USER MOD reduce.3.24.130724 H: found=0, std=0, add=605, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 602 hydrogens (0 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 Set 1.1: A 2 SER OG : rot -170:sc= 0.761 USER MOD Set 1.2: A 94 LYS NZ :NH3+ 166:sc= 0.965 (180deg=-0.18) USER MOD Set 2.1: A 45 THR OG1 : rot 180:sc= -0.102 USER MOD Set 2.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl 145:sc=-0.000117 (180deg=-0.0696) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -108:sc= 0.897 USER MOD Single : A 12 THR OG1 : rot -170:sc=-0.000456 USER MOD Single : A 16 LYS NZ :NH3+ -176:sc= -1.13 (180deg=-1.22) USER MOD Single : A 17 GLN : amide:sc= -0.789 K(o=-0.79,f=-2.4!) USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.131 X(o=-0.13,f=-0.13) USER MOD Single : A 30 THR OG1 : rot 61:sc= 0.464 USER MOD Single : A 34 LYS NZ :NH3+ 171:sc= -2! (180deg=-2.04!) USER MOD Single : A 36 GLN : amide:sc=-0.00516 K(o=-0.0052,f=-0.94) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ -159:sc= 0.576 (180deg=-0.31!) USER MOD Single : A 40 TYR OH : rot 180:sc= -1.73! USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -1.23 K(o=-1.2,f=-2.5!) USER MOD Single : A 51 THR OG1 : rot 69:sc= 0.509 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN :FLIP amide:sc= -0.168 F(o=-1.5,f=-0.17) USER MOD Single : A 69 SER OG : rot 92:sc= 0.771 USER MOD Single : A 71 SER OG : rot 114:sc= -0.526! USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 SER OG : rot 93:sc= 1.07 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ -153:sc= 0.364 (180deg=-1.76!) USER MOD Single : A 88 THR OG1 : rot 14:sc= 0.855 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot -130:sc= -1.71! USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 148:sc= 0.605 (180deg=-0.676) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.013 4.901 -5.088 1.00 0.00 N ATOM 2 CA GLY A 1 1.000 4.032 -4.384 1.00 0.00 C ATOM 3 C GLY A 1 2.156 4.825 -3.804 1.00 0.00 C ATOM 4 O GLY A 1 3.311 4.647 -4.205 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.758 4.315 -5.467 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.377 5.596 -4.419 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.485 5.400 -5.869 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.497 3.489 -3.584 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.386 3.287 -5.080 1.00 0.00 H new ATOM 7 N SER A 2 1.850 5.700 -2.863 1.00 0.00 N ATOM 8 CA SER A 2 2.855 6.526 -2.243 1.00 0.00 C ATOM 9 C SER A 2 2.315 7.115 -0.944 1.00 0.00 C ATOM 10 O SER A 2 1.139 6.936 -0.615 1.00 0.00 O ATOM 11 CB SER A 2 3.282 7.643 -3.205 1.00 0.00 C ATOM 12 OG SER A 2 4.474 8.275 -2.765 1.00 0.00 O ATOM 0 H SER A 2 0.904 5.853 -2.513 1.00 0.00 H new ATOM 0 HA SER A 2 3.728 5.916 -2.011 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.434 7.229 -4.202 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.484 8.382 -3.285 1.00 0.00 H new ATOM 0 HG SER A 2 4.636 9.078 -3.303 1.00 0.00 H new ATOM 18 N MET A 3 3.169 7.798 -0.206 1.00 0.00 N ATOM 19 CA MET A 3 2.767 8.411 1.046 1.00 0.00 C ATOM 20 C MET A 3 1.981 9.687 0.790 1.00 0.00 C ATOM 21 O MET A 3 2.391 10.538 -0.015 1.00 0.00 O ATOM 22 CB MET A 3 3.986 8.706 1.936 1.00 0.00 C ATOM 23 CG MET A 3 4.961 9.728 1.364 1.00 0.00 C ATOM 24 SD MET A 3 6.346 10.057 2.471 1.00 0.00 S ATOM 25 CE MET A 3 7.233 11.311 1.548 1.00 0.00 C ATOM 0 H MET A 3 4.148 7.943 -0.452 1.00 0.00 H new ATOM 0 HA MET A 3 2.125 7.704 1.572 1.00 0.00 H new ATOM 0 HB2 MET A 3 3.634 9.062 2.904 1.00 0.00 H new ATOM 0 HB3 MET A 3 4.522 7.774 2.115 1.00 0.00 H new ATOM 0 HG2 MET A 3 5.342 9.367 0.409 1.00 0.00 H new ATOM 0 HG3 MET A 3 4.431 10.659 1.164 1.00 0.00 H new ATOM 0 HE1 MET A 3 7.676 12.027 2.240 1.00 0.00 H new ATOM 0 HE2 MET A 3 8.020 10.841 0.959 1.00 0.00 H new ATOM 0 HE3 MET A 3 6.543 11.829 0.882 1.00 0.00 H new ATOM 35 N SER A 4 0.859 9.818 1.461 1.00 0.00 N ATOM 36 CA SER A 4 0.034 10.989 1.325 1.00 0.00 C ATOM 37 C SER A 4 0.580 12.105 2.199 1.00 0.00 C ATOM 38 O SER A 4 0.225 12.229 3.372 1.00 0.00 O ATOM 39 CB SER A 4 -1.410 10.664 1.697 1.00 0.00 C ATOM 40 OG SER A 4 -1.888 9.566 0.933 1.00 0.00 O ATOM 0 H SER A 4 0.498 9.120 2.111 1.00 0.00 H new ATOM 0 HA SER A 4 0.049 11.321 0.287 1.00 0.00 H new ATOM 0 HB2 SER A 4 -1.474 10.430 2.760 1.00 0.00 H new ATOM 0 HB3 SER A 4 -2.041 11.536 1.525 1.00 0.00 H new ATOM 0 HG SER A 4 -2.814 9.370 1.186 1.00 0.00 H new ATOM 46 N SER A 5 1.469 12.887 1.635 1.00 0.00 N ATOM 47 CA SER A 5 2.099 13.957 2.357 1.00 0.00 C ATOM 48 C SER A 5 2.289 15.160 1.458 1.00 0.00 C ATOM 49 O SER A 5 2.549 15.015 0.264 1.00 0.00 O ATOM 50 CB SER A 5 3.455 13.491 2.907 1.00 0.00 C ATOM 51 OG SER A 5 4.102 14.526 3.625 1.00 0.00 O ATOM 0 H SER A 5 1.773 12.797 0.665 1.00 0.00 H new ATOM 0 HA SER A 5 1.456 14.243 3.190 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.309 12.630 3.559 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.091 13.164 2.084 1.00 0.00 H new ATOM 0 HG SER A 5 4.864 14.858 3.106 1.00 0.00 H new ATOM 57 N VAL A 6 2.127 16.339 2.022 1.00 0.00 N ATOM 58 CA VAL A 6 2.361 17.566 1.292 1.00 0.00 C ATOM 59 C VAL A 6 3.683 18.176 1.761 1.00 0.00 C ATOM 60 O VAL A 6 4.178 19.152 1.203 1.00 0.00 O ATOM 61 CB VAL A 6 1.198 18.582 1.490 1.00 0.00 C ATOM 62 CG1 VAL A 6 1.208 19.173 2.894 1.00 0.00 C ATOM 63 CG2 VAL A 6 1.243 19.681 0.434 1.00 0.00 C ATOM 0 H VAL A 6 1.832 16.473 2.989 1.00 0.00 H new ATOM 0 HA VAL A 6 2.411 17.335 0.228 1.00 0.00 H new ATOM 0 HB VAL A 6 0.262 18.037 1.368 1.00 0.00 H new ATOM 0 HG11 VAL A 6 0.383 19.878 2.998 1.00 0.00 H new ATOM 0 HG12 VAL A 6 1.096 18.373 3.626 1.00 0.00 H new ATOM 0 HG13 VAL A 6 2.152 19.691 3.064 1.00 0.00 H new ATOM 0 HG21 VAL A 6 0.419 20.376 0.597 1.00 0.00 H new ATOM 0 HG22 VAL A 6 2.190 20.217 0.506 1.00 0.00 H new ATOM 0 HG23 VAL A 6 1.152 19.237 -0.557 1.00 0.00 H new ATOM 73 N PHE A 7 4.256 17.567 2.789 1.00 0.00 N ATOM 74 CA PHE A 7 5.507 18.027 3.352 1.00 0.00 C ATOM 75 C PHE A 7 6.618 17.037 3.059 1.00 0.00 C ATOM 76 O PHE A 7 6.359 15.916 2.610 1.00 0.00 O ATOM 77 CB PHE A 7 5.377 18.254 4.871 1.00 0.00 C ATOM 78 CG PHE A 7 4.948 17.039 5.657 1.00 0.00 C ATOM 79 CD1 PHE A 7 5.878 16.102 6.081 1.00 0.00 C ATOM 80 CD2 PHE A 7 3.616 16.841 5.978 1.00 0.00 C ATOM 81 CE1 PHE A 7 5.488 14.995 6.806 1.00 0.00 C ATOM 82 CE2 PHE A 7 3.220 15.734 6.703 1.00 0.00 C ATOM 83 CZ PHE A 7 4.158 14.810 7.117 1.00 0.00 C ATOM 0 H PHE A 7 3.866 16.745 3.251 1.00 0.00 H new ATOM 0 HA PHE A 7 5.757 18.980 2.885 1.00 0.00 H new ATOM 0 HB2 PHE A 7 6.337 18.599 5.256 1.00 0.00 H new ATOM 0 HB3 PHE A 7 4.658 19.054 5.045 1.00 0.00 H new ATOM 0 HD1 PHE A 7 6.922 16.241 5.840 1.00 0.00 H new ATOM 0 HD2 PHE A 7 2.877 17.561 5.658 1.00 0.00 H new ATOM 0 HE1 PHE A 7 6.224 14.274 7.130 1.00 0.00 H new ATOM 0 HE2 PHE A 7 2.177 15.592 6.946 1.00 0.00 H new ATOM 0 HZ PHE A 7 3.850 13.944 7.684 1.00 0.00 H new ATOM 93 N GLY A 8 7.842 17.452 3.309 1.00 0.00 N ATOM 94 CA GLY A 8 8.978 16.595 3.076 1.00 0.00 C ATOM 95 C GLY A 8 9.505 15.973 4.349 1.00 0.00 C ATOM 96 O GLY A 8 8.798 15.230 5.028 1.00 0.00 O ATOM 0 H GLY A 8 8.072 18.377 3.673 1.00 0.00 H new ATOM 0 HA2 GLY A 8 8.696 15.805 2.379 1.00 0.00 H new ATOM 0 HA3 GLY A 8 9.772 17.171 2.601 1.00 0.00 H new ATOM 100 N ALA A 9 10.737 16.301 4.697 1.00 0.00 N ATOM 101 CA ALA A 9 11.371 15.730 5.878 1.00 0.00 C ATOM 102 C ALA A 9 11.999 16.819 6.728 1.00 0.00 C ATOM 103 O ALA A 9 12.839 16.551 7.586 1.00 0.00 O ATOM 104 CB ALA A 9 12.420 14.711 5.463 1.00 0.00 C ATOM 0 H ALA A 9 11.320 16.959 4.180 1.00 0.00 H new ATOM 0 HA ALA A 9 10.609 15.229 6.475 1.00 0.00 H new ATOM 0 HB1 ALA A 9 12.889 14.289 6.352 1.00 0.00 H new ATOM 0 HB2 ALA A 9 11.946 13.914 4.890 1.00 0.00 H new ATOM 0 HB3 ALA A 9 13.178 15.198 4.849 1.00 0.00 H new ATOM 110 N GLY A 10 11.567 18.041 6.502 1.00 0.00 N ATOM 111 CA GLY A 10 12.108 19.168 7.223 1.00 0.00 C ATOM 112 C GLY A 10 11.638 20.475 6.641 1.00 0.00 C ATOM 113 O GLY A 10 12.438 21.275 6.167 1.00 0.00 O ATOM 0 H GLY A 10 10.842 18.277 5.824 1.00 0.00 H new ATOM 0 HA2 GLY A 10 11.811 19.107 8.270 1.00 0.00 H new ATOM 0 HA3 GLY A 10 13.197 19.128 7.198 1.00 0.00 H new ATOM 117 N CYS A 11 10.337 20.669 6.636 1.00 0.00 N ATOM 118 CA CYS A 11 9.748 21.889 6.124 1.00 0.00 C ATOM 119 C CYS A 11 9.711 22.960 7.193 1.00 0.00 C ATOM 120 O CYS A 11 9.648 22.656 8.386 1.00 0.00 O ATOM 121 CB CYS A 11 8.345 21.610 5.648 1.00 0.00 C ATOM 122 SG CYS A 11 8.239 20.214 4.531 1.00 0.00 S ATOM 0 H CYS A 11 9.660 19.990 6.984 1.00 0.00 H new ATOM 0 HA CYS A 11 10.359 22.246 5.295 1.00 0.00 H new ATOM 0 HB2 CYS A 11 7.706 21.425 6.511 1.00 0.00 H new ATOM 0 HB3 CYS A 11 7.956 22.497 5.148 1.00 0.00 H new ATOM 127 N THR A 12 9.741 24.204 6.769 1.00 0.00 N ATOM 128 CA THR A 12 9.684 25.316 7.689 1.00 0.00 C ATOM 129 C THR A 12 8.248 25.582 8.114 1.00 0.00 C ATOM 130 O THR A 12 7.304 25.038 7.525 1.00 0.00 O ATOM 131 CB THR A 12 10.245 26.589 7.041 1.00 0.00 C ATOM 132 OG1 THR A 12 9.526 26.869 5.826 1.00 0.00 O ATOM 133 CG2 THR A 12 11.718 26.432 6.735 1.00 0.00 C ATOM 0 H THR A 12 9.805 24.471 5.787 1.00 0.00 H new ATOM 0 HA THR A 12 10.286 25.054 8.559 1.00 0.00 H new ATOM 0 HB THR A 12 10.123 27.416 7.740 1.00 0.00 