USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 990 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 12 SER OG : rot 120:sc= 1.09 USER MOD Set 1.2: A 40 SER OG : rot 169:sc= 1.02 USER MOD Set 2.1: A 16 GLN : amide:sc= -0.466 K(o=-0.51,f=-5.7) USER MOD Set 2.2: A 50 MET CE :methyl -135:sc= -0.0478 (180deg=-2.51!) USER MOD Set 3.1: A 5 MET CE :methyl -162:sc= -1.63 (180deg=-2.32) USER MOD Set 3.2: A 35 SER OG : rot -143:sc= 1.49 USER MOD Set 3.3: A 73 TYR OH : rot 166:sc= 0.645 USER MOD Single : A 1 MET CE :methyl 166:sc= 0 (180deg=-0.0795) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 178:sc= 1.24 (180deg=1.19) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 0.785 K(o=0.78,f=-1.4) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -163:sc= -0.815 (180deg=-1.44) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 2.27 (180deg=2.27) USER MOD Single : A 24 THR OG1 : rot -130:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 163:sc= 1.53 (180deg=1.2) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0.384 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HE2:sc= 0.9 K(o=0.9,f=-5.4!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0.077 USER MOD Single : A 60 GLN : amide:sc= -0.251 K(o=-0.25,f=-0.9) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.126 USER MOD Single : A 62 SER OG : rot 76:sc= 1.11 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.669 K(o=0.67,f=-7.8!) USER MOD Single : A 78 SER OG : rot 170:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.0599 K(o=-0.06,f=-1.2) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.057 USER MOD Single : A 93 GLN : amide:sc= 0.39 K(o=0.39,f=-0.76) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.588 K(o=0.59,f=-0.45) USER MOD Single : A 108 SER OG : rot 180:sc=0.000319 USER MOD Single : A 114 THR OG1 : rot 85:sc= 0.752 USER MOD Single : A 118 GLN : amide:sc= 1.13 K(o=1.1,f=-1) USER MOD Single : A 120 LYS NZ :NH3+ -170:sc= 1.27 (180deg=1.2) USER MOD Single : A 125 ASN : amide:sc= -0.305 K(o=-0.31,f=-2.8!) USER MOD Single : A 129 LYS NZ :NH3+ -175:sc= 1.21 (180deg=1.14) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.308 0.545 0.385 1.00 0.00 N ATOM 2 CA MET A 1 2.149 0.545 -0.853 1.00 0.00 C ATOM 3 C MET A 1 2.282 -0.885 -1.411 1.00 0.00 C ATOM 4 O MET A 1 2.459 -1.830 -0.642 1.00 0.00 O ATOM 5 CB MET A 1 3.557 1.160 -0.595 1.00 0.00 C ATOM 6 CG MET A 1 3.890 2.344 -1.510 1.00 0.00 C ATOM 7 SD MET A 1 5.254 3.380 -0.908 1.00 0.00 S ATOM 8 CE MET A 1 5.589 4.320 -2.418 1.00 0.00 C ATOM 0 H1 MET A 1 1.227 1.516 0.750 1.00 0.00 H new ATOM 0 H2 MET A 1 0.361 0.179 0.161 1.00 0.00 H new ATOM 0 H3 MET A 1 1.751 -0.060 1.106 1.00 0.00 H new ATOM 0 HA MET A 1 1.647 1.170 -1.592 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.616 1.487 0.443 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.312 0.385 -0.729 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.144 1.965 -2.500 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.000 2.963 -1.625 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.222 5.175 -2.181 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.098 3.681 -3.139 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.649 4.671 -2.844 1.00 0.00 H new ATOM 18 N LYS A 2 2.245 -1.064 -2.740 1.00 0.00 N ATOM 19 CA LYS A 2 2.505 -2.378 -3.365 1.00 0.00 C ATOM 20 C LYS A 2 4.010 -2.536 -3.441 1.00 0.00 C ATOM 21 O LYS A 2 4.669 -1.689 -4.037 1.00 0.00 O ATOM 22 CB LYS A 2 1.818 -2.524 -4.745 1.00 0.00 C ATOM 23 CG LYS A 2 0.379 -1.973 -4.777 1.00 0.00 C ATOM 24 CD LYS A 2 -0.233 -2.039 -6.187 1.00 0.00 C ATOM 25 CE LYS A 2 -1.350 -0.997 -6.380 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.640 -1.380 -5.735 1.00 0.00 N ATOM 0 H LYS A 2 2.038 -0.319 -3.405 1.00 0.00 H new ATOM 0 HA LYS A 2 2.072 -3.178 -2.764 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.414 -2.005 -5.495 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.801 -3.578 -5.024 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.242 -2.542 -4.085 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.379 -0.940 -4.430 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.548 -1.875 -6.929 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.634 -3.037 -6.362 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.019 -0.042 -5.973 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.517 -0.848 -7.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.347 -0.636 -5.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.978 -2.276 -6.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.496 -1.495 -4.711 1.00 0.00 H new ATOM 40 N LYS A 3 4.569 -3.572 -2.825 1.00 0.00 N ATOM 41 CA LYS A 3 6.014 -3.785 -2.841 1.00 0.00 C ATOM 42 C LYS A 3 6.342 -4.580 -4.093 1.00 0.00 C ATOM 43 O LYS A 3 5.706 -5.607 -4.334 1.00 0.00 O ATOM 44 CB LYS A 3 6.438 -4.434 -1.526 1.00 0.00 C ATOM 45 CG LYS A 3 7.958 -4.376 -1.308 1.00 0.00 C ATOM 46 CD LYS A 3 8.359 -4.956 0.057 1.00 0.00 C ATOM 47 CE LYS A 3 7.640 -4.223 1.207 1.00 0.00 C ATOM 48 NZ LYS A 3 8.129 -4.665 2.540 1.00 0.00 N ATOM 0 H LYS A 3 4.045 -4.278 -2.308 1.00 0.00 H new ATOM 0 HA LYS A 3 6.586 -2.859 -2.897 1.00 0.00 H new ATOM 0 HB2 LYS A 3 5.936 -3.933 -0.698 1.00 0.00 H new ATOM 0 HB3 LYS A 3 6.111 -5.474 -1.515 1.00 0.00 H new ATOM 0 HG2 LYS A 3 8.461 -4.930 -2.101 1.00 0.00 H new ATOM 0 HG3 LYS A 3 8.296 -3.342 -1.378 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.115 -6.018 0.090 1.00 0.00 H new ATOM 0 HD3 LYS A 3 9.438 -4.873 0.188 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.791 -3.149 1.103 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.567 -4.402 1.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.644 -4.124 3.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.931 -5.678 2.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 9.154 -4.502 2.605 1.00 0.00 H new ATOM 62 N VAL A 4 7.299 -4.092 -4.872 1.00 0.00 N ATOM 63 CA VAL A 4 7.618 -4.552 -6.216 1.00 0.00 C ATOM 64 C VAL A 4 9.041 -5.115 -6.242 1.00 0.00 C ATOM 65 O VAL A 4 9.916 -4.632 -5.525 1.00 0.00 O ATOM 66 CB VAL A 4 7.490 -3.382 -7.217 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.175 -3.854 -8.640 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.441 -2.319 -6.863 1.00 0.00 C ATOM 0 H VAL A 4 7.902 -3.328 -4.568 1.00 0.00 H new ATOM 0 HA VAL A 4 6.919 -5.337 -6.504 1.00 0.00 H new ATOM 0 HB VAL A 4 8.478 -2.925 -7.155 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.096 -2.991 -9.301 1.00 0.00 H new ATOM 0 HG12 VAL A 4 7.973 -4.508 -8.991 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.231 -4.400 -8.642 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.434 -1.545 -7.630 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.457 -2.784 -6.807 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.686 -1.872 -5.899 1.00 0.00 H new ATOM 78 N MET A 5 9.295 -6.072 -7.128 1.00 0.00 N ATOM 79 CA MET A 5 10.620 -6.589 -7.461 1.00 0.00 C ATOM 80 C MET A 5 10.682 -6.852 -8.966 1.00 0.00 C ATOM 81 O MET A 5 9.673 -7.228 -9.561 1.00 0.00 O ATOM 82 CB MET A 5 10.894 -7.857 -6.630 1.00 0.00 C ATOM 83 CG MET A 5 12.219 -8.554 -6.964 1.00 0.00 C ATOM 84 SD MET A 5 12.633 -10.017 -5.977 1.00 0.00 S ATOM 85 CE MET A 5 12.738 -9.309 -4.310 1.00 0.00 C ATOM 0 H MET A 5 8.552 -6.529 -7.657 1.00 0.00 H new ATOM 0 HA MET A 5 11.397 -5.865 -7.216 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.892 -7.592 -5.573 1.00 0.00 H new ATOM 0 HB3 MET A 5 10.077 -8.562 -6.783 1.00 0.00 H new ATOM 0 HG2 MET A 5 12.196 -8.846 -8.014 1.00 0.00 H new ATOM 0 HG3 MET A 5 13.024 -7.828 -6.853 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.284 -9.991 -3.659 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.259 -8.353 -4.353 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.733 -9.157 -3.915 1.00 0.00 H new ATOM 95 N PHE A 6 11.866 -6.689 -9.554 1.00 0.00 N ATOM 96 CA PHE A 6 12.210 -6.971 -10.942 1.00 0.00 C ATOM 97 C PHE A 6 13.557 -7.673 -10.854 1.00 0.00 C ATOM 98 O PHE A 6 14.443 -7.157 -10.173 1.00 0.00 O ATOM 99 CB PHE A 6 12.344 -5.680 -11.760 1.00 0.00 C ATOM 100 CG PHE A 6 11.050 -4.941 -12.012 1.00 0.00 C ATOM 101 CD1 PHE A 6 10.581 -4.010 -11.067 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.325 -5.163 -13.199 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.389 -3.312 -11.309 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.144 -4.443 -13.448 1.00 0.00 C ATOM 105 CZ PHE A 6 8.678 -3.516 -12.502 1.00 0.00 C ATOM 0 H PHE A 6 12.666 -6.330 -9.033 1.00 0.00 H new ATOM 0 HA PHE A 6 11.444 -7.567 -11.438 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.031 -5.011 -11.243 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.798 -5.923 -12.721 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.137 -3.834 -10.158 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.677 -5.887 -13.919 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.016 -2.614 -10.574 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.596 -4.602 -14.365 1.00 0.00 H new ATOM 0 HZ PHE A 6 7.772 -2.960 -12.692 1.00 0.00 H new ATOM 115 N VAL A 7 13.725 -8.834 -11.482 1.00 0.00 N ATOM 116 CA VAL A 7 14.904 -9.654 -11.234 1.00 0.00 C ATOM 117 C VAL A 7 15.170 -10.600 -12.415 1.00 0.00 C ATOM 118 O VAL A 7 14.282 -10.913 -13.203 1.00 0.00 O ATOM 119 CB VAL A 7 14.715 -10.349 -9.849 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.328 -10.993 -9.660 1.00 0.00 C ATOM 121 CG2 VAL A 7 15.801 -11.371 -9.488 1.00 0.00 C ATOM 0 H VAL A 7 13.068 -9.223 -12.158 1.00 0.00 H new ATOM 0 HA VAL A 7 15.813 -9.056 -11.172 1.00 0.00 H new ATOM 0 HB VAL A 7 14.808 -9.513 -9.156 1.00 0.00 H new ATOM 0 HG11 VAL A 7 13.273 -11.456 -8.675 1.00 0.00 H new ATOM 0 HG12 VAL A 7 12.557 -10.227 -9.745 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.172 -11.752 -10.426 1.00 0.00 H new ATOM 0 HG21 VAL A 7 15.585 -11.801 -8.510 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.819 -12.163 -10.237 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.772 -10.876 -9.461 1.00 0.00 H new ATOM 131 N CYS A 8 16.422 -11.027 -12.547 1.00 0.00 N ATOM 132 CA CYS A 8 16.899 -12.088 -13.428 1.00 0.00 C ATOM 133 C CYS A 8 17.967 -12.873 -12.637 1.00 0.00 C ATOM 134 O CYS A 8 18.281 -12.508 -11.502 1.00 0.00 O ATOM 135 CB CYS A 8 17.427 -11.473 -14.743 1.00 0.00 C ATOM 136 SG CYS A 8 18.001 -12.658 -16.005 1.00 0.00 S ATOM 0 H CYS A 8 17.181 -10.613 -12.005 1.00 0.00 H new ATOM 0 HA CYS A 8 16.109 -12.778 -13.724 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.636 -10.863 -15.179 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.251 -10.802 -14.502 1.00 0.00 H new ATOM 141 N LYS A 9 18.529 -13.943 -13.220 1.00 0.00 N ATOM 142 CA LYS A 9 19.513 -14.828 -12.576 1.00 0.00 C ATOM 143 C LYS A 9 20.661 -14.032 -11.935 1.00 0.00 C ATOM 144 O LYS A 9 21.075 -14.360 -10.828 1.00 0.00 O ATOM 145 CB LYS A 9 20.041 -15.823 -13.630 1.00 0.00 C ATOM 146 CG LYS A 9 20.916 -16.935 -13.022 1.00 0.00 C ATOM 147 CD LYS A 9 21.566 -17.848 -14.077 1.00 0.00 C ATOM 148 CE LYS A 9 20.545 -18.656 -14.901 1.00 0.00 C ATOM 149 NZ LYS A 9 21.211 -19.566 -15.876 1.00 0.00 N ATOM 0 H LYS A 9 18.307 -14.224 -14.175 1.00 0.00 H new ATOM 0 HA LYS A 9 19.029 -15.374 -11.766 1.00 0.00 H new ATOM 0 HB2 LYS A 9 19.196 -16.276 -14.149 1.00 0.00 H new ATOM 0 HB3 LYS A 9 20.620 -15.280 -14.377 1.00 0.00 H new ATOM 0 HG2 LYS A 9 21.698 -16.480 -12.415 1.00 0.00 H new ATOM 0 HG3 LYS A 9 20.306 -17.542 -12.353 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.167 -17.239 -14.753 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.247 -18.538 -13.579 1.00 0.00 H new ATOM 0 HE2 LYS A 9 19.918 -19.241 -14.228 1.00 0.00 H new ATOM 0 HE3 LYS A 9 19.887 -17.971 -15.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 20.489 -20.091 -16.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 21.789 -19.006 -16.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 21.820 -20.237 -15.365 1.00 0.00 H new ATOM 163 N ARG A 10 21.147 -12.986 -12.615 1.00 0.00 N ATOM 164 CA ARG A 10 22.084 -11.990 -12.088 1.00 0.00 C ATOM 165 C ARG A 10 21.571 -10.603 -12.488 1.00 0.00 C ATOM 166 O ARG A 10 20.660 -10.496 -13.308 1.00 0.00 O ATOM 167 CB ARG A 10 23.507 -12.258 -12.627 1.00 0.00 C ATOM 168 CG ARG A 10 24.137 -13.532 -12.038 1.00 0.00 C ATOM 169 CD ARG A 10 25.577 -13.716 -12.530 1.00 0.00 C ATOM 170 NE ARG A 10 26.226 -14.866 -11.877 1.00 0.00 N ATOM 171 CZ ARG A 10 27.500 -15.249 -12.022 1.00 0.00 C ATOM 172 NH1 ARG A 10 28.301 -14.648 -12.902 1.00 0.00 N ATOM 173 NH2 ARG A 10 27.971 -16.236 -11.271 1.00 0.00 N ATOM 0 H ARG A 10 20.887 -12.805 -13.585 1.00 0.00 H new ATOM 0 HA ARG A 10 22.144 -12.049 -11.001 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.469 -12.346 -13.713 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.144 -11.404 -12.398 1.00 0.00 H new ATOM 0 HG2 ARG A 10 24.126 -13.477 -10.949 1.00 0.00 H new ATOM 0 HG3 ARG A 10 23.540 -14.400 -12.319 1.00 0.00 H new ATOM 0 HD2 ARG A 10 25.578 -13.861 -13.610 1.00 0.00 H new ATOM 0 HD3 ARG A 10 26.150 -12.811 -12.329 1.00 0.00 H new ATOM 0 HE ARG A 10 25.646 -15.426 -11.252 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.945 -13.884 -13.477 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.270 -14.952 -13.000 1.00 0.00 H new ATOM 0 HH21 ARG A 10 27.364 -16.694 -10.592 1.00 0.00 H new ATOM 0 HH22 ARG A 10 28.940 -16.536 -11.373 1.00 0.00 H new ATOM 187 N ASN A 11 22.157 -9.542 -11.922 1.00 0.00 N ATOM 188 CA ASN A 11 21.848 -8.165 -12.332 1.00 0.00 C ATOM 189 C ASN A 11 22.426 -7.899 -13.727 1.00 0.00 C ATOM 190 O ASN A 11 21.775 -7.278 -14.570 1.00 0.00 O ATOM 191 CB ASN A 11 22.407 -7.170 -11.291 1.00 0.00 C ATOM 192 CG ASN A 11 22.014 -5.711 -11.516 1.00 0.00 C ATOM 193 OD1 ASN A 11 21.253 -5.351 -12.406 1.00 0.00 O ATOM 194 ND2 ASN A 11 22.537 -4.830 -10.679 1.00 0.00 N ATOM 0 H ASN A 11 22.850 -9.610 -11.177 1.00 0.00 H new ATOM 0 HA ASN A 11 20.768 -8.029 -12.381 1.00 0.00 H new ATOM 0 HB2 ASN A 11 22.067 -7.474 -10.301 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.495 -7.242 -11.290 1.00 0.00 H new ATOM 0 HD21 ASN A 11 22.308 -3.840 -10.771 1.00 0.00 H new ATOM 0 HD22 ASN A 11 23.170 -5.140 -9.941 1.00 0.00 H new ATOM 201 N SER A 12 23.636 -8.412 -13.975 1.00 0.00 N ATOM 202 CA SER A 12 24.373 -8.244 -15.223 1.00 0.00 C ATOM 203 C SER A 12 23.509 -8.629 -16.430 1.00 0.00 C ATOM 204 O SER A 12 22.796 -9.639 -16.406 1.00 0.00 O ATOM 205 CB SER A 12 25.640 -9.111 -15.201 1.00 0.00 C ATOM 206 OG SER A 12 26.300 -9.032 -13.941 1.00 0.00 O ATOM 0 H SER A 12 24.141 -8.972 -13.289 1.00 0.00 H new ATOM 0 HA SER A 12 24.648 -7.193 -15.316 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.377 -10.148 -15.412 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.319 -8.787 -15.990 1.00 0.00 H new ATOM 0 HG SER A 12 26.346 -9.925 -13.539 1.00 0.00 H new ATOM 212 N SER A 13 23.614 -7.836 -17.493 1.00 0.00 N ATOM 213 CA SER A 13 23.025 -8.097 -18.798 1.00 0.00 C ATOM 214 C SER A 13 21.487 -8.205 -18.811 1.00 0.00 C ATOM 215 O SER A 13 20.942 -8.725 -19.790 1.00 0.00 O ATOM 216 CB SER A 13 23.727 -9.291 -19.473 1.00 0.00 C ATOM 217 OG SER A 13 25.148 -9.206 -19.347 1.00 0.00 O ATOM 0 H SER A 13 24.134 -6.959 -17.465 1.00 0.00 H new ATOM 0 HA SER A 13 23.208 -7.207 -19.400 1.00 0.00 H new ATOM 0 HB2 SER A 13 23.376 -10.221 -19.025 1.00 0.00 H new ATOM 0 