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= -0.43 (180deg=-0.43) 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 (180deg=0) USER MOD Single : B 18 DT C7 :methyl -30:sc= -1.34 (180deg=-2.13!) USER MOD Single : B 22 DT C7 :methyl 150:sc= -0.0769 (180deg=-0.0769) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 N1 DCZ A 1 30.270 12.498 30.752 1.00 0.00 N HETATM 2 C2 DCZ A 1 30.841 11.827 31.849 1.00 0.00 C HETATM 3 N3 DCZ A 1 31.206 12.499 32.972 1.00 0.00 N HETATM 4 C4 DCZ A 1 31.008 13.798 33.012 1.00 0.00 C HETATM 5 C5 DCZ A 1 30.448 14.541 31.942 1.00 0.00 C HETATM 6 C6 DCZ A 1 30.097 13.863 30.819 1.00 0.00 C HETATM 7 O2 DCZ A 1 31.021 10.605 31.844 1.00 0.00 O HETATM 8 N4 DCZ A 1 31.373 14.391 34.113 1.00 0.00 N HETATM 9 C1' DCZ A 1 29.873 11.679 29.561 1.00 0.00 C HETATM 10 C2' DCZ A 1 28.881 12.305 28.577 1.00 0.00 C HETATM 11 C3' DCZ A 1 28.985 11.325 27.413 1.00 0.00 C HETATM 12 C4' DCZ A 1 30.464 10.902 27.485 1.00 0.00 C HETATM 13 O4' DCZ A 1 30.979 11.403 28.720 1.00 0.00 O HETATM 14 O3' DCZ A 1 28.109 10.225 27.636 1.00 0.00 O HETATM 15 C5' DCZ A 1 31.307 11.420 26.305 1.00 0.00 C HETATM 16 O5' DCZ A 1 31.335 12.844 26.218 1.00 0.00 O HETATM 0 HO51 DCZ A 1 31.885 13.114 25.453 1.00 0.00 H new HETATM 0 HN42 DCZ A 1 31.249 15.398 34.215 1.00 0.00 H new HETATM 0 HN41 DCZ A 1 31.783 13.848 34.873 1.00 0.00 H new HETATM 0 H5'2 DCZ A 1 32.327 11.048 26.404 1.00 0.00 H new HETATM 0 H5'1 DCZ A 1 30.908 11.013 25.376 1.00 0.00 H new HETATM 0 H2'2 DCZ A 1 27.871 12.359 28.984 1.00 0.00 H new HETATM 0 H2'1 DCZ A 1 29.164 13.318 28.292 1.00 0.00 H new HETATM 0 H6 DCZ A 1 29.677 14.400 29.968 1.00 0.00 H new HETATM 0 H5 DCZ A 1 30.304 15.619 32.018 1.00 0.00 H new HETATM 0 H4' DCZ A 1 30.523 9.815 27.427 1.00 0.00 H new HETATM 0 H3' DCZ A 1 28.706 11.732 26.441 1.00 0.00 H new HETATM 0 H1' DCZ A 1 29.424 10.820 30.060 1.00 0.00 H new ATOM 29 P DG A 2 26.791 10.023 26.733 1.00 0.00 P ATOM 30 OP1 DG A 2 26.031 8.877 27.291 1.00 0.00 O ATOM 31 OP2 DG A 2 27.196 9.998 25.306 1.00 0.00 O ATOM 32 O5' DG A 2 25.971 11.378 27.014 1.00 0.00 O ATOM 33 C5' DG A 2 24.632 11.555 26.569 1.00 0.00 C ATOM 34 C4' DG A 2 24.119 12.976 26.858 1.00 0.00 C ATOM 35 O4' DG A 2 24.134 13.211 28.266 1.00 0.00 O ATOM 36 C3' DG A 2 24.983 14.075 26.205 1.00 0.00 C ATOM 37 O3' DG A 2 24.215 15.157 25.707 1.00 0.00 O ATOM 38 C2' DG A 2 25.780 14.582 27.396 1.00 0.00 C ATOM 39 C1' DG A 2 24.725 14.478 28.501 1.00 0.00 C ATOM 40 N9 DG A 2 25.295 14.586 29.868 1.00 0.00 N ATOM 41 C8 DG A 2 26.600 14.798 30.245 1.00 0.00 C ATOM 42 N7 DG A 2 26.795 14.853 31.535 1.00 0.00 N ATOM 43 C5 DG A 2 25.508 14.691 32.065 1.00 0.00 C ATOM 44 C6 DG A 2 25.029 14.709 33.422 1.00 0.00 C ATOM 45 O6 DG A 2 25.663 14.838 34.471 1.00 0.00 O ATOM 46 N1 DG A 2 23.661 14.565 33.526 1.00 0.00 N ATOM 47 C2 DG A 2 22.839 14.393 32.465 1.00 0.00 C ATOM 48 N2 DG A 2 21.561 14.292 32.713 1.00 0.00 N ATOM 49 N3 DG A 2 23.233 14.359 31.194 1.00 0.00 N ATOM 50 C4 DG A 2 24.585 14.523 31.051 1.00 0.00 C ATOM 0 H5' DG A 2 23.986 10.828 27.061 1.00 0.00 H new ATOM 0 H5'' DG A 2 24.575 11.359 25.498 1.00 0.00 H new ATOM 0 H4' DG A 2 23.113 13.028 26.441 1.00 0.00 H new ATOM 0 H3' DG A 2 25.555 13.694 25.359 1.00 0.00 H new ATOM 0 H2' DG A 2 26.657 13.967 27.600 1.00 0.00 H new ATOM 0 H2'' DG A 2 26.133 15.603 27.254 1.00 0.00 H new ATOM 0 H1' DG A 2 24.009 15.299 28.465 1.00 0.00 H new ATOM 0 H8 DG A 2 27.402 14.910 29.530 1.00 0.00 H new ATOM 0 H1 DG A 2 23.245 14.590 34.457 1.00 0.00 H new ATOM 0 H21 DG A 2 20.901 14.161 31.946 1.00 0.00 H new ATOM 0 H22 DG A 2 21.222 14.344 33.674 1.00 0.00 H new ATOM 62 P DA A 3 23.651 15.170 24.206 1.00 0.00 P ATOM 63 OP1 DA A 3 23.040 13.850 23.909 1.00 0.00 O ATOM 64 OP2 DA A 3 24.720 15.686 23.316 1.00 0.00 O ATOM 65 O5' DA A 3 22.479 16.273 24.271 1.00 0.00 O ATOM 66 C5' DA A 3 21.317 16.089 25.078 1.00 0.00 C ATOM 67 C4' DA A 3 21.271 17.002 26.315 1.00 0.00 C ATOM 68 O4' DA A 3 22.274 16.738 27.286 1.00 0.00 O ATOM 69 C3' DA A 3 21.395 18.501 25.966 1.00 0.00 C ATOM 70 O3' DA A 3 20.164 19.225 25.814 1.00 0.00 O ATOM 71 C2' DA A 3 22.360 19.032 27.038 1.00 0.00 C ATOM 72 C1' DA A 3 22.361 17.907 28.077 1.00 0.00 C ATOM 73 N9 DA A 3 23.548 17.887 28.964 1.00 0.00 N ATOM 74 C8 DA A 3 24.880 17.968 28.634 1.00 0.00 C ATOM 75 N7 DA A 3 25.690 17.999 29.663 1.00 0.00 N ATOM 76 C5 DA A 3 24.813 17.936 30.758 1.00 0.00 C ATOM 77 C6 DA A 3 24.959 17.964 32.169 1.00 0.00 C ATOM 78 N6 DA A 3 26.101 18.072 32.819 1.00 0.00 N ATOM 79 N1 DA A 3 23.900 17.895 32.977 1.00 0.00 N ATOM 80 C2 DA A 3 22.702 17.776 32.423 1.00 0.00 C ATOM 81 N3 DA A 3 22.407 17.724 31.130 1.00 0.00 N ATOM 82 C4 DA A 3 23.513 17.830 30.341 1.00 0.00 C ATOM 0 H5' DA A 3 21.272 15.050 25.403 1.00 0.00 H new ATOM 0 H5'' DA A 3 20.431 16.271 24.470 1.00 0.00 H new ATOM 0 H4' DA A 3 20.290 16.772 26.732 1.00 0.00 H new ATOM 0 H3' DA A 3 21.777 18.651 24.956 1.00 0.00 H new ATOM 0 H2' DA A 3 23.356 19.210 26.633 1.00 0.00 H new ATOM 0 H2'' DA A 3 22.015 19.975 27.462 1.00 0.00 H new ATOM 0 H1' DA A 3 21.542 18.024 28.786 1.00 0.00 H new ATOM 0 H8 DA A 3 25.229 18.003 27.613 1.00 0.00 H new ATOM 0 H61 DA A 3 26.108 18.084 33.839 1.00 0.00 H new ATOM 0 H62 DA A 3 26.977 18.144 32.302 1.00 0.00 H new ATOM 0 H2 DA A 3 21.867 17.714 33.105 1.00 0.00 H new ATOM 94 P DT A 4 18.937 19.249 26.879 1.00 0.00 P ATOM 95 OP1 DT A 4 18.279 17.920 26.892 1.00 0.00 O ATOM 96 OP2 DT A 4 18.109 20.439 26.566 1.00 0.00 O ATOM 97 O5' DT A 4 19.682 19.474 28.284 1.00 0.00 O ATOM 98 C5' DT A 4 19.003 19.830 29.476 1.00 0.00 C ATOM 99 C4' DT A 4 19.825 20.850 30.280 1.00 0.00 C ATOM 100 O4' DT A 4 21.101 20.375 30.687 1.00 0.00 O ATOM 101 C3' DT A 4 20.203 22.090 29.475 1.00 0.00 C ATOM 102 O3' DT A 4 19.095 22.945 29.242 1.00 0.00 O ATOM 103 C2' DT A 4 21.255 22.703 30.399 1.00 0.00 C ATOM 104 C1' DT A 4 21.819 21.500 31.168 1.00 0.00 C ATOM 105 N1 DT A 4 23.300 21.350 31.051 1.00 0.00 N ATOM 106 C2 DT A 4 24.046 21.330 32.236 1.00 0.00 C ATOM 107 O2 DT A 4 23.548 21.371 33.359 1.00 0.00 O ATOM 108 N3 DT A 4 25.412 21.273 32.117 1.00 0.00 N ATOM 109 C4 DT A 4 26.117 21.214 30.937 1.00 0.00 C ATOM 110 O4 DT A 4 27.343 21.105 