USER MOD reduce.3.24.130724 H: found=0, std=0, add=1436, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1436 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: B 51 ASN : amide:sc= -3.34 K(o=-4.6,f=0.3!) USER MOD Set 1.2: B 87 LYS NZ :NH3+ -133:sc= -1.24 (180deg=0.876) USER MOD Set 2.1: B 68 HIS : no HD1:sc= -5.05! K(o=-10!,f=-6.5) USER MOD Set 2.2: B 72 HIS : no HD1:sc= -5.11! C(o=-10!,f=-12!) USER MOD Set 3.1: B 43 LYS NZ :NH3+ -163:sc= -0.979! (180deg=-2.46!) USER MOD Set 3.2: B 53 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: B 27 GLN : amide:sc= 0 X(o=-23,f=-23) USER MOD Set 4.2: B 32 TYR OH : rot 30:sc= 0.321 USER MOD Set 4.3: B 41 HIS : no HE2:sc= -23.1! C(o=-23!,f=-23!) USER MOD Set 5.1: B 13 MET CE :methyl 145:sc= -1 (180deg=-2.4!) USER MOD Set 5.2: B 17 MET CE :methyl 156:sc= -7.31! (180deg=-10.5!) USER MOD Set 5.3: B 18 GLN : amide:sc= -20.1! C(o=-28!,f=-35!) USER MOD Set 6.1: A 88 SER OG : rot 171:sc= 0.224 USER MOD Set 6.2: B 55 HIS : no HE2:sc= -18.4! C(o=-17!,f=-16!) USER MOD Set 6.3: B 88 SER OG : rot 114:sc= 1.2 USER MOD Set 7.1: A 72 HIS : no HD1:sc= -6.63! C(o=-9!,f=-4.3!) USER MOD Set 7.2: A 87 LYS NZ :NH3+ 147:sc= -2.34! (180deg=-0.00231) USER MOD Set 8.1: A 64 SER OG : rot -158:sc= 1.85 USER MOD Set 8.2: A 75 TYR OH : rot 104:sc= 1.08 USER MOD Set 9.1: A 31 LYS NZ :NH3+ 168:sc= -1.21! (180deg=-1.4!) USER MOD Set 9.2: A 32 TYR OH : rot 15:sc= -1.2 USER MOD Set10.1: A 13 MET CE :methyl 159:sc= -6.49! (180deg=-9.3!) USER MOD Set10.2: A 21 SER OG : rot -80:sc= -4.31! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 143:sc= 0.247 (180deg=-1.01) USER MOD Single : A 2 CYS SG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -0.0507 X(o=-0.051,f=0) USER MOD Single : A 14 SER OG : rot -55:sc= -0.0312 USER MOD Single : A 17 MET CE :methyl 158:sc= -9.62! (180deg=-12!) USER MOD Single : A 18 GLN : amide:sc= -11.5! C(o=-12!,f=-10!) USER MOD Single : A 19 GLN : amide:sc= -4.28! C(o=-4.3!,f=-8.3!) USER MOD Single : A 24 CYS SG : rot 159:sc= -3.04! USER MOD Single : A 26 THR OG1 : rot 68:sc= 0.466 USER MOD Single : A 27 GLN : amide:sc= -3.77! K(o=-3.8!,f=-0.56) USER MOD Single : A 33 ASN : amide:sc= -0.386 K(o=-0.39,f=-2.2) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HE2:sc= -20.8! C(o=-21!,f=-23!) USER MOD Single : A 43 LYS NZ :NH3+ 170:sc= -0.424 (180deg=-0.617) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -162:sc= -0.161 (180deg=-1.79!) USER MOD Single : A 50 TYR OH : rot 73:sc= -4.22! USER MOD Single : A 51 ASN : amide:sc= -0.533 K(o=-0.53,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.37 USER MOD Single : A 55 HIS : no HE2:sc= -23.6! C(o=-24!,f=-22!) USER MOD Single : A 56 CYS SG : rot 92:sc= -3.25! USER MOD Single : A 61 ASN : amide:sc= -1.61 K(o=-1.6,f=-0.75) USER MOD Single : A 65 TYR OH : rot 120:sc= -0.042 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -3.05! C(o=-3.1!,f=-6!) USER MOD Single : A 70 THR OG1 : rot -92:sc= -0.618! USER MOD Single : A 71 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00285) USER MOD Single : A 77 TYR OH : rot 180:sc= -0.522 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.061) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 CYS SG : rot -1:sc= 1.03 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 ASN : amide:sc= -2.04! K(o=-2!,f=-0.3) USER MOD Single : B 14 SER OG : rot 180:sc= 0.118 USER MOD Single : B 19 GLN : amide:sc= -7.86! C(o=-7.9!,f=-6.6!) USER MOD Single : B 21 SER OG : rot -80:sc= -2.61! USER MOD Single : B 24 CYS SG : rot 173:sc= -5.18! USER MOD Single : B 26 THR OG1 : rot 79:sc= 1.03 USER MOD Single : B 31 LYS NZ :NH3+ 170:sc= -0.969! (180deg=-1.38!) USER MOD Single : B 33 ASN : amide:sc= -0.878 K(o=-0.88,f=-3.5!) USER MOD Single : B 36 LYS NZ :NH3+ -130:sc= -0.183 (180deg=-1.03) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= -1.32! (180deg=-1.32!) USER MOD Single : B 50 TYR OH : rot 60:sc= -4.35! USER MOD Single : B 56 CYS SG : rot 41:sc= -9.43! USER MOD Single : B 61 ASN : amide:sc= -0.305 K(o=-0.3,f=-3.2!) USER MOD Single : B 64 SER OG : rot -114:sc= 1.14 USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 180:sc= 0 USER MOD Single : B 70 THR OG1 : rot -130:sc= -0.656 USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 75 TYR OH : rot 10:sc= 1.84 USER MOD Single : B 77 TYR OH : rot 180:sc= -0.133 USER MOD Single : B 80 GLN : amide:sc= -2.54! K(o=-2.5!,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -25.379 12.051 6.313 1.00 0.00 N ATOM 2 CA MET A 1 -24.433 11.166 7.039 1.00 0.00 C ATOM 3 C MET A 1 -25.155 9.969 7.649 1.00 0.00 C ATOM 4 O MET A 1 -26.262 10.099 8.173 1.00 0.00 O ATOM 5 CB MET A 1 -23.743 11.981 8.134 1.00 0.00 C ATOM 6 CG MET A 1 -24.664 12.969 8.830 1.00 0.00 C ATOM 7 SD MET A 1 -24.505 14.643 8.180 1.00 0.00 S ATOM 8 CE MET A 1 -25.878 15.452 8.997 1.00 0.00 C ATOM 0 H1 MET A 1 -25.101 13.044 6.451 1.00 0.00 H new ATOM 0 H2 MET A 1 -25.358 11.823 5.298 1.00 0.00 H new ATOM 0 H3 MET A 1 -26.341 11.907 6.681 1.00 0.00 H new ATOM 0 HA MET A 1 -23.694 10.781 6.336 1.00 0.00 H new ATOM 0 HB2 MET A 1 -23.329 11.299 8.876 1.00 0.00 H new ATOM 0 HB3 MET A 1 -22.905 12.524 7.697 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.696 12.637 8.720 1.00 0.00 H new ATOM 0 HG3 MET A 1 -24.444 12.975 9.897 1.00 0.00 H new ATOM 0 HE1 MET A 1 -25.914 16.499 8.696 1.00 0.00 H new ATOM 0 HE2 MET A 1 -26.809 14.961 8.715 1.00 0.00 H new ATOM 0 HE3 MET A 1 -25.747 15.389 10.077 1.00 0.00 H new ATOM 20 N CYS A 2 -24.520 8.804 7.579 1.00 0.00 N ATOM 21 CA CYS A 2 -25.097 7.580 8.123 1.00 0.00 C ATOM 22 C CYS A 2 -24.244 6.371 7.756 1.00 0.00 C ATOM 23 O CYS A 2 -24.102 5.435 8.542 1.00 0.00 O ATOM 24 CB CYS A 2 -26.524 7.389 7.605 1.00 0.00 C ATOM 25 SG CYS A 2 -27.769 7.227 8.907 1.00 0.00 S ATOM 0 H CYS A 2 -23.603 8.682 7.150 1.00 0.00 H new ATOM 0 HA CYS A 2 -25.123 7.670 9.209 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -26.785 8.237 6.971 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -26.554 6.499 6.976 1.00 0.00 H new ATOM 0 HG CYS A 2 -28.942 7.072 8.369 1.00 0.00 H new ATOM 31 N ASP A 3 -23.675 6.402 6.556 1.00 0.00 N ATOM 32 CA ASP A 3 -22.831 5.312 6.082 1.00 0.00 C ATOM 33 C ASP A 3 -21.514 5.852 5.535 1.00 0.00 C ATOM 34 O ASP A 3 -20.647 5.088 5.108 1.00 0.00 O ATOM 35 CB ASP A 3 -23.556 4.509 5.001 1.00 0.00 C ATOM 36 CG ASP A 3 -24.425 5.380 4.114 1.00 0.00 C ATOM 37 OD1 ASP A 3 -24.093 6.572 3.945 1.00 0.00 O ATOM 38 OD2 ASP A 3 -25.438 4.871 3.590 1.00 0.00 O ATOM 0 H ASP A 3 -23.783 7.170 5.894 1.00 0.00 H new ATOM 0 HA ASP A 3 -22.615 4.655 6.925 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -22.822 3.988 4.386 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -24.175 3.746 5.473 1.00 0.00 H new ATOM 43 N ARG A 4 -21.373 7.174 5.550 1.00 0.00 N ATOM 44 CA ARG A 4 -20.163 7.820 5.054 1.00 0.00 C ATOM 45 C ARG A 4 -18.950 7.417 5.885 1.00 0.00 C ATOM 46 O ARG A 4 -17.904 7.059 5.342 1.00 0.00 O ATOM 47 CB ARG A 4 -20.327 9.341 5.075 1.00 0.00 C ATOM 48 CG ARG A 4 -20.183 9.986 3.707 1.00 0.00 C ATOM 49 CD ARG A 4 -21.138 9.368 2.701 1.00 0.00 C ATOM 50 NE ARG A 4 -22.100 10.341 2.190 1.00 0.00 N ATOM 51 CZ ARG A 4 -22.891 11.072 2.969 1.00 0.00 C ATOM 52 NH1 ARG A 4 -22.829 10.945 4.287 1.00 0.00 N ATOM 53 NH2 ARG A 4 -23.743 11.934 2.429 1.00 0.00 N ATOM 0 H ARG A 4 -22.082 7.819 5.900 1.00 0.00 H new ATOM 0 HA ARG A 4 -20.002 7.492 4.027 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -21.308 9.587 5.482 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -19.585 9.769 5.749 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -20.376 11.056 3.785 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -19.158 9.872 3.355 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -20.569 8.950 1.870 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -21.672 8.541 3.169 1.00 0.00 H new ATOM 0 HE ARG A 4 -22.169 10.466 1.180 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -22.173 10.285 4.705 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -23.437 11.507 4.883 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -23.791 12.036 1.415 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -24.350 12.494 3.028 1.00 0.00 H new ATOM 67 N LYS A 5 -19.098 7.475 7.204 1.00 0.00 N ATOM 68 CA LYS A 5 -18.016 7.115 8.111 1.00 0.00 C ATOM 69 C LYS A 5 -16.689 7.705 7.645 1.00 0.00 C ATOM 70 O LYS A 5 -16.658 8.623 6.824 1.00 0.00 O ATOM 71 CB LYS A 5 -17.900 5.593 8.216 1.00 0.00 C ATOM 72 CG LYS A 5 -17.716 5.093 9.639 1.00 0.00 C ATOM 73 CD LYS A 5 -18.099 3.627 9.767 1.00 0.00 C ATOM 74 CE LYS A 5 -17.620 3.040 11.083 1.00 0.00 C ATOM 75 NZ LYS A 5 -18.590 3.284 12.186 1.00 0.00 N ATOM 0 H LYS A 5 -19.958 7.768 7.668 1.00 0.00 H new ATOM 0 HA LYS A 5 -18.248 7.527 9.093 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -18.796 5.139 7.793 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -17.057 5.259 7.611 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -16.677 5.227 9.942 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -18.325 5.690 10.318 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -19.182 3.525 9.695 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -17.670 3.064 8.938 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -17.465 1.967 10.967 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -16.656 3.475 11.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -18.226 2.868 13.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -18.719 4.308 12.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -19.503 2.847 11.948 1.00 0.00 H new ATOM 89 N ALA A 6 -15.594 7.170 8.175 1.00 0.00 N ATOM 90 CA ALA A 6 -14.260 7.637 7.821 1.00 0.00 C ATOM 91 C ALA A 6 -14.085 9.114 8.148 1.00 0.00 C ATOM 92 O ALA A 6 -15.025 9.781 8.580 1.00 0.00 O ATOM 93 CB ALA A 6 -13.984 7.388 6.347 1.00 0.00 C ATOM 0 H ALA A 6 -15.606 6.409 8.854 1.00 0.00 H new ATOM 0 HA ALA A 6 -13.541 7.073 8.415 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.984 7.743 6.099 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -14.052 6.320 6.139 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.718 7.922 5.744 1.00 0.00 H new ATOM 99 N VAL A 7 -12.872 9.617 7.943 1.00 0.00 N ATOM 100 CA VAL A 7 -12.569 11.013 8.222 1.00 0.00 C ATOM 101 C VAL A 7 -11.575 11.582 7.216 1.00 0.00 C ATOM 102 O VAL A 7 -10.411 11.811 7.545 1.00 0.00 O ATOM 103 CB VAL A 7 -11.992 11.184 9.639 1.00 0.00 C ATOM 104 CG1 VAL A 7 -12.050 12.640 10.066 1.00 0.00 C ATOM 105 CG2 VAL A 7 -12.733 10.300 10.629 1.00 0.00 C ATOM 0 H VAL A 7 -12.084 9.077 7.585 1.00 0.00 H new ATOM 0 HA VAL A 7 -13.509 11.558 8.143 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.947 10.875 9.625 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -11.638 12.741 11.070 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -11.468 13.246 9.372 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -13.086 12.979 10.063 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -12.310 10.435 11.625 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -13.788 10.574 10.642 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -12.633 9.256 10.331 1.00 0.00 H new ATOM 115 N ILE A 8 -12.035 11.820 5.989 1.00 0.00 N ATOM 116 CA ILE A 8 -11.169 12.372 4.956 1.00 0.00 C ATOM 117 C ILE A 8 -10.317 13.500 5.533 1.00 0.00 C ATOM 118 O ILE A 8 -10.830 14.409 6.185 1.00 0.00 O ATOM 119 CB ILE A 8 -11.988 12.881 3.737 1.00 0.00 C ATOM 120 CG1 ILE A 8 -12.207 11.742 2.740 1.00 0.00 C ATOM 121 CG2 ILE A 8 -11.302 14.056 3.044 1.00 0.00 C ATOM 122 CD1 ILE A 8 -13.483 10.964 2.975 1.00 0.00 C ATOM 0 H ILE A 8 -12.994 11.640 5.690 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.515 11.574 4.604 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.951 13.231 4.109 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -12.223 12.153 1.731 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -11.360 11.058 2.792 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.906 14.382 2.197 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -11.191 14.880 3.749 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -10.319 13.746 2.690 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -13.570 10.173 2.230 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.462 10.523 3.971 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -14.338 11.635 2.893 1.00 0.00 H new ATOM 134 N LYS A 9 -9.015 13.432 5.287 1.00 0.00 N ATOM 135 CA LYS A 9 -8.092 14.446 5.783 1.00 0.00 C ATOM 136 C LYS A 9 -7.354 15.110 4.629 1.00 0.00 C ATOM 137 O LYS A 9 -6.705 16.142 4.803 1.00 0.00 O ATOM 138 CB LYS A 9 -7.092 13.825 6.758 1.00 0.00 C ATOM 139 CG LYS A 9 -7.701 12.765 7.661 1.00 0.00 C ATOM 140 CD LYS A 9 -8.510 13.390 8.784 1.00 0.00 C ATOM 141 CE LYS A 9 -8.872 12.366 9.850 1.00 0.00 C ATOM 142 NZ LYS A 9 -8.305 12.725 11.179 1.00 0.00 N ATOM 0 H LYS A 9 -8.574 12.687 4.748 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.670 15.206 6.309 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -6.273 13.381 6.192 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.662 14.613 7.376 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.341 12.108 7.072 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.909 12.146 8.082 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.939 14.201 9.237 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -9.420 13.829 8.376 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -9.957 12.289 9.927 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -8.504 11.385 9.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -8.574 12.003 11.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -7.268 12.773 11.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -8.676 13.650 11.476 1.00 0.00 H new ATOM 156 N ASN A 10 -7.460 14.511 3.450 1.00 0.00 N ATOM 157 CA ASN A 10 -6.805 15.043 2.262 1.00 0.00 C ATOM 158 C ASN A 10 -7.607 14.698 1.015 1.00 0.00 C ATOM 159 O ASN A 10 -8.518 15.430 0.627 1.00 0.00 O ATOM 160 CB ASN A 10 -5.389 14.479 2.142 1.00 0.00 C ATOM 161 CG ASN A 10 -4.483 15.367 1.312 1.00 0.00 C ATOM 162 OD1 ASN A 10 -3.779 16.226 1.843 1.00 0.00 O ATOM 163 ND2 ASN A 10 -4.496 15.162 -0.001 1.00 0.00 N ATOM 0 H ASN A 10 -7.993 13.656 3.291 1.00 0.00 H new ATOM 0 HA ASN A 10 -6.748 16.128 2.355 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -4.963 14.359 3.138 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -5.433 13.487 1.692 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -3.907 15.728 -0.611 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -5.095 14.439 -0.398 1.00 0.00 H new ATOM 170 N ALA A 11 -7.268 13.574 0.401 1.00 0.00 N ATOM 171 CA ALA A 11 -7.960 13.118 -0.795 1.00 0.00 C ATOM 172 C ALA A 11 -7.708 14.042 -1.981 1.00 0.00 C ATOM 173 O ALA A 11 -6.780 14.849 -1.974 1.00 0.00 O ATOM 174 CB ALA A 11 -9.452 13.000 -0.522 1.00 0.00 C ATOM 0 H ALA A 11 -6.516 12.960 0.713 1.00 0.00 H new ATOM 0 HA ALA A 11 -7.564 12.136 -1.055 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -9.961 12.658 -1.423 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -9.619 12.284 0.283 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -9.846 13.973 -0.230 1.00 0.00 H new ATOM 180 N ASP A 12 -8.547 13.902 -3.000 1.00 0.00 N ATOM 181 CA ASP A 12 -8.438 14.701 -4.212 1.00 0.00 C ATOM 182 C ASP A 12 -9.357 14.141 -5.288 1.00 0.00 C ATOM 183 O ASP A 12 -9.063 14.217 -6.480 1.00 0.00 O ATOM 184 CB ASP A 12 -6.994 14.717 -4.712 1.00 0.00 C ATOM 185 CG ASP A 12 -6.595 16.060 -5.289 1.00 0.00 C ATOM 186 OD1 ASP A 12 -7.460 16.725 -5.897 1.00 0.00 O ATOM 187 OD2 ASP A 12 -5.418 16.447 -5.135 1.00 0.00 O ATOM 0 H ASP A 12 -9.318 13.235 -3.009 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.738 15.724 -3.984 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -6.325 14.466 -3.889 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -6.868 13.946 -5.472 1.00 0.00 H new ATOM 192 N MET A 13 -10.470 13.565 -4.847 1.00 0.00 N ATOM 193 CA MET A 13 -11.443 12.972 -5.753 1.00 0.00 C ATOM 194 C MET A 13 -12.687 13.844 -5.871 1.00 0.00 C ATOM 195 O MET A 13 -12.952 14.684 -5.012 1.00 0.00 O ATOM 196 CB MET A 13 -11.833 11.580 -5.258 1.00 0.00 C ATOM 197 CG MET A 13 -10.851 10.497 -5.664 1.00 0.00 C ATOM 198 SD MET A 13 -10.138 9.634 -4.254 1.00 0.00 S ATOM 199 CE MET A 13 -11.119 8.136 -4.242 1.00 0.00 C ATOM 0 H MET A 13 -10.720 13.497 -3.861 1.00 0.00 H new ATOM 0 HA MET A 13 -10.985 12.894 -6.739 1.00 0.00 H new ATOM 0 HB2 MET A 13 -11.913 11.599 -4.171 1.00 0.00 H new ATOM 0 HB3 MET A 13 -12.820 11.328 -5.646 1.00 0.00 H new ATOM 0 HG2 MET A 13 -11.357 9.777 -6.306 1.00 0.00 H new ATOM 0 HG3 MET A 13 -10.050 10.942 -6.254 1.00 0.00 H new ATOM 0 HE1 MET A 13 -10.586 7.356 -3.698 1.00 0.00 H new ATOM 0 HE2 MET A 13 -12.074 8.330 -3.754 1.00 0.00 H new ATOM 0 HE3 MET A 13 -11.295 7.808 -5.267 1.00 0.00 H new ATOM 209 N SER A 14 -13.447 13.635 -6.940 1.00 0.00 N ATOM 210 CA SER A 14 -14.669 14.398 -7.171 1.00 0.00 C ATOM 211 C SER A 14 -15.713 14.086 -6.101 1.00 0.00 C ATOM 212 O SER A 14 -16.710 13.415 -6.368 1.00 0.00 O ATOM 213 CB SER A 14 -15.235 14.092 -8.559 1.00 0.00 C ATOM 214 OG SER A 14 -16.651 14.154 -8.559 1.00 0.00 O ATOM 0 H SER A 14 -13.239 12.944 -7.661 1.00 0.00 H new ATOM 0 HA SER A 14 -14.422 15.458 -7.116 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.837 14.804 -9.282 1.00 0.00 H new ATOM 0 HB3 SER A 14 -14.912 13.101 -8.876 1.00 0.00 H new ATOM 0 HG SER A 14 -17.005 13.554 -7.870 1.00 0.00 H new ATOM 220 N GLU A 15 -15.475 14.580 -4.891 1.00 0.00 N ATOM 221 CA GLU A 15 -16.391 14.359 -3.778 1.00 0.00 C ATOM 222 C GLU A 15 -17.070 12.997 -3.884 1.00 0.00 C ATOM 223 O GLU A 15 -16.582 12.005 -3.344 1.00 0.00 O ATOM 224 CB GLU A 15 -17.447 15.466 -3.734 1.00 0.00 C ATOM 225 CG GLU A 15 -16.950 16.757 -3.104 1.00 0.00 C ATOM 226 CD GLU A 15 -17.878 17.274 -2.024 1.00 0.00 C ATOM 227 OE1 GLU A 15 -18.980 16.709 -1.866 1.00 0.00 O ATOM 228 OE2 GLU A 15 -17.504 18.247 -1.336 1.00 0.00 O ATOM 0 H GLU A 15 -14.654 15.137 -4.656 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.810 14.380 -2.856 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.786 15.674 -4.749 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.312 15.109 -3.176 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -15.960 16.592 -2.679 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -16.841 17.516 -3.878 1.00 0.00 H new ATOM 235 N GLU A 16 -18.200 12.957 -4.580 1.00 0.00 N ATOM 236 CA GLU A 16 -18.948 11.716 -4.752 1.00 0.00 C ATOM 237 C GLU A 16 -18.014 10.510 -4.773 1.00 0.00 C ATOM 238 O GLU A 16 -18.379 9.424 -4.323 1.00 0.00 O ATOM 239 CB GLU A 16 -19.767 11.762 -6.042 1.00 0.00 C ATOM 240 CG GLU A 16 -18.956 11.449 -7.288 1.00 0.00 C ATOM 241 CD GLU A 16 -19.825 11.245 -8.513 1.00 0.00 C ATOM 242 OE1 GLU A 16 -20.572 12.179 -8.873 1.00 0.00 O ATOM 243 OE2 GLU A 16 -19.759 10.151 -9.112 1.00 0.00 O ATOM 0 H GLU A 16 -18.619 13.769 -5.034 1.00 0.00 H new ATOM 0 HA GLU A 16 -19.624 11.613 -3.903 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -20.590 11.051 -5.966 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -20.210 12.752 -6.146 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -18.256 12.263 -7.475 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -18.362 10.551 -7.115 1.00 0.00 H new ATOM 250 N MET A 17 -16.808 10.705 -5.299 1.00 0.00 N ATOM 251 CA MET A 17 -15.827 9.630 -5.376 1.00 0.00 C ATOM 252 C MET A 17 -15.214 9.348 -4.007 1.00 0.00 C ATOM 253 O MET A 17 -15.081 8.193 -3.605 1.00 0.00 O ATOM 254 CB MET A 17 -14.730 9.984 -6.384 1.00 0.00 C ATOM 255 CG MET A 17 -13.432 9.229 -6.166 1.00 0.00 C ATOM 256 SD MET A 17 -13.699 7.506 -5.722 1.00 0.00 S ATOM 257 CE MET A 17 -14.319 6.878 -7.275 1.00 0.00 C ATOM 0 H MET A 17 -16.488 11.597 -5.677 1.00 0.00 H new ATOM 0 HA MET A 17 -16.339 8.728 -5.711 1.00 0.00 H new ATOM 0 HB2 MET A 17 -15.094 9.779 -7.391 1.00 0.00 H new ATOM 0 HB3 MET A 17 -14.531 11.054 -6.329 1.00 0.00 H new ATOM 0 HG2 MET A 17 -12.831 9.277 -7.074 1.00 0.00 H new ATOM 0 HG3 MET A 17 -12.859 9.719 -5.378 1.00 0.00 H new ATOM 0 HE1 MET A 17 -14.171 5.799 -7.316 1.00 0.00 H new ATOM 0 HE2 MET A 17 -15.382 7.102 -7.360 1.00 0.00 H new ATOM 0 HE3 MET A 17 -13.782 7.349 -8.098 1.00 0.00 H new ATOM 267 N GLN A 18 -14.837 10.407 -3.296 1.00 0.00 N ATOM 268 CA GLN A 18 -14.236 10.262 -1.975 1.00 0.00 C ATOM 269 C GLN A 18 -15.219 9.624 -0.999 1.00 0.00 C ATOM 270 O GLN A 18 -14.820 8.930 -0.064 1.00 0.00 O ATOM 271 CB GLN A 18 -13.775 11.619 -1.441 1.00 0.00 C ATOM 272 CG GLN A 18 -14.339 12.802 -2.209 1.00 0.00 C ATOM 273 CD GLN A 18 -13.285 13.839 -2.541 1.00 0.00 C ATOM 274 OE1 GLN A 18 -13.600 14.999 -2.807 1.00 0.00 O ATOM 275 NE2 GLN A 18 -12.023 13.426 -2.528 1.00 0.00 N ATOM 0 H GLN A 18 -14.937 11.372 -3.612 1.00 0.00 H new ATOM 0 HA GLN A 18 -13.368 9.609 -2.071 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -14.066 11.705 -0.394 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.686 11.662 -1.474 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -14.796 12.446 -3.132 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -15.129 13.268 -1.621 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -11.806 12.455 -2.302 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.270 14.080 -2.744 1.00 0.00 H new ATOM 284 N GLN A 19 -16.508 9.852 -1.230 1.00 0.00 N ATOM 285 CA GLN A 19 -17.543 9.289 -0.377 1.00 0.00 C ATOM 286 C GLN A 19 -17.734 7.820 -0.707 1.00 0.00 C ATOM 287 O GLN A 19 -17.808 6.971 0.184 1.00 0.00 O ATOM 288 CB GLN A 19 -18.859 10.048 -0.558 1.00 0.00 C ATOM 289 CG GLN A 19 -18.760 11.528 -0.222 1.00 0.00 C ATOM 290 CD GLN A 19 -18.136 11.777 1.139 