00 N ATOM 205 C5 DA A 7 19.697 28.766 33.137 1.00 0.00 C ATOM 206 C6 DA A 7 20.832 28.254 32.469 1.00 0.00 C ATOM 207 N6 DA A 7 20.919 28.135 31.162 1.00 0.00 N ATOM 208 N1 DA A 7 21.900 27.815 33.135 1.00 0.00 N ATOM 209 C2 DA A 7 21.862 27.894 34.457 1.00 0.00 C ATOM 210 N3 DA A 7 20.881 28.349 35.235 1.00 0.00 N ATOM 211 C4 DA A 7 19.806 28.778 34.504 1.00 0.00 C ATOM 0 H5' DA A 7 14.560 28.054 37.281 1.00 0.00 H new ATOM 0 H5'' DA A 7 14.186 29.604 38.008 1.00 0.00 H new ATOM 0 H4' DA A 7 16.370 28.806 38.634 1.00 0.00 H new ATOM 0 H3' DA A 7 15.936 31.491 37.836 1.00 0.00 H new ATOM 0 H2' DA A 7 17.048 31.263 35.710 1.00 0.00 H new ATOM 0 H2'' DA A 7 18.397 31.680 36.748 1.00 0.00 H new ATOM 0 H1' DA A 7 19.110 29.395 36.970 1.00 0.00 H new ATOM 0 H8 DA A 7 16.879 29.994 33.876 1.00 0.00 H new ATOM 0 H61 DA A 7 21.767 27.757 30.740 1.00 0.00 H new ATOM 0 H62 DA A 7 20.138 28.420 30.571 1.00 0.00 H new ATOM 0 H2 DA A 7 22.744 27.543 34.972 1.00 0.00 H new ATOM 223 P DC A 8 17.980 32.337 39.557 1.00 0.00 P ATOM 224 OP1 DC A 8 17.944 32.334 41.041 1.00 0.00 O ATOM 225 OP2 DC A 8 17.289 33.428 38.827 1.00 0.00 O ATOM 226 O5' DC A 8 19.518 32.307 39.084 1.00 0.00 O ATOM 227 C5' DC A 8 20.408 31.333 39.613 1.00 0.00 C ATOM 228 C4' DC A 8 21.798 31.361 38.971 1.00 0.00 C ATOM 229 O4' DC A 8 21.680 31.048 37.588 1.00 0.00 O ATOM 230 C3' DC A 8 22.514 32.711 39.115 1.00 0.00 C ATOM 231 O3' DC A 8 23.770 32.540 39.770 1.00 0.00 O ATOM 232 C2' DC A 8 22.637 33.161 37.661 1.00 0.00 C ATOM 233 C1' DC A 8 22.565 31.864 36.850 1.00 0.00 C ATOM 234 N1 DC A 8 22.014 31.988 35.468 1.00 0.00 N ATOM 235 C2 DC A 8 22.693 31.401 34.389 1.00 0.00 C ATOM 236 O2 DC A 8 23.816 30.910 34.506 1.00 0.00 O ATOM 237 N3 DC A 8 22.131 31.348 33.150 1.00 0.00 N ATOM 238 C4 DC A 8 20.925 31.857 32.992 1.00 0.00 C ATOM 239 N4 DC A 8 20.412 31.766 31.800 1.00 0.00 N ATOM 240 C5 DC A 8 20.186 32.464 34.040 1.00 0.00 C ATOM 241 C6 DC A 8 20.764 32.519 35.266 1.00 0.00 C ATOM 0 H5' DC A 8 19.973 30.343 39.476 1.00 0.00 H new ATOM 0 H5'' DC A 8 20.509 31.491 40.687 1.00 0.00 H new ATOM 0 H4' DC A 8 22.401 30.623 39.499 1.00 0.00 H new ATOM 0 H3' DC A 8 21.997 33.448 39.729 1.00 0.00 H new ATOM 0 H2' DC A 8 21.833 33.845 37.388 1.00 0.00 H new ATOM 0 H2'' DC A 8 23.576 33.687 37.486 1.00 0.00 H new ATOM 0 H1' DC A 8 23.579 31.488 36.715 1.00 0.00 H new ATOM 0 H41 DC A 8 19.482 32.141 31.615 1.00 0.00 H new ATOM 0 H42 DC A 8 20.940 31.319 31.050 1.00 0.00 H new ATOM 0 H5 DC A 8 19.199 32.868 33.868 1.00 0.00 H new ATOM 0 H6 DC A 8 20.238 32.983 36.087 1.00 0.00 H new ATOM 253 P DA A 9 24.629 33.784 40.348 1.00 0.00 P ATOM 254 OP1 DA A 9 25.487 33.275 41.452 1.00 0.00 O ATOM 255 OP2 DA A 9 23.715 34.922 40.630 1.00 0.00 O ATOM 256 O5' DA A 9 25.581 34.202 39.120 1.00 0.00 O ATOM 257 C5' DA A 9 26.620 33.331 38.693 1.00 0.00 C ATOM 258 C4' DA A 9 27.076 33.588 37.252 1.00 0.00 C ATOM 259 O4' DA A 9 25.956 33.507 36.369 1.00 0.00 O ATOM 260 C3' DA A 9 27.752 34.949 37.022 1.00 0.00 C ATOM 261 O3' DA A 9 28.937 34.756 36.252 1.00 0.00 O ATOM 262 C2' DA A 9 26.652 35.713 36.291 1.00 0.00 C ATOM 263 C1' DA A 9 25.992 34.602 35.475 1.00 0.00 C ATOM 264 N9 DA A 9 24.615 34.936 35.042 1.00 0.00 N ATOM 265 C8 DA A 9 23.617 35.547 35.765 1.00 0.00 C ATOM 266 N7 DA A 9 22.480 35.675 35.133 1.00 0.00 N ATOM 267 C5 DA A 9 22.768 35.135 33.872 1.00 0.00 C ATOM 268 C6 DA A 9 22.038 34.977 32.670 1.00 0.00 C ATOM 269 N6 DA A 9 20.788 35.355 32.483 1.00 0.00 N ATOM 270 N1 DA A 9 22.585 34.400 31.604 1.00 0.00 N ATOM 271 C2 DA A 9 23.833 33.969 31.704 1.00 0.00 C ATOM 272 N3 DA A 9 24.650 34.053 32.746 1.00 0.00 N ATOM 273 C4 DA A 9 24.055 34.663 33.812 1.00 0.00 C ATOM 0 H5' DA A 9 26.278 32.300 38.780 1.00 0.00 H new ATOM 0 H5'' DA A 9 27.474 33.441 39.362 1.00 0.00 H new ATOM 0 H4' DA A 9 27.822 32.819 37.052 1.00 0.00 H new ATOM 0 H3' DA A 9 28.090 35.481 37.911 1.00 0.00 H new ATOM 0 H2' DA A 9 25.953 36.184 36.982 1.00 0.00 H new ATOM 0 H2'' DA A 9 27.054 36.503 35.657 1.00 0.00 H new ATOM 0 H1' DA A 9 26.543 34.414 34.554 1.00 0.00 H new ATOM 0 H8 DA A 9 23.762 35.894 36.777 1.00 0.00 H new ATOM 0 H61 DA A 9 20.338 35.201 31.580 1.00 0.00 H new ATOM 0 H62 DA A 9 20.271 35.801 33.241 1.00 0.00 H new ATOM 0 H2 DA A 9 24.237 33.488 30.826 1.00 0.00 H new ATOM 285 P DT A 10 29.932 35.962 35.872 1.00 0.00 P ATOM 286 OP1 DT A 10 31.285 35.385 35.637 1.00 0.00 O ATOM 287 OP2 DT A 10 29.789 37.046 36.883 1.00 0.00 O ATOM 288 O5' DT A 10 29.334 36.482 34.474 1.00 0.00 O ATOM 289 C5' DT A 10 29.530 35.726 33.289 1.00 0.00 C ATOM 290 C4' DT A 10 28.819 36.284 32.052 1.00 0.00 C ATOM 291 O4' DT A 10 27.413 36.110 32.096 1.00 0.00 O ATOM 292 C3' DT A 10 28.994 37.789 31.866 1.00 0.00 C ATOM 293 O3' DT A 10 30.311 38.125 31.458 1.00 0.00 O ATOM 294 C2' DT