H new ATOM 0 HG1 THR A 12 9.982 27.583 5.334 1.00 0.00 H new ATOM 0 HG21 THR A 12 12.094 27.347 6.276 1.00 0.00 H new ATOM 0 HG22 THR A 12 12.263 26.239 7.659 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.860 25.597 6.049 1.00 0.00 H new ATOM 141 N ASP A 13 8.074 26.419 9.125 1.00 0.00 N ATOM 142 CA ASP A 13 6.740 26.801 9.560 1.00 0.00 C ATOM 143 C ASP A 13 6.124 27.721 8.519 1.00 0.00 C ATOM 144 O ASP A 13 4.904 27.864 8.427 1.00 0.00 O ATOM 145 CB ASP A 13 6.776 27.489 10.925 1.00 0.00 C ATOM 146 CG ASP A 13 5.394 27.872 11.410 1.00 0.00 C ATOM 147 OD1 ASP A 13 4.597 26.966 11.733 1.00 0.00 O ATOM 148 OD2 ASP A 13 5.093 29.077 11.466 1.00 0.00 O ATOM 0 H ASP A 13 8.834 26.844 9.656 1.00 0.00 H new ATOM 0 HA ASP A 13 6.133 25.902 9.664 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.243 26.825 11.652 1.00 0.00 H new ATOM 0 HB3 ASP A 13 7.398 28.382 10.863 1.00 0.00 H new ATOM 153 N VAL A 14 6.992 28.320 7.716 1.00 0.00 N ATOM 154 CA VAL A 14 6.580 29.181 6.625 1.00 0.00 C ATOM 155 C VAL A 14 5.866 28.348 5.553 1.00 0.00 C ATOM 156 O VAL A 14 4.977 28.837 4.848 1.00 0.00 O ATOM 157 CB VAL A 14 7.801 29.902 6.001 1.00 0.00 C ATOM 158 CG1 VAL A 14 7.361 30.917 4.967 1.00 0.00 C ATOM 159 CG2 VAL A 14 8.640 30.571 7.081 1.00 0.00 C ATOM 0 H VAL A 14 8.003 28.220 7.806 1.00 0.00 H new ATOM 0 HA VAL A 14 5.898 29.936 7.017 1.00 0.00 H new ATOM 0 HB VAL A 14 8.415 29.152 5.502 1.00 0.00 H new ATOM 0 HG11 VAL A 14 8.237 31.409 4.544 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.810 30.412 4.173 1.00 0.00 H new ATOM 0 HG13 VAL A 14 6.719 31.661 5.438 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.492 31.072 6.622 1.00 0.00 H new ATOM 0 HG22 VAL A 14 8.032 31.303 7.612 1.00 0.00 H new ATOM 0 HG23 VAL A 14 8.997 29.818 7.783 1.00 0.00 H new ATOM 169 N CYS A 15 6.248 27.077 5.461 1.00 0.00 N ATOM 170 CA CYS A 15 5.625 26.147 4.537 1.00 0.00 C ATOM 171 C CYS A 15 4.296 25.682 5.121 1.00 0.00 C ATOM 172 O CYS A 15 3.348 25.368 4.399 1.00 0.00 O ATOM 173 CB CYS A 15 6.558 24.947 4.288 1.00 0.00 C ATOM 174 SG CYS A 15 5.842 23.619 3.288 1.00 0.00 S ATOM 0 H CYS A 15 6.995 26.669 6.024 1.00 0.00 H new ATOM 0 HA CYS A 15 5.444 26.640 3.582 1.00 0.00 H new ATOM 0 HB2 CYS A 15 7.463 25.305 3.796 1.00 0.00 H new ATOM 0 HB3 CYS A 15 6.860 24.535 5.251 1.00 0.00 H new ATOM 179 N LYS A 16 4.227 25.670 6.451 1.00 0.00 N ATOM 180 CA LYS A 16 3.025 25.277 7.156 1.00 0.00 C ATOM 181 C LYS A 16 1.976 26.398 7.116 1.00 0.00 C ATOM 182 O LYS A 16 0.852 26.217 7.585 1.00 0.00 O ATOM 183 CB LYS A 16 3.350 24.912 8.613 1.00 0.00 C ATOM 184 CG LYS A 16 4.440 23.846 8.790 1.00 0.00 C ATOM 185 CD LYS A 16 4.089 22.536 8.091 1.00 0.00 C ATOM 186 CE LYS A 16 4.809 22.413 6.751 1.00 0.00 C ATOM 187 NZ LYS A 16 4.398 21.201 6.011 1.00 0.00 N ATOM 0 H LYS A 16 5.002 25.932 7.060 1.00 0.00 H new ATOM 0 HA LYS A 16 2.613 24.400 6.656 1.00 0.00 H new ATOM 0 HB2 LYS A 16 3.659 25.816 9.137 1.00 0.00 H new ATOM 0 HB3 LYS A 16 2.438 24.560 9.095 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.383 24.225 8.395 1.00 0.00 H new ATOM 0 HG3 LYS A 16 4.592 23.658 9.853 1.00 0.00 H new ATOM 0 HD2 LYS A 16 4.360 21.696 8.731 1.00 0.00 H new ATOM 0 HD3 LYS A 16 3.012 22.482 7.934 1.00 0.00 H new ATOM 0 HE2 LYS A 16 4.601 23.295 6.146 1.00 0.00 H new ATOM 0 HE3 LYS A 16 5.886 22.388 6.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 4.959 21.120 5.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 4.556 20.362 6.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 3.389 21.268 5.768 1.00 0.00 H new ATOM 201 N GLN A 17 2.353 27.554 6.548 1.00 0.00 N ATOM 202 CA GLN A 17 1.439 28.697 6.425 1.00 0.00 C ATOM 203 C GLN A 17 0.254 28.373 5.516 1.00 0.00 C ATOM 204 O GLN A 17 0.159 27.277 4.945 1.00 0.00 O ATOM 205 CB GLN A 17 2.169 29.943 5.888 1.00 0.00 C ATOM 206 CG GLN A 17 2.922 30.743 6.942 1.00 0.00 C ATOM 207 CD GLN A 17 3.579 32.002 6.371 1.00 0.00 C ATOM 208 OE1 GLN A 17 3.109 32.577 5.388 1.00 0.00 O ATOM 209 NE2 GLN A 17 4.658 32.434 6.996 1.00 0.00 N ATOM 0 H GLN A 17 3.284 27.721 6.167 1.00 0.00 H new ATOM 0 HA GLN A 17 1.065 28.909 7.427 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.873 29.631 5.117 1.00 0.00 H new ATOM 0 HB3 GLN A 17 1.440 30.596 5.408 1.00 0.00 H new ATOM 0 HG2 GLN A 17 2.233 31.027 7.738 1.00 0.00 H new ATOM 0 HG3 GLN A 17 3.687 30.112 7.393 1.00 0.00 H new ATOM 0 HE21 GLN A 17 5.015 31.928 7.807 1.00 0.00 H new ATOM 0 HE22 GLN A 17 5.135 33.274 6.668 1.00 0.00 H new ATOM 218 N THR A 18 -0.639 29.328 5.381 1.00 0.00 N ATOM 219 CA THR A 18 -1.823 29.176 4.554 1.00 0.00 C ATOM 220 C THR A 18 -2.324 30.554 4.115 1.00 0.00 C ATOM 221 O THR A 18 -2.902 31.292 4.915 1.00 0.00 O ATOM 222 CB THR A 18 -2.953 28.434 5.309 1.00 0.00 C ATOM 223 OG1 THR A 18 -2.445 27.209 5.859 1.00 0.00 O ATOM 224 CG2 THR A 18 -4.110 28.119 4.370 1.00 0.00 C ATOM 0 H THR A 18 -0.568 30.235 5.841 1.00 0.00 H new ATOM 0 HA THR A 18 -1.549 28.581 3.683 1.00 0.00 H new ATOM 0 HB THR A 18 -3.313 29.079 6.110 1.00 0.00 H new ATOM 0 HG1 THR A 18 -3.162 26.743 6.337 1.00 0.00 H new ATOM 0 HG21 THR A 18 -4.893 27.598 4.920 1.00 0.00 H new ATOM 0 HG22 THR A 18 -4.510 29.047 3.961 1.00 0.00 H new ATOM 0 HG23 THR A 18 -3.756 27.487 3.556 1.00 0.00 H new ATOM 232 N PRO A 19 -2.091 30.938 2.844 1.00 0.00 N ATOM 233 CA PRO A 19 -1.398 30.099 1.848 1.00 0.00 C ATOM 234 C PRO A 19 0.077 29.929 2.177 1.00 0.00 C ATOM 235 O PRO A 19 0.602 30.606 3.064 1.00 0.00 O ATOM 236 CB PRO A 19 -1.557 30.893 0.551 1.00 0.00 C ATOM 237 CG PRO A 19 -1.711 32.300 0.996 1.00 0.00 C ATOM 238 CD PRO A 19 -2.468 32.238 2.290 1.00 0.00 C ATOM 0 HA PRO A 19 -1.808 29.090 1.803 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -0.688 30.774 -0.097 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -2.426 30.558 -0.016 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -0.740 32.775 1.133 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -2.252 32.888 0.254 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.190 33.054 2.957 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -3.544 32.309 2.130 1.00 0.00 H new ATOM 246 N CYS A 20 0.740 29.037 1.460 1.00 0.00 N ATOM 247 CA CYS A 20 2.131 28.754 1.700 1.00 0.00 C ATOM 248 C CYS A 20 2.958 30.032 1.602 1.00 0.00 C ATOM 249 O CYS A 20 2.914 30.738 0.589 1.00 0.00 O ATOM 250 CB CYS A 20 2.618 27.725 0.709 1.00 0.00 C ATOM 251 SG CYS A 20 4.100 26.893 1.228 1.00 0.00 S ATOM 0 H CYS A 20 0.326 28.496 0.701 1.00 0.00 H new ATOM 0 HA CYS A 20 2.246 28.354 2.707 1.00 0.00 H new ATOM 0 HB2 CYS A 20 1.833 26.986 0.548 1.00 0.00 H new ATOM 0 HB3 CYS A 20 2.800 28.212 -0.249 1.00 0.00 H new ATOM 256 N GLY A 21 3.715 30.322 2.647 1.00 0.00 N ATOM 257 CA GLY A 21 4.429 31.560 2.710 1.00 0.00 C ATOM 258 C GLY A 21 5.799 31.508 2.084 1.00 0.00 C ATOM 259 O GLY A 21 6.443 32.530 1.951 1.00 0.00 O ATOM 0 H GLY A 21 3.843 29.712 3.454 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.842 32.332 2.213 1.00 0.00 H new ATOM 0 HA3 GLY A 21 4.528 31.858 3.754 1.00 0.00 H new ATOM 263 N CYS A 22 6.247 30.331 1.680 1.00 0.00 N ATOM 264 CA CYS A 22 7.578 30.196 1.064 1.00 0.00 C ATOM 265 C CYS A 22 7.675 30.962 -0.250 1.00 0.00 C ATOM 266 O CYS A 22 8.762 31.276 -0.716 1.00 0.00 O ATOM 267 CB CYS A 22 7.931 28.736 0.850 1.00 0.00 C ATOM 268 SG CYS A 22 8.258 27.833 2.370 1.00 0.00 S ATOM 0 H CYS A 22 5.724 29.459 1.761 1.00 0.00 H new ATOM 0 HA CYS A 22 8.298 30.632 1.757 1.00 0.00 H new ATOM 0 HB2 CYS A 22 7.113 28.249 0.319 1.00 0.00 H new ATOM 0 HB3 CYS A 22 8.809 28.675 0.207 1.00 0.00 H new ATOM 273 N ALA A 23 6.533 31.284 -0.827 1.00 0.00 N ATOM 274 CA ALA A 23 6.495 32.030 -2.071 1.00 0.00 C ATOM 275 C ALA A 23 6.495 33.528 -1.786 1.00 0.00 C ATOM 276 O ALA A 23 6.505 34.353 -2.699 1.00 0.00 O ATOM 277 CB ALA A 23 5.265 31.644 -2.872 1.00 0.00 C ATOM 0 H ALA A 23 5.616 31.040 -0.453 1.00 0.00 H new ATOM 0 HA ALA A 23 7.383 31.788 -2.656 1.00 0.00 H new ATOM 0 HB1 ALA A 23 5.245 32.209 -3.804 1.00 0.00 H new ATOM 0 HB2 ALA A 23 5.296 30.578 -3.095 1.00 0.00 H new ATOM 0 HB3 ALA A 23 4.369 31.868 -2.293 1.00 0.00 H new ATOM 283 N THR A 24 6.477 33.864 -0.513 1.00 0.00 N ATOM 284 CA THR A 24 6.447 35.225 -0.079 1.00 0.00 C ATOM 285 C THR A 24 7.642 35.535 0.841 1.00 0.00 C ATOM 286 O THR A 24 8.175 36.639 0.836 1.00 0.00 O ATOM 287 CB THR A 24 5.133 35.479 0.682 1.00 0.00 C ATOM 288 OG1 THR A 24 4.012 35.243 -0.184 1.00 0.00 O ATOM 289 CG2 THR A 24 5.077 36.881 1.213 1.00 0.00 C ATOM 0 H THR A 24 6.483 33.186 0.249 1.00 0.00 H new ATOM 0 HA THR A 24 6.509 35.874 -0.952 1.00 0.00 H new ATOM 0 HB THR A 24 5.093 34.791 1.527 1.00 0.00 H new ATOM 0 HG1 THR A 24 3.179 35.405 0.307 1.00 0.00 H new ATOM 0 HG21 THR A 24 4.138 37.031 1.746 1.00 0.00 H new ATOM 0 HG22 THR A 24 5.911 37.045 1.895 1.00 0.00 H new ATOM 0 HG23 THR A 24 5.141 37.587 0.385 1.00 0.00 H new ATOM 297 N SER A 25 8.059 34.546 1.606 1.00 0.00 N ATOM 298 CA SER A 25 9.115 34.727 2.586 1.00 0.00 C ATOM 299 C SER A 25 10.349 33.874 2.288 1.00 0.00 C ATOM 300 O SER A 25 11.288 33.827 3.088 1.00 0.00 O ATOM 301 CB SER A 25 8.563 34.399 3.967 1.00 0.00 C ATOM 302 OG SER A 25 7.517 35.294 4.306 1.00 0.00 O ATOM 0 H SER A 25 7.680 33.600 1.568 1.00 0.00 H new