USER MOD reduce.3.24.130724 H: found=0, std=0, add=1000, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1000 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 101 SER OG : rot 180:sc= 0.189 USER MOD Set 1.2: A 103 THR OG1 : rot 27:sc= 0.181 USER MOD Set 2.1: A 79 LYS NZ :NH3+ -165:sc= -2.85! (180deg=-3.62!) USER MOD Set 2.2: A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 0 MET CE :methyl 141:sc= -0.252 (180deg=-1.13) USER MOD Single : A 0 MET N :NH3+ -175:sc= 0 (180deg=-0.0285) USER MOD Single : A 1 ASN : amide:sc= -10.3! C(o=-10!,f=-7.8!) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 40:sc= 0.56 USER MOD Single : A 19 THR OG1 : rot -46:sc= 1.14 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.0374 USER MOD Single : A 27 THR OG1 : rot -150:sc= 0 USER MOD Single : A 28 THR OG1 : rot -11:sc= -0.301 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot 180:sc= -0.441 USER MOD Single : A 32 THR OG1 : rot 180:sc=-0.00143 USER MOD Single : A 37 TYR OH : rot -125:sc= -1.24! USER MOD Single : A 40 SER OG : rot -10:sc= -1.67! USER MOD Single : A 41 HIS : no HD1:sc= -0.187 X(o=-0.19,f=-0.19) USER MOD Single : A 42 SER OG : rot -17:sc= 0.137 USER MOD Single : A 43 THR OG1 : rot 180:sc= -1.17 USER MOD Single : A 44 GLN : amide:sc= -0.0993 X(o=-0.099,f=0.14) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.312 USER MOD Single : A 49 ASN : amide:sc= -7.52! C(o=-7.5!,f=-12!) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.541 K(o=-0.54,f=-4.9!) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0741) USER MOD Single : A 67 HIS : no HD1:sc= -0.436 K(o=-0.44,f=-3.1!) USER MOD Single : A 73 ASN : amide:sc= -1.14 K(o=-1.1,f=-0.31) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 SER OG : rot 70:sc= 0.343 USER MOD Single : A 86 SER OG : rot -84:sc= 0.315 USER MOD Single : A 87 GLN : amide:sc= -3.68 K(o=-3.7,f=-8.2!) USER MOD Single : A 91 SER OG : rot 41:sc= -0.12 USER MOD Single : A 93 SER OG : rot 180:sc= -0.316 USER MOD Single : A 102 THR OG1 : rot 180:sc= -1.32 USER MOD Single : A 104 SER OG : rot 92:sc= 1.18 USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 121 GLN : amide:sc= -0.708 K(o=-0.71,f=-1.8) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 128 HIS : no HD1:sc= -0.328 X(o=-0.33,f=-0.089) USER MOD Single : A 129 HIS : no HD1:sc= -0.11 X(o=-0.11,f=0.0087) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 34.217 -3.019 -1.995 1.00 0.00 N ATOM 2 CA MET A 0 33.493 -3.299 -3.262 1.00 0.00 C ATOM 3 C MET A 0 32.564 -2.148 -3.628 1.00 0.00 C ATOM 4 O MET A 0 32.549 -1.691 -4.771 1.00 0.00 O ATOM 5 CB MET A 0 32.685 -4.592 -3.137 1.00 0.00 C ATOM 6 CG MET A 0 33.544 -5.831 -2.953 1.00 0.00 C ATOM 7 SD MET A 0 32.587 -7.357 -3.025 1.00 0.00 S ATOM 8 CE MET A 0 31.918 -7.257 -4.684 1.00 0.00 C ATOM 0 H1 MET A 0 34.904 -3.778 -1.813 1.00 0.00 H new ATOM 0 H2 MET A 0 34.717 -2.111 -2.075 1.00 0.00 H new ATOM 0 H3 MET A 0 33.537 -2.972 -1.210 1.00 0.00 H new ATOM 0 HA MET A 0 34.234 -3.411 -4.053 1.00 0.00 H new ATOM 0 HB2 MET A 0 32.003 -4.504 -2.291 1.00 0.00 H new ATOM 0 HB3 MET A 0 32.071 -4.715 -4.030 1.00 0.00 H new ATOM 0 HG2 MET A 0 34.313 -5.853 -3.725 1.00 0.00 H new ATOM 0 HG3 MET A 0 34.057 -5.773 -1.993 1.00 0.00 H new ATOM 0 HE1 MET A 0 31.925 -8.247 -5.139 1.00 0.00 H new ATOM 0 HE2 MET A 0 30.895 -6.884 -4.642 1.00 0.00 H new ATOM 0 HE3 MET A 0 32.527 -6.578 -5.282 1.00 0.00 H new ATOM 20 N ASN A 1 31.788 -1.686 -2.648 1.00 0.00 N ATOM 21 CA ASN A 1 30.849 -0.588 -2.859 1.00 0.00 C ATOM 22 C ASN A 1 29.736 -0.996 -3.819 1.00 0.00 C ATOM 23 O ASN A 1 29.927 -1.858 -4.678 1.00 0.00 O ATOM 24 CB ASN A 1 31.582 0.646 -3.391 1.00 0.00 C ATOM 25 CG ASN A 1 31.797 1.693 -2.318 1.00 0.00 C ATOM 26 OD1 ASN A 1 32.845 2.335 -2.256 1.00 0.00 O ATOM 27 ND2 ASN A 1 30.791 1.877 -1.474 1.00 0.00 N ATOM 0 H ASN A 1 31.792 -2.057 -1.698 1.00 0.00 H new ATOM 0 HA ASN A 1 30.396 -0.342 -1.899 1.00 0.00 H new ATOM 0 HB2 ASN A 1 32.546 0.345 -3.800 1.00 0.00 H new ATOM 0 HB3 ASN A 1 31.010 1.081 -4.210 1.00 0.00 H new ATOM 0 HD21 ASN A 1 30.867 2.575 -0.734 1.00 0.00 H new ATOM 0 HD22 ASN A 1 29.941 1.321 -1.565 1.00 0.00 H new ATOM 34 N CYS A 2 28.570 -0.374 -3.667 1.00 0.00 N ATOM 35 CA CYS A 2 27.429 -0.681 -4.519 1.00 0.00 C ATOM 36 C CYS A 2 27.203 0.416 -5.552 1.00 0.00 C ATOM 37 O CYS A 2 27.846 1.465 -5.506 1.00 0.00 O ATOM 38 CB CYS A 2 26.165 -0.856 -3.679 1.00 0.00 C ATOM 39 SG CYS A 2 26.314 -2.095 -2.355 1.00 0.00 S ATOM 0 H CYS A 2 28.392 0.343 -2.964 1.00 0.00 H new ATOM 0 HA CYS A 2 27.649 -1.613 -5.040 1.00 0.00 H new ATOM 0 HB2 CYS A 2 25.902 0.104 -3.235 1.00 0.00 H new ATOM 0 HB3 CYS A 2 25.342 -1.140 -4.336 1.00 0.00 H new ATOM 44 N GLY A 3 26.289 0.168 -6.480 1.00 0.00 N ATOM 45 CA GLY A 3 25.962 1.171 -7.473 1.00 0.00 C ATOM 46 C GLY A 3 24.971 2.177 -6.915 1.00 0.00 C ATOM 47 O GLY A 3 24.427 1.960 -5.832 1.00 0.00 O ATOM 0 H GLY A 3 25.770 -0.706 -6.563 1.00 0.00 H new ATOM 0 HA2 GLY A 3 26.869 1.685 -7.790 1.00 0.00 H new ATOM 0 HA3 GLY A 3 25.542 0.691 -8.357 1.00 0.00 H new ATOM 51 N PRO A 4 24.716 3.292 -7.620 1.00 0.00 N ATOM 52 CA PRO A 4 23.771 4.313 -7.154 1.00 0.00 C ATOM 53 C PRO A 4 22.471 3.698 -6.637 1.00 0.00 C ATOM 54 O PRO A 4 21.819 2.930 -7.345 1.00 0.00 O ATOM 55 CB PRO A 4 23.522 5.146 -8.408 1.00 0.00 C ATOM 56 CG PRO A 4 24.792 5.037 -9.180 1.00 0.00 C ATOM 57 CD PRO A 4 25.318 3.649 -8.919 1.00 0.00 C ATOM 0 HA PRO A 4 24.158 4.891 -6.315 1.00 0.00 H new ATOM 0 HB2 PRO A 4 22.676 4.763 -8.978 1.00 0.00 H new ATOM 0 HB3 PRO A 4 23.296 6.183 -8.159 1.00 0.00 H new ATOM 0 HG2 PRO A 4 24.617 5.194 -10.244 1.00 0.00 H new ATOM 0 HG3 PRO A 4 25.509 5.793 -8.860 1.00 0.00 H new ATOM 0 HD2 PRO A 4 25.021 2.953 -9.704 1.00 0.00 H new ATOM 0 HD3 PRO A 4 26.407 3.634 -8.875 1.00 0.00 H new ATOM 65 N PRO A 5 22.079 4.029 -5.390 1.00 0.00 N ATOM 66 CA PRO A 5 20.860 3.499 -4.774 1.00 0.00 C ATOM 67 C PRO A 5 19.663 3.514 -5.718 1.00 0.00 C ATOM 68 O PRO A 5 19.338 4.544 -6.307 1.00 0.00 O ATOM 69 CB PRO A 5 20.628 4.445 -3.599 1.00 0.00 C ATOM 70 CG PRO A 5 21.996 4.872 -3.202 1.00 0.00 C ATOM 71 CD PRO A 5 22.793 4.948 -4.480 1.00 0.00 C ATOM 0 HA PRO A 5 20.971 2.453 -4.489 1.00 0.00 H new ATOM 0 HB2 PRO A 5 20.013 5.297 -3.889 1.00 0.00 H new ATOM 0 HB3 PRO A 5 20.113 3.944 -2.779 1.00 0.00 H new ATOM 0 HG2 PRO A 5 21.973 5.838 -2.698 1.00 0.00 H new ATOM 0 HG3 PRO A 5 22.441 4.161 -2.506 1.00 0.00 H new ATOM 0 HD2 PRO A 5 22.820 5.963 -4.876 1.00 0.00 H new ATOM 0 HD3 PRO A 5 23.827 4.638 -4.327 1.00 0.00 H new ATOM 79 N PRO A 6 18.993 2.360 -5.867 1.00 0.00 N ATOM 80 CA PRO A 6 17.823 2.230 -6.738 1.00 0.00 C ATOM 81 C PRO A 6 16.647 3.054 -6.233 1.00 0.00 C ATOM 82 O PRO A 6 16.695 3.692 -5.182 1.00 0.00 O ATOM 83 CB PRO A 6 17.476 0.733 -6.667 1.00 0.00 C ATOM 84 CG PRO A 6 18.678 0.071 -6.082 1.00 0.00 C ATOM 85 CD PRO A 6 19.321 1.093 -5.196 1.00 0.00 C ATOM 0 HA PRO A 6 18.030 2.586 -7.747 1.00 0.00 H new ATOM 0 HB2 PRO A 6 16.595 0.564 -6.048 1.00 0.00 H new ATOM 0 HB3 PRO A 6 17.252 0.335 -7.657 1.00 0.00 H new ATOM 0 HG2 PRO A 6 18.397 -0.816 -5.515 1.00 0.00 H new ATOM 0 HG3 PRO A 6 19.364 -0.254 -6.864 1.00 0.00 H new ATOM 0 HD2 PRO A 6 18.922 1.057 -4.182 1.00 0.00 H new ATOM 0 HD3 PRO A 6 20.398 0.942 -5.120 1.00 0.00 H new ATOM 93 N THR A 7 15.591 3.010 -7.036 1.00 0.00 N ATOM 94 CA THR A 7 14.348 3.707 -6.749 1.00 0.00 C ATOM 95 C THR A 7 13.344 2.698 -6.213 1.00 0.00 C ATOM 96 O THR A 7 12.301 2.477 -6.831 1.00 0.00 O ATOM 97 CB THR A 7 13.773 4.368 -8.018 1.00 0.00 C ATOM 98 OG1 THR A 7 14.797 5.112 -8.689 1.00 0.00 O ATOM 99 CG2 THR A 7 12.617 5.295 -7.671 1.00 0.00 C ATOM 0 H THR A 7 15.575 2.485 -7.910 1.00 0.00 H new ATOM 0 HA THR A 7 14.543 4.490 -6.016 1.00 0.00 H new ATOM 0 HB THR A 7 13.404 3.580 -8.674 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.425 5.527 -9.495 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.229 5.749 -8.583 1.00 0.00 H new ATOM 0 HG22 THR A 7 11.826 4.724 -7.185 1.00 0.00 H new ATOM 0 HG23 THR A 7 12.967 6.077 -6.997 1.00 0.00 H new ATOM 107 N LEU A 8 13.657 2.067 -5.082 1.00 0.00 N ATOM 108 CA LEU A 8 12.772 1.044 -4.535 1.00 0.00 C ATOM 109 C LEU A 8 11.327 1.520 -4.603 1.00 0.00 C ATOM 110 O LEU A 8 10.968 2.523 -3.990 1.00 0.00 O ATOM 111 CB LEU A 8 13.157 0.723 -3.086 1.00 0.00 C ATOM 112 CG LEU A 8 14.583 0.194 -2.887 1.00 0.00 C ATOM 113 CD1 LEU A 8 15.599 1.324 -2.975 1.00 0.00 C ATOM 114 CD2 LEU A 8 14.704 -0.515 -1.548 1.00 0.00 C ATOM 0 H LEU A 8 14.501 2.242 -4.536 1.00 0.00 H new ATOM 0 HA LEU A 8 12.875 0.136 -5.129 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.035 1.625 -2.487 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.456 -0.015 -2.696 1.00 0.00 H new ATOM 0 HG LEU A 8 14.793 -0.519 -3.684 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.602 0.923 -2.831 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.534 1.796 -3.955 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.389 2.063 -2.202 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.722 -0.884 -1.423 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.470 0.183 -0.744 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.008 -1.353 -1.516 1.00 0.00 H new ATOM 126 N SER A 9 10.500 0.803 -5.354 1.00 0.00 N ATOM 127 CA SER A 9 9.104 1.182 -5.520 1.00 0.00 C ATOM 128 C SER A 9 8.257 0.796 -4.315 1.00 0.00 C ATOM 129 O SER A 9 7.029 0.846 -4.378 1.00 0.00 O ATOM 130 CB SER A 9 8.529 0.545 -6.785 1.00 0.00 C ATOM 131 OG SER A 9 8.478 -0.866 -6.668 1.00 0.00 O ATOM 0 H SER A 9 10.772 -0.042 -5.856 1.00 0.00 H new ATOM 0 HA SER A 9 9.073 2.268 -5.611 1.00 0.00 H new ATOM 0 HB2 SER A 9 7.528 0.934 -6.969 1.00 0.00 H new ATOM 0 HB3 SER A 9 9.140 0.820 -7.644 1.00 0.00 H new ATOM 0 HG SER A 9 8.105 -1.249 -7.489 1.00 0.00 H new ATOM 137 N PHE A 10 8.903 0.404 -3.223 1.00 0.00 N ATOM 138 CA PHE A 10 8.175 0.041 -2.016 1.00 0.00 C ATOM 139 C PHE A 10 8.617 0.911 -0.843 1.00 0.00 C ATOM 140 O PHE A 10 8.145 0.751 0.277 1.00 0.00 O ATOM 141 CB PHE A 10 8.331 -1.445 -1.688 1.00 0.00 C ATOM 142 CG PHE A 10 9.709 -1.849 -1.262 1.00 0.00 C ATOM 143 CD1 PHE A 10 10.703 -2.068 -2.202 1.00 0.00 C ATOM 144 CD2 PHE A 10 10.008 -2.020 0.079 1.00 0.00 C ATOM 145 CE1 PHE A 10 11.971 -2.449 -1.809 1.00 0.00 C ATOM 146 CE2 PHE A 10 11.273 -2.402 0.478 1.00 0.00 C ATOM 147 CZ PHE A 10 12.255 -2.617 -0.467 1.00 0.00 C ATOM 0 H PHE A 10 9.918 0.330 -3.149 1.00 0.00 H new ATOM 0 HA PHE A 10 7.116 0.221 -2.199 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.629 -1.704 -0.895 1.00 0.00 H new ATOM 0 HB3 PHE A 10 8.050 -2.028 -2.565 1.00 0.00 H new ATOM 0 HD1 PHE A 10 10.484 -1.940 -3.252 1.00 0.00 H new ATOM 0 HD2 PHE A 10 9.242 -1.852 0.822 1.00 0.00 H new ATOM 0 HE1 PHE A 10 12.739 -2.615 -2.549 1.00 0.00 H new ATOM 0 HE2 PHE A 10 11.493 -2.532 1.527 1.00 0.00 H new ATOM 0 HZ PHE A 10 13.246 -2.917 -0.158 1.00 0.00 H new ATOM 157 N ALA A 11 9.527 1.837 -1.122 1.00 0.00 N ATOM 158 CA ALA A 11 10.045 2.757 -0.118 1.00 0.00 C ATOM 159 C ALA A 11 10.624 3.986 -0.808 1.00 0.00 C ATOM 160 O ALA A 11 10.978 3.953 -1.984 1.00 0.00 O ATOM 161 CB ALA A 11 11.121 2.069 0.710 1.00 0.00 C ATOM 0 H ALA A 11 9.926 1.971 -2.051 1.00 0.00 H new ATOM 0 HA ALA A 11 9.235 3.064 0.544 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.504 2.763 1.458 1.00 0.00 H new ATOM 0 HB2 ALA A 11 10.696 1.197 1.207 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.936 1.753 0.058 1.00 0.00 H new ATOM 167 N ALA A 12 10.712 5.069 -0.048 1.00 0.00 N ATOM 168 CA ALA A 12 11.289 6.303 -0.561 1.00 0.00 C ATOM 169 C ALA A 12 12.411 6.799 0.350 1.00 0.00 C ATOM 170 O ALA A 12 12.283 6.763 1.571 1.00 0.00 O ATOM 171 CB ALA A 12 10.214 7.369 -0.711 1.00 0.00 C ATOM 0 H ALA A 12 10.393 5.118 0.920 1.00 0.00 H new ATOM 0 HA ALA A 12 11.715 6.098 -1.543 1.00 0.00 H new ATOM 0 HB1 ALA A 12 10.662 8.285 -1.096 1.00 0.00 H new ATOM 0 HB2 ALA A 12 9.449 7.020 -1.405 1.00 0.00 H new ATOM 0 HB3 ALA A 12 9.760 7.567 0.260 1.00 0.00 H new ATOM 177 N PRO A 13 13.524 7.279 -0.232 1.00 0.00 N ATOM 178 CA PRO A 13 14.670 7.774 0.541 1.00 0.00 C ATOM 179 C PRO A 13 14.262 8.800 1.596 1.00 0.00 C ATOM 180 O PRO A 13 13.273 9.516 1.431 1.00 0.00 O ATOM 181 CB PRO A 13 15.560 8.425 -0.519 1.00 0.00 C ATOM 182 CG PRO A 13 15.208 7.731 -1.791 1.00 0.00 C ATOM 183 CD PRO A 13 13.748 7.387 -1.686 1.00 0.00 C ATOM 0 HA PRO A 13 15.160 6.974 1.097 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.373 9.497 -0.588 1.00 0.00 H new ATOM 0 HB3 PRO A 13 16.616 8.300 -0.280 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.396 8.374 -2.651 1.00 0.00 H new ATOM 0 HG3 PRO A 13 15.812 6.833 -1.926 1.00 0.00 H new ATOM 0 HD2 PRO A 13 13.121 8.158 -2.133 1.00 0.00 H new ATOM 0 HD3 PRO A 13 13.518 6.453 -2.198 1.00 0.00 H new ATOM 191 N MET A 14 15.033 8.864 2.680 1.00 0.00 N ATOM 192 CA MET A 14 14.753 9.802 3.763 1.00 0.00 C ATOM 193 C MET A 14 16.000 10.062 4.606 1.00 0.00 C ATOM 194 O MET A 14 16.047 11.018 5.382 1.00 0.00 O ATOM 195 CB MET A 14 13.623 9.264 4.646 1.00 0.00 C ATOM 196 CG MET A 14 13.297 10.150 5.838 1.00 0.00 C ATOM 197 SD MET A 14 12.770 11.805 5.356 1.00 0.00 S ATOM 198 CE MET A 14 12.439 12.534 6.958 1.00 0.00 C ATOM 0 H MET A 14 15.854 8.278 2.831 1.00 0.00 H new ATOM 0 HA MET A 14 14.442 10.748 3.319 1.00 0.00 H new ATOM 0 HB2 MET A 14 12.726 9.145 4.038 1.00 0.00 H new ATOM 0 HB3 MET A 14 13.898 8.273 5.007 1.00 0.00 H new ATOM 0 HG2 MET A 14 12.510 9.681 6.429 1.00 0.00 H new ATOM 0 HG3 MET A 14 14.175 10.226 6.479 1.00 0.00 H new ATOM 0 HE1 MET A 14 12.102 13.562 6.827 1.00 0.00 H new ATOM 0 HE2 MET A 14 11.664 11.960 7.466 1.00 0.00 H new ATOM 0 HE3 MET A 14 13.349 12.524 7.558 1.00 0.00 H new ATOM 208 N ASP A 15 17.011 9.218 4.445 1.00 0.00 N ATOM 209 CA ASP A 15 18.246 9.358 5.203 1.00 0.00 C ATOM 210 C ASP A 15 19.400 8.742 4.437 1.00 0.00 C ATOM 211 O ASP A 15 19.649 7.540 4.522 1.00 0.00 O ATOM 212 CB ASP A 15 18.109 8.694 6.570 1.00 0.00 C ATOM 213 CG ASP A 15 19.298 8.965 7.470 1.00 0.00 C ATOM 214 OD1 ASP A 15 20.362 8.347 7.248 1.00 0.00 O ATOM 215 OD2 ASP A 15 19.168 9.795 8.394 1.00 0.00 O ATOM 0 H ASP A 15 17.000 8.430 3.797 1.00 0.00 H new ATOM 0 HA ASP A 15 18.446 10.419 5.350 1.00 0.00 H new ATOM 0 HB2 ASP A 15 17.201 9.053 7.055 1.00 0.00 H new ATOM 0 HB3 ASP A 15 17.996 7.618 6.438 1.00 0.00 H new ATOM 220 N ILE A 16 20.099 9.576 3.685 1.00 0.00 N ATOM 221 CA ILE A 16 21.209 9.125 2.881 1.00 0.00 C ATOM 222 C ILE A 16 21.932 10.300 2.246 1.00 0.00 C ATOM 223 O ILE A 16 21.518 10.800 1.203 1.00 0.00 O ATOM 224 CB ILE A 16 20.712 8.182 1.776 1.00 0.00 C ATOM 225 CG1 ILE A 16 21.841 7.848 0.802 1.00 0.00 C ATOM 226 CG2 ILE A 16 19.514 8.790 1.059 1.00 0.00 C ATOM 227 CD1 ILE A 16 21.387 7.119 -0.445 1.00 0.00 C ATOM 0 H ILE A 16 19.910 10.576 3.619 1.00 0.00 H new ATOM 0 HA ILE A 16 21.902 8.594 3.534 1.00 0.00 H new ATOM 0 HB ILE A 16 20.388 7.247 2.233 1.00 0.00 H new ATOM 0 HG12 ILE A 16 22.338 8.772 0.509 1.00 0.00 H new ATOM 0 HG13 ILE A 16 22.582 7.237 1.317 1.00 0.00 H new ATOM 0 HG21 ILE A 16 19.173 8.110 0.279 1.00 0.00 H new ATOM 0 HG22 ILE A 16 18.708 8.955 1.774 1.00 0.00 H new ATOM 0 HG23 ILE A 16 19.802 9.741 0.611 1.00 0.00 H new ATOM 0 HD11 ILE A 16 22.248 6.919 -1.083 