A 10 27.943 38.018 30.785 1.00 0.00 C ATOM 295 C1' DT A 10 26.860 36.987 31.122 1.00 0.00 C ATOM 296 N1 DT A 10 25.591 37.586 31.619 1.00 0.00 N ATOM 297 C2 DT A 10 24.592 37.835 30.674 1.00 0.00 C ATOM 298 O2 DT A 10 24.805 37.839 29.464 1.00 0.00 O ATOM 299 N3 DT A 10 23.336 38.111 31.158 1.00 0.00 N ATOM 300 C4 DT A 10 23.023 38.340 32.479 1.00 0.00 C ATOM 301 O4 DT A 10 21.852 38.565 32.778 1.00 0.00 O ATOM 302 C5 DT A 10 24.171 38.300 33.392 1.00 0.00 C ATOM 303 C7 DT A 10 24.003 38.691 34.850 1.00 0.00 C ATOM 304 C6 DT A 10 25.394 37.898 32.949 1.00 0.00 C ATOM 0 H5' DT A 10 29.184 34.707 33.462 1.00 0.00 H new ATOM 0 H5'' DT A 10 30.599 35.669 33.083 1.00 0.00 H new ATOM 0 H4' DT A 10 29.285 35.721 31.243 1.00 0.00 H new ATOM 0 H3' DT A 10 28.867 38.401 32.759 1.00 0.00 H new ATOM 0 H2' DT A 10 27.552 39.035 30.813 1.00 0.00 H new ATOM 0 H2'' DT A 10 28.352 37.861 29.787 1.00 0.00 H new ATOM 0 H1' DT A 10 26.582 36.462 30.208 1.00 0.00 H new ATOM 0 H3 DT A 10 22.572 38.149 30.483 1.00 0.00 H new ATOM 0 H71 DT A 10 24.715 38.135 35.460 1.00 0.00 H new ATOM 0 H72 DT A 10 24.184 39.760 34.963 1.00 0.00 H new ATOM 0 H73 DT A 10 22.989 38.459 35.174 1.00 0.00 H new ATOM 0 H6 DT A 10 26.217 37.823 33.644 1.00 0.00 H new ATOM 317 P DC A 11 30.993 39.529 31.870 1.00 0.00 P ATOM 318 OP1 DC A 11 32.444 39.442 31.566 1.00 0.00 O ATOM 319 OP2 DC A 11 30.571 39.901 33.243 1.00 0.00 O ATOM 320 O5' DC A 11 30.319 40.573 30.853 1.00 0.00 O ATOM 321 C5' DC A 11 30.648 40.570 29.469 1.00 0.00 C ATOM 322 C4' DC A 11 29.713 41.470 28.653 1.00 0.00 C ATOM 323 O4' DC A 11 28.371 40.999 28.797 1.00 0.00 O ATOM 324 C3' DC A 11 29.751 42.940 29.108 1.00 0.00 C ATOM 325 O3' DC A 11 29.692 43.838 28.012 1.00 0.00 O ATOM 326 C2' DC A 11 28.475 43.054 29.924 1.00 0.00 C ATOM 327 C1' DC A 11 27.549 42.091 29.167 1.00 0.00 C ATOM 328 N1 DC A 11 26.365 41.646 29.957 1.00 0.00 N ATOM 329 C2 DC A 11 25.116 41.581 29.321 1.00 0.00 C ATOM 330 O2 DC A 11 24.989 41.605 28.093 1.00 0.00 O ATOM 331 N3 DC A 11 23.977 41.495 30.047 1.00 0.00 N ATOM 332 C4 DC A 11 24.075 41.438 31.357 1.00 0.00 C ATOM 333 N4 DC A 11 22.950 41.425 32.006 1.00 0.00 N ATOM 334 C5 DC A 11 25.307 41.320 32.049 1.00 0.00 C ATOM 335 C6 DC A 11 26.441 41.413 31.312 1.00 0.00 C ATOM 0 H5' DC A 11 30.595 39.551 29.086 1.00 0.00 H new ATOM 0 H5'' DC A 11 31.677 40.906 29.341 1.00 0.00 H new ATOM 0 H4' DC A 11 30.052 41.427 27.618 1.00 0.00 H new ATOM 0 H3' DC A 11 30.666 43.189 29.645 1.00 0.00 H new ATOM 0 H2' DC A 11 28.622 42.753 30.961 1.00 0.00 H new ATOM 0 H2'' DC A 11 28.086 44.072 29.939 1.00 0.00 H new ATOM 0 H1' DC A 11 27.108 42.592 28.305 1.00 0.00 H new ATOM 0 H41 DC A 11 22.950 41.382 33.025 1.00 0.00 H new ATOM 0 H42 DC A 11 22.067 41.458 31.497 1.00 0.00 H new ATOM 0 H5 DC A 11 25.340 41.163 33.117 1.00 0.00 H new ATOM 0 H6 DC A 11 27.404 41.304 31.788 1.00 0.00 H new ATOM 347 P DG A 12 30.999 44.637 27.537 1.00 0.00 P ATOM 348 OP1 DG A 12 32.130 43.681 27.414 1.00 0.00 O ATOM 349 OP2 DG A 12 31.152 45.830 28.408 1.00 0.00 O ATOM 350 O5' DG A 12 30.580 45.137 26.069 1.00 0.00 O ATOM 351 C5' DG A 12 30.432 44.228 24.982 1.00 0.00 C ATOM 352 C4' DG A 12 29.094 44.404 24.242 1.00 0.00 C ATOM 353 O4' DG A 12 28.016 43.960 25.068 1.00 0.00 O ATOM 354 C3' DG A 12 28.800 45.862 23.839 1.00 0.00 C ATOM 355 O3' DG A 12 28.180 45.939 22.556 1.00 0.00 O ATOM 356 C2' DG A 12 27.818 46.289 24.925 1.00 0.00 C ATOM 357 C1' DG A 12 27.040 44.988 25.134 1.00 0.00 C ATOM 358 N9 DG A 12 26.305 44.948 26.421 1.00 0.00 N ATOM 359 C8 DG A 12 26.748 45.294 27.675 1.00 0.00 C ATOM 360 N7 DG A 12 25.841 45.204 28.613 1.00 0.00 N ATOM 361 C5 DG A 12 24.701 44.765 27.924 1.00 0.00 C ATOM 362 C6 DG A 12 23.361 44.488 28.377 1.00 0.00 C ATOM 363 O6 DG A 12 22.885 44.578 29.511 1.00 0.00 O ATOM 364 N1 DG A 12 22.511 44.081 27.367 1.00 0.00 N ATOM 365 C2 DG A 12 22.889 43.949 26.073 1.00 0.00 C ATOM 366 N2 DG A 12 21.961 43.607 25.219 1.00 0.00 N ATOM 367 N3 DG A 12 24.109 44.200 25.602 1.00 0.00 N ATOM 368 C4 DG A 12 24.979 44.602 26.582 1.00 0.00 C ATOM 0 H5' DG A 12 30.505 43.206 25.355 1.00 0.00 H new ATOM 0 H5'' DG A 12 31.253 44.371 24.279 1.00 0.00 H new ATOM 0 H4' DG A 12 29.181 43.810 23.332 1.00 0.00 H new ATOM 0 H3' DG A 12 29.695 46.479 23.764 1.00 0.00 H new ATOM 0 H2' DG A 12 28.323 46.619 25.833 1.00 0.00 H new ATOM 0 H2'' DG A 12 27.175 47.108 24.602 1.00 0.00 H new ATOM 0 HO3' DG A 12 28.006 46.877 22.333 1.00 0.00 H new ATOM 0 H1' DG A 12 26.265 44.879 24.376 1.00 0.00 H new ATOM 0 H8 DG A 12 27.761 45.614 27.870 1.00 0.00 H new ATOM 0 H1 DG A 12 21.543 43.868 27.610 1.00 0.00 H new ATOM 0 H21 DG A 12 22.193 43.494 24.232 1.00 0.00 H new ATOM 0 H22 DG A 12 21.005 43.453 25.539 1.00 0.00 H new TER 381 DG A 12 HETATM 382 N1 DCZ B 13 17.522 43.930 27.731 