USER MOD reduce.3.24.130724 H: found=0, std=0, add=1748, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1742 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 50 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: B 67 GLN : amide:sc= -0.407 X(o=-0.41,f=-0.34) USER MOD Set 2.1: B 56 THR OG1 : rot -57:sc= 0.792 USER MOD Set 2.2: B 59 SER OG : rot -159:sc= 1.93 USER MOD Set 3.1: A 56 THR OG1 : rot -55:sc= 0.745 USER MOD Set 3.2: A 59 SER OG : rot -119:sc= 1.99 USER MOD Set 4.1: A 50 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 67 GLN : amide:sc= -0.419 X(o=-0.42,f=-0.34) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.132 K(o=-0.13,f=-0.83) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ -139:sc= -0.176 (180deg=-0.489) USER MOD Single : A 14 ASN : amide:sc= -4.5! C(o=-4.5!,f=-13!) USER MOD Single : A 19 GLN : amide:sc= -0.057 K(o=-0.057,f=-3!) USER MOD Single : A 21 TYR OH : rot 180:sc= -1.71! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 HIS : no HD1:sc= -1.5 K(o=-1.5,f=-2.1!) USER MOD Single : A 37 LYS NZ :NH3+ -165:sc=-0.00526 (180deg=-0.395) USER MOD Single : A 39 TYR OH : rot -89:sc= -2.47! USER MOD Single : A 40 HIS : no HD1:sc= -0.0476 X(o=-0.048,f=-0.45) USER MOD Single : A 42 ASN : amide:sc= -0.772 K(o=-0.77,f=-3.4!) USER MOD Single : A 53 SER OG : rot 65:sc= 0.31 USER MOD Single : A 57 GLN : amide:sc= -5.32! C(o=-5.3!,f=-9!) USER MOD Single : A 58 TYR OH : rot -171:sc= -8.06! USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -6.14! C(o=-6.1!,f=-3.5!) USER MOD Single : A 68 HIS : no HD1:sc= -1.59! K(o=-1.6!,f=-2.4) USER MOD Single : A 69 ASN : amide:sc=-0.00827 K(o=-0.0083,f=-1.1) USER MOD Single : A 73 SER OG : rot 180:sc= 0.0493 USER MOD Single : A 81 GLN : amide:sc= -0.0965 X(o=-0.096,f=-0.34) USER MOD Single : A 90 TYR OH : rot -56:sc= -0.754 USER MOD Single : A 91 TYR OH : rot 180:sc= -0.0271 USER MOD Single : A 95 LYS NZ :NH3+ 169:sc= -0.339 (180deg=-1.05) USER MOD Single : A 97 LYS NZ :NH3+ -151:sc= -0.156 (180deg=-0.892) USER MOD Single : A 100 GLN : amide:sc= -2.22 K(o=-2.2,f=-8.7!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -5.43! C(o=-5.4!,f=-6.9!) USER MOD Single : A 104 MET CE :methyl -149:sc= -13.2! (180deg=-18.7!) USER MOD Single : A 108 SER OG : rot -92:sc= -4.11! USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 167:sc= -0.46 USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 5 ASN : amide:sc= -0.0998 K(o=-0.1,f=-0.83) USER MOD Single : B 6 TYR OH : rot 180:sc= 0 USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 11 THR OG1 : rot 180:sc= 0 USER MOD Single : B 13 LYS NZ :NH3+ 136:sc= -0.408 (180deg=-0.973) USER MOD Single : B 14 ASN : amide:sc= -2.18! C(o=-2.2!,f=-8.7!) USER MOD Single : B 19 GLN : amide:sc= -0.048 K(o=-0.048,f=-2.8!) USER MOD Single : B 21 TYR OH : rot 180:sc= -1.71! USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 HIS : no HD1:sc= -1.69 X(o=-1.7,f=-2.1!) USER MOD Single : B 37 LYS NZ :NH3+ -164:sc=-0.00481 (180deg=-0.387) USER MOD Single : B 39 TYR OH : rot -83:sc= -2.05! USER MOD Single : B 40 HIS : no HD1:sc= -0.0454 X(o=-0.045,f=-0.47) USER MOD Single : B 42 ASN : amide:sc= -0.815 K(o=-0.81,f=-3.6!) USER MOD Single : B 53 SER OG : rot 65:sc= 0.373 USER MOD Single : B 57 GLN : amide:sc= -5.19! C(o=-5.2!,f=-8.6!) USER MOD Single : B 58 TYR OH : rot 180:sc= -8.14! USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -6.21! C(o=-6.2!,f=-3.5!) USER MOD Single : B 68 HIS : no HD1:sc= -1.84! K(o=-1.8!,f=-2.6) USER MOD Single : B 69 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : B 73 SER OG : rot 180:sc= 0.0574 USER MOD Single : B 81 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.4) USER MOD Single : B 90 TYR OH : rot -61:sc= -0.816 USER MOD Single : B 91 TYR OH : rot 180:sc= -0.0577 USER MOD Single : B 95 LYS NZ :NH3+ -157:sc= -0.562 (180deg=-1.74!) USER MOD Single : B 97 LYS NZ :NH3+ -154:sc= -0.209 (180deg=-1.04) USER MOD Single : B 100 GLN : amide:sc= -2.3 K(o=-2.3,f=-8.6!) USER MOD Single : B 102 SER OG : rot 180:sc= 0 USER MOD Single : B 103 ASN : amide:sc= -5.86! C(o=-5.9!,f=-7.5!) USER MOD Single : B 104 MET CE :methyl -144:sc= -13.7! (180deg=-18.8!) USER MOD Single : B 108 SER OG : rot -101:sc= -3.93! USER MOD Single : B 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 SER OG : rot 167:sc= -0.308 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 7.838 -1.567 -15.815 1.00 0.00 N ATOM 2 CA ALA A 1 8.382 -2.273 -14.621 1.00 0.00 C ATOM 3 C ALA A 1 8.460 -1.299 -13.444 1.00 0.00 C ATOM 4 O ALA A 1 9.212 -0.347 -13.463 1.00 0.00 O ATOM 5 CB ALA A 1 9.782 -2.803 -14.938 1.00 0.00 C ATOM 0 H1 ALA A 1 7.785 -2.229 -16.615 1.00 0.00 H new ATOM 0 H2 ALA A 1 6.887 -1.205 -15.601 1.00 0.00 H new ATOM 0 H3 ALA A 1 8.462 -0.773 -16.063 1.00 0.00 H new ATOM 0 HA ALA A 1 7.728 -3.105 -14.361 1.00 0.00 H new ATOM 0 HB1 ALA A 1 10.182 -3.320 -14.065 1.00 0.00 H new ATOM 0 HB2 ALA A 1 9.727 -3.497 -15.777 1.00 0.00 H new ATOM 0 HB3 ALA A 1 10.436 -1.971 -15.198 1.00 0.00 H new ATOM 13 N LEU A 2 7.686 -1.531 -12.418 1.00 0.00 N ATOM 14 CA LEU A 2 7.718 -0.616 -11.242 1.00 0.00 C ATOM 15 C LEU A 2 8.752 -1.113 -10.236 1.00 0.00 C ATOM 16 O LEU A 2 8.443 -1.393 -9.095 1.00 0.00 O ATOM 17 CB LEU A 2 6.346 -0.591 -10.577 1.00 0.00 C ATOM 18 CG LEU A 2 5.285 -0.158 -11.591 1.00 0.00 C ATOM 19 CD1 LEU A 2 3.994 0.200 -10.855 1.00 0.00 C ATOM 20 CD2 LEU A 2 5.783 1.064 -12.366 1.00 0.00 C ATOM 0 H LEU A 2 7.035 -2.313 -12.344 1.00 0.00 H new ATOM 0 HA LEU A 2 7.983 0.388 -11.575 1.00 0.00 H new ATOM 0 HB2 LEU A 2 6.105 -1.579 -10.184 1.00 0.00 H new ATOM 0 HB3 LEU A 2 6.355 0.096 -9.731 1.00 0.00 H new ATOM 0 HG LEU A 2 5.095 -0.976 -12.286 1.00 0.00 H new ATOM 0 HD11 LEU A 2 3.237 0.509 -11.576 1.00 0.00 H new ATOM 0 HD12 LEU A 2 3.636 -0.670 -10.304 1.00 0.00 H new ATOM 0 HD13 LEU A 2 4.186 1.017 -10.159 1.00 0.00 H new ATOM 0 HD21 LEU A 2 5.026 1.371 -13.088 1.00 0.00 H new ATOM 0 HD22 LEU A 2 5.975 1.882 -11.672 1.00 0.00 H new ATOM 0 HD23 LEU A 2 6.704 0.811 -12.892 1.00 0.00 H new ATOM 32 N ASP A 3 9.976 -1.221 -10.653 1.00 0.00 N ATOM 33 CA ASP A 3 11.041 -1.697 -9.728 1.00 0.00 C ATOM 34 C ASP A 3 12.011 -0.552 -9.438 1.00 0.00 C ATOM 35 O ASP A 3 11.818 0.566 -9.872 1.00 0.00 O ATOM 36 CB ASP A 3 11.799 -2.856 -10.377 1.00 0.00 C ATOM 37 CG ASP A 3 11.847 -2.655 -11.893 1.00 0.00 C ATOM 38 OD1 ASP A 3 12.221 -1.574 -12.315 1.00 0.00 O ATOM 39 OD2 ASP A 3 11.507 -3.585 -12.605 1.00 0.00 O ATOM 0 H ASP A 3 10.290 -1.000 -11.598 1.00 0.00 H new ATOM 0 HA ASP A 3 10.589 -2.036 -8.796 1.00 0.00 H new ATOM 0 HB2 ASP A 3 12.811 -2.912 -9.975 1.00 0.00 H new ATOM 0 HB3 ASP A 3 11.310 -3.801 -10.141 1.00 0.00 H new ATOM 44 N THR A 4 13.052 -0.823 -8.702 1.00 0.00 N ATOM 45 CA THR A 4 14.038 0.244 -8.376 1.00 0.00 C ATOM 46 C THR A 4 15.020 0.419 -9.538 1.00 0.00 C ATOM 47 O THR A 4 16.015 1.105 -9.423 1.00 0.00 O ATOM 48 CB THR A 4 14.795 -0.150 -7.108 1.00 0.00 C ATOM 49 OG1 THR A 4 15.852 -1.040 -7.444 1.00 0.00 O ATOM 50 CG2 THR A 4 13.830 -0.839 -6.140 1.00 0.00 C ATOM 0 H THR A 4 13.263 -1.741 -8.311 1.00 0.00 H new ATOM 0 HA THR A 4 13.518 1.188 -8.213 1.00 0.00 H new ATOM 0 HB THR A 4 15.211 0.740 -6.636 1.00 0.00 H new ATOM 0 HG1 THR A 4 16.339 -1.291 -6.631 1.00 0.00 H new ATOM 0 HG21 THR A 4 14.365 -1.122 -5.233 1.00 0.00 H new ATOM 0 HG22 THR A 4 13.020 -0.155 -5.885 1.00 0.00 H new ATOM 0 HG23 THR A 4 13.417 -1.731 -6.611 1.00 0.00 H new ATOM 58 N ASN A 5 14.742 -0.188 -10.659 1.00 0.00 N ATOM 59 CA ASN A 5 15.653 -0.045 -11.828 1.00 0.00 C ATOM 60 C ASN A 5 15.074 0.991 -12.794 1.00 0.00 C ATOM 61 O ASN A 5 15.777 1.838 -13.307 1.00 0.00 O ATOM 62 CB ASN A 5 15.786 -1.393 -12.540 1.00 0.00 C ATOM 63 CG ASN A 5 17.213 -1.919 -12.373 1.00 0.00 C ATOM 64 OD1 ASN A 5 17.840 -1.699 -11.357 1.00 0.00 O ATOM 65 ND2 ASN A 5 17.756 -2.612 -13.337 1.00 0.00 N ATOM 0 H ASN A 5 13.924 -0.776 -10.815 1.00 0.00 H new ATOM 0 HA ASN A 5 16.636 0.281 -11.489 1.00 0.00 H new ATOM 0 HB2 ASN A 5 15.073 -2.107 -12.127 1.00 0.00 H new ATOM 0 HB3 ASN A 5 15.549 -1.282 -13.598 1.00 0.00 H new ATOM 0 HD21 ASN A 5 18.706 -2.968 -13.236 1.00 0.00 H new ATOM 0 HD22 ASN A 5 17.230 -2.797 -14.191 1.00 0.00 H new ATOM 72 N TYR A 6 13.793 0.927 -13.046 1.00 0.00 N ATOM 73 CA TYR A 6 13.162 1.898 -13.976 1.00 0.00 C ATOM 74 C TYR A 6 12.752 3.155 -13.206 1.00 0.00 C ATOM 75 O TYR A 6 12.502 4.194 -13.782 1.00 0.00 O ATOM 76 CB TYR A 6 11.926 1.245 -14.594 1.00 0.00 C ATOM 77 CG TYR A 6 11.087 2.289 -15.287 1.00 0.00 C ATOM 78 CD1 TYR A 6 11.515 2.848 -16.497 1.00 0.00 C ATOM 79 CD2 TYR A 6 9.878 2.697 -14.716 1.00 0.00 C ATOM 80 CE1 TYR A 6 10.732 3.816 -17.135 1.00 0.00 C ATOM 81 CE2 TYR A 6 9.093 3.665 -15.354 1.00 0.00 C ATOM 82 CZ TYR A 6 9.521 4.225 -16.564 1.00 0.00 C ATOM 83 OH TYR A 6 8.748 5.179 -17.194 1.00 0.00 O ATOM 0 H TYR A 6 13.157 0.239 -12.644 1.00 0.00 H new ATOM 0 HA TYR A 6 13.866 2.178 -14.759 1.00 0.00 H new ATOM 0 HB2 TYR A 6 12.227 0.477 -15.306 1.00 0.00 H new ATOM 0 HB3 TYR A 6 11.340 0.750 -13.820 1.00 0.00 H new ATOM 0 HD1 TYR A 6 12.449 2.532 -16.938 1.00 0.00 H new ATOM 0 HD2 TYR A 6 9.549 2.265 -13.782 1.00 0.00 H new ATOM 0 HE1 TYR A 6 11.062 4.248 -18.068 1.00 0.00 H new ATOM 0 HE2 TYR A 6 8.158 3.979 -14.913 1.00 0.00 H new ATOM 0 HH TYR A 6 7.940 5.347 -16.665 1.00 0.00 H new ATOM 93 N CYS A 7 12.678 3.069 -11.905 1.00 0.00 N ATOM 94 CA CYS A 7 12.282 4.260 -11.101 1.00 0.00 C ATOM 95 C CYS A 7 13.519 5.107 -10.799 1.00 0.00 C ATOM 96 O CYS A 7 13.419 6.233 -10.353 1.00 0.00 O ATOM 97 CB CYS A 7 11.642 3.801 -9.790 1.00 0.00 C ATOM 98 SG CYS A 7 9.927 3.321 -10.104 1.00 0.00 S ATOM 0 H CYS A 7 12.875 2.226 -11.365 1.00 0.00 H new ATOM 0 HA CYS A 7 11.564 4.856 -11.665 1.00 0.00 H new ATOM 0 HB2 CYS A 7 12.198 2.960 -9.375 1.00 0.00 H new ATOM 0 HB3 CYS A 7 11.679 4.603 -9.053 1.00 0.00 H new ATOM 103 N PHE A 8 14.684 4.575 -11.042 1.00 0.00 N ATOM 104 CA PHE A 8 15.927 5.351 -10.772 1.00 0.00 C ATOM 105 C PHE A 8 16.292 6.178 -12.009 1.00 0.00 C ATOM 106 O PHE A 8 17.427 6.569 -12.192 1.00 0.00 O ATOM 107 CB PHE A 8 17.070 4.386 -10.446 1.00 0.00 C ATOM 108 CG PHE A 8 17.111 4.130 -8.956 1.00 0.00 C ATOM 109 CD1 PHE A 8 15.960 4.311 -8.177 1.00 0.00 C ATOM 110 CD2 PHE A 8 18.303 3.709 -8.353 1.00 0.00 C ATOM 111 CE1 PHE A 8 16.002 4.073 -6.799 1.00 0.00 C ATOM 112 CE2 PHE A 8 18.344 3.472 -6.973 1.00 0.00 C ATOM 113 CZ PHE A 8 17.194 3.653 -6.197 1.00 0.00 C ATOM 0 H PHE A 8 14.830 3.637 -11.416 1.00 0.00 H new ATOM 0 HA PHE A 8 15.763 6.018 -9.926 1.00 0.00 H new ATOM 0 HB2 PHE A 8 16.931 3.447 -10.982 1.00 0.00 H new ATOM 0 HB3 PHE A 8 18.019 4.806 -10.779 1.00 0.00 H new ATOM 0 HD1 PHE A 8 15.040 4.634 -8.641 1.00 0.00 H new ATOM 0 HD2 PHE A 8 19.190 3.567 -8.952 1.00 0.00 H new ATOM 0 HE1 PHE A 8 15.115 4.213 -6.200 1.00 0.00 H new ATOM 0 HE2 PHE A 8 19.264 3.149 -6.508 1.00 0.00 H new ATOM 0 HZ PHE A 8 17.226 3.469 -5.133 1.00 0.00 H new ATOM 123 N SER A 9 15.337 6.449 -12.857 1.00 0.00 N ATOM 124 CA SER A 9 15.628 7.251 -14.078 1.00 0.00 C ATOM 125 C SER A 9 14.914 8.601 -13.985 1.00 0.00 C ATOM 126 O SER A 9 15.446 9.561 -13.464 1.00 0.00 O ATOM 127 CB SER A 9 15.133 6.496 -15.313 1.00 0.00 C ATOM 128 OG SER A 9 16.124 5.563 -15.723 1.00 0.00 O ATOM 0 H SER A 9 14.367 6.149 -12.756 1.00 0.00 H new ATOM 0 HA SER A 9 16.703 7.414 -14.158 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.201 5.978 -15.087 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.921 7.197 -16.121 1.00 0.00 H new ATOM 0 HG SER A 9 15.808 5.077 -16.513 1.00 0.00 H new ATOM 134 N SER A 10 13.710 8.682 -14.484 1.00 0.00 N ATOM 135 CA SER A 10 12.963 9.970 -14.421 1.00 0.00 C ATOM 136 C SER A 10 12.365 10.143 -13.023 1.00 0.00 C ATOM 137 O SER A 10 12.706 9.430 -12.101 1.00 0.00 O ATOM 138 CB SER A 10 11.840 9.959 -15.459 1.00 0.00 C ATOM 139 OG SER A 10 10.995 8.841 -15.224 1.00 0.00 O ATOM 0 H SER A 10 13.212 7.913 -14.932 1.00 0.00 H new ATOM 0 HA SER A 10 13.643 10.796 -14.631 1.00 0.00 H new ATOM 0 HB2 SER A 10 11.265 10.883 -15.399 1.00 0.00 H new ATOM 0 HB3 SER A 10 12.259 9.908 -16.464 1.00 0.00 H new ATOM 0 HG SER A 10 10.273 8.832 -15.887 1.00 0.00 H new ATOM 145 N THR A 11 11.477 11.083 -12.857 1.00 0.00 N ATOM 146 CA THR A 11 10.863 11.299 -11.520 1.00 0.00 C ATOM 147 C THR A 11 9.646 10.390 -11.367 1.00 0.00 C ATOM 148 O THR A 11 9.343 9.911 -10.293 1.00 0.00 O ATOM 149 CB THR A 11 10.437 12.763 -11.394 1.00 0.00 C ATOM 150 OG1 THR A 11 11.588 13.578 -11.224 1.00 0.00 O ATOM 151 CG2 THR A 11 9.511 12.928 -10.190 1.00 0.00 C ATOM 0 H THR A 11 11.150 11.711 -13.591 1.00 0.00 H new ATOM 0 HA THR A 11 11.586 11.063 -10.739 1.00 0.00 H new ATOM 0 HB THR A 11 9.908 13.064 -12.298 1.00 0.00 H new ATOM 0 HG1 THR A 11 11.316 14.516 -11.145 1.00 0.00 H new ATOM 0 HG21 THR A 11 9.210 13.972 -10.103 1.00 0.00 H new ATOM 0 HG22 THR A 11 8.627 12.305 -10.323 1.00 0.00 H new ATOM 0 HG23 THR A 11 10.035 12.625 -9.284 1.00 0.00 H new ATOM 159 N GLU A 12 8.955 10.153 -12.440 1.00 0.00 N ATOM 160 CA GLU A 12 7.750 9.275 -12.391 1.00 0.00 C ATOM 161 C GLU A 12 6.782 9.781 -11.318 1.00 0.00 C ATOM 162 O GLU A 12 7.048 9.701 -10.135 1.00 0.00 O ATOM 163 CB GLU A 12 8.169 7.840 -12.068 1.00 0.00 C ATOM 164 CG GLU A 12 7.649 6.902 -13.159 1.00 0.00 C ATOM 165 CD GLU A 12 6.171 7.195 -13.424 1.00 0.00 C ATOM 166 OE1 GLU A 12 5.344 6.668 -12.698 1.00 0.00 O ATOM 167 OE2 GLU A 12 5.892 7.940 -14.348 1.00 0.00 O ATOM 0 H GLU A 12 9.172 10.532 -13.362 1.00 0.00 H new ATOM 0 HA GLU A 12 7.254 9.296 -13.361 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.255 7.772 -12.002 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.772 7.543 -11.098 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.227 7.036 -14.074 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.775 5.864 -12.851 1.00 0.00 H new ATOM 174 N LYS A 13 5.658 10.303 -11.723 1.00 0.00 N ATOM 175 CA LYS A 13 4.671 10.817 -10.732 1.00 0.00 C ATOM 176 C LYS A 13 3.691 9.704 -10.353 1.00 0.00 C ATOM 177 O LYS A 13 2.710 9.935 -9.674 1.00 0.00 O ATOM 178 CB LYS A 13 3.898 11.980 -11.354 1.00 0.00 C ATOM 179 CG LYS A 13 2.961 11.441 -12.438 1.00 0.00 C ATOM 180 CD LYS A 13 2.337 12.604 -13.210 1.00 0.00 C ATOM 181 CE LYS A 13 1.818 13.654 -12.226 1.00 0.00 C ATOM 182 NZ LYS A 13 0.856 13.019 -11.281 1.00 0.00 N ATOM 0 H LYS A 13 5.379 10.396 -12.700 1.00 0.00 H new ATOM 0 HA LYS A 13 5.195 11.155 -9.838 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.325 12.502 -10.588 1.00 0.00 H new ATOM 0 HB3 LYS A 13 4.591 12.704 -11.783 1.00 0.00 H new ATOM 0 HG2 LYS A 13 3.513 10.795 -13.120 1.00 0.00 H new ATOM 0 HG3 LYS A 13 2.179 10.832 -11.985 1.00 0.00 H new ATOM 0 HD2 LYS A 13 3.076 13.049 -13.876 1.00 0.00 H new ATOM 0 HD3 LYS A 13 1.521 12.242 -13.835 1.00 0.00 H new ATOM 0 HE2 LYS A 13 2.649 14.093 -11.675 1.00 0.00 H new ATOM 0 HE3 LYS A 13 1.331 14.465 -12.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 0.051 13.658 -11.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 0.513 12.124 -11.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 1.332 12.831 -10.375 1.00 0.00 H new ATOM 196 N ASN A 14 3.942 8.501 -10.791 1.00 0.00 N ATOM 197 CA ASN A 14 3.014 7.382 -10.457 1.00 0.00 C ATOM 198 C ASN A 14 3.704 6.394 -9.513 1.00 0.00 C ATOM 199 O ASN A 14 4.770 6.654 -8.993 1.00 0.00 O ATOM 200 CB ASN A 14 2.611 6.655 -11.741 1.00 0.00 C ATOM 201 CG ASN A 14 2.374 7.676 -12.855 1.00 0.00 C ATOM 202 OD1 ASN A 14 2.229 8.853 -12.594 1.00 0.00 O ATOM 203 ND2 ASN A 14 2.326 7.272 -14.095 1.00 0.00 N ATOM 0 H ASN A 14 4.746 8.244 -11.364 1.00 0.00 H new ATOM 0 HA ASN A 14 2.128 7.787 -9.968 1.00 0.00 H new ATOM 0 HB2 ASN A 14 3.393 5.955 -12.036 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.707 6.070 -11.571 1.00 0.00 H new ATOM 0 HD21 ASN A 14 2.167 7.945 -14.845 1.00 0.00 H new ATOM 0 HD22 ASN A 14 2.448 6.283 -14.314 1.00 0.00 H new ATOM 210 N CYS A 15 3.098 5.258 -9.294 1.00 0.00 N ATOM 211 CA CYS A 15 3.706 4.241 -8.391 1.00 0.00 C ATOM 212 C CYS A 15 5.137 3.951 -8.850 1.00 0.00 C ATOM 213 O CYS A 15 5.377 3.063 -9.644 1.00 0.00 O ATOM 214 CB CYS A 15 2.864 2.959 -8.454 1.00 0.00 C ATOM 215 SG CYS A 15 3.793 1.553 -7.784 1.00 0.00 S ATOM 0 H CYS A 15 2.203 4.990 -9.704 1.00 0.00 H new ATOM 0 HA CYS A 15 3.729 4.611 -7.366 1.00 0.00 H new ATOM 0 HB2 CYS A 15 1.942 3.095 -7.889 1.00 0.00 H new ATOM 0 HB3 CYS A 15 2.579 2.755 -9.486 1.00 0.00 H new ATOM 220 N CYS A 16 6.091 4.692 -8.356 1.00 0.00 N ATOM 221 CA CYS A 16 7.502 4.453 -8.766 1.00 0.00 C ATOM 222 C CYS A 16 8.387 4.367 -7.521 1.00 0.00 C ATOM 223 O CYS A 16 8.477 5.297 -6.745 1.00 0.00 O ATOM 224 CB CYS A 16 7.982 5.605 -9.652 1.00 0.00 C ATOM 225 SG CYS A 16 9.096 4.966 -10.930 1.00 0.00 S ATOM 0 H CYS A 16 5.954 5.451 -7.688 1.00 0.00 H new ATOM 0 HA CYS A 16 7.563 3.518 -9.323 1.00 0.00 H new ATOM 0 HB2 CYS A 16 7.129 6.101 -10.114 1.00 0.00 H new ATOM 0 HB3 CYS A 16 8.496 6.352 -9.047 1.00 0.00 H new ATOM 230 N VAL A 17 9.037 3.254 -7.324 1.00 0.00 N ATOM 231 CA VAL A 17 9.915 3.103 -6.130 1.00 0.00 C ATOM 232 C VAL A 17 11.086 4.084 -6.220 1.00 0.00 C ATOM 233 O VAL A 17 11.909 4.002 -7.108 1.00 0.00 O ATOM 234 CB VAL A 17 10.459 1.675 -6.080 1.00 0.00 C ATOM 235 CG1 VAL A 17 11.458 1.474 -7.212 1.00 0.00 C ATOM 236 CG2 VAL A 17 11.169 1.446 -4.750 1.00 0.00 C ATOM 0 H VAL A 17 8.998 2.441 -7.939 1.00 0.00 H new ATOM 0 HA VAL A 17 9.337 3.311 -5.230 1.00 0.00 H new ATOM 0 HB VAL A 17 9.633 0.972 -6.184 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.847 0.456 -7.178 1.00 0.00 H new ATOM 0 HG12 VAL A 17 10.963 1.641 -8.168 1.00 0.00 H new ATOM 0 HG13 VAL A 17 12.281 2.181 -7.101 1.00 0.00 H new ATOM 0 HG21 VAL A 17 11.557 0.428 -4.715 1.00 0.00 H new ATOM 0 HG22 VAL A 17 11.994 2.152 -4.652 1.00 0.00 H new ATOM 0 HG23 VAL A 17 10.465 1.594 -3.931 1.00 0.00 H new ATOM 246 N ARG A 18 11.175 5.008 -5.304 1.00 0.00 N ATOM 247 CA ARG A 18 12.301 5.983 -5.342 1.00 0.00 C ATOM 248 C ARG A 18 13.378 5.552 -4.341 1.00 0.00 C ATOM 249 O ARG A 18 13.133 4.753 -3.460 1.00 0.00 O ATOM 250 CB ARG A 18 11.781 7.375 -4.977 1.00 0.00 C ATOM 251 CG ARG A 18 11.103 8.000 -6.198 1.00 0.00 C ATOM 252 CD ARG A 18 10.401 9.296 -5.787 1.00 0.00 C ATOM 253 NE ARG A 18 8.944 9.191 -6.086 1.00 0.00 N ATOM 254 CZ ARG A 18 8.543 8.628 -7.192 1.00 0.00 C ATOM 255 NH1 ARG A 18 9.327 8.608 -8.235 1.00 0.00 N ATOM 256 NH2 ARG A 18 7.358 8.083 -7.255 1.00 0.00 N ATOM 0 H ARG A 18 10.519 5.130 -4.533 1.00 0.00 H new ATOM 0 HA ARG A 18 12.730 6.011 -6.344 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.074 7.306 -4.150 1.00 0.00 H new ATOM 0 HB3 ARG A 18 12.604 8.006 -4.641 1.00 0.00 H new ATOM 0 HG2 ARG A 18 11.842 8.205 -6.972 1.00 0.00 H new ATOM 0 HG3 ARG A 18 10.381 7.302 -6.623 1.00 0.00 H new ATOM 0 HD2 ARG A 18 10.552 9.482 -4.724 1.00 0.00 H new ATOM 0 HD3 ARG A 18 10.833 10.141 -6.323 1.00 0.00 H new ATOM 0 HE ARG A 18 8.260 9.560 -5.425 1.00 0.00 H new ATOM 0 HH11 ARG A 18 10.253 9.033 -8.185 1.00 0.00 H new ATOM 0 HH12 ARG A 18 9.014 8.168 -9.100 1.00 0.00 H new ATOM 0 HH21 ARG A 18 6.746 8.098 -6.439 1.00 0.00 H new ATOM 0 HH22 ARG A 18 7.044 7.643 -8.120 1.00 0.00 H new ATOM 270 N GLN A 19 14.569 6.069 -4.472 1.00 0.00 N ATOM 271 CA GLN A 19 15.658 5.681 -3.530 1.00 0.00 C ATOM 272 C GLN A 19 15.304 6.144 -2.115 1.00 0.00 C ATOM 273 O GLN A 19 14.793 7.229 -1.916 1.00 0.00 O ATOM 274 CB GLN A 19 16.969 6.337 -3.968 1.00 0.00 C ATOM 275 CG GLN A 19 16.836 7.859 -3.876 1.00 0.00 C ATOM 276 CD GLN A 19 17.759 8.384 -2.776 1.00 0.00 C ATOM 277 OE1 GLN A 19 17.698 7.935 -1.648 1.00 0.00 O ATOM 278 NE2 GLN A 19 18.620 9.324 -3.057 1.00 0.00 N ATOM 0 H GLN A 19 14.835 6.743 -5.190 1.00 0.00 H new ATOM 0 HA GLN A 19 15.772 4.597 -3.537 1.00 0.00 H new ATOM 0 HB2 GLN A 19 17.788 5.994 -3.336 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.211 6.044 -4.990 1.00 0.00 H new ATOM 0 HG2 GLN A 19 17.094 8.316 -4.831 1.00 0.00 H new ATOM 0 HG3 GLN A 19 15.803 8.132 -3.661 1.00 0.00 H new ATOM 0 HE21 GLN A 19 18.672 9.702 -4.003 1.00 0.00 H new ATOM 0 HE22 GLN A 19 19.241 9.681 -2.330 1.00 0.00 H new ATOM 287 N LEU A 20 15.571 5.330 -1.130 1.00 0.00 N ATOM 288 CA LEU A 20 15.250 5.725 0.271 1.00 0.00 C ATOM 289 C LEU A 20 16.316 5.187 1.220 1.00 0.00 C ATOM 290 O LEU A 20 16.006 4.609 2.242 1.00 0.00 O ATOM 291 CB LEU A 20 13.894 5.145 0.673 1.00 0.00 C ATOM 292 CG LEU A 20 13.482 5.695 2.041 1.00 0.00 C ATOM 293 CD1 LEU A 20 13.577 7.220 2.031 1.00 0.00 C ATOM 294 CD2 LEU A 20 12.040 5.281 2.344 1.00 0.00 C ATOM 0 H LEU A 20 15.997 4.409 -1.235 1.00 0.00 H new ATOM 0 HA LEU A 20 15.220 6.813 0.331 1.00 0.00 H new ATOM 0 HB2 LEU A 20 13.142 5.401 -0.074 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.949 4.057 0.710 1.00 0.00 H new ATOM 0 HG LEU A 20 14.147 5.294 2.806 1.00 0.00 H new ATOM 0 HD11 LEU A 20 13.283 7.609 3.006 1.00 0.00 H new ATOM 0 HD12 LEU A 20 14.603 7.519 1.815 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.913 7.621 1.265 1.00 0.00 H new ATOM 0 HD21 LEU A 20 11.746 5.672 3.318 1.00 0.00 H new ATOM 0 HD22 LEU A 20 11.378 5.682 1.577 1.00 0.00 H new ATOM 0 HD23 LEU A 20 11.968 4.193 2.353 1.00 0.00 H new ATOM 306 N TYR A 21 17.570 5.363 0.907 1.00 0.00 N ATOM 307 CA TYR A 21 18.616 4.848 1.829 1.00 0.00 C ATOM 308 C TYR A 21 18.263 5.280 3.247 1.00 0.00 C ATOM 309 O TYR A 21 17.947 6.426 3.498 1.00 0.00 O ATOM 310 CB TYR A 21 19.987 5.415 1.464 1.00 0.00 C ATOM 311 CG TYR A 21 20.989 4.978 2.510 1.00 0.00 C ATOM 312 CD1 TYR A 21 20.990 5.577 3.779 1.00 0.00 C ATOM 313 CD2 TYR A 21 21.913 3.972 2.212 1.00 0.00 C ATOM 314 CE1 TYR A 21 21.917 5.169 4.748 1.00 0.00 C ATOM 315 CE2 TYR A 21 22.841 3.564 3.179 1.00 0.00 C ATOM 316 CZ TYR A 21 22.844 4.162 4.446 1.00 0.00 C ATOM 317 OH TYR A 21 23.759 3.760 5.397 1.00 0.00 O ATOM 0 H TYR A 21 17.910 5.833 0.068 1.00 0.00 H new ATOM 0 HA TYR A 21 18.657 3.762 1.752 1.00 0.00 H new ATOM 0 HB2 TYR A 21 20.291 5.062 0.479 1.00 0.00 H new ATOM 0 HB3 TYR A 21 19.944 6.503 1.413 1.00 0.00 H new ATOM 0 HD1 TYR A 21 20.276 6.353 4.009 1.00 0.00 H new ATOM 0 HD2 TYR A 21 21.911 3.509 1.236 1.00 0.00 H new ATOM 0 HE1 TYR A 21 21.917 5.629 5.725 1.00 0.00 H new ATOM 0 HE2 TYR A 21 23.555 2.787 2.947 1.00 0.00 H new ATOM 0 HH TYR A 21 24.327 3.053 5.026 1.00 0.00 H new ATOM 327 N ILE A 22 18.314 4.378 4.179 1.00 0.00 N ATOM 328 CA ILE A 22 17.984 4.745 5.578 1.00 0.00 C ATOM 329 C ILE A 22 19.197 4.475 6.461 1.00 0.00 C ATOM 330 O ILE A 22 19.599 3.346 6.658 1.00 0.00 O ATOM 331 CB ILE A 22 16.796 3.916 6.064 1.00 0.00 C ATOM 332 CG1 ILE A 22 15.576 4.216 5.188 1.00 0.00 C ATOM 333 CG2 ILE A 22 16.484 4.284 7.517 1.00 0.00 C ATOM 334 