1.00 0.00 H new ATOM 0 HD12 ILE A 16 20.917 6.177 -0.165 1.00 0.00 H new ATOM 0 HD13 ILE A 16 20.669 7.736 -0.986 1.00 0.00 H new ATOM 239 N THR A 17 22.999 10.760 2.884 1.00 0.00 N ATOM 240 CA THR A 17 23.764 11.868 2.340 1.00 0.00 C ATOM 241 C THR A 17 24.092 11.605 0.881 1.00 0.00 C ATOM 242 O THR A 17 24.923 10.754 0.564 1.00 0.00 O ATOM 243 CB THR A 17 25.073 12.106 3.106 1.00 0.00 C ATOM 244 OG1 THR A 17 25.830 10.891 3.177 1.00 0.00 O ATOM 245 CG2 THR A 17 24.798 12.624 4.510 1.00 0.00 C ATOM 0 H THR A 17 23.349 10.388 3.767 1.00 0.00 H new ATOM 0 HA THR A 17 23.145 12.760 2.440 1.00 0.00 H new ATOM 0 HB THR A 17 25.648 12.859 2.568 1.00 0.00 H new ATOM 0 HG1 THR A 17 25.769 10.417 2.321 1.00 0.00 H new ATOM 0 HG21 THR A 17 25.742 12.784 5.030 1.00 0.00 H new ATOM 0 HG22 THR A 17 24.253 13.566 4.450 1.00 0.00 H new ATOM 0 HG23 THR A 17 24.202 11.894 5.057 1.00 0.00 H new ATOM 253 N LEU A 18 23.429 12.334 -0.002 1.00 0.00 N ATOM 254 CA LEU A 18 23.634 12.174 -1.424 1.00 0.00 C ATOM 255 C LEU A 18 25.026 12.640 -1.823 1.00 0.00 C ATOM 256 O LEU A 18 25.979 12.515 -1.053 1.00 0.00 O ATOM 257 CB LEU A 18 22.570 12.959 -2.188 1.00 0.00 C ATOM 258 CG LEU A 18 21.309 12.166 -2.543 1.00 0.00 C ATOM 259 CD1 LEU A 18 21.678 10.895 -3.293 1.00 0.00 C ATOM 260 CD2 LEU A 18 20.516 11.833 -1.290 1.00 0.00 C ATOM 0 H LEU A 18 22.742 13.045 0.248 1.00 0.00 H new ATOM 0 HA LEU A 18 23.547 11.117 -1.675 1.00 0.00 H new ATOM 0 HB2 LEU A 18 22.281 13.824 -1.592 1.00 0.00 H new ATOM 0 HB3 LEU A 18 23.012 13.340 -3.109 1.00 0.00 H new ATOM 0 HG LEU A 18 20.684 12.782 -3.190 1.00 0.00 H new ATOM 0 HD11 LEU A 18 20.772 10.341 -3.539 1.00 0.00 H new ATOM 0 HD12 LEU A 18 22.205 11.154 -4.211 1.00 0.00 H new ATOM 0 HD13 LEU A 18 22.322 10.277 -2.667 1.00 0.00 H new ATOM 0 HD21 LEU A 18 19.624 11.270 -1.563 1.00 0.00 H new ATOM 0 HD22 LEU A 18 21.132 11.235 -0.618 1.00 0.00 H new ATOM 0 HD23 LEU A 18 20.223 12.756 -0.789 1.00 0.00 H new ATOM 272 N THR A 19 25.134 13.167 -3.034 1.00 0.00 N ATOM 273 CA THR A 19 26.403 13.671 -3.550 1.00 0.00 C ATOM 274 C THR A 19 27.411 12.539 -3.703 1.00 0.00 C ATOM 275 O THR A 19 28.609 12.775 -3.856 1.00 0.00 O ATOM 276 CB THR A 19 26.998 14.763 -2.636 1.00 0.00 C ATOM 277 OG1 THR A 19 27.796 14.164 -1.607 1.00 0.00 O ATOM 278 CG2 THR A 19 25.897 15.602 -1.999 1.00 0.00 C ATOM 0 H THR A 19 24.353 13.258 -3.684 1.00 0.00 H new ATOM 0 HA THR A 19 26.198 14.111 -4.526 1.00 0.00 H new ATOM 0 HB THR A 19 27.621 15.413 -3.251 1.00 0.00 H new ATOM 0 HG1 THR A 19 27.307 13.413 -1.209 1.00 0.00 H new ATOM 0 HG21 THR A 19 26.344 16.364 -1.360 1.00 0.00 H new ATOM 0 HG22 THR A 19 25.308 16.083 -2.780 1.00 0.00 H new ATOM 0 HG23 THR A 19 25.250 14.960 -1.401 1.00 0.00 H new ATOM 286 N GLU A 20 26.910 11.309 -3.665 1.00 0.00 N ATOM 287 CA GLU A 20 27.758 10.132 -3.799 1.00 0.00 C ATOM 288 C GLU A 20 27.270 9.242 -4.937 1.00 0.00 C ATOM 289 O GLU A 20 26.419 9.641 -5.731 1.00 0.00 O ATOM 290 CB GLU A 20 27.775 9.338 -2.490 1.00 0.00 C ATOM 291 CG GLU A 20 28.191 10.160 -1.282 1.00 0.00 C ATOM 292 CD GLU A 20 28.321 9.322 -0.025 1.00 0.00 C ATOM 293 OE1 GLU A 20 27.301 9.134 0.671 1.00 0.00 O ATOM 294 OE2 GLU A 20 29.443 8.854 0.263 1.00 0.00 O ATOM 0 H GLU A 20 25.919 11.102 -3.542 1.00 0.00 H new ATOM 0 HA GLU A 20 28.770 10.466 -4.027 1.00 0.00 H new ATOM 0 HB2 GLU A 20 26.782 8.925 -2.313 1.00 0.00 H new ATOM 0 HB3 GLU A 20 28.457 8.494 -2.596 1.00 0.00 H new ATOM 0 HG2 GLU A 20 29.143 10.648 -1.489 1.00 0.00 H new ATOM 0 HG3 GLU A 20 27.458 10.949 -1.114 1.00 0.00 H new ATOM 301 N THR A 21 27.817 8.036 -5.006 1.00 0.00 N ATOM 302 CA THR A 21 27.444 7.079 -6.038 1.00 0.00 C ATOM 303 C THR A 21 27.628 5.651 -5.543 1.00 0.00 C ATOM 304 O THR A 21 26.984 4.721 -6.029 1.00 0.00 O ATOM 305 CB THR A 21 28.284 7.273 -7.314 1.00 0.00 C ATOM 306 OG1 THR A 21 29.330 8.222 -7.075 1.00 0.00 O ATOM 307 CG2 THR A 21 27.416 7.748 -8.471 1.00 0.00 C ATOM 0 H THR A 21 28.525 7.696 -4.355 1.00 0.00 H new ATOM 0 HA THR A 21 26.394 7.255 -6.272 1.00 0.00 H new ATOM 0 HB THR A 21 28.721 6.311 -7.581 1.00 0.00 H new ATOM 0 HG1 THR A 21 29.860 8.337 -7.891 1.00 0.00 H new ATOM 0 HG21 THR A 21 28.033 7.877 -9.360 1.00 0.00 H new ATOM 0 HG22 THR A 21 26.641 7.008 -8.672 1.00 0.00 H new ATOM 0 HG23 THR A 21 26.951 8.699 -8.211 1.00 0.00 H new ATOM 315 N ARG A 22 28.516 5.491 -4.569 1.00 0.00 N ATOM 316 CA ARG A 22 28.809 4.185 -3.994 1.00 0.00 C ATOM 317 C ARG A 22 28.605 4.213 -2.481 1.00 0.00 C ATOM 318 O ARG A 22 28.727 5.268 -1.856 1.00 0.00 O ATOM 319 CB ARG A 22 30.244 3.793 -4.322 1.00 0.00 C ATOM 320 CG ARG A 22 30.536 3.767 -5.815 1.00 0.00 C ATOM 321 CD ARG A 22 32.029 3.716 -6.096 1.00 0.00 C ATOM 322 NE ARG A 22 32.634 2.469 -5.638 1.00 0.00 N ATOM 323 CZ ARG A 22 33.855 2.389 -5.121 1.00 0.00 C ATOM 324 NH1 ARG A 22 34.591 3.484 -4.981 1.00 0.00 N ATOM 325 NH2 ARG A 22 34.340 1.216 -4.740 1.00 0.00 N ATOM 0 H ARG A 22 29.049 6.257 -4.158 1.00 0.00 H new ATOM 0 HA ARG A 22 28.128 3.448 -4.421 1.00 0.00 H new ATOM 0 HB2 ARG A 22 30.924 4.494 -3.838 1.00 0.00 H new ATOM 0 HB3 ARG A 22 30.449 2.808 -3.902 1.00 0.00 H new ATOM 0 HG2 ARG A 22 30.051 2.901 -6.265 1.00 0.00 H new ATOM 0 HG3 ARG A 22 30.107 4.652 -6.285 1.00 0.00 H new ATOM 0 HD2 ARG A 22 32.200 3.829 -7.167 1.00 0.00 H new ATOM 0 HD3 ARG A 22 32.518 4.557 -5.605 1.00 0.00 H new ATOM 0 HE ARG A 22 32.089 1.611 -5.720 1.00 0.00 H new ATOM 0 HH11 ARG A 22 34.219 4.389 -5.270 1.00 0.00 H new ATOM 0 HH12 ARG A 22 35.528 3.421 -4.584 1.00 0.00 H new ATOM 0 HH21 ARG A 22 33.776 0.373 -4.844 1.00 0.00 H new ATOM 0 HH22 ARG A 22 35.278 1.156 -4.343 1.00 0.00 H new ATOM 339 N PHE A 23 28.300 3.059 -1.888 1.00 0.00 N ATOM 340 CA PHE A 23 28.066 2.957 -0.446 1.00 0.00 C ATOM 341 C PHE A 23 28.587 1.617 0.064 1.00 0.00 C ATOM 342 O PHE A 23 28.068 0.563 -0.301 1.00 0.00 O ATOM 343 CB PHE A 23 26.571 3.099 -0.138 1.00 0.00 C ATOM 344 CG PHE A 23 25.983 4.395 -0.621 1.00 0.00 C ATOM 345 CD1 PHE A 23 25.751 4.601 -1.969 1.00 0.00 C ATOM 346 CD2 PHE A 23 25.680 5.413 0.270 1.00 0.00 C ATOM 347 CE1 PHE A 23 25.233 5.793 -2.425 1.00 0.00 C ATOM 348 CE2 PHE A 23 25.154 6.610 -0.180 1.00 0.00 C ATOM 349 CZ PHE A 23 24.932 6.800 -1.531 1.00 0.00 C ATOM 0 H PHE A 23 28.208 2.175 -2.388 1.00 0.00 H new ATOM 0 HA PHE A 23 28.599 3.762 0.059 1.00 0.00 H new ATOM 0 HB2 PHE A 23 26.032 2.270 -0.598 1.00 0.00 H new ATOM 0 HB3 PHE A 23 26.420 3.019 0.939 1.00 0.00 H new ATOM 0 HD1 PHE A 23 25.979 3.816 -2.674 1.00 0.00 H new ATOM 0 HD2 PHE A 23 25.857 5.270 1.326 1.00 0.00 H new ATOM 0 HE1 PHE A 23 25.063 5.939 -3.481 1.00 0.00 H new ATOM 0 HE2 PHE A 23 24.917 7.395 0.523 1.00 0.00 H new ATOM 0 HZ PHE A 23 24.524 7.735 -1.886 1.00 0.00 H new ATOM 359 N LYS A 24 29.625 1.663 0.898 1.00 0.00 N ATOM 360 CA LYS A 24 30.234 0.445 1.429 1.00 0.00 C ATOM 361 C LYS A 24 29.204 -0.505 2.018 1.00 0.00 C ATOM 362 O LYS A 24 28.055 -0.135 2.253 1.00 0.00 O ATOM 363 CB LYS A 24 31.284 0.770 2.490 1.00 0.00 C ATOM 364 CG LYS A 24 30.873 1.882 3.441 1.00 0.00 C ATOM 365 CD LYS A 24 31.761 1.916 4.674 1.00 0.00 C ATOM 366 CE LYS A 24 31.281 2.948 5.681 1.00 0.00 C ATOM 367 NZ LYS A 24 32.153 2.997 6.887 1.00 0.00 N ATOM 0 H LYS A 24 30.060 2.528 1.220 1.00 0.00 H new ATOM 0 HA LYS A 24 30.713 -0.050 0.584 1.00 0.00 H new ATOM 0 HB2 LYS A 24 31.494 -0.130 3.068 1.00 0.00 H new ATOM 0 HB3 LYS A 24 32.212 1.054 1.994 1.00 0.00 H new ATOM 0 HG2 LYS A 24 30.927 2.841 2.926 1.00 0.00 H new ATOM 0 HG3 LYS A 24 29.835 1.740 3.742 1.00 0.00 H new ATOM 0 HD2 LYS A 24 31.775 0.931 5.140 1.00 0.00 H new ATOM 0 HD3 LYS A 24 32.785 2.144 4.379 1.00 0.00 H new ATOM 0 HE2 LYS A 24 31.258 3.931 5.210 1.00 0.00 H new ATOM 0 HE3 LYS A 24 30.260 2.714 5.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 31.791 3.713 7.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 32.156 2.067 7.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 33.123 3.245 6.604 1.00 0.00 H new ATOM 381 N THR A 25 29.638 -1.733 2.261 1.00 0.00 N ATOM 382 CA THR A 25 28.773 -2.755 2.816 1.00 0.00 C ATOM 383 C THR A 25 28.406 -2.453 4.261 1.00 0.00 C ATOM 384 O THR A 25 27.564 -3.127 4.852 1.00 0.00 O ATOM 385 CB THR A 25 29.436 -4.132 2.752 1.00 0.00 C ATOM 386 OG1 THR A 25 30.831 -4.023 3.059 1.00 0.00 O ATOM 387 CG2 THR A 25 29.253 -4.767 1.378 1.00 0.00 C ATOM 0 H THR A 25 30.592 -2.044 2.080 1.00 0.00 H new ATOM 0 HA THR A 25 27.866 -2.759 2.212 1.00 0.00 H new ATOM 0 HB THR A 25 28.955 -4.773 3.491 1.00 0.00 H new ATOM 0 HG1 THR A 25 31.245 -4.910 3.017 1.00 0.00 H new ATOM 0 HG21 THR A 25 29.735 -5.745 1.362 1.00 0.00 H new ATOM 0 HG22 THR A 25 28.189 -4.883 1.169 1.00 0.00 H new ATOM 0 HG23 THR A 25 29.704 -4.128 0.619 1.00 0.00 H new ATOM 395 N GLY A 26 29.044 -1.437 4.822 1.00 0.00 N ATOM 396 CA GLY A 26 28.767 -1.056 6.190 1.00 0.00 C ATOM 397 C GLY A 26 27.699 0.010 6.251 1.00 0.00 C ATOM 398 O GLY A 26 27.142 0.295 7.310 1.00 0.00 O ATOM 0 H GLY A 26 29.750 -0.869 4.353 1.00 0.00 H new ATOM 0 HA2 GLY A 26 28.446 -1.930 6.756 1.00 0.00 H new ATOM 0 HA3 GLY A 26 29.679 -0.689 6.661 1.00 0.00 H new ATOM 402 N THR A 27 27.420 0.601 5.094 1.00 0.00 N ATOM 403 CA THR A 27 26.416 1.652 4.976 1.00 0.00 C ATOM 404 C THR A 27 25.022 1.114 5.277 1.00 0.00 C ATOM 405 O THR A 27 24.792 -0.095 5.233 1.00 0.00 O ATOM 406 CB THR A 27 26.420 2.275 3.566 1.00 0.00 C ATOM 407 OG1 THR A 27 25.921 3.617 3.623 1.00 0.00 O ATOM 408 CG2 THR A 27 25.570 1.460 2.605 1.00 0.00 C ATOM 0 H THR A 27 27.881 0.366 4.215 1.00 0.00 H new ATOM 0 HA THR A 27 26.672 2.420 5.706 1.00 0.00 H new ATOM 0 HB THR A 27 27.447 2.279 3.202 1.00 0.00 H new ATOM 0 HG1 THR A 27 25.483 3.839 2.775 1.00 0.00 H new ATOM 0 HG21 THR A 27 25.591 1.923 1.618 1.00 0.00 H new ATOM 0 HG22 THR A 27 25.966 0.447 2.539 1.00 0.00 H new ATOM 0 HG23 THR A 27 24.543 1.425 2.968 1.00 0.00 H new ATOM 416 N THR A 28 24.094 2.015 5.580 1.00 0.00 N ATOM 417 CA THR A 28 22.721 1.624 5.876 1.00 0.00 C ATOM 418 C THR A 28 21.765 2.792 5.658 1.00 0.00 C ATOM 419 O THR A 28 21.921 3.856 6.258 1.00 0.00 O ATOM 420 CB THR A 28 22.573 1.108 7.320 1.00 0.00 C ATOM 421 OG1 THR A 28 23.463 0.008 7.542 1.00 0.00 O ATOM 422 CG2 THR A 28 21.142 0.669 7.597 1.00 0.00 C ATOM 0 H THR A 28 24.267 3.019 5.627 1.00 0.00 H new ATOM 0 HA THR A 28 22.468 0.815 5.191 1.00 0.00 H new ATOM 0 HB THR A 28 22.825 1.923 7.998 1.00 0.00 H new ATOM 0 HG1 THR A 28 23.839 -0.286 6.686 1.00 0.00 H new ATOM 0 HG21 THR A 28 21.064 0.309 8.623 1.00 0.00 H new ATOM 0 HG22 THR A 28 20.468 1.514 7.457 1.00 0.00 H new ATOM 0 HG23 THR A 28 20.867 -0.131 6.910 1.00 0.00 H new ATOM 430 N LEU A 29 20.776 2.583 4.796 1.00 0.00 N ATOM 431 CA LEU A 29 19.803 3.624 4.486 1.00 0.00 C ATOM 432 C LEU A 29 18.565 3.495 5.371 1.00 0.00 C ATOM 433 O LEU A 29 18.425 2.529 6.121 1.00 0.00 O ATOM 434 CB LEU A 29 19.404 3.563 3.008 1.00 0.00 C ATOM 435 CG LEU A 29 20.566 3.679 2.018 1.00 0.00 C ATOM 436 CD1 LEU A 29 21.296 2.350 1.899 1.00 0.00 C ATOM 437 CD2 LEU A 29 20.068 4.136 0.656 1.00 0.00 C ATOM 0 H LEU A 29 20.627 1.704 4.300 1.00 0.00 H new ATOM 0 HA LEU A 29 20.268 4.590 4.685 1.00 0.00 H new ATOM 0 HB2 LEU A 29 18.884 2.622 2.826 1.00 0.00 H new ATOM 0 HB3 LEU A 29 18.693 4.364 2.806 1.00 0.00 H new ATOM 0 HG LEU A 29 21.264 4.426 2.395 1.00 0.00 H new ATOM 0 HD11 LEU A 29 22.119 2.449 1.191 1.00 0.00 H new ATOM 0 HD12 LEU A 29 21.688 2.062 2.874 1.00 0.00 H new ATOM 0 HD13 LEU A 29 20.604 1.585 1.546 1.00 0.00 H new ATOM 0 HD21 LEU A 29 20.910 4.212 -0.032 1.00 0.00 H new ATOM 0 HD22 LEU A 29 19.348 3.414 0.271 1.00 0.00 H new ATOM 0 HD23 LEU A 29 19.589 5.110 0.752 1.00 0.00 H new ATOM 449 N LYS A 30 17.669 4.475 5.277 1.00 0.00 N ATOM 450 CA LYS A 30 16.446 4.473 6.074 1.00 0.00 C ATOM 451 C LYS A 30 15.226 4.160 5.215 1.00 0.00 C ATOM 452 O LYS A 30 14.676 3.060 5.277 1.00 0.00 O ATOM 453 CB LYS A 30 16.255 5.826 6.760 1.00 0.00 C ATOM 454 CG LYS A 30 15.071 5.862 7.715 1.00 0.00 C ATOM 455 CD LYS A 30 14.969 7.200 8.428 1.00 0.00 C ATOM 456 CE LYS A 30 16.158 7.438 9.347 1.00 0.00 C ATOM 457 NZ LYS A 30 16.051 8.733 10.072 1.00 0.00 N ATOM 0 H LYS A 30 17.767 5.279 4.658 1.00 0.00 H new ATOM 0 HA LYS A 30 16.546 3.694 6.830 1.00 0.00 H new ATOM 0 HB2 LYS A 30 17.162 6.077 7.310 1.00 0.00 H new ATOM 0 HB3 LYS A 30 16.121 6.594 5.999 1.00 0.00 H new ATOM 0 HG2 LYS A 30 14.151 5.672 7.162 1.00 0.00 H new ATOM 0 HG3 LYS A 30 15.171 5.064 8.450 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.912 8.002 7.692 1.00 0.00 H new ATOM 0 HD3 LYS A 30 14.047 7.234 9.009 1.00 0.00 H new ATOM 0 HE2 LYS A 30 16.228 6.623 10.068 1.00 0.00 H new ATOM 0 HE3 LYS A 30 17.077 7.425 8.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 16.881 8.856 10.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 16.010 9.513 9.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 15.187 8.736 10.651 1.00 0.00 H new ATOM 471 N TYR A 31 14.810 5.142 4.419 1.00 0.00 N ATOM 472 CA TYR A 31 13.651 4.994 3.545 1.00 0.00 C ATOM 473 C TYR A 31 12.360 4.890 4.352 1.00 0.00 C ATOM 474 O TYR A 31 12.330 4.303 5.434 1.00 0.00 O ATOM 475 CB TYR A 31 13.811 3.776 2.630 1.00 0.00 C ATOM 476 CG TYR A 31 14.651 4.054 1.404 1.00 0.00 C ATOM 477 CD1 TYR A 31 15.973 4.463 1.520 1.00 0.00 C ATOM 478 CD2 TYR A 31 14.118 3.913 0.128 1.00 0.00 C ATOM 479 CE1 TYR A 31 16.741 4.723 0.402 1.00 0.00 C ATOM 480 CE2 TYR A 31 14.881 4.171 -0.996 1.00 0.00 C ATOM 481 CZ TYR A 31 16.191 4.576 -0.853 1.00 0.00 C ATOM 482 OH TYR A 31 16.953 4.836 -1.968 1.00 0.00 O ATOM 0 H TYR A 31 15.262 6.054 4.362 1.00 0.00 H new ATOM 0 HA TYR A 31 13.589 5.887 2.923 1.00 0.00 H new ATOM 0 HB2 TYR A 31 14.265 2.963 3.196 1.00 0.00 H new ATOM 0 HB3 TYR A 31 12.825 3.434 2.316 1.00 0.00 H new ATOM 0 HD1 TYR A 31 16.408 4.580 2.502 1.00 0.00 H new ATOM 0 HD2 TYR A 31 13.092 3.597 0.013 1.00 0.00 H new ATOM 0 HE1 TYR A 31 17.768 5.040 0.511 1.00 0.00 H new ATOM 0 HE2 TYR A 31 14.453 4.056 -1.981 1.00 0.00 H new ATOM 0 HH TYR A 31 16.416 4.683 -2.774 1.00 0.00 H new ATOM 492 N THR A 32 11.295 5.470 3.809 1.00 0.00 N ATOM 493 CA THR A 32 9.995 5.459 4.467 1.00 0.00 C ATOM 494 C THR A 32 8.922 4.876 3.555 1.00 0.00 C ATOM 495 O THR A 32 8.991 5.011 2.333 1.00 0.00 O ATOM 496 CB THR A 32 9.580 6.877 4.905 1.00 0.00 C ATOM 497 OG1 THR A 32 8.152 6.993 4.916 1.00 0.00 O ATOM 498 CG2 THR A 32 10.177 7.927 3.979 1.00 0.00 C ATOM 0 H THR A 32 11.308 5.955 2.912 1.00 0.00 H new ATOM 0 HA THR A 32 10.089 4.829 5.352 1.00 0.00 H new ATOM 0 HB THR A 32 9.961 7.047 5.912 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.899 7.897 5.197 1.00 0.00 H new ATOM 0 HG21 THR A 32 9.870 8.920 4.309 1.00 0.00 H new ATOM 0 HG22 THR A 32 11.264 7.857 4.003 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.825 7.757 2.962 1.00 0.00 H new ATOM 506 N CYS A 33 7.929 4.232 4.157 1.00 0.00 N ATOM 507 CA CYS A 33 6.847 3.614 3.400 1.00 0.00 C ATOM 508 C CYS A 33 5.676 4.570 3.208 1.00 0.00 C ATOM 509 O CYS A 33 4.958 4.912 4.149 1.00 0.00 O ATOM 510 CB CYS A 33 6.353 2.355 4.113 1.00 0.00 C ATOM 511 SG CYS A 33 7.612 1.052 4.285 1.00 0.00 S ATOM 0 H CYS A 33 7.851 4.124 5.168 1.00 0.00 H new ATOM 0 HA CYS A 33 7.246 3.354 2.419 1.00 0.00 H new ATOM 0 HB2 CYS A 33 5.993 2.630 5.104 1.00 0.00 H new ATOM 0 