1.00 0.00 N HETATM 383 C2 DCZ B 13 18.890 43.812 27.456 1.00 0.00 C HETATM 384 N3 DCZ B 13 19.800 43.804 28.459 1.00 0.00 N HETATM 385 C4 DCZ B 13 19.363 43.861 29.700 1.00 0.00 C HETATM 386 C5 DCZ B 13 17.986 43.898 30.051 1.00 0.00 C HETATM 387 C6 DCZ B 13 17.087 43.923 29.035 1.00 0.00 C HETATM 388 O2 DCZ B 13 19.328 43.727 26.307 1.00 0.00 O HETATM 389 N4 DCZ B 13 20.286 43.947 30.614 1.00 0.00 N HETATM 390 C1' DCZ B 13 16.569 44.113 26.600 1.00 0.00 C HETATM 391 C2' DCZ B 13 16.011 42.784 26.110 1.00 0.00 C HETATM 392 C3' DCZ B 13 14.691 43.221 25.486 1.00 0.00 C HETATM 393 C4' DCZ B 13 14.253 44.341 26.436 1.00 0.00 C HETATM 394 O4' DCZ B 13 15.446 44.905 26.981 1.00 0.00 O HETATM 395 O3' DCZ B 13 14.915 43.720 24.170 1.00 0.00 O HETATM 396 C5' DCZ B 13 13.294 43.884 27.558 1.00 0.00 C HETATM 397 O5' DCZ B 13 13.780 42.831 28.394 1.00 0.00 O HETATM 0 HO51 DCZ B 13 13.106 42.614 29.072 1.00 0.00 H new HETATM 0 HN42 DCZ B 13 20.025 43.995 31.599 1.00 0.00 H new HETATM 0 HN41 DCZ B 13 21.270 43.966 30.345 1.00 0.00 H new HETATM 0 H5'2 DCZ B 13 13.061 44.744 28.186 1.00 0.00 H new HETATM 0 H5'1 DCZ B 13 12.358 43.560 27.102 1.00 0.00 H new HETATM 0 H2'2 DCZ B 13 16.669 42.305 25.385 1.00 0.00 H new HETATM 0 H2'1 DCZ B 13 15.865 42.075 26.925 1.00 0.00 H new HETATM 0 H6 DCZ B 13 16.019 43.938 29.253 1.00 0.00 H new HETATM 0 H5 DCZ B 13 17.666 43.906 31.093 1.00 0.00 H new HETATM 0 H4' DCZ B 13 13.674 45.072 25.871 1.00 0.00 H new HETATM 0 H3' DCZ B 13 13.953 42.426 25.380 1.00 0.00 H new HETATM 0 H1' DCZ B 13 17.143 44.604 25.814 1.00 0.00 H new ATOM 410 P DG B 14 14.388 42.906 22.891 1.00 0.00 P ATOM 411 OP1 DG B 14 14.856 43.601 21.664 1.00 0.00 O ATOM 412 OP2 DG B 14 12.936 42.652 23.068 1.00 0.00 O ATOM 413 O5' DG B 14 15.174 41.513 23.059 1.00 0.00 O ATOM 414 C5' DG B 14 16.443 41.270 22.462 1.00 0.00 C ATOM 415 C4' DG B 14 17.167 40.065 23.086 1.00 0.00 C ATOM 416 O4' DG B 14 17.929 40.456 24.229 1.00 0.00 O ATOM 417 C3' DG B 14 16.231 38.919 23.527 1.00 0.00 C ATOM 418 O3' DG B 14 16.659 37.654 23.055 1.00 0.00 O ATOM 419 C2' DG B 14 16.389 38.981 25.040 1.00 0.00 C ATOM 420 C1' DG B 14 17.859 39.392 25.160 1.00 0.00 C ATOM 421 N9 DG B 14 18.264 39.784 26.537 1.00 0.00 N ATOM 422 C8 DG B 14 17.476 39.893 27.660 1.00 0.00 C ATOM 423 N7 DG B 14 18.121 40.208 28.749 1.00 0.00 N ATOM 424 C5 DG B 14 19.450 40.309 28.323 1.00 0.00 C ATOM 425 C6 DG B 14 20.654 40.599 29.057 1.00 0.00 C ATOM 426 O6 DG B 14 20.794 40.810 30.261 1.00 0.00 O ATOM 427 N1 DG B 14 21.785 40.631 28.271 1.00 0.00 N ATOM 428 C2 DG B 14 21.787 40.361 26.945 1.00 0.00 C ATOM 429 N2 DG B 14 22.945 40.431 26.343 1.00 0.00 N ATOM 430 N3 DG B 14 20.706 40.047 26.228 1.00 0.00 N ATOM 431 C4 DG B 14 19.552 40.052 26.971 1.00 0.00 C ATOM 0 H5' DG B 14 17.066 42.158 22.567 1.00 0.00 H new ATOM 0 H5'' DG B 14 16.311 41.097 21.394 1.00 0.00 H new ATOM 0 H4' DG B 14 17.807 39.694 22.285 1.00 0.00 H new ATOM 0 H3' DG B 14 15.214 39.030 23.150 1.00 0.00 H new ATOM 0 H2' DG B 14 15.718 39.709 25.496 1.00 0.00 H new ATOM 0 H2'' DG B 14 16.188 38.021 25.516 1.00 0.00 H new ATOM 0 H1' DG B 14 18.555 38.579 24.954 1.00 0.00 H new ATOM 0 H8 DG B 14 16.408 39.731 27.641 1.00 0.00 H new ATOM 0 H1 DG B 14 22.672 40.872 28.714 1.00 0.00 H new ATOM 0 H21 DG B 14 23.013 40.239 25.344 1.00 0.00 H new ATOM 0 H22 DG B 14 23.781 40.678 26.873 1.00 0.00 H new ATOM 443 P DA B 15 16.220 37.124 21.603 1.00 0.00 P ATOM 444 OP1 DA B 15 16.204 38.259 20.646 1.00 0.00 O ATOM 445 OP2 DA B 15 14.992 36.306 21.767 1.00 0.00 O ATOM 446 O5' DA B 15 17.420 36.138 21.187 1.00 0.00 O ATOM 447 C5' DA B 15 18.758 36.605 21.023 1.00 0.00 C ATOM 448 C4' DA B 15 19.694 36.171 22.164 1.00 0.00 C ATOM 449 O4' DA B 15 19.416 36.810 23.400 1.00 0.00 O ATOM 450 C3' DA B 15 19.625 34.670 22.465 1.00 0.00 C ATOM 451 O3' DA B 15 20.448 33.936 21.564 1.00 0.00 O ATOM 452 C2' DA B 15 20.080 34.617 23.925 1.00 0.00 C ATOM 453 C1' DA B 15 20.100 36.070 24.391 1.00 0.00 C ATOM 454 N9 DA B 15 19.503 36.244 25.734 1.00 0.00 N ATOM 455 C8 DA B 15 18.189 36.159 26.132 1.00 0.00 C ATOM 456 N7 DA B 15 17.996 36.419 27.403 1.00 0.00 N ATOM 457 C5 DA B 15 19.298 36.653 27.882 1.00 0.00 C ATOM 458 C6 DA B 15 19.886 36.987 29.132 1.00 0.00 C ATOM 459 N6 DA B 15 19.243 37.198 30.265 1.00 0.00 N ATOM 460 N1 DA B 15 21.205 37.137 29.259 1.00 0.00 N ATOM 461 C2 DA B 15 21.955 36.950 28.182 1.00 0.00 C ATOM 462 N3 DA B 15 21.564 36.648 26.955 1.00 0.00 N ATOM 463 C4 DA B 15 20.213 36.523 26.870 1.00 0.00 C ATOM 0 H5' DA B 15 18.751 37.693 20.961 1.00 0.00 H new ATOM 0 H5'' DA B 15 19.152 36.234 20.077 1.00 0.00 H new ATOM 0 H4' DA B 15 20.676 36.457 21.787 1.00 0.00 H new ATOM 0 H3' DA B 15 18.645 34.213 22.332 1.00 0.00 H new ATOM 0 H2' DA B 15 19.397 34.019 24.529 1.00 0.00 H new ATOM 0 H2'' DA