USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 915 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 8 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 80 CYS SG : rot 180:sc= -0.0557 USER MOD Set 2.1: A 43 HIS : no HE2:sc= 0.508 K(o=1.2,f=-0.38) USER MOD Set 2.2: A 45 THR OG1 : rot 99:sc= 0.722 USER MOD Set 3.1: A 23 LYS NZ :NH3+ -171:sc= 1.07 (180deg=0) USER MOD Set 3.2: A 60 GLN : amide:sc= 0.759 K(o=1.8,f=-2.6) USER MOD Set 4.1: A 15 SER OG : rot -160:sc= 0.0392 USER MOD Set 4.2: A 16 GLN : amide:sc= -0.683 K(o=2.9,f=0.47) USER MOD Set 4.3: A 34 SER OG : rot -102:sc= 1.41 USER MOD Set 4.4: A 39 SER OG : rot 180:sc= 0.144 USER MOD Set 4.5: A 40 SER OG : rot -110:sc= 0.929 USER MOD Set 4.6: A 62 SER OG : rot 168:sc= 1.05 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 135:sc= 0.00944 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 170:sc= 1.27 (180deg=1.14) USER MOD Single : A 5 MET CE :methyl -162:sc= 0 (180deg=-0.921) USER MOD Single : A 17 MET CE :methyl -148:sc= -0.376 (180deg=-0.742) USER MOD Single : A 24 THR OG1 : rot 80:sc= 1.13 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -150:sc= 0 USER MOD Single : A 35 CYS SG : rot 51:sc= -0.641 USER MOD Single : A 49 MET CE :methyl 160:sc= -0.1 (180deg=-0.215) USER MOD Single : A 50 MET CE :methyl -165:sc= -0.159 (180deg=-0.195) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 2.04 K(o=2,f=-0.0027) USER MOD Single : A 69 ASN : amide:sc= 1 K(o=1,f=-0.073) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 119:sc= 0.135 USER MOD Single : A 85 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 92 THR OG1 : rot -36:sc= 0.315 USER MOD Single : A 93 GLN : amide:sc= -0.856! C(o=-0.86!,f=-5.4!) USER MOD Single : A 100 GLN : amide:sc= 0.411 X(o=0.41,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0.0471 USER MOD Single : A 114 THR OG1 : rot 71:sc= 1.28 USER MOD Single : A 118 GLN : amide:sc= 0.622 K(o=0.62,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -151:sc= 1.32 (180deg=1.14) USER MOD Single : A 125 ASN : amide:sc= 0.19 X(o=0.19,f=-0.036) USER MOD Single : A 129 LYS NZ :NH3+ 164:sc= 1.29 (180deg=1.23) USER MOD Single : A 131 SER OG : rot 62:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.336 1.484 1.606 1.00 0.00 N ATOM 2 CA MET A 1 3.508 1.328 0.124 1.00 0.00 C ATOM 3 C MET A 1 4.505 0.200 -0.205 1.00 0.00 C ATOM 4 O MET A 1 5.502 0.042 0.496 1.00 0.00 O ATOM 5 CB MET A 1 3.919 2.675 -0.539 1.00 0.00 C ATOM 6 CG MET A 1 4.099 2.608 -2.067 1.00 0.00 C ATOM 7 SD MET A 1 4.360 4.204 -2.893 1.00 0.00 S ATOM 8 CE MET A 1 2.653 4.816 -2.965 1.00 0.00 C ATOM 0 H1 MET A 1 3.367 2.493 1.855 1.00 0.00 H new ATOM 0 H2 MET A 1 2.420 1.085 1.893 1.00 0.00 H new ATOM 0 H3 MET A 1 4.102 0.982 2.099 1.00 0.00 H new ATOM 0 HA MET A 1 2.545 1.041 -0.298 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.162 3.425 -0.308 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.852 3.016 -0.091 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.948 1.961 -2.287 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.217 2.135 -2.499 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.637 5.793 -3.447 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.040 4.119 -3.537 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.255 4.903 -1.954 1.00 0.00 H new ATOM 18 N LYS A 2 4.261 -0.571 -1.283 1.00 0.00 N ATOM 19 CA LYS A 2 5.158 -1.660 -1.742 1.00 0.00 C ATOM 20 C LYS A 2 6.420 -1.115 -2.402 1.00 0.00 C ATOM 21 O LYS A 2 6.348 -0.160 -3.177 1.00 0.00 O ATOM 22 CB LYS A 2 4.433 -2.604 -2.720 1.00 0.00 C ATOM 23 CG LYS A 2 3.256 -3.377 -2.105 1.00 0.00 C ATOM 24 CD LYS A 2 2.413 -4.046 -3.208 1.00 0.00 C ATOM 25 CE LYS A 2 1.405 -3.090 -3.883 1.00 0.00 C ATOM 26 NZ LYS A 2 0.136 -2.953 -3.102 1.00 0.00 N ATOM 0 H LYS A 2 3.432 -0.458 -1.866 1.00 0.00 H new ATOM 0 HA LYS A 2 5.448 -2.221 -0.854 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.066 -2.020 -3.564 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.154 -3.319 -3.116 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.631 -4.134 -1.416 1.00 0.00 H new ATOM 0 HG3 LYS A 2 2.632 -2.698 -1.524 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.081 -4.452 -3.968 1.00 0.00 H new ATOM 0 HD3 LYS A 2 1.870 -4.888 -2.778 1.00 0.00 H new ATOM 0 HE2 LYS A 2 1.863 -2.108 -4.001 1.00 0.00 H new ATOM 0 HE3 LYS A 2 1.175 -3.457 -4.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -0.507 -2.302 -3.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.318 -3.884 -3.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 0.349 -2.578 -2.156 1.00 0.00 H new ATOM 40 N LYS A 3 7.553 -1.782 -2.184 1.00 0.00 N ATOM 41 CA LYS A 3 8.832 -1.506 -2.859 1.00 0.00 C ATOM 42 C LYS A 3 9.184 -2.614 -3.854 1.00 0.00 C ATOM 43 O LYS A 3 9.246 -3.787 -3.491 1.00 0.00 O ATOM 44 CB LYS A 3 9.906 -1.286 -1.783 1.00 0.00 C ATOM 45 CG LYS A 3 11.177 -0.591 -2.298 1.00 0.00 C ATOM 46 CD LYS A 3 12.185 -0.305 -1.167 1.00 0.00 C ATOM 47 CE LYS A 3 11.601 0.599 -0.068 1.00 0.00 C ATOM 48 NZ LYS A 3 12.619 0.924 0.970 1.00 0.00 N ATOM 0 H LYS A 3 7.614 -2.551 -1.516 1.00 0.00 H new ATOM 0 HA LYS A 3 8.761 -0.599 -3.459 1.00 0.00 H new ATOM 0 HB2 LYS A 3 9.480 -0.689 -0.976 1.00 0.00 H new ATOM 0 HB3 LYS A 3 10.180 -2.251 -1.356 1.00 0.00 H new ATOM 0 HG2 LYS A 3 11.650 -1.217 -3.054 1.00 0.00 H new ATOM 0 HG3 LYS A 3 10.905 0.345 -2.785 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.506 -1.248 -0.724 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.073 0.168 -1.587 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.228 1.521 -0.514 1.00 0.00 H new ATOM 0 HE3 LYS A 3 10.750 0.103 0.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.249 1.664 1.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 12.832 0.071 1.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.488 1.263 0.510 1.00 0.00 H new ATOM 62 N VAL A 4 9.406 -2.220 -5.107 1.00 0.00 N ATOM 63 CA VAL A 4 9.771 -3.088 -6.234 1.00 0.00 C ATOM 64 C VAL A 4 11.288 -3.093 -6.426 1.00 0.00 C ATOM 65 O VAL A 4 11.853 -2.097 -6.877 1.00 0.00 O ATOM 66 CB VAL A 4 9.063 -2.634 -7.527 1.00 0.00 C ATOM 67 CG1 VAL A 4 9.355 -3.603 -8.678 1.00 0.00 C ATOM 68 CG2 VAL A 4 7.539 -2.574 -7.360 1.00 0.00 C ATOM 0 H VAL A 4 9.334 -1.240 -5.381 1.00 0.00 H new ATOM 0 HA VAL A 4 9.444 -4.103 -6.008 1.00 0.00 H new ATOM 0 HB VAL A 4 9.449 -1.639 -7.747 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.845 -3.262 -9.579 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.429 -3.638 -8.860 1.00 0.00 H new ATOM 0 HG13 VAL A 4 8.999 -4.599 -8.414 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.083 -2.250 -8.295 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.163 -3.562 -7.096 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.287 -1.867 -6.569 1.00 0.00 H new ATOM 78 N MET A 5 11.950 -4.207 -6.107 1.00 0.00 N ATOM 79 CA MET A 5 13.362 -4.415 -6.459 1.00 0.00 C ATOM 80 C MET A 5 13.473 -5.046 -7.852 1.00 0.00 C ATOM 81 O MET A 5 12.848 -6.077 -8.106 1.00 0.00 O ATOM 82 CB MET A 5 14.067 -5.304 -5.423 1.00 0.00 C ATOM 83 CG MET A 5 15.566 -5.468 -5.713 1.00 0.00 C ATOM 84 SD MET A 5 16.553 -3.957 -5.553 1.00 0.00 S ATOM 85 CE MET A 5 17.150 -4.178 -3.853 1.00 0.00 C ATOM 0 H MET A 5 11.529 -4.987 -5.601 1.00 0.00 H new ATOM 0 HA MET A 5 13.854 -3.442 -6.465 1.00 0.00 H new ATOM 0 HB2 MET A 5 13.937 -4.873 -4.430 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.593 -6.286 -5.409 1.00 0.00 H new ATOM 0 HG2 MET A 5 15.970 -6.220 -5.036 1.00 0.00 H new ATOM 0 HG3 MET A 5 15.684 -5.854 -6.725 1.00 0.00 H new ATOM 0 HE1 MET A 5 17.502 -3.223 -3.464 1.00 0.00 H new ATOM 0 HE2 MET A 5 16.338 -4.548 -3.227 1.00 0.00 H new ATOM 0 HE3 MET A 5 17.969 -4.897 -3.846 1.00 0.00 H new ATOM 95 N PHE A 6 14.313 -4.482 -8.719 1.00 0.00 N ATOM 96 CA PHE A 6 14.697 -5.076 -10.003 1.00 0.00 C ATOM 97 C PHE A 6 16.118 -5.668 -9.927 1.00 0.00 C ATOM 98 O PHE A 6 17.053 -4.944 -9.587 1.00 0.00 O ATOM 99 CB PHE A 6 14.564 -4.011 -11.102 1.00 0.00 C ATOM 100 CG PHE A 6 13.129 -3.634 -11.418 1.00 0.00 C ATOM 101 CD1 PHE A 6 12.355 -4.488 -12.222 1.00 0.00 C ATOM 102 CD2 PHE A 6 12.553 -2.456 -10.907 1.00 0.00 C ATOM 103 CE1 PHE A 6 11.029 -4.156 -12.543 1.00 0.00 C ATOM 104 CE2 PHE A 6 11.227 -2.115 -11.241 1.00 0.00 C ATOM 105 CZ PHE A 6 10.471 -2.955 -12.083 1.00 0.00 C ATOM 0 H PHE A 6 14.756 -3.580 -8.546 1.00 0.00 H new ATOM 0 HA PHE A 6 14.032 -5.905 -10.246 1.00 0.00 H new ATOM 0 HB2 PHE A 6 15.106 -3.116 -10.796 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.042 -4.378 -12.010 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.783 -5.406 -12.596 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.128 -1.812 -10.258 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.437 -4.828 -13.146 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.789 -1.208 -10.851 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.469 -2.675 -12.372 1.00 0.00 H new ATOM 115 N VAL A 7 16.301 -6.960 -10.244 1.00 0.00 N ATOM 116 CA VAL A 7 17.594 -7.680 -10.111 1.00 0.00 C ATOM 117 C VAL A 7 18.063 -8.352 -11.407 1.00 0.00 C ATOM 118 O VAL A 7 17.270 -8.961 -12.122 1.00 0.00 O ATOM 119 CB VAL A 7 17.614 -8.672 -8.923 1.00 0.00 C ATOM 120 CG1 VAL A 7 17.199 -7.992 -7.615 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.706 -9.893 -9.095 1.00 0.00 C ATOM 0 H VAL A 7 15.550 -7.548 -10.605 1.00 0.00 H new ATOM 0 HA VAL A 7 18.320 -6.897 -9.891 1.00 0.00 H new ATOM 0 HB VAL A 7 18.649 -9.012 -8.893 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.225 -8.719 -6.803 1.00 0.00 H new ATOM 0 HG12 VAL A 7 17.888 -7.177 -7.394 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.189 -7.596 -7.716 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.785 -10.532 -8.215 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.673 -9.565 -9.214 1.00 0.00 H new ATOM 0 HG23 VAL A 7 17.013 -10.453 -9.978 1.00 0.00 H new ATOM 131 N CYS A 8 19.362 -8.261 -11.720 1.00 0.00 N ATOM 132 CA CYS A 8 19.968 -8.857 -12.924 1.00 0.00 C ATOM 133 C CYS A 8 21.400 -9.391 -12.669 1.00 0.00 C ATOM 134 O CYS A 8 21.940 -9.239 -11.573 1.00 0.00 O ATOM 135 CB CYS A 8 19.907 -7.797 -14.044 1.00 0.00 C ATOM 136 SG CYS A 8 19.974 -8.596 -15.677 1.00 0.00 S ATOM 0 H CYS A 8 20.035 -7.764 -11.136 1.00 0.00 H new ATOM 0 HA CYS A 8 19.407 -9.741 -13.227 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.989 -7.216 -13.954 1.00 0.00 H new ATOM 0 HB3 CYS A 8 20.738 -7.099 -13.939 1.00 0.00 H new ATOM 0 HG CYS A 8 19.919 -7.689 -16.607 1.00 0.00 H new ATOM 224 N ARG A 14 20.010 -3.791 -17.117 1.00 0.00 N ATOM 225 CA ARG A 14 18.548 -3.946 -17.247 1.00 0.00 C ATOM 226 C ARG A 14 17.820 -3.870 -15.916 1.00 0.00 C ATOM 227 O ARG A 14 16.680 -3.446 -15.898 1.00 0.00 O ATOM 228 CB ARG A 14 18.220 -5.245 -18.002 1.00 0.00 C ATOM 229 CG ARG A 14 18.593 -5.117 -19.485 1.00 0.00 C ATOM 230 CD ARG A 14 18.226 -6.388 -20.249 1.00 0.00 C ATOM 231 NE ARG A 14 19.205 -7.462 -19.983 1.00 0.00 N ATOM 232 CZ ARG A 14 19.062 -8.598 -19.329 1.00 0.00 C ATOM 233 NH1 ARG A 14 17.940 -8.917 -18.760 1.00 0.00 N ATOM 234 NH2 ARG A 14 20.057 -9.420 -19.222 1.00 0.00 N ATOM 0 HA ARG A 14 18.182 -3.099 -17.828 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.763 -6.078 -17.556 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.158 -5.469 -17.907 1.00 0.00 H new ATOM 0 HG2 ARG A 14 18.076 -4.263 -19.922 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.662 -4.926 -19.581 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.229 -6.718 -19.957 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.192 -6.178 -21.318 1.00 0.00 H new ATOM 0 HE ARG A 14 20.137 -7.299 -20.365 1.00 0.00 H new ATOM 0 HH11 ARG A 14 17.143 -8.283 -18.813 1.00 0.00 H new ATOM 0 HH12 ARG A 14 17.855 -9.802 -18.260 1.00 0.00 H new ATOM 0 HH21 ARG A 14 20.956 -9.190 -19.645 1.00 0.00 H new ATOM 0 HH22 ARG A 14 19.941 -10.298 -18.715 1.00 0.00 H new ATOM 248 N SER A 15 18.469 -4.191 -14.804 1.00 0.00 N ATOM 249 CA SER A 15 17.915 -3.927 -13.463 1.00 0.00 C ATOM 250 C SER A 15 17.752 -2.419 -13.229 1.00 0.00 C ATOM 251 O SER A 15 16.687 -1.984 -12.799 1.00 0.00 O ATOM 252 CB SER A 15 18.786 -4.578 -12.385 1.00 0.00 C ATOM 253 OG SER A 15 20.153 -4.453 -12.723 1.00 0.00 O ATOM 0 H SER A 15 19.386 -4.638 -14.795 1.00 0.00 H new ATOM 0 HA SER A 15 16.923 -4.375 -13.401 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.597 -4.106 -11.421 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.524 -5.631 -12.282 1.00 0.00 H new ATOM 0 HG SER A 15 20.675 -5.119 -12.228 1.00 0.00 H new ATOM 259 N GLN A 16 18.744 -1.605 -13.613 1.00 0.00 N ATOM 260 CA GLN A 16 18.653 -0.131 -13.577 1.00 0.00 C ATOM 261 C GLN A 16 17.669 0.403 -14.622 1.00 0.00 C ATOM 262 O GLN A 16 16.906 1.311 -14.325 1.00 0.00 O ATOM 263 CB GLN A 16 20.032 0.535 -13.780 1.00 0.00 C ATOM 264 CG GLN A 16 21.016 0.329 -12.617 1.00 0.00 C ATOM 265 CD GLN A 16 21.420 -1.128 -12.442 1.00 0.00 C ATOM 266 OE1 GLN A 16 21.827 -1.793 -13.382 1.00 0.00 O ATOM 267 NE2 GLN A 16 21.271 -1.684 -11.263 1.00 0.00 N ATOM 0 H GLN A 16 19.640 -1.948 -13.960 1.00 0.00 H new ATOM 0 HA GLN A 16 18.284 0.127 -12.584 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.480 0.142 -14.693 1.00 0.00 H new ATOM 0 HB3 GLN A 16 19.886 1.605 -13.931 1.00 0.00 H new ATOM 0 HG2 GLN A 16 21.908 0.931 -12.790 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.562 0.690 -11.694 1.00 0.00 H new ATOM 0 HE21 GLN A 16 20.931 -1.130 -10.477 1.00 0.00 H new ATOM 0 HE22 GLN A 16 21.495 -2.670 -11.132 1.00 0.00 H new ATOM 276 N MET A 17 17.639 -0.160 -15.837 1.00 0.00 N ATOM 277 CA MET A 17 16.733 0.310 -16.897 1.00 0.00 C ATOM 278 C MET A 17 15.266 -0.041 -16.616 1.00 0.00 C ATOM 279 O MET A 17 14.394 0.801 -16.824 1.00 0.00 O ATOM 280 CB MET A 17 17.219 -0.192 -18.269 1.00 0.00 C ATOM 