1.00 0.00 C ATOM 291 OE1 GLN A 19 -18.289 10.975 2.060 1.00 0.00 O ATOM 292 NE2 GLN A 19 -17.430 12.893 1.272 1.00 0.00 N ATOM 0 H GLN A 19 -16.858 10.422 -2.000 1.00 0.00 H new ATOM 0 HA GLN A 19 -17.233 9.385 0.664 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -19.192 9.940 -1.590 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -19.622 9.591 0.072 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -18.168 12.032 -0.986 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -19.756 11.970 -0.247 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -17.329 13.530 0.482 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -16.988 13.114 2.165 1.00 0.00 H new ATOM 301 N ASP A 20 -17.792 7.526 -1.999 1.00 0.00 N ATOM 302 CA ASP A 20 -17.950 6.157 -2.454 1.00 0.00 C ATOM 303 C ASP A 20 -16.688 5.363 -2.148 1.00 0.00 C ATOM 304 O ASP A 20 -16.740 4.160 -1.885 1.00 0.00 O ATOM 305 CB ASP A 20 -18.254 6.118 -3.953 1.00 0.00 C ATOM 306 CG ASP A 20 -19.672 5.665 -4.242 1.00 0.00 C ATOM 307 OD1 ASP A 20 -20.588 6.068 -3.495 1.00 0.00 O ATOM 308 OD2 ASP A 20 -19.865 4.906 -5.214 1.00 0.00 O ATOM 0 H ASP A 20 -17.732 8.217 -2.747 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.790 5.707 -1.925 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -18.098 7.109 -4.379 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -17.553 5.445 -4.446 1.00 0.00 H new ATOM 313 N SER A 21 -15.553 6.057 -2.164 1.00 0.00 N ATOM 314 CA SER A 21 -14.272 5.435 -1.869 1.00 0.00 C ATOM 315 C SER A 21 -14.256 4.955 -0.426 1.00 0.00 C ATOM 316 O SER A 21 -13.897 3.812 -0.143 1.00 0.00 O ATOM 317 CB SER A 21 -13.126 6.419 -2.109 1.00 0.00 C ATOM 318 OG SER A 21 -12.068 6.205 -1.192 1.00 0.00 O ATOM 0 H SER A 21 -15.498 7.053 -2.379 1.00 0.00 H new ATOM 0 HA SER A 21 -14.135 4.582 -2.534 1.00 0.00 H new ATOM 0 HB2 SER A 21 -12.756 6.309 -3.128 1.00 0.00 H new ATOM 0 HB3 SER A 21 -13.494 7.441 -2.012 1.00 0.00 H new ATOM 0 HG SER A 21 -12.286 6.629 -0.336 1.00 0.00 H new ATOM 324 N VAL A 22 -14.670 5.833 0.484 1.00 0.00 N ATOM 325 CA VAL A 22 -14.722 5.489 1.895 1.00 0.00 C ATOM 326 C VAL A 22 -15.572 4.240 2.101 1.00 0.00 C ATOM 327 O VAL A 22 -15.145 3.287 2.752 1.00 0.00 O ATOM 328 CB VAL A 22 -15.303 6.637 2.740 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.558 6.172 4.165 1.00 0.00 C ATOM 330 CG2 VAL A 22 -14.371 7.838 2.725 1.00 0.00 C ATOM 0 H VAL A 22 -14.972 6.783 0.267 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.699 5.303 2.221 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.254 6.940 2.302 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.969 6.996 4.749 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -16.267 5.345 4.156 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.621 5.842 4.613 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.800 8.639 3.328 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.403 7.552 3.136 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -14.242 8.185 1.700 1.00 0.00 H new ATOM 340 N GLU A 23 -16.774 4.251 1.532 1.00 0.00 N ATOM 341 CA GLU A 23 -17.676 3.113 1.647 1.00 0.00 C ATOM 342 C GLU A 23 -16.973 1.833 1.214 1.00 0.00 C ATOM 343 O GLU A 23 -17.166 0.775 1.810 1.00 0.00 O ATOM 344 CB GLU A 23 -18.933 3.337 0.804 1.00 0.00 C ATOM 345 CG GLU A 23 -19.891 4.358 1.398 1.00 0.00 C ATOM 346 CD GLU A 23 -21.070 3.713 2.100 1.00 0.00 C ATOM 347 OE1 GLU A 23 -20.865 3.118 3.180 1.00 0.00 O ATOM 348 OE2 GLU A 23 -22.198 3.803 1.572 1.00 0.00 O ATOM 0 H GLU A 23 -17.143 5.032 0.990 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.972 3.013 2.691 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.638 3.665 -0.193 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.455 2.387 0.686 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.352 4.988 2.106 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -20.257 5.011 0.606 1.00 0.00 H new ATOM 355 N CYS A 24 -16.145 1.941 0.178 1.00 0.00 N ATOM 356 CA CYS A 24 -15.401 0.790 -0.321 1.00 0.00 C ATOM 357 C CYS A 24 -14.344 0.367 0.693 1.00 0.00 C ATOM 358 O CYS A 24 -14.099 -0.824 0.900 1.00 0.00 O ATOM 359 CB CYS A 24 -14.739 1.118 -1.661 1.00 0.00 C ATOM 360 SG CYS A 24 -15.901 1.613 -2.956 1.00 0.00 S ATOM 0 H CYS A 24 -15.974 2.809 -0.329 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.099 -0.033 -0.470 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -14.016 1.920 -1.510 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -14.181 0.246 -2.002 1.00 0.00 H new ATOM 0 HG CYS A 24 -15.268 2.279 -3.875 1.00 0.00 H new ATOM 366 N ALA A 25 -13.745 1.353 1.351 1.00 0.00 N ATOM 367 CA ALA A 25 -12.745 1.082 2.367 1.00 0.00 C ATOM 368 C ALA A 25 -13.436 0.463 3.561 1.00 0.00 C ATOM 369 O ALA A 25 -12.870 -0.354 4.288 1.00 0.00 O ATOM 370 CB ALA A 25 -12.020 2.362 2.761 1.00 0.00 C ATOM 0 H ALA A 25 -13.936 2.343 1.197 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.996 0.392 1.978 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.274 2.138 3.524 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.528 2.785 1.886 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.738 3.080 3.156 1.00 0.00 H new ATOM 376 N THR A 26 -14.691 0.856 3.726 1.00 0.00 N ATOM 377 CA THR A 26 -15.523 0.356 4.800 1.00 0.00 C ATOM 378 C THR A 26 -15.955 -1.075 4.505 1.00 0.00 C ATOM 379 O THR A 26 -15.918 -1.940 5.381 1.00 0.00 O ATOM 380 CB THR A 26 -16.744 1.254 4.965 1.00 0.00 C ATOM 381 OG1 THR A 26 -16.352 2.579 5.275 1.00 0.00 O ATOM 382 CG2 THR A 26 -17.676 0.786 6.049 1.00 0.00 C ATOM 0 H THR A 26 -15.156 1.530 3.118 1.00 0.00 H new ATOM 0 HA THR A 26 -14.951 0.361 5.728 1.00 0.00 H new ATOM 0 HB THR A 26 -17.270 1.213 4.011 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.909 2.979 4.498 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.525 1.466 6.118 1.00 0.00 H new ATOM 0 HG22 THR A 26 -18.032 -0.217 5.814 1.00 0.00 H new ATOM 0 HG23 THR A 26 -17.147 0.769 7.002 1.00 0.00 H new ATOM 390 N GLN A 27 -16.346 -1.325 3.256 1.00 0.00 N ATOM 391 CA GLN A 27 -16.763 -2.657 2.844 1.00 0.00 C ATOM 392 C GLN A 27 -15.687 -3.664 3.218 1.00 0.00 C ATOM 393 O GLN A 27 -15.975 -4.735 3.750 1.00 0.00 O ATOM 394 CB GLN A 27 -17.022 -2.699 1.337 1.00 0.00 C ATOM 395 CG GLN A 27 -15.755 -2.826 0.509 1.00 0.00 C ATOM 396 CD GLN A 27 -15.903 -3.797 -0.646 1.00 0.00 C ATOM 397 OE1 GLN A 27 -15.026 -3.896 -1.504 1.00 0.00 O ATOM 398 NE2 GLN A 27 -17.015 -4.520 -0.672 1.00 0.00 N ATOM 0 H GLN A 27 -16.381 -0.623 2.517 1.00 0.00 H new ATOM 0 HA GLN A 27 -17.691 -2.911 3.357 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -17.679 -3.539 1.112 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -17.551 -1.793 1.042 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -15.481 -1.845 0.120 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -14.938 -3.154 1.151 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -17.715 -4.405 0.061 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -17.170 -5.191 -1.425 1.00 0.00 H new ATOM 407 N ALA A 28 -14.439 -3.295 2.950 1.00 0.00 N ATOM 408 CA ALA A 28 -13.304 -4.147 3.272 1.00 0.00 C ATOM 409 C ALA A 28 -13.025 -4.108 4.768 1.00 0.00 C ATOM 410 O ALA A 28 -12.476 -5.049 5.339 1.00 0.00 O ATOM 411 CB ALA A 28 -12.073 -3.704 2.498 1.00 0.00 C ATOM 0 H ALA A 28 -14.189 -2.409 2.510 1.00 0.00 H new ATOM 0 HA ALA A 28 -13.546 -5.171 2.986 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.233 -4.351 2.750 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.273 -3.768 1.428 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.829 -2.674 2.760 1.00 0.00 H new ATOM 417 N LEU A 29 -13.405 -3.002 5.395 1.00 0.00 N ATOM 418 CA LEU A 29 -13.199 -2.820 6.825 1.00 0.00 C ATOM 419 C LEU A 29 -14.067 -3.776 7.638 1.00 0.00 C ATOM 420 O LEU A 29 -13.600 -4.392 8.597 1.00 0.00 O ATOM 421 CB LEU A 29 -13.502 -1.380 7.219 1.00 0.00 C ATOM 422 CG LEU A 29 -12.355 -0.405 6.977 1.00 0.00 C ATOM 423 CD1 LEU A 29 -12.892 0.952 6.569 1.00 0.00 C ATOM 424 CD2 LEU A 29 -11.490 -0.288 8.218 1.00 0.00 C ATOM 0 H LEU A 29 -13.859 -2.215 4.933 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.155 -3.043 7.044 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -14.375 -1.040 6.662 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -13.768 -1.354 8.276 1.00 0.00 H new ATOM 0 HG LEU A 29 -11.738 -0.788 6.164 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -12.061 1.636 6.400 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -13.473 0.853 5.652 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -13.530 1.344 7.361 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.676 0.412 8.029 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -12.094 0.074 9.050 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.078 -1.266 8.468 1.00 0.00 H new ATOM 436 N GLU A 30 -15.334 -3.892 7.254 1.00 0.00 N ATOM 437 CA GLU A 30 -16.269 -4.768 7.952 1.00 0.00 C ATOM 438 C GLU A 30 -16.103 -6.217 7.502 1.00 0.00 C ATOM 439 O GLU A 30 -16.363 -7.147 8.266 1.00 0.00 O ATOM 440 CB GLU A 30 -17.708 -4.309 7.710 1.00 0.00 C ATOM 441 CG GLU A 30 -18.334 -3.614 8.908 1.00 0.00 C ATOM 442 CD GLU A 30 -19.738 -3.114 8.624 1.00 0.00 C ATOM 443 OE1 GLU A 30 -20.458 -3.777 7.848 1.00 0.00 O ATOM 444 OE2 GLU A 30 -20.116 -2.060 9.177 1.00 0.00 O ATOM 0 H GLU A 30 -15.737 -3.390 6.463 1.00 0.00 H new ATOM 0 HA GLU A 30 -16.050 -4.712 9.018 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -17.726 -3.631 6.857 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -18.316 -5.173 7.443 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -18.362 -4.305 9.751 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -17.706 -2.774 9.205 1.00 0.00 H new ATOM 451 N LYS A 31 -15.670 -6.404 6.259 1.00 0.00 N ATOM 452 CA LYS A 31 -15.472 -7.740 5.714 1.00 0.00 C ATOM 453 C LYS A 31 -14.178 -8.354 6.235 1.00 0.00 C ATOM 454 O LYS A 31 -14.075 -9.570 6.400 1.00 0.00 O ATOM 455 CB LYS A 31 -15.454 -7.692 4.187 1.00 0.00 C ATOM 456 CG LYS A 31 -16.820 -7.909 3.562 1.00 0.00 C ATOM 457 CD LYS A 31 -16.903 -7.290 2.178 1.00 0.00 C ATOM 458 CE LYS A 31 -16.768 -8.341 1.086 1.00 0.00 C ATOM 459 NZ LYS A 31 -16.944 -9.723 1.614 1.00 0.00 N ATOM 0 H LYS A 31 -15.450 -5.647 5.612 1.00 0.00 H new ATOM 0 HA LYS A 31 -16.303 -8.366 6.039 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -15.065 -6.726 3.866 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -14.767 -8.452 3.815 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -17.026 -8.977 3.497 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -17.588 -7.475 4.203 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -17.855 -6.770 2.068 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -16.117 -6.544 2.065 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -17.509 -8.153 0.309 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -15.787 -8.254 0.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -17.048 -10.387 0.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -16.112 -9.987 2.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -17.795 -9.761 2.210 1.00 0.00 H new ATOM 473 N TYR A 32 -13.193 -7.502 6.501 1.00 0.00 N ATOM 474 CA TYR A 32 -11.904 -7.954 7.012 1.00 0.00 C ATOM 475 C TYR A 32 -11.153 -6.799 7.663 1.00 0.00 C ATOM 476 O TYR A 32 -11.150 -5.681 7.147 1.00 0.00 O ATOM 477 CB TYR A 32 -11.053 -8.558 5.890 1.00 0.00 C ATOM 478 CG TYR A 32 -11.756 -8.624 4.552 1.00 0.00 C ATOM 479 CD1 TYR A 32 -12.253 -7.476 3.952 1.00 0.00 C ATOM 480 CD2 TYR A 32 -11.916 -9.833 3.889 1.00 0.00 C ATOM 481 CE1 TYR A 32 -12.892 -7.529 2.729 1.00 0.00 C ATOM 482 CE2 TYR A 32 -12.552 -9.895 2.664 1.00 0.00 C ATOM 483 CZ TYR A 32 -13.040 -8.741 2.088 1.00 0.00 C ATOM 484 OH TYR A 32 -13.675 -8.799 0.869 1.00 0.00 O ATOM 0 H TYR A 32 -13.263 -6.493 6.371 1.00 0.00 H new ATOM 0 HA TYR A 32 -12.092 -8.724 7.761 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -10.142 -7.969 5.782 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -10.750 -9.564 6.179 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -12.138 -6.525 4.450 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -11.537 -10.739 4.338 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -13.274 -6.626 2.277 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -12.666 -10.843 2.160 1.00 0.00 H new ATOM 0 HH TYR A 32 -13.744 -7.897 0.493 1.00 0.00 H new ATOM 494 N ASN A 33 -10.514 -7.073 8.795 1.00 0.00 N ATOM 495 CA ASN A 33 -9.757 -6.050 9.505 1.00 0.00 C ATOM 496 C ASN A 33 -8.268 -6.196 9.228 1.00 0.00 C ATOM 497 O ASN A 33 -7.430 -5.823 10.049 1.00 0.00 O ATOM 498 CB ASN A 33 -10.021 -6.134 11.011 1.00 0.00 C ATOM 499 CG ASN A 33 -11.495 -6.279 11.334 1.00 0.00 C ATOM 500 OD1 ASN A 33 -12.132 -7.260 10.951 1.00 0.00 O ATOM 501 ND2 ASN A 33 -12.044 -5.300 12.043 1.00 0.00 N ATOM 0 H ASN A 33 -10.505 -7.991 9.239 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.085 -5.075 9.146 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -9.476 -6.982 11.425 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -9.632 -5.238 11.495 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -13.032 -5.343 12.291 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -11.477 -4.505 12.339 1.00 0.00 H new ATOM 508 N ILE A 34 -7.948 -6.741 8.062 1.00 0.00 N ATOM 509 CA ILE A 34 -6.563 -6.941 7.662 1.00 0.00 C ATOM 510 C ILE A 34 -6.104 -5.838 6.715 1.00 0.00 C ATOM 511 O ILE A 34 -6.267 -5.951 5.502 1.00 0.00 O ATOM 512 CB ILE A 34 -6.368 -8.302 6.970 1.00 0.00 C ATOM 513 CG1 ILE A 34 -6.823 -9.434 7.887 1.00 0.00 C ATOM 514 CG2 ILE A 34 -4.913 -8.490 6.567 1.00 0.00 C ATOM 515 CD1 ILE A 34 -6.061 -9.490 9.189 1.00 0.00 C ATOM 0 H ILE A 34 -8.633 -7.054 7.374 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.964 -6.914 8.572 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.979 -8.324 6.067 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.885 -9.315 8.100 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.707 -10.384 7.365 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.793 -9.457 6.079 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.621 -7.697 5.878 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.282 -8.450 7.455 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -6.434 -10.317 9.794 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -5.001 -9.640 8.984 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.197 -8.554 9.731 1.00 0.00 H new ATOM 527 N GLU A 35 -5.533 -4.777 7.283 1.00 0.00 N ATOM 528 CA GLU A 35 -5.047 -3.644 6.497 1.00 0.00 C ATOM 529 C GLU A 35 -4.751 -4.058 5.061 1.00 0.00 C ATOM 530 O GLU A 35 -5.548 -3.811 4.156 1.00 0.00 O ATOM 531 CB GLU A 35 -3.789 -3.057 7.140 1.00 0.00 C ATOM 532 CG GLU A 35 -4.079 -2.148 8.323 1.00 0.00 C ATOM 533 CD GLU A 35 -3.938 -2.861 9.654 1.00 0.00 C ATOM 534 OE1 GLU A 35 -2.939 -3.588 9.836 1.00 0.00 O ATOM 535 OE2 GLU A 35 -4.826 -2.690 10.516 1.00 0.00 O ATOM 0 H GLU A 35 -5.395 -4.678 8.289 1.00 0.00 H new ATOM 0 HA GLU A 35 -5.830 -2.886 6.479 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -3.144 -3.872 7.468 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.235 -2.495 6.388 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -3.399 -1.296 8.297 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -5.090 -1.752 8.233 1.00 0.00 H new ATOM 542 N LYS A 36 -3.602 -4.694 4.856 1.00 0.00 N ATOM 543 CA LYS A 36 -3.208 -5.146 3.530 1.00 0.00 C ATOM 544 C LYS A 36 -4.392 -5.767 2.792 1.00 0.00 C ATOM 545 O LYS A 36 -4.591 -5.520 1.602 1.00 0.00 O ATOM 546 CB LYS A 36 -2.063 -6.157 3.631 1.00 0.00 C ATOM 547 CG LYS A 36 -2.049 -6.933 4.938 1.00 0.00 C ATOM 548 CD LYS A 36 -2.560 -8.351 4.747 1.00 0.00 C ATOM 549 CE LYS A 36 -1.467 -9.270 4.222 1.00 0.00 C ATOM 550 NZ LYS A 36 -2.022 -10.544 3.687 1.00 0.00 N ATOM 0 H LYS A 36 -2.929 -4.907 5.592 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.866 -4.279 2.964 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.136 -6.860 2.802 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.115 -5.631 3.520 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.034 -6.961 5.335 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.666 -6.419 5.675 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.935 -8.735 5.696 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -3.399 -8.346 4.051 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.909 -8.759 3.437 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.761 -9.490 5.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.245 -11.142 3.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.533 -11.044 4.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -2.676 -10.337 2.905 1.00 0.00 H new ATOM 564 N ASP A 37 -5.178 -6.570 3.503 1.00 0.00 N ATOM 565 CA ASP A 37 -6.341 -7.219 2.911 1.00 0.00 C ATOM 566 C ASP A 37 -7.365 -6.181 2.465 1.00 0.00 C ATOM 567 O ASP A 37 -7.700 -6.088 1.285 1.00 0.00 O ATOM 568 CB ASP A 37 -6.979 -8.181 3.915 1.00 0.00 C ATOM 569 CG ASP A 37 -7.438 -9.473 3.268 1.00 0.00 C ATOM 570 OD1 ASP A 37 -6.716 -9.986 2.388 1.00 0.00 O ATOM 571 OD2 ASP A 37 -8.520 -9.972 3.643 1.00 0.00 O ATOM 0 H ASP A 37 -5.030 -6.786 4.489 1.00 0.00 H new ATOM 0 HA ASP A 37 -6.012 -7.783 2.038 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.261 -8.408 4.703 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -7.830 -7.694 4.390 1.00 0.00 H new ATOM 576 N ILE A 38 -7.855 -5.405 3.421 1.00 0.00 N ATOM 577 CA ILE A 38 -8.841 -4.371 3.143 1.00 0.00 C ATOM 578 C ILE A 38 -8.429 -3.515 1.948 1.00 0.00 C ATOM 579 O ILE A 38 -9.263 -3.148 1.119 1.00 0.00 O ATOM 580 CB ILE A 38 -9.048 -3.462 4.369 1.00 0.00 C ATOM 581 CG1 ILE A 38 -9.608 -4.273 5.539 1.00 0.00 C ATOM 582 CG2 ILE A 38 -9.971 -2.304 4.028 1.00 0.00 C ATOM 583 CD1 ILE A 38 -9.302 -3.674 6.894 1.00 0.00 C ATOM 0 H ILE A 38 -7.584 -5.473 4.402 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.777 -4.878 2.908 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.083 -3.050 4.663 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.689 -4.360 5.425 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.201 -5.283 5.498 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.104 -1.674 4.907 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.533 -1.715 3.222 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.939 -2.692 3.709 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -9.730 -4.303 7.675 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -8.222 -3.612 7.029 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -9.733 -2.675 6.956 1.00 0.00 H new ATOM 595 N ALA A 39 -7.142 -3.199 1.868 1.00 0.00 N ATOM 596 CA ALA A 39 -6.622 -2.385 0.777 1.00 0.00 C ATOM 597 C ALA A 39 -6.659 -3.141 -0.548 1.00 0.00 C ATOM 598 O ALA A 39 -7.009 -2.577 -1.585 1.00 0.00 O ATOM 599 CB ALA A 39 -5.202 -1.934 1.088 1.00 0.00 C ATOM 0 H ALA A 39 -6.439 -3.494 2.546 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.261 -1.507 0.679 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.825 -1.327 0.265 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.200 -1.344 2.005 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.563 -2.807 1.217 1.00 0.00 H new ATOM 605 N ALA A 40 -6.293 -4.417 -0.509 1.00 0.00 N ATOM 606 CA ALA A 40 -6.282 -5.245 -1.709 1.00 0.00 C ATOM 607 C ALA A 40 -7.637 -5.222 -2.408 1.00 0.00 C ATOM 608 O ALA A 40 -7.736 -4.860 -3.581 1.00 0.00 O ATOM 609 CB ALA A 40 -5.891 -6.673 -1.361 1.00 0.00 C ATOM 0 H ALA A 40 -6.000 -4.900 0.340 1.00 0.00 H new ATOM 0 HA ALA A 40 -5.542 -4.833 -2.396 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.887 -7.280 -2.266 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -4.896 -6.680 -0.915 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.609 -7.084 -0.652 1.00 0.00 H new ATOM 615 N HIS A 41 -8.677 -5.611 -1.680 1.00 0.00 N ATOM 616 CA HIS A 41 -10.029 -5.639 -2.228 1.00 0.00 C ATOM 617 C HIS A 41 -10.454 -4.254 -2.704 1.00 0.00 C ATOM 618 O HIS A 41 -10.807 -4.067 -3.869 1.00 0.00 O ATOM 619 CB HIS A 41 -11.018 -6.151 -1.178 1.00 0.00 C ATOM 620 CG HIS A 41 -10.362 -6.805 -0.003 1.00 0.00 C ATOM 621 ND1 HIS A 41 -10.718 -6.542 1.303 1.00 0.00 N ATOM 622 CD2 HIS A 41 -9.360 -7.714 0.060 1.00 0.00 C ATOM 623 CE1 HIS A 41 -9.964 -7.260 2.116 1.00 0.00 C ATOM 624 NE2 HIS A 41 -9.133 -7.979 1.387 1.00 0.00 N ATOM 0 H HIS A 41 -8.610 -5.912 -0.708 1.00 0.00 H new ATOM 0 HA HIS A 41 -10.031 -6.315 -3.083 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -11.625 -5.317 -0.826 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -11.696 -6.863 -1.647 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -11.449 -5.894 1.596 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -8.837 -8.149 -0.779 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -10.019 -7.258 3.195 1.00 0.00 H new ATOM 633 N ILE A 42 -10.420 -3.286 -1.794 1.00 0.00 N ATOM 634 CA ILE A 42 -10.805 -1.917 -2.116 1.00 0.00 C ATOM 635 C ILE A 42 -10.327 -1.519 -3.509 1.00 0.00 C ATOM 636 O ILE A 42 -11.075 -0.926 -4.286 1.00 0.00 O ATOM 637 CB ILE A 42 -10.239 -0.918 -1.088 1.00 0.00 C ATOM 638 CG1 ILE A 42 -10.857 -1.166 0.290 1.00 0.00 C ATOM 639 CG2 ILE A 42 -10.496 0.511 -1.541 1.00 0.00 C ATOM 640 CD1 ILE A 42 -10.134 -0.456 1.415 1.00 0.00 C ATOM 0 H ILE A 42 -10.129 -3.425 -0.826 1.00 0.00 H new ATOM 0 HA ILE A 42 -11.894 -1.883 -2.087 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.162 -1.066 -1.014 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.897 -0.842 0.276 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -10.860 -2.237 0.490 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -10.090 1.205 -0.804 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -10.013 0.680 -2.503 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.569 0.674 -1.640 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.627 -0.677 2.361 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -9.100 -0.798 1.456 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -10.154 0.619 1.239 1.00 0.00 H new ATOM 652 N LYS A 43 -9.077 -1.846 -3.815 1.00 0.00 N ATOM 653 CA LYS A 43 -8.497 -1.519 -5.111 1.00 0.00 C ATOM 654 C LYS A 43 -9.154 -2.331 -6.226 1.00 0.00 C ATOM 655 O LYS A 43 -9.726 -1.772 -7.162 1.00 0.00 O ATOM 656 CB LYS A 43 -6.981 -1.768 -5.086 1.00 0.00 C ATOM 657 CG LYS A 43 -6.378 -2.137 -6.436 1.00 0.00 C ATOM 658 CD LYS A 43 -6.868 -1.217 -7.545 1.00 0.00 C ATOM 659 CE LYS A 43 -6.119 -1.456 -8.849 1.00 0.00 C ATOM 660 NZ LYS A 43 -5.267 -2.676 -8.793 1.00 0.00 N ATOM 0 H LYS A 43 -8.446 -2.338 -3.183 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.679 -0.464 -5.313 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.485 -0.872 -4.714 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.769 -2.568 -4.377 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -5.291 -2.085 -6.375 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -6.635 -3.168 -6.679 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -7.935 -1.375 -7.704 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -6.742 -0.179 -7.238 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -6.835 -1.552 -9.665 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -5.496 -0.590 -9.