HB3 SER A 13 23.456 -9.324 -20.528 1.00 0.00 H new ATOM 0 HG SER A 13 25.562 -9.979 -19.784 1.00 0.00 H new ATOM 223 N ARG A 14 20.749 -7.737 -17.786 1.00 0.00 N ATOM 224 CA ARG A 14 19.286 -7.644 -17.909 1.00 0.00 C ATOM 225 C ARG A 14 18.628 -6.621 -16.988 1.00 0.00 C ATOM 226 O ARG A 14 17.919 -5.743 -17.469 1.00 0.00 O ATOM 227 CB ARG A 14 18.637 -9.032 -17.684 1.00 0.00 C ATOM 228 CG ARG A 14 17.217 -9.101 -18.251 1.00 0.00 C ATOM 229 CD ARG A 14 17.196 -9.244 -19.779 1.00 0.00 C ATOM 230 NE ARG A 14 17.232 -10.658 -20.197 1.00 0.00 N ATOM 231 CZ ARG A 14 18.208 -11.295 -20.864 1.00 0.00 C ATOM 232 NH1 ARG A 14 19.404 -10.743 -21.046 1.00 0.00 N ATOM 233 NH2 ARG A 14 17.982 -12.514 -21.346 1.00 0.00 N ATOM 0 H ARG A 14 21.129 -7.427 -16.891 1.00 0.00 H new ATOM 0 HA ARG A 14 19.110 -7.291 -18.925 1.00 0.00 H new ATOM 0 HB2 ARG A 14 19.252 -9.800 -18.153 1.00 0.00 H new ATOM 0 HB3 ARG A 14 18.612 -9.252 -16.617 1.00 0.00 H new ATOM 0 HG2 ARG A 14 16.692 -9.945 -17.804 1.00 0.00 H new ATOM 0 HG3 ARG A 14 16.672 -8.201 -17.967 1.00 0.00 H new ATOM 0 HD2 ARG A 14 16.298 -8.770 -20.176 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.050 -8.717 -20.205 1.00 0.00 H new ATOM 0 HE ARG A 14 16.417 -11.220 -19.950 1.00 0.00 H new ATOM 0 HH11 ARG A 14 19.598 -9.813 -20.675 1.00 0.00 H new ATOM 0 HH12 ARG A 14 20.127 -11.250 -21.557 1.00 0.00 H new ATOM 0 HH21 ARG A 14 17.074 -12.957 -21.208 1.00 0.00 H new ATOM 0 HH22 ARG A 14 18.717 -13.006 -21.854 1.00 0.00 H new ATOM 247 N SER A 15 18.844 -6.702 -15.678 1.00 0.00 N ATOM 248 CA SER A 15 18.078 -5.941 -14.684 1.00 0.00 C ATOM 249 C SER A 15 18.470 -4.464 -14.531 1.00 0.00 C ATOM 250 O SER A 15 18.090 -3.845 -13.541 1.00 0.00 O ATOM 251 CB SER A 15 18.111 -6.708 -13.355 1.00 0.00 C ATOM 252 OG SER A 15 17.918 -8.097 -13.606 1.00 0.00 O ATOM 0 H SER A 15 19.561 -7.301 -15.269 1.00 0.00 H new ATOM 0 HA SER A 15 17.055 -5.869 -15.053 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.065 -6.547 -12.853 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.333 -6.336 -12.688 1.00 0.00 H new ATOM 0 HG SER A 15 17.940 -8.589 -12.759 1.00 0.00 H new ATOM 258 N GLN A 16 19.218 -3.863 -15.468 1.00 0.00 N ATOM 259 CA GLN A 16 19.787 -2.532 -15.252 1.00 0.00 C ATOM 260 C GLN A 16 18.732 -1.434 -15.148 1.00 0.00 C ATOM 261 O GLN A 16 18.850 -0.602 -14.263 1.00 0.00 O ATOM 262 CB GLN A 16 20.883 -2.230 -16.306 1.00 0.00 C ATOM 263 CG GLN A 16 20.364 -2.033 -17.751 1.00 0.00 C ATOM 264 CD GLN A 16 21.460 -1.707 -18.774 1.00 0.00 C ATOM 265 OE1 GLN A 16 21.528 -0.593 -19.269 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.330 -2.634 -19.124 1.00 0.00 N ATOM 0 H GLN A 16 19.440 -4.276 -16.374 1.00 0.00 H new ATOM 0 HA GLN A 16 20.268 -2.538 -14.274 1.00 0.00 H new ATOM 0 HB2 GLN A 16 21.420 -1.331 -16.003 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.604 -3.048 -16.303 1.00 0.00 H new ATOM 0 HG2 GLN A 16 19.847 -2.939 -18.066 1.00 0.00 H new ATOM 0 HG3 GLN A 16 19.629 -1.229 -17.754 1.00 0.00 H new ATOM 0 HE21 GLN A 16 22.276 -3.566 -18.712 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.057 -2.419 -19.806 1.00 0.00 H new ATOM 275 N MET A 17 17.706 -1.428 -16.004 1.00 0.00 N ATOM 276 CA MET A 17 16.785 -0.291 -16.140 1.00 0.00 C ATOM 277 C MET A 17 15.383 -0.540 -15.580 1.00 0.00 C ATOM 278 O MET A 17 14.670 0.424 -15.321 1.00 0.00 O ATOM 279 CB MET A 17 16.798 0.075 -17.630 1.00 0.00 C ATOM 280 CG MET A 17 15.935 1.253 -18.100 1.00 0.00 C ATOM 281 SD MET A 17 16.461 2.965 -17.803 1.00 0.00 S ATOM 282 CE MET A 17 16.318 3.227 -16.019 1.00 0.00 C ATOM 0 H MET A 17 17.489 -2.209 -16.623 1.00 0.00 H new ATOM 0 HA MET A 17 17.122 0.545 -15.526 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.830 0.287 -17.911 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.490 -0.807 -18.191 1.00 0.00 H new ATOM 0 HG2 MET A 17 15.799 1.142 -19.176 1.00 0.00 H new ATOM 0 HG3 MET A 17 14.954 1.135 -17.641 1.00 0.00 H new ATOM 0 HE1 MET A 17 16.324 4.296 -15.807 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.385 2.791 -15.661 1.00 0.00 H new ATOM 0 HE3 MET A 17 17.158 2.752 -15.513 1.00 0.00 H new ATOM 292 N ALA A 18 14.968 -1.797 -15.400 1.00 0.00 N ATOM 293 CA ALA A 18 13.574 -2.140 -15.062 1.00 0.00 C ATOM 294 C ALA A 18 13.186 -1.639 -13.669 1.00 0.00 C ATOM 295 O ALA A 18 12.211 -0.905 -13.531 1.00 0.00 O ATOM 296 CB ALA A 18 13.366 -3.651 -15.243 1.00 0.00 C ATOM 0 H ALA A 18 15.583 -2.607 -15.483 1.00 0.00 H new ATOM 0 HA ALA A 18 12.899 -1.626 -15.746 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.337 -3.909 -14.994 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.568 -3.925 -16.278 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.045 -4.193 -14.585 1.00 0.00 H new ATOM 302 N GLU A 19 14.003 -1.934 -12.653 1.00 0.00 N ATOM 303 CA GLU A 19 13.794 -1.371 -11.315 1.00 0.00 C ATOM 304 C GLU A 19 13.945 0.150 -11.372 1.00 0.00 C ATOM 305 O GLU A 19 13.225 0.858 -10.669 1.00 0.00 O ATOM 306 CB GLU A 19 14.740 -2.037 -10.307 1.00 0.00 C ATOM 307 CG GLU A 19 16.183 -1.512 -10.262 1.00 0.00 C ATOM 308 CD GLU A 19 16.363 -0.267 -9.381 1.00 0.00 C ATOM 309 OE1 GLU A 19 16.045 -0.296 -8.171 1.00 0.00 O ATOM 310 OE2 GLU A 19 16.868 0.752 -9.896 1.00 0.00 O ATOM 0 H GLU A 19 14.809 -2.554 -12.730 1.00 0.00 H new ATOM 0 HA GLU A 19 12.781 -1.579 -10.969 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.308 -1.929 -9.312 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.773 -3.104 -10.526 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.836 -2.303 -9.894 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.506 -1.278 -11.276 1.00 0.00 H new ATOM 317 N GLY A 20 14.824 0.632 -12.268 1.00 0.00 N ATOM 318 CA GLY A 20 15.023 2.044 -12.551 1.00 0.00 C ATOM 319 C GLY A 20 13.702 2.741 -12.851 1.00 0.00 C ATOM 320 O GLY A 20 13.252 3.572 -12.068 1.00 0.00 O ATOM 0 H GLY A 20 15.426 0.025 -12.824 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.504 2.523 -11.698 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.696 2.155 -13.401 1.00 0.00 H new ATOM 324 N PHE A 21 13.031 2.392 -13.951 1.00 0.00 N ATOM 325 CA PHE A 21 11.795 3.088 -14.305 1.00 0.00 C ATOM 326 C PHE A 21 10.694 2.850 -13.306 1.00 0.00 C ATOM 327 O PHE A 21 9.851 3.727 -13.133 1.00 0.00 O ATOM 328 CB PHE A 21 11.291 2.704 -15.692 1.00 0.00 C ATOM 329 CG PHE A 21 11.924 3.540 -16.766 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.770 4.940 -16.760 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.706 2.909 -17.736 1.00 0.00 C ATOM 332 CE1 PHE A 21 12.402 5.704 -17.759 1.00 0.00 C ATOM 333 CE2 PHE A 21 13.344 3.674 -18.721 1.00 0.00 C ATOM 334 CZ PHE A 21 13.182 5.069 -18.744 1.00 0.00 C ATOM 0 H PHE A 21 13.313 1.653 -14.595 1.00 0.00 H new ATOM 0 HA PHE A 21 12.054 4.147 -14.300 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.504 1.651 -15.878 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.208 2.822 -15.731 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.174 5.421 -15.998 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.818 1.835 -17.727 1.00 0.00 H new ATOM 0 HE1 PHE A 21 12.288 6.778 -17.770 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.961 3.190 -19.464 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.656 5.655 -19.518 1.00 0.00 H new ATOM 344 N ALA A 22 10.675 1.705 -12.635 1.00 0.00 N ATOM 345 CA ALA A 22 9.599 1.432 -11.708 1.00 0.00 C ATOM 346 C ALA A 22 9.646 2.361 -10.498 1.00 0.00 C ATOM 347 O ALA A 22 8.583 2.719 -10.007 1.00 0.00 O ATOM 348 CB ALA A 22 9.632 -0.044 -11.331 1.00 0.00 C ATOM 0 H ALA A 22 11.377 0.970 -12.716 1.00 0.00 H new ATOM 0 HA ALA A 22 8.642 1.638 -12.188 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.824 -0.259 -10.632 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.508 -0.651 -12.228 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.588 -0.279 -10.863 1.00 0.00 H new ATOM 354 N LYS A 23 10.818 2.837 -10.058 1.00 0.00 N ATOM 355 CA LYS A 23 10.852 3.830 -8.977 1.00 0.00 C ATOM 356 C LYS A 23 10.332 5.193 -9.454 1.00 0.00 C ATOM 357 O LYS A 23 9.769 5.939 -8.659 1.00 0.00 O ATOM 358 CB LYS A 23 12.243 3.868 -8.310 1.00 0.00 C ATOM 359 CG LYS A 23 13.320 4.696 -9.037 1.00 0.00 C ATOM 360 CD LYS A 23 14.633 3.942 -9.298 1.00 0.00 C ATOM 361 CE LYS A 23 15.303 3.447 -8.009 1.00 0.00 C ATOM 362 NZ LYS A 23 16.670 2.922 -8.250 1.00 0.00 N ATOM 0 H LYS A 23 11.730 2.561 -10.421 1.00 0.00 H new ATOM 0 HA LYS A 23 10.161 3.527 -8.190 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.129 4.264 -7.301 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.605 2.844 -8.212 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.916 5.038 -9.990 1.00 0.00 H new ATOM 0 HG3 LYS A 23 13.538 5.585 -8.446 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.434 3.090 -9.948 1.00 0.00 H new ATOM 0 HD3 LYS A 23 15.322 4.596 -9.832 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.352 4.265 -7.290 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.690 2.665 -7.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 17.082 2.600 -7.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.623 2.124 -8.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 17.265 3.674 -8.653 1.00 0.00 H new ATOM 376 N THR A 24 10.469 5.494 -10.746 1.00 0.00 N ATOM 377 CA THR A 24 10.036 6.725 -11.374 1.00 0.00 C ATOM 378 C THR A 24 8.521 6.719 -11.605 1.00 0.00 C ATOM 379 O THR A 24 7.801 7.577 -11.097 1.00 0.00 O ATOM 380 CB THR A 24 10.898 6.879 -12.635 1.00 0.00 C ATOM 381 OG1 THR A 24 12.202 7.238 -12.230 1.00 0.00 O ATOM 382 CG2 THR A 24 10.359 7.850 -13.673 1.00 0.00 C ATOM 0 H THR A 24 10.906 4.851 -11.406 1.00 0.00 H new ATOM 0 HA THR A 24 10.185 7.604 -10.746 1.00 0.00 H new ATOM 0 HB THR A 24 10.889 5.919 -13.150 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.501 8.018 -12.743 1.00 0.00 H new ATOM 0 HG21 THR A 24 11.039 7.887 -14.524 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.377 7.516 -14.008 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.274 8.843 -13.232 1.00 0.00 H new ATOM 390 N LEU A 25 8.030 5.719 -12.333 1.00 0.00 N ATOM 391 CA LEU A 25 6.625 5.606 -12.727 1.00 0.00 C ATOM 392 C LEU A 25 5.778 5.223 -11.515 1.00 0.00 C ATOM 393 O LEU A 25 4.656 5.699 -11.334 1.00 0.00 O ATOM 394 CB LEU A 25 6.513 4.529 -13.823 1.00 0.00 C ATOM 395 CG LEU A 25 7.257 4.859 -15.128 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.369 3.584 -15.959 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.561 5.964 -15.925 1.00 0.00 C ATOM 0 H LEU A 25 8.607 4.949 -12.673 1.00 0.00 H new ATOM 0 HA LEU A 25 6.261 6.559 -13.111 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.898 3.588 -13.429 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.459 4.371 -14.052 1.00 0.00 H new ATOM 0 HG LEU A 25 8.249 5.235 -14.879 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.895 3.801 -16.889 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.921 2.831 -15.397 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.371 3.208 -16.185 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.122 6.163 -16.838 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.551 5.646 -16.182 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.513 6.872 -15.323 1.00 0.00 H new ATOM 409 N GLY A 26 6.341 4.371 -10.655 1.00 0.00 N ATOM 410 CA GLY A 26 5.713 3.882 -9.444 1.00 0.00 C ATOM 411 C GLY A 26 5.811 4.861 -8.279 1.00 0.00 C ATOM 412 O GLY A 26 5.295 4.551 -7.206 1.00 0.00 O ATOM 0 H GLY A 26 7.279 3.995 -10.795 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.663 3.672 -9.646 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.177 2.938 -9.157 1.00 0.00 H new ATOM 416 N ALA A 27 6.422 6.035 -8.464 1.00 0.00 N ATOM 417 CA ALA A 27 6.552 7.044 -7.421 1.00 0.00 C ATOM 418 C ALA A 27 5.166 7.383 -6.866 1.00 0.00 C ATOM 419 O ALA A 27 4.207 7.524 -7.633 1.00 0.00 O ATOM 420 CB ALA A 27 7.247 8.293 -7.983 1.00 0.00 C ATOM 0 H ALA A 27 6.842 6.309 -9.352 1.00 0.00 H new ATOM 0 HA ALA A 27 7.165 6.657 -6.607 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.340 9.042 -7.197 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.238 8.025 -8.348 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.656 8.700 -8.804 1.00 0.00 H new ATOM 426 N GLY A 28 5.054 7.476 -5.539 1.00 0.00 N ATOM 427 CA GLY A 28 3.814 7.824 -4.851 1.00 0.00 C ATOM 428 C GLY A 28 2.749 6.720 -4.857 1.00 0.00 C ATOM 429 O GLY A 28 1.635 6.979 -4.396 1.00 0.00 O ATOM 0 H GLY A 28 5.835 7.309 -4.905 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.047 8.080 -3.817 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.395 8.717 -5.314 1.00 0.00 H new ATOM 433 N LYS A 29 3.046 5.509 -5.363 1.00 0.00 N ATOM 434 CA LYS A 29 2.064 4.411 -5.429 1.00 0.00 C ATOM 435 C LYS A 29 2.657 3.055 -5.033 1.00 0.00 C ATOM 436 O LYS A 29 2.022 2.332 -4.269 1.00 0.00 O ATOM 437 CB LYS A 29 1.327 4.417 -6.798 1.00 0.00 C ATOM 438 CG LYS A 29 2.240 4.384 -8.040 1.00 0.00 C ATOM 439 CD LYS A 29 1.520 4.667 -9.370 1.00 0.00 C ATOM 440 CE LYS A 29 1.215 6.157 -9.625 1.00 0.00 C ATOM 441 NZ LYS A 29 2.433 6.991 -9.859 1.00 0.00 N ATOM 0 H LYS A 29 3.964 5.265 -5.734 1.00 0.00 H new ATOM 0 HA LYS A 29 1.303 4.591 -4.670 1.00 0.00 H new ATOM 0 HB2 LYS A 29 0.659 3.556 -6.836 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.702 5.308 -6.851 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.036 5.117 -7.909 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.715 3.405 -8.100 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.133 4.289 -10.188 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.584 4.109 -9.388 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.557 6.241 -10.490 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.670 6.558 -8.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.157 7.892 -10.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 2.905 7.179 -8.