281 CG MET A 17 16.679 0.657 -19.428 1.00 0.00 C ATOM 282 SD MET A 17 17.293 2.367 -19.436 1.00 0.00 S ATOM 283 CE MET A 17 15.846 3.276 -18.817 1.00 0.00 C ATOM 0 H MET A 17 18.232 -0.943 -16.112 1.00 0.00 H new ATOM 0 HA MET A 17 16.764 1.399 -16.912 1.00 0.00 H new ATOM 0 HB2 MET A 17 18.309 -0.181 -18.291 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.907 -1.228 -18.405 1.00 0.00 H new ATOM 0 HG2 MET A 17 16.948 0.180 -20.371 1.00 0.00 H new ATOM 0 HG3 MET A 17 15.590 0.672 -19.378 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.819 4.268 -19.268 1.00 0.00 H new ATOM 0 HE2 MET A 17 14.937 2.734 -19.078 1.00 0.00 H new ATOM 0 HE3 MET A 17 15.913 3.372 -17.733 1.00 0.00 H new ATOM 293 N ALA A 18 14.995 -1.226 -16.060 1.00 0.00 N ATOM 294 CA ALA A 18 13.667 -1.592 -15.544 1.00 0.00 C ATOM 295 C ALA A 18 13.236 -0.651 -14.406 1.00 0.00 C ATOM 296 O ALA A 18 12.129 -0.121 -14.438 1.00 0.00 O ATOM 297 CB ALA A 18 13.693 -3.063 -15.114 1.00 0.00 C ATOM 0 H ALA A 18 15.692 -1.963 -15.954 1.00 0.00 H new ATOM 0 HA ALA A 18 12.918 -1.476 -16.328 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.714 -3.347 -14.729 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.941 -3.688 -15.972 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.443 -3.201 -14.335 1.00 0.00 H new ATOM 303 N GLU A 19 14.149 -0.337 -13.478 1.00 0.00 N ATOM 304 CA GLU A 19 13.944 0.714 -12.472 1.00 0.00 C ATOM 305 C GLU A 19 13.646 2.078 -13.119 1.00 0.00 C ATOM 306 O GLU A 19 12.756 2.772 -12.648 1.00 0.00 O ATOM 307 CB GLU A 19 15.157 0.763 -11.524 1.00 0.00 C ATOM 308 CG GLU A 19 15.430 2.131 -10.893 1.00 0.00 C ATOM 309 CD GLU A 19 16.527 2.019 -9.835 1.00 0.00 C ATOM 310 OE1 GLU A 19 17.719 1.905 -10.218 1.00 0.00 O ATOM 311 OE2 GLU A 19 16.215 2.094 -8.629 1.00 0.00 O ATOM 0 H GLU A 19 15.052 -0.805 -13.403 1.00 0.00 H new ATOM 0 HA GLU A 19 13.061 0.470 -11.882 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.006 0.036 -10.727 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.043 0.451 -12.076 1.00 0.00 H new ATOM 0 HG2 GLU A 19 15.730 2.841 -11.664 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.517 2.519 -10.440 1.00 0.00 H new ATOM 318 N GLY A 20 14.316 2.449 -14.213 1.00 0.00 N ATOM 319 CA GLY A 20 14.081 3.699 -14.950 1.00 0.00 C ATOM 320 C GLY A 20 12.664 3.827 -15.494 1.00 0.00 C ATOM 321 O GLY A 20 11.962 4.786 -15.180 1.00 0.00 O ATOM 0 H GLY A 20 15.055 1.877 -14.623 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.287 4.543 -14.292 1.00 0.00 H new ATOM 0 HA3 GLY A 20 14.787 3.761 -15.778 1.00 0.00 H new ATOM 325 N PHE A 21 12.190 2.828 -16.244 1.00 0.00 N ATOM 326 CA PHE A 21 10.789 2.801 -16.698 1.00 0.00 C ATOM 327 C PHE A 21 9.823 2.755 -15.502 1.00 0.00 C ATOM 328 O PHE A 21 8.831 3.481 -15.485 1.00 0.00 O ATOM 329 CB PHE A 21 10.572 1.639 -17.689 1.00 0.00 C ATOM 330 CG PHE A 21 11.057 1.950 -19.095 1.00 0.00 C ATOM 331 CD1 PHE A 21 10.235 2.692 -19.965 1.00 0.00 C ATOM 332 CD2 PHE A 21 12.321 1.520 -19.537 1.00 0.00 C ATOM 333 CE1 PHE A 21 10.690 3.035 -21.248 1.00 0.00 C ATOM 334 CE2 PHE A 21 12.775 1.860 -20.824 1.00 0.00 C ATOM 335 CZ PHE A 21 11.964 2.630 -21.674 1.00 0.00 C ATOM 0 H PHE A 21 12.748 2.031 -16.550 1.00 0.00 H new ATOM 0 HA PHE A 21 10.569 3.725 -17.233 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.091 0.754 -17.320 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.510 1.394 -17.724 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.250 2.998 -19.644 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.945 0.926 -18.886 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.059 3.611 -21.908 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.747 1.529 -21.159 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.321 2.910 -22.654 1.00 0.00 H new ATOM 345 N ALA A 22 10.135 1.992 -14.453 1.00 0.00 N ATOM 346 CA ALA A 22 9.278 1.873 -13.269 1.00 0.00 C ATOM 347 C ALA A 22 9.183 3.162 -12.441 1.00 0.00 C ATOM 348 O ALA A 22 8.081 3.532 -12.046 1.00 0.00 O ATOM 349 CB ALA A 22 9.777 0.681 -12.453 1.00 0.00 C ATOM 0 H ALA A 22 10.990 1.438 -14.399 1.00 0.00 H new ATOM 0 HA ALA A 22 8.251 1.702 -13.591 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.159 0.565 -11.563 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.717 -0.224 -13.057 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.812 0.851 -12.156 1.00 0.00 H new ATOM 355 N LYS A 23 10.279 3.904 -12.237 1.00 0.00 N ATOM 356 CA LYS A 23 10.250 5.187 -11.506 1.00 0.00 C ATOM 357 C LYS A 23 9.572 6.311 -12.302 1.00 0.00 C ATOM 358 O LYS A 23 9.091 7.269 -11.709 1.00 0.00 O ATOM 359 CB LYS A 23 11.656 5.575 -10.997 1.00 0.00 C ATOM 360 CG LYS A 23 12.600 6.152 -12.068 1.00 0.00 C ATOM 361 CD LYS A 23 13.887 6.725 -11.452 1.00 0.00 C ATOM 362 CE LYS A 23 14.700 7.474 -12.523 1.00 0.00 C ATOM 363 NZ LYS A 23 15.844 8.237 -11.938 1.00 0.00 N ATOM 0 H LYS A 23 11.206 3.639 -12.569 1.00 0.00 H new ATOM 0 HA LYS A 23 9.623 5.040 -10.627 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.547 6.308 -10.198 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.124 4.693 -10.559 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.857 5.371 -12.784 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.083 6.935 -12.623 1.00 0.00 H new ATOM 0 HD2 LYS A 23 13.638 7.402 -10.635 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.486 5.919 -11.027 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.079 6.759 -13.254 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.045 8.161 -13.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.267 8.843 -12.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 15.502 8.828 -11.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.560 7.571 -11.583 1.00 0.00 H new ATOM 377 N THR A 24 9.509 6.179 -13.634 1.00 0.00 N ATOM 378 CA THR A 24 8.851 7.154 -14.530 1.00 0.00 C ATOM 379 C THR A 24 7.348 6.875 -14.683 1.00 0.00 C ATOM 380 O THR A 24 6.543 7.800 -14.611 1.00 0.00 O ATOM 381 CB THR A 24 9.530 7.187 -15.910 1.00 0.00 C ATOM 382 OG1 THR A 24 10.929 7.309 -15.780 1.00 0.00 O ATOM 383 CG2 THR A 24 9.090 8.389 -16.745 1.00 0.00 C ATOM 0 H THR A 24 9.916 5.386 -14.130 1.00 0.00 H new ATOM 0 HA THR A 24 8.961 8.133 -14.063 1.00 0.00 H new ATOM 0 HB THR A 24 9.242 6.254 -16.395 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.315 6.434 -15.567 1.00 0.00 H new ATOM 0 HG21 THR A 24 9.597 8.367 -17.710 1.00 0.00 H new ATOM 0 HG22 THR A 24 8.012 8.349 -16.901 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.347 9.310 -16.221 1.00 0.00 H new ATOM 391 N LEU A 25 6.955 5.604 -14.866 1.00 0.00 N ATOM 392 CA LEU A 25 5.558 5.208 -15.157 1.00 0.00 C ATOM 393 C LEU A 25 4.781 4.783 -13.901 1.00 0.00 C ATOM 394 O LEU A 25 3.597 5.076 -13.761 1.00 0.00 O ATOM 395 CB LEU A 25 5.551 4.083 -16.213 1.00 0.00 C ATOM 396 CG LEU A 25 6.327 4.406 -17.501 1.00 0.00 C ATOM 397 CD1 LEU A 25 6.264 3.216 -18.455 1.00 0.00 C ATOM 398 CD2 LEU A 25 5.793 5.635 -18.237 1.00 0.00 C ATOM 0 H LEU A 25 7.598 4.814 -14.817 1.00 0.00 H new ATOM 0 HA LEU A 25 5.043 6.085 -15.548 1.00 0.00 H new ATOM 0 HB2 LEU A 25 5.973 3.182 -15.767 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.518 3.855 -16.475 1.00 0.00 H new ATOM 0 HG LEU A 25 7.351 4.618 -17.193 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.815 3.450 -19.366 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.707 2.343 -17.977 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.224 3.004 -18.705 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.385 5.807 -19.136 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.752 5.469 -18.514 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.861 6.507 -17.586 1.00 0.00 H new ATOM 410 N GLY A 26 5.474 4.137 -12.959 1.00 0.00 N ATOM 411 CA GLY A 26 4.992 3.814 -11.610 1.00 0.00 C ATOM 412 C GLY A 26 5.231 4.914 -10.581 1.00 0.00 C ATOM 413 O GLY A 26 5.018 4.663 -9.396 1.00 0.00 O ATOM 0 H GLY A 26 6.427 3.810 -13.121 1.00 0.00 H new ATOM 0 HA2 GLY A 26 3.924 3.603 -11.659 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.482 2.901 -11.270 1.00 0.00 H new ATOM 417 N ALA A 27 5.673 6.105 -11.012 1.00 0.00 N ATOM 418 CA ALA A 27 6.102 7.223 -10.149 1.00 0.00 C ATOM 419 C ALA A 27 5.254 7.473 -8.879 1.00 0.00 C ATOM 420 O ALA A 27 5.803 7.725 -7.806 1.00 0.00 O ATOM 421 CB ALA A 27 6.117 8.495 -11.011 1.00 0.00 C ATOM 0 H ALA A 27 5.745 6.327 -12.005 1.00 0.00 H new ATOM 0 HA ALA A 27 7.084 6.948 -9.764 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.431 9.343 -10.402 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.814 8.365 -11.839 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.117 8.680 -11.404 1.00 0.00 H new ATOM 427 N GLY A 28 3.925 7.388 -9.006 1.00 0.00 N ATOM 428 CA GLY A 28 2.950 7.608 -7.924 1.00 0.00 C ATOM 429 C GLY A 28 2.230 6.345 -7.430 1.00 0.00 C ATOM 430 O GLY A 28 1.154 6.466 -6.842 1.00 0.00 O ATOM 0 H GLY A 28 3.480 7.156 -9.894 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.464 8.068 -7.080 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.202 8.322 -8.269 1.00 0.00 H new ATOM 434 N LYS A 29 2.758 5.138 -7.701 1.00 0.00 N ATOM 435 CA LYS A 29 2.068 3.853 -7.474 1.00 0.00 C ATOM 436 C LYS A 29 2.789 2.994 -6.442 1.00 0.00 C ATOM 437 O LYS A 29 2.158 2.398 -5.571 1.00 0.00 O ATOM 438 CB LYS A 29 1.970 3.080 -8.805 1.00 0.00 C ATOM 439 CG LYS A 29 1.268 3.821 -9.956 1.00 0.00 C ATOM 440 CD LYS A 29 -0.195 4.177 -9.652 1.00 0.00 C ATOM 441 CE LYS A 29 -0.851 4.815 -10.885 1.00 0.00 C ATOM 442 NZ LYS A 29 -2.275 5.172 -10.629 1.00 0.00 N ATOM 0 H LYS A 29 3.694 5.025 -8.091 1.00 0.00 H new ATOM 0 HA LYS A 29 1.073 4.074 -7.088 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.978 2.818 -9.127 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.441 2.145 -8.623 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.818 4.736 -10.178 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.304 3.202 -10.852 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -0.743 3.280 -9.362 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.242 4.866 -8.808 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.297 5.710 -11.170 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.795 4.124 -11.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -2.685 5.600 -11.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.809 4.314 -10.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -2.327 5.851 -9.843 1.00 0.00 H new ATOM 456 N ILE A 30 4.115 2.940 -6.568 1.00 0.00 N ATOM 457 CA ILE A 30 5.019 2.100 -5.777 1.00 0.00 C ATOM 458 C ILE A 30 6.402 2.750 -5.595 1.00 0.00 C ATOM 459 O ILE A 30 6.761 3.698 -6.296 1.00 0.00 O ATOM 460 CB ILE A 30 5.155 0.687 -6.407 1.00 0.00 C ATOM 461 CG1 ILE A 30 5.219 0.584 -7.948 1.00 0.00 C ATOM 462 CG2 ILE A 30 4.043 -0.247 -5.907 1.00 0.00 C ATOM 463 CD1 ILE A 30 6.455 1.256 -8.551 1.00 0.00 C ATOM 0 H ILE A 30 4.612 3.506 -7.255 1.00 0.00 H new ATOM 0 HA ILE A 30 4.576 1.997 -4.786 1.00 0.00 H new ATOM 0 HB ILE A 30 6.145 0.385 -6.065 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.210 -0.467 -8.235 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.324 1.038 -8.373 1.00 0.00 H new ATOM 0 HG21 ILE A 30 4.161 -1.230 -6.363 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.106 -0.340 -4.823 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.072 0.165 -6.180 1.00 0.00 H new ATOM 0 HD11 ILE A 30 6.436 1.146 -9.635 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.455 2.315 -8.294 1.00 0.00 H new ATOM 0 HD13 ILE A 30 7.355 0.786 -8.154 1.00 0.00 H new ATOM 475 N ALA A 31 7.186 2.214 -4.657 1.00 0.00 N ATOM 476 CA ALA A 31 8.606 2.545 -4.499 1.00 0.00 C ATOM 477 C ALA A 31 9.445 1.623 -5.401 1.00 0.00 C ATOM 478 O ALA A 31 9.031 0.504 -5.699 1.00 0.00 O ATOM 479 CB ALA A 31 8.985 2.473 -3.012 1.00 0.00 C ATOM 0 H ALA A 31 6.850 1.531 -3.978 1.00 0.00 H new ATOM 0 HA ALA A 31 8.812 3.566 -4.820 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.040 2.719 -2.893 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.381 3.184 -2.448 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.803 1.465 -2.638 1.00 0.00 H new ATOM 485 N VAL A 32 10.617 2.071 -5.852 1.00 0.00 N ATOM 486 CA VAL A 32 11.454 1.381 -6.854 1.00 0.00 C ATOM 487 C VAL A 32 12.930 1.387 -6.437 1.00 0.00 C ATOM 488 O VAL A 32 13.450 2.416 -6.003 1.00 0.00 O ATOM 489 CB VAL A 32 11.310 2.042 -8.241 1.00 0.00 C ATOM 490 CG1 VAL A 32 12.128 1.310 -9.308 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.861 2.030 -8.737 1.00 0.00 C ATOM 0 H VAL A 32 11.028 2.946 -5.527 1.00 0.00 H new ATOM 0 HA VAL A 32 11.107 0.349 -6.913 1.00 0.00 H new ATOM 0 HB VAL A 32 11.666 3.063 -8.105 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.999 1.807 -10.270 1.00 0.00 H new ATOM 0 HG12 VAL A 32 13.182 1.323 -9.031 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.786 0.278 -9.384 1.00 0.00 H new ATOM 0 HG21 VAL A 32 9.808 2.505 -9.716 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.511 1.001 -8.814 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.231 2.576 -8.034 1.00 0.00 H new ATOM 501 N THR A 33 13.603 0.248 -6.620 1.00 0.00 N ATOM 502 CA THR A 33 15.051 0.072 -6.394 1.00 0.00 C ATOM 503 C THR A 33 15.641 -0.902 -7.427 1.00 0.00 C ATOM 504 O THR A 33 14.921 -1.769 -7.932 1.00 0.00 O ATOM 505 CB THR A 33 15.307 -0.443 -4.967 1.00 0.00 C ATOM 506 OG1 THR A 33 14.569 0.313 -4.026 1.00 0.00 O ATOM 507 CG2 THR A 33 16.767 -0.368 -4.524 1.00 0.00 C ATOM 0 H THR A 33 13.147 -0.607 -6.939 1.00 0.00 H new ATOM 0 HA THR A 33 15.541 1.038 -6.511 1.00 0.00 H new ATOM 0 HB THR A 33 15.002 -1.489 -4.998 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.051 0.333 -3.173 1.00 0.00 H new ATOM 0 HG21 THR A 33 16.859 -0.750 -3.507 1.00 0.00 H new ATOM 0 HG22 THR A 33 17.382 -0.968 -5.194 1.00 0.00 H