CD1 ILE A 22 14.313 3.668 5.856 1.00 0.00 C ATOM 0 H ILE A 22 18.570 3.401 4.033 1.00 0.00 H new ATOM 0 HA ILE A 22 17.721 5.802 5.628 1.00 0.00 H new ATOM 0 HB ILE A 22 17.038 2.855 6.000 1.00 0.00 H new ATOM 0 HG12 ILE A 22 15.481 5.291 5.036 1.00 0.00 H new ATOM 0 HG13 ILE A 22 15.703 3.765 4.204 1.00 0.00 H new ATOM 0 HG21 ILE A 22 15.637 3.695 7.868 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.354 4.075 8.140 1.00 0.00 H new ATOM 0 HG23 ILE A 22 16.239 5.344 7.579 1.00 0.00 H new ATOM 0 HD11 ILE A 22 13.447 3.884 5.230 1.00 0.00 H new ATOM 0 HD12 ILE A 22 14.408 2.590 5.985 1.00 0.00 H new ATOM 0 HD13 ILE A 22 14.183 4.140 6.830 1.00 0.00 H new ATOM 346 N ASP A 23 19.783 5.505 6.997 1.00 0.00 N ATOM 347 CA ASP A 23 20.967 5.314 7.866 1.00 0.00 C ATOM 348 C ASP A 23 20.483 4.990 9.278 1.00 0.00 C ATOM 349 O ASP A 23 20.269 5.864 10.088 1.00 0.00 O ATOM 350 CB ASP A 23 21.838 6.578 7.878 1.00 0.00 C ATOM 351 CG ASP A 23 21.353 7.603 6.843 1.00 0.00 C ATOM 352 OD1 ASP A 23 20.345 8.244 7.094 1.00 0.00 O ATOM 353 OD2 ASP A 23 22.001 7.729 5.817 1.00 0.00 O ATOM 0 H ASP A 23 19.490 6.474 6.869 1.00 0.00 H new ATOM 0 HA ASP A 23 21.575 4.494 7.483 1.00 0.00 H new ATOM 0 HB2 ASP A 23 21.819 7.025 8.872 1.00 0.00 H new ATOM 0 HB3 ASP A 23 22.874 6.310 7.669 1.00 0.00 H new ATOM 358 N PHE A 24 20.300 3.721 9.541 1.00 0.00 N ATOM 359 CA PHE A 24 19.813 3.226 10.869 1.00 0.00 C ATOM 360 C PHE A 24 19.702 4.335 11.922 1.00 0.00 C ATOM 361 O PHE A 24 18.632 4.607 12.426 1.00 0.00 O ATOM 362 CB PHE A 24 20.776 2.154 11.381 1.00 0.00 C ATOM 363 CG PHE A 24 20.320 0.805 10.885 1.00 0.00 C ATOM 364 CD1 PHE A 24 19.081 0.297 11.291 1.00 0.00 C ATOM 365 CD2 PHE A 24 21.127 0.067 10.014 1.00 0.00 C ATOM 366 CE1 PHE A 24 18.649 -0.949 10.824 1.00 0.00 C ATOM 367 CE2 PHE A 24 20.695 -1.181 9.551 1.00 0.00 C ATOM 368 CZ PHE A 24 19.457 -1.687 9.956 1.00 0.00 C ATOM 0 H PHE A 24 20.475 2.978 8.864 1.00 0.00 H new ATOM 0 HA PHE A 24 18.811 2.826 10.715 1.00 0.00 H new ATOM 0 HB2 PHE A 24 21.788 2.360 11.033 1.00 0.00 H new ATOM 0 HB3 PHE A 24 20.805 2.164 12.471 1.00 0.00 H new ATOM 0 HD1 PHE A 24 18.458 0.867 11.965 1.00 0.00 H new ATOM 0 HD2 PHE A 24 22.083 0.459 9.699 1.00 0.00 H new ATOM 0 HE1 PHE A 24 17.691 -1.340 11.134 1.00 0.00 H new ATOM 0 HE2 PHE A 24 21.319 -1.753 8.880 1.00 0.00 H new ATOM 0 HZ PHE A 24 19.125 -2.650 9.597 1.00 0.00 H new ATOM 378 N ARG A 25 20.789 4.956 12.286 1.00 0.00 N ATOM 379 CA ARG A 25 20.711 6.010 13.346 1.00 0.00 C ATOM 380 C ARG A 25 20.540 7.409 12.748 1.00 0.00 C ATOM 381 O ARG A 25 19.902 8.260 13.337 1.00 0.00 O ATOM 382 CB ARG A 25 21.979 5.983 14.211 1.00 0.00 C ATOM 383 CG ARG A 25 23.179 5.524 13.380 1.00 0.00 C ATOM 384 CD ARG A 25 24.473 5.770 14.164 1.00 0.00 C ATOM 385 NE ARG A 25 24.204 5.653 15.626 1.00 0.00 N ATOM 386 CZ ARG A 25 24.984 4.924 16.378 1.00 0.00 C ATOM 387 NH1 ARG A 25 26.202 5.319 16.629 1.00 0.00 N ATOM 388 NH2 ARG A 25 24.544 3.802 16.877 1.00 0.00 N ATOM 0 H ARG A 25 21.719 4.785 11.903 1.00 0.00 H new ATOM 0 HA ARG A 25 19.836 5.791 13.957 1.00 0.00 H new ATOM 0 HB2 ARG A 25 22.170 6.975 14.620 1.00 0.00 H new ATOM 0 HB3 ARG A 25 21.836 5.311 15.057 1.00 0.00 H new ATOM 0 HG2 ARG A 25 23.084 4.465 13.139 1.00 0.00 H new ATOM 0 HG3 ARG A 25 23.207 6.065 12.434 1.00 0.00 H new ATOM 0 HD2 ARG A 25 25.233 5.048 13.865 1.00 0.00 H new ATOM 0 HD3 ARG A 25 24.866 6.761 13.935 1.00 0.00 H new ATOM 0 HE ARG A 25 23.410 6.143 16.039 1.00 0.00 H new ATOM 0 HH11 ARG A 25 26.544 6.197 16.238 1.00 0.00 H new ATOM 0 HH12 ARG A 25 26.812 4.750 17.216 1.00 0.00 H new ATOM 0 HH21 ARG A 25 23.592 3.495 16.680 1.00 0.00 H new ATOM 0 HH22 ARG A 25 25.152 3.232 17.464 1.00 0.00 H new ATOM 402 N LYS A 26 21.103 7.678 11.606 1.00 0.00 N ATOM 403 CA LYS A 26 20.956 9.045 11.029 1.00 0.00 C ATOM 404 C LYS A 26 19.482 9.329 10.728 1.00 0.00 C ATOM 405 O LYS A 26 18.947 10.352 11.105 1.00 0.00 O ATOM 406 CB LYS A 26 21.754 9.140 9.734 1.00 0.00 C ATOM 407 CG LYS A 26 22.261 10.571 9.543 1.00 0.00 C ATOM 408 CD LYS A 26 22.302 10.903 8.050 1.00 0.00 C ATOM 409 CE LYS A 26 22.708 12.365 7.862 1.00 0.00 C ATOM 410 NZ LYS A 26 22.031 12.916 6.653 1.00 0.00 N ATOM 0 H LYS A 26 21.652 7.022 11.051 1.00 0.00 H new ATOM 0 HA LYS A 26 21.328 9.775 11.748 1.00 0.00 H new ATOM 0 HB2 LYS A 26 22.595 8.447 9.762 1.00 0.00 H new ATOM 0 HB3 LYS A 26 21.130 8.849 8.889 1.00 0.00 H new ATOM 0 HG2 LYS A 26 21.609 11.272 10.064 1.00 0.00 H new ATOM 0 HG3 LYS A 26 23.255 10.677 9.977 1.00 0.00 H new ATOM 0 HD2 LYS A 26 23.011 10.250 7.541 1.00 0.00 H new ATOM 0 HD3 LYS A 26 21.325 10.725 7.600 1.00 0.00 H new ATOM 0 HE2 LYS A 26 22.434 12.946 8.742 1.00 0.00 H new ATOM 0 HE3 LYS A 26 23.790 12.442 7.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 22.306 13.911 6.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 22.314 12.367 5.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 21.000 12.855 6.775 1.00 0.00 H new ATOM 424 N ASP A 27 18.833 8.442 10.029 1.00 0.00 N ATOM 425 CA ASP A 27 17.407 8.661 9.671 1.00 0.00 C ATOM 426 C ASP A 27 16.464 8.078 10.736 1.00 0.00 C ATOM 427 O ASP A 27 15.571 8.750 11.211 1.00 0.00 O ATOM 428 CB ASP A 27 17.144 7.983 8.331 1.00 0.00 C ATOM 429 CG ASP A 27 17.397 8.978 7.198 1.00 0.00 C ATOM 430 OD1 ASP A 27 16.924 10.097 7.301 1.00 0.00 O ATOM 431 OD2 ASP A 27 18.062 8.604 6.245 1.00 0.00 O ATOM 0 H ASP A 27 19.233 7.568 9.688 1.00 0.00 H new ATOM 0 HA ASP A 27 17.216 9.732 9.611 1.00 0.00 H new ATOM 0 HB2 ASP A 27 17.792 7.114 8.218 1.00 0.00 H new ATOM 0 HB3 ASP A 27 16.116 7.622 8.290 1.00 0.00 H new ATOM 436 N LEU A 28 16.634 6.835 11.100 1.00 0.00 N ATOM 437 CA LEU A 28 15.718 6.228 12.115 1.00 0.00 C ATOM 438 C LEU A 28 16.252 6.472 13.527 1.00 0.00 C ATOM 439 O LEU A 28 15.505 6.483 14.485 1.00 0.00 O ATOM 440 CB LEU A 28 15.625 4.719 11.886 1.00 0.00 C ATOM 441 CG LEU A 28 15.066 4.438 10.495 1.00 0.00 C ATOM 442 CD1 LEU A 28 14.777 2.943 10.361 1.00 0.00 C ATOM 443 CD2 LEU A 28 13.770 5.227 10.298 1.00 0.00 C ATOM 0 H LEU A 28 17.361 6.216 10.743 1.00 0.00 H new ATOM 0 HA LEU A 28 14.735 6.688 12.011 1.00 0.00 H new ATOM 0 HB2 LEU A 28 16.611 4.265 11.990 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.985 4.266 12.643 1.00 0.00 H new ATOM 0 HG LEU A 28 15.792 4.740 9.740 1.00 0.00 H new ATOM 0 HD11 LEU A 28 14.377 2.737 9.368 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.699 2.380 10.505 1.00 0.00 H new ATOM 0 HD13 LEU A 28 14.048 2.644 11.115 1.00 0.00 H new ATOM 0 HD21 LEU A 28 13.370 5.027 9.304 1.00 0.00 H new ATOM 0 HD22 LEU A 28 13.042 4.924 11.050 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.974 6.293 10.399 1.00 0.00 H new ATOM 455 N GLY A 29 17.532 6.646 13.673 1.00 0.00 N ATOM 456 CA GLY A 29 18.091 6.864 15.036 1.00 0.00 C ATOM 457 C GLY A 29 18.030 5.545 15.811 1.00 0.00 C ATOM 458 O GLY A 29 18.258 5.498 17.003 1.00 0.00 O ATOM 0 H GLY A 29 18.214 6.647 12.914 1.00 0.00 H new ATOM 0 HA2 GLY A 29 19.121 7.216 14.970 1.00 0.00 H new ATOM 0 HA3 GLY A 29 17.524 7.635 15.558 1.00 0.00 H new ATOM 462 N TRP A 30 17.719 4.470 15.133 1.00 0.00 N ATOM 463 CA TRP A 30 17.634 3.147 15.810 1.00 0.00 C ATOM 464 C TRP A 30 18.826 2.968 16.748 1.00 0.00 C ATOM 465 O TRP A 30 19.967 3.113 16.357 1.00 0.00 O ATOM 466 CB TRP A 30 17.655 2.040 14.756 1.00 0.00 C ATOM 467 CG TRP A 30 16.264 1.770 14.285 1.00 0.00 C ATOM 468 CD1 TRP A 30 15.197 2.568 14.514 1.00 0.00 C ATOM 469 CD2 TRP A 30 15.772 0.641 13.509 1.00 0.00 C ATOM 470 NE1 TRP A 30 14.081 1.998 13.929 1.00 0.00 N ATOM 471 CE2 TRP A 30 14.384 0.810 13.297 1.00 0.00 C ATOM 472 CE3 TRP A 30 16.391 -0.501 12.974 1.00 0.00 C ATOM 473 CZ2 TRP A 30 13.635 -0.124 12.580 1.00 0.00 C ATOM 474 CZ3 TRP A 30 15.639 -1.443 12.251 1.00 0.00 C ATOM 475 CH2 TRP A 30 14.264 -1.254 12.055 1.00 0.00 C ATOM 0 H TRP A 30 17.519 4.455 14.133 1.00 0.00 H new ATOM 0 HA TRP A 30 16.710 3.096 16.386 1.00 0.00 H new ATOM 0 HB2 TRP A 30 18.283 2.336 13.916 1.00 0.00 H new ATOM 0 HB3 TRP A 30 18.090 1.133 15.175 1.00 0.00 H new ATOM 0 HD1 TRP A 30 15.213 3.498 15.063 1.00 0.00 H new ATOM 0 HE1 TRP A 30 13.147 2.407 13.961 1.00 0.00 H new ATOM 0 HE3 TRP A 30 17.450 -0.656 13.119 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 12.576 0.027 12.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 16.124 -2.318 11.844 1.00 0.00 H new ATOM 0 HH2 TRP A 30 13.692 -1.982 11.499 1.00 0.00 H new ATOM 486 N LYS A 31 18.568 2.653 17.985 1.00 0.00 N ATOM 487 CA LYS A 31 19.667 2.461 18.955 1.00 0.00 C ATOM 488 C LYS A 31 19.821 0.972 19.261 1.00 0.00 C ATOM 489 O LYS A 31 20.773 0.552 19.888 1.00 0.00 O ATOM 490 CB LYS A 31 19.307 3.204 20.234 1.00 0.00 C ATOM 491 CG LYS A 31 19.854 4.632 20.173 1.00 0.00 C ATOM 492 CD LYS A 31 20.108 5.143 21.593 1.00 0.00 C ATOM 493 CE LYS A 31 20.851 6.479 21.530 1.00 0.00 C ATOM 494 NZ LYS A 31 20.858 7.108 22.880 1.00 0.00 N ATOM 0 H LYS A 31 17.631 2.520 18.365 1.00 0.00 H new ATOM 0 HA LYS A 31 20.603 2.841 18.546 1.00 0.00 H new ATOM 0 HB2 LYS A 31 18.225 3.224 20.362 1.00 0.00 H new ATOM 0 HB3 LYS A 31 19.720 2.683 21.097 1.00 0.00 H new ATOM 0 HG2 LYS A 31 20.779 4.654 19.596 1.00 0.00 H new ATOM 0 HG3 LYS A 31 19.144 5.283 19.662 1.00 0.00 H new ATOM 0 HD2 LYS A 31 19.162 5.265 22.121 1.00 0.00 H new ATOM 0 HD3 LYS A 31 20.694 4.415 22.153 1.00 0.00 H new ATOM 0 HE2 LYS A 31 21.873 6.323 21.185 1.00 0.00 H new ATOM 0 HE3 LYS A 31 20.369 7.142 20.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 21.363 8.016 22.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 19.879 7.270 23.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 21.336 6.477 23.554 1.00 0.00 H new ATOM 508 N TRP A 32 18.886 0.169 18.833 1.00 0.00 N ATOM 509 CA TRP A 32 18.979 -1.290 19.114 1.00 0.00 C ATOM 510 C TRP A 32 19.794 -1.987 18.025 1.00 0.00 C ATOM 511 O TRP A 32 19.949 -3.190 18.035 1.00 0.00 O ATOM 512 CB TRP A 32 17.574 -1.895 19.167 1.00 0.00 C ATOM 513 CG TRP A 32 17.023 -2.051 17.782 1.00 0.00 C ATOM 514 CD1 TRP A 32 16.491 -1.055 17.042 1.00 0.00 C ATOM 515 CD2 TRP A 32 16.942 -3.254 16.964 1.00 0.00 C ATOM 516 NE1 TRP A 32 16.071 -1.569 15.832 1.00 0.00 N ATOM 517 CE2 TRP A 32 16.328 -2.920 15.734 1.00 0.00 C ATOM 518 CE3 TRP A 32 17.332 -4.587 17.167 1.00 0.00 C ATOM 519 CZ2 TRP A 32 16.107 -3.877 14.744 1.00 0.00 C ATOM 520 CZ3 TRP A 32 17.115 -5.554 16.172 1.00 0.00 C ATOM 521 CH2 TRP A 32 16.499 -5.199 14.963 1.00 0.00 C ATOM 0 H TRP A 32 18.065 0.459 18.303 1.00 0.00 H new ATOM 0 HA TRP A 32 19.474 -1.433 20.074 1.00 0.00 H new ATOM 0 HB2 TRP A 32 17.607 -2.864 19.664 1.00 0.00 H new ATOM 0 HB3 TRP A 32 16.917 -1.256 19.757 1.00 0.00 H new ATOM 0 HD1 TRP A 32 16.408 -0.023 17.348 1.00 0.00 H new ATOM 0 HE1 TRP A 32 15.625 -1.017 15.100 1.00 0.00 H new ATOM 0 HE3 TRP A 32 17.803 -4.871 18.096 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 15.635 -3.597 13.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 17.424 -6.575 16.338 1.00 0.00 H new ATOM 0 HH2 TRP A 32 16.328 -5.947 14.203 1.00 0.00 H new ATOM 532 N ILE A 33 20.313 -1.250 17.084 1.00 0.00 N ATOM 533 CA ILE A 33 21.109 -1.894 16.004 1.00 0.00 C ATOM 534 C ILE A 33 22.452 -1.174 15.848 1.00 0.00 C ATOM 535 O ILE A 33 22.516 0.034 15.740 1.00 0.00 O ATOM 536 CB ILE A 33 20.321 -1.834 14.689 1.00 0.00 C ATOM 537 CG1 ILE A 33 19.316 -2.981 14.667 1.00 0.00 C ATOM 538 CG2 ILE A 33 21.267 -1.974 13.492 1.00 0.00 C ATOM 539 CD1 ILE A 33 18.472 -2.902 13.399 1.00 0.00 C ATOM 0 H ILE A 33 20.221 -0.236 17.016 1.00 0.00 H new ATOM 0 HA ILE A 33 21.299 -2.936 16.262 1.00 0.00 H new ATOM 0 HB ILE A 33 19.808 -0.875 14.622 1.00 0.00 H new ATOM 0 HG12 ILE A 33 19.839 -3.936 14.708 1.00 0.00 H new ATOM 0 HG13 ILE A 33 18.674 -2.931 15.546 1.00 0.00 H new ATOM 0 HG21 ILE A 33 20.692 -1.929 12.567 1.00 0.00 H new ATOM 0 HG22 ILE A 33 21.995 -1.163 13.507 1.00 0.00 H new ATOM 0 HG23 ILE A 33 21.788 -2.930 13.550 1.00 0.00 H new ATOM 0 HD11 ILE A 33 17.755 -3.723 13.387 1.00 0.00 H new ATOM 0 HD12 ILE A 33 17.937 -1.953 13.377 1.00 0.00 H new ATOM 0 HD13 ILE A 33 19.120 -2.973 12.526 1.00 0.00 H new ATOM 551 N HIS A 34 23.520 -1.919 15.828 1.00 0.00 N ATOM 552 CA HIS A 34 24.867 -1.302 15.669 1.00 0.00 C ATOM 553 C HIS A 34 25.259 -1.327 14.188 1.00 0.00 C ATOM 554 O HIS A 34 25.582 -0.312 13.604 1.00 0.00 O ATOM 555 CB HIS A 34 25.886 -2.099 16.493 1.00 0.00 C ATOM 556 CG HIS A 34 27.283 -1.776 16.034 1.00 0.00 C ATOM 557 ND1 HIS A 34 27.748 -0.474 15.936 1.00 0.00 N ATOM 558 CD2 HIS A 34 28.325 -2.577 15.637 1.00 0.00 C ATOM 559 CE1 HIS A 34 29.018 -0.529 15.496 1.00 0.00 C ATOM 560 NE2 HIS A 34 29.420 -1.787 15.298 1.00 0.00 N ATOM 0 H HIS A 34 23.519 -2.935 15.915 1.00 0.00 H new ATOM 0 HA HIS A 34 24.849 -0.270 16.019 1.00 0.00 H new ATOM 0 HB2 HIS A 34 25.777 -1.860 17.551 1.00 0.00 H new ATOM 0 HB3 HIS A 34 25.697 -3.167 16.386 1.00 0.00 H new ATOM 0 HD2 HIS A 34 28.299 -3.656 15.594 1.00 0.00 H new ATOM 0 HE1 HIS A 34 29.637 0.339 15.324 1.00 0.00 H new ATOM 0 HE2 HIS A 34 30.333 -2.101 14.969 1.00 0.00 H new ATOM 568 N GLU A 35 25.233 -2.482 13.577 1.00 0.00 N ATOM 569 CA GLU A 35 25.602 -2.572 12.136 1.00 0.00 C ATOM 570 C GLU A 35 24.511 -3.333 11.374 1.00 0.00 C ATOM 571 O GLU A 35 23.791 -4.120 11.953 1.00 0.00 O ATOM 572 CB GLU A 35 26.935 -3.310 11.996 1.00 0.00 C ATOM 573 CG GLU A 35 28.087 -2.309 12.104 1.00 0.00 C ATOM 574 CD GLU A 35 29.314 -2.857 11.371 1.00 0.00 C ATOM 575 OE1 GLU A 35 29.958 -3.738 11.915 1.00 0.00 O ATOM 576 OE2 GLU A 35 29.586 -2.384 10.281 1.00 0.00 O ATOM 0 H GLU A 35 24.972 -3.366 14.014 1.00 0.00 H new ATOM 0 HA GLU A 35 25.698 -1.568 11.722 1.00 0.00 H new ATOM 0 HB2 GLU A 35 27.025 -4.070 12.772 1.00 0.00 H new ATOM 0 HB3 GLU A 35 26.977 -3.827 11.037 1.00 0.00 H new ATOM 0 HG2 GLU A 35 27.792 -1.352 11.674 1.00 0.00 H new ATOM 0 HG3 GLU A 35 28.328 -2.128 13.152 1.00 0.00 H new ATOM 583 N PRO A 36 24.419 -3.066 10.097 1.00 0.00 N ATOM 584 CA PRO A 36 25.301 -2.107 9.407 1.00 0.00 C ATOM 585 C PRO A 36 24.891 -0.671 9.737 1.00 0.00 C ATOM 586 O PRO A 36 23.865 -0.430 10.341 1.00 0.00 O ATOM 587 CB PRO A 36 25.082 -2.417 7.925 1.00 0.00 C ATOM 588 CG PRO A 36 23.709 -3.121 7.826 1.00 0.00 C ATOM 589 CD PRO A 36 23.413 -3.699 9.221 1.00 0.00 C ATOM 0 HA PRO A 36 26.347 -2.196 9.702 1.00 0.00 H new ATOM 0 HB2 PRO A 36 25.094 -1.503 7.331 1.00 0.00 H new ATOM 0 HB3 PRO A 36 25.876 -3.057 7.541 1.00 0.00 H new ATOM 0 HG2 PRO A 36 22.933 -2.417 7.525 1.00 0.00 H new ATOM 0 HG3 PRO A 36 23.731 -3.911 7.075 1.00 0.00 H new ATOM 0 HD2 PRO A 36 22.399 -3.462 9.543 1.00 0.00 H new ATOM 0 HD3 PRO A 36 23.505 -4.785 9.230 1.00 0.00 H new ATOM 597 N LYS A 37 25.685 0.283 9.343 1.00 0.00 N ATOM 598 CA LYS A 37 25.355 1.698 9.624 1.00 0.00 C ATOM 599 C LYS A 37 24.008 2.040 8.988 1.00 0.00 C ATOM 600 O LYS A 37 23.221 2.788 9.535 1.00 0.00 O ATOM 601 CB LYS A 37 26.444 2.570 9.017 1.00 0.00 C ATOM 602 CG LYS A 37 27.548 2.808 10.051 1.00 0.00 C ATOM 603 CD LYS A 37 28.590 3.769 9.477 1.00 0.00 C ATOM 604 CE LYS A 37 28.373 5.165 10.064 1.00 0.00 C ATOM 605 NZ LYS A 37 27.247 5.834 9.352 1.00 0.00 N ATOM 0 H LYS A 37 26.556 0.137 8.833 1.00 0.00 H new ATOM 0 HA LYS A 37 25.294 1.868 10.699 1.00 0.00 H new ATOM 0 HB2 LYS A 37 26.859 2.088 8.132 1.00 0.00 H new ATOM 0 HB3 LYS A 37 26.023 3.522 8.694 1.00 0.00 H new ATOM 0 HG2 LYS A 37 27.121 3.222 10.965 1.00 0.00 H new ATOM 0 HG3 LYS A 37 28.019 1.862 10.319 1.00 0.00 H new ATOM 0 HD2 LYS A 37 29.594 3.416 9.712 1.00 0.00 H new ATOM 0 HD3 LYS A 37 28.510 3.803 8.390 1.00 0.00 H new ATOM 0 HE2 LYS A 37 28.152 5.093 11.129 1.00 0.00 H new ATOM 0 HE3 LYS A 37 29.283 5.758 9.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 27.259 6.852 9.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 27.351 5.692 8.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 26.345 5.425 9.669 1.00 0.00 H new ATOM 619 N GLY A 38 23.741 1.496 7.836 1.00 0.00 N ATOM 620 CA GLY A 38 22.445 1.784 7.155 1.00 0.00 C ATOM 621 C GLY A 38 22.220 0.768 6.034 1.00 0.00 C ATOM 622 O GLY A 38 22.808 -0.295 6.021 1.00 0.00 O ATOM 0 H GLY A 38 24.363 0.863 7.334 1.00 0.00 H new ATOM 0 HA2 GLY A 38 21.626 1.736 7.873 1.00 0.00 H new ATOM 0 HA3 GLY A 38 22.453 2.795 6.748 1.00 0.00 H new ATOM 626 N TYR A 39 21.374 1.083 5.091 1.00 0.00 N ATOM 627 CA TYR A 39 21.118 0.128 3.976 1.00 0.00 C ATOM 628 C TYR A 39 20.178 0.768 2.950 1.00 0.00 C ATOM 629 O TYR A 39 19.633 1.831 3.170 1.00 0.00 O ATOM 630 CB TYR A 39 20.481 -1.149 4.537 1.00 0.00 C ATOM 631 CG TYR A 39 19.022 -0.904 4.858 1.00 0.00 C ATOM 632 CD1 TYR A 39 18.665 -0.073 5.927 1.00 0.00 C ATOM 633 CD2 TYR A 39 18.027 -1.513 4.086 1.00 0.00 C ATOM 634 CE1 TYR A 39 17.315 0.149 6.223 1.00 0.00 C ATOM 635 CE2 TYR A 39 16.676 -1.291 4.382 1.00 0.00 C ATOM 636 CZ TYR A 39 16.320 -0.461 5.451 1.00 0.00 C ATOM 637 OH TYR A 39 14.989 -0.244 5.742 1.00 0.00 O ATOM 0 H TYR A 39 20.851 1.957 5.045 1.00 0.00 H new ATOM 0 HA TYR A 39 22.060 -0.120 3.488 1.00 0.00 H new ATOM 0 HB2 TYR A 39 20.571 -1.958 3.813 1.00 0.00 H new ATOM 0 HB3 TYR A 39 21.011 -1.465 5.435 1.00 0.00 H new ATOM 0 HD1 TYR A 39 19.432 0.397 6.524 1.00 0.00 H new ATOM 0 HD2 TYR A 39 18.301 -2.155 3.261 1.00 0.00 H new ATOM 0 HE1 TYR A 39 17.041 0.791 7.047 1.00 0.00 H new ATOM 0 HE2 TYR A 39 15.909 -1.761 3.785 1.00 0.00 H new ATOM 0 HH TYR A 39 14.681 -0.916 6.385 1.00 0.00 H new ATOM 647 N HIS A 40 19.978 0.124 1.832 1.00 0.00 N ATOM 648 CA HIS A 40 19.067 0.690 0.799 1.00 0.00 C ATOM 649 C HIS A 40 17.638 0.232 1.093 1.00 0.00 C ATOM 650 O HIS A 40 17.176 -0.767 0.577 1.00 0.00 O ATOM 651 CB HIS A 40 19.488 0.190 -0.585 1.00 0.00 C ATOM 652 CG HIS A 40 20.852 0.727 -0.921 1.00 0.00 C ATOM 653 ND1 HIS A 40 22.013 0.172 -0.406 1.00 0.00 N ATOM 654 CD2 HIS A 40 21.258 1.769 -1.719 1.00 0.00 C ATOM 655 CE1 HIS A 40 23.051 0.875 -0.894 1.00 0.00 C ATOM 656 NE2 HIS A 40 22.646 1.860 -1.700 1.00 0.00 N ATOM 0 H HIS A 40 20.407 -0.769 1.590 1.00 0.00 H new ATOM 0 HA HIS A 40 19.119 1.779 0.819 1.00 0.00 H new ATOM 0 HB2 HIS A 40 19.501 -0.900 -0.601 1.00 0.00 H new ATOM 0 HB3 HIS A 40 18.765 0.511 -1.335 1.00 0.00 H new ATOM 0 HD2 HIS A 40 20.600 2.419 -2.276 1.00 0.00 H new ATOM 0 HE1 HIS A 40 24.085 0.668 -0.662 1.00 0.00 H new ATOM 0 HE2 HIS A 40 23.229 2.534 -2.195 1.00 0.00 H new ATOM 664 N ALA A 41 16.936 0.948 1.928 1.00 0.00 N ATOM 665 CA ALA A 41 15.542 0.546 2.266 1.00 0.00 C ATOM 666 C ALA A 41 14.617 0.813 1.075 1.00 0.00 C ATOM 667 O ALA A 41 13.657 0.101 0.855 1.00 0.00 O ATOM 668 CB ALA A 41 15.066 1.344 3.482 1.00 0.00 C ATOM 0 H ALA A 41 17.268 1.794 2.391 1.00 0.00 H new ATOM 0 HA ALA A 41 15.519 -0.519 2.498 1.00 0.00 H new ATOM 0 HB1 ALA A 41 14.046 1.052 3.732 1.00 0.00 H new ATOM 0 HB2 ALA A 41 15.720 1.140 4.330 1.00 0.00 H new ATOM 0 HB3 ALA A 41 15.093 2.409 3.251 1.00 0.00 H new ATOM 674 N ASN A 42 14.894 1.826 0.300 1.00 0.00 N ATOM 675 CA ASN A 42 14.023 2.122 -0.874 1.00 0.00 C ATOM 676 C ASN A 42 12.581 2.322 -0.404 1.00 0.00 C ATOM 677 O ASN A 42 12.279 2.200 0.767 1.00 0.00 O ATOM 678 CB ASN A 42 14.075 0.947 -1.852 1.00 0.00 C ATOM 679 CG ASN A 42 15.164 1.197 -2.897 1.00 0.00 C ATOM 680 OD1 ASN A 42 15.389 2.320 -3.300 1.00 0.00 O ATOM 681 ND2 ASN A 42 15.855 0.189 -3.355 1.00 0.00 N ATOM 0 H ASN A 42 15.683 2.460 0.428 1.00 0.00 H new ATOM 0 HA ASN A 42 14.375 3.028 -1.367 1.00 0.00 H new ATOM 0 HB2 ASN A 42 14.279 0.021 -1.314 1.00 0.00 H new ATOM 0 HB3 ASN A 42 13.109 0.825 -2.341 1.00 0.00 H new ATOM 0 HD21 ASN A 42 16.584 0.345 -4.051 1.00 0.00 H new ATOM 0 HD22 ASN A 42 15.666 -0.755 -3.017 1.00 0.00 H new ATOM 688 N PHE A 43 11.685 2.619 -1.308 1.00 0.00 N ATOM 689 CA PHE A 43 10.261 2.815 -0.912 1.00 0.00 C ATOM 690 C PHE A 43 9.435 3.182 -2.141 1.00 0.00 C ATOM 691 O PHE A 43 9.906 3.108 -3.256 1.00 0.00 O ATOM 692 CB PHE A 43 10.146 3.918 0.145 1.00 0.00 C ATOM 693 CG PHE A 43 10.324 5.286 -0.470 1.00 0.00 C ATOM 694 CD1 PHE A 43 11.339 5.524 -1.404 1.00 0.00 C ATOM 695 CD2 PHE A 43 9.476 6.329 -0.082 1.00 0.00 C ATOM 696 CE1 PHE A 43 11.504 6.804 -1.944 1.00 0.00 C ATOM 697 CE2 PHE A 43 9.640 7.603 -0.626 1.00 0.00 C ATOM 698 CZ PHE A 43 10.654 7.843 -1.556 1.00 0.00 C ATOM 0 H PHE A 43 11.878 2.734 -2.303 1.00 0.00 H new ATOM 0 HA PHE A 43 9.882 1.887 -0.485 1.00 0.00 H new ATOM 0 HB2 PHE A 43 9.172 3.859 0.631 1.00 0.00 H new ATOM 0 HB3 PHE A 43 10.898 3.764 0.919 1.00 0.00 H new ATOM 0 HD1 PHE A 43 11.994 4.721 -1.707 1.00 0.00 H new ATOM 0 HD2 PHE A 43 8.693 6.148 0.640 1.00 0.00 H new ATOM 0 HE1 PHE A 43 12.289 6.989 -2.662 1.00 0.00 H new ATOM 0 HE2 PHE A 43 8.982 8.405 -0.327 1.00 0.00 H new ATOM 0 HZ PHE A 43 10.781 8.830 -1.975 1.00 0.00 H new ATOM 708 N CYS A 44 8.199 3.560 -1.954 1.00 0.00 N ATOM 709 CA CYS A 44 7.349 3.905 -3.130 1.00 0.00 C ATOM 710 C CYS A 44 6.598 5.211 -2.862 1.00 0.00 C ATOM 711 O CYS A 44 6.243 5.515 -1.741 1.00 0.00 O ATOM 712 CB CYS A 44 6.327 2.788 -3.373 1.00 0.00 C ATOM 713 SG CYS A 44 6.983 1.195 -2.803 1.00 0.00 S ATOM 0 H CYS A 44 7.744 3.644 -1.045 1.00 0.00 H new ATOM 0 HA CYS A 44 7.988 4.021 -4.006 1.00 0.00 H new ATOM 0 HB2 CYS A 44 5.399 3.015 -2.848 1.00 0.00 H new ATOM 0 HB3 CYS A 44 6.087 2.731 -4.435 1.00 0.00 H new ATOM 718 N LEU A 45 6.345 5.983 -3.885 1.00 0.00 N ATOM 719 CA LEU A 45 5.607 7.262 -3.689 1.00 0.00 C ATOM 720 C LEU A 45 4.661 7.497 -4.869 1.00 0.00 C ATOM 721 O LEU A 45 4.692 6.786 -5.855 1.00 0.00 O ATOM 722 CB LEU A 45 6.601 8.420 -3.599 1.00 0.00 C ATOM 723 CG LEU A 45 7.272 8.412 -2.228 1.00 0.00 C ATOM 724 CD1 LEU A 45 8.123 9.674 -2.078 1.00 0.00 C ATOM 725 CD2 LEU A 45 6.206 8.384 -1.131 1.00 0.00 C ATOM 0 H LEU A 45 6.618 5.782 -4.847 1.00 0.00 H new ATOM 0 HA LEU A 45 5.030 7.205 -2.766 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.352 8.330 -4.384 1.00 0.00 H new ATOM 0 HB3 LEU A 45 6.086 9.368 -3.758 1.00 0.00 H new ATOM 0 HG LEU A 45 7.903 7.528 -2.138 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.605 9.674 -1.100 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.884 9.694 -2.858 1.00 0.00 H new ATOM 0 HD13 LEU A 45 7.487 10.555 -2.169 1.00 0.00 H new ATOM 0 HD21 LEU A 45 6.689 8.378 -0.154 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.572 9.266 -1.217 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.596 7.487 -1.239 1.00 0.00 H new ATOM 737 N GLY A 46 3.822 8.493 -4.778 1.00 0.00 N ATOM 738 CA GLY A 46 2.875 8.779 -5.892 1.00 0.00 C ATOM 739 C GLY A 46 1.943 7.580 -6.097 1.00 0.00 C ATOM 740 O GLY A 46 2.343 6.448 -5.916 1.00 0.00 O ATOM 0 H GLY A 46 3.752 9.122 -3.978 1.00 0.00 H new ATOM 0 HA2 GLY A 46 2.291 9.671 -5.666 1.00 0.00 H new ATOM 0 HA3 GLY A 46 3.428 8.983 -6.809 1.00 0.00 H new ATOM 744 N