ATOM 0 HA SER A 25 9.442 35.766 2.543 1.00 0.00 H new ATOM 0 HB2 SER A 25 8.193 33.374 3.984 1.00 0.00 H new ATOM 0 HB3 SER A 25 9.359 34.463 4.709 1.00 0.00 H new ATOM 0 HG SER A 25 7.171 35.071 5.195 1.00 0.00 H new ATOM 308 N GLY A 26 10.358 33.212 1.152 1.00 0.00 N ATOM 309 CA GLY A 26 11.494 32.399 0.804 1.00 0.00 C ATOM 310 C GLY A 26 11.338 30.971 1.269 1.00 0.00 C ATOM 311 O GLY A 26 10.702 30.700 2.287 1.00 0.00 O ATOM 0 H GLY A 26 9.603 33.221 0.466 1.00 0.00 H new ATOM 0 HA2 GLY A 26 11.632 32.414 -0.277 1.00 0.00 H new ATOM 0 HA3 GLY A 26 12.394 32.827 1.246 1.00 0.00 H new ATOM 315 N CYS A 27 11.918 30.072 0.528 1.00 0.00 N ATOM 316 CA CYS A 27 11.835 28.654 0.814 1.00 0.00 C ATOM 317 C CYS A 27 13.112 28.134 1.491 1.00 0.00 C ATOM 318 O CYS A 27 14.219 28.562 1.160 1.00 0.00 O ATOM 319 CB CYS A 27 11.589 27.903 -0.478 1.00 0.00 C ATOM 320 SG CYS A 27 11.601 26.131 -0.290 1.00 0.00 S ATOM 0 H CYS A 27 12.469 30.296 -0.301 1.00 0.00 H new ATOM 0 HA CYS A 27 11.010 28.490 1.507 1.00 0.00 H new ATOM 0 HB2 CYS A 27 10.627 28.209 -0.888 1.00 0.00 H new ATOM 0 HB3 CYS A 27 12.351 28.188 -1.204 1.00 0.00 H new ATOM 325 N ASN A 28 12.949 27.201 2.440 1.00 0.00 N ATOM 326 CA ASN A 28 14.095 26.613 3.166 1.00 0.00 C ATOM 327 C ASN A 28 13.827 25.138 3.485 1.00 0.00 C ATOM 328 O ASN A 28 14.356 24.603 4.456 1.00 0.00 O ATOM 329 CB ASN A 28 14.350 27.349 4.498 1.00 0.00 C ATOM 330 CG ASN A 28 14.511 28.847 4.363 1.00 0.00 C ATOM 331 OD1 ASN A 28 15.608 29.350 4.133 1.00 0.00 O ATOM 332 ND2 ASN A 28 13.420 29.572 4.537 1.00 0.00 N ATOM 0 H ASN A 28 12.041 26.835 2.725 1.00 0.00 H new ATOM 0 HA ASN A 28 14.968 26.711 2.520 1.00 0.00 H new ATOM 0 HB2 ASN A 28 13.522 27.144 5.176 1.00 0.00 H new ATOM 0 HB3 ASN A 28 15.249 26.939 4.959 1.00 0.00 H new ATOM 0 HD21 ASN A 28 13.470 30.589 4.482 1.00 0.00 H new ATOM 0 HD22 ASN A 28 12.528 29.114 4.726 1.00 0.00 H new ATOM 339 N CYS A 29 13.016 24.489 2.672 1.00 0.00 N ATOM 340 CA CYS A 29 12.630 23.102 2.934 1.00 0.00 C ATOM 341 C CYS A 29 13.644 22.073 2.434 1.00 0.00 C ATOM 342 O CYS A 29 14.696 22.416 1.895 1.00 0.00 O ATOM 343 CB CYS A 29 11.267 22.828 2.347 1.00 0.00 C ATOM 344 SG CYS A 29 9.989 23.851 3.062 1.00 0.00 S ATOM 0 H CYS A 29 12.610 24.891 1.827 1.00 0.00 H new ATOM 0 HA CYS A 29 12.601 22.989 4.018 1.00 0.00 H new ATOM 0 HB2 CYS A 29 11.300 22.994 1.270 1.00 0.00 H new ATOM 0 HB3 CYS A 29 11.015 21.779 2.500 1.00 0.00 H new ATOM 349 N THR A 30 13.301 20.803 2.631 1.00 0.00 N ATOM 350 CA THR A 30 14.154 19.690 2.265 1.00 0.00 C ATOM 351 C THR A 30 13.857 19.172 0.848 1.00 0.00 C ATOM 352 O THR A 30 12.917 19.626 0.189 1.00 0.00 O ATOM 353 CB THR A 30 14.002 18.547 3.286 1.00 0.00 C ATOM 354 OG1 THR A 30 12.626 18.448 3.699 1.00 0.00 O ATOM 355 CG2 THR A 30 14.877 18.796 4.505 1.00 0.00 C ATOM 0 H THR A 30 12.416 20.521 3.052 1.00 0.00 H new ATOM 0 HA THR A 30 15.182 20.053 2.272 1.00 0.00 H new ATOM 0 HB THR A 30 14.315 17.616 2.813 1.00 0.00 H new ATOM 0 HG1 THR A 30 12.064 18.250 2.921 1.00 0.00 H new ATOM 0 HG21 THR A 30 14.755 17.977 5.214 1.00 0.00 H new ATOM 0 HG22 THR A 30 15.921 18.857 4.197 1.00 0.00 H new ATOM 0 HG23 THR A 30 14.583 19.733 4.979 1.00 0.00 H new ATOM 363 N ASP A 31 14.648 18.196 0.409 1.00 0.00 N ATOM 364 CA ASP A 31 14.556 17.640 -0.952 1.00 0.00 C ATOM 365 C ASP A 31 13.393 16.652 -1.093 1.00 0.00 C ATOM 366 O ASP A 31 13.226 16.019 -2.132 1.00 0.00 O ATOM 367 CB ASP A 31 15.867 16.930 -1.315 1.00 0.00 C ATOM 368 CG ASP A 31 17.093 17.786 -1.077 1.00 0.00 C ATOM 369 OD1 ASP A 31 17.446 18.601 -1.954 1.00 0.00 O ATOM 370 OD2 ASP A 31 17.720 17.645 0.000 1.00 0.00 O ATOM 0 H ASP A 31 15.373 17.764 0.981 1.00 0.00 H new ATOM 0 HA ASP A 31 14.376 18.473 -1.631 1.00 0.00 H new ATOM 0 HB2 ASP A 31 15.951 16.015 -0.729 1.00 0.00 H new ATOM 0 HB3 ASP A 31 15.835 16.636 -2.364 1.00 0.00 H new ATOM 375 N ASP A 32 12.595 16.526 -0.056 1.00 0.00 N ATOM 376 CA ASP A 32 11.465 15.597 -0.077 1.00 0.00 C ATOM 377 C ASP A 32 10.144 16.354 -0.074 1.00 0.00 C ATOM 378 O ASP A 32 9.070 15.762 -0.109 1.00 0.00 O ATOM 379 CB ASP A 32 11.544 14.664 1.130 1.00 0.00 C ATOM 380 CG ASP A 32 10.459 13.606 1.140 1.00 0.00 C ATOM 381 OD1 ASP A 32 9.849 13.394 2.200 1.00 0.00 O ATOM 382 OD2 ASP A 32 10.236 12.961 0.091 1.00 0.00 O ATOM 0 H ASP A 32 12.699 17.049 0.814 1.00 0.00 H new ATOM 0 HA ASP A 32 11.514 15.006 -0.991 1.00 0.00 H new ATOM 0 HB2 ASP A 32 12.518 14.176 1.140 1.00 0.00 H new ATOM 0 HB3 ASP A 32 11.474 15.255 2.043 1.00 0.00 H new ATOM 387 N CYS A 33 10.241 17.669 -0.056 1.00 0.00 N ATOM 388 CA CYS A 33 9.069 18.535 0.015 1.00 0.00 C ATOM 389 C CYS A 33 8.079 18.258 -1.131 1.00 0.00 C ATOM 390 O CYS A 33 8.310 18.642 -2.280 1.00 0.00 O ATOM 391 CB CYS A 33 9.502 19.997 0.007 1.00 0.00 C ATOM 392 SG CYS A 33 8.177 21.156 0.374 1.00 0.00 S ATOM 0 H CYS A 33 11.129 18.171 -0.090 1.00 0.00 H new ATOM 0 HA CYS A 33 8.550 18.318 0.948 1.00 0.00 H new ATOM 0 HB2 CYS A 33 10.301 20.132 0.736 1.00 0.00 H new ATOM 0 HB3 CYS A 33 9.919 20.236 -0.971 1.00 0.00 H new ATOM 397 N LYS A 34 6.973 17.597 -0.796 1.00 0.00 N ATOM 398 CA LYS A 34 5.933 17.245 -1.768 1.00 0.00 C ATOM 399 C LYS A 34 5.004 18.432 -2.027 1.00 0.00 C ATOM 400 O LYS A 34 3.886 18.258 -2.512 1.00 0.00 O ATOM 401 CB LYS A 34 5.088 16.072 -1.235 1.00 0.00 C ATOM 402 CG LYS A 34 5.864 14.797 -0.930 1.00 0.00 C ATOM 403 CD LYS A 34 6.352 14.098 -2.192 1.00 0.00 C ATOM 404 CE LYS A 34 7.308 12.973 -1.834 1.00 0.00 C ATOM 405 NZ LYS A 34 8.081 12.503 -3.004 1.00 0.00 N ATOM 0 H LYS A 34 6.770 17.289 0.155 1.00 0.00 H new ATOM 0 HA LYS A 34 6.428 16.963 -2.697 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.580 16.395 -0.326 1.00 0.00 H new ATOM 0 HB3 LYS A 34 4.314 15.841 -1.967 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.719 15.038 -0.298 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.230 14.116 -0.363 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.503 13.700 -2.747 1.00 0.00 H new ATOM 0 HD3 LYS A 34 6.851 14.815 -2.844 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.995 13.315 -1.060 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.745 12.140 -1.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.823 11.847 -2.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 7.445 12.014 -3.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.518 13.317 -3.481 1.00 0.00 H new ATOM 419 N CYS A 35 5.468 19.631 -1.745 1.00 0.00 N ATOM 420 CA CYS A 35 4.629 20.785 -1.870 1.00 0.00 C ATOM 421 C CYS A 35 4.858 21.435 -3.221 1.00 0.00 C ATOM 422 O CYS A 35 5.822 22.171 -3.416 1.00 0.00 O ATOM 423 CB CYS A 35 4.896 21.763 -0.720 1.00 0.00 C ATOM 424 SG CYS A 35 3.435 22.669 -0.152 1.00 0.00 S ATOM 0 H CYS A 35 6.419 19.823 -1.430 1.00 0.00 H new ATOM 0 HA CYS A 35 3.583 20.485 -1.809 1.00 0.00 H new ATOM 0 HB2 CYS A 35 5.315 21.210 0.121 1.00 0.00 H new ATOM 0 HB3 CYS A 35 5.652 22.481 -1.038 1.00 0.00 H new ATOM 429 N GLN A 36 3.965 21.139 -4.162 1.00 0.00 N ATOM 430 CA GLN A 36 4.063 21.642 -5.541 1.00 0.00 C ATOM 431 C GLN A 36 3.943 23.178 -5.608 1.00 0.00 C ATOM 432 O GLN A 36 4.107 23.767 -6.669 1.00 0.00 O ATOM 433 CB GLN A 36 2.960 21.015 -6.428 1.00 0.00 C ATOM 434 CG GLN A 36 3.022 19.487 -6.593 1.00 0.00 C ATOM 435 CD GLN A 36 4.101 19.011 -7.573 1.00 0.00 C ATOM 436 OE1 GLN A 36 4.469 19.723 -8.508 1.00 0.00 O ATOM 437 NE2 GLN A 36 4.603 17.812 -7.352 1.00 0.00 N ATOM 0 H GLN A 36 3.152 20.545 -3.997 1.00 0.00 H new ATOM 0 HA GLN A 36 5.048 21.356 -5.910 1.00 0.00 H new ATOM 0 HB2 GLN A 36 1.989 21.277 -6.007 1.00 0.00 H new ATOM 0 HB3 GLN A 36 3.012 21.471 -7.417 1.00 0.00 H new ATOM 0 HG2 GLN A 36 3.204 19.033 -5.619 1.00 0.00 H new ATOM 0 HG3 GLN A 36 2.051 19.129 -6.935 1.00 0.00 H new ATOM 0 HE21 GLN A 36 4.268 17.256 -6.565 1.00 0.00 H new ATOM 0 HE22 GLN A 36 5.326 17.440 -7.968 1.00 0.00 H new ATOM 446 N SER A 37 3.691 23.810 -4.472 1.00 0.00 N ATOM 447 CA SER A 37 3.430 25.243 -4.437 1.00 0.00 C ATOM 448 C SER A 37 4.666 26.101 -4.113 1.00 0.00 C ATOM 449 O SER A 37 4.879 27.131 -4.747 1.00 0.00 O ATOM 450 CB SER A 37 2.302 25.538 -3.442 1.00 0.00 C ATOM 451 OG SER A 37 1.140 24.794 -3.778 1.00 0.00 O ATOM 0 H SER A 37 3.661 23.353 -3.560 1.00 0.00 H new ATOM 0 HA SER A 37 3.132 25.525 -5.447 1.00 0.00 H new ATOM 0 HB2 SER A 37 2.624 25.285 -2.432 1.00 0.00 H new ATOM 0 HB3 SER A 37 2.073 26.604 -3.447 1.00 0.00 H new ATOM 0 HG SER A 37 0.428 24.990 -3.134 1.00 0.00 H new ATOM 457 N CYS A 38 5.486 25.684 -3.154 1.00 0.00 N ATOM 458 CA CYS A 38 6.592 26.535 -2.720 1.00 0.00 C ATOM 459 C CYS A 38 7.833 26.391 -3.595 1.00 0.00 C ATOM 460 O CYS A 38 8.482 27.382 -3.933 1.00 0.00 O ATOM 461 CB CYS A 38 6.935 26.285 -1.243 1.00 0.00 C ATOM 462 SG CYS A 38 7.398 24.587 -0.839 1.00 0.00 S ATOM 0 H CYS A 38 5.412 24.788 -2.673 1.00 0.00 H new ATOM 0 HA CYS A 38 6.249 27.564 -2.831 1.00 0.00 H new ATOM 0 HB2 CYS A 38 7.755 26.945 -0.960 1.00 0.00 H new ATOM 0 HB3 CYS A 38 6.075 26.565 -0.634 1.00 0.00 H new ATOM 467 N LYS A 39 8.139 25.173 -3.989 1.00 0.00 N ATOM 468 CA LYS A 39 9.354 24.903 -4.756 1.00 0.00 C ATOM 469 C LYS A 39 9.146 25.140 -6.269 1.00 0.00 C ATOM 470 O LYS A 39 10.049 24.930 -7.084 1.00 0.00 O ATOM 471 CB LYS A 39 9.831 23.464 -4.463 1.00 0.00 C ATOM 472 CG LYS A 39 9.342 22.397 -5.432 1.00 0.00 C ATOM 473 CD LYS A 39 7.839 22.423 -5.622 1.00 0.00 C ATOM 474 CE LYS A 39 7.441 21.565 -6.824 1.00 0.00 C ATOM 475 NZ LYS A 39 8.309 21.830 -8.015 1.00 0.00 N ATOM 0 H LYS A 39 7.569 24.350 -3.795 1.00 0.00 H new ATOM 0 HA LYS A 39 10.129 25.604 -4.444 1.00 0.00 H new ATOM 0 HB2 LYS A 39 10.921 23.455 -4.461 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.509 23.191 -3.458 1.00 0.00 H new ATOM 0 HG2 LYS A 39 9.828 22.538 -6.397 1.00 0.00 H new ATOM 0 HG3 LYS A 39 9.641 21.415 -5.065 1.00 0.00 H new ATOM 0 HD2 LYS A 39 7.346 22.053 -4.723 1.00 0.00 H new ATOM 0 HD3 LYS A 39 7.502 23.449 -5.771 1.00 0.00 H new ATOM 0 HE2 LYS A 39 7.507 20.511 -6.555 1.00 0.00 H new ATOM 0 HE3 LYS A 39 6.401 21.763 -7.