new ATOM 0 HG23 THR A 33 17.103 0.668 -4.554 1.00 0.00 H new ATOM 515 N SER A 34 16.937 -0.813 -7.742 1.00 0.00 N ATOM 516 CA SER A 34 17.651 -1.816 -8.549 1.00 0.00 C ATOM 517 C SER A 34 18.919 -2.356 -7.879 1.00 0.00 C ATOM 518 O SER A 34 19.510 -1.726 -6.998 1.00 0.00 O ATOM 519 CB SER A 34 17.969 -1.309 -9.953 1.00 0.00 C ATOM 520 OG SER A 34 18.994 -0.339 -9.940 1.00 0.00 O ATOM 0 H SER A 34 17.528 -0.037 -7.443 1.00 0.00 H new ATOM 0 HA SER A 34 16.955 -2.651 -8.632 1.00 0.00 H new ATOM 0 HB2 SER A 34 18.269 -2.147 -10.583 1.00 0.00 H new ATOM 0 HB3 SER A 34 17.070 -0.882 -10.398 1.00 0.00 H new ATOM 0 HG SER A 34 18.600 0.554 -10.026 1.00 0.00 H new ATOM 526 N CYS A 35 19.309 -3.561 -8.296 1.00 0.00 N ATOM 527 CA CYS A 35 20.404 -4.335 -7.718 1.00 0.00 C ATOM 528 C CYS A 35 20.949 -5.341 -8.751 1.00 0.00 C ATOM 529 O CYS A 35 20.287 -5.653 -9.743 1.00 0.00 O ATOM 530 CB CYS A 35 19.817 -4.991 -6.449 1.00 0.00 C ATOM 531 SG CYS A 35 20.842 -6.318 -5.772 1.00 0.00 S ATOM 0 H CYS A 35 18.854 -4.040 -9.073 1.00 0.00 H new ATOM 0 HA CYS A 35 21.267 -3.727 -7.447 1.00 0.00 H new ATOM 0 HB2 CYS A 35 19.680 -4.225 -5.686 1.00 0.00 H new ATOM 0 HB3 CYS A 35 18.830 -5.390 -6.681 1.00 0.00 H new ATOM 0 HG CYS A 35 22.065 -5.898 -5.640 1.00 0.00 H new ATOM 537 N GLY A 36 22.154 -5.869 -8.527 1.00 0.00 N ATOM 538 CA GLY A 36 22.712 -6.990 -9.287 1.00 0.00 C ATOM 539 C GLY A 36 23.218 -8.089 -8.362 1.00 0.00 C ATOM 540 O GLY A 36 23.586 -7.821 -7.219 1.00 0.00 O ATOM 0 H GLY A 36 22.780 -5.524 -7.800 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.951 -7.395 -9.954 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.529 -6.635 -9.915 1.00 0.00 H new ATOM 544 N LEU A 37 23.282 -9.332 -8.842 1.00 0.00 N ATOM 545 CA LEU A 37 23.689 -10.474 -7.997 1.00 0.00 C ATOM 546 C LEU A 37 25.133 -10.318 -7.469 1.00 0.00 C ATOM 547 O LEU A 37 25.436 -10.712 -6.346 1.00 0.00 O ATOM 548 CB LEU A 37 23.495 -11.793 -8.773 1.00 0.00 C ATOM 549 CG LEU A 37 22.061 -12.069 -9.274 1.00 0.00 C ATOM 550 CD1 LEU A 37 22.019 -13.436 -9.958 1.00 0.00 C ATOM 551 CD2 LEU A 37 21.014 -12.042 -8.160 1.00 0.00 C ATOM 0 H LEU A 37 23.060 -9.581 -9.806 1.00 0.00 H new ATOM 0 HA LEU A 37 23.048 -10.496 -7.116 1.00 0.00 H new ATOM 0 HB2 LEU A 37 24.166 -11.790 -9.632 1.00 0.00 H new ATOM 0 HB3 LEU A 37 23.802 -12.619 -8.132 1.00 0.00 H new ATOM 0 HG LEU A 37 21.812 -11.268 -9.970 1.00 0.00 H new ATOM 0 HD11 LEU A 37 21.008 -13.634 -10.313 1.00 0.00 H new ATOM 0 HD12 LEU A 37 22.708 -13.441 -10.803 1.00 0.00 H new ATOM 0 HD13 LEU A 37 22.312 -14.208 -9.246 1.00 0.00 H new ATOM 0 HD21 LEU A 37 20.029 -12.243 -8.581 1.00 0.00 H new ATOM 0 HD22 LEU A 37 21.253 -12.803 -7.417 1.00 0.00 H new ATOM 0 HD23 LEU A 37 21.012 -11.060 -7.686 1.00 0.00 H new ATOM 563 N GLU A 38 25.985 -9.643 -8.249 1.00 0.00 N ATOM 564 CA GLU A 38 27.337 -9.189 -7.879 1.00 0.00 C ATOM 565 C GLU A 38 27.495 -7.687 -8.217 1.00 0.00 C ATOM 566 O GLU A 38 28.551 -7.247 -8.672 1.00 0.00 O ATOM 567 CB GLU A 38 28.390 -10.057 -8.597 1.00 0.00 C ATOM 568 CG GLU A 38 28.290 -11.556 -8.298 1.00 0.00 C ATOM 569 CD GLU A 38 29.416 -12.318 -9.019 1.00 0.00 C ATOM 570 OE1 GLU A 38 29.511 -12.220 -10.267 1.00 0.00 O ATOM 571 OE2 GLU A 38 30.235 -12.995 -8.354 1.00 0.00 O ATOM 0 H GLU A 38 25.741 -9.384 -9.205 1.00 0.00 H new ATOM 0 HA GLU A 38 27.489 -9.303 -6.806 1.00 0.00 H new ATOM 0 HB2 GLU A 38 28.294 -9.907 -9.672 1.00 0.00 H new ATOM 0 HB3 GLU A 38 29.383 -9.709 -8.314 1.00 0.00 H new ATOM 0 HG2 GLU A 38 28.357 -11.725 -7.223 1.00 0.00 H new ATOM 0 HG3 GLU A 38 27.320 -11.935 -8.621 1.00 0.00 H new ATOM 578 N SER A 39 26.430 -6.897 -7.992 1.00 0.00 N ATOM 579 CA SER A 39 26.263 -5.502 -8.455 1.00 0.00 C ATOM 580 C SER A 39 26.014 -5.420 -9.974 1.00 0.00 C ATOM 581 O SER A 39 25.943 -6.440 -10.660 1.00 0.00 O ATOM 582 CB SER A 39 27.411 -4.599 -7.981 1.00 0.00 C ATOM 583 OG SER A 39 27.003 -3.247 -8.049 1.00 0.00 O ATOM 0 H SER A 39 25.625 -7.225 -7.459 1.00 0.00 H new ATOM 0 HA SER A 39 25.360 -5.112 -7.985 1.00 0.00 H new ATOM 0 HB2 SER A 39 27.692 -4.855 -6.959 1.00 0.00 H new ATOM 0 HB3 SER A 39 28.293 -4.756 -8.603 1.00 0.00 H new ATOM 0 HG SER A 39 27.734 -2.669 -7.745 1.00 0.00 H new ATOM 589 N SER A 40 25.807 -4.210 -10.490 1.00 0.00 N ATOM 590 CA SER A 40 25.434 -3.903 -11.886 1.00 0.00 C ATOM 591 C SER A 40 26.222 -2.698 -12.432 1.00 0.00 C ATOM 592 O SER A 40 27.093 -2.155 -11.744 1.00 0.00 O ATOM 593 CB SER A 40 23.937 -3.574 -11.989 1.00 0.00 C ATOM 594 OG SER A 40 23.118 -4.337 -11.120 1.00 0.00 O ATOM 0 H SER A 40 25.898 -3.367 -9.923 1.00 0.00 H new ATOM 0 HA SER A 40 25.670 -4.790 -12.474 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.792 -2.516 -11.772 1.00 0.00 H new ATOM 0 HB3 SER A 40 23.610 -3.736 -13.016 1.00 0.00 H new ATOM 0 HG SER A 40 22.582 -4.967 -11.645 1.00 0.00 H new ATOM 600 N ARG A 41 25.882 -2.228 -13.644 1.00 0.00 N ATOM 601 CA ARG A 41 26.407 -0.981 -14.236 1.00 0.00 C ATOM 602 C ARG A 41 25.325 -0.117 -14.887 1.00 0.00 C ATOM 603 O ARG A 41 24.280 -0.622 -15.285 1.00 0.00 O ATOM 604 CB ARG A 41 27.508 -1.318 -15.274 1.00 0.00 C ATOM 605 CG ARG A 41 27.002 -2.138 -16.481 1.00 0.00 C ATOM 606 CD ARG A 41 28.027 -2.217 -17.619 1.00 0.00 C ATOM 607 NE ARG A 41 27.595 -3.210 -18.621 1.00 0.00 N ATOM 608 CZ ARG A 41 27.649 -3.146 -19.938 1.00 0.00 C ATOM 609 NH1 ARG A 41 28.065 -2.118 -20.614 1.00 0.00 N ATOM 610 NH2 ARG A 41 27.270 -4.160 -20.651 1.00 0.00 N ATOM 0 H ARG A 41 25.222 -2.712 -14.253 1.00 0.00 H new ATOM 0 HA ARG A 41 26.823 -0.394 -13.417 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.947 -0.389 -15.637 1.00 0.00 H new ATOM 0 HB3 ARG A 41 28.303 -1.874 -14.778 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.755 -3.147 -16.151 1.00 0.00 H new ATOM 0 HG3 ARG A 41 26.082 -1.691 -16.858 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.137 -1.239 -18.088 1.00 0.00 H new ATOM 0 HD3 ARG A 41 29.004 -2.492 -17.221 1.00 0.00 H new ATOM 0 HE ARG A 41 27.198 -4.069 -18.241 1.00 0.00 H new ATOM 0 HH11 ARG A 41 28.381 -1.280 -20.125 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.076 -2.148 -21.633 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.930 -5.006 -20.194 1.00 0.00 H new ATOM 0 HH22 ARG A 41 27.311 -4.112 -21.669 1.00 0.00 H new ATOM 624 N VAL A 42 25.604 1.177 -15.048 1.00 0.00 N ATOM 625 CA VAL A 42 24.801 2.099 -15.882 1.00 0.00 C ATOM 626 C VAL A 42 25.584 2.268 -17.189 1.00 0.00 C ATOM 627 O VAL A 42 26.815 2.225 -17.194 1.00 0.00 O ATOM 628 CB VAL A 42 24.507 3.458 -15.214 1.00 0.00 C ATOM 629 CG1 VAL A 42 23.491 4.287 -16.007 1.00 0.00 C ATOM 630 CG2 VAL A 42 23.942 3.279 -13.798 1.00 0.00 C ATOM 0 H VAL A 42 26.402 1.629 -14.601 1.00 0.00 H new ATOM 0 HA VAL A 42 23.810 1.676 -16.047 1.00 0.00 H new ATOM 0 HB VAL A 42 25.464 3.978 -15.182 1.00 0.00 H new ATOM 0 HG11 VAL A 42 23.317 5.234 -15.497 1.00 0.00 H new ATOM 0 HG12 VAL A 42 23.880 4.479 -17.007 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.553 3.738 -16.082 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.747 4.257 -13.358 1.00 0.00 H new ATOM 0 HG22 VAL A 42 23.013 2.711 -13.846 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.664 2.742 -13.183 1.00 0.00 H new ATOM 640 N HIS A 43 24.871 2.433 -18.302 1.00 0.00 N ATOM 641 CA HIS A 43 25.456 2.386 -19.648 1.00 0.00 C ATOM 642 C HIS A 43 25.059 3.599 -20.507 1.00 0.00 C ATOM 643 O HIS A 43 23.861 3.794 -20.713 1.00 0.00 O ATOM 644 CB HIS A 43 25.046 1.059 -20.309 1.00 0.00 C ATOM 645 CG HIS A 43 25.740 0.877 -21.629 1.00 0.00 C ATOM 646 ND1 HIS A 43 27.123 0.827 -21.792 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.145 0.919 -22.854 1.00 0.00 C ATOM 648 CE1 HIS A 43 27.337 0.829 -23.116 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.170 0.894 -23.777 1.00 0.00 N ATOM 0 H HIS A 43 23.865 2.604 -18.299 1.00 0.00 H new ATOM 0 HA HIS A 43 26.542 2.436 -19.564 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.292 0.228 -19.648 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.966 1.041 -20.456 1.00 0.00 H new ATOM 0 HD1 HIS A 43 27.828 0.795 -21.055 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.086 0.963 -23.061 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.309 0.785 -23.584 1.00 0.00 H new ATOM 657 N PRO A 44 25.999 4.392 -21.068 1.00 0.00 N ATOM 658 CA PRO A 44 25.680 5.625 -21.803 1.00 0.00 C ATOM 659 C PRO A 44 24.684 5.456 -22.956 1.00 0.00 C ATOM 660 O PRO A 44 23.792 6.290 -23.124 1.00 0.00 O ATOM 661 CB PRO A 44 27.025 6.171 -22.293 1.00 0.00 C ATOM 662 CG PRO A 44 27.997 5.689 -21.220 1.00 0.00 C ATOM 663 CD PRO A 44 27.446 4.309 -20.869 1.00 0.00 C ATOM 0 HA PRO A 44 25.162 6.315 -21.137 1.00 0.00 H new ATOM 0 HB2 PRO A 44 27.285 5.783 -23.278 1.00 0.00 H new ATOM 0 HB3 PRO A 44 27.016 7.258 -22.371 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.019 5.634 -21.594 1.00 0.00 H new ATOM 0 HG3 PRO A 44 28.009 6.353 -20.356 1.00 0.00 H new ATOM 0 HD2 PRO A 44 27.884 3.540 -21.505 1.00 0.00 H new ATOM 0 HD3 PRO A 44 27.684 4.044 -19.839 1.00 0.00 H new ATOM 671 N THR A 45 24.754 4.347 -23.704 1.00 0.00 N ATOM 672 CA THR A 45 23.799 4.080 -24.799 1.00 0.00 C ATOM 673 C THR A 45 22.384 3.845 -24.272 1.00 0.00 C ATOM 674 O THR A 45 21.431 4.255 -24.921 1.00 0.00 O ATOM 675 CB THR A 45 24.240 2.894 -25.678 1.00 0.00 C ATOM 676 OG1 THR A 45 25.631 2.924 -25.928 1.00 0.00 O ATOM 677 CG2 THR A 45 23.525 2.828 -27.026 1.00 0.00 C ATOM 0 H THR A 45 25.458 3.620 -23.575 1.00 0.00 H new ATOM 0 HA THR A 45 23.791 4.975 -25.420 1.00 0.00 H new ATOM 0 HB THR A 45 23.969 2.010 -25.100 1.00 0.00 H new ATOM 0 HG1 THR A 45 26.086 2.307 -25.318 1.00 0.00 H new ATOM 0 HG21 THR A 45 23.888 1.968 -27.589 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.452 2.729 -26.864 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.725 3.740 -27.589 1.00 0.00 H new ATOM 685 N ALA A 46 22.210 3.281 -23.070 1.00 0.00 N ATOM 686 CA ALA A 46 20.882 3.156 -22.464 1.00 0.00 C ATOM 687 C ALA A 46 20.314 4.535 -22.105 1.00 0.00 C ATOM 688 O ALA A 46 19.182 4.840 -22.468 1.00 0.00 O ATOM 689 CB ALA A 46 20.955 2.206 -21.258 1.00 0.00 C ATOM 0 H ALA A 46 22.969 2.906 -22.502 1.00 0.00 H new ATOM 0 HA ALA A 46 20.188 2.721 -23.183 1.00 0.00 H new ATOM 0 HB1 ALA A 46 19.967 2.113 -20.807 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.297 1.225 -21.588 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.653 2.605 -20.522 1.00 0.00 H new ATOM 695 N ILE A 47 21.130 5.414 -21.513 1.00 0.00 N ATOM 696 CA ILE A 47 20.732 6.802 -21.207 1.00 0.00 C ATOM 697 C ILE A 47 20.235 7.491 -22.492 1.00 0.00 C ATOM 698 O ILE A 47 19.121 8.017 -22.521 1.00 0.00 O ATOM 699 CB ILE A 47 21.890 7.604 -20.557 1.00 0.00 C ATOM 700 CG1 ILE A 47 22.558 6.822 -19.403 1.00 0.00 C ATOM 701 CG2 ILE A 47 21.360 8.962 -20.059 1.00 0.00 C ATOM 702 CD1 ILE A 47 23.778 7.517 -18.784 1.00 0.00 C ATOM 0 H ILE A 47 22.084 5.189 -21.231 1.00 0.00 H new ATOM 0 HA ILE A 47 19.921 6.774 -20.479 1.00 0.00 H new ATOM 0 HB ILE A 47 22.656 7.768 -21.315 1.00 0.00 H new ATOM 0 HG12 ILE A 47 21.818 6.651 -18.621 1.00 0.00 H new ATOM 0 HG13 ILE A 47 22.863 5.843 -19.773 1.00 0.00 H new ATOM 0 HG21 ILE A 47 22.174 9.525 -19.602 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.956 9.526 -20.900 1.00 0.00 H new ATOM 0 HG23 ILE A 47 20.574 8.798 -19.322 1.00 0.00 H new ATOM 0 HD11 ILE A 47 24.182 6.898 -17.983 1.00 0.00 H new ATOM 0 HD12 ILE A 47 24.540 7.664 -19.549 1.00 0.00 H new ATOM 0 HD13 ILE A 47 23.479 8.484 -18.379 1.00 0.00 H new ATOM 714 N ALA A 48 21.006 7.403 -23.580 1.00 0.00 N ATOM 715 CA ALA A 48 20.695 8.091 -24.834 1.00 0.00 C ATOM 716 C ALA A 48 19.541 7.456 -25.638 1.00 0.00 C ATOM 717 O ALA A 48 18.804 8.170 -26.321 1.00 0.00 O ATOM 718 CB ALA A 48 21.981 8.165 -25.664 1.00 0.00 C ATOM 0 H ALA A 48 21.864 6.852 -23.615 1.00 0.00 H new ATOM 0 HA ALA A 48 20.331 9.088 -24.587 1.00 0.00 H new ATOM 0 HB1 ALA A 48 21.777 8.674 -26.606 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.740 8.717 -25.110 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.341 7.157 -25.867 1.00 0.00 H new ATOM 724 N MET A 49 19.344 6.136 -25.555 1.00 0.00 N ATOM 725 CA MET A 49 18.235 5.432 -26.216 1.00 0.00 C ATOM 726 C MET A 49 16.906 5.585 -25.472 1.00 0.00 C ATOM 727 O MET A 49 15.857 5.420 -26.095 1.00 0.00 O ATOM 728 CB MET A 49 18.586 3.944 -26.393 1.00 0.00 C ATOM 729 CG MET A 49 19.726 3.709 -27.395 1.00 0.00 C ATOM 730 SD MET A 49 19.298 3.954 -29.142 1.00 0.00 S ATOM 731 CE MET A 49 20.023 5.595 -29.423 1.00 0.00 C ATOM 0 H MET A 49 19.956 5.518 -25.022 1.00 0.00 H new ATOM 0 HA MET A 49 18.099 5.894 -27.194 1.00 0.00 H new ATOM 0 HB2 MET A 49 18.868 3.526 -25.427 1.00 0.00 H new ATOM 0 HB3 MET A 49 17.700 3.405 -26.727 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.550 4.377 -27.144 1.00 0.00 H new ATOM 0 HG3 MET A 49 20.092 2.690 -27.269 1.00 0.00 H new ATOM 0 HE1 MET A 49 20.171 5.749 -30.492 1.00 0.00 H new ATOM 0 HE2 MET A 49 19.351 6.361 -29.035 1.00 0.00 H new ATOM 0 HE3 MET A 49 20.983 5.661 -28.911 1.00 0.00 H new ATOM 741 N MET A 50 16.921 5.892 -24.167 1.00 0.00 N ATOM 742 CA MET A 50 15.694 6.041 -23.367 1.00 0.00 C ATOM 743 C MET A 50 15.357 7.503 -23.019 1.00 0.00 C ATOM 744 O MET A 50 14.195 7.794 -22.738 1.00 0.00 O ATOM 745 CB MET A 50 15.709 5.130 -22.124 1.00 0.00 C ATOM 746 CG MET A 50 16.183 3.678 -22.320 1.00 0.00 C ATOM 747 SD MET A 50 15.970 2.895 -23.935 1.00 0.00 S ATOM 748 CE MET A 50 17.113 1.496 -23.760 1.00 0.00 C ATOM 0 H MET A 50 17.779 6.044 -23.637 1.00 0.00 H new ATOM 0 HA MET A 50 14.878 5.705 -24.007 1.00 0.00 H new ATOM 0 HB2 MET A 50 16.347 5.595 -21.372 1.00 0.00 H new ATOM 0 HB3 MET A 50 14.700 5.103 -21.713 1.00 0.00 H new ATOM 0 HG2 MET A 50 17.245 3.643 -22.075 1.00 0.00 H new ATOM 0 HG3 MET A 50 15.666 3.061 -21.585 1.00 