PRO A 47 0.721 7.870 -6.471 1.00 0.00 N ATOM 745 CA PRO A 47 -0.302 6.836 -6.714 1.00 0.00 C ATOM 746 C PRO A 47 -0.084 6.186 -8.084 1.00 0.00 C ATOM 747 O PRO A 47 0.944 6.357 -8.706 1.00 0.00 O ATOM 748 CB PRO A 47 -1.616 7.620 -6.686 1.00 0.00 C ATOM 749 CG PRO A 47 -1.254 9.092 -6.997 1.00 0.00 C ATOM 750 CD PRO A 47 0.247 9.252 -6.687 1.00 0.00 C ATOM 0 HA PRO A 47 -0.279 6.026 -5.984 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -2.317 7.229 -7.423 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -2.097 7.536 -5.712 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -1.461 9.330 -8.040 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -1.850 9.774 -6.390 1.00 0.00 H new ATOM 0 HD2 PRO A 47 0.775 9.730 -7.512 1.00 0.00 H new ATOM 0 HD3 PRO A 47 0.408 9.871 -5.804 1.00 0.00 H new ATOM 758 N CYS A 48 -1.048 5.445 -8.561 1.00 0.00 N ATOM 759 CA CYS A 48 -0.894 4.791 -9.891 1.00 0.00 C ATOM 760 C CYS A 48 -2.246 4.750 -10.607 1.00 0.00 C ATOM 761 O CYS A 48 -3.282 4.725 -9.973 1.00 0.00 O ATOM 762 CB CYS A 48 -0.380 3.359 -9.716 1.00 0.00 C ATOM 763 SG CYS A 48 -1.084 2.621 -8.217 1.00 0.00 S ATOM 0 H CYS A 48 -1.933 5.265 -8.088 1.00 0.00 H new ATOM 0 HA CYS A 48 -0.180 5.364 -10.482 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -0.648 2.760 -10.586 1.00 0.00 H new ATOM 0 HB3 CYS A 48 0.708 3.360 -9.653 1.00 0.00 H new ATOM 768 N PRO A 49 -2.189 4.728 -11.914 1.00 0.00 N ATOM 769 CA PRO A 49 -3.393 4.669 -12.758 1.00 0.00 C ATOM 770 C PRO A 49 -3.974 3.247 -12.725 1.00 0.00 C ATOM 771 O PRO A 49 -3.898 2.571 -11.717 1.00 0.00 O ATOM 772 CB PRO A 49 -2.873 5.068 -14.148 1.00 0.00 C ATOM 773 CG PRO A 49 -1.353 4.794 -14.146 1.00 0.00 C ATOM 774 CD PRO A 49 -0.917 4.759 -12.668 1.00 0.00 C ATOM 0 HA PRO A 49 -4.204 5.321 -12.435 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -3.370 4.491 -14.928 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -3.077 6.119 -14.351 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -1.129 3.848 -14.639 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -0.818 5.572 -14.690 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -0.306 3.882 -12.454 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -0.321 5.634 -12.408 1.00 0.00 H new ATOM 782 N TYR A 50 -4.562 2.782 -13.794 1.00 0.00 N ATOM 783 CA TYR A 50 -5.144 1.403 -13.770 1.00 0.00 C ATOM 784 C TYR A 50 -4.120 0.390 -14.289 1.00 0.00 C ATOM 785 O TYR A 50 -3.451 -0.275 -13.525 1.00 0.00 O ATOM 786 CB TYR A 50 -6.413 1.327 -14.642 1.00 0.00 C ATOM 787 CG TYR A 50 -6.675 2.649 -15.329 1.00 0.00 C ATOM 788 CD1 TYR A 50 -6.918 3.797 -14.567 1.00 0.00 C ATOM 789 CD2 TYR A 50 -6.672 2.725 -16.727 1.00 0.00 C ATOM 790 CE1 TYR A 50 -7.156 5.021 -15.201 1.00 0.00 C ATOM 791 CE2 TYR A 50 -6.912 3.949 -17.362 1.00 0.00 C ATOM 792 CZ TYR A 50 -7.155 5.097 -16.600 1.00 0.00 C ATOM 793 OH TYR A 50 -7.391 6.304 -17.226 1.00 0.00 O ATOM 0 H TYR A 50 -4.666 3.287 -14.674 1.00 0.00 H new ATOM 0 HA TYR A 50 -5.407 1.167 -12.739 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -6.300 0.541 -15.388 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -7.269 1.058 -14.023 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -6.922 3.738 -13.489 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.484 1.839 -17.315 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -7.341 5.907 -14.612 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.910 4.007 -18.440 1.00 0.00 H new ATOM 0 HH TYR A 50 -7.354 6.181 -18.198 1.00 0.00 H new ATOM 803 N ILE A 51 -4.007 0.260 -15.581 1.00 0.00 N ATOM 804 CA ILE A 51 -3.045 -0.722 -16.166 1.00 0.00 C ATOM 805 C ILE A 51 -1.735 -0.744 -15.367 1.00 0.00 C ATOM 806 O ILE A 51 -1.042 -1.740 -15.341 1.00 0.00 O ATOM 807 CB ILE A 51 -2.746 -0.329 -17.613 1.00 0.00 C ATOM 808 CG1 ILE A 51 -2.222 1.108 -17.651 1.00 0.00 C ATOM 809 CG2 ILE A 51 -4.026 -0.426 -18.445 1.00 0.00 C ATOM 810 CD1 ILE A 51 -1.505 1.357 -18.979 1.00 0.00 C ATOM 0 H ILE A 51 -4.543 0.795 -16.264 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.492 -1.715 -16.128 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.995 -1.003 -18.024 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.048 1.810 -17.534 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.538 1.279 -16.819 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.812 -0.146 -19.476 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -4.401 -1.449 -18.418 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -4.778 0.247 -18.035 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -1.132 2.381 -19.005 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.669 0.664 -19.077 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.202 1.204 -19.803 1.00 0.00 H new ATOM 822 N TRP A 52 -1.385 0.339 -14.730 1.00 0.00 N ATOM 823 CA TRP A 52 -0.111 0.369 -13.949 1.00 0.00 C ATOM 824 C TRP A 52 -0.057 -0.804 -12.965 1.00 0.00 C ATOM 825 O TRP A 52 -0.442 -0.667 -11.822 1.00 0.00 O ATOM 826 CB TRP A 52 -0.021 1.676 -13.167 1.00 0.00 C ATOM 827 CG TRP A 52 1.379 2.195 -13.231 1.00 0.00 C ATOM 828 CD1 TRP A 52 2.081 2.659 -12.174 1.00 0.00 C ATOM 829 CD2 TRP A 52 2.258 2.307 -14.388 1.00 0.00 C ATOM 830 NE1 TRP A 52 3.334 3.050 -12.606 1.00 0.00 N ATOM 831 CE2 TRP A 52 3.492 2.854 -13.964 1.00 0.00 C ATOM 832 CE3 TRP A 52 2.104 1.993 -15.750 1.00 0.00 C ATOM 833 CZ2 TRP A 52 4.539 3.079 -14.858 1.00 0.00 C ATOM 834 CZ3 TRP A 52 3.156 2.218 -16.653 1.00 0.00 C ATOM 835 CH2 TRP A 52 4.370 2.760 -16.209 1.00 0.00 C ATOM 0 H TRP A 52 -1.924 1.205 -14.715 1.00 0.00 H new ATOM 0 HA TRP A 52 0.724 0.291 -14.645 1.00 0.00 H new ATOM 0 HB2 TRP A 52 -0.712 2.410 -13.582 1.00 0.00 H new ATOM 0 HB3 TRP A 52 -0.314 1.513 -12.130 1.00 0.00 H new ATOM 0 HD1 TRP A 52 1.721 2.715 -11.157 1.00 0.00 H new ATOM 0 HE1 TRP A 52 4.055 3.436 -11.996 1.00 0.00 H new ATOM 0 HE3 TRP A 52 1.172 1.577 -16.103 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 5.472 3.496 -14.510 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 3.029 1.972 -17.697 1.00 0.00 H new ATOM 0 HH2 TRP A 52 5.174 2.931 -16.910 1.00 0.00 H new ATOM 846 N SER A 53 0.436 -1.938 -13.408 1.00 0.00 N ATOM 847 CA SER A 53 0.549 -3.144 -12.521 1.00 0.00 C ATOM 848 C SER A 53 -0.477 -3.087 -11.385 1.00 0.00 C ATOM 849 O SER A 53 -0.241 -2.481 -10.358 1.00 0.00 O ATOM 850 CB SER A 53 1.956 -3.202 -11.925 1.00 0.00 C ATOM 851 OG SER A 53 2.063 -2.240 -10.882 1.00 0.00 O ATOM 0 H SER A 53 0.770 -2.082 -14.361 1.00 0.00 H new ATOM 0 HA SER A 53 0.355 -4.034 -13.120 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.159 -4.200 -11.537 1.00 0.00 H new ATOM 0 HB3 SER A 53 2.699 -3.003 -12.697 1.00 0.00 H new ATOM 0 HG SER A 53 1.458 -2.482 -10.150 1.00 0.00 H new ATOM 857 N LEU A 54 -1.609 -3.707 -11.557 1.00 0.00 N ATOM 858 CA LEU A 54 -2.638 -3.677 -10.480 1.00 0.00 C ATOM 859 C LEU A 54 -2.586 -4.980 -9.683 1.00 0.00 C ATOM 860 O LEU A 54 -2.603 -6.062 -10.238 1.00 0.00 O ATOM 861 CB LEU A 54 -4.023 -3.509 -11.102 1.00 0.00 C ATOM 862 CG LEU A 54 -4.157 -2.089 -11.651 1.00 0.00 C ATOM 863 CD1 LEU A 54 -5.268 -2.043 -12.701 1.00 0.00 C ATOM 864 CD2 LEU A 54 -4.498 -1.133 -10.507 1.00 0.00 C ATOM 0 H LEU A 54 -1.867 -4.232 -12.393 1.00 0.00 H new ATOM 0 HA LEU A 54 -2.438 -2.839 -9.812 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.167 -4.236 -11.901 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.795 -3.698 -10.356 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.215 -1.790 -12.111 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.360 -1.029 -13.089 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.026 -2.724 -13.517 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.212 -2.344 -12.246 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.594 -0.119 -10.896 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -5.439 -1.436 -10.048 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.704 -1.161 -9.760 1.00 0.00 H new ATOM 876 N ASP A 55 -2.520 -4.886 -8.383 1.00 0.00 N ATOM 877 CA ASP A 55 -2.464 -6.122 -7.549 1.00 0.00 C ATOM 878 C ASP A 55 -3.878 -6.503 -7.107 1.00 0.00 C ATOM 879 O ASP A 55 -4.353 -7.588 -7.381 1.00 0.00 O ATOM 880 CB ASP A 55 -1.595 -5.866 -6.315 1.00 0.00 C ATOM 881 CG ASP A 55 -1.698 -7.057 -5.363 1.00 0.00 C ATOM 882 OD1 ASP A 55 -1.697 -8.178 -5.845 1.00 0.00 O ATOM 883 OD2 ASP A 55 -1.775 -6.830 -4.166 1.00 0.00 O ATOM 0 H ASP A 55 -2.502 -4.009 -7.862 1.00 0.00 H new ATOM 0 HA ASP A 55 -2.034 -6.936 -8.133 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -0.558 -5.714 -6.613 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -1.919 -4.955 -5.811 1.00 0.00 H new ATOM 888 N THR A 56 -4.553 -5.622 -6.422 1.00 0.00 N ATOM 889 CA THR A 56 -5.934 -5.937 -5.963 1.00 0.00 C ATOM 890 C THR A 56 -6.945 -5.390 -6.973 1.00 0.00 C ATOM 891 O THR A 56 -6.648 -4.497 -7.741 1.00 0.00 O ATOM 892 CB THR A 56 -6.177 -5.286 -4.598 1.00 0.00 C ATOM 893 OG1 THR A 56 -6.473 -3.908 -4.779 1.00 0.00 O ATOM 894 CG2 THR A 56 -4.925 -5.432 -3.732 1.00 0.00 C ATOM 0 H THR A 56 -4.208 -4.698 -6.161 1.00 0.00 H new ATOM 0 HA THR A 56 -6.052 -7.017 -5.879 1.00 0.00 H new ATOM 0 HB THR A 56 -7.016 -5.776 -4.104 1.00 0.00 H new ATOM 0 HG1 THR A 56 -5.751 -3.482 -5.286 1.00 0.00 H new ATOM 0 HG21 THR A 56 -5.098 -4.969 -2.761 1.00 0.00 H new ATOM 0 HG22 THR A 56 -4.699 -6.489 -3.594 1.00 0.00 H new ATOM 0 HG23 THR A 56 -4.084 -4.942 -4.223 1.00 0.00 H new ATOM 902 N GLN A 57 -8.138 -5.919 -6.978 1.00 0.00 N ATOM 903 CA GLN A 57 -9.166 -5.427 -7.938 1.00 0.00 C ATOM 904 C GLN A 57 -9.532 -3.984 -7.591 1.00 0.00 C ATOM 905 O GLN A 57 -9.786 -3.172 -8.457 1.00 0.00 O ATOM 906 CB GLN A 57 -10.414 -6.306 -7.843 1.00 0.00 C ATOM 907 CG GLN A 57 -10.240 -7.538 -8.734 1.00 0.00 C ATOM 908 CD GLN A 57 -9.363 -8.566 -8.017 1.00 0.00 C ATOM 909 OE1 GLN A 57 -9.865 -9.503 -7.427 1.00 0.00 O ATOM 910 NE2 GLN A 57 -8.065 -8.431 -8.042 1.00 0.00 N ATOM 0 H GLN A 57 -8.445 -6.670 -6.359 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.769 -5.469 -8.952 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -10.579 -6.612 -6.810 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -11.294 -5.742 -8.152 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -11.212 -7.972 -8.966 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -9.784 -7.253 -9.682 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -7.643 -7.645 -8.537 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -7.472 -9.112 -7.567 1.00 0.00 H new ATOM 919 N TYR A 58 -9.558 -3.658 -6.327 1.00 0.00 N ATOM 920 CA TYR A 58 -9.904 -2.265 -5.926 1.00 0.00 C ATOM 921 C TYR A 58 -8.801 -1.315 -6.408 1.00 0.00 C ATOM 922 O TYR A 58 -8.941 -0.109 -6.351 1.00 0.00 O ATOM 923 CB TYR A 58 -10.038 -2.197 -4.394 1.00 0.00 C ATOM 924 CG TYR A 58 -9.783 -0.787 -3.914 1.00 0.00 C ATOM 925 CD1 TYR A 58 -10.730 0.215 -4.149 1.00 0.00 C ATOM 926 CD2 TYR A 58 -8.593 -0.483 -3.243 1.00 0.00 C ATOM 927 CE1 TYR A 58 -10.487 1.521 -3.713 1.00 0.00 C ATOM 928 CE2 TYR A 58 -8.349 0.825 -2.810 1.00 0.00 C ATOM 929 CZ TYR A 58 -9.296 1.826 -3.046 1.00 0.00 C ATOM 930 OH TYR A 58 -9.058 3.115 -2.624 1.00 0.00 O ATOM 0 H TYR A 58 -9.355 -4.295 -5.556 1.00 0.00 H new ATOM 0 HA TYR A 58 -10.851 -1.968 -6.377 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -11.036 -2.517 -4.094 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -9.330 -2.882 -3.928 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -11.648 -0.020 -4.667 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -7.863 -1.258 -3.059 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -11.219 2.295 -3.891 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -7.430 1.061 -2.294 1.00 0.00 H new ATOM 0 HH TYR A 58 -8.133 3.190 -2.308 1.00 0.00 H new ATOM 940 N SER A 59 -7.705 -1.847 -6.877 1.00 0.00 N ATOM 941 CA SER A 59 -6.598 -0.972 -7.355 1.00 0.00 C ATOM 942 C SER A 59 -6.941 -0.413 -8.739 1.00 0.00 C ATOM 943 O SER A 59 -6.388 0.577 -9.173 1.00 0.00 O ATOM 944 CB SER A 59 -5.306 -1.786 -7.438 1.00 0.00 C ATOM 945 OG SER A 59 -4.816 -2.025 -6.126 1.00 0.00 O ATOM 0 H SER A 59 -7.529 -2.849 -6.950 1.00 0.00 H new ATOM 0 HA SER A 59 -6.464 -0.145 -6.657 1.00 0.00 H new ATOM 0 HB2 SER A 59 -5.491 -2.732 -7.947 1.00 0.00 H new ATOM 0 HB3 SER A 59 -4.561 -1.248 -8.024 1.00 0.00 H new ATOM 0 HG SER A 59 -3.926 -1.626 -6.032 1.00 0.00 H new ATOM 951 N LYS A 60 -7.849 -1.040 -9.436 1.00 0.00 N ATOM 952 CA LYS A 60 -8.223 -0.544 -10.791 1.00 0.00 C ATOM 953 C LYS A 60 -9.485 0.318 -10.691 1.00 0.00 C ATOM 954 O LYS A 60 -9.680 1.242 -11.455 1.00 0.00 O ATOM 955 CB LYS A 60 -8.490 -1.734 -11.715 1.00 0.00 C ATOM 956 CG LYS A 60 -9.446 -2.711 -11.029 1.00 0.00 C ATOM 957 CD LYS A 60 -10.361 -3.352 -12.076 1.00 0.00 C ATOM 958 CE LYS A 60 -11.375 -4.264 -11.380 1.00 0.00 C ATOM 959 NZ LYS A 60 -12.004 -5.163 -12.388 1.00 0.00 N ATOM 0 H LYS A 60 -8.348 -1.874 -9.126 1.00 0.00 H new ATOM 0 HA LYS A 60 -7.407 0.054 -11.196 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -8.920 -1.388 -12.655 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -7.554 -2.236 -11.958 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -8.881 -3.481 -10.504 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -10.042 -2.188 -10.281 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -10.880 -2.579 -12.642 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -9.769 -3.926 -12.789 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -10.881 -4.854 -10.608 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -12.139 -3.665 -10.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -12.693 -5.784 -11.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -12.489 -4.591 -13.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -11.270 -5.743 -12.842 1.00 0.00 H new ATOM 973 N VAL A 61 -10.342 0.025 -9.752 1.00 0.00 N ATOM 974 CA VAL A 61 -11.586 0.825 -9.598 1.00 0.00 C ATOM 975 C VAL A 61 -11.229 2.209 -9.047 1.00 0.00 C ATOM 976 O VAL A 61 -11.712 3.220 -9.517 1.00 0.00 O ATOM 977 CB VAL A 61 -12.528 0.097 -8.630 1.00 0.00 C ATOM 978 CG1 VAL A 61 -13.563 1.071 -8.060 1.00 0.00 C ATOM 979 CG2 VAL A 61 -13.250 -1.025 -9.379 1.00 0.00 C ATOM 0 H VAL A 61 -10.232 -0.737 -9.083 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.081 0.943 -10.562 1.00 0.00 H new ATOM 0 HB VAL A 61 -11.942 -0.317 -7.809 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -14.224 0.540 -7.375 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.053 1.872 -7.524 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -14.150 1.496 -8.874 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -13.921 -1.546 -8.696 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -13.827 -0.601 -10.201 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.517 -1.729 -9.775 1.00 0.00 H new ATOM 989 N LEU A 62 -10.388 2.257 -8.054 1.00 0.00 N ATOM 990 CA LEU A 62 -9.998 3.568 -7.467 1.00 0.00 C ATOM 991 C LEU A 62 -9.007 4.270 -8.401 1.00 0.00 C ATOM 992 O LEU A 62 -9.030 5.476 -8.542 1.00 0.00 O ATOM 993 CB LEU A 62 -9.366 3.319 -6.094 1.00 0.00 C ATOM 994 CG LEU A 62 -8.644 4.568 -5.583 1.00 0.00 C ATOM 995 CD1 LEU A 62 -9.612 5.438 -4.774 1.00 0.00 C ATOM 996 CD2 LEU A 62 -7.493 4.126 -4.680 1.00 0.00 C ATOM 0 H LEU A 62 -9.952 1.442 -7.622 1.00 0.00 H new ATOM 0 HA LEU A 62 -10.872 4.209 -7.349 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -10.138 3.026 -5.383 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -8.662 2.490 -6.160 1.00 0.00 H new ATOM 0 HG LEU A 62 -8.267 5.146 -6.427 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.090 6.325 -4.414 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -10.446 5.740 -5.407 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -9.989 4.869 -3.924 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.966 5.004 -4.306 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.888 3.555 -3.840 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.802 3.504 -5.249 1.00 0.00 H new ATOM 1008 N ALA A 63 -8.148 3.532 -9.053 1.00 0.00 N ATOM 1009 CA ALA A 63 -7.181 4.183 -9.984 1.00 0.00 C ATOM 1010 C ALA A 63 -7.961 5.121 -10.907 1.00 0.00 C ATOM 1011 O ALA A 63 -7.529 6.216 -11.208 1.00 0.00 O ATOM 1012 CB ALA A 63 -6.452 3.118 -10.810 1.00 0.00 C ATOM 0 H ALA A 63 -8.074 2.517 -8.983 1.00 0.00 H new ATOM 0 HA ALA A 63 -6.438 4.747 -9.420 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -5.748 3.602 -11.487 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -5.911 2.447 -10.143 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.178 2.547 -11.389 1.00 0.00 H new ATOM 1018 N LEU A 64 -9.120 4.703 -11.338 1.00 0.00 N ATOM 1019 CA LEU A 64 -9.952 5.571 -12.217 1.00 0.00 C ATOM 1020 C LEU A 64 -10.684 6.576 -11.336 1.00 0.00 C ATOM 1021 O LEU A 64 -10.842 7.726 -11.681 1.00 0.00 O ATOM 1022 CB LEU A 64 -10.978 4.714 -12.957 1.00 0.00 C ATOM 1023 CG LEU A 64 -10.272 3.891 -14.028 1.00 0.00 C ATOM 1024 CD1 LEU A 64 -11.186 2.754 -14.478 1.00 0.00 C ATOM 1025 CD2 LEU A 64 -9.945 4.785 -15.225 1.00 0.00 C ATOM 0 H LEU A 64 -9.527 3.794 -11.118 1.00 0.00 H new ATOM 0 HA LEU A 64 -9.322 6.085 -12.943 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.491 4.056 -12.256 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.738 5.349 -13.413 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.349 3.478 -13.620 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.683 2.164 -15.244 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.421 2.117 -13.625 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -12.108 3.168 -14.886 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -9.440 4.197 -15.991 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -10.867 5.198 -15.634 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.294 5.599 -14.904 1.00 0.00 H new ATOM 1037 N TYR A 65 -11.122 6.140 -10.191 1.00 0.00 N ATOM 1038 CA TYR A 65 -11.837 7.057 -9.262 1.00 0.00 C ATOM 1039 C TYR A 65 -11.065 8.376 -9.173 1.00 0.00 C ATOM 1040 O TYR A 65 -11.629 9.429 -8.950 1.00 0.00 O ATOM 1041 CB TYR A 65 -11.904 6.402 -7.882 1.00 0.00 C ATOM 1042 CG TYR A 65 -12.704 7.265 -6.939 1.00 0.00 C ATOM 1043 CD1 TYR A 65 -14.103 7.181 -6.928 1.00 0.00 C ATOM 1044 CD2 TYR A 65 -12.046 8.142 -6.069 1.00 0.00 C ATOM 1045 CE1 TYR A 65 -14.841 7.977 -6.044 1.00 0.00 C ATOM 1046 CE2 TYR A 65 -12.786 8.937 -5.186 1.00 0.00 C ATOM 1047 CZ TYR A 65 -14.184 8.854 -5.173 1.00 0.00 C ATOM 1048 OH TYR A 65 -14.913 9.637 -4.301 1.00 0.00 O ATOM 0 H TYR A 65 -11.015 5.183 -9.856 1.00 0.00 H new ATOM 0 HA TYR A 65 -12.847 7.253 -9.623 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -12.360 5.415 -7.961 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.897 6.257 -7.490 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -14.610 6.504 -7.600 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -10.968 8.205 -6.079 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -15.919 7.914 -6.034 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -12.279 9.614 -4.515 1.00 0.00 H new ATOM 0 HH TYR A 65 -14.303 10.187 -3.767 1.00 0.00 H new ATOM 1058 N ASN A 66 -9.773 8.318 -9.351 1.00 0.00 N ATOM 1059 CA ASN A 66 -8.939 9.553 -9.286 1.00 0.00 C ATOM 1060 C ASN A 66 -8.699 10.072 -10.700 1.00 0.00 C ATOM 1061 O ASN A 66 -8.903 11.231 -10.999 1.00 0.00 O ATOM 1062 CB ASN A 66 -7.593 9.205 -8.672 1.00 0.00 C ATOM 1063 CG ASN A 66 -7.007 10.433 -7.972 1.00 0.00 C ATOM 1064 OD1 ASN A 66 -6.896 11.489 -8.562 1.00 0.00 O ATOM 1065 ND2 ASN A 66 -6.624 10.336 -6.729 1.00 0.00 N ATOM 0 H ASN A 66 -9.255 7.460 -9.540 1.00 0.00 H new ATOM 0 HA ASN A 66 -9.449 10.309 -8.689 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -7.709 8.389 -7.958 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -6.910 8.856 -9.446 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -6.231 11.147 -6.252 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -6.718 9.449 -6.234 1.00 0.00 H new ATOM 1072 N GLN A 67 -8.260 9.207 -11.572 1.00 0.00 N ATOM 1073 CA GLN A 67 -7.990 9.614 -12.982 1.00 0.00 C ATOM 1074 C GLN A 67 -9.210 10.324 -13.571 1.00 0.00 C ATOM 1075 O GLN A 67 -9.127 10.981 -14.590 1.00 0.00 O ATOM 1076 CB GLN A 67 -7.677 8.366 -13.810 1.00 0.00 C ATOM 1077 CG GLN A 67 -6.170 8.104 -13.790 1.00 0.00 C ATOM 1078 CD GLN A 67 -5.446 9.232 -14.526 1.00 0.00 C ATOM 1079 OE1 GLN A 67 -5.532 9.340 -15.733 1.00 0.00 O ATOM 1080 NE2 GLN A 67 -4.730 10.086 -13.845 1.00 0.00 N ATOM 0 H GLN A 67 -8.075 8.225 -11.367 1.00 0.00 H new ATOM 0 HA GLN A 67 -7.142 10.298 -13.002 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -8.212 7.506 -13.407 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -8.019 8.502 -14.836 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -5.815 8.040 -12.761 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -5.950 7.147 -14.263 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -4.657 9.997 -12.832 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -4.244 10.842 -14.327 1.00 0.00 H new ATOM 1089 N HIS A 68 -10.338 10.197 -12.939 1.00 0.00 N ATOM 1090 CA HIS A 68 -11.566 10.863 -13.460 1.00 0.00 C ATOM 1091 C HIS A 68 -11.751 12.213 -12.763 1.00 0.00 C ATOM 1092 O HIS A 68 -11.938 13.230 -13.399 1.00 0.00 O ATOM 1093 CB HIS A 68 -12.785 9.979 -13.183 1.00 0.00 C ATOM 1094 CG HIS A 68 -12.944 8.975 -14.289 1.00 0.00 C ATOM 1095 ND1 HIS A 68 -12.366 7.716 -14.239 1.00 0.00 N ATOM 1096 CD2 HIS A 68 -13.621 9.030 -15.480 1.00 0.00 C ATOM 1097 CE1 HIS A 68 -12.706 7.069 -15.368 1.00 0.00 C ATOM 1098 NE2 HIS A 68 -13.470 7.825 -16.162 1.00 0.00 N ATOM 0 H HIS A 68 -10.467 9.660 -12.081 1.00 0.00 H new ATOM 0 HA HIS A 68 -11.464 11.018 -14.534 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -12.665 9.467 -12.228 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -13.682 10.594 -13.105 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -14.186 9.879 -15.835 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -12.399 6.061 -15.604 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -13.859 7.574 -17.071 1.00 0.00 H new ATOM 1106 N ASN A 69 -11.704 12.227 -11.459 1.00 0.00 N ATOM 1107 CA ASN A 69 -11.881 13.509 -10.720 1.00 0.00 C ATOM 1108 C ASN A 69 -10.510 14.083 -10.347 1.00 0.00 C ATOM 1109 O ASN A 69 -9.836 13.551 -9.486 1.00 0.00 O ATOM 1110 CB ASN A 69 -12.679 13.250 -9.441 1.00 0.00 C ATOM 1111 CG ASN A 69 -14.098 12.809 -9.805 1.00 0.00 C ATOM 1112 OD1 ASN A 69 -14.645 13.244 -10.798 1.00 0.00 O ATOM 1113 ND2 ASN A 69 -14.720 11.956 -9.037 1.00 0.00 N ATOM 0 H ASN A 69 -11.551 11.406 -10.873 1.00 0.00 H new ATOM 0 HA ASN A 69 -12.414 14.219 -11.353 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -12.190 12.481 -8.844 