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 7.817 21.523 -8.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 8.513 22.848 -8.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 9.200 21.303 -7.919 1.00 0.00 H new ATOM 489 N TYR A 40 7.951 25.567 -6.630 1.00 0.00 N ATOM 490 CA TYR A 40 7.615 25.812 -8.022 1.00 0.00 C ATOM 491 C TYR A 40 8.209 27.141 -8.470 1.00 0.00 C ATOM 492 O TYR A 40 8.469 28.021 -7.649 1.00 0.00 O ATOM 493 CB TYR A 40 6.093 25.784 -8.198 1.00 0.00 C ATOM 494 CG TYR A 40 5.593 25.864 -9.621 1.00 0.00 C ATOM 495 CD1 TYR A 40 5.622 24.749 -10.446 1.00 0.00 C ATOM 496 CD2 TYR A 40 5.068 27.044 -10.131 1.00 0.00 C ATOM 497 CE1 TYR A 40 5.146 24.806 -11.739 1.00 0.00 C ATOM 498 CE2 TYR A 40 4.593 27.110 -11.424 1.00 0.00 C ATOM 499 CZ TYR A 40 4.634 25.987 -12.224 1.00 0.00 C ATOM 500 OH TYR A 40 4.158 26.045 -13.511 1.00 0.00 O ATOM 0 H TYR A 40 7.192 25.753 -5.975 1.00 0.00 H new ATOM 0 HA TYR A 40 8.040 25.029 -8.649 1.00 0.00 H new ATOM 0 HB2 TYR A 40 5.711 24.866 -7.750 1.00 0.00 H new ATOM 0 HB3 TYR A 40 5.666 26.615 -7.636 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.024 23.820 -10.069 1.00 0.00 H new ATOM 0 HD2 TYR A 40 5.031 27.924 -9.505 1.00 0.00 H new ATOM 0 HE1 TYR A 40 5.175 23.928 -12.367 1.00 0.00 H new ATOM 0 HE2 TYR A 40 4.191 28.036 -11.808 1.00 0.00 H new ATOM 0 HH TYR A 40 3.830 26.949 -13.698 1.00 0.00 H new ATOM 510 N GLY A 41 8.437 27.275 -9.755 1.00 0.00 N ATOM 511 CA GLY A 41 9.057 28.472 -10.275 1.00 0.00 C ATOM 512 C GLY A 41 10.535 28.265 -10.533 1.00 0.00 C ATOM 513 O GLY A 41 11.030 28.553 -11.618 1.00 0.00 O ATOM 0 H GLY A 41 8.204 26.573 -10.458 1.00 0.00 H new ATOM 0 HA2 GLY A 41 8.563 28.766 -11.201 1.00 0.00 H new ATOM 0 HA3 GLY A 41 8.921 29.290 -9.568 1.00 0.00 H new ATOM 517 N ALA A 42 11.231 27.735 -9.540 1.00 0.00 N ATOM 518 CA ALA A 42 12.666 27.498 -9.642 1.00 0.00 C ATOM 519 C ALA A 42 12.971 26.009 -9.732 1.00 0.00 C ATOM 520 O ALA A 42 14.094 25.576 -9.475 1.00 0.00 O ATOM 521 CB ALA A 42 13.373 28.099 -8.445 1.00 0.00 C ATOM 0 H ALA A 42 10.823 27.458 -8.647 1.00 0.00 H new ATOM 0 HA ALA A 42 13.027 27.974 -10.554 1.00 0.00 H new ATOM 0 HB1 ALA A 42 14.445 27.919 -8.527 1.00 0.00 H new ATOM 0 HB2 ALA A 42 13.187 29.173 -8.414 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.997 27.639 -7.531 1.00 0.00 H new ATOM 527 N GLY A 43 11.980 25.233 -10.116 1.00 0.00 N ATOM 528 CA GLY A 43 12.169 23.807 -10.203 1.00 0.00 C ATOM 529 C GLY A 43 11.423 23.155 -11.331 1.00 0.00 C ATOM 530 O GLY A 43 11.876 22.163 -11.887 1.00 0.00 O ATOM 0 H GLY A 43 11.049 25.563 -10.369 1.00 0.00 H new ATOM 0 HA2 GLY A 43 13.233 23.599 -10.318 1.00 0.00 H new ATOM 0 HA3 GLY A 43 11.855 23.352 -9.264 1.00 0.00 H new ATOM 534 N CYS A 44 10.328 23.738 -11.704 1.00 0.00 N ATOM 535 CA CYS A 44 9.437 23.134 -12.677 1.00 0.00 C ATOM 536 C CYS A 44 9.192 24.041 -13.853 1.00 0.00 C ATOM 537 O CYS A 44 9.843 25.076 -14.013 1.00 0.00 O ATOM 538 CB CYS A 44 8.091 22.774 -12.022 1.00 0.00 C ATOM 539 SG CYS A 44 8.093 21.227 -11.100 1.00 0.00 S ATOM 0 H CYS A 44 10.016 24.643 -11.352 1.00 0.00 H new ATOM 0 HA CYS A 44 9.925 22.229 -13.040 1.00 0.00 H new ATOM 0 HB2 CYS A 44 7.802 23.582 -11.349 1.00 0.00 H new ATOM 0 HB3 CYS A 44 7.328 22.718 -12.798 1.00 0.00 H new ATOM 544 N THR A 45 8.267 23.628 -14.677 1.00 0.00 N ATOM 545 CA THR A 45 7.844 24.384 -15.804 1.00 0.00 C ATOM 546 C THR A 45 6.356 24.159 -16.008 1.00 0.00 C ATOM 547 O THR A 45 5.775 23.219 -15.442 1.00 0.00 O ATOM 548 CB THR A 45 8.623 23.986 -17.086 1.00 0.00 C ATOM 549 OG1 THR A 45 8.251 24.837 -18.174 1.00 0.00 O ATOM 550 CG2 THR A 45 8.352 22.537 -17.465 1.00 0.00 C ATOM 0 H THR A 45 7.782 22.737 -14.573 1.00 0.00 H new ATOM 0 HA THR A 45 8.047 25.438 -15.615 1.00 0.00 H new ATOM 0 HB THR A 45 9.687 24.100 -16.878 1.00 0.00 H new ATOM 0 HG1 THR A 45 8.749 24.578 -18.977 1.00 0.00 H new ATOM 0 HG21 THR A 45 8.911 22.286 -18.367 1.00 0.00 H new ATOM 0 HG22 THR A 45 8.665 21.883 -16.651 1.00 0.00 H new ATOM 0 HG23 THR A 45 7.286 22.402 -17.649 1.00 0.00 H new ATOM 558 N ASP A 46 5.751 24.989 -16.817 1.00 0.00 N ATOM 559 CA ASP A 46 4.322 24.899 -17.096 1.00 0.00 C ATOM 560 C ASP A 46 4.002 23.649 -17.914 1.00 0.00 C ATOM 561 O ASP A 46 2.846 23.259 -18.051 1.00 0.00 O ATOM 562 CB ASP A 46 3.833 26.164 -17.821 1.00 0.00 C ATOM 563 CG ASP A 46 4.634 26.478 -19.072 1.00 0.00 C ATOM 564 OD1 ASP A 46 4.111 26.287 -20.185 1.00 0.00 O ATOM 565 OD2 ASP A 46 5.801 26.923 -18.943 1.00 0.00 O ATOM 0 H ASP A 46 6.225 25.749 -17.306 1.00 0.00 H new ATOM 0 HA ASP A 46 3.795 24.822 -16.145 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.784 26.039 -18.090 1.00 0.00 H new ATOM 0 HB3 ASP A 46 3.889 27.012 -17.138 1.00 0.00 H new ATOM 570 N THR A 47 5.037 23.020 -18.436 1.00 0.00 N ATOM 571 CA THR A 47 4.894 21.815 -19.226 1.00 0.00 C ATOM 572 C THR A 47 4.858 20.555 -18.331 1.00 0.00 C ATOM 573 O THR A 47 4.365 19.507 -18.739 1.00 0.00 O ATOM 574 CB THR A 47 6.057 21.701 -20.231 1.00 0.00 C ATOM 575 OG1 THR A 47 6.281 22.980 -20.840 1.00 0.00 O ATOM 576 CG2 THR A 47 5.740 20.686 -21.314 1.00 0.00 C ATOM 0 H THR A 47 6.002 23.331 -18.323 1.00 0.00 H new ATOM 0 HA THR A 47 3.948 21.880 -19.764 1.00 0.00 H new ATOM 0 HB THR A 47 6.948 21.373 -19.695 1.00 0.00 H new ATOM 0 HG1 THR A 47 7.021 22.913 -21.479 1.00 0.00 H new ATOM 0 HG21 THR A 47 6.576 20.624 -22.011 1.00 0.00 H new ATOM 0 HG22 THR A 47 5.573 19.709 -20.860 1.00 0.00 H new ATOM 0 HG23 THR A 47 4.843 20.995 -21.851 1.00 0.00 H new ATOM 584 N CYS A 48 5.347 20.672 -17.110 1.00 0.00 N ATOM 585 CA CYS A 48 5.396 19.527 -16.202 1.00 0.00 C ATOM 586 C CYS A 48 4.071 19.352 -15.458 1.00 0.00 C ATOM 587 O CYS A 48 3.570 18.235 -15.301 1.00 0.00 O ATOM 588 CB CYS A 48 6.552 19.689 -15.202 1.00 0.00 C ATOM 589 SG CYS A 48 6.698 18.349 -13.992 1.00 0.00 S ATOM 0 H CYS A 48 5.715 21.540 -16.720 1.00 0.00 H new ATOM 0 HA CYS A 48 5.567 18.631 -16.799 1.00 0.00 H new ATOM 0 HB2 CYS A 48 7.487 19.763 -15.757 1.00 0.00 H new ATOM 0 HB3 CYS A 48 6.423 20.630 -14.668 1.00 0.00 H new ATOM 594 N LYS A 49 3.482 20.464 -15.051 1.00 0.00 N ATOM 595 CA LYS A 49 2.253 20.447 -14.255 1.00 0.00 C ATOM 596 C LYS A 49 1.015 20.129 -15.101 1.00 0.00 C ATOM 597 O LYS A 49 -0.102 20.085 -14.578 1.00 0.00 O ATOM 598 CB LYS A 49 2.064 21.793 -13.581 1.00 0.00 C ATOM 599 CG LYS A 49 1.699 22.903 -14.551 1.00 0.00 C ATOM 600 CD LYS A 49 1.669 24.250 -13.871 1.00 0.00 C ATOM 601 CE LYS A 49 0.773 24.249 -12.642 1.00 0.00 C ATOM 602 NZ LYS A 49 0.772 25.564 -11.966 1.00 0.00 N ATOM 0 H LYS A 49 3.833 21.399 -15.257 1.00 0.00 H new ATOM 0 HA LYS A 49 2.359 19.657 -13.511 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.282 21.707 -12.826 1.00 0.00 H new ATOM 0 HB3 LYS A 49 2.982 22.063 -13.059 1.00 0.00 H new ATOM 0 HG2 LYS A 49 2.420 22.924 -15.368 1.00 0.00 H new ATOM 0 HG3 LYS A 49 0.724 22.696 -14.991 1.00 0.00 H new ATOM 0 HD2 LYS A 49 2.681 24.532 -13.581 1.00 0.00 H new ATOM 0 HD3 LYS A 49 1.317 25.004 -14.575 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.245 23.989 -12.933 1.00 0.00 H new ATOM 0 HE3 LYS A 49 1.111 23.482 -11.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.151 25.526 -11.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.739 25.801 -11.