0.00 H new ATOM 0 HE1 MET A 50 17.311 1.063 -24.740 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.049 1.843 -23.321 1.00 0.00 H new ATOM 0 HE3 MET A 50 16.667 0.741 -23.113 1.00 0.00 H new ATOM 758 N GLU A 51 16.293 8.456 -23.133 1.00 0.00 N ATOM 759 CA GLU A 51 15.970 9.889 -22.977 1.00 0.00 C ATOM 760 C GLU A 51 15.017 10.410 -24.071 1.00 0.00 C ATOM 761 O GLU A 51 14.224 11.318 -23.824 1.00 0.00 O ATOM 762 CB GLU A 51 17.227 10.769 -22.840 1.00 0.00 C ATOM 763 CG GLU A 51 18.025 10.962 -24.133 1.00 0.00 C ATOM 764 CD GLU A 51 19.188 11.950 -23.909 1.00 0.00 C ATOM 765 OE1 GLU A 51 18.983 13.176 -24.094 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.317 11.523 -23.561 1.00 0.00 O ATOM 0 H GLU A 51 17.275 8.266 -23.331 1.00 0.00 H new ATOM 0 HA GLU A 51 15.429 9.968 -22.034 1.00 0.00 H new ATOM 0 HB2 GLU A 51 16.928 11.748 -22.466 1.00 0.00 H new ATOM 0 HB3 GLU A 51 17.882 10.327 -22.089 1.00 0.00 H new ATOM 0 HG2 GLU A 51 18.416 10.003 -24.473 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.369 11.336 -24.919 1.00 0.00 H new ATOM 773 N GLU A 52 15.008 9.767 -25.245 1.00 0.00 N ATOM 774 CA GLU A 52 14.043 10.032 -26.334 1.00 0.00 C ATOM 775 C GLU A 52 12.627 9.468 -26.050 1.00 0.00 C ATOM 776 O GLU A 52 11.678 9.769 -26.775 1.00 0.00 O ATOM 777 CB GLU A 52 14.617 9.577 -27.691 1.00 0.00 C ATOM 778 CG GLU A 52 15.029 8.101 -27.736 1.00 0.00 C ATOM 779 CD GLU A 52 15.483 7.658 -29.142 1.00 0.00 C ATOM 780 OE1 GLU A 52 16.423 8.245 -29.727 1.00 0.00 O ATOM 781 OE2 GLU A 52 14.930 6.663 -29.669 1.00 0.00 O ATOM 0 H GLU A 52 15.680 9.035 -25.475 1.00 0.00 H new ATOM 0 HA GLU A 52 13.900 11.111 -26.385 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.873 9.759 -28.467 1.00 0.00 H new ATOM 0 HB3 GLU A 52 15.484 10.192 -27.931 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.838 7.931 -27.026 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.190 7.483 -27.417 1.00 0.00 H new ATOM 788 N VAL A 53 12.478 8.703 -24.959 1.00 0.00 N ATOM 789 CA VAL A 53 11.204 8.233 -24.370 1.00 0.00 C ATOM 790 C VAL A 53 10.894 9.012 -23.068 1.00 0.00 C ATOM 791 O VAL A 53 9.894 8.764 -22.397 1.00 0.00 O ATOM 792 CB VAL A 53 11.235 6.690 -24.199 1.00 0.00 C ATOM 793 CG1 VAL A 53 9.911 6.078 -23.719 1.00 0.00 C ATOM 794 CG2 VAL A 53 11.579 5.997 -25.527 1.00 0.00 C ATOM 0 H VAL A 53 13.286 8.374 -24.430 1.00 0.00 H new ATOM 0 HA VAL A 53 10.374 8.444 -25.044 1.00 0.00 H new ATOM 0 HB VAL A 53 11.995 6.524 -23.435 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.022 4.998 -23.627 1.00 0.00 H new ATOM 0 HG12 VAL A 53 9.646 6.500 -22.750 1.00 0.00 H new ATOM 0 HG13 VAL A 53 9.124 6.302 -24.440 1.00 0.00 H new ATOM 0 HG21 VAL A 53 11.594 4.917 -25.381 1.00 0.00 H new ATOM 0 HG22 VAL A 53 10.828 6.251 -26.275 1.00 0.00 H new ATOM 0 HG23 VAL A 53 12.559 6.331 -25.868 1.00 0.00 H new ATOM 804 N GLY A 54 11.734 9.994 -22.705 1.00 0.00 N ATOM 805 CA GLY A 54 11.602 10.819 -21.496 1.00 0.00 C ATOM 806 C GLY A 54 12.115 10.159 -20.205 1.00 0.00 C ATOM 807 O GLY A 54 11.819 10.650 -19.114 1.00 0.00 O ATOM 0 H GLY A 54 12.550 10.243 -23.264 1.00 0.00 H new ATOM 0 HA2 GLY A 54 12.143 11.753 -21.650 1.00 0.00 H new ATOM 0 HA3 GLY A 54 10.552 11.077 -21.363 1.00 0.00 H new ATOM 811 N ILE A 55 12.867 9.055 -20.311 1.00 0.00 N ATOM 812 CA ILE A 55 13.425 8.309 -19.167 1.00 0.00 C ATOM 813 C ILE A 55 14.826 8.836 -18.812 1.00 0.00 C ATOM 814 O ILE A 55 15.553 9.333 -19.670 1.00 0.00 O ATOM 815 CB ILE A 55 13.477 6.787 -19.452 1.00 0.00 C ATOM 816 CG1 ILE A 55 12.291 6.230 -20.263 1.00 0.00 C ATOM 817 CG2 ILE A 55 13.615 5.969 -18.154 1.00 0.00 C ATOM 818 CD1 ILE A 55 10.904 6.396 -19.625 1.00 0.00 C ATOM 0 H ILE A 55 13.111 8.644 -21.212 1.00 0.00 H new ATOM 0 HA ILE A 55 12.763 8.466 -18.315 1.00 0.00 H new ATOM 0 HB ILE A 55 14.365 6.675 -20.074 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.282 6.718 -21.238 1.00 0.00 H new ATOM 0 HG13 ILE A 55 12.463 5.168 -20.439 1.00 0.00 H new ATOM 0 HG21 ILE A 55 13.648 4.907 -18.395 1.00 0.00 H new ATOM 0 HG22 ILE A 55 14.534 6.253 -17.641 1.00 0.00 H new ATOM 0 HG23 ILE A 55 12.761 6.168 -17.506 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.147 5.968 -20.283 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.882 5.882 -18.664 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.697 7.456 -19.475 1.00 0.00 H new ATOM 830 N ASP A 56 15.239 8.662 -17.559 1.00 0.00 N ATOM 831 CA ASP A 56 16.618 8.911 -17.112 1.00 0.00 C ATOM 832 C ASP A 56 17.074 7.868 -16.084 1.00 0.00 C ATOM 833 O ASP A 56 16.362 7.591 -15.119 1.00 0.00 O ATOM 834 CB ASP A 56 16.741 10.328 -16.535 1.00 0.00 C ATOM 835 CG ASP A 56 18.133 10.586 -15.925 1.00 0.00 C ATOM 836 OD1 ASP A 56 19.148 10.152 -16.521 1.00 0.00 O ATOM 837 OD2 ASP A 56 18.211 11.183 -14.824 1.00 0.00 O ATOM 0 H ASP A 56 14.623 8.341 -16.813 1.00 0.00 H new ATOM 0 HA ASP A 56 17.273 8.825 -17.979 1.00 0.00 H new ATOM 0 HB2 ASP A 56 16.550 11.057 -17.322 1.00 0.00 H new ATOM 0 HB3 ASP A 56 15.978 10.476 -15.771 1.00 0.00 H new ATOM 842 N ILE A 57 18.285 7.324 -16.268 1.00 0.00 N ATOM 843 CA ILE A 57 18.966 6.476 -15.278 1.00 0.00 C ATOM 844 C ILE A 57 20.433 6.873 -15.034 1.00 0.00 C ATOM 845 O ILE A 57 21.160 6.125 -14.387 1.00 0.00 O ATOM 846 CB ILE A 57 18.814 4.967 -15.585 1.00 0.00 C ATOM 847 CG1 ILE A 57 19.501 4.511 -16.888 1.00 0.00 C ATOM 848 CG2 ILE A 57 17.331 4.565 -15.582 1.00 0.00 C ATOM 849 CD1 ILE A 57 19.775 3.001 -16.868 1.00 0.00 C ATOM 0 H ILE A 57 18.827 7.462 -17.121 1.00 0.00 H new ATOM 0 HA ILE A 57 18.449 6.662 -14.337 1.00 0.00 H new ATOM 0 HB ILE A 57 19.338 4.447 -14.783 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.870 4.758 -17.742 1.00 0.00 H new ATOM 0 HG13 ILE A 57 20.438 5.052 -17.018 1.00 0.00 H new ATOM 0 HG21 ILE A 57 17.242 3.501 -15.800 1.00 0.00 H new ATOM 0 HG22 ILE A 57 16.900 4.772 -14.603 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.798 5.136 -16.342 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.260 2.707 -17.799 1.00 0.00 H new ATOM 0 HD12 ILE A 57 20.426 2.761 -16.028 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.834 2.462 -16.763 1.00 0.00 H new ATOM 861 N SER A 58 20.890 8.038 -15.506 1.00 0.00 N ATOM 862 CA SER A 58 22.298 8.464 -15.386 1.00 0.00 C ATOM 863 C SER A 58 22.782 8.505 -13.922 1.00 0.00 C ATOM 864 O SER A 58 23.929 8.168 -13.619 1.00 0.00 O ATOM 865 CB SER A 58 22.447 9.857 -16.020 1.00 0.00 C ATOM 866 OG SER A 58 23.812 10.242 -16.088 1.00 0.00 O ATOM 0 H SER A 58 20.297 8.717 -15.984 1.00 0.00 H new ATOM 0 HA SER A 58 22.916 7.731 -15.904 1.00 0.00 H new ATOM 0 HB2 SER A 58 22.016 9.853 -17.021 1.00 0.00 H new ATOM 0 HB3 SER A 58 21.888 10.588 -15.436 1.00 0.00 H new ATOM 0 HG SER A 58 23.881 11.130 -16.496 1.00 0.00 H new ATOM 872 N GLY A 59 21.875 8.857 -12.997 1.00 0.00 N ATOM 873 CA GLY A 59 22.132 8.940 -11.552 1.00 0.00 C ATOM 874 C GLY A 59 21.941 7.634 -10.758 1.00 0.00 C ATOM 875 O GLY A 59 22.059 7.668 -9.532 1.00 0.00 O ATOM 0 H GLY A 59 20.915 9.099 -13.242 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.155 9.286 -11.404 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.474 9.699 -11.129 1.00 0.00 H new ATOM 879 N GLN A 60 21.626 6.497 -11.400 1.00 0.00 N ATOM 880 CA GLN A 60 21.375 5.230 -10.683 1.00 0.00 C ATOM 881 C GLN A 60 22.666 4.549 -10.183 1.00 0.00 C ATOM 882 O GLN A 60 23.768 4.799 -10.677 1.00 0.00 O ATOM 883 CB GLN A 60 20.531 4.254 -11.528 1.00 0.00 C ATOM 884 CG GLN A 60 19.175 4.813 -11.988 1.00 0.00 C ATOM 885 CD GLN A 60 18.324 5.416 -10.883 1.00 0.00 C ATOM 886 OE1 GLN A 60 17.945 6.578 -10.919 1.00 0.00 O ATOM 887 NE2 GLN A 60 17.970 4.647 -9.888 1.00 0.00 N ATOM 0 H GLN A 60 21.538 6.426 -12.414 1.00 0.00 H new ATOM 0 HA GLN A 60 20.801 5.501 -9.797 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.107 3.964 -12.407 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.357 3.348 -10.947 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.351 5.575 -12.748 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.611 4.012 -12.465 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.285 3.677 -9.856 1.00 0.00 H new ATOM 0 HE22 GLN A 60 17.379 5.016 -9.143 1.00 0.00 H new ATOM 896 N THR A 61 22.508 3.653 -9.207 1.00 0.00 N ATOM 897 CA THR A 61 23.579 2.864 -8.562 1.00 0.00 C ATOM 898 C THR A 61 23.187 1.381 -8.454 1.00 0.00 C ATOM 899 O THR A 61 22.054 1.000 -8.759 1.00 0.00 O ATOM 900 CB THR A 61 23.907 3.427 -7.162 1.00 0.00 C ATOM 901 OG1 THR A 61 22.746 3.438 -6.352 1.00 0.00 O ATOM 902 CG2 THR A 61 24.459 4.856 -7.219 1.00 0.00 C ATOM 0 H THR A 61 21.588 3.442 -8.820 1.00 0.00 H new ATOM 0 HA THR A 61 24.468 2.941 -9.188 1.00 0.00 H new ATOM 0 HB THR A 61 24.671 2.774 -6.740 1.00 0.00 H new ATOM 0 HG1 THR A 61 22.968 3.795 -5.467 1.00 0.00 H new ATOM 0 HG21 THR A 61 24.673 5.204 -6.208 1.00 0.00 H new ATOM 0 HG22 THR A 61 25.376 4.869 -7.809 1.00 0.00 H new ATOM 0 HG23 THR A 61 23.721 5.513 -7.680 1.00 0.00 H new ATOM 910 N SER A 62 24.130 0.526 -8.044 1.00 0.00 N ATOM 911 CA SER A 62 23.880 -0.880 -7.688 1.00 0.00 C ATOM 912 C SER A 62 24.864 -1.367 -6.612 1.00 0.00 C ATOM 913 O SER A 62 25.916 -0.757 -6.394 1.00 0.00 O ATOM 914 CB SER A 62 23.965 -1.766 -8.929 1.00 0.00 C ATOM 915 OG SER A 62 23.412 -3.043 -8.646 1.00 0.00 O ATOM 0 H SER A 62 25.109 0.795 -7.947 1.00 0.00 H new ATOM 0 HA SER A 62 22.873 -0.948 -7.276 1.00 0.00 H new ATOM 0 HB2 SER A 62 23.428 -1.302 -9.756 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.004 -1.870 -9.242 1.00 0.00 H new ATOM 0 HG SER A 62 23.287 -3.538 -9.482 1.00 0.00 H new ATOM 921 N ASP A 63 24.512 -2.469 -5.949 1.00 0.00 N ATOM 922 CA ASP A 63 25.350 -3.215 -5.005 1.00 0.00 C ATOM 923 C ASP A 63 24.983 -4.716 -5.059 1.00 0.00 C ATOM 924 O ASP A 63 23.882 -5.051 -5.514 1.00 0.00 O ATOM 925 CB ASP A 63 25.173 -2.682 -3.571 1.00 0.00 C ATOM 926 CG ASP A 63 25.861 -1.328 -3.337 1.00 0.00 C ATOM 927 OD1 ASP A 63 27.112 -1.300 -3.227 1.00 0.00 O ATOM 928 OD2 ASP A 63 25.155 -0.300 -3.177 1.00 0.00 O ATOM 0 H ASP A 63 23.589 -2.888 -6.060 1.00 0.00 H new ATOM 0 HA ASP A 63 26.394 -3.084 -5.290 1.00 0.00 H new ATOM 0 HB2 ASP A 63 24.109 -2.583 -3.356 1.00 0.00 H new ATOM 0 HB3 ASP A 63 25.574 -3.412 -2.867 1.00 0.00 H new ATOM 933 N PRO A 64 25.858 -5.633 -4.593 1.00 0.00 N ATOM 934 CA PRO A 64 25.566 -7.066 -4.544 1.00 0.00 C ATOM 935 C PRO A 64 24.344 -7.380 -3.679 1.00 0.00 C ATOM 936 O PRO A 64 24.219 -6.872 -2.565 1.00 0.00 O ATOM 937 CB PRO A 64 26.834 -7.740 -3.997 1.00 0.00 C ATOM 938 CG PRO A 64 27.938 -6.732 -4.313 1.00 0.00 C ATOM 939 CD PRO A 64 27.223 -5.397 -4.134 1.00 0.00 C ATOM 0 HA PRO A 64 25.314 -7.441 -5.536 1.00 0.00 H new ATOM 0 HB2 PRO A 64 26.758 -7.929 -2.926 1.00 0.00 H new ATOM 0 HB3 PRO A 64 27.018 -8.701 -4.478 1.00 0.00 H new ATOM 0 HG2 PRO A 64 28.786 -6.833 -3.636 1.00 0.00 H new ATOM 0 HG3 PRO A 64 28.322 -6.855 -5.326 1.00 0.00 H new ATOM 0 HD2 PRO A 64 27.239 -5.078 -3.092 1.00 0.00 H new ATOM 0 HD3 PRO A 64 27.704 -4.611 -4.716 1.00 0.00 H new ATOM 947 N ILE A 65 23.456 -8.252 -4.160 1.00 0.00 N ATOM 948 CA ILE A 65 22.151 -8.515 -3.523 1.00 0.00 C ATOM 949 C ILE A 65 22.230 -8.949 -2.048 1.00 0.00 C ATOM 950 O ILE A 65 21.370 -8.585 -1.249 1.00 0.00 O ATOM 951 CB ILE A 65 21.352 -9.511 -4.397 1.00 0.00 C ATOM 952 CG1 ILE A 65 19.861 -9.501 -4.002 1.00 0.00 C ATOM 953 CG2 ILE A 65 21.952 -10.934 -4.366 1.00 0.00 C ATOM 954 CD1 ILE A 65 18.983 -10.361 -4.913 1.00 0.00 C ATOM 0 H ILE A 65 23.616 -8.801 -5.005 1.00 0.00 H new ATOM 0 HA ILE A 65 21.618 -7.565 -3.474 1.00 0.00 H new ATOM 0 HB ILE A 65 21.428 -9.177 -5.432 1.00 0.00 H new ATOM 0 HG12 ILE A 65 19.763 -9.855 -2.976 1.00 0.00 H new ATOM 0 HG13 ILE A 65 19.495 -8.474 -4.021 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.355 -11.594 -4.995 1.00 0.00 H new ATOM 0 HG22 ILE A 65 22.976 -10.905 -4.739 1.00 0.00 H new ATOM 0 HG23 ILE A 65 21.949 -11.308 -3.342 1.00 0.00 H new ATOM 0 HD11 ILE A 65 17.948 -10.307 -4.577 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.052 -9.994 -5.937 1.00 0.00 H new ATOM 0 HD13 ILE A 65 19.323 -11.396 -4.875 1.00 0.00 H new ATOM 966 N GLU A 66 23.303 -9.640 -1.647 1.00 0.00 N ATOM 967 CA GLU A 66 23.510 -10.096 -0.261 1.00 0.00 C ATOM 968 C GLU A 66 23.752 -8.943 0.741 1.00 0.00 C ATOM 969 O GLU A 66 23.641 -9.160 1.949 1.00 0.00 O ATOM 970 CB GLU A 66 24.669 -11.106 -0.209 1.00 0.00 C ATOM 971 CG GLU A 66 24.369 -12.391 -0.993 1.00 0.00 C ATOM 972 CD GLU A 66 25.500 -13.420 -0.799 1.00 0.00 C ATOM 973 OE1 GLU A 66 26.489 -13.397 -1.573 1.00 0.00 O ATOM 974 OE2 GLU A 66 25.409 -14.261 0.129 1.00 0.00 O ATOM 0 H GLU A 66 24.060 -9.902 -2.278 1.00 0.00 H new ATOM 0 HA GLU A 66 22.582 -10.576 0.051 1.00 0.00 H new ATOM 0 HB2 GLU A 66 25.569 -10.641 -0.611 1.00 0.00 H new ATOM 0 HB3 GLU A 66 24.879 -11.360 0.830 1.00 0.00 H new ATOM 0 HG2 GLU A 66 23.422 -12.815 -0.658 1.00 0.00 H new ATOM 0 HG3 GLU A 66 24.258 -12.160 -2.052 1.00 0.00 H new ATOM 981 N ASN A 67 24.042 -7.717 0.275 1.00 0.00 N ATOM 982 CA ASN A 67 24.140 -6.536 1.149 1.00 0.00 C ATOM 983 C ASN A 67 22.756 -5.998 1.600 1.00 0.00 C ATOM 984 O ASN A 67 22.675 -5.274 2.595 1.00 0.00 O ATOM 985 CB ASN A 67 25.018 -5.451 0.478 1.00 0.00 C ATOM 986 CG ASN A 67 24.211 -4.296 -0.107 1.00 0.00 C ATOM 987 OD1 ASN A 67 24.102 -3.224 0.467 1.00 0.00 O ATOM 988 ND2 ASN A 67 23.589 -4.495 -1.241 1.00 0.00 N ATOM 0 H ASN A 67 24.214 -7.517 -0.710 1.00 0.00 H new ATOM 0 HA ASN A 67 24.631 -6.844 2.072 1.00 0.00 H new ATOM 0 HB2 ASN A 67 25.721 -5.058 1.212 1.00 0.00 H new ATOM 0 HB3 ASN A 67 25.608 -5.911 -0.315 1.00 0.00 H new ATOM 0 HD21 ASN A 67 23.014 -3.755 -1.644 1.00 0.00 H new ATOM 0 HD22 ASN A 67 23.679 -5.390 -1.722 1.00 0.00 H new ATOM 995 N PHE A 68 21.683 -6.333 0.874 1.00 0.00 N ATOM 996 CA PHE A 68 20.323 -5.833 1.110 1.00 0.00 