30.991 1.00 0.00 O ATOM 111 C5 DT A 4 25.290 21.279 29.730 1.00 0.00 C ATOM 112 C7 DT A 4 25.943 21.283 28.356 1.00 0.00 C ATOM 113 C6 DT A 4 23.931 21.335 29.822 1.00 0.00 C ATOM 0 H5' DT A 4 18.826 18.940 30.080 1.00 0.00 H new ATOM 0 H5'' DT A 4 18.027 20.251 29.234 1.00 0.00 H new ATOM 0 H4' DT A 4 19.156 21.053 31.117 1.00 0.00 H new ATOM 0 H3' DT A 4 20.559 21.890 28.464 1.00 0.00 H new ATOM 0 H2' DT A 4 22.033 23.216 29.833 1.00 0.00 H new ATOM 0 H2'' DT A 4 20.815 23.437 31.074 1.00 0.00 H new ATOM 0 H1' DT A 4 21.681 21.628 32.242 1.00 0.00 H new ATOM 0 H3 DT A 4 25.953 21.275 32.981 1.00 0.00 H new ATOM 0 H71 DT A 4 25.274 20.815 27.634 1.00 0.00 H new ATOM 0 H72 DT A 4 26.144 22.310 28.052 1.00 0.00 H new ATOM 0 H73 DT A 4 26.879 20.727 28.397 1.00 0.00 H new ATOM 0 H6 DT A 4 23.338 21.368 28.920 1.00 0.00 H new ATOM 126 P DG A 5 19.160 24.097 28.116 1.00 0.00 P ATOM 127 OP1 DG A 5 17.813 24.717 28.007 1.00 0.00 O ATOM 128 OP2 DG A 5 19.819 23.577 26.891 1.00 0.00 O ATOM 129 O5' DG A 5 20.161 25.148 28.794 1.00 0.00 O ATOM 130 C5' DG A 5 19.787 25.868 29.957 1.00 0.00 C ATOM 131 C4' DG A 5 20.956 26.663 30.547 1.00 0.00 C ATOM 132 O4' DG A 5 21.999 25.829 31.038 1.00 0.00 O ATOM 133 C3' DG A 5 21.648 27.549 29.504 1.00 0.00 C ATOM 134 O3' DG A 5 21.006 28.765 29.096 1.00 0.00 O ATOM 135 C2' DG A 5 23.040 27.731 30.108 1.00 0.00 C ATOM 136 C1' DG A 5 23.142 26.655 31.200 1.00 0.00 C ATOM 137 N9 DG A 5 24.394 25.850 31.152 1.00 0.00 N ATOM 138 C8 DG A 5 24.882 25.064 30.136 1.00 0.00 C ATOM 139 N7 DG A 5 26.026 24.484 30.405 1.00 0.00 N ATOM 140 C5 DG A 5 26.327 24.920 31.705 1.00 0.00 C ATOM 141 C6 DG A 5 27.440 24.657 32.591 1.00 0.00 C ATOM 142 O6 DG A 5 28.442 23.961 32.415 1.00 0.00 O ATOM 143 N1 DG A 5 27.346 25.297 33.811 1.00 0.00 N ATOM 144 C2 DG A 5 26.318 26.103 34.157 1.00 0.00 C ATOM 145 N2 DG A 5 26.363 26.667 35.331 1.00 0.00 N ATOM 146 N3 DG A 5 25.278 26.374 33.376 1.00 0.00 N ATOM 147 C4 DG A 5 25.329 25.754 32.161 1.00 0.00 C ATOM 0 H5' DG A 5 19.408 25.173 30.706 1.00 0.00 H new ATOM 0 H5'' DG A 5 18.972 26.550 29.714 1.00 0.00 H new ATOM 0 H4' DG A 5 20.491 27.245 31.342 1.00 0.00 H new ATOM 0 H3' DG A 5 21.633 27.068 28.526 1.00 0.00 H new ATOM 0 H2' DG A 5 23.817 27.604 29.354 1.00 0.00 H new ATOM 0 H2'' DG A 5 23.162 28.730 30.526 1.00 0.00 H new ATOM 0 H1' DG A 5 23.177 27.136 32.177 1.00 0.00 H new ATOM 0 H8 DG A 5 24.367 24.935 29.196 1.00 0.00 H new ATOM 0 H1 DG A 5 28.094 25.153 34.489 1.00 0.00 H new ATOM 0 H21 DG A 5 25.607 27.283 35.630 1.00 0.00 H new ATOM 0 H22 DG A 5 27.154 26.493 35.950 1.00 0.00 H new ATOM 159 P DT A 6 20.103 29.725 30.044 1.00 0.00 P ATOM 160 OP1 DT A 6 18.908 28.975 30.501 1.00 0.00 O ATOM 161 OP2 DT A 6 19.896 30.997 29.309 1.00 0.00 O ATOM 162 O5' DT A 6 21.043 30.049 31.304 1.00 0.00 O ATOM 163 C5' DT A 6 20.665 29.773 32.647 1.00 0.00 C ATOM 164 C4' DT A 6 21.743 30.284 33.601 1.00 0.00 C ATOM 165 O4' DT A 6 22.983 29.664 33.312 1.00 0.00 O ATOM 166 C3' DT A 6 21.950 31.800 33.487 1.00 0.00 C ATOM 167 O3' DT A 6 21.436 32.425 34.657 1.00 0.00 O ATOM 168 C2' DT A 6 23.464 31.934 33.301 1.00 0.00 C ATOM 169 C1' DT A 6 24.013 30.560 33.675 1.00 0.00 C ATOM 170 N1 DT A 6 25.255 30.129 32.976 1.00 0.00 N ATOM 171 C2 DT A 6 26.334 29.686 33.753 1.00 0.00 C ATOM 172 O2 DT A 6 26.479 29.941 34.949 1.00 0.00 O ATOM 173 N3 DT A 6 27.292 28.943 33.105 1.00 0.00 N ATOM 174 C4 DT A 6 27.270 28.595 31.774 1.00 0.00 C ATOM 175 O4 DT A 6 28.085 27.773 31.363 1.00 0.00 O ATOM 176 C5 DT A 6 26.241 29.267 30.983 1.00 0.00 C ATOM 177 C7 DT A 6 26.225 29.115 29.470 1.00 0.00 C ATOM 178 C6 DT A 6 25.282 30.005 31.600 1.00 0.00 C ATOM 0 H5' DT A 6 20.525 28.701 32.782 1.00 0.00 H new ATOM 0 H5'' DT A 6 19.711 30.250 32.872 1.00 0.00 H new ATOM 0 H4' DT A 6 21.403 30.043 34.608 1.00 0.00 H new ATOM 0 H3' DT A 6 21.428 32.289 32.665 1.00 0.00 H new ATOM 0 H2' DT A 6 23.717 32.197 32.274 1.00 0.00 H new ATOM 0 H2'' DT A 6 23.876 32.715 33.941 1.00 0.00 H new ATOM 0 H1' DT A 6 24.289 30.585 34.729 1.00 0.00 H new ATOM 0 H3 DT A 6 28.087 28.622 33.658 1.00 0.00 H new ATOM 0 H71 DT A 6 25.200 29.190 29.108 1.00 0.00 H new ATOM 0 H72 DT A 6 26.828 29.903 29.019 1.00 0.00 H new ATOM 0 H73 DT A 6 26.636 28.143 29.198 1.00 0.00 H new ATOM 0 H6 DT A 6 24.529 30.502 31.006 1.00 0.00 H new ATOM 191 P DA A 7 21.237 34.022 34.773 1.00 0.00 P ATOM 192 OP1 DA A 7 20.191 34.283 35.794 1.00 0.00 O ATOM 193 OP2 DA A 7 21.074 34.599 33.415 1.00 0.00 O ATOM 194 O5' DA A 7 22.654 34.501 35.357 1.00 0.00 O ATOM 195 C5' DA A 7 23.063 34.107 36.660 1.00 0.00 C ATOM 196 C4' DA A 7 24.558 34.338 36.898 1.00 0.00 C ATOM 197 O4' DA A 7 25.330 33.528 36.022 1.00 0.00 O ATOM 198 C3' DA A 7 25.006 35.794 36.715 1.00 0.00 C ATOM 199 O3' DA A 7 25.603 36.240 37.927 1.00 0.00 O ATOM 200 C2' DA A 7 25.975 35.687 35.535 1.00 0.00 C ATOM 201 C1' DA A 7 26.478 34.247 35.626 1.00 0.00 C ATOM 202 N9 DA A 7 26.929 33.677 34.337 1.00 0.00 N ATOM 203 C8 DA A 7 26.235 33.656 33.151 1.00 0.00 C ATOM 204 N7 DA A 7 26.774 32.924 32.214 1.00 0.00 N ATOM 205 C5 DA A 7 27.953 32.468 32.822 1.00 0.00 C ATOM 206 C6 DA A 7 29.028 31.652 32.402 1.00 0.00 C ATOM 207 N6 DA A 7 29.106 31.081 31.218 1.00 0.00 N ATOM 208 N1 DA A 7 30.055 31.381 33.206 1.00 0.00 N ATOM 209 C2 DA A 7 30.033 31.914 34.419 1.00 0.00 C ATOM 210 N3 DA A 7 29.100 32.686 34.969 1.00 0.00 N ATOM 211 C4 DA A 7 28.068 32.930 34.107 1.00 0.00 C ATOM 0 H5' DA A 7 22.834 33.051 36.806 1.00 0.00 H new ATOM 0 H5'' DA A 7 22.490 34.663 37.401 1.00 0.00 H new ATOM 0 H4' DA A 7 24.723 34.071 37.942 1.00 0.00 H new ATOM 0 H3' DA A 7 24.221 36.522 36.508 1.00 0.00 H new ATOM 0 H2' DA A 7 25.476 35.880 34.585 1.00 0.00 H new ATOM 0 H2'' DA A 7 26.791 36.405 35.618 1.00 0.00 H new ATOM 0 H1' DA A 7 27.338 34.198 36.293 1.00 0.00 H new ATOM 0 H8 DA A 7 25.315 34.203 33.005 1.00 0.00 H new ATOM 0 H61 DA A 7 29.913 30.504 30.982 1.00 0.00 H new ATOM 0 H62 DA A 7 28.359 31.216 30.537 1.00 0.00 H new ATOM 0 H2 DA A 7 30.886 31.692 35.044 1.00 0.00 H new ATOM 223 P DC A 8 26.032 37.775 38.175 1.00 0.00 P ATOM 224 OP1 DC A 8 26.053 38.015 39.641 1.00 0.00 O ATOM 225 OP2 DC A 8 25.207 38.660 37.316 1.00 0.00 O ATOM 