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.911 -2.895 -9.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -4.464 -2.510 -8.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.830 -3.477 -8.441 1.00 0.00 H new ATOM 674 N LYS A 44 -9.062 -3.652 -6.122 1.00 0.00 N ATOM 675 CA LYS A 44 -9.639 -4.541 -7.122 1.00 0.00 C ATOM 676 C LYS A 44 -11.037 -4.085 -7.528 1.00 0.00 C ATOM 677 O LYS A 44 -11.336 -3.947 -8.713 1.00 0.00 O ATOM 678 CB LYS A 44 -9.690 -5.973 -6.591 1.00 0.00 C ATOM 679 CG LYS A 44 -9.154 -7.001 -7.572 1.00 0.00 C ATOM 680 CD LYS A 44 -10.070 -7.152 -8.774 1.00 0.00 C ATOM 681 CE LYS A 44 -10.365 -8.614 -9.069 1.00 0.00 C ATOM 682 NZ LYS A 44 -11.530 -9.114 -8.289 1.00 0.00 N ATOM 0 H LYS A 44 -8.592 -4.131 -5.354 1.00 0.00 H new ATOM 0 HA LYS A 44 -9.002 -4.509 -8.006 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.115 -6.030 -5.667 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.721 -6.223 -6.341 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -8.160 -6.704 -7.906 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -9.048 -7.963 -7.071 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.004 -6.621 -8.590 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -9.607 -6.690 -9.646 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -10.562 -8.737 -10.134 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -9.487 -9.216 -8.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -11.698 -10.114 -8.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -11.333 -9.021 -7.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -12.374 -8.557 -8.530 1.00 0.00 H new ATOM 696 N GLU A 45 -11.888 -3.857 -6.536 1.00 0.00 N ATOM 697 CA GLU A 45 -13.256 -3.421 -6.790 1.00 0.00 C ATOM 698 C GLU A 45 -13.279 -2.028 -7.415 1.00 0.00 C ATOM 699 O GLU A 45 -13.948 -1.801 -8.423 1.00 0.00 O ATOM 700 CB GLU A 45 -14.067 -3.425 -5.493 1.00 0.00 C ATOM 701 CG GLU A 45 -15.570 -3.390 -5.714 1.00 0.00 C ATOM 702 CD GLU A 45 -16.334 -4.150 -4.648 1.00 0.00 C ATOM 703 OE1 GLU A 45 -16.199 -5.391 -4.589 1.00 0.00 O ATOM 704 OE2 GLU A 45 -17.069 -3.504 -3.871 1.00 0.00 O ATOM 0 H GLU A 45 -11.656 -3.966 -5.549 1.00 0.00 H new ATOM 0 HA GLU A 45 -13.707 -4.122 -7.493 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.813 -4.316 -4.919 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -13.777 -2.564 -4.890 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.907 -2.354 -5.728 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.800 -3.813 -6.692 1.00 0.00 H new ATOM 711 N PHE A 46 -12.547 -1.099 -6.809 1.00 0.00 N ATOM 712 CA PHE A 46 -12.485 0.269 -7.305 1.00 0.00 C ATOM 713 C PHE A 46 -11.980 0.309 -8.744 1.00 0.00 C ATOM 714 O PHE A 46 -12.314 1.218 -9.505 1.00 0.00 O ATOM 715 CB PHE A 46 -11.578 1.115 -6.410 1.00 0.00 C ATOM 716 CG PHE A 46 -12.284 2.274 -5.768 1.00 0.00 C ATOM 717 CD1 PHE A 46 -12.982 2.106 -4.583 1.00 0.00 C ATOM 718 CD2 PHE A 46 -12.252 3.531 -6.350 1.00 0.00 C ATOM 719 CE1 PHE A 46 -13.633 3.170 -3.990 1.00 0.00 C ATOM 720 CE2 PHE A 46 -12.902 4.599 -5.763 1.00 0.00 C ATOM 721 CZ PHE A 46 -13.593 4.418 -4.580 1.00 0.00 C ATOM 0 H PHE A 46 -11.988 -1.270 -5.973 1.00 0.00 H new ATOM 0 HA PHE A 46 -13.494 0.681 -7.285 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -11.155 0.480 -5.631 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.744 1.491 -7.003 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -13.017 1.132 -4.118 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.712 3.677 -7.274 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -14.173 3.026 -3.066 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -12.870 5.573 -6.228 1.00 0.00 H new ATOM 0 HZ PHE A 46 -14.101 5.251 -4.118 1.00 0.00 H new ATOM 731 N ASP A 47 -11.173 -0.682 -9.111 1.00 0.00 N ATOM 732 CA ASP A 47 -10.621 -0.758 -10.458 1.00 0.00 C ATOM 733 C ASP A 47 -11.637 -1.353 -11.429 1.00 0.00 C ATOM 734 O ASP A 47 -11.686 -0.976 -12.599 1.00 0.00 O ATOM 735 CB ASP A 47 -9.338 -1.593 -10.461 1.00 0.00 C ATOM 736 CG ASP A 47 -9.576 -3.029 -10.886 1.00 0.00 C ATOM 737 OD1 ASP A 47 -9.937 -3.249 -12.063 1.00 0.00 O ATOM 738 OD2 ASP A 47 -9.400 -3.935 -10.045 1.00 0.00 O ATOM 0 H ASP A 47 -10.887 -1.443 -8.494 1.00 0.00 H new ATOM 0 HA ASP A 47 -10.385 0.254 -10.786 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -8.613 -1.135 -11.133 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -8.899 -1.582 -9.463 1.00 0.00 H new ATOM 743 N LYS A 48 -12.445 -2.286 -10.937 1.00 0.00 N ATOM 744 CA LYS A 48 -13.456 -2.930 -11.765 1.00 0.00 C ATOM 745 C LYS A 48 -14.828 -2.299 -11.548 1.00 0.00 C ATOM 746 O LYS A 48 -15.831 -2.777 -12.078 1.00 0.00 O ATOM 747 CB LYS A 48 -13.517 -4.427 -11.463 1.00 0.00 C ATOM 748 CG LYS A 48 -12.826 -5.286 -12.510 1.00 0.00 C ATOM 749 CD LYS A 48 -13.648 -5.380 -13.784 1.00 0.00 C ATOM 750 CE LYS A 48 -13.109 -4.458 -14.865 1.00 0.00 C ATOM 751 NZ LYS A 48 -12.266 -5.191 -15.849 1.00 0.00 N ATOM 0 H LYS A 48 -12.419 -2.612 -9.971 1.00 0.00 H new ATOM 0 HA LYS A 48 -13.174 -2.788 -12.808 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -13.058 -4.613 -10.492 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -14.561 -4.732 -11.386 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.846 -4.866 -12.738 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.659 -6.286 -12.109 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.643 -6.408 -14.146 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -14.685 -5.122 -13.569 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -13.941 -3.981 -15.383 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -12.522 -3.663 -14.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -11.917 -4.527 -16.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -11.458 -5.625 -15.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -12.833 -5.933 -16.307 1.00 0.00 H new ATOM 765 N LYS A 49 -14.865 -1.224 -10.768 1.00 0.00 N ATOM 766 CA LYS A 49 -16.115 -0.531 -10.486 1.00 0.00 C ATOM 767 C LYS A 49 -15.999 0.954 -10.814 1.00 0.00 C ATOM 768 O LYS A 49 -16.980 1.694 -10.743 1.00 0.00 O ATOM 769 CB LYS A 49 -16.505 -0.713 -9.018 1.00 0.00 C ATOM 770 CG LYS A 49 -18.002 -0.872 -8.803 1.00 0.00 C ATOM 771 CD LYS A 49 -18.545 0.195 -7.867 1.00 0.00 C ATOM 772 CE LYS A 49 -19.783 0.865 -8.442 1.00 0.00 C ATOM 773 NZ LYS A 49 -19.772 0.874 -9.931 1.00 0.00 N ATOM 0 H LYS A 49 -14.045 -0.815 -10.321 1.00 0.00 H new ATOM 0 HA LYS A 49 -16.892 -0.964 -11.116 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.994 -1.590 -8.621 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -16.153 0.147 -8.448 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -18.517 -0.813 -9.762 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -18.209 -1.859 -8.390 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -18.788 -0.254 -6.904 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -17.776 0.945 -7.684 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -20.674 0.345 -8.089 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -19.845 1.889 -8.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -20.448 1.584 -10.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -18.817 1.109 -10.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -20.043 -0.065 -10.286 1.00 0.00 H new ATOM 787 N TYR A 50 -14.794 1.384 -11.173 1.00 0.00 N ATOM 788 CA TYR A 50 -14.551 2.782 -11.510 1.00 0.00 C ATOM 789 C TYR A 50 -13.672 2.902 -12.750 1.00 0.00 C ATOM 790 O TYR A 50 -14.103 3.422 -13.780 1.00 0.00 O ATOM 791 CB TYR A 50 -13.890 3.505 -10.336 1.00 0.00 C ATOM 792 CG TYR A 50 -14.843 3.836 -9.209 1.00 0.00 C ATOM 793 CD1 TYR A 50 -15.724 4.906 -9.310 1.00 0.00 C ATOM 794 CD2 TYR A 50 -14.859 3.082 -8.043 1.00 0.00 C ATOM 795 CE1 TYR A 50 -16.594 5.212 -8.282 1.00 0.00 C ATOM 796 CE2 TYR A 50 -15.727 3.381 -7.011 1.00 0.00 C ATOM 797 CZ TYR A 50 -16.592 4.447 -7.134 1.00 0.00 C ATOM 798 OH TYR A 50 -17.458 4.747 -6.109 1.00 0.00 O ATOM 0 H TYR A 50 -13.971 0.785 -11.238 1.00 0.00 H new ATOM 0 HA TYR A 50 -15.514 3.247 -11.722 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -13.083 2.884 -9.947 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -13.436 4.427 -10.698 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -15.728 5.508 -10.207 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -14.181 2.247 -7.941 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -17.273 6.047 -8.376 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -15.728 2.782 -6.112 1.00 0.00 H new ATOM 0 HH TYR A 50 -18.368 4.485 -6.362 1.00 0.00 H new ATOM 808 N ASN A 51 -12.436 2.422 -12.640 1.00 0.00 N ATOM 809 CA ASN A 51 -11.484 2.476 -13.744 1.00 0.00 C ATOM 810 C ASN A 51 -10.058 2.309 -13.225 1.00 0.00 C ATOM 811 O ASN A 51 -9.531 3.190 -12.548 1.00 0.00 O ATOM 812 CB ASN A 51 -11.611 3.800 -14.499 1.00 0.00 C ATOM 813 CG ASN A 51 -10.675 3.882 -15.688 1.00 0.00 C ATOM 814 OD1 ASN A 51 -10.049 4.915 -15.931 1.00 0.00 O ATOM 815 ND2 ASN A 51 -10.573 2.792 -16.440 1.00 0.00 N ATOM 0 H ASN A 51 -12.070 1.989 -11.792 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.709 1.659 -14.429 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -12.639 3.923 -14.841 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -11.401 4.625 -13.818 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -9.958 2.790 -17.254 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -11.109 1.957 -16.203 1.00 0.00 H new ATOM 822 N PRO A 52 -9.414 1.169 -13.531 1.00 0.00 N ATOM 823 CA PRO A 52 -8.044 0.894 -13.082 1.00 0.00 C ATOM 824 C PRO A 52 -7.046 1.955 -13.561 1.00 0.00 C ATOM 825 O PRO A 52 -7.306 2.648 -14.545 1.00 0.00 O ATOM 826 CB PRO A 52 -7.723 -0.466 -13.710 1.00 0.00 C ATOM 827 CG PRO A 52 -9.051 -1.082 -13.989 1.00 0.00 C ATOM 828 CD PRO A 52 -9.965 0.058 -14.327 1.00 0.00 C ATOM 0 HA PRO A 52 -7.967 0.903 -11.995 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -7.141 -0.352 -14.624 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.135 -1.085 -13.033 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.988 -1.791 -14.814 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -9.417 -1.633 -13.123 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -9.955 0.281 -15.394 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -10.998 -0.159 -14.057 1.00 0.00 H new ATOM 836 N THR A 53 -5.900 2.086 -12.872 1.00 0.00 N ATOM 837 CA THR A 53 -5.578 1.270 -11.703 1.00 0.00 C ATOM 838 C THR A 53 -5.644 2.107 -10.435 1.00 0.00 C ATOM 839 O THR A 53 -5.218 3.261 -10.419 1.00 0.00 O ATOM 840 CB THR A 53 -4.192 0.644 -11.856 1.00 0.00 C ATOM 841 OG1 THR A 53 -3.981 -0.357 -10.876 1.00 0.00 O ATOM 842 CG2 THR A 53 -3.072 1.649 -11.735 1.00 0.00 C ATOM 0 H THR A 53 -5.175 2.762 -13.114 1.00 0.00 H new ATOM 0 HA THR A 53 -6.314 0.470 -11.627 1.00 0.00 H new ATOM 0 HB THR A 53 -4.174 0.220 -12.860 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.089 -0.746 -10.993 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.114 1.142 -11.853 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.179 2.408 -12.510 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.113 2.124 -10.755 1.00 0.00 H new ATOM 850 N TRP A 54 -6.199 1.528 -9.376 1.00 0.00 N ATOM 851 CA TRP A 54 -6.341 2.238 -8.113 1.00 0.00 C ATOM 852 C TRP A 54 -5.283 1.824 -7.098 1.00 0.00 C ATOM 853 O TRP A 54 -5.193 0.660 -6.710 1.00 0.00 O ATOM 854 CB TRP A 54 -7.734 1.997 -7.533 1.00 0.00 C ATOM 855 CG TRP A 54 -8.829 2.560 -8.381 1.00 0.00 C ATOM 856 CD1 TRP A 54 -9.298 2.050 -9.556 1.00 0.00 C ATOM 857 CD2 TRP A 54 -9.588 3.744 -8.124 1.00 0.00 C ATOM 858 NE1 TRP A 54 -10.304 2.845 -10.046 1.00 0.00 N ATOM 859 CE2 TRP A 54 -10.503 3.892 -9.184 1.00 0.00 C ATOM 860 CE3 TRP A 54 -9.584 4.695 -7.099 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -11.404 4.953 -9.246 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -10.478 5.747 -7.162 1.00 0.00 C ATOM 863 CH2 TRP A 54 -11.378 5.869 -8.228 1.00 0.00 C ATOM 0 H TRP A 54 -6.556 0.573 -9.368 1.00 0.00 H new ATOM 0 HA TRP A 54 -6.203 3.299 -8.319 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -7.890 0.925 -7.413 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -7.788 2.440 -6.539 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -8.931 1.152 -10.031 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -10.820 2.683 -10.911 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -8.894 4.609 -6.272 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -12.098 5.050 -10.068 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -10.483 6.488 -6.376 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -12.065 6.702 -8.248 1.00 0.00 H new ATOM 874 N HIS A 55 -4.506 2.803 -6.651 1.00 0.00 N ATOM 875 CA HIS A 55 -3.471 2.575 -5.654 1.00 0.00 C ATOM 876 C HIS A 55 -3.966 3.089 -4.308 1.00 0.00 C ATOM 877 O HIS A 55 -3.850 4.277 -4.010 1.00 0.00 O ATOM 878 CB HIS A 55 -2.170 3.286 -6.042 1.00 0.00 C ATOM 879 CG HIS A 55 -1.951 3.407 -7.522 1.00 0.00 C ATOM 880 ND1 HIS A 55 -0.851 4.034 -8.066 1.00 0.00 N ATOM 881 CD2 HIS A 55 -2.695 2.981 -8.571 1.00 0.00 C ATOM 882 CE1 HIS A 55 -0.928 3.991 -9.384 1.00 0.00 C ATOM 883 NE2 HIS A 55 -2.037 3.359 -9.716 1.00 0.00 N ATOM 0 H HIS A 55 -4.576 3.770 -6.967 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.262 1.507 -5.593 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -2.170 4.284 -5.604 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.330 2.746 -5.605 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -0.095 4.464 -7.534 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -3.631 2.444 -8.517 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -0.206 4.403 -10.073 1.00 0.00 H new ATOM 892 N CYS A 56 -4.555 2.201 -3.516 1.00 0.00 N ATOM 893 CA CYS A 56 -5.105 2.591 -2.224 1.00 0.00 C ATOM 894 C CYS A 56 -4.342 1.978 -1.057 1.00 0.00 C ATOM 895 O CYS A 56 -3.621 0.993 -1.211 1.00 0.00 O ATOM 896 CB CYS A 56 -6.574 2.179 -2.144 1.00 0.00 C ATOM 897 SG CYS A 56 -6.930 0.568 -2.880 1.00 0.00 S ATOM 0 H CYS A 56 -4.664 1.213 -3.744 1.00 0.00 H new ATOM 0 HA CYS A 56 -5.009 3.674 -2.146 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -6.879 2.164 -1.098 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -7.180 2.936 -2.642 1.00 0.00 H new ATOM 0 HG CYS A 56 -6.852 -0.353 -1.966 1.00 0.00 H new ATOM 903 N ILE A 57 -4.533 2.572 0.117 1.00 0.00 N ATOM 904 CA ILE A 57 -3.895 2.102 1.344 1.00 0.00 C ATOM 905 C ILE A 57 -4.916 2.049 2.477 1.00 0.00 C ATOM 906 O ILE A 57 -5.954 2.708 2.416 1.00 0.00 O ATOM 907 CB ILE A 57 -2.724 3.017 1.762 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.803 3.283 0.569 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.943 2.396 2.915 1.00 0.00 C ATOM 910 CD1 ILE A 57 -1.353 2.029 -0.147 1.00 0.00 C ATOM 0 H ILE A 57 -5.131 3.388 0.245 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.501 1.105 1.148 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.133 3.969 2.101 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -2.320 3.929 -0.140 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -0.924 3.828 0.915 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.122 3.056 3.195 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.605 2.257 3.770 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -1.543 1.430 2.605 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.704 2.299 -0.980 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.807 1.390 0.547 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.224 1.493 -0.524 1.00 0.00 H new ATOM 922 N VAL A 58 -4.628 1.263 3.508 1.00 0.00 N ATOM 923 CA VAL A 58 -5.540 1.136 4.640 1.00 0.00 C ATOM 924 C VAL A 58 -4.813 0.662 5.894 1.00 0.00 C ATOM 925 O VAL A 58 -4.422 -0.500 5.996 1.00 0.00 O ATOM 926 CB VAL A 58 -6.689 0.164 4.323 1.00 0.00 C ATOM 927 CG1 VAL A 58 -6.139 -1.167 3.843 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.585 -0.024 5.537 1.00 0.00 C ATOM 0 H VAL A 58 -3.776 0.707 3.584 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.951 2.128 4.825 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.293 0.592 3.523 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.965 -1.844 3.623 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.547 -1.012 2.941 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.510 -1.602 4.620 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.391 -0.715 5.291 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.999 -0.429 6.362 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.008 0.937 5.829 1.00 0.00 H new ATOM 938 N GLY A 59 -4.640 1.574 6.848 1.00 0.00 N ATOM 939 CA GLY A 59 -3.965 1.240 8.088 1.00 0.00 C ATOM 940 C GLY A 59 -4.572 1.950 9.279 1.00 0.00 C ATOM 941 O GLY A 59 -5.753 2.294 9.265 1.00 0.00 O ATOM 0 H GLY A 59 -4.957 2.541 6.782 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.012 0.163 8.247 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.911 1.504 8.008 1.00 0.00 H new ATOM 945 N ARG A 60 -3.773 2.166 10.319 1.00 0.00 N ATOM 946 CA ARG A 60 -4.261 2.832 11.513 1.00 0.00 C ATOM 947 C ARG A 60 -3.121 3.349 12.384 1.00 0.00 C ATOM 948 O ARG A 60 -3.265 3.458 13.602 1.00 0.00 O ATOM 949 CB ARG A 60 -5.122 1.869 12.317 1.00 0.00 C ATOM 950 CG ARG A 60 -4.575 0.451 12.360 1.00 0.00 C ATOM 951 CD ARG A 60 -5.602 -0.527 12.908 1.00 0.00 C ATOM 952 NE ARG A 60 -5.083 -1.287 14.041 1.00 0.00 N ATOM 953 CZ ARG A 60 -5.790 -2.197 14.705 1.00 0.00 C ATOM 954 NH1 ARG A 60 -7.038 -2.462 14.344 1.00 0.00 N ATOM 955 NH2 ARG A 60 -5.249 -2.842 15.729 1.00 0.00 N ATOM 0 H ARG A 60 -2.792 1.890 10.356 1.00 0.00 H new ATOM 0 HA ARG A 60 -4.852 3.691 11.197 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -5.216 2.244 13.336 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -6.125 1.849 11.891 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.278 0.144 11.357 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.679 0.424 12.980 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.494 0.019 13.216 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.905 -1.215 12.118 1.00 0.00 H new ATOM 0 HE ARG A 60 -4.124 -1.110 14.340 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -7.457 -1.968 13.556 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -7.579 -3.160 14.854 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -4.289 -2.641 16.009 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -5.793 -3.540 16.237 1.00 0.00 H new ATOM 969 N ASN A 61 -1.990 3.672 11.765 1.00 0.00 N ATOM 970 CA ASN A 61 -0.845 4.180 12.513 1.00 0.00 C ATOM 971 C ASN A 61 0.415 4.201 11.657 1.00 0.00 C ATOM 972 O ASN A 61 1.528 4.114 12.176 1.00 0.00 O ATOM 973 CB ASN A 61 -0.611 3.333 13.764 1.00 0.00 C ATOM 974 CG ASN A 61 0.055 4.119 14.878 1.00 0.00 C ATOM 975 OD1 ASN A 61 -0.294 5.270 15.135 1.00 0.00 O ATOM 976 ND2 ASN A 61 1.019 3.497 15.546 1.00 0.00 N ATOM 0 H ASN A 61 -1.842 3.593 10.759 1.00 0.00 H new ATOM 0 HA ASN A 61 -1.070 5.205 12.809 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.565 2.942 14.119 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.010 2.474 13.507 1.00 0.00 H new ATOM 0 HD21 ASN A 61 1.503 3.975 16.307 1.00 0.00 H new ATOM 0 HD22 ASN A 61 1.276 2.541 15.299 1.00 0.00 H new ATOM 983 N PHE A 62 0.236 4.322 10.349 1.00 0.00 N ATOM 984 CA PHE A 62 1.367 4.360 9.430 1.00 0.00 C ATOM 985 C PHE A 62 1.710 5.796 9.045 1.00 0.00 C ATOM 986 O PHE A 62 1.384 6.738 9.767 1.00 0.00 O ATOM 987 CB PHE A 62 1.064 3.537 8.178 1.00 0.00 C ATOM 988 CG PHE A 62 0.042 4.167 7.279 1.00 0.00 C ATOM 989 CD1 PHE A 62 -1.127 4.695 7.800 1.00 0.00 C ATOM 990 CD2 PHE A 62 0.252 4.230 5.914 1.00 0.00 C ATOM 991 CE1 PHE A 62 -2.069 5.275 6.973 1.00 0.00 C ATOM 992 CE2 PHE A 62 -0.684 4.809 5.079 1.00 0.00 C ATOM 993 CZ PHE A 62 -1.848 5.333 5.610 1.00 0.00 C ATOM 0 H PHE A 62 -0.677 4.395 9.901 1.00 0.00 H new ATOM 0 HA PHE A 62 2.229 3.927 9.937 1.00 0.00 H new ATOM 0 HB2 PHE A 62 1.987 3.390 7.618 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.713 2.550 8.478 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -1.304 4.653 8.865 1.00 0.00 H new ATOM 0 HD2 PHE A 62 1.160 3.821 5.495 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -2.977 