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.086 6.483 -10.489 1.00 0.00 H new ATOM 455 N ILE A 30 3.855 2.687 -5.501 1.00 0.00 N ATOM 456 CA ILE A 30 4.441 1.349 -5.297 1.00 0.00 C ATOM 457 C ILE A 30 5.936 1.471 -4.970 1.00 0.00 C ATOM 458 O ILE A 30 6.581 2.445 -5.350 1.00 0.00 O ATOM 459 CB ILE A 30 4.135 0.434 -6.508 1.00 0.00 C ATOM 460 CG1 ILE A 30 4.841 0.895 -7.798 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.618 0.343 -6.747 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.569 0.029 -9.037 1.00 0.00 C ATOM 0 H ILE A 30 4.455 3.313 -6.038 1.00 0.00 H new ATOM 0 HA ILE A 30 3.979 0.867 -4.435 1.00 0.00 H new ATOM 0 HB ILE A 30 4.527 -0.552 -6.258 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.535 1.918 -8.015 1.00 0.00 H new ATOM 0 HG13 ILE A 30 5.916 0.916 -7.618 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.423 -0.304 -7.602 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.134 -0.069 -5.862 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.221 1.338 -6.947 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.110 0.436 -9.891 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.903 -0.991 -8.848 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.500 0.027 -9.252 1.00 0.00 H new ATOM 474 N ALA A 31 6.473 0.493 -4.238 1.00 0.00 N ATOM 475 CA ALA A 31 7.807 0.535 -3.650 1.00 0.00 C ATOM 476 C ALA A 31 8.663 -0.591 -4.218 1.00 0.00 C ATOM 477 O ALA A 31 8.440 -1.751 -3.886 1.00 0.00 O ATOM 478 CB ALA A 31 7.646 0.387 -2.135 1.00 0.00 C ATOM 0 H ALA A 31 5.975 -0.373 -4.034 1.00 0.00 H new ATOM 0 HA ALA A 31 8.306 1.476 -3.883 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.627 0.414 -1.660 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.035 1.205 -1.752 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.161 -0.563 -1.912 1.00 0.00 H new ATOM 484 N VAL A 32 9.614 -0.286 -5.094 1.00 0.00 N ATOM 485 CA VAL A 32 10.509 -1.295 -5.652 1.00 0.00 C ATOM 486 C VAL A 32 11.614 -1.608 -4.633 1.00 0.00 C ATOM 487 O VAL A 32 12.244 -0.689 -4.101 1.00 0.00 O ATOM 488 CB VAL A 32 11.099 -0.788 -6.982 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.728 -1.947 -7.759 1.00 0.00 C ATOM 490 CG2 VAL A 32 10.062 -0.118 -7.896 1.00 0.00 C ATOM 0 H VAL A 32 9.786 0.660 -5.436 1.00 0.00 H new ATOM 0 HA VAL A 32 9.959 -2.213 -5.858 1.00 0.00 H new ATOM 0 HB VAL A 32 11.843 -0.040 -6.707 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.141 -1.575 -8.697 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.524 -2.394 -7.164 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.967 -2.698 -7.971 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.547 0.215 -8.814 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.276 -0.833 -8.139 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.626 0.740 -7.384 1.00 0.00 H new ATOM 500 N THR A 33 11.888 -2.896 -4.435 1.00 0.00 N ATOM 501 CA THR A 33 13.020 -3.409 -3.690 1.00 0.00 C ATOM 502 C THR A 33 13.502 -4.626 -4.469 1.00 0.00 C ATOM 503 O THR A 33 13.047 -5.751 -4.243 1.00 0.00 O ATOM 504 CB THR A 33 12.618 -3.787 -2.261 1.00 0.00 C ATOM 505 OG1 THR A 33 11.906 -2.740 -1.614 1.00 0.00 O ATOM 506 CG2 THR A 33 13.879 -4.126 -1.450 1.00 0.00 C ATOM 0 H THR A 33 11.296 -3.638 -4.809 1.00 0.00 H new ATOM 0 HA THR A 33 13.806 -2.661 -3.590 1.00 0.00 H new ATOM 0 HB THR A 33 11.958 -4.652 -2.317 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.666 -3.020 -0.706 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.596 -4.395 -0.433 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.397 -4.964 -1.916 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.540 -3.259 -1.425 1.00 0.00 H new ATOM 514 N SER A 34 14.380 -4.395 -5.439 1.00 0.00 N ATOM 515 CA SER A 34 14.740 -5.433 -6.382 1.00 0.00 C ATOM 516 C SER A 34 16.007 -6.162 -5.944 1.00 0.00 C ATOM 517 O SER A 34 17.119 -5.859 -6.384 1.00 0.00 O ATOM 518 CB SER A 34 14.786 -4.875 -7.797 1.00 0.00 C ATOM 519 OG SER A 34 13.439 -4.634 -8.188 1.00 0.00 O ATOM 0 H SER A 34 14.850 -3.502 -5.588 1.00 0.00 H new ATOM 0 HA SER A 34 13.966 -6.200 -6.393 1.00 0.00 H new ATOM 0 HB2 SER A 34 15.369 -3.955 -7.831 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.265 -5.581 -8.476 1.00 0.00 H new ATOM 0 HG SER A 34 13.423 -4.271 -9.098 1.00 0.00 H new ATOM 525 N SER A 35 15.808 -7.127 -5.051 1.00 0.00 N ATOM 526 CA SER A 35 16.796 -8.106 -4.624 1.00 0.00 C ATOM 527 C SER A 35 17.199 -9.012 -5.808 1.00 0.00 C ATOM 528 O SER A 35 16.594 -8.951 -6.884 1.00 0.00 O ATOM 529 CB SER A 35 16.198 -8.900 -3.450 1.00 0.00 C ATOM 530 OG SER A 35 15.362 -8.051 -2.671 1.00 0.00 O ATOM 0 H SER A 35 14.909 -7.251 -4.585 1.00 0.00 H new ATOM 0 HA SER A 35 17.711 -7.618 -4.287 1.00 0.00 H new ATOM 0 HB2 SER A 35 15.623 -9.746 -3.826 1.00 0.00 H new ATOM 0 HB3 SER A 35 16.997 -9.308 -2.830 1.00 0.00 H new ATOM 0 HG SER A 35 15.452 -8.283 -1.723 1.00 0.00 H new ATOM 536 N GLY A 36 18.217 -9.863 -5.636 1.00 0.00 N ATOM 537 CA GLY A 36 18.791 -10.670 -6.701 1.00 0.00 C ATOM 538 C GLY A 36 19.496 -11.860 -6.079 1.00 0.00 C ATOM 539 O GLY A 36 19.302 -12.152 -4.899 1.00 0.00 O ATOM 0 H GLY A 36 18.668 -10.007 -4.733 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.010 -11.007 -7.383 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.494 -10.078 -7.288 1.00 0.00 H new ATOM 543 N LEU A 37 20.287 -12.575 -6.865 1.00 0.00 N ATOM 544 CA LEU A 37 20.921 -13.822 -6.522 1.00 0.00 C ATOM 545 C LEU A 37 22.329 -13.690 -7.058 1.00 0.00 C ATOM 546 O LEU A 37 22.486 -13.292 -8.214 1.00 0.00 O ATOM 547 CB LEU A 37 20.159 -14.957 -7.215 1.00 0.00 C ATOM 548 CG LEU A 37 18.850 -15.309 -6.494 1.00 0.00 C ATOM 549 CD1 LEU A 37 17.752 -15.610 -7.518 1.00 0.00 C ATOM 550 CD2 LEU A 37 19.056 -16.505 -5.558 1.00 0.00 C ATOM 0 H LEU A 37 20.511 -12.275 -7.814 1.00 0.00 H new ATOM 0 HA LEU A 37 20.927 -14.039 -5.454 1.00 0.00 H new ATOM 0 HB2 LEU A 37 19.938 -14.668 -8.243 1.00 0.00 H new ATOM 0 HB3 LEU A 37 20.794 -15.842 -7.262 1.00 0.00 H new ATOM 0 HG LEU A 37 18.542 -14.455 -5.891 1.00 0.00 H new ATOM 0 HD11 LEU A 37 16.827 -15.859 -6.997 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.590 -14.734 -8.146 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.056 -16.452 -8.140 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.118 -16.740 -5.056 1.00 0.00 H new ATOM 0 HD22 LEU A 37 19.383 -17.368 -6.137 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.814 -16.259 -4.814 1.00 0.00 H new ATOM 562 N GLU A 38 23.322 -14.009 -6.224 1.00 0.00 N ATOM 563 CA GLU A 38 24.759 -13.767 -6.432 1.00 0.00 C ATOM 564 C GLU A 38 25.066 -12.266 -6.458 1.00 0.00 C ATOM 565 O GLU A 38 25.753 -11.743 -5.578 1.00 0.00 O ATOM 566 CB GLU A 38 25.276 -14.450 -7.710 1.00 0.00 C ATOM 567 CG GLU A 38 24.890 -15.922 -7.779 1.00 0.00 C ATOM 568 CD GLU A 38 25.508 -16.589 -9.018 1.00 0.00 C ATOM 569 OE1 GLU A 38 26.658 -17.089 -8.952 1.00 0.00 O ATOM 570 OE2 GLU A 38 24.882 -16.575 -10.104 1.00 0.00 O ATOM 0 H GLU A 38 23.138 -14.470 -5.333 1.00 0.00 H new ATOM 0 HA GLU A 38 25.285 -14.211 -5.587 1.00 0.00 H new ATOM 0 HB2 GLU A 38 24.878 -13.932 -8.582 1.00 0.00 H new ATOM 0 HB3 GLU A 38 26.361 -14.359 -7.753 1.00 0.00 H new ATOM 0 HG2 GLU A 38 25.228 -16.434 -6.878 1.00 0.00 H new ATOM 0 HG3 GLU A 38 23.805 -16.017 -7.812 1.00 0.00 H new ATOM 577 N SER A 39 24.461 -11.598 -7.439 1.00 0.00 N ATOM 578 CA SER A 39 24.381 -10.179 -7.661 1.00 0.00 C ATOM 579 C SER A 39 25.692 -9.481 -7.966 1.00 0.00 C ATOM 580 O SER A 39 26.808 -9.965 -7.745 1.00 0.00 O ATOM 581 CB SER A 39 23.558 -9.524 -6.551 1.00 0.00 C ATOM 582 OG SER A 39 22.208 -9.967 -6.606 1.00 0.00 O ATOM 0 H SER A 39 23.965 -12.106 -8.171 1.00 0.00 H new ATOM 0 HA SER A 39 23.851 -10.043 -8.604 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.988 -9.767 -5.579 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.596 -8.439 -6.654 1.00 0.00 H new ATOM 0 HG SER A 39 21.694 -9.541 -5.889 1.00 0.00 H new ATOM 588 N SER A 40 25.484 -8.327 -8.588 1.00 0.00 N ATOM 589 CA SER A 40 26.481 -7.518 -9.221 1.00 0.00 C ATOM 590 C SER A 40 25.884 -6.125 -9.385 1.00 0.00 C ATOM 591 O SER A 40 24.683 -5.921 -9.158 1.00 0.00 O ATOM 592 CB SER A 40 26.781 -8.203 -10.556 1.00 0.00 C ATOM 593 OG SER A 40 25.624 -8.419 -11.345 1.00 0.00 O ATOM 0 H SER A 40 24.552 -7.919 -8.660 1.00 0.00 H new ATOM 0 HA SER A 40 27.410 -7.415 -8.661 1.00 0.00 H new ATOM 0 HB2 SER A 40 27.488 -7.594 -11.119 1.00 0.00 H new ATOM 0 HB3 SER A 40 27.266 -9.160 -10.365 1.00 0.00 H new ATOM 0 HG SER A 40 25.890 -8.696 -12.247 1.00 0.00 H new ATOM 599 N ARG A 41 26.699 -5.157 -9.784 1.00 0.00 N ATOM 600 CA ARG A 41 26.224 -3.809 -10.063 1.00 0.00 C ATOM 601 C ARG A 41 25.878 -3.693 -11.541 1.00 0.00 C ATOM 602 O ARG A 41 26.211 -4.558 -12.353 1.00 0.00 O ATOM 603 CB ARG A 41 27.271 -2.773 -9.600 1.00 0.00 C ATOM 604 CG ARG A 41 26.678 -1.703 -8.670 1.00 0.00 C ATOM 605 CD ARG A 41 27.784 -0.799 -8.117 1.00 0.00 C ATOM 606 NE ARG A 41 27.229 0.245 -7.238 1.00 0.00 N ATOM 607 CZ ARG A 41 27.926 1.044 -6.420 1.00 0.00 C ATOM 608 NH1 ARG A 41 29.254 0.958 -6.346 1.00 0.00 N ATOM 609 NH2 ARG A 41 27.285 1.939 -5.672 1.00 0.00 N ATOM 0 H ARG A 41 27.702 -5.283 -9.923 1.00 0.00 H new ATOM 0 HA ARG A 41 25.314 -3.600 -9.501 1.00 0.00 H new ATOM 0 HB2 ARG A 41 28.081 -3.288 -9.084 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.707 -2.288 -10.474 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.949 -1.103 -9.215 1.00 0.00 H new ATOM 0 HG3 ARG A 41 26.147 -2.182 -7.848 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.505 -1.400 -7.562 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.324 -0.334 -8.942 1.00 0.00 H new ATOM 0 HE ARG A 41 26.217 0.371 -7.254 1.00 0.00 H new ATOM 0 HH11 ARG A 41 29.754 0.277 -6.917 1.00 0.00 H new ATOM 0 HH12 ARG A 41 29.771 1.574 -5.718 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.269 2.013 -5.724 1.00 0.00 H new ATOM 0 HH22 ARG A 41 27.810 2.551 -5.047 1.00 0.00 H new ATOM 623 N VAL A 42 25.187 -2.609 -11.865 1.00 0.00 N ATOM 624 CA VAL A 42 24.784 -2.298 -13.222 1.00 0.00 C ATOM 625 C VAL A 42 26.008 -1.842 -14.040 1.00 0.00 C ATOM 626 O VAL A 42 27.093 -1.610 -13.500 1.00 0.00 O ATOM 627 CB VAL A 42 23.652 -1.262 -13.174 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.462 -1.722 -12.326 1.00 0.00 C ATOM 629 CG2 VAL A 42 24.132 0.103 -12.679 1.00 0.00 C ATOM 0 H VAL A 42 24.888 -1.914 -11.181 1.00 0.00 H new ATOM 0 HA VAL A 42 24.394 -3.179 -13.731 1.00 0.00 H new ATOM 0 HB VAL A 42 23.317 -1.161 -14.206 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.693 -0.949 -12.329 1.00 0.00 H new ATOM 0 HG12 VAL A 42 22.053 -2.643 -12.742 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.792 -1.902 -11.303 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.294 0.800 -12.664 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.539 0.003 -11.673 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.906 0.481 -13.347 1.00 0.00 H new ATOM 639 N HIS A 43 25.815 -1.684 -15.351 1.00 0.00 N ATOM 640 CA HIS A 43 26.881 -1.321 -16.284 1.00 0.00 C ATOM 641 C HIS A 43 27.100 0.202 -16.285 1.00 0.00 C ATOM 642 O HIS A 43 26.136 0.943 -16.074 1.00 0.00 O ATOM 643 CB HIS A 43 26.530 -1.901 -17.663 1.00 0.00 C ATOM 644 CG HIS A 43 26.331 -3.401 -17.611 1.00 0.00 C ATOM 645 ND1 HIS A 43 27.322 -4.355 -17.593 1.00 0.00 N ATOM 646 CD2 HIS A 43 25.139 -4.063 -17.470 1.00 0.00 C ATOM 647 CE1 HIS A 43 26.741 -5.558 -17.453 1.00 0.00 C ATOM 648 NE2 HIS A 43 25.404 -5.433 -17.359 1.00 0.00 N ATOM 0 H HIS A 43 24.906 -1.806 -15.798 1.00 0.00 H new ATOM 0 HA HIS A 43 27.836 -1.748 -15.979 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.622 -1.427 -18.036 1.00 0.00 H new ATOM 0 HB3 HIS A 43 27.326 -1.665 -18.369 1.00 0.00 H new ATOM 0 HD1 HIS A 43 28.324 -4.179 -17.672 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.161 -3.605 -17.448 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.274 -6.497 -17.420 1.00 0.00 H new ATOM 656 N PRO A 44 28.322 0.703 -16.552 1.00 0.00 N ATOM 657 CA PRO A 44 28.647 2.125 -16.420 1.00 0.00 C ATOM 658 C PRO A 44 27.830 3.000 -17.372 1.00 0.00 C ATOM 659 O PRO A 44 27.256 4.008 -16.958 1.00 0.00 O ATOM 660 CB PRO A 44 30.150 2.230 -16.709 1.00 0.00 C ATOM 661 CG PRO A 44 30.454 0.983 -17.539 1.00 0.00 C ATOM 662 CD PRO A 44 29.513 -0.049 -16.928 1.00 0.00 C ATOM 0 HA PRO A 44 28.400 2.490 -15.423 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.389 3.142 -17.256 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.733 2.249 -15.788 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.253 1.140 -18.599 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.498 0.682 -17.454 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.273 -0.837 -17.642 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.965 -0.531 -16.061 1.00 0.00 H new ATOM 670 N THR A 45 27.720 2.597 -18.638 1.00 0.00 N ATOM 671 CA THR A 45 26.983 3.355 -19.643 1.00 0.00 C ATOM 672 C THR A 45 25.481 3.323 -19.335 1.00 0.00 C ATOM 673 O THR A 45 24.786 4.288 -19.650 1.00 0.00 O ATOM 674 CB THR A 45 27.346 2.834 -21.038 1.00 0.00 C ATOM 675 OG1 THR A 45 28.753 2.642 -21.133 1.00 0.00 O ATOM 676 CG2 THR A 45 26.882 3.764 -22.166 1.00 0.00 C ATOM 0 H THR A 45 28.139 1.737 -18.993 1.00 0.00 H new ATOM 0 HA THR A 45 27.267 4.407 -19.619 1.00 0.00 H new ATOM 0 HB THR A 45 26.822 1.887 -21.164 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.978 2.307 -22.026 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.169 3.340 -23.128 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.798 3.872 -22.126 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.349 4.742 -22.047 1.00 0.00 H new ATOM 684 N ALA A 46 24.984 2.287 -18.633 1.00 0.00 N ATOM 685 CA ALA A 46 23.610 2.295 -18.153 1.00 0.00 C ATOM 686 C ALA A 46 23.414 3.496 -17.264 1.00 0.00 C ATOM 687 O ALA A 46 22.519 4.282 -17.516 1.00 0.00 O ATOM 688 CB ALA A 46 23.236 1.020 -17.377 1.00 0.00 C ATOM 0 H ALA A 46 25.514 1.449 -18.394 1.00 0.00 H new ATOM 0 HA ALA A 46 22.958 2.337 -19.026 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.200 1.087 -17.046 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.355 0.152 -18.025 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.888 0.917 -16.510 1.00 0.00 H new ATOM 694 N ILE A 47 24.264 3.675 -16.259 1.00 0.00 N ATOM 695 CA ILE A 47 24.061 4.724 -15.267 1.00 0.00 C ATOM 696 C ILE A 47 24.036 6.070 -15.985 1.00 0.00 C ATOM 697 O ILE A 47 23.172 6.883 -15.690 1.00 0.00 O ATOM 698 CB ILE A 47 25.163 4.682 -14.179 1.00 0.00 C ATOM 699 CG1 ILE A 47 25.128 3.339 -13.416 1.00 0.00 C ATOM 700 CG2 ILE A 47 25.013 5.871 -13.207 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.380 3.063 -12.575 1.00 0.00 C ATOM 0 H ILE A 47 25.099 3.108 -16.110 1.00 0.00 H new ATOM 0 HA ILE A 47 23.111 4.570 -14.756 1.00 0.00 H new ATOM 0 HB ILE A 47 26.132 4.765 -14.670 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.255 3.327 -12.763 1.00 0.00 H new ATOM 0 HG13 ILE A 47 25.000 2.529 -14.134 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.796 5.823 -12.450 1.00 0.00 H new ATOM 0 HG22 ILE A 47 25.099 6.806 -13.760 1.00 0.00 H new ATOM 0 HG23 ILE A 47 24.038 5.824 -12.723 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.276 2.102 -12.072 1.00 0.00 H new ATOM 0 HD12 ILE A 47 27.256 3.040 -13.223 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.500 3.851 -11.831 1.00 0.00 H new ATOM 713 N ALA A 48 24.913 6.284 -16.967 1.00 0.00 N ATOM 714 CA ALA A 48 24.946 7.537 -17.700 1.00 0.00 C ATOM 715 C ALA A 48 23.638 7.769 -18.468 1.00 0.00 C ATOM 716 O ALA A 48 23.036 8.829 -18.332 1.00 0.00 O ATOM 717 CB ALA A 48 26.162 7.570 -18.633 1.00 0.00 C ATOM 0 H ALA A 48 25.608 5.601 -17.269 1.00 0.00 H new ATOM 0 HA ALA A 48 25.043 8.354 -16.985 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.177 8.514 -19.178 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.075 7.476 -18.045 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.100 6.743 -19.341 1.00 0.00 H new ATOM 723 N MET A 49 23.168 6.784 -19.233 1.00 0.00 N ATOM 724 CA MET A 49 21.931 6.900 -20.015 1.00 0.00 C ATOM 725 C MET A 49 20.709 7.028 -19.099 1.00 0.00 C ATOM 726 O MET A 49 19.746 7.755 -19.362 1.00 0.00 O ATOM 727 CB MET A 49 21.801 5.646 -20.893 1.00 0.00 C ATOM 728 CG MET A 49 22.895 5.583 -21.962 1.00 0.00 C ATOM 729 SD MET A 49 22.796 6.899 -23.199 1.00 0.00 S ATOM 730 CE MET A 49 24.471 7.546 -22.983 1.00 0.00 C ATOM 0 H MET A 49 23.632 5.881 -19.330 1.00 0.00 H new ATOM 0 HA MET A 49 21.974 7.797 -20.633 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.854 4.756 -20.266 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.823 5.639 -21.374 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.868 5.631 -21.474 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.839 4.619 -22.468 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.629 