226 O5' DC A 8 27.543 37.799 37.630 1.00 0.00 O ATOM 227 C5' DC A 8 28.551 37.035 38.277 1.00 0.00 C ATOM 228 C4' DC A 8 29.853 36.953 37.475 1.00 0.00 C ATOM 229 O4' DC A 8 29.662 36.199 36.283 1.00 0.00 O ATOM 230 C3' DC A 8 30.431 38.322 37.081 1.00 0.00 C ATOM 231 O3' DC A 8 31.749 38.455 37.606 1.00 0.00 O ATOM 232 C2' DC A 8 30.373 38.257 35.552 1.00 0.00 C ATOM 233 C1' DC A 8 30.491 36.754 35.282 1.00 0.00 C ATOM 234 N1 DC A 8 29.999 36.284 33.953 1.00 0.00 N ATOM 235 C2 DC A 8 30.779 35.396 33.190 1.00 0.00 C ATOM 236 O2 DC A 8 31.919 35.060 33.517 1.00 0.00 O ATOM 237 N3 DC A 8 30.301 34.871 32.031 1.00 0.00 N ATOM 238 C4 DC A 8 29.090 35.214 31.645 1.00 0.00 C ATOM 239 N4 DC A 8 28.660 34.682 30.540 1.00 0.00 N ATOM 240 C5 DC A 8 28.253 36.104 32.366 1.00 0.00 C ATOM 241 C6 DC A 8 28.744 36.627 33.515 1.00 0.00 C ATOM 0 H5' DC A 8 28.176 36.027 38.454 1.00 0.00 H new ATOM 0 H5'' DC A 8 28.760 37.473 39.253 1.00 0.00 H new ATOM 0 H4' DC A 8 30.565 36.468 38.142 1.00 0.00 H new ATOM 0 H3' DC A 8 29.901 39.192 37.468 1.00 0.00 H new ATOM 0 H2' DC A 8 29.441 38.668 35.163 1.00 0.00 H new ATOM 0 H2'' DC A 8 31.186 38.818 35.090 1.00 0.00 H new ATOM 0 H1' DC A 8 31.542 36.464 35.288 1.00 0.00 H new ATOM 0 H41 DC A 8 27.729 34.911 30.192 1.00 0.00 H new ATOM 0 H42 DC A 8 29.254 34.035 30.021 1.00 0.00 H new ATOM 0 H5 DC A 8 27.264 36.355 32.013 1.00 0.00 H new ATOM 0 H6 DC A 8 28.145 37.318 34.090 1.00 0.00 H new ATOM 253 P DA A 9 32.522 39.875 37.653 1.00 0.00 P ATOM 254 OP1 DA A 9 33.563 39.795 38.710 1.00 0.00 O ATOM 255 OP2 DA A 9 31.525 40.973 37.720 1.00 0.00 O ATOM 256 O5' DA A 9 33.249 39.939 36.218 1.00 0.00 O ATOM 257 C5' DA A 9 34.354 39.090 35.929 1.00 0.00 C ATOM 258 C4' DA A 9 34.524 38.812 34.432 1.00 0.00 C ATOM 259 O4' DA A 9 33.371 38.189 33.886 1.00 0.00 O ATOM 260 C3' DA A 9 34.780 40.043 33.556 1.00 0.00 C ATOM 261 O3' DA A 9 36.174 40.332 33.467 1.00 0.00 O ATOM 262 C2' DA A 9 34.187 39.602 32.212 1.00 0.00 C ATOM 263 C1' DA A 9 33.527 38.258 32.489 1.00 0.00 C ATOM 264 N9 DA A 9 32.255 38.112 31.759 1.00 0.00 N ATOM 265 C8 DA A 9 31.072 38.780 31.955 1.00 0.00 C ATOM 266 N7 DA A 9 30.143 38.492 31.081 1.00 0.00 N ATOM 267 C5 DA A 9 30.783 37.575 30.231 1.00 0.00 C ATOM 268 C6 DA A 9 30.409 36.852 29.071 1.00 0.00 C ATOM 269 N6 DA A 9 29.235 36.922 28.472 1.00 0.00 N ATOM 270 N1 DA A 9 31.261 36.019 28.474 1.00 0.00 N ATOM 271 C2 DA A 9 32.474 35.890 28.995 1.00 0.00 C ATOM 272 N3 DA A 9 32.976 36.494 30.065 1.00 0.00 N ATOM 273 C4 DA A 9 32.066 37.330 30.643 1.00 0.00 C ATOM 0 H5' DA A 9 34.225 38.144 36.456 1.00 0.00 H new ATOM 0 H5'' DA A 9 35.266 39.547 36.313 1.00 0.00 H new ATOM 0 H4' DA A 9 35.407 38.174 34.408 1.00 0.00 H new ATOM 0 H3' DA A 9 34.340 40.965 33.937 1.00 0.00 H new ATOM 0 H2' DA A 9 33.462 40.328 31.844 1.00 0.00 H new ATOM 0 H2'' DA A 9 34.962 39.511 31.451 1.00 0.00 H new ATOM 0 H1' DA A 9 34.137 37.428 32.133 1.00 0.00 H new ATOM 0 H8 DA A 9 30.922 39.483 32.761 1.00 0.00 H new ATOM 0 H61 DA A 9 29.054 36.363 27.638 1.00 0.00 H new ATOM 0 H62 DA A 9 28.509 37.535 28.843 1.00 0.00 H new ATOM 0 H2 DA A 9 33.137 35.207 28.484 1.00 0.00 H new ATOM 285 P DT A 10 36.741 41.604 32.647 1.00 0.00 P ATOM 286 OP1 DT A 10 38.160 41.800 33.042 1.00 0.00 O ATOM 287 OP2 DT A 10 35.793 42.734 32.814 1.00 0.00 O ATOM 288 O5' DT A 10 36.696 41.126 31.105 1.00 0.00 O ATOM 289 C5' DT A 10 37.580 40.123 30.613 1.00 0.00 C ATOM 290 C4' DT A 10 37.242 39.644 29.189 1.00 0.00 C ATOM 291 O4' DT A 10 36.018 38.921 29.118 1.00 0.00 O ATOM 292 C3' DT A 10 37.044 40.775 28.180 1.00 0.00 C ATOM 293 O3' DT A 10 38.254 41.371 27.737 1.00 0.00 O ATOM 294 C2' DT A 10 36.376 40.012 27.041 1.00 0.00 C ATOM 295 C1' DT A 10 35.625 38.880 27.748 1.00 0.00 C ATOM 296 N1 DT A 10 34.154 39.003 27.572 1.00 0.00 N ATOM 297 C2 DT A 10 33.577 38.340 26.480 1.00 0.00 C ATOM 298 O2 DT A 10 34.215 37.666 25.673 1.00 0.00 O ATOM 299 N3 DT A 10 32.223 38.496 26.308 1.00 0.00 N ATOM 300 C4 DT A 10 31.398 39.277 27.081 1.00 0.00 C ATOM 301 O4 DT A 10 30.199 39.295 26.812 1.00 0.00 O ATOM 302 C5 DT A 10 32.072 40.003 28.163 1.00 0.00 C ATOM 303 C7 DT A 10 31.288 40.927 29.080 1.00 0.00 C ATOM 304 C6 DT A 10 33.406 39.840 28.375 1.00 0.00 C ATOM 0 H5' DT A 10 37.558 39.268 31.289 1.00 0.00 H new ATOM 0 H5'' DT A 10 38.598 40.512 30.624 1.00 0.00 H new ATOM 0 H4' DT A 10 38.111 39.032 28.947 1.00 0.00 H new ATOM 0 H3' DT A 10 36.486 41.617 28.589 1.00 0.00 H new ATOM 0 H2' DT A 10 35.697 40.651 26.476 1.00 0.00 H new ATOM 0 H2'' DT A 10 37.110 39.625 26.335 1.00 0.00 H new ATOM 0 H1' DT A 10 35.879 37.913 27.315 1.00 0.00 H new ATOM 0 H3 DT A 10 31.791 37.986 25.537 1.00 0.00 H new ATOM 0 H71 DT A 10 31.757 40.947 30.064 1.00 0.00 H new ATOM 0 H72 DT A 10 31.279 41.933 28.661 1.00 0.00 H new ATOM 0 H73 DT A 10 30.265 40.564 29.174 1.00 0.00 H new ATOM 0 H6 DT A 10 33.886 40.373 29.183 1.00 0.00 H new ATOM 317 P DC A 11 38.296 42.923 27.305 1.00 0.00 P ATOM 318 OP1 DC A 11 39.682 43.232 26.869 1.00 0.00 O ATOM 319 OP2 DC A 11 37.698 43.734 28.394 1.00 0.00 O ATOM 320 O5' DC A 11 37.310 42.998 26.028 1.00 0.00 O ATOM 321 C5' DC A 11 37.758 42.707 24.708 1.00 0.00 C ATOM 322 C4' DC A 11 36.638 42.800 23.657 1.00 0.00 C ATOM 323 O4' DC A 11 35.664 41.775 23.823 1.00 0.00 O ATOM 324 C3' DC A 11 35.807 44.087 23.737 1.00 0.00 C ATOM 325 O3' DC A 11 36.400 45.333 23.345 1.00 0.00 O ATOM 326 C2' DC A 11 34.558 43.686 22.961 1.00 0.00 C ATOM 327 C1' DC A 11 34.511 42.155 23.081 1.00 0.00 C ATOM 328 N1 DC A 11 33.250 41.749 23.760 1.00 0.00 N ATOM 329 C2 DC A 11 32.195 41.236 22.989 1.00 0.00 C ATOM 330 O2 DC A 11 32.367 40.778 21.858 1.00 0.00 O ATOM 331 N3 DC A 11 30.926 41.230 23.463 1.00 0.00 N ATOM 332 C4 DC A 11 30.713 41.697 24.676 1.00 0.00 C ATOM 333 N4 DC A 11 29.480 41.689 25.081 1.00 0.00 N ATOM 334 C5 DC A 11 31.748 42.164 25.532 1.00 0.00 C ATOM 335 C6 DC A 11 33.013 42.159 25.048 1.00 0.00 C ATOM 0 H5' DC A 11 38.184 41.704 24.688 1.00 0.00 H new ATOM 0 H5'' DC A 11 38.557 43.399 24.441 1.00 0.00 H new ATOM 0 H4' DC A 11 37.187 42.735 22.718 1.00 0.00 H new ATOM 0 H3' DC A 11 35.638 44.377 24.774 1.00 0.00 H new ATOM 0 H2' DC A 11 33.664 44.146 23.382 1.00 