HB3 CYS A 33 5.501 1.952 3.565 1.00 0.00 H new ATOM 516 N LEU A 34 5.526 4.994 1.954 1.00 0.00 N ATOM 517 CA LEU A 34 4.471 5.921 1.569 1.00 0.00 C ATOM 518 C LEU A 34 3.161 5.590 2.290 1.00 0.00 C ATOM 519 O LEU A 34 2.840 4.426 2.526 1.00 0.00 O ATOM 520 CB LEU A 34 4.284 5.931 0.049 1.00 0.00 C ATOM 521 CG LEU A 34 5.584 6.078 -0.759 1.00 0.00 C ATOM 522 CD1 LEU A 34 5.299 5.999 -2.251 1.00 0.00 C ATOM 523 CD2 LEU A 34 6.285 7.385 -0.417 1.00 0.00 C ATOM 0 H LEU A 34 6.129 4.705 1.184 1.00 0.00 H new ATOM 0 HA LEU A 34 4.771 6.924 1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.790 5.006 -0.248 1.00 0.00 H new ATOM 0 HB3 LEU A 34 3.614 6.749 -0.215 1.00 0.00 H new ATOM 0 HG LEU A 34 6.246 5.255 -0.492 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.231 6.105 -2.806 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.846 5.036 -2.484 1.00 0.00 H new ATOM 0 HD13 LEU A 34 4.615 6.800 -2.534 1.00 0.00 H new ATOM 0 HD21 LEU A 34 7.202 7.469 -1.000 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.628 8.222 -0.652 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.527 7.401 0.646 1.00 0.00 H new ATOM 535 N PRO A 35 2.404 6.637 2.647 1.00 0.00 N ATOM 536 CA PRO A 35 1.145 6.555 3.380 1.00 0.00 C ATOM 537 C PRO A 35 0.357 5.245 3.271 1.00 0.00 C ATOM 538 O PRO A 35 0.387 4.417 4.181 1.00 0.00 O ATOM 539 CB PRO A 35 0.354 7.703 2.764 1.00 0.00 C ATOM 540 CG PRO A 35 1.379 8.744 2.435 1.00 0.00 C ATOM 541 CD PRO A 35 2.717 8.044 2.340 1.00 0.00 C ATOM 0 HA PRO A 35 1.332 6.605 4.453 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -0.181 7.380 1.871 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -0.391 8.088 3.460 1.00 0.00 H new ATOM 0 HG2 PRO A 35 1.136 9.238 1.494 1.00 0.00 H new ATOM 0 HG3 PRO A 35 1.403 9.516 3.204 1.00 0.00 H new ATOM 0 HD2 PRO A 35 3.153 8.149 1.346 1.00 0.00 H new ATOM 0 HD3 PRO A 35 3.435 8.457 3.048 1.00 0.00 H new ATOM 549 N GLY A 36 -0.343 5.068 2.159 1.00 0.00 N ATOM 550 CA GLY A 36 -1.222 3.920 1.976 1.00 0.00 C ATOM 551 C GLY A 36 -0.585 2.540 2.042 1.00 0.00 C ATOM 552 O GLY A 36 -1.177 1.650 2.643 1.00 0.00 O ATOM 0 H GLY A 36 -0.319 5.708 1.365 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.003 3.968 2.735 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -1.712 4.020 1.007 1.00 0.00 H new ATOM 556 N TYR A 37 0.588 2.361 1.414 1.00 0.00 N ATOM 557 CA TYR A 37 1.274 1.051 1.356 1.00 0.00 C ATOM 558 C TYR A 37 0.508 -0.091 2.019 1.00 0.00 C ATOM 559 O TYR A 37 0.095 -0.023 3.176 1.00 0.00 O ATOM 560 CB TYR A 37 2.693 1.149 1.898 1.00 0.00 C ATOM 561 CG TYR A 37 3.682 1.398 0.789 1.00 0.00 C ATOM 562 CD1 TYR A 37 3.929 2.681 0.339 1.00 0.00 C ATOM 563 CD2 TYR A 37 4.339 0.348 0.165 1.00 0.00 C ATOM 564 CE1 TYR A 37 4.803 2.914 -0.700 1.00 0.00 C ATOM 565 CE2 TYR A 37 5.219 0.576 -0.872 1.00 0.00 C ATOM 566 CZ TYR A 37 5.445 1.864 -1.300 1.00 0.00 C ATOM 567 OH TYR A 37 6.312 2.106 -2.338 1.00 0.00 O ATOM 0 H TYR A 37 1.088 3.110 0.935 1.00 0.00 H new ATOM 0 HA TYR A 37 1.316 0.794 0.298 1.00 0.00 H new ATOM 0 HB2 TYR A 37 2.751 1.955 2.629 1.00 0.00 H new ATOM 0 HB3 TYR A 37 2.951 0.227 2.419 1.00 0.00 H new ATOM 0 HD1 TYR A 37 3.429 3.515 0.809 1.00 0.00 H new ATOM 0 HD2 TYR A 37 4.159 -0.664 0.496 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.982 3.923 -1.041 1.00 0.00 H new ATOM 0 HE2 TYR A 37 5.727 -0.251 -1.345 1.00 0.00 H new ATOM 0 HH TYR A 37 6.049 1.571 -3.116 1.00 0.00 H new ATOM 577 N VAL A 38 0.434 -1.183 1.275 1.00 0.00 N ATOM 578 CA VAL A 38 -0.345 -2.332 1.710 1.00 0.00 C ATOM 579 C VAL A 38 0.531 -3.529 2.077 1.00 0.00 C ATOM 580 O VAL A 38 1.444 -3.893 1.345 1.00 0.00 O ATOM 581 CB VAL A 38 -1.335 -2.750 0.610 1.00 0.00 C ATOM 582 CG1 VAL A 38 -1.762 -4.192 0.791 1.00 0.00 C ATOM 583 CG2 VAL A 38 -2.535 -1.821 0.598 1.00 0.00 C ATOM 0 H VAL A 38 0.899 -1.298 0.375 1.00 0.00 H new ATOM 0 HA VAL A 38 -0.883 -2.025 2.606 1.00 0.00 H new ATOM 0 HB VAL A 38 -0.835 -2.671 -0.355 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.462 -4.466 0.002 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -0.887 -4.840 0.741 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -2.245 -4.309 1.761 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.226 -2.130 -0.186 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -3.038 -1.864 1.564 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.203 -0.800 0.408 1.00 0.00 H new ATOM 593 N ARG A 39 0.230 -4.133 3.224 1.00 0.00 N ATOM 594 CA ARG A 39 0.948 -5.314 3.703 1.00 0.00 C ATOM 595 C ARG A 39 2.468 -5.129 3.684 1.00 0.00 C ATOM 596 O ARG A 39 2.979 -4.072 3.311 1.00 0.00 O ATOM 597 CB ARG A 39 0.567 -6.524 2.847 1.00 0.00 C ATOM 598 CG ARG A 39 0.685 -7.851 3.577 1.00 0.00 C ATOM 599 CD ARG A 39 0.340 -9.018 2.667 1.00 0.00 C ATOM 600 NE ARG A 39 1.232 -9.093 1.513 1.00 0.00 N ATOM 601 CZ ARG A 39 1.395 -10.187 0.775 1.00 0.00 C ATOM 602 NH1 ARG A 39 0.734 -11.297 1.073 1.00 0.00 N ATOM 603 NH2 ARG A 39 2.222 -10.172 -0.261 1.00 0.00 N ATOM 0 H ARG A 39 -0.515 -3.820 3.846 1.00 0.00 H new ATOM 0 HA ARG A 39 0.656 -5.473 4.741 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -0.458 -6.402 2.497 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.205 -6.548 1.963 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.700 -7.971 3.955 1.00 0.00 H new ATOM 0 HG3 ARG A 39 0.021 -7.853 4.441 1.00 0.00 H new ATOM 0 HD2 ARG A 39 0.399 -9.948 3.232 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -0.690 -8.918 2.324 1.00 0.00 H new ATOM 0 HE ARG A 39 1.760 -8.258 1.259 1.00 0.00 H new ATOM 0 HH11 ARG A 39 0.098 -11.313 1.870 1.00 0.00 H new ATOM 0 HH12 ARG A 39 0.861 -12.134 0.505 1.00 0.00 H new ATOM 0 HH21 ARG A 39 2.734 -9.321 -0.493 1.00 0.00 H new ATOM 0 HH22 ARG A 39 2.346 -11.012 -0.826 1.00 0.00 H new ATOM 617 N SER A 40 3.174 -6.174 4.122 1.00 0.00 N ATOM 618 CA SER A 40 4.638 -6.196 4.142 1.00 0.00 C ATOM 619 C SER A 40 5.242 -5.302 5.230 1.00 0.00 C ATOM 620 O SER A 40 6.361 -5.551 5.678 1.00 0.00 O ATOM 621 CB SER A 40 5.193 -5.796 2.775 1.00 0.00 C ATOM 622 OG SER A 40 6.603 -5.921 2.741 1.00 0.00 O ATOM 0 H SER A 40 2.745 -7.030 4.473 1.00 0.00 H new ATOM 0 HA SER A 40 4.927 -7.220 4.378 1.00 0.00 H new ATOM 0 HB2 SER A 40 4.750 -6.424 2.002 1.00 0.00 H new ATOM 0 HB3 SER A 40 4.910 -4.767 2.551 1.00 0.00 H new ATOM 0 HG SER A 40 6.938 -6.090 3.646 1.00 0.00 H new ATOM 628 N HIS A 41 4.516 -4.272 5.658 1.00 0.00 N ATOM 629 CA HIS A 41 5.030 -3.360 6.683 1.00 0.00 C ATOM 630 C HIS A 41 5.554 -4.112 7.900 1.00 0.00 C ATOM 631 O HIS A 41 4.861 -4.956 8.469 1.00 0.00 O ATOM 632 CB HIS A 41 3.966 -2.352 7.112 1.00 0.00 C ATOM 633 CG HIS A 41 2.573 -2.902 7.128 1.00 0.00 C ATOM 634 ND1 HIS A 41 1.595 -2.498 6.244 1.00 0.00 N ATOM 635 CD2 HIS A 41 1.992 -3.822 7.933 1.00 0.00 C ATOM 636 CE1 HIS A 41 0.473 -3.144 6.506 1.00 0.00 C ATOM 637 NE2 HIS A 41 0.687 -3.954 7.526 1.00 0.00 N ATOM 0 H HIS A 41 3.581 -4.047 5.318 1.00 0.00 H new ATOM 0 HA HIS A 41 5.863 -2.820 6.233 1.00 0.00 H new ATOM 0 HB2 HIS A 41 4.211 -1.983 8.108 1.00 0.00 H new ATOM 0 HB3 HIS A 41 3.999 -1.496 6.438 1.00 0.00 H new ATOM 0 HD2 HIS A 41 2.467 -4.354 8.745 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -0.461 -3.029 5.976 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -0.004 -4.577 7.944 1.00 0.00 H new ATOM 646 N SER A 42 6.786 -3.789 8.293 1.00 0.00 N ATOM 647 CA SER A 42 7.414 -4.425 9.443 1.00 0.00 C ATOM 648 C SER A 42 8.774 -3.802 9.751 1.00 0.00 C ATOM 649 O SER A 42 9.326 -4.009 10.833 1.00 0.00 O ATOM 650 CB SER A 42 7.578 -5.927 9.195 1.00 0.00 C ATOM 651 OG SER A 42 8.250 -6.553 10.274 1.00 0.00 O ATOM 0 H SER A 42 7.366 -3.090 7.829 1.00 0.00 H new ATOM 0 HA SER A 42 6.764 -4.268 10.304 1.00 0.00 H new ATOM 0 HB2 SER A 42 6.598 -6.385 9.058 1.00 0.00 H new ATOM 0 HB3 SER A 42 8.137 -6.087 8.273 1.00 0.00 H new ATOM 0 HG SER A 42 8.699 -5.873 10.819 1.00 0.00 H new ATOM 657 N THR A 43 9.310 -3.033 8.803 1.00 0.00 N ATOM 658 CA THR A 43 10.618 -2.397 8.987 1.00 0.00 C ATOM 659 C THR A 43 10.878 -1.327 7.924 1.00 0.00 C ATOM 660 O THR A 43 9.940 -0.795 7.330 1.00 0.00 O ATOM 661 CB THR A 43 11.759 -3.433 8.931 1.00 0.00 C ATOM 662 OG1 THR A 43 11.263 -4.741 9.240 1.00 0.00 O ATOM 663 CG2 THR A 43 12.869 -3.070 9.907 1.00 0.00 C ATOM 0 H THR A 43 8.865 -2.835 7.907 1.00 0.00 H new ATOM 0 HA THR A 43 10.598 -1.930 9.972 1.00 0.00 H new ATOM 0 HB THR A 43 12.163 -3.430 7.919 1.00 0.00 H new ATOM 0 HG1 THR A 43 11.998 -5.388 9.199 1.00 0.00 H new ATOM 0 HG21 THR A 43 13.662 -3.815 9.849 1.00 0.00 H new ATOM 0 HG22 THR A 43 13.272 -2.090 9.651 1.00 0.00 H new ATOM 0 HG23 THR A 43 12.468 -3.044 10.920 1.00 0.00 H new ATOM 671 N GLN A 44 12.163 -1.013 7.701 1.00 0.00 N ATOM 672 CA GLN A 44 12.567 -0.013 6.706 1.00 0.00 C ATOM 673 C GLN A 44 14.062 0.306 6.813 1.00 0.00 C ATOM 674 O GLN A 44 14.446 1.285 7.452 1.00 0.00 O ATOM 675 CB GLN A 44 11.752 1.276 6.873 1.00 0.00 C ATOM 676 CG GLN A 44 11.666 1.764 8.311 1.00 0.00 C ATOM 677 CD GLN A 44 10.780 2.985 8.462 1.00 0.00 C ATOM 678 OE1 GLN A 44 10.673 3.805 7.550 1.00 0.00 O ATOM 679 NE2 GLN A 44 10.137 3.110 9.617 1.00 0.00 N ATOM 0 H GLN A 44 12.943 -1.441 8.200 1.00 0.00 H new ATOM 0 HA GLN A 44 12.372 -0.435 5.720 1.00 0.00 H new ATOM 0 HB2 GLN A 44 12.197 2.059 6.259 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.744 1.109 6.494 1.00 0.00 H new ATOM 0 HG2 GLN A 44 11.282 0.961 8.941 1.00 0.00 H new ATOM 0 HG3 GLN A 44 12.667 2.000 8.671 1.00 0.00 H new ATOM 0 HE21 GLN A 44 10.255 2.406 10.345 1.00 0.00 H new ATOM 0 HE22 GLN A 44 9.525 3.910 9.776 1.00 0.00 H new ATOM 688 N THR A 45 14.904 -0.517 6.178 1.00 0.00 N ATOM 689 CA THR A 45 16.357 -0.308 6.216 1.00 0.00 C ATOM 690 C THR A 45 17.082 -1.045 5.085 1.00 0.00 C ATOM 691 O THR A 45 16.871 -2.239 4.872 1.00 0.00 O ATOM 692 CB THR A 45 16.958 -0.768 7.559 1.00 0.00 C ATOM 693 OG1 THR A 45 16.288 -1.948 8.018 1.00 0.00 O ATOM 694 CG2 THR A 45 16.852 0.325 8.612 1.00 0.00 C ATOM 0 H THR A 45 14.608 -1.328 5.635 1.00 0.00 H new ATOM 0 HA THR A 45 16.504 0.765 6.091 1.00 0.00 H new ATOM 0 HB THR A 45 18.013 -0.988 7.398 1.00 0.00 H new ATOM 0 HG1 THR A 45 16.677 -2.234 8.871 1.00 0.00 H new ATOM 0 HG21 THR A 45 17.284 -0.029 9.548 1.00 0.00 H new ATOM 0 HG22 THR A 45 17.392 1.209 8.274 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.804 0.578 8.769 1.00 0.00 H new ATOM 702 N LEU A 46 17.941 -0.318 4.367 1.00 0.00 N ATOM 703 CA LEU A 46 18.724 -0.893 3.269 1.00 0.00 C ATOM 704 C LEU A 46 20.175 -1.078 3.716 1.00 0.00 C ATOM 705 O LEU A 46 20.641 -0.386 4.622 1.00 0.00 O ATOM 706 CB LEU A 46 18.690 0.010 2.029 1.00 0.00 C ATOM 707 CG LEU A 46 17.316 0.214 1.384 1.00 0.00 C ATOM 708 CD1 LEU A 46 17.461 0.915 0.036 1.00 0.00 C ATOM 709 CD2 LEU A 46 16.593 -1.112 1.223 1.00 0.00 C ATOM 0 H LEU A 46 18.113 0.675 4.527 1.00 0.00 H new ATOM 0 HA LEU A 46 18.285 -1.856 3.008 1.00 0.00 H new ATOM 0 HB2 LEU A 46 19.089 0.986 2.304 1.00 0.00 H new ATOM 0 HB3 LEU A 46 19.362 -0.409 1.280 1.00 0.00 H new ATOM 0 HG LEU A 46 16.719 0.847 2.041 1.00 0.00 H new ATOM 0 HD11 LEU A 46 16.476 1.053 -0.410 1.00 0.00 H new ATOM 0 HD12 LEU A 46 17.933 1.887 0.180 1.00 0.00 H new ATOM 0 HD13 LEU A 46 18.077 0.307 -0.626 1.00 0.00 H new ATOM 0 HD21 LEU A 46 15.620 -0.942 0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 46 17.183 -1.774 0.589 1.00 0.00 H new ATOM 0 HD23 LEU A 46 16.456 -1.573 2.201 1.00 0.00 H new ATOM 721 N THR A 47 20.888 -2.012 3.085 1.00 0.00 N ATOM 722 CA THR A 47 22.288 -2.258 3.429 1.00 0.00 C ATOM 723 C THR A 47 23.037 -2.895 2.267 1.00 0.00 C ATOM 724 O THR A 47 22.455 -3.643 1.481 1.00 0.00 O ATOM 725 CB THR A 47 22.424 -3.186 4.651 1.00 0.00 C ATOM 726 OG1 THR A 47 21.297 -3.027 5.520 1.00 0.00 O ATOM 727 CG2 THR A 47 23.703 -2.882 5.414 1.00 0.00 C ATOM 0 H THR A 47 20.523 -2.605 2.340 1.00 0.00 H new ATOM 0 HA THR A 47 22.718 -1.284 3.663 1.00 0.00 H new ATOM 0 HB THR A 47 22.462 -4.216 4.295 1.00 0.00 H new ATOM 0 HG1 THR A 47 21.393 -3.622 6.292 1.00 0.00 H new ATOM 0 HG21 THR A 47 23.781 -3.548 6.273 1.00 0.00 H new ATOM 0 HG22 THR A 47 24.562 -3.032 4.760 1.00 0.00 H new ATOM 0 HG23 THR A 47 23.685 -1.848 5.757 1.00 0.00 H new ATOM 735 N CYS A 48 24.331 -2.599 2.158 1.00 0.00 N ATOM 736 CA CYS A 48 25.141 -3.173 1.100 1.00 0.00 C ATOM 737 C CYS A 48 25.745 -4.481 1.587 1.00 0.00 C ATOM 738 O CYS A 48 26.442 -4.523 2.599 1.00 0.00 O ATOM 739 CB CYS A 48 26.226 -2.191 0.673 1.00 0.00 C ATOM 740 SG CYS A 48 25.732 -1.092 -0.690 1.00 0.00 S ATOM 0 H CYS A 48 24.832 -1.970 2.786 1.00 0.00 H new ATOM 0 HA CYS A 48 24.518 -3.376 0.229 1.00 0.00 H new ATOM 0 HB2 CYS A 48 26.510 -1.583 1.532 1.00 0.00 H new ATOM 0 HB3 CYS A 48 27.111 -2.751 0.372 1.00 0.00 H new ATOM 745 N ASN A 49 25.453 -5.552 0.861 1.00 0.00 N ATOM 746 CA ASN A 49 26.009 -6.859 1.173 1.00 0.00 C ATOM 747 C ASN A 49 27.171 -7.158 0.218 1.00 0.00 C ATOM 748 O ASN A 49 27.514 -6.327 -0.622 1.00 0.00 O ATOM 749 CB ASN A 49 24.930 -7.937 1.054 1.00 0.00 C ATOM 750 CG ASN A 49 24.774 -8.438 -0.363 1.00 0.00 C ATOM 751 OD1 ASN A 49 25.375 -9.441 -0.744 1.00 0.00 O ATOM 752 ND2 ASN A 49 23.966 -7.742 -1.151 1.00 0.00 N ATOM 0 H ASN A 49 24.833 -5.540 0.051 1.00 0.00 H new ATOM 0 HA ASN A 49 26.379 -6.858 2.198 1.00 0.00 H new ATOM 0 HB2 ASN A 49 25.181 -8.773 1.707 1.00 0.00 H new ATOM 0 HB3 ASN A 49 23.978 -7.535 1.402 1.00 0.00 H new ATOM 0 HD21 ASN A 49 23.822 -8.033 -2.118 1.00 0.00 H new ATOM 0 HD22 ASN A 49 23.489 -6.916 -0.790 1.00 0.00 H new ATOM 759 N SER A 50 27.770 -8.339 0.343 1.00 0.00 N ATOM 760 CA SER A 50 28.882 -8.726 -0.525 1.00 0.00 C ATOM 761 C SER A 50 28.351 -9.474 -1.747 1.00 0.00 C ATOM 762 O SER A 50 28.575 -10.673 -1.917 1.00 0.00 O ATOM 763 CB SER A 50 29.878 -9.599 0.241 1.00 0.00 C ATOM 764 OG SER A 50 30.977 -9.960 -0.577 1.00 0.00 O ATOM 0 H SER A 50 27.507 -9.043 1.033 1.00 0.00 H new ATOM 0 HA SER A 50 29.399 -7.826 -0.858 1.00 0.00 H new ATOM 0 HB2 SER A 50 30.236 -9.062 1.119 1.00 0.00 H new ATOM 0 HB3 SER A 50 29.377 -10.498 0.599 1.00 0.00 H new ATOM 0 HG SER A 50 31.599 -10.516 -0.063 1.00 0.00 H new ATOM 770 N ASP A 51 27.639 -8.731 -2.585 1.00 0.00 N ATOM 771 CA ASP A 51 27.042 -9.256 -3.811 1.00 0.00 C ATOM 772 C ASP A 51 26.974 -8.165 -4.870 1.00 0.00 C ATOM 773 O ASP A 51 26.444 -8.371 -5.961 1.00 0.00 O ATOM 774 CB ASP A 51 25.628 -9.757 -3.535 1.00 0.00 C ATOM 775 CG ASP A 51 25.137 -10.709 -4.608 1.00 0.00 C ATOM 776 OD1 ASP A 51 24.687 -10.229 -5.669 1.00 0.00 O ATOM 777 OD2 ASP A 51 25.208 -11.937 -4.390 1.00 0.00 O ATOM 0 H ASP A 51 27.457 -7.739 -2.434 1.00 0.00 H new ATOM 0 HA ASP A 51 27.662 -10.079 -4.168 1.00 0.00 H new ATOM 0 HB2 ASP A 51 25.605 -10.259 -2.568 1.00 0.00 H new ATOM 0 HB3 ASP A 51 24.950 -8.906 -3.469 1.00 0.00 H new ATOM 782 N GLY A 52 27.526 -7.004 -4.535 1.00 0.00 N ATOM 783 CA GLY A 52 27.489 -5.882 -5.455 1.00 0.00 C ATOM 784 C GLY A 52 26.067 -5.492 -5.813 1.00 0.00 C ATOM 785 O GLY A 52 25.808 -4.803 -6.799 1.00 0.00 O ATOM 0 H GLY A 52 27.996 -6.820 -3.649 1.00 0.00 H new ATOM 0 HA2 GLY A 52 27.998 -5.028 -5.007 1.00 0.00 H new ATOM 0 HA3 GLY A 52 28.035 -6.139 -6.363 1.00 0.00 H new ATOM 789 N GLU A 53 25.161 -5.966 -4.969 1.00 0.00 N ATOM 790 CA GLU A 53 23.744 -5.663 -5.124 1.00 0.00 C ATOM 791 C GLU A 53 23.149 -5.207 -3.804 1.00 0.00 C ATOM 792 O GLU A 53 23.655 -5.545 -2.733 1.00 0.00 O ATOM 793 CB GLU A 53 22.976 -6.883 -5.632 1.00 0.00 C ATOM 794 CG GLU A 53 22.541 -7.833 -4.524 1.00 0.00 C ATOM 795 CD GLU A 53 21.712 -8.993 -5.036 1.00 0.00 C ATOM 796 OE1 GLU A 53 20.549 -8.762 -5.432 1.00 0.00 O ATOM 797 OE2 GLU A 53 22.220 -10.134 -5.040 1.00 0.00 O ATOM 0 H GLU A 53 25.381 -6.561 -4.171 1.00 0.00 H new ATOM 0 HA GLU A 53 23.655 -4.860 -5.856 1.00 0.00 H new ATOM 0 HB2 GLU A 53 22.094 -6.546 -6.177 1.00 0.00 H new ATOM 0 HB3 GLU A 53 23.601 -7.426 -6.341 1.00 0.00 H new ATOM 0 HG2 GLU A 53 23.424 -8.220 -4.016 1.00 0.00 H new ATOM 0 HG3 GLU A 53 21.964 -7.280 -3.783 1.00 0.00 H new ATOM 804 N TRP A 54 22.075 -4.435 -3.881 1.00 0.00 N ATOM 805 CA TRP A 54 21.412 -3.958 -2.694 1.00 0.00 C ATOM 806 C TRP A 54 20.495 -5.039 -2.149 1.00 0.00 C ATOM 807 O TRP A 54 19.474 -5.381 -2.746 1.00 0.00 O ATOM 808 CB TRP A 54 20.623 -2.694 -3.016 1.00 0.00 C ATOM 809 CG TRP A 54 21.490 -1.535 -3.397 1.00 0.00 C ATOM 810 CD1 TRP A 54 21.857 -1.154 -4.656 1.00 0.00 C ATOM 811 CD2 TRP A 54 22.102 -0.608 -2.502 1.00 0.00 C ATOM 812 NE1 TRP A 54 22.659 -0.038 -4.593 1.00 0.00 N ATOM 813 CE2 TRP A 54 22.823 0.316 -3.279 1.00 0.00 C ATOM 814 CE3 TRP A 54 22.103 -0.472 -1.117 1.00 0.00 C ATOM 815 CZ2 TRP A 54 23.542 1.364 -2.709 1.00 0.00 C ATOM 816 CZ3 TRP A 54 22.815 0.567 -0.550 1.00 0.00 C ATOM 817 CH2 TRP A 54 23.525 1.475 -1.345 1.00 0.00 C ATOM 0 H TRP A 54 21.650 -4.130 -4.757 1.00 0.00 H new ATOM 0 HA TRP A 54 22.155 -3.718 -1.934 1.00 0.00 H new ATOM 0 HB2 TRP A 54 19.931 -2.904 -3.831 1.00 0.00 H new ATOM 0 HB3 TRP A 54 20.021 -2.419 -2.150 1.00 0.00 H new ATOM 0 HD1 TRP A 54 21.561 -1.655 -5.566 1.00 0.00 H new ATOM 0 HE1 TRP A 54 23.065 0.447 -5.393 1.00 0.00 H new ATOM 0 HE3 TRP A 54 21.557 -1.167 -0.