8.382 -23.664 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.600 7.885 -21.955 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.195 6.761 -23.200 1.00 0.00 H new ATOM 740 N MET A 50 20.749 6.320 -17.985 1.00 0.00 N ATOM 741 CA MET A 50 19.619 6.215 -17.100 1.00 0.00 C ATOM 742 C MET A 50 19.571 7.510 -16.289 1.00 0.00 C ATOM 743 O MET A 50 18.485 8.016 -16.034 1.00 0.00 O ATOM 744 CB MET A 50 19.692 4.911 -16.298 1.00 0.00 C ATOM 745 CG MET A 50 19.670 3.605 -17.144 1.00 0.00 C ATOM 746 SD MET A 50 19.501 3.680 -18.968 1.00 0.00 S ATOM 747 CE MET A 50 19.493 1.925 -19.463 1.00 0.00 C ATOM 0 H MET A 50 21.571 5.803 -17.674 1.00 0.00 H new ATOM 0 HA MET A 50 18.666 6.133 -17.622 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.604 4.922 -15.701 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.855 4.886 -15.600 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.593 3.067 -16.928 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.849 2.993 -16.770 1.00 0.00 H new ATOM 0 HE1 MET A 50 20.147 1.787 -20.324 1.00 0.00 H new ATOM 0 HE2 MET A 50 19.849 1.312 -18.635 1.00 0.00 H new ATOM 0 HE3 MET A 50 18.478 1.626 -19.726 1.00 0.00 H new ATOM 757 N GLU A 51 20.713 8.145 -16.020 1.00 0.00 N ATOM 758 CA GLU A 51 20.771 9.473 -15.454 1.00 0.00 C ATOM 759 C GLU A 51 20.391 10.521 -16.499 1.00 0.00 C ATOM 760 O GLU A 51 19.968 11.613 -16.111 1.00 0.00 O ATOM 761 CB GLU A 51 22.152 9.772 -14.854 1.00 0.00 C ATOM 762 CG GLU A 51 22.357 9.111 -13.486 1.00 0.00 C ATOM 763 CD GLU A 51 21.746 9.941 -12.336 1.00 0.00 C ATOM 764 OE1 GLU A 51 20.521 10.219 -12.337 1.00 0.00 O ATOM 765 OE2 GLU A 51 22.503 10.333 -11.412 1.00 0.00 O ATOM 0 H GLU A 51 21.631 7.736 -16.196 1.00 0.00 H new ATOM 0 HA GLU A 51 20.046 9.519 -14.641 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.925 9.425 -15.540 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.275 10.850 -14.754 1.00 0.00 H new ATOM 0 HG2 GLU A 51 21.907 8.118 -13.494 1.00 0.00 H new ATOM 0 HG3 GLU A 51 23.424 8.976 -13.307 1.00 0.00 H new ATOM 772 N GLU A 52 20.468 10.218 -17.802 1.00 0.00 N ATOM 773 CA GLU A 52 19.913 11.109 -18.813 1.00 0.00 C ATOM 774 C GLU A 52 18.386 11.154 -18.692 1.00 0.00 C ATOM 775 O GLU A 52 17.802 12.211 -18.941 1.00 0.00 O ATOM 776 CB GLU A 52 20.399 10.824 -20.249 1.00 0.00 C ATOM 777 CG GLU A 52 21.856 11.244 -20.485 1.00 0.00 C ATOM 778 CD GLU A 52 22.012 12.775 -20.564 1.00 0.00 C ATOM 779 OE1 GLU A 52 21.796 13.355 -21.658 1.00 0.00 O ATOM 780 OE2 GLU A 52 22.362 13.410 -19.540 1.00 0.00 O ATOM 0 H GLU A 52 20.904 9.373 -18.171 1.00 0.00 H new ATOM 0 HA GLU A 52 20.304 12.106 -18.607 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.296 9.759 -20.457 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.756 11.350 -20.955 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.479 10.858 -19.679 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.217 10.795 -21.410 1.00 0.00 H new ATOM 787 N VAL A 53 17.743 10.065 -18.247 1.00 0.00 N ATOM 788 CA VAL A 53 16.330 10.087 -17.869 1.00 0.00 C ATOM 789 C VAL A 53 16.153 10.384 -16.362 1.00 0.00 C ATOM 790 O VAL A 53 15.040 10.308 -15.841 1.00 0.00 O ATOM 791 CB VAL A 53 15.576 8.856 -18.401 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.428 8.936 -19.929 1.00 0.00 C ATOM 793 CG2 VAL A 53 16.183 7.497 -18.038 1.00 0.00 C ATOM 0 H VAL A 53 18.187 9.153 -18.141 1.00 0.00 H new ATOM 0 HA VAL A 53 15.844 10.926 -18.368 1.00 0.00 H new ATOM 0 HB VAL A 53 14.610 8.899 -17.898 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.892 8.058 -20.289 1.00 0.00 H new ATOM 0 HG12 VAL A 53 14.871 9.835 -20.194 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.416 8.973 -20.389 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.572 6.701 -18.463 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.195 7.432 -18.438 1.00 0.00 H new ATOM 0 HG23 VAL A 53 16.214 7.390 -16.954 1.00 0.00 H new ATOM 803 N GLY A 54 17.224 10.786 -15.667 1.00 0.00 N ATOM 804 CA GLY A 54 17.196 11.258 -14.288 1.00 0.00 C ATOM 805 C GLY A 54 17.057 10.133 -13.259 1.00 0.00 C ATOM 806 O GLY A 54 16.570 10.391 -12.154 1.00 0.00 O ATOM 0 H GLY A 54 18.162 10.790 -16.067 1.00 0.00 H new ATOM 0 HA2 GLY A 54 18.111 11.815 -14.084 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.366 11.954 -14.168 1.00 0.00 H new ATOM 810 N ILE A 55 17.434 8.898 -13.609 1.00 0.00 N ATOM 811 CA ILE A 55 17.238 7.710 -12.786 1.00 0.00 C ATOM 812 C ILE A 55 18.576 7.166 -12.279 1.00 0.00 C ATOM 813 O ILE A 55 19.481 6.883 -13.067 1.00 0.00 O ATOM 814 CB ILE A 55 16.442 6.643 -13.550 1.00 0.00 C ATOM 815 CG1 ILE A 55 15.082 7.199 -14.026 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.253 5.370 -12.703 1.00 0.00 C ATOM 817 CD1 ILE A 55 14.075 6.133 -14.463 1.00 0.00 C ATOM 0 H ILE A 55 17.895 8.697 -14.496 1.00 0.00 H new ATOM 0 HA ILE A 55 16.652 7.992 -11.911 1.00 0.00 H new ATOM 0 HB ILE A 55 17.020 6.370 -14.432 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.642 7.786 -13.220 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.255 7.880 -14.859 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.685 4.635 -13.273 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.228 4.956 -12.446 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.712 5.618 -11.790 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.150 6.615 -14.781 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.489 5.560 -15.292 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.867 5.464 -13.628 1.00 0.00 H new ATOM 829 N ASP A 56 18.656 6.925 -10.966 1.00 0.00 N ATOM 830 CA ASP A 56 19.758 6.192 -10.352 1.00 0.00 C ATOM 831 C ASP A 56 19.416 4.706 -10.429 1.00 0.00 C ATOM 832 O ASP A 56 18.338 4.299 -9.992 1.00 0.00 O ATOM 833 CB ASP A 56 19.970 6.611 -8.891 1.00 0.00 C ATOM 834 CG ASP A 56 21.143 5.846 -8.244 1.00 0.00 C ATOM 835 OD1 ASP A 56 21.013 4.628 -7.968 1.00 0.00 O ATOM 836 OD2 ASP A 56 22.196 6.481 -7.994 1.00 0.00 O ATOM 0 H ASP A 56 17.951 7.237 -10.299 1.00 0.00 H new ATOM 0 HA ASP A 56 20.685 6.410 -10.882 1.00 0.00 H new ATOM 0 HB2 ASP A 56 20.164 7.683 -8.844 1.00 0.00 H new ATOM 0 HB3 ASP A 56 19.058 6.427 -8.323 1.00 0.00 H new ATOM 841 N ILE A 57 20.316 3.900 -10.991 1.00 0.00 N ATOM 842 CA ILE A 57 20.271 2.429 -10.966 1.00 0.00 C ATOM 843 C ILE A 57 21.558 1.877 -10.332 1.00 0.00 C ATOM 844 O ILE A 57 21.568 0.759 -9.827 1.00 0.00 O ATOM 845 CB ILE A 57 20.017 1.847 -12.376 1.00 0.00 C ATOM 846 CG1 ILE A 57 20.921 2.507 -13.438 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.529 1.959 -12.759 1.00 0.00 C ATOM 848 CD1 ILE A 57 21.106 1.637 -14.680 1.00 0.00 C ATOM 0 H ILE A 57 21.126 4.260 -11.495 1.00 0.00 H new ATOM 0 HA ILE A 57 19.430 2.113 -10.349 1.00 0.00 H new ATOM 0 HB ILE A 57 20.277 0.789 -12.346 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.490 3.464 -13.731 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.896 2.717 -12.999 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.377 1.543 -13.755 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.925 1.407 -12.039 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.230 3.007 -12.755 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.751 2.152 -15.392 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.564 0.689 -14.396 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.136 1.448 -15.140 1.00 0.00 H new ATOM 860 N SER A 58 22.634 2.668 -10.339 1.00 0.00 N ATOM 861 CA SER A 58 23.904 2.507 -9.643 1.00 0.00 C ATOM 862 C SER A 58 23.764 1.899 -8.238 1.00 0.00 C ATOM 863 O SER A 58 24.554 1.035 -7.856 1.00 0.00 O ATOM 864 CB SER A 58 24.545 3.911 -9.552 1.00 0.00 C ATOM 865 OG SER A 58 23.970 4.822 -10.488 1.00 0.00 O ATOM 0 H SER A 58 22.632 3.525 -10.892 1.00 0.00 H new ATOM 0 HA SER A 58 24.522 1.804 -10.202 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.420 4.302 -8.542 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.617 3.833 -9.734 1.00 0.00 H new ATOM 0 HG SER A 58 24.400 5.698 -10.398 1.00 0.00 H new ATOM 871 N GLY A 59 22.752 2.315 -7.476 1.00 0.00 N ATOM 872 CA GLY A 59 22.516 1.896 -6.097 1.00 0.00 C ATOM 873 C GLY A 59 21.798 0.551 -5.948 1.00 0.00 C ATOM 874 O GLY A 59 21.288 0.273 -4.862 1.00 0.00 O ATOM 0 H GLY A 59 22.052 2.975 -7.814 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.474 1.840 -5.580 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.928 2.664 -5.595 1.00 0.00 H new ATOM 878 N GLN A 60 21.692 -0.267 -7.008 1.00 0.00 N ATOM 879 CA GLN A 60 20.850 -1.464 -6.988 1.00 0.00 C ATOM 880 C GLN A 60 21.291 -2.520 -5.976 1.00 0.00 C ATOM 881 O GLN A 60 20.456 -3.306 -5.524 1.00 0.00 O ATOM 882 CB GLN A 60 20.816 -2.140 -8.374 1.00 0.00 C ATOM 883 CG GLN A 60 19.373 -2.237 -8.871 1.00 0.00 C ATOM 884 CD GLN A 60 19.256 -3.107 -10.122 1.00 0.00 C ATOM 885 OE1 GLN A 60 19.113 -4.323 -10.038 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.303 -2.504 -11.300 1.00 0.00 N ATOM 0 H GLN A 60 22.182 -0.116 -7.890 1.00 0.00 H new ATOM 0 HA GLN A 60 19.865 -1.099 -6.696 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.416 -1.568 -9.082 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.257 -3.135 -8.314 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.745 -2.650 -8.082 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.996 -1.237 -9.088 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.422 -1.492 -11.351 1.00 0.00 H new ATOM 0 HE22 GLN A 60 19.220 -3.051 -12.157 1.00 0.00 H new ATOM 895 N THR A 61 22.588 -2.602 -5.689 1.00 0.00 N ATOM 896 CA THR A 61 23.171 -3.686 -4.918 1.00 0.00 C ATOM 897 C THR A 61 22.551 -3.675 -3.514 1.00 0.00 C ATOM 898 O THR A 61 22.571 -2.659 -2.811 1.00 0.00 O ATOM 899 CB THR A 61 24.713 -3.587 -4.940 1.00 0.00 C ATOM 900 OG1 THR A 61 25.149 -2.250 -5.165 1.00 0.00 O ATOM 901 CG2 THR A 61 25.279 -4.445 -6.077 1.00 0.00 C ATOM 0 H THR A 61 23.269 -1.906 -5.992 1.00 0.00 H new ATOM 0 HA THR A 61 22.942 -4.657 -5.357 1.00 0.00 H new ATOM 0 HB THR A 61 25.067 -3.932 -3.969 1.00 0.00 H new ATOM 0 HG1 THR A 61 26.129 -2.222 -5.171 1.00 0.00 H new ATOM 0 HG21 THR A 61 26.366 -4.368 -6.084 1.00 0.00 H new ATOM 0 HG22 THR A 61 24.989 -5.485 -5.927 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.884 -4.093 -7.030 1.00 0.00 H new ATOM 909 N SER A 62 21.952 -4.808 -3.142 1.00 0.00 N ATOM 910 CA SER A 62 21.112 -4.982 -1.973 1.00 0.00 C ATOM 911 C SER A 62 21.335 -6.406 -1.440 1.00 0.00 C ATOM 912 O SER A 62 22.179 -7.155 -1.948 1.00 0.00 O ATOM 913 CB SER A 62 19.652 -4.767 -2.425 1.00 0.00 C ATOM 914 OG SER A 62 19.426 -3.458 -2.930 1.00 0.00 O ATOM 0 H SER A 62 22.050 -5.668 -3.681 1.00 0.00 H new ATOM 0 HA SER A 62 21.346 -4.276 -1.177 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.402 -5.498 -3.194 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.984 -4.949 -1.583 1.00 0.00 H new ATOM 0 HG SER A 62 19.799 -3.387 -3.834 1.00 0.00 H new ATOM 920 N ASP A 63 20.569 -6.782 -0.418 1.00 0.00 N ATOM 921 CA ASP A 63 20.535 -8.138 0.127 1.00 0.00 C ATOM 922 C ASP A 63 20.164 -9.172 -0.951 1.00 0.00 C ATOM 923 O ASP A 63 19.474 -8.832 -1.922 1.00 0.00 O ATOM 924 CB ASP A 63 19.492 -8.199 1.244 1.00 0.00 C ATOM 925 CG ASP A 63 20.081 -7.804 2.607 1.00 0.00 C ATOM 926 OD1 ASP A 63 20.854 -8.602 3.187 1.00 0.00 O ATOM 927 OD2 ASP A 63 19.788 -6.686 3.097 1.00 0.00 O ATOM 0 H ASP A 63 19.941 -6.139 0.065 1.00 0.00 H new ATOM 0 HA ASP A 63 21.529 -8.377 0.506 1.00 0.00 H new ATOM 0 HB2 ASP A 63 18.663 -7.534 1.002 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.085 -9.208 1.304 1.00 0.00 H new ATOM 932 N PRO A 64 20.566 -10.445 -0.781 1.00 0.00 N ATOM 933 CA PRO A 64 20.110 -11.531 -1.637 1.00 0.00 C ATOM 934 C PRO A 64 18.604 -11.748 -1.455 1.00 0.00 C ATOM 935 O PRO A 64 18.045 -11.479 -0.392 1.00 0.00 O ATOM 936 CB PRO A 64 20.920 -12.759 -1.206 1.00 0.00 C ATOM 937 CG PRO A 64 21.200 -12.489 0.274 1.00 0.00 C ATOM 938 CD PRO A 64 21.379 -10.970 0.312 1.00 0.00 C ATOM 0 HA PRO A 64 20.261 -11.320 -2.696 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.358 -13.682 -1.348 1.00 0.00 H new ATOM 0 HB3 PRO A 64 21.842 -12.855 -1.780 1.00 0.00 H new ATOM 0 HG2 PRO A 64 20.376 -12.815 0.908 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.093 -13.011 0.619 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.056 -10.562 1.270 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.427 -10.697 0.186 1.00 0.00 H new ATOM 946 N ILE A 65 17.951 -12.320 -2.468 1.00 0.00 N ATOM 947 CA ILE A 65 16.509 -12.576 -2.473 1.00 0.00 C ATOM 948 C ILE A 65 16.107 -13.484 -1.299 1.00 0.00 C ATOM 949 O ILE A 65 14.994 -13.403 -0.783 1.00 0.00 O ATOM 950 CB ILE A 65 16.128 -13.168 -3.853 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.666 -12.860 -4.199 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.445 -14.670 -3.964 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.254 -13.303 -5.612 1.00 0.00 C ATOM 0 H ILE A 65 18.417 -12.624 -3.323 1.00 0.00 H new ATOM 0 HA ILE A 65 15.954 -11.649 -2.329 1.00 0.00 H new ATOM 0 HB ILE A 65 16.756 -12.676 -4.596 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.019 -13.351 -3.472 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.498 -11.787 -4.102 1.00 0.00 H new ATOM 0 HG21 ILE A 65 16.157 -15.031 -4.952 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.513 -14.828 -3.817 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.889 -15.216 -3.202 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.207 -13.051 -5.782 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.874 -12.792 -6.349 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.388 -14.380 -5.709 1.00 0.00 H new ATOM 965 N GLU A 66 17.041 -14.332 -0.859 1.00 0.00 N ATOM 966 CA GLU A 66 16.835 -15.364 0.153 1.00 0.00 C ATOM 967 C GLU A 66 16.585 -14.726 1.523 1.00 0.00 C ATOM 968 O GLU A 66 15.966 -15.322 2.407 1.00 0.00 O ATOM 969 CB GLU A 66 18.084 -16.257 0.255 1.00 0.00 C ATOM 970 CG GLU A 66 18.699 -16.613 -1.100 1.00 0.00 C ATOM 971 CD GLU A 66 19.835 -17.642 -0.955 1.00 0.00 C ATOM 972 OE1 GLU A 66 19.557 -18.867 -0.957 1.00 0.00 O ATOM 973 OE2 GLU A 66 21.017 -17.232 -0.845 1.00 0.00 O ATOM 0 H GLU A 66 17.997 -14.315 -1.214 1.00 0.00 H new ATOM 0 HA GLU A 66 15.970 -15.959 -0.140 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.834 -15.750 0.862 1.00 0.00 H new ATOM 0 HB3 GLU A 66 17.820 -17.177 0.777 1.00 0.00 H new ATOM 0 HG2 GLU A 66 17.927 -17.013 -1.757 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.084 -15.710 -1.574 1.00 0.00 H new ATOM 980 N ASN A 67 17.101 -13.505 1.688 1.00 0.00 N ATOM 981 CA ASN A 67 16.939 -12.685 2.882 1.00 0.00 C ATOM 982 C ASN A 67 15.465 -12.337 3.145 1.00 0.00 C ATOM 983 O ASN A 67 15.100 -12.029 4.283 1.00 0.00 O ATOM 984 CB ASN A 67 17.742 -11.389 2.714 1.00 0.00 C ATOM 985 CG ASN A 67 17.969 -10.700 4.052 1.00 0.00 C ATOM 986 OD1 ASN A 67 17.259 -9.772 4.429 1.00 0.00 O ATOM 987 ND2 ASN A 67 18.970 -11.147 4.800 1.00 0.00 N ATOM 0 H ASN A 67 17.661 -13.049 0.968 1.00 0.00 H new ATOM 0 HA ASN A 67 17.304 -13.258 3.735 1.00 0.00 H new ATOM 0 HB2 ASN A 67 18.703 -11.612 2.250 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.212 -10.715 2.041 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.161 -10.718 5.706 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.549 -11.919 4.469 1.00 0.00 H new ATOM 994 N PHE A 68 14.627 -12.381 2.105 1.00 