0.00 H new ATOM 0 H2'' DC A 11 34.618 44.002 21.919 1.00 0.00 H new ATOM 0 H1' DC A 11 34.518 41.662 22.109 1.00 0.00 H new ATOM 0 H41 DC A 11 29.246 42.037 26.011 1.00 0.00 H new ATOM 0 H42 DC A 11 28.745 41.335 24.469 1.00 0.00 H new ATOM 0 H5 DC A 11 31.533 42.510 26.532 1.00 0.00 H new ATOM 0 H6 DC A 11 33.833 42.477 25.674 1.00 0.00 H new ATOM 347 P DG A 12 37.194 45.636 21.962 1.00 0.00 P ATOM 348 OP1 DG A 12 38.327 44.685 21.849 1.00 0.00 O ATOM 349 OP2 DG A 12 37.497 47.088 21.964 1.00 0.00 O ATOM 350 O5' DG A 12 36.162 45.381 20.743 1.00 0.00 O ATOM 351 C5' DG A 12 36.325 44.315 19.812 1.00 0.00 C ATOM 352 C4' DG A 12 35.135 44.167 18.842 1.00 0.00 C ATOM 353 O4' DG A 12 33.982 43.674 19.528 1.00 0.00 O ATOM 354 C3' DG A 12 34.729 45.486 18.153 1.00 0.00 C ATOM 355 O3' DG A 12 34.368 45.276 16.789 1.00 0.00 O ATOM 356 C2' DG A 12 33.501 45.886 18.968 1.00 0.00 C ATOM 357 C1' DG A 12 32.877 44.514 19.225 1.00 0.00 C ATOM 358 N9 DG A 12 31.862 44.501 20.311 1.00 0.00 N ATOM 359 C8 DG A 12 31.826 45.235 21.476 1.00 0.00 C ATOM 360 N7 DG A 12 30.765 45.029 22.212 1.00 0.00 N ATOM 361 C5 DG A 12 30.026 44.093 21.472 1.00 0.00 C ATOM 362 C6 DG A 12 28.740 43.484 21.710 1.00 0.00 C ATOM 363 O6 DG A 12 27.961 43.641 22.651 1.00 0.00 O ATOM 364 N1 DG A 12 28.343 42.623 20.706 1.00 0.00 N ATOM 365 C2 DG A 12 29.081 42.361 19.603 1.00 0.00 C ATOM 366 N2 DG A 12 28.561 41.549 18.722 1.00 0.00 N ATOM 367 N3 DG A 12 30.269 42.900 19.333 1.00 0.00 N ATOM 368 C4 DG A 12 30.694 43.763 20.310 1.00 0.00 C ATOM 0 H5' DG A 12 36.458 43.381 20.358 1.00 0.00 H new ATOM 0 H5'' DG A 12 37.236 44.480 19.237 1.00 0.00 H new ATOM 0 H4' DG A 12 35.479 43.469 18.079 1.00 0.00 H new ATOM 0 H3' DG A 12 35.526 46.229 18.129 1.00 0.00 H new ATOM 0 H2' DG A 12 33.766 46.400 19.892 1.00 0.00 H new ATOM 0 H2'' DG A 12 32.834 46.548 18.415 1.00 0.00 H new ATOM 0 HO3' DG A 12 34.115 46.131 16.382 1.00 0.00 H new ATOM 0 H1' DG A 12 32.312 44.180 18.354 1.00 0.00 H new ATOM 0 H8 DG A 12 32.609 45.923 21.758 1.00 0.00 H new ATOM 0 H1 DG A 12 27.441 42.157 20.802 1.00 0.00 H new ATOM 0 H21 DG A 12 29.077 41.319 17.873 1.00 0.00 H new ATOM 0 H22 DG A 12 27.639 41.145 18.883 1.00 0.00 H new TER 381 DG A 12 HETATM 382 N1 DCZ B 13 23.850 40.186 20.106 1.00 0.00 N HETATM 383 C2 DCZ B 13 25.128 40.758 20.010 1.00 0.00 C HETATM 384 N3 DCZ B 13 25.666 41.439 21.055 1.00 0.00 N HETATM 385 C4 DCZ B 13 24.976 41.507 22.177 1.00 0.00 C HETATM 386 C5 DCZ B 13 23.704 40.905 22.357 1.00 0.00 C HETATM 387 C6 DCZ B 13 23.170 40.249 21.298 1.00 0.00 C HETATM 388 O2 DCZ B 13 25.812 40.673 18.988 1.00 0.00 O HETATM 389 N4 DCZ B 13 25.500 42.216 23.136 1.00 0.00 N HETATM 390 C1' DCZ B 13 23.206 39.577 18.904 1.00 0.00 C HETATM 391 C2' DCZ B 13 22.976 38.073 19.059 1.00 0.00 C HETATM 392 C3' DCZ B 13 21.732 37.828 18.208 1.00 0.00 C HETATM 393 C4' DCZ B 13 20.975 39.154 18.348 1.00 0.00 C HETATM 394 O4' DCZ B 13 21.918 40.158 18.722 1.00 0.00 O HETATM 395 O3' DCZ B 13 22.049 37.580 16.843 1.00 0.00 O HETATM 396 C5' DCZ B 13 19.800 39.075 19.345 1.00 0.00 C HETATM 397 O5' DCZ B 13 20.158 38.571 20.633 1.00 0.00 O HETATM 0 HO51 DCZ B 13 19.365 38.552 21.209 1.00 0.00 H new HETATM 0 HN42 DCZ B 13 25.013 42.306 24.028 1.00 0.00 H new HETATM 0 HN41 DCZ B 13 26.397 42.681 22.995 1.00 0.00 H new HETATM 0 H5'2 DCZ B 13 19.371 40.070 19.463 1.00 0.00 H new HETATM 0 H5'1 DCZ B 13 19.021 38.440 18.922 1.00 0.00 H new HETATM 0 H2'2 DCZ B 13 23.829 37.495 18.703 1.00 0.00 H new HETATM 0 H2'1 DCZ B 13 22.814 37.794 20.100 1.00 0.00 H new HETATM 0 H6 DCZ B 13 22.196 39.769 21.393 1.00 0.00 H new HETATM 0 H5 DCZ B 13 23.177 40.968 23.309 1.00 0.00 H new HETATM 0 H4' DCZ B 13 20.515 39.403 17.392 1.00 0.00 H new HETATM 0 H3' DCZ B 13 21.171 36.950 18.528 1.00 0.00 H new HETATM 0 H1' DCZ B 13 23.878 39.758 18.065 1.00 0.00 H new ATOM 410 P DG B 14 22.066 36.081 16.255 1.00 0.00 P ATOM 411 OP1 DG B 14 22.237 36.161 14.783 1.00 0.00 O ATOM 412 OP2 DG B 14 20.903 35.338 16.801 1.00 0.00 O ATOM 413 O5' DG B 14 23.405 35.490 16.918 1.00 0.00 O ATOM 414 C5' DG B 14 24.680 35.664 16.311 1.00 0.00 C ATOM 415 C4' DG B 14 25.844 35.335 17.259 1.00 0.00 C ATOM 416 O4' DG B 14 26.133 36.430 18.125 1.00 0.00 O ATOM 417 C3' DG B 14 25.587 34.101 18.149 1.00 0.00 C ATOM 418 O3' DG B 14 26.678 33.200 18.143 1.00 0.00 O ATOM 419 C2' DG B 14 25.461 34.746 19.522 1.00 0.00 C ATOM 420 C1' DG B 14 26.478 35.879 19.382 1.00 0.00 C ATOM 421 N9 DG B 14 26.430 36.884 20.476 1.00 0.00 N ATOM 422 C8 DG B 14 25.434 37.111 21.398 1.00 0.00 C ATOM 423 N7 DG B 14 25.719 38.021 22.290 1.00 0.00 N ATOM 424 C5 DG B 14 27.014 38.427 21.940 1.00 0.00 C ATOM 425 C6 DG B 14 27.907 39.376 22.550 1.00 0.00 C ATOM 426 O6 DG B 14 27.737 40.072 23.549 1.00 0.00 O ATOM 427 N1 DG B 14 29.121 39.487 21.907 1.00 0.00 N ATOM 428 C2 DG B 14 29.461 38.771 20.810 1.00 0.00 C ATOM 429 N2 DG B 14 30.662 38.968 20.333 1.00 0.00 N ATOM 430 N3 DG B 14 28.678 37.870 20.219 1.00 0.00 N ATOM 431 C4 DG B 14 27.454 37.743 20.826 1.00 0.00 C ATOM 0 H5' DG B 14 24.776 36.695 15.969 1.00 0.00 H new ATOM 0 H5'' DG B 14 24.746 35.028 15.428 1.00 0.00 H new ATOM 0 H4' DG B 14 26.684 35.122 16.598 1.00 0.00 H new ATOM 0 H3' DG B 14 24.729 33.512 17.827 1.00 0.00 H new ATOM 0 H2' DG B 14 24.454 35.113 19.718 1.00 0.00 H new ATOM 0 H2'' DG B 14 25.713 34.058 20.329 1.00 0.00 H new ATOM 0 H1' DG B 14 27.507 35.524 19.448 1.00 0.00 H new ATOM 0 H8 DG B 14 24.494 36.580 21.385 1.00 0.00 H new ATOM 0 H1 DG B 14 29.803 40.147 22.280 1.00 0.00 H new ATOM 0 H21 DG B 14 30.973 38.456 19.508 1.00 0.00 H new ATOM 0 H22 DG B 14 31.288 39.634 20.786 1.00 0.00 H new ATOM 443 P DA B 15 26.794 32.073 17.006 1.00 0.00 P ATOM 444 OP1 DA B 15 26.563 32.693 15.678 1.00 0.00 O ATOM 445 OP2 DA B 15 25.958 30.919 17.417 1.00 0.00 O ATOM 446 O5' DA B 15 28.332 31.626 17.090 1.00 0.00 O ATOM 447 C5' DA B 15 29.404 32.529 16.837 1.00 0.00 C ATOM 448 C4' DA B 15 30.198 32.910 18.100 1.00 0.00 C ATOM 449 O4' DA B 15 29.603 33.901 18.933 1.00 0.00 O ATOM 450 C3' DA B 15 30.516 31.707 19.005 1.00 0.00 C ATOM 451 O3' DA B 15 31.812 31.207 18.708 1.00 0.00 O ATOM 452 C2' DA B 15 30.350 32.302 20.409 1.00 0.00 C ATOM 453 C1' DA