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 24.093 2.063 -3.321 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 22.824 0.681 0.524 1.00 0.00 H new ATOM 0 HH2 TRP A 54 24.070 2.279 -0.872 1.00 0.00 H new ATOM 828 N VAL A 55 20.891 -5.571 -1.004 1.00 0.00 N ATOM 829 CA VAL A 55 20.160 -6.632 -0.333 1.00 0.00 C ATOM 830 C VAL A 55 19.251 -6.023 0.719 1.00 0.00 C ATOM 831 O VAL A 55 19.632 -5.050 1.372 1.00 0.00 O ATOM 832 CB VAL A 55 21.134 -7.625 0.330 1.00 0.00 C ATOM 833 CG1 VAL A 55 20.613 -8.096 1.675 1.00 0.00 C ATOM 834 CG2 VAL A 55 21.396 -8.812 -0.583 1.00 0.00 C ATOM 0 H VAL A 55 21.734 -5.276 -0.511 1.00 0.00 H new ATOM 0 HA VAL A 55 19.564 -7.173 -1.068 1.00 0.00 H new ATOM 0 HB VAL A 55 22.075 -7.102 0.499 1.00 0.00 H new ATOM 0 HG11 VAL A 55 21.324 -8.795 2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 55 20.488 -7.239 2.337 1.00 0.00 H new ATOM 0 HG13 VAL A 55 19.652 -8.592 1.539 1.00 0.00 H new ATOM 0 HG21 VAL A 55 22.086 -9.501 -0.096 1.00 0.00 H new ATOM 0 HG22 VAL A 55 20.457 -9.325 -0.791 1.00 0.00 H new ATOM 0 HG23 VAL A 55 21.833 -8.462 -1.518 1.00 0.00 H new ATOM 844 N TYR A 56 18.062 -6.595 0.904 1.00 0.00 N ATOM 845 CA TYR A 56 17.149 -6.072 1.913 1.00 0.00 C ATOM 846 C TYR A 56 15.804 -6.793 1.910 1.00 0.00 C ATOM 847 O TYR A 56 15.521 -7.583 1.008 1.00 0.00 O ATOM 848 CB TYR A 56 16.927 -4.573 1.690 1.00 0.00 C ATOM 849 CG TYR A 56 16.597 -4.232 0.251 1.00 0.00 C ATOM 850 CD1 TYR A 56 15.313 -4.404 -0.249 1.00 0.00 C ATOM 851 CD2 TYR A 56 17.574 -3.743 -0.610 1.00 0.00 C ATOM 852 CE1 TYR A 56 15.013 -4.099 -1.564 1.00 0.00 C ATOM 853 CE2 TYR A 56 17.280 -3.435 -1.924 1.00 0.00 C ATOM 854 CZ TYR A 56 15.999 -3.615 -2.396 1.00 0.00 C ATOM 855 OH TYR A 56 15.704 -3.309 -3.705 1.00 0.00 O ATOM 0 H TYR A 56 17.716 -7.400 0.382 1.00 0.00 H new ATOM 0 HA TYR A 56 17.612 -6.243 2.885 1.00 0.00 H new ATOM 0 HB2 TYR A 56 16.116 -4.231 2.334 1.00 0.00 H new ATOM 0 HB3 TYR A 56 17.823 -4.030 1.990 1.00 0.00 H new ATOM 0 HD1 TYR A 56 14.536 -4.782 0.399 1.00 0.00 H new ATOM 0 HD2 TYR A 56 18.580 -3.602 -0.245 1.00 0.00 H new ATOM 0 HE1 TYR A 56 14.009 -4.240 -1.938 1.00 0.00 H new ATOM 0 HE2 TYR A 56 18.051 -3.055 -2.578 1.00 0.00 H new ATOM 0 HH TYR A 56 16.510 -2.979 -4.154 1.00 0.00 H new ATOM 865 N ASN A 57 14.980 -6.524 2.913 1.00 0.00 N ATOM 866 CA ASN A 57 13.673 -7.161 3.010 1.00 0.00 C ATOM 867 C ASN A 57 12.568 -6.209 2.568 1.00 0.00 C ATOM 868 O ASN A 57 12.807 -5.019 2.360 1.00 0.00 O ATOM 869 CB ASN A 57 13.415 -7.618 4.448 1.00 0.00 C ATOM 870 CG ASN A 57 14.461 -8.598 4.946 1.00 0.00 C ATOM 871 OD1 ASN A 57 15.608 -8.581 4.499 1.00 0.00 O ATOM 872 ND2 ASN A 57 14.070 -9.455 5.881 1.00 0.00 N ATOM 0 H ASN A 57 15.191 -5.872 3.668 1.00 0.00 H new ATOM 0 HA ASN A 57 13.669 -8.027 2.348 1.00 0.00 H new ATOM 0 HB2 ASN A 57 13.397 -6.748 5.104 1.00 0.00 H new ATOM 0 HB3 ASN A 57 12.431 -8.082 4.507 1.00 0.00 H new ATOM 0 HD21 ASN A 57 14.730 -10.135 6.258 1.00 0.00 H new ATOM 0 HD22 ASN A 57 13.109 -9.434 6.223 1.00 0.00 H new ATOM 879 N THR A 58 11.357 -6.740 2.423 1.00 0.00 N ATOM 880 CA THR A 58 10.212 -5.935 2.027 1.00 0.00 C ATOM 881 C THR A 58 9.420 -5.549 3.266 1.00 0.00 C ATOM 882 O THR A 58 8.987 -6.413 4.028 1.00 0.00 O ATOM 883 CB THR A 58 9.297 -6.684 1.040 1.00 0.00 C ATOM 884 OG1 THR A 58 10.090 -7.372 0.064 1.00 0.00 O ATOM 885 CG2 THR A 58 8.357 -5.716 0.337 1.00 0.00 C ATOM 0 H THR A 58 11.146 -7.726 2.575 1.00 0.00 H new ATOM 0 HA THR A 58 10.584 -5.044 1.521 1.00 0.00 H new ATOM 0 HB THR A 58 8.703 -7.404 1.603 1.00 0.00 H new ATOM 0 HG1 THR A 58 9.502 -7.847 -0.559 1.00 0.00 H new ATOM 0 HG21 THR A 58 7.720 -6.266 -0.356 1.00 0.00 H new ATOM 0 HG22 THR A 58 7.737 -5.209 1.076 1.00 0.00 H new ATOM 0 HG23 THR A 58 8.940 -4.978 -0.214 1.00 0.00 H new ATOM 893 N PHE A 59 9.232 -4.253 3.467 1.00 0.00 N ATOM 894 CA PHE A 59 8.528 -3.769 4.646 1.00 0.00 C ATOM 895 C PHE A 59 7.339 -2.877 4.294 1.00 0.00 C ATOM 896 O PHE A 59 7.000 -1.972 5.056 1.00 0.00 O ATOM 897 CB PHE A 59 9.511 -3.012 5.534 1.00 0.00 C ATOM 898 CG PHE A 59 10.541 -2.240 4.756 1.00 0.00 C ATOM 899 CD1 PHE A 59 10.222 -1.024 4.177 1.00 0.00 C ATOM 900 CD2 PHE A 59 11.825 -2.738 4.600 1.00 0.00 C ATOM 901 CE1 PHE A 59 11.166 -0.315 3.457 1.00 0.00 C ATOM 902 CE2 PHE A 59 12.772 -2.034 3.880 1.00 0.00 C ATOM 903 CZ PHE A 59 12.442 -0.820 3.307 1.00 0.00 C ATOM 0 H PHE A 59 9.555 -3.521 2.834 1.00 0.00 H new ATOM 0 HA PHE A 59 8.125 -4.632 5.175 1.00 0.00 H new ATOM 0 HB2 PHE A 59 8.957 -2.324 6.173 1.00 0.00 H new ATOM 0 HB3 PHE A 59 10.017 -3.720 6.190 1.00 0.00 H new ATOM 0 HD1 PHE A 59 9.225 -0.624 4.289 1.00 0.00 H new ATOM 0 HD2 PHE A 59 12.088 -3.686 5.046 1.00 0.00 H new ATOM 0 HE1 PHE A 59 10.905 0.634 3.012 1.00 0.00 H new ATOM 0 HE2 PHE A 59 13.769 -2.432 3.765 1.00 0.00 H new ATOM 0 HZ PHE A 59 13.180 -0.268 2.744 1.00 0.00 H new ATOM 913 N CYS A 60 6.717 -3.145 3.144 1.00 0.00 N ATOM 914 CA CYS A 60 5.549 -2.386 2.673 1.00 0.00 C ATOM 915 C CYS A 60 5.410 -2.515 1.163 1.00 0.00 C ATOM 916 O CYS A 60 6.403 -2.455 0.439 1.00 0.00 O ATOM 917 CB CYS A 60 5.649 -0.904 3.049 1.00 0.00 C ATOM 918 SG CYS A 60 7.272 -0.159 2.692 1.00 0.00 S ATOM 0 H CYS A 60 7.005 -3.892 2.512 1.00 0.00 H new ATOM 0 HA CYS A 60 4.669 -2.805 3.161 1.00 0.00 H new ATOM 0 HB2 CYS A 60 4.880 -0.350 2.511 1.00 0.00 H new ATOM 0 HB3 CYS A 60 5.436 -0.794 4.112 1.00 0.00 H new ATOM 923 N ILE A 61 4.180 -2.694 0.685 1.00 0.00 N ATOM 924 CA ILE A 61 3.946 -2.822 -0.749 1.00 0.00 C ATOM 925 C ILE A 61 2.591 -2.284 -1.171 1.00 0.00 C ATOM 926 O ILE A 61 1.548 -2.817 -0.799 1.00 0.00 O ATOM 927 CB ILE A 61 4.049 -4.277 -1.229 1.00 0.00 C ATOM 928 CG1 ILE A 61 3.402 -5.224 -0.221 1.00 0.00 C ATOM 929 CG2 ILE A 61 5.496 -4.643 -1.472 1.00 0.00 C ATOM 930 CD1 ILE A 61 3.328 -6.660 -0.695 1.00 0.00 C ATOM 0 H ILE A 61 3.341 -2.753 1.262 1.00 0.00 H new ATOM 0 HA ILE A 61 4.732 -2.225 -1.213 1.00 0.00 H new ATOM 0 HB ILE A 61 3.509 -4.376 -2.170 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.965 -5.187 0.712 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.395 -4.871 0.000 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.558 -5.677 -1.812 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.915 -3.985 -2.233 1.00 0.00 H new ATOM 0 HG23 ILE A 61 6.060 -4.531 -0.546 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.857 -7.273 0.073 1.00 0.00 H new ATOM 0 HD12 ILE A 61 2.740 -6.711 -1.611 1.00 0.00 H new ATOM 0 HD13 ILE A 61 4.334 -7.031 -0.889 1.00 0.00 H new ATOM 942 N TYR A 62 2.622 -1.229 -1.965 1.00 0.00 N ATOM 943 CA TYR A 62 1.402 -0.639 -2.487 1.00 0.00 C ATOM 944 C TYR A 62 0.633 -1.685 -3.278 1.00 0.00 C ATOM 945 O TYR A 62 1.108 -2.210 -4.284 1.00 0.00 O ATOM 946 CB TYR A 62 1.715 0.584 -3.344 1.00 0.00 C ATOM 947 CG TYR A 62 1.039 1.830 -2.829 1.00 0.00 C ATOM 948 CD1 TYR A 62 -0.346 1.939 -2.818 1.00 0.00 C ATOM 949 CD2 TYR A 62 1.786 2.886 -2.328 1.00 0.00 C ATOM 950 CE1 TYR A 62 -0.968 3.068 -2.322 1.00 0.00 C ATOM 951 CE2 TYR A 62 1.177 4.020 -1.834 1.00 0.00 C ATOM 952 CZ TYR A 62 -0.200 4.108 -1.830 1.00 0.00 C ATOM 953 OH TYR A 62 -0.811 5.235 -1.332 1.00 0.00 O ATOM 0 H TYR A 62 3.479 -0.763 -2.263 1.00 0.00 H new ATOM 0 HA TYR A 62 0.782 -0.302 -1.656 1.00 0.00 H new ATOM 0 HB2 TYR A 62 2.793 0.742 -3.369 1.00 0.00 H new ATOM 0 HB3 TYR A 62 1.397 0.398 -4.370 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -0.946 1.128 -3.203 1.00 0.00 H new ATOM 0 HD2 TYR A 62 2.864 2.819 -2.325 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.046 3.138 -2.318 1.00 0.00 H new ATOM 0 HE2 TYR A 62 1.774 4.835 -1.452 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.129 5.869 -1.026 1.00 0.00 H new ATOM 963 N LYS A 63 -0.567 -1.969 -2.791 1.00 0.00 N ATOM 964 CA LYS A 63 -1.434 -2.985 -3.368 1.00 0.00 C ATOM 965 C LYS A 63 -2.870 -2.750 -2.923 1.00 0.00 C ATOM 966 O LYS A 63 -3.256 -3.158 -1.828 1.00 0.00 O ATOM 967 CB LYS A 63 -0.927 -4.343 -2.882 1.00 0.00 C ATOM 968 CG LYS A 63 -1.918 -5.486 -2.977 1.00 0.00 C ATOM 969 CD LYS A 63 -1.783 -6.429 -1.783 1.00 0.00 C ATOM 970 CE LYS A 63 -0.326 -6.702 -1.426 1.00 0.00 C ATOM 971 NZ LYS A 63 0.010 -8.149 -1.526 1.00 0.00 N ATOM 0 H LYS A 63 -0.968 -1.498 -1.980 1.00 0.00 H new ATOM 0 HA LYS A 63 -1.416 -2.947 -4.457 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -0.040 -4.607 -3.458 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -0.614 -4.243 -1.843 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.933 -5.090 -3.019 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.753 -6.039 -3.902 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -2.291 -5.996 -0.921 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -2.283 -7.371 -2.008 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.323 -6.132 -2.091 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.129 -6.353 -0.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.042 -8.270 -1.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -0.437 -8.664 -0.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.340 -8.525 -2.430 1.00 0.00 H new ATOM 985 N ARG A 64 -3.669 -2.100 -3.764 1.00 0.00 N ATOM 986 CA ARG A 64 -5.051 -1.805 -3.420 1.00 0.00 C ATOM 987 C ARG A 64 -5.971 -2.879 -3.995 1.00 0.00 C ATOM 988 O ARG A 64 -5.590 -4.043 -4.069 1.00 0.00 O ATOM 989 CB ARG A 64 -5.452 -0.421 -3.942 1.00 0.00 C ATOM 990 CG ARG A 64 -5.250 -0.239 -5.438 1.00 0.00 C ATOM 991 CD ARG A 64 -3.819 0.154 -5.767 1.00 0.00 C ATOM 992 NE ARG A 64 -3.649 0.460 -7.184 1.00 0.00 N ATOM 993 CZ ARG A 64 -2.465 0.633 -7.764 1.00 0.00 C ATOM 994 NH1 ARG A 64 -1.352 0.528 -7.051 1.00 0.00 N ATOM 995 NH2 ARG A 64 -2.393 0.911 -9.059 1.00 0.00 N ATOM 0 H ARG A 64 -3.382 -1.769 -4.685 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.149 -1.801 -2.334 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.501 -0.245 -3.704 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -4.873 0.337 -3.413 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -5.501 -1.165 -5.955 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -5.932 0.527 -5.807 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.535 1.022 -5.172 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.147 -0.657 -5.488 1.00 0.00 H new ATOM 0 HE ARG A 64 -4.485 0.546 -7.762 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -1.403 0.314 -6.055 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -0.445 0.661 -7.499 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -3.247 0.992 -9.611 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -1.484 1.043 -9.502 1.00 0.00 H new ATOM 1009 N CYS A 65 -7.176 -2.488 -4.410 1.00 0.00 N ATOM 1010 CA CYS A 65 -8.129 -3.437 -4.973 1.00 0.00 C ATOM 1011 C CYS A 65 -8.925 -2.786 -6.093 1.00 0.00 C ATOM 1012 O CYS A 65 -8.918 -1.563 -6.235 1.00 0.00 O ATOM 1013 CB CYS A 65 -9.085 -3.933 -3.888 1.00 0.00 C ATOM 1014 SG CYS A 65 -8.346 -4.020 -2.226 1.00 0.00 S ATOM 0 H CYS A 65 -7.512 -1.526 -4.366 1.00 0.00 H new ATOM 0 HA CYS A 65 -7.573 -4.284 -5.376 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -9.952 -3.273 -3.854 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -9.448 -4.923 -4.164 1.00 0.00 H new ATOM 1019 N ARG A 66 -9.611 -3.598 -6.893 1.00 0.00 N ATOM 1020 CA ARG A 66 -10.411 -3.059 -7.981 1.00 0.00 C ATOM 1021 C ARG A 66 -11.542 -2.217 -7.410 1.00 0.00 C ATOM 1022 O ARG A 66 -12.055 -2.491 -6.329 1.00 0.00 O ATOM 1023 CB ARG A 66 -10.958 -4.179 -8.871 1.00 0.00 C ATOM 1024 CG ARG A 66 -11.840 -3.683 -10.005 1.00 0.00 C ATOM 1025 CD ARG A 66 -11.067 -2.779 -10.950 1.00 0.00 C ATOM 1026 NE ARG A 66 -10.049 -3.509 -11.701 1.00 0.00 N ATOM 1027 CZ ARG A 66 -9.104 -2.918 -12.429 1.00 0.00 C ATOM 1028 NH1 ARG A 66 -9.049 -1.594 -12.500 1.00 0.00 N ATOM 1029 NH2 ARG A 66 -8.214 -3.650 -13.084 1.00 0.00 N ATOM 0 H ARG A 66 -9.628 -4.614 -6.809 1.00 0.00 H new ATOM 0 HA ARG A 66 -9.778 -2.428 -8.605 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -10.122 -4.738 -9.291 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -11.529 -4.874 -8.255 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -12.239 -4.534 -10.557 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -12.692 -3.141 -9.595 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -11.760 -2.306 -11.646 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -10.593 -1.980 -10.380 1.00 0.00 H new ATOM 0 HE ARG A 66 -10.063 -4.528 -11.666 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -9.731 -1.027 -11.996 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -8.324 -1.143 -13.058 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -8.252 -4.668 -13.031 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -7.491 -3.195 -13.641 1.00 0.00 H new ATOM 1043 N HIS A 67 -11.922 -1.194 -8.154 1.00 0.00 N ATOM 1044 CA HIS A 67 -12.992 -0.297 -7.737 1.00 0.00 C ATOM 1045 C HIS A 67 -14.277 -1.064 -7.402 1.00 0.00 C ATOM 1046 O HIS A 67 -14.700 -1.945 -8.150 1.00 0.00 O ATOM 1047 CB HIS A 67 -13.267 0.728 -8.840 1.00 0.00 C ATOM 1048 CG HIS A 67 -14.121 1.875 -8.402 1.00 0.00 C ATOM 1049 ND1 HIS A 67 -15.467 1.968 -8.692 1.00 0.00 N ATOM 1050 CD2 HIS A 67 -13.813 2.987 -7.696 1.00 0.00 C ATOM 1051 CE1 HIS A 67 -15.948 3.090 -8.185 1.00 0.00 C ATOM 1052 NE2 HIS A 67 -14.965 3.726 -7.575 1.00 0.00 N ATOM 0 H HIS A 67 -11.505 -0.960 -9.055 1.00 0.00 H new ATOM 0 HA HIS A 67 -12.667 