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.426 26.292 -12.623 1.00 0.00 H new ATOM 616 N GLN A 50 1.215 19.906 -16.398 1.00 0.00 N ATOM 617 CA GLN A 50 0.106 19.626 -17.312 1.00 0.00 C ATOM 618 C GLN A 50 -0.717 18.440 -16.831 1.00 0.00 C ATOM 619 O GLN A 50 -1.929 18.402 -17.019 1.00 0.00 O ATOM 620 CB GLN A 50 0.620 19.354 -18.708 1.00 0.00 C ATOM 621 CG GLN A 50 1.504 20.451 -19.248 1.00 0.00 C ATOM 622 CD GLN A 50 1.618 20.419 -20.747 1.00 0.00 C ATOM 623 OE1 GLN A 50 1.492 19.365 -21.371 1.00 0.00 O ATOM 624 NE2 GLN A 50 1.884 21.555 -21.333 1.00 0.00 N ATOM 0 H GLN A 50 2.134 19.913 -16.841 1.00 0.00 H new ATOM 0 HA GLN A 50 -0.533 20.509 -17.332 1.00 0.00 H new ATOM 0 HB2 GLN A 50 1.177 18.417 -18.705 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -0.228 19.218 -19.379 1.00 0.00 H new ATOM 0 HG2 GLN A 50 1.107 21.418 -18.938 1.00 0.00 H new ATOM 0 HG3 GLN A 50 2.498 20.360 -18.810 1.00 0.00 H new ATOM 0 HE21 GLN A 50 1.980 22.405 -20.778 1.00 0.00 H new ATOM 0 HE22 GLN A 50 1.996 21.592 -22.346 1.00 0.00 H new ATOM 633 N THR A 51 -0.036 17.484 -16.203 1.00 0.00 N ATOM 634 CA THR A 51 -0.667 16.288 -15.653 1.00 0.00 C ATOM 635 C THR A 51 -1.163 15.351 -16.772 1.00 0.00 C ATOM 636 O THR A 51 -2.076 15.692 -17.526 1.00 0.00 O ATOM 637 CB THR A 51 -1.822 16.646 -14.693 1.00 0.00 C ATOM 638 OG1 THR A 51 -1.386 17.682 -13.791 1.00 0.00 O ATOM 639 CG2 THR A 51 -2.241 15.428 -13.886 1.00 0.00 C ATOM 0 H THR A 51 0.974 17.518 -16.061 1.00 0.00 H new ATOM 0 HA THR A 51 0.094 15.759 -15.079 1.00 0.00 H new ATOM 0 HB THR A 51 -2.673 16.991 -15.280 1.00 0.00 H new ATOM 0 HG1 THR A 51 -1.267 18.519 -14.287 1.00 0.00 H new ATOM 0 HG21 THR A 51 -3.056 15.699 -13.215 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.574 14.641 -14.562 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.394 15.070 -13.302 1.00 0.00 H new ATOM 647 N PRO A 52 -0.552 14.153 -16.901 1.00 0.00 N ATOM 648 CA PRO A 52 0.532 13.698 -16.015 1.00 0.00 C ATOM 649 C PRO A 52 1.774 14.551 -16.174 1.00 0.00 C ATOM 650 O PRO A 52 2.340 15.030 -15.192 1.00 0.00 O ATOM 651 CB PRO A 52 0.815 12.261 -16.489 1.00 0.00 C ATOM 652 CG PRO A 52 -0.363 11.888 -17.322 1.00 0.00 C ATOM 653 CD PRO A 52 -0.858 13.161 -17.933 1.00 0.00 C ATOM 0 HA PRO A 52 0.255 13.762 -14.963 1.00 0.00 H new ATOM 0 HB2 PRO A 52 1.738 12.211 -17.067 1.00 0.00 H new ATOM 0 HB3 PRO A 52 0.931 11.583 -15.644 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -0.084 11.169 -18.092 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -1.138 11.420 -16.714 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -0.351 13.384 -18.872 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -1.925 13.118 -18.150 1.00 0.00 H new ATOM 661 N CYS A 53 2.173 14.757 -17.416 1.00 0.00 N ATOM 662 CA CYS A 53 3.326 15.557 -17.724 1.00 0.00 C ATOM 663 C CYS A 53 3.416 15.788 -19.224 1.00 0.00 C ATOM 664 O CYS A 53 3.178 14.870 -20.013 1.00 0.00 O ATOM 665 CB CYS A 53 4.577 14.854 -17.237 1.00 0.00 C ATOM 666 SG CYS A 53 6.049 15.879 -17.269 1.00 0.00 S ATOM 0 H CYS A 53 1.701 14.371 -18.234 1.00 0.00 H new ATOM 0 HA CYS A 53 3.235 16.521 -17.224 1.00 0.00 H new ATOM 0 HB2 CYS A 53 4.412 14.505 -16.218 1.00 0.00 H new ATOM 0 HB3 CYS A 53 4.748 13.971 -17.853 1.00 0.00 H new ATOM 671 N GLY A 54 3.727 17.012 -19.621 1.00 0.00 N ATOM 672 CA GLY A 54 3.877 17.304 -21.021 1.00 0.00 C ATOM 673 C GLY A 54 5.328 17.350 -21.450 1.00 0.00 C ATOM 674 O GLY A 54 5.621 17.401 -22.644 1.00 0.00 O ATOM 0 H GLY A 54 3.877 17.804 -18.996 1.00 0.00 H new ATOM 0 HA2 GLY A 54 3.352 16.548 -21.605 1.00 0.00 H new ATOM 0 HA3 GLY A 54 3.405 18.261 -21.242 1.00 0.00 H new ATOM 678 N CYS A 55 6.244 17.348 -20.479 1.00 0.00 N ATOM 679 CA CYS A 55 7.660 17.377 -20.776 1.00 0.00 C ATOM 680 C CYS A 55 8.083 16.098 -21.491 1.00 0.00 C ATOM 681 O CYS A 55 8.319 16.101 -22.699 1.00 0.00 O ATOM 682 CB CYS A 55 8.471 17.543 -19.491 1.00 0.00 C ATOM 683 SG CYS A 55 8.269 19.127 -18.649 1.00 0.00 S ATOM 0 H CYS A 55 6.021 17.327 -19.484 1.00 0.00 H new ATOM 0 HA CYS A 55 7.853 18.227 -21.430 1.00 0.00 H new ATOM 0 HB2 CYS A 55 8.194 16.746 -18.801 1.00 0.00 H new ATOM 0 HB3 CYS A 55 9.526 17.408 -19.727 1.00 0.00 H new ATOM 688 N GLY A 56 8.141 15.003 -20.743 1.00 0.00 N ATOM 689 CA GLY A 56 8.561 13.733 -21.309 1.00 0.00 C ATOM 690 C GLY A 56 9.966 13.803 -21.876 1.00 0.00 C ATOM 691 O GLY A 56 10.931 13.993 -21.136 1.00 0.00 O ATOM 0 H GLY A 56 7.904 14.971 -19.751 1.00 0.00 H new ATOM 0 HA2 GLY A 56 8.518 12.961 -20.541 1.00 0.00 H new ATOM 0 HA3 GLY A 56 7.866 13.439 -22.096 1.00 0.00 H new ATOM 695 N SER A 57 10.076 13.676 -23.189 1.00 0.00 N ATOM 696 CA SER A 57 11.364 13.742 -23.864 1.00 0.00 C ATOM 697 C SER A 57 11.658 15.173 -24.345 1.00 0.00 C ATOM 698 O SER A 57 12.640 15.419 -25.053 1.00 0.00 O ATOM 699 CB SER A 57 11.385 12.762 -25.035 1.00 0.00 C ATOM 700 OG SER A 57 11.045 11.451 -24.599 1.00 0.00 O ATOM 0 H SER A 57 9.283 13.526 -23.813 1.00 0.00 H new ATOM 0 HA SER A 57 12.145 13.463 -23.157 1.00 0.00 H new ATOM 0 HB2 SER A 57 10.683 13.089 -25.802 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.375 12.754 -25.491 1.00 0.00 H new ATOM 0 HG SER A 57 11.062 10.837 -25.363 1.00 0.00 H new ATOM 706 N GLY A 58 10.797 16.099 -23.956 1.00 0.00 N ATOM 707 CA GLY A 58 10.975 17.498 -24.291 1.00 0.00 C ATOM 708 C GLY A 58 10.720 18.369 -23.083 1.00 0.00 C ATOM 709 O GLY A 58 9.711 19.067 -23.007 1.00 0.00 O ATOM 0 H GLY A 58 9.962 15.902 -23.404 1.00 0.00 H new ATOM 0 HA2 GLY A 58 11.988 17.664 -24.659 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.294 17.775 -25.096 1.00 0.00 H new ATOM 713 N CYS A 59 11.632 18.313 -22.140 1.00 0.00 N ATOM 714 CA CYS A 59 11.494 19.015 -20.877 1.00 0.00 C ATOM 715 C CYS A 59 11.952 20.473 -20.960 1.00 0.00 C ATOM 716 O CYS A 59 12.803 20.830 -21.779 1.00 0.00 O ATOM 717 CB CYS A 59 12.263 18.255 -19.794 1.00 0.00 C ATOM 718 SG CYS A 59 12.550 19.174 -18.270 1.00 0.00 S ATOM 0 H CYS A 59 12.496 17.778 -22.224 1.00 0.00 H new ATOM 0 HA CYS A 59 10.435 19.048 -20.621 1.00 0.00 H new ATOM 0 HB2 CYS A 59 11.715 17.344 -19.553 1.00 0.00 H new ATOM 0 HB3 CYS A 59 13.226 17.949 -20.202 1.00 0.00 H new ATOM 723 N ASN A 60 11.363 21.309 -20.109 1.00 0.00 N ATOM 724 CA ASN A 60 11.697 22.730 -20.044 1.00 0.00 C ATOM 725 C ASN A 60 11.741 23.198 -18.597 1.00 0.00 C ATOM 726 O ASN A 60 11.532 24.380 -18.310 1.00 0.00 O ATOM 727 CB ASN A 60 10.672 23.576 -20.821 1.00 0.00 C ATOM 728 CG ASN A 60 10.783 23.426 -22.324 1.00 0.00 C ATOM 729 OD1 ASN A 60 10.116 22.589 -22.928 1.00 0.00 O ATOM 730 ND2 ASN A 60 11.622 24.239 -22.938 1.00 0.00 N ATOM 0 H ASN A 60 10.643 21.022 -19.446 1.00 0.00 H new ATOM 0 HA ASN A 60 12.678 22.861 -20.500 1.00 0.00 H new ATOM 0 HB2 ASN A 60 9.667 23.293 -20.508 1.00 0.00 H new ATOM 0 HB3 ASN A 60 10.804 24.625 -20.557 1.00 0.00 H new ATOM 0 HD21 ASN A 60 11.735 24.186 -23.950 1.00 0.00 H new ATOM 0 HD22 ASN A 60 12.158 24.920 -22.400 1.00 0.00 H new ATOM 737 N CYS A 61 12.012 22.274 -17.688 1.00 0.00 N ATOM 738 CA CYS A 61 12.054 22.583 -16.264 1.00 0.00 C ATOM 739 C CYS A 61 13.319 23.314 -15.861 1.00 0.00 C ATOM 740 O CYS A 61 14.140 23.694 -16.697 1.00 0.00 O ATOM 741 CB CYS A 61 11.902 21.321 -15.432 1.00 0.00 C ATOM 742 SG CYS A 61 10.199 20.879 -15.113 1.00 0.00 S ATOM 0 H CYS A 61 12.207 21.298 -17.911 1.00 0.00 H new ATOM 0 HA CYS A 61 11.214 23.250 -16.070 1.00 0.00 H new ATOM 0 HB2 CYS A 61 12.393 20.495 -15.946 1.00 0.00 H new ATOM 0 HB3 CYS A 61 12.418 21.457 -14.482 1.00 0.00 H new ATOM 747 N LYS A 62 13.467 23.499 -14.566 1.00 0.00 N ATOM 748 CA LYS A 62 14.587 24.212 -14.016 1.00 0.00 C ATOM 749 C LYS A 62 15.659 23.235 -13.547 1.00 0.00 C ATOM 750 O LYS A 62 16.631 22.989 -14.256 1.00 0.00 O ATOM 751 CB LYS A 62 14.103 25.093 -12.861 1.00 0.00 C ATOM 752 CG LYS A 62 13.099 26.171 -13.269 1.00 0.00 C ATOM 753 CD LYS A 62 13.776 27.480 -13.679 1.00 0.00 C ATOM 754 CE LYS A 62 14.619 27.339 -14.937 1.00 0.00 C ATOM 755 NZ LYS A 62 15.173 28.644 -15.379 1.00 0.00 N ATOM 0 H LYS A 62 12.808 23.155 -13.867 1.00 0.00 H new ATOM 0 HA LYS A 62 15.030 24.847 -14.783 1.00 0.00 H new ATOM 0 HB2 LYS A 62 13.647 24.458 -12.101 1.00 0.00 H new ATOM 0 HB3 LYS A 62 14.966 25.573 -12.399 1.00 0.00 H new ATOM 0 HG2 LYS A 62 12.494 25.804 -14.098 1.00 0.00 H new ATOM 0 HG3 LYS A 62 12.419 26.362 -12.439 1.00 0.00 H new ATOM 0 HD2 LYS A 62 13.014 28.242 -13.841 1.00 0.00 H new ATOM 0 HD3 LYS A 62 14.407 27.829 -12.862 1.00 0.00 H new ATOM 0 HE2 LYS A 62 15.436 26.642 -14.751 1.00 0.00 H new ATOM 0 HE3 LYS A 62 14.012 26.913 -15.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 15.741 28.506 -16.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 14.393 29.302 -15.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 15.773 29.039 -14.627 1.00 0.00 H new ATOM 769 N GLU A 63 15.454 22.661 -12.365 1.00 0.00 N ATOM 770 CA GLU A 63 16.387 21.693 -11.795 1.00 0.00 C ATOM 771 C GLU A 63 15.797 21.106 -10.499 1.00 0.00 C ATOM 772 O GLU A 63 16.024 19.946 -10.174 1.00 0.00 O ATOM 773 CB GLU A 63 17.777 22.342 -11.556 1.00 0.00 C ATOM 774 CG GLU A 63 18.919 21.338 -11.368 1.00 0.00 C ATOM 775 CD GLU A 63 20.304 21.930 -11.661 1.00 0.00 C ATOM 776 OE1 GLU A 63 20.947 21.483 -12.629 1.00 0.00 O ATOM 777 OE2 GLU A 63 20.741 22.834 -10.924 1.00 0.00 O ATOM 0 H GLU A 63 14.642 22.852 -11.778 1.00 0.00 H new ATOM 0 HA GLU A 63 16.535 20.876 -12.501 1.00 0.00 H new ATOM 0 HB2 GLU A 63 18.013 22.988 -12.401 1.00 0.00 H new ATOM 0 HB3 GLU A 63 17.720 22.979 -10.673 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.900 20.965 -10.344 1.00 0.00 H new ATOM 0 HG3 GLU A 63 18.752 20.482 -12.022 1.00 0.00 H new ATOM 784 N ASP A 64 14.996 21.914 -9.793 1.00 0.00 N ATOM 785 CA ASP A 64 14.309 21.471 -8.558 1.00 0.00 C ATOM 786 C ASP A 64 13.007 20.731 -8.930 1.00 0.00 C ATOM 787 O ASP A 64 11.911 21.082 -8.478 1.00 0.00 O ATOM 788 CB ASP A 64 13.982 22.690 -7.658 1.00 0.00 C ATOM 789 CG ASP A 64 13.662 22.323 -6.204 1.00 0.00 C ATOM 790 OD1 ASP A 64 12.514 21.935 -5.915 1.00 0.00 O ATOM 791 OD2 ASP A 64 14.562 22.463 -5.344 1.00 0.00 O ATOM 0 H ASP A 64 14.803 22.882 -10.051 1.00 0.00 H new ATOM 0 HA ASP A 64 14.966 20.797 -8.008 1.00 0.00 H new ATOM 0 HB2 ASP A 64 14.829 23.376 -7.671 1.00 0.00 H new ATOM 0 HB3 ASP A 64 13.132 23.225 -8.083 1.00 0.00 H new ATOM 796 N CYS A 65 13.128 19.744 -9.791 1.00 0.00 N