B 15 30.292 33.807 20.171 1.00 0.00 C ATOM 454 N9 DA B 15 29.619 34.519 21.285 1.00 0.00 N ATOM 455 C8 DA B 15 28.354 34.322 21.785 1.00 0.00 C ATOM 456 N7 DA B 15 28.062 35.055 22.830 1.00 0.00 N ATOM 457 C5 DA B 15 29.248 35.775 23.051 1.00 0.00 C ATOM 458 C6 DA B 15 29.680 36.729 24.009 1.00 0.00 C ATOM 459 N6 DA B 15 28.956 37.203 25.005 1.00 0.00 N ATOM 460 N1 DA B 15 30.912 37.236 23.969 1.00 0.00 N ATOM 461 C2 DA B 15 31.726 36.824 23.007 1.00 0.00 C ATOM 462 N3 DA B 15 31.471 35.942 22.046 1.00 0.00 N ATOM 463 C4 DA B 15 30.200 35.451 22.120 1.00 0.00 C ATOM 0 H5' DA B 15 29.005 33.435 16.381 1.00 0.00 H new ATOM 0 H5'' DA B 15 30.083 32.080 16.112 1.00 0.00 H new ATOM 0 H4' DA B 15 31.104 33.326 17.660 1.00 0.00 H new ATOM 0 H3' DA B 15 29.877 30.833 18.879 1.00 0.00 H new ATOM 0 H2' DA B 15 29.442 31.939 20.891 1.00 0.00 H new ATOM 0 H2'' DA B 15 31.184 32.033 21.057 1.00 0.00 H new ATOM 0 H1' DA B 15 31.270 34.286 20.133 1.00 0.00 H new ATOM 0 H8 DA B 15 27.657 33.620 21.351 1.00 0.00 H new ATOM 0 H61 DA B 15 29.356 37.889 25.645 1.00 0.00 H new ATOM 0 H62 DA B 15 27.996 36.883 25.135 1.00 0.00 H new ATOM 0 H2 DA B 15 32.715 37.257 23.004 1.00 0.00 H new ATOM 475 P DT B 16 32.391 29.861 19.383 1.00 0.00 P ATOM 476 OP1 DT B 16 33.504 29.361 18.537 1.00 0.00 O ATOM 477 OP2 DT B 16 31.264 28.950 19.705 1.00 0.00 O ATOM 478 O5' DT B 16 32.994 30.442 20.752 1.00 0.00 O ATOM 479 C5' DT B 16 34.097 31.338 20.736 1.00 0.00 C ATOM 480 C4' DT B 16 34.332 32.019 22.089 1.00 0.00 C ATOM 481 O4' DT B 16 33.292 32.909 22.460 1.00 0.00 O ATOM 482 C3' DT B 16 34.401 31.037 23.252 1.00 0.00 C ATOM 483 O3' DT B 16 35.618 30.308 23.206 1.00 0.00 O ATOM 484 C2' DT B 16 34.306 32.014 24.419 1.00 0.00 C ATOM 485 C1' DT B 16 33.426 33.143 23.857 1.00 0.00 C ATOM 486 N1 DT B 16 32.095 33.227 24.521 1.00 0.00 N ATOM 487 C2 DT B 16 31.974 34.120 25.588 1.00 0.00 C ATOM 488 O2 DT B 16 32.922 34.745 26.057 1.00 0.00 O ATOM 489 N3 DT B 16 30.722 34.281 26.125 1.00 0.00 N ATOM 490 C4 DT B 16 29.585 33.603 25.744 1.00 0.00 C ATOM 491 O4 DT B 16 28.515 33.896 26.278 1.00 0.00 O ATOM 492 C5 DT B 16 29.800 32.595 24.702 1.00 0.00 C ATOM 493 C7 DT B 16 28.651 31.718 24.237 1.00 0.00 C ATOM 494 C6 DT B 16 31.029 32.441 24.132 1.00 0.00 C ATOM 0 H5' DT B 16 33.928 32.101 19.976 1.00 0.00 H new ATOM 0 H5'' DT B 16 34.996 30.794 20.448 1.00 0.00 H new ATOM 0 H4' DT B 16 35.277 32.537 21.929 1.00 0.00 H new ATOM 0 H3' DT B 16 33.642 30.256 23.283 1.00 0.00 H new ATOM 0 H2' DT B 16 33.856 31.551 25.297 1.00 0.00 H new ATOM 0 H2'' DT B 16 35.288 32.380 24.720 1.00 0.00 H new ATOM 0 H1' DT B 16 33.900 34.105 24.052 1.00 0.00 H new ATOM 0 H3 DT B 16 30.624 34.965 26.875 1.00 0.00 H new ATOM 0 H71 DT B 16 28.801 31.446 23.192 1.00 0.00 H new ATOM 0 H72 DT B 16 28.614 30.814 24.846 1.00 0.00 H new ATOM 0 H73 DT B 16 27.713 32.263 24.339 1.00 0.00 H new ATOM 0 H6 DT B 16 31.170 31.694 23.365 1.00 0.00 H new ATOM 507 P DG B 17 35.709 28.774 23.682 1.00 0.00 P ATOM 508 OP1 DG B 17 36.961 28.192 23.136 1.00 0.00 O ATOM 509 OP2 DG B 17 34.423 28.085 23.409 1.00 0.00 O ATOM 510 O5' DG B 17 35.856 28.918 25.270 1.00 0.00 O ATOM 511 C5' DG B 17 37.052 29.390 25.876 1.00 0.00 C ATOM 512 C4' DG B 17 36.995 29.285 27.407 1.00 0.00 C ATOM 513 O4' DG B 17 36.006 30.172 27.915 1.00 0.00 O ATOM 514 C3' DG B 17 36.626 27.868 27.881 1.00 0.00 C ATOM 515 O3' DG B 17 37.223 27.538 29.122 1.00 0.00 O ATOM 516 C2' DG B 17 35.122 27.994 28.080 1.00 0.00 C ATOM 517 C1' DG B 17 35.000 29.435 28.586 1.00 0.00 C ATOM 518 N9 DG B 17 33.688 30.084 28.337 1.00 0.00 N ATOM 519 C8 DG B 17 32.807 29.918 27.292 1.00 0.00 C ATOM 520 N7 DG B 17 31.753 30.693 27.346 1.00 0.00 N ATOM 521 C5 DG B 17 31.946 31.428 28.524 1.00 0.00 C ATOM 522 C6 DG B 17 31.153 32.445 29.170 1.00 0.00 C ATOM 523 O6 DG B 17 30.067 32.913 28.840 1.00 0.00 O ATOM 524 N1 DG B 17 31.715 32.941 30.330 1.00 0.00 N ATOM 525 C2 DG B 17 32.885 32.507 30.838 1.00 0.00 C ATOM 526 N2 DG B 17 33.301 33.051 31.946 1.00 0.00 N ATOM 527 N3 DG B 17 33.654 31.581 30.276 1.00 0.00 N ATOM 528 C4 DG B 17 33.131 31.067 29.124 1.00 0.00 C ATOM 0 H5' DG B 17 37.220 30.428 25.589 1.00 0.00 H new ATOM 0 H5'' DG B 17 37.900 28.815 25.503 1.00 0.00 H new ATOM 0 H4' DG B 17 37.989 29.538 27.774 1.00 0.00 H new ATOM 0 H3' DG B 17 36.953 27.098 27.182 1.00 0.00 H new ATOM 0 H2' DG B 17 34.571 27.837 27.153 1.00 0.00 H new ATOM 0 H2'' DG B 17 34.742 27.272 28.803 1.00 0.00 H new ATOM 0 H1' DG B 17 35.105 29.416 29.671 1.00 0.00 H new ATOM 0 H8 DG B 17 32.971 29.208 26.495 1.00 0.00 H new ATOM 0 H1 DG B 17 31.216 33.677 30.830 1.00 0.00 H new ATOM 0 H21 DG B 17 34.182 32.750 32.363 1.00 0.00 H new ATOM 0 H22 DG B 17 32.746 33.778 32.397 1.00 0.00 H new ATOM 540 P DT B 18 38.721 26.967 29.210 1.00 0.00 P ATOM 541 OP1 DT B 18 39.581 27.654 28.214 1.00 0.00 O ATOM 542 OP2 DT B 18 38.655 25.485 29.205 1.00 0.00 O ATOM 543 O5' DT B 18 39.164 27.445 30.678 1.00 0.00 O ATOM 544 C5' DT B 18 39.170 28.823 31.048 1.00 0.00 C ATOM 545 C4' DT B 18 38.137 29.155 32.138 1.00 0.00 C ATOM 546 O4' DT B 18 36.794 29.208 31.677 1.00 0.00 O ATOM 547 C3' DT B 18 38.158 28.186 33.332 1.00 0.00 C ATOM 548 O3' DT B 18 38.754 28.834 34.449 1.00 0.00 O ATOM 549 C2' DT B 18 36.674 27.840 33.521 1.00 0.00 C ATOM 550 C1' DT B 18 35.974 28.996 32.813 1.00 0.00 C ATOM 551 N1 DT B 18 34.553 28.769 32.413 1.00 0.00 N ATOM 552 C2 DT B 18 33.582 29.670 32.881 1.00 0.00 C ATOM 553 O2 DT B 18 33.772 30.493 33.770 1.00 0.00 O ATOM 554 N3 DT B 18 32.339 29.607 32.302 1.00 0.00 N ATOM 555 C4 DT B 18 31.980 28.752 31.291 1.00 0.00 C ATOM 556 O4 DT B 18 30.905 28.931 30.727 1.00 0.00 O ATOM 557 C5 DT B 18 32.955 27.703 30.999 1.00 0.00 C ATOM 558 C7 DT B 18 32.577 26.560 30.068 1.00 0.00 C ATOM 559 C6 DT B 18 34.200 27.749 31.551 1.00 0.00 C ATOM 0 H5' DT B 18 38.969 29.431 30.166 1.00 0.00 H new ATOM 0 H5'' DT B 18 40.164 29.094 31.402 1.00 0.00 H new ATOM 0 H4' DT B 18 38.456 30.148 32.453 1.00 0.00 H new ATOM 0 H3' DT B 18 38.749 27.280 33.193 1.00 0.00 H new ATOM 0 H2' DT B 18 36.421 26.878 33.075 1.00 0.00 H new ATOM 0 H2'' DT B 18 36.401 27.784 34.575 1.00 0.00 H new ATOM 0 H1' DT B 18 35.878 29.845 33.489 1.00 0.00 