0.00 N ATOM 995 CA PHE A 68 13.241 -11.934 2.111 1.00 0.00 C ATOM 996 C PHE A 68 12.272 -13.112 2.039 1.00 0.00 C ATOM 997 O PHE A 68 12.671 -14.281 2.028 1.00 0.00 O ATOM 998 CB PHE A 68 13.020 -10.994 0.916 1.00 0.00 C ATOM 999 CG PHE A 68 13.912 -9.786 0.958 1.00 0.00 C ATOM 1000 CD1 PHE A 68 13.599 -8.737 1.833 1.00 0.00 C ATOM 1001 CD2 PHE A 68 15.077 -9.748 0.178 1.00 0.00 C ATOM 1002 CE1 PHE A 68 14.463 -7.632 1.933 1.00 0.00 C ATOM 1003 CE2 PHE A 68 15.954 -8.655 0.293 1.00 0.00 C ATOM 1004 CZ PHE A 68 15.642 -7.593 1.164 1.00 0.00 C ATOM 0 H PHE A 68 14.915 -12.747 1.197 1.00 0.00 H new ATOM 0 HA PHE A 68 13.046 -11.408 3.046 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.199 -11.541 -0.010 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.979 -10.672 0.900 1.00 0.00 H new ATOM 0 HD1 PHE A 68 12.698 -8.777 2.428 1.00 0.00 H new ATOM 0 HD2 PHE A 68 15.299 -10.553 -0.507 1.00 0.00 H new ATOM 0 HE1 PHE A 68 14.223 -6.815 2.598 1.00 0.00 H new ATOM 0 HE2 PHE A 68 16.866 -8.630 -0.286 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.309 -6.747 1.242 1.00 0.00 H new ATOM 1014 N ASN A 69 10.983 -12.772 1.971 1.00 0.00 N ATOM 1015 CA ASN A 69 9.905 -13.683 1.677 1.00 0.00 C ATOM 1016 C ASN A 69 9.091 -13.033 0.582 1.00 0.00 C ATOM 1017 O ASN A 69 8.829 -11.829 0.667 1.00 0.00 O ATOM 1018 CB ASN A 69 9.033 -13.897 2.913 1.00 0.00 C ATOM 1019 CG ASN A 69 7.984 -15.000 2.792 1.00 0.00 C ATOM 1020 OD1 ASN A 69 7.537 -15.362 1.709 1.00 0.00 O ATOM 1021 ND2 ASN A 69 7.520 -15.521 3.918 1.00 0.00 N ATOM 0 H ASN A 69 10.663 -11.816 2.127 1.00 0.00 H new ATOM 0 HA ASN A 69 10.287 -14.657 1.372 1.00 0.00 H new ATOM 0 HB2 ASN A 69 9.681 -14.127 3.759 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.526 -12.961 3.145 1.00 0.00 H new ATOM 0 HD21 ASN A 69 6.786 -16.228 3.888 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.897 -15.215 4.815 1.00 0.00 H new ATOM 1028 N ALA A 70 8.658 -13.787 -0.417 1.00 0.00 N ATOM 1029 CA ALA A 70 7.905 -13.205 -1.487 1.00 0.00 C ATOM 1030 C ALA A 70 6.508 -12.872 -1.007 1.00 0.00 C ATOM 1031 O ALA A 70 5.882 -11.979 -1.570 1.00 0.00 O ATOM 1032 CB ALA A 70 7.842 -14.142 -2.680 1.00 0.00 C ATOM 0 H ALA A 70 8.819 -14.791 -0.498 1.00 0.00 H new ATOM 0 HA ALA A 70 8.404 -12.289 -1.804 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.265 -13.676 -3.478 1.00 0.00 H new ATOM 0 HB2 ALA A 70 8.852 -14.348 -3.035 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.364 -15.076 -2.384 1.00 0.00 H new ATOM 1038 N ASP A 71 6.035 -13.565 0.031 1.00 0.00 N ATOM 1039 CA ASP A 71 4.721 -13.326 0.586 1.00 0.00 C ATOM 1040 C ASP A 71 4.614 -11.912 1.182 1.00 0.00 C ATOM 1041 O ASP A 71 3.515 -11.367 1.316 1.00 0.00 O ATOM 1042 CB ASP A 71 4.381 -14.374 1.649 1.00 0.00 C ATOM 1043 CG ASP A 71 2.952 -14.189 2.186 1.00 0.00 C ATOM 1044 OD1 ASP A 71 1.981 -14.440 1.430 1.00 0.00 O ATOM 1045 OD2 ASP A 71 2.789 -13.854 3.386 1.00 0.00 O ATOM 0 H ASP A 71 6.558 -14.303 0.502 1.00 0.00 H new ATOM 0 HA ASP A 71 4.001 -13.407 -0.229 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.485 -15.372 1.224 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.092 -14.303 2.472 1.00 0.00 H new ATOM 1050 N ASP A 72 5.759 -11.307 1.534 1.00 0.00 N ATOM 1051 CA ASP A 72 5.834 -9.939 2.016 1.00 0.00 C ATOM 1052 C ASP A 72 5.630 -8.933 0.879 1.00 0.00 C ATOM 1053 O ASP A 72 5.121 -7.831 1.097 1.00 0.00 O ATOM 1054 CB ASP A 72 7.194 -9.690 2.669 1.00 0.00 C ATOM 1055 CG ASP A 72 7.222 -8.306 3.337 1.00 0.00 C ATOM 1056 OD1 ASP A 72 6.541 -8.120 4.373 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.945 -7.404 2.850 1.00 0.00 O ATOM 0 H ASP A 72 6.667 -11.770 1.487 1.00 0.00 H new ATOM 0 HA ASP A 72 5.038 -9.801 2.747 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.395 -10.463 3.411 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.982 -9.755 1.919 1.00 0.00 H new ATOM 1062 N TYR A 73 6.023 -9.319 -0.337 1.00 0.00 N ATOM 1063 CA TYR A 73 5.868 -8.528 -1.538 1.00 0.00 C ATOM 1064 C TYR A 73 4.431 -8.630 -2.060 1.00 0.00 C ATOM 1065 O TYR A 73 3.700 -9.574 -1.746 1.00 0.00 O ATOM 1066 CB TYR A 73 6.894 -8.923 -2.612 1.00 0.00 C ATOM 1067 CG TYR A 73 8.298 -8.409 -2.358 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.045 -8.871 -1.257 1.00 0.00 C ATOM 1069 CD2 TYR A 73 8.866 -7.470 -3.240 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.354 -8.410 -1.041 1.00 0.00 C ATOM 1071 CE2 TYR A 73 10.180 -7.012 -3.034 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.940 -7.497 -1.945 1.00 0.00 C ATOM 1073 OH TYR A 73 12.243 -7.140 -1.790 1.00 0.00 O ATOM 0 H TYR A 73 6.470 -10.220 -0.507 1.00 0.00 H new ATOM 0 HA TYR A 73 6.063 -7.485 -1.287 1.00 0.00 H new ATOM 0 HB2 TYR A 73 6.926 -10.010 -2.684 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.553 -8.550 -3.578 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.608 -9.585 -0.574 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.292 -7.101 -4.077 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.913 -8.754 -0.183 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.610 -6.288 -3.710 1.00 0.00 H new ATOM 0 HH TYR A 73 12.558 -6.692 -2.603 1.00 0.00 H new ATOM 1083 N ASP A 74 4.028 -7.656 -2.882 1.00 0.00 N ATOM 1084 CA ASP A 74 2.755 -7.717 -3.605 1.00 0.00 C ATOM 1085 C ASP A 74 2.986 -8.173 -5.044 1.00 0.00 C ATOM 1086 O ASP A 74 2.217 -8.980 -5.571 1.00 0.00 O ATOM 1087 CB ASP A 74 2.050 -6.362 -3.580 1.00 0.00 C ATOM 1088 CG ASP A 74 0.712 -6.438 -4.339 1.00 0.00 C ATOM 1089 OD1 ASP A 74 -0.295 -6.873 -3.730 1.00 0.00 O ATOM 1090 OD2 ASP A 74 0.658 -6.022 -5.519 1.00 0.00 O ATOM 0 H ASP A 74 4.570 -6.811 -3.064 1.00 0.00 H new ATOM 0 HA ASP A 74 2.112 -8.442 -3.107 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.873 -6.056 -2.549 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.689 -5.604 -4.032 1.00 0.00 H new ATOM 1095 N VAL A 75 4.075 -7.713 -5.669 1.00 0.00 N ATOM 1096 CA VAL A 75 4.330 -7.892 -7.087 1.00 0.00 C ATOM 1097 C VAL A 75 5.801 -8.219 -7.305 1.00 0.00 C ATOM 1098 O VAL A 75 6.696 -7.613 -6.711 1.00 0.00 O ATOM 1099 CB VAL A 75 3.844 -6.645 -7.869 1.00 0.00 C ATOM 1100 CG1 VAL A 75 3.924 -5.296 -7.127 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.504 -6.540 -9.255 1.00 0.00 C ATOM 0 H VAL A 75 4.812 -7.198 -5.188 1.00 0.00 H new ATOM 0 HA VAL A 75 3.764 -8.738 -7.477 1.00 0.00 H new ATOM 0 HB VAL A 75 2.776 -6.832 -7.983 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.557 -4.501 -7.776 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.313 -5.340 -6.226 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.959 -5.092 -6.854 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.134 -5.652 -9.768 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.585 -6.468 -9.139 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.260 -7.426 -9.842 1.00 0.00 H new ATOM 1111 N VAL A 76 6.062 -9.176 -8.187 1.00 0.00 N ATOM 1112 CA VAL A 76 7.393 -9.640 -8.501 1.00 0.00 C ATOM 1113 C VAL A 76 7.404 -9.940 -9.999 1.00 0.00 C ATOM 1114 O VAL A 76 6.409 -10.420 -10.550 1.00 0.00 O ATOM 1115 CB VAL A 76 7.706 -10.885 -7.661 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.094 -11.445 -8.001 1.00 0.00 C ATOM 1117 CG2 VAL A 76 7.636 -10.652 -6.137 1.00 0.00 C ATOM 0 H VAL A 76 5.332 -9.657 -8.712 1.00 0.00 H new ATOM 0 HA VAL A 76 8.159 -8.900 -8.269 1.00 0.00 H new ATOM 0 HB VAL A 76 6.924 -11.598 -7.922 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.290 -12.327 -7.391 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.128 -11.718 -9.056 1.00 0.00 H new ATOM 0 HG13 VAL A 76 9.851 -10.688 -7.798 1.00 0.00 H new ATOM 0 HG21 VAL A 76 7.870 -11.580 -5.616 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.356 -9.885 -5.853 1.00 0.00 H new ATOM 0 HG23 VAL A 76 6.632 -10.326 -5.864 1.00 0.00 H new ATOM 1127 N ILE A 77 8.516 -9.637 -10.656 1.00 0.00 N ATOM 1128 CA ILE A 77 8.659 -9.677 -12.096 1.00 0.00 C ATOM 1129 C ILE A 77 10.006 -10.318 -12.395 1.00 0.00 C ATOM 1130 O ILE A 77 11.015 -9.926 -11.801 1.00 0.00 O ATOM 1131 CB ILE A 77 8.615 -8.233 -12.650 1.00 0.00 C ATOM 1132 CG1 ILE A 77 7.330 -7.455 -12.271 1.00 0.00 C ATOM 1133 CG2 ILE A 77 8.868 -8.210 -14.162 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.053 -7.971 -12.937 1.00 0.00 C ATOM 0 H ILE A 77 9.370 -9.347 -10.179 1.00 0.00 H new ATOM 0 HA ILE A 77 7.856 -10.248 -12.562 1.00 0.00 H new ATOM 0 HB ILE A 77 9.429 -7.700 -12.159 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.202 -7.496 -11.189 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.464 -6.406 -12.537 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.831 -7.182 -14.522 1.00 0.00 H new ATOM 0 HG22 ILE A 77 9.850 -8.633 -14.373 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.103 -8.799 -14.668 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.205 -7.367 -12.614 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.155 -7.904 -14.020 1.00 0.00 H new ATOM 0 HD13 ILE A 77 5.888 -9.010 -12.652 1.00 0.00 H new ATOM 1146 N SER A 78 10.028 -11.273 -13.314 1.00 0.00 N ATOM 1147 CA SER A 78 11.259 -11.794 -13.862 1.00 0.00 C ATOM 1148 C SER A 78 11.547 -11.057 -15.173 1.00 0.00 C ATOM 1149 O SER A 78 10.701 -10.331 -15.699 1.00 0.00 O ATOM 1150 CB SER A 78 11.186 -13.306 -14.035 1.00 0.00 C ATOM 1151 OG SER A 78 11.156 -13.948 -12.767 1.00 0.00 O ATOM 0 H SER A 78 9.187 -11.705 -13.697 1.00 0.00 H new ATOM 0 HA SER A 78 12.087 -11.619 -13.175 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.296 -13.571 -14.605 1.00 0.00 H new ATOM 0 HB3 SER A 78 12.046 -13.655 -14.607 1.00 0.00 H new ATOM 0 HG SER A 78 10.948 -14.898 -12.886 1.00 0.00 H new ATOM 1157 N LEU A 79 12.766 -11.188 -15.691 1.00 0.00 N ATOM 1158 CA LEU A 79 13.186 -10.518 -16.920 1.00 0.00 C ATOM 1159 C LEU A 79 13.935 -11.488 -17.838 1.00 0.00 C ATOM 1160 O LEU A 79 14.724 -11.054 -18.681 1.00 0.00 O ATOM 1161 CB LEU A 79 14.038 -9.282 -16.561 1.00 0.00 C ATOM 1162 CG LEU A 79 13.339 -8.190 -15.729 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.412 -7.242 -15.184 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.341 -7.386 -16.566 1.00 0.00 C ATOM 0 H LEU A 79 13.494 -11.764 -15.268 1.00 0.00 H new ATOM 0 HA LEU A 79 12.309 -10.179 -17.472 1.00 0.00 H new ATOM 0 HB2 LEU A 79 14.917 -9.620 -16.012 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.394 -8.831 -17.487 1.00 0.00 H new ATOM 0 HG LEU A 79 12.785 -8.670 -14.922 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.939 -6.460 -14.591 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.108 -7.801 -14.558 1.00 0.00 H new ATOM 0 HD13 LEU A 79 14.954 -6.790 -16.015 1.00 0.00 H new ATOM 0 HD21 LEU A 79 11.871 -6.627 -15.941 1.00 0.00 H new ATOM 0 HD22 LEU A 79 12.864 -6.903 -17.392 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.577 -8.055 -16.962 1.00 0.00 H new ATOM 1176 N CYS A 80 13.786 -12.798 -17.632 1.00 0.00 N ATOM 1177 CA CYS A 80 14.518 -13.803 -18.403 1.00 0.00 C ATOM 1178 C CYS A 80 14.037 -15.258 -18.227 1.00 0.00 C ATOM 1179 O CYS A 80 14.635 -16.147 -18.838 1.00 0.00 O ATOM 1180 CB CYS A 80 16.016 -13.721 -18.038 1.00 0.00 C ATOM 1181 SG CYS A 80 16.431 -13.934 -16.286 1.00 0.00 S ATOM 0 H CYS A 80 13.158 -13.190 -16.930 1.00 0.00 H new ATOM 0 HA CYS A 80 14.330 -13.561 -19.449 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.549 -14.480 -18.610 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.395 -12.752 -18.364 1.00 0.00 H new ATOM 1186 N GLY A 81 13.019 -15.550 -17.413 1.00 0.00 N ATOM 1187 CA GLY A 81 12.531 -16.911 -17.221 1.00 0.00 C ATOM 1188 C GLY A 81 11.676 -17.056 -15.965 1.00 0.00 C ATOM 1189 O GLY A 81 11.425 -16.088 -15.249 1.00 0.00 O ATOM 0 H GLY A 81 12.514 -14.849 -16.871 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.946 -17.209 -18.091 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.380 -17.592 -17.159 1.00 0.00 H new ATOM 1193 N SER A 82 11.282 -18.297 -15.676 1.00 0.00 N ATOM 1194 CA SER A 82 10.397 -18.661 -14.572 1.00 0.00 C ATOM 1195 C SER A 82 11.074 -19.783 -13.776 1.00 0.00 C ATOM 1196 O SER A 82 11.520 -20.770 -14.369 1.00 0.00 O ATOM 1197 CB SER A 82 9.032 -19.098 -15.129 1.00 0.00 C ATOM 1198 OG SER A 82 8.501 -18.106 -16.003 1.00 0.00 O ATOM 0 H SER A 82 11.582 -19.103 -16.224 1.00 0.00 H new ATOM 0 HA SER A 82 10.221 -17.813 -13.910 1.00 0.00 H new ATOM 0 HB2 SER A 82 9.138 -20.042 -15.664 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.338 -19.274 -14.307 1.00 0.00 H new ATOM 0 HG SER A 82 7.633 -18.404 -16.348 1.00 0.00 H new ATOM 1204 N GLY A 83 11.216 -19.614 -12.451 1.00 0.00 N ATOM 1205 CA GLY A 83 12.021 -20.511 -11.617 1.00 0.00 C ATOM 1206 C GLY A 83 13.470 -20.557 -12.116 1.00 0.00 C ATOM 1207 O GLY A 83 14.109 -21.609 -12.076 1.00 0.00 O ATOM 0 H GLY A 83 10.776 -18.853 -11.933 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.998 -20.172 -10.581 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.593 -21.513 -11.634 1.00 0.00 H new ATOM 1211 N VAL A 84 13.980 -19.430 -12.633 1.00 0.00 N ATOM 1212 CA VAL A 84 15.248 -19.329 -13.357 1.00 0.00 C ATOM 1213 C VAL A 84 16.430 -19.276 -12.368 1.00 0.00 C ATOM 1214 O VAL A 84 17.089 -18.254 -12.191 1.00 0.00 O ATOM 1215 CB VAL A 84 15.116 -18.228 -14.445 1.00 0.00 C ATOM 1216 CG1 VAL A 84 14.708 -16.840 -13.919 1.00 0.00 C ATOM 1217 CG2 VAL A 84 16.350 -18.110 -15.346 1.00 0.00 C ATOM 0 H VAL A 84 13.501 -18.533 -12.554 1.00 0.00 H new ATOM 0 HA VAL A 84 15.493 -20.221 -13.934 1.00 0.00 H new ATOM 0 HB VAL A 84 14.283 -18.587 -15.050 1.00 0.00 H new ATOM 0 HG11 VAL A 84 14.642 -16.140 -14.752 1.00 0.00 H new ATOM 0 HG12 VAL A 84 13.739 -16.909 -13.425 1.00 0.00 H new ATOM 0 HG13 VAL A 84 15.454 -16.487 -13.207 1.00 0.00 H new ATOM 0 HG21 VAL A 84 16.189 -17.323 -16.082 1.00 0.00 H new ATOM 0 HG22 VAL A 84 17.222 -17.866 -14.739 1.00 0.00 H new ATOM 0 HG23 VAL A 84 16.518 -19.057 -15.859 1.00 0.00 H new ATOM 1227 N ASN A 85 16.659 -20.416 -11.704 1.00 0.00 N ATOM 1228 CA ASN A 85 17.621 -20.630 -10.612 1.00 0.00 C ATOM 1229 C ASN A 85 17.339 -19.627 -9.493 1.00 0.00 C ATOM 1230 O ASN A 85 18.210 -18.887 -9.031 1.00 0.00 O ATOM 1231 CB ASN A 85 19.080 -20.648 -11.100 1.00 0.00 C ATOM 1232 CG ASN A 85 20.053 -21.085 -9.997 1.00 0.00 C ATOM 1233 OD1 ASN A 85 19.674 -21.718 -9.011 1.00 0.00 O ATOM 1234 ND2 ASN A 85 21.339 -20.803 -10.154 1.00 0.00 N ATOM 0 H ASN A 85 16.146 -21.268 -11.928 1.00 0.00 H new ATOM 0 HA ASN A 85 17.482 -21.629 -10.198 1.00 0.00 H new ATOM 0 HB2 ASN A 85 19.169 -21.325 -11.950 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.356 -19.654 -11.453 1.00 0.00 H new ATOM 0 HD21 ASN A 85 22.017 -21.111 -9.457 1.00 0.00 H new ATOM 0 HD22 ASN A 85 21.650 -20.279 -10.972 1.00 0.00 H new ATOM 1241 N LEU A 86 16.057 -19.571 -9.129 1.00 0.00 N ATOM 1242 CA LEU A 86 15.438 -18.582 -8.263 1.00 0.00 C ATOM 1243 C LEU A 86 14.206 -19.259 -7.632 1.00 0.00 C ATOM 1244 O LEU A 86 13.574 -20.055 -8.331 1.00 0.00 O ATOM 1245 CB LEU A 86 15.108 -17.372 -9.169 1.00 0.00 C ATOM 1246 CG LEU A 86 13.995 -16.442 -8.668 1.00 0.00 C ATOM 1247 CD1 LEU A 86 14.261 -14.997 -9.102 1.00 0.00 C ATOM 1248 CD2 LEU A 86 12.656 -16.865 -9.293 1.00 0.00 C ATOM 0 H LEU A 86 15.384 -20.264 -9.456 1.00 0.00 H new ATOM 0 HA LEU A 86 16.061 -18.223 -7.444 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.016 -16.783 -9.300 1.00 0.00 H new ATOM 0 HB3 LEU A 86 