C ATOM 997 C PHE A 68 19.471 -6.788 1.974 1.00 0.00 C ATOM 998 O PHE A 68 19.819 -7.951 2.188 1.00 0.00 O ATOM 999 CB PHE A 68 19.646 -5.542 -0.245 1.00 0.00 C ATOM 1000 CG PHE A 68 20.302 -4.479 -1.107 1.00 0.00 C ATOM 1001 CD1 PHE A 68 20.507 -3.177 -0.610 1.00 0.00 C ATOM 1002 CD2 PHE A 68 20.677 -4.789 -2.428 1.00 0.00 C ATOM 1003 CE1 PHE A 68 21.101 -2.200 -1.427 1.00 0.00 C ATOM 1004 CE2 PHE A 68 21.278 -3.811 -3.240 1.00 0.00 C ATOM 1005 CZ PHE A 68 21.479 -2.517 -2.741 1.00 0.00 C ATOM 0 H PHE A 68 21.738 -6.977 0.085 1.00 0.00 H new ATOM 0 HA PHE A 68 20.400 -4.910 1.685 1.00 0.00 H new ATOM 0 HB2 PHE A 68 19.608 -6.470 -0.815 1.00 0.00 H new ATOM 0 HB3 PHE A 68 18.615 -5.242 -0.056 1.00 0.00 H new ATOM 0 HD1 PHE A 68 20.208 -2.930 0.398 1.00 0.00 H new ATOM 0 HD2 PHE A 68 20.503 -5.781 -2.819 1.00 0.00 H new ATOM 0 HE1 PHE A 68 21.267 -1.204 -1.043 1.00 0.00 H new ATOM 0 HE2 PHE A 68 21.584 -4.057 -4.246 1.00 0.00 H new ATOM 0 HZ PHE A 68 21.926 -1.761 -3.370 1.00 0.00 H new ATOM 1015 N ASN A 69 18.322 -6.284 2.445 1.00 0.00 N ATOM 1016 CA ASN A 69 17.316 -7.019 3.229 1.00 0.00 C ATOM 1017 C ASN A 69 16.011 -7.194 2.431 1.00 0.00 C ATOM 1018 O ASN A 69 15.280 -6.231 2.216 1.00 0.00 O ATOM 1019 CB ASN A 69 17.100 -6.305 4.586 1.00 0.00 C ATOM 1020 CG ASN A 69 17.103 -4.776 4.548 1.00 0.00 C ATOM 1021 OD1 ASN A 69 17.847 -4.120 5.265 1.00 0.00 O ATOM 1022 ND2 ASN A 69 16.303 -4.151 3.714 1.00 0.00 N ATOM 0 H ASN A 69 18.056 -5.313 2.284 1.00 0.00 H new ATOM 0 HA ASN A 69 17.677 -8.026 3.437 1.00 0.00 H new ATOM 0 HB2 ASN A 69 16.148 -6.636 5.001 1.00 0.00 H new ATOM 0 HB3 ASN A 69 17.879 -6.633 5.274 1.00 0.00 H new ATOM 0 HD21 ASN A 69 16.307 -3.132 3.670 1.00 0.00 H new ATOM 0 HD22 ASN A 69 15.678 -4.685 3.110 1.00 0.00 H new ATOM 1029 N ALA A 70 15.679 -8.413 2.013 1.00 0.00 N ATOM 1030 CA ALA A 70 14.579 -8.680 1.083 1.00 0.00 C ATOM 1031 C ALA A 70 13.174 -8.394 1.647 1.00 0.00 C ATOM 1032 O ALA A 70 12.222 -8.218 0.887 1.00 0.00 O ATOM 1033 CB ALA A 70 14.694 -10.138 0.664 1.00 0.00 C ATOM 0 H ALA A 70 16.171 -9.255 2.313 1.00 0.00 H new ATOM 0 HA ALA A 70 14.678 -7.995 0.241 1.00 0.00 H new ATOM 0 HB1 ALA A 70 13.891 -10.381 -0.032 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.656 -10.302 0.179 1.00 0.00 H new ATOM 0 HB3 ALA A 70 14.617 -10.777 1.544 1.00 0.00 H new ATOM 1039 N ASP A 71 13.046 -8.318 2.974 1.00 0.00 N ATOM 1040 CA ASP A 71 11.781 -8.063 3.679 1.00 0.00 C ATOM 1041 C ASP A 71 11.199 -6.670 3.370 1.00 0.00 C ATOM 1042 O ASP A 71 9.989 -6.456 3.428 1.00 0.00 O ATOM 1043 CB ASP A 71 12.052 -8.159 5.184 1.00 0.00 C ATOM 1044 CG ASP A 71 10.755 -8.102 6.010 1.00 0.00 C ATOM 1045 OD1 ASP A 71 9.929 -9.042 5.906 1.00 0.00 O ATOM 1046 OD2 ASP A 71 10.571 -7.138 6.792 1.00 0.00 O ATOM 0 H ASP A 71 13.838 -8.435 3.607 1.00 0.00 H new ATOM 0 HA ASP A 71 11.052 -8.801 3.345 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.578 -9.089 5.399 1.00 0.00 H new ATOM 0 HB3 ASP A 71 12.710 -7.344 5.486 1.00 0.00 H new ATOM 1051 N ASP A 72 12.079 -5.730 3.026 1.00 0.00 N ATOM 1052 CA ASP A 72 11.764 -4.336 2.725 1.00 0.00 C ATOM 1053 C ASP A 72 11.426 -4.122 1.235 1.00 0.00 C ATOM 1054 O ASP A 72 11.060 -3.018 0.836 1.00 0.00 O ATOM 1055 CB ASP A 72 12.959 -3.495 3.185 1.00 0.00 C ATOM 1056 CG ASP A 72 12.652 -1.988 3.203 1.00 0.00 C ATOM 1057 OD1 ASP A 72 11.716 -1.561 3.920 1.00 0.00 O ATOM 1058 OD2 ASP A 72 13.380 -1.212 2.537 1.00 0.00 O ATOM 0 H ASP A 72 13.076 -5.930 2.946 1.00 0.00 H new ATOM 0 HA ASP A 72 10.864 -4.027 3.257 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.259 -3.813 4.184 1.00 0.00 H new ATOM 0 HB3 ASP A 72 13.805 -3.681 2.524 1.00 0.00 H new ATOM 1063 N TYR A 73 11.519 -5.187 0.424 1.00 0.00 N ATOM 1064 CA TYR A 73 11.166 -5.242 -0.989 1.00 0.00 C ATOM 1065 C TYR A 73 10.016 -6.230 -1.146 1.00 0.00 C ATOM 1066 O TYR A 73 10.208 -7.395 -1.486 1.00 0.00 O ATOM 1067 CB TYR A 73 12.394 -5.604 -1.831 1.00 0.00 C ATOM 1068 CG TYR A 73 13.542 -4.650 -1.594 1.00 0.00 C ATOM 1069 CD1 TYR A 73 13.612 -3.435 -2.291 1.00 0.00 C ATOM 1070 CD2 TYR A 73 14.481 -4.939 -0.590 1.00 0.00 C ATOM 1071 CE1 TYR A 73 14.632 -2.518 -1.986 1.00 0.00 C ATOM 1072 CE2 TYR A 73 15.499 -4.023 -0.274 1.00 0.00 C ATOM 1073 CZ TYR A 73 15.578 -2.799 -0.977 1.00 0.00 C ATOM 1074 OH TYR A 73 16.553 -1.890 -0.693 1.00 0.00 O ATOM 0 H TYR A 73 11.865 -6.084 0.766 1.00 0.00 H new ATOM 0 HA TYR A 73 10.834 -4.270 -1.353 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.711 -6.619 -1.593 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.126 -5.593 -2.887 1.00 0.00 H new ATOM 0 HD1 TYR A 73 12.886 -3.206 -3.057 1.00 0.00 H new ATOM 0 HD2 TYR A 73 14.420 -5.875 -0.055 1.00 0.00 H new ATOM 0 HE1 TYR A 73 14.693 -1.587 -2.530 1.00 0.00 H new ATOM 0 HE2 TYR A 73 16.216 -4.253 0.500 1.00 0.00 H new ATOM 0 HH TYR A 73 17.122 -2.235 0.027 1.00 0.00 H new ATOM 1084 N ASP A 74 8.807 -5.758 -0.850 1.00 0.00 N ATOM 1085 CA ASP A 74 7.555 -6.530 -0.900 1.00 0.00 C ATOM 1086 C ASP A 74 7.337 -7.235 -2.249 1.00 0.00 C ATOM 1087 O ASP A 74 6.651 -8.255 -2.320 1.00 0.00 O ATOM 1088 CB ASP A 74 6.364 -5.581 -0.671 1.00 0.00 C ATOM 1089 CG ASP A 74 6.612 -4.555 0.444 1.00 0.00 C ATOM 1090 OD1 ASP A 74 7.294 -3.543 0.149 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.129 -4.755 1.584 1.00 0.00 O ATOM 0 H ASP A 74 8.661 -4.792 -0.557 1.00 0.00 H new ATOM 0 HA ASP A 74 7.627 -7.292 -0.124 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.145 -5.053 -1.599 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.481 -6.170 -0.424 1.00 0.00 H new ATOM 1096 N VAL A 75 7.913 -6.685 -3.322 1.00 0.00 N ATOM 1097 CA VAL A 75 7.789 -7.163 -4.699 1.00 0.00 C ATOM 1098 C VAL A 75 9.182 -7.219 -5.347 1.00 0.00 C ATOM 1099 O VAL A 75 9.950 -6.259 -5.264 1.00 0.00 O ATOM 1100 CB VAL A 75 6.792 -6.258 -5.451 1.00 0.00 C ATOM 1101 CG1 VAL A 75 6.698 -6.618 -6.939 1.00 0.00 C ATOM 1102 CG2 VAL A 75 5.384 -6.361 -4.845 1.00 0.00 C ATOM 0 H VAL A 75 8.505 -5.857 -3.249 1.00 0.00 H new ATOM 0 HA VAL A 75 7.391 -8.177 -4.736 1.00 0.00 H new ATOM 0 HB VAL A 75 7.171 -5.241 -5.350 1.00 0.00 H new ATOM 0 HG11 VAL A 75 5.985 -5.956 -7.429 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.677 -6.504 -7.403 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.365 -7.651 -7.043 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.703 -5.712 -5.395 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.035 -7.392 -4.909 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.414 -6.052 -3.800 1.00 0.00 H new ATOM 1112 N VAL A 76 9.535 -8.335 -5.991 1.00 0.00 N ATOM 1113 CA VAL A 76 10.888 -8.564 -6.552 1.00 0.00 C ATOM 1114 C VAL A 76 10.794 -9.111 -7.978 1.00 0.00 C ATOM 1115 O VAL A 76 10.214 -10.171 -8.204 1.00 0.00 O ATOM 1116 CB VAL A 76 11.720 -9.497 -5.641 1.00 0.00 C ATOM 1117 CG1 VAL A 76 13.066 -9.892 -6.272 1.00 0.00 C ATOM 1118 CG2 VAL A 76 12.047 -8.848 -4.287 1.00 0.00 C ATOM 0 H VAL A 76 8.894 -9.114 -6.143 1.00 0.00 H new ATOM 0 HA VAL A 76 11.406 -7.606 -6.594 1.00 0.00 H new ATOM 0 HB VAL A 76 11.091 -10.377 -5.506 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.609 -10.547 -5.591 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.888 -10.414 -7.212 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.656 -8.995 -6.461 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.632 -9.541 -3.683 1.00 0.00 H new ATOM 0 HG22 VAL A 76 12.621 -7.936 -4.450 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.120 -8.606 -3.766 1.00 0.00 H new ATOM 1128 N ILE A 77 11.371 -8.394 -8.944 1.00 0.00 N ATOM 1129 CA ILE A 77 11.418 -8.773 -10.366 1.00 0.00 C ATOM 1130 C ILE A 77 12.873 -9.092 -10.726 1.00 0.00 C ATOM 1131 O ILE A 77 13.756 -8.239 -10.628 1.00 0.00 O ATOM 1132 CB ILE A 77 10.823 -7.655 -11.271 1.00 0.00 C ATOM 1133 CG1 ILE A 77 9.274 -7.473 -11.277 1.00 0.00 C ATOM 1134 CG2 ILE A 77 11.234 -7.861 -12.742 1.00 0.00 C ATOM 1135 CD1 ILE A 77 8.515 -7.882 -10.015 1.00 0.00 C ATOM 0 H ILE A 77 11.834 -7.505 -8.757 1.00 0.00 H new ATOM 0 HA ILE A 77 10.802 -9.656 -10.538 1.00 0.00 H new ATOM 0 HB ILE A 77 11.242 -6.760 -10.812 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.059 -6.423 -11.475 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.871 -8.044 -12.113 1.00 0.00 H new ATOM 0 HG21 ILE A 77 10.806 -7.067 -13.354 1.00 0.00 H new ATOM 0 HG22 ILE A 77 12.321 -7.836 -12.823 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.867 -8.826 -13.091 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.449 -7.702 -10.157 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.681 -8.941 -9.817 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.872 -7.295 -9.169 1.00 0.00 H new ATOM 1147 N SER A 78 13.113 -10.316 -11.177 1.00 0.00 N ATOM 1148 CA SER A 78 14.372 -10.758 -11.781 1.00 0.00 C ATOM 1149 C SER A 78 14.312 -10.576 -13.299 1.00 0.00 C ATOM 1150 O SER A 78 13.226 -10.491 -13.873 1.00 0.00 O ATOM 1151 CB SER A 78 14.663 -12.211 -11.405 1.00 0.00 C ATOM 1152 OG SER A 78 14.770 -12.331 -9.996 1.00 0.00 O ATOM 0 H SER A 78 12.414 -11.058 -11.133 1.00 0.00 H new ATOM 0 HA SER A 78 15.189 -10.147 -11.396 1.00 0.00 H new ATOM 0 HB2 SER A 78 13.868 -12.858 -11.775 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.588 -12.540 -11.878 1.00 0.00 H new ATOM 0 HG SER A 78 14.078 -12.942 -9.666 1.00 0.00 H new ATOM 1158 N LEU A 79 15.466 -10.471 -13.962 1.00 0.00 N ATOM 1159 CA LEU A 79 15.554 -10.282 -15.416 1.00 0.00 C ATOM 1160 C LEU A 79 16.551 -11.265 -16.057 1.00 0.00 C ATOM 1161 O LEU A 79 17.393 -10.869 -16.862 1.00 0.00 O ATOM 1162 CB LEU A 79 15.846 -8.795 -15.743 1.00 0.00 C ATOM 1163 CG LEU A 79 14.810 -7.776 -15.217 1.00 0.00 C ATOM 1164 CD1 LEU A 79 15.193 -7.183 -13.859 1.00 0.00 C ATOM 1165 CD2 LEU A 79 14.701 -6.586 -16.169 1.00 0.00 C ATOM 0 H LEU A 79 16.375 -10.515 -13.502 1.00 0.00 H new ATOM 0 HA LEU A 79 14.590 -10.521 -15.866 1.00 0.00 H new ATOM 0 HB2 LEU A 79 16.822 -8.537 -15.333 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.917 -8.687 -16.825 1.00 0.00 H new ATOM 0 HG LEU A 79 13.877 -8.333 -15.133 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.427 -6.475 -13.542 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.275 -7.983 -13.123 1.00 0.00 H new ATOM 0 HD13 LEU A 79 16.150 -6.669 -13.944 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.967 -5.878 -15.784 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.671 -6.095 -16.251 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.387 -6.935 -17.153 1.00 0.00 H new ATOM 1177 N CYS A 80 16.490 -12.542 -15.676 1.00 0.00 N ATOM 1178 CA CYS A 80 17.488 -13.568 -16.008 1.00 0.00 C ATOM 1179 C CYS A 80 16.922 -14.798 -16.749 1.00 0.00 C ATOM 1180 O CYS A 80 17.583 -15.836 -16.789 1.00 0.00 O ATOM 1181 CB CYS A 80 18.202 -13.972 -14.708 1.00 0.00 C ATOM 1182 SG CYS A 80 18.938 -12.530 -13.879 1.00 0.00 S ATOM 0 H CYS A 80 15.723 -12.905 -15.111 1.00 0.00 H new ATOM 0 HA CYS A 80 18.188 -13.133 -16.721 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.493 -14.456 -14.037 1.00 0.00 H new ATOM 0 HB3 CYS A 80 18.980 -14.702 -14.930 1.00 0.00 H new ATOM 0 HG CYS A 80 19.529 -12.913 -12.786 1.00 0.00 H new ATOM 1229 N ASN A 85 19.827 -16.807 -9.786 1.00 0.00 N ATOM 1230 CA ASN A 85 20.267 -17.439 -8.537 1.00 0.00 C ATOM 1231 C ASN A 85 20.032 -16.460 -7.371 1.00 0.00 C ATOM 1232 O ASN A 85 20.461 -15.311 -7.451 1.00 0.00 O ATOM 1233 CB ASN A 85 21.740 -17.866 -8.691 1.00 0.00 C ATOM 1234 CG ASN A 85 22.275 -18.661 -7.506 1.00 0.00 C ATOM 1235 OD1 ASN A 85 21.559 -19.046 -6.591 1.00 0.00 O ATOM 1236 ND2 ASN A 85 23.558 -18.941 -7.486 1.00 0.00 N ATOM 0 HA ASN A 85 19.693 -18.339 -8.316 1.00 0.00 H new ATOM 0 HB2 ASN A 85 21.842 -18.466 -9.595 1.00 0.00 H new ATOM 0 HB3 ASN A 85 22.355 -16.976 -8.827 1.00 0.00 H new ATOM 0 HD21 ASN A 85 23.951 -19.476 -6.712 1.00 0.00 H new ATOM 0 HD22 ASN A 85 24.161 -18.624 -8.245 1.00 0.00 H new ATOM 1243 N LEU A 86 19.317 -16.877 -6.319 1.00 0.00 N ATOM 1244 CA LEU A 86 18.845 -15.992 -5.242 1.00 0.00 C ATOM 1245 C LEU A 86 18.874 -16.661 -3.850 1.00 0.00 C ATOM 1246 O LEU A 86 18.502 -17.836 -3.742 1.00 0.00 O ATOM 1247 CB LEU A 86 17.387 -15.572 -5.527 1.00 0.00 C ATOM 1248 CG LEU A 86 17.168 -14.582 -6.682 1.00 0.00 C ATOM 1249 CD1 LEU A 86 15.671 -14.361 -6.882 1.00 0.00 C ATOM 1250 CD2 LEU A 86 17.795 -13.216 -6.414 1.00 0.00 C ATOM 0 H LEU A 86 19.045 -17.851 -6.188 1.00 0.00 H new ATOM 0 HA LEU A 86 19.522 -15.138 -5.225 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.808 -16.472 -5.735 1.00 0.00 H new ATOM 0 HB3 LEU A 86 16.976 -15.132 -4.619 1.00 0.00 H new ATOM 0 HG LEU A 86 17.641 -15.019 -7.562 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.513 -13.659 -7.701 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.192 -15.310 -7.120 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.238 -13.955 -5.968 1.00 0.00 H new ATOM 0 HD21 LEU A 86 17.609 -12.558 -7.263 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.354 -12.783 -5.516 1.00 0.00 H new ATOM 0 HD23 LEU A 86 18.870 -13.330 -6.272 1.00 0.00 H new ATOM 1262 N PRO A 87 19.238 -15.924 -2.777 1.00 0.00 N ATOM 1263 CA PRO A 87 19.061 -16.397 -1.401 1.00 0.00 C ATOM 1264 C PRO A 87 17.558 -16.561 -1.085 1.00 0.00 C ATOM 1265 O PRO A 87 16.730 -15.866 -1.687 1.00 0.00 O ATOM 1266 CB PRO A 87 19.738 -15.354 -0.499 1.00 0.00 C ATOM 1267 CG PRO A 87 20.678 -14.596 -1.439 1.00 0.00 C ATOM 1268 CD PRO A 87 19.971 -14.666 -2.791 1.00 0.00 C ATOM 0 HA PRO A 87 19.511 -17.377 -1.240 1.00 0.00 H new ATOM 0 HB2 PRO A 87 19.006 -14.686 -0.044 1.00 0.00 H new ATOM 0 HB3 PRO A 87 20.286 -15.828 0.315 1.00 0.00 H new ATOM 0 HG2 PRO A 87 20.822 -13.565 -1.115 1.00 0.00 H new ATOM 0 HG3 PRO A 87 21.664 -15.059 -1.478 1.00 0.00 H new ATOM 0 HD2 PRO A 87 19.297 -13.820 -2.927 1.00 0.00 H new