H new ATOM 0 H3 DT B 18 31.626 30.247 32.651 1.00 0.00 H new ATOM 0 H71 DT B 18 31.506 26.370 30.141 1.00 0.00 H new ATOM 0 H72 DT B 18 32.829 26.828 29.042 1.00 0.00 H new ATOM 0 H73 DT B 18 33.125 25.662 30.353 1.00 0.00 H new ATOM 0 H6 DT B 18 34.919 26.979 31.312 1.00 0.00 H new ATOM 572 P DA B 19 39.371 28.009 35.693 1.00 0.00 P ATOM 573 OP1 DA B 19 40.364 28.876 36.374 1.00 0.00 O ATOM 574 OP2 DA B 19 39.796 26.663 35.233 1.00 0.00 O ATOM 575 O5' DA B 19 38.095 27.829 36.653 1.00 0.00 O ATOM 576 C5' DA B 19 37.587 28.933 37.389 1.00 0.00 C ATOM 577 C4' DA B 19 36.152 28.704 37.872 1.00 0.00 C ATOM 578 O4' DA B 19 35.262 28.590 36.771 1.00 0.00 O ATOM 579 C3' DA B 19 35.950 27.468 38.763 1.00 0.00 C ATOM 580 O3' DA B 19 35.681 27.896 40.095 1.00 0.00 O ATOM 581 C2' DA B 19 34.786 26.751 38.066 1.00 0.00 C ATOM 582 C1' DA B 19 34.149 27.840 37.204 1.00 0.00 C ATOM 583 N9 DA B 19 33.423 27.316 36.025 1.00 0.00 N ATOM 584 C8 DA B 19 33.862 26.385 35.112 1.00 0.00 C ATOM 585 N7 DA B 19 33.009 26.114 34.159 1.00 0.00 N ATOM 586 C5 DA B 19 31.920 26.939 34.477 1.00 0.00 C ATOM 587 C6 DA B 19 30.655 27.175 33.893 1.00 0.00 C ATOM 588 N6 DA B 19 30.219 26.583 32.802 1.00 0.00 N ATOM 589 N1 DA B 19 29.801 28.056 34.410 1.00 0.00 N ATOM 590 C2 DA B 19 30.172 28.698 35.506 1.00 0.00 C ATOM 591 N3 DA B 19 31.315 28.589 36.178 1.00 0.00 N ATOM 592 C4 DA B 19 32.161 27.682 35.603 1.00 0.00 C ATOM 0 H5' DA B 19 37.619 29.827 36.766 1.00 0.00 H new ATOM 0 H5'' DA B 19 38.231 29.120 38.248 1.00 0.00 H new ATOM 0 H4' DA B 19 35.938 29.582 38.482 1.00 0.00 H new ATOM 0 H3' DA B 19 36.805 26.800 38.867 1.00 0.00 H new ATOM 0 H2' DA B 19 35.136 25.915 37.460 1.00 0.00 H new ATOM 0 H2'' DA B 19 34.076 26.346 38.787 1.00 0.00 H new ATOM 0 H1' DA B 19 33.401 28.399 37.767 1.00 0.00 H new ATOM 0 H8 DA B 19 34.833 25.916 35.177 1.00 0.00 H new ATOM 0 H61 DA B 19 29.292 26.804 32.438 1.00 0.00 H new ATOM 0 H62 DA B 19 30.808 25.903 32.321 1.00 0.00 H new ATOM 0 H2 DA B 19 29.455 29.400 35.906 1.00 0.00 H new ATOM 604 P DC B 20 35.465 26.867 41.320 1.00 0.00 P ATOM 605 OP1 DC B 20 35.762 27.585 42.585 1.00 0.00 O ATOM 606 OP2 DC B 20 36.184 25.601 41.029 1.00 0.00 O ATOM 607 O5' DC B 20 33.883 26.583 41.249 1.00 0.00 O ATOM 608 C5' DC B 20 32.951 27.634 41.476 1.00 0.00 C ATOM 609 C4' DC B 20 31.520 27.280 41.045 1.00 0.00 C ATOM 610 O4' DC B 20 31.435 27.019 39.645 1.00 0.00 O ATOM 611 C3' DC B 20 30.958 26.045 41.771 1.00 0.00 C ATOM 612 O3' DC B 20 29.990 26.439 42.741 1.00 0.00 O ATOM 613 C2' DC B 20 30.398 25.200 40.617 1.00 0.00 C ATOM 614 C1' DC B 20 30.313 26.176 39.442 1.00 0.00 C ATOM 615 N1 DC B 20 30.381 25.507 38.107 1.00 0.00 N ATOM 616 C2 DC B 20 29.298 25.576 37.212 1.00 0.00 C ATOM 617 O2 DC B 20 28.269 26.198 37.476 1.00 0.00 O ATOM 618 N3 DC B 20 29.347 24.956 36.000 1.00 0.00 N ATOM 619 C4 DC B 20 30.435 24.279 35.695 1.00 0.00 C ATOM 620 N4 DC B 20 30.469 23.723 34.519 1.00 0.00 N ATOM 621 C5 DC B 20 31.563 24.181 36.549 1.00 0.00 C ATOM 622 C6 DC B 20 31.504 24.808 37.749 1.00 0.00 C ATOM 0 H5' DC B 20 33.277 28.522 40.935 1.00 0.00 H new ATOM 0 H5'' DC B 20 32.952 27.888 42.536 1.00 0.00 H new ATOM 0 H4' DC B 20 30.931 28.158 41.311 1.00 0.00 H new ATOM 0 H3' DC B 20 31.685 25.478 42.353 1.00 0.00 H new ATOM 0 H2' DC B 20 31.050 24.357 40.388 1.00 0.00 H new ATOM 0 H2'' DC B 20 29.419 24.788 40.864 1.00 0.00 H new ATOM 0 H1' DC B 20 29.358 26.701 39.423 1.00 0.00 H new ATOM 0 H41 DC B 20 31.288 23.187 34.232 1.00 0.00 H new ATOM 0 H42 DC B 20 29.677 23.823 33.884 1.00 0.00 H new ATOM 0 H5 DC B 20 32.440 23.625 36.253 1.00 0.00 H new ATOM 0 H6 DC B 20 32.345 24.757 38.425 1.00 0.00 H new ATOM 634 P DA B 21 29.372 25.408 43.826 1.00 0.00 P ATOM 635 OP1 DA B 21 28.841 26.198 44.966 1.00 0.00 O ATOM 636 OP2 DA B 21 30.366 24.339 44.103 1.00 0.00 O ATOM 637 O5' DA B 21 28.133 24.753 43.036 1.00 0.00 O ATOM 638 C5' DA B 21 27.006 25.539 42.665 1.00 0.00 C ATOM 639 C4' DA B 21 26.157 24.873 41.574 1.00 0.00 C ATOM 640 O4' DA B 21 26.920 24.647 40.401 1.00 0.00 O ATOM 641 C3' DA B 21 25.598 23.498 41.950 1.00 0.00 C ATOM 642 O3' DA B 21 24.370 23.604 42.663 1.00 0.00 O ATOM 643 C2' DA B 21 25.437 22.830 40.580 1.00 0.00 C ATOM 644 C1' DA B 21 26.177 23.747 39.609 1.00 0.00 C ATOM 645 N9 DA B 21 27.041 23.042 38.641 1.00 0.00 N ATOM 646 C8 DA B 21 28.279 22.485 38.844 1.00 0.00 C ATOM 647 N7 DA B 21 28.797 21.922 37.780 1.00 0.00 N ATOM 648 C5 DA B 21 27.805 22.125 36.803 1.00 0.00 C ATOM 649 C6 DA B 21 27.658 21.791 35.433 1.00 0.00 C ATOM 650 N6 DA B 21 28.546 21.143 34.704 1.00 0.00 N ATOM 651 N1 DA B 21 26.562 22.124 34.749 1.00 0.00 N ATOM 652 C2 DA B 21 25.610 22.784 35.393 1.00 0.00 C ATOM 653 N3 DA B 21 25.593 23.171 36.662 1.00 0.00 N ATOM 654 C4 DA B 21 26.734 22.807 37.319 1.00 0.00 C ATOM 0 H5' DA B 21 27.347 26.512 42.312 1.00 0.00 H new ATOM 0 H5'' DA B 21 26.387 25.718 43.544 1.00 0.00 H new ATOM 0 H4' DA B 21 25.337 25.576 41.428 1.00 0.00 H new ATOM 0 H3' DA B 21 26.236 22.930 42.627 1.00 0.00 H new ATOM 0 H2' DA B 21 25.861 21.826 40.577 1.00 0.00 H new ATOM 0 H2'' DA B 21 24.386 22.732 40.309 1.00 0.00 H new ATOM 0 H1' DA B 21 25.448 24.258 38.980 1.00 0.00 H new ATOM 0 H8 DA B 21 28.783 22.509 39.799 1.00 0.00 H new ATOM 0 H61 DA B 21 28.354 20.946 33.722 1.00 0.00 H new ATOM 0 H62 DA B 21 29.425 20.839 35.122 1.00 0.00 H new ATOM 0 H2 DA B 21 24.737 23.039 34.811 1.00 0.00 H new ATOM 666 P DT B 22 23.628 22.313 43.285 1.00 0.00 P ATOM 667 OP1 DT B 22 22.634 22.797 44.277 1.00 0.00 O ATOM 668 OP2 DT B 22 24.655 21.337 43.727 1.00 0.00 O ATOM 669 O5' DT B 22 22.839 21.682 42.027 1.00 0.00 O ATOM 670 C5' DT B 22 21.673 22.307 41.503 1.00 0.00 C ATOM 671 C4' DT B 22 21.112 21.614 40.251 1.00 0.00 C ATOM 672 O4' DT B 22 21.947 21.771 39.112 1.00 0.00 O ATOM 673 C3' DT B 22 20.950 20.100 40.398 1.00 0.00 C ATOM 674 O3' DT B 22 19.837 19.753 41.214 1.00 0.00 O ATOM 675 C2' DT B 22 20.746 19.734 38.930 1.00 0.00 C ATOM 676 C1' DT B 22 21.590 20.765 38.169 1.00 0.00 C ATOM 677 N1 DT B 22 22.800 20.157 37.547 1.00 0.00 N ATOM 678 C2 DT B 22 22.695 19.684 36.231 1.00 0.00 C ATOM 679 O2 DT B 22 21.659 19.736 35.568 1.00 0.00 O ATOM 680 N3 DT B 22 23.828 