B 15 21.066 34.161 24.014 1.00 0.00 H new ATOM 0 H1' DA B 15 21.125 36.424 24.504 1.00 0.00 H new ATOM 0 H8 DA B 15 17.386 35.901 25.457 1.00 0.00 H new ATOM 0 H61 DA B 15 19.763 37.433 31.110 1.00 0.00 H new ATOM 0 H62 DA B 15 18.226 37.126 30.295 1.00 0.00 H new ATOM 0 H2 DA B 15 23.020 37.058 28.324 1.00 0.00 H new ATOM 475 P DT B 16 20.640 32.335 21.662 1.00 0.00 P ATOM 476 OP1 DT B 16 21.100 31.851 20.335 1.00 0.00 O ATOM 477 OP2 DT B 16 19.422 31.736 22.263 1.00 0.00 O ATOM 478 O5' DT B 16 21.852 32.189 22.712 1.00 0.00 O ATOM 479 C5' DT B 16 23.147 32.700 22.408 1.00 0.00 C ATOM 480 C4' DT B 16 24.048 32.789 23.647 1.00 0.00 C ATOM 481 O4' DT B 16 23.467 33.635 24.629 1.00 0.00 O ATOM 482 C3' DT B 16 24.300 31.434 24.311 1.00 0.00 C ATOM 483 O3' DT B 16 25.429 30.823 23.690 1.00 0.00 O ATOM 484 C2' DT B 16 24.595 31.866 25.744 1.00 0.00 C ATOM 485 C1' DT B 16 23.871 33.208 25.918 1.00 0.00 C ATOM 486 N1 DT B 16 22.685 33.159 26.827 1.00 0.00 N ATOM 487 C2 DT B 16 22.815 33.748 28.090 1.00 0.00 C ATOM 488 O2 DT B 16 23.857 34.247 28.509 1.00 0.00 O ATOM 489 N3 DT B 16 21.699 33.778 28.890 1.00 0.00 N ATOM 490 C4 DT B 16 20.447 33.337 28.538 1.00 0.00 C ATOM 491 O4 DT B 16 19.521 33.511 29.330 1.00 0.00 O ATOM 492 C5 DT B 16 20.368 32.718 27.213 1.00 0.00 C ATOM 493 C7 DT B 16 19.036 32.185 26.711 1.00 0.00 C ATOM 494 C6 DT B 16 21.472 32.633 26.418 1.00 0.00 C ATOM 0 H5' DT B 16 23.048 33.690 21.962 1.00 0.00 H new ATOM 0 H5'' DT B 16 23.621 32.061 21.663 1.00 0.00 H new ATOM 0 H4' DT B 16 24.996 33.186 23.284 1.00 0.00 H new ATOM 0 H3' DT B 16 23.492 30.705 24.242 1.00 0.00 H new ATOM 0 H2' DT B 16 24.233 31.128 26.460 1.00 0.00 H new ATOM 0 H2'' DT B 16 25.667 31.973 25.910 1.00 0.00 H new ATOM 0 H1' DT B 16 24.565 33.901 26.393 1.00 0.00 H new ATOM 0 H3 DT B 16 21.810 34.162 29.829 1.00 0.00 H new ATOM 0 H71 DT B 16 18.434 31.855 27.557 1.00 0.00 H new ATOM 0 H72 DT B 16 18.507 32.973 26.175 1.00 0.00 H new ATOM 0 H73 DT B 16 19.210 31.344 26.040 1.00 0.00 H new ATOM 0 H6 DT B 16 21.399 32.148 25.456 1.00 0.00 H new ATOM 507 P DG B 17 25.537 29.242 23.392 1.00 0.00 P ATOM 508 OP1 DG B 17 26.473 29.069 22.250 1.00 0.00 O ATOM 509 OP2 DG B 17 24.174 28.665 23.279 1.00 0.00 O ATOM 510 O5' DG B 17 26.226 28.613 24.704 1.00 0.00 O ATOM 511 C5' DG B 17 27.575 28.901 25.042 1.00 0.00 C ATOM 512 C4' DG B 17 28.148 28.021 26.167 1.00 0.00 C ATOM 513 O4' DG B 17 27.598 28.333 27.438 1.00 0.00 O ATOM 514 C3' DG B 17 27.977 26.508 25.978 1.00 0.00 C ATOM 515 O3' DG B 17 29.219 25.903 26.356 1.00 0.00 O ATOM 516 C2' DG B 17 26.714 26.242 26.814 1.00 0.00 C ATOM 517 C1' DG B 17 26.583 27.412 27.797 1.00 0.00 C ATOM 518 N9 DG B 17 25.239 28.078 27.845 1.00 0.00 N ATOM 519 C8 DG B 17 24.238 28.160 26.899 1.00 0.00 C ATOM 520 N7 DG B 17 23.188 28.850 27.267 1.00 0.00 N ATOM 521 C5 DG B 17 23.498 29.255 28.571 1.00 0.00 C ATOM 522 C6 DG B 17 22.772 30.043 29.541 1.00 0.00 C ATOM 523 O6 DG B 17 21.683 30.609 29.440 1.00 0.00 O ATOM 524 N1 DG B 17 23.413 30.158 30.758 1.00 0.00 N ATOM 525 C2 DG B 17 24.606 29.587 31.024 1.00 0.00 C ATOM 526 N2 DG B 17 25.096 29.734 32.220 1.00 0.00 N ATOM 527 N3 DG B 17 25.337 28.913 30.145 1.00 0.00 N ATOM 528 C4 DG B 17 24.734 28.764 28.932 1.00 0.00 C ATOM 0 H5' DG B 17 27.647 29.946 25.342 1.00 0.00 H new ATOM 0 H5'' DG B 17 28.194 28.782 24.152 1.00 0.00 H new ATOM 0 H4' DG B 17 29.211 28.258 26.117 1.00 0.00 H new ATOM 0 H3' DG B 17 27.809 26.091 24.985 1.00 0.00 H new ATOM 0 H2' DG B 17 25.834 26.173 26.175 1.00 0.00 H new ATOM 0 H2'' DG B 17 26.795 25.295 27.348 1.00 0.00 H new ATOM 0 H1' DG B 17 26.693 27.023 28.809 1.00 0.00 H new ATOM 0 H8 DG B 17 24.315 27.691 25.929 1.00 0.00 H new ATOM 0 H1 DG B 17 22.962 30.702 31.493 1.00 0.00 H new ATOM 0 H21 DG B 17 25.996 29.316 32.457 1.00 0.00 H new ATOM 0 H22 DG B 17 24.580 30.267 32.920 1.00 0.00 H new ATOM 540 P DT B 18 29.426 24.431 26.993 1.00 0.00 P ATOM 541 OP1 DT B 18 30.831 24.027 26.733 1.00 0.00 O ATOM 542 OP2 DT B 18 28.335 23.526 26.554 1.00 0.00 O ATOM 543 O5' DT B 18 29.275 24.731 28.568 1.00 0.00 O ATOM 544 C5' DT B 18 30.144 25.673 29.194 1.00 0.00 C ATOM 545 C4' DT B 18 29.860 25.908 30.680 1.00 0.00 C ATOM 546 O4' DT B 18 28.524 26.363 30.830 1.00 0.00 O ATOM 547 C3' DT B 18 30.041 24.665 31.562 1.00 0.00 C ATOM 548 O3' DT B 18 30.754 25.014 32.746 1.00 0.00 O ATOM 549 C2' DT B 18 28.602 24.246 31.841 1.00 0.00 C ATOM 550 C1' DT B 18 27.857 25.582 31.803 1.00 0.00 C ATOM 551 N1 DT B 18 26.423 25.534 31.406 1.00 0.00 N ATOM 552 C2 DT B 18 25.498 26.261 32.172 1.00 0.00 C ATOM 553 O2 DT B 18 25.728 26.713 33.291 1.00 0.00 O ATOM 554 N3 DT B 18 24.253 26.456 31.627 1.00 0.00 N ATOM 555 C4 DT B 18 23.859 26.020 30.384 1.00 0.00 C ATOM 556 O4 DT B 18 22.793 26.423 29.932 1.00 0.00 O ATOM 557 C5 DT B 