ATOM 797 CA CYS A 65 11.979 18.963 -10.210 1.00 0.00 C ATOM 798 C CYS A 65 11.967 17.621 -9.505 1.00 0.00 C ATOM 799 O CYS A 65 12.996 16.962 -9.404 1.00 0.00 O ATOM 800 CB CYS A 65 11.973 18.761 -11.719 1.00 0.00 C ATOM 801 SG CYS A 65 10.568 17.798 -12.310 1.00 0.00 S ATOM 0 H CYS A 65 14.011 19.461 -10.216 1.00 0.00 H new ATOM 0 HA CYS A 65 11.080 19.516 -9.936 1.00 0.00 H new ATOM 0 HB2 CYS A 65 11.967 19.735 -12.208 1.00 0.00 H new ATOM 0 HB3 CYS A 65 12.896 18.262 -12.014 1.00 0.00 H new ATOM 806 N ARG A 66 10.797 17.215 -9.037 1.00 0.00 N ATOM 807 CA ARG A 66 10.656 15.978 -8.275 1.00 0.00 C ATOM 808 C ARG A 66 9.908 14.934 -9.076 1.00 0.00 C ATOM 809 O ARG A 66 9.415 13.942 -8.530 1.00 0.00 O ATOM 810 CB ARG A 66 9.917 16.264 -6.976 1.00 0.00 C ATOM 811 CG ARG A 66 10.465 17.464 -6.248 1.00 0.00 C ATOM 812 CD ARG A 66 9.837 17.642 -4.888 1.00 0.00 C ATOM 813 NE ARG A 66 10.383 18.826 -4.193 1.00 0.00 N ATOM 814 CZ ARG A 66 11.678 18.978 -3.835 1.00 0.00 C ATOM 815 NH1 ARG A 66 12.543 17.989 -4.020 1.00 0.00 N ATOM 816 NH2 ARG A 66 12.085 20.111 -3.266 1.00 0.00 N ATOM 0 H ARG A 66 9.924 17.726 -9.171 1.00 0.00 H new ATOM 0 HA ARG A 66 11.650 15.589 -8.053 1.00 0.00 H new ATOM 0 HB2 ARG A 66 8.861 16.426 -7.192 1.00 0.00 H new ATOM 0 HB3 ARG A 66 9.980 15.390 -6.327 1.00 0.00 H new ATOM 0 HG2 ARG A 66 11.544 17.358 -6.137 1.00 0.00 H new ATOM 0 HG3 ARG A 66 10.293 18.359 -6.846 1.00 0.00 H new ATOM 0 HD2 ARG A 66 8.757 17.747 -4.995 1.00 0.00 H new ATOM 0 HD3 ARG A 66 10.013 16.751 -4.285 1.00 0.00 H new ATOM 0 HE ARG A 66 9.737 19.582 -3.967 1.00 0.00 H new ATOM 0 HH11 ARG A 66 12.232 17.110 -4.434 1.00 0.00 H new ATOM 0 HH12 ARG A 66 13.519 18.108 -3.749 1.00 0.00 H new ATOM 0 HH21 ARG A 66 11.420 20.866 -3.100 1.00 0.00 H new ATOM 0 HH22 ARG A 66 13.062 20.224 -2.997 1.00 0.00 H new ATOM 830 N CYS A 67 9.832 15.155 -10.364 1.00 0.00 N ATOM 831 CA CYS A 67 9.134 14.261 -11.247 1.00 0.00 C ATOM 832 C CYS A 67 10.114 13.332 -11.947 1.00 0.00 C ATOM 833 O CYS A 67 11.162 13.767 -12.408 1.00 0.00 O ATOM 834 CB CYS A 67 8.358 15.066 -12.276 1.00 0.00 C ATOM 835 SG CYS A 67 7.404 14.065 -13.416 1.00 0.00 S ATOM 0 H CYS A 67 10.253 15.960 -10.828 1.00 0.00 H new ATOM 0 HA CYS A 67 8.441 13.656 -10.662 1.00 0.00 H new ATOM 0 HB2 CYS A 67 7.685 15.748 -11.756 1.00 0.00 H new ATOM 0 HB3 CYS A 67 9.057 15.680 -12.844 1.00 0.00 H new ATOM 840 N GLN A 68 9.768 12.056 -12.041 1.00 0.00 N ATOM 841 CA GLN A 68 10.637 11.089 -12.699 1.00 0.00 C ATOM 842 C GLN A 68 10.144 10.802 -14.114 1.00 0.00 C ATOM 843 O GLN A 68 10.602 9.860 -14.765 1.00 0.00 O ATOM 844 CB GLN A 68 10.734 9.781 -11.889 1.00 0.00 C ATOM 845 CG GLN A 68 9.406 9.055 -11.703 1.00 0.00 C ATOM 846 CD GLN A 68 8.897 9.093 -10.271 1.00 0.00 C ATOM 847 OE1 GLN A 68 9.234 10.146 -9.546 1.00 0.00 O flip ATOM 848 NE2 GLN A 68 8.190 8.182 -9.824 1.00 0.00 N flip ATOM 0 H GLN A 68 8.899 11.668 -11.674 1.00 0.00 H new ATOM 0 HA GLN A 68 11.635 11.524 -12.757 1.00 0.00 H new ATOM 0 HB2 GLN A 68 11.434 9.110 -12.387 1.00 0.00 H new ATOM 0 HB3 GLN A 68 11.152 10.006 -10.908 1.00 0.00 H new ATOM 0 HG2 GLN A 68 8.660 9.503 -12.359 1.00 0.00 H new ATOM 0 HG3 GLN A 68 9.521 8.016 -12.013 1.00 0.00 H new ATOM 0 HE21 GLN A 68 7.951 7.385 -10.414 1.00 0.00 H new ATOM 0 HE22 GLN A 68 7.846 8.227 -8.865 1.00 0.00 H new ATOM 857 N SER A 69 9.216 11.621 -14.586 1.00 0.00 N ATOM 858 CA SER A 69 8.659 11.452 -15.904 1.00 0.00 C ATOM 859 C SER A 69 9.491 12.202 -16.934 1.00 0.00 C ATOM 860 O SER A 69 9.685 11.726 -18.051 1.00 0.00 O ATOM 861 CB SER A 69 7.217 11.949 -15.927 1.00 0.00 C ATOM 862 OG SER A 69 6.472 11.396 -14.850 1.00 0.00 O ATOM 0 H SER A 69 8.836 12.412 -14.066 1.00 0.00 H new ATOM 0 HA SER A 69 8.673 10.392 -16.156 1.00 0.00 H new ATOM 0 HB2 SER A 69 7.202 13.037 -15.864 1.00 0.00 H new ATOM 0 HB3 SER A 69 6.750 11.678 -16.874 1.00 0.00 H new ATOM 0 HG SER A 69 6.508 12.003 -14.081 1.00 0.00 H new ATOM 868 N CYS A 70 9.980 13.375 -16.560 1.00 0.00 N ATOM 869 CA CYS A 70 10.785 14.164 -17.465 1.00 0.00 C ATOM 870 C CYS A 70 12.259 14.135 -17.076 1.00 0.00 C ATOM 871 O CYS A 70 13.140 14.184 -17.941 1.00 0.00 O ATOM 872 CB CYS A 70 10.258 15.593 -17.555 1.00 0.00 C ATOM 873 SG CYS A 70 10.227 16.506 -15.998 1.00 0.00 S ATOM 0 H CYS A 70 9.832 13.795 -15.642 1.00 0.00 H new ATOM 0 HA CYS A 70 10.707 13.716 -18.456 1.00 0.00 H new ATOM 0 HB2 CYS A 70 10.871 16.144 -18.268 1.00 0.00 H new ATOM 0 HB3 CYS A 70 9.246 15.564 -17.960 1.00 0.00 H new ATOM 878 N SER A 71 12.527 14.053 -15.779 1.00 0.00 N ATOM 879 CA SER A 71 13.893 13.958 -15.290 1.00 0.00 C ATOM 880 C SER A 71 14.536 12.665 -15.780 1.00 0.00 C ATOM 881 O SER A 71 13.841 11.678 -16.035 1.00 0.00 O ATOM 882 CB SER A 71 13.904 14.004 -13.770 1.00 0.00 C ATOM 883 OG SER A 71 13.225 15.152 -13.304 1.00 0.00 O ATOM 0 H SER A 71 11.815 14.051 -15.048 1.00 0.00 H new ATOM 0 HA SER A 71 14.466 14.802 -15.674 1.00 0.00 H new ATOM 0 HB2 SER A 71 13.431 13.107 -13.370 1.00 0.00 H new ATOM 0 HB3 SER A 71 14.932 14.011 -13.408 1.00 0.00 H new ATOM 0 HG SER A 71 12.418 14.880 -12.818 1.00 0.00 H new ATOM 889 N THR A 72 15.849 12.665 -15.912 1.00 0.00 N ATOM 890 CA THR A 72 16.542 11.485 -16.416 1.00 0.00 C ATOM 891 C THR A 72 16.695 10.426 -15.339 1.00 0.00 C ATOM 892 O THR A 72 16.789 10.740 -14.138 1.00 0.00 O ATOM 893 CB THR A 72 17.924 11.827 -17.033 1.00 0.00 C ATOM 894 OG1 THR A 72 18.458 10.677 -17.705 1.00 0.00 O ATOM 895 CG2 THR A 72 18.902 12.272 -15.960 1.00 0.00 C ATOM 0 H THR A 72 16.453 13.454 -15.682 1.00 0.00 H new ATOM 0 HA THR A 72 15.916 11.083 -17.213 1.00 0.00 H new ATOM 0 HB THR A 72 17.784 12.641 -17.744 1.00 0.00 H new ATOM 0 HG1 THR A 72 19.329 10.901 -18.094 1.00 0.00 H new ATOM 0 HG21 THR A 72 19.863 12.506 -16.418 1.00 0.00 H new ATOM 0 HG22 THR A 72 18.514 13.159 -15.459 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.032 11.471 -15.232 1.00 0.00 H new ATOM 903 N ALA A 73 16.707 9.173 -15.779 1.00 0.00 N ATOM 904 CA ALA A 73 16.834 8.034 -14.900 1.00 0.00 C ATOM 905 C ALA A 73 18.048 8.155 -14.014 1.00 0.00 C ATOM 906 O ALA A 73 19.161 8.412 -14.480 1.00 0.00 O ATOM 907 CB ALA A 73 16.899 6.745 -15.706 1.00 0.00 C ATOM 0 H ALA A 73 16.628 8.925 -16.765 1.00 0.00 H new ATOM 0 HA ALA A 73 15.952 8.009 -14.261 1.00 0.00 H new ATOM 0 HB1 ALA A 73 16.995 5.897 -15.028 1.00 0.00 H new ATOM 0 HB2 ALA A 73 15.988 6.638 -16.295 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.761 6.776 -16.373 1.00 0.00 H new ATOM 913 N CYS A 74 17.814 8.019 -12.740 1.00 0.00 N ATOM 914 CA CYS A 74 18.872 8.036 -11.755 1.00 0.00 C ATOM 915 C CYS A 74 19.758 6.826 -11.886 1.00 0.00 C ATOM 916 O CYS A 74 19.381 5.825 -12.496 1.00 0.00 O ATOM 917 CB CYS A 74 18.290 8.065 -10.356 1.00 0.00 C ATOM 918 SG CYS A 74 17.547 9.619 -9.919 1.00 0.00 S ATOM 0 H CYS A 74 16.881 7.892 -12.347 1.00 0.00 H new ATOM 0 HA CYS A 74 19.466 8.933 -11.929 1.00 0.00 H new ATOM 0 HB2 CYS A 74 17.541 7.278 -10.268 1.00 0.00 H new ATOM 0 HB3 CYS A 74 19.079 7.836 -9.640 1.00 0.00 H new ATOM 923 N LYS A 75 20.927 6.915 -11.303 1.00 0.00 N ATOM 924 CA LYS A 75 21.845 5.789 -11.290 1.00 0.00 C ATOM 925 C LYS A 75 21.586 4.908 -10.081 1.00 0.00 C ATOM 926 O LYS A 75 22.415 4.076 -9.705 1.00 0.00 O ATOM 927 CB LYS A 75 23.302 6.256 -11.328 1.00 0.00 C ATOM 928 CG LYS A 75 23.767 6.690 -12.710 1.00 0.00 C ATOM 929 CD LYS A 75 23.696 5.532 -13.699 1.00 0.00 C ATOM 930 CE LYS A 75 24.083 5.969 -15.098 1.00 0.00 C ATOM 931 NZ LYS A 75 23.895 4.882 -16.090 1.00 0.00 N ATOM 0 H LYS A 75 21.271 7.751 -10.830 1.00 0.00 H new ATOM 0 HA LYS A 75 21.669 5.199 -12.190 1.00 0.00 H new ATOM 0 HB2 LYS A 75 23.426 7.088 -10.634 1.00 0.00 H new ATOM 0 HB3 LYS A 75 23.943 5.448 -10.975 1.00 0.00 H new ATOM 0 HG2 LYS A 75 23.147 7.514 -13.064 1.00 0.00 H new ATOM 0 HG3 LYS A 75 24.790 7.062 -12.653 1.00 0.00 H new ATOM 0 HD2 LYS A 75 24.359 4.731 -13.371 1.00 0.00 H new ATOM 0 HD3 LYS A 75 22.685 5.124 -13.711 1.00 0.00 H new ATOM 0 HE2 LYS A 75 23.483 6.832 -15.387 1.00 0.00 H new ATOM 0 HE3 LYS A 75 25.125 6.289 -15.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 24.171 5.222 -17.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 24.486 4.067 -15.