19.127 35.683 1.00 0.00 N ATOM 681 C4 DT B 22 25.042 18.974 36.312 1.00 0.00 C ATOM 682 O4 DT B 22 25.978 18.483 35.682 1.00 0.00 O ATOM 683 C5 DT B 22 25.070 19.428 37.703 1.00 0.00 C ATOM 684 C7 DT B 22 26.333 19.274 38.531 1.00 0.00 C ATOM 685 C6 DT B 22 23.970 19.999 38.263 1.00 0.00 C ATOM 0 H5' DT B 22 21.905 23.344 41.261 1.00 0.00 H new ATOM 0 H5'' DT B 22 20.903 22.324 42.274 1.00 0.00 H new ATOM 0 H4' DT B 22 20.146 22.103 40.127 1.00 0.00 H new ATOM 0 H3' DT B 22 21.774 19.585 40.891 1.00 0.00 H new ATOM 0 H2' DT B 22 21.077 18.716 38.723 1.00 0.00 H new ATOM 0 H2'' DT B 22 19.695 19.791 38.647 1.00 0.00 H new ATOM 0 H1' DT B 22 21.017 21.183 37.341 1.00 0.00 H new ATOM 0 H3 DT B 22 23.761 18.797 34.720 1.00 0.00 H new ATOM 0 H71 DT B 22 26.383 20.073 39.271 1.00 0.00 H new ATOM 0 H72 DT B 22 26.320 18.309 39.039 1.00 0.00 H new ATOM 0 H73 DT B 22 27.205 19.329 37.879 1.00 0.00 H new ATOM 0 H6 DT B 22 24.012 20.336 39.288 1.00 0.00 H new ATOM 698 P DC B 23 19.684 18.291 41.884 1.00 0.00 P ATOM 699 OP1 DC B 23 18.606 18.366 42.903 1.00 0.00 O ATOM 700 OP2 DC B 23 21.023 17.803 42.297 1.00 0.00 O ATOM 701 O5' DC B 23 19.176 17.356 40.678 1.00 0.00 O ATOM 702 C5' DC B 23 17.928 17.582 40.036 1.00 0.00 C ATOM 703 C4' DC B 23 17.677 16.621 38.862 1.00 0.00 C ATOM 704 O4' DC B 23 18.736 16.725 37.907 1.00 0.00 O ATOM 705 C3' DC B 23 17.571 15.146 39.288 1.00 0.00 C ATOM 706 O3' DC B 23 16.533 14.505 38.551 1.00 0.00 O ATOM 707 C2' DC B 23 18.969 14.627 38.963 1.00 0.00 C ATOM 708 C1' DC B 23 19.355 15.457 37.735 1.00 0.00 C ATOM 709 N1 DC B 23 20.833 15.614 37.579 1.00 0.00 N ATOM 710 C2 DC B 23 21.440 15.264 36.363 1.00 0.00 C ATOM 711 O2 DC B 23 20.793 14.901 35.381 1.00 0.00 O ATOM 712 N3 DC B 23 22.786 15.311 36.219 1.00 0.00 N ATOM 713 C4 DC B 23 23.511 15.725 37.235 1.00 0.00 C ATOM 714 N4 DC B 23 24.795 15.735 37.047 1.00 0.00 N ATOM 715 C5 DC B 23 22.961 16.155 38.470 1.00 0.00 C ATOM 716 C6 DC B 23 21.614 16.083 38.610 1.00 0.00 C ATOM 0 H5' DC B 23 17.893 18.609 39.672 1.00 0.00 H new ATOM 0 H5'' DC B 23 17.125 17.474 40.765 1.00 0.00 H new ATOM 0 H4' DC B 23 16.720 16.920 38.435 1.00 0.00 H new ATOM 0 H3' DC B 23 17.305 14.971 40.331 1.00 0.00 H new ATOM 0 H2' DC B 23 19.661 14.781 39.791 1.00 0.00 H new ATOM 0 H2'' DC B 23 18.965 13.559 38.746 1.00 0.00 H new ATOM 0 H1' DC B 23 19.021 14.953 36.828 1.00 0.00 H new ATOM 0 H41 DC B 23 25.417 16.045 37.793 1.00 0.00 H new ATOM 0 H42 DC B 23 25.182 15.433 36.153 1.00 0.00 H new ATOM 0 H5 DC B 23 23.590 16.525 39.267 1.00 0.00 H new ATOM 0 H6 DC B 23 21.152 16.395 39.535 1.00 0.00 H new ATOM 728 P DG B 24 16.082 12.978 38.823 1.00 0.00 P ATOM 729 OP1 DG B 24 14.673 12.830 38.380 1.00 0.00 O ATOM 730 OP2 DG B 24 16.438 12.605 40.215 1.00 0.00 O ATOM 731 O5' DG B 24 17.026 12.144 37.818 1.00 0.00 O ATOM 732 C5' DG B 24 16.868 12.259 36.410 1.00 0.00 C ATOM 733 C4' DG B 24 18.000 11.587 35.619 1.00 0.00 C ATOM 734 O4' DG B 24 19.245 12.235 35.879 1.00 0.00 O ATOM 735 C3' DG B 24 18.185 10.091 35.946 1.00 0.00 C ATOM 736 O3' DG B 24 18.314 9.311 34.758 1.00 0.00 O ATOM 737 C2' DG B 24 19.504 10.098 36.713 1.00 0.00 C ATOM 738 C1' DG B 24 20.234 11.228 35.991 1.00 0.00 C ATOM 739 N9 DG B 24 21.441 11.697 36.712 1.00 0.00 N ATOM 740 C8 DG B 24 21.571 12.062 38.031 1.00 0.00 C ATOM 741 N7 DG B 24 22.796 12.342 38.395 1.00 0.00 N ATOM 742 C5 DG B 24 23.542 12.135 37.225 1.00 0.00 C ATOM 743 C6 DG B 24 24.957 12.229 36.960 1.00 0.00 C ATOM 744 O6 DG B 24 25.877 12.529 37.724 1.00 0.00 O ATOM 745 N1 DG B 24 25.299 11.910 35.659 1.00 0.00 N ATOM 746 C2 DG B 24 24.399 11.542 34.713 1.00 0.00 C ATOM 747 N2 DG B 24 24.853 11.261 33.518 1.00 0.00 N ATOM 748 N3 DG B 24 23.089 11.435 34.910 1.00 0.00 N ATOM 749 C4 DG B 24 22.716 11.746 36.190 1.00 0.00 C ATOM 0 H5' DG B 24 16.822 13.314 36.141 1.00 0.00 H new ATOM 0 H5'' DG B 24 15.916 11.814 36.120 1.00 0.00 H new ATOM 0 H4' DG B 24 17.707 11.677 34.573 1.00 0.00 H new ATOM 0 H3' DG B 24 17.345 9.661 36.491 1.00 0.00 H new ATOM 0 H2' DG B 24 19.366 10.304 37.774 1.00 0.00 H new ATOM 0 H2'' DG B 24 20.033 9.148 36.639 1.00 0.00 H new ATOM 0 HO3' DG B 24 18.432 8.368 34.997 1.00 0.00 H new ATOM 0 H1' DG B 24 20.631 10.913 35.026 1.00 0.00 H new ATOM 0 H8 DG B 24 20.732 12.113 38.710 1.00 0.00 H new ATOM 0 H1 DG B 24 26.283 11.954 35.396 1.00 0.00 H new ATOM 0 H21 DG B 24 24.207 10.980 32.780 1.00 0.00 H new ATOM 0 H22 DG B 24 25.853 11.323 33.325 1.00 0.00 H new TER 762 DG B 24 HETATM 763 O81 9TK A 101 23.207 30.770 38.654 1.00 0.00 O HETATM 764 C81 9TK A 101 23.860 30.179 37.800 1.00 0.00 C HETATM 765 C83 9TK A 101 21.808 27.707 36.073 1.00 0.00 C HETATM 766 N81 9TK A 101 21.978 28.686 37.025 1.00 0.00 N HETATM 767 C88 9TK A 101 20.917 29.164 37.925 1.00 0.00 C HETATM 768 C82 9TK A 101 23.313 29.076 36.936 1.00 0.00 C HETATM 769 N82 9TK A 101 23.967 28.372 36.016 1.00 0.00 N HETATM 770 C84 9TK A 101 23.027 27.524 35.483 1.00 0.00 C HETATM 776 N PYB A 102 25.191 30.501 37.534 1.00 0.00 N HETATM 777 CA PYB A 102 25.982 31.428 38.207 1.00 0.00 C HETATM 778 CB1 PYB A 102 27.282 31.833 37.811 1.00 0.00 C HETATM 779 CB PYB A 102 25.643 32.094 39.354 1.00 0.00 C HETATM 780 CG1 PYB A 102 27.722 32.760 38.729 1.00 0.00 C HETATM 781 NG2 PYB A 102 26.686 32.955 39.654 1.00 0.00 N HETATM 782 CD PYB A 102 26.598 33.951 40.733 1.00 0.00 C HETATM 783 C PYB A 102 29.033 33.450 38.883 1.00 0.00 C HETATM 784 O PYB A 102 29.292 34.100 39.888 1.00 0.00 O HETATM 0 HD3 PYB A 102 25.773 34.635 40.531 1.00 0.00 H new HETATM 0 HD2 PYB A 102 26.425 33.444 41.682 1.00 0.00 H new HETATM 0 HD1 PYB A 102 27.530 34.513 40.786 1.00 0.00 H new HETATM 0 HB1 PYB A 102 27.832 31.476 36.940 1.00 0.00 H new HETATM 0 HB PYB A 102 24.723 31.970 39.925 1.00 0.00 H new HETATM 0 H PYB A 102 25.538 30.055 36.685 1.00 0.00 H new HETATM 791 N PYB A 103 29.943 33.341 37.836 1.00 0.00 N HETATM 792 CA PYB A 103 31.242 33.862 37.844 1.00 0.00 C HETATM 793 CB1 PYB A 103 32.067 34.113 36.714 1.00 0.00 C HETATM 794 CB PYB A 103 31.924 34.256 38.964 1.00 0.00 C HETATM 795 CG1 PYB A 103 33.224 34.718 37.163 1.00 0.00 C HETATM 796 NG2 PYB A 103 33.129 34.800 38.559 1.00 0.00 N HETATM 797 CD PYB A 103 34.085 35.367 