18 24.787 25.103 29.727 1.00 0.00 C ATOM 558 C7 DT B 18 24.366 24.370 28.465 1.00 0.00 C ATOM 559 C6 DT B 18 26.031 24.908 30.237 1.00 0.00 C ATOM 0 H5' DT B 18 30.068 26.624 28.668 1.00 0.00 H new ATOM 0 H5'' DT B 18 31.172 25.329 29.083 1.00 0.00 H new ATOM 0 H4' DT B 18 30.591 26.645 31.013 1.00 0.00 H new ATOM 0 H3' DT B 18 30.620 23.860 31.109 1.00 0.00 H new ATOM 0 H2' DT B 18 28.228 23.551 31.089 1.00 0.00 H new ATOM 0 H2'' DT B 18 28.503 23.753 32.808 1.00 0.00 H new ATOM 0 H1' DT B 18 27.862 25.969 32.822 1.00 0.00 H new ATOM 0 H3 DT B 18 23.568 26.963 32.187 1.00 0.00 H new ATOM 0 H71 DT B 18 23.289 24.204 28.483 1.00 0.00 H new ATOM 0 H72 DT B 18 24.627 24.969 27.592 1.00 0.00 H new ATOM 0 H73 DT B 18 24.880 23.410 28.413 1.00 0.00 H new ATOM 0 H6 DT B 18 26.722 24.256 29.723 1.00 0.00 H new ATOM 572 P DA B 19 31.582 23.922 33.608 1.00 0.00 P ATOM 573 OP1 DA B 19 32.614 24.651 34.389 1.00 0.00 O ATOM 574 OP2 DA B 19 32.022 22.827 32.708 1.00 0.00 O ATOM 575 O5' DA B 19 30.489 23.320 34.629 1.00 0.00 O ATOM 576 C5' DA B 19 30.139 24.031 35.810 1.00 0.00 C ATOM 577 C4' DA B 19 28.769 23.651 36.377 1.00 0.00 C ATOM 578 O4' DA B 19 27.742 23.940 35.441 1.00 0.00 O ATOM 579 C3' DA B 19 28.584 22.197 36.841 1.00 0.00 C ATOM 580 O3' DA B 19 28.497 22.191 38.265 1.00 0.00 O ATOM 581 C2' DA B 19 27.289 21.798 36.125 1.00 0.00 C ATOM 582 C1' DA B 19 26.635 23.130 35.762 1.00 0.00 C ATOM 583 N9 DA B 19 25.761 23.062 34.572 1.00 0.00 N ATOM 584 C8 DA B 19 26.083 22.547 33.339 1.00 0.00 C ATOM 585 N7 DA B 19 25.167 22.709 32.427 1.00 0.00 N ATOM 586 C5 DA B 19 24.142 23.354 33.133 1.00 0.00 C ATOM 587 C6 DA B 19 22.857 23.827 32.788 1.00 0.00 C ATOM 588 N6 DA B 19 22.351 23.731 31.579 1.00 0.00 N ATOM 589 N1 DA B 19 22.075 24.448 33.668 1.00 0.00 N ATOM 590 C2 DA B 19 22.545 24.590 34.899 1.00 0.00 C ATOM 591 N3 DA B 19 23.723 24.202 35.384 1.00 0.00 N ATOM 592 C4 DA B 19 24.490 23.582 34.437 1.00 0.00 C ATOM 0 H5' DA B 19 30.149 25.100 35.596 1.00 0.00 H new ATOM 0 H5'' DA B 19 30.899 23.851 36.570 1.00 0.00 H new ATOM 0 H4' DA B 19 28.706 24.262 37.278 1.00 0.00 H new ATOM 0 H3' DA B 19 29.388 21.500 36.606 1.00 0.00 H new ATOM 0 H2' DA B 19 27.493 21.200 35.237 1.00 0.00 H new ATOM 0 H2'' DA B 19 26.645 21.201 36.771 1.00 0.00 H new ATOM 0 H1' DA B 19 25.999 23.480 36.575 1.00 0.00 H new ATOM 0 H8 DA B 19 27.020 22.048 33.142 1.00 0.00 H new ATOM 0 H61 DA B 19 21.416 24.091 31.387 1.00 0.00 H new ATOM 0 H62 DA B 19 22.893 23.297 30.832 1.00 0.00 H new ATOM 0 H2 DA B 19 21.888 25.084 35.599 1.00 0.00 H new ATOM 604 P DC B 20 28.227 20.860 39.143 1.00 0.00 P ATOM 605 OP1 DC B 20 28.778 21.092 40.503 1.00 0.00 O ATOM 606 OP2 DC B 20 28.687 19.673 38.380 1.00 0.00 O ATOM 607 O5' DC B 20 26.621 20.807 39.249 1.00 0.00 O ATOM 608 C5' DC B 20 25.900 21.874 39.856 1.00 0.00 C ATOM 609 C4' DC B 20 24.387 21.809 39.607 1.00 0.00 C ATOM 610 O4' DC B 20 24.123 21.855 38.206 1.00 0.00 O ATOM 611 C3' DC B 20 23.706 20.550 40.171 1.00 0.00 C ATOM 612 O3' DC B 20 22.528 20.916 40.891 1.00 0.00 O ATOM 613 C2' DC B 20 23.404 19.764 38.896 1.00 0.00 C ATOM 614 C1' DC B 20 23.126 20.896 37.904 1.00 0.00 C ATOM 615 N1 DC B 20 23.224 20.536 36.458 1.00 0.00 N ATOM 616 C2 DC B 20 22.214 20.949 35.577 1.00 0.00 C ATOM 617 O2 DC B 20 21.173 21.473 35.976 1.00 0.00 O ATOM 618 N3 DC B 20 22.344 20.783 34.234 1.00 0.00 N ATOM 619 C4 DC B 20 23.450 20.230 33.778 1.00 0.00 C ATOM 620 N4 DC B 20 23.552 20.104 32.486 1.00 0.00 N ATOM 621 C5 DC B 20 24.501 19.770 34.616 1.00 0.00 C ATOM 622 C6 DC B 20 24.349 19.929 35.955 1.00 0.00 C ATOM 0 H5' DC B 20 26.282 22.822 39.478 1.00 0.00 H new ATOM 0 H5'' DC B 20 26.084 21.862 40.930 1.00 0.00 H new ATOM 0 H4' DC B 20 23.973 22.670 40.132 1.00 0.00 H new ATOM 0 H3' DC B 20 24.299 19.977 40.884 1.00 0.00 H new ATOM 0 H2' DC B 20 24.245 19.144 38.587 1.00 0.00 H new ATOM 0 H2'' DC B 20 22.546 19.102 39.015 1.00 0.00 H new ATOM 0 H1' DC B 20 22.093 21.225 38.020 1.00 0.00 H new ATOM 0 H41 DC B 20 24.387 19.683 32.079 1.00 0.00 H new ATOM 0 H42 DC B 20 22.797 20.427 31.881 1.00 0.00 H new ATOM 0 H5 DC B 20 25.387 19.311 34.203 1.00 0.00 H new ATOM 0 H6 DC B 20 25.116 19.577 36.629 1.00 0.00 H new ATOM 634 P DA B 21 21.856 19.959 42.009 1.00 0.00 P ATOM 635 OP1 DA B 21 21.053 20.817 42.919 1.00 0.00 O ATOM 636 OP2 DA B 21 22.909 19.096 42.606 1.00 0.00 O ATOM 637 O5' DA B 21 20.847 19.013 41.174 1.00 0.00 O ATOM 638 C5' DA B 21 19.589 19.513 40.741 1.00 0.00 C ATOM 639 C4' DA B 21 19.038 18.825 39.490 1.00 0.00 C ATOM 640 O4' DA B 21 19.977 18.880 38.427 1.00 0.00 O ATOM 641 C3' DA B 21 18.586 17.363 39.619 1.00 0.00 C ATOM 642 O3' DA B 21 17.163 17.331 39.746 1.00 0.00 O ATOM 643 C2' DA B 21 19.096 16.737 38.321 1.00 0.00 C ATOM 644 C1' DA B 21 19.554 17.928 37.481 1.00 0.00 C ATOM 