0.215 -6.832 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -12.317 1.115 -9.208 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.752 0.225 -9.677 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -12.842 3.246 -7.301 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -16.971 3.429 -8.257 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -15.047 4.621 -7.092 1.00 0.00 H new ATOM 1061 N PRO A 68 -14.907 -0.726 -6.260 1.00 0.00 N ATOM 1062 CA PRO A 68 -16.162 -1.352 -5.803 1.00 0.00 C ATOM 1063 C PRO A 68 -17.293 -1.216 -6.813 1.00 0.00 C ATOM 1064 O PRO A 68 -18.142 -2.099 -6.937 1.00 0.00 O ATOM 1065 CB PRO A 68 -16.523 -0.549 -4.544 1.00 0.00 C ATOM 1066 CG PRO A 68 -15.722 0.702 -4.630 1.00 0.00 C ATOM 1067 CD PRO A 68 -14.454 0.314 -5.322 1.00 0.00 C ATOM 0 HA PRO A 68 -16.031 -2.422 -5.644 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -17.590 -0.331 -4.510 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -16.283 -1.108 -3.639 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -16.255 1.472 -5.188 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -15.520 1.109 -3.639 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -14.000 1.158 -5.841 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -13.710 -0.067 -4.622 1.00 0.00 H new ATOM 1075 N GLY A 69 -17.294 -0.101 -7.530 1.00 0.00 N ATOM 1076 CA GLY A 69 -18.348 0.166 -8.491 1.00 0.00 C ATOM 1077 C GLY A 69 -19.230 1.306 -8.027 1.00 0.00 C ATOM 1078 O GLY A 69 -18.993 1.915 -6.983 1.00 0.00 O ATOM 0 H GLY A 69 -16.582 0.626 -7.464 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -17.909 0.411 -9.458 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -18.951 -0.731 -8.633 1.00 0.00 H new ATOM 1082 N GLU A 70 -20.247 1.590 -8.831 1.00 0.00 N ATOM 1083 CA GLU A 70 -21.191 2.656 -8.529 1.00 0.00 C ATOM 1084 C GLU A 70 -22.273 2.168 -7.582 1.00 0.00 C ATOM 1085 O GLU A 70 -22.937 1.164 -7.829 1.00 0.00 O ATOM 1086 CB GLU A 70 -21.805 3.222 -9.811 1.00 0.00 C ATOM 1087 CG GLU A 70 -22.753 4.387 -9.575 1.00 0.00 C ATOM 1088 CD GLU A 70 -22.051 5.603 -9.002 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -21.471 6.379 -9.791 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -22.080 5.779 -7.767 1.00 0.00 O ATOM 0 H GLU A 70 -20.439 1.094 -9.701 1.00 0.00 H new ATOM 0 HA GLU A 70 -20.645 3.459 -8.034 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -21.003 3.547 -10.474 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -22.343 2.427 -10.327 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -23.231 4.658 -10.516 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -23.544 4.074 -8.894 1.00 0.00 H new ATOM 1097 N LEU A 71 -22.456 2.922 -6.509 1.00 0.00 N ATOM 1098 CA LEU A 71 -23.469 2.619 -5.516 1.00 0.00 C ATOM 1099 C LEU A 71 -24.667 3.536 -5.746 1.00 0.00 C ATOM 1100 O LEU A 71 -24.658 4.699 -5.342 1.00 0.00 O ATOM 1101 CB LEU A 71 -22.885 2.806 -4.112 1.00 0.00 C ATOM 1102 CG LEU A 71 -23.884 2.700 -2.966 1.00 0.00 C ATOM 1103 CD1 LEU A 71 -24.589 1.351 -2.975 1.00 0.00 C ATOM 1104 CD2 LEU A 71 -23.192 2.935 -1.632 1.00 0.00 C ATOM 0 H LEU A 71 -21.908 3.757 -6.305 1.00 0.00 H new ATOM 0 HA LEU A 71 -23.796 1.583 -5.606 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -22.104 2.061 -3.960 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -22.406 3.784 -4.064 1.00 0.00 H new ATOM 0 HG LEU A 71 -24.640 3.473 -3.105 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -25.296 1.304 -2.146 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -25.125 1.227 -3.916 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -23.852 0.555 -2.869 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -23.921 2.856 -0.825 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -22.411 2.188 -1.491 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -22.748 3.930 -1.623 1.00 0.00 H new ATOM 1116 N ARG A 72 -25.696 3.002 -6.403 1.00 0.00 N ATOM 1117 CA ARG A 72 -26.892 3.791 -6.689 1.00 0.00 C ATOM 1118 C ARG A 72 -27.566 4.191 -5.387 1.00 0.00 C ATOM 1119 O ARG A 72 -27.805 3.359 -4.510 1.00 0.00 O ATOM 1120 CB ARG A 72 -27.862 3.046 -7.606 1.00 0.00 C ATOM 1121 CG ARG A 72 -29.093 3.859 -7.973 1.00 0.00 C ATOM 1122 CD ARG A 72 -30.028 3.082 -8.886 1.00 0.00 C ATOM 1123 NE ARG A 72 -30.561 1.889 -8.236 1.00 0.00 N ATOM 1124 CZ ARG A 72 -31.369 1.021 -8.836 1.00 0.00 C ATOM 1125 NH1 ARG A 72 -31.734 1.211 -10.096 1.00 0.00 N ATOM 1126 NH2 ARG A 72 -31.812 -0.040 -8.175 1.00 0.00 N ATOM 0 H ARG A 72 -25.726 2.041 -6.743 1.00 0.00 H new ATOM 0 HA ARG A 72 -26.586 4.691 -7.222 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -27.340 2.760 -8.519 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -28.177 2.124 -7.117 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -29.625 4.144 -7.065 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -28.786 4.781 -8.466 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -30.852 3.726 -9.194 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -29.494 2.793 -9.791 1.00 0.00 H new ATOM 0 HE ARG A 72 -30.299 1.711 -7.266 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -31.395 2.025 -10.608 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -32.354 0.543 -10.554 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -31.533 -0.190 -7.206 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -32.432 -0.706 -8.636 1.00 0.00 H new ATOM 1140 N ASN A 73 -27.864 5.483 -5.276 1.00 0.00 N ATOM 1141 CA ASN A 73 -28.444 6.032 -4.064 1.00 0.00 C ATOM 1142 C ASN A 73 -27.434 5.810 -2.956 1.00 0.00 C ATOM 1143 O ASN A 73 -27.772 5.341 -1.871 1.00 0.00 O ATOM 1144 CB ASN A 73 -29.783 5.365 -3.730 1.00 0.00 C ATOM 1145 CG ASN A 73 -30.729 5.329 -4.915 1.00 0.00 C ATOM 1146 OD1 ASN A 73 -31.552 4.421 -5.038 1.00 0.00 O ATOM 1147 ND2 ASN A 73 -30.618 6.317 -5.796 1.00 0.00 N ATOM 0 H ASN A 73 -27.711 6.168 -6.016 1.00 0.00 H new ATOM 0 HA ASN A 73 -28.657 7.094 -4.190 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -29.601 4.347 -3.384 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -30.257 5.901 -2.908 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -31.229 6.343 -6.613 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -29.922 7.050 -5.656 1.00 0.00 H new ATOM 1154 N GLY A 74 -26.188 6.174 -3.240 1.00 0.00 N ATOM 1155 CA GLY A 74 -25.134 5.987 -2.273 1.00 0.00 C ATOM 1156 C GLY A 74 -23.848 6.681 -2.670 1.00 0.00 C ATOM 1157 O GLY A 74 -23.747 7.239 -3.764 1.00 0.00 O ATOM 0 H GLY A 74 -25.894 6.594 -4.122 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -25.463 6.366 -1.305 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -24.944 4.921 -2.150 1.00 0.00 H new ATOM 1161 N GLN A 75 -22.860 6.645 -1.780 1.00 0.00 N ATOM 1162 CA GLN A 75 -21.573 7.281 -2.040 1.00 0.00 C ATOM 1163 C GLN A 75 -20.433 6.488 -1.409 1.00 0.00 C ATOM 1164 O GLN A 75 -19.915 6.864 -0.357 1.00 0.00 O ATOM 1165 CB GLN A 75 -21.564 8.714 -1.498 1.00 0.00 C ATOM 1166 CG GLN A 75 -22.596 9.623 -2.146 1.00 0.00 C ATOM 1167 CD GLN A 75 -22.589 11.020 -1.558 1.00 0.00 C ATOM 1168 OE1 GLN A 75 -23.307 11.307 -0.601 1.00 0.00 O ATOM 1169 NE2 GLN A 75 -21.774 11.899 -2.130 1.00 0.00 N ATOM 0 H GLN A 75 -22.926 6.182 -0.873 1.00 0.00 H new ATOM 0 HA GLN A 75 -21.426 7.304 -3.120 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -21.742 8.687 -0.423 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -20.573 9.142 -1.646 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -22.402 9.682 -3.217 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -23.587 9.186 -2.025 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -21.196 11.618 -2.922 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -21.726 12.855 -1.777 1.00 0.00 H new ATOM 1178 N VAL A 76 -20.060 5.381 -2.047 1.00 0.00 N ATOM 1179 CA VAL A 76 -18.974 4.547 -1.543 1.00 0.00 C ATOM 1180 C VAL A 76 -17.766 5.403 -1.168 1.00 0.00 C ATOM 1181 O VAL A 76 -17.171 6.054 -2.027 1.00 0.00 O ATOM 1182 CB VAL A 76 -18.559 3.472 -2.570 1.00 0.00 C ATOM 1183 CG1 VAL A 76 -18.766 3.980 -3.979 1.00 0.00 C ATOM 1184 CG2 VAL A 76 -17.118 3.031 -2.354 1.00 0.00 C ATOM 0 H VAL A 76 -20.491 5.043 -2.908 1.00 0.00 H new ATOM 0 HA VAL A 76 -19.342 4.039 -0.651 1.00 0.00 H new ATOM 0 HB VAL A 76 -19.195 2.599 -2.423 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -18.469 3.210 -4.691 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -19.818 4.224 -4.127 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -18.161 4.873 -4.136 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -16.855 2.274 -3.092 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -16.455 3.889 -2.462 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -17.011 2.614 -1.353 1.00 0.00 H new ATOM 1194 N GLU A 77 -17.409 5.406 0.110 1.00 0.00 N ATOM 1195 CA GLU A 77 -16.273 6.193 0.580 1.00 0.00 C ATOM 1196 C GLU A 77 -14.989 5.784 -0.136 1.00 0.00 C ATOM 1197 O GLU A 77 -14.459 4.698 0.094 1.00 0.00 O ATOM 1198 CB GLU A 77 -16.102 6.030 2.092 1.00 0.00 C ATOM 1199 CG GLU A 77 -15.032 6.930 2.685 1.00 0.00 C ATOM 1200 CD GLU A 77 -15.341 8.403 2.505 1.00 0.00 C ATOM 1201 OE1 GLU A 77 -16.039 8.974 3.369 1.00 0.00 O ATOM 1202 OE2 GLU A 77 -14.884 8.986 1.500 1.00 0.00 O ATOM 0 H GLU A 77 -17.887 4.875 0.838 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.474 7.240 0.354 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -17.053 6.240 2.581 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -15.853 4.992 2.311 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -14.928 6.712 3.748 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.073 6.704 2.218 1.00 0.00 H new ATOM 1209 N ILE A 78 -14.495 6.662 -1.005 1.00 0.00 N ATOM 1210 CA ILE A 78 -13.272 6.393 -1.752 1.00 0.00 C ATOM 1211 C ILE A 78 -12.312 7.570 -1.675 1.00 0.00 C ATOM 1212 O ILE A 78 -12.530 8.609 -2.299 1.00 0.00 O ATOM 1213 CB ILE A 78 -13.566 6.082 -3.233 1.00 0.00 C ATOM 1214 CG1 ILE A 78 -14.333 4.764 -3.352 1.00 0.00 C ATOM 1215 CG2 ILE A 78 -12.274 6.031 -4.040 1.00 0.00 C ATOM 1216 CD1 ILE A 78 -13.501 3.535 -3.041 1.00 0.00 C ATOM 0 H ILE A 78 -14.923 7.565 -1.208 1.00 0.00 H new ATOM 0 HA ILE A 78 -12.812 5.518 -1.292 1.00 0.00 H new ATOM 0 HB ILE A 78 -14.185 6.881 -3.640 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -15.188 4.791 -2.677 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -14.728 4.676 -4.364 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -12.504 5.810 -5.082 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -11.767 6.994 -3.977 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -11.625 5.252 -3.639 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -14.117 2.642 -3.148 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -12.660 3.481 -3.732 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -13.127 3.598 -2.019 1.00 0.00 H new ATOM 1228 N LYS A 79 -11.248 7.400 -0.903 1.00 0.00 N ATOM 1229 CA LYS A 79 -10.244 8.438 -0.748 1.00 0.00 C ATOM 1230 C LYS A 79 -8.851 7.838 -0.767 1.00 0.00 C ATOM 1231 O LYS A 79 -7.947 8.360 -1.422 1.00 0.00 O ATOM 1232 CB LYS A 79 -10.453 9.216 0.558 1.00 0.00 C ATOM 1233 CG LYS A 79 -10.444 8.353 1.813 1.00 0.00 C ATOM 1234 CD LYS A 79 -11.730 7.568 1.971 1.00 0.00 C ATOM 1235 CE LYS A 79 -11.681 6.686 3.205 1.00 0.00 C ATOM 1236 NZ LYS A 79 -10.320 6.133 3.445 1.00 0.00 N ATOM 0 H LYS A 79 -11.059 6.549 -0.373 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.348 9.128 -1.585 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -9.672 9.971 0.646 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -11.404 9.746 0.503 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -9.601 7.663 1.773 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -10.296 8.986 2.688 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -12.573 8.255 2.044 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -11.896 6.953 1.086 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -11.996 7.263 4.075 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -12.390 5.866 3.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -10.379 5.351 4.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -9.925 5.782 2.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -9.704 6.879 3.826 1.00 0.00 H new ATOM 1250 N THR A 80 -8.681 6.737 -0.048 1.00 0.00 N ATOM 1251 CA THR A 80 -7.392 6.072 0.028 1.00 0.00 C ATOM 1252 C THR A 80 -7.189 5.140 -1.151 1.00 0.00 C ATOM 1253 O THR A 80 -6.341 4.248 -1.112 1.00 0.00 O ATOM 1254 CB THR A 80 -7.263 5.274 1.335 1.00 0.00 C ATOM 1255 OG1 THR A 80 -8.258 4.243 1.380 1.00 0.00 O ATOM 1256 CG2 THR A 80 -7.422 6.193 2.534 1.00 0.00 C ATOM 0 H THR A 80 -9.421 6.287 0.490 1.00 0.00 H new ATOM 0 HA THR A 80 -6.625 6.846 0.004 1.00 0.00 H new ATOM 0 HB THR A 80 -6.273 4.820 1.368 1.00 0.00 H new ATOM 0 HG1 THR A 80 -8.168 3.738 2.215 1.00 0.00 H new ATOM 0 HG21 THR A 80 -7.328 5.613 3.452 1.00 0.00 H new ATOM 0 HG22 THR A 80 -6.649 6.961 2.509 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.404 6.666 2.502 1.00 0.00 H new ATOM 1264 N ASP A 81 -7.979 5.351 -2.199 1.00 0.00 N ATOM 1265 CA ASP A 81 -7.886 4.533 -3.398 1.00 0.00 C ATOM 1266 C ASP A 81 -8.227 3.085 -3.094 1.00 0.00 C ATOM 1267 O ASP A 81 -7.946 2.194 -3.892 1.00 0.00 O ATOM 1268 CB ASP A 81 -6.478 4.606 -3.966 1.00 0.00 C ATOM 1269 CG ASP A 81 -6.161 5.959 -4.573 1.00 0.00 C ATOM 1270 OD1 ASP A 81 -5.738 6.862 -3.823 1.00 0.00 O ATOM 1271 OD2 ASP A 81 -6.339 6.115 -5.800 1.00 0.00 O ATOM 0 H ASP A 81 -8.690 6.082 -2.240 1.00 0.00 H new ATOM 0 HA ASP A 81 -8.600 4.917 -4.127 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -5.760 4.390 -3.175 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -6.357 3.834 -4.726 1.00 0.00 H new ATOM 1276 N LEU A 82 -8.768 2.869 -1.896 1.00 0.00 N ATOM 1277 CA LEU A 82 -9.176 1.543 -1.425 1.00 0.00 C ATOM 1278 C LEU A 82 -7.994 0.586 -1.439 1.00 0.00 C ATOM 1279 O LEU A 82 -7.971 -0.398 -2.178 1.00 0.00 O ATOM 1280 CB LEU A 82 -10.378 0.991 -2.199 1.00 0.00 C ATOM 1281 CG LEU A 82 -10.211 0.838 -3.701 1.00 0.00 C ATOM 1282 CD1 LEU A 82 -10.851 -0.454 -4.144 1.00 0.00 C ATOM 1283 CD2 LEU A 82 -10.812 2.031 -4.428 1.00 0.00 C ATOM 0 H LEU A 82 -8.937 3.613 -1.219 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.511 1.647 -0.393 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -10.631 0.015 -1.784 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -11.230 1.646 -2.016 1.00 0.00 H new ATOM 0 HG LEU A 82 -9.150 0.805 -3.949 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -10.733 -0.568 -5.222 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -10.371 -1.291 -3.636 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -11.912 -0.439 -3.895 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -10.683 1.905 -5.503 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -11.875 2.101 -4.195 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.309 2.943 -4.107 1.00 0.00 H new ATOM 1295 N SER A 83 -7.013 0.898 -0.606 1.00 0.00 N ATOM 1296 CA SER A 83 -5.827 0.064 -0.465 1.00 0.00 C ATOM 1297 C SER A 83 -6.098 -1.072 0.520 1.00 0.00 C ATOM 1298 O SER A 83 -6.643 -0.845 1.601 1.00 0.00 O ATOM 1299 CB SER A 83 -4.641 0.904 0.016 1.00 0.00 C ATOM 1300 OG SER A 83 -4.354 1.950 -0.894 1.00 0.00 O