5.683 7.391 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -0.507 4.852 4.014 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.583 5.787 4.961 1.00 0.00 H new ATOM 1003 N GLY A 63 2.371 5.956 7.903 1.00 0.00 N ATOM 1004 CA GLY A 63 2.751 7.279 7.441 1.00 0.00 C ATOM 1005 C GLY A 63 2.920 7.331 5.937 1.00 0.00 C ATOM 1006 O GLY A 63 4.037 7.251 5.427 1.00 0.00 O ATOM 0 H GLY A 63 2.651 5.192 7.288 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.993 8.000 7.745 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.684 7.576 7.921 1.00 0.00 H new ATOM 1010 N SER A 64 1.806 7.459 5.226 1.00 0.00 N ATOM 1011 CA SER A 64 1.829 7.511 3.770 1.00 0.00 C ATOM 1012 C SER A 64 2.516 8.778 3.271 1.00 0.00 C ATOM 1013 O SER A 64 2.661 9.753 4.008 1.00 0.00 O ATOM 1014 CB SER A 64 0.408 7.433 3.211 1.00 0.00 C ATOM 1015 OG SER A 64 -0.311 8.626 3.475 1.00 0.00 O ATOM 0 H SER A 64 0.874 7.529 5.635 1.00 0.00 H new ATOM 0 HA SER A 64 2.400 6.652 3.416 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.446 7.258 2.136 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.114 6.585 3.654 1.00 0.00 H new ATOM 0 HG SER A 64 -1.273 8.444 3.435 1.00 0.00 H new ATOM 1021 N TYR A 65 2.936 8.752 2.010 1.00 0.00 N ATOM 1022 CA TYR A 65 3.609 9.889 1.397 1.00 0.00 C ATOM 1023 C TYR A 65 3.706 9.701 -0.113 1.00 0.00 C ATOM 1024 O TYR A 65 4.758 9.926 -0.713 1.00 0.00 O ATOM 1025 CB TYR A 65 5.006 10.064 1.997 1.00 0.00 C ATOM 1026 CG TYR A 65 5.703 11.336 1.571 1.00 0.00 C ATOM 1027 CD1 TYR A 65 5.342 12.565 2.109 1.00 0.00 C ATOM 1028 CD2 TYR A 65 6.728 11.307 0.633 1.00 0.00 C ATOM 1029 CE1 TYR A 65 5.981 13.729 1.724 1.00 0.00 C ATOM 1030 CE2 TYR A 65 7.373 12.466 0.244 1.00 0.00 C ATOM 1031 CZ TYR A 65 6.995 13.673 0.792 1.00 0.00 C ATOM 1032 OH TYR A 65 7.635 14.829 0.407 1.00 0.00 O ATOM 0 H TYR A 65 2.820 7.950 1.390 1.00 0.00 H new ATOM 0 HA TYR A 65 3.024 10.787 1.599 1.00 0.00 H new ATOM 0 HB2 TYR A 65 4.928 10.051 3.084 1.00 0.00 H new ATOM 0 HB3 TYR A 65 5.622 9.211 1.712 1.00 0.00 H new ATOM 0 HD1 TYR A 65 4.549 12.612 2.840 1.00 0.00 H new ATOM 0 HD2 TYR A 65 7.026 10.363 0.201 1.00 0.00 H new ATOM 0 HE1 TYR A 65 5.687 14.677 2.151 1.00 0.00 H new ATOM 0 HE2 TYR A 65 8.169 12.426 -0.485 1.00 0.00 H new ATOM 0 HH TYR A 65 8.590 14.760 0.618 1.00 0.00 H new ATOM 1042 N VAL A 66 2.600 9.281 -0.720 1.00 0.00 N ATOM 1043 CA VAL A 66 2.556 9.057 -2.160 1.00 0.00 C ATOM 1044 C VAL A 66 1.958 10.263 -2.880 1.00 0.00 C ATOM 1045 O VAL A 66 1.158 11.004 -2.309 1.00 0.00 O ATOM 1046 CB VAL A 66 1.738 7.797 -2.510 1.00 0.00 C ATOM 1047 CG1 VAL A 66 2.131 6.638 -1.607 1.00 0.00 C ATOM 1048 CG2 VAL A 66 0.244 8.072 -2.407 1.00 0.00 C ATOM 0 H VAL A 66 1.723 9.089 -0.236 1.00 0.00 H new ATOM 0 HA VAL A 66 3.584 8.911 -2.493 1.00 0.00 H new ATOM 0 HB VAL A 66 1.961 7.524 -3.541 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.544 5.758 -1.868 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.191 6.419 -1.737 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.941 6.906 -0.568 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.311 7.168 -2.659 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.001 8.376 -1.389 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.028 8.869 -3.099 1.00 0.00 H new ATOM 1058 N THR A 67 2.353 10.457 -4.133 1.00 0.00 N ATOM 1059 CA THR A 67 1.856 11.577 -4.922 1.00 0.00 C ATOM 1060 C THR A 67 0.694 11.145 -5.814 1.00 0.00 C ATOM 1061 O THR A 67 0.643 10.005 -6.276 1.00 0.00 O ATOM 1062 CB THR A 67 2.985 12.176 -5.767 1.00 0.00 C ATOM 1063 OG1 THR A 67 2.758 13.555 -5.997 1.00 0.00 O ATOM 1064 CG2 THR A 67 3.153 11.510 -7.115 1.00 0.00 C ATOM 0 H THR A 67 3.014 9.855 -4.623 1.00 0.00 H new ATOM 0 HA THR A 67 1.490 12.340 -4.235 1.00 0.00 H new ATOM 0 HB THR A 67 3.893 12.011 -5.187 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.489 13.921 -6.537 1.00 0.00 H new ATOM 0 HG21 THR A 67 3.970 11.986 -7.657 1.00 0.00 H new ATOM 0 HG22 THR A 67 3.379 10.453 -6.973 1.00 0.00 H new ATOM 0 HG23 THR A 67 2.231 11.610 -7.688 1.00 0.00 H new ATOM 1072 N HIS A 68 -0.234 12.066 -6.054 1.00 0.00 N ATOM 1073 CA HIS A 68 -1.392 11.783 -6.892 1.00 0.00 C ATOM 1074 C HIS A 68 -1.164 12.286 -8.314 1.00 0.00 C ATOM 1075 O HIS A 68 -0.201 13.005 -8.581 1.00 0.00 O ATOM 1076 CB HIS A 68 -2.649 12.424 -6.299 1.00 0.00 C ATOM 1077 CG HIS A 68 -2.798 13.876 -6.634 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -1.758 14.652 -7.101 1.00 0.00 N ATOM 1079 CD2 HIS A 68 -3.875 14.695 -6.570 1.00 0.00 C ATOM 1080 CE1 HIS A 68 -2.186 15.883 -7.308 1.00 0.00 C ATOM 1081 NE2 HIS A 68 -3.468 15.936 -6.995 1.00 0.00 N ATOM 0 H HIS A 68 -0.206 13.014 -5.680 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.533 10.703 -6.927 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.526 11.885 -6.659 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.628 12.310 -5.215 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -0.805 14.325 -7.262 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -4.868 14.423 -6.245 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -1.590 16.707 -7.671 1.00 0.00 H new ATOM 1090 N GLU A 69 -2.054 11.905 -9.224 1.00 0.00 N ATOM 1091 CA GLU A 69 -1.945 12.320 -10.617 1.00 0.00 C ATOM 1092 C GLU A 69 -3.202 11.954 -11.399 1.00 0.00 C ATOM 1093 O GLU A 69 -3.177 11.068 -12.253 1.00 0.00 O ATOM 1094 CB GLU A 69 -0.722 11.671 -11.269 1.00 0.00 C ATOM 1095 CG GLU A 69 -0.357 10.322 -10.671 1.00 0.00 C ATOM 1096 CD GLU A 69 0.987 9.814 -11.153 1.00 0.00 C ATOM 1097 OE1 GLU A 69 1.155 9.655 -12.380 1.00 0.00 O ATOM 1098 OE2 GLU A 69 1.871 9.576 -10.304 1.00 0.00 O ATOM 0 H GLU A 69 -2.858 11.310 -9.022 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.831 13.404 -10.636 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.912 11.547 -12.335 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.130 12.344 -11.173 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -0.342 10.403 -9.584 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -1.128 9.595 -10.926 1.00 0.00 H new ATOM 1105 N THR A 70 -4.302 12.641 -11.105 1.00 0.00 N ATOM 1106 CA THR A 70 -5.563 12.383 -11.789 1.00 0.00 C ATOM 1107 C THR A 70 -6.730 13.062 -11.073 1.00 0.00 C ATOM 1108 O THR A 70 -6.841 14.289 -11.072 1.00 0.00 O ATOM 1109 CB THR A 70 -5.813 10.877 -11.886 1.00 0.00 C ATOM 1110 OG1 THR A 70 -5.007 10.174 -10.955 1.00 0.00 O ATOM 1111 CG2 THR A 70 -5.528 10.309 -13.260 1.00 0.00 C ATOM 0 H THR A 70 -4.345 13.377 -10.401 1.00 0.00 H new ATOM 0 HA THR A 70 -5.492 12.800 -12.793 1.00 0.00 H new ATOM 0 HB THR A 70 -6.873 10.746 -11.670 1.00 0.00 H new ATOM 0 HG1 THR A 70 -4.168 9.908 -11.385 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.726 9.237 -13.259 1.00 0.00 H new ATOM 0 HG22 THR A 70 -6.169 10.796 -13.995 1.00 0.00 H new ATOM 0 HG23 THR A 70 -4.483 10.485 -13.517 1.00 0.00 H new ATOM 1119 N LYS A 71 -7.598 12.256 -10.469 1.00 0.00 N ATOM 1120 CA LYS A 71 -8.759 12.772 -9.755 1.00 0.00 C ATOM 1121 C LYS A 71 -9.323 11.717 -8.813 1.00 0.00 C ATOM 1122 O LYS A 71 -10.372 11.913 -8.198 1.00 0.00 O ATOM 1123 CB LYS A 71 -9.837 13.217 -10.745 1.00 0.00 C ATOM 1124 CG LYS A 71 -10.095 12.209 -11.854 1.00 0.00 C ATOM 1125 CD LYS A 71 -11.111 12.731 -12.857 1.00 0.00 C ATOM 1126 CE LYS A 71 -11.420 11.694 -13.924 1.00 0.00 C ATOM 1127 NZ LYS A 71 -10.285 11.520 -14.871 1.00 0.00 N ATOM 0 H LYS A 71 -7.518 11.239 -10.461 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.442 13.632 -9.165 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -10.766 13.395 -10.203 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -9.541 14.167 -11.190 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -9.160 11.983 -12.366 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -10.455 11.276 -11.422 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -12.029 13.006 -12.338 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -10.728 13.636 -13.328 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -11.646 10.740 -13.449 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -12.311 11.994 -14.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.547 10.830 -15.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.063 12.432 -15.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.451 11.176 -14.354 1.00 0.00 H new ATOM 1141 N HIS A 72 -8.618 10.595 -8.704 1.00 0.00 N ATOM 1142 CA HIS A 72 -9.047 9.506 -7.837 1.00 0.00 C ATOM 1143 C HIS A 72 -8.026 9.255 -6.730 1.00 0.00 C ATOM 1144 O HIS A 72 -7.446 8.173 -6.643 1.00 0.00 O ATOM 1145 CB HIS A 72 -9.254 8.230 -8.652 1.00 0.00 C ATOM 1146 CG HIS A 72 -9.633 8.482 -10.080 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -10.935 8.442 -10.533 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -8.870 8.776 -11.160 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -10.956 8.698 -11.829 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -9.717 8.905 -12.232 1.00 0.00 N ATOM 0 H HIS A 72 -7.748 10.417 -9.206 1.00 0.00 H new ATOM 0 HA HIS A 72 -9.992 9.793 -7.376 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -8.337 7.641 -8.627 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -10.032 7.630 -8.179 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -7.796 8.888 -11.175 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -11.837 8.732 -12.452 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -9.434 9.125 -13.187 1.00 0.00 H new ATOM 1159 N PHE A 73 -7.809 10.261 -5.885 1.00 0.00 N ATOM 1160 CA PHE A 73 -6.855 10.145 -4.786 1.00 0.00 C ATOM 1161 C PHE A 73 -7.460 10.671 -3.487 1.00 0.00 C ATOM 1162 O PHE A 73 -7.413 11.868 -3.214 1.00 0.00 O ATOM 1163 CB PHE A 73 -5.569 10.911 -5.123 1.00 0.00 C ATOM 1164 CG PHE A 73 -4.769 11.331 -3.921 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -4.316 10.393 -3.008 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -4.472 12.668 -3.705 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -3.580 10.779 -1.903 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -3.737 13.059 -2.602 1.00 0.00 C ATOM 1169 CZ PHE A 73 -3.291 12.114 -1.700 1.00 0.00 C ATOM 0 H PHE A 73 -8.280 11.164 -5.941 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.613 9.091 -4.647 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.944 10.286 -5.761 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.829 11.798 -5.701 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -4.540 9.348 -3.161 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -4.819 13.412 -4.407 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -3.232 10.037 -1.199 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -3.512 14.104 -2.446 1.00 0.00 H new ATOM 0 HZ PHE A 73 -2.717 12.418 -0.837 1.00 0.00 H new ATOM 1179 N ILE A 74 -8.025 9.769 -2.691 1.00 0.00 N ATOM 1180 CA ILE A 74 -8.636 10.153 -1.424 1.00 0.00 C ATOM 1181 C ILE A 74 -7.820 9.646 -0.239 1.00 0.00 C ATOM 1182 O ILE A 74 -7.401 8.490 -0.211 1.00 0.00 O ATOM 1183 CB ILE A 74 -10.077 9.617 -1.302 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -10.825 10.373 -0.193 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -10.059 8.116 -1.034 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -12.113 9.715 0.261 1.00 0.00 C ATOM 0 H ILE A 74 -8.072 8.772 -2.900 1.00 0.00 H new ATOM 0 HA ILE A 74 -8.659 11.243 -1.409 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.604 9.783 -2.241 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.163 10.478 0.667 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -11.051 11.379 -0.546 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -11.082 7.749 -0.950 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.557 7.606 -1.856 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.525 7.919 -0.104 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -12.573 10.317 1.045 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -12.798 9.634 -0.583 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -11.896 8.720 0.648 1.00 0.00 H new ATOM 1198 N TYR A 75 -7.613 10.515 0.742 1.00 0.00 N ATOM 1199 CA TYR A 75 -6.863 10.153 1.937 1.00 0.00 C ATOM 1200 C TYR A 75 -7.672 10.480 3.186 1.00 0.00 C ATOM 1201 O TYR A 75 -7.576 11.579 3.731 1.00 0.00 O ATOM 1202 CB TYR A 75 -5.520 10.881 1.976 1.00 0.00 C ATOM 1203 CG TYR A 75 -4.527 10.266 2.937 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -4.470 8.889 3.118 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -3.649 11.060 3.664 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -3.566 8.322 3.996 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -2.742 10.500 4.544 1.00 0.00 C ATOM 1208 CZ TYR A 75 -2.705 9.131 4.706 1.00 0.00 C ATOM 1209 OH TYR A 75 -1.804 8.569 5.582 1.00 0.00 O ATOM 0 H TYR A 75 -7.954 11.476 0.733 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.672 9.080 1.909 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -5.089 10.886 0.975 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -5.688 11.921 2.256 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -5.143 8.252 2.563 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -3.676 12.132 3.540 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.534 7.250 4.125 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -2.066 11.131 5.102 1.00 0.00 H new ATOM 0 HH TYR A 75 -0.910 8.574 5.180 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.481 9.522 3.621 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.323 9.708 4.797 1.00 0.00 C ATOM 1221 C PHE A 76 -8.915 8.769 5.926 1.00 0.00 C ATOM 1222 O PHE A 76 -8.053 7.908 5.753 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.791 9.472 4.437 1.00 0.00 C ATOM 1224 CG PHE A 76 -11.025 8.185 3.696 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -10.573 8.026 2.396 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -11.696 7.134 4.301 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -10.785 6.844 1.713 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -11.911 5.950 3.623 1.00 0.00 C ATOM 1229 CZ PHE A 76 -11.455 5.805 2.327 1.00 0.00 C ATOM 0 H PHE A 76 -8.572 8.608 3.177 1.00 0.00 H new ATOM 0 HA PHE A 76 -9.192 10.734 5.141 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.386 9.470 5.351 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.146 10.303 3.828 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.049 8.836 1.911 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -12.055 7.242 5.314 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.427 6.733 0.700 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.435 5.138 4.106 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.622 4.880 1.795 1.00 0.00 H new ATOM 1239 N TYR A 77 -9.547 8.942 7.083 1.00 0.00 N ATOM 1240 CA TYR A 77 -9.261 8.113 8.245 1.00 0.00 C ATOM 1241 C TYR A 77 -10.551 7.574 8.855 1.00 0.00 C ATOM 1242 O TYR A 77 -11.291 8.305 9.513 1.00 0.00 O ATOM 1243 CB TYR A 77 -8.482 8.914 9.291 1.00 0.00 C ATOM 1244 CG TYR A 77 -8.451 8.259 10.653 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -9.439 8.521 11.593 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -7.434 7.378 10.998 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -9.415 7.923 12.839 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -7.403 6.776 12.241 1.00 0.00 C ATOM 1249 CZ TYR A 77 -8.396 7.052 13.157 1.00 0.00 C ATOM 1250 OH TYR A 77 -8.368 6.454 14.396 1.00 0.00 O ATOM 0 H TYR A 77 -10.263 9.652 7.239 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.653 7.269 7.920 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.459 9.055 8.941 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.927 9.905 9.383 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -10.239 9.203 11.347 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.655 7.160 10.283 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -10.191 8.137 13.559 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -6.605 6.093 12.494 1.00 0.00 H new ATOM 0 HH TYR A 77 -7.585 5.868 14.459 1.00 0.00 H new ATOM 1260 N LEU A 78 -10.813 6.291 8.631 1.00 0.00 N ATOM 1261 CA LEU A 78 -12.011 5.648 9.157 1.00 0.00 C ATOM 1262 C LEU A 78 -12.104 5.824 10.669 1.00 0.00 C ATOM 1263 O LEU A 78 -11.122 6.173 11.325 1.00 0.00 O ATOM 1264 CB LEU A 78 -12.006 4.158 8.798 1.00 0.00 C ATOM 1265 CG LEU A 78 -12.565 3.806 7.412 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -14.080 3.690 7.462 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -12.140 4.832 6.367 1.00 0.00 C ATOM 0 H LEU A 78 -10.210 5.674 8.087 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.882 6.122 8.705 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.981 3.791 8.860 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.583 3.620 9.550 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.152 2.841 7.119 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.459 3.440 6.471 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.362 2.907 8.166 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.507 4.639 7.785 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.552 4.555 5.396 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.512 5.816 6.651 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -11.052 4.859 6.305 1.00 0.00 H new ATOM 1279 N GLY A 79 -13.291 5.579 11.217 1.00 0.00 N ATOM 1280 CA GLY A 79 -13.491 5.716 12.648 1.00 0.00 C ATOM 1281 C GLY A 79 -12.238 5.398 13.442 1.00 0.00 C ATOM 1282 O GLY A 79 -11.855 6.152 14.338 1.00 0.00 O ATOM 0 H GLY A 79 -14.118 5.288 10.695 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -13.810 6.734 12.871 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.296 5.053 12.964 1.00 0.00 H new ATOM 1286 N GLN A 80 -11.599 4.282 13.111 1.00 0.00 N ATOM 1287 CA GLN A 80 -10.382 3.865 13.798 1.00 0.00 C ATOM 1288 C GLN A 80 -9.368 3.303 12.806 1.00 0.00 C ATOM 1289 O GLN A 80 -8.454 2.570 13.184 1.00 0.00 O ATOM 1290 CB GLN A 80 -10.704 2.820 14.867 1.00 0.00 C ATOM 1291 CG GLN A 80 -10.264 3.226 16.262 1.00 0.00 C ATOM 1292 CD GLN A 80 -9.486 2.133 16.969 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -9.890 0.971 16.974 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -8.364 2.504 17.573 1.00 0.00 N ATOM 0 H GLN A 80 -11.903 3.649 12.371 1.00 0.00 H new ATOM 0 HA GLN A 80 -9.947 4.740 14.281 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -11.778 2.636 14.872 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.221 1.879 14.602 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -9.647 4.123 16.198 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -11.141 3.484 16.855 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -8.067 3.479 17.543 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -7.799 1.814 18.067 1.00 0.00 H new ATOM 1303 N VAL A 81 -9.543 3.651 11.536 1.00 0.00 N ATOM 1304 CA VAL A 81 -8.652 3.184 10.479 1.00 0.00 C ATOM 1305 C VAL A 81 -8.356 4.306 9.488 1.00 0.00 C ATOM 1306 O VAL A 81 -8.884 5.409 9.613 1.00 0.00 O ATOM 1307 CB VAL A 81 -9.269 1.987 9.728 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -8.280 1.402 8.733 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -9.732 0.925 10.715 1.00 0.00 C ATOM 0 H VAL A 81 -10.297 4.257 11.212 1.00 0.00 H new ATOM 0 HA VAL A 81 -7.721 2.866 10.949 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.135 2.342 9.170 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -8.739 0.559 8.216 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -8.001 2.165 8.006 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.390 1.062 9.262 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -10.165 0.086 10.170 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.881 0.577 11.300 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -10.482 1.350 11.382 1.00 0.00 H new ATOM 1319 N ALA A 82 -7.511 4.019 8.506 1.00 0.00 N ATOM 1320 CA ALA A 82 -7.153 5.005 7.497 1.00 0.00 C ATOM 1321 C ALA A 82 -7.113 4.366 6.116 1.00 0.00 C ATOM 1322 O ALA A 82 -6.842 3.173 5.982 1.00 0.00 O ATOM 1323 CB ALA A 82 -5.816 5.649 7.829 1.00 0.00 C ATOM 0 H ALA A 82 -7.061 3.111 8.388 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.915 5.784 7.492 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.566 6.383 7.063 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.881 6.143 8.798 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -5.042 4.883 7.864 1.00 0.00 H new ATOM 1329 N ILE A 83 -7.389 5.162 5.092 1.00 0.00 N ATOM 1330 CA ILE A 83 -7.389 4.665 3.723 1.00 0.00 C ATOM 1331 C ILE A 83 -6.811 5.699 2.766 1.00 0.00 C ATOM 1332 O ILE A 83 -7.306 6.825 2.674 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.808 4.282 3.258 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -9.722 4.045 4.464 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.760 3.044 2.375 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.377 2.796 5.247 1.00 0.00 C ATOM 0 H ILE A 83 -7.615 6.152 5.183 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.763 3.772 3.712 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.215 5.108 2.675 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.665 4.908 5.128 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -10.754 3.975 4.120 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.769 2.786 2.055 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.142 3.245 1.500 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.334 2.213 2.937 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.065 2.691 6.086 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.461 1.925 4.598 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.356 2.872 5.622 1.00 0.00 H new ATOM 1348 N LEU A 84 -5.758 5.308 2.057 1.00 0.00 N ATOM 1349 CA