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -12.713 14.153 -8.832 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -15.666 11.655 -9.271 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -14.260 11.591 -8.203 1.00 0.00 H new ATOM 1120 N PRO A 70 -10.136 15.157 -10.997 1.00 0.00 N ATOM 1121 CA PRO A 70 -8.849 15.823 -10.741 1.00 0.00 C ATOM 1122 C PRO A 70 -8.930 16.649 -9.455 1.00 0.00 C ATOM 1123 O PRO A 70 -9.659 17.618 -9.373 1.00 0.00 O ATOM 1124 CB PRO A 70 -8.659 16.725 -11.962 1.00 0.00 C ATOM 1125 CG PRO A 70 -10.069 16.956 -12.557 1.00 0.00 C ATOM 1126 CD PRO A 70 -10.954 15.805 -12.043 1.00 0.00 C ATOM 0 HA PRO A 70 -8.022 15.126 -10.605 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -8.197 17.671 -11.678 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -8.001 16.256 -12.693 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -10.468 17.921 -12.246 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -10.034 16.962 -13.646 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -11.896 16.177 -11.639 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -11.204 15.107 -12.842 1.00 0.00 H new ATOM 1134 N GLY A 71 -8.190 16.271 -8.450 1.00 0.00 N ATOM 1135 CA GLY A 71 -8.228 17.032 -7.170 1.00 0.00 C ATOM 1136 C GLY A 71 -8.674 16.106 -6.037 1.00 0.00 C ATOM 1137 O GLY A 71 -8.822 16.521 -4.905 1.00 0.00 O ATOM 0 H GLY A 71 -7.561 15.468 -8.460 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -7.243 17.444 -6.950 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -8.914 17.875 -7.256 1.00 0.00 H new ATOM 1141 N ALA A 72 -8.882 14.849 -6.329 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.308 13.902 -5.269 1.00 0.00 C ATOM 1143 C ALA A 72 -8.070 13.268 -4.645 1.00 0.00 C ATOM 1144 O ALA A 72 -7.250 12.678 -5.317 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.188 12.810 -5.876 1.00 0.00 C ATOM 0 H ALA A 72 -8.774 14.441 -7.258 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.876 14.436 -4.507 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -10.499 12.117 -5.094 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -11.069 13.263 -6.330 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -9.625 12.270 -6.637 1.00 0.00 H new ATOM 1151 N SER A 73 -7.933 13.394 -3.363 1.00 0.00 N ATOM 1152 CA SER A 73 -6.747 12.810 -2.674 1.00 0.00 C ATOM 1153 C SER A 73 -7.102 11.430 -2.114 1.00 0.00 C ATOM 1154 O SER A 73 -6.806 11.118 -0.979 1.00 0.00 O ATOM 1155 CB SER A 73 -6.320 13.730 -1.530 1.00 0.00 C ATOM 1156 OG SER A 73 -7.471 14.349 -0.971 1.00 0.00 O ATOM 0 H SER A 73 -8.592 13.878 -2.754 1.00 0.00 H new ATOM 0 HA SER A 73 -5.929 12.709 -3.387 1.00 0.00 H new ATOM 0 HB2 SER A 73 -5.793 13.159 -0.766 1.00 0.00 H new ATOM 0 HB3 SER A 73 -5.627 14.488 -1.896 1.00 0.00 H new ATOM 0 HG SER A 73 -7.201 14.938 -0.236 1.00 0.00 H new ATOM 1162 N ALA A 74 -7.730 10.599 -2.902 1.00 0.00 N ATOM 1163 CA ALA A 74 -8.093 9.242 -2.407 1.00 0.00 C ATOM 1164 C ALA A 74 -7.545 8.182 -3.366 1.00 0.00 C ATOM 1165 O ALA A 74 -7.976 7.046 -3.364 1.00 0.00 O ATOM 1166 CB ALA A 74 -9.616 9.115 -2.311 1.00 0.00 C ATOM 0 H ALA A 74 -8.006 10.801 -3.863 1.00 0.00 H new ATOM 0 HA ALA A 74 -7.659 9.092 -1.418 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.876 8.120 -1.948 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.001 9.865 -1.620 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.057 9.269 -3.296 1.00 0.00 H new ATOM 1172 N ALA A 75 -6.591 8.544 -4.180 1.00 0.00 N ATOM 1173 CA ALA A 75 -6.005 7.558 -5.132 1.00 0.00 C ATOM 1174 C ALA A 75 -5.556 6.320 -4.344 1.00 0.00 C ATOM 1175 O ALA A 75 -5.797 6.235 -3.157 1.00 0.00 O ATOM 1176 CB ALA A 75 -4.804 8.200 -5.831 1.00 0.00 C ATOM 0 H ALA A 75 -6.192 9.481 -4.227 1.00 0.00 H new ATOM 0 HA ALA A 75 -6.741 7.263 -5.880 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.367 7.488 -6.530 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -5.130 9.087 -6.373 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -4.059 8.483 -5.088 1.00 0.00 H new ATOM 1182 N PRO A 76 -4.919 5.391 -5.018 1.00 0.00 N ATOM 1183 CA PRO A 76 -4.439 4.155 -4.377 1.00 0.00 C ATOM 1184 C PRO A 76 -3.161 4.439 -3.594 1.00 0.00 C ATOM 1185 O PRO A 76 -2.873 5.570 -3.251 1.00 0.00 O ATOM 1186 CB PRO A 76 -4.164 3.216 -5.551 1.00 0.00 C ATOM 1187 CG PRO A 76 -3.949 4.120 -6.784 1.00 0.00 C ATOM 1188 CD PRO A 76 -4.611 5.474 -6.462 1.00 0.00 C ATOM 0 HA PRO A 76 -5.150 3.732 -3.667 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -3.284 2.602 -5.360 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -5.000 2.535 -5.709 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -2.886 4.248 -6.989 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -4.394 3.674 -7.673 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -3.942 6.307 -6.680 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -5.513 5.627 -7.054 1.00 0.00 H new ATOM 1196 N CYS A 77 -2.393 3.432 -3.302 1.00 0.00 N ATOM 1197 CA CYS A 77 -1.142 3.670 -2.536 1.00 0.00 C ATOM 1198 C CYS A 77 -0.044 2.707 -2.994 1.00 0.00 C ATOM 1199 O CYS A 77 0.033 1.582 -2.544 1.00 0.00 O ATOM 1200 CB CYS A 77 -1.415 3.462 -1.047 1.00 0.00 C ATOM 1201 SG CYS A 77 -0.980 4.969 -0.144 1.00 0.00 S ATOM 0 H CYS A 77 -2.574 2.461 -3.558 1.00 0.00 H new ATOM 0 HA CYS A 77 -0.807 4.692 -2.712 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -2.466 3.220 -0.888 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -0.834 2.619 -0.673 1.00 0.00 H new ATOM 1206 N CYS A 78 0.816 3.146 -3.873 1.00 0.00 N ATOM 1207 CA CYS A 78 1.925 2.261 -4.335 1.00 0.00 C ATOM 1208 C CYS A 78 2.716 1.802 -3.100 1.00 0.00 C ATOM 1209 O CYS A 78 2.950 2.573 -2.191 1.00 0.00 O ATOM 1210 CB CYS A 78 2.830 3.054 -5.287 1.00 0.00 C ATOM 1211 SG CYS A 78 4.201 2.015 -5.854 1.00 0.00 S ATOM 0 H CYS A 78 0.799 4.077 -4.290 1.00 0.00 H new ATOM 0 HA CYS A 78 1.537 1.390 -4.864 1.00 0.00 H new ATOM 0 HB2 CYS A 78 2.252 3.405 -6.142 1.00 0.00 H new ATOM 0 HB3 CYS A 78 3.219 3.937 -4.780 1.00 0.00 H new ATOM 1216 N VAL A 79 3.106 0.552 -3.034 1.00 0.00 N ATOM 1217 CA VAL A 79 3.844 0.072 -1.827 1.00 0.00 C ATOM 1218 C VAL A 79 4.898 -0.978 -2.220 1.00 0.00 C ATOM 1219 O VAL A 79 4.930 -1.426 -3.345 1.00 0.00 O ATOM 1220 CB VAL A 79 2.829 -0.528 -0.838 1.00 0.00 C ATOM 1221 CG1 VAL A 79 1.502 0.214 -0.966 1.00 0.00 C ATOM 1222 CG2 VAL A 79 2.591 -2.010 -1.148 1.00 0.00 C ATOM 0 H VAL A 79 2.947 -0.150 -3.757 1.00 0.00 H new ATOM 0 HA VAL A 79 4.365 0.907 -1.359 1.00 0.00 H new ATOM 0 HB VAL A 79 3.226 -0.429 0.172 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.780 -0.208 -0.267 1.00 0.00 H new ATOM 0 HG12 VAL A 79 1.652 1.270 -0.739 1.00 0.00 H new ATOM 0 HG13 VAL A 79 1.124 0.111 -1.983 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.871 -2.419 -0.439 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.201 -2.112 -2.161 1.00 0.00 H new ATOM 0 HG23 VAL A 79 3.531 -2.555 -1.065 1.00 0.00 H new ATOM 1232 N PRO A 80 5.729 -1.342 -1.270 1.00 0.00 N ATOM 1233 CA PRO A 80 6.793 -2.341 -1.484 1.00 0.00 C ATOM 1234 C PRO A 80 6.208 -3.755 -1.470 1.00 0.00 C ATOM 1235 O PRO A 80 5.952 -4.322 -0.424 1.00 0.00 O ATOM 1236 CB PRO A 80 7.736 -2.125 -0.297 1.00 0.00 C ATOM 1237 CG PRO A 80 6.902 -1.430 0.803 1.00 0.00 C ATOM 1238 CD PRO A 80 5.683 -0.799 0.104 1.00 0.00 C ATOM 0 HA PRO A 80 7.297 -2.232 -2.444 1.00 0.00 H new ATOM 0 HB2 PRO A 80 8.135 -3.075 0.060 1.00 0.00 H new ATOM 0 HB3 PRO A 80 8.588 -1.510 -0.585 1.00 0.00 H new ATOM 0 HG2 PRO A 80 6.585 -2.148 1.560 1.00 0.00 H new ATOM 0 HG3 PRO A 80 7.492 -0.669 1.313 1.00 0.00 H new ATOM 0 HD2 PRO A 80 4.754 -1.067 0.607 1.00 0.00 H new ATOM 0 HD3 PRO A 80 5.744 0.289 0.104 1.00 0.00 H new ATOM 1246 N GLN A 81 5.995 -4.330 -2.621 1.00 0.00 N ATOM 1247 CA GLN A 81 5.428 -5.705 -2.677 1.00 0.00 C ATOM 1248 C GLN A 81 6.496 -6.708 -2.232 1.00 0.00 C ATOM 1249 O GLN A 81 6.378 -7.338 -1.200 1.00 0.00 O ATOM 1250 CB GLN A 81 4.989 -6.011 -4.112 1.00 0.00 C ATOM 1251 CG GLN A 81 4.777 -7.515 -4.278 1.00 0.00 C ATOM 1252 CD GLN A 81 3.687 -7.988 -3.313 1.00 0.00 C ATOM 1253 OE1 GLN A 81 3.978 -8.444 -2.226 1.00 0.00 O ATOM 1254 NE2 GLN A 81 2.434 -7.897 -3.668 1.00 0.00 N ATOM 0 H GLN A 81 6.190 -3.905 -3.527 1.00 0.00 H new ATOM 0 HA GLN A 81 4.566 -5.780 -2.014 1.00 0.00 H new ATOM 0 HB2 GLN A 81 4.067 -5.477 -4.342 1.00 0.00 H new ATOM 0 HB3 GLN A 81 5.744 -5.661 -4.816 1.00 0.00 H new ATOM 0 HG2 GLN A 81 4.491 -7.741 -5.305 1.00 0.00 H new ATOM 0 HG3 GLN A 81 5.707 -8.048 -4.081 1.00 0.00 H new ATOM 0 HE21 GLN A 81 2.189 -7.514 -4.581 1.00 0.00 H new ATOM 0 HE22 GLN A 81 1.700 -8.209 -3.032 1.00 0.00 H new ATOM 1263 N ALA A 82 7.540 -6.856 -3.001 1.00 0.00 N ATOM 1264 CA ALA A 82 8.615 -7.812 -2.619 1.00 0.00 C ATOM 1265 C ALA A 82 9.631 -7.088 -1.735 1.00 0.00 C ATOM 1266 O ALA A 82 10.009 -5.965 -2.004 1.00 0.00 O ATOM 1267 CB ALA A 82 9.311 -8.330 -3.878 1.00 0.00 C ATOM 0 H ALA A 82 7.694 -6.356 -3.877 1.00 0.00 H new ATOM 0 HA ALA A 82 8.185 -8.653 -2.076 1.00 0.00 H new ATOM 0 HB1 ALA A 82 10.098 -9.030 -3.597 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.584 -8.837 -4.513 1.00 0.00 H new ATOM 0 HB3 ALA A 82 9.748 -7.493 -4.423 1.00 0.00 H new ATOM 1273 N LEU A 83 10.071 -7.713 -0.679 1.00 0.00 N ATOM 1274 CA LEU A 83 11.056 -7.047 0.214 1.00 0.00 C ATOM 1275 C LEU A 83 12.315 -7.898 0.324 1.00 0.00 C ATOM 1276 O LEU A 83 12.515 -8.843 -0.413 1.00 0.00 O ATOM 1277 CB LEU A 83 10.448 -6.873 1.608 1.00 0.00 C ATOM 1278 CG LEU A 83 9.272 -5.907 1.528 1.00 0.00 C ATOM 1279 CD1 LEU A 83 8.236 -6.267 2.594 1.00 0.00 C ATOM 1280 CD2 LEU A 83 9.772 -4.481 1.764 1.00 0.00 C ATOM 0 H LEU A 83 9.792 -8.653 -0.397 1.00 0.00 H new ATOM 0 HA LEU A 83 11.311 -6.073 -0.203 1.00 0.00 H new ATOM 0 HB2 LEU A 83 10.116 -7.836 1.995 1.00 0.00 H new ATOM 0 HB3 LEU A 83 11.199 -6.493 2.300 1.00 0.00 H new ATOM 0 HG LEU A 83 8.812 -5.976 0.542 1.00 0.00 H new ATOM 0 HD11 LEU A 83 7.397 -5.574 2.534 1.00 0.00 H new ATOM 0 HD12 LEU A 83 7.880 -7.284 2.427 1.00 0.00 H new ATOM 0 HD13 LEU A 83 8.692 -6.200 3.582 1.00 0.00 H new ATOM 0 HD21 LEU A 83 8.933 -3.787 1.707 1.00 0.00 H new ATOM 0 HD22 LEU A 83 10.232 -4.415 2.750 1.00 0.00 H new ATOM 0 HD23 LEU A 83 10.508 -4.223 1.003 1.00 0.00 H new ATOM 1292 N GLU A 84 13.158 -7.563 1.251 1.00 0.00 N ATOM 1293 CA GLU A 84 14.414 -8.333 1.445 1.00 0.00 C ATOM 1294 C GLU A 84 14.808 -8.255 2.921 1.00 0.00 C ATOM 1295 O GLU A 84 14.419 -7.336 3.611 1.00 0.00 O ATOM 1296 CB GLU A 84 15.525 -7.731 0.581 1.00 0.00 C ATOM 1297 CG GLU A 84 15.686 -8.559 -0.696 1.00 0.00 C ATOM 1298 CD GLU A 84 17.107 -8.393 -1.237 1.00 0.00 C ATOM 1299 OE1 GLU A 84 17.878 -7.681 -0.614 1.00 0.00 O ATOM 1300 OE2 GLU A 84 17.401 -8.981 -2.265 1.00 0.00 O ATOM 0 H GLU A 84 13.031 -6.779 1.892 1.00 0.00 H new ATOM 0 HA GLU A 84 14.265 -9.373 1.153 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.285 -6.698 0.329 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.463 -7.714 1.136 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.485 -9.610 -0.488 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.961 -8.238 -1.444 1.00 0.00 H new ATOM 1307 N PRO A 85 15.566 -9.222 3.363 1.00 0.00 N ATOM 1308 CA PRO A 85 16.021 -9.291 4.761 1.00 0.00 C ATOM 1309 C PRO A 85 17.130 -8.267 5.023 1.00 0.00 C ATOM 1310 O PRO A 85 17.317 -7.337 4.264 1.00 0.00 O ATOM 1311 CB PRO A 85 16.525 -10.728 4.907 1.00 0.00 C ATOM 1312 CG PRO A 85 16.840 -11.226 3.479 1.00 0.00 C ATOM 1313 CD PRO A 85 16.044 -10.329 2.512 1.00 0.00 C ATOM 0 HA PRO A 85 15.237 -9.055 5.481 1.00 0.00 H new ATOM 0 HB2 PRO A 85 17.414 -10.766 5.537 1.00 0.00 H new ATOM 0 HB3 PRO A 85 15.772 -11.358 5.381 1.00 0.00 H new ATOM 0 HG2 PRO A 85 17.909 -11.163 3.274 1.00 0.00 H new ATOM 0 HG3 PRO A 85 16.554 -12.271 3.362 1.00 0.00 H new ATOM 0 HD2 PRO A 85 16.671 -9.965 1.698 1.00 0.00 H new ATOM 0 HD3 PRO A 85 15.214 -10.870 2.057 1.00 0.00 H new ATOM 1321 N LEU A 86 17.847 -8.411 6.105 1.00 0.00 N ATOM 1322 CA LEU A 86 18.914 -7.421 6.421 1.00 0.00 C ATOM 1323 C LEU A 86 19.834 -7.990 7.514 1.00 0.00 C ATOM 1324 O LEU A 86 19.428 -8.119 8.648 1.00 0.00 O ATOM 1325 CB LEU A 86 18.214 -6.122 6.884 1.00 0.00 C ATOM 1326 CG LEU A 86 19.038 -5.353 7.930 1.00 0.00 C ATOM 1327 CD1 LEU A 86 19.982 -4.370 7.246 1.00 0.00 C ATOM 1328 CD2 LEU A 86 18.085 -4.572 8.836 1.00 0.00 C ATOM 0 H LEU A 86 17.740 -9.168 6.780 1.00 0.00 H new ATOM 0 HA LEU A 86 19.536 -7.209 5.551 1.00 0.00 H new ATOM 0 HB2 LEU A 86 18.038 -5.480 6.021 1.00 0.00 H new ATOM 0 HB3 LEU A 86 17.238 -6.368 7.303 1.00 0.00 H new ATOM 0 HG LEU A 86 19.624 -6.064 8.512 1.00 0.00 H new ATOM 0 HD11 LEU A 86 20.558 -3.834 8.000 1.00 0.00 H new ATOM 0 HD12 LEU A 86 20.661 -4.914 6.590 1.00 0.00 H new ATOM 0 HD13 LEU A 86 19.403 -3.658 6.658 1.00 0.00 H new ATOM 0 HD21 LEU A 86 18.660 -4.023 9.582 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.505 -3.870 8.236 1.00 0.00 H new ATOM 0 HD23 LEU A 86 17.409 -5.265 9.337 1.00 0.00 H new ATOM 1340 N PRO A 87 21.057 -8.297 7.147 1.00 0.00 N ATOM 1341 CA PRO A 87 22.054 -8.835 8.092 1.00 0.00 C ATOM 1342 C PRO A 87 22.574 -7.705 8.980 1.00 0.00 C ATOM 1343 O PRO A 87 23.172 -6.759 8.509 1.00 0.00 O ATOM 1344 CB PRO A 87 23.157 -9.382 7.183 1.00 0.00 C ATOM 1345 CG PRO A 87 23.010 -8.647 5.830 1.00 0.00 C ATOM 1346 CD PRO A 87 21.559 -8.130 5.767 1.00 0.00 C ATOM 0 HA PRO A 87 21.660 -9.600 8.761 1.00 0.00 H new ATOM 0 HB2 PRO A 87 24.141 -9.205 7.617 1.00 0.00 H new ATOM 0 HB3 PRO A 87 23.055 -10.459 7.053 1.00 0.00 H new ATOM 0 HG2 PRO A 87 23.719 -7.822 5.758 1.00 0.00 H new ATOM 0 HG3 PRO A 87 23.218 -9.320 4.998 1.00 0.00 H new ATOM 0 HD2 PRO A 87 21.521 -7.087 5.452 1.00 0.00 H new ATOM 0 HD3 PRO A 87 20.963 -8.700 5.054 1.00 0.00 H new ATOM 1354 N ILE A 88 22.329 -7.782 10.258 1.00 0.00 N ATOM 1355 CA ILE A 88 22.789 -6.692 11.160 1.00 0.00 C ATOM 1356 C ILE A 88 23.571 -7.256 12.338 1.00 0.00 C ATOM 1357 O ILE A 88 24.048 -8.373 12.321 1.00 0.00 O ATOM 1358 CB ILE A 88 21.568 -5.941 11.698 1.00 0.00 C ATOM 1359 CG1 ILE A 88 20.903 -6.766 12.805 1.00 0.00 C ATOM 1360 CG2 ILE A 88 20.571 -5.730 10.568 1.00 0.00 C ATOM 1361 CD1 ILE A 88 19.565 -6.142 13.190 1.00 0.00 C ATOM 0 H ILE A 88 21.833 -8.548 10.714 1.00 0.00 H new ATOM 0 HA ILE A 88 23.437 -6.023 10.593 1.00 0.00 H new ATOM 0 HB ILE A 88 21.883 -4.978 12.100 1.00 0.00 H new ATOM 0 HG12 ILE A 88 20.751 -7.790 12.465 1.00 0.00 H new ATOM 0 HG13 ILE A 88 21.556 -6.813 13.677 1.00 0.00 H new ATOM 0 HG21 ILE A 88 19.700 -5.196 10.947 1.00 0.00 H new ATOM 0 HG22 ILE A 88 21.038 -5.146 9.775 1.00 0.00 H new ATOM 0 HG23 ILE A 88 20.260 -6.697 10.172 1.00 0.00 H new ATOM 0 HD11 ILE A 88 19.100 -6.735 13.977 1.00 0.00 H new ATOM 0 HD12 ILE A 88 19.727 -5.126 13.549 1.00 0.00 H new ATOM 0 HD13 ILE A 88 18.910 -6.118 12.319 1.00 0.00 H new ATOM 1373 N VAL A 89 23.664 -6.471 13.370 1.00 0.00 N ATOM 1374 CA VAL A 89 24.372 -6.887 14.606 1.00 0.00 C ATOM 1375 C VAL A 89 23.960 -5.932 15.720 1.00 0.00 C ATOM 1376 O VAL A 89 24.280 -4.763 15.687 1.00 0.00 O ATOM 1377 CB VAL A 89 25.889 -6.794 14.419 1.00 0.00 C ATOM 1378 CG1 VAL A 89 26.578 -7.505 15.583 1.00 0.00 C ATOM 1379 CG2 VAL A 89 26.306 -7.450 13.101 1.00 0.00 C ATOM 0 H VAL A 89 23.267 -5.532 13.408 1.00 0.00 H new ATOM 0 HA VAL A 89 24.113 -7.918 14.845 1.00 0.00 H new ATOM 0 HB VAL A 89 26.183 -5.745 14.394 1.00 0.00 H new ATOM 0 HG11 VAL A 89 27.659 -7.444 15.458 1.00 0.00 H new ATOM 0 HG12 VAL A 89 26.293 -7.028 16.521 1.00 0.00 H new ATOM 0 HG13 VAL A 89 26.274 -8.551 15.602 1.00 0.00 H new ATOM 0 HG21 VAL A 89 27.387 -7.375 12.983 1.00 0.00 H new ATOM 0 HG22 VAL A 89 26.014 -8.500 13.109 1.00 0.00 H new ATOM 0 HG23 VAL A 89 25.815 -6.943 12.271 1.00 0.00 H new ATOM 1389 N TYR A 90 23.245 -6.404 16.698 1.00 0.00 N ATOM 1390 CA TYR A 90 22.814 -5.492 17.789 1.00 0.00 C ATOM 1391 C TYR A 90 23.261 -6.043 19.139 1.00 0.00 C ATOM 1392 O TYR A 90 23.973 -7.021 19.218 1.00 0.00 O ATOM 1393 CB TYR A 90 21.294 -5.367 17.772 1.00 0.00 C ATOM 1394 CG TYR A 90 20.672 -6.707 17.461 1.00 0.00 C ATOM 1395 CD1 TYR A 90 20.526 -7.114 16.131 1.00 0.00 C ATOM 1396 CD2 TYR A 90 20.237 -7.540 18.498 1.00 0.00 C ATOM 1397 CE1 TYR A 90 19.946 -8.352 15.834 1.00 0.00 C ATOM 1398 CE2 TYR A 90 19.656 -8.780 18.202 1.00 0.00 C ATOM 1399 CZ TYR A 90 19.511 -9.186 16.870 1.00 0.00 C ATOM 1400 OH TYR A 90 18.938 -10.406 16.579 1.00 0.00 O ATOM 0 H TYR A 90 22.942 -7.374 16.790 1.00 0.00 H new ATOM 0 HA TYR A 90 23.267 -4.513 17.636 1.00 0.00 H new ATOM 0 HB2 TYR A 90 20.939 -5.007 18.738 1.00 0.00 H new ATOM 0 HB3 TYR A 90 20.989 -4.633 17.026 1.00 0.00 H new ATOM 0 HD1 TYR A 90 20.862 -6.471 15.331 1.00 0.00 H new ATOM 0 HD2 TYR A 90 20.349 -7.227 19.526 1.00 0.00 H new ATOM 0 HE1 TYR A 90 19.834 -8.664 14.806 1.00 0.00 H new ATOM 0 HE2 TYR A 90 19.320 -9.423 19.002 1.00 0.00 H new ATOM 0 HH TYR A 90 18.175 -10.274 15.978 1.00 0.00 H new ATOM 1410 N TYR A 91 22.853 -5.415 20.203 1.00 0.00 N ATOM 1411 CA TYR A 91 23.259 -5.895 21.551 1.00 0.00 C ATOM 1412 C TYR A 91 22.029 -6.121 22.429 1.00 0.00 C ATOM 1413 O TYR A 91 21.233 -5.229 22.642 1.00 0.00 O ATOM 1414 CB TYR A 91 24.138 -4.841 22.213 1.00 0.00 C ATOM 1415 CG TYR A 91 25.585 -5.145 21.938 1.00 0.00 C ATOM 1416 CD1 TYR A 91 26.202 -4.618 20.802 1.00 0.00 C ATOM 1417 CD2 TYR A 91 26.311 -5.941 22.828 1.00 0.00 C ATOM 1418 CE1 TYR A 91 27.553 -4.890 20.552 1.00 0.00 C ATOM 1419 CE2 TYR A 91 27.659 -6.212 22.585 1.00 0.00 C ATOM 1420 CZ TYR A 91 28.283 -5.687 21.446 1.00 0.00 C ATOM 1421 OH TYR A 91 29.615 -5.953 21.204 1.00 0.00 O ATOM 0 H TYR A 91 22.255 -4.589 20.198 1.00 0.00 H new ATOM 0 HA TYR A 91 23.802 -6.834 21.440 1.00 0.00 H new ATOM 0 HB2 TYR A 91 23.885 -3.851 21.833 1.00 0.00 H new ATOM 0 HB3 TYR A 91 23.957 -4.825 23.288 1.00 0.00 H new ATOM 0 HD1 TYR A 91 25.639 -4.002 20.117 1.00 0.00 H new ATOM 0 HD2 TYR A 91 25.829 -6.347 23.705 1.00 0.00 H new ATOM 0 HE1 TYR A 91 28.032 -4.487 19.672 1.00 0.00 H new ATOM 0 HE2 TYR A 91 28.220 -6.826 23.274 1.00 0.00 H new ATOM 0 HH TYR A 91 29.971 -6.518 21.921 1.00 0.00 H new ATOM 1431 N VAL A 92 21.889 -7.297 22.974 1.00 0.00 N ATOM 1432 CA VAL A 92 20.738 -7.564 23.873 1.00 0.00 C ATOM 1433 C VAL A 92 21.225 -7.400 25.304 1.00 0.00 C ATOM 1434 O VAL A 92 21.723 -8.324 25.912 1.00 0.00 O ATOM 1435 CB VAL A 92 20.223 -8.984 23.672 1.00 0.00 C ATOM 1436 CG1 VAL A 92 18.733 -9.016 24.003 1.00 0.00 C ATOM 1437 CG2 VAL A 92 20.438 -9.407 22.217 1.00 0.00 C ATOM 0 H VAL A 92 22.523 -8.083 22.834 1.00 0.00 H new ATOM 0 HA VAL A 92 19.925 -6.872 23.654 1.00 0.00 H new ATOM 0 HB VAL A 92 20.762 -9.671 24.324 1.00 0.00 H new ATOM 0 HG11 VAL A 92 18.351 -10.027 23.863 1.00 0.00 H new ATOM 0 HG12 VAL A 92 18.584 -8.712 25.039 1.00 0.00 H new ATOM 0 HG13 VAL A 92 18.199 -8.332 23.343 1.00 0.00 H new ATOM 0 HG21 VAL A 92 20.069 -10.423 22.075 1.00 0.00 H new ATOM 0 HG22 VAL A 92 19.897 -8.729 21.557 1.00 0.00 H new ATOM 0 HG23 VAL A 92 21.502 -9.371 21.981 1.00 0.00 H new ATOM 1447 N GLY A 93 21.111 -6.221 25.834 1.00 0.00 N ATOM 1448 CA GLY A 93 21.601 -5.981 27.217 1.00 0.00 C ATOM 1449 C GLY A 93 23.123 -5.821 27.171 1.00 0.00 C ATOM 1450 O GLY A 93 23.646 -4.726 27.233 1.00 0.00 O ATOM 0 H GLY A 93 20.700 -5.411 25.371 1.00 0.00 H new ATOM 0 HA2 GLY A 93 21.138 -5.086 27.633 1.00 0.00 H new ATOM 0 HA3 GLY A 93 21.327 -6.813 27.866 1.00 0.00 H new ATOM 1454 N ARG A 94 23.839 -6.910 27.065 1.00 0.00 N ATOM 1455 CA ARG A 94 25.330 -6.825 27.018 1.00 0.00 C ATOM 1456 C ARG A 94 25.910 -7.893 26.082 1.00 0.00 C ATOM 1457 O ARG A 94 27.107 -7.965 25.884 1.00 0.00 O ATOM 1458 CB ARG A 94 25.875 -7.060 28.420 1.00 0.00 C ATOM 1459 CG ARG A 94 25.246 -6.058 29.390 1.00 0.00 C ATOM 1460 CD ARG A 94 25.896 -6.202 30.768 1.00 0.00 C ATOM 1461 NE ARG A 94 25.144 -5.384 31.762 1.00 0.00 N ATOM 1462 CZ ARG A 94 25.136 -4.083 31.666 1.00 0.00 C ATOM 1463 NH1 ARG A 94 25.953 -3.483 30.843 1.00 0.00 N ATOM 1464 NH2 ARG A 94 24.311 -3.380 32.394 1.00 0.00 N ATOM 0 H ARG A 94 23.457 -7.854 27.009 1.00 0.00 H new ATOM 0 HA ARG A 94 25.614 -5.840 26.647 1.00 0.00 H new ATOM 0 HB2 ARG A 94 25.655 -8.078 28.740 1.00 0.00 H new ATOM 0 HB3 ARG A 94 26.960 -6.952 28.422 1.00 0.00 H new ATOM 0 HG2 ARG A 94 25.380 -5.042 29.018 1.00 0.00 H new ATOM 0 HG3 ARG A 94 24.172 -6.232 29.463 1.00 0.00 H new ATOM 0 HD2 ARG A 94 25.900 -7.249 31.072 1.00 0.00 H new ATOM 0 HD3 ARG A 94 26.936 -5.878 30.727 1.00 0.00 H new ATOM 0 HE ARG A 94 24.635 -5.842 32.518 1.00 0.00 H new ATOM 0 HH11 ARG A 94 26.598 -4.032 30.274 1.00 0.00 H new ATOM 0 HH12 ARG A 94 25.946 -2.466 30.769 1.00 0.00 H new ATOM 0 HH21 ARG A 94 23.673 -3.848 33.038 1.00 0.00 H new ATOM 0 HH22 ARG A 94 24.305 -2.363 32.319 1.00 0.00 H new ATOM 1478 N LYS A 95 25.088 -8.729 25.513 1.00 0.00 N ATOM 1479 CA LYS A 95 25.616 -9.788 24.607 1.00 0.00 C ATOM 1480 C LYS A 95 25.454 -9.350 23.147 1.00 0.00 C ATOM 1481 O LYS A 95 24.385 -8.946 22.745 1.00 0.00 O ATOM 1482 CB LYS A 95 24.831 -11.082 24.831 1.00 0.00 C ATOM 1483 CG LYS A 95 24.634 -11.310 26.332 1.00 0.00 C ATOM 1484 CD LYS A 95 23.137 -11.331 26.652 1.00 0.00 C ATOM 1485 CE LYS A 95 22.933 -11.586 28.147 1.00 0.00 C ATOM 1486 NZ LYS A 95 24.062 -10.985 28.913 1.00 0.00 N ATOM 0 H LYS A 95 24.075 -8.726 25.635 1.00 0.00 H new ATOM 0 HA LYS A 95 26.672 -9.951 24.822 1.00 0.00 H new ATOM 0 HB2 LYS A 95 23.864 -11.023 24.332 1.00 0.00 H new ATOM 0 HB3 LYS A 95 25.366 -11.924 24.392 1.00 0.00 H new ATOM 0 HG2 LYS A 95 25.094 -12.252 26.631 1.00 0.00 H new ATOM 0 HG3 LYS A 95 25.127 -10.520 26.899 1.00 0.00 H new ATOM 0 HD2 LYS A 95 22.682 -10.382 26.370 1.00 0.00 H new ATOM 0 HD3 LYS A 95 22.642 -12.108 26.070 1.00 0.00 H new ATOM 0 HE2 LYS A 95 21.987 -11.155 28.474 1.00 0.00 H new ATOM 0 HE3 LYS A 95 22.878 -12.657 28.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 23.836 -10.992 29.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 24.927 -11.538 28.