ATOM 0 H SER A 83 -7.015 1.728 -0.013 1.00 0.00 H new ATOM 0 HA SER A 83 -5.582 -0.362 -1.438 1.00 0.00 H new ATOM 0 HB2 SER A 83 -4.862 1.323 0.998 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.764 0.267 0.131 1.00 0.00 H new ATOM 0 HG SER A 83 -5.072 2.616 -0.863 1.00 0.00 H new ATOM 1306 N PHE A 84 -5.725 -2.293 0.136 1.00 0.00 N ATOM 1307 CA PHE A 84 -5.928 -3.468 0.986 1.00 0.00 C ATOM 1308 C PHE A 84 -5.562 -3.163 2.436 1.00 0.00 C ATOM 1309 O PHE A 84 -4.617 -2.420 2.702 1.00 0.00 O ATOM 1310 CB PHE A 84 -5.092 -4.643 0.468 1.00 0.00 C ATOM 1311 CG PHE A 84 -5.013 -5.812 1.415 1.00 0.00 C ATOM 1312 CD1 PHE A 84 -4.073 -5.836 2.434 1.00 0.00 C ATOM 1313 CD2 PHE A 84 -5.873 -6.888 1.282 1.00 0.00 C ATOM 1314 CE1 PHE A 84 -3.994 -6.908 3.302 1.00 0.00 C ATOM 1315 CE2 PHE A 84 -5.799 -7.964 2.147 1.00 0.00 C ATOM 1316 CZ PHE A 84 -4.859 -7.974 3.158 1.00 0.00 C ATOM 0 H PHE A 84 -5.280 -2.495 -0.759 1.00 0.00 H new ATOM 0 HA PHE A 84 -6.984 -3.737 0.950 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -5.513 -4.984 -0.478 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.082 -4.291 0.259 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -3.393 -5.005 2.551 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -6.611 -6.887 0.493 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -3.257 -6.912 4.091 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -6.477 -8.797 2.032 1.00 0.00 H new ATOM 0 HZ PHE A 84 -4.801 -8.814 3.835 1.00 0.00 H new ATOM 1326 N GLY A 85 -6.312 -3.738 3.372 1.00 0.00 N ATOM 1327 CA GLY A 85 -6.048 -3.514 4.779 1.00 0.00 C ATOM 1328 C GLY A 85 -6.904 -2.400 5.342 1.00 0.00 C ATOM 1329 O GLY A 85 -6.423 -1.562 6.105 1.00 0.00 O ATOM 0 H GLY A 85 -7.100 -4.356 3.178 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.236 -4.433 5.335 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.995 -3.268 4.916 1.00 0.00 H new ATOM 1333 N SER A 86 -8.181 -2.393 4.965 1.00 0.00 N ATOM 1334 CA SER A 86 -9.108 -1.367 5.425 1.00 0.00 C ATOM 1335 C SER A 86 -10.534 -1.680 5.007 1.00 0.00 C ATOM 1336 O SER A 86 -11.037 -2.779 5.244 1.00 0.00 O ATOM 1337 CB SER A 86 -8.678 0.002 4.882 1.00 0.00 C ATOM 1338 OG SER A 86 -8.683 0.013 3.465 1.00 0.00 O ATOM 0 H SER A 86 -8.595 -3.087 4.342 1.00 0.00 H new ATOM 0 HA SER A 86 -9.082 -1.346 6.514 1.00 0.00 H new ATOM 0 HB2 SER A 86 -9.351 0.773 5.257 1.00 0.00 H new ATOM 0 HB3 SER A 86 -7.680 0.244 5.247 1.00 0.00 H new ATOM 0 HG SER A 86 -7.834 -0.345 3.132 1.00 0.00 H new ATOM 1344 N GLN A 87 -11.168 -0.707 4.377 1.00 0.00 N ATOM 1345 CA GLN A 87 -12.542 -0.853 3.921 1.00 0.00 C ATOM 1346 C GLN A 87 -13.070 0.451 3.341 1.00 0.00 C ATOM 1347 O GLN A 87 -12.476 1.515 3.522 1.00 0.00 O ATOM 1348 CB GLN A 87 -13.450 -1.320 5.067 1.00 0.00 C ATOM 1349 CG GLN A 87 -13.252 -0.556 6.368 1.00 0.00 C ATOM 1350 CD GLN A 87 -13.952 0.789 6.377 1.00 0.00 C ATOM 1351 OE1 GLN A 87 -15.116 0.893 6.763 1.00 0.00 O ATOM 1352 NE2 GLN A 87 -13.244 1.827 5.954 1.00 0.00 N ATOM 0 H GLN A 87 -10.751 0.200 4.168 1.00 0.00 H new ATOM 0 HA GLN A 87 -12.549 -1.609 3.135 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -14.490 -1.222 4.755 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -13.271 -2.380 5.250 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -13.624 -1.158 7.197 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -12.186 -0.406 6.536 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -12.282 1.695 5.643 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -13.662 2.757 5.940 1.00 0.00 H new ATOM 1361 N ILE A 88 -14.182 0.353 2.629 1.00 0.00 N ATOM 1362 CA ILE A 88 -14.808 1.513 2.014 1.00 0.00 C ATOM 1363 C ILE A 88 -16.260 1.645 2.463 1.00 0.00 C ATOM 1364 O ILE A 88 -17.171 1.153 1.798 1.00 0.00 O ATOM 1365 CB ILE A 88 -14.757 1.420 0.479 1.00 0.00 C ATOM 1366 CG1 ILE A 88 -15.077 -0.009 0.032 1.00 0.00 C ATOM 1367 CG2 ILE A 88 -13.390 1.853 -0.032 1.00 0.00 C ATOM 1368 CD1 ILE A 88 -15.157 -0.177 -1.467 1.00 0.00 C ATOM 0 H ILE A 88 -14.673 -0.525 2.462 1.00 0.00 H new ATOM 0 HA ILE A 88 -14.251 2.393 2.334 1.00 0.00 H new ATOM 0 HB ILE A 88 -15.505 2.091 0.057 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -14.313 -0.681 0.423 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -16.026 -0.314 0.473 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -13.369 1.782 -1.119 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -13.199 2.883 0.268 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -12.622 1.204 0.389 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -15.387 -1.216 -1.705 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -15.940 0.468 -1.864 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -14.201 0.095 -1.915 1.00 0.00 H new ATOM 1380 N GLU A 89 -16.468 2.306 3.598 1.00 0.00 N ATOM 1381 CA GLU A 89 -17.808 2.492 4.134 1.00 0.00 C ATOM 1382 C GLU A 89 -18.728 3.126 3.096 1.00 0.00 C ATOM 1383 O GLU A 89 -18.364 4.100 2.439 1.00 0.00 O ATOM 1384 CB GLU A 89 -17.761 3.360 5.392 1.00 0.00 C ATOM 1385 CG GLU A 89 -17.920 2.572 6.682 1.00 0.00 C ATOM 1386 CD GLU A 89 -17.949 3.463 7.909 1.00 0.00 C ATOM 1387 OE1 GLU A 89 -19.026 4.014 8.218 1.00 0.00 O ATOM 1388 OE2 GLU A 89 -16.894 3.609 8.562 1.00 0.00 O ATOM 0 H GLU A 89 -15.726 2.720 4.162 1.00 0.00 H new ATOM 0 HA GLU A 89 -18.207 1.511 4.393 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -16.812 3.896 5.418 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -18.549 4.110 5.335 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -18.841 1.991 6.637 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -17.099 1.861 6.773 1.00 0.00 H new ATOM 1395 N PHE A 90 -19.922 2.566 2.963 1.00 0.00 N ATOM 1396 CA PHE A 90 -20.904 3.055 2.003 1.00 0.00 C ATOM 1397 C PHE A 90 -21.968 3.890 2.699 1.00 0.00 C ATOM 1398 O PHE A 90 -22.223 3.712 3.890 1.00 0.00 O ATOM 1399 CB PHE A 90 -21.545 1.873 1.285 1.00 0.00 C ATOM 1400 CG PHE A 90 -20.539 0.961 0.649 1.00 0.00 C ATOM 1401 CD1 PHE A 90 -20.000 -0.096 1.365 1.00 0.00 C ATOM 1402 CD2 PHE A 90 -20.126 1.160 -0.661 1.00 0.00 C ATOM 1403 CE1 PHE A 90 -19.069 -0.936 0.790 1.00 0.00 C ATOM 1404 CE2 PHE A 90 -19.195 0.320 -1.241 1.00 0.00 C ATOM 1405 CZ PHE A 90 -18.665 -0.728 -0.513 1.00 0.00 C ATOM 0 H PHE A 90 -20.237 1.766 3.512 1.00 0.00 H new ATOM 0 HA PHE A 90 -20.400 3.690 1.274 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -22.145 1.305 1.996 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -22.226 2.245 0.519 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -20.312 -0.264 2.385 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -20.536 1.979 -1.232 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -18.657 -1.756 1.359 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -18.882 0.482 -2.262 1.00 0.00 H new ATOM 0 HZ PHE A 90 -17.935 -1.384 -0.964 1.00 0.00 H new ATOM 1415 N SER A 91 -22.589 4.807 1.960 1.00 0.00 N ATOM 1416 CA SER A 91 -23.623 5.665 2.519 1.00 0.00 C ATOM 1417 C SER A 91 -24.858 5.712 1.628 1.00 0.00 C ATOM 1418 O SER A 91 -24.803 6.179 0.494 1.00 0.00 O ATOM 1419 CB SER A 91 -23.088 7.082 2.720 1.00 0.00 C ATOM 1420 OG SER A 91 -22.474 7.570 1.539 1.00 0.00 O ATOM 0 H SER A 91 -22.392 4.972 0.973 1.00 0.00 H new ATOM 0 HA SER A 91 -23.910 5.241 3.481 1.00 0.00 H new ATOM 0 HB2 SER A 91 -23.904 7.744 3.009 1.00 0.00 H new ATOM 0 HB3 SER A 91 -22.367 7.089 3.537 1.00 0.00 H new ATOM 0 HG SER A 91 -23.011 7.312 0.761 1.00 0.00 H new ATOM 1426 N CYS A 92 -25.969 5.236 2.167 1.00 0.00 N ATOM 1427 CA CYS A 92 -27.218 5.257 1.414 1.00 0.00 C ATOM 1428 C CYS A 92 -27.849 6.640 1.545 1.00 0.00 C ATOM 1429 O CYS A 92 -28.142 7.096 2.650 1.00 0.00 O ATOM 1430 CB CYS A 92 -28.179 4.163 1.889 1.00 0.00 C ATOM 1431 SG CYS A 92 -27.763 2.489 1.291 1.00 0.00 S ATOM 0 H CYS A 92 -26.035 4.837 3.104 1.00 0.00 H new ATOM 0 HA CYS A 92 -27.006 5.053 0.365 1.00 0.00 H new ATOM 0 HB2 CYS A 92 -28.192 4.154 2.979 1.00 0.00 H new ATOM 0 HB3 CYS A 92 -29.188 4.414 1.561 1.00 0.00 H new ATOM 1436 N SER A 93 -28.042 7.303 0.405 1.00 0.00 N ATOM 1437 CA SER A 93 -28.602 8.656 0.375 1.00 0.00 C ATOM 1438 C SER A 93 -29.854 8.795 1.231 1.00 0.00 C ATOM 1439 O SER A 93 -30.429 7.810 1.687 1.00 0.00 O ATOM 1440 CB SER A 93 -28.927 9.066 -1.061 1.00 0.00 C ATOM 1441 OG SER A 93 -29.653 8.050 -1.731 1.00 0.00 O ATOM 0 H SER A 93 -27.818 6.924 -0.515 1.00 0.00 H new ATOM 0 HA SER A 93 -27.840 9.315 0.792 1.00 0.00 H new ATOM 0 HB2 SER A 93 -29.507 9.989 -1.056 1.00 0.00 H new ATOM 0 HB3 SER A 93 -28.003 9.273 -1.601 1.00 0.00 H new ATOM 0 HG SER A 93 -29.849 8.338 -2.647 1.00 0.00 H new ATOM 1447 N GLU A 94 -30.268 10.045 1.425 1.00 0.00 N ATOM 1448 CA GLU A 94 -31.449 10.361 2.219 1.00 0.00 C ATOM 1449 C GLU A 94 -32.629 9.469 1.837 1.00 0.00 C ATOM 1450 O GLU A 94 -32.759 9.041 0.691 1.00 0.00 O ATOM 1451 CB GLU A 94 -31.813 11.837 2.033 1.00 0.00 C ATOM 1452 CG GLU A 94 -33.218 12.184 2.490 1.00 0.00 C ATOM 1453 CD GLU A 94 -33.458 13.680 2.547 1.00 0.00 C ATOM 1454 OE1 GLU A 94 -33.875 14.254 1.520 1.00 0.00 O ATOM 1455 OE2 GLU A 94 -33.230 14.277 3.620 1.00 0.00 O ATOM 0 H GLU A 94 -29.796 10.862 1.038 1.00 0.00 H new ATOM 0 HA GLU A 94 -31.220 10.174 3.268 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -31.100 12.450 2.585 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -31.709 12.097 0.980 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -33.940 11.729 1.812 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -33.392 11.754 3.476 1.00 0.00 H new ATOM 1462 N GLY A 95 -33.487 9.206 2.819 1.00 0.00 N ATOM 1463 CA GLY A 95 -34.651 8.368 2.592 1.00 0.00 C ATOM 1464 C GLY A 95 -34.306 6.896 2.488 1.00 0.00 C ATOM 1465 O GLY A 95 -35.083 6.043 2.916 1.00 0.00 O ATOM 0 H GLY A 95 -33.396 9.560 3.771 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -35.361 8.513 3.406 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -35.148 8.685 1.675 1.00 0.00 H new ATOM 1469 N PHE A 96 -33.145 6.588 1.922 1.00 0.00 N ATOM 1470 CA PHE A 96 -32.728 5.202 1.757 1.00 0.00 C ATOM 1471 C PHE A 96 -31.588 4.883 2.715 1.00 0.00 C ATOM 1472 O PHE A 96 -30.576 5.581 2.743 1.00 0.00 O ATOM 1473 CB PHE A 96 -32.279 4.935 0.317 1.00 0.00 C ATOM 1474 CG PHE A 96 -33.071 5.678 -0.720 1.00 0.00 C ATOM 1475 CD1 PHE A 96 -34.341 5.257 -1.075 1.00 0.00 C ATOM 1476 CD2 PHE A 96 -32.542 6.797 -1.342 1.00 0.00 C ATOM 1477 CE1 PHE A 96 -35.072 5.938 -2.031 1.00 0.00 C ATOM 1478 CE2 PHE A 96 -33.268 7.483 -2.298 1.00 0.00 C ATOM 1479 CZ PHE A 96 -34.533 7.053 -2.643 1.00 0.00 C ATOM 0 H PHE A 96 -32.479 7.276 1.571 1.00 0.00 H new ATOM 0 HA PHE A 96 -33.581 4.561 1.980 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -31.228 5.206 0.219 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -32.352 3.866 0.117 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -34.766 4.386 -0.599 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -31.552 7.137 -1.077 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -36.062 5.599 -2.299 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -32.845 8.355 -2.775 1.00 0.00 H new ATOM 0 HZ PHE A 96 -35.101 7.587 -3.390 1.00 0.00 H new ATOM 1489 N PHE A 97 -31.755 3.830 3.506 1.00 0.00 N ATOM 1490 CA PHE A 97 -30.730 3.432 4.460 1.00 0.00 C ATOM 1491 C PHE A 97 -29.882 2.299 3.902 1.00 0.00 C ATOM 1492 O PHE A 97 -30.227 1.671 2.901 1.00 0.00 O ATOM 1493 CB PHE A 97 -31.360 3.044 5.803 1.00 0.00 C ATOM 1494 CG PHE A 97 -32.198 1.797 5.773 1.00 0.00 C ATOM 1495 CD1 PHE A 97 -33.370 1.748 5.034 1.00 0.00 C ATOM 1496 CD2 PHE A 97 -31.825 0.681 6.504 1.00 0.00 C ATOM 1497 CE1 PHE A 97 -34.150 0.608 5.021 1.00 0.00 C ATOM 1498 CE2 PHE A 97 -32.604 -0.460 6.498 1.00 0.00 C ATOM 1499 CZ PHE A 97 -33.768 -0.496 5.755 1.00 0.00 C ATOM 0 H PHE A 97 -32.587 3.239 3.505 1.00 0.00 H new ATOM 0 HA PHE A 97 -30.074 4.285 4.632 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -30.564 2.912 6.536 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -31.979 3.872 6.150 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -33.677 2.611 4.462 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -30.915 0.703 7.085 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -35.058 0.581 4.437 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -32.303 -1.323 7.074 1.00 0.00 H new ATOM 0 HZ PHE A 97 -34.378 -1.387 5.749 1.00 0.00 H new ATOM 1509 N LEU A 98 -28.767 2.054 4.576 1.00 0.00 N ATOM 1510 CA LEU A 98 -27.840 1.017 4.153 1.00 0.00 C ATOM 1511 C LEU A 98 -28.194 -0.332 4.753 1.00 0.00 C ATOM 1512 O LEU A 98 -28.606 -0.428 5.910 1.00 0.00 O ATOM 1513 CB LEU A 98 -26.411 1.392 4.531 1.00 0.00 C ATOM 1514 CG LEU A 98 -25.343 0.479 3.935 1.00 0.00 C ATOM 1515 CD1 LEU A 98 -24.058 1.252 3.706 1.00 0.00 C ATOM 1516 CD2 LEU A 98 -25.102 -0.718 4.838 1.00 0.00 C ATOM 0 H LEU A 98 -28.484 2.559 5.416 1.00 0.00 H new ATOM 0 HA LEU A 98 -27.917 0.935 3.069 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -26.219 2.415 4.208 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -26.319 1.378 5.617 1.00 0.00 H new ATOM 0 HG LEU A 98 -25.696 0.110 2.972 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -23.305 0.588 3.281 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -24.247 2.076 3.017 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -23.698 1.648 4.655 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -24.338 -1.358 4.397 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -24.767 -0.374 5.817 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -26.028 -1.282 4.949 1.00 0.00 H new ATOM 1528 N ILE A 99 -28.023 -1.375 3.950 1.00 0.00 N ATOM 1529 CA ILE A 99 -28.295 -2.749 4.355 1.00 0.00 C ATOM 1530 C ILE A 99 -27.467 -3.701 3.510 1.00 0.00 C ATOM 1531 O ILE A 99 -27.731 -3.919 2.327 1.00 0.00 O ATOM 1532 CB ILE A 99 -29.774 -3.130 4.142 1.00 0.00 C ATOM 1533 CG1 ILE A 99 -30.674 -1.905 4.257 1.00 0.00 C ATOM 1534 CG2 ILE A 99 -30.193 -4.198 5.136 1.00 0.00 C ATOM 1535 CD1 ILE A 99 -31.971 -2.033 3.489 1.00 0.00 C ATOM 0 H ILE A 99 -27.688 -1.290 2.990 1.00 0.00 H new ATOM 0 HA ILE A 99 -28.047 -2.823 5.414 1.00 0.00 H new ATOM 0 HB ILE A 99 -29.882 -3.533 3.135 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -30.900 -1.728 5.308 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -30.132 -1.031 3.896 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -31.239 -4.456 4.973 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -29.575 -5.085 4.999 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -30.066 -3.820 6.151 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -32.560 -1.125 3.616 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -31.754 -2.179 2.431 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -32.534 -2.887 3.866 1.00 0.00 H new ATOM 1547 N GLY A 100 -26.454 -4.256 4.160 1.00 0.00 N ATOM 1548 CA GLY A 100 -25.544 -5.183 3.524 1.00 0.00 C ATOM 1549 C GLY A 100 -24.357 -5.485 4.419 1.00 0.00 C ATOM 1550 O GLY A 100 -23.972 -6.643 4.581 1.00 0.00 O ATOM 0 H GLY A 100 -26.244 -4.073 5.141 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -26.069 -6.108 3.287 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -25.194 -4.764 2.580 1.00 0.00 H new ATOM 1554 N SER A 101 -23.787 -4.432 5.009 1.00 0.00 N ATOM 1555 CA SER A 