LEU A 84 -5.099 6.192 1.106 1.00 0.00 C ATOM 1350 C LEU A 84 -5.356 5.732 -0.326 1.00 0.00 C ATOM 1351 O LEU A 84 -4.549 5.008 -0.909 1.00 0.00 O ATOM 1352 CB LEU A 84 -3.596 6.234 1.384 1.00 0.00 C ATOM 1353 CG LEU A 84 -2.751 6.885 0.291 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -2.628 8.379 0.534 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -1.375 6.239 0.230 1.00 0.00 C ATOM 0 H LEU A 84 -5.342 4.379 2.124 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.511 7.194 1.224 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.430 6.771 2.318 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.242 5.214 1.536 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.247 6.733 -0.668 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.023 8.827 -0.254 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.620 8.831 0.531 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -2.153 8.553 1.500 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.785 6.714 -0.554 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.872 6.363 1.189 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.481 5.177 0.011 1.00 0.00 H new ATOM 1367 N LEU A 85 -6.484 6.156 -0.883 1.00 0.00 N ATOM 1368 CA LEU A 85 -6.851 5.788 -2.246 1.00 0.00 C ATOM 1369 C LEU A 85 -6.269 6.770 -3.253 1.00 0.00 C ATOM 1370 O LEU A 85 -6.288 7.982 -3.037 1.00 0.00 O ATOM 1371 CB LEU A 85 -8.373 5.738 -2.394 1.00 0.00 C ATOM 1372 CG LEU A 85 -8.934 4.381 -2.820 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -9.152 3.497 -1.606 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -10.233 4.555 -3.592 1.00 0.00 C ATOM 0 H LEU A 85 -7.161 6.756 -0.412 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.438 4.799 -2.447 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.825 6.020 -1.443 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.677 6.486 -3.126 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.209 3.899 -3.476 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.552 2.534 -1.924 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -8.203 3.344 -1.092 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.858 3.977 -0.929 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.615 3.577 -3.886 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.967 5.057 -2.961 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -10.049 5.155 -4.483 1.00 0.00 H new ATOM 1386 N PHE A 86 -5.755 6.240 -4.357 1.00 0.00 N ATOM 1387 CA PHE A 86 -5.170 7.078 -5.401 1.00 0.00 C ATOM 1388 C PHE A 86 -4.665 6.236 -6.574 1.00 0.00 C ATOM 1389 O PHE A 86 -3.960 5.247 -6.380 1.00 0.00 O ATOM 1390 CB PHE A 86 -4.033 7.931 -4.819 1.00 0.00 C ATOM 1391 CG PHE A 86 -2.666 7.321 -4.967 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -2.192 6.411 -4.035 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -1.857 7.659 -6.040 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -0.937 5.848 -4.172 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -0.601 7.101 -6.182 1.00 0.00 C ATOM 1396 CZ PHE A 86 -0.140 6.195 -5.247 1.00 0.00 C ATOM 0 H PHE A 86 -5.731 5.239 -4.553 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.949 7.739 -5.781 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -4.038 8.905 -5.307 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -4.229 8.104 -3.761 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.810 6.139 -3.192 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -2.212 8.367 -6.774 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.580 5.138 -3.441 1.00 0.00 H new ATOM 0 HE2 PHE A 86 0.020 7.373 -7.023 1.00 0.00 H new ATOM 0 HZ PHE A 86 0.842 5.758 -5.356 1.00 0.00 H new ATOM 1406 N LYS A 87 -5.024 6.644 -7.790 1.00 0.00 N ATOM 1407 CA LYS A 87 -4.605 5.934 -8.995 1.00 0.00 C ATOM 1408 C LYS A 87 -3.462 6.668 -9.685 1.00 0.00 C ATOM 1409 O LYS A 87 -2.748 7.454 -9.061 1.00 0.00 O ATOM 1410 CB LYS A 87 -5.780 5.787 -9.960 1.00 0.00 C ATOM 1411 CG LYS A 87 -7.013 5.169 -9.326 1.00 0.00 C ATOM 1412 CD LYS A 87 -8.285 5.757 -9.910 1.00 0.00 C ATOM 1413 CE LYS A 87 -8.502 5.306 -11.346 1.00 0.00 C ATOM 1414 NZ LYS A 87 -8.133 6.366 -12.322 1.00 0.00 N ATOM 0 H LYS A 87 -5.605 7.464 -7.966 1.00 0.00 H new ATOM 0 HA LYS A 87 -4.257 4.944 -8.701 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -6.039 6.769 -10.356 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.470 5.173 -10.806 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.003 4.090 -9.482 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -6.993 5.336 -8.249 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.138 5.457 -9.301 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -8.234 6.845 -9.874 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.909 4.412 -11.539 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -9.547 5.031 -11.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -7.756 5.926 -13.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -8.975 6.928 -12.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.409 6.985 -11.905 1.00 0.00 H new ATOM 1428 N SER A 88 -3.299 6.411 -10.976 1.00 0.00 N ATOM 1429 CA SER A 88 -2.246 7.049 -11.758 1.00 0.00 C ATOM 1430 C SER A 88 -2.608 7.058 -13.234 1.00 0.00 C ATOM 1431 O SER A 88 -1.747 7.192 -14.103 1.00 0.00 O ATOM 1432 CB SER A 88 -0.920 6.325 -11.551 1.00 0.00 C ATOM 1433 OG SER A 88 0.039 7.174 -10.946 1.00 0.00 O ATOM 0 H SER A 88 -3.883 5.764 -11.506 1.00 0.00 H new ATOM 0 HA SER A 88 -2.143 8.079 -11.418 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.077 5.446 -10.926 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.542 5.971 -12.510 1.00 0.00 H new ATOM 0 HG SER A 88 0.827 6.649 -10.694 1.00 0.00 H new ATOM 1439 N GLY A 89 -3.894 6.912 -13.499 1.00 0.00 N ATOM 1440 CA GLY A 89 -4.382 6.901 -14.865 1.00 0.00 C ATOM 1441 C GLY A 89 -4.776 5.512 -15.328 1.00 0.00 C ATOM 1442 O GLY A 89 -3.890 4.632 -15.385 1.00 0.00 O ATOM 1443 OXT GLY A 89 -5.968 5.302 -15.631 1.00 0.00 O ATOM 0 H GLY A 89 -4.617 6.800 -12.788 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.242 7.565 -14.946 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -3.611 7.296 -15.526 1.00 0.00 H new TER 1447 GLY A 89 ATOM 1448 N MET B 1 26.550 3.474 11.532 1.00 0.00 N ATOM 1449 CA MET B 1 26.629 3.709 10.067 1.00 0.00 C ATOM 1450 C MET B 1 25.264 3.539 9.408 1.00 0.00 C ATOM 1451 O MET B 1 24.228 3.733 10.044 1.00 0.00 O ATOM 1452 CB MET B 1 27.634 2.722 9.469 1.00 0.00 C ATOM 1453 CG MET B 1 28.936 3.370 9.029 1.00 0.00 C ATOM 1454 SD MET B 1 29.853 2.357 7.853 1.00 0.00 S ATOM 1455 CE MET B 1 31.537 2.690 8.362 1.00 0.00 C ATOM 0 H1 MET B 1 27.492 3.596 11.955 1.00 0.00 H new ATOM 0 H2 MET B 1 25.889 4.155 11.958 1.00 0.00 H new ATOM 0 H3 MET B 1 26.213 2.506 11.711 1.00 0.00 H new ATOM 0 HA MET B 1 26.955 4.733 9.884 1.00 0.00 H new ATOM 0 HB2 MET B 1 27.853 1.949 10.206 1.00 0.00 H new ATOM 0 HB3 MET B 1 27.177 2.226 8.613 1.00 0.00 H new ATOM 0 HG2 MET B 1 28.721 4.339 8.578 1.00 0.00 H new ATOM 0 HG3 MET B 1 29.558 3.557 9.904 1.00 0.00 H new ATOM 0 HE1 MET B 1 32.226 2.133 7.727 1.00 0.00 H new ATOM 0 HE2 MET B 1 31.741 3.757 8.270 1.00 0.00 H new ATOM 0 HE3 MET B 1 31.671 2.383 9.399 1.00 0.00 H new ATOM 1467 N CYS B 2 25.270 3.176 8.129 1.00 0.00 N ATOM 1468 CA CYS B 2 24.030 2.982 7.385 1.00 0.00 C ATOM 1469 C CYS B 2 23.718 1.499 7.219 1.00 0.00 C ATOM 1470 O CYS B 2 24.563 0.722 6.775 1.00 0.00 O ATOM 1471 CB CYS B 2 24.126 3.648 6.012 1.00 0.00 C ATOM 1472 SG CYS B 2 24.828 2.589 4.725 1.00 0.00 S ATOM 0 H CYS B 2 26.118 3.010 7.587 1.00 0.00 H new ATOM 0 HA CYS B 2 23.222 3.443 7.952 1.00 0.00 H new ATOM 0 HB2 CYS B 2 23.130 3.965 5.703 1.00 0.00 H new ATOM 0 HB3 CYS B 2 24.734 4.548 6.099 1.00 0.00 H new ATOM 0 HG CYS B 2 25.138 1.434 5.235 1.00 0.00 H new ATOM 1478 N ASP B 3 22.498 1.113 7.577 1.00 0.00 N ATOM 1479 CA ASP B 3 22.074 -0.278 7.467 1.00 0.00 C ATOM 1480 C ASP B 3 20.620 -0.369 7.013 1.00 0.00 C ATOM 1481 O ASP B 3 20.042 0.613 6.549 1.00 0.00 O ATOM 1482 CB ASP B 3 22.251 -0.993 8.807 1.00 0.00 C ATOM 1483 CG ASP B 3 23.634 -1.593 8.965 1.00 0.00 C ATOM 1484 OD1 ASP B 3 24.503 -1.315 8.110 1.00 0.00 O ATOM 1485 OD2 ASP B 3 23.850 -2.340 9.942 1.00 0.00 O ATOM 0 H ASP B 3 21.786 1.743 7.946 1.00 0.00 H new ATOM 0 HA ASP B 3 22.699 -0.766 6.719 1.00 0.00 H new ATOM 0 HB2 ASP B 3 22.069 -0.288 9.618 1.00 0.00 H new ATOM 0 HB3 ASP B 3 21.504 -1.781 8.896 1.00 0.00 H new ATOM 1490 N ARG B 4 20.035 -1.554 7.151 1.00 0.00 N ATOM 1491 CA ARG B 4 18.648 -1.776 6.756 1.00 0.00 C ATOM 1492 C ARG B 4 17.729 -1.773 7.975 1.00 0.00 C ATOM 1493 O ARG B 4 16.755 -1.023 8.029 1.00 0.00 O ATOM 1494 CB ARG B 4 18.510 -3.101 6.003 1.00 0.00 C ATOM 1495 CG ARG B 4 19.731 -3.999 6.119 1.00 0.00 C ATOM 1496 CD ARG B 4 20.483 -4.086 4.800 1.00 0.00 C ATOM 1497 NE ARG B 4 21.893 -3.739 4.950 1.00 0.00 N ATOM 1498 CZ ARG B 4 22.832 -4.610 5.309 1.00 0.00 C ATOM 1499 NH1 ARG B 4 22.508 -5.871 5.556 1.00 0.00 N ATOM 1500 NH2 ARG B 4 24.094 -4.219 5.420 1.00 0.00 N ATOM 0 H ARG B 4 20.500 -2.377 7.534 1.00 0.00 H new ATOM 0 HA ARG B 4 18.352 -0.961 6.095 1.00 0.00 H new ATOM 0 HB2 ARG B 4 17.639 -3.636 6.383 1.00 0.00 H new ATOM 0 HB3 ARG B 4 18.322 -2.892 4.950 1.00 0.00 H new ATOM 0 HG2 ARG B 4 20.395 -3.615 6.893 1.00 0.00 H new ATOM 0 HG3 ARG B 4 19.422 -4.997 6.430 1.00 0.00 H new ATOM 0 HD2 ARG B 4 20.399 -5.097 4.401 1.00 0.00 H new ATOM 0 HD3 ARG B 4 20.020 -3.417 4.074 1.00 0.00 H new ATOM 0 HE ARG B 4 22.174 -2.775 4.769 1.00 0.00 H new ATOM 0 HH11 ARG B 4 21.538 -6.174 5.471 1.00 0.00 H new ATOM 0 HH12 ARG B 4 23.229 -6.538 5.831 1.00 0.00 H new ATOM 0 HH21 ARG B 4 24.346 -3.249 5.230 1.00 0.00 H new ATOM 0 HH22 ARG B 4 24.813 -4.888 5.695 1.00 0.00 H new ATOM 1514 N LYS B 5 18.046 -2.619 8.949 1.00 0.00 N ATOM 1515 CA LYS B 5 17.250 -2.718 10.168 1.00 0.00 C ATOM 1516 C LYS B 5 15.766 -2.855 9.840 1.00 0.00 C ATOM 1517 O LYS B 5 14.907 -2.430 10.613 1.00 0.00 O ATOM 1518 CB LYS B 5 17.481 -1.492 11.053 1.00 0.00 C ATOM 1519 CG LYS B 5 16.874 -1.618 12.440 1.00 0.00 C ATOM 1520 CD LYS B 5 17.689 -2.548 13.323 1.00 0.00 C ATOM 1521 CE LYS B 5 16.983 -3.876 13.535 1.00 0.00 C ATOM 1522 NZ LYS B 5 17.297 -4.467 14.866 1.00 0.00 N ATOM 0 H LYS B 5 18.849 -3.247 8.918 1.00 0.00 H new ATOM 0 HA LYS B 5 17.566 -3.611 10.708 1.00 0.00 H new ATOM 0 HB2 LYS B 5 18.553 -1.321 11.149 1.00 0.00 H new ATOM 0 HB3 LYS B 5 17.061 -0.615 10.560 1.00 0.00 H new ATOM 0 HG2 LYS B 5 16.816 -0.633 12.903 1.00 0.00 H new ATOM 0 HG3 LYS B 5 15.854 -1.993 12.359 1.00 0.00 H new ATOM 0 HD2 LYS B 5 18.664 -2.722 12.868 1.00 0.00 H new ATOM 0 HD3 LYS B 5 17.868 -2.072 14.287 1.00 0.00 H new ATOM 0 HE2 LYS B 5 15.906 -3.733 13.447 1.00 0.00 H new ATOM 0 HE3 LYS B 5 17.277 -4.573 12.750 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 16.796 -5.372 14.971 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 18.322 -4.628 14.941 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 16.993 -3.814 15.616 1.00 0.00 H new ATOM 1536 N ALA B 6 15.475 -3.451 8.690 1.00 0.00 N ATOM 1537 CA ALA B 6 14.099 -3.648 8.255 1.00 0.00 C ATOM 1538 C ALA B 6 13.811 -5.118 7.979 1.00 0.00 C ATOM 1539 O ALA B 6 14.604 -5.993 8.329 1.00 0.00 O ATOM 1540 CB ALA B 6 13.810 -2.814 7.017 1.00 0.00 C ATOM 0 H ALA B 6 16.176 -3.807 8.041 1.00 0.00 H new ATOM 0 HA ALA B 6 13.444 -3.322 9.063 1.00 0.00 H new ATOM 0 HB1 ALA B 6 12.778 -2.972 6.704 1.00 0.00 H new ATOM 0 HB2 ALA B 6 13.962 -1.759 7.245 1.00 0.00 H new ATOM 0 HB3 ALA B 6 14.482 -3.112 6.213 1.00 0.00 H new ATOM 1546 N VAL B 7 12.672 -5.381 7.352 1.00 0.00 N ATOM 1547 CA VAL B 7 12.273 -6.743 7.026 1.00 0.00 C ATOM 1548 C VAL B 7 11.351 -6.772 5.813 1.00 0.00 C ATOM 1549 O VAL B 7 10.139 -6.938 5.947 1.00 0.00 O ATOM 1550 CB VAL B 7 11.558 -7.415 8.213 1.00 0.00 C ATOM 1551 CG1 VAL B 7 11.255 -8.873 7.900 1.00 0.00 C ATOM 1552 CG2 VAL B 7 12.394 -7.296 9.479 1.00 0.00 C ATOM 0 H VAL B 7 12.006 -4.666 7.058 1.00 0.00 H new ATOM 0 HA VAL B 7 13.186 -7.294 6.798 1.00 0.00 H new ATOM 0 HB VAL B 7 10.612 -6.900 8.381 1.00 0.00 H new ATOM 0 HG11 VAL B 7 10.750 -9.330 8.751 1.00 0.00 H new ATOM 0 HG12 VAL B 7 10.612 -8.931 7.022 1.00 0.00 H new ATOM 0 HG13 VAL B 7 12.186 -9.404 7.703 1.00 0.00 H new ATOM 0 HG21 VAL B 7 11.872 -7.777 10.306 1.00 0.00 H new ATOM 0 HG22 VAL B 7 13.357 -7.783 9.326 1.00 0.00 H new ATOM 0 HG23 VAL B 7 12.552 -6.243 9.713 1.00 0.00 H new ATOM 1562 N ILE B 8 11.932 -6.609 4.628 1.00 0.00 N ATOM 1563 CA ILE B 8 11.158 -6.618 3.393 1.00 0.00 C ATOM 1564 C ILE B 8 9.996 -7.608 3.495 1.00 0.00 C ATOM 1565 O ILE B 8 10.107 -8.652 4.138 1.00 0.00 O ATOM 1566 CB ILE B 8 12.059 -6.955 2.172 1.00 0.00 C ATOM 1567 CG1 ILE B 8 12.582 -5.669 1.531 1.00 0.00 C ATOM 1568 CG2 ILE B 8 11.325 -7.797 1.130 1.00 0.00 C ATOM 1569 CD1 ILE B 8 13.632 -4.959 2.355 1.00 0.00 C ATOM 0 H ILE B 8 12.934 -6.469 4.498 1.00 0.00 H new ATOM 0 HA ILE B 8 10.749 -5.619 3.243 1.00 0.00 H new ATOM 0 HB ILE B 8 12.897 -7.546 2.541 1.00 0.00 H new ATOM 0 HG12 ILE B 8 13.000 -5.906 0.553 1.00 0.00 H new ATOM 0 HG13 ILE B 8 11.745 -4.991 1.364 1.00 0.00 H new ATOM 0 HG21 ILE B 8 11.994 -8.008 0.296 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.002 -8.735 1.582 1.00 0.00 H new ATOM 0 HG23 ILE B 8 10.454 -7.250 0.768 1.00 0.00 H new ATOM 0 HD11 ILE B 8 13.954 -4.057 1.835 1.00 0.00 H new ATOM 0 HD12 ILE B 8 13.213 -4.689 3.324 1.00 0.00 H new ATOM 0 HD13 ILE B 8 14.488 -5.618 2.500 1.00 0.00 H new ATOM 1581 N LYS B 9 8.886 -7.270 2.847 1.00 0.00 N ATOM 1582 CA LYS B 9 7.705 -8.127 2.856 1.00 0.00 C ATOM 1583 C LYS B 9 7.319 -8.513 1.434 1.00 0.00 C ATOM 1584 O LYS B 9 6.662 -9.530 1.208 1.00 0.00 O ATOM 1585 CB LYS B 9 6.535 -7.416 3.539 1.00 0.00 C ATOM 1586 CG LYS B 9 6.915 -6.741 4.847 1.00 0.00 C ATOM 1587 CD LYS B 9 6.939 -7.734 5.999 1.00 0.00 C ATOM 1588 CE LYS B 9 7.941 -8.849 5.750 1.00 0.00 C ATOM 1589 NZ LYS B 9 7.905 -9.881 6.824 1.00 0.00 N ATOM 0 H LYS B 9 8.779 -6.410 2.309 1.00 0.00 H new ATOM 0 HA LYS B 9 7.942 -9.032 3.415 1.00 0.00 H new ATOM 0 HB2 LYS B 9 6.128 -6.668 2.859 1.00 0.00 H new ATOM 0 HB3 LYS B 9 5.742 -8.139 3.730 1.00 0.00 H new ATOM 0 HG2 LYS B 9 7.895 -6.275 4.746 1.00 0.00 H new ATOM 0 HG3 LYS B 9 6.204 -5.944 5.067 1.00 0.00 H new ATOM 0 HD2 LYS B 9 7.192 -7.215 6.923 1.00 0.00 H new ATOM 0 HD3 LYS B 9 5.945 -8.160 6.135 1.00 0.00 H new ATOM 0 HE2 LYS B 9 7.730 -9.318 4.789 1.00 0.00 H new ATOM 0 HE3 LYS B 9 8.944 -8.427 5.686 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 8.603 -10.623 6.616 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 8.131 -9.439 7.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 6.955 -10.302 6.869 1.00 0.00 H new ATOM 1603 N ASN B 10 7.739 -7.691 0.479 1.00 0.00 N ATOM 1604 CA ASN B 10 7.449 -7.934 -0.929 1.00 0.00 C ATOM 1605 C ASN B 10 8.523 -7.302 -1.808 1.00 0.00 C ATOM 1606 O ASN B 10 9.502 -7.951 -2.173 1.00 0.00 O ATOM 1607 CB ASN B 10 6.074 -7.369 -1.290 1.00 0.00 C ATOM 1608 CG ASN B 10 5.289 -8.287 -2.204 1.00 0.00 C ATOM 1609 OD1 ASN B 10 5.192 -9.490 -1.962 1.00 0.00 O ATOM 1610 ND2 ASN B 10 4.722 -7.722 -3.264 1.00 0.00 N ATOM 0 H ASN B 10 8.284 -6.847 0.656 1.00 0.00 H new ATOM 0 HA ASN B 10 7.444 -9.010 -1.103 1.00 0.00 H new ATOM 0 HB2 ASN B 10 5.504 -7.198 -0.377 1.00 0.00 H new ATOM 0 HB3 ASN B 10 6.199 -6.400 -1.774 1.00 0.00 H new ATOM 0 HD21 ASN B 10 4.180 -8.290 -3.916 1.00 0.00 H new ATOM 0 HD22 ASN B 10 4.828 -6.721 -3.426 1.00 0.00 H new ATOM 1617 N ALA B 11 8.335 -6.029 -2.131 1.00 0.00 N ATOM 1618 CA ALA B 11 9.290 -5.298 -2.954 1.00 0.00 C ATOM 1619 C ALA B 11 9.476 -5.954 -4.318 1.00 0.00 C ATOM 1620 O ALA B 11 9.892 -7.110 -4.411 1.00 0.00 O ATOM 1621 CB ALA B 11 10.627 -5.196 -2.234 1.00 0.00 C ATOM 0 H ALA B 11 7.528 -5.480 -1.835 1.00 0.00 H new ATOM 0 HA ALA B 11 8.891 -4.297 -3.120 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.335 -4.648 -2.856 1.00 0.00 H new ATOM 0 HB2 ALA B 11 10.492 -4.670 -1.289 1.00 0.00 H new ATOM 0 HB3 ALA B 11 11.013 -6.197 -2.040 1.00 0.00 H new ATOM 1627 N ASP B 12 9.180 -5.204 -5.373 1.00 0.00 N ATOM 1628 CA ASP B 12 9.328 -5.703 -6.732 1.00 0.00 C ATOM 1629 C ASP B 12 10.354 -4.872 -7.490 1.00 0.00 C ATOM 1630 O ASP B 12 10.326 -4.787 -8.717 1.00 0.00 O ATOM 1631 CB ASP B 12 7.985 -5.679 -7.465 1.00 0.00 C ATOM 1632 CG ASP B 12 7.403 -7.066 -7.645 1.00 0.00 C ATOM 1633 OD1 ASP B 12 8.163 -7.985 -8.018 1.00 0.00 O ATOM 1634 OD2 ASP B 12 6.187 -7.236 -7.414 1.00 0.00 O ATOM 0 H ASP B 12 8.835 -4.246 -5.311 1.00 0.00 H new ATOM 0 HA ASP B 12 9.676 -6.735 -6.683 1.00 0.00 H new ATOM 0 HB2 ASP B 12 7.281 -5.061 -6.908 1.00 0.00 H new ATOM 0 HB3 ASP B 12 8.115 -5.212 -8.441 1.00 0.00 H new ATOM 1639 N MET B 13 11.260 -4.259 -6.738 1.00 0.00 N ATOM 1640 CA MET B 13 12.306 -3.424 -7.313 1.00 0.00 C ATOM 1641 C MET B 13 13.664 -4.110 -7.208 1.00 0.00 C ATOM 1642 O MET B 13 13.807 -5.128 -6.531 1.00 0.00 O ATOM 1643 CB MET B 13 12.340 -2.068 -6.600 1.00 0.00 C ATOM 1644 CG MET B 13 13.665 -1.333 -6.728 1.00 0.00 C ATOM 1645 SD MET B 13 13.488 0.453 -6.549 1.00 0.00 S ATOM 1646 CE MET B 13 13.023 0.577 -4.823 1.00 0.00 C ATOM 0 H MET B 13 11.290 -4.326 -5.721 1.00 0.00 H new ATOM 0 HA MET B 13 12.085 -3.267 -8.369 1.00 0.00 H new ATOM 0 HB2 MET B 13 11.547 -1.438 -7.002 1.00 0.00 H new ATOM 0 HB3 MET B 13 12.121 -2.220 -5.543 1.00 0.00 H new ATOM 0 HG2 MET B 13 14.356 -1.703 -5.971 1.00 0.00 H new ATOM 0 HG3 MET B 13 14.107 -1.555 -7.699 1.00 0.00 H new ATOM 0 HE1 MET B 13 13.455 1.481 -4.394 1.00 0.00 H new ATOM 0 HE2 MET B 13 11.937 0.620 -4.741 1.00 0.00 H new ATOM 0 HE3 MET B 13 13.394 -0.294 -4.283 1.00 0.00 H new ATOM 1656 N SER B 14 14.660 -3.544 -7.883 1.00 0.00 N ATOM 1657 CA SER B 14 16.008 -4.101 -7.864 1.00 0.00 C ATOM 1658 C SER B 14 16.488 -4.309 -6.431 1.00 0.00 C ATOM 1659 O SER B 14 16.359 -3.421 -5.588 1.00 0.00 O ATOM 1660 CB SER B 14 16.972 -3.176 -8.609 1.00 0.00 C ATOM 1661 OG SER B 14 16.285 -2.379 -9.558 1.00 0.00 O ATOM 0 H SER B 14 14.559 -2.701 -8.449 1.00 0.00 H new ATOM 0 HA SER B 14 15.984 -5.069 -8.364 1.00 0.00 H new ATOM 0 HB2 SER B 14 17.488 -2.533 -7.896 1.00 0.00 H new ATOM 0 HB3 SER B 14 17.734 -3.770 -9.113 1.00 0.00 H new ATOM 0 HG SER B 14 16.924 -1.796 -10.019 1.00 0.00 H new ATOM 1667 N GLU B 15 17.044 -5.486 -6.164 1.00 0.00 N ATOM 1668 CA GLU B 15 17.544 -5.809 -4.831 1.00 0.00 C ATOM 1669 C GLU B 15 18.303 -4.629 -4.234 1.00 0.00 C ATOM 1670 O GLU B 15 17.873 -4.040 -3.242 1.00 0.00 O ATOM 1671 CB GLU B 15 18.455 -7.039 -4.880 1.00 0.00 C ATOM 1672 CG GLU B 15 18.716 -7.556 -6.285 1.00 0.00 C ATOM 1673 CD GLU B 15 20.177 -7.892 -6.518 1.00 0.00 C ATOM 1674 OE1 GLU B 15 20.784 -8.540 -5.640 1.00 0.00 O ATOM 1675 OE2 GLU B 15 20.712 -7.507 -7.579 1.00 0.00 O ATOM 0 H GLU B 15 17.160 -6.231 -6.851 1.00 0.00 H new ATOM 0 HA GLU B 15 16.685 -6.029 -4.197 1.00 0.00 H new ATOM 0 HB2 GLU B 15 19.408 -6.792 -4.411 1.00 0.00 H new ATOM 0 HB3 GLU B 15 18.005 -7.836 -4.288 1.00 0.00 H new ATOM 0 HG2 GLU B 15 18.110 -8.445 -6.460 1.00 0.00 H new ATOM 0 HG3 GLU B 15 18.399 -6.806 -7.010 1.00 0.00 H new ATOM 1682 N GLU B 16 19.434 -4.289 -4.843 1.00 0.00 N ATOM 1683 CA GLU B 16 20.256 -3.181 -4.370 1.00 0.00 C ATOM 1684 C GLU B 16 19.394 -1.974 -4.017 1.00 0.00 C ATOM 1685 O GLU B 16 19.705 -1.227 -3.089 1.00 0.00 O ATOM 1686 CB GLU B 16 21.284 -2.792 -5.434 1.00 0.00 C ATOM 1687 CG GLU B 16 22.713 -3.136 -5.051 1.00 0.00 C ATOM 1688 CD GLU B 16 23.687 -2.931 -6.195 1.00 0.00 C ATOM 1689 OE1 GLU B 16 23.242 -2.936 -7.362 1.00 0.00 O ATOM 1690 OE2 GLU B 16 24.894 -2.765 -5.923 1.00 0.00 O ATOM 0 H GLU B 16 19.803 -4.765 -5.666 1.00 0.00 H new ATOM 0 HA GLU B 16 20.778 -3.508 -3.470 1.00 0.00 H new ATOM 0 HB2 GLU B 16 21.036 -3.295 -6.369 1.00 0.00 H new ATOM 0 HB3 GLU B 16 21.214 -1.720 -5.620 1.00 0.00 H new ATOM 0 HG2 GLU B 16 23.017 -2.520 -4.205 1.00 0.00 H new ATOM 0 HG3 GLU B 16 22.758 -4.174 -4.722 1.00 0.00 H new ATOM 1697 N MET B 17 18.311 -1.787 -4.762 1.00 0.00 N ATOM 1698 CA MET B 17 17.406 -0.668 -4.527 1.00 0.00 C ATOM 1699 C MET B 17 16.573 -0.893 -3.269 1.00 0.00 C ATOM 1700 O MET B 17 16.226 0.056 -2.566 1.00 0.00 O ATOM 1701 CB MET B 17 16.489 -0.464 -5.733 1.00 0.00 C ATOM 1702 CG MET B 17 17.153 0.281 -6.879 1.00 0.00 C ATOM 1703 SD MET B 17 16.289 1.803 -7.310 1.00 0.00 S ATOM 1704 CE MET B 17 16.311 2.660 -5.737 1.00 0.00 C ATOM 0 H MET B 17 18.038 -2.395 -5.534 1.00 0.00 H new ATOM 0 HA MET B 17 18.009 0.229 -4.383 1.00 0.00 H new ATOM 0 HB2 MET B 17 16.150 -1.436 -6.090 1.00 0.00 H new ATOM 0 HB3 MET B 17 15.603 0.087 -5.417 1.00 0.00 H new ATOM 0 HG2 MET B 17 18.182 0.516 -6.607 1.00 0.00 H new ATOM 0 HG3 MET B 17 17.195 -0.368 -7.753 1.00 0.00 H new ATOM 0 HE1 MET B 17 16.219 3.733 -5.906 1.00 0.00 H new ATOM 0 HE2 MET B 17 15.478 2.317 -5.124 1.00 0.00 H new ATOM 0 HE3 MET B 17 17.249 2.453 -5.223 1.00 0.00 H new ATOM 1714 N GLN B 18 16.254 -2.153 -2.990 1.00 0.00 N ATOM 1715 CA GLN B 18 15.461 -2.495 -1.814 1.00 0.00 C ATOM 1716 C GLN B 18 16.249 -2.240 -0.534 1.00 0.00 C ATOM 1717 O GLN B 18 15.694 -1.784 0.466 1.00 0.00 O ATOM 1718 CB GLN B 18 15.018 -3.956 -1.875 1.00 0.00 C ATOM 1719 CG GLN B 18 14.939 -4.509 -3.288 1.00 0.00 C ATOM 1720 CD GLN B 18 13.772 -3.941 -4.072 1.00 0.00 C ATOM 1721 OE1 GLN B 18 13.805 -2.791 -4.510 1.00 0.00 O ATOM 1722 NE2 GLN B 18 12.732 -4.746 -4.254 1.00 0.00 N ATOM 0 H GLN B 18 16.531 -2.952 -3.560 1.00 0.00 H new ATOM 0 HA GLN B 18 14.576 -1.858 -1.807 1.00 0.00 H new ATOM 0 HB2 GLN B 18 15.714 -4.562 -1.295 1.00 0.00 H new ATOM 0 HB3 GLN B 18 14.041 -4.051 -1.401 1.00 0.00 H new ATOM 0 HG2 GLN B 18 15.868 -4.287 -3.814 1.00 0.00 H new ATOM 0 HG3 GLN B 18 14.849 -5.594 -3.245 1.00 0.00 