645 N9 DA B 21 20.657 17.625 36.547 1.00 0.00 N ATOM 646 C8 DA B 21 21.903 17.113 36.820 1.00 0.00 C ATOM 647 N7 DA B 21 22.648 16.911 35.763 1.00 0.00 N ATOM 648 C5 DA B 21 21.821 17.343 34.712 1.00 0.00 C ATOM 649 C6 DA B 21 21.944 17.424 33.302 1.00 0.00 C ATOM 650 N6 DA B 21 22.995 17.052 32.594 1.00 0.00 N ATOM 651 N1 DA B 21 20.958 17.920 32.557 1.00 0.00 N ATOM 652 C2 DA B 21 19.857 18.332 33.161 1.00 0.00 C ATOM 653 N3 DA B 21 19.585 18.311 34.458 1.00 0.00 N ATOM 654 C4 DA B 21 20.619 17.799 35.186 1.00 0.00 C ATOM 0 H5' DA B 21 19.684 20.581 40.543 1.00 0.00 H new ATOM 0 H5'' DA B 21 18.868 19.402 41.551 1.00 0.00 H new ATOM 0 H4' DA B 21 18.133 19.402 39.300 1.00 0.00 H new ATOM 0 H3' DA B 21 18.965 16.827 40.489 1.00 0.00 H new ATOM 0 H2' DA B 21 19.916 16.044 38.509 1.00 0.00 H new ATOM 0 H2'' DA B 21 18.312 16.173 37.817 1.00 0.00 H new ATOM 0 H1' DA B 21 18.740 18.264 36.839 1.00 0.00 H new ATOM 0 H8 DA B 21 22.239 16.896 37.823 1.00 0.00 H new ATOM 0 H61 DA B 21 22.987 17.151 31.579 1.00 0.00 H new ATOM 0 H62 DA B 21 23.815 16.666 33.062 1.00 0.00 H new ATOM 0 H2 DA B 21 19.086 18.734 32.521 1.00 0.00 H new ATOM 666 P DT B 22 16.329 15.978 40.040 1.00 0.00 P ATOM 667 OP1 DT B 22 15.076 16.366 40.737 1.00 0.00 O ATOM 668 OP2 DT B 22 17.227 14.992 40.694 1.00 0.00 O ATOM 669 O5' DT B 22 15.946 15.417 38.575 1.00 0.00 O ATOM 670 C5' DT B 22 14.954 16.072 37.788 1.00 0.00 C ATOM 671 C4' DT B 22 14.916 15.627 36.322 1.00 0.00 C ATOM 672 O4' DT B 22 16.151 15.939 35.701 1.00 0.00 O ATOM 673 C3' DT B 22 14.689 14.124 36.116 1.00 0.00 C ATOM 674 O3' DT B 22 13.313 13.810 35.923 1.00 0.00 O ATOM 675 C2' DT B 22 15.502 13.847 34.850 1.00 0.00 C ATOM 676 C1' DT B 22 16.258 15.138 34.546 1.00 0.00 C ATOM 677 N1 DT B 22 17.687 14.896 34.232 1.00 0.00 N ATOM 678 C2 DT B 22 18.115 15.052 32.908 1.00 0.00 C ATOM 679 O2 DT B 22 17.371 15.356 31.977 1.00 0.00 O ATOM 680 N3 DT B 22 19.448 14.834 32.667 1.00 0.00 N ATOM 681 C4 DT B 22 20.384 14.444 33.595 1.00 0.00 C ATOM 682 O4 DT B 22 21.547 14.297 33.226 1.00 0.00 O ATOM 683 C5 DT B 22 19.863 14.242 34.948 1.00 0.00 C ATOM 684 C7 DT B 22 20.756 13.752 36.073 1.00 0.00 C ATOM 685 C6 DT B 22 18.552 14.469 35.219 1.00 0.00 C ATOM 0 H5' DT B 22 15.130 17.147 37.825 1.00 0.00 H new ATOM 0 H5'' DT B 22 13.976 15.893 38.235 1.00 0.00 H new ATOM 0 H4' DT B 22 14.069 16.158 35.887 1.00 0.00 H new ATOM 0 H3' DT B 22 14.986 13.524 36.976 1.00 0.00 H new ATOM 0 H2' DT B 22 16.192 13.017 35.003 1.00 0.00 H new ATOM 0 H2'' DT B 22 14.851 13.571 34.020 1.00 0.00 H new ATOM 0 H1' DT B 22 15.830 15.618 33.666 1.00 0.00 H new ATOM 0 H3 DT B 22 19.775 14.974 31.711 1.00 0.00 H new ATOM 0 H71 DT B 22 20.398 14.152 37.022 1.00 0.00 H new ATOM 0 H72 DT B 22 20.734 12.663 36.107 1.00 0.00 H new ATOM 0 H73 DT B 22 21.778 14.089 35.900 1.00 0.00 H new ATOM 0 H6 DT B 22 18.181 14.313 36.221 1.00 0.00 H new ATOM 698 P DC B 23 12.765 12.292 36.004 1.00 0.00 P ATOM 699 OP1 DC B 23 11.282 12.344 35.930 1.00 0.00 O ATOM 700 OP2 DC B 23 13.394 11.624 37.171 1.00 0.00 O ATOM 701 O5' DC B 23 13.319 11.586 34.661 1.00 0.00 O ATOM 702 C5' DC B 23 12.767 11.888 33.383 1.00 0.00 C ATOM 703 C4' DC B 23 13.573 11.286 32.219 1.00 0.00 C ATOM 704 O4' DC B 23 14.884 11.842 32.120 1.00 0.00 O ATOM 705 C3' DC B 23 13.720 9.755 32.291 1.00 0.00 C ATOM 706 O3' DC B 23 12.966 9.154 31.242 1.00 0.00 O ATOM 707 C2' DC B 23 15.234 9.566 32.165 1.00 0.00 C ATOM 708 C1' DC B 23 15.717 10.867 31.519 1.00 0.00 C ATOM 709 N1 DC B 23 17.161 11.143 31.784 1.00 0.00 N ATOM 710 C2 DC B 23 18.066 11.235 30.712 1.00 0.00 C ATOM 711 O2 DC B 23 17.707 11.253 29.534 1.00 0.00 O ATOM 712 N3 DC B 23 19.401 11.302 30.938 1.00 0.00 N ATOM 713 C4 DC B 23 19.825 11.316 32.185 1.00 0.00 C ATOM 714 N4 DC B 23 21.113 11.357 32.347 1.00 0.00 N ATOM 715 C5 DC B 23 18.962 11.304 33.312 1.00 0.00 C ATOM 716 C6 DC B 23 17.630 11.213 33.074 1.00 0.00 C ATOM 0 H5' DC B 23 12.718 12.970 33.262 1.00 0.00 H new ATOM 0 H5'' DC B 23 11.743 11.516 33.339 1.00 0.00 H new ATOM 0 H4' DC B 23 12.985 11.542 31.338 1.00 0.00 H new ATOM 0 H3' DC B 23 13.338 9.285 33.197 1.00 0.00 H new ATOM 0 H2' DC B 23 15.699 9.407 33.138 1.00 0.00 H new ATOM 0 H2'' DC B 23 15.478 8.700 31.550 1.00 0.00 H new ATOM 0 H1' DC B 23 15.650 10.842 30.431 1.00 0.00 H new ATOM 0 H41 DC B 23 21.509 11.370 33.287 1.00 0.00 H new ATOM 0 H42 DC B 23 21.729 11.376 31.534 1.00 0.00 H new ATOM 0 H5 DC B 23 19.350 11.365 34.318 1.00 0.00 H new ATOM 0 H6 DC B 23 16.935 11.195 33.901 1.00 0.00 H new ATOM 728 P DG B 24 12.871 7.554 31.028 1.00 0.00 P ATOM 729 OP1 DG B 24 11.605 7.262 30.309 1.00 0.00 O ATOM 730 OP2 DG B 24 13.139 6.870 32.317 1.00 0.00 O ATOM 731 O5' DG B 24 14.102 7.264 30.030 1.00 0.00 O ATOM 732 C5' DG B 24 14.136 7.860 28.739 1.00 0.00 C ATOM 733 