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 24.212 -10.005 28.599 1.00 0.00 H new ATOM 1500 N PRO A 96 26.518 -9.449 22.389 1.00 0.00 N ATOM 1501 CA PRO A 96 26.508 -9.074 20.966 1.00 0.00 C ATOM 1502 C PRO A 96 25.863 -10.192 20.139 1.00 0.00 C ATOM 1503 O PRO A 96 26.139 -11.357 20.341 1.00 0.00 O ATOM 1504 CB PRO A 96 27.991 -8.929 20.621 1.00 0.00 C ATOM 1505 CG PRO A 96 28.765 -9.765 21.668 1.00 0.00 C ATOM 1506 CD PRO A 96 27.824 -9.940 22.875 1.00 0.00 C ATOM 0 HA PRO A 96 25.941 -8.166 20.760 1.00 0.00 H new ATOM 0 HB2 PRO A 96 28.192 -9.288 19.612 1.00 0.00 H new ATOM 0 HB3 PRO A 96 28.298 -7.884 20.655 1.00 0.00 H new ATOM 0 HG2 PRO A 96 29.051 -10.733 21.256 1.00 0.00 H new ATOM 0 HG3 PRO A 96 29.685 -9.260 21.964 1.00 0.00 H new ATOM 0 HD2 PRO A 96 27.766 -10.983 23.188 1.00 0.00 H new ATOM 0 HD3 PRO A 96 28.170 -9.368 23.736 1.00 0.00 H new ATOM 1514 N LYS A 97 25.005 -9.853 19.214 1.00 0.00 N ATOM 1515 CA LYS A 97 24.349 -10.909 18.391 1.00 0.00 C ATOM 1516 C LYS A 97 24.132 -10.400 16.963 1.00 0.00 C ATOM 1517 O LYS A 97 23.924 -9.225 16.736 1.00 0.00 O ATOM 1518 CB LYS A 97 22.994 -11.265 19.008 1.00 0.00 C ATOM 1519 CG LYS A 97 23.156 -11.494 20.513 1.00 0.00 C ATOM 1520 CD LYS A 97 22.120 -12.513 20.988 1.00 0.00 C ATOM 1521 CE LYS A 97 22.502 -13.019 22.381 1.00 0.00 C ATOM 1522 NZ LYS A 97 23.792 -13.763 22.304 1.00 0.00 N ATOM 0 H LYS A 97 24.731 -8.895 18.994 1.00 0.00 H new ATOM 0 HA LYS A 97 24.989 -11.791 18.366 1.00 0.00 H new ATOM 0 HB2 LYS A 97 22.279 -10.462 18.828 1.00 0.00 H new ATOM 0 HB3 LYS A 97 22.593 -12.161 18.535 1.00 0.00 H new ATOM 0 HG2 LYS A 97 24.162 -11.853 20.731 1.00 0.00 H new ATOM 0 HG3 LYS A 97 23.030 -10.554 21.050 1.00 0.00 H new ATOM 0 HD2 LYS A 97 21.131 -12.056 21.014 1.00 0.00 H new ATOM 0 HD3 LYS A 97 22.068 -13.347 20.288 1.00 0.00 H new ATOM 0 HE2 LYS A 97 22.594 -12.181 23.071 1.00 0.00 H new ATOM 0 HE3 LYS A 97 21.718 -13.668 22.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 23.819 -14.489 23.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 23.875 -14.219 21.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 24.583 -13.101 22.437 1.00 0.00 H new ATOM 1536 N VAL A 98 24.165 -11.283 16.001 1.00 0.00 N ATOM 1537 CA VAL A 98 23.944 -10.862 14.588 1.00 0.00 C ATOM 1538 C VAL A 98 22.699 -11.568 14.054 1.00 0.00 C ATOM 1539 O VAL A 98 22.500 -12.744 14.282 1.00 0.00 O ATOM 1540 CB VAL A 98 25.146 -11.263 13.731 1.00 0.00 C ATOM 1541 CG1 VAL A 98 24.848 -10.956 12.261 1.00 0.00 C ATOM 1542 CG2 VAL A 98 26.377 -10.473 14.176 1.00 0.00 C ATOM 0 H VAL A 98 24.336 -12.280 16.134 1.00 0.00 H new ATOM 0 HA VAL A 98 23.816 -9.780 14.547 1.00 0.00 H new ATOM 0 HB VAL A 98 25.337 -12.330 13.850 1.00 0.00 H new ATOM 0 HG11 VAL A 98 25.704 -11.241 11.649 1.00 0.00 H new ATOM 0 HG12 VAL A 98 23.970 -11.519 11.942 1.00 0.00 H new ATOM 0 HG13 VAL A 98 24.657 -9.889 12.143 1.00 0.00 H new ATOM 0 HG21 VAL A 98 27.233 -10.759 13.565 1.00 0.00 H new ATOM 0 HG22 VAL A 98 26.187 -9.406 14.058 1.00 0.00 H new ATOM 0 HG23 VAL A 98 26.590 -10.690 15.223 1.00 0.00 H new ATOM 1552 N GLU A 99 21.856 -10.871 13.344 1.00 0.00 N ATOM 1553 CA GLU A 99 20.638 -11.532 12.811 1.00 0.00 C ATOM 1554 C GLU A 99 20.417 -11.119 11.363 1.00 0.00 C ATOM 1555 O GLU A 99 21.309 -10.640 10.690 1.00 0.00 O ATOM 1556 CB GLU A 99 19.424 -11.112 13.632 1.00 0.00 C ATOM 1557 CG GLU A 99 18.713 -12.354 14.173 1.00 0.00 C ATOM 1558 CD GLU A 99 17.199 -12.151 14.096 1.00 0.00 C ATOM 1559 OE1 GLU A 99 16.656 -12.298 13.014 1.00 0.00 O ATOM 1560 OE2 GLU A 99 16.609 -11.852 15.122 1.00 0.00 O ATOM 0 H GLU A 99 21.958 -9.883 13.113 1.00 0.00 H new ATOM 0 HA GLU A 99 20.770 -12.612 12.870 1.00 0.00 H new ATOM 0 HB2 GLU A 99 19.735 -10.471 14.457 1.00 0.00 H new ATOM 0 HB3 GLU A 99 18.740 -10.529 13.015 1.00 0.00 H new ATOM 0 HG2 GLU A 99 19.002 -13.232 13.595 1.00 0.00 H new ATOM 0 HG3 GLU A 99 19.014 -12.538 15.204 1.00 0.00 H new ATOM 1567 N GLN A 100 19.223 -11.298 10.890 1.00 0.00 N ATOM 1568 CA GLN A 100 18.898 -10.922 9.491 1.00 0.00 C ATOM 1569 C GLN A 100 17.456 -10.432 9.448 1.00 0.00 C ATOM 1570 O GLN A 100 16.545 -11.179 9.150 1.00 0.00 O ATOM 1571 CB GLN A 100 19.034 -12.142 8.589 1.00 0.00 C ATOM 1572 CG GLN A 100 20.426 -12.757 8.751 1.00 0.00 C ATOM 1573 CD GLN A 100 20.361 -13.916 9.746 1.00 0.00 C ATOM 1574 OE1 GLN A 100 19.740 -13.808 10.785 1.00 0.00 O ATOM 1575 NE2 GLN A 100 20.981 -15.031 9.470 1.00 0.00 N ATOM 0 H GLN A 100 18.446 -11.694 11.419 1.00 0.00 H new ATOM 0 HA GLN A 100 19.578 -10.142 9.148 1.00 0.00 H new ATOM 0 HB2 GLN A 100 18.270 -12.878 8.840 1.00 0.00 H new ATOM 0 HB3 GLN A 100 18.872 -11.857 7.550 1.00 0.00 H new ATOM 0 HG2 GLN A 100 20.793 -13.111 7.788 1.00 0.00 H new ATOM 0 HG3 GLN A 100 21.130 -12.002 9.102 1.00 0.00 H new ATOM 0 HE21 GLN A 100 21.502 -15.122 8.598 1.00 0.00 H new ATOM 0 HE22 GLN A 100 20.944 -15.811 10.126 1.00 0.00 H new ATOM 1584 N LEU A 101 17.240 -9.190 9.759 1.00 0.00 N ATOM 1585 CA LEU A 101 15.855 -8.657 9.752 1.00 0.00 C ATOM 1586 C LEU A 101 15.132 -9.140 8.503 1.00 0.00 C ATOM 1587 O LEU A 101 15.715 -9.296 7.449 1.00 0.00 O ATOM 1588 CB LEU A 101 15.883 -7.130 9.778 1.00 0.00 C ATOM 1589 CG LEU A 101 16.658 -6.634 11.007 1.00 0.00 C ATOM 1590 CD1 LEU A 101 16.195 -5.220 11.363 1.00 0.00 C ATOM 1591 CD2 LEU A 101 16.406 -7.563 12.198 1.00 0.00 C ATOM 0 H LEU A 101 17.963 -8.519 10.018 1.00 0.00 H new ATOM 0 HA LEU A 101 15.328 -9.015 10.636 1.00 0.00 H new ATOM 0 HB2 LEU A 101 16.349 -6.752 8.868 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.865 -6.741 9.800 1.00 0.00 H new ATOM 0 HG LEU A 101 17.723 -6.628 10.777 1.00 0.00 H new ATOM 0 HD11 LEU A 101 16.744 -4.866 12.235 1.00 0.00 H new ATOM 0 HD12 LEU A 101 16.382 -4.553 10.521 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.128 -5.232 11.586 1.00 0.00 H new ATOM 0 HD21 LEU A 101 16.960 -7.202 13.064 1.00 0.00 H new ATOM 0 HD22 LEU A 101 15.341 -7.578 12.429 1.00 0.00 H new ATOM 0 HD23 LEU A 101 16.737 -8.571 11.949 1.00 0.00 H new ATOM 1603 N SER A 102 13.867 -9.396 8.624 1.00 0.00 N ATOM 1604 CA SER A 102 13.087 -9.894 7.453 1.00 0.00 C ATOM 1605 C SER A 102 12.275 -8.756 6.835 1.00 0.00 C ATOM 1606 O SER A 102 11.740 -7.918 7.531 1.00 0.00 O ATOM 1607 CB SER A 102 12.139 -11.004 7.909 1.00 0.00 C ATOM 1608 OG SER A 102 12.885 -12.191 8.143 1.00 0.00 O ATOM 0 H SER A 102 13.331 -9.283 9.485 1.00 0.00 H new ATOM 0 HA SER A 102 13.779 -10.282 6.706 1.00 0.00 H new ATOM 0 HB2 SER A 102 11.618 -10.703 8.818 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.378 -11.183 7.150 1.00 0.00 H new ATOM 0 HG SER A 102 12.281 -12.904 8.437 1.00 0.00 H new ATOM 1614 N ASN A 103 12.168 -8.724 5.532 1.00 0.00 N ATOM 1615 CA ASN A 103 11.375 -7.641 4.878 1.00 0.00 C ATOM 1616 C ASN A 103 11.896 -6.281 5.337 1.00 0.00 C ATOM 1617 O ASN A 103 11.160 -5.319 5.425 1.00 0.00 O ATOM 1618 CB ASN A 103 9.903 -7.777 5.274 1.00 0.00 C ATOM 1619 CG ASN A 103 9.191 -8.708 4.290 1.00 0.00 C ATOM 1620 OD1 ASN A 103 8.027 -8.526 3.999 1.00 0.00 O ATOM 1621 ND2 ASN A 103 9.848 -9.705 3.764 1.00 0.00 N ATOM 0 H ASN A 103 12.593 -9.398 4.895 1.00 0.00 H new ATOM 0 HA ASN A 103 11.472 -7.724 3.796 1.00 0.00 H new ATOM 0 HB2 ASN A 103 9.823 -8.172 6.287 1.00 0.00 H new ATOM 0 HB3 ASN A 103 9.424 -6.798 5.275 1.00 0.00 H new ATOM 0 HD21 ASN A 103 9.383 -10.332 3.108 1.00 0.00 H new ATOM 0 HD22 ASN A 103 10.826 -9.857 4.009 1.00 0.00 H new ATOM 1628 N MET A 104 13.162 -6.193 5.622 1.00 0.00 N ATOM 1629 CA MET A 104 13.734 -4.896 6.068 1.00 0.00 C ATOM 1630 C MET A 104 14.293 -4.159 4.852 1.00 0.00 C ATOM 1631 O MET A 104 15.135 -3.291 4.972 1.00 0.00 O ATOM 1632 CB MET A 104 14.858 -5.153 7.073 1.00 0.00 C ATOM 1633 CG MET A 104 14.765 -4.138 8.212 1.00 0.00 C ATOM 1634 SD MET A 104 15.724 -2.664 7.785 1.00 0.00 S ATOM 1635 CE MET A 104 16.132 -2.166 9.475 1.00 0.00 C ATOM 0 H MET A 104 13.827 -6.965 5.565 1.00 0.00 H new ATOM 0 HA MET A 104 12.960 -4.292 6.542 1.00 0.00 H new ATOM 0 HB2 MET A 104 14.783 -6.166 7.468 1.00 0.00 H new ATOM 0 HB3 MET A 104 15.827 -5.074 6.579 1.00 0.00 H new ATOM 0 HG2 MET A 104 13.724 -3.869 8.390 1.00 0.00 H new ATOM 0 HG3 MET A 104 15.143 -4.576 9.136 1.00 0.00 H new ATOM 0 HE1 MET A 104 16.219 -1.081 9.523 1.00 0.00 H new ATOM 0 HE2 MET A 104 15.345 -2.498 10.152 1.00 0.00 H new ATOM 0 HE3 MET A 104 17.078 -2.619 9.769 1.00 0.00 H new ATOM 1645 N ILE A 105 13.828 -4.501 3.680 1.00 0.00 N ATOM 1646 CA ILE A 105 14.324 -3.822 2.450 1.00 0.00 C ATOM 1647 C ILE A 105 13.258 -3.916 1.359 1.00 0.00 C ATOM 1648 O ILE A 105 12.317 -4.677 1.461 1.00 0.00 O ATOM 1649 CB ILE A 105 15.600 -4.506 1.962 1.00 0.00 C ATOM 1650 CG1 ILE A 105 16.685 -4.391 3.034 1.00 0.00 C ATOM 1651 CG2 ILE A 105 16.079 -3.827 0.677 1.00 0.00 C ATOM 1652 CD1 ILE A 105 17.997 -4.962 2.493 1.00 0.00 C ATOM 0 H ILE A 105 13.125 -5.223 3.522 1.00 0.00 H new ATOM 0 HA ILE A 105 14.536 -2.777 2.675 1.00 0.00 H new ATOM 0 HB ILE A 105 15.396 -5.559 1.765 1.00 0.00 H new ATOM 0 HG12 ILE A 105 16.820 -3.348 3.320 1.00 0.00 H new ATOM 0 HG13 ILE A 105 16.383 -4.931 3.932 1.00 0.00 H new ATOM 0 HG21 ILE A 105 16.989 -4.313 0.326 1.00 0.00 H new ATOM 0 HG22 ILE A 105 15.306 -3.909 -0.088 1.00 0.00 H new ATOM 0 HG23 ILE A 105 16.283 -2.775 0.876 1.00 0.00 H new ATOM 0 HD11 ILE A 105 18.771 -4.881 3.256 1.00 0.00 H new ATOM 0 HD12 ILE A 105 17.856 -6.010 2.229 1.00 0.00 H new ATOM 0 HD13 ILE A 105 18.300 -4.403 1.608 1.00 0.00 H new ATOM 1664 N VAL A 106 13.398 -3.151 0.313 1.00 0.00 N ATOM 1665 CA VAL A 106 12.396 -3.199 -0.781 1.00 0.00 C ATOM 1666 C VAL A 106 13.068 -3.714 -2.059 1.00 0.00 C ATOM 1667 O VAL A 106 14.244 -3.506 -2.280 1.00 0.00 O ATOM 1668 CB VAL A 106 11.842 -1.790 -1.012 1.00 0.00 C ATOM 1669 CG1 VAL A 106 11.172 -1.718 -2.382 1.00 0.00 C ATOM 1670 CG2 VAL A 106 10.813 -1.464 0.073 1.00 0.00 C ATOM 0 H VAL A 106 14.165 -2.494 0.171 1.00 0.00 H new ATOM 0 HA VAL A 106 11.579 -3.869 -0.512 1.00 0.00 H new ATOM 0 HB VAL A 106 12.660 -1.070 -0.971 1.00 0.00 H new ATOM 0 HG11 VAL A 106 10.779 -0.714 -2.543 1.00 0.00 H new ATOM 0 HG12 VAL A 106 11.903 -1.950 -3.157 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.355 -2.439 -2.426 1.00 0.00 H new ATOM 0 HG21 VAL A 106 10.418 -0.461 -0.090 1.00 0.00 H new ATOM 0 HG22 VAL A 106 9.998 -2.187 0.031 1.00 0.00 H new ATOM 0 HG23 VAL A 106 11.289 -1.511 1.052 1.00 0.00 H new ATOM 1680 N ARG A 107 12.328 -4.383 -2.899 1.00 0.00 N ATOM 1681 CA ARG A 107 12.919 -4.909 -4.161 1.00 0.00 C ATOM 1682 C ARG A 107 11.893 -4.780 -5.289 1.00 0.00 C ATOM 1683 O ARG A 107 12.049 -5.343 -6.354 1.00 0.00 O ATOM 1684 CB ARG A 107 13.294 -6.381 -3.976 1.00 0.00 C ATOM 1685 CG ARG A 107 14.568 -6.687 -4.766 1.00 0.00 C ATOM 1686 CD ARG A 107 14.234 -7.616 -5.935 1.00 0.00 C ATOM 1687 NE ARG A 107 15.461 -8.350 -6.355 1.00 0.00 N ATOM 1688 CZ ARG A 107 15.393 -9.249 -7.298 1.00 0.00 C ATOM 1689 NH1 ARG A 107 14.601 -9.065 -8.319 1.00 0.00 N ATOM 1690 NH2 ARG A 107 16.116 -10.332 -7.220 1.00 0.00 N ATOM 0 H ARG A 107 11.338 -4.588 -2.766 1.00 0.00 H new ATOM 0 HA ARG A 107 13.813 -4.339 -4.412 1.00 0.00 H new ATOM 0 HB2 ARG A 107 13.448 -6.598 -2.919 1.00 0.00 H new ATOM 0 HB3 ARG A 107 12.480 -7.020 -4.317 1.00 0.00 H new ATOM 0 HG2 ARG A 107 15.009 -5.762 -5.137 1.00 0.00 H new ATOM 0 HG3 ARG A 107 15.308 -7.154 -4.116 1.00 0.00 H new ATOM 0 HD2 ARG A 107 13.458 -8.323 -5.641 1.00 0.00 H new ATOM 0 HD3 ARG A 107 13.839 -7.038 -6.771 1.00 0.00 H new ATOM 0 HE ARG A 107 16.354 -8.149 -5.905 1.00 0.00 H new ATOM 0 HH11 ARG A 107 14.035 -8.218 -8.380 1.00 0.00 H new ATOM 0 HH12 ARG A 107 14.548 -9.768 -9.056 1.00 0.00 H new ATOM 0 HH21 ARG A 107 16.734 -10.476 -6.422 1.00 0.00 H new ATOM 0 HH22 ARG A 107 16.063 -11.035 -7.957 1.00 0.00 H new ATOM 1704 N SER A 108 10.842 -4.042 -5.058 1.00 0.00 N ATOM 1705 CA SER A 108 9.798 -3.870 -6.107 1.00 0.00 C ATOM 1706 C SER A 108 8.518 -3.347 -5.454 1.00 0.00 C ATOM 1707 O SER A 108 8.036 -3.898 -4.486 1.00 0.00 O ATOM 1708 CB SER A 108 9.517 -5.217 -6.774 1.00 0.00 C ATOM 1709 OG SER A 108 9.819 -6.266 -5.862 1.00 0.00 O ATOM 0 H SER A 108 10.661 -3.549 -4.184 1.00 0.00 H new ATOM 0 HA SER A 108 10.145 -3.162 -6.859 1.00 0.00 H new ATOM 0 HB2 SER A 108 8.472 -5.274 -7.078 1.00 0.00 H new ATOM 0 HB3 SER A 108 10.118 -5.321 -7.677 1.00 0.00 H new ATOM 0 HG SER A 108 10.745 -6.559 -5.995 1.00 0.00 H new ATOM 1715 N CYS A 109 7.968 -2.280 -5.967 1.00 0.00 N ATOM 1716 CA CYS A 109 6.725 -1.723 -5.360 1.00 0.00 C ATOM 1717 C CYS A 109 5.493 -2.273 -6.087 1.00 0.00 C ATOM 1718 O CYS A 109 5.581 -3.208 -6.859 1.00 0.00 O ATOM 1719 CB CYS A 109 6.740 -0.199 -5.475 1.00 0.00 C ATOM 1720 SG CYS A 109 8.014 0.476 -4.382 1.00 0.00 S ATOM 0 H CYS A 109 8.324 -1.772 -6.777 1.00 0.00 H new ATOM 0 HA CYS A 109 6.682 -2.013 -4.310 1.00 0.00 H new ATOM 0 HB2 CYS A 109 6.936 0.097 -6.506 1.00 0.00 H new ATOM 0 HB3 CYS A 109 5.764 0.206 -5.207 1.00 0.00 H new ATOM 1725 N LYS A 110 4.342 -1.700 -5.843 1.00 0.00 N ATOM 1726 CA LYS A 110 3.105 -2.185 -6.511 1.00 0.00 C ATOM 1727 C LYS A 110 1.979 -1.182 -6.246 1.00 0.00 C ATOM 1728 O LYS A 110 2.201 0.009 -6.217 1.00 0.00 O ATOM 1729 CB LYS A 110 2.723 -3.556 -5.948 1.00 0.00 C ATOM 1730 CG LYS A 110 2.072 -4.397 -7.049 1.00 0.00 C ATOM 1731 CD LYS A 110 2.907 -5.656 -7.292 1.00 0.00 C ATOM 1732 CE LYS A 110 3.855 -5.421 -8.469 1.00 0.00 C ATOM 1733 NZ LYS A 110 4.481 -6.713 -8.868 1.00 0.00 N ATOM 0 H LYS A 110 4.209 -0.914 -5.207 1.00 0.00 H new ATOM 0 HA LYS A 110 3.271 -2.278 -7.584 1.00 0.00 H new ATOM 0 HB2 LYS A 110 3.608 -4.063 -5.564 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.035 -3.438 -5.111 1.00 0.00 H new ATOM 0 HG2 LYS A 110 1.057 -4.671 -6.760 1.00 0.00 H new ATOM 0 HG3 LYS A 110 1.996 -3.816 -7.968 1.00 0.00 H new ATOM 0 HD2 LYS A 110 3.477 -5.906 -6.397 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.254 -6.503 -7.501 1.00 0.00 H new ATOM 0 HE2 LYS A 110 3.309 -4.994 -9.310 1.00 0.00 H new ATOM 0 HE3 LYS A 110 4.625 -4.702 -8.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 5.126 -6.554 -9.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 5.015 -7.102 -8.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 3.739 -7.386 -9.149 1.00 0.00 H new ATOM 1747 N CYS A 111 0.776 -1.642 -6.049 1.00 0.00 N ATOM 1748 CA CYS A 111 -0.338 -0.688 -5.785 1.00 0.00 C ATOM 1749 C CYS A 111 -1.416 -1.379 -4.950 1.00 0.00 C ATOM 1750 O CYS A 111 -2.397 -1.874 -5.469 1.00 0.00 O ATOM 1751 CB CYS A 111 -0.931 -0.217 -7.116 1.00 0.00 C ATOM 1752 SG CYS A 111 0.142 1.059 -7.827 1.00 0.00 S ATOM 0 H CYS A 111 0.516 -2.628 -6.059 1.00 0.00 H new ATOM 0 HA CYS A 111 0.041 0.174 -5.236 1.00 0.00 H new ATOM 0 HB2 CYS A 111 -1.023 -1.057 -7.805 1.00 0.00 H new ATOM 0 HB3 CYS A 111 -1.934 0.179 -6.961 1.00 0.00 H new ATOM 1757 N SER A 112 -1.242 -1.420 -3.654 1.00 0.00 N ATOM 1758 CA SER A 112 -2.257 -2.081 -2.788 1.00 0.00 C ATOM 1759 C SER A 112 -3.367 -1.083 -2.450 1.00 0.00 C ATOM 1760 O SER A 112 -4.521 -1.476 -2.485 1.00 0.00 O ATOM 1761 CB SER A 112 -1.591 -2.558 -1.497 1.00 0.00 C ATOM 1762 OG SER A 112 -2.249 -3.730 -1.033 1.00 0.00 O ATOM 1763 OXT SER A 112 -3.043 0.058 -2.163 1.00 0.00 O ATOM 0 H SER A 112 -0.442 -1.024 -3.161 1.00 0.00 H new ATOM 0 HA SER A 112 -2.684 -2.935 -3.315 1.00 0.00 H new ATOM 0 HB2 SER A 112 -0.536 -2.766 -1.674 1.00 0.00 H new ATOM 0 HB3 SER A 112 -1.639 -1.776 -0.739 1.00 0.00 H new ATOM 0 HG SER A 112 -1.707 -4.155 -0.336 1.00 0.00 H new TER 1769 SER A 112 ATOM 1770 N ALA B 1 -7.893 -0.367 15.963 1.00 0.00 N ATOM 1771 CA ALA B 1 -8.460 -1.139 14.821 1.00 0.00 C ATOM 1772 C ALA B 1 -8.516 -0.246 13.580 1.00 0.00 C ATOM 1773 O ALA B 1 -9.242 0.727 13.535 1.00 0.00 O ATOM 1774 CB ALA B 1 -9.872 -1.610 15.174 1.00 0.00 C ATOM 0 H1 ALA B 1 -7.855 -0.973 16.807 1.00 0.00 H new ATOM 0 H2 ALA B 1 -6.933 -0.047 15.723 1.00 0.00 H new ATOM 0 H3 ALA B 1 -8.495 0.459 16.157 1.00 0.00 H new ATOM 0 HA ALA B 1 -7.829 -2.004 14.619 1.00 0.00 H new ATOM 0 HB1 ALA B 1 -10.287 -2.175 14.339 1.00 0.00 H new ATOM 0 HB2 ALA B 1 -9.833 -2.246 16.058 1.00 0.00 H new ATOM 0 HB3 ALA B 1 -10.504 -0.745 15.377 1.00 0.00 H new ATOM 1782 N LEU B 2 -7.754 -0.569 12.571 1.00 0.00 N ATOM 1783 CA LEU B 2 -7.764 0.264 11.335 1.00 0.00 C ATOM 1784 C LEU B 2 -8.808 -0.278 10.364 1.00 0.00 C ATOM 1785 O LEU B 2 -8.506 -0.638 9.243 1.00 0.00 O ATOM 1786 CB LEU B 2 -6.392 0.213 10.675 1.00 0.00 C ATOM 1787 CG LEU B 2 -5.329 0.716 11.654 1.00 0.00 C ATOM 1788 CD1 LEU B 2 -4.035 1.015 10.894 1.00 0.00 C ATOM 1789 CD2 LEU B 2 -5.825 1.994 12.336 1.00 0.00 C ATOM 0 H LEU B 2 -7.126 -1.372 12.549 1.00 0.00 H new ATOM 0 HA LEU B 2 -8.006 1.294 11.597 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -6.163 -0.808 10.368 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -6.389 0.826 9.773 1.00 0.00 H new ATOM 0 HG LEU B 2 -5.140 -0.049 12.407 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -3.278 1.373 11.591 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -3.680 0.106 10.408 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -4.224 1.779 10.140 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -5.067 2.352 13.033 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -6.015 2.758 11.582 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -6.747 1.783 12.878 1.00 0.00 H new ATOM 1801 N ASP B 3 -10.033 -0.336 10.787 1.00 0.00 N ATOM 1802 CA ASP B 3 -11.107 -0.851 9.897 1.00 0.00 C ATOM 1803 C ASP B 3 -12.055 0.289 9.529 1.00 0.00 C ATOM 1804 O ASP B 3 -11.839 1.431 9.887 1.00 0.00 O ATOM 1805 CB ASP B 3 -11.888 -1.950 10.622 1.00 0.00 C ATOM 1806 CG ASP B 3 -11.931 -1.646 12.121 1.00 0.00 C ATOM 1807 OD1 ASP B 3 -12.286 -0.533 12.470 1.00 0.00 O ATOM 1808 OD2 ASP B 3 -11.607 -2.533 12.894 1.00 0.00 O ATOM 0 H ASP B 3 -10.341 -0.048 11.716 1.00 0.00 H new ATOM 0 HA ASP B 3 -10.661 -1.260 8.990 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -12.901 -2.013 10.224 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -11.417 -2.918 10.450 1.00 0.00 H new ATOM 1813 N THR B 4 -13.101 -0.011 8.813 1.00 0.00 N ATOM 1814 CA THR B 4 -14.066 1.050 8.412 1.00 0.00 C ATOM 1815 C THR B 4 -15.043 1.323 9.559 1.00 0.00 C ATOM 1816 O THR B 4 -16.024 2.022 9.398 1.00 0.00 O ATOM 1817 CB THR B 4 -14.832 0.588 7.172 1.00 0.00 C ATOM 1818 OG1 THR B 4 -15.894 -0.271 7.565 1.00 0.00 O ATOM 1819 CG2 THR B 4 -13.876 -0.166 6.242 1.00 0.00 C ATOM 0 H THR B 4 -13.331 -0.950 8.487 1.00 0.00 H new ATOM 0 HA THR B 4 -13.526 1.969 8.184 1.00 0.00 H new ATOM 0 HB THR B 4 -15.243 1.452 6.649 1.00 0.00 H new ATOM 0 HG1 THR B 4 -16.387 -0.566 6.771 1.00 0.00 H new ATOM 0 HG21 THR B 4 -14.417 -0.498 5.356 1.00 0.00 H new ATOM 0 HG22 THR B 4 -13.062 0.495 5.944 1.00 0.00 H new ATOM 0 HG23 THR B 4 -13.468 -1.032 6.764 1.00 0.00 H new ATOM 1827 N ASN B 5 -14.779 0.786 10.719 1.00 0.00 N ATOM 1828 CA ASN B 5 -15.686 1.026 11.874 1.00 0.00 C ATOM 1829 C ASN B 5 -15.084 2.112 12.770 1.00 0.00 C ATOM 1830 O ASN B 5 -15.771 3.003 13.228 1.00 0.00 O ATOM 1831 CB ASN B 5 -15.845 -0.268 12.676 1.00 0.00 C ATOM 1832 CG ASN B 5 -17.280 -0.781 12.537 1.00 0.00 C ATOM 1833 OD1 ASN B 5 -17.899 -0.615 11.504 1.00 0.00 O ATOM 1834 ND2 ASN B 5 -17.839 -1.402 13.540 1.00 0.00 N ATOM 0 H ASN B 5 -13.974 0.191 10.915 1.00 0.00 H new ATOM 0 HA ASN B 5 -16.662 1.349 11.512 1.00 0.00 H new ATOM 0 HB2 ASN B 5 -15.142 -1.020 12.317 1.00 0.00 H new ATOM 0 HB3 ASN B 5 -15.611 -0.089 13.726 1.00 0.00 H new ATOM 0 HD21 ASN B 5 -18.795 -1.748 13.457 1.00 0.00 H new ATOM 0 HD22 ASN B 5 -17.320 -1.541 14.407 1.00 0.00 H new ATOM 1841 N TYR B 6 -13.805 2.043 13.025 1.00 0.00 N ATOM 1842 CA TYR B 6 -13.156 3.063 13.889 1.00 0.00 C ATOM 1843 C TYR B 6 -12.723 4.258 13.035 1.00 0.00 C ATOM 1844 O TYR B 6 -12.455 5.330 13.543 1.00 0.00 O ATOM 1845 CB TYR B 6 -11.933 2.431 14.549 1.00 0.00 C ATOM 1846 CG TYR B 6 -11.076 3.505 15.174 1.00 0.00 C ATOM 1847 CD1 TYR B 6 -11.502 4.160 16.334 1.00 0.00 C ATOM 1848 CD2 TYR B 6 -9.853 3.843 14.586 1.00 0.00 C ATOM 1849 CE1 TYR B 6 -10.702 5.155 16.909 1.00 0.00 C ATOM 1850 CE2 TYR B 6 -9.053 4.839 15.159 1.00 0.00 C ATOM 1851 CZ TYR B 6 -9.477 5.495 16.321 1.00 0.00 C ATOM 1852 OH TYR B 6 -8.688 6.475 16.888 1.00 0.00 O ATOM 0 H TYR B 6 -13.181 1.319 12.669 1.00 0.00 H new ATOM 0 HA TYR B 6 -13.854 3.408 14.652 1.00 0.00 H new ATOM 0 HB2 TYR B 6 -12.248 1.716 15.309 1.00 0.00 H new ATOM 0 HB3 TYR B 6 -11.355 1.877 13.809 1.00 0.00 H new ATOM 0 HD1 TYR B 6 -12.447 3.899 16.786 1.00 0.00 H new ATOM 0 HD2 TYR B 6 -9.526 3.336 13.690 1.00 0.00 H new ATOM 0 HE1 TYR B 6 -11.029 5.660 17.806 1.00 0.00 H new ATOM 0 HE2 TYR B 6 -8.109 5.101 14.705 1.00 0.00 H new ATOM 0 HH TYR B 6 -7.872 6.587 16.356 1.00 0.00 H new ATOM 1862 N CYS B 7 -12.654 4.085 11.743 1.00 0.00 N ATOM 1863 CA CYS B 7 -12.236 5.212 10.862 1.00 0.00 C ATOM 1864 C CYS B 7 -13.458 6.058 10.505 1.00 0.00 C ATOM 1865 O CYS B 7 -13.339 7.150 9.986 1.00 0.00 O ATOM 1866 CB CYS B 7 -11.606 4.657 9.585 1.00 0.00 C ATOM 1867 SG CYS B 7 -9.899 4.168 9.930 1.00 0.00 S ATOM 0 H CYS B 7 -12.869 3.213 11.260 1.00 0.00 H new ATOM 0 HA CYS B 7 -11.506 5.831 11.384 1.00 0.00 H new ATOM 0 HB2 CYS B 7 -12.177 3.801 9.226 1.00 0.00 H new ATOM 0 HB3 CYS B 7 -11.629 5.409 8.797 1.00 0.00 H new ATOM 1872 N PHE B 8 -14.633 5.564 10.780 1.00 0.00 N ATOM 1873 CA PHE B 8 -15.862 6.342 10.459 1.00 0.00 C ATOM 1874 C PHE B 8 -16.212 7.255 11.637 1.00 0.00 C ATOM 1875 O PHE B 8 -17.341 7.673 11.796 1.00 0.00 O ATOM 1876 CB PHE B 8 -17.022 5.377 10.195 1.00 0.00 C ATOM 1877 CG PHE B 8 -17.065 5.020 8.726 1.00 0.00 C ATOM 1878 CD1 PHE B 8 -15.914 5.143 7.937 1.00 0.00 C ATOM 1879 CD2 PHE B 8 -18.259 4.563 8.154 1.00 0.00 C ATOM 1880 CE1 PHE B 8 -15.958 4.811 6.577 1.00 0.00 C ATOM 1881 CE2 PHE B 8 -18.303 4.231 6.795 1.00 0.00 C ATOM 1882 CZ PHE B 8 -17.153 4.355 6.007 1.00 0.00 C ATOM 0 H PHE B 8 -14.795 4.655 11.213 1.00 0.00 H new ATOM 0 HA PHE B 8 -15.686 6.949 9.571 1.00 0.00 H new ATOM 0 HB2 PHE B 8 -16.901 4.475 10.795 1.00 0.00 H new ATOM 0 HB3 PHE B 8 -17.964 5.835 10.495 1.00 0.00 H new ATOM 0 HD1 PHE B 8 -14.992 5.494 8.378 1.00 0.00 H new ATOM 0 HD2 PHE B 8 -19.146 4.467 8.762 1.00 0.00 H new ATOM 0 HE1 PHE B 8 -15.071 4.907 5.968 1.00 0.00 H new ATOM 0 HE2 PHE B 8 -19.224 3.879 6.355 1.00 0.00 H new ATOM 0 HZ PHE B 8 -17.187 4.099 4.958 1.00 0.00 H new ATOM 1892 N SER B 9 -15.252 7.568 12.465 1.00 0.00 N ATOM 1893 CA SER B 9 -15.529 8.453 13.630 1.00 0.00 C ATOM 1894 C SER B 9 -14.791 9.781 13.447 1.00 0.00 C ATOM 1895 O SER B 9 -15.307 10.716 12.867 1.00 0.00 O ATOM 1896 CB SER B 9 -15.046 7.775 14.912 1.00 0.00 C ATOM 1897 OG SER B 9 -16.067 6.915 15.401 1.00 0.00 O ATOM 0 H SER B 9 -14.287 7.248 12.384 1.00 0.00 H new ATOM 0 HA SER B 9 -16.601 8.638 13.699 1.00 0.00 H new ATOM 0 HB2 SER B 9 -14.138 7.205 14.716 1.00 0.00 H new ATOM 0 HB3 SER B 9 -14.796 8.525 15.662 1.00 0.00 H new ATOM 0 HG SER B 9 -15.760 6.477 16.222 1.00 0.00 H new ATOM 1903 N SER B 10 -13.584 9.874 13.937 1.00 0.00 N ATOM 1904 CA SER B 10 -12.814 11.141 13.790 1.00 0.00 C ATOM 1905 C SER B 10 -12.212 11.209 12.384 1.00 0.00 C ATOM 1906 O SER B 10 -12.567 10.444 11.511 1.00 0.00 O ATOM 1907 CB SER B 10 -11.692 11.180 14.827 1.00 0.00 C ATOM 1908 OG SER B 10 -10.876 10.026 14.680 1.00 0.00 O ATOM 0 H SER B 10 -13.098 9.126 14.433 1.00 0.00 H new ATOM 0 HA SER B 10 -13.479 11.991 13.944 1.00 0.00 H new ATOM 0 