39.524 1.00 0.00 C HETATM 798 C PYB A 103 34.440 35.220 36.451 1.00 0.00 C HETATM 799 O PYB A 103 35.382 35.695 37.069 1.00 0.00 O HETATM 0 HD3 PYB A 103 33.613 36.188 40.064 1.00 0.00 H new HETATM 0 HD2 PYB A 103 34.389 34.595 40.231 1.00 0.00 H new HETATM 0 HD1 PYB A 103 34.962 35.738 38.993 1.00 0.00 H new HETATM 0 HB1 PYB A 103 31.829 33.871 35.678 1.00 0.00 H new HETATM 0 HB PYB A 103 31.578 34.158 39.993 1.00 0.00 H new HETATM 0 H PYB A 103 29.496 33.100 36.952 1.00 0.00 H new HETATM 806 N PYB A 104 34.472 35.142 35.060 1.00 0.00 N HETATM 807 CA PYB A 104 35.547 35.523 34.243 1.00 0.00 C HETATM 808 CB1 PYB A 104 35.554 35.528 32.823 1.00 0.00 C HETATM 809 CB PYB A 104 36.776 35.974 34.668 1.00 0.00 C HETATM 810 CG1 PYB A 104 36.775 36.018 32.406 1.00 0.00 C HETATM 811 NG2 PYB A 104 37.519 36.314 33.549 1.00 0.00 N HETATM 812 CD PYB A 104 38.874 36.881 33.632 1.00 0.00 C HETATM 813 C PYB A 104 37.348 36.195 31.043 1.00 0.00 C HETATM 814 O PYB A 104 38.448 36.673 30.811 1.00 0.00 O HETATM 0 HD3 PYB A 104 38.842 37.819 34.186 1.00 0.00 H new HETATM 0 HD2 PYB A 104 39.531 36.179 34.145 1.00 0.00 H new HETATM 0 HD1 PYB A 104 39.253 37.065 32.627 1.00 0.00 H new HETATM 0 HB1 PYB A 104 34.739 35.202 32.177 1.00 0.00 H new HETATM 0 HB PYB A 104 37.107 36.050 35.704 1.00 0.00 H new HETATM 0 H PYB A 104 33.596 34.833 34.639 1.00 0.00 H new HETATM 821 N ABU A 105 36.576 35.724 30.007 1.00 0.00 N HETATM 822 CA ABU A 105 37.130 35.615 28.646 1.00 0.00 C HETATM 823 CB ABU A 105 36.313 34.729 27.679 1.00 0.00 C HETATM 824 CG ABU A 105 36.097 33.257 28.133 1.00 0.00 C HETATM 825 CD ABU A 105 37.029 32.775 29.254 1.00 0.00 C HETATM 826 OE1 ABU A 105 38.240 32.678 29.112 1.00 0.00 O HETATM 0 H ABU A 105 35.604 35.428 30.100 1.00 0.00 H new HETATM 0 HB1 ABU A 105 35.337 35.191 27.529 1.00 0.00 H new HETATM 0 HB2 ABU A 105 36.814 34.722 26.711 1.00 0.00 H new HETATM 0 HG1 ABU A 105 35.512 32.727 27.381 1.00 0.00 H new HETATM 0 HG2 ABU A 105 37.064 32.768 28.253 1.00 0.00 H new HETATM 0 HE2 ABU A 105 35.564 33.244 29.083 1.00 0.00 H new HETATM 834 N IMT A 106 36.386 32.531 30.443 1.00 0.00 N HETATM 835 CA IMT A 106 36.889 32.513 31.712 1.00 0.00 C HETATM 836 NB1 IMT A 106 36.124 32.293 32.824 1.00 0.00 N HETATM 837 CB IMT A 106 38.179 32.818 32.050 1.00 0.00 C HETATM 838 CG1 IMT A 106 36.948 32.459 33.856 1.00 0.00 C HETATM 839 NG2 IMT A 106 38.235 32.784 33.426 1.00 0.00 N HETATM 840 CD IMT A 106 39.446 33.053 34.217 1.00 0.00 C HETATM 841 C IMT A 106 36.625 32.346 35.326 1.00 0.00 C HETATM 842 O IMT A 106 37.430 32.589 36.220 1.00 0.00 O HETATM 0 HN2 IMT A 106 35.390 32.375 30.287 1.00 0.00 H new HETATM 0 HD3 IMT A 106 40.222 32.336 33.950 1.00 0.00 H new HETATM 0 HD2 IMT A 106 39.799 34.063 34.010 1.00 0.00 H new HETATM 0 HD1 IMT A 106 39.216 32.960 35.278 1.00 0.00 H new HETATM 0 HB IMT A 106 38.998 33.043 31.367 1.00 0.00 H new HETATM 848 N PYB A 107 35.328 31.918 35.612 1.00 0.00 N HETATM 849 CA PYB A 107 34.743 31.740 36.866 1.00 0.00 C HETATM 850 CB1 PYB A 107 33.461 31.175 37.117 1.00 0.00 C HETATM 851 CB PYB A 107 35.312 32.079 38.063 1.00 0.00 C HETATM 852 CG1 PYB A 107 33.272 31.153 38.485 1.00 0.00 C HETATM 853 NG2 PYB A 107 34.432 31.696 39.064 1.00 0.00 N HETATM 854 CD PYB A 107 34.778 31.840 40.486 1.00 0.00 C HETATM 855 C PYB A 107 32.113 30.739 39.338 1.00 0.00 C HETATM 856 O PYB A 107 32.161 30.861 40.554 1.00 0.00 O HETATM 0 HD3 PYB A 107 35.672 31.256 40.704 1.00 0.00 H new HETATM 0 HD2 PYB A 107 34.967 32.890 40.710 1.00 0.00 H new HETATM 0 HD1 PYB A 107 33.952 31.482 41.100 1.00 0.00 H new HETATM 0 HB1 PYB A 107 32.755 30.823 36.365 1.00 0.00 H new HETATM 0 HB PYB A 107 36.279 32.561 38.204 1.00 0.00 H new HETATM 0 H PYB A 107 34.828 31.632 34.771 1.00 0.00 H new HETATM 863 N PYB A 108 30.974 30.203 38.730 1.00 0.00 N HETATM 864 CA PYB A 108 29.758 29.966 39.394 1.00 0.00 C HETATM 865 CB1 PYB A 108 28.675 29.137 38.977 1.00 0.00 C HETATM 866 CB PYB A 108 29.414 30.529 40.595 1.00 0.00 C HETATM 867 CG1 PYB A 108 27.721 29.147 39.982 1.00 0.00 C HETATM 868 NG2 PYB A 108 28.173 30.043 40.962 1.00 0.00 N HETATM 869 CD PYB A 108 27.499 30.500 42.187 1.00 0.00 C HETATM 870 C PYB A 108 26.405 28.448 40.157 1.00 0.00 C HETATM 871 O PYB A 108 25.742 28.589 41.174 1.00 0.00 O HETATM 0 HD3 PYB A 108 28.121 30.269 43.052 1.00 0.00 H new HETATM 0 HD2 PYB A 108 27.337 31.577 42.133 1.00 0.00 H new HETATM 0 HD1 PYB A 108 26.539 29.993 42.285 1.00 0.00 H new HETATM 0 HB1 PYB A 108 28.609 28.592 38.035 1.00 0.00 H new HETATM 0 HB PYB A 108 30.016 31.238 41.163 1.00 0.00 H new HETATM 0 H PYB A 108 31.162 29.753 37.834 1.00 0.00 H new HETATM 878 N PYB A 109 25.949 27.611 39.145 1.00 0.00 N HETATM 879 CA PYB A 109 24.695 26.978 39.107 1.00 0.00 C HETATM 880 CB1 PYB A 109 24.266 26.069 38.108 1.00 0.00 C HETATM 881 CB PYB A 109 23.655 27.137 39.994 1.00 0.00 C HETATM 882 CG1 PYB A 109 22.974 25.684 38.397 1.00 0.00 C HETATM 883 NG2 PYB A 109 22.600 26.335 39.574 1.00 0.00 N HETATM 884 CD PYB A 109 21.315 26.244 40.284 1.00 0.00 C HETATM 885 C PYB A 109 22.030 24.830 37.626 1.00 0.00 C HETATM 886 O PYB A 109 20.853 24.649 37.901 1.00 0.00 O HETATM 0 HD3 PYB A 109 21.485 25.883 41.298 1.00 0.00 H new HETATM 0 HD2 PYB A 109 20.850 27.229 40.322 1.00 0.00 H new HETATM 0 HD1 PYB A 109 20.657 25.552 39.758 1.00 0.00 H new HETATM 0 HB1 PYB A 109 24.857 25.732 37.256 1.00 0.00 H new HETATM 0 HB PYB A 109 23.658 27.780 40.874 1.00 0.00 H new HETATM 0 H PYB A 109 26.635 27.428 38.413 1.00 0.00 H new HETATM 893 C01 9T8 A 110 13.910 24.221 31.191 1.00 0.00 C HETATM 894 N02 9T8 A 110 19.338 23.693 33.529 1.00 0.00 N HETATM 895 C03 9T8 A 110 15.546 24.345 33.065 1.00 0.00 C HETATM 896 C05 9T8 A 110 18.081 24.004 32.829 1.00 0.00 C HETATM 897 C06 9T8 A 110 20.252 24.649 33.924 1.00 0.00 C HETATM 898 C07 9T8 A 110 21.664 24.133 34.177 1.00 0.00 C HETATM 899 C04 9T8 A 110 16.850 23.873 33.749 1.00 0.00 C HETATM 900 N01 9T8 A 110 15.075 23.503 31.876 1.00 0.00 N HETATM 901 C02 9T8 A 110 14.590 22.128 32.348 1.00 0.00 C HETATM 902 N03 9T8 A 110 22.587 24.257 36.508 1.00 0.00 N HETATM 903 C08 9T8 A 110 21.848 23.428 35.540 1.00 0.00 C HETATM 904 O01 9T8 A 110 19.957 25.830 33.985 1.00 0.00 O