ATOM 0 HD3 PRO A 87 20.688 -14.638 -3.612 1.00 0.00 H new ATOM 1276 N PRO A 88 17.163 -17.421 -0.125 1.00 0.00 N ATOM 1277 CA PRO A 88 15.757 -17.798 0.081 1.00 0.00 C ATOM 1278 C PRO A 88 14.828 -16.644 0.493 1.00 0.00 C ATOM 1279 O PRO A 88 13.630 -16.693 0.220 1.00 0.00 O ATOM 1280 CB PRO A 88 15.790 -18.921 1.127 1.00 0.00 C ATOM 1281 CG PRO A 88 17.104 -18.692 1.871 1.00 0.00 C ATOM 1282 CD PRO A 88 18.028 -18.171 0.774 1.00 0.00 C ATOM 0 HA PRO A 88 15.320 -18.120 -0.865 1.00 0.00 H new ATOM 0 HB2 PRO A 88 14.935 -18.865 1.800 1.00 0.00 H new ATOM 0 HB3 PRO A 88 15.763 -19.905 0.658 1.00 0.00 H new ATOM 0 HG2 PRO A 88 16.990 -17.971 2.680 1.00 0.00 H new ATOM 0 HG3 PRO A 88 17.483 -19.612 2.315 1.00 0.00 H new ATOM 0 HD2 PRO A 88 18.812 -17.537 1.187 1.00 0.00 H new ATOM 0 HD3 PRO A 88 18.523 -18.991 0.253 1.00 0.00 H new ATOM 1290 N GLU A 89 15.358 -15.562 1.074 1.00 0.00 N ATOM 1291 CA GLU A 89 14.556 -14.371 1.406 1.00 0.00 C ATOM 1292 C GLU A 89 14.132 -13.536 0.178 1.00 0.00 C ATOM 1293 O GLU A 89 13.184 -12.760 0.275 1.00 0.00 O ATOM 1294 CB GLU A 89 15.249 -13.531 2.491 1.00 0.00 C ATOM 1295 CG GLU A 89 16.610 -12.947 2.084 1.00 0.00 C ATOM 1296 CD GLU A 89 17.158 -12.017 3.188 1.00 0.00 C ATOM 1297 OE1 GLU A 89 17.830 -12.521 4.123 1.00 0.00 O ATOM 1298 OE2 GLU A 89 16.916 -10.785 3.138 1.00 0.00 O ATOM 0 H GLU A 89 16.343 -15.483 1.326 1.00 0.00 H new ATOM 0 HA GLU A 89 13.615 -14.736 1.817 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.588 -12.712 2.773 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.386 -14.150 3.378 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.317 -13.755 1.899 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.509 -12.392 1.151 1.00 0.00 H new ATOM 1305 N TRP A 90 14.765 -13.714 -0.991 1.00 0.00 N ATOM 1306 CA TRP A 90 14.461 -12.962 -2.228 1.00 0.00 C ATOM 1307 C TRP A 90 13.407 -13.621 -3.141 1.00 0.00 C ATOM 1308 O TRP A 90 13.068 -13.067 -4.186 1.00 0.00 O ATOM 1309 CB TRP A 90 15.764 -12.664 -2.976 1.00 0.00 C ATOM 1310 CG TRP A 90 16.642 -11.682 -2.272 1.00 0.00 C ATOM 1311 CD1 TRP A 90 17.672 -11.987 -1.453 1.00 0.00 C ATOM 1312 CD2 TRP A 90 16.514 -10.228 -2.230 1.00 0.00 C ATOM 1313 NE1 TRP A 90 18.189 -10.828 -0.906 1.00 0.00 N ATOM 1314 CE2 TRP A 90 17.481 -9.721 -1.317 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.632 -9.298 -2.826 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 17.528 -8.372 -0.954 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.691 -7.932 -2.489 1.00 0.00 C ATOM 1318 CH2 TRP A 90 16.619 -7.473 -1.533 1.00 0.00 C ATOM 0 H TRP A 90 15.515 -14.394 -1.110 1.00 0.00 H new ATOM 0 HA TRP A 90 13.991 -12.028 -1.920 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.314 -13.595 -3.118 1.00 0.00 H new ATOM 0 HB3 TRP A 90 15.525 -12.280 -3.968 1.00 0.00 H new ATOM 0 HD1 TRP A 90 18.036 -12.985 -1.256 1.00 0.00 H new ATOM 0 HE1 TRP A 90 18.992 -10.797 -0.278 1.00 0.00 H new ATOM 0 HE3 TRP A 90 14.905 -9.639 -3.548 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 18.256 -8.025 -0.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.021 -7.232 -2.966 1.00 0.00 H new ATOM 0 HH2 TRP A 90 16.631 -6.432 -1.247 1.00 0.00 H new ATOM 1329 N VAL A 91 12.897 -14.802 -2.764 1.00 0.00 N ATOM 1330 CA VAL A 91 11.905 -15.599 -3.527 1.00 0.00 C ATOM 1331 C VAL A 91 10.584 -15.846 -2.774 1.00 0.00 C ATOM 1332 O VAL A 91 9.698 -16.539 -3.275 1.00 0.00 O ATOM 1333 CB VAL A 91 12.520 -16.938 -3.986 1.00 0.00 C ATOM 1334 CG1 VAL A 91 13.646 -16.714 -5.000 1.00 0.00 C ATOM 1335 CG2 VAL A 91 13.065 -17.751 -2.804 1.00 0.00 C ATOM 0 H VAL A 91 13.169 -15.251 -1.889 1.00 0.00 H new ATOM 0 HA VAL A 91 11.647 -14.994 -4.396 1.00 0.00 H new ATOM 0 HB VAL A 91 11.715 -17.501 -4.458 1.00 0.00 H new ATOM 0 HG11 VAL A 91 14.059 -17.676 -5.304 1.00 0.00 H new ATOM 0 HG12 VAL A 91 13.251 -16.196 -5.874 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.431 -16.110 -4.545 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.489 -18.686 -3.170 1.00 0.00 H new ATOM 0 HG22 VAL A 91 13.838 -17.177 -2.294 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.255 -17.968 -2.108 1.00 0.00 H new ATOM 1345 N THR A 92 10.440 -15.289 -1.566 1.00 0.00 N ATOM 1346 CA THR A 92 9.332 -15.551 -0.612 1.00 0.00 C ATOM 1347 C THR A 92 8.361 -14.358 -0.463 1.00 0.00 C ATOM 1348 O THR A 92 7.470 -14.358 0.389 1.00 0.00 O ATOM 1349 CB THR A 92 9.915 -16.063 0.723 1.00 0.00 C ATOM 1350 OG1 THR A 92 8.926 -16.534 1.616 1.00 0.00 O ATOM 1351 CG2 THR A 92 10.781 -15.018 1.425 1.00 0.00 C ATOM 0 H THR A 92 11.114 -14.615 -1.202 1.00 0.00 H new ATOM 0 HA THR A 92 8.699 -16.339 -1.019 1.00 0.00 H new ATOM 0 HB THR A 92 10.546 -16.906 0.443 1.00 0.00 H new ATOM 0 HG1 THR A 92 8.122 -15.979 1.536 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.165 -15.431 2.358 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.615 -14.743 0.779 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.182 -14.133 1.639 1.00 0.00 H new ATOM 1359 N GLN A 93 8.530 -13.334 -1.304 1.00 0.00 N ATOM 1360 CA GLN A 93 7.697 -12.132 -1.425 1.00 0.00 C ATOM 1361 C GLN A 93 6.248 -12.438 -1.839 1.00 0.00 C ATOM 1362 O GLN A 93 5.951 -13.503 -2.387 1.00 0.00 O ATOM 1363 CB GLN A 93 8.343 -11.209 -2.477 1.00 0.00 C ATOM 1364 CG GLN A 93 9.489 -10.354 -1.917 1.00 0.00 C ATOM 1365 CD GLN A 93 10.749 -11.127 -1.530 1.00 0.00 C ATOM 1366 OE1 GLN A 93 10.994 -12.245 -1.959 1.00 0.00 O ATOM 1367 NE2 GLN A 93 11.600 -10.585 -0.693 1.00 0.00 N ATOM 0 H GLN A 93 9.307 -13.321 -1.965 1.00 0.00 H new ATOM 0 HA GLN A 93 7.647 -11.659 -0.444 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.721 -11.816 -3.299 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.578 -10.552 -2.892 1.00 0.00 H new ATOM 0 HG2 GLN A 93 9.757 -9.603 -2.660 1.00 0.00 H new ATOM 0 HG3 GLN A 93 9.126 -9.819 -1.039 1.00 0.00 H new ATOM 0 HE21 GLN A 93 11.423 -9.653 -0.318 1.00 0.00 H new ATOM 0 HE22 GLN A 93 12.439 -11.095 -0.417 1.00 0.00 H new ATOM 1376 N GLU A 94 5.345 -11.469 -1.633 1.00 0.00 N ATOM 1377 CA GLU A 94 3.945 -11.607 -2.059 1.00 0.00 C ATOM 1378 C GLU A 94 3.791 -11.683 -3.588 1.00 0.00 C ATOM 1379 O GLU A 94 2.947 -12.441 -4.073 1.00 0.00 O ATOM 1380 CB GLU A 94 3.058 -10.506 -1.456 1.00 0.00 C ATOM 1381 CG GLU A 94 3.478 -9.057 -1.730 1.00 0.00 C ATOM 1382 CD GLU A 94 2.411 -8.081 -1.200 1.00 0.00 C ATOM 1383 OE1 GLU A 94 2.456 -7.718 0.000 1.00 0.00 O ATOM 1384 OE2 GLU A 94 1.514 -7.672 -1.979 1.00 0.00 O ATOM 0 H GLU A 94 5.558 -10.583 -1.175 1.00 0.00 H new ATOM 0 HA GLU A 94 3.599 -12.563 -1.667 1.00 0.00 H new ATOM 0 HB2 GLU A 94 2.044 -10.643 -1.831 1.00 0.00 H new ATOM 0 HB3 GLU A 94 3.022 -10.651 -0.376 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.436 -8.853 -1.253 1.00 0.00 H new ATOM 0 HG3 GLU A 94 3.617 -8.908 -2.801 1.00 0.00 H new ATOM 1391 N ILE A 95 4.620 -10.943 -4.346 1.00 0.00 N ATOM 1392 CA ILE A 95 4.641 -10.981 -5.821 1.00 0.00 C ATOM 1393 C ILE A 95 6.090 -11.048 -6.329 1.00 0.00 C ATOM 1394 O ILE A 95 6.939 -10.242 -5.936 1.00 0.00 O ATOM 1395 CB ILE A 95 3.842 -9.793 -6.418 1.00 0.00 C ATOM 1396 CG1 ILE A 95 2.391 -9.795 -5.869 1.00 0.00 C ATOM 1397 CG2 ILE A 95 3.839 -9.841 -7.961 1.00 0.00 C ATOM 1398 CD1 ILE A 95 1.497 -8.647 -6.330 1.00 0.00 C ATOM 0 H ILE A 95 5.301 -10.296 -3.949 1.00 0.00 H new ATOM 0 HA ILE A 95 4.141 -11.886 -6.165 1.00 0.00 H new ATOM 0 HB ILE A 95 4.332 -8.867 -6.116 1.00 0.00 H new ATOM 0 HG12 ILE A 95 1.918 -10.734 -6.154 1.00 0.00 H new ATOM 0 HG13 ILE A 95 2.436 -9.779 -4.780 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.271 -8.996 -8.350 1.00 0.00 H new ATOM 0 HG22 ILE A 95 4.864 -9.790 -8.329 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.380 -10.771 -8.295 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.509 -8.753 -5.883 1.00 0.00 H new ATOM 0 HD12 ILE A 95 1.935 -7.698 -6.021 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.408 -8.669 -7.416 1.00 0.00 H new ATOM 1410 N PHE A 96 6.361 -12.004 -7.220 1.00 0.00 N ATOM 1411 CA PHE A 96 7.672 -12.256 -7.829 1.00 0.00 C ATOM 1412 C PHE A 96 7.556 -12.438 -9.353 1.00 0.00 C ATOM 1413 O PHE A 96 6.557 -12.966 -9.844 1.00 0.00 O ATOM 1414 CB PHE A 96 8.308 -13.486 -7.161 1.00 0.00 C ATOM 1415 CG PHE A 96 9.717 -13.808 -7.625 1.00 0.00 C ATOM 1416 CD1 PHE A 96 9.934 -14.640 -8.743 1.00 0.00 C ATOM 1417 CD2 PHE A 96 10.823 -13.272 -6.937 1.00 0.00 C ATOM 1418 CE1 PHE A 96 11.242 -14.933 -9.165 1.00 0.00 C ATOM 1419 CE2 PHE A 96 12.130 -13.564 -7.364 1.00 0.00 C ATOM 1420 CZ PHE A 96 12.339 -14.394 -8.477 1.00 0.00 C ATOM 0 H PHE A 96 5.645 -12.651 -7.551 1.00 0.00 H new ATOM 0 HA PHE A 96 8.315 -11.391 -7.666 1.00 0.00 H new ATOM 0 HB2 PHE A 96 8.323 -13.328 -6.083 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.673 -14.352 -7.348 1.00 0.00 H new ATOM 0 HD1 PHE A 96 9.091 -15.054 -9.277 1.00 0.00 H new ATOM 0 HD2 PHE A 96 10.666 -12.635 -6.079 1.00 0.00 H new ATOM 0 HE1 PHE A 96 11.403 -15.574 -10.020 1.00 0.00 H new ATOM 0 HE2 PHE A 96 12.975 -13.149 -6.835 1.00 0.00 H new ATOM 0 HZ PHE A 96 13.344 -14.617 -8.803 1.00 0.00 H new ATOM 1430 N GLU A 97 8.589 -12.042 -10.098 1.00 0.00 N ATOM 1431 CA GLU A 97 8.723 -12.273 -11.545 1.00 0.00 C ATOM 1432 C GLU A 97 10.170 -12.616 -11.939 1.00 0.00 C ATOM 1433 O GLU A 97 11.109 -12.247 -11.238 1.00 0.00 O ATOM 1434 CB GLU A 97 8.335 -11.013 -12.341 1.00 0.00 C ATOM 1435 CG GLU A 97 6.905 -10.474 -12.176 1.00 0.00 C ATOM 1436 CD GLU A 97 5.799 -11.438 -12.656 1.00 0.00 C ATOM 1437 OE1 GLU A 97 6.074 -12.381 -13.436 1.00 0.00 O ATOM 1438 OE2 GLU A 97 4.617 -11.196 -12.311 1.00 0.00 O ATOM 0 H GLU A 97 9.382 -11.536 -9.703 1.00 0.00 H new ATOM 0 HA GLU A 97 8.061 -13.107 -11.778 1.00 0.00 H new ATOM 0 HB2 GLU A 97 9.027 -10.217 -12.066 1.00 0.00 H new ATOM 0 HB3 GLU A 97 8.494 -11.223 -13.399 1.00 0.00 H new ATOM 0 HG2 GLU A 97 6.736 -10.242 -11.124 1.00 0.00 H new ATOM 0 HG3 GLU A 97 6.817 -9.537 -12.727 1.00 0.00 H new ATOM 1445 N ASP A 98 10.358 -13.255 -13.099 1.00 0.00 N ATOM 1446 CA ASP A 98 11.674 -13.441 -13.733 1.00 0.00 C ATOM 1447 C ASP A 98 11.553 -13.294 -15.264 1.00 0.00 C ATOM 1448 O ASP A 98 11.082 -14.196 -15.965 1.00 0.00 O ATOM 1449 CB ASP A 98 12.365 -14.748 -13.304 1.00 0.00 C ATOM 1450 CG ASP A 98 13.857 -14.779 -13.698 1.00 0.00 C ATOM 1451 OD1 ASP A 98 14.361 -13.809 -14.314 1.00 0.00 O ATOM 1452 OD2 ASP A 98 14.530 -15.790 -13.395 1.00 0.00 O ATOM 0 H ASP A 98 9.592 -13.664 -13.634 1.00 0.00 H new ATOM 0 HA ASP A 98 12.334 -12.650 -13.376 1.00 0.00 H new ATOM 0 HB2 ASP A 98 12.274 -14.867 -12.224 1.00 0.00 H new ATOM 0 HB3 ASP A 98 11.853 -15.594 -13.762 1.00 0.00 H new ATOM 1457 N TRP A 99 11.903 -12.111 -15.777 1.00 0.00 N ATOM 1458 CA TRP A 99 11.664 -11.693 -17.165 1.00 0.00 C ATOM 1459 C TRP A 99 12.648 -12.324 -18.166 1.00 0.00 C ATOM 1460 O TRP A 99 13.783 -12.655 -17.837 1.00 0.00 O ATOM 1461 CB TRP A 99 11.596 -10.156 -17.217 1.00 0.00 C ATOM 1462 CG TRP A 99 10.454 -9.524 -16.461 1.00 0.00 C ATOM 1463 CD1 TRP A 99 9.378 -10.173 -15.951 1.00 0.00 C ATOM 1464 CD2 TRP A 99 10.244 -8.109 -16.138 1.00 0.00 C ATOM 1465 NE1 TRP A 99 8.527 -9.271 -15.351 1.00 0.00 N ATOM 1466 CE2 TRP A 99 9.017 -7.991 -15.422 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.938 -6.903 -16.399 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.512 -6.768 -14.975 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.433 -5.660 -15.962 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.225 -5.590 -15.251 1.00 0.00 C ATOM 0 H TRP A 99 12.374 -11.396 -15.223 1.00 0.00 H new ATOM 0 HA TRP A 99 10.700 -12.079 -17.496 1.00 0.00 H new ATOM 0 HB2 TRP A 99 12.531 -9.756 -16.826 1.00 0.00 H new ATOM 0 HB3 TRP A 99 11.530 -9.849 -18.261 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.213 -11.239 -16.007 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.643 -9.523 -14.909 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.871 -6.935 -16.942 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.584 -6.729 -14.424 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 10.981 -4.754 -16.177 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.846 -4.635 -14.918 1.00 0.00 H new ATOM 1481 N GLN A 100 12.214 -12.454 -19.425 1.00 0.00 N ATOM 1482 CA GLN A 100 12.883 -13.229 -20.491 1.00 0.00 C ATOM 1483 C GLN A 100 13.670 -12.328 -21.467 1.00 0.00 C ATOM 1484 O GLN A 100 13.636 -12.509 -22.684 1.00 0.00 O ATOM 1485 CB GLN A 100 11.830 -14.115 -21.192 1.00 0.00 C ATOM 1486 CG GLN A 100 10.937 -14.961 -20.259 1.00 0.00 C ATOM 1487 CD GLN A 100 11.683 -16.042 -19.477 1.00 0.00 C ATOM 1488 OE1 GLN A 100 12.326 -16.921 -20.033 1.00 0.00 O ATOM 1489 NE2 GLN A 100 11.630 -16.044 -18.161 1.00 0.00 N ATOM 0 H GLN A 100 11.355 -12.008 -19.747 1.00 0.00 H new ATOM 0 HA GLN A 100 13.640 -13.877 -20.049 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.188 -13.474 -21.796 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.346 -14.787 -21.878 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.440 -14.297 -19.552 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.157 -15.434 -20.855 1.00 0.00 H new ATOM 0 HE21 GLN A 100 11.101 -15.323 -17.671 1.00 0.00 H new ATOM 0 HE22 GLN A 100 12.118 -16.767 -17.632 1.00 0.00 H new ATOM 1498 N LEU A 101 14.325 -11.302 -20.913 1.00 0.00 N ATOM 1499 CA LEU A 101 14.958 -10.203 -21.655 1.00 0.00 C ATOM 1500 C LEU A 101 16.426 -10.469 -22.018 1.00 0.00 C ATOM 1501 O LEU A 101 17.095 -11.332 -21.452 1.00 0.00 O ATOM 1502 CB LEU A 101 14.768 -8.898 -20.844 1.00 0.00 C ATOM 1503 CG LEU A 101 13.480 -8.093 -21.126 1.00 0.00 C ATOM 1504 CD1 LEU A 101 12.262 -8.920 -21.521 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.117 -7.295 -19.883 1.00 0.00 C ATOM 0 H LEU A 101 14.433 -11.209 -19.903 1.00 0.00 H new ATOM 0 HA LEU A 101 14.466 -10.107 -22.623 1.00 0.00 