14.826 -17.746 -10.153 1.00 0.00 H new ATOM 0 HG LEU A 86 13.965 -16.508 -7.580 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.460 -14.354 -8.737 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.212 -14.662 -8.689 1.00 0.00 H new ATOM 0 HD13 LEU A 86 14.300 -14.945 -10.190 1.00 0.00 H new ATOM 0 HD21 LEU A 86 11.864 -16.205 -8.938 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.724 -16.799 -10.379 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.429 -17.892 -9.006 1.00 0.00 H new ATOM 1260 N PRO A 87 13.842 -18.990 -6.358 1.00 0.00 N ATOM 1261 CA PRO A 87 12.764 -19.736 -5.706 1.00 0.00 C ATOM 1262 C PRO A 87 11.376 -19.421 -6.288 1.00 0.00 C ATOM 1263 O PRO A 87 11.115 -18.274 -6.651 1.00 0.00 O ATOM 1264 CB PRO A 87 12.864 -19.438 -4.203 1.00 0.00 C ATOM 1265 CG PRO A 87 14.293 -18.926 -4.032 1.00 0.00 C ATOM 1266 CD PRO A 87 14.588 -18.232 -5.359 1.00 0.00 C ATOM 0 HA PRO A 87 12.883 -20.804 -5.888 1.00 0.00 H new ATOM 0 HB2 PRO A 87 12.131 -18.693 -3.892 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.684 -20.331 -3.604 1.00 0.00 H new ATOM 0 HG2 PRO A 87 14.374 -18.236 -3.192 1.00 0.00 H new ATOM 0 HG3 PRO A 87 14.991 -19.742 -3.842 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.271 -17.189 -5.338 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.656 -18.236 -5.577 1.00 0.00 H new ATOM 1274 N PRO A 88 10.447 -20.392 -6.350 1.00 0.00 N ATOM 1275 CA PRO A 88 9.185 -20.218 -7.066 1.00 0.00 C ATOM 1276 C PRO A 88 8.199 -19.301 -6.358 1.00 0.00 C ATOM 1277 O PRO A 88 7.385 -18.693 -7.044 1.00 0.00 O ATOM 1278 CB PRO A 88 8.639 -21.634 -7.274 1.00 0.00 C ATOM 1279 CG PRO A 88 9.215 -22.410 -6.091 1.00 0.00 C ATOM 1280 CD PRO A 88 10.589 -21.774 -5.906 1.00 0.00 C ATOM 0 HA PRO A 88 9.348 -19.708 -8.015 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.549 -21.649 -7.273 1.00 0.00 H new ATOM 0 HB3 PRO A 88 8.962 -22.054 -8.226 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.597 -22.305 -5.199 1.00 0.00 H new ATOM 0 HG3 PRO A 88 9.288 -23.476 -6.304 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.905 -21.820 -4.864 1.00 0.00 H new ATOM 0 HD3 PRO A 88 11.345 -22.298 -6.491 1.00 0.00 H new ATOM 1288 N GLU A 89 8.298 -19.101 -5.042 1.00 0.00 N ATOM 1289 CA GLU A 89 7.401 -18.182 -4.344 1.00 0.00 C ATOM 1290 C GLU A 89 7.480 -16.760 -4.927 1.00 0.00 C ATOM 1291 O GLU A 89 6.529 -15.983 -4.824 1.00 0.00 O ATOM 1292 CB GLU A 89 7.703 -18.201 -2.835 1.00 0.00 C ATOM 1293 CG GLU A 89 9.096 -17.656 -2.465 1.00 0.00 C ATOM 1294 CD GLU A 89 9.359 -17.723 -0.949 1.00 0.00 C ATOM 1295 OE1 GLU A 89 9.477 -18.847 -0.401 1.00 0.00 O ATOM 1296 OE2 GLU A 89 9.480 -16.649 -0.312 1.00 0.00 O ATOM 0 H GLU A 89 8.985 -19.560 -4.444 1.00 0.00 H new ATOM 0 HA GLU A 89 6.375 -18.519 -4.492 1.00 0.00 H new ATOM 0 HB2 GLU A 89 6.945 -17.614 -2.316 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.617 -19.225 -2.471 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.860 -18.228 -2.991 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.182 -16.623 -2.802 1.00 0.00 H new ATOM 1303 N TRP A 90 8.599 -16.427 -5.577 1.00 0.00 N ATOM 1304 CA TRP A 90 8.787 -15.155 -6.246 1.00 0.00 C ATOM 1305 C TRP A 90 7.953 -15.071 -7.515 1.00 0.00 C ATOM 1306 O TRP A 90 7.291 -14.061 -7.742 1.00 0.00 O ATOM 1307 CB TRP A 90 10.285 -14.957 -6.478 1.00 0.00 C ATOM 1308 CG TRP A 90 11.014 -14.779 -5.181 1.00 0.00 C ATOM 1309 CD1 TRP A 90 11.720 -15.728 -4.531 1.00 0.00 C ATOM 1310 CD2 TRP A 90 10.978 -13.636 -4.278 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.062 -15.279 -3.269 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.586 -14.006 -3.043 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.436 -12.341 -4.363 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.633 -13.135 -1.945 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.462 -11.463 -3.269 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.058 -11.857 -2.060 1.00 0.00 C ATOM 0 H TRP A 90 9.405 -17.048 -5.649 1.00 0.00 H new ATOM 0 HA TRP A 90 8.429 -14.334 -5.624 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.690 -15.817 -7.011 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.446 -14.085 -7.111 1.00 0.00 H new ATOM 0 HD1 TRP A 90 11.979 -16.695 -4.937 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.598 -15.821 -2.592 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.990 -12.015 -5.291 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.105 -13.442 -1.023 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.022 -10.481 -3.357 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.075 -11.179 -1.219 1.00 0.00 H new ATOM 1327 N VAL A 91 7.920 -16.131 -8.317 1.00 0.00 N ATOM 1328 CA VAL A 91 7.172 -16.142 -9.555 1.00 0.00 C ATOM 1329 C VAL A 91 5.669 -16.349 -9.333 1.00 0.00 C ATOM 1330 O VAL A 91 4.917 -16.341 -10.307 1.00 0.00 O ATOM 1331 CB VAL A 91 7.803 -17.084 -10.599 1.00 0.00 C ATOM 1332 CG1 VAL A 91 9.314 -16.832 -10.737 1.00 0.00 C ATOM 1333 CG2 VAL A 91 7.560 -18.583 -10.374 1.00 0.00 C ATOM 0 H VAL A 91 8.413 -17.002 -8.121 1.00 0.00 H new ATOM 0 HA VAL A 91 7.244 -15.146 -9.991 1.00 0.00 H new ATOM 0 HB VAL A 91 7.282 -16.831 -11.522 1.00 0.00 H new ATOM 0 HG11 VAL A 91 9.730 -17.512 -11.481 1.00 0.00 H new ATOM 0 HG12 VAL A 91 9.484 -15.802 -11.052 1.00 0.00 H new ATOM 0 HG13 VAL A 91 9.801 -17.003 -9.777 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.047 -19.153 -11.165 1.00 0.00 H new ATOM 0 HG22 VAL A 91 7.971 -18.877 -9.408 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.489 -18.784 -10.389 1.00 0.00 H new ATOM 1343 N THR A 92 5.210 -16.520 -8.088 1.00 0.00 N ATOM 1344 CA THR A 92 3.800 -16.756 -7.800 1.00 0.00 C ATOM 1345 C THR A 92 3.101 -15.661 -6.976 1.00 0.00 C ATOM 1346 O THR A 92 2.066 -15.932 -6.354 1.00 0.00 O ATOM 1347 CB THR A 92 3.663 -18.150 -7.165 1.00 0.00 C ATOM 1348 OG1 THR A 92 4.369 -18.211 -5.935 1.00 0.00 O ATOM 1349 CG2 THR A 92 4.217 -19.250 -8.066 1.00 0.00 C ATOM 0 H THR A 92 5.805 -16.498 -7.260 1.00 0.00 H new ATOM 0 HA THR A 92 3.265 -16.715 -8.749 1.00 0.00 H new ATOM 0 HB THR A 92 2.596 -18.310 -7.011 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.270 -19.104 -5.545 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.098 -20.216 -7.576 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.674 -19.254 -9.011 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.275 -19.067 -8.256 1.00 0.00 H new ATOM 1357 N GLN A 93 3.618 -14.423 -6.962 1.00 0.00 N ATOM 1358 CA GLN A 93 2.924 -13.335 -6.281 1.00 0.00 C ATOM 1359 C GLN A 93 1.648 -12.910 -7.031 1.00 0.00 C ATOM 1360 O GLN A 93 1.310 -13.493 -8.065 1.00 0.00 O ATOM 1361 CB GLN A 93 3.892 -12.198 -5.898 1.00 0.00 C ATOM 1362 CG GLN A 93 4.908 -12.665 -4.838 1.00 0.00 C ATOM 1363 CD GLN A 93 4.223 -13.351 -3.644 1.00 0.00 C ATOM 1364 OE1 GLN A 93 3.279 -12.822 -3.055 1.00 0.00 O ATOM 1365 NE2 GLN A 93 4.597 -14.580 -3.320 1.00 0.00 N ATOM 0 H GLN A 93 4.497 -14.159 -7.407 1.00 0.00 H new ATOM 0 HA GLN A 93 2.551 -13.699 -5.324 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.422 -11.853 -6.786 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.326 -11.349 -5.514 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.617 -13.356 -5.295 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.481 -11.808 -4.484 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.378 -15.020 -3.806 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.104 -15.086 -2.584 1.00 0.00 H new ATOM 1374 N GLU A 94 0.915 -11.921 -6.494 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.436 -11.553 -6.949 1.00 0.00 C ATOM 1376 C GLU A 94 -0.492 -11.243 -8.451 1.00 0.00 C ATOM 1377 O GLU A 94 -1.525 -11.440 -9.098 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.980 -10.365 -6.136 1.00 0.00 C ATOM 1379 CG GLU A 94 -1.109 -10.647 -4.632 1.00 0.00 C ATOM 1380 CD GLU A 94 -2.081 -11.805 -4.331 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.318 -11.593 -4.384 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.619 -12.933 -4.036 1.00 0.00 O ATOM 0 H GLU A 94 1.249 -11.346 -5.720 1.00 0.00 H new ATOM 0 HA GLU A 94 -1.070 -12.423 -6.779 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.323 -9.508 -6.280 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.958 -10.086 -6.529 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.127 -10.886 -4.225 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.454 -9.746 -4.125 1.00 0.00 H new ATOM 1389 N ILE A 95 0.626 -10.772 -9.001 1.00 0.00 N ATOM 1390 CA ILE A 95 0.877 -10.635 -10.422 1.00 0.00 C ATOM 1391 C ILE A 95 2.294 -11.180 -10.617 1.00 0.00 C ATOM 1392 O ILE A 95 3.180 -10.932 -9.788 1.00 0.00 O ATOM 1393 CB ILE A 95 0.677 -9.182 -10.915 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.134 -9.032 -12.386 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.405 -8.173 -10.011 1.00 0.00 C ATOM 1396 CD1 ILE A 95 0.558 -7.792 -13.088 1.00 0.00 C ATOM 0 H ILE A 95 1.415 -10.462 -8.434 1.00 0.00 H new ATOM 0 HA ILE A 95 0.166 -11.192 -11.032 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.389 -8.961 -10.863 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.222 -8.983 -12.416 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.840 -9.923 -12.941 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.242 -7.163 -10.388 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.017 -8.248 -8.995 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.473 -8.391 -10.008 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.922 -7.753 -14.115 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.531 -7.848 -13.091 1.00 0.00 H new ATOM 0 HD13 ILE A 95 0.874 -6.894 -12.557 1.00 0.00 H new ATOM 1408 N PHE A 96 2.491 -11.922 -11.702 1.00 0.00 N ATOM 1409 CA PHE A 96 3.794 -12.341 -12.171 1.00 0.00 C ATOM 1410 C PHE A 96 3.886 -11.906 -13.637 1.00 0.00 C ATOM 1411 O PHE A 96 2.900 -12.027 -14.372 1.00 0.00 O ATOM 1412 CB PHE A 96 4.004 -13.843 -12.021 1.00 0.00 C ATOM 1413 CG PHE A 96 5.347 -14.286 -12.568 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.534 -13.754 -12.029 1.00 0.00 C ATOM 1415 CD2 PHE A 96 5.412 -15.186 -13.649 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.780 -14.121 -12.563 1.00 0.00 C ATOM 1417 CE2 PHE A 96 6.661 -15.555 -14.182 1.00 0.00 C ATOM 1418 CZ PHE A 96 7.844 -15.024 -13.640 1.00 0.00 C ATOM 0 H PHE A 96 1.726 -12.253 -12.289 1.00 0.00 H new ATOM 0 HA PHE A 96 4.580 -11.880 -11.573 1.00 0.00 H new ATOM 0 HB2 PHE A 96 3.934 -14.116 -10.968 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.207 -14.374 -12.542 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.486 -13.061 -11.202 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.504 -15.593 -14.069 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.688 -13.710 -12.147 1.00 0.00 H new ATOM 0 HE2 PHE A 96 6.711 -16.248 -15.009 1.00 0.00 H new ATOM 0 HZ PHE A 96 8.802 -15.309 -14.050 1.00 0.00 H new ATOM 1428 N GLU A 97 5.047 -11.422 -14.066 1.00 0.00 N ATOM 1429 CA GLU A 97 5.373 -11.161 -15.461 1.00 0.00 C ATOM 1430 C GLU A 97 6.836 -11.546 -15.668 1.00 0.00 C ATOM 1431 O GLU A 97 7.590 -11.720 -14.705 1.00 0.00 O ATOM 1432 CB GLU A 97 5.168 -9.700 -15.887 1.00 0.00 C ATOM 1433 CG GLU A 97 3.763 -9.113 -15.673 1.00 0.00 C ATOM 1434 CD GLU A 97 2.706 -9.622 -16.680 1.00 0.00 C ATOM 1435 OE1 GLU A 97 2.991 -10.481 -17.551 1.00 0.00 O ATOM 1436 OE2 GLU A 97 1.563 -9.108 -16.627 1.00 0.00 O ATOM 0 H GLU A 97 5.811 -11.194 -13.430 1.00 0.00 H new ATOM 0 HA GLU A 97 4.693 -11.749 -16.078 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.882 -9.083 -15.342 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.415 -9.615 -16.945 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.431 -9.352 -14.663 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.821 -8.027 -15.741 1.00 0.00 H new ATOM 1443 N ASP A 98 7.212 -11.692 -16.933 1.00 0.00 N ATOM 1444 CA ASP A 98 8.504 -12.177 -17.375 1.00 0.00 C ATOM 1445 C ASP A 98 8.614 -11.890 -18.862 1.00 0.00 C ATOM 1446 O ASP A 98 7.679 -12.188 -19.617 1.00 0.00 O ATOM 1447 CB ASP A 98 8.712 -13.672 -17.154 1.00 0.00 C ATOM 1448 CG ASP A 98 10.095 -14.039 -17.713 1.00 0.00 C ATOM 1449 OD1 ASP A 98 11.105 -13.493 -17.201 1.00 0.00 O ATOM 1450 OD2 ASP A 98 10.162 -14.833 -18.682 1.00 0.00 O ATOM 0 H ASP A 98 6.592 -11.464 -17.710 1.00 0.00 H new ATOM 0 HA ASP A 98 9.266 -11.668 -16.784 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.652 -13.914 -16.093 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.932 -14.245 -17.656 1.00 0.00 H new ATOM 1455 N TRP A 99 9.733 -11.309 -19.283 1.00 0.00 N ATOM 1456 CA TRP A 99 9.900 -10.775 -20.625 1.00 0.00 C ATOM 1457 C TRP A 99 11.375 -10.877 -20.989 1.00 0.00 C ATOM 1458 O TRP A 99 12.225 -10.615 -20.138 1.00 0.00 O ATOM 1459 CB TRP A 99 9.490 -9.296 -20.623 1.00 0.00 C ATOM 1460 CG TRP A 99 8.143 -8.914 -20.082 1.00 0.00 C ATOM 1461 CD1 TRP A 99 6.929 -9.341 -20.497 1.00 0.00 C ATOM 1462 CD2 TRP A 99 7.877 -8.005 -18.980 1.00 0.00 C ATOM 1463 NE1 TRP A 99 5.940 -8.751 -19.726 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.470 -7.882 -18.803 1.00 0.00 C ATOM 1465 CE3 TRP A 99 8.699 -7.258 -18.119 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 5.901 -7.042 -17.834 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 8.140 -6.475 -17.103 1.00 0.00 C ATOM 1468 CH2 TRP A 99 6.751 -6.350 -16.958 1.00 0.00 C ATOM 0 H TRP A 99 10.557 -11.196 -18.693 1.00 0.00 H new ATOM 0 HA TRP A 99 9.289 -11.327 -21.339 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.241 -8.747 -20.054 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.545 -8.938 -21.651 1.00 0.00 H new ATOM 0 HD1 TRP A 99 6.756 -10.036 -21.306 1.00 0.00 H new ATOM 0 HE1 TRP A 99 4.943 -8.938 -19.831 1.00 0.00 H new ATOM 0 HE3 TRP A 99 9.771 -7.289 -18.