H new ATOM 0 HE21 GLN B 18 12.747 -5.692 -3.873 1.00 0.00 H new ATOM 0 HE22 GLN B 18 11.918 -4.418 -4.774 1.00 0.00 H new ATOM 1731 N GLN B 19 17.546 -2.523 -0.575 1.00 0.00 N ATOM 1732 CA GLN B 19 18.406 -2.311 0.579 1.00 0.00 C ATOM 1733 C GLN B 19 18.656 -0.824 0.762 1.00 0.00 C ATOM 1734 O GLN B 19 18.685 -0.317 1.885 1.00 0.00 O ATOM 1735 CB GLN B 19 19.732 -3.051 0.399 1.00 0.00 C ATOM 1736 CG GLN B 19 20.061 -3.994 1.544 1.00 0.00 C ATOM 1737 CD GLN B 19 21.437 -3.744 2.129 1.00 0.00 C ATOM 1738 OE1 GLN B 19 21.872 -2.599 2.257 1.00 0.00 O ATOM 1739 NE2 GLN B 19 22.134 -4.817 2.487 1.00 0.00 N ATOM 0 H GLN B 19 18.023 -2.899 -1.394 1.00 0.00 H new ATOM 0 HA GLN B 19 17.911 -2.704 1.467 1.00 0.00 H new ATOM 0 HB2 GLN B 19 19.698 -3.619 -0.531 1.00 0.00 H new ATOM 0 HB3 GLN B 19 20.535 -2.321 0.298 1.00 0.00 H new ATOM 0 HG2 GLN B 19 19.312 -3.883 2.328 1.00 0.00 H new ATOM 0 HG3 GLN B 19 20.002 -5.023 1.190 1.00 0.00 H new ATOM 0 HE21 GLN B 19 21.736 -5.748 2.364 1.00 0.00 H new ATOM 0 HE22 GLN B 19 23.067 -4.710 2.885 1.00 0.00 H new ATOM 1748 N ASP B 20 18.815 -0.126 -0.356 1.00 0.00 N ATOM 1749 CA ASP B 20 19.042 1.307 -0.326 1.00 0.00 C ATOM 1750 C ASP B 20 17.763 2.022 0.085 1.00 0.00 C ATOM 1751 O ASP B 20 17.799 3.031 0.789 1.00 0.00 O ATOM 1752 CB ASP B 20 19.512 1.809 -1.692 1.00 0.00 C ATOM 1753 CG ASP B 20 20.759 2.665 -1.593 1.00 0.00 C ATOM 1754 OD1 ASP B 20 20.698 3.729 -0.941 1.00 0.00 O ATOM 1755 OD2 ASP B 20 21.796 2.273 -2.168 1.00 0.00 O ATOM 0 H ASP B 20 18.790 -0.532 -1.292 1.00 0.00 H new ATOM 0 HA ASP B 20 19.823 1.522 0.403 1.00 0.00 H new ATOM 0 HB2 ASP B 20 19.710 0.956 -2.341 1.00 0.00 H new ATOM 0 HB3 ASP B 20 18.714 2.386 -2.159 1.00 0.00 H new ATOM 1760 N SER B 21 16.631 1.474 -0.346 1.00 0.00 N ATOM 1761 CA SER B 21 15.333 2.041 -0.013 1.00 0.00 C ATOM 1762 C SER B 21 15.110 1.973 1.491 1.00 0.00 C ATOM 1763 O SER B 21 14.606 2.916 2.102 1.00 0.00 O ATOM 1764 CB SER B 21 14.218 1.293 -0.745 1.00 0.00 C ATOM 1765 OG SER B 21 13.079 1.133 0.084 1.00 0.00 O ATOM 0 H SER B 21 16.589 0.637 -0.927 1.00 0.00 H new ATOM 0 HA SER B 21 15.314 3.084 -0.330 1.00 0.00 H new ATOM 0 HB2 SER B 21 13.941 1.839 -1.647 1.00 0.00 H new ATOM 0 HB3 SER B 21 14.580 0.315 -1.063 1.00 0.00 H new ATOM 0 HG SER B 21 13.220 0.377 0.691 1.00 0.00 H new ATOM 1771 N VAL B 22 15.508 0.851 2.084 1.00 0.00 N ATOM 1772 CA VAL B 22 15.369 0.657 3.519 1.00 0.00 C ATOM 1773 C VAL B 22 16.218 1.671 4.274 1.00 0.00 C ATOM 1774 O VAL B 22 15.765 2.280 5.243 1.00 0.00 O ATOM 1775 CB VAL B 22 15.792 -0.762 3.940 1.00 0.00 C ATOM 1776 CG1 VAL B 22 15.492 -0.995 5.411 1.00 0.00 C ATOM 1777 CG2 VAL B 22 15.101 -1.806 3.074 1.00 0.00 C ATOM 0 H VAL B 22 15.929 0.064 1.591 1.00 0.00 H new ATOM 0 HA VAL B 22 14.316 0.796 3.765 1.00 0.00 H new ATOM 0 HB VAL B 22 16.868 -0.858 3.794 1.00 0.00 H new ATOM 0 HG11 VAL B 22 15.798 -2.003 5.689 1.00 0.00 H new ATOM 0 HG12 VAL B 22 16.040 -0.270 6.013 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.423 -0.879 5.587 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.413 -2.802 3.387 1.00 0.00 H new ATOM 0 HG22 VAL B 22 14.021 -1.713 3.184 1.00 0.00 H new ATOM 0 HG23 VAL B 22 15.374 -1.651 2.030 1.00 0.00 H new ATOM 1787 N GLU B 23 17.452 1.855 3.814 1.00 0.00 N ATOM 1788 CA GLU B 23 18.366 2.804 4.437 1.00 0.00 C ATOM 1789 C GLU B 23 17.758 4.202 4.444 1.00 0.00 C ATOM 1790 O GLU B 23 17.898 4.946 5.414 1.00 0.00 O ATOM 1791 CB GLU B 23 19.704 2.821 3.694 1.00 0.00 C ATOM 1792 CG GLU B 23 20.330 1.446 3.529 1.00 0.00 C ATOM 1793 CD GLU B 23 21.448 1.434 2.505 1.00 0.00 C ATOM 1794 OE1 GLU B 23 21.935 2.527 2.146 1.00 0.00 O ATOM 1795 OE2 GLU B 23 21.839 0.333 2.064 1.00 0.00 O ATOM 0 H GLU B 23 17.841 1.359 3.012 1.00 0.00 H new ATOM 0 HA GLU B 23 18.538 2.490 5.467 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.557 3.264 2.709 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.400 3.465 4.232 1.00 0.00 H new ATOM 0 HG2 GLU B 23 20.719 1.110 4.490 1.00 0.00 H new ATOM 0 HG3 GLU B 23 19.561 0.734 3.230 1.00 0.00 H new ATOM 1802 N CYS B 24 17.073 4.547 3.357 1.00 0.00 N ATOM 1803 CA CYS B 24 16.434 5.852 3.243 1.00 0.00 C ATOM 1804 C CYS B 24 15.280 5.964 4.231 1.00 0.00 C ATOM 1805 O CYS B 24 15.057 7.019 4.827 1.00 0.00 O ATOM 1806 CB CYS B 24 15.929 6.079 1.817 1.00 0.00 C ATOM 1807 SG CYS B 24 16.615 7.549 1.018 1.00 0.00 S ATOM 0 H CYS B 24 16.947 3.942 2.545 1.00 0.00 H new ATOM 0 HA CYS B 24 17.173 6.618 3.477 1.00 0.00 H new ATOM 0 HB2 CYS B 24 16.171 5.204 1.214 1.00 0.00 H new ATOM 0 HB3 CYS B 24 14.842 6.163 1.836 1.00 0.00 H new ATOM 0 HG CYS B 24 16.243 7.580 -0.227 1.00 0.00 H new ATOM 1813 N ALA B 25 14.571 4.856 4.429 1.00 0.00 N ATOM 1814 CA ALA B 25 13.468 4.827 5.373 1.00 0.00 C ATOM 1815 C ALA B 25 14.039 4.879 6.772 1.00 0.00 C ATOM 1816 O ALA B 25 13.434 5.420 7.697 1.00 0.00 O ATOM 1817 CB ALA B 25 12.626 3.574 5.180 1.00 0.00 C ATOM 0 H ALA B 25 14.743 3.973 3.949 1.00 0.00 H new ATOM 0 HA ALA B 25 12.816 5.685 5.207 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.805 3.573 5.898 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.223 3.559 4.167 1.00 0.00 H new ATOM 0 HB3 ALA B 25 13.246 2.691 5.337 1.00 0.00 H new ATOM 1823 N THR B 26 15.238 4.327 6.894 1.00 0.00 N ATOM 1824 CA THR B 26 15.955 4.306 8.149 1.00 0.00 C ATOM 1825 C THR B 26 16.482 5.700 8.460 1.00 0.00 C ATOM 1826 O THR B 26 16.447 6.151 9.604 1.00 0.00 O ATOM 1827 CB THR B 26 17.107 3.310 8.069 1.00 0.00 C ATOM 1828 OG1 THR B 26 16.670 2.080 7.520 1.00 0.00 O ATOM 1829 CG2 THR B 26 17.729 3.018 9.409 1.00 0.00 C ATOM 0 H THR B 26 15.736 3.883 6.123 1.00 0.00 H new ATOM 0 HA THR B 26 15.280 3.997 8.947 1.00 0.00 H new ATOM 0 HB THR B 26 17.855 3.781 7.431 1.00 0.00 H new ATOM 0 HG1 THR B 26 16.609 2.160 6.545 1.00 0.00 H new ATOM 0 HG21 THR B 26 18.542 2.303 9.285 1.00 0.00 H new ATOM 0 HG22 THR B 26 18.120 3.941 9.838 1.00 0.00 H new ATOM 0 HG23 THR B 26 16.976 2.599 10.076 1.00 0.00 H new ATOM 1837 N GLN B 27 16.950 6.386 7.420 1.00 0.00 N ATOM 1838 CA GLN B 27 17.460 7.739 7.571 1.00 0.00 C ATOM 1839 C GLN B 27 16.376 8.624 8.165 1.00 0.00 C ATOM 1840 O GLN B 27 16.625 9.413 9.077 1.00 0.00 O ATOM 1841 CB GLN B 27 17.915 8.296 6.220 1.00 0.00 C ATOM 1842 CG GLN B 27 19.390 8.665 6.180 1.00 0.00 C ATOM 1843 CD GLN B 27 19.771 9.411 4.917 1.00 0.00 C ATOM 1844 OE1 GLN B 27 19.203 10.458 4.605 1.00 0.00 O ATOM 1845 NE2 GLN B 27 20.736 8.874 4.180 1.00 0.00 N ATOM 0 H GLN B 27 16.985 6.025 6.467 1.00 0.00 H new ATOM 0 HA GLN B 27 18.320 7.722 8.240 1.00 0.00 H new ATOM 0 HB2 GLN B 27 17.713 7.557 5.445 1.00 0.00 H new ATOM 0 HB3 GLN B 27 17.321 9.179 5.982 1.00 0.00 H new ATOM 0 HG2 GLN B 27 19.630 9.280 7.047 1.00 0.00 H new ATOM 0 HG3 GLN B 27 19.990 7.758 6.257 1.00 0.00 H new ATOM 0 HE21 GLN B 27 21.180 8.005 4.476 1.00 0.00 H new ATOM 0 HE22 GLN B 27 21.033 9.331 3.318 1.00 0.00 H new ATOM 1854 N ALA B 28 15.161 8.464 7.649 1.00 0.00 N ATOM 1855 CA ALA B 28 14.020 9.226 8.134 1.00 0.00 C ATOM 1856 C ALA B 28 13.658 8.788 9.547 1.00 0.00 C ATOM 1857 O ALA B 28 13.287 9.605 10.391 1.00 0.00 O ATOM 1858 CB ALA B 28 12.828 9.043 7.207 1.00 0.00 C ATOM 0 H ALA B 28 14.943 7.813 6.895 1.00 0.00 H new ATOM 0 HA ALA B 28 14.289 10.282 8.151 1.00 0.00 H new ATOM 0 HB1 ALA B 28 11.983 9.619 7.583 1.00 0.00 H new ATOM 0 HB2 ALA B 28 13.088 9.391 6.207 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.558 7.988 7.165 1.00 0.00 H new ATOM 1864 N LEU B 29 13.773 7.487 9.794 1.00 0.00 N ATOM 1865 CA LEU B 29 13.466 6.921 11.100 1.00 0.00 C ATOM 1866 C LEU B 29 14.412 7.469 12.163 1.00 0.00 C ATOM 1867 O LEU B 29 14.002 7.752 13.289 1.00 0.00 O ATOM 1868 CB LEU B 29 13.562 5.399 11.051 1.00 0.00 C ATOM 1869 CG LEU B 29 12.350 4.704 10.438 1.00 0.00 C ATOM 1870 CD1 LEU B 29 12.792 3.608 9.486 1.00 0.00 C ATOM 1871 CD2 LEU B 29 11.454 4.138 11.526 1.00 0.00 C ATOM 0 H LEU B 29 14.078 6.803 9.102 1.00 0.00 H new ATOM 0 HA LEU B 29 12.447 7.205 11.364 1.00 0.00 H new ATOM 0 HB2 LEU B 29 14.449 5.122 10.481 1.00 0.00 H new ATOM 0 HB3 LEU B 29 13.705 5.025 12.065 1.00 0.00 H new ATOM 0 HG LEU B 29 11.779 5.440 9.873 1.00 0.00 H new ATOM 0 HD11 LEU B 29 11.915 3.123 9.058 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.394 4.041 8.687 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.385 2.872 10.029 1.00 0.00 H new ATOM 0 HD21 LEU B 29 10.595 3.646 11.070 1.00 0.00 H new ATOM 0 HD22 LEU B 29 12.014 3.415 12.119 1.00 0.00 H new ATOM 0 HD23 LEU B 29 11.109 4.946 12.171 1.00 0.00 H new ATOM 1883 N GLU B 30 15.680 7.615 11.793 1.00 0.00 N ATOM 1884 CA GLU B 30 16.693 8.129 12.708 1.00 0.00 C ATOM 1885 C GLU B 30 16.643 9.652 12.776 1.00 0.00 C ATOM 1886 O GLU B 30 17.078 10.255 13.756 1.00 0.00 O ATOM 1887 CB GLU B 30 18.085 7.671 12.266 1.00 0.00 C ATOM 1888 CG GLU B 30 18.758 6.731 13.254 1.00 0.00 C ATOM 1889 CD GLU B 30 20.265 6.690 13.083 1.00 0.00 C ATOM 1890 OE1 GLU B 30 20.739 6.898 11.948 1.00 0.00 O ATOM 1891 OE2 GLU B 30 20.969 6.450 14.087 1.00 0.00 O ATOM 0 H GLU B 30 16.031 7.384 10.864 1.00 0.00 H new ATOM 0 HA GLU B 30 16.485 7.733 13.702 1.00 0.00 H new ATOM 0 HB2 GLU B 30 18.005 7.173 11.300 1.00 0.00 H new ATOM 0 HB3 GLU B 30 18.718 8.547 12.121 1.00 0.00 H new ATOM 0 HG2 GLU B 30 18.519 7.045 14.270 1.00 0.00 H new ATOM 0 HG3 GLU B 30 18.354 5.727 13.128 1.00 0.00 H new ATOM 1898 N LYS B 31 16.104 10.267 11.726 1.00 0.00 N ATOM 1899 CA LYS B 31 15.995 11.721 11.666 1.00 0.00 C ATOM 1900 C LYS B 31 14.707 12.196 12.332 1.00 0.00 C ATOM 1901 O LYS B 31 14.622 13.332 12.802 1.00 0.00 O ATOM 1902 CB LYS B 31 16.036 12.196 10.213 1.00 0.00 C ATOM 1903 CG LYS B 31 17.426 12.590 9.740 1.00 0.00 C ATOM 1904 CD LYS B 31 17.769 11.930 8.413 1.00 0.00 C ATOM 1905 CE LYS B 31 18.411 12.911 7.440 1.00 0.00 C ATOM 1906 NZ LYS B 31 18.663 14.240 8.064 1.00 0.00 N ATOM 0 H LYS B 31 15.737 9.782 10.907 1.00 0.00 H new ATOM 0 HA LYS B 31 16.841 12.148 12.204 1.00 0.00 H new ATOM 0 HB2 LYS B 31 15.654 11.404 9.570 1.00 0.00 H new ATOM 0 HB3 LYS B 31 15.367 13.049 10.100 1.00 0.00 H new ATOM 0 HG2 LYS B 31 17.482 13.673 9.634 1.00 0.00 H new ATOM 0 HG3 LYS B 31 18.162 12.304 10.491 1.00 0.00 H new ATOM 0 HD2 LYS B 31 18.448 11.095 8.587 1.00 0.00 H new ATOM 0 HD3 LYS B 31 16.864 11.517 7.968 1.00 0.00 H new ATOM 0 HE2 LYS B 31 19.352 12.497 7.078 1.00 0.00 H new ATOM 0 HE3 LYS B 31 17.763 13.036 6.572 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 19.249 14.817 7.427 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 17.757 14.722 8.232 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 19.159 14.110 8.969 1.00 0.00 H new ATOM 1920 N TYR B 32 13.709 11.321 12.367 1.00 0.00 N ATOM 1921 CA TYR B 32 12.424 11.648 12.974 1.00 0.00 C ATOM 1922 C TYR B 32 11.683 10.377 13.377 1.00 0.00 C ATOM 1923 O TYR B 32 12.139 9.268 13.098 1.00 0.00 O ATOM 1924 CB TYR B 32 11.568 12.468 12.003 1.00 0.00 C ATOM 1925 CG TYR B 32 12.334 12.979 10.804 1.00 0.00 C ATOM 1926 CD1 TYR B 32 13.028 14.181 10.860 1.00 0.00 C ATOM 1927 CD2 TYR B 32 12.365 12.259 9.617 1.00 0.00 C ATOM 1928 CE1 TYR B 32 13.733 14.650 9.768 1.00 0.00 C ATOM 1929 CE2 TYR B 32 13.069 12.720 8.521 1.00 0.00 C ATOM 1930 CZ TYR B 32 13.751 13.916 8.601 1.00 0.00 C ATOM 1931 OH TYR B 32 14.452 14.379 7.512 1.00 0.00 O ATOM 0 H TYR B 32 13.765 10.378 11.982 1.00 0.00 H new ATOM 0 HA TYR B 32 12.610 12.243 13.868 1.00 0.00 H new ATOM 0 HB2 TYR B 32 10.736 11.854 11.658 1.00 0.00 H new ATOM 0 HB3 TYR B 32 11.138 13.315 12.537 1.00 0.00 H new ATOM 0 HD1 TYR B 32 13.016 14.759 11.772 1.00 0.00 H new ATOM 0 HD2 TYR B 32 11.830 11.323 9.549 1.00 0.00 H new ATOM 0 HE1 TYR B 32 14.267 15.587 9.828 1.00 0.00 H new ATOM 0 HE2 TYR B 32 13.085 12.146 7.606 1.00 0.00 H new ATOM 0 HH TYR B 32 15.216 14.911 7.817 1.00 0.00 H new ATOM 1941 N ASN B 33 10.539 10.542 14.035 1.00 0.00 N ATOM 1942 CA ASN B 33 9.743 9.401 14.474 1.00 0.00 C ATOM 1943 C ASN B 33 8.269 9.597 14.134 1.00 0.00 C ATOM 1944 O ASN B 33 7.388 9.228 14.911 1.00 0.00 O ATOM 1945 CB ASN B 33 9.908 9.185 15.980 1.00 0.00 C ATOM 1946 CG ASN B 33 9.542 10.416 16.785 1.00 0.00 C ATOM 1947 OD1 ASN B 33 8.445 10.958 16.646 1.00 0.00 O ATOM 1948 ND2 ASN B 33 10.460 10.865 17.633 1.00 0.00 N ATOM 0 H ASN B 33 10.144 11.451 14.275 1.00 0.00 H new ATOM 0 HA ASN B 33 10.102 8.518 13.946 1.00 0.00 H new ATOM 0 HB2 ASN B 33 9.283 8.349 16.295 1.00 0.00 H new ATOM 0 HB3 ASN B 33 10.941 8.909 16.193 1.00 0.00 H new ATOM 0 HD21 ASN B 33 10.269 11.690 18.201 1.00 0.00 H new ATOM 0 HD22 ASN B 33 11.356 10.385 17.716 1.00 0.00 H new ATOM 1955 N ILE B 34 8.009 10.174 12.967 1.00 0.00 N ATOM 1956 CA ILE B 34 6.643 10.413 12.516 1.00 0.00 C ATOM 1957 C ILE B 34 6.385 9.713 11.186 1.00 0.00 C ATOM 1958 O ILE B 34 6.868 10.152 10.145 1.00 0.00 O ATOM 1959 CB ILE B 34 6.359 11.920 12.356 1.00 0.00 C ATOM 1960 CG1 ILE B 34 7.081 12.715 13.442 1.00 0.00 C ATOM 1961 CG2 ILE B 34 4.863 12.187 12.403 1.00 0.00 C ATOM 1962 CD1 ILE B 34 6.561 12.438 14.831 1.00 0.00 C ATOM 0 H ILE B 34 8.728 10.486 12.314 1.00 0.00 H new ATOM 0 HA ILE B 34 5.977 10.008 13.278 1.00 0.00 H new ATOM 0 HB ILE B 34 6.734 12.243 11.385 1.00 0.00 H new ATOM 0 HG12 ILE B 34 8.145 12.481 13.407 1.00 0.00 H new ATOM 0 HG13 ILE B 34 6.981 13.780 13.230 1.00 0.00 H new ATOM 0 HG21 ILE B 34 4.680 13.255 12.289 1.00 0.00 H new ATOM 0 HG22 ILE B 34 4.371 11.646 11.594 1.00 0.00 H new ATOM 0 HG23 ILE B 34 4.463 11.851 13.360 1.00 0.00 H new ATOM 0 HD11 ILE B 34 7.117 13.035 15.554 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.504 12.698 14.882 1.00 0.00 H new ATOM 0 HD13 ILE B 34 6.686 11.380 15.062 1.00 0.00 H new ATOM 1974 N GLU B 35 5.625 8.621 11.230 1.00 0.00 N ATOM 1975 CA GLU B 35 5.313 7.855 10.024 1.00 0.00 C ATOM 1976 C GLU B 35 5.293 8.757 8.796 1.00 0.00 C ATOM 1977 O GLU B 35 6.182 8.685 7.946 1.00 0.00 O ATOM 1978 CB GLU B 35 3.962 7.152 10.177 1.00 0.00 C ATOM 1979 CG GLU B 35 3.792 6.445 11.512 1.00 0.00 C ATOM 1980 CD GLU B 35 2.933 7.234 12.482 1.00 0.00 C ATOM 1981 OE1 GLU B 35 2.090 8.029 12.018 1.00 0.00 O ATOM 1982 OE2 GLU B 35 3.104 7.054 13.706 1.00 0.00 O ATOM 0 H GLU B 35 5.214 8.247 12.085 1.00 0.00 H new ATOM 0 HA GLU B 35 6.092 7.105 9.888 1.00 0.00 H new ATOM 0 HB2 GLU B 35 3.165 7.886 10.060 1.00 0.00 H new ATOM 0 HB3 GLU B 35 3.847 6.425 9.373 1.00 0.00 H new ATOM 0 HG2 GLU B 35 3.342 5.466 11.346 1.00 0.00 H new ATOM 0 HG3 GLU B 35 4.773 6.274 11.956 1.00 0.00 H new ATOM 1989 N LYS B 36 4.281 9.612 8.709 1.00 0.00 N ATOM 1990 CA LYS B 36 4.156 10.533 7.586 1.00 0.00 C ATOM 1991 C LYS B 36 5.480 11.242 7.323 1.00 0.00 C ATOM 1992 O LYS B 36 5.853 11.475 6.173 1.00 0.00 O ATOM 1993 CB LYS B 36 3.056 11.562 7.862 1.00 0.00 C ATOM 1994 CG LYS B 36 2.645 11.637 9.324 1.00 0.00 C ATOM 1995 CD LYS B 36 2.148 13.026 9.693 1.00 0.00 C ATOM 1996 CE LYS B 36 3.293 14.021 9.788 1.00 0.00 C ATOM 1997 NZ LYS B 36 3.357 14.910 8.596 1.00 0.00 N ATOM 0 H LYS B 36 3.536 9.687 9.402 1.00 0.00 H new ATOM 0 HA LYS B 36 3.888 9.958 6.700 1.00 0.00 H new ATOM 0 HB2 LYS B 36 3.400 12.545 7.539 1.00 0.00 H new ATOM 0 HB3 LYS B 36 2.181 11.317 7.260 1.00 0.00 H new ATOM 0 HG2 LYS B 36 1.862 10.905 9.521 1.00 0.00 H new ATOM 0 HG3 LYS B 36 3.493 11.373 9.955 1.00 0.00 H new ATOM 0 HD2 LYS B 36 1.430 13.367 8.947 1.00 0.00 H new ATOM 0 HD3 LYS B 36 1.621 12.984 10.646 1.00 0.00 H new ATOM 0 HE2 LYS B 36 3.174 14.627 10.686 1.00 0.00 H new ATOM 0 HE3 LYS B 36 4.235 13.482 9.890 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 4.327 14.920 8.222 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 2.708 14.557 7.864 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 3.081 15.875 8.868 1.00 0.00 H new ATOM 2011 N ASP B 37 6.188 11.578 8.397 1.00 0.00 N ATOM 2012 CA ASP B 37 7.475 12.256 8.284 1.00 0.00 C ATOM 2013 C ASP B 37 8.513 11.338 7.647 1.00 0.00 C ATOM 2014 O ASP B 37 9.063 11.645 6.588 1.00 0.00 O ATOM 2015 CB ASP B 37 7.958 12.711 9.662 1.00 0.00 C ATOM 2016 CG ASP B 37 8.936 13.866 9.580 1.00 0.00 C ATOM 2017 OD1 ASP B 37 9.321 14.239 8.452 1.00 0.00 O ATOM 2018 OD2 ASP B 37 9.319 14.397 10.644 1.00 0.00 O ATOM 0 H ASP B 37 5.892 11.392 9.355 1.00 0.00 H new ATOM 0 HA ASP B 37 7.345 13.130 7.646 1.00 0.00 H new ATOM 0 HB2 ASP B 37 7.100 13.008 10.265 1.00 0.00 H new ATOM 0 HB3 ASP B 37 8.432 11.873 10.173 1.00 0.00 H new ATOM 2023 N ILE B 38 8.772 10.208 8.296 1.00 0.00 N ATOM 2024 CA ILE B 38 9.738 9.242 7.794 1.00 0.00 C ATOM 2025 C ILE B 38 9.505 8.964 6.315 1.00 0.00 C ATOM 2026 O ILE B 38 10.440 8.977 5.514 1.00 0.00 O ATOM 2027 CB ILE B 38 9.665 7.918 8.578 1.00 0.00 C ATOM 2028 CG1 ILE B 38 9.495 8.196 10.073 1.00 0.00 C ATOM 2029 CG2 ILE B 38 10.910 7.084 8.328 1.00 0.00 C ATOM 2030 CD1 ILE B 38 8.810 7.076 10.823 1.00 0.00 C ATOM 0 H ILE B 38 8.325 9.940 9.172 1.00 0.00 H new ATOM 0 HA ILE B 38 10.729 9.676 7.929 1.00 0.00 H new ATOM 0 HB ILE B 38 8.799 7.354 8.230 1.00 0.00 H new ATOM 0 HG12 ILE B 38 10.476 8.372 10.515 1.00 0.00 H new ATOM 0 HG13 ILE B 38 8.919 9.113 10.200 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.842 6.152 8.889 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.991 6.862 7.264 1.00 0.00 H new ATOM 0 HG23 ILE B 38 11.791 7.639 8.651 1.00 0.00 H new ATOM 0 HD11 ILE B 38 8.724 7.343 11.876 1.00 0.00 H new ATOM 0 HD12 ILE B 38 7.815 6.915 10.407 1.00 0.00 H new ATOM 0 HD13 ILE B 38 9.396 6.162 10.727 1.00 0.00 H new ATOM 2042 N ALA B 39 8.249 8.721 5.958 1.00 0.00 N ATOM 2043 CA ALA B 39 7.889 8.449 4.572 1.00 0.00 C ATOM 2044 C ALA B 39 8.356 9.580 3.664 1.00 0.00 C ATOM 2045 O ALA B 39 9.011 9.345 2.648 1.00 0.00 O ATOM 2046 CB ALA B 39 6.385 8.254 4.447 1.00 0.00 C ATOM 0 H ALA B 39 7.464 8.707 6.609 1.00 0.00 H new ATOM 0 HA ALA B 39 8.387 7.531 4.259 1.00 0.00 H new ATOM 0 HB1 ALA B 39 6.130 8.052 3.407 1.00 0.00 H new ATOM 0 HB2 ALA B 39 6.074 7.413 5.067 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.872 9.157 4.777 1.00 0.00 H new ATOM 2052 N ALA B 40 8.021 10.810 4.043 1.00 0.00 N ATOM 2053 CA ALA B 40 8.412 11.979 3.269 1.00 0.00 C ATOM 2054 C ALA B 40 9.924 12.022 3.092 1.00 0.00 C ATOM 2055 O ALA B 40 10.432 11.955 1.973 1.00 0.00 O ATOM 2056 CB ALA B 40 7.918 13.249 3.945 1.00 0.00 C ATOM 0 H ALA B 40 7.480 11.021 4.882 1.00 0.00 H new ATOM 0 HA ALA B 40 7.954 11.910 2.282 1.00 0.00 H new ATOM 0 HB1 ALA B 40 8.218 14.115 3.355 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.831 13.221 4.022 1.00 0.00 H new ATOM 0 HB3 ALA B 40 8.351 13.322 4.943 1.00 0.00 H new ATOM 2062 N HIS B 41 10.639 12.125 4.207 1.00 0.00 N ATOM 2063 CA HIS B 41 12.096 12.164 4.179 1.00 0.00 C ATOM 2064 C HIS B 41 12.627 11.250 3.080 1.00 0.00 C ATOM 2065 O HIS B 41 13.385 11.681 2.210 1.00 0.00 O ATOM 2066 CB HIS B 41 12.658 11.749 5.548 1.00 0.00 C ATOM 2067 CG HIS B 41 14.043 11.175 5.499 1.00 0.00 C ATOM 2068 ND1 HIS B 41 15.103 11.703 6.208 1.00 0.00 N ATOM 2069 CD2 HIS B 41 14.538 10.108 4.828 1.00 0.00 C ATOM 2070 CE1 HIS B 41 16.187 10.984 5.974 1.00 0.00 C ATOM 2071 NE2 HIS B 41 15.871 10.011 5.141 1.00 0.00 N ATOM 0 H HIS B 41 10.233 12.183 5.141 1.00 0.00 H new ATOM 0 HA HIS B 41 12.420 13.182 3.964 1.00 0.00 H new ATOM 0 HB2 HIS B 41 12.661 12.619 6.205 1.00 0.00 H new ATOM 0 HB3 HIS B 41 11.988 11.014 5.995 1.00 0.00 H new ATOM 0 HD1 HIS B 41 15.057 12.520 6.817 1.00 0.00 H new ATOM 0 HD2 HIS B 41 13.986 9.454 4.169 1.00 0.00 H new ATOM 0 HE1 HIS B 41 17.166 11.163 6.394 1.00 0.00 H new ATOM 2080 N ILE B 42 12.221 9.985 3.126 1.00 0.00 N ATOM 2081 CA ILE B 42 12.650 9.007 2.135 1.00 0.00 C ATOM 2082 C ILE B 42 12.416 9.521 0.721 1.00 0.00 C ATOM 2083 O ILE B 42 13.362 9.828 -0.004 1.00 0.00 O ATOM 2084 CB ILE B 42 11.909 7.667 2.309 1.00 0.00 C ATOM 2085 CG1 ILE B 42 12.063 7.152 3.741 1.00 0.00 C ATOM 2086 CG2 ILE B 42 12.429 6.643 1.312 1.00 0.00 C ATOM 2087 CD1 ILE B 42 10.912 6.278 4.197 1.00 0.00 C ATOM 0 H ILE B 42 11.595 9.614 3.840 1.00 0.00 H new ATOM 0 HA ILE B 42 13.717 8.847 2.291 1.00 0.00 H new ATOM 0 HB ILE B 42 10.848 7.828 2.116 1.00 0.00 H new ATOM 0 HG12 ILE B 42 12.991 6.585 3.817 1.00 0.00 H new ATOM 0 HG13 ILE B 42 12.153 8.003 4.417 1.00 0.00 H new ATOM 0 HG21 ILE B 42 11.897 5.701 1.446 1.00 0.00 H new ATOM 0 HG22 ILE B 42 12.269 7.009 0.298 1.00 0.00 H new ATOM 0 HG23 ILE B 42 13.495 6.484 1.476 1.00 0.00 H new ATOM 0 HD11 ILE B 42 11.089 5.949 5.221 1.00 0.00 H new ATOM 0 HD12 ILE B 42 9.983 6.847 4.154 1.00 0.00 H new ATOM 0 HD13 ILE B 42 10.835 5.408 3.545 1.00 0.00 H new ATOM 2099 N LYS B 43 11.148 9.612 0.332 1.00 0.00 N ATOM 2100 CA LYS B 43 10.793 10.087 -0.999 1.00 0.00 C ATOM 2101 C LYS B 43 11.761 11.169 -1.467 1.00 0.00 C ATOM 2102 O LYS B 43 12.477 10.991 -2.452 1.00 0.00 O ATOM 2103 CB LYS B 43 9.362 10.629 -1.006 1.00 0.00 C ATOM 2104 CG LYS B 43 8.912 11.140 -2.366 1.00 0.00 C ATOM 2105 CD LYS B 43 9.115 12.642 -2.491 1.00 0.00 C ATOM 2106 CE LYS B 43 7.808 13.360 -2.786 1.00 0.00 C ATOM 2107 NZ LYS B 43 6.778 12.438 -3.341 1.00 0.00 N ATOM 0 H LYS B 43 10.352 9.363 0.919 1.00 0.00 H new ATOM 0 HA LYS B 43 10.858 9.244 -1.687 1.00 0.00 H new ATOM 0 HB2 LYS B 43 8.682 9.842 -0.680 1.00 0.00 H new ATOM 0 HB3 LYS B 43 9.285 11.438 -0.279 1.00 0.00 H new ATOM 0 HG2 LYS B 43 9.470 10.630 -3.151 1.00 0.00 H new ATOM 0 HG3 LYS B 43 7.859 10.900 -2.516 1.00 0.00 H new ATOM 0 HD2 LYS B 43 9.544 13.030 -1.567 1.00 0.00 H new ATOM 0 HD3 LYS B 43 9.832 12.848 -3.286 1.00 0.00 H new ATOM 0 HE2 LYS B 43 7.431 13.817 -1.871 1.00 0.00 H new ATOM 0 HE3 LYS B 43 7.990 14.168 -3.494 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 6.022 12.993 -3.791 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 7.216 11.813 -4.047 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 