H new ATOM 0 HB2 LEU A 101 14.788 -9.149 -19.784 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.624 -8.250 -21.034 1.00 0.00 H new ATOM 0 HG LEU A 101 13.717 -7.467 -21.986 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.414 -8.258 -21.696 1.00 0.00 H new ATOM 0 HD12 LEU A 101 12.481 -9.478 -22.431 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.019 -9.616 -20.718 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.209 -6.722 -20.071 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.951 -7.977 -19.049 1.00 0.00 H new ATOM 0 HD23 LEU A 101 13.931 -6.613 -19.638 1.00 0.00 H new ATOM 1517 N GLU A 102 16.909 -9.677 -22.977 1.00 0.00 N ATOM 1518 CA GLU A 102 18.239 -9.782 -23.587 1.00 0.00 C ATOM 1519 C GLU A 102 19.011 -8.463 -23.468 1.00 0.00 C ATOM 1520 O GLU A 102 18.405 -7.397 -23.397 1.00 0.00 O ATOM 1521 CB GLU A 102 18.082 -10.240 -25.047 1.00 0.00 C ATOM 1522 CG GLU A 102 17.531 -9.170 -26.001 1.00 0.00 C ATOM 1523 CD GLU A 102 17.391 -9.735 -27.425 1.00 0.00 C ATOM 1524 OE1 GLU A 102 18.422 -9.854 -28.130 1.00 0.00 O ATOM 1525 OE2 GLU A 102 16.252 -10.052 -27.850 1.00 0.00 O ATOM 0 H GLU A 102 16.361 -8.911 -23.368 1.00 0.00 H new ATOM 0 HA GLU A 102 18.831 -10.525 -23.053 1.00 0.00 H new ATOM 0 HB2 GLU A 102 19.053 -10.571 -25.416 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.420 -11.105 -25.073 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.561 -8.822 -25.645 1.00 0.00 H new ATOM 0 HG3 GLU A 102 18.196 -8.306 -26.010 1.00 0.00 H new ATOM 1532 N ASP A 103 20.344 -8.512 -23.476 1.00 0.00 N ATOM 1533 CA ASP A 103 21.178 -7.305 -23.417 1.00 0.00 C ATOM 1534 C ASP A 103 21.428 -6.717 -24.820 1.00 0.00 C ATOM 1535 O ASP A 103 21.905 -7.430 -25.710 1.00 0.00 O ATOM 1536 CB ASP A 103 22.500 -7.589 -22.683 1.00 0.00 C ATOM 1537 CG ASP A 103 22.264 -7.879 -21.200 1.00 0.00 C ATOM 1538 OD1 ASP A 103 21.864 -6.942 -20.472 1.00 0.00 O ATOM 1539 OD2 ASP A 103 22.353 -9.048 -20.763 1.00 0.00 O ATOM 0 H ASP A 103 20.875 -9.381 -23.523 1.00 0.00 H new ATOM 0 HA ASP A 103 20.632 -6.553 -22.848 1.00 0.00 H new ATOM 0 HB2 ASP A 103 23.000 -8.440 -23.147 1.00 0.00 H new ATOM 0 HB3 ASP A 103 23.166 -6.733 -22.786 1.00 0.00 H new ATOM 1544 N PRO A 104 21.146 -5.419 -25.045 1.00 0.00 N ATOM 1545 CA PRO A 104 21.335 -4.782 -26.350 1.00 0.00 C ATOM 1546 C PRO A 104 22.756 -4.223 -26.576 1.00 0.00 C ATOM 1547 O PRO A 104 23.114 -3.937 -27.712 1.00 0.00 O ATOM 1548 CB PRO A 104 20.263 -3.695 -26.378 1.00 0.00 C ATOM 1549 CG PRO A 104 20.224 -3.219 -24.929 1.00 0.00 C ATOM 1550 CD PRO A 104 20.410 -4.521 -24.158 1.00 0.00 C ATOM 0 HA PRO A 104 21.235 -5.499 -27.165 1.00 0.00 H new ATOM 0 HB2 PRO A 104 20.524 -2.887 -27.062 1.00 0.00 H new ATOM 0 HB3 PRO A 104 19.298 -4.087 -26.701 1.00 0.00 H new ATOM 0 HG2 PRO A 104 21.016 -2.502 -24.714 1.00 0.00 H new ATOM 0 HG3 PRO A 104 19.279 -2.733 -24.685 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.961 -4.350 -23.233 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.447 -4.950 -23.881 1.00 0.00 H new ATOM 1594 N SER A 108 22.890 -4.114 -31.864 1.00 0.00 N ATOM 1595 CA SER A 108 22.586 -2.828 -32.519 1.00 0.00 C ATOM 1596 C SER A 108 21.755 -1.893 -31.627 1.00 0.00 C ATOM 1597 O SER A 108 21.018 -2.337 -30.746 1.00 0.00 O ATOM 1598 CB SER A 108 21.896 -3.091 -33.868 1.00 0.00 C ATOM 1599 OG SER A 108 21.530 -1.876 -34.506 1.00 0.00 O ATOM 0 HA SER A 108 23.527 -2.306 -32.696 1.00 0.00 H new ATOM 0 HB2 SER A 108 22.564 -3.658 -34.516 1.00 0.00 H new ATOM 0 HB3 SER A 108 21.008 -3.704 -33.711 1.00 0.00 H new ATOM 0 HG SER A 108 21.095 -2.074 -35.362 1.00 0.00 H new ATOM 1605 N LEU A 109 21.789 -0.589 -31.911 1.00 0.00 N ATOM 1606 CA LEU A 109 20.905 0.413 -31.294 1.00 0.00 C ATOM 1607 C LEU A 109 19.429 0.163 -31.650 1.00 0.00 C ATOM 1608 O LEU A 109 18.543 0.494 -30.868 1.00 0.00 O ATOM 1609 CB LEU A 109 21.404 1.826 -31.641 1.00 0.00 C ATOM 1610 CG LEU A 109 22.519 2.323 -30.694 1.00 0.00 C ATOM 1611 CD1 LEU A 109 23.741 1.400 -30.620 1.00 0.00 C ATOM 1612 CD2 LEU A 109 22.993 3.704 -31.146 1.00 0.00 C ATOM 0 H LEU A 109 22.441 -0.189 -32.586 1.00 0.00 H new ATOM 0 HA LEU A 109 20.947 0.320 -30.209 1.00 0.00 H new ATOM 0 HB2 LEU A 109 21.776 1.832 -32.666 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.565 2.521 -31.602 1.00 0.00 H new ATOM 0 HG LEU A 109 22.073 2.346 -29.699 1.00 0.00 H new ATOM 0 HD11 LEU A 109 24.475 1.823 -29.934 1.00 0.00 H new ATOM 0 HD12 LEU A 109 23.434 0.417 -30.262 1.00 0.00 H new ATOM 0 HD13 LEU A 109 24.184 1.303 -31.611 1.00 0.00 H new ATOM 0 HD21 LEU A 109 23.780 4.055 -30.478 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.381 3.641 -32.163 1.00 0.00 H new ATOM 0 HD23 LEU A 109 22.156 4.402 -31.120 1.00 0.00 H new ATOM 1624 N GLU A 110 19.149 -0.542 -32.750 1.00 0.00 N ATOM 1625 CA GLU A 110 17.800 -1.036 -33.055 1.00 0.00 C ATOM 1626 C GLU A 110 17.344 -2.053 -31.989 1.00 0.00 C ATOM 1627 O GLU A 110 16.178 -2.059 -31.590 1.00 0.00 O ATOM 1628 CB GLU A 110 17.801 -1.648 -34.464 1.00 0.00 C ATOM 1629 CG GLU A 110 16.400 -2.065 -34.927 1.00 0.00 C ATOM 1630 CD GLU A 110 16.425 -2.557 -36.387 1.00 0.00 C ATOM 1631 OE1 GLU A 110 16.708 -3.757 -36.626 1.00 0.00 O ATOM 1632 OE2 GLU A 110 16.165 -1.748 -37.311 1.00 0.00 O ATOM 0 H GLU A 110 19.847 -0.786 -33.453 1.00 0.00 H new ATOM 0 HA GLU A 110 17.087 -0.211 -33.034 1.00 0.00 H new ATOM 0 HB2 GLU A 110 18.213 -0.926 -35.169 1.00 0.00 H new ATOM 0 HB3 GLU A 110 18.458 -2.518 -34.478 1.00 0.00 H new ATOM 0 HG2 GLU A 110 16.019 -2.855 -34.280 1.00 0.00 H new ATOM 0 HG3 GLU A 110 15.717 -1.221 -34.836 1.00 0.00 H new ATOM 1639 N VAL A 111 18.266 -2.853 -31.430 1.00 0.00 N ATOM 1640 CA VAL A 111 17.975 -3.790 -30.330 1.00 0.00 C ATOM 1641 C VAL A 111 17.762 -3.034 -29.021 1.00 0.00 C ATOM 1642 O VAL A 111 16.838 -3.383 -28.297 1.00 0.00 O ATOM 1643 CB VAL A 111 19.010 -4.927 -30.201 1.00 0.00 C ATOM 1644 CG1 VAL A 111 18.527 -5.992 -29.209 1.00 0.00 C ATOM 1645 CG2 VAL A 111 19.210 -5.640 -31.546 1.00 0.00 C ATOM 0 H VAL A 111 19.241 -2.869 -31.730 1.00 0.00 H new ATOM 0 HA VAL A 111 17.042 -4.295 -30.580 1.00 0.00 H new ATOM 0 HB VAL A 111 19.939 -4.469 -29.861 1.00 0.00 H new ATOM 0 HG11 VAL A 111 19.272 -6.784 -29.134 1.00 0.00 H new ATOM 0 HG12 VAL A 111 18.381 -5.537 -28.229 1.00 0.00 H new ATOM 0 HG13 VAL A 111 17.584 -6.413 -29.558 1.00 0.00 H new ATOM 0 HG21 VAL A 111 19.944 -6.437 -31.430 1.00 0.00 H new ATOM 0 HG22 VAL A 111 18.262 -6.065 -31.877 1.00 0.00 H new ATOM 0 HG23 VAL A 111 19.566 -4.925 -32.288 1.00 0.00 H new ATOM 1655 N PHE A 112 18.478 -1.934 -28.745 1.00 0.00 N ATOM 1656 CA PHE A 112 18.150 -1.048 -27.608 1.00 0.00 C ATOM 1657 C PHE A 112 16.712 -0.520 -27.737 1.00 0.00 C ATOM 1658 O PHE A 112 15.920 -0.637 -26.803 1.00 0.00 O ATOM 1659 CB PHE A 112 19.126 0.142 -27.515 1.00 0.00 C ATOM 1660 CG PHE A 112 20.442 -0.099 -26.802 1.00 0.00 C ATOM 1661 CD1 PHE A 112 21.566 -0.571 -27.504 1.00 0.00 C ATOM 1662 CD2 PHE A 112 20.564 0.202 -25.433 1.00 0.00 C ATOM 1663 CE1 PHE A 112 22.794 -0.749 -26.843 1.00 0.00 C ATOM 1664 CE2 PHE A 112 21.789 0.014 -24.768 1.00 0.00 C ATOM 1665 CZ PHE A 112 22.905 -0.468 -25.473 1.00 0.00 C ATOM 0 H PHE A 112 19.287 -1.633 -29.289 1.00 0.00 H new ATOM 0 HA PHE A 112 18.242 -1.640 -26.698 1.00 0.00 H new ATOM 0 HB2 PHE A 112 19.347 0.479 -28.528 1.00 0.00 H new ATOM 0 HB3 PHE A 112 18.613 0.962 -27.011 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.485 -0.798 -28.557 1.00 0.00 H new ATOM 0 HD2 PHE A 112 19.711 0.580 -24.889 1.00 0.00 H new ATOM 0 HE1 PHE A 112 23.654 -1.103 -27.391 1.00 0.00 H new ATOM 0 HE2 PHE A 112 21.872 0.240 -23.715 1.00 0.00 H new ATOM 0 HZ PHE A 112 23.844 -0.621 -24.962 1.00 0.00 H new ATOM 1675 N ARG A 113 16.337 -0.030 -28.926 1.00 0.00 N ATOM 1676 CA ARG A 113 14.979 0.476 -29.221 1.00 0.00 C ATOM 1677 C ARG A 113 13.895 -0.619 -29.249 1.00 0.00 C ATOM 1678 O ARG A 113 12.721 -0.304 -29.080 1.00 0.00 O ATOM 1679 CB ARG A 113 15.008 1.304 -30.523 1.00 0.00 C ATOM 1680 CG ARG A 113 15.826 2.602 -30.377 1.00 0.00 C ATOM 1681 CD ARG A 113 15.706 3.480 -31.627 1.00 0.00 C ATOM 1682 NE ARG A 113 16.248 4.838 -31.395 1.00 0.00 N ATOM 1683 CZ ARG A 113 17.210 5.458 -32.051 1.00 0.00 C ATOM 1684 NH1 ARG A 113 17.906 4.883 -32.995 1.00 0.00 N ATOM 1685 NH2 ARG A 113 17.483 6.696 -31.769 1.00 0.00 N ATOM 0 H ARG A 113 16.971 0.029 -29.723 1.00 0.00 H new ATOM 0 HA ARG A 113 14.687 1.121 -28.393 1.00 0.00 H new ATOM 0 HB2 ARG A 113 15.431 0.700 -31.325 1.00 0.00 H new ATOM 0 HB3 ARG A 113 13.988 1.552 -30.815 1.00 0.00 H new ATOM 0 HG2 ARG A 113 15.479 3.157 -29.506 1.00 0.00 H new ATOM 0 HG3 ARG A 113 16.873 2.356 -30.202 1.00 0.00 H new ATOM 0 HD2 ARG A 113 16.240 3.011 -32.454 1.00 0.00 H new ATOM 0 HD3 ARG A 113 14.659 3.551 -31.923 1.00 0.00 H new ATOM 0 HE ARG A 113 15.823 5.361 -30.630 1.00 0.00 H new ATOM 0 HH11 ARG A 113 17.715 3.915 -33.252 1.00 0.00 H new ATOM 0 HH12 ARG A 113 18.641 5.402 -33.475 1.00 0.00 H new ATOM 0 HH21 ARG A 113 16.955 7.182 -31.044 1.00 0.00 H new ATOM 0 HH22 ARG A 113 18.225 7.182 -32.272 1.00 0.00 H new ATOM 1699 N THR A 114 14.278 -1.893 -29.361 1.00 0.00 N ATOM 1700 CA THR A 114 13.388 -3.064 -29.234 1.00 0.00 C ATOM 1701 C THR A 114 13.264 -3.558 -27.784 1.00 0.00 C ATOM 1702 O THR A 114 12.178 -3.912 -27.334 1.00 0.00 O ATOM 1703 CB THR A 114 13.863 -4.223 -30.129 1.00 0.00 C ATOM 1704 OG1 THR A 114 14.123 -3.794 -31.451 1.00 0.00 O ATOM 1705 CG2 THR A 114 12.808 -5.318 -30.299 1.00 0.00 C ATOM 0 H THR A 114 15.246 -2.153 -29.549 1.00 0.00 H new ATOM 0 HA THR A 114 12.403 -2.731 -29.561 1.00 0.00 H new ATOM 0 HB THR A 114 14.753 -4.595 -29.621 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.933 -3.242 -31.462 1.00 0.00 H new ATOM 0 HG21 THR A 114 13.202 -6.107 -30.940 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.556 -5.735 -29.324 1.00 0.00 H new ATOM 0 HG23 THR A 114 11.913 -4.894 -30.754 1.00 0.00 H new ATOM 1713 N VAL A 115 14.363 -3.599 -27.020 1.00 0.00 N ATOM 1714 CA VAL A 115 14.391 -4.097 -25.624 1.00 0.00 C ATOM 1715 C VAL A 115 13.749 -3.102 -24.667 1.00 0.00 C ATOM 1716 O VAL A 115 13.025 -3.525 -23.768 1.00 0.00 O ATOM 1717 CB VAL A 115 15.818 -4.534 -25.211 1.00 0.00 C ATOM 1718 CG1 VAL A 115 15.892 -4.899 -23.720 1.00 0.00 C ATOM 1719 CG2 VAL A 115 16.250 -5.762 -26.018 1.00 0.00 C ATOM 0 H VAL A 115 15.275 -3.284 -27.352 1.00 0.00 H new ATOM 0 HA VAL A 115 13.779 -4.997 -25.565 1.00 0.00 H new ATOM 0 HB VAL A 115 16.478 -3.689 -25.408 1.00 0.00 H new ATOM 0 HG11 VAL A 115 16.909 -5.200 -23.469 1.00 0.00 H new ATOM 0 HG12 VAL A 115 15.611 -4.034 -23.119 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.208 -5.722 -23.513 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.255 -6.059 -25.718 1.00 0.00 H new ATOM 0 HG22 VAL A 115 15.558 -6.583 -25.830 1.00 0.00 H new ATOM 0 HG23 VAL A 115 16.245 -5.519 -27.081 1.00 0.00 H new ATOM 1729 N ARG A 116 13.879 -1.793 -24.909 1.00 0.00 N ATOM 1730 CA ARG A 116 13.235 -0.755 -24.074 1.00 0.00 C ATOM 1731 C ARG A 116 11.718 -0.923 -23.960 1.00 0.00 C ATOM 1732 O ARG A 116 11.176 -0.826 -22.872 1.00 0.00 O ATOM 1733 CB ARG A 116 13.647 0.634 -24.595 1.00 0.00 C ATOM 1734 CG ARG A 116 12.921 1.094 -25.865 1.00 0.00 C ATOM 1735 CD ARG A 116 13.420 2.463 -26.334 1.00 0.00 C ATOM 1736 NE ARG A 116 12.708 2.879 -27.559 1.00 0.00 N ATOM 1737 CZ ARG A 116 12.964 3.942 -28.299 1.00 0.00 C ATOM 1738 NH1 ARG A 116 13.911 4.773 -28.003 1.00 0.00 N ATOM 1739 NH2 ARG A 116 12.290 4.180 -29.384 1.00 0.00 N ATOM 0 H ARG A 116 14.428 -1.418 -25.682 1.00 0.00 H new ATOM 0 HA ARG A 116 13.591 -0.867 -23.050 1.00 0.00 H new ATOM 0 HB2 ARG A 116 13.470 1.367 -23.808 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.719 0.628 -24.790 1.00 0.00 H new ATOM 0 HG2 ARG A 116 13.071 0.360 -26.657 1.00 0.00 H new ATOM 0 HG3 ARG A 116 11.849 1.142 -25.675 1.00 0.00 H new ATOM 0 HD2 ARG A 116 13.266 3.202 -25.548 1.00 0.00 H new ATOM 0 HD3 ARG A 116 14.492 2.420 -26.526 1.00 0.00 H new ATOM 0 HE ARG A 116 11.939 2.283 -27.865 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.487 4.616 -27.176 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.082 5.584 -28.597 1.00 0.00 H new ATOM 0 HH21 ARG A 116 11.550 3.541 -29.675 1.00 0.00 H new ATOM 0 HH22 ARG A 116 12.501 5.006 -29.944 1.00 0.00 H new ATOM 1753 N GLY A 117 11.052 -1.277 -25.060 1.00 0.00 N ATOM 1754 CA GLY A 117 9.599 -1.488 -25.093 1.00 0.00 C ATOM 1755 C GLY A 117 9.175 -2.782 -24.405 1.00 0.00 C ATOM 1756 O GLY A 117 8.145 -2.802 -23.739 1.00 0.00 O ATOM 0 H GLY A 117 11.506 -1.427 -25.961 1.00 0.00 H new ATOM 0 HA2 GLY A 117 9.103 -0.646 -24.611 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.262 -1.505 -26.130 1.00 0.00 H new ATOM 1760 N GLN A 118 10.020 -3.822 -24.449 1.00 0.00 N ATOM 1761 CA GLN A 118 9.789 -5.084 -23.730 1.00 0.00 C ATOM 1762 C GLN A 118 9.914 -4.877 -22.219 1.00 0.00 C ATOM 1763 O GLN A 118 9.058 -5.313 -21.458 1.00 0.00 O ATOM 1764 CB GLN A 118 10.737 -6.176 -24.260 1.00 0.00 C ATOM 1765 CG GLN A 118 10.349 -6.612 -25.681 1.00 0.00 C ATOM 1766 CD GLN A 118 11.459 -7.437 -26.311 1.00 0.00 C ATOM 1767 OE1 GLN A 118 11.520 -8.656 -26.216 1.00 0.00 O ATOM 1768 NE2 GLN A 118 12.400 -6.773 -26.945 1.00 0.00 N ATOM 0 H GLN A 118 10.887 -3.812 -24.987 1.00 0.00 H new ATOM 0 HA GLN A 118 8.770 -5.423 -23.914 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.761 -5.803 -24.259 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.711 -7.038 -23.593 1.00 0.00 H new ATOM 0 HG2 GLN A 118 9.429 -7.195 -25.649 1.00 0.00 H new ATOM 0 HG3 GLN A 118 10.149 -5.734 -26.295 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.344 -5.757 -27.021 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.186 -7.273 -27.361 1.00 0.00 H new ATOM 1777 N VAL A 119 10.927 -4.123 -21.784 1.00 0.00 N ATOM 1778 CA VAL A 119 11.049 -3.655 -20.386 1.00 0.00 C ATOM 1779 C VAL A 119 9.846 -2.781 -20.003 1.00 0.00 C ATOM 1780 O VAL A 119 9.222 -3.042 -18.983 1.00 0.00 O ATOM 1781 CB VAL A 119 12.378 -2.902 -20.199 1.00 0.00 C ATOM 1782 CG1 VAL A 119 12.512 -2.253 -18.817 1.00 0.00 C ATOM 1783 CG2 VAL A 119 13.587 -3.834 -20.371 1.00 0.00 C ATOM 0 H VAL A 119 11.691 -3.815 -22.386 1.00 0.00 H new ATOM 0 HA VAL A 119 11.052 -4.517 -19.719 1.00 0.00 H new ATOM 0 HB VAL A 119 12.366 -2.129 -20.967 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.470 -1.738 -18.748 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.704 -1.536 -18.672 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.458 -3.022 -18.047 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.507 -3.266 -20.232 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.538 -4.633 -19.631 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.575 -4.265 -21.372 1.00 0.00 H new ATOM 1793 N LYS A 120 9.464 -1.799 -20.830 1.00 0.00 N ATOM 1794 CA LYS A 120 8.330 -0.887 -20.585 1.00 0.00 C ATOM 1795 C LYS A 120 7.012 -1.630 -20.416 1.00 0.00 C ATOM 1796 O LYS A 120 6.336 -1.390 -19.432 1.00 0.00 O ATOM 1797 CB LYS A 120 8.271 0.166 -21.709 1.00 0.00 C ATOM 1798 CG LYS A 120 7.222 1.273 -21.484 1.00 0.00 C ATOM 1799 CD LYS A 120 5.877 1.024 -22.190 1.00 0.00 C ATOM 1800 CE LYS A 120 4.988 2.271 -22.052 1.00 0.00 C ATOM 1801 NZ LYS A 120 3.659 2.089 -22.699 1.00 0.00 N ATOM 0 H LYS A 120 9.944 -1.609 -21.710 1.00 0.00 H new ATOM 0 HA LYS A 120 8.494 -0.376 -19.636 1.00 0.00 H new ATOM 0 HB2 LYS A 120 9.253 0.627 -21.811 1.00 0.00 H new ATOM 0 HB3 LYS A 120 8.055 -0.337 -22.652 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.044 1.376 -20.414 1.00 0.00 H new ATOM 0 HG3 LYS A 120 7.631 2.221 -21.832 1.00 0.00 H new ATOM 0 HD2 LYS A 120 6.043 0.797 -23.243 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.379 0.159 -21.752 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.848 2.500 -20.996 1.00 0.00 H new ATOM 0 HE3 LYS A 120 5.494 3.127 -22.