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.829 -6.930 -17.764 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 8.792 -5.956 -16.416 1.00 0.00 H new ATOM 0 HH2 TRP A 99 6.339 -5.726 -16.179 1.00 0.00 H new ATOM 1479 N GLN A 100 11.696 -11.172 -22.250 1.00 0.00 N ATOM 1480 CA GLN A 100 13.071 -11.158 -22.740 1.00 0.00 C ATOM 1481 C GLN A 100 13.409 -9.713 -23.142 1.00 0.00 C ATOM 1482 O GLN A 100 13.295 -9.346 -24.313 1.00 0.00 O ATOM 1483 CB GLN A 100 13.216 -12.194 -23.873 1.00 0.00 C ATOM 1484 CG GLN A 100 14.669 -12.374 -24.338 1.00 0.00 C ATOM 1485 CD GLN A 100 14.783 -13.443 -25.429 1.00 0.00 C ATOM 1486 OE1 GLN A 100 15.176 -14.580 -25.168 1.00 0.00 O ATOM 1487 NE2 GLN A 100 14.441 -13.118 -26.668 1.00 0.00 N ATOM 0 H GLN A 100 11.008 -11.427 -22.959 1.00 0.00 H new ATOM 0 HA GLN A 100 13.794 -11.455 -21.980 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.828 -13.154 -23.532 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.604 -11.885 -24.721 1.00 0.00 H new ATOM 0 HG2 GLN A 100 15.051 -11.426 -24.716 1.00 0.00 H new ATOM 0 HG3 GLN A 100 15.292 -12.653 -23.488 1.00 0.00 H new ATOM 0 HE21 GLN A 100 14.116 -12.174 -26.876 1.00 0.00 H new ATOM 0 HE22 GLN A 100 14.503 -13.812 -27.413 1.00 0.00 H new ATOM 1496 N LEU A 101 13.784 -8.879 -22.164 1.00 0.00 N ATOM 1497 CA LEU A 101 14.278 -7.531 -22.449 1.00 0.00 C ATOM 1498 C LEU A 101 15.643 -7.643 -23.119 1.00 0.00 C ATOM 1499 O LEU A 101 16.456 -8.483 -22.729 1.00 0.00 O ATOM 1500 CB LEU A 101 14.401 -6.650 -21.186 1.00 0.00 C ATOM 1501 CG LEU A 101 13.127 -5.915 -20.770 1.00 0.00 C ATOM 1502 CD1 LEU A 101 12.581 -4.957 -21.839 1.00 0.00 C ATOM 1503 CD2 LEU A 101 12.038 -6.891 -20.340 1.00 0.00 C ATOM 0 H LEU A 101 13.754 -9.115 -21.172 1.00 0.00 H new ATOM 0 HA LEU A 101 13.551 -7.048 -23.102 1.00 0.00 H new ATOM 0 HB2 LEU A 101 14.725 -7.278 -20.356 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.187 -5.913 -21.353 1.00 0.00 H new ATOM 0 HG LEU A 101 13.420 -5.299 -19.920 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.677 -4.475 -21.468 1.00 0.00 H new ATOM 0 HD12 LEU A 101 13.330 -4.198 -22.065 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.348 -5.517 -22.744 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.146 -6.336 -20.050 1.00 0.00 H new ATOM 0 HD22 LEU A 101 11.798 -7.557 -21.169 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.390 -7.479 -19.493 1.00 0.00 H new ATOM 1515 N GLU A 102 15.907 -6.790 -24.108 1.00 0.00 N ATOM 1516 CA GLU A 102 17.244 -6.640 -24.653 1.00 0.00 C ATOM 1517 C GLU A 102 18.070 -5.867 -23.613 1.00 0.00 C ATOM 1518 O GLU A 102 17.513 -5.144 -22.784 1.00 0.00 O ATOM 1519 CB GLU A 102 17.217 -5.941 -26.024 1.00 0.00 C ATOM 1520 CG GLU A 102 16.592 -6.837 -27.100 1.00 0.00 C ATOM 1521 CD GLU A 102 16.501 -6.115 -28.456 1.00 0.00 C ATOM 1522 OE1 GLU A 102 17.503 -6.099 -29.213 1.00 0.00 O ATOM 1523 OE2 GLU A 102 15.415 -5.575 -28.779 1.00 0.00 O ATOM 0 H GLU A 102 15.205 -6.193 -24.546 1.00 0.00 H new ATOM 0 HA GLU A 102 17.701 -7.612 -24.837 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.651 -5.012 -25.949 1.00 0.00 H new ATOM 0 HB3 GLU A 102 18.232 -5.673 -26.317 1.00 0.00 H new ATOM 0 HG2 GLU A 102 17.187 -7.744 -27.209 1.00 0.00 H new ATOM 0 HG3 GLU A 102 15.595 -7.145 -26.784 1.00 0.00 H new ATOM 1530 N ASP A 103 19.398 -6.000 -23.651 1.00 0.00 N ATOM 1531 CA ASP A 103 20.307 -5.281 -22.775 1.00 0.00 C ATOM 1532 C ASP A 103 21.397 -4.618 -23.620 1.00 0.00 C ATOM 1533 O ASP A 103 21.964 -5.269 -24.505 1.00 0.00 O ATOM 1534 CB ASP A 103 20.884 -6.201 -21.702 1.00 0.00 C ATOM 1535 CG ASP A 103 21.749 -5.405 -20.720 1.00 0.00 C ATOM 1536 OD1 ASP A 103 22.869 -4.999 -21.098 1.00 0.00 O ATOM 1537 OD2 ASP A 103 21.294 -5.161 -19.576 1.00 0.00 O ATOM 0 H ASP A 103 19.873 -6.622 -24.305 1.00 0.00 H new ATOM 0 HA ASP A 103 19.761 -4.501 -22.244 1.00 0.00 H new ATOM 0 HB2 ASP A 103 20.074 -6.695 -21.165 1.00 0.00 H new ATOM 0 HB3 ASP A 103 21.481 -6.984 -22.169 1.00 0.00 H new ATOM 1542 N PRO A 104 21.669 -3.321 -23.416 1.00 0.00 N ATOM 1543 CA PRO A 104 22.526 -2.540 -24.294 1.00 0.00 C ATOM 1544 C PRO A 104 24.032 -2.615 -23.979 1.00 0.00 C ATOM 1545 O PRO A 104 24.810 -2.114 -24.787 1.00 0.00 O ATOM 1546 CB PRO A 104 21.998 -1.121 -24.121 1.00 0.00 C ATOM 1547 CG PRO A 104 21.599 -1.073 -22.649 1.00 0.00 C ATOM 1548 CD PRO A 104 20.969 -2.444 -22.483 1.00 0.00 C ATOM 0 HA PRO A 104 22.480 -2.922 -25.314 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.759 -0.377 -24.356 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.148 -0.925 -24.775 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.457 -0.930 -21.992 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.897 -0.267 -22.437 1.00 0.00 H new ATOM 0 HD2 PRO A 104 21.074 -2.801 -21.458 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.902 -2.413 -22.702 1.00 0.00 H new ATOM 1556 N ASP A 105 24.458 -3.223 -22.860 1.00 0.00 N ATOM 1557 CA ASP A 105 25.843 -3.134 -22.376 1.00 0.00 C ATOM 1558 C ASP A 105 26.893 -3.448 -23.449 1.00 0.00 C ATOM 1559 O ASP A 105 27.831 -2.673 -23.667 1.00 0.00 O ATOM 1560 CB ASP A 105 26.080 -4.067 -21.185 1.00 0.00 C ATOM 1561 CG ASP A 105 27.589 -4.150 -20.861 1.00 0.00 C ATOM 1562 OD1 ASP A 105 28.196 -3.115 -20.497 1.00 0.00 O ATOM 1563 OD2 ASP A 105 28.175 -5.251 -21.007 1.00 0.00 O ATOM 0 H ASP A 105 23.852 -3.789 -22.267 1.00 0.00 H new ATOM 0 HA ASP A 105 25.966 -2.093 -22.077 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.534 -3.703 -20.315 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.694 -5.061 -21.411 1.00 0.00 H new ATOM 1568 N GLY A 106 26.727 -4.586 -24.129 1.00 0.00 N ATOM 1569 CA GLY A 106 27.712 -5.105 -25.069 1.00 0.00 C ATOM 1570 C GLY A 106 27.603 -4.510 -26.475 1.00 0.00 C ATOM 1571 O GLY A 106 28.233 -5.049 -27.391 1.00 0.00 O ATOM 0 H GLY A 106 25.898 -5.174 -24.039 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.711 -4.909 -24.679 1.00 0.00 H new ATOM 0 HA3 GLY A 106 27.602 -6.188 -25.134 1.00 0.00 H new ATOM 1575 N GLN A 107 26.786 -3.469 -26.687 1.00 0.00 N ATOM 1576 CA GLN A 107 26.444 -2.972 -28.019 1.00 0.00 C ATOM 1577 C GLN A 107 26.200 -1.448 -28.037 1.00 0.00 C ATOM 1578 O GLN A 107 26.615 -0.727 -27.124 1.00 0.00 O ATOM 1579 CB GLN A 107 25.291 -3.828 -28.585 1.00 0.00 C ATOM 1580 CG GLN A 107 24.017 -3.824 -27.735 1.00 0.00 C ATOM 1581 CD GLN A 107 23.029 -4.899 -28.223 1.00 0.00 C ATOM 1582 OE1 GLN A 107 22.884 -5.145 -29.419 1.00 0.00 O ATOM 1583 NE2 GLN A 107 22.332 -5.581 -27.325 1.00 0.00 N ATOM 0 H GLN A 107 26.343 -2.947 -25.931 1.00 0.00 H new ATOM 0 HA GLN A 107 27.293 -3.089 -28.693 1.00 0.00 H new ATOM 0 HB2 GLN A 107 25.046 -3.469 -29.585 1.00 0.00 H new ATOM 0 HB3 GLN A 107 25.638 -4.856 -28.692 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.271 -4.005 -26.691 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.546 -2.842 -27.783 1.00 0.00 H new ATOM 0 HE21 GLN A 107 22.448 -5.382 -26.331 1.00 0.00 H new ATOM 0 HE22 GLN A 107 21.680 -6.305 -27.628 1.00 0.00 H new ATOM 1592 N SER A 108 25.574 -0.961 -29.112 1.00 0.00 N ATOM 1593 CA SER A 108 25.469 0.453 -29.453 1.00 0.00 C ATOM 1594 C SER A 108 24.593 1.337 -28.555 1.00 0.00 C ATOM 1595 O SER A 108 23.629 0.882 -27.938 1.00 0.00 O ATOM 1596 CB SER A 108 25.036 0.569 -30.930 1.00 0.00 C ATOM 1597 OG SER A 108 25.665 -0.426 -31.735 1.00 0.00 O ATOM 0 H SER A 108 25.111 -1.566 -29.791 1.00 0.00 H new ATOM 0 HA SER A 108 26.465 0.860 -29.277 1.00 0.00 H new ATOM 0 HB2 SER A 108 23.953 0.467 -31.003 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.289 1.559 -31.309 1.00 0.00 H new ATOM 0 HG SER A 108 25.370 -0.329 -32.665 1.00 0.00 H new ATOM 1603 N LEU A 109 24.857 2.652 -28.617 1.00 0.00 N ATOM 1604 CA LEU A 109 24.063 3.738 -28.036 1.00 0.00 C ATOM 1605 C LEU A 109 22.611 3.682 -28.494 1.00 0.00 C ATOM 1606 O LEU A 109 21.706 3.956 -27.713 1.00 0.00 O ATOM 1607 CB LEU A 109 24.726 5.057 -28.482 1.00 0.00 C ATOM 1608 CG LEU A 109 24.065 6.339 -27.952 1.00 0.00 C ATOM 1609 CD1 LEU A 109 24.077 6.377 -26.424 1.00 0.00 C ATOM 1610 CD2 LEU A 109 24.827 7.543 -28.510 1.00 0.00 C ATOM 0 H LEU A 109 25.681 3.003 -29.105 1.00 0.00 H new ATOM 0 HA LEU A 109 24.042 3.653 -26.950 1.00 0.00 H new ATOM 0 HB2 LEU A 109 25.768 5.047 -28.162 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.728 5.093 -29.571 1.00 0.00 H new ATOM 0 HG LEU A 109 23.024 6.364 -28.275 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.603 7.296 -26.079 1.00 0.00 H new ATOM 0 HD12 LEU A 109 23.531 5.518 -26.034 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.106 6.344 -26.067 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.372 8.463 -28.144 1.00 0.00 H new ATOM 0 HD22 LEU A 109 25.866 7.498 -28.185 1.00 0.00 H new ATOM 0 HD23 LEU A 109 24.787 7.526 -29.599 1.00 0.00 H new ATOM 1622 N GLU A 110 22.378 3.261 -29.736 1.00 0.00 N ATOM 1623 CA GLU A 110 21.034 3.110 -30.280 1.00 0.00 C ATOM 1624 C GLU A 110 20.242 2.064 -29.489 1.00 0.00 C ATOM 1625 O GLU A 110 19.035 2.203 -29.293 1.00 0.00 O ATOM 1626 CB GLU A 110 21.134 2.783 -31.778 1.00 0.00 C ATOM 1627 CG GLU A 110 19.893 3.215 -32.568 1.00 0.00 C ATOM 1628 CD GLU A 110 19.880 4.728 -32.893 1.00 0.00 C ATOM 1629 OE1 GLU A 110 19.981 5.569 -31.966 1.00 0.00 O ATOM 1630 OE2 GLU A 110 19.761 5.084 -34.092 1.00 0.00 O ATOM 0 H GLU A 110 23.119 3.015 -30.393 1.00 0.00 H new ATOM 0 HA GLU A 110 20.480 4.043 -30.179 1.00 0.00 H new ATOM 0 HB2 GLU A 110 22.013 3.275 -32.194 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.282 1.710 -31.901 1.00 0.00 H new ATOM 0 HG2 GLU A 110 19.846 2.649 -33.498 1.00 0.00 H new ATOM 0 HG3 GLU A 110 19.000 2.964 -31.996 1.00 0.00 H new ATOM 1637 N VAL A 111 20.919 1.040 -28.964 1.00 0.00 N ATOM 1638 CA VAL A 111 20.292 0.012 -28.153 1.00 0.00 C ATOM 1639 C VAL A 111 20.019 0.551 -26.751 1.00 0.00 C ATOM 1640 O VAL A 111 18.953 0.265 -26.226 1.00 0.00 O ATOM 1641 CB VAL A 111 21.106 -1.295 -28.155 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.257 -2.450 -27.602 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.575 -1.671 -29.575 1.00 0.00 C ATOM 0 H VAL A 111 21.922 0.907 -29.094 1.00 0.00 H new ATOM 0 HA VAL A 111 19.330 -0.249 -28.594 1.00 0.00 H new ATOM 0 HB VAL A 111 21.980 -1.130 -27.525 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.844 -3.369 -27.609 1.00 0.00 H new ATOM 0 HG12 VAL A 111 19.953 -2.221 -26.581 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.371 -2.581 -28.224 1.00 0.00 H new ATOM 0 HG21 VAL A 111 22.146 -2.599 -29.536 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.707 -1.806 -30.221 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.204 -0.875 -29.973 1.00 0.00 H new ATOM 1653 N PHE A 112 20.892 1.373 -26.151 1.00 0.00 N ATOM 1654 CA PHE A 112 20.567 2.057 -24.886 1.00 0.00 C ATOM 1655 C PHE A 112 19.291 2.890 -25.065 1.00 0.00 C ATOM 1656 O PHE A 112 18.354 2.756 -24.280 1.00 0.00 O ATOM 1657 CB PHE A 112 21.725 2.955 -24.409 1.00 0.00 C ATOM 1658 CG PHE A 112 22.890 2.232 -23.756 1.00 0.00 C ATOM 1659 CD1 PHE A 112 22.852 1.928 -22.382 1.00 0.00 C ATOM 1660 CD2 PHE A 112 24.009 1.841 -24.517 1.00 0.00 C ATOM 1661 CE1 PHE A 112 23.897 1.195 -21.787 1.00 0.00 C ATOM 1662 CE2 PHE A 112 25.051 1.107 -23.925 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.984 0.764 -22.565 1.00 0.00 C ATOM 0 H PHE A 112 21.822 1.581 -26.516 1.00 0.00 H new ATOM 0 HA PHE A 112 20.406 1.297 -24.122 1.00 0.00 H new ATOM 0 HB2 PHE A 112 22.102 3.516 -25.264 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.329 3.682 -23.700 1.00 0.00 H new ATOM 0 HD1 PHE A 112 22.018 2.258 -21.781 1.00 0.00 H new ATOM 0 HD2 PHE A 112 24.067 2.107 -25.562 1.00 0.00 H new ATOM 0 HE1 PHE A 112 23.863 0.964 -20.732 1.00 0.00 H new ATOM 0 HE2 PHE A 112 25.903 0.807 -24.516 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.767 0.170 -22.118 1.00 0.00 H new ATOM 1673 N ARG A 113 19.213 3.679 -26.141 1.00 0.00 N ATOM 1674 CA ARG A 113 18.036 4.499 -26.457 1.00 0.00 C ATOM 1675 C ARG A 113 16.787 3.622 -26.621 1.00 0.00 C ATOM 1676 O ARG A 113 15.741 3.932 -26.055 1.00 0.00 O ATOM 1677 CB ARG A 113 18.317 5.300 -27.745 1.00 0.00 C ATOM 1678 CG ARG A 113 19.366 6.414 -27.568 1.00 0.00 C ATOM 1679 CD ARG A 113 19.991 6.746 -28.927 1.00 0.00 C ATOM 1680 NE ARG A 113 20.740 8.012 -28.929 1.00 0.00 N ATOM 1681 CZ ARG A 113 21.307 8.554 -30.017 1.00 0.00 C ATOM 1682 NH1 ARG A 113 21.236 7.942 -31.198 1.00 0.00 N ATOM 1683 NH2 ARG A 113 21.951 9.715 -29.916 1.00 0.00 N ATOM 0 H ARG A 113 19.968 3.768 -26.822 1.00 0.00 H new ATOM 0 HA ARG A 113 17.844 5.189 -25.635 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.656 4.614 -28.521 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.385 5.744 -28.096 1.00 0.00 H new ATOM 0 HG2 ARG A 113 18.900 7.303 -27.143 1.00 0.00 H new ATOM 0 HG3 ARG A 113 20.138 6.094 -26.869 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.659 5.936 -29.219 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.203 6.797 -29.679 1.00 0.00 H new ATOM 0 HE ARG A 113 20.834 8.511 -28.044 1.00 0.00 H new ATOM 0 HH11 ARG A 113 20.746 7.051 -31.282 1.00 0.00 H new ATOM 0 HH12 ARG A 113 21.671 8.364 -32.018 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.011 10.188 -29.014 1.00 0.00 H new ATOM 0 HH22 ARG A 113 22.384 10.131 -30.740 1.00 0.00 H new ATOM 1697 N THR A 114 16.905 2.497 -27.325 1.00 0.00 N ATOM 1698 CA THR A 114 15.828 1.557 -27.541 1.00 0.00 C ATOM 1699 C THR A 114 15.392 0.933 -26.216 1.00 0.00 C ATOM 1700 O THR A 114 14.200 0.907 -25.921 1.00 0.00 O ATOM 1701 CB THR A 114 16.358 0.518 -28.542 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.475 1.087 -29.835 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.489 -0.729 -28.611 1.00 0.00 C ATOM 0 H THR A 114 17.779 2.215 -27.769 1.00 0.00 H new ATOM 0 HA THR A 114 14.937 2.038 -27.945 1.00 0.00 H new ATOM 0 HB THR A 114 17.341 0.214 -28.181 1.00 0.00 H new ATOM 0 HG1 THR A 114 17.336 1.548 -29.913 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.911 -1.427 -29.334 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.451 -1.201 -27.629 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.481 -0.453 -28.920 1.00 0.00 H new ATOM 1711 N VAL A 115 16.321 0.439 -25.397 1.00 0.00 N ATOM 1712 CA VAL A 115 15.982 -0.356 -24.229 1.00 0.00 C ATOM 1713 C VAL A 115 15.334 0.525 -23.172 1.00 0.00 C ATOM 1714 O VAL A 115 14.432 0.052 -22.488 1.00 0.00 O ATOM 1715 CB VAL A 115 17.206 -1.173 -23.758 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.958 -1.862 -22.408 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.508 -2.267 -24.798 1.00 0.00 C ATOM 0 H VAL A 115 17.323 0.581 -25.528 1.00 0.00 H new ATOM 0 HA VAL A 115 15.230 -1.106 -24.475 1.00 0.00 H new ATOM 0 HB VAL A 115 18.039 -0.479 -23.646 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.846 -2.424 -22.118 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.741 -1.109 -21.650 1.00 0.00 H new ATOM 0 HG13 VAL A 115 16.111 -2.542 -22.497 1.00 0.00 H new ATOM 0 HG21 VAL A 115 18.371 -2.849 -24.474 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.644 -2.924 -24.897 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.724 -1.804 -25.761 1.00 0.00 H new ATOM 1727 N ARG A 116 15.672 1.819 -23.097 1.00 0.00 N ATOM 1728 CA ARG A 116 14.913 2.735 -22.247 1.00 0.00 C ATOM 1729 C ARG A 116 13.440 2.713 -22.657 1.00 0.00 C ATOM 1730 O ARG A 116 12.590 2.509 -21.798 1.00 0.00 O ATOM 1731 CB ARG A 116 15.495 4.164 -22.272 1.00 0.00 C ATOM 1732 CG ARG A 116 16.800 4.293 -21.468 1.00 0.00 C ATOM 1733 CD ARG A 116 17.173 5.752 -21.151 1.00 0.00 C ATOM 1734 NE ARG A 116 17.808 6.457 -22.289 1.00 0.00 N ATOM 1735 CZ ARG A 116 17.250 7.292 -23.181 1.00 0.00 C ATOM 1736 NH1 ARG A 116 15.936 7.504 -23.204 1.00 0.00 N ATOM 1737 NH2 ARG A 116 18.020 7.913 -24.069 1.00 0.00 N ATOM 0 H ARG A 116 16.448 2.245 -23.603 1.00 0.00 H new ATOM 0 HA ARG A 116 14.993 2.395 -21.214 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.680 4.457 -23.305 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.757 4.859 -21.871 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.701 3.739 -20.535 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.612 3.830 -22.029 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.274 6.293 -20.854 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.852 5.769 -20.298 1.00 0.00 H new ATOM 0 HE ARG A 116 18.806 6.285 -22.412 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.331 7.028 -22.535 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.534 8.143 -23.891 1.00 0.00 H new ATOM 0 HH21 ARG A 116 19.028 7.754 -24.070 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.603 8.548 -24.749 1.00 0.00 H new ATOM 1751 N GLY A 117 13.142 2.823 -23.951 1.00 0.00 N ATOM 1752 CA GLY A 117 11.775 2.766 -24.467 1.00 0.00 C ATOM 1753 C GLY A 117 11.110 1.419 -24.180 1.00 0.00 C ATOM 1754 O GLY A 117 10.002 1.397 -23.641 1.00 0.00 