C4' DG B 24 15.500 7.723 28.046 1.00 0.00 C ATOM 734 O4' DG B 24 16.522 8.357 28.816 1.00 0.00 O ATOM 735 C3' DG B 24 15.932 6.262 27.818 1.00 0.00 C ATOM 736 O3' DG B 24 16.355 6.056 26.471 1.00 0.00 O ATOM 737 C2' DG B 24 17.119 6.126 28.763 1.00 0.00 C ATOM 738 C1' DG B 24 17.677 7.544 28.717 1.00 0.00 C ATOM 739 N9 DG B 24 18.661 7.785 29.796 1.00 0.00 N ATOM 740 C8 DG B 24 18.468 7.820 31.157 1.00 0.00 C ATOM 741 N7 DG B 24 19.572 7.926 31.854 1.00 0.00 N ATOM 742 C5 DG B 24 20.579 7.937 30.876 1.00 0.00 C ATOM 743 C6 DG B 24 22.020 7.972 30.971 1.00 0.00 C ATOM 744 O6 DG B 24 22.745 8.049 31.965 1.00 0.00 O ATOM 745 N1 DG B 24 22.649 7.872 29.746 1.00 0.00 N ATOM 746 C2 DG B 24 21.999 7.795 28.562 1.00 0.00 C ATOM 747 N2 DG B 24 22.725 7.689 27.483 1.00 0.00 N ATOM 748 N3 DG B 24 20.681 7.786 28.418 1.00 0.00 N ATOM 749 C4 DG B 24 20.022 7.851 29.617 1.00 0.00 C ATOM 0 H5' DG B 24 13.885 8.917 28.827 1.00 0.00 H new ATOM 0 H5'' DG B 24 13.370 7.401 28.114 1.00 0.00 H new ATOM 0 H4' DG B 24 15.375 8.202 27.075 1.00 0.00 H new ATOM 0 H3' DG B 24 15.132 5.543 27.995 1.00 0.00 H new ATOM 0 H2' DG B 24 16.817 5.832 29.768 1.00 0.00 H new ATOM 0 H2'' DG B 24 17.841 5.385 28.418 1.00 0.00 H new ATOM 0 HO3' DG B 24 16.626 5.122 26.352 1.00 0.00 H new ATOM 0 H1' DG B 24 18.243 7.755 27.810 1.00 0.00 H new ATOM 0 H8 DG B 24 17.490 7.765 31.612 1.00 0.00 H new ATOM 0 H1 DG B 24 23.669 7.855 29.733 1.00 0.00 H new ATOM 0 H21 DG B 24 22.275 7.628 26.570 1.00 0.00 H new ATOM 0 H22 DG B 24 23.742 7.667 27.553 1.00 0.00 H new TER 762 DG B 24 HETATM 763 O81 9U2 A 100 15.383 25.281 38.689 1.00 0.00 O HETATM 764 C81 9U2 A 100 15.983 24.813 37.732 1.00 0.00 C HETATM 765 C82 9U2 A 100 15.396 23.815 36.770 1.00 0.00 C HETATM 766 C84 9U2 A 100 14.091 23.315 36.796 1.00 0.00 C HETATM 767 C85 9U2 A 100 12.937 23.662 37.732 1.00 0.00 C HETATM 768 S81 9U2 A 100 13.786 22.239 35.451 1.00 0.00 S HETATM 769 C83 9U2 A 100 15.430 22.499 34.941 1.00 0.00 C HETATM 770 N81 9U2 A 100 16.138 23.310 35.705 1.00 0.00 N HETATM 771 CM8 9U2 A 100 12.425 25.114 37.590 1.00 0.00 C HETATM 772 CM9 9U2 A 100 13.103 23.218 39.208 1.00 0.00 C HETATM 781 N PYB A 101 17.291 25.213 37.440 1.00 0.00 N HETATM 782 CA PYB A 101 18.098 26.057 38.204 1.00 0.00 C HETATM 783 CB1 PYB A 101 19.391 26.530 37.845 1.00 0.00 C HETATM 784 CB PYB A 101 17.795 26.532 39.453 1.00 0.00 C HETATM 785 CG1 PYB A 101 19.871 27.266 38.910 1.00 0.00 C HETATM 786 NG2 PYB A 101 18.860 27.304 39.879 1.00 0.00 N HETATM 787 CD PYB A 101 18.828 28.043 41.151 1.00 0.00 C HETATM 788 C PYB A 101 21.209 27.867 39.181 1.00 0.00 C HETATM 789 O PYB A 101 21.516 28.262 40.299 1.00 0.00 O HETATM 0 HD3 PYB A 101 18.002 28.754 41.138 1.00 0.00 H new HETATM 0 HD2 PYB A 101 18.691 27.343 41.975 1.00 0.00 H new HETATM 0 HD1 PYB A 101 19.767 28.580 41.284 1.00 0.00 H new HETATM 0 HB1 PYB A 101 19.907 26.345 36.903 1.00 0.00 H new HETATM 0 HB PYB A 101 16.879 26.336 40.011 1.00 0.00 H new HETATM 0 H PYB A 101 17.617 24.879 36.533 1.00 0.00 H new HETATM 796 N PYB A 102 22.094 27.979 38.117 1.00 0.00 N HETATM 797 CA PYB A 102 23.419 28.418 38.225 1.00 0.00 C HETATM 798 CB1 PYB A 102 24.208 28.972 37.184 1.00 0.00 C HETATM 799 CB PYB A 102 24.168 28.419 39.375 1.00 0.00 C HETATM 800 CG1 PYB A 102 25.418 29.352 37.729 1.00 0.00 C HETATM 801 NG2 PYB A 102 25.406 28.972 39.076 1.00 0.00 N HETATM 802 CD PYB A 102 26.473 29.107 40.077 1.00 0.00 C HETATM 803 C PYB A 102 26.604 30.016 37.111 1.00 0.00 C HETATM 804 O PYB A 102 27.660 30.204 37.700 1.00 0.00 O HETATM 0 HD3 PYB A 102 26.125 29.734 40.898 1.00 0.00 H new HETATM 0 HD2 PYB A 102 26.739 28.122 40.460 1.00 0.00 H new HETATM 0 HD1 PYB A 102 27.348 29.565 39.616 1.00 0.00 H new HETATM 0 HB1 PYB A 102 23.912 29.079 36.140 1.00 0.00 H new HETATM 0 HB PYB A 102 23.848 28.051 40.350 1.00 0.00 H new HETATM 0 H PYB A 102 21.607 28.044 37.223 1.00 0.00 H new HETATM 811 N PYB A 103 26.415 30.457 35.815 1.00 0.00 N HETATM 812 CA PYB A 103 27.352 31.080 34.997 1.00 0.00 C HETATM 813 CB1 PYB A 103 27.012 31.749 33.805 1.00 0.00 C HETATM 814 CB PYB A 103 28.713 31.162 35.171 1.00 0.00 C HETATM 815 CG1 PYB A 103 28.175 32.186 33.223 1.00 0.00 C HETATM 816 NG2 PYB A 103 29.229 31.848 34.074 1.00 0.00 N HETATM 817 CD PYB A 103 30.658 32.134 33.883 1.00 0.00 C HETATM 818 C PYB A 103 28.366 32.809 31.891 1.00 0.00 C HETATM 819 O PYB A 103 29.438 33.062 31.364 1.00 0.00 O HETATM 0 HD3 PYB A 103 31.023 32.737 34.715 1.00 0.00 H new HETATM 0 HD2 PYB A 103 31.214 31.197 33.842 1.00 0.00 H new HETATM 0 HD1 PYB A 103 30.798 32.680 32.950 1.00 0.00 H new HETATM 0 HB1 PYB A 103 26.005 31.894 33.415 1.00 0.00 H new HETATM 0 HB PYB A 103 29.282 30.764 36.011 1.00 0.00 H new HETATM 0 H PYB A 103 25.427 30.471 35.561 1.00 0.00 H new HETATM 826 N ABU A 104 27.175 33.064 