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 3.301 3.010 -23.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 3.754 1.449 -23.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.992 1.680 -22.014 1.00 0.00 H new ATOM 1815 N GLU A 121 6.647 -2.551 -21.307 1.00 0.00 N ATOM 1816 CA GLU A 121 5.360 -3.271 -21.210 1.00 0.00 C ATOM 1817 C GLU A 121 5.343 -4.280 -20.050 1.00 0.00 C ATOM 1818 O GLU A 121 4.303 -4.521 -19.432 1.00 0.00 O ATOM 1819 CB GLU A 121 4.991 -3.920 -22.557 1.00 0.00 C ATOM 1820 CG GLU A 121 5.780 -5.188 -22.910 1.00 0.00 C ATOM 1821 CD GLU A 121 5.373 -5.725 -24.296 1.00 0.00 C ATOM 1822 OE1 GLU A 121 4.267 -6.308 -24.417 1.00 0.00 O ATOM 1823 OE2 GLU A 121 6.154 -5.587 -25.270 1.00 0.00 O ATOM 0 H GLU A 121 7.218 -2.822 -22.107 1.00 0.00 H new ATOM 0 HA GLU A 121 4.589 -2.536 -20.979 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.929 -4.164 -22.545 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.141 -3.186 -23.349 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.848 -4.970 -22.900 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.603 -5.953 -22.154 1.00 0.00 H new ATOM 1830 N ARG A 122 6.514 -4.824 -19.692 1.00 0.00 N ATOM 1831 CA ARG A 122 6.688 -5.670 -18.502 1.00 0.00 C ATOM 1832 C ARG A 122 6.523 -4.860 -17.220 1.00 0.00 C ATOM 1833 O ARG A 122 5.673 -5.209 -16.409 1.00 0.00 O ATOM 1834 CB ARG A 122 8.000 -6.459 -18.617 1.00 0.00 C ATOM 1835 CG ARG A 122 7.812 -7.579 -19.655 1.00 0.00 C ATOM 1836 CD ARG A 122 9.122 -8.317 -19.916 1.00 0.00 C ATOM 1837 NE ARG A 122 8.903 -9.472 -20.816 1.00 0.00 N ATOM 1838 CZ ARG A 122 8.423 -10.671 -20.520 1.00 0.00 C ATOM 1839 NH1 ARG A 122 8.099 -11.013 -19.304 1.00 0.00 N ATOM 1840 NH2 ARG A 122 8.276 -11.562 -21.452 1.00 0.00 N ATOM 0 H ARG A 122 7.374 -4.689 -20.224 1.00 0.00 H new ATOM 0 HA ARG A 122 5.896 -6.417 -18.447 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.813 -5.798 -18.917 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.273 -6.882 -17.650 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.059 -8.283 -19.301 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.439 -7.155 -20.587 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.847 -7.635 -20.361 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.546 -8.660 -18.972 1.00 0.00 H new ATOM 0 HE ARG A 122 9.155 -9.325 -21.793 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.212 -10.347 -18.540 1.00 0.00 H new ATOM 0 HH12 ARG A 122 7.733 -11.946 -19.117 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.530 -11.340 -22.415 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.906 -12.484 -21.222 1.00 0.00 H new ATOM 1854 N VAL A 123 7.217 -3.727 -17.085 1.00 0.00 N ATOM 1855 CA VAL A 123 6.987 -2.736 -16.014 1.00 0.00 C ATOM 1856 C VAL A 123 5.520 -2.298 -15.959 1.00 0.00 C ATOM 1857 O VAL A 123 4.938 -2.315 -14.885 1.00 0.00 O ATOM 1858 CB VAL A 123 7.907 -1.527 -16.240 1.00 0.00 C ATOM 1859 CG1 VAL A 123 7.580 -0.314 -15.377 1.00 0.00 C ATOM 1860 CG2 VAL A 123 9.372 -1.884 -15.948 1.00 0.00 C ATOM 0 H VAL A 123 7.967 -3.462 -17.723 1.00 0.00 H new ATOM 0 HA VAL A 123 7.220 -3.197 -15.054 1.00 0.00 H new ATOM 0 HB VAL A 123 7.745 -1.268 -17.286 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.279 0.492 -15.602 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.563 0.018 -15.587 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.664 -0.583 -14.324 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.000 -1.009 -16.116 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.468 -2.206 -14.911 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.689 -2.691 -16.609 1.00 0.00 H new ATOM 1870 N GLU A 124 4.900 -1.932 -17.082 1.00 0.00 N ATOM 1871 CA GLU A 124 3.536 -1.419 -17.114 1.00 0.00 C ATOM 1872 C GLU A 124 2.508 -2.452 -16.651 1.00 0.00 C ATOM 1873 O GLU A 124 1.728 -2.161 -15.746 1.00 0.00 O ATOM 1874 CB GLU A 124 3.211 -0.929 -18.536 1.00 0.00 C ATOM 1875 CG GLU A 124 2.204 0.209 -18.496 1.00 0.00 C ATOM 1876 CD GLU A 124 1.510 0.409 -19.854 1.00 0.00 C ATOM 1877 OE1 GLU A 124 2.212 0.639 -20.868 1.00 0.00 O ATOM 1878 OE2 GLU A 124 0.258 0.342 -19.917 1.00 0.00 O ATOM 0 H GLU A 124 5.338 -1.985 -18.002 1.00 0.00 H new ATOM 0 HA GLU A 124 3.475 -0.588 -16.411 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.124 -0.596 -19.029 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.812 -1.753 -19.128 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.454 0.004 -17.732 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.709 1.131 -18.207 1.00 0.00 H new ATOM 1885 N ASN A 125 2.529 -3.673 -17.205 1.00 0.00 N ATOM 1886 CA ASN A 125 1.552 -4.693 -16.811 1.00 0.00 C ATOM 1887 C ASN A 125 1.813 -5.223 -15.388 1.00 0.00 C ATOM 1888 O ASN A 125 0.857 -5.514 -14.670 1.00 0.00 O ATOM 1889 CB ASN A 125 1.418 -5.786 -17.890 1.00 0.00 C ATOM 1890 CG ASN A 125 2.259 -7.018 -17.614 1.00 0.00 C ATOM 1891 OD1 ASN A 125 1.835 -7.964 -16.967 1.00 0.00 O ATOM 1892 ND2 ASN A 125 3.490 -7.027 -18.063 1.00 0.00 N ATOM 0 H ASN A 125 3.199 -3.973 -17.914 1.00 0.00 H new ATOM 0 HA ASN A 125 0.570 -4.224 -16.752 1.00 0.00 H new ATOM 0 HB2 ASN A 125 0.372 -6.081 -17.969 1.00 0.00 H new ATOM 0 HB3 ASN A 125 1.705 -5.369 -18.855 1.00 0.00 H new ATOM 0 HD21 ASN A 125 4.096 -7.825 -17.873 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.842 -6.236 -18.603 1.00 0.00 H new ATOM 1899 N LEU A 126 3.080 -5.258 -14.945 1.00 0.00 N ATOM 1900 CA LEU A 126 3.440 -5.534 -13.551 1.00 0.00 C ATOM 1901 C LEU A 126 2.872 -4.454 -12.633 1.00 0.00 C ATOM 1902 O LEU A 126 2.185 -4.773 -11.669 1.00 0.00 O ATOM 1903 CB LEU A 126 4.972 -5.692 -13.426 1.00 0.00 C ATOM 1904 CG LEU A 126 5.559 -6.045 -12.040 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.697 -4.848 -11.098 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.770 -7.146 -11.327 1.00 0.00 C ATOM 0 H LEU A 126 3.885 -5.094 -15.549 1.00 0.00 H new ATOM 0 HA LEU A 126 2.996 -6.477 -13.232 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.285 -6.466 -14.127 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.431 -4.759 -13.754 1.00 0.00 H new ATOM 0 HG LEU A 126 6.561 -6.408 -12.270 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.116 -5.179 -10.148 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.358 -4.106 -11.547 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.716 -4.404 -10.927 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.227 -7.353 -10.359 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.741 -6.819 -11.180 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.780 -8.052 -11.934 1.00 0.00 H new ATOM 1918 N ILE A 127 3.109 -3.174 -12.917 1.00 0.00 N ATOM 1919 CA ILE A 127 2.659 -2.124 -11.991 1.00 0.00 C ATOM 1920 C ILE A 127 1.130 -1.978 -12.007 1.00 0.00 C ATOM 1921 O ILE A 127 0.528 -1.821 -10.945 1.00 0.00 O ATOM 1922 CB ILE A 127 3.433 -0.819 -12.240 1.00 0.00 C ATOM 1923 CG1 ILE A 127 4.916 -1.072 -11.872 1.00 0.00 C ATOM 1924 CG2 ILE A 127 2.874 0.355 -11.412 1.00 0.00 C ATOM 1925 CD1 ILE A 127 5.869 0.040 -12.301 1.00 0.00 C ATOM 0 H ILE A 127 3.593 -2.841 -13.751 1.00 0.00 H new ATOM 0 HA ILE A 127 2.896 -2.417 -10.968 1.00 0.00 H new ATOM 0 HB ILE A 127 3.331 -0.539 -13.288 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.993 -1.204 -10.793 1.00 0.00 H new ATOM 0 HG13 ILE A 127 5.237 -2.007 -12.331 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.452 1.255 -11.621 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.831 0.524 -11.678 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.944 0.117 -10.351 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.886 -0.218 -12.005 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.826 0.159 -13.384 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.577 0.974 -11.822 1.00 0.00 H new ATOM 1937 N ALA A 128 0.482 -2.137 -13.162 1.00 0.00 N ATOM 1938 CA ALA A 128 -0.975 -2.062 -13.294 1.00 0.00 C ATOM 1939 C ALA A 128 -1.726 -3.150 -12.503 1.00 0.00 C ATOM 1940 O ALA A 128 -2.846 -2.903 -12.042 1.00 0.00 O ATOM 1941 CB ALA A 128 -1.328 -2.103 -14.788 1.00 0.00 C ATOM 0 H ALA A 128 0.960 -2.324 -14.044 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.307 -1.123 -12.852 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.410 -2.048 -14.908 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.863 -1.257 -15.295 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.961 -3.033 -15.223 1.00 0.00 H new ATOM 1947 N LYS A 129 -1.112 -4.330 -12.299 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.697 -5.414 -11.485 1.00 0.00 C ATOM 1949 C LYS A 129 -1.419 -5.301 -9.979 1.00 0.00 C ATOM 1950 O LYS A 129 -2.165 -5.899 -9.204 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.360 -6.807 -12.057 1.00 0.00 C ATOM 1952 CG LYS A 129 0.077 -7.287 -11.809 1.00 0.00 C ATOM 1953 CD LYS A 129 0.280 -8.708 -12.343 1.00 0.00 C ATOM 1954 CE LYS A 129 1.734 -9.147 -12.132 1.00 0.00 C ATOM 1955 NZ LYS A 129 1.951 -10.554 -12.568 1.00 0.00 N ATOM 0 H LYS A 129 -0.199 -4.559 -12.692 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.776 -5.285 -11.565 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -2.048 -7.535 -11.627 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.541 -6.794 -13.132 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.780 -6.609 -12.293 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.294 -7.261 -10.741 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.394 -9.396 -11.833 1.00 0.00 H new ATOM 0 HD3 LYS A 129 0.031 -8.745 -13.403 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.398 -8.486 -12.689 1.00 0.00 H new ATOM 0 HE3 LYS A 129 1.995 -9.048 -11.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.971 -10.733 -12.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.554 -11.202 -11.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 1.480 -10.711 -13.482 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.393 -4.542 -9.552 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.073 -4.377 -8.109 1.00 0.00 C ATOM 1971 C ILE A 130 -0.553 -3.047 -7.501 1.00 0.00 C ATOM 1972 O ILE A 130 -0.643 -2.943 -6.276 1.00 0.00 O ATOM 1973 CB ILE A 130 1.418 -4.655 -7.797 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.345 -3.502 -8.229 1.00 0.00 C ATOM 1975 CG2 ILE A 130 1.853 -5.990 -8.423 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.819 -3.712 -7.869 1.00 0.00 C ATOM 0 H ILE A 130 0.231 -4.032 -10.178 1.00 0.00 H new ATOM 0 HA ILE A 130 -0.658 -5.147 -7.607 1.00 0.00 H new ATOM 0 HB ILE A 130 1.514 -4.727 -6.714 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.262 -3.369 -9.308 1.00 0.00 H new ATOM 0 HG13 ILE A 130 1.998 -2.579 -7.766 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.903 -6.173 -8.196 1.00 0.00 H new ATOM 0 HG22 ILE A 130 1.247 -6.798 -8.014 1.00 0.00 H new ATOM 0 HG23 ILE A 130 1.718 -5.946 -9.504 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.402 -2.856 -8.208 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.919 -3.814 -6.788 1.00 0.00 H new ATOM 0 HD13 ILE A 130 4.187 -4.616 -8.354 1.00 0.00 H new ATOM 1988 N SER A 131 -0.855 -2.041 -8.330 1.00 0.00 N ATOM 1989 CA SER A 131 -1.375 -0.724 -7.909 1.00 0.00 C ATOM 1990 C SER A 131 -2.699 -0.819 -7.133 1.00 0.00 C ATOM 1991 O SER A 131 -3.642 -1.496 -7.610 1.00 0.00 O ATOM 1992 CB SER A 131 -1.575 0.188 -9.118 1.00 0.00 C ATOM 1993 OG SER A 131 -0.327 0.457 -9.726 1.00 0.00 O ATOM 1994 OXT SER A 131 -2.804 -0.186 -6.055 1.00 0.00 O ATOM 0 H SER A 131 -0.743 -2.117 -9.341 1.00 0.00 H new ATOM 0 HA SER A 131 -0.624 -0.306 -7.238 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.245 -0.286 -9.836 1.00 0.00 H new ATOM 0 HB3 SER A 131 -2.047 1.120 -8.808 1.00 0.00 H new ATOM 0 HG SER A 131 0.069 -0.381 -10.045 1.00 0.00 H new