O ATOM 0 H GLY A 117 13.847 2.955 -24.676 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.185 3.565 -24.018 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.786 2.943 -25.542 1.00 0.00 H new ATOM 1758 N GLN A 118 11.797 0.305 -24.477 1.00 0.00 N ATOM 1759 CA GLN A 118 11.268 -1.050 -24.276 1.00 0.00 C ATOM 1760 C GLN A 118 10.842 -1.236 -22.825 1.00 0.00 C ATOM 1761 O GLN A 118 9.715 -1.620 -22.521 1.00 0.00 O ATOM 1762 CB GLN A 118 12.315 -2.124 -24.615 1.00 0.00 C ATOM 1763 CG GLN A 118 12.634 -2.202 -26.108 1.00 0.00 C ATOM 1764 CD GLN A 118 13.525 -3.393 -26.466 1.00 0.00 C ATOM 1765 OE1 GLN A 118 14.181 -3.999 -25.620 1.00 0.00 O ATOM 1766 NE2 GLN A 118 13.563 -3.732 -27.741 1.00 0.00 N ATOM 0 H GLN A 118 12.740 0.321 -24.865 1.00 0.00 H new ATOM 0 HA GLN A 118 10.414 -1.165 -24.943 1.00 0.00 H new ATOM 0 HB2 GLN A 118 13.232 -1.915 -24.064 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.954 -3.095 -24.276 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.703 -2.270 -26.670 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.127 -1.280 -26.418 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.010 -3.214 -28.423 1.00 0.00 H new ATOM 0 HE22 GLN A 118 14.146 -4.512 -28.044 1.00 0.00 H new ATOM 1775 N VAL A 119 11.770 -0.936 -21.922 1.00 0.00 N ATOM 1776 CA VAL A 119 11.582 -1.144 -20.494 1.00 0.00 C ATOM 1777 C VAL A 119 10.507 -0.192 -19.975 1.00 0.00 C ATOM 1778 O VAL A 119 9.633 -0.649 -19.248 1.00 0.00 O ATOM 1779 CB VAL A 119 12.925 -0.975 -19.767 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.746 -1.097 -18.253 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.928 -2.059 -20.186 1.00 0.00 C ATOM 0 H VAL A 119 12.678 -0.540 -22.164 1.00 0.00 H new ATOM 0 HA VAL A 119 11.236 -2.159 -20.299 1.00 0.00 H new ATOM 0 HB VAL A 119 13.298 0.013 -20.036 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.711 -0.974 -17.761 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.060 -0.325 -17.904 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.339 -2.079 -18.013 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.868 -1.911 -19.654 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.524 -3.042 -19.943 1.00 0.00 H new ATOM 0 HG23 VAL A 119 14.105 -1.995 -21.260 1.00 0.00 H new ATOM 1791 N LYS A 120 10.527 1.091 -20.353 1.00 0.00 N ATOM 1792 CA LYS A 120 9.543 2.066 -19.881 1.00 0.00 C ATOM 1793 C LYS A 120 8.144 1.554 -20.189 1.00 0.00 C ATOM 1794 O LYS A 120 7.293 1.554 -19.308 1.00 0.00 O ATOM 1795 CB LYS A 120 9.791 3.411 -20.579 1.00 0.00 C ATOM 1796 CG LYS A 120 8.879 4.532 -20.056 1.00 0.00 C ATOM 1797 CD LYS A 120 9.263 5.877 -20.696 1.00 0.00 C ATOM 1798 CE LYS A 120 8.335 7.032 -20.278 1.00 0.00 C ATOM 1799 NZ LYS A 120 7.003 6.981 -20.937 1.00 0.00 N ATOM 0 H LYS A 120 11.222 1.479 -20.991 1.00 0.00 H new ATOM 0 HA LYS A 120 9.637 2.205 -18.804 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.832 3.701 -20.439 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.635 3.293 -21.651 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.839 4.298 -20.282 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.962 4.601 -18.971 1.00 0.00 H new ATOM 0 HD2 LYS A 120 10.288 6.124 -20.420 1.00 0.00 H new ATOM 0 HD3 LYS A 120 9.241 5.776 -21.781 1.00 0.00 H new ATOM 0 HE2 LYS A 120 8.199 7.007 -19.197 1.00 0.00 H new ATOM 0 HE3 LYS A 120 8.816 7.981 -20.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 6.489 7.866 -20.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 7.127 6.862 -21.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 6.459 6.179 -20.559 1.00 0.00 H new ATOM 1813 N GLU A 121 7.923 1.069 -21.406 1.00 0.00 N ATOM 1814 CA GLU A 121 6.618 0.624 -21.850 1.00 0.00 C ATOM 1815 C GLU A 121 6.171 -0.641 -21.097 1.00 0.00 C ATOM 1816 O GLU A 121 5.030 -0.701 -20.633 1.00 0.00 O ATOM 1817 CB GLU A 121 6.705 0.439 -23.368 1.00 0.00 C ATOM 1818 CG GLU A 121 5.365 0.012 -23.973 1.00 0.00 C ATOM 1819 CD GLU A 121 5.430 -0.035 -25.508 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.133 0.996 -26.163 1.00 0.00 O ATOM 1821 OE2 GLU A 121 5.759 -1.106 -26.076 1.00 0.00 O ATOM 0 H GLU A 121 8.653 0.975 -22.113 1.00 0.00 H new ATOM 0 HA GLU A 121 5.846 1.360 -21.624 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.030 1.372 -23.829 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.462 -0.311 -23.599 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.088 -0.970 -23.589 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.586 0.708 -23.662 1.00 0.00 H new ATOM 1828 N ARG A 122 7.060 -1.626 -20.901 1.00 0.00 N ATOM 1829 CA ARG A 122 6.707 -2.842 -20.152 1.00 0.00 C ATOM 1830 C ARG A 122 6.441 -2.524 -18.682 1.00 0.00 C ATOM 1831 O ARG A 122 5.468 -3.013 -18.110 1.00 0.00 O ATOM 1832 CB ARG A 122 7.773 -3.933 -20.314 1.00 0.00 C ATOM 1833 CG ARG A 122 7.815 -4.452 -21.764 1.00 0.00 C ATOM 1834 CD ARG A 122 8.257 -5.912 -21.785 1.00 0.00 C ATOM 1835 NE ARG A 122 8.402 -6.412 -23.167 1.00 0.00 N ATOM 1836 CZ ARG A 122 7.529 -7.171 -23.852 1.00 0.00 C ATOM 1837 NH1 ARG A 122 6.390 -7.578 -23.295 1.00 0.00 N ATOM 1838 NH2 ARG A 122 7.804 -7.519 -25.103 1.00 0.00 N ATOM 0 H ARG A 122 8.019 -1.606 -21.247 1.00 0.00 H new ATOM 0 HA ARG A 122 5.782 -3.235 -20.575 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.750 -3.536 -20.037 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.560 -4.758 -19.634 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.831 -4.355 -22.222 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.502 -3.847 -22.355 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.206 -6.014 -21.258 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.529 -6.522 -21.251 1.00 0.00 H new ATOM 0 HE ARG A 122 9.259 -6.153 -23.656 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.169 -7.314 -22.335 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.738 -8.153 -23.829 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.673 -7.211 -25.539 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.146 -8.095 -25.629 1.00 0.00 H new ATOM 1852 N VAL A 123 7.265 -1.674 -18.079 1.00 0.00 N ATOM 1853 CA VAL A 123 7.081 -1.260 -16.696 1.00 0.00 C ATOM 1854 C VAL A 123 5.771 -0.462 -16.573 1.00 0.00 C ATOM 1855 O VAL A 123 5.010 -0.713 -15.642 1.00 0.00 O ATOM 1856 CB VAL A 123 8.339 -0.528 -16.209 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.179 0.057 -14.805 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.570 -1.453 -16.160 1.00 0.00 C ATOM 0 H VAL A 123 8.076 -1.255 -18.534 1.00 0.00 H new ATOM 0 HA VAL A 123 6.967 -2.116 -16.030 1.00 0.00 H new ATOM 0 HB VAL A 123 8.483 0.271 -16.936 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.100 0.562 -14.514 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.356 0.772 -14.800 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.967 -0.745 -14.098 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.435 -0.890 -15.810 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.376 -2.281 -15.478 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.771 -1.844 -17.157 1.00 0.00 H new ATOM 1868 N GLU A 124 5.445 0.431 -17.517 1.00 0.00 N ATOM 1869 CA GLU A 124 4.186 1.170 -17.488 1.00 0.00 C ATOM 1870 C GLU A 124 2.999 0.212 -17.526 1.00 0.00 C ATOM 1871 O GLU A 124 2.045 0.409 -16.779 1.00 0.00 O ATOM 1872 CB GLU A 124 4.070 2.178 -18.649 1.00 0.00 C ATOM 1873 CG GLU A 124 4.722 3.531 -18.345 1.00 0.00 C ATOM 1874 CD GLU A 124 4.356 4.585 -19.406 1.00 0.00 C ATOM 1875 OE1 GLU A 124 3.196 5.067 -19.413 1.00 0.00 O ATOM 1876 OE2 GLU A 124 5.236 4.974 -20.211 1.00 0.00 O ATOM 0 H GLU A 124 6.043 0.656 -18.312 1.00 0.00 H new ATOM 0 HA GLU A 124 4.175 1.732 -16.554 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.533 1.751 -19.539 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.017 2.334 -18.881 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.403 3.877 -17.362 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.805 3.414 -18.306 1.00 0.00 H new ATOM 1883 N ASN A 125 3.064 -0.840 -18.346 1.00 0.00 N ATOM 1884 CA ASN A 125 1.980 -1.811 -18.463 1.00 0.00 C ATOM 1885 C ASN A 125 1.739 -2.534 -17.132 1.00 0.00 C ATOM 1886 O ASN A 125 0.597 -2.645 -16.691 1.00 0.00 O ATOM 1887 CB ASN A 125 2.270 -2.821 -19.581 1.00 0.00 C ATOM 1888 CG ASN A 125 1.132 -3.835 -19.696 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.206 -4.932 -19.149 1.00 0.00 O ATOM 1890 ND2 ASN A 125 0.051 -3.488 -20.381 1.00 0.00 N ATOM 0 H ASN A 125 3.866 -1.040 -18.943 1.00 0.00 H new ATOM 0 HA ASN A 125 1.072 -1.266 -18.720 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.395 -2.297 -20.529 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.207 -3.339 -19.377 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.733 -4.136 -20.459 1.00 0.00 H new ATOM 0 HD22 ASN A 125 0.004 -2.573 -20.830 1.00 0.00 H new ATOM 1897 N LEU A 126 2.811 -2.971 -16.463 1.00 0.00 N ATOM 1898 CA LEU A 126 2.756 -3.621 -15.158 1.00 0.00 C ATOM 1899 C LEU A 126 2.091 -2.699 -14.134 1.00 0.00 C ATOM 1900 O LEU A 126 1.148 -3.103 -13.457 1.00 0.00 O ATOM 1901 CB LEU A 126 4.191 -4.019 -14.787 1.00 0.00 C ATOM 1902 CG LEU A 126 4.433 -4.684 -13.425 1.00 0.00 C ATOM 1903 CD1 LEU A 126 4.750 -3.681 -12.309 1.00 0.00 C ATOM 1904 CD2 LEU A 126 3.330 -5.650 -12.988 1.00 0.00 C ATOM 0 H LEU A 126 3.760 -2.879 -16.825 1.00 0.00 H new ATOM 0 HA LEU A 126 2.142 -4.521 -15.177 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.558 -4.697 -15.558 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.807 -3.121 -14.833 1.00 0.00 H new ATOM 0 HG LEU A 126 5.324 -5.289 -13.592 1.00 0.00 H new ATOM 0 HD11 LEU A 126 4.910 -4.217 -11.373 1.00 0.00 H new ATOM 0 HD12 LEU A 126 5.650 -3.123 -12.566 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.915 -2.990 -12.193 1.00 0.00 H new ATOM 0 HD21 LEU A 126 3.582 -6.074 -12.016 1.00 0.00 H new ATOM 0 HD22 LEU A 126 2.384 -5.113 -12.916 1.00 0.00 H new ATOM 0 HD23 LEU A 126 3.237 -6.452 -13.721 1.00 0.00 H new ATOM 1916 N ILE A 127 2.527 -1.444 -14.051 1.00 0.00 N ATOM 1917 CA ILE A 127 1.996 -0.460 -13.118 1.00 0.00 C ATOM 1918 C ILE A 127 0.526 -0.196 -13.460 1.00 0.00 C ATOM 1919 O ILE A 127 -0.297 -0.179 -12.554 1.00 0.00 O ATOM 1920 CB ILE A 127 2.899 0.788 -13.207 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.305 0.399 -12.702 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.338 1.949 -12.381 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.349 1.494 -12.890 1.00 0.00 C ATOM 0 H ILE A 127 3.273 -1.078 -14.643 1.00 0.00 H new ATOM 0 HA ILE A 127 2.007 -0.803 -12.083 1.00 0.00 H new ATOM 0 HB ILE A 127 2.945 1.127 -14.242 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.244 0.146 -11.644 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.634 -0.498 -13.226 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.000 2.810 -12.468 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.348 2.214 -12.751 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.266 1.650 -11.335 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.311 1.148 -12.512 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.440 1.732 -13.950 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.044 2.386 -12.343 1.00 0.00 H new ATOM 1935 N ALA A 128 0.176 -0.058 -14.742 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.194 0.194 -15.171 1.00 0.00 C ATOM 1937 C ALA A 128 -2.137 -0.956 -14.794 1.00 0.00 C ATOM 1938 O ALA A 128 -3.330 -0.715 -14.591 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.229 0.447 -16.682 1.00 0.00 C ATOM 0 H ALA A 128 0.842 -0.119 -15.512 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.549 1.082 -14.648 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.256 0.635 -16.996 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.613 1.314 -16.920 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.843 -0.427 -17.206 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.634 -2.195 -14.688 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.425 -3.308 -14.184 1.00 0.00 C ATOM 1947 C LYS A 129 -2.693 -3.136 -12.696 1.00 0.00 C ATOM 1948 O LYS A 129 -3.849 -3.185 -12.272 1.00 0.00 O ATOM 1949 CB LYS A 129 -1.750 -4.663 -14.462 1.00 0.00 C ATOM 1950 CG LYS A 129 -1.797 -5.067 -15.940 1.00 0.00 C ATOM 1951 CD LYS A 129 -1.076 -6.404 -16.138 1.00 0.00 C ATOM 1952 CE LYS A 129 -1.198 -6.862 -17.600 1.00 0.00 C ATOM 1953 NZ LYS A 129 -0.787 -8.277 -17.786 1.00 0.00 N ATOM 0 H LYS A 129 -0.679 -2.443 -14.948 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.376 -3.305 -14.716 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.711 -4.618 -14.137 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.237 -5.434 -13.865 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.832 -5.150 -16.271 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -1.328 -4.297 -16.552 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.025 -6.302 -15.868 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.504 -7.157 -15.476 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -2.229 -6.739 -17.931 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.582 -6.222 -18.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.806 -8.514 -18.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.176 -8.410 -17.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.443 -8.899 -17.273 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.637 -2.961 -11.899 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.751 -3.013 -10.451 1.00 0.00 C ATOM 1969 C ILE A 130 -2.338 -1.748 -9.811 1.00 0.00 C ATOM 1970 O ILE A 130 -3.091 -1.861 -8.838 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.419 -3.440 -9.818 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.718 -2.431 -10.066 1.00 0.00 C ATOM 1973 CG2 ILE A 130 -0.042 -4.851 -10.296 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.083 -2.861 -9.530 1.00 0.00 C ATOM 0 H ILE A 130 -0.692 -2.782 -12.239 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.494 -3.780 -10.231 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.561 -3.458 -8.737 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.803 -2.257 -11.139 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.447 -1.479 -9.609 1.00 0.00 H new ATOM 0 HG21 ILE A 130 0.904 -5.148 -9.843 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.821 -5.555 -10.003 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.059 -4.853 -11.381 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.820 -2.089 -9.751 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.021 -3.006 -8.451 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.383 -3.795 -10.005 1.00 0.00 H new ATOM 1986 N SER A 131 -1.992 -0.569 -10.322 1.00 0.00 N ATOM 1987 CA SER A 131 -2.266 0.726 -9.741 1.00 0.00 C ATOM 1988 C SER A 131 -3.422 1.391 -10.490 1.00 0.00 C ATOM 1989 O SER A 131 -3.247 1.812 -11.656 1.00 0.00 O ATOM 1990 CB SER A 131 -0.983 1.555 -9.740 1.00 0.00 C ATOM 1991 OG SER A 131 -0.038 0.934 -8.873 1.00 0.00 O ATOM 1992 OXT SER A 131 -4.532 1.469 -9.914 1.00 0.00 O ATOM 0 H SER A 131 -1.484 -0.497 -11.204 1.00 0.00 H new ATOM 0 HA SER A 131 -2.585 0.631 -8.703 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.579 1.627 -10.750 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.190 2.572 -9.407 1.00 0.00 H new ATOM 0 HG SER A 131 0.791 1.456 -8.865 1.00 0.00 H new TER 1998 SER A 131