6.376 11.864 -2.573 1.00 0.00 H new ATOM 2121 N LYS B 44 11.778 12.290 -0.754 1.00 0.00 N ATOM 2122 CA LYS B 44 12.657 13.401 -1.095 1.00 0.00 C ATOM 2123 C LYS B 44 14.072 12.913 -1.384 1.00 0.00 C ATOM 2124 O LYS B 44 14.721 13.375 -2.323 1.00 0.00 O ATOM 2125 CB LYS B 44 12.683 14.426 0.041 1.00 0.00 C ATOM 2126 CG LYS B 44 11.308 14.952 0.414 1.00 0.00 C ATOM 2127 CD LYS B 44 11.226 16.461 0.243 1.00 0.00 C ATOM 2128 CE LYS B 44 11.058 16.848 -1.217 1.00 0.00 C ATOM 2129 NZ LYS B 44 9.737 17.484 -1.474 1.00 0.00 N ATOM 0 H LYS B 44 11.192 12.453 0.065 1.00 0.00 H new ATOM 0 HA LYS B 44 12.265 13.874 -1.996 1.00 0.00 H new ATOM 0 HB2 LYS B 44 13.140 13.971 0.920 1.00 0.00 H new ATOM 0 HB3 LYS B 44 13.317 15.263 -0.250 1.00 0.00 H new ATOM 0 HG2 LYS B 44 10.552 14.472 -0.208 1.00 0.00 H new ATOM 0 HG3 LYS B 44 11.084 14.689 1.448 1.00 0.00 H new ATOM 0 HD2 LYS B 44 10.388 16.849 0.822 1.00 0.00 H new ATOM 0 HD3 LYS B 44 12.129 16.923 0.641 1.00 0.00 H new ATOM 0 HE2 LYS B 44 11.854 17.535 -1.504 1.00 0.00 H new ATOM 0 HE3 LYS B 44 11.162 15.961 -1.842 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 9.662 17.733 -2.481 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 8.977 16.819 -1.224 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 9.648 18.345 -0.897 1.00 0.00 H new ATOM 2143 N GLU B 45 14.544 11.975 -0.572 1.00 0.00 N ATOM 2144 CA GLU B 45 15.884 11.425 -0.740 1.00 0.00 C ATOM 2145 C GLU B 45 15.969 10.577 -2.004 1.00 0.00 C ATOM 2146 O GLU B 45 16.931 10.675 -2.765 1.00 0.00 O ATOM 2147 CB GLU B 45 16.266 10.584 0.478 1.00 0.00 C ATOM 2148 CG GLU B 45 17.667 10.865 0.995 1.00 0.00 C ATOM 2149 CD GLU B 45 17.843 12.303 1.444 1.00 0.00 C ATOM 2150 OE1 GLU B 45 17.207 12.694 2.445 1.00 0.00 O ATOM 2151 OE2 GLU B 45 18.614 13.038 0.794 1.00 0.00 O ATOM 0 H GLU B 45 14.020 11.579 0.209 1.00 0.00 H new ATOM 0 HA GLU B 45 16.583 12.256 -0.834 1.00 0.00 H new ATOM 0 HB2 GLU B 45 15.549 10.770 1.277 1.00 0.00 H new ATOM 0 HB3 GLU B 45 16.188 9.528 0.219 1.00 0.00 H new ATOM 0 HG2 GLU B 45 17.883 10.198 1.830 1.00 0.00 H new ATOM 0 HG3 GLU B 45 18.391 10.641 0.212 1.00 0.00 H new ATOM 2158 N PHE B 46 14.957 9.743 -2.219 1.00 0.00 N ATOM 2159 CA PHE B 46 14.920 8.877 -3.390 1.00 0.00 C ATOM 2160 C PHE B 46 14.794 9.696 -4.669 1.00 0.00 C ATOM 2161 O PHE B 46 15.271 9.289 -5.728 1.00 0.00 O ATOM 2162 CB PHE B 46 13.753 7.895 -3.285 1.00 0.00 C ATOM 2163 CG PHE B 46 14.177 6.503 -2.922 1.00 0.00 C ATOM 2164 CD1 PHE B 46 14.532 6.192 -1.620 1.00 0.00 C ATOM 2165 CD2 PHE B 46 14.222 5.506 -3.883 1.00 0.00 C ATOM 2166 CE1 PHE B 46 14.924 4.911 -1.283 1.00 0.00 C ATOM 2167 CE2 PHE B 46 14.612 4.224 -3.552 1.00 0.00 C ATOM 2168 CZ PHE B 46 14.965 3.926 -2.250 1.00 0.00 C ATOM 0 H PHE B 46 14.153 9.649 -1.598 1.00 0.00 H new ATOM 0 HA PHE B 46 15.856 8.319 -3.428 1.00 0.00 H new ATOM 0 HB2 PHE B 46 13.048 8.259 -2.538 1.00 0.00 H new ATOM 0 HB3 PHE B 46 13.223 7.869 -4.237 1.00 0.00 H new ATOM 0 HD1 PHE B 46 14.502 6.959 -0.860 1.00 0.00 H new ATOM 0 HD2 PHE B 46 13.949 5.734 -4.903 1.00 0.00 H new ATOM 0 HE1 PHE B 46 15.198 4.680 -0.264 1.00 0.00 H new ATOM 0 HE2 PHE B 46 14.641 3.455 -4.310 1.00 0.00 H new ATOM 0 HZ PHE B 46 15.273 2.924 -1.989 1.00 0.00 H new ATOM 2178 N ASP B 47 14.150 10.852 -4.564 1.00 0.00 N ATOM 2179 CA ASP B 47 13.965 11.728 -5.714 1.00 0.00 C ATOM 2180 C ASP B 47 15.277 12.400 -6.095 1.00 0.00 C ATOM 2181 O ASP B 47 15.596 12.541 -7.276 1.00 0.00 O ATOM 2182 CB ASP B 47 12.901 12.786 -5.409 1.00 0.00 C ATOM 2183 CG ASP B 47 13.502 14.112 -4.986 1.00 0.00 C ATOM 2184 OD1 ASP B 47 14.190 14.743 -5.815 1.00 0.00 O ATOM 2185 OD2 ASP B 47 13.282 14.521 -3.826 1.00 0.00 O ATOM 0 H ASP B 47 13.748 11.204 -3.695 1.00 0.00 H new ATOM 0 HA ASP B 47 13.630 11.122 -6.556 1.00 0.00 H new ATOM 0 HB2 ASP B 47 12.281 12.938 -6.293 1.00 0.00 H new ATOM 0 HB3 ASP B 47 12.246 12.420 -4.619 1.00 0.00 H new ATOM 2190 N LYS B 48 16.033 12.816 -5.086 1.00 0.00 N ATOM 2191 CA LYS B 48 17.309 13.478 -5.312 1.00 0.00 C ATOM 2192 C LYS B 48 18.449 12.466 -5.368 1.00 0.00 C ATOM 2193 O LYS B 48 19.534 12.766 -5.869 1.00 0.00 O ATOM 2194 CB LYS B 48 17.575 14.506 -4.211 1.00 0.00 C ATOM 2195 CG LYS B 48 17.252 15.932 -4.621 1.00 0.00 C ATOM 2196 CD LYS B 48 18.426 16.589 -5.330 1.00 0.00 C ATOM 2197 CE LYS B 48 18.603 16.044 -6.738 1.00 0.00 C ATOM 2198 NZ LYS B 48 19.793 16.630 -7.414 1.00 0.00 N ATOM 0 H LYS B 48 15.783 12.706 -4.103 1.00 0.00 H new ATOM 0 HA LYS B 48 17.258 13.990 -6.273 1.00 0.00 H new ATOM 0 HB2 LYS B 48 16.984 14.247 -3.333 1.00 0.00 H new ATOM 0 HB3 LYS B 48 18.623 14.449 -3.918 1.00 0.00 H new ATOM 0 HG2 LYS B 48 16.382 15.934 -5.277 1.00 0.00 H new ATOM 0 HG3 LYS B 48 16.987 16.514 -3.738 1.00 0.00 H new ATOM 0 HD2 LYS B 48 18.269 17.667 -5.373 1.00 0.00 H new ATOM 0 HD3 LYS B 48 19.338 16.422 -4.757 1.00 0.00 H new ATOM 0 HE2 LYS B 48 18.706 14.960 -6.697 1.00 0.00 H new ATOM 0 HE3 LYS B 48 17.710 16.258 -7.325 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 19.879 16.233 -8.371 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 19.684 17.662 -7.476 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 20.649 16.404 -6.868 1.00 0.00 H new ATOM 2212 N LYS B 49 18.196 11.268 -4.854 1.00 0.00 N ATOM 2213 CA LYS B 49 19.203 10.213 -4.846 1.00 0.00 C ATOM 2214 C LYS B 49 19.143 9.398 -6.135 1.00 0.00 C ATOM 2215 O LYS B 49 20.170 8.966 -6.655 1.00 0.00 O ATOM 2216 CB LYS B 49 19.004 9.292 -3.640 1.00 0.00 C ATOM 2217 CG LYS B 49 20.291 8.652 -3.145 1.00 0.00 C ATOM 2218 CD LYS B 49 20.011 7.399 -2.330 1.00 0.00 C ATOM 2219 CE LYS B 49 20.780 6.201 -2.866 1.00 0.00 C ATOM 2220 NZ LYS B 49 20.870 6.214 -4.352 1.00 0.00 N ATOM 0 H LYS B 49 17.303 11.003 -4.438 1.00 0.00 H new ATOM 0 HA LYS B 49 20.184 10.683 -4.775 1.00 0.00 H new ATOM 0 HB2 LYS B 49 18.556 9.863 -2.827 1.00 0.00 H new ATOM 0 HB3 LYS B 49 18.296 8.507 -3.906 1.00 0.00 H new ATOM 0 HG2 LYS B 49 20.924 8.400 -3.996 1.00 0.00 H new ATOM 0 HG3 LYS B 49 20.844 9.367 -2.536 1.00 0.00 H new ATOM 0 HD2 LYS B 49 20.285 7.572 -1.289 1.00 0.00 H new ATOM 0 HD3 LYS B 49 18.943 7.184 -2.347 1.00 0.00 H new ATOM 0 HE2 LYS B 49 21.784 6.196 -2.442 1.00 0.00 H new ATOM 0 HE3 LYS B 49 20.292 5.282 -2.541 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 21.402 5.381 -4.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 19.913 6.193 -4.758 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 21.359 7.078 -4.663 1.00 0.00 H new ATOM 2234 N TYR B 50 17.932 9.192 -6.642 1.00 0.00 N ATOM 2235 CA TYR B 50 17.740 8.427 -7.868 1.00 0.00 C ATOM 2236 C TYR B 50 16.989 9.246 -8.915 1.00 0.00 C ATOM 2237 O TYR B 50 17.487 9.455 -10.021 1.00 0.00 O ATOM 2238 CB TYR B 50 16.974 7.134 -7.575 1.00 0.00 C ATOM 2239 CG TYR B 50 17.405 6.441 -6.301 1.00 0.00 C ATOM 2240 CD1 TYR B 50 17.035 6.937 -5.056 1.00 0.00 C ATOM 2241 CD2 TYR B 50 18.181 5.289 -6.343 1.00 0.00 C ATOM 2242 CE1 TYR B 50 17.426 6.306 -3.891 1.00 0.00 C ATOM 2243 CE2 TYR B 50 18.575 4.651 -5.181 1.00 0.00 C ATOM 2244 CZ TYR B 50 18.196 5.164 -3.959 1.00 0.00 C ATOM 2245 OH TYR B 50 18.586 4.532 -2.800 1.00 0.00 O ATOM 0 H TYR B 50 17.071 9.543 -6.224 1.00 0.00 H new ATOM 0 HA TYR B 50 18.725 8.179 -8.265 1.00 0.00 H new ATOM 0 HB2 TYR B 50 15.910 7.360 -7.512 1.00 0.00 H new ATOM 0 HB3 TYR B 50 17.105 6.448 -8.412 1.00 0.00 H new ATOM 0 HD1 TYR B 50 16.432 7.831 -4.999 1.00 0.00 H new ATOM 0 HD2 TYR B 50 18.481 4.885 -7.299 1.00 0.00 H new ATOM 0 HE1 TYR B 50 17.130 6.705 -2.932 1.00 0.00 H new ATOM 0 HE2 TYR B 50 19.177 3.755 -5.231 1.00 0.00 H new ATOM 0 HH TYR B 50 17.793 4.256 -2.295 1.00 0.00 H new ATOM 2255 N ASN B 51 15.789 9.700 -8.549 1.00 0.00 N ATOM 2256 CA ASN B 51 14.942 10.493 -9.437 1.00 0.00 C ATOM 2257 C ASN B 51 13.478 10.324 -9.040 1.00 0.00 C ATOM 2258 O ASN B 51 12.950 9.213 -9.058 1.00 0.00 O ATOM 2259 CB ASN B 51 15.130 10.074 -10.898 1.00 0.00 C ATOM 2260 CG ASN B 51 14.631 8.667 -11.166 1.00 0.00 C ATOM 2261 OD1 ASN B 51 15.328 7.689 -10.896 1.00 0.00 O ATOM 2262 ND2 ASN B 51 13.420 8.559 -11.701 1.00 0.00 N ATOM 0 H ASN B 51 15.379 9.528 -7.631 1.00 0.00 H new ATOM 0 HA ASN B 51 15.232 11.539 -9.340 1.00 0.00 H new ATOM 0 HB2 ASN B 51 14.600 10.774 -11.545 1.00 0.00 H new ATOM 0 HB3 ASN B 51 16.187 10.137 -11.158 1.00 0.00 H new ATOM 0 HD21 ASN B 51 13.033 7.638 -11.904 1.00 0.00 H new ATOM 0 HD22 ASN B 51 12.877 9.397 -11.908 1.00 0.00 H new ATOM 2269 N PRO B 52 12.798 11.422 -8.669 1.00 0.00 N ATOM 2270 CA PRO B 52 11.392 11.370 -8.260 1.00 0.00 C ATOM 2271 C PRO B 52 10.481 10.808 -9.357 1.00 0.00 C ATOM 2272 O PRO B 52 10.910 10.658 -10.501 1.00 0.00 O ATOM 2273 CB PRO B 52 11.038 12.831 -7.962 1.00 0.00 C ATOM 2274 CG PRO B 52 12.098 13.637 -8.630 1.00 0.00 C ATOM 2275 CD PRO B 52 13.336 12.789 -8.608 1.00 0.00 C ATOM 0 HA PRO B 52 11.249 10.707 -7.407 1.00 0.00 H new ATOM 0 HB2 PRO B 52 10.050 13.083 -8.348 1.00 0.00 H new ATOM 0 HB3 PRO B 52 11.018 13.020 -6.889 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.813 13.886 -9.652 1.00 0.00 H new ATOM 0 HG3 PRO B 52 12.261 14.579 -8.106 1.00 0.00 H new ATOM 0 HD2 PRO B 52 13.989 13.005 -9.454 1.00 0.00 H new ATOM 0 HD3 PRO B 52 13.922 12.953 -7.704 1.00 0.00 H new ATOM 2283 N THR B 53 9.221 10.495 -9.013 1.00 0.00 N ATOM 2284 CA THR B 53 8.705 10.671 -7.656 1.00 0.00 C ATOM 2285 C THR B 53 8.410 9.325 -7.005 1.00 0.00 C ATOM 2286 O THR B 53 7.590 8.550 -7.497 1.00 0.00 O ATOM 2287 CB THR B 53 7.452 11.551 -7.671 1.00 0.00 C ATOM 2288 OG1 THR B 53 7.307 12.235 -6.438 1.00 0.00 O ATOM 2289 CG2 THR B 53 6.174 10.782 -7.919 1.00 0.00 C ATOM 0 H THR B 53 8.538 10.115 -9.668 1.00 0.00 H new ATOM 0 HA THR B 53 9.471 11.170 -7.062 1.00 0.00 H new ATOM 0 HB THR B 53 7.601 12.245 -8.498 1.00 0.00 H new ATOM 0 HG1 THR B 53 6.502 12.794 -6.466 1.00 0.00 H new ATOM 0 HG21 THR B 53 5.329 11.470 -7.916 1.00 0.00 H new ATOM 0 HG22 THR B 53 6.232 10.283 -8.886 1.00 0.00 H new ATOM 0 HG23 THR B 53 6.039 10.038 -7.134 1.00 0.00 H new ATOM 2297 N TRP B 54 9.094 9.054 -5.901 1.00 0.00 N ATOM 2298 CA TRP B 54 8.916 7.799 -5.182 1.00 0.00 C ATOM 2299 C TRP B 54 7.843 7.922 -4.107 1.00 0.00 C ATOM 2300 O TRP B 54 8.024 8.633 -3.118 1.00 0.00 O ATOM 2301 CB TRP B 54 10.231 7.366 -4.535 1.00 0.00 C ATOM 2302 CG TRP B 54 11.362 7.228 -5.504 1.00 0.00 C ATOM 2303 CD1 TRP B 54 11.961 8.228 -6.214 1.00 0.00 C ATOM 2304 CD2 TRP B 54 12.032 6.018 -5.868 1.00 0.00 C ATOM 2305 NE1 TRP B 54 12.963 7.714 -6.999 1.00 0.00 N ATOM 2306 CE2 TRP B 54 13.028 6.357 -6.802 1.00 0.00 C ATOM 2307 CE3 TRP B 54 11.887 4.680 -5.492 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 13.874 5.404 -7.367 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 12.726 3.736 -6.051 1.00 0.00 C ATOM 2310 CH2 TRP B 54 13.709 4.100 -6.978 1.00 0.00 C ATOM 0 H TRP B 54 9.777 9.686 -5.484 1.00 0.00 H new ATOM 0 HA TRP B 54 8.599 7.049 -5.906 1.00 0.00 H new ATOM 0 HB2 TRP B 54 10.506 8.093 -3.771 1.00 0.00 H new ATOM 0 HB3 TRP B 54 10.080 6.413 -4.029 1.00 0.00 H new ATOM 0 HD1 TRP B 54 11.687 9.271 -6.165 1.00 0.00 H new ATOM 0 HE1 TRP B 54 13.561 8.252 -7.626 1.00 0.00 H new ATOM 0 HE3 TRP B 54 11.132 4.389 -4.777 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 14.631 5.683 -8.085 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 12.622 2.699 -5.768 1.00 0.00 H new ATOM 0 HH2 TRP B 54 14.351 3.338 -7.395 1.00 0.00 H new ATOM 2321 N HIS B 55 6.737 7.206 -4.288 1.00 0.00 N ATOM 2322 CA HIS B 55 5.659 7.226 -3.307 1.00 0.00 C ATOM 2323 C HIS B 55 6.096 6.450 -2.074 1.00 0.00 C ATOM 2324 O HIS B 55 6.359 5.250 -2.150 1.00 0.00 O ATOM 2325 CB HIS B 55 4.381 6.623 -3.893 1.00 0.00 C ATOM 2326 CG HIS B 55 3.982 7.227 -5.203 1.00 0.00 C ATOM 2327 ND1 HIS B 55 4.517 8.404 -5.685 1.00 0.00 N ATOM 2328 CD2 HIS B 55 3.095 6.810 -6.137 1.00 0.00 C ATOM 2329 CE1 HIS B 55 3.977 8.683 -6.858 1.00 0.00 C ATOM 2330 NE2 HIS B 55 3.112 7.732 -7.155 1.00 0.00 N ATOM 0 H HIS B 55 6.565 6.610 -5.098 1.00 0.00 H new ATOM 0 HA HIS B 55 5.444 8.258 -3.031 1.00 0.00 H new ATOM 0 HB2 HIS B 55 4.522 5.550 -4.025 1.00 0.00 H new ATOM 0 HB3 HIS B 55 3.567 6.752 -3.179 1.00 0.00 H new ATOM 0 HD1 HIS B 55 5.220 8.970 -5.210 1.00 0.00 H new ATOM 0 HD2 HIS B 55 2.487 5.918 -6.090 1.00 0.00 H new ATOM 0 HE1 HIS B 55 4.205 9.543 -7.470 1.00 0.00 H new ATOM 2339 N CYS B 56 6.206 7.138 -0.946 1.00 0.00 N ATOM 2340 CA CYS B 56 6.652 6.497 0.281 1.00 0.00 C ATOM 2341 C CYS B 56 5.570 6.473 1.350 1.00 0.00 C ATOM 2342 O CYS B 56 4.895 7.471 1.598 1.00 0.00 O ATOM 2343 CB CYS B 56 7.893 7.209 0.818 1.00 0.00 C ATOM 2344 SG CYS B 56 9.046 7.745 -0.467 1.00 0.00 S ATOM 0 H CYS B 56 5.994 8.132 -0.856 1.00 0.00 H new ATOM 0 HA CYS B 56 6.891 5.462 0.036 1.00 0.00 H new ATOM 0 HB2 CYS B 56 7.579 8.078 1.396 1.00 0.00 H new ATOM 0 HB3 CYS B 56 8.414 6.541 1.504 1.00 0.00 H new ATOM 0 HG CYS B 56 8.380 8.222 -1.476 1.00 0.00 H new ATOM 2350 N ILE B 57 5.436 5.322 1.996 1.00 0.00 N ATOM 2351 CA ILE B 57 4.463 5.142 3.064 1.00 0.00 C ATOM 2352 C ILE B 57 5.070 4.313 4.188 1.00 0.00 C ATOM 2353 O ILE B 57 5.233 3.100 4.059 1.00 0.00 O ATOM 2354 CB ILE B 57 3.182 4.461 2.566 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.490 5.356 1.534 1.00 0.00 C ATOM 2356 CG2 ILE B 57 2.261 4.159 3.744 1.00 0.00 C ATOM 2357 CD1 ILE B 57 1.088 4.917 1.186 1.00 0.00 C ATOM 0 H ILE B 57 5.995 4.492 1.796 1.00 0.00 H new ATOM 0 HA ILE B 57 4.197 6.133 3.431 1.00 0.00 H new ATOM 0 HB ILE B 57 3.433 3.516 2.085 1.00 0.00 H new ATOM 0 HG12 ILE B 57 2.456 6.376 1.917 1.00 0.00 H new ATOM 0 HG13 ILE B 57 3.090 5.376 0.624 1.00 0.00 H new ATOM 0 HG21 ILE B 57 1.354 3.676 3.382 1.00 0.00 H new ATOM 0 HG22 ILE B 57 2.771 3.497 4.444 1.00 0.00 H new ATOM 0 HG23 ILE B 57 2.000 5.089 4.249 1.00 0.00 H new ATOM 0 HD11 ILE B 57 0.665 5.600 0.450 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.115 3.909 0.772 1.00 0.00 H new ATOM 0 HD13 ILE B 57 0.471 4.924 2.084 1.00 0.00 H new ATOM 2369 N VAL B 58 5.418 4.978 5.283 1.00 0.00 N ATOM 2370 CA VAL B 58 6.027 4.302 6.419 1.00 0.00 C ATOM 2371 C VAL B 58 5.106 4.297 7.630 1.00 0.00 C ATOM 2372 O VAL B 58 4.640 5.345 8.077 1.00 0.00 O ATOM 2373 CB VAL B 58 7.365 4.955 6.808 1.00 0.00 C ATOM 2374 CG1 VAL B 58 7.198 6.457 6.955 1.00 0.00 C ATOM 2375 CG2 VAL B 58 7.909 4.343 8.090 1.00 0.00 C ATOM 0 H VAL B 58 5.289 5.982 5.407 1.00 0.00 H new ATOM 0 HA VAL B 58 6.206 3.273 6.107 1.00 0.00 H new ATOM 0 HB VAL B 58 8.086 4.767 6.012 1.00 0.00 H new ATOM 0 HG11 VAL B 58 8.153 6.904 7.230 1.00 0.00 H new ATOM 0 HG12 VAL B 58 6.859 6.880 6.009 1.00 0.00 H new ATOM 0 HG13 VAL B 58 6.462 6.667 7.731 1.00 0.00 H new ATOM 0 HG21 VAL B 58 8.855 4.819 8.347 1.00 0.00 H new ATOM 0 HG22 VAL B 58 7.194 4.497 8.898 1.00 0.00 H new ATOM 0 HG23 VAL B 58 8.068 3.275 7.944 1.00 0.00 H new ATOM 2385 N GLY B 59 4.859 3.107 8.158 1.00 0.00 N ATOM 2386 CA GLY B 59 4.006 2.969 9.319 1.00 0.00 C ATOM 2387 C GLY B 59 4.460 1.837 10.215 1.00 0.00 C ATOM 2388 O GLY B 59 5.640 1.739 10.550 1.00 0.00 O ATOM 0 H GLY B 59 5.237 2.230 7.800 1.00 0.00 H new ATOM 0 HA2 GLY B 59 4.005 3.902 9.883 1.00 0.00 H new ATOM 0 HA3 GLY B 59 2.980 2.790 8.998 1.00 0.00 H new ATOM 2392 N ARG B 60 3.526 0.982 10.607 1.00 0.00 N ATOM 2393 CA ARG B 60 3.843 -0.140 11.468 1.00 0.00 C ATOM 2394 C ARG B 60 2.705 -1.154 11.489 1.00 0.00 C ATOM 2395 O ARG B 60 2.790 -2.182 12.160 1.00 0.00 O ATOM 2396 CB ARG B 60 4.127 0.363 12.875 1.00 0.00 C ATOM 2397 CG ARG B 60 3.164 1.442 13.340 1.00 0.00 C ATOM 2398 CD ARG B 60 3.753 2.260 14.478 1.00 0.00 C ATOM 2399 NE ARG B 60 3.287 1.799 15.783 1.00 0.00 N ATOM 2400 CZ ARG B 60 3.708 2.308 16.936 1.00 0.00 C ATOM 2401 NH1 ARG B 60 4.600 3.290 16.944 1.00 0.00 N ATOM 2402 NH2 ARG B 60 3.236 1.838 18.083 1.00 0.00 N ATOM 0 H ARG B 60 2.544 1.047 10.341 1.00 0.00 H new ATOM 0 HA ARG B 60 4.729 -0.640 11.076 1.00 0.00 H new ATOM 0 HB2 ARG B 60 4.081 -0.477 13.568 1.00 0.00 H new ATOM 0 HB3 ARG B 60 5.144 0.754 12.914 1.00 0.00 H new ATOM 0 HG2 ARG B 60 2.922 2.100 12.505 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.231 0.983 13.665 1.00 0.00 H new ATOM 0 HD2 ARG B 60 4.841 2.202 14.441 1.00 0.00 H new ATOM 0 HD3 ARG B 60 3.485 3.308 14.347 1.00 0.00 H new ATOM 0 HE ARG B 60 2.601 1.045 15.811 1.00 0.00 H new ATOM 0 HH11 ARG B 60 4.964 3.656 16.064 1.00 0.00 H new ATOM 0 HH12 ARG B 60 4.922 3.679 17.830 1.00 0.00 H new ATOM 0 HH21 ARG B 60 2.549 1.084 18.081 1.00 0.00 H new ATOM 0 HH22 ARG B 60 3.560 2.230 18.967 1.00 0.00 H new ATOM 2416 N ASN B 61 1.641 -0.858 10.750 1.00 0.00 N ATOM 2417 CA ASN B 61 0.489 -1.748 10.686 1.00 0.00 C ATOM 2418 C ASN B 61 -0.528 -1.257 9.661 1.00 0.00 C ATOM 2419 O ASN B 61 -1.735 -1.422 9.843 1.00 0.00 O ATOM 2420 CB ASN B 61 -0.170 -1.866 12.062 1.00 0.00 C ATOM 2421 CG ASN B 61 -0.076 -3.270 12.627 1.00 0.00 C ATOM 2422 OD1 ASN B 61 0.468 -4.172 11.991 1.00 0.00 O ATOM 2423 ND2 ASN B 61 -0.606 -3.462 13.830 1.00 0.00 N ATOM 0 H ASN B 61 1.553 -0.011 10.189 1.00 0.00 H new ATOM 0 HA ASN B 61 0.842 -2.731 10.375 1.00 0.00 H new ATOM 0 HB2 ASN B 61 0.305 -1.167 12.751 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -1.218 -1.577 11.986 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -0.571 -4.386 14.261 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -1.048 -2.686 14.323 1.00 0.00 H new ATOM 2430 N PHE B 62 -0.036 -0.657 8.580 1.00 0.00 N ATOM 2431 CA PHE B 62 -0.908 -0.150 7.530 1.00 0.00 C ATOM 2432 C PHE B 62 -1.087 -1.191 6.429 1.00 0.00 C ATOM 2433 O PHE B 62 -0.316 -2.145 6.329 1.00 0.00 O ATOM 2434 CB PHE B 62 -0.340 1.141 6.941 1.00 0.00 C ATOM 2435 CG PHE B 62 0.853 0.922 6.055 1.00 0.00 C ATOM 2436 CD1 PHE B 62 2.043 0.445 6.581 1.00 0.00 C ATOM 2437 CD2 PHE B 62 0.784 1.192 4.698 1.00 0.00 C ATOM 2438 CE1 PHE B 62 3.141 0.240 5.770 1.00 0.00 C ATOM 2439 CE2 PHE B 62 1.881 0.990 3.881 1.00 0.00 C ATOM 2440 CZ PHE B 62 3.061 0.513 4.418 1.00 0.00 C ATOM 0 H PHE B 62 0.959 -0.511 8.411 1.00 0.00 H new ATOM 0 HA PHE B 62 -1.882 0.062 7.971 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -1.120 1.644 6.369 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -0.060 1.810 7.755 1.00 0.00 H new ATOM 0 HD1 PHE B 62 2.112 0.231 7.637 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -0.137 1.564 4.274 1.00 0.00 H new ATOM 0 HE1 PHE B 62 4.062 -0.134 6.192 1.00 0.00 H new ATOM 0 HE2 PHE B 62 1.815 1.205 2.825 1.00 0.00 H new ATOM 0 HZ PHE B 62 3.919 0.354 3.782 1.00 0.00 H new ATOM 2450 N GLY B 63 -2.107 -0.993 5.604 1.00 0.00 N ATOM 2451 CA GLY B 63 -2.373 -1.913 4.515 1.00 0.00 C ATOM 2452 C GLY B 63 -2.266 -1.234 3.166 1.00 0.00 C ATOM 2453 O GLY B 63 -3.274 -0.852 2.572 1.00 0.00 O ATOM 0 H GLY B 63 -2.757 -0.209 5.670 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -1.669 -2.744 4.561 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.371 -2.335 4.631 1.00 0.00 H new ATOM 2457 N SER B 64 -1.038 -1.072 2.689 1.00 0.00 N ATOM 2458 CA SER B 64 -0.796 -0.419 1.408 1.00 0.00 C ATOM 2459 C SER B 64 -1.084 -1.358 0.243 1.00 0.00 C ATOM 2460 O SER B 64 -0.573 -2.477 0.186 1.00 0.00 O ATOM 2461 CB SER B 64 0.645 0.084 1.329 1.00 0.00 C ATOM 2462 OG SER B 64 1.562 -0.929 1.704 1.00 0.00 O ATOM 0 H SER B 64 -0.194 -1.384 3.170 1.00 0.00 H new ATOM 0 HA SER B 64 -1.475 0.430 1.336 1.00 0.00 H new ATOM 0 HB2 SER B 64 0.862 0.417 0.314 1.00 0.00 H new ATOM 0 HB3 SER B 64 0.767 0.949 1.981 1.00 0.00 H new ATOM 0 HG SER B 64 2.012 -0.671 2.535 1.00 0.00 H new ATOM 2468 N TYR B 65 -1.901 -0.884 -0.689 1.00 0.00 N ATOM 2469 CA TYR B 65 -2.261 -1.661 -1.866 1.00 0.00 C ATOM 2470 C TYR B 65 -2.223 -0.784 -3.112 1.00 0.00 C ATOM 2471 O TYR B 65 -3.259 -0.480 -3.707 1.00 0.00 O ATOM 2472 CB TYR B 65 -3.652 -2.276 -1.700 1.00 0.00 C ATOM 2473 CG TYR B 65 -3.922 -3.425 -2.646 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -3.376 -4.682 -2.417 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -4.722 -3.251 -3.769 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -3.620 -5.733 -3.280 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -4.970 -4.298 -4.637 1.00 0.00 C ATOM 2478 CZ TYR B 65 -4.417 -5.537 -4.388 1.00 0.00 C ATOM 2479 OH TYR B 65 -4.661 -6.581 -5.249 1.00 0.00 O ATOM 0 H TYR B 65 -2.329 0.041 -0.651 1.00 0.00 H new ATOM 0 HA TYR B 65 -1.536 -2.467 -1.979 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -3.765 -2.626 -0.674 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -4.403 -1.502 -1.857 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -2.751 -4.840 -1.551 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -5.157 -2.282 -3.967 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -3.188 -6.704 -3.088 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -5.594 -4.147 -5.506 1.00 0.00 H new ATOM 0 HH TYR B 65 -5.242 -6.276 -5.977 1.00 0.00 H new ATOM 2489 N VAL B 66 -1.019 -0.372 -3.493 1.00 0.00 N ATOM 2490 CA VAL B 66 -0.833 0.477 -4.661 1.00 0.00 C ATOM 2491 C VAL B 66 -0.120 -0.275 -5.778 1.00 0.00 C ATOM 2492 O VAL B 66 0.657 -1.195 -5.524 1.00 0.00 O ATOM 2493 CB VAL B 66 -0.026 1.741 -4.308 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -0.735 2.539 -3.225 1.00 0.00 C ATOM 2495 CG2 VAL B 66 1.384 1.370 -3.870 1.00 0.00 C ATOM 0 H VAL B 66 -0.155 -0.614 -3.007 1.00 0.00 H new ATOM 0 HA VAL B 66 -1.825 0.771 -5.003 1.00 0.00 H new ATOM 0 HB VAL B 66 0.048 2.364 -5.199 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -0.151 3.429 -2.988 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -1.722 2.836 -3.579 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.840 1.925 -2.331 1.00 0.00 H new ATOM 0 HG21 VAL B 66 1.939 2.276 -3.625 1.00 0.00 H new ATOM 0 HG22 VAL B 66 1.335 0.726 -2.992 1.00 0.00 H new ATOM 