31.262 1.00 0.00 N HETATM 827 CA ABU A 104 27.022 33.440 29.855 1.00 0.00 C HETATM 828 CB ABU A 104 26.417 32.278 29.047 1.00 0.00 C HETATM 829 CG ABU A 104 27.438 31.296 28.426 1.00 0.00 C HETATM 830 CD ABU A 104 28.468 30.651 29.368 1.00 0.00 C HETATM 831 OE1 ABU A 104 29.663 30.759 29.138 1.00 0.00 O HETATM 0 H ABU A 104 26.282 33.006 31.752 1.00 0.00 H new HETATM 0 HB1 ABU A 104 25.748 31.715 29.698 1.00 0.00 H new HETATM 0 HB2 ABU A 104 25.806 32.695 28.246 1.00 0.00 H new HETATM 0 HG1 ABU A 104 26.907 30.517 27.879 1.00 0.00 H new HETATM 0 HG2 ABU A 104 28.093 31.836 27.743 1.00 0.00 H new HETATM 0 HE2 ABU A 104 28.034 30.842 29.218 1.00 0.00 H new HETATM 839 N IMT A 105 27.966 29.962 30.451 1.00 0.00 N HETATM 840 CA IMT A 105 28.630 29.397 31.513 1.00 0.00 C HETATM 841 NB1 IMT A 105 28.015 28.805 32.592 1.00 0.00 N HETATM 842 CB IMT A 105 29.990 29.393 31.666 1.00 0.00 C HETATM 843 CG1 IMT A 105 29.008 28.463 33.418 1.00 0.00 C HETATM 844 NG2 IMT A 105 30.249 28.786 32.872 1.00 0.00 N HETATM 845 CD IMT A 105 31.600 28.538 33.398 1.00 0.00 C HETATM 846 C IMT A 105 28.929 27.854 34.799 1.00 0.00 C HETATM 847 O IMT A 105 29.900 27.735 35.543 1.00 0.00 O HETATM 0 HN2 IMT A 105 26.946 29.960 30.428 1.00 0.00 H new HETATM 0 HD3 IMT A 105 32.148 27.898 32.706 1.00 0.00 H new HETATM 0 HD2 IMT A 105 32.126 29.486 33.510 1.00 0.00 H new HETATM 0 HD1 IMT A 105 31.528 28.046 34.368 1.00 0.00 H new HETATM 0 HB IMT A 105 30.725 29.793 30.968 1.00 0.00 H new HETATM 853 N PYB A 106 27.668 27.421 35.203 1.00 0.00 N HETATM 854 CA PYB A 106 27.314 26.868 36.436 1.00 0.00 C HETATM 855 CB1 PYB A 106 26.045 26.312 36.743 1.00 0.00 C HETATM 856 CB PYB A 106 28.104 26.782 37.554 1.00 0.00 C HETATM 857 CG1 PYB A 106 26.075 25.888 38.054 1.00 0.00 C HETATM 858 NG2 PYB A 106 27.366 26.143 38.543 1.00 0.00 N HETATM 859 CD PYB A 106 27.972 25.734 39.821 1.00 0.00 C HETATM 860 C PYB A 106 24.987 25.345 38.920 1.00 0.00 C HETATM 861 O PYB A 106 25.117 25.186 40.126 1.00 0.00 O HETATM 0 HD3 PYB A 106 28.785 25.033 39.630 1.00 0.00 H new HETATM 0 HD2 PYB A 106 28.363 26.612 40.336 1.00 0.00 H new HETATM 0 HD1 PYB A 106 27.218 25.254 40.444 1.00 0.00 H new HETATM 0 HB1 PYB A 106 25.197 26.234 36.063 1.00 0.00 H new HETATM 0 HB PYB A 106 29.126 27.149 37.649 1.00 0.00 H new HETATM 0 H PYB A 106 26.990 27.445 34.441 1.00 0.00 H new HETATM 868 N PYB A 107 23.801 25.021 38.282 1.00 0.00 N HETATM 869 CA PYB A 107 22.607 24.664 38.909 1.00 0.00 C HETATM 870 CB1 PYB A 107 21.553 23.927 38.315 1.00 0.00 C HETATM 871 CB PYB A 107 22.261 24.948 40.206 1.00 0.00 C HETATM 872 CG1 PYB A 107 20.581 23.739 39.272 1.00 0.00 C HETATM 873 NG2 PYB A 107 21.004 24.404 40.431 1.00 0.00 N HETATM 874 CD PYB A 107 20.296 24.525 41.716 1.00 0.00 C HETATM 875 C PYB A 107 19.289 22.996 39.218 1.00 0.00 C HETATM 876 O PYB A 107 18.480 22.993 40.135 1.00 0.00 O HETATM 0 HD3 PYB A 107 20.892 24.066 42.505 1.00 0.00 H new HETATM 0 HD2 PYB A 107 20.138 25.579 41.947 1.00 0.00 H new HETATM 0 HD1 PYB A 107 19.332 24.020 41.649 1.00 0.00 H new HETATM 0 HB1 PYB A 107 21.518 23.572 37.285 1.00 0.00 H new HETATM 0 HB PYB A 107 22.863 25.500 40.928 1.00 0.00 H new HETATM 0 H PYB A 107 23.970 24.748 37.314 1.00 0.00 H new HETATM 883 N PYB A 108 19.072 22.266 38.059 1.00 0.00 N HETATM 884 CA PYB A 108 17.954 21.491 37.759 1.00 0.00 C HETATM 885 CB1 PYB A 108 17.843 20.670 36.615 1.00 0.00 C HETATM 886 CB PYB A 108 16.795 21.373 38.489 1.00 0.00 C HETATM 887 CG1 PYB A 108 16.596 20.090 36.628 1.00 0.00 C HETATM 888 NG2 PYB A 108 15.973 20.469 37.821 1.00 0.00 N HETATM 889 CD PYB A 108 14.674 20.030 38.344 1.00 0.00 C HETATM 890 C PYB A 108 15.908 19.300 35.571 1.00 0.00 C HETATM 891 O PYB A 108 14.760 18.892 35.640 1.00 0.00 O HETATM 0 HD3 PYB A 108 14.816 19.545 39.310 1.00 0.00 H new HETATM 0 HD2 PYB A 108 14.020 20.893 38.464 1.00 0.00 H new HETATM 0 HD1 PYB A 108 14.220 19.325 37.647 1.00 0.00 H new HETATM 0 HB1 PYB A 108 18.611 20.522 35.855 1.00 0.00 H new HETATM 0 HB PYB A 108 16.562 21.891 39.419 1.00 0.00 H new HETATM 0 H PYB A 108 19.878 22.263 37.434 1.00 0.00 H new HETATM 898 C01 9T8 A 109 11.607 19.068 26.716 1.00 0.00 C HETATM 899 N02 9T8 A 109 15.692 17.906 30.131 1.00 0.00 N HETATM 900 C03 9T8 A 109 13.300 17.800 28.042 1.00 0.00 C HETATM 901 C05 9T8 A 109 15.084 16.701 29.540 1.00 0.00 C HETATM 902 C06 9T8 A 109 15.022 18.730 31.006 1.00 0.00 C HETATM 903 C07 9T8 A 109 15.876 19.412 32.067 1.00 0.00 C HETATM 904 C04 9T8 A 109 14.551 16.902 28.103 1.00 0.00 C HETATM 905 N01 9T8 A 109 12.892 18.248 26.639 1.00 0.00 N HETATM 906 C02 9T8 A 109 12.673 17.061 25.699 1.00 0.00 C HETATM 907 N03 9T8 A 109 16.665 19.120 34.435 1.00 0.00 N HETATM 908 C08 9T8 A 109 16.188 18.439 33.221 1.00 0.00 C HETATM 909 O01 9T8 A 109 13.804 18.817 30.993 1.00 0.00 O