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 22.896 4.594 -16.104 1.00 0.00 H new ATOM 945 N CYS A 76 20.427 5.093 -9.477 1.00 0.00 N ATOM 946 CA CYS A 76 20.030 4.309 -8.346 1.00 0.00 C ATOM 947 C CYS A 76 19.680 2.892 -8.779 1.00 0.00 C ATOM 948 O CYS A 76 18.858 2.691 -9.672 1.00 0.00 O ATOM 949 CB CYS A 76 18.843 4.949 -7.642 1.00 0.00 C ATOM 950 SG CYS A 76 19.091 6.660 -7.183 1.00 0.00 S ATOM 0 H CYS A 76 19.742 5.793 -9.764 1.00 0.00 H new ATOM 0 HA CYS A 76 20.866 4.266 -7.648 1.00 0.00 H new ATOM 0 HB2 CYS A 76 17.971 4.883 -8.293 1.00 0.00 H new ATOM 0 HB3 CYS A 76 18.615 4.374 -6.744 1.00 0.00 H new ATOM 955 N ALA A 77 20.293 1.927 -8.115 1.00 0.00 N ATOM 956 CA ALA A 77 20.138 0.517 -8.426 1.00 0.00 C ATOM 957 C ALA A 77 21.000 -0.299 -7.482 1.00 0.00 C ATOM 958 O ALA A 77 22.099 0.125 -7.139 1.00 0.00 O ATOM 959 CB ALA A 77 20.576 0.255 -9.855 1.00 0.00 C ATOM 0 H ALA A 77 20.922 2.105 -7.332 1.00 0.00 H new ATOM 0 HA ALA A 77 19.091 0.234 -8.312 1.00 0.00 H new ATOM 0 HB1 ALA A 77 20.458 -0.804 -10.083 1.00 0.00 H new ATOM 0 HB2 ALA A 77 19.963 0.844 -10.537 1.00 0.00 H new ATOM 0 HB3 ALA A 77 21.622 0.537 -9.972 1.00 0.00 H new ATOM 965 N ALA A 78 20.493 -1.441 -7.040 1.00 0.00 N ATOM 966 CA ALA A 78 21.245 -2.351 -6.163 1.00 0.00 C ATOM 967 C ALA A 78 21.776 -1.637 -4.911 1.00 0.00 C ATOM 968 O ALA A 78 22.905 -1.868 -4.482 1.00 0.00 O ATOM 969 CB ALA A 78 22.390 -2.996 -6.939 1.00 0.00 C ATOM 0 H ALA A 78 19.556 -1.769 -7.273 1.00 0.00 H new ATOM 0 HA ALA A 78 20.559 -3.127 -5.823 1.00 0.00 H new ATOM 0 HB1 ALA A 78 22.942 -3.668 -6.282 1.00 0.00 H new ATOM 0 HB2 ALA A 78 21.987 -3.560 -7.780 1.00 0.00 H new ATOM 0 HB3 ALA A 78 23.060 -2.221 -7.310 1.00 0.00 H new ATOM 975 N GLY A 79 20.949 -0.785 -4.327 1.00 0.00 N ATOM 976 CA GLY A 79 21.350 -0.064 -3.129 1.00 0.00 C ATOM 977 C GLY A 79 22.169 1.183 -3.421 1.00 0.00 C ATOM 978 O GLY A 79 22.998 1.589 -2.609 1.00 0.00 O ATOM 0 H GLY A 79 20.007 -0.577 -4.658 1.00 0.00 H new ATOM 0 HA2 GLY A 79 20.459 0.219 -2.568 1.00 0.00 H new ATOM 0 HA3 GLY A 79 21.931 -0.730 -2.490 1.00 0.00 H new ATOM 982 N SER A 80 21.941 1.800 -4.570 1.00 0.00 N ATOM 983 CA SER A 80 22.670 2.988 -4.938 1.00 0.00 C ATOM 984 C SER A 80 21.800 4.255 -4.845 1.00 0.00 C ATOM 985 O SER A 80 21.822 5.099 -5.740 1.00 0.00 O ATOM 986 CB SER A 80 23.243 2.825 -6.338 1.00 0.00 C ATOM 987 OG SER A 80 24.151 1.737 -6.393 1.00 0.00 O ATOM 0 H SER A 80 21.255 1.492 -5.259 1.00 0.00 H new ATOM 0 HA SER A 80 23.486 3.115 -4.227 1.00 0.00 H new ATOM 0 HB2 SER A 80 22.433 2.664 -7.050 1.00 0.00 H new ATOM 0 HB3 SER A 80 23.751 3.742 -6.636 1.00 0.00 H new ATOM 0 HG SER A 80 23.675 0.928 -6.674 1.00 0.00 H new ATOM 993 N CYS A 81 21.031 4.369 -3.770 1.00 0.00 N ATOM 994 CA CYS A 81 20.262 5.577 -3.502 1.00 0.00 C ATOM 995 C CYS A 81 20.657 6.095 -2.114 1.00 0.00 C ATOM 996 O CYS A 81 19.946 5.883 -1.126 1.00 0.00 O ATOM 997 CB CYS A 81 18.765 5.314 -3.545 1.00 0.00 C ATOM 998 SG CYS A 81 17.778 6.798 -3.841 1.00 0.00 S ATOM 0 H CYS A 81 20.923 3.637 -3.068 1.00 0.00 H new ATOM 0 HA CYS A 81 20.483 6.316 -4.272 1.00 0.00 H new ATOM 0 HB2 CYS A 81 18.555 4.586 -4.328 1.00 0.00 H new ATOM 0 HB3 CYS A 81 18.456 4.865 -2.601 1.00 0.00 H new ATOM 1003 N LYS A 82 21.804 6.747 -2.051 1.00 0.00 N ATOM 1004 CA LYS A 82 22.421 7.168 -0.783 1.00 0.00 C ATOM 1005 C LYS A 82 21.696 8.295 -0.051 1.00 0.00 C ATOM 1006 O LYS A 82 22.119 8.683 1.038 1.00 0.00 O ATOM 1007 CB LYS A 82 23.830 7.610 -1.035 1.00 0.00 C ATOM 1008 CG LYS A 82 23.913 8.814 -1.933 1.00 0.00 C ATOM 1009 CD LYS A 82 25.301 9.331 -1.969 1.00 0.00 C ATOM 1010 CE LYS A 82 25.462 10.436 -2.988 1.00 0.00 C ATOM 1011 NZ LYS A 82 26.843 10.961 -3.017 1.00 0.00 N ATOM 0 H LYS A 82 22.345 7.006 -2.876 1.00 0.00 H new ATOM 0 HA LYS A 82 22.366 6.292 -0.137 1.00 0.00 H new ATOM 0 HB2 LYS A 82 24.310 7.839 -0.083 1.00 0.00 H new ATOM 0 HB3 LYS A 82 24.389 6.789 -1.484 1.00 0.00 H new ATOM 0 HG2 LYS A 82 23.590 8.549 -2.940 1.00 0.00 H new ATOM 0 HG3 LYS A 82 23.237 9.591 -1.575 1.00 0.00 H new ATOM 0 HD2 LYS A 82 25.576 9.704 -0.982 1.00 0.00 H new ATOM 0 HD3 LYS A 82 25.986 8.517 -2.204 1.00 0.00 H new ATOM 0 HE2 LYS A 82 25.195 10.061 -3.976 1.00 0.00 H new ATOM 0 HE3 LYS A 82 24.770 11.246 -2.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 26.912 11.717 -3.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 27.089 11.342 -2.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 27.501 10.194 -3.262 1.00 0.00 H new ATOM 1025 N CYS A 83 20.633 8.822 -0.613 1.00 0.00 N ATOM 1026 CA CYS A 83 19.946 9.932 0.025 1.00 0.00 C ATOM 1027 C CYS A 83 19.272 9.467 1.301 1.00 0.00 C ATOM 1028 O CYS A 83 19.082 10.245 2.242 1.00 0.00 O ATOM 1029 CB CYS A 83 18.927 10.535 -0.914 1.00 0.00 C ATOM 1030 SG CYS A 83 17.667 9.380 -1.408 1.00 0.00 S ATOM 0 H CYS A 83 20.227 8.510 -1.495 1.00 0.00 H new ATOM 0 HA CYS A 83 20.682 10.697 0.274 1.00 0.00 H new ATOM 0 HB2 CYS A 83 18.457 11.391 -0.430 1.00 0.00 H new ATOM 0 HB3 CYS A 83 19.436 10.910 -1.802 1.00 0.00 H new ATOM 1035 N GLY A 84 18.918 8.195 1.338 1.00 0.00 N ATOM 1036 CA GLY A 84 18.303 7.652 2.516 1.00 0.00 C ATOM 1037 C GLY A 84 16.944 7.085 2.231 1.00 0.00 C ATOM 1038 O GLY A 84 16.381 6.359 3.048 1.00 0.00 O ATOM 0 H GLY A 84 19.047 7.533 0.573 1.00 0.00 H new ATOM 0 HA2 GLY A 84 18.941 6.872 2.931 1.00 0.00 H new ATOM 0 HA3 GLY A 84 18.219 8.432 3.273 1.00 0.00 H new ATOM 1042 N LYS A 85 16.405 7.429 1.078 1.00 0.00 N ATOM 1043 CA LYS A 85 15.123 6.907 0.656 1.00 0.00 C ATOM 1044 C LYS A 85 15.266 5.438 0.346 1.00 0.00 C ATOM 1045 O LYS A 85 14.537 4.598 0.870 1.00 0.00 O ATOM 1046 CB LYS A 85 14.643 7.641 -0.583 1.00 0.00 C ATOM 1047 CG LYS A 85 14.429 9.123 -0.385 1.00 0.00 C ATOM 1048 CD LYS A 85 13.334 9.391 0.620 1.00 0.00 C ATOM 1049 CE LYS A 85 12.568 10.618 0.235 1.00 0.00 C ATOM 1050 NZ LYS A 85 11.333 10.769 1.033 1.00 0.00 N ATOM 0 H LYS A 85 16.839 8.071 0.415 1.00 0.00 H new ATOM 0 HA LYS A 85 14.396 7.049 1.455 1.00 0.00 H new ATOM 0 HB2 LYS A 85 15.370 7.495 -1.382 1.00 0.00 H new ATOM 0 HB3 LYS A 85 13.707 7.192 -0.917 1.00 0.00 H new ATOM 0 HG2 LYS A 85 15.357 9.584 -0.047 1.00 0.00 H new ATOM 0 HG3 LYS A 85 14.172 9.586 -1.338 1.00 0.00 H new ATOM 0 HD2 LYS A 85 12.661 8.535 0.673 1.00 0.00 H new ATOM 0 HD3 LYS A 85 13.765 9.519 1.613 1.00 0.00 H new ATOM 0 HE2 LYS A 85 13.198 11.497 0.371 1.00 0.00 H new ATOM 0 HE3 LYS A 85 12.313 10.570 -0.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 10.629 11.305 0.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 10.951 9.829 1.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 11.549 11.280 1.913 1.00 0.00 H new ATOM 1064 N GLY A 86 16.214 5.144 -0.511 1.00 0.00 N ATOM 1065 CA GLY A 86 16.492 3.770 -0.863 1.00 0.00 C ATOM 1066 C GLY A 86 15.563 3.264 -1.931 1.00 0.00 C ATOM 1067 O GLY A 86 15.129 2.114 -1.899 1.00 0.00 O ATOM 0 H GLY A 86 16.804 5.833 -0.976 1.00 0.00 H new ATOM 0 HA2 GLY A 86 17.522 3.686 -1.209 1.00 0.00 H new ATOM 0 HA3 GLY A 86 16.401 3.143 0.024 1.00 0.00 H new ATOM 1071 N CYS A 87 15.254 4.124 -2.873 1.00 0.00 N ATOM 1072 CA CYS A 87 14.364 3.785 -3.962 1.00 0.00 C ATOM 1073 C CYS A 87 15.051 2.845 -4.927 1.00 0.00 C ATOM 1074 O CYS A 87 14.431 1.924 -5.463 1.00 0.00 O ATOM 1075 CB CYS A 87 13.944 5.055 -4.661 1.00 0.00 C ATOM 1076 SG CYS A 87 13.464 6.337 -3.511 1.00 0.00 S ATOM 0 H CYS A 87 15.612 5.079 -2.907 1.00 0.00 H new ATOM 0 HA CYS A 87 13.481 3.278 -3.573 1.00 0.00 H new ATOM 0 HB2 CYS A 87 14.766 5.415 -5.280 1.00 0.00 H new ATOM 0 HB3 CYS A 87 13.111 4.840 -5.330 1.00 0.00 H new ATOM 1081 N THR A 88 16.346 3.081 -5.129 1.00 0.00 N ATOM 1082 CA THR A 88 17.182 2.260 -5.998 1.00 0.00 C ATOM 1083 C THR A 88 16.554 2.055 -7.371 1.00 0.00 C ATOM 1084 O THR A 88 16.461 0.938 -7.872 1.00 0.00 O ATOM 1085 CB THR A 88 17.541 0.906 -5.338 1.00 0.00 C ATOM 1086 OG1 THR A 88 16.362 0.148 -5.026 1.00 0.00 O ATOM 1087 CG2 THR A 88 18.321 1.157 -4.065 1.00 0.00 C ATOM 0 H THR A 88 16.847 3.854 -4.690 1.00 0.00 H new ATOM 0 HA THR A 88 18.111 2.810 -6.147 1.00 0.00 H new ATOM 0 HB THR A 88 18.142 0.333 -6.044 1.00 0.00 H new ATOM 0 HG1 THR A 88 15.592 0.535 -5.492 1.00 0.00 H new ATOM 0 HG21 THR A 88 18.574 0.204 -3.600 1.00 0.00 H new ATOM 0 HG22 THR A 88 19.236 1.701 -4.300 1.00 0.00 H new ATOM 0 HG23 THR A 88 17.715 1.747 -3.377 1.00 0.00 H new ATOM 1095 N GLY A 89 16.149 3.153 -7.976 1.00 0.00 N ATOM 1096 CA GLY A 89 15.512 3.091 -9.274 1.00 0.00 C ATOM 1097 C GLY A 89 14.617 4.283 -9.518 1.00 0.00 C ATOM 1098 O GLY A 89 13.968 4.757 -8.595 1.00 0.00 O ATOM 0 H GLY A 89 16.249 4.093 -7.592 1.00 0.00 H new ATOM 0 HA2 GLY A 89 16.275 3.044 -10.051 1.00 0.00 H new ATOM 0 HA3 GLY A 89 14.926 2.175 -9.348 1.00 0.00 H new ATOM 1102 N PRO A 90 14.542 4.770 -10.766 1.00 0.00 N ATOM 1103 CA PRO A 90 13.751 5.963 -11.115 1.00 0.00 C ATOM 1104 C PRO A 90 12.255 5.764 -10.887 1.00 0.00 C ATOM 1105 O PRO A 90 11.552 6.687 -10.494 1.00 0.00 O ATOM 1106 CB PRO A 90 14.042 6.165 -12.608 1.00 0.00 C ATOM 1107 CG PRO A 90 14.492 4.830 -13.094 1.00 0.00 C ATOM 1108 CD PRO A 90 15.209 4.190 -11.941 1.00 0.00 C ATOM 0 HA PRO A 90 14.019 6.818 -10.494 1.00 0.00 H new ATOM 0 HB2 PRO A 90 13.153 6.501 -13.142 1.00 0.00 H new ATOM 0 HB3 PRO A 90 14.811 6.922 -12.762 1.00 0.00 H new ATOM 0 HG2 PRO A 90 13.643 4.224 -13.411 1.00 0.00 H new ATOM 0 HG3 PRO A 90 15.151 4.931 -13.956 1.00 0.00 H new ATOM 0 HD2 PRO A 90 15.116 3.104 -11.962 1.00 0.00 H new ATOM 0 HD3 PRO A 90 16.275 4.419 -11.953 1.00 0.00 H new ATOM 1116 N ASP A 91 11.786 4.547 -11.115 1.00 0.00 N ATOM 1117 CA ASP A 91 10.370 4.223 -10.959 1.00 0.00 C ATOM 1118 C ASP A 91 9.941 4.264 -9.506 1.00 0.00 C ATOM 1119 O ASP A 91 8.774 4.515 -9.200 1.00 0.00 O ATOM 1120 CB ASP A 91 10.063 2.852 -11.554 1.00 0.00 C ATOM 1121 CG ASP A 91 10.126 2.852 -13.059 1.00 0.00 C ATOM 1122 OD1 ASP A 91 11.167 2.452 -13.623 1.00 0.00 O ATOM 1123 OD2 ASP A 91 9.133 3.260 -13.696 1.00 0.00 O ATOM 0 H ASP A 91 12.366 3.762 -11.410 1.00 0.00 H new ATOM 0 HA ASP A 91 9.804 4.982 -11.499 1.00 0.00 H new ATOM 0 HB2 ASP A 91 10.772 2.122 -11.163 1.00 0.00 H new ATOM 0 HB3 ASP A 91 9.070 2.534 -11.235 1.00 0.00 H new ATOM 1128 N SER A 92 10.877 4.018 -8.613 1.00 0.00 N ATOM 1129 CA