0 HG23 VAL B 66 1.889 0.843 -4.679 1.00 0.00 H new ATOM 2505 N THR B 67 -0.389 0.123 -7.016 1.00 0.00 N ATOM 2506 CA THR B 67 0.227 -0.513 -8.173 1.00 0.00 C ATOM 2507 C THR B 67 1.634 0.028 -8.406 1.00 0.00 C ATOM 2508 O THR B 67 1.822 1.225 -8.622 1.00 0.00 O ATOM 2509 CB THR B 67 -0.632 -0.293 -9.416 1.00 0.00 C ATOM 2510 OG1 THR B 67 -0.317 -1.243 -10.418 1.00 0.00 O ATOM 2511 CG2 THR B 67 -0.465 1.082 -10.018 1.00 0.00 C ATOM 0 H THR B 67 -1.030 0.883 -7.244 1.00 0.00 H new ATOM 0 HA THR B 67 0.299 -1.583 -7.976 1.00 0.00 H new ATOM 0 HB THR B 67 -1.663 -0.403 -9.080 1.00 0.00 H new ATOM 0 HG1 THR B 67 -0.879 -1.086 -11.205 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.102 1.174 -10.898 1.00 0.00 H new ATOM 0 HG22 THR B 67 -0.748 1.837 -9.285 1.00 0.00 H new ATOM 0 HG23 THR B 67 0.576 1.229 -10.307 1.00 0.00 H new ATOM 2519 N HIS B 68 2.620 -0.863 -8.359 1.00 0.00 N ATOM 2520 CA HIS B 68 4.010 -0.476 -8.564 1.00 0.00 C ATOM 2521 C HIS B 68 4.205 0.146 -9.944 1.00 0.00 C ATOM 2522 O HIS B 68 3.418 -0.093 -10.859 1.00 0.00 O ATOM 2523 CB HIS B 68 4.925 -1.691 -8.408 1.00 0.00 C ATOM 2524 CG HIS B 68 4.730 -2.727 -9.471 1.00 0.00 C ATOM 2525 ND1 HIS B 68 3.609 -2.781 -10.273 1.00 0.00 N ATOM 2526 CD2 HIS B 68 5.522 -3.751 -9.864 1.00 0.00 C ATOM 2527 CE1 HIS B 68 3.721 -3.793 -11.114 1.00 0.00 C ATOM 2528 NE2 HIS B 68 4.872 -4.398 -10.887 1.00 0.00 N ATOM 0 H HIS B 68 2.481 -1.858 -8.181 1.00 0.00 H new ATOM 0 HA HIS B 68 4.269 0.268 -7.810 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.963 -1.358 -8.422 1.00 0.00 H new ATOM 0 HB3 HIS B 68 4.749 -2.145 -7.433 1.00 0.00 H new ATOM 0 HD2 HIS B 68 6.485 -4.011 -9.451 1.00 0.00 H new ATOM 0 HE1 HIS B 68 2.994 -4.077 -11.861 1.00 0.00 H new ATOM 0 HE2 HIS B 68 5.222 -5.214 -11.390 1.00 0.00 H new ATOM 2537 N GLU B 69 5.259 0.943 -10.085 1.00 0.00 N ATOM 2538 CA GLU B 69 5.558 1.599 -11.354 1.00 0.00 C ATOM 2539 C GLU B 69 7.062 1.786 -11.531 1.00 0.00 C ATOM 2540 O GLU B 69 7.803 1.899 -10.553 1.00 0.00 O ATOM 2541 CB GLU B 69 4.848 2.951 -11.429 1.00 0.00 C ATOM 2542 CG GLU B 69 3.455 2.937 -10.821 1.00 0.00 C ATOM 2543 CD GLU B 69 2.431 3.642 -11.689 1.00 0.00 C ATOM 2544 OE1 GLU B 69 2.775 4.008 -12.833 1.00 0.00 O ATOM 2545 OE2 GLU B 69 1.287 3.827 -11.226 1.00 0.00 O ATOM 0 H GLU B 69 5.921 1.151 -9.337 1.00 0.00 H new ATOM 0 HA GLU B 69 5.196 0.961 -12.160 1.00 0.00 H new ATOM 0 HB2 GLU B 69 5.452 3.699 -10.916 1.00 0.00 H new ATOM 0 HB3 GLU B 69 4.778 3.259 -12.472 1.00 0.00 H new ATOM 0 HG2 GLU B 69 3.142 1.905 -10.663 1.00 0.00 H new ATOM 0 HG3 GLU B 69 3.486 3.414 -9.842 1.00 0.00 H new ATOM 2552 N THR B 70 7.510 1.813 -12.783 1.00 0.00 N ATOM 2553 CA THR B 70 8.928 1.979 -13.084 1.00 0.00 C ATOM 2554 C THR B 70 9.749 0.878 -12.420 1.00 0.00 C ATOM 2555 O THR B 70 9.704 -0.279 -12.838 1.00 0.00 O ATOM 2556 CB THR B 70 9.414 3.352 -12.617 1.00 0.00 C ATOM 2557 OG1 THR B 70 8.807 4.384 -13.375 1.00 0.00 O ATOM 2558 CG2 THR B 70 10.913 3.525 -12.724 1.00 0.00 C ATOM 0 H THR B 70 6.912 1.722 -13.604 1.00 0.00 H new ATOM 0 HA THR B 70 9.060 1.908 -14.164 1.00 0.00 H new ATOM 0 HB THR B 70 9.132 3.415 -11.566 1.00 0.00 H new ATOM 0 HG1 THR B 70 9.496 5.000 -13.700 1.00 0.00 H new ATOM 0 HG21 THR B 70 11.190 4.520 -12.377 1.00 0.00 H new ATOM 0 HG22 THR B 70 11.411 2.775 -12.110 1.00 0.00 H new ATOM 0 HG23 THR B 70 11.220 3.405 -13.763 1.00 0.00 H new ATOM 2566 N LYS B 71 10.489 1.241 -11.377 1.00 0.00 N ATOM 2567 CA LYS B 71 11.308 0.277 -10.653 1.00 0.00 C ATOM 2568 C LYS B 71 10.428 -0.652 -9.827 1.00 0.00 C ATOM 2569 O LYS B 71 10.920 -1.439 -9.019 1.00 0.00 O ATOM 2570 CB LYS B 71 12.300 1.000 -9.739 1.00 0.00 C ATOM 2571 CG LYS B 71 13.553 1.479 -10.454 1.00 0.00 C ATOM 2572 CD LYS B 71 14.367 2.418 -9.577 1.00 0.00 C ATOM 2573 CE LYS B 71 15.673 2.815 -10.245 1.00 0.00 C ATOM 2574 NZ LYS B 71 15.554 4.108 -10.975 1.00 0.00 N ATOM 0 H LYS B 71 10.538 2.194 -11.015 1.00 0.00 H new ATOM 0 HA LYS B 71 11.864 -0.315 -11.380 1.00 0.00 H new ATOM 0 HB2 LYS B 71 11.803 1.856 -9.283 1.00 0.00 H new ATOM 0 HB3 LYS B 71 12.588 0.330 -8.929 1.00 0.00 H new ATOM 0 HG2 LYS B 71 14.163 0.621 -10.736 1.00 0.00 H new ATOM 0 HG3 LYS B 71 13.275 1.989 -11.376 1.00 0.00 H new ATOM 0 HD2 LYS B 71 13.782 3.312 -9.359 1.00 0.00 H new ATOM 0 HD3 LYS B 71 14.578 1.935 -8.623 1.00 0.00 H new ATOM 0 HE2 LYS B 71 16.456 2.895 -9.491 1.00 0.00 H new ATOM 0 HE3 LYS B 71 15.978 2.033 -10.940 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 16.466 4.343 -11.416 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 14.824 4.025 -11.711 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 15.288 4.860 -10.308 1.00 0.00 H new ATOM 2588 N HIS B 72 9.121 -0.548 -10.034 1.00 0.00 N ATOM 2589 CA HIS B 72 8.166 -1.372 -9.307 1.00 0.00 C ATOM 2590 C HIS B 72 7.930 -0.807 -7.911 1.00 0.00 C ATOM 2591 O HIS B 72 7.007 -0.021 -7.701 1.00 0.00 O ATOM 2592 CB HIS B 72 8.671 -2.812 -9.214 1.00 0.00 C ATOM 2593 CG HIS B 72 8.718 -3.515 -10.535 1.00 0.00 C ATOM 2594 ND1 HIS B 72 7.967 -4.637 -10.820 1.00 0.00 N ATOM 2595 CD2 HIS B 72 9.431 -3.250 -11.656 1.00 0.00 C ATOM 2596 CE1 HIS B 72 8.217 -5.030 -12.056 1.00 0.00 C ATOM 2597 NE2 HIS B 72 9.101 -4.205 -12.584 1.00 0.00 N ATOM 0 H HIS B 72 8.699 0.099 -10.700 1.00 0.00 H new ATOM 0 HA HIS B 72 7.221 -1.366 -9.850 1.00 0.00 H new ATOM 0 HB2 HIS B 72 9.669 -2.811 -8.776 1.00 0.00 H new ATOM 0 HB3 HIS B 72 8.026 -3.372 -8.536 1.00 0.00 H new ATOM 0 HD2 HIS B 72 10.129 -2.438 -11.794 1.00 0.00 H new ATOM 0 HE1 HIS B 72 7.773 -5.882 -12.550 1.00 0.00 H new ATOM 0 HE2 HIS B 72 9.478 -4.267 -13.530 1.00 0.00 H new ATOM 2606 N PHE B 73 8.778 -1.207 -6.968 1.00 0.00 N ATOM 2607 CA PHE B 73 8.674 -0.740 -5.588 1.00 0.00 C ATOM 2608 C PHE B 73 9.427 -1.672 -4.644 1.00 0.00 C ATOM 2609 O PHE B 73 10.086 -2.615 -5.082 1.00 0.00 O ATOM 2610 CB PHE B 73 7.205 -0.641 -5.159 1.00 0.00 C ATOM 2611 CG PHE B 73 6.613 -1.950 -4.716 1.00 0.00 C ATOM 2612 CD1 PHE B 73 6.933 -3.128 -5.371 1.00 0.00 C ATOM 2613 CD2 PHE B 73 5.738 -2.000 -3.643 1.00 0.00 C ATOM 2614 CE1 PHE B 73 6.391 -4.332 -4.963 1.00 0.00 C ATOM 2615 CE2 PHE B 73 5.192 -3.202 -3.231 1.00 0.00 C ATOM 2616 CZ PHE B 73 5.519 -4.369 -3.892 1.00 0.00 C ATOM 0 H PHE B 73 9.547 -1.856 -7.135 1.00 0.00 H new ATOM 0 HA PHE B 73 9.124 0.251 -5.535 1.00 0.00 H new ATOM 0 HB2 PHE B 73 7.122 0.079 -4.345 1.00 0.00 H new ATOM 0 HB3 PHE B 73 6.619 -0.251 -5.991 1.00 0.00 H new ATOM 0 HD1 PHE B 73 7.613 -3.105 -6.209 1.00 0.00 H new ATOM 0 HD2 PHE B 73 5.479 -1.090 -3.122 1.00 0.00 H new ATOM 0 HE1 PHE B 73 6.649 -5.244 -5.481 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.511 -3.228 -2.393 1.00 0.00 H new ATOM 0 HZ PHE B 73 5.094 -5.309 -3.573 1.00 0.00 H new ATOM 2626 N ILE B 74 9.319 -1.406 -3.347 1.00 0.00 N ATOM 2627 CA ILE B 74 9.984 -2.227 -2.343 1.00 0.00 C ATOM 2628 C ILE B 74 9.312 -2.082 -0.983 1.00 0.00 C ATOM 2629 O ILE B 74 9.282 -0.997 -0.404 1.00 0.00 O ATOM 2630 CB ILE B 74 11.474 -1.865 -2.202 1.00 0.00 C ATOM 2631 CG1 ILE B 74 12.162 -2.866 -1.241 1.00 0.00 C ATOM 2632 CG2 ILE B 74 11.617 -0.412 -1.750 1.00 0.00 C ATOM 2633 CD1 ILE B 74 13.031 -2.250 -0.157 1.00 0.00 C ATOM 0 H ILE B 74 8.778 -0.629 -2.967 1.00 0.00 H new ATOM 0 HA ILE B 74 9.903 -3.259 -2.684 1.00 0.00 H new ATOM 0 HB ILE B 74 11.976 -1.946 -3.166 1.00 0.00 H new ATOM 0 HG12 ILE B 74 11.391 -3.470 -0.763 1.00 0.00 H new ATOM 0 HG13 ILE B 74 12.777 -3.544 -1.832 1.00 0.00 H new ATOM 0 HG21 ILE B 74 12.674 -0.164 -1.653 1.00 0.00 H new ATOM 0 HG22 ILE B 74 11.156 0.245 -2.487 1.00 0.00 H new ATOM 0 HG23 ILE B 74 11.123 -0.280 -0.787 1.00 0.00 H new ATOM 0 HD11 ILE B 74 13.462 -3.041 0.457 1.00 0.00 H new ATOM 0 HD12 ILE B 74 13.831 -1.671 -0.618 1.00 0.00 H new ATOM 0 HD13 ILE B 74 12.423 -1.596 0.468 1.00 0.00 H new ATOM 2645 N TYR B 75 8.775 -3.187 -0.478 1.00 0.00 N ATOM 2646 CA TYR B 75 8.105 -3.189 0.816 1.00 0.00 C ATOM 2647 C TYR B 75 8.949 -3.917 1.856 1.00 0.00 C ATOM 2648 O TYR B 75 9.545 -4.956 1.570 1.00 0.00 O ATOM 2649 CB TYR B 75 6.731 -3.851 0.702 1.00 0.00 C ATOM 2650 CG TYR B 75 5.798 -3.514 1.844 1.00 0.00 C ATOM 2651 CD1 TYR B 75 5.447 -2.198 2.115 1.00 0.00 C ATOM 2652 CD2 TYR B 75 5.268 -4.513 2.650 1.00 0.00 C ATOM 2653 CE1 TYR B 75 4.595 -1.886 3.156 1.00 0.00 C ATOM 2654 CE2 TYR B 75 4.415 -4.210 3.694 1.00 0.00 C ATOM 2655 CZ TYR B 75 4.081 -2.896 3.943 1.00 0.00 C ATOM 2656 OH TYR B 75 3.231 -2.590 4.981 1.00 0.00 O ATOM 0 H TYR B 75 8.791 -4.093 -0.946 1.00 0.00 H new ATOM 0 HA TYR B 75 7.974 -2.155 1.135 1.00 0.00 H new ATOM 0 HB2 TYR B 75 6.267 -3.547 -0.236 1.00 0.00 H new ATOM 0 HB3 TYR B 75 6.861 -4.932 0.657 1.00 0.00 H new ATOM 0 HD1 TYR B 75 5.847 -1.405 1.501 1.00 0.00 H new ATOM 0 HD2 TYR B 75 5.527 -5.544 2.458 1.00 0.00 H new ATOM 0 HE1 TYR B 75 4.332 -0.857 3.353 1.00 0.00 H new ATOM 0 HE2 TYR B 75 4.012 -4.999 4.312 1.00 0.00 H new ATOM 0 HH TYR B 75 2.973 -1.646 4.925 1.00 0.00 H new ATOM 2666 N PHE B 76 8.994 -3.366 3.063 1.00 0.00 N ATOM 2667 CA PHE B 76 9.763 -3.963 4.148 1.00 0.00 C ATOM 2668 C PHE B 76 9.278 -3.445 5.498 1.00 0.00 C ATOM 2669 O PHE B 76 8.484 -2.507 5.566 1.00 0.00 O ATOM 2670 CB PHE B 76 11.252 -3.663 3.974 1.00 0.00 C ATOM 2671 CG PHE B 76 11.543 -2.224 3.657 1.00 0.00 C ATOM 2672 CD1 PHE B 76 11.153 -1.675 2.448 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.207 -1.421 4.572 1.00 0.00 C ATOM 2674 CE1 PHE B 76 11.419 -0.351 2.155 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.476 -0.097 4.284 1.00 0.00 C ATOM 2676 CZ PHE B 76 12.082 0.439 3.074 1.00 0.00 C ATOM 0 H PHE B 76 8.507 -2.506 3.315 1.00 0.00 H new ATOM 0 HA PHE B 76 9.616 -5.043 4.117 1.00 0.00 H new ATOM 0 HB2 PHE B 76 11.779 -3.939 4.888 1.00 0.00 H new ATOM 0 HB3 PHE B 76 11.649 -4.290 3.176 1.00 0.00 H new ATOM 0 HD1 PHE B 76 10.635 -2.288 1.725 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.517 -1.835 5.520 1.00 0.00 H new ATOM 0 HE1 PHE B 76 11.109 0.066 1.208 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.994 0.518 5.005 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.292 1.474 2.847 1.00 0.00 H new ATOM 2686 N TYR B 77 9.757 -4.065 6.571 1.00 0.00 N ATOM 2687 CA TYR B 77 9.366 -3.668 7.920 1.00 0.00 C ATOM 2688 C TYR B 77 10.588 -3.518 8.822 1.00 0.00 C ATOM 2689 O TYR B 77 11.274 -4.494 9.123 1.00 0.00 O ATOM 2690 CB TYR B 77 8.398 -4.697 8.510 1.00 0.00 C ATOM 2691 CG TYR B 77 7.944 -4.372 9.915 1.00 0.00 C ATOM 2692 CD1 TYR B 77 8.769 -4.615 11.004 1.00 0.00 C ATOM 2693 CD2 TYR B 77 6.690 -3.823 10.152 1.00 0.00 C ATOM 2694 CE1 TYR B 77 8.358 -4.321 12.291 1.00 0.00 C ATOM 2695 CE2 TYR B 77 6.272 -3.525 11.435 1.00 0.00 C ATOM 2696 CZ TYR B 77 7.109 -3.777 12.500 1.00 0.00 C ATOM 2697 OH TYR B 77 6.698 -3.482 13.780 1.00 0.00 O ATOM 0 H TYR B 77 10.415 -4.843 6.534 1.00 0.00 H new ATOM 0 HA TYR B 77 8.867 -2.701 7.860 1.00 0.00 H new ATOM 0 HB2 TYR B 77 7.523 -4.772 7.864 1.00 0.00 H new ATOM 0 HB3 TYR B 77 8.878 -5.675 8.511 1.00 0.00 H new ATOM 0 HD1 TYR B 77 9.748 -5.041 10.844 1.00 0.00 H new ATOM 0 HD2 TYR B 77 6.031 -3.626 9.320 1.00 0.00 H new ATOM 0 HE1 TYR B 77 9.012 -4.517 13.128 1.00 0.00 H new ATOM 0 HE2 TYR B 77 5.295 -3.097 11.602 1.00 0.00 H new ATOM 0 HH TYR B 77 5.794 -3.104 13.754 1.00 0.00 H new ATOM 2707 N LEU B 78 10.854 -2.287 9.252 1.00 0.00 N ATOM 2708 CA LEU B 78 11.992 -2.005 10.121 1.00 0.00 C ATOM 2709 C LEU B 78 11.755 -2.563 11.522 1.00 0.00 C ATOM 2710 O LEU B 78 10.646 -2.984 11.847 1.00 0.00 O ATOM 2711 CB LEU B 78 12.245 -0.497 10.192 1.00 0.00 C ATOM 2712 CG LEU B 78 12.872 0.130 8.942 1.00 0.00 C ATOM 2713 CD1 LEU B 78 14.367 -0.147 8.900 1.00 0.00 C ATOM 2714 CD2 LEU B 78 12.199 -0.386 7.677 1.00 0.00 C ATOM 0 H LEU B 78 10.295 -1.468 9.012 1.00 0.00 H new ATOM 0 HA LEU B 78 12.871 -2.492 9.700 1.00 0.00 H new ATOM 0 HB2 LEU B 78 11.297 0.003 10.391 1.00 0.00 H new ATOM 0 HB3 LEU B 78 12.896 -0.296 11.043 1.00 0.00 H new ATOM 0 HG LEU B 78 12.719 1.208 8.991 1.00 0.00 H new ATOM 0 HD11 LEU B 78 14.796 0.305 8.006 1.00 0.00 H new ATOM 0 HD12 LEU B 78 14.841 0.278 9.785 1.00 0.00 H new ATOM 0 HD13 LEU B 78 14.537 -1.223 8.879 1.00 0.00 H new ATOM 0 HD21 LEU B 78 12.663 0.074 6.805 1.00 0.00 H new ATOM 0 HD22 LEU B 78 12.313 -1.468 7.620 1.00 0.00 H new ATOM 0 HD23 LEU B 78 11.139 -0.134 7.700 1.00 0.00 H new ATOM 2726 N GLY B 79 12.804 -2.563 12.344 1.00 0.00 N ATOM 2727 CA GLY B 79 12.693 -3.073 13.703 1.00 0.00 C ATOM 2728 C GLY B 79 11.280 -2.996 14.247 1.00 0.00 C ATOM 2729 O GLY B 79 10.738 -3.990 14.734 1.00 0.00 O ATOM 0 H GLY B 79 13.730 -2.218 12.093 1.00 0.00 H new ATOM 0 HA2 GLY B 79 13.030 -4.109 13.726 1.00 0.00 H new ATOM 0 HA3 GLY B 79 13.359 -2.507 14.354 1.00 0.00 H new ATOM 2733 N GLN B 80 10.680 -1.814 14.159 1.00 0.00 N ATOM 2734 CA GLN B 80 9.319 -1.606 14.640 1.00 0.00 C ATOM 2735 C GLN B 80 8.571 -0.644 13.721 1.00 0.00 C ATOM 2736 O GLN B 80 7.845 0.235 14.185 1.00 0.00 O ATOM 2737 CB GLN B 80 9.336 -1.058 16.069 1.00 0.00 C ATOM 2738 CG GLN B 80 8.065 -1.350 16.850 1.00 0.00 C ATOM 2739 CD GLN B 80 8.282 -1.323 18.350 1.00 0.00 C ATOM 2740 OE1 GLN B 80 7.349 -1.525 19.128 1.00 0.00 O ATOM 2741 NE2 GLN B 80 9.519 -1.075 18.766 1.00 0.00 N ATOM 0 H GLN B 80 11.116 -0.984 13.758 1.00 0.00 H new ATOM 0 HA GLN B 80 8.803 -2.566 14.638 1.00 0.00 H new ATOM 0 HB2 GLN B 80 10.186 -1.484 16.602 1.00 0.00 H new ATOM 0 HB3 GLN B 80 9.491 0.020 16.033 1.00 0.00 H new ATOM 0 HG2 GLN B 80 7.303 -0.617 16.584 1.00 0.00 H new ATOM 0 HG3 GLN B 80 7.682 -2.328 16.560 1.00 0.00 H new ATOM 0 HE21 GLN B 80 10.263 -0.913 18.087 1.00 0.00 H new ATOM 0 HE22 GLN B 80 9.725 -1.046 19.765 1.00 0.00 H new ATOM 2750 N VAL B 81 8.762 -0.814 12.417 1.00 0.00 N ATOM 2751 CA VAL B 81 8.116 0.043 11.431 1.00 0.00 C ATOM 2752 C VAL B 81 8.037 -0.645 10.068 1.00 0.00 C ATOM 2753 O VAL B 81 8.648 -1.693 9.854 1.00 0.00 O ATOM 2754 CB VAL B 81 8.873 1.377 11.287 1.00 0.00 C ATOM 2755 CG1 VAL B 81 8.343 2.185 10.113 1.00 0.00 C ATOM 2756 CG2 VAL B 81 8.782 2.178 12.577 1.00 0.00 C ATOM 0 H VAL B 81 9.360 -1.538 12.019 1.00 0.00 H new ATOM 0 HA VAL B 81 7.104 0.240 11.785 1.00 0.00 H new ATOM 0 HB VAL B 81 9.921 1.153 11.090 1.00 0.00 H new ATOM 0 HG11 VAL B 81 8.896 3.121 10.036 1.00 0.00 H new ATOM 0 HG12 VAL B 81 8.467 1.614 9.193 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.286 2.400 10.267 1.00 0.00 H new ATOM 0 HG21 VAL B 81 9.321 3.118 12.460 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.736 2.385 12.803 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.223 1.605 13.393 1.00 0.00 H new ATOM 2766 N ALA B 82 7.286 -0.044 9.151 1.00 0.00 N ATOM 2767 CA ALA B 82 7.127 -0.588 7.810 1.00 0.00 C ATOM 2768 C ALA B 82 7.265 0.518 6.770 1.00 0.00 C ATOM 2769 O ALA B 82 6.810 1.641 6.987 1.00 0.00 O ATOM 2770 CB ALA B 82 5.779 -1.279 7.677 1.00 0.00 C ATOM 0 H ALA B 82 6.776 0.824 9.315 1.00 0.00 H new ATOM 0 HA ALA B 82 7.912 -1.325 7.637 1.00 0.00 H new ATOM 0 HB1 ALA B 82 5.674 -1.681 6.669 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.714 -2.092 8.400 1.00 0.00 H new ATOM 0 HB3 ALA B 82 4.982 -0.560 7.866 1.00 0.00 H new ATOM 2776 N ILE B 83 7.903 0.204 5.648 1.00 0.00 N ATOM 2777 CA ILE B 83 8.101 1.191 4.594 1.00 0.00 C ATOM 2778 C ILE B 83 7.646 0.671 3.233 1.00 0.00 C ATOM 2779 O ILE B 83 8.014 -0.427 2.817 1.00 0.00 O ATOM 2780 CB ILE B 83 9.578 1.625 4.495 1.00 0.00 C ATOM 2781 CG1 ILE B 83 10.328 1.286 5.791 1.00 0.00 C ATOM 2782 CG2 ILE B 83 9.670 3.113 4.190 1.00 0.00 C ATOM 2783 CD1 ILE B 83 9.999 2.205 6.950 1.00 0.00 C ATOM 0 H ILE B 83 8.289 -0.718 5.446 1.00 0.00 H new ATOM 0 HA ILE B 83 7.489 2.051 4.866 1.00 0.00 H new ATOM 0 HB ILE B 83 10.049 1.077 3.679 1.00 0.00 H new ATOM 0 HG12 ILE B 83 10.095 0.260 6.076 1.00 0.00 H new ATOM 0 HG13 ILE B 83 11.400 1.328 5.600 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.718 3.407 4.123 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.173 3.322 3.243 1.00 0.00 H new ATOM 0 HG23 ILE B 83 9.185 3.678 4.986 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.568 1.901 7.828 1.00 0.00 H new ATOM 0 HD12 ILE B 83 10.259 3.230 6.686 1.00 0.00 H new ATOM 0 HD13 ILE B 83 8.933 2.146 7.170 1.00 0.00 H new ATOM 2795 N LEU B 84 6.847 1.482 2.546 1.00 0.00 N ATOM 2796 CA LEU B 84 6.334 1.135 1.225 1.00 0.00 C ATOM 2797 C LEU B 84 6.843 2.128 0.183 1.00 0.00 C ATOM 2798 O LEU B 84 6.295 3.219 0.032 1.00 0.00 O ATOM 2799 CB LEU B 84 4.802 1.125 1.237 1.00 0.00 C ATOM 2800 CG LEU B 84 4.136 1.370 -0.119 1.00 0.00 C ATOM 2801 CD1 LEU B 84 3.761 0.049 -0.774 1.00 0.00 C ATOM 2802 CD2 LEU B 84 2.909 2.256 0.044 1.00 0.00 C ATOM 0 H LEU B 84 6.539 2.393 2.887 1.00 0.00 H new ATOM 0 HA LEU B 84 6.690 0.138 0.964 1.00 0.00 H new ATOM 0 HB2 LEU B 84 4.464 0.162 1.620 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.456 1.886 1.936 1.00 0.00 H new ATOM 0 HG LEU B 84 4.847 1.884 -0.767 1.00 0.00 H new ATOM 0 HD11 LEU B 84 3.289 0.242 -1.737 1.00 0.00 H new ATOM 0 HD12 LEU B 84 4.659 -0.551 -0.924 1.00 0.00 H new ATOM 0 HD13 LEU B 84 3.067 -0.492 -0.131 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.447 2.421 -0.929 1.00 0.00 H new ATOM 0 HD22 LEU B 84 2.194 1.769 0.707 1.00 0.00 H new ATOM 0 HD23 LEU B 84 3.206 3.214 0.471 1.00 0.00 H new ATOM 2814 N LEU B 85 7.903 1.748 -0.523 1.00 0.00 N ATOM 2815 CA LEU B 85 8.493 2.611 -1.539 1.00 0.00 C ATOM 2816 C LEU B 85 8.066 2.192 -2.941 1.00 0.00 C ATOM 2817 O LEU B 85 8.445 1.126 -3.425 1.00 0.00 O ATOM 2818 CB LEU B 85 10.018 2.587 -1.432 1.00 0.00 C ATOM 2819 CG LEU B 85 10.662 3.917 -1.044 1.00 0.00 C ATOM 2820 CD1 LEU B 85 10.239 4.326 0.357 1.00 0.00 C ATOM 2821 CD2 LEU B 85 12.177 3.822 -1.140 1.00 0.00 C ATOM 0 H LEU B 85 8.371 0.849 -0.410 1.00 0.00 H new ATOM 0 HA LEU B 85 8.134 3.625 -1.363 1.00 0.00 H new ATOM 0 HB2 LEU B 85 10.303 1.835 -0.696 1.00 0.00 H new ATOM 0 HB3 LEU B 85 10.429 2.268 -2.390 1.00 0.00 H new ATOM 0 HG LEU B 85 10.321 4.682 -1.741 1.00 0.00 H new ATOM 0 HD11 LEU B 85 10.708 5.275 0.616 1.00 0.00 H new ATOM 0 HD12 LEU B 85 9.155 4.435 0.393 1.00 0.00 H new ATOM 0 HD13 LEU B 85 10.551 3.562 1.069 1.00 0.00 H new ATOM 0 HD21 LEU B 85 12.620 4.778 -0.860 1.00 0.00 H new ATOM 0 HD22 LEU B 85 12.536 3.044 -0.466 1.00 0.00 H new ATOM 0 HD23 LEU B 85 12.462 3.575 -2.163 1.00 0.00 H new ATOM 2833 N PHE B 86 7.278 3.043 -3.590 1.00 0.00 N ATOM 2834 CA PHE B 86 6.805 2.766 -4.942 1.00 0.00 C ATOM 2835 C PHE B 86 6.597 4.064 -5.719 1.00 0.00 C ATOM 2836 O PHE B 86 5.934 4.984 -5.243 1.00 0.00 O ATOM 2837 CB PHE B 86 5.506 1.959 -4.899 1.00 0.00 C ATOM 2838 CG PHE B 86 4.280 2.796 -4.675 1.00 0.00 C ATOM 2839 CD1 PHE B 86 4.037 3.375 -3.441 1.00 0.00 C ATOM 2840 CD2 PHE B 86 3.371 3.000 -5.700 1.00 0.00 C ATOM 2841 CE1 PHE B 86 2.908 4.143 -3.232 1.00 0.00 C ATOM 2842 CE2 PHE B 86 2.239 3.766 -5.496 1.00 0.00 C ATOM 2843 CZ PHE B 86 2.007 4.338 -4.261 1.00 0.00 C ATOM 0 H PHE B 86 6.954 3.929 -3.202 1.00 0.00 H new ATOM 0 HA PHE B 86 7.565 2.177 -5.455 1.00 0.00 H new ATOM 0 HB2 PHE B 86 5.396 1.414 -5.837 1.00 0.00 H new ATOM 0 HB3 PHE B 86 5.577 1.216 -4.105 1.00 0.00 H new ATOM 0 HD1 PHE B 86 4.738 3.225 -2.633 1.00 0.00 H new ATOM 0 HD2 PHE B 86 3.549 2.556 -6.668 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.730 4.590 -2.265 1.00 0.00 H new ATOM 0 HE2 PHE B 86 1.536 3.917 -6.302 1.00 0.00 H new ATOM 0 HZ PHE B 86 1.123 4.937 -4.100 1.00 0.00 H new ATOM 2853 N LYS B 87 7.176 4.131 -6.914 1.00 0.00 N ATOM 2854 CA LYS B 87 7.064 5.319 -7.757 1.00 0.00 C ATOM 2855 C LYS B 87 5.899 5.198 -8.732 1.00 0.00 C ATOM 2856 O LYS B 87 5.303 4.130 -8.877 1.00 0.00 O ATOM 2857 CB LYS B 87 8.363 5.539 -8.530 1.00 0.00 C ATOM 2858 CG LYS B 87 9.609 5.420 -7.670 1.00 0.00 C ATOM 2859 CD LYS B 87 10.863 5.337 -8.522 1.00 0.00 C ATOM 2860 CE LYS B 87 11.136 6.648 -9.243 1.00 0.00 C ATOM 2861 NZ LYS B 87 12.450 6.632 -9.945 1.00 0.00 N ATOM 0 H LYS B 87 7.728 3.376 -7.322 1.00 0.00 H new ATOM 0 HA LYS B 87 6.878 6.174 -7.107 1.00 0.00 H new ATOM 0 HB2 LYS B 87 8.421 4.813 -9.341 1.00 0.00 H new ATOM 0 HB3 LYS B 87 8.341 6.528 -8.988 1.00 0.00 H new ATOM 0 HG2 LYS B 87 9.676 6.280 -7.003 1.00 0.00 H new ATOM 0 HG3 LYS B 87 9.535 4.533 -7.040 1.00 0.00 H new ATOM 0 HD2 LYS B 87 11.716 5.083 -7.892 1.00 0.00 H new ATOM 0 HD3 LYS B 87 10.755 4.535 -9.252 1.00 0.00 H new ATOM 0 HE2 LYS B 87 10.341 6.838 -9.964 1.00 0.00 H new ATOM 0 HE3 LYS B 87 11.118 7.468 -8.525 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 12.967 7.510 -9.735 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 13.007 5.816 -9.620 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 12.295 6.559 -10.971 1.00 0.00 H new ATOM 2875 N SER B 88 5.583 6.302 -9.402 1.00 0.00 N ATOM 2876 CA SER B 88 4.493 6.328 -10.372 1.00 0.00 C ATOM 2877 C SER B 88 5.014 6.689 -11.754 1.00 0.00 C ATOM 2878 O SER B 88 4.259 7.106 -12.632 1.00 0.00 O ATOM 2879 CB SER B 88 3.426 7.332 -9.942 1.00 0.00 C ATOM 2880 OG SER B 88 2.172 6.699 -9.754 1.00 0.00 O ATOM 0 H SER B 88 6.068 7.193 -9.291 1.00 0.00 H new ATOM 0 HA SER B 88 4.050 5.333 -10.414 1.00 0.00 H new ATOM 0 HB2 SER B 88 3.733 7.819 -9.016 1.00 0.00 H new ATOM 0 HB3 SER B 88 3.333 8.113 -10.697 1.00 0.00 H new ATOM 0 HG SER B 88 1.924 6.740 -8.807 1.00 0.00 H new ATOM 2886 N GLY B 89 6.311 6.521 -11.930 1.00 0.00 N ATOM 2887 CA GLY B 89 6.939 6.828 -13.202 1.00 0.00 C ATOM 2888 C GLY B 89 6.861 8.302 -13.548 1.00 0.00 C ATOM 2889 O GLY B 89 7.900 8.879 -13.932 1.00 0.00 O ATOM 2890 OXT GLY B 89 5.759 8.880 -13.436 1.00 0.00 O ATOM 0 H GLY B 89 6.948 6.175 -11.212 1.00 0.00 H new ATOM 0 HA2 GLY B 89 7.984 6.520 -13.171 1.00 0.00 H new ATOM 0 HA3 GLY B 89 6.459 6.247 -13.990 1.00 0.00 H new TER 2894 GLY B 89