101 -22.642 -4.572 5.908 1.00 0.00 C ATOM 1556 C SER A 101 -22.155 -3.216 6.398 1.00 0.00 C ATOM 1557 O SER A 101 -21.652 -3.085 7.515 1.00 0.00 O ATOM 1558 CB SER A 101 -21.496 -5.310 5.210 1.00 0.00 C ATOM 1559 OG SER A 101 -20.378 -5.448 6.070 1.00 0.00 O ATOM 0 H SER A 101 -24.102 -3.471 4.879 1.00 0.00 H new ATOM 0 HA SER A 101 -22.971 -5.153 6.770 1.00 0.00 H new ATOM 0 HB2 SER A 101 -21.836 -6.295 4.889 1.00 0.00 H new ATOM 0 HB3 SER A 101 -21.203 -4.766 4.312 1.00 0.00 H new ATOM 0 HG SER A 101 -19.661 -5.923 5.601 1.00 0.00 H new ATOM 1565 N THR A 102 -22.301 -2.222 5.538 1.00 0.00 N ATOM 1566 CA THR A 102 -21.874 -0.858 5.837 1.00 0.00 C ATOM 1567 C THR A 102 -20.360 -0.773 5.864 1.00 0.00 C ATOM 1568 O THR A 102 -19.785 0.265 6.193 1.00 0.00 O ATOM 1569 CB THR A 102 -22.449 -0.337 7.169 1.00 0.00 C ATOM 1570 OG1 THR A 102 -23.449 -1.235 7.668 1.00 0.00 O ATOM 1571 CG2 THR A 102 -23.063 1.035 6.972 1.00 0.00 C ATOM 0 H THR A 102 -22.718 -2.333 4.614 1.00 0.00 H new ATOM 0 HA THR A 102 -22.265 -0.224 5.042 1.00 0.00 H new ATOM 0 HB THR A 102 -21.634 -0.271 7.890 1.00 0.00 H new ATOM 0 HG1 THR A 102 -23.804 -0.892 8.515 1.00 0.00 H new ATOM 0 HG21 THR A 102 -23.466 1.393 7.920 1.00 0.00 H new ATOM 0 HG22 THR A 102 -22.300 1.728 6.618 1.00 0.00 H new ATOM 0 HG23 THR A 102 -23.866 0.972 6.237 1.00 0.00 H new ATOM 1579 N THR A 103 -19.726 -1.876 5.512 1.00 0.00 N ATOM 1580 CA THR A 103 -18.284 -1.964 5.454 1.00 0.00 C ATOM 1581 C THR A 103 -17.908 -2.939 4.359 1.00 0.00 C ATOM 1582 O THR A 103 -18.652 -3.879 4.078 1.00 0.00 O ATOM 1583 CB THR A 103 -17.679 -2.415 6.789 1.00 0.00 C ATOM 1584 OG1 THR A 103 -18.465 -3.468 7.359 1.00 0.00 O ATOM 1585 CG2 THR A 103 -17.589 -1.250 7.759 1.00 0.00 C ATOM 0 H THR A 103 -20.203 -2.741 5.257 1.00 0.00 H new ATOM 0 HA THR A 103 -17.884 -0.973 5.242 1.00 0.00 H new ATOM 0 HB THR A 103 -16.672 -2.786 6.600 1.00 0.00 H new ATOM 0 HG1 THR A 103 -18.926 -3.956 6.645 1.00 0.00 H new ATOM 0 HG21 THR A 103 -17.157 -1.592 8.699 1.00 0.00 H new ATOM 0 HG22 THR A 103 -16.959 -0.470 7.333 1.00 0.00 H new ATOM 0 HG23 THR A 103 -18.587 -0.851 7.942 1.00 0.00 H new ATOM 1593 N SER A 104 -16.762 -2.726 3.737 1.00 0.00 N ATOM 1594 CA SER A 104 -16.285 -3.626 2.707 1.00 0.00 C ATOM 1595 C SER A 104 -14.795 -3.851 2.892 1.00 0.00 C ATOM 1596 O SER A 104 -14.003 -2.933 2.708 1.00 0.00 O ATOM 1597 CB SER A 104 -16.556 -3.048 1.315 1.00 0.00 C ATOM 1598 OG SER A 104 -16.066 -3.907 0.301 1.00 0.00 O ATOM 0 H SER A 104 -16.145 -1.936 3.929 1.00 0.00 H new ATOM 0 HA SER A 104 -16.815 -4.575 2.792 1.00 0.00 H new ATOM 0 HB2 SER A 104 -17.628 -2.898 1.182 1.00 0.00 H new ATOM 0 HB3 SER A 104 -16.084 -2.069 1.226 1.00 0.00 H new ATOM 0 HG SER A 104 -16.775 -4.524 0.024 1.00 0.00 H new ATOM 1604 N ARG A 105 -14.407 -5.070 3.247 1.00 0.00 N ATOM 1605 CA ARG A 105 -13.004 -5.403 3.455 1.00 0.00 C ATOM 1606 C ARG A 105 -12.431 -6.014 2.187 1.00 0.00 C ATOM 1607 O ARG A 105 -13.166 -6.585 1.381 1.00 0.00 O ATOM 1608 CB ARG A 105 -12.855 -6.379 4.623 1.00 0.00 C ATOM 1609 CG ARG A 105 -13.421 -5.848 5.931 1.00 0.00 C ATOM 1610 CD ARG A 105 -13.020 -6.721 7.108 1.00 0.00 C ATOM 1611 NE ARG A 105 -11.583 -6.667 7.363 1.00 0.00 N ATOM 1612 CZ ARG A 105 -10.990 -7.290 8.378 1.00 0.00 C ATOM 1613 NH1 ARG A 105 -11.706 -8.017 9.225 1.00 0.00 N ATOM 1614 NH2 ARG A 105 -9.679 -7.185 8.546 1.00 0.00 N ATOM 0 H ARG A 105 -15.049 -5.848 3.397 1.00 0.00 H new ATOM 0 HA ARG A 105 -12.456 -4.492 3.695 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -13.356 -7.314 4.372 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -11.799 -6.611 4.760 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -13.067 -4.830 6.095 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -14.508 -5.801 5.866 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -13.559 -6.399 7.999 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -13.315 -7.752 6.912 1.00 0.00 H new ATOM 0 HE ARG A 105 -11.001 -6.121 6.727 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -12.715 -8.100 9.099 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -11.248 -8.493 10.002 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -9.125 -6.626 7.897 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -9.225 -7.663 9.324 1.00 0.00 H new ATOM 1628 N CYS A 106 -11.123 -5.914 2.022 1.00 0.00 N ATOM 1629 CA CYS A 106 -10.471 -6.434 0.836 1.00 0.00 C ATOM 1630 C CYS A 106 -9.597 -7.623 1.187 1.00 0.00 C ATOM 1631 O CYS A 106 -8.662 -7.506 1.975 1.00 0.00 O ATOM 1632 CB CYS A 106 -9.636 -5.343 0.174 1.00 0.00 C ATOM 1633 SG CYS A 106 -9.033 -5.780 -1.484 1.00 0.00 S ATOM 0 H CYS A 106 -10.493 -5.477 2.695 1.00 0.00 H new ATOM 0 HA CYS A 106 -11.238 -6.764 0.136 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -10.233 -4.434 0.105 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -8.782 -5.115 0.812 1.00 0.00 H new ATOM 1638 N GLU A 107 -9.919 -8.769 0.611 1.00 0.00 N ATOM 1639 CA GLU A 107 -9.184 -9.988 0.872 1.00 0.00 C ATOM 1640 C GLU A 107 -8.305 -10.336 -0.319 1.00 0.00 C ATOM 1641 O GLU A 107 -8.781 -10.791 -1.357 1.00 0.00 O ATOM 1642 CB GLU A 107 -10.162 -11.114 1.190 1.00 0.00 C ATOM 1643 CG GLU A 107 -9.573 -12.215 2.060 1.00 0.00 C ATOM 1644 CD GLU A 107 -8.411 -12.930 1.400 1.00 0.00 C ATOM 1645 OE1 GLU A 107 -8.655 -13.921 0.682 1.00 0.00 O ATOM 1646 OE2 GLU A 107 -7.256 -12.499 1.604 1.00 0.00 O ATOM 0 H GLU A 107 -10.692 -8.877 -0.046 1.00 0.00 H new ATOM 0 HA GLU A 107 -8.532 -9.845 1.734 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -11.033 -10.694 1.693 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -10.513 -11.552 0.256 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -9.239 -11.785 3.005 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -10.352 -12.940 2.297 1.00 0.00 H new ATOM 1653 N VAL A 108 -7.015 -10.121 -0.139 1.00 0.00 N ATOM 1654 CA VAL A 108 -6.058 -10.387 -1.198 1.00 0.00 C ATOM 1655 C VAL A 108 -5.815 -11.881 -1.335 1.00 0.00 C ATOM 1656 O VAL A 108 -5.413 -12.552 -0.386 1.00 0.00 O ATOM 1657 CB VAL A 108 -4.729 -9.644 -0.967 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -3.549 -10.428 -1.523 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -4.786 -8.266 -1.600 1.00 0.00 C ATOM 0 H VAL A 108 -6.607 -9.765 0.725 1.00 0.00 H new ATOM 0 HA VAL A 108 -6.487 -10.013 -2.128 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.585 -9.541 0.108 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -2.627 -9.875 -1.343 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -3.492 -11.398 -1.030 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -3.681 -10.573 -2.595 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.842 -7.749 -1.431 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -4.959 -8.365 -2.672 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -5.598 -7.693 -1.153 1.00 0.00 H new ATOM 1669 N GLN A 109 -6.069 -12.387 -2.532 1.00 0.00 N ATOM 1670 CA GLN A 109 -5.903 -13.800 -2.821 1.00 0.00 C ATOM 1671 C GLN A 109 -4.830 -13.984 -3.885 1.00 0.00 C ATOM 1672 O GLN A 109 -5.058 -13.705 -5.062 1.00 0.00 O ATOM 1673 CB GLN A 109 -7.240 -14.386 -3.287 1.00 0.00 C ATOM 1674 CG GLN A 109 -8.389 -14.107 -2.324 1.00 0.00 C ATOM 1675 CD GLN A 109 -9.755 -14.263 -2.970 1.00 0.00 C ATOM 1676 OE1 GLN A 109 -9.929 -15.058 -3.894 1.00 0.00 O ATOM 1677 NE2 GLN A 109 -10.735 -13.500 -2.484 1.00 0.00 N ATOM 0 H GLN A 109 -6.394 -11.833 -3.324 1.00 0.00 H new ATOM 0 HA GLN A 109 -5.587 -14.326 -1.920 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -7.487 -13.975 -4.266 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -7.133 -15.464 -3.411 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -8.316 -14.785 -1.473 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -8.291 -13.094 -1.934 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -10.546 -12.855 -1.717 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -11.673 -13.562 -2.879 1.00 0.00 H new ATOM 1686 N ASP A 110 -3.656 -14.451 -3.464 1.00 0.00 N ATOM 1687 CA ASP A 110 -2.538 -14.640 -4.379 1.00 0.00 C ATOM 1688 C ASP A 110 -2.137 -13.300 -4.986 1.00 0.00 C ATOM 1689 O ASP A 110 -2.349 -12.251 -4.379 1.00 0.00 O ATOM 1690 CB ASP A 110 -2.915 -15.633 -5.478 1.00 0.00 C ATOM 1691 CG ASP A 110 -3.010 -17.057 -4.966 1.00 0.00 C ATOM 1692 OD1 ASP A 110 -4.095 -17.443 -4.482 1.00 0.00 O ATOM 1693 OD2 ASP A 110 -1.999 -17.786 -5.049 1.00 0.00 O ATOM 0 H ASP A 110 -3.457 -14.704 -2.496 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.690 -15.045 -3.827 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -3.871 -15.342 -5.914 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.174 -15.586 -6.276 1.00 0.00 H new ATOM 1698 N ARG A 111 -1.560 -13.331 -6.182 1.00 0.00 N ATOM 1699 CA ARG A 111 -1.147 -12.115 -6.857 1.00 0.00 C ATOM 1700 C ARG A 111 -2.349 -11.366 -7.426 1.00 0.00 C ATOM 1701 O ARG A 111 -2.207 -10.545 -8.332 1.00 0.00 O ATOM 1702 CB ARG A 111 -0.158 -12.452 -7.970 1.00 0.00 C ATOM 1703 CG ARG A 111 1.204 -12.895 -7.461 1.00 0.00 C ATOM 1704 CD ARG A 111 2.167 -13.162 -8.606 1.00 0.00 C ATOM 1705 NE ARG A 111 1.677 -14.205 -9.503 1.00 0.00 N ATOM 1706 CZ ARG A 111 2.295 -14.565 -10.624 1.00 0.00 C ATOM 1707 NH1 ARG A 111 3.423 -13.966 -10.985 1.00 0.00 N ATOM 1708 NH2 ARG A 111 1.786 -15.523 -11.386 1.00 0.00 N ATOM 0 H ARG A 111 -1.369 -14.188 -6.701 1.00 0.00 H new ATOM 0 HA ARG A 111 -0.662 -11.465 -6.129 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -0.579 -13.242 -8.591 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -0.031 -11.578 -8.609 1.00 0.00 H new ATOM 0 HG2 ARG A 111 1.617 -12.126 -6.808 1.00 0.00 H new ATOM 0 HG3 ARG A 111 1.093 -13.797 -6.860 1.00 0.00 H new ATOM 0 HD2 ARG A 111 2.323 -12.243 -9.170 1.00 0.00 H new ATOM 0 HD3 ARG A 111 3.136 -13.457 -8.203 1.00 0.00 H new ATOM 0 HE ARG A 111 0.811 -14.685 -9.256 1.00 0.00 H new ATOM 0 HH11 ARG A 111 3.818 -13.228 -10.402 1.00 0.00 H new ATOM 0 HH12 ARG A 111 3.895 -14.244 -11.845 1.00 0.00 H new ATOM 0 HH21 ARG A 111 0.919 -15.985 -11.113 1.00 0.00 H new ATOM 0 HH22 ARG A 111 2.262 -15.798 -12.246 1.00 0.00 H new ATOM 1722 N GLY A 112 -3.529 -11.650 -6.883 1.00 0.00 N ATOM 1723 CA GLY A 112 -4.733 -10.990 -7.345 1.00 0.00 C ATOM 1724 C GLY A 112 -5.627 -10.559 -6.204 1.00 0.00 C ATOM 1725 O GLY A 112 -6.266 -11.385 -5.553 1.00 0.00 O ATOM 0 H GLY A 112 -3.671 -12.325 -6.132 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -4.461 -10.118 -7.939 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -5.285 -11.663 -8.001 1.00 0.00 H new ATOM 1729 N VAL A 113 -5.667 -9.255 -5.969 1.00 0.00 N ATOM 1730 CA VAL A 113 -6.481 -8.688 -4.902 1.00 0.00 C ATOM 1731 C VAL A 113 -7.929 -9.141 -5.034 1.00 0.00 C ATOM 1732 O VAL A 113 -8.454 -9.274 -6.139 1.00 0.00 O ATOM 1733 CB VAL A 113 -6.396 -7.158 -4.907 1.00 0.00 C ATOM 1734 CG1 VAL A 113 -6.721 -6.594 -3.539 1.00 0.00 C ATOM 1735 CG2 VAL A 113 -5.009 -6.718 -5.354 1.00 0.00 C ATOM 0 H VAL A 113 -5.142 -8.566 -6.507 1.00 0.00 H new ATOM 0 HA VAL A 113 -6.091 -9.049 -3.950 1.00 0.00 H new ATOM 0 HB VAL A 113 -7.133 -6.771 -5.611 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -6.654 -5.506 -3.568 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -7.732 -6.888 -3.255 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -6.012 -6.982 -2.808 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -4.955 -5.629 -5.355 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -4.262 -7.117 -4.668 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -4.815 -7.092 -6.359 1.00 0.00 H new ATOM 1745 N GLY A 114 -8.564 -9.373 -3.893 1.00 0.00 N ATOM 1746 CA GLY A 114 -9.926 -9.873 -3.977 1.00 0.00 C ATOM 1747 C GLY A 114 -10.938 -9.311 -2.998 1.00 0.00 C ATOM 1748 O GLY A 114 -11.057 -9.830 -1.888 1.00 0.00 O ATOM 0 H GLY A 114 -8.188 -9.234 -2.955 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -10.293 -9.684 -4.986 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.896 -10.955 -3.847 1.00 0.00 H new ATOM 1752 N TRP A 115 -11.669 -8.260 -3.366 1.00 0.00 N ATOM 1753 CA TRP A 115 -12.702 -7.702 -2.490 1.00 0.00 C ATOM 1754 C TRP A 115 -13.592 -8.813 -1.939 1.00 0.00 C ATOM 1755 O TRP A 115 -13.633 -9.917 -2.483 1.00 0.00 O ATOM 1756 CB TRP A 115 -13.580 -6.696 -3.244 1.00 0.00 C ATOM 1757 CG TRP A 115 -13.069 -5.287 -3.227 1.00 0.00 C ATOM 1758 CD1 TRP A 115 -12.686 -4.541 -4.305 1.00 0.00 C ATOM 1759 CD2 TRP A 115 -12.899 -4.446 -2.080 1.00 0.00 C ATOM 1760 NE1 TRP A 115 -12.294 -3.289 -3.896 1.00 0.00 N ATOM 1761 CE2 TRP A 115 -12.412 -3.208 -2.537 1.00 0.00 C ATOM 1762 CE3 TRP A 115 -13.110 -4.619 -0.714 1.00 0.00 C ATOM 1763 CZ2 TRP A 115 -12.136 -2.151 -1.677 1.00 0.00 C ATOM 1764 CZ3 TRP A 115 -12.834 -3.569 0.141 1.00 0.00 C ATOM 1765 CH2 TRP A 115 -12.352 -2.348 -0.343 1.00 0.00 C ATOM 0 H TRP A 115 -11.567 -7.779 -4.260 1.00 0.00 H new ATOM 0 HA TRP A 115 -12.195 -7.193 -1.670 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -13.675 -7.022 -4.280 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -14.580 -6.711 -2.812 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -12.691 -4.885 -5.329 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -11.968 -2.541 -4.508 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -13.483 -5.557 -0.330 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -11.764 -1.208 -2.050 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -12.993 -3.693 1.202 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -12.147 -1.546 0.351 1.00 0.00 H new ATOM 1776 N SER A 116 -14.310 -8.514 -0.863 1.00 0.00 N ATOM 1777 CA SER A 116 -15.203 -9.490 -0.254 1.00 0.00 C ATOM 1778 C SER A 116 -16.656 -9.195 -0.623 1.00 0.00 C ATOM 1779 O SER A 116 -17.395 -10.087 -1.039 1.00 0.00 O ATOM 1780 CB SER A 116 -15.039 -9.487 1.268 1.00 0.00 C ATOM 1781 OG SER A 116 -13.724 -9.861 1.641 1.00 0.00 O ATOM 0 H SER A 116 -14.291 -7.607 -0.396 1.00 0.00 H new ATOM 0 HA SER A 116 -14.940 -10.477 -0.635 1.00 0.00 H new ATOM 0 HB2 SER A 116 -15.263 -8.494 1.659 1.00 0.00 H new ATOM 0 HB3 SER A 116 -15.757 -10.175 1.715 1.00 0.00 H new ATOM 0 HG SER A 116 -13.645 -9.849 2.618 1.00 0.00 H new ATOM 1787 N HIS A 117 -17.058 -7.933 -0.469 1.00 0.00 N ATOM 1788 CA HIS A 117 -18.421 -7.513 -0.789 1.00 0.00 C ATOM 1789 C HIS A 117 -18.498 -5.995 -0.957 1.00 0.00 C ATOM 1790 O HIS A 117 -18.370 -5.252 0.016 1.00 0.00 O ATOM 1791 CB HIS A 117 -19.386 -7.958 0.310 1.00 0.00 C ATOM 1792 CG HIS A 117 -20.828 -7.817 -0.067 1.00 0.00 C ATOM 1793 ND1 HIS A 117 -21.578 -8.857 -0.575 1.00 0.00 N ATOM 1794 CD2 HIS A 117 -21.660 -6.750 -0.009 1.00 0.00 C ATOM 1795 CE1 HIS A 117 -22.806 -8.437 -0.813 1.00 0.00 C ATOM 1796 NE2 HIS A 117 -22.884 -7.163 -0.478 1.00 0.00 N ATOM 0 H HIS A 117 -16.458 -7.184 -0.124 1.00 0.00 H new ATOM 0 HA HIS A 117 -18.706 -7.984 -1.730 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -19.184 -9.000 0.559 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -19.195 -7.372 1.209 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -21.409 -5.760 0.341 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -23.611 -9.035 -1.214 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -23.717 -6.580 -0.555 1.00 0.00 H new ATOM 1805 N PRO A 118 -18.713 -5.517 -2.196 1.00 0.00 N ATOM 1806 CA PRO A 118 -18.802 -4.094 -2.500 1.00 0.00 C ATOM 1807 C PRO A 118 -20.223 -3.548 -2.368 1.00 0.00 C ATOM 1808 O PRO A 118 -21.030 -4.076 -1.603 1.00 0.00 O ATOM 1809 CB PRO A 118 -18.334 -4.020 -3.964 1.00 0.00 C ATOM 1810 CG PRO A 118 -18.205 -5.440 -4.442 1.00 0.00 C ATOM 1811 CD PRO A 118 -18.869 -6.310 -3.412 1.00 0.00 C ATOM 0 HA PRO A 118 -18.208 -3.494 -1.810 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -19.051 -3.469 -4.573 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -17.381 -3.496 -4.041 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -18.679 -5.564 -5.416 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -17.157 -5.714 -4.561 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -19.917 -6.493 -3.648 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -18.386 -7.284 -3.328 1.00 0.00 H new ATOM 1819 N LEU A 119 -20.496 -2.476 -3.121 1.00 0.00 N ATOM 1820 CA LEU A 119 -21.799 -1.806 -3.149 1.00 0.00 C ATOM 1821 C LEU A 119 -22.898 -2.597 -2.429 1.00 0.00 C ATOM 1822 O LEU A 119 -23.275 -3.687 -2.864 1.00 0.00 O ATOM 1823 CB LEU A 119 -22.199 -1.579 -4.604 1.00 0.00 C ATOM 1824 CG LEU A 119 -21.034 -1.320 -5.567 1.00 0.00 C ATOM 1825 CD1 LEU A 119 -21.536 -1.211 -6.997 1.00 0.00 C ATOM 1826 CD2 LEU A 119 -20.279 -0.065 -5.159 1.00 0.00 C ATOM 0 H LEU A 119 -19.807 -2.044 -3.737 1.00 0.00 H new ATOM 0 HA LEU A 119 -21.696 -0.861 -2.616 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -22.751 -2.452 -4.953 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -22.882 -0.731 -4.649 1.00 0.00 H new ATOM 0 HG LEU A 119 -20.346 -2.164 -5.515 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -20.695 -1.027 -7.665 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -22.029 -2.141 -7.281 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -22.245 -0.387 -7.072 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -19.455 0.105 -5.852 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -20.955 0.790 -5.182 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -19.885 -0.189 -4.150 1.00 0.00 H new ATOM 1838 N PRO A 120 -23.430 -2.050 -1.316 1.00 0.00 N ATOM 1839 CA PRO A 120 -24.493 -2.695 -0.538 1.00 0.00 C ATOM 1840 C PRO A 120 -25.873 -2.475 -1.152 1.00 0.00 C ATOM 1841 O PRO A 120 -25.990 -2.189 -2.344 1.00 0.00 O ATOM 1842 CB PRO A 120 -24.392 -1.995 0.813 1.00 0.00 C ATOM 1843 CG PRO A 120 -23.929 -0.620 0.480 1.00 0.00 C ATOM 1844 CD PRO A 120 -23.032 -0.757 -0.724 1.00 0.00 C ATOM 0 HA PRO A 120 -24.376 -3.778 -0.489 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -25.354 -1.978 1.325 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -23.689 -2.503 1.473 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -24.774 0.033 0.263 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -23.391 -0.177 1.318 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -23.176 0.065 -1.425 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -21.979 -0.754 -0.441 1.00 0.00 H new ATOM 1852 N GLN A 121 -26.919 -2.607 -0.334 1.00 0.00 N ATOM 1853 CA GLN A 121 -28.285 -2.424 -0.799 1.00 0.00 C ATOM 1854 C GLN A 121 -28.914 -1.165 -0.202 1.00 0.00 C ATOM 1855 O GLN A 121 -29.068 -1.052 1.014 1.00 0.00 O ATOM 1856 CB GLN A 121 -29.121 -3.646 -0.424 1.00 0.00 C ATOM 1857 CG GLN A 121 -29.054 -4.772 -1.443 1.00 0.00 C ATOM 1858 CD GLN A 121 -27.641 -5.279 -1.664 1.00 0.00 C ATOM 1859 OE1 GLN A 121 -26.928 -4.798 -2.545 1.00 0.00 O ATOM 1860 NE2 GLN A 121 -27.230 -6.254 -0.862 1.00 0.00 N ATOM 0 H GLN A 121 -26.840 -2.841 0.656 1.00 0.00 H new ATOM 0 HA GLN A 121 -28.263 -2.308 -1.883 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -28.784 -4.022 0.542 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -30.160 -3.340 -0.302 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -29.683 -5.597 -1.109 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -29.463 -4.423 -2.391 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -27.855 -6.622 -0.145 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -26.289 -6.635 -0.963 1.00 0.00 H new ATOM 1869 N CYS A 122 -29.273 -0.223 -1.070 1.00 0.00 N ATOM 1870 CA CYS A 122 -29.895 1.016 -0.610 1.00 0.00 C ATOM 1871 C CYS A 122 -31.407 0.971 -0.825 1.00 0.00 C ATOM 1872 O CYS A 122 -31.885 1.013 -1.959 1.00 0.00 O ATOM 1873 CB CYS A 122 -29.294 2.230 -1.322 1.00 0.00 C ATOM 1874 SG CYS A 122 -27.636 2.705 -0.725 1.00 0.00 S ATOM 0 H CYS A 122 -29.147 -0.291 -2.080 1.00 0.00 H new ATOM 0 HA CYS A 122 -29.697 1.114 0.457 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -29.236 2.019 -2.390 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -29.968 3.078 -1.201 1.00 0.00 H new ATOM 1879 N GLU A 123 -32.150 0.888 0.275 1.00 0.00 N ATOM 1880 CA GLU A 123 -33.609 0.826 0.208 1.00 0.00 C ATOM 1881 C GLU A 123 -34.231 1.932 1.049 1.00 0.00 C ATOM 1882 O GLU A 123 -33.691 2.336 2.078 1.00 0.00 O ATOM 1883 CB GLU A 123 -34.119 -0.528 0.699 1.00 0.00 C ATOM 1884 CG GLU A 123 -33.348 -1.711 0.148 1.00 0.00 C ATOM 1885 CD GLU A 123 -33.359 -1.767 -1.368 1.00 0.00 C ATOM 1886 OE1 GLU A 123 -34.449 -1.958 -1.948 1.00 0.00 O ATOM 1887 OE2 GLU A 123 -32.276 -1.625 -1.974 1.00 0.00 O ATOM 0 H GLU A 123 -31.769 0.862 1.221 1.00 0.00 H new ATOM 0 HA GLU A 123 -33.899 0.959 -0.834 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -34.071 -0.550 1.788 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -35.169 -0.631 0.424 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -32.317 -1.661 0.497 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -33.774 -2.633 0.544 1.00 0.00 H new ATOM 1894 N ILE A 124 -35.379 2.408 0.582 1.00 0.00 N ATOM 1895 CA ILE A 124 -36.094 3.481 1.260 1.00 0.00 C ATOM 1896 C ILE A 124 -36.743 2.979 2.546 1.00 0.00 C ATOM 1897 O ILE A 124 -37.154 1.822 2.639 1.00 0.00 O ATOM 1898 CB ILE A 124 -37.179 4.098 0.350 1.00 0.00 C ATOM 1899 CG1 ILE A 124 -37.766 5.356 0.999 1.00 0.00 C ATOM 1900 CG2 ILE A 124 -38.274 3.081 0.061 1.00 0.00 C ATOM 1901 CD1 ILE A 124 -38.771 6.078 0.127 1.00 0.00 C ATOM 0 H ILE A 124 -35.835 2.067 -0.264 1.00 0.00 H new ATOM 0 HA ILE A 124 -35.360 4.249 1.504 1.00 0.00 H new ATOM 0 HB ILE A 124 -36.719 4.382 -0.596 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -38.245 5.080 1.938 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -36.954 6.040 1.245 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -39.030 3.533 -0.581 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -37.843 2.214 -0.440 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -38.735 2.766 0.997 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -39.143 6.958 0.652 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -38.292 6.386 -0.802 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -39.603 5.411 -0.098 1.00 0.00 H new ATOM 1913 N LEU A 125 -36.827 3.860 3.536 1.00 0.00 N ATOM 1914 CA LEU A 125 -37.422 3.519 4.821 1.00 0.00 C ATOM 1915 C LEU A 125 -38.932 3.328 4.688 1.00 0.00 C ATOM 1916 O LEU A 125 -39.590 2.842 5.607 1.00 0.00 O ATOM 1917 CB LEU A 125 -37.120 4.619 5.840 1.00 0.00 C ATOM 1918 CG LEU A 125 -35.632 4.882 6.088 1.00 0.00 C ATOM 1919 CD1 LEU A 125 -35.430 6.269 6.677 1.00 0.00 C ATOM 1920 CD2 LEU A 125 -35.047 3.822 7.010 1.00 0.00 C ATOM 0 H LEU A 125 -36.489 4.820 3.472 1.00 0.00 H new ATOM 0 HA LEU A 125 -36.988 2.580 5.165 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -37.585 5.545 5.501 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -37.589 4.354 6.787 1.00 0.00 H new ATOM 0 HG LEU A 125 -35.110 4.831 5.133 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -34.367 6.441 6.848 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -35.812 7.018 5.983 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -35.966 6.344 7.623 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -33.989 4.026 7.174 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -35.572 3.840 7.965 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -35.160 2.839 6.552 1.00 0.00 H new ATOM 1932 N GLU A 126 -39.471 3.715 3.534 1.00 0.00 N ATOM 1933 CA GLU A 126 -40.901 3.593 3.270 1.00 0.00 C ATOM 1934 C GLU A 126 -41.175 2.422 2.326 1.00 0.00 C ATOM 1935 O GLU A 126 -40.253 1.717 1.916 1.00 0.00 O ATOM 1936 CB GLU A 126 -41.432 4.896 2.664 1.00 0.00 C ATOM 1937 CG GLU A 126 -42.945 5.038 2.733 1.00 0.00 C ATOM 1938 CD GLU A 126 -43.441 6.306 2.066 1.00 0.00 C ATOM 1939 OE1 GLU A 126 -43.487 6.341 0.818 1.00 0.00 O ATOM 1940 OE2 GLU A 126 -43.783 7.263 2.791 1.00 0.00 O ATOM 0 H GLU A 126 -38.936 4.117 2.765 1.00 0.00 H new ATOM 0 HA GLU A 126 -41.415 3.403 4.212 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -40.974 5.739 3.182 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -41.119 4.954 1.622 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -43.410 4.175 2.256 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -43.260 5.033 3.777 1.00 0.00 H new ATOM 1947 N HIS A 127 -42.446 2.214 1.990 1.00 0.00 N ATOM 1948 CA HIS A 127 -42.833 1.131 1.092 1.00 0.00 C ATOM 1949 C HIS A 127 -42.441 1.454 -0.348 1.00 0.00 C ATOM 1950 O HIS A 127 -41.364 1.071 -0.806 1.00 0.00 O ATOM 1951 CB HIS A 127 -44.339 0.874 1.189 1.00 0.00 C ATOM 1952 CG HIS A 127 -44.811 -0.278 0.358 1.00 0.00 C ATOM 1953 ND1 HIS A 127 -44.595 -1.595 0.706 1.00 0.00 N ATOM 1954 CD2 HIS A 127 -45.495 -0.307 -0.810 1.00 0.00 C ATOM 1955 CE1 HIS A 127 -45.126 -2.384 -0.211 1.00 0.00 C ATOM 1956 NE2 HIS A 127 -45.679 -1.628 -1.142 1.00 0.00 N ATOM 0 H HIS A 127 -43.224 2.781 2.326 1.00 0.00 H new ATOM 0 HA HIS A 127 -42.303 0.228 1.395 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -44.600 0.689 2.231 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -44.872 1.774 0.882 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -45.833 0.549 -1.376 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -45.110 -3.464 -0.201 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -46.164 -1.969 -1.972 1.00 0.00 H new ATOM 1965 N HIS A 128 -43.318 2.167 -1.055 1.00 0.00 N ATOM 1966 CA HIS A 128 -43.062 2.545 -2.443 1.00 0.00 C ATOM 1967 C HIS A 128 -44.214 3.371 -3.006 1.00 0.00 C ATOM 1968 O HIS A 128 -45.367 3.200 -2.609 1.00 0.00 O ATOM 1969 CB HIS A 128 -42.847 1.300 -3.309 1.00 0.00 C ATOM 1970 CG HIS A 128 -42.473 1.612 -4.726 1.00 0.00 C ATOM 1971 ND1 HIS A 128 -41.166 1.684 -5.160 1.00 0.00 N ATOM 1972 CD2 HIS A 128 -43.242 1.874 -5.810 1.00 0.00 C ATOM 1973 CE1 HIS A 128 -41.148 1.978 -6.449 1.00 0.00 C ATOM 1974 NE2 HIS A 128 -42.394 2.098 -6.867 1.00 0.00 N ATOM 0 H HIS A 128 -44.212 2.494 -0.688 1.00 0.00 H new ATOM 0 HA HIS A 128 -42.157 3.152 -2.461 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -42.064 0.687 -2.862 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -43.759 0.703 -3.306 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -44.321 1.902 -5.838 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -40.264 2.099 -7.057 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -42.681 2.321 -7.820 1.00 0.00 H new ATOM 1983 N HIS A 129 -43.893 4.267 -3.936 1.00 0.00 N ATOM 1984 CA HIS A 129 -44.899 5.119 -4.561 1.00 0.00 C ATOM 1985 C HIS A 129 -44.719 5.138 -6.078 1.00 0.00 C ATOM 1986 O HIS A 129 -43.595 5.091 -6.578 1.00 0.00 O ATOM 1987 CB HIS A 129 -44.811 6.541 -4.004 1.00 0.00 C ATOM 1988 CG HIS A 129 -45.930 7.433 -4.449 1.00 0.00 C ATOM 1989 ND1 HIS A 129 -47.170 7.443 -3.846 1.00 0.00 N ATOM 1990 CD2 HIS A 129 -45.990 8.351 -5.444 1.00 0.00 C ATOM 1991 CE1 HIS A 129 -47.945 8.327 -4.451 1.00 0.00 C ATOM 1992 NE2 HIS A 129 -47.252 8.891 -5.422 1.00 0.00 N ATOM 0 H HIS A 129 -42.943 4.421 -4.273 1.00 0.00 H new ATOM 0 HA HIS A 129 -45.884 4.711 -4.333 1.00 0.00 H new ATOM 0 HB2 HIS A 129 -44.806 6.495 -2.915 1.00 0.00 H new ATOM 0 HB3 HIS A 129 -43.863 6.983 -4.309 1.00 0.00 H new ATOM 0 HD2 HIS A 129 -45.194 8.609 -6.127 1.00 0.00 H new ATOM 0 HE1 HIS A 129 -48.970 8.549 -4.194 1.00 0.00 H new ATOM 0 HE2 HIS A 129 -47.598 9.612 -6.055 1.00 0.00 H new ATOM 2001 N HIS A 130 -45.831 5.206 -6.803 1.00 0.00 N ATOM 2002 CA HIS A 130 -45.793 5.228 -8.263 1.00 0.00 C ATOM 2003 C HIS A 130 -45.192 6.531 -8.780 1.00 0.00 C ATOM 2004 O HIS A 130 -44.699 7.350 -8.005 1.00 0.00 O ATOM 2005 CB HIS A 130 -47.199 5.040 -8.834 1.00 0.00 C ATOM 2006 CG HIS A 130 -47.810 3.715 -8.499 1.00 0.00 C ATOM 2007 ND1 HIS A 130 -48.773 3.553 -7.525 1.00 0.00 N ATOM 2008 CD2 HIS A 130 -47.595 2.483 -9.019 1.00 0.00 C ATOM 2009 CE1 HIS A 130 -49.122 2.281 -7.458 1.00 0.00 C ATOM 2010 NE2 HIS A 130 -48.421 1.612 -8.355 1.00 0.00 N ATOM 0 H HIS A 130 -46.769 5.247 -6.405 1.00 0.00 H new ATOM 0 HA HIS A 130 -45.159 4.405 -8.593 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -47.844 5.834 -8.457 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -47.159 5.149 -9.918 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -46.902 2.233 -9.809 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -49.855 1.860 -6.785 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -48.484 0.609 -8.527 1.00 0.00 H new ATOM 2019 N HIS A 131 -45.235 6.714 -10.096 1.00 0.00 N ATOM 2020 CA HIS A 131 -44.696 7.918 -10.718 1.00 0.00 C ATOM 2021 C HIS A 131 -45.806 8.926 -11.004 1.00 0.00 C ATOM 2022 O HIS A 131 -45.803 10.035 -10.471 1.00 0.00 O ATOM 2023 CB HIS A 131 -43.966 7.566 -12.016 1.00 0.00 C ATOM 2024 CG HIS A 131 -43.275 8.733 -12.649 1.00 0.00 C ATOM 2025 ND1 HIS A 131 -43.857 9.516 -13.623 1.00 0.00 N ATOM 2026 CD2 HIS A 131 -42.042 9.252 -12.439 1.00 0.00 C ATOM 2027 CE1 HIS A 131 -43.012 10.465 -13.986 1.00 0.00 C ATOM 2028 NE2 HIS A 131 -41.904 10.327 -13.283 1.00 0.00 N ATOM 0 H HIS A 131 -45.637 6.044 -10.752 1.00 0.00 H new ATOM 0 HA HIS A 131 -43.988 8.369 -10.022 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -43.232 6.787 -11.811 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -44.682 7.150 -12.725 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -41.305 8.889 -11.739 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -43.197 11.224 -14.731 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -41.079 10.922 -13.355 1.00 0.00 H new ATOM 2037 N HIS A 132 -46.754 8.531 -11.849 1.00 0.00 N ATOM 2038 CA HIS A 132 -47.869 9.402 -12.205 1.00 0.00 C ATOM 2039 C HIS A 132 -49.165 8.605 -12.320 1.00 0.00 C ATOM 2040 O HIS A 132 -49.362 7.943 -13.361 1.00 0.00 O ATOM 2041 CB HIS A 132 -47.581 10.122 -13.525 1.00 0.00 C ATOM 2042 CG HIS A 132 -48.563 11.207 -13.841 1.00 0.00 C ATOM 2043 ND1 HIS A 132 -49.622 11.037 -14.707 1.00 0.00 N ATOM 2044 CD2 HIS A 132 -48.642 12.486 -13.400 1.00 0.00 C ATOM 2045 CE1 HIS A 132 -50.309 12.162 -14.788 1.00 0.00 C ATOM 2046 NE2 HIS A 132 -49.736 13.057 -14.004 1.00 0.00 N ATOM 2047 OXT HIS A 132 -49.973 8.651 -11.369 1.00 0.00 O ATOM 0 H HIS A 132 -46.772 7.616 -12.299 1.00 0.00 H new ATOM 0 HA HIS A 132 -47.986 10.142 -11.414 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -46.579 10.550 -13.485 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -47.584 9.393 -14.335 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -47.971 12.967 -12.704 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -51.189 12.323 -15.392 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -50.054 14.017 -13.869 1.00 0.00 H new TER 2056 HIS A 132