SER A 92 10.591 4.030 -7.194 1.00 0.00 C ATOM 1130 C SER A 92 11.021 5.355 -6.580 1.00 0.00 C ATOM 1131 O SER A 92 10.650 5.678 -5.454 1.00 0.00 O ATOM 1132 CB SER A 92 11.324 2.879 -6.509 1.00 0.00 C ATOM 1133 OG SER A 92 11.105 1.657 -7.197 1.00 0.00 O ATOM 0 H SER A 92 11.847 3.806 -8.847 1.00 0.00 H new ATOM 0 HA SER A 92 9.517 3.909 -7.051 1.00 0.00 H new ATOM 0 HB2 SER A 92 12.392 3.094 -6.472 1.00 0.00 H new ATOM 0 HB3 SER A 92 10.982 2.787 -5.478 1.00 0.00 H new ATOM 0 HG SER A 92 11.585 0.934 -6.741 1.00 0.00 H new ATOM 1139 N CYS A 93 11.802 6.114 -7.334 1.00 0.00 N ATOM 1140 CA CYS A 93 12.328 7.381 -6.868 1.00 0.00 C ATOM 1141 C CYS A 93 11.243 8.421 -6.733 1.00 0.00 C ATOM 1142 O CYS A 93 10.352 8.520 -7.568 1.00 0.00 O ATOM 1143 CB CYS A 93 13.417 7.891 -7.806 1.00 0.00 C ATOM 1144 SG CYS A 93 15.048 7.975 -7.056 1.00 0.00 S ATOM 0 H CYS A 93 12.086 5.867 -8.282 1.00 0.00 H new ATOM 0 HA CYS A 93 12.757 7.207 -5.881 1.00 0.00 H new ATOM 0 HB2 CYS A 93 13.463 7.241 -8.680 1.00 0.00 H new ATOM 0 HB3 CYS A 93 13.140 8.884 -8.162 1.00 0.00 H new ATOM 1149 N LYS A 94 11.309 9.170 -5.660 1.00 0.00 N ATOM 1150 CA LYS A 94 10.374 10.258 -5.419 1.00 0.00 C ATOM 1151 C LYS A 94 11.143 11.506 -4.981 1.00 0.00 C ATOM 1152 O LYS A 94 10.599 12.392 -4.312 1.00 0.00 O ATOM 1153 CB LYS A 94 9.345 9.841 -4.357 1.00 0.00 C ATOM 1154 CG LYS A 94 8.582 8.577 -4.729 1.00 0.00 C ATOM 1155 CD LYS A 94 7.639 8.117 -3.630 1.00 0.00 C ATOM 1156 CE LYS A 94 7.223 6.681 -3.870 1.00 0.00 C ATOM 1157 NZ LYS A 94 6.380 6.157 -2.775 1.00 0.00 N ATOM 0 H LYS A 94 12.008 9.049 -4.927 1.00 0.00 H new ATOM 0 HA LYS A 94 9.835 10.489 -6.338 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.856 9.684 -3.407 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.636 10.655 -4.207 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.011 8.757 -5.640 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.292 7.780 -4.950 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.128 8.205 -2.660 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.759 8.759 -3.603 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.677 6.614 -4.811 1.00 0.00 H new ATOM 0 HE3 LYS A 94 8.112 6.059 -3.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 5.926 5.272 -3.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 6.971 5.973 -1.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 5.649 6.857 -2.534 1.00 0.00 H new ATOM 1171 N CYS A 95 12.406 11.563 -5.390 1.00 0.00 N ATOM 1172 CA CYS A 95 13.310 12.658 -5.046 1.00 0.00 C ATOM 1173 C CYS A 95 13.380 13.683 -6.192 1.00 0.00 C ATOM 1174 O CYS A 95 12.636 13.576 -7.174 1.00 0.00 O ATOM 1175 CB CYS A 95 14.696 12.077 -4.781 1.00 0.00 C ATOM 1176 SG CYS A 95 14.666 10.548 -3.812 1.00 0.00 S ATOM 0 H CYS A 95 12.836 10.846 -5.974 1.00 0.00 H new ATOM 0 HA CYS A 95 12.941 13.170 -4.157 1.00 0.00 H new ATOM 0 HB2 CYS A 95 15.188 11.884 -5.734 1.00 0.00 H new ATOM 0 HB3 CYS A 95 15.298 12.819 -4.256 1.00 0.00 H new ATOM 1181 N ASP A 96 14.263 14.682 -6.064 1.00 0.00 N ATOM 1182 CA ASP A 96 14.419 15.692 -7.111 1.00 0.00 C ATOM 1183 C ASP A 96 15.729 15.520 -7.883 1.00 0.00 C ATOM 1184 O ASP A 96 16.509 14.609 -7.614 1.00 0.00 O ATOM 1185 CB ASP A 96 14.291 17.124 -6.561 1.00 0.00 C ATOM 1186 CG ASP A 96 15.394 17.522 -5.614 1.00 0.00 C ATOM 1187 OD1 ASP A 96 16.433 18.011 -6.086 1.00 0.00 O ATOM 1188 OD2 ASP A 96 15.205 17.385 -4.396 1.00 0.00 O ATOM 0 H ASP A 96 14.872 14.809 -5.256 1.00 0.00 H new ATOM 0 HA ASP A 96 13.598 15.535 -7.811 1.00 0.00 H new ATOM 0 HB2 ASP A 96 14.276 17.823 -7.398 1.00 0.00 H new ATOM 0 HB3 ASP A 96 13.334 17.220 -6.048 1.00 0.00 H new ATOM 1193 N ARG A 97 15.963 16.421 -8.834 1.00 0.00 N ATOM 1194 CA ARG A 97 17.117 16.334 -9.739 1.00 0.00 C ATOM 1195 C ARG A 97 18.389 16.894 -9.118 1.00 0.00 C ATOM 1196 O ARG A 97 19.454 16.877 -9.742 1.00 0.00 O ATOM 1197 CB ARG A 97 16.821 17.075 -11.037 1.00 0.00 C ATOM 1198 CG ARG A 97 15.488 16.714 -11.645 1.00 0.00 C ATOM 1199 CD ARG A 97 15.310 17.315 -13.033 1.00 0.00 C ATOM 1200 NE ARG A 97 16.490 17.135 -13.883 1.00 0.00 N ATOM 1201 CZ ARG A 97 16.526 17.414 -15.189 1.00 0.00 C ATOM 1202 NH1 ARG A 97 15.421 17.805 -15.826 1.00 0.00 N ATOM 1203 NH2 ARG A 97 17.664 17.291 -15.858 1.00 0.00 N ATOM 0 H ARG A 97 15.364 17.230 -9.002 1.00 0.00 H new ATOM 0 HA ARG A 97 17.284 15.275 -9.938 1.00 0.00 H new ATOM 0 HB2 ARG A 97 16.846 18.148 -10.848 1.00 0.00 H new ATOM 0 HB3 ARG A 97 17.610 16.860 -11.757 1.00 0.00 H new ATOM 0 HG2 ARG A 97 15.400 15.629 -11.706 1.00 0.00 H new ATOM 0 HG3 ARG A 97 14.687 17.063 -10.994 1.00 0.00 H new ATOM 0 HD2 ARG A 97 14.447 16.856 -13.515 1.00 0.00 H new ATOM 0 HD3 ARG A 97 15.094 18.379 -12.939 1.00 0.00 H new ATOM 0 HE ARG A 97 17.339 16.773 -13.449 1.00 0.00 H new ATOM 0 HH11 ARG A 97 14.542 17.892 -15.316 1.00 0.00 H new ATOM 0 HH12 ARG A 97 15.455 18.017 -16.823 1.00 0.00 H new ATOM 0 HH21 ARG A 97 18.509 16.984 -15.375 1.00 0.00 H new ATOM 0 HH22 ARG A 97 17.695 17.503 -16.855 1.00 0.00 H new ATOM 1217 N SER A 98 18.277 17.404 -7.928 1.00 0.00 N ATOM 1218 CA SER A 98 19.414 17.952 -7.228 1.00 0.00 C ATOM 1219 C SER A 98 19.499 17.362 -5.825 1.00 0.00 C ATOM 1220 O SER A 98 20.014 17.995 -4.893 1.00 0.00 O ATOM 1221 CB SER A 98 19.290 19.471 -7.170 1.00 0.00 C ATOM 1222 OG SER A 98 19.226 20.019 -8.477 1.00 0.00 O ATOM 0 H SER A 98 17.399 17.455 -7.411 1.00 0.00 H new ATOM 0 HA SER A 98 20.329 17.694 -7.761 1.00 0.00 H new ATOM 0 HB2 SER A 98 18.396 19.747 -6.610 1.00 0.00 H new ATOM 0 HB3 SER A 98 20.143 19.890 -6.636 1.00 0.00 H new ATOM 0 HG SER A 98 19.874 20.750 -8.557 1.00 0.00 H new ATOM 1228 N CYS A 99 19.020 16.132 -5.693 1.00 0.00 N ATOM 1229 CA CYS A 99 19.003 15.445 -4.417 1.00 0.00 C ATOM 1230 C CYS A 99 20.378 14.828 -4.122 1.00 0.00 C ATOM 1231 O CYS A 99 21.354 15.089 -4.828 1.00 0.00 O ATOM 1232 CB CYS A 99 17.906 14.366 -4.416 1.00 0.00 C ATOM 1233 SG CYS A 99 17.571 13.628 -2.792 1.00 0.00 S ATOM 0 H CYS A 99 18.635 15.588 -6.466 1.00 0.00 H new ATOM 0 HA CYS A 99 18.781 16.165 -3.630 1.00 0.00 H new ATOM 0 HB2 CYS A 99 16.984 14.804 -4.798 1.00 0.00 H new ATOM 0 HB3 CYS A 99 18.193 13.574 -5.108 1.00 0.00 H new ATOM 1238 N SER A 100 20.453 14.029 -3.077 1.00 0.00 N ATOM 1239 CA SER A 100 21.692 13.389 -2.701 1.00 0.00 C ATOM 1240 C SER A 100 22.038 12.262 -3.678 1.00 0.00 C ATOM 1241 O SER A 100 23.200 12.068 -4.019 1.00 0.00 O ATOM 1242 CB SER A 100 21.605 12.863 -1.260 1.00 0.00 C ATOM 1243 OG SER A 100 22.808 12.225 -0.860 1.00 0.00 O ATOM 0 H SER A 100 19.663 13.808 -2.471 1.00 0.00 H new ATOM 0 HA SER A 100 22.492 14.128 -2.747 1.00 0.00 H new ATOM 0 HB2 SER A 100 21.389 13.690 -0.583 1.00 0.00 H new ATOM 0 HB3 SER A 100 20.776 12.160 -1.179 1.00 0.00 H new ATOM 0 HG SER A 100 22.717 11.904 0.062 1.00 0.00 H new ATOM 1249 N CYS A 101 21.024 11.539 -4.141 1.00 0.00 N ATOM 1250 CA CYS A 101 21.243 10.441 -5.076 1.00 0.00 C ATOM 1251 C CYS A 101 21.599 10.980 -6.462 1.00 0.00 C ATOM 1252 O CYS A 101 22.546 10.515 -7.109 1.00 0.00 O ATOM 1253 CB CYS A 101 19.996 9.547 -5.151 1.00 0.00 C ATOM 1254 SG CYS A 101 18.475 10.422 -5.600 1.00 0.00 S ATOM 0 H CYS A 101 20.048 11.692 -3.886 1.00 0.00 H new ATOM 0 HA CYS A 101 22.079 9.841 -4.716 1.00 0.00 H new ATOM 0 HB2 CYS A 101 20.174 8.756 -5.879 1.00 0.00 H new ATOM 0 HB3 CYS A 101 19.851 9.064 -4.185 1.00 0.00 H new ATOM 1259 N LYS A 102 20.853 11.971 -6.896 1.00 0.00 N ATOM 1260 CA LYS A 102 21.044 12.580 -8.185 1.00 0.00 C ATOM 1261 C LYS A 102 21.480 14.034 -8.023 1.00 0.00 C ATOM 1262 O LYS A 102 20.618 14.862 -7.664 1.00 0.00 O ATOM 1263 CB LYS A 102 19.738 12.480 -8.974 1.00 0.00 C ATOM 1264 CG LYS A 102 19.622 13.431 -10.145 1.00 0.00 C ATOM 1265 CD LYS A 102 20.574 13.097 -11.281 1.00 0.00 C ATOM 1266 CE LYS A 102 20.192 11.776 -11.941 1.00 0.00 C ATOM 1267 NZ LYS A 102 18.740 11.730 -12.282 1.00 0.00 N ATOM 0 H LYS A 102 20.090 12.378 -6.355 1.00 0.00 H new ATOM 0 HA LYS A 102 21.831 12.060 -8.731 1.00 0.00 H new ATOM 0 HB2 LYS A 102 19.631 11.460 -9.342 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.906 12.662 -8.294 1.00 0.00 H new ATOM 0 HG2 LYS A 102 18.599 13.413 -10.520 1.00 0.00 H new ATOM 0 HG3 LYS A 102 19.818 14.447 -9.801 1.00 0.00 H new ATOM 0 HD2 LYS A 102 20.557 13.896 -12.022 1.00 0.00 H new ATOM 0 HD3 LYS A 102 21.594 13.036 -10.900 1.00 0.00 H new ATOM 0 HE2 LYS A 102 20.783 11.637 -12.846 1.00 0.00 H new ATOM 0 HE3 LYS A 102 20.435 10.951 -11.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 18.603 11.158 -13.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 18.212 11.304 -11.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 18.392 12.696 -12.450 1.00 0.00 H new TER 1281 LYS A 102 HETATM 1282 CD CD A 201 17.527 8.683 -7.442 1.00 0.00 CD HETATM 1283 CD CD A 202 15.248 7.923 -4.554 1.00 0.00 CD HETATM 1284 CD CD A 203 17.109 10.968 -3.383 1.00 0.00 CD HETATM 1285 CD CD A 204 7.575 16.204 -15.186 1.00 0.00 CD HETATM 1286 CD CD A 205 8.895 19.563 -13.149 1.00 0.00 CD HETATM 1287 CD CD A 206 10.291 18.914 -17.004 1.00 0.00 CD HETATM 1288 CD CD A 207 8.042 22.207 2.825 1.00 0.00 CD HETATM 1289 CD CD A 208 9.335 25.580 1.100 1.00 0.00 CD HETATM 1290 CD CD A 209 5.172 24.521 0.927 1.00 0.00 CD