HB2 SER B 10 -11.093 12.082 14.698 1.00 0.00 H new ATOM 0 HB3 SER B 10 -12.112 11.217 15.832 1.00 0.00 H new ATOM 0 HG SER B 10 -10.154 10.049 15.343 1.00 0.00 H new ATOM 1914 N THR B 11 -11.307 12.121 12.157 1.00 0.00 N ATOM 1915 CA THR B 11 -10.689 12.237 10.811 1.00 0.00 C ATOM 1916 C THR B 11 -9.488 11.298 10.720 1.00 0.00 C ATOM 1917 O THR B 11 -9.197 10.739 9.682 1.00 0.00 O ATOM 1918 CB THR B 11 -10.237 13.683 10.590 1.00 0.00 C ATOM 1919 OG1 THR B 11 -11.375 14.504 10.364 1.00 0.00 O ATOM 1920 CG2 THR B 11 -9.310 13.751 9.379 1.00 0.00 C ATOM 0 H THR B 11 -10.970 12.791 12.848 1.00 0.00 H new ATOM 0 HA THR B 11 -11.415 11.963 10.045 1.00 0.00 H new ATOM 0 HB THR B 11 -9.703 14.035 11.473 1.00 0.00 H new ATOM 0 HG1 THR B 11 -11.087 15.430 10.224 1.00 0.00 H new ATOM 0 HG21 THR B 11 -8.990 14.781 9.224 1.00 0.00 H new ATOM 0 HG22 THR B 11 -8.437 13.122 9.553 1.00 0.00 H new ATOM 0 HG23 THR B 11 -9.841 13.399 8.494 1.00 0.00 H new ATOM 1928 N GLU B 12 -8.800 11.126 11.805 1.00 0.00 N ATOM 1929 CA GLU B 12 -7.609 10.225 11.817 1.00 0.00 C ATOM 1930 C GLU B 12 -6.636 10.634 10.709 1.00 0.00 C ATOM 1931 O GLU B 12 -6.905 10.469 9.536 1.00 0.00 O ATOM 1932 CB GLU B 12 -8.058 8.778 11.595 1.00 0.00 C ATOM 1933 CG GLU B 12 -7.551 7.906 12.747 1.00 0.00 C ATOM 1934 CD GLU B 12 -6.068 8.191 12.992 1.00 0.00 C ATOM 1935 OE1 GLU B 12 -5.250 7.604 12.304 1.00 0.00 O ATOM 1936 OE2 GLU B 12 -5.776 8.993 13.865 1.00 0.00 O ATOM 0 H GLU B 12 -9.009 11.573 12.698 1.00 0.00 H new ATOM 0 HA GLU B 12 -7.109 10.307 12.782 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -9.145 8.728 11.537 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -7.671 8.407 10.646 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -8.125 8.110 13.651 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -7.695 6.852 12.509 1.00 0.00 H new ATOM 1943 N LYS B 13 -5.501 11.167 11.072 1.00 0.00 N ATOM 1944 CA LYS B 13 -4.511 11.586 10.040 1.00 0.00 C ATOM 1945 C LYS B 13 -3.543 10.436 9.754 1.00 0.00 C ATOM 1946 O LYS B 13 -2.545 10.606 9.082 1.00 0.00 O ATOM 1947 CB LYS B 13 -3.724 12.795 10.549 1.00 0.00 C ATOM 1948 CG LYS B 13 -3.341 12.579 12.016 1.00 0.00 C ATOM 1949 CD LYS B 13 -1.878 12.980 12.237 1.00 0.00 C ATOM 1950 CE LYS B 13 -1.586 14.299 11.519 1.00 0.00 C ATOM 1951 NZ LYS B 13 -0.659 14.045 10.380 1.00 0.00 N ATOM 0 H LYS B 13 -5.217 11.330 12.038 1.00 0.00 H new ATOM 0 HA LYS B 13 -5.039 11.851 9.124 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -2.827 12.938 9.946 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -4.323 13.700 10.449 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -3.991 13.170 12.661 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -3.486 11.534 12.289 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -1.677 13.084 13.303 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -1.217 12.198 11.863 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -2.514 14.742 11.156 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -1.142 15.013 12.212 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -0.987 14.567 9.542 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 0.298 14.364 10.634 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -0.640 13.027 10.168 1.00 0.00 H new ATOM 1965 N ASN B 14 -3.825 9.268 10.260 1.00 0.00 N ATOM 1966 CA ASN B 14 -2.915 8.114 10.015 1.00 0.00 C ATOM 1967 C ASN B 14 -3.620 7.074 9.142 1.00 0.00 C ATOM 1968 O ASN B 14 -4.683 7.314 8.606 1.00 0.00 O ATOM 1969 CB ASN B 14 -2.527 7.477 11.351 1.00 0.00 C ATOM 1970 CG ASN B 14 -2.280 8.574 12.388 1.00 0.00 C ATOM 1971 OD1 ASN B 14 -2.115 9.727 12.044 1.00 0.00 O ATOM 1972 ND2 ASN B 14 -2.248 8.261 13.656 1.00 0.00 N ATOM 0 H ASN B 14 -4.644 9.062 10.832 1.00 0.00 H new ATOM 0 HA ASN B 14 -2.019 8.466 9.504 1.00 0.00 H new ATOM 0 HB2 ASN B 14 -3.320 6.811 11.692 1.00 0.00 H new ATOM 0 HB3 ASN B 14 -1.631 6.869 11.229 1.00 0.00 H new ATOM 0 HD21 ASN B 14 -2.085 8.985 14.356 1.00 0.00 H new ATOM 0 HD22 ASN B 14 -2.386 7.293 13.946 1.00 0.00 H new ATOM 1979 N CYS B 15 -3.034 5.916 9.002 1.00 0.00 N ATOM 1980 CA CYS B 15 -3.661 4.850 8.171 1.00 0.00 C ATOM 1981 C CYS B 15 -5.099 4.622 8.646 1.00 0.00 C ATOM 1982 O CYS B 15 -5.356 3.796 9.500 1.00 0.00 O ATOM 1983 CB CYS B 15 -2.847 3.559 8.323 1.00 0.00 C ATOM 1984 SG CYS B 15 -3.803 2.130 7.745 1.00 0.00 S ATOM 0 H CYS B 15 -2.144 5.662 9.430 1.00 0.00 H new ATOM 0 HA CYS B 15 -3.675 5.148 7.123 1.00 0.00 H new ATOM 0 HB2 CYS B 15 -1.921 3.638 7.754 1.00 0.00 H new ATOM 0 HB3 CYS B 15 -2.569 3.419 9.368 1.00 0.00 H new ATOM 1989 N CYS B 16 -6.039 5.344 8.099 1.00 0.00 N ATOM 1990 CA CYS B 16 -7.455 5.161 8.522 1.00 0.00 C ATOM 1991 C CYS B 16 -8.341 5.006 7.285 1.00 0.00 C ATOM 1992 O CYS B 16 -8.416 5.884 6.447 1.00 0.00 O ATOM 1993 CB CYS B 16 -7.911 6.380 9.327 1.00 0.00 C ATOM 1994 SG CYS B 16 -9.036 5.850 10.645 1.00 0.00 S ATOM 0 H CYS B 16 -5.887 6.051 7.379 1.00 0.00 H new ATOM 0 HA CYS B 16 -7.535 4.267 9.141 1.00 0.00 H new ATOM 0 HB2 CYS B 16 -7.048 6.890 9.755 1.00 0.00 H new ATOM 0 HB3 CYS B 16 -8.411 7.094 8.673 1.00 0.00 H new ATOM 1999 N VAL B 17 -9.011 3.895 7.163 1.00 0.00 N ATOM 2000 CA VAL B 17 -9.892 3.679 5.982 1.00 0.00 C ATOM 2001 C VAL B 17 -11.045 4.685 6.004 1.00 0.00 C ATOM 2002 O VAL B 17 -11.868 4.680 6.896 1.00 0.00 O ATOM 2003 CB VAL B 17 -10.463 2.262 6.031 1.00 0.00 C ATOM 2004 CG1 VAL B 17 -11.464 2.160 7.175 1.00 0.00 C ATOM 2005 CG2 VAL B 17 -11.182 1.953 4.720 1.00 0.00 C ATOM 0 H VAL B 17 -8.987 3.125 7.832 1.00 0.00 H new ATOM 0 HA VAL B 17 -9.310 3.814 5.070 1.00 0.00 H new ATOM 0 HB VAL B 17 -9.649 1.553 6.182 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -11.873 1.150 7.212 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -10.964 2.384 8.117 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -12.273 2.873 7.015 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -11.588 0.942 4.757 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -11.994 2.665 4.574 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -10.478 2.031 3.892 1.00 0.00 H new ATOM 2015 N ARG B 18 -11.119 5.545 5.027 1.00 0.00 N ATOM 2016 CA ARG B 18 -12.227 6.540 4.998 1.00 0.00 C ATOM 2017 C ARG B 18 -13.312 6.063 4.029 1.00 0.00 C ATOM 2018 O ARG B 18 -13.084 5.200 3.204 1.00 0.00 O ATOM 2019 CB ARG B 18 -11.682 7.894 4.540 1.00 0.00 C ATOM 2020 CG ARG B 18 -10.996 8.590 5.717 1.00 0.00 C ATOM 2021 CD ARG B 18 -10.275 9.843 5.218 1.00 0.00 C ATOM 2022 NE ARG B 18 -8.820 9.738 5.526 1.00 0.00 N ATOM 2023 CZ ARG B 18 -8.427 9.247 6.669 1.00 0.00 C ATOM 2024 NH1 ARG B 18 -9.209 9.315 7.711 1.00 0.00 N ATOM 2025 NH2 ARG B 18 -7.252 8.689 6.770 1.00 0.00 N ATOM 0 H ARG B 18 -10.462 5.602 4.249 1.00 0.00 H new ATOM 0 HA ARG B 18 -12.655 6.643 5.995 1.00 0.00 H new ATOM 0 HB2 ARG B 18 -10.975 7.756 3.722 1.00 0.00 H new ATOM 0 HB3 ARG B 18 -12.493 8.515 4.159 1.00 0.00 H new ATOM 0 HG2 ARG B 18 -11.733 8.859 6.474 1.00 0.00 H new ATOM 0 HG3 ARG B 18 -10.285 7.912 6.190 1.00 0.00 H new ATOM 0 HD2 ARG B 18 -10.423 9.956 4.144 1.00 0.00 H new ATOM 0 HD3 ARG B 18 -10.695 10.730 5.693 1.00 0.00 H new ATOM 0 HE ARG B 18 -8.131 10.051 4.842 1.00 0.00 H new ATOM 0 HH11 ARG B 18 -10.127 9.752 7.632 1.00 0.00 H new ATOM 0 HH12 ARG B 18 -8.902 8.931 8.605 1.00 0.00 H new ATOM 0 HH21 ARG B 18 -6.641 8.637 5.955 1.00 0.00 H new ATOM 0 HH22 ARG B 18 -6.945 8.305 7.664 1.00 0.00 H new ATOM 2039 N GLN B 19 -14.493 6.611 4.123 1.00 0.00 N ATOM 2040 CA GLN B 19 -15.591 6.183 3.207 1.00 0.00 C ATOM 2041 C GLN B 19 -15.227 6.539 1.765 1.00 0.00 C ATOM 2042 O GLN B 19 -14.693 7.596 1.492 1.00 0.00 O ATOM 2043 CB GLN B 19 -16.887 6.897 3.597 1.00 0.00 C ATOM 2044 CG GLN B 19 -16.724 8.404 3.390 1.00 0.00 C ATOM 2045 CD GLN B 19 -17.647 8.866 2.260 1.00 0.00 C ATOM 2046 OE1 GLN B 19 -17.603 8.335 1.169 1.00 0.00 O ATOM 2047 NE2 GLN B 19 -18.487 9.841 2.479 1.00 0.00 N ATOM 0 H GLN B 19 -14.746 7.336 4.794 1.00 0.00 H new ATOM 0 HA GLN B 19 -15.730 5.105 3.288 1.00 0.00 H new ATOM 0 HB2 GLN B 19 -17.715 6.524 2.994 1.00 0.00 H new ATOM 0 HB3 GLN B 19 -17.131 6.687 4.638 1.00 0.00 H new ATOM 0 HG2 GLN B 19 -16.964 8.936 4.310 1.00 0.00 H new ATOM 0 HG3 GLN B 19 -15.688 8.639 3.147 1.00 0.00 H new ATOM 0 HE21 GLN B 19 -18.523 10.287 3.396 1.00 0.00 H new ATOM 0 HE22 GLN B 19 -19.107 10.157 1.733 1.00 0.00 H new ATOM 2056 N LEU B 20 -15.512 5.665 0.837 1.00 0.00 N ATOM 2057 CA LEU B 20 -15.182 5.957 -0.587 1.00 0.00 C ATOM 2058 C LEU B 20 -16.258 5.376 -1.498 1.00 0.00 C ATOM 2059 O LEU B 20 -15.958 4.724 -2.479 1.00 0.00 O ATOM 2060 CB LEU B 20 -13.837 5.325 -0.945 1.00 0.00 C ATOM 2061 CG LEU B 20 -13.412 5.772 -2.346 1.00 0.00 C ATOM 2062 CD1 LEU B 20 -13.477 7.297 -2.439 1.00 0.00 C ATOM 2063 CD2 LEU B 20 -11.981 5.309 -2.617 1.00 0.00 C ATOM 0 H LEU B 20 -15.958 4.763 1.004 1.00 0.00 H new ATOM 0 HA LEU B 20 -15.131 7.037 -0.722 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -13.082 5.617 -0.215 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -13.914 4.238 -0.907 1.00 0.00 H new ATOM 0 HG LEU B 20 -14.084 5.334 -3.084 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -13.174 7.614 -3.437 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -14.497 7.630 -2.246 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -12.806 7.735 -1.700 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -11.678 5.627 -3.615 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -11.311 5.747 -1.877 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -11.932 4.222 -2.552 1.00 0.00 H new ATOM 2075 N TYR B 21 -17.507 5.596 -1.200 1.00 0.00 N ATOM 2076 CA TYR B 21 -18.563 5.039 -2.086 1.00 0.00 C ATOM 2077 C TYR B 21 -18.203 5.367 -3.530 1.00 0.00 C ATOM 2078 O TYR B 21 -17.868 6.488 -3.857 1.00 0.00 O ATOM 2079 CB TYR B 21 -19.923 5.654 -1.761 1.00 0.00 C ATOM 2080 CG TYR B 21 -20.934 5.166 -2.775 1.00 0.00 C ATOM 2081 CD1 TYR B 21 -20.925 5.678 -4.082 1.00 0.00 C ATOM 2082 CD2 TYR B 21 -21.876 4.199 -2.411 1.00 0.00 C ATOM 2083 CE1 TYR B 21 -21.860 5.222 -5.021 1.00 0.00 C ATOM 2084 CE2 TYR B 21 -22.813 3.745 -3.348 1.00 0.00 C ATOM 2085 CZ TYR B 21 -22.805 4.256 -4.652 1.00 0.00 C ATOM 2086 OH TYR B 21 -23.729 3.807 -5.574 1.00 0.00 O ATOM 0 H TYR B 21 -17.838 6.128 -0.395 1.00 0.00 H new ATOM 0 HA TYR B 21 -18.624 3.961 -1.935 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -20.233 5.374 -0.754 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -19.860 6.742 -1.784 1.00 0.00 H new ATOM 0 HD1 TYR B 21 -20.197 6.424 -4.364 1.00 0.00 H new ATOM 0 HD2 TYR B 21 -21.881 3.802 -1.407 1.00 0.00 H new ATOM 0 HE1 TYR B 21 -21.852 5.615 -6.027 1.00 0.00 H new ATOM 0 HE2 TYR B 21 -23.542 3.000 -3.065 1.00 0.00 H new ATOM 0 HH TYR B 21 -24.310 3.138 -5.156 1.00 0.00 H new ATOM 2096 N ILE B 22 -18.270 4.404 -4.398 1.00 0.00 N ATOM 2097 CA ILE B 22 -17.935 4.671 -5.818 1.00 0.00 C ATOM 2098 C ILE B 22 -19.153 4.365 -6.681 1.00 0.00 C ATOM 2099 O ILE B 22 -19.576 3.232 -6.801 1.00 0.00 O ATOM 2100 CB ILE B 22 -16.762 3.789 -6.249 1.00 0.00 C ATOM 2101 CG1 ILE B 22 -15.541 4.110 -5.381 1.00 0.00 C ATOM 2102 CG2 ILE B 22 -16.433 4.069 -7.717 1.00 0.00 C ATOM 2103 CD1 ILE B 22 -14.283 3.519 -6.021 1.00 0.00 C ATOM 0 H ILE B 22 -18.542 3.444 -4.186 1.00 0.00 H new ATOM 0 HA ILE B 22 -17.653 5.717 -5.937 1.00 0.00 H new ATOM 0 HB ILE B 22 -17.028 2.739 -6.129 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -15.433 5.189 -5.273 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -15.677 3.702 -4.380 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -15.597 3.442 -8.028 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -17.303 3.846 -8.334 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -16.164 5.118 -7.836 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -13.417 3.749 -5.401 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -14.391 2.438 -6.106 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -14.143 3.948 -7.013 1.00 0.00 H new ATOM 2115 N ASP B 23 -19.721 5.367 -7.285 1.00 0.00 N ATOM 2116 CA ASP B 23 -20.908 5.140 -8.140 1.00 0.00 C ATOM 2117 C ASP B 23 -20.432 4.714 -9.527 1.00 0.00 C ATOM 2118 O ASP B 23 -20.206 5.527 -10.394 1.00 0.00 O ATOM 2119 CB ASP B 23 -21.757 6.415 -8.236 1.00 0.00 C ATOM 2120 CG ASP B 23 -21.253 7.499 -7.272 1.00 0.00 C ATOM 2121 OD1 ASP B 23 -20.233 8.102 -7.564 1.00 0.00 O ATOM 2122 OD2 ASP B 23 -21.899 7.707 -6.258 1.00 0.00 O ATOM 0 H ASP B 23 -19.411 6.337 -7.221 1.00 0.00 H new ATOM 0 HA ASP B 23 -21.530 4.358 -7.704 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -21.732 6.794 -9.258 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -22.797 6.179 -8.009 1.00 0.00 H new ATOM 2127 N PHE B 24 -20.270 3.427 -9.702 1.00 0.00 N ATOM 2128 CA PHE B 24 -19.793 2.835 -10.995 1.00 0.00 C ATOM 2129 C PHE B 24 -19.662 3.869 -12.119 1.00 0.00 C ATOM 2130 O PHE B 24 -18.588 4.088 -12.639 1.00 0.00 O ATOM 2131 CB PHE B 24 -20.777 1.749 -11.433 1.00 0.00 C ATOM 2132 CG PHE B 24 -20.345 0.427 -10.848 1.00 0.00 C ATOM 2133 CD1 PHE B 24 -19.117 -0.129 -11.219 1.00 0.00 C ATOM 2134 CD2 PHE B 24 -21.166 -0.235 -9.930 1.00 0.00 C ATOM 2135 CE1 PHE B 24 -18.709 -1.349 -10.670 1.00 0.00 C ATOM 2136 CE2 PHE B 24 -20.757 -1.457 -9.385 1.00 0.00 C ATOM 2137 CZ PHE B 24 -19.530 -2.012 -9.755 1.00 0.00 C ATOM 0 H PHE B 24 -20.455 2.735 -8.976 1.00 0.00 H new ATOM 0 HA PHE B 24 -18.798 2.427 -10.816 1.00 0.00 H new ATOM 0 HB2 PHE B 24 -21.784 1.997 -11.099 1.00 0.00 H new ATOM 0 HB3 PHE B 24 -20.809 1.687 -12.521 1.00 0.00 H new ATOM 0 HD1 PHE B 24 -18.484 0.383 -11.929 1.00 0.00 H new ATOM 0 HD2 PHE B 24 -22.114 0.196 -9.642 1.00 0.00 H new ATOM 0 HE1 PHE B 24 -17.759 -1.778 -10.954 1.00 0.00 H new ATOM 0 HE2 PHE B 24 -21.391 -1.971 -8.678 1.00 0.00 H new ATOM 0 HZ PHE B 24 -19.216 -2.955 -9.333 1.00 0.00 H new ATOM 2147 N ARG B 25 -20.739 4.482 -12.525 1.00 0.00 N ATOM 2148 CA ARG B 25 -20.645 5.460 -13.653 1.00 0.00 C ATOM 2149 C ARG B 25 -20.445 6.894 -13.150 1.00 0.00 C ATOM 2150 O ARG B 25 -19.791 7.690 -13.792 1.00 0.00 O ATOM 2151 CB ARG B 25 -21.914 5.400 -14.512 1.00 0.00 C ATOM 2152 CG ARG B 25 -23.117 4.998 -13.656 1.00 0.00 C ATOM 2153 CD ARG B 25 -24.410 5.192 -14.457 1.00 0.00 C ATOM 2154 NE ARG B 25 -24.139 4.990 -15.910 1.00 0.00 N ATOM 2155 CZ ARG B 25 -24.929 4.234 -16.622 1.00 0.00 C ATOM 2156 NH1 ARG B 25 -26.133 4.642 -16.915 1.00 0.00 N ATOM 2157 NH2 ARG B 25 -24.514 3.070 -17.044 1.00 0.00 N ATOM 0 H ARG B 25 -21.671 4.353 -12.132 1.00 0.00 H new ATOM 0 HA ARG B 25 -19.776 5.183 -14.250 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -22.095 6.371 -14.973 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -21.779 4.683 -15.322 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -23.023 3.957 -13.346 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -23.147 5.600 -12.748 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -25.168 4.486 -14.118 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -24.807 6.193 -14.287 1.00 0.00 H new ATOM 0 HE ARG B 25 -23.336 5.443 -16.347 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -26.457 5.552 -16.588 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -26.750 4.051 -17.472 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -23.572 2.751 -16.817 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -25.132 2.479 -17.601 1.00 0.00 H new ATOM 2171 N LYS B 26 -21.005 7.249 -12.030 1.00 0.00 N ATOM 2172 CA LYS B 26 -20.832 8.649 -11.546 1.00 0.00 C ATOM 2173 C LYS B 26 -19.354 8.927 -11.265 1.00 0.00 C ATOM 2174 O LYS B 26 -18.801 9.913 -11.709 1.00 0.00 O ATOM 2175 CB LYS B 26 -21.627 8.845 -10.259 1.00 0.00 C ATOM 2176 CG LYS B 26 -22.105 10.295 -10.164 1.00 0.00 C ATOM 2177 CD LYS B 26 -22.123 10.730 -8.697 1.00 0.00 C ATOM 2178 CE LYS B 26 -22.515 12.206 -8.606 1.00 0.00 C ATOM 2179 NZ LYS B 26 -21.819 12.833 -7.446 1.00 0.00 N ATOM 0 H LYS B 26 -21.568 6.642 -11.434 1.00 0.00 H new ATOM 0 HA LYS B 26 -21.191 9.335 -12.313 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -22.481 8.168 -10.241 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -21.008 8.599 -9.397 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -21.446 10.945 -10.739 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -23.102 10.390 -10.595 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -22.830 10.120 -8.135 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -21.141 10.575 -8.249 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -22.247 12.722 -9.528 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -23.595 12.300 -8.491 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -22.085 13.837 -7.383 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -22.096 12.346 -6.570 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -20.790 12.755 -7.575 1.00 0.00 H new ATOM 2193 N ASP B 27 -18.720 8.078 -10.507 1.00 0.00 N ATOM 2194 CA ASP B 27 -17.291 8.295 -10.164 1.00 0.00 C ATOM 2195 C ASP B 27 -16.360 7.626 -11.187 1.00 0.00 C ATOM 2196 O ASP B 27 -15.456 8.250 -11.708 1.00 0.00 O ATOM 2197 CB ASP B 27 -17.039 7.704 -8.782 1.00 0.00 C ATOM 2198 CG ASP B 27 -17.274 8.776 -7.717 1.00 0.00 C ATOM 2199 OD1 ASP B 27 -16.782 9.878 -7.895 1.00 0.00 O ATOM 2200 OD2 ASP B 27 -17.944 8.477 -6.742 1.00 0.00 O ATOM 0 H ASP B 27 -19.136 7.236 -10.108 1.00 0.00 H new ATOM 0 HA ASP B 27 -17.081 9.364 -10.175 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -17.702 6.856 -8.611 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -16.018 7.329 -8.716 1.00 0.00 H new ATOM 2205 N LEU B 28 -16.552 6.364 -11.465 1.00 0.00 N ATOM 2206 CA LEU B 28 -15.648 5.674 -12.436 1.00 0.00 C ATOM 2207 C LEU B 28 -16.179 5.828 -13.861 1.00 0.00 C ATOM 2208 O LEU B 28 -15.432 5.756 -14.818 1.00 0.00 O ATOM 2209 CB LEU B 28 -15.579 4.183 -12.103 1.00 0.00 C ATOM 2210 CG LEU B 28 -15.032 3.993 -10.692 1.00 0.00 C ATOM 2211 CD1 LEU B 28 -14.778 2.503 -10.448 1.00 0.00 C ATOM 2212 CD2 LEU B 28 -13.719 4.764 -10.546 1.00 0.00 C ATOM 0 H LEU B 28 -17.289 5.783 -11.066 1.00 0.00 H new ATOM 0 HA LEU B 28 -14.658 6.125 -12.365 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -16.571 3.737 -12.181 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -14.941 3.670 -12.822 1.00 0.00 H new ATOM 0 HG LEU B 28 -15.754 4.366 -9.965 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -14.387 2.361 -9.441 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -15.712 1.952 -10.555 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -14.054 2.134 -11.174 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -13.328 4.629 -9.538 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -12.995 4.390 -11.270 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -13.898 5.824 -10.726 1.00 0.00 H new ATOM 2224 N GLY B 29 -17.455 6.020 -14.019 1.00 0.00 N ATOM 2225 CA GLY B 29 -18.010 6.154 -15.396 1.00 0.00 C ATOM 2226 C GLY B 29 -17.972 4.785 -16.079 1.00 0.00 C ATOM 2227 O GLY B 29 -18.198 4.662 -17.266 1.00 0.00 O ATOM 0 H GLY B 29 -18.136 6.090 -13.263 1.00 0.00 H new ATOM 0 HA2 GLY B 29 -19.033 6.527 -15.356 1.00 0.00 H new ATOM 0 HA3 GLY B 29 -17.429 6.877 -15.968 1.00 0.00 H new ATOM 2231 N TRP B 30 -17.681 3.753 -15.331 1.00 0.00 N ATOM 2232 CA TRP B 30 -17.618 2.387 -15.917 1.00 0.00 C ATOM 2233 C TRP B 30 -18.813 2.166 -16.843 1.00 0.00 C ATOM 2234 O TRP B 30 -19.951 2.360 -16.465 1.00 0.00 O ATOM 2235 CB TRP B 30 -17.659 1.353 -14.790 1.00 0.00 C ATOM 2236 CG TRP B 30 -16.272 1.090 -14.302 1.00 0.00 C ATOM 2237 CD1 TRP B 30 -15.189 1.849 -14.586 1.00 0.00 C ATOM 2238 CD2 TRP B 30 -15.801 0.008 -13.450 1.00 0.00 C ATOM 2239 NE1 TRP B 30 -14.084 1.300 -13.962 1.00 0.00 N ATOM 2240 CE2 TRP B 30 -14.410 0.164 -13.250 1.00 0.00 C ATOM 2241 CE3 TRP B 30 -16.441 -1.084 -12.838 1.00 0.00 C ATOM 2242 CZ2 TRP B 30 -13.678 -0.733 -12.471 1.00 0.00 C ATOM 2243 CZ3 TRP B 30 -15.708 -1.988 -12.053 1.00 0.00 C ATOM 2244 CH2 TRP B 30 -14.330 -1.813 -11.870 1.00 0.00 C ATOM 0 H TRP B 30 -17.483 3.801 -14.332 1.00 0.00 H new ATOM 0 HA TRP B 30 -16.694 2.281 -16.486 1.00 0.00 H new ATOM 0 HB2 TRP B 30 -18.281 1.716 -13.972 1.00 0.00 H new ATOM 0 HB3 TRP B 30 -18.111 0.428 -15.148 1.00 0.00 H new ATOM 0 HD1 TRP B 30 -15.188 2.738 -15.199 1.00 0.00 H new ATOM 0 HE1 TRP B 30 -13.142 1.688 -14.021 1.00 0.00 H new ATOM 0 HE3 TRP B 30 -17.503 -1.228 -12.973 1.00 0.00 H new ATOM 0 HZ2 TRP B 30 -12.616 -0.594 -12.334 1.00 0.00 H new ATOM 0 HZ3 TRP B 30 -16.209 -2.824 -11.587 1.00 0.00 H new ATOM 0 HH2 TRP B 30 -13.772 -2.512 -11.265 1.00 0.00 H new ATOM 2255 N LYS B 31 -18.559 1.762 -18.054 1.00 0.00 N ATOM 2256 CA LYS B 31 -19.660 1.526 -19.012 1.00 0.00 C ATOM 2257 C LYS B 31 -19.843 0.022 -19.216 1.00 0.00 C ATOM 2258 O LYS B 31 -20.801 -0.420 -19.817 1.00 0.00 O ATOM 2259 CB LYS B 31 -19.284 2.173 -20.337 1.00 0.00 C ATOM 2260 CG LYS B 31 -19.804 3.611 -20.375 1.00 0.00 C ATOM 2261 CD LYS B 31 -20.071 4.019 -21.825 1.00 0.00 C ATOM 2262 CE LYS B 31 -20.816 5.355 -21.850 1.00 0.00 C ATOM 2263 NZ LYS B 31 -20.755 5.932 -23.223 1.00 0.00 N ATOM 0 H LYS B 31 -17.624 1.585 -18.421 1.00 0.00 H new ATOM 0 HA LYS B 31 -20.589 1.951 -18.633 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -18.201 2.164 -20.463 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -19.705 1.602 -21.164 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -20.719 3.694 -19.788 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -19.075 4.285 -19.925 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -19.130 4.105 -22.369 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -20.661 3.252 -22.327 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -21.854 5.210 -21.550 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -20.371 6.045 -21.134 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -21.261 6.840 -23.241 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -19.762 6.084 -23.492 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -21.199 5.275 -23.896 1.00 0.00 H new ATOM 2277 N TRP B 32 -18.923 -0.768 -18.732 1.00 0.00 N ATOM 2278 CA TRP B 32 -19.042 -2.241 -18.915 1.00 0.00 C ATOM 2279 C TRP B 32 -19.872 -2.850 -17.785 1.00 0.00 C ATOM 2280 O TRP B 32 -20.056 -4.046 -17.721 1.00 0.00 O ATOM 2281 CB TRP B 32 -17.649 -2.874 -18.926 1.00 0.00 C ATOM 2282 CG TRP B 32 -17.102 -2.948 -17.532 1.00 0.00 C ATOM 2283 CD1 TRP B 32 -16.551 -1.915 -16.860 1.00 0.00 C ATOM 2284 CD2 TRP B 32 -17.045 -4.094 -16.634 1.00 0.00 C ATOM 2285 NE1 TRP B 32 -16.144 -2.354 -15.617 1.00 0.00 N ATOM 2286 CE2 TRP B 32 -16.428 -3.690 -15.428 1.00 0.00 C ATOM 2287 CE3 TRP B 32 -17.462 -5.431 -16.749 1.00 0.00 C ATOM 2288 CZ2 TRP B 32 -16.227 -4.581 -14.374 1.00 0.00 C ATOM 2289 CZ3 TRP B 32 -17.266 -6.333 -15.689 1.00 0.00 C ATOM 2290 CH2 TRP B 32 -16.647 -5.907 -14.504 1.00 0.00 C ATOM 0 H TRP B 32 -18.097 -0.458 -18.220 1.00 0.00 H new ATOM 0 HA TRP B 32 -19.539 -2.438 -19.865 1.00 0.00 H new ATOM 0 HB2 TRP B 32 -17.699 -3.873 -19.358 1.00 0.00 H new ATOM 0 HB3 TRP B 32 -16.980 -2.288 -19.556 1.00 0.00 H new ATOM 0 HD1 TRP B 32 -16.446 -0.908 -17.235 1.00 0.00 H new ATOM 0 HE1 TRP B 32 -15.688 -1.762 -14.922 1.00 0.00 H new ATOM 0 HE3 TRP B 32 -17.937 -5.768 -17.659 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 -15.750 -4.248 -13.464 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 -17.593 -7.358 -15.787 1.00 0.00 H new ATOM 0 HH2 TRP B 32 -16.495 -6.604 -13.693 1.00 0.00 H new ATOM 2301 N ILE B 33 -20.372 -2.044 -16.890 1.00 0.00 N ATOM 2302 CA ILE B 33 -21.181 -2.600 -15.772 1.00 0.00 C ATOM 2303 C ILE B 33 -22.512 -1.848 -15.668 1.00 0.00 C ATOM 2304 O ILE B 33 -22.555 -0.633 -15.644 1.00 0.00 O ATOM 2305 CB ILE B 33 -20.395 -2.469 -14.461 1.00 0.00 C ATOM 2306 CG1 ILE B 33 -19.414 -3.632 -14.358 1.00 0.00 C ATOM 2307 CG2 ILE B 33 -21.345 -2.508 -13.260 1.00 0.00 C ATOM 2308 CD1 ILE B 33 -18.555 -3.471 -13.107 1.00 0.00 C ATOM 0 H ILE B 33 -20.256 -1.031 -16.885 1.00 0.00 H new ATOM 0 HA ILE B 33 -21.389 -3.653 -15.962 1.00 0.00 H new ATOM 0 HB ILE B 33 -19.862 -1.518 -14.458 1.00 0.00 H new ATOM 0 HG12 ILE B 33 -19.957 -4.576 -14.319 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -18.780 -3.665 -15.244 1.00 0.00 H new ATOM 0 HG21 ILE B 33 -20.771 -2.414 -12.338 1.00 0.00 H new ATOM 0 HG22 ILE B 33 -22.055 -1.684 -13.331 1.00 0.00 H new ATOM 0 HG23 ILE B 33 -21.886 -3.454 -13.255 1.00 0.00 H new ATOM 0 HD11 ILE B 33 -17.855 -4.304 -13.037 1.00 0.00 H new ATOM 0 HD12 ILE B 33 -18.000 -2.535 -13.165 1.00 0.00 H new ATOM 0 HD13 ILE B 33 -19.195 -3.460 -12.225 1.00 0.00 H new ATOM 2320 N HIS B 34 -23.594 -2.569 -15.596 1.00 0.00 N ATOM 2321 CA HIS B 34 -24.928 -1.918 -15.482 1.00 0.00 C ATOM 2322 C HIS B 34 -25.320 -1.836 -14.003 1.00 0.00 C ATOM 2323 O HIS B 34 -25.622 -0.777 -13.488 1.00 0.00 O ATOM 2324 CB HIS B 34 -25.964 -2.749 -16.250 1.00 0.00 C ATOM 2325 CG HIS B 34 -27.354 -2.366 -15.818 1.00 0.00 C ATOM 2326 ND1 HIS B 34 -27.794 -1.052 -15.818 1.00 0.00 N ATOM 2327 CD2 HIS B 34 -28.412 -3.115 -15.365 1.00 0.00 C ATOM 2328 CE1 HIS B 34 -29.066 -1.049 -15.378 1.00 0.00 C ATOM 2329 NE2 HIS B 34 -29.491 -2.282 -15.088 1.00 0.00 N ATOM 0 H HIS B 34 -23.612 -3.589 -15.611 1.00 0.00 H new ATOM 0 HA HIS B 34 -24.890 -0.913 -15.903 1.00 0.00 H new ATOM 0 HB2 HIS B 34 -25.850 -2.587 -17.322 1.00 0.00 H new ATOM 0 HB3 HIS B 34 -25.798 -3.811 -16.068 1.00 0.00 H new ATOM 0 HD2 HIS B 34 -28.407 -4.188 -15.242 1.00 0.00 H new ATOM 0 HE1 HIS B 34 -29.669 -0.159 -15.272 1.00 0.00 H new ATOM 0 HE2 HIS B 34 -30.410 -2.554 -14.738 1.00 0.00 H new ATOM 2337 N GLU B 35 -25.316 -2.947 -13.317 1.00 0.00 N ATOM 2338 CA GLU B 35 -25.686 -2.933 -11.873 1.00 0.00 C ATOM 2339 C GLU B 35 -24.607 -3.659 -11.062 1.00 0.00 C ATOM 2340 O GLU B 35 -23.899 -4.497 -11.587 1.00 0.00 O ATOM 2341 CB GLU B 35 -27.030 -3.639 -11.683 1.00 0.00 C ATOM 2342 CG GLU B 35 -28.166 -2.633 -11.875 1.00 0.00 C ATOM 2343 CD GLU B 35 -29.400 -3.098 -11.102 1.00 0.00 C ATOM 2344 OE1 GLU B 35 -30.067 -4.002 -11.580 1.00 0.00 O ATOM 2345 OE2 GLU B 35 -29.658 -2.544 -10.047 1.00 0.00 O ATOM 0 H GLU B 35 -25.073 -3.863 -13.694 1.00 0.00 H new ATOM 0 HA GLU B 35 -25.767 -1.902 -11.529 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -27.128 -4.456 -12.398 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -27.084 -4.079 -10.687 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -27.856 -1.648 -11.526 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -28.404 -2.535 -12.934 1.00 0.00 H new ATOM 2352 N PRO B 36 -24.510 -3.308 -9.805 1.00 0.00 N ATOM 2353 CA PRO B 36 -25.374 -2.290 -9.183 1.00 0.00 C ATOM 2354 C PRO B 36 -24.939 -0.888 -9.608 1.00 0.00 C ATOM 2355 O PRO B 36 -23.909 -0.706 -10.224 1.00 0.00 O ATOM 2356 CB PRO B 36 -25.159 -2.503 -7.681 1.00 0.00 C ATOM 2357 CG PRO B 36 -23.798 -3.222 -7.535 1.00 0.00 C ATOM 2358 CD PRO B 36 -23.512 -3.897 -8.889 1.00 0.00 C ATOM 0 HA PRO B 36 -26.421 -2.380 -9.473 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -25.155 -1.551 -7.150 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -25.963 -3.102 -7.254 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -23.010 -2.513 -7.281 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -23.833 -3.960 -6.734 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -22.495 -3.698 -9.227 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -23.620 -4.980 -8.825 1.00 0.00 H new ATOM 2366 N LYS B 37 -25.717 0.105 -9.281 1.00 0.00 N ATOM 2367 CA LYS B 37 -25.359 1.491 -9.658 1.00 0.00 C ATOM 2368 C LYS B 37 -24.008 1.852 -9.043 1.00 0.00 C ATOM 2369 O LYS B 37 -23.207 2.546 -9.637 1.00 0.00 O ATOM 2370 CB LYS B 37 -26.436 2.423 -9.116 1.00 0.00 C ATOM 2371 CG LYS B 37 -27.532 2.607 -10.167 1.00 0.00 C ATOM 2372 CD LYS B 37 -28.562 3.619 -9.663 1.00 0.00 C ATOM 2373 CE LYS B 37 -28.325 4.969 -10.341 1.00 0.00 C ATOM 2374 NZ LYS B 37 -27.192 5.667 -9.672 1.00 0.00 N ATOM 0 H LYS B 37 -26.592 0.010 -8.765 1.00 0.00 H new ATOM 0 HA LYS B 37 -25.290 1.586 -10.742 1.00 0.00 H new ATOM 0 HB2 LYS B 37 -26.861 2.011 -8.201 1.00 0.00 H new ATOM 0 HB3 LYS B 37 -26.000 3.388 -8.858 1.00 0.00 H new ATOM 0 HG2 LYS B 37 -27.096 2.953 -11.105 1.00 0.00 H new ATOM 0 HG3 LYS B 37 -28.016 1.652 -10.373 1.00 0.00 H new ATOM 0 HD2 LYS B 37 -29.570 3.265 -9.877 1.00 0.00 H new ATOM 0 HD3 LYS B 37 -28.484 3.725 -8.581 1.00 0.00 H new ATOM 0 HE2 LYS B 37 -28.103 4.823 -11.398 1.00 0.00 H new ATOM 0 HE3 LYS B 37 -29.226 5.579 -10.285 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 -27.199 6.673 -9.937 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 -27.291 5.580 -8.640 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 -26.294 5.237 -9.971 1.00 0.00 H new ATOM 2388 N GLY B 38 -23.751 1.382 -7.856 1.00 0.00 N ATOM 2389 CA GLY B 38 -22.452 1.692 -7.192 1.00 0.00 C ATOM 2390 C GLY B 38 -22.248 0.752 -6.004 1.00 0.00 C ATOM 2391 O GLY B 38 -22.864 -0.292 -5.914 1.00 0.00 O ATOM 0 H GLY B 38 -24.385 0.795 -7.314 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -21.633 1.580 -7.902 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -22.442 2.728 -6.855 1.00 0.00 H new ATOM 2395 N TYR B 39 -21.388 1.110 -5.089 1.00 0.00 N ATOM 2396 CA TYR B 39 -21.151 0.229 -3.911 1.00 0.00 C ATOM 2397 C TYR B 39 -20.199 0.919 -2.929 1.00 0.00 C ATOM 2398 O TYR B 39 -19.635 1.954 -3.220 1.00 0.00 O ATOM 2399 CB TYR B 39 -20.537 -1.095 -4.382 1.00 0.00 C ATOM 2400 CG TYR B 39 -19.074 -0.900 -4.715 1.00 0.00 C ATOM 2401 CD1 TYR B 39 -18.699 -0.150 -5.838 1.00 0.00 C ATOM 2402 CD2 TYR B 39 -18.091 -1.473 -3.900 1.00 0.00 C ATOM 2403 CE1 TYR B 39 -17.345 0.025 -6.144 1.00 0.00 C ATOM 2404 CE2 TYR B 39 -16.738 -1.297 -4.207 1.00 0.00 C ATOM 2405 CZ TYR B 39 -16.364 -0.549 -5.328 1.00 0.00 C ATOM 2406 OH TYR B 39 -15.029 -0.377 -5.630 1.00 0.00 O ATOM 0 H TYR B 39 -20.842 1.971 -5.106 1.00 0.00 H new ATOM 0 HA TYR B 39 -22.099 0.033 -3.409 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -20.643 -1.851 -3.604 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -21.072 -1.462 -5.258 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -19.456 0.293 -6.468 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -18.377 -2.051 -3.034 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -17.057 0.603 -7.010 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -15.980 -1.740 -3.577 1.00 0.00 H new ATOM 0 HH TYR B 39 -14.759 -1.035 -6.304 1.00 0.00 H new ATOM 2416 N HIS B 40 -20.012 0.347 -1.770 1.00 0.00 N ATOM 2417 CA HIS B 40 -19.091 0.964 -0.774 1.00 0.00 C ATOM 2418 C HIS B 40 -17.669 0.465 -1.037 1.00 0.00 C ATOM 2419 O HIS B 40 -17.225 -0.505 -0.455 1.00 0.00 O ATOM 2420 CB HIS B 40 -19.521 0.562 0.638 1.00 0.00 C ATOM 2421 CG HIS B 40 -20.871 1.154 0.939 1.00 0.00 C ATOM 2422 ND1 HIS B 40 -22.047 0.598 0.462 1.00 0.00 N ATOM 2423 CD2 HIS B 40 -21.246 2.254 1.671 1.00 0.00 C ATOM 2424 CE1 HIS B 40 -23.065 1.357 0.908 1.00 0.00 C ATOM 2425 NE2 HIS B 40 -22.632 2.379 1.650 1.00 0.00 N ATOM 0 H HIS B 40 -20.457 -0.520 -1.470 1.00 0.00 H new ATOM 0 HA HIS B 40 -19.124 2.050 -0.864 1.00 0.00 H new ATOM 0 HB2 HIS B 40 -19.561 -0.524 0.722 1.00 0.00 H new ATOM 0 HB3 HIS B 40 -18.789 0.911 1.366 1.00 0.00 H new ATOM 0 HD2 HIS B 40 -20.569 2.920 2.185 1.00 0.00 H new ATOM 0 HE1 HIS B 40 -24.105 1.163 0.692 1.00 0.00 H new ATOM 0 HE2 HIS B 40 -23.196 3.097 2.104 1.00 0.00 H new ATOM 2433 N ALA B 41 -16.958 1.111 -1.918 1.00 0.00 N ATOM 2434 CA ALA B 41 -15.570 0.665 -2.227 1.00 0.00 C ATOM 2435 C ALA B 41 -14.640 0.993 -1.055 1.00 0.00 C ATOM 2436 O ALA B 41 -13.697 0.277 -0.784 1.00 0.00 O ATOM 2437 CB ALA B 41 -15.081 1.371 -3.492 1.00 0.00 C ATOM 0 H ALA B 41 -17.277 1.928 -2.438 1.00 0.00 H new ATOM 0 HA ALA B 41 -15.565 -0.413 -2.387 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -14.066 1.047 -3.720 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -15.738 1.121 -4.325 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -15.090 2.449 -3.334 1.00 0.00 H new ATOM 2443 N ASN B 42 -14.896 2.064 -0.354 1.00 0.00 N ATOM 2444 CA ASN B 42 -14.020 2.421 0.799 1.00 0.00 C ATOM 2445 C ASN B 42 -12.574 2.563 0.320 1.00 0.00 C ATOM 2446 O ASN B 42 -12.271 2.355 -0.838 1.00 0.00 O ATOM 2447 CB ASN B 42 -14.095 1.315 1.853 1.00 0.00 C ATOM 2448 CG ASN B 42 -15.181 1.655 2.876 1.00 0.00 C ATOM 2449 OD1 ASN B 42 -15.387 2.807 3.202 1.00 0.00 O ATOM 2450 ND2 ASN B 42 -15.890 0.692 3.400 1.00 0.00 N ATOM 0 H ASN B 42 -15.670 2.705 -0.528 1.00 0.00 H new ATOM 0 HA ASN B 42 -14.355 3.365 1.230 1.00 0.00 H new ATOM 0 HB2 ASN B 42 -14.316 0.359 1.377 1.00 0.00 H new ATOM 0 HB3 ASN B 42 -13.132 1.208 2.352 1.00 0.00 H new ATOM 0 HD21 ASN B 42 -16.617 0.907 4.083 1.00 0.00 H new ATOM 0 HD22 ASN B 42 -15.717 -0.275 3.127 1.00 0.00 H new ATOM 2457 N PHE B 43 -11.673 2.904 1.204 1.00 0.00 N ATOM 2458 CA PHE B 43 -10.245 3.047 0.799 1.00 0.00 C ATOM 2459 C PHE B 43 -9.412 3.479 2.001 1.00 0.00 C ATOM 2460 O PHE B 43 -9.883 3.486 3.118 1.00 0.00 O ATOM 2461 CB PHE B 43 -10.108 4.073 -0.330 1.00 0.00 C ATOM 2462 CG PHE B 43 -10.264 5.482 0.191 1.00 0.00 C ATOM 2463 CD1 PHE B 43 -11.276 5.802 1.103 1.00 0.00 C ATOM 2464 CD2 PHE B 43 -9.397 6.482 -0.266 1.00 0.00 C ATOM 2465 CE1 PHE B 43 -11.420 7.118 1.555 1.00 0.00 C ATOM 2466 CE2 PHE B 43 -9.540 7.793 0.188 1.00 0.00 C ATOM 2467 CZ PHE B 43 -10.552 8.113 1.098 1.00 0.00 C ATOM 0 H PHE B 43 -11.865 3.089 2.188 1.00 0.00 H new ATOM 0 HA PHE B 43 -9.884 2.085 0.437 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -9.134 3.965 -0.807 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -10.861 3.880 -1.094 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -11.946 5.033 1.458 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -8.616 6.238 -0.971 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -12.202 7.365 2.257 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -8.868 8.562 -0.164 1.00 0.00 H new ATOM 0 HZ PHE B 43 -10.663 9.129 1.448 1.00 0.00 H new ATOM 2477 N CYS B 44 -8.171 3.823 1.788 1.00 0.00 N ATOM 2478 CA CYS B 44 -7.314 4.231 2.937 1.00 0.00 C ATOM 2479 C CYS B 44 -6.539 5.502 2.581 1.00 0.00 C ATOM 2480 O CYS B 44 -6.178 5.723 1.442 1.00 0.00 O ATOM 2481 CB CYS B 44 -6.311 3.113 3.256 1.00 0.00 C ATOM 2482 SG CYS B 44 -6.996 1.498 2.794 1.00 0.00 S ATOM 0 H CYS B 44 -7.716 3.839 0.875 1.00 0.00 H new ATOM 0 HA CYS B 44 -7.950 4.418 3.803 1.00 0.00 H new ATOM 0 HB2 CYS B 44 -5.379 3.287 2.718 1.00 0.00 H new ATOM 0 HB3 CYS B 44 -6.072 3.123 4.319 1.00 0.00 H new ATOM 2487 N LEU B 45 -6.272 6.337 3.551 1.00 0.00 N ATOM 2488 CA LEU B 45 -5.511 7.587 3.269 1.00 0.00 C ATOM 2489 C LEU B 45 -4.564 7.884 4.433 1.00 0.00 C ATOM 2490 O LEU B 45 -4.610 7.244 5.464 1.00 0.00 O ATOM 2491 CB LEU B 45 -6.485 8.753 3.100 1.00 0.00 C ATOM 2492 CG LEU B 45 -7.156 8.666 1.733 1.00 0.00 C ATOM 2493 CD1 LEU B 45 -7.987 9.928 1.500 1.00 0.00 C ATOM 2494 CD2 LEU B 45 -6.091 8.549 0.641 1.00 0.00 C ATOM 0 H LEU B 45 -6.548 6.207 4.524 1.00 0.00 H new ATOM 0 HA LEU B 45 -4.934 7.458 2.353 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -7.238 8.728 3.888 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -5.954 9.700 3.196 1.00 0.00 H new ATOM 0 HG LEU B 45 -7.801 7.788 1.700 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -8.469 9.871 0.524 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -8.748 10.011 2.276 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -7.337 10.803 1.533 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -6.575 8.487 -0.334 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -5.443 9.425 0.670 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -5.496 7.651 0.808 1.00 0.00 H new ATOM 2506 N GLY B 46 -3.704 8.854 4.274 1.00 0.00 N ATOM 2507 CA GLY B 46 -2.753 9.197 5.369 1.00 0.00 C ATOM 2508 C GLY B 46 -1.842 8.000 5.654 1.00 0.00 C ATOM 2509 O GLY B 46 -2.264 6.865 5.552 1.00 0.00 O ATOM 0 H GLY B 46 -3.619 9.424 3.432 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -2.154 10.063 5.086 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -3.303 9.470 6.269 1.00 0.00 H new ATOM 2513 N PRO B 47 -0.615 8.291 6.008 1.00 0.00 N ATOM 2514 CA PRO B 47 0.389 7.259 6.322 1.00 0.00 C ATOM 2515 C PRO B 47 0.162 6.708 7.733 1.00 0.00 C ATOM 2516 O PRO B 47 -0.862 6.943 8.342 1.00 0.00 O ATOM 2517 CB PRO B 47 1.717 8.014 6.239 1.00 0.00 C ATOM 2518 CG PRO B 47 1.382 9.511 6.449 1.00 0.00 C ATOM 2519 CD PRO B 47 -0.115 9.676 6.128 1.00 0.00 C ATOM 0 HA PRO B 47 0.349 6.402 5.650 1.00 0.00 H new ATOM 0 HB2 PRO B 47 2.413 7.661 7.000 1.00 0.00 H new ATOM 0 HB3 PRO B 47 2.195 7.855 5.272 1.00 0.00 H new ATOM 0 HG2 PRO B 47 1.594 9.815 7.474 1.00 0.00 H new ATOM 0 HG3 PRO B 47 1.990 10.139 5.797 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -0.634 10.220 6.917 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -0.265 10.235 5.204 1.00 0.00 H new ATOM 2527 N CYS B 48 1.111 5.982 8.259 1.00 0.00 N ATOM 2528 CA CYS B 48 0.947 5.424 9.631 1.00 0.00 C ATOM 2529 C CYS B 48 2.297 5.408 10.349 1.00 0.00 C ATOM 2530 O CYS B 48 3.333 5.321 9.719 1.00 0.00 O ATOM 2531 CB CYS B 48 0.408 3.992 9.554 1.00 0.00 C ATOM 2532 SG CYS B 48 1.095 3.142 8.107 1.00 0.00 S ATOM 0 H CYS B 48 1.991 5.752 7.798 1.00 0.00 H new ATOM 0 HA CYS B 48 0.244 6.050 10.181 1.00 0.00 H new ATOM 0 HB2 CYS B 48 0.668 3.448 10.462 1.00 0.00 H new ATOM 0 HB3 CYS B 48 -0.680 4.008 9.493 1.00 0.00 H new ATOM 2537 N PRO B 49 2.240 5.475 11.655 1.00 0.00 N ATOM 2538 CA PRO B 49 3.443 5.452 12.502 1.00 0.00 C ATOM 2539 C PRO B 49 3.998 4.019 12.565 1.00 0.00 C ATOM 2540 O PRO B 49 3.912 3.280 11.605 1.00 0.00 O ATOM 2541 CB PRO B 49 2.931 5.952 13.863 1.00 0.00 C ATOM 2542 CG PRO B 49 1.406 5.704 13.876 1.00 0.00 C ATOM 2543 CD PRO B 49 0.970 5.580 12.404 1.00 0.00 C ATOM 0 HA PRO B 49 4.265 6.067 12.137 1.00 0.00 H new ATOM 0 HB2 PRO B 49 3.418 5.419 14.680 1.00 0.00 H new ATOM 0 HB3 PRO B 49 3.153 7.011 13.996 1.00 0.00 H new ATOM 0 HG2 PRO B 49 1.165 4.796 14.430 1.00 0.00 H new ATOM 0 HG3 PRO B 49 0.884 6.525 14.367 1.00 0.00 H new ATOM 0 HD2 PRO B 49 0.342 4.703 12.248 1.00 0.00 H new ATOM 0 HD3 PRO B 49 0.391 6.447 12.086 1.00 0.00 H new ATOM 2551 N TYR B 50 4.576 3.616 13.664 1.00 0.00 N ATOM 2552 CA TYR B 50 5.132 2.229 13.733 1.00 0.00 C ATOM 2553 C TYR B 50 4.089 1.272 14.318 1.00 0.00 C ATOM 2554 O TYR B 50 3.405 0.573 13.599 1.00 0.00 O ATOM 2555 CB TYR B 50 6.399 2.187 14.610 1.00 0.00 C ATOM 2556 CG TYR B 50 6.685 3.547 15.208 1.00 0.00 C ATOM 2557 CD1 TYR B 50 6.947 4.639 14.372 1.00 0.00 C ATOM 2558 CD2 TYR B 50 6.685 3.713 16.598 1.00 0.00 C ATOM 2559 CE1 TYR B 50 7.207 5.897 14.926 1.00 0.00 C ATOM 2560 CE2 TYR B 50 6.946 4.972 17.152 1.00 0.00 C ATOM 2561 CZ TYR B 50 7.207 6.064 16.315 1.00 0.00 C ATOM 2562 OH TYR B 50 7.464 7.305 16.862 1.00 0.00 O ATOM 0 H TYR B 50 4.688 4.177 14.509 1.00 0.00 H new ATOM 0 HA TYR B 50 5.390 1.921 12.720 1.00 0.00 H new ATOM 0 HB2 TYR B 50 6.271 1.454 15.407 1.00 0.00 H new ATOM 0 HB3 TYR B 50 7.250 1.862 14.012 1.00 0.00 H new ATOM 0 HD1 TYR B 50 6.948 4.510 13.300 1.00 0.00 H new ATOM 0 HD2 TYR B 50 6.484 2.870 17.243 1.00 0.00 H new ATOM 0 HE1 TYR B 50 7.408 6.740 14.281 1.00 0.00 H new ATOM 0 HE2 TYR B 50 6.946 5.101 18.224 1.00 0.00 H new ATOM 0 HH TYR B 50 7.424 7.246 17.839 1.00 0.00 H new ATOM 2572 N ILE B 51 3.978 1.227 15.616 1.00 0.00 N ATOM 2573 CA ILE B 51 2.998 0.306 16.265 1.00 0.00 C ATOM 2574 C ILE B 51 1.689 0.253 15.468 1.00 0.00 C ATOM 2575 O ILE B 51 0.979 -0.731 15.502 1.00 0.00 O ATOM 2576 CB ILE B 51 2.705 0.801 17.681 1.00 0.00 C ATOM 2577 CG1 ILE B 51 2.183 2.237 17.618 1.00 0.00 C ATOM 2578 CG2 ILE B 51 3.990 0.762 18.511 1.00 0.00 C ATOM 2579 CD1 ILE B 51 1.472 2.582 18.928 1.00 0.00 C ATOM 0 H ILE B 51 4.528 1.793 16.262 1.00 0.00 H new ATOM 0 HA ILE B 51 3.428 -0.695 16.296 1.00 0.00 H new ATOM 0 HB ILE B 51 1.955 0.160 18.143 1.00 0.00 H new ATOM 0 HG12 ILE B 51 3.009 2.928 17.448 1.00 0.00 H new ATOM 0 HG13 ILE B 51 1.496 2.349 16.779 1.00 0.00 H new ATOM 0 HG21 ILE B 51 3.782 1.115 19.521 1.00 0.00 H new ATOM 0 HG22 ILE B 51 4.364 -0.261 18.554 1.00 0.00 H new ATOM 0 HG23 ILE B 51 4.741 1.404 18.050 1.00 0.00 H new ATOM 0 HD11 ILE B 51 1.101 3.606 18.882 1.00 0.00 H new ATOM 0 HD12 ILE B 51 0.636 1.899 19.079 1.00 0.00 H new ATOM 0 HD13 ILE B 51 2.172 2.487 19.758 1.00 0.00 H new ATOM 2591 N TRP B 52 1.357 1.299 14.762 1.00 0.00 N ATOM 2592 CA TRP B 52 0.084 1.301 13.978 1.00 0.00 C ATOM 2593 C TRP B 52 0.010 0.067 13.076 1.00 0.00 C ATOM 2594 O TRP B 52 0.398 0.118 11.927 1.00 0.00 O ATOM 2595 CB TRP B 52 0.026 2.555 13.110 1.00 0.00 C ATOM 2596 CG TRP B 52 -1.359 3.113 13.140 1.00 0.00 C ATOM 2597 CD1 TRP B 52 -2.043 3.543 12.058 1.00 0.00 C ATOM 2598 CD2 TRP B 52 -2.240 3.306 14.285 1.00 0.00 C ATOM 2599 NE1 TRP B 52 -3.287 3.989 12.463 1.00 0.00 N ATOM 2600 CE2 TRP B 52 -3.458 3.863 13.827 1.00 0.00 C ATOM 2601 CE3 TRP B 52 -2.104 3.054 15.662 1.00 0.00 C ATOM 2602 CZ2 TRP B 52 -4.503 4.160 14.703 1.00 0.00 C ATOM 2603 CZ3 TRP B 52 -3.154 3.352 16.547 1.00 0.00 C ATOM 2604 CH2 TRP B 52 -4.350 3.902 16.068 1.00 0.00 C ATOM 0 H TRP B 52 1.910 2.153 14.693 1.00 0.00 H new ATOM 0 HA TRP B 52 -0.755 1.286 14.673 1.00 0.00 H new ATOM 0 HB2 TRP B 52 0.737 3.296 13.474 1.00 0.00 H new ATOM 0 HB3 TRP B 52 0.312 2.316 12.086 1.00 0.00 H new ATOM 0 HD1 TRP B 52 -1.678 3.539 11.042 1.00 0.00 H new ATOM 0 HE1 TRP B 52 -3.993 4.366 11.831 1.00 0.00 H new ATOM 0 HE3 TRP B 52 -1.187 2.629 16.042 1.00 0.00 H new ATOM 0 HZ2 TRP B 52 -5.422 4.586 14.329 1.00 0.00 H new ATOM 0 HZ3 TRP B 52 -3.038 3.156 17.603 1.00 0.00 H new ATOM 0 HH2 TRP B 52 -5.154 4.127 16.753 1.00 0.00 H new ATOM 2615 N SER B 53 -0.506 -1.027 13.592 1.00 0.00 N ATOM 2616 CA SER B 53 -0.641 -2.287 12.788 1.00 0.00 C ATOM 2617 C SER B 53 0.385 -2.326 11.653 1.00 0.00 C ATOM 2618 O SER B 53 0.165 -1.780 10.589 1.00 0.00 O ATOM 2619 CB SER B 53 -2.049 -2.358 12.197 1.00 0.00 C ATOM 2620 OG SER B 53 -2.138 -1.473 11.087 1.00 0.00 O ATOM 0 H SER B 53 -0.844 -1.100 14.551 1.00 0.00 H new ATOM 0 HA SER B 53 -0.463 -3.138 13.445 1.00 0.00 H new ATOM 0 HB2 SER B 53 -2.273 -3.377 11.883 1.00 0.00 H new ATOM 0 HB3 SER B 53 -2.787 -2.088 12.952 1.00 0.00 H new ATOM 0 HG SER B 53 -1.545 -1.785 10.372 1.00 0.00 H new ATOM 2626 N LEU B 54 1.503 -2.959 11.865 1.00 0.00 N ATOM 2627 CA LEU B 54 2.532 -3.019 10.791 1.00 0.00 C ATOM 2628 C LEU B 54 2.460 -4.374 10.085 1.00 0.00 C ATOM 2629 O LEU B 54 2.463 -5.415 10.712 1.00 0.00 O ATOM 2630 CB LEU B 54 3.920 -2.830 11.403 1.00 0.00 C ATOM 2631 CG LEU B 54 4.054 -1.390 11.898 1.00 0.00 C ATOM 2632 CD1 LEU B 54 5.199 -1.295 12.909 1.00 0.00 C ATOM 2633 CD2 LEU B 54 4.346 -0.471 10.711 1.00 0.00 C ATOM 0 H LEU B 54 1.749 -3.436 12.732 1.00 0.00 H new ATOM 0 HA LEU B 54 2.346 -2.227 10.066 1.00 0.00 H new ATOM 0 HB2 LEU B 54 4.066 -3.527 12.228 1.00 0.00 H new ATOM 0 HB3 LEU B 54 4.690 -3.047 10.663 1.00 0.00 H new ATOM 0 HG LEU B 54 3.124 -1.085 12.378 1.00 0.00 H new ATOM 0 HD11 LEU B 54 5.291 -0.267 13.259 1.00 0.00 H new ATOM 0 HD12 LEU B 54 4.992 -1.950 13.756 1.00 0.00 H new ATOM 0 HD13 LEU B 54 6.131 -1.601 12.433 1.00 0.00 H new ATOM 0 HD21 LEU B 54 4.442 0.557 11.061 1.00 0.00 H new ATOM 0 HD22 LEU B 54 5.275 -0.779 10.232 1.00 0.00 H new ATOM 0 HD23 LEU B 54 3.529 -0.534 9.992 1.00 0.00 H new ATOM 2645 N ASP B 55 2.392 -4.367 8.781 1.00 0.00 N ATOM 2646 CA ASP B 55 2.318 -5.654 8.033 1.00 0.00 C ATOM 2647 C ASP B 55 3.724 -6.087 7.617 1.00 0.00 C ATOM 2648 O ASP B 55 4.182 -7.158 7.963 1.00 0.00 O ATOM 2649 CB ASP B 55 1.452 -5.469 6.785 1.00 0.00 C ATOM 2650 CG ASP B 55 1.534 -6.724 5.916 1.00 0.00 C ATOM 2651 OD1 ASP B 55 1.517 -7.809 6.473 1.00 0.00 O ATOM 2652 OD2 ASP B 55 1.614 -6.578 4.707 1.00 0.00 O ATOM 0 H ASP B 55 2.385 -3.527 8.203 1.00 0.00 H new ATOM 0 HA ASP B 55 1.878 -6.419 8.672 1.00 0.00 H new ATOM 0 HB2 ASP B 55 0.418 -5.280 7.072 1.00 0.00 H new ATOM 0 HB3 ASP B 55 1.790 -4.600 6.220 1.00 0.00 H new ATOM 2657 N THR B 56 4.413 -5.264 6.876 1.00 0.00 N ATOM 2658 CA THR B 56 5.788 -5.630 6.436 1.00 0.00 C ATOM 2659 C THR B 56 6.809 -5.036 7.409 1.00 0.00 C ATOM 2660 O THR B 56 6.530 -4.087 8.114 1.00 0.00 O ATOM 2661 CB THR B 56 6.039 -5.076 5.033 1.00 0.00 C ATOM 2662 OG1 THR B 56 6.389 -3.701 5.124 1.00 0.00 O ATOM 2663 CG2 THR B 56 4.773 -5.227 4.187 1.00 0.00 C ATOM 0 H THR B 56 4.083 -4.353 6.556 1.00 0.00 H new ATOM 0 HA THR B 56 5.888 -6.715 6.421 1.00 0.00 H new ATOM 0 HB THR B 56 6.853 -5.629 4.565 1.00 0.00 H new ATOM 0 HG1 THR B 56 5.675 -3.211 5.582 1.00 0.00 H new ATOM 0 HG21 THR B 56 4.954 -4.832 3.188 1.00 0.00 H new ATOM 0 HG22 THR B 56 4.506 -6.281 4.117 1.00 0.00 H new ATOM 0 HG23 THR B 56 3.956 -4.676 4.653 1.00 0.00 H new ATOM 2671 N GLN B 57 7.992 -5.585 7.450 1.00 0.00 N ATOM 2672 CA GLN B 57 9.029 -5.049 8.374 1.00 0.00 C ATOM 2673 C GLN B 57 9.420 -3.639 7.931 1.00 0.00 C ATOM 2674 O GLN B 57 9.685 -2.773 8.741 1.00 0.00 O ATOM 2675 CB GLN B 57 10.260 -5.955 8.338 1.00 0.00 C ATOM 2676 CG GLN B 57 10.064 -7.121 9.311 1.00 0.00 C ATOM 2677 CD GLN B 57 9.171 -8.182 8.665 1.00 0.00 C ATOM 2678 OE1 GLN B 57 9.658 -9.164 8.141 1.00 0.00 O ATOM 2679 NE2 GLN B 57 7.876 -8.026 8.682 1.00 0.00 N ATOM 0 H GLN B 57 8.284 -6.381 6.884 1.00 0.00 H new ATOM 0 HA GLN B 57 8.633 -5.016 9.389 1.00 0.00 H new ATOM 0 HB2 GLN B 57 10.417 -6.333 7.328 1.00 0.00 H new ATOM 0 HB3 GLN B 57 11.151 -5.388 8.608 1.00 0.00 H new ATOM 0 HG2 GLN B 57 11.029 -7.554 9.575 1.00 0.00 H new ATOM 0 HG3 GLN B 57 9.611 -6.764 10.236 1.00 0.00 H new ATOM 0 HE21 GLN B 57 7.467 -7.201 9.122 1.00 0.00 H new ATOM 0 HE22 GLN B 57 7.272 -8.729 8.255 1.00 0.00 H new ATOM 2688 N TYR B 58 9.457 -3.400 6.648 1.00 0.00 N ATOM 2689 CA TYR B 58 9.828 -2.045 6.155 1.00 0.00 C ATOM 2690 C TYR B 58 8.742 -1.043 6.570 1.00 0.00 C ATOM 2691 O TYR B 58 8.905 0.153 6.434 1.00 0.00 O ATOM 2692 CB TYR B 58 9.961 -2.081 4.621 1.00 0.00 C ATOM 2693 CG TYR B 58 9.730 -0.702 4.047 1.00 0.00 C ATOM 2694 CD1 TYR B 58 10.696 0.296 4.213 1.00 0.00 C ATOM 2695 CD2 TYR B 58 8.543 -0.421 3.360 1.00 0.00 C ATOM 2696 CE1 TYR B 58 10.474 1.575 3.692 1.00 0.00 C ATOM 2697 CE2 TYR B 58 8.322 0.859 2.841 1.00 0.00 C ATOM 2698 CZ TYR B 58 9.289 1.856 3.008 1.00 0.00 C ATOM 2699 OH TYR B 58 9.072 3.118 2.502 1.00 0.00 O ATOM 0 H TYR B 58 9.246 -4.084 5.922 1.00 0.00 H new ATOM 0 HA TYR B 58 10.781 -1.738 6.587 1.00 0.00 H new ATOM 0 HB2 TYR B 58 10.953 -2.438 4.342 1.00 0.00 H new ATOM 0 HB3 TYR B 58 9.240 -2.783 4.202 1.00 0.00 H new ATOM 0 HD1 TYR B 58 11.612 0.079 4.743 1.00 0.00 H new ATOM 0 HD2 TYR B 58 7.798 -1.192 3.231 1.00 0.00 H new ATOM 0 HE1 TYR B 58 11.220 2.346 3.819 1.00 0.00 H new ATOM 0 HE2 TYR B 58 7.406 1.077 2.312 1.00 0.00 H new ATOM 0 HH TYR B 58 8.201 3.146 2.054 1.00 0.00 H new ATOM 2709 N SER B 59 7.638 -1.522 7.074 1.00 0.00 N ATOM 2710 CA SER B 59 6.549 -0.595 7.491 1.00 0.00 C ATOM 2711 C SER B 59 6.907 0.053 8.831 1.00 0.00 C ATOM 2712 O SER B 59 6.386 1.091 9.187 1.00 0.00 O ATOM 2713 CB SER B 59 5.242 -1.377 7.635 1.00 0.00 C ATOM 2714 OG SER B 59 4.756 -1.721 6.344 1.00 0.00 O ATOM 0 H SER B 59 7.443 -2.513 7.215 1.00 0.00 H new ATOM 0 HA SER B 59 6.428 0.182 6.736 1.00 0.00 H new ATOM 0 HB2 SER B 59 5.407 -2.278 8.226 1.00 0.00 H new ATOM 0 HB3 SER B 59 4.503 -0.778 8.167 1.00 0.00 H new ATOM 0 HG SER B 59 3.797 -1.916 6.397 1.00 0.00 H new ATOM 2720 N LYS B 60 7.792 -0.549 9.578 1.00 0.00 N ATOM 2721 CA LYS B 60 8.178 0.036 10.894 1.00 0.00 C ATOM 2722 C LYS B 60 9.455 0.864 10.733 1.00 0.00 C ATOM 2723 O LYS B 60 9.668 1.834 11.433 1.00 0.00 O ATOM 2724 CB LYS B 60 8.424 -1.092 11.900 1.00 0.00 C ATOM 2725 CG LYS B 60 9.354 -2.136 11.279 1.00 0.00 C ATOM 2726 CD LYS B 60 10.267 -2.716 12.361 1.00 0.00 C ATOM 2727 CE LYS B 60 11.202 -3.752 11.737 1.00 0.00 C ATOM 2728 NZ LYS B 60 11.910 -4.498 12.816 1.00 0.00 N ATOM 0 H LYS B 60 8.264 -1.420 9.334 1.00 0.00 H new ATOM 0 HA LYS B 60 7.374 0.678 11.255 1.00 0.00 H new ATOM 0 HB2 LYS B 60 8.867 -0.691 12.811 1.00 0.00 H new ATOM 0 HB3 LYS B 60 7.478 -1.554 12.183 1.00 0.00 H new ATOM 0 HG2 LYS B 60 8.768 -2.931 10.818 1.00 0.00 H new ATOM 0 HG3 LYS B 60 9.952 -1.682 10.489 1.00 0.00 H new ATOM 0 HD2 LYS B 60 10.848 -1.920 12.827 1.00 0.00 H new ATOM 0 HD3 LYS B 60 9.669 -3.177 13.148 1.00 0.00 H new ATOM 0 HE2 LYS B 60 10.633 -4.443 11.116 1.00 0.00 H new ATOM 0 HE3 LYS B 60 11.925 -3.260 11.086 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 12.546 -5.203 12.391 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 12.465 -3.833 13.391 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 11.213 -4.980 13.420 1.00 0.00 H new ATOM 2742 N VAL B 61 10.305 0.489 9.818 1.00 0.00 N ATOM 2743 CA VAL B 61 11.565 1.253 9.612 1.00 0.00 C ATOM 2744 C VAL B 61 11.233 2.603 8.969 1.00 0.00 C ATOM 2745 O VAL B 61 11.739 3.634 9.366 1.00 0.00 O ATOM 2746 CB VAL B 61 12.494 0.443 8.696 1.00 0.00 C ATOM 2747 CG1 VAL B 61 13.529 1.360 8.041 1.00 0.00 C ATOM 2748 CG2 VAL B 61 13.216 -0.622 9.524 1.00 0.00 C ATOM 0 H VAL B 61 10.180 -0.315 9.203 1.00 0.00 H new ATOM 0 HA VAL B 61 12.063 1.426 10.566 1.00 0.00 H new ATOM 0 HB VAL B 61 11.897 -0.030 7.916 1.00 0.00 H new ATOM 0 HG11 VAL B 61 14.180 0.771 7.395 1.00 0.00 H new ATOM 0 HG12 VAL B 61 13.019 2.119 7.448 1.00 0.00 H new ATOM 0 HG13 VAL B 61 14.126 1.844 8.813 1.00 0.00 H new ATOM 0 HG21 VAL B 61 13.877 -1.199 8.877 1.00 0.00 H new ATOM 0 HG22 VAL B 61 13.804 -0.139 10.305 1.00 0.00 H new ATOM 0 HG23 VAL B 61 12.483 -1.287 9.980 1.00 0.00 H new ATOM 2758 N LEU B 62 10.390 2.602 7.976 1.00 0.00 N ATOM 2759 CA LEU B 62 10.023 3.877 7.302 1.00 0.00 C ATOM 2760 C LEU B 62 9.044 4.657 8.185 1.00 0.00 C ATOM 2761 O LEU B 62 9.082 5.870 8.239 1.00 0.00 O ATOM 2762 CB LEU B 62 9.387 3.546 5.948 1.00 0.00 C ATOM 2763 CG LEU B 62 8.686 4.771 5.352 1.00 0.00 C ATOM 2764 CD1 LEU B 62 9.666 5.563 4.480 1.00 0.00 C ATOM 2765 CD2 LEU B 62 7.524 4.288 4.487 1.00 0.00 C ATOM 0 H LEU B 62 9.937 1.769 7.600 1.00 0.00 H new ATOM 0 HA LEU B 62 10.907 4.494 7.143 1.00 0.00 H new ATOM 0 HB2 LEU B 62 10.154 3.192 5.260 1.00 0.00 H new ATOM 0 HB3 LEU B 62 8.668 2.735 6.069 1.00 0.00 H new ATOM 0 HG LEU B 62 8.325 5.415 6.154 1.00 0.00 H new ATOM 0 HD11 LEU B 62 9.159 6.432 4.060 1.00 0.00 H new ATOM 0 HD12 LEU B 62 10.509 5.893 5.087 1.00 0.00 H new ATOM 0 HD13 LEU B 62 10.028 4.928 3.671 1.00 0.00 H new ATOM 0 HD21 LEU B 62 7.012 5.147 4.053 1.00 0.00 H new ATOM 0 HD22 LEU B 62 7.905 3.651 3.688 1.00 0.00 H new ATOM 0 HD23 LEU B 62 6.825 3.721 5.101 1.00 0.00 H new ATOM 2777 N ALA B 63 8.178 3.979 8.890 1.00 0.00 N ATOM 2778 CA ALA B 63 7.223 4.707 9.773 1.00 0.00 C ATOM 2779 C ALA B 63 8.018 5.693 10.632 1.00 0.00 C ATOM 2780 O ALA B 63 7.604 6.813 10.858 1.00 0.00 O ATOM 2781 CB ALA B 63 6.477 3.712 10.670 1.00 0.00 C ATOM 0 H ALA B 63 8.091 2.963 8.893 1.00 0.00 H new ATOM 0 HA ALA B 63 6.490 5.243 9.170 1.00 0.00 H new ATOM 0 HB1 ALA B 63 5.781 4.252 11.312 1.00 0.00 H new ATOM 0 HB2 ALA B 63 5.925 3.006 10.050 1.00 0.00 H new ATOM 0 HB3 ALA B 63 7.194 3.170 11.287 1.00 0.00 H new ATOM 2787 N LEU B 64 9.172 5.287 11.089 1.00 0.00 N ATOM 2788 CA LEU B 64 10.017 6.201 11.908 1.00 0.00 C ATOM 2789 C LEU B 64 10.767 7.130 10.962 1.00 0.00 C ATOM 2790 O LEU B 64 10.950 8.296 11.228 1.00 0.00 O ATOM 2791 CB LEU B 64 11.029 5.384 12.709 1.00 0.00 C ATOM 2792 CG LEU B 64 10.311 4.649 13.833 1.00 0.00 C ATOM 2793 CD1 LEU B 64 11.208 3.534 14.365 1.00 0.00 C ATOM 2794 CD2 LEU B 64 9.995 5.630 14.964 1.00 0.00 C ATOM 0 H LEU B 64 9.566 4.360 10.930 1.00 0.00 H new ATOM 0 HA LEU B 64 9.393 6.773 12.594 1.00 0.00 H new ATOM 0 HB2 LEU B 64 11.534 4.671 12.058 1.00 0.00 H new ATOM 0 HB3 LEU B 64 11.797 6.039 13.120 1.00 0.00 H new ATOM 0 HG LEU B 64 9.383 4.221 13.453 1.00 0.00 H new ATOM 0 HD11 LEU B 64 10.695 3.007 15.170 1.00 0.00 H new ATOM 0 HD12 LEU B 64 11.435 2.835 13.560 1.00 0.00 H new ATOM 0 HD13 LEU B 64 12.135 3.963 14.745 1.00 0.00 H new ATOM 0 HD21 LEU B 64 9.481 5.104 15.769 1.00 0.00 H new ATOM 0 HD22 LEU B 64 10.923 6.058 15.344 1.00 0.00 H new ATOM 0 HD23 LEU B 64 9.356 6.428 14.586 1.00 0.00 H new ATOM 2806 N TYR B 65 11.194 6.609 9.848 1.00 0.00 N ATOM 2807 CA TYR B 65 11.926 7.446 8.860 1.00 0.00 C ATOM 2808 C TYR B 65 11.178 8.770 8.681 1.00 0.00 C ATOM 2809 O TYR B 65 11.760 9.795 8.387 1.00 0.00 O ATOM 2810 CB TYR B 65 11.981 6.699 7.527 1.00 0.00 C ATOM 2811 CG TYR B 65 12.797 7.482 6.530 1.00 0.00 C ATOM 2812 CD1 TYR B 65 14.193 7.373 6.526 1.00 0.00 C ATOM 2813 CD2 TYR B 65 12.154 8.309 5.600 1.00 0.00 C ATOM 2814 CE1 TYR B 65 14.946 8.094 5.592 1.00 0.00 C ATOM 2815 CE2 TYR B 65 12.909 9.029 4.667 1.00 0.00 C ATOM 2816 CZ TYR B 65 14.304 8.921 4.661 1.00 0.00 C ATOM 2817 OH TYR B 65 15.047 9.632 3.741 1.00 0.00 O ATOM 0 H TYR B 65 11.067 5.634 9.578 1.00 0.00 H new ATOM 0 HA TYR B 65 12.939 7.646 9.208 1.00 0.00 H new ATOM 0 HB2 TYR B 65 12.419 5.711 7.672 1.00 0.00 H new ATOM 0 HB3 TYR B 65 10.972 6.547 7.144 1.00 0.00 H new ATOM 0 HD1 TYR B 65 14.688 6.734 7.242 1.00 0.00 H new ATOM 0 HD2 TYR B 65 11.077 8.391 5.603 1.00 0.00 H new ATOM 0 HE1 TYR B 65 16.023 8.013 5.589 1.00 0.00 H new ATOM 0 HE2 TYR B 65 12.414 9.669 3.951 1.00 0.00 H new ATOM 0 HH TYR B 65 14.447 10.154 3.169 1.00 0.00 H new ATOM 2827 N ASN B 66 9.885 8.747 8.861 1.00 0.00 N ATOM 2828 CA ASN B 66 9.073 9.988 8.713 1.00 0.00 C ATOM 2829 C ASN B 66 8.842 10.605 10.089 1.00 0.00 C ATOM 2830 O ASN B 66 9.066 11.779 10.308 1.00 0.00 O ATOM 2831 CB ASN B 66 7.720 9.622 8.122 1.00 0.00 C ATOM 2832 CG ASN B 66 7.156 10.809 7.339 1.00 0.00 C ATOM 2833 OD1 ASN B 66 7.061 11.903 7.857 1.00 0.00 O ATOM 2834 ND2 ASN B 66 6.774 10.636 6.104 1.00 0.00 N ATOM 0 H ASN B 66 9.352 7.913 9.107 1.00 0.00 H new ATOM 0 HA ASN B 66 9.596 10.693 8.067 1.00 0.00 H new ATOM 0 HB2 ASN B 66 7.822 8.758 7.466 1.00 0.00 H new ATOM 0 HB3 ASN B 66 7.030 9.339 8.917 1.00 0.00 H new ATOM 0 HD21 ASN B 66 6.395 11.420 5.573 1.00 0.00 H new ATOM 0 HD22 ASN B 66 6.854 9.717 5.669 1.00 0.00 H new ATOM 2841 N GLN B 67 8.388 9.809 11.016 1.00 0.00 N ATOM 2842 CA GLN B 67 8.125 10.315 12.395 1.00 0.00 C ATOM 2843 C GLN B 67 9.358 11.041 12.936 1.00 0.00 C ATOM 2844 O GLN B 67 9.287 11.765 13.910 1.00 0.00 O ATOM 2845 CB GLN B 67 7.788 9.134 13.306 1.00 0.00 C ATOM 2846 CG GLN B 67 6.276 8.900 13.300 1.00 0.00 C ATOM 2847 CD GLN B 67 5.574 10.086 13.965 1.00 0.00 C ATOM 2848 OE1 GLN B 67 5.663 10.267 15.163 1.00 0.00 O ATOM 2849 NE2 GLN B 67 4.874 10.909 13.232 1.00 0.00 N ATOM 0 H GLN B 67 8.185 8.819 10.877 1.00 0.00 H new ATOM 0 HA GLN B 67 7.289 11.014 12.367 1.00 0.00 H new ATOM 0 HB2 GLN B 67 8.307 8.238 12.965 1.00 0.00 H new ATOM 0 HB3 GLN B 67 8.132 9.334 14.321 1.00 0.00 H new ATOM 0 HG2 GLN B 67 5.920 8.780 12.277 1.00 0.00 H new ATOM 0 HG3 GLN B 67 6.038 7.978 13.831 1.00 0.00 H new ATOM 0 HE21 GLN B 67 4.799 10.758 12.226 1.00 0.00 H new ATOM 0 HE22 GLN B 67 4.403 11.703 13.665 1.00 0.00 H new ATOM 2858 N HIS B 68 10.483 10.852 12.316 1.00 0.00 N ATOM 2859 CA HIS B 68 11.724 11.528 12.792 1.00 0.00 C ATOM 2860 C HIS B 68 11.933 12.824 12.006 1.00 0.00 C ATOM 2861 O HIS B 68 12.139 13.878 12.574 1.00 0.00 O ATOM 2862 CB HIS B 68 12.925 10.605 12.575 1.00 0.00 C ATOM 2863 CG HIS B 68 13.067 9.677 13.748 1.00 0.00 C ATOM 2864 ND1 HIS B 68 12.470 8.426 13.780 1.00 0.00 N ATOM 2865 CD2 HIS B 68 13.742 9.802 14.934 1.00 0.00 C ATOM 2866 CE1 HIS B 68 12.797 7.853 14.952 1.00 0.00 C ATOM 2867 NE2 HIS B 68 13.572 8.649 15.694 1.00 0.00 N ATOM 0 H HIS B 68 10.602 10.257 11.496 1.00 0.00 H new ATOM 0 HA HIS B 68 11.627 11.756 13.853 1.00 0.00 H new ATOM 0 HB2 HIS B 68 12.794 10.031 11.658 1.00 0.00 H new ATOM 0 HB3 HIS B 68 13.833 11.196 12.454 1.00 0.00 H new ATOM 0 HD2 HIS B 68 14.319 10.665 15.233 1.00 0.00 H new ATOM 0 HE1 HIS B 68 12.472 6.869 15.256 1.00 0.00 H new ATOM 0 HE2 HIS B 68 13.956 8.454 16.618 1.00 0.00 H new ATOM 2875 N ASN B 69 11.886 12.753 10.704 1.00 0.00 N ATOM 2876 CA ASN B 69 12.087 13.980 9.882 1.00 0.00 C ATOM 2877 C ASN B 69 10.726 14.551 9.467 1.00 0.00 C ATOM 2878 O ASN B 69 10.045 13.975 8.641 1.00 0.00 O ATOM 2879 CB ASN B 69 12.882 13.621 8.625 1.00 0.00 C ATOM 2880 CG ASN B 69 14.292 13.182 9.022 1.00 0.00 C ATOM 2881 OD1 ASN B 69 14.847 13.678 9.983 1.00 0.00 O ATOM 2882 ND2 ASN B 69 14.902 12.268 8.319 1.00 0.00 N ATOM 0 H ASN B 69 11.717 11.898 10.174 1.00 0.00 H new ATOM 0 HA ASN B 69 12.631 14.721 10.467 1.00 0.00 H new ATOM 0 HB2 ASN B 69 12.380 12.821 8.080 1.00 0.00 H new ATOM 0 HB3 ASN B 69 12.932 14.480 7.956 1.00 0.00 H new ATOM 0 HD21 ASN B 69 15.843 11.971 8.576 1.00 0.00 H new ATOM 0 HD22 ASN B 69 14.438 11.851 7.512 1.00 0.00 H new ATOM 2889 N PRO B 70 10.369 15.671 10.045 1.00 0.00 N ATOM 2890 CA PRO B 70 9.094 16.340 9.742 1.00 0.00 C ATOM 2891 C PRO B 70 9.192 17.077 8.404 1.00 0.00 C ATOM 2892 O PRO B 70 9.941 18.022 8.258 1.00 0.00 O ATOM 2893 CB PRO B 70 8.918 17.324 10.902 1.00 0.00 C ATOM 2894 CG PRO B 70 10.330 17.568 11.484 1.00 0.00 C ATOM 2895 CD PRO B 70 11.196 16.371 11.049 1.00 0.00 C ATOM 0 HA PRO B 70 8.254 15.651 9.650 1.00 0.00 H new ATOM 0 HB2 PRO B 70 8.474 18.257 10.556 1.00 0.00 H new ATOM 0 HB3 PRO B 70 8.250 16.915 11.660 1.00 0.00 H new ATOM 0 HG2 PRO B 70 10.747 18.504 11.111 1.00 0.00 H new ATOM 0 HG3 PRO B 70 10.293 17.646 12.571 1.00 0.00 H new ATOM 0 HD2 PRO B 70 12.145 16.699 10.624 1.00 0.00 H new ATOM 0 HD3 PRO B 70 11.432 15.723 11.893 1.00 0.00 H new ATOM 2903 N GLY B 71 8.445 16.648 7.426 1.00 0.00 N ATOM 2904 CA GLY B 71 8.498 17.319 6.098 1.00 0.00 C ATOM 2905 C GLY B 71 8.926 16.309 5.031 1.00 0.00 C ATOM 2906 O GLY B 71 9.079 16.645 3.873 1.00 0.00 O ATOM 0 H GLY B 71 7.799 15.861 7.489 1.00 0.00 H new ATOM 0 HA2 GLY B 71 7.521 17.734 5.850 1.00 0.00 H new ATOM 0 HA3 GLY B 71 9.200 18.152 6.128 1.00 0.00 H new ATOM 2910 N ALA B 72 9.115 15.072 5.407 1.00 0.00 N ATOM 2911 CA ALA B 72 9.522 14.048 4.414 1.00 0.00 C ATOM 2912 C ALA B 72 8.274 13.396 3.833 1.00 0.00 C ATOM 2913 O ALA B 72 7.444 12.866 4.543 1.00 0.00 O ATOM 2914 CB ALA B 72 10.383 12.982 5.090 1.00 0.00 C ATOM 0 H ALA B 72 9.004 14.731 6.362 1.00 0.00 H new ATOM 0 HA ALA B 72 10.099 14.522 3.619 1.00 0.00 H new ATOM 0 HB1 ALA B 72 10.678 12.233 4.355 1.00 0.00 H new ATOM 0 HB2 ALA B 72 11.274 13.447 5.512 1.00 0.00 H new ATOM 0 HB3 ALA B 72 9.812 12.504 5.886 1.00 0.00 H new ATOM 2920 N SER B 73 8.136 13.441 2.546 1.00 0.00 N ATOM 2921 CA SER B 73 6.942 12.833 1.898 1.00 0.00 C ATOM 2922 C SER B 73 7.273 11.414 1.431 1.00 0.00 C ATOM 2923 O SER B 73 6.978 11.034 0.316 1.00 0.00 O ATOM 2924 CB SER B 73 6.528 13.681 0.694 1.00 0.00 C ATOM 2925 OG SER B 73 7.687 14.262 0.111 1.00 0.00 O ATOM 0 H SER B 73 8.801 13.875 1.906 1.00 0.00 H new ATOM 0 HA SER B 73 6.124 12.794 2.617 1.00 0.00 H new ATOM 0 HB2 SER B 73 6.008 13.064 -0.039 1.00 0.00 H new ATOM 0 HB3 SER B 73 5.833 14.461 1.005 1.00 0.00 H new ATOM 0 HG SER B 73 7.427 14.805 -0.662 1.00 0.00 H new ATOM 2931 N ALA B 74 7.880 10.624 2.277 1.00 0.00 N ATOM 2932 CA ALA B 74 8.219 9.230 1.872 1.00 0.00 C ATOM 2933 C ALA B 74 7.654 8.247 2.898 1.00 0.00 C ATOM 2934 O ALA B 74 8.062 7.105 2.970 1.00 0.00 O ATOM 2935 CB ALA B 74 9.740 9.073 1.786 1.00 0.00 C ATOM 0 H ALA B 74 8.154 10.882 3.225 1.00 0.00 H new ATOM 0 HA ALA B 74 7.782 9.021 0.895 1.00 0.00 H new ATOM 0 HB1 ALA B 74 9.984 8.053 1.490 1.00 0.00 H new ATOM 0 HB2 ALA B 74 10.137 9.770 1.048 1.00 0.00 H new ATOM 0 HB3 ALA B 74 10.183 9.284 2.759 1.00 0.00 H new ATOM 2941 N ALA B 75 6.708 8.680 3.687 1.00 0.00 N ATOM 2942 CA ALA B 75 6.102 7.769 4.700 1.00 0.00 C ATOM 2943 C ALA B 75 5.631 6.491 3.998 1.00 0.00 C ATOM 2944 O ALA B 75 5.867 6.323 2.817 1.00 0.00 O ATOM 2945 CB ALA B 75 4.915 8.479 5.353 1.00 0.00 C ATOM 0 H ALA B 75 6.328 9.627 3.674 1.00 0.00 H new ATOM 0 HA ALA B 75 6.832 7.509 5.466 1.00 0.00 H new ATOM 0 HB1 ALA B 75 4.463 7.823 6.096 1.00 0.00 H new ATOM 0 HB2 ALA B 75 5.259 9.393 5.837 1.00 0.00 H new ATOM 0 HB3 ALA B 75 4.176 8.728 4.591 1.00 0.00 H new ATOM 2951 N PRO B 76 4.979 5.619 4.732 1.00 0.00 N ATOM 2952 CA PRO B 76 4.476 4.352 4.176 1.00 0.00 C ATOM 2953 C PRO B 76 3.202 4.607 3.375 1.00 0.00 C ATOM 2954 O PRO B 76 2.935 5.717 2.957 1.00 0.00 O ATOM 2955 CB PRO B 76 4.186 3.500 5.411 1.00 0.00 C ATOM 2956 CG PRO B 76 3.989 4.488 6.580 1.00 0.00 C ATOM 2957 CD PRO B 76 4.679 5.804 6.169 1.00 0.00 C ATOM 0 HA PRO B 76 5.178 3.869 3.496 1.00 0.00 H new ATOM 0 HB2 PRO B 76 3.295 2.890 5.263 1.00 0.00 H new ATOM 0 HB3 PRO B 76 5.010 2.816 5.614 1.00 0.00 H new ATOM 0 HG2 PRO B 76 2.929 4.651 6.774 1.00 0.00 H new ATOM 0 HG3 PRO B 76 4.424 4.093 7.498 1.00 0.00 H new ATOM 0 HD2 PRO B 76 4.029 6.663 6.333 1.00 0.00 H new ATOM 0 HD3 PRO B 76 5.587 5.976 6.747 1.00 0.00 H new ATOM 2965 N CYS B 77 2.417 3.596 3.150 1.00 0.00 N ATOM 2966 CA CYS B 77 1.169 3.804 2.371 1.00 0.00 C ATOM 2967 C CYS B 77 0.055 2.894 2.890 1.00 0.00 C ATOM 2968 O CYS B 77 -0.043 1.743 2.516 1.00 0.00 O ATOM 2969 CB CYS B 77 1.437 3.492 0.898 1.00 0.00 C ATOM 2970 SG CYS B 77 1.038 4.945 -0.102 1.00 0.00 S ATOM 0 H CYS B 77 2.583 2.641 3.469 1.00 0.00 H new ATOM 0 HA CYS B 77 0.852 4.841 2.481 1.00 0.00 H new ATOM 0 HB2 CYS B 77 2.482 3.215 0.757 1.00 0.00 H new ATOM 0 HB3 CYS B 77 0.836 2.641 0.579 1.00 0.00 H new ATOM 2975 N CYS B 78 -0.796 3.405 3.738 1.00 0.00 N ATOM 2976 CA CYS B 78 -1.921 2.573 4.258 1.00 0.00 C ATOM 2977 C CYS B 78 -2.723 2.048 3.056 1.00 0.00 C ATOM 2978 O CYS B 78 -2.943 2.763 2.098 1.00 0.00 O ATOM 2979 CB CYS B 78 -2.808 3.443 5.157 1.00 0.00 C ATOM 2980 SG CYS B 78 -4.200 2.471 5.788 1.00 0.00 S ATOM 0 H CYS B 78 -0.762 4.361 4.093 1.00 0.00 H new ATOM 0 HA CYS B 78 -1.549 1.732 4.842 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -2.222 3.836 5.988 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -3.178 4.300 4.595 1.00 0.00 H new ATOM 2985 N VAL B 79 -3.134 0.804 3.072 1.00 0.00 N ATOM 2986 CA VAL B 79 -3.882 0.260 1.900 1.00 0.00 C ATOM 2987 C VAL B 79 -4.953 -0.744 2.361 1.00 0.00 C ATOM 2988 O VAL B 79 -4.991 -1.119 3.512 1.00 0.00 O ATOM 2989 CB VAL B 79 -2.878 -0.422 0.951 1.00 0.00 C ATOM 2990 CG1 VAL B 79 -1.539 0.303 1.029 1.00 0.00 C ATOM 2991 CG2 VAL B 79 -2.666 -1.885 1.357 1.00 0.00 C ATOM 0 H VAL B 79 -2.985 0.148 3.839 1.00 0.00 H new ATOM 0 HA VAL B 79 -4.389 1.072 1.379 1.00 0.00 H new ATOM 0 HB VAL B 79 -3.275 -0.383 -0.063 1.00 0.00 H new ATOM 0 HG11 VAL B 79 -0.826 -0.177 0.359 1.00 0.00 H new ATOM 0 HG12 VAL B 79 -1.671 1.344 0.733 1.00 0.00 H new ATOM 0 HG13 VAL B 79 -1.161 0.261 2.051 1.00 0.00 H new ATOM 0 HG21 VAL B 79 -1.954 -2.352 0.676 1.00 0.00 H new ATOM 0 HG22 VAL B 79 -2.277 -1.928 2.374 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -3.616 -2.417 1.309 1.00 0.00 H new ATOM 3001 N PRO B 80 -5.791 -1.156 1.437 1.00 0.00 N ATOM 3002 CA PRO B 80 -6.871 -2.120 1.717 1.00 0.00 C ATOM 3003 C PRO B 80 -6.310 -3.542 1.796 1.00 0.00 C ATOM 3004 O PRO B 80 -6.064 -4.180 0.791 1.00 0.00 O ATOM 3005 CB PRO B 80 -7.813 -1.966 0.518 1.00 0.00 C ATOM 3006 CG PRO B 80 -6.968 -1.359 -0.626 1.00 0.00 C ATOM 3007 CD PRO B 80 -5.738 -0.703 0.031 1.00 0.00 C ATOM 0 HA PRO B 80 -7.371 -1.939 2.668 1.00 0.00 H new ATOM 0 HB2 PRO B 80 -8.229 -2.930 0.224 1.00 0.00 H new ATOM 0 HB3 PRO B 80 -8.654 -1.318 0.766 1.00 0.00 H new ATOM 0 HG2 PRO B 80 -6.663 -2.130 -1.333 1.00 0.00 H new ATOM 0 HG3 PRO B 80 -7.546 -0.624 -1.186 1.00 0.00 H new ATOM 0 HD2 PRO B 80 -4.813 -1.017 -0.454 1.00 0.00 H new ATOM 0 HD3 PRO B 80 -5.782 0.384 -0.039 1.00 0.00 H new ATOM 3015 N GLN B 81 -6.109 -4.043 2.983 1.00 0.00 N ATOM 3016 CA GLN B 81 -5.567 -5.422 3.131 1.00 0.00 C ATOM 3017 C GLN B 81 -6.653 -6.433 2.757 1.00 0.00 C ATOM 3018 O GLN B 81 -6.547 -7.134 1.770 1.00 0.00 O ATOM 3019 CB GLN B 81 -5.133 -5.637 4.584 1.00 0.00 C ATOM 3020 CG GLN B 81 -4.948 -7.130 4.853 1.00 0.00 C ATOM 3021 CD GLN B 81 -3.871 -7.689 3.920 1.00 0.00 C ATOM 3022 OE1 GLN B 81 -4.176 -8.210 2.866 1.00 0.00 O ATOM 3023 NE2 GLN B 81 -2.616 -7.602 4.267 1.00 0.00 N ATOM 0 H GLN B 81 -6.297 -3.555 3.859 1.00 0.00 H new ATOM 0 HA GLN B 81 -4.708 -5.558 2.474 1.00 0.00 H new ATOM 0 HB2 GLN B 81 -4.202 -5.105 4.778 1.00 0.00 H new ATOM 0 HB3 GLN B 81 -5.881 -5.226 5.261 1.00 0.00 H new ATOM 0 HG2 GLN B 81 -4.662 -7.290 5.893 1.00 0.00 H new ATOM 0 HG3 GLN B 81 -5.889 -7.658 4.696 1.00 0.00 H new ATOM 0 HE21 GLN B 81 -2.361 -7.164 5.152 1.00 0.00 H new ATOM 0 HE22 GLN B 81 -1.890 -7.972 3.653 1.00 0.00 H new ATOM 3032 N ALA B 82 -7.699 -6.509 3.532 1.00 0.00 N ATOM 3033 CA ALA B 82 -8.792 -7.470 3.214 1.00 0.00 C ATOM 3034 C ALA B 82 -9.795 -6.789 2.284 1.00 0.00 C ATOM 3035 O ALA B 82 -10.155 -5.646 2.478 1.00 0.00 O ATOM 3036 CB ALA B 82 -9.495 -7.892 4.506 1.00 0.00 C ATOM 0 H ALA B 82 -7.844 -5.948 4.371 1.00 0.00 H new ATOM 0 HA ALA B 82 -8.378 -8.353 2.727 1.00 0.00 H new ATOM 0 HB1 ALA B 82 -10.294 -8.595 4.272 1.00 0.00 H new ATOM 0 HB2 ALA B 82 -8.776 -8.369 5.172 1.00 0.00 H new ATOM 0 HB3 ALA B 82 -9.916 -7.013 4.995 1.00 0.00 H new ATOM 3042 N LEU B 83 -10.245 -7.475 1.270 1.00 0.00 N ATOM 3043 CA LEU B 83 -11.217 -6.853 0.333 1.00 0.00 C ATOM 3044 C LEU B 83 -12.491 -7.686 0.281 1.00 0.00 C ATOM 3045 O LEU B 83 -12.709 -8.575 1.080 1.00 0.00 O ATOM 3046 CB LEU B 83 -10.607 -6.784 -1.068 1.00 0.00 C ATOM 3047 CG LEU B 83 -9.414 -5.836 -1.052 1.00 0.00 C ATOM 3048 CD1 LEU B 83 -8.386 -6.285 -2.092 1.00 0.00 C ATOM 3049 CD2 LEU B 83 -9.887 -4.421 -1.383 1.00 0.00 C ATOM 0 H LEU B 83 -9.982 -8.436 1.052 1.00 0.00 H new ATOM 0 HA LEU B 83 -11.453 -5.848 0.682 1.00 0.00 H new ATOM 0 HB2 LEU B 83 -10.293 -7.777 -1.390 1.00 0.00 H new ATOM 0 HB3 LEU B 83 -11.352 -6.438 -1.785 1.00 0.00 H new ATOM 0 HG LEU B 83 -8.956 -5.847 -0.063 1.00 0.00 H new ATOM 0 HD11 LEU B 83 -7.534 -5.605 -2.078 1.00 0.00 H new ATOM 0 HD12 LEU B 83 -8.049 -7.295 -1.858 1.00 0.00 H new ATOM 0 HD13 LEU B 83 -8.842 -6.275 -3.082 1.00 0.00 H new ATOM 0 HD21 LEU B 83 -9.035 -3.741 -1.372 1.00 0.00 H new ATOM 0 HD22 LEU B 83 -10.346 -4.413 -2.372 1.00 0.00 H new ATOM 0 HD23 LEU B 83 -10.618 -4.099 -0.641 1.00 0.00 H new ATOM 3061 N GLU B 84 -13.328 -7.400 -0.667 1.00 0.00 N ATOM 3062 CA GLU B 84 -14.600 -8.158 -0.811 1.00 0.00 C ATOM 3063 C GLU B 84 -14.993 -8.173 -2.289 1.00 0.00 C ATOM 3064 O GLU B 84 -14.582 -7.313 -3.041 1.00 0.00 O ATOM 3065 CB GLU B 84 -15.698 -7.479 0.010 1.00 0.00 C ATOM 3066 CG GLU B 84 -15.881 -8.223 1.335 1.00 0.00 C ATOM 3067 CD GLU B 84 -17.295 -7.984 1.866 1.00 0.00 C ATOM 3068 OE1 GLU B 84 -18.050 -7.300 1.195 1.00 0.00 O ATOM 3069 OE2 GLU B 84 -17.599 -8.489 2.933 1.00 0.00 O ATOM 0 H GLU B 84 -13.186 -6.664 -1.359 1.00 0.00 H new ATOM 0 HA GLU B 84 -14.471 -9.179 -0.451 1.00 0.00 H new ATOM 0 HB2 GLU B 84 -15.434 -6.438 0.199 1.00 0.00 H new ATOM 0 HB3 GLU B 84 -16.634 -7.474 -0.549 1.00 0.00 H new ATOM 0 HG2 GLU B 84 -15.711 -9.290 1.191 1.00 0.00 H new ATOM 0 HG3 GLU B 84 -15.146 -7.878 2.062 1.00 0.00 H new ATOM 3076 N PRO B 85 -15.770 -9.153 -2.664 1.00 0.00 N ATOM 3077 CA PRO B 85 -16.226 -9.310 -4.055 1.00 0.00 C ATOM 3078 C PRO B 85 -17.315 -8.284 -4.388 1.00 0.00 C ATOM 3079 O PRO B 85 -17.482 -7.300 -3.696 1.00 0.00 O ATOM 3080 CB PRO B 85 -16.758 -10.743 -4.103 1.00 0.00 C ATOM 3081 CG PRO B 85 -17.082 -11.136 -2.643 1.00 0.00 C ATOM 3082 CD PRO B 85 -16.271 -10.188 -1.740 1.00 0.00 C ATOM 0 HA PRO B 85 -15.438 -9.140 -4.788 1.00 0.00 H new ATOM 0 HB2 PRO B 85 -17.648 -10.806 -4.729 1.00 0.00 H new ATOM 0 HB3 PRO B 85 -16.018 -11.418 -4.532 1.00 0.00 H new ATOM 0 HG2 PRO B 85 -18.150 -11.041 -2.444 1.00 0.00 H new ATOM 0 HG3 PRO B 85 -16.814 -12.175 -2.453 1.00 0.00 H new ATOM 0 HD2 PRO B 85 -16.892 -9.755 -0.956 1.00 0.00 H new ATOM 0 HD3 PRO B 85 -15.452 -10.711 -1.246 1.00 0.00 H new ATOM 3090 N LEU B 86 -18.036 -8.489 -5.458 1.00 0.00 N ATOM 3091 CA LEU B 86 -19.084 -7.504 -5.843 1.00 0.00 C ATOM 3092 C LEU B 86 -20.016 -8.130 -6.894 1.00 0.00 C ATOM 3093 O LEU B 86 -19.613 -8.345 -8.017 1.00 0.00 O ATOM 3094 CB LEU B 86 -18.361 -6.253 -6.395 1.00 0.00 C ATOM 3095 CG LEU B 86 -19.170 -5.545 -7.495 1.00 0.00 C ATOM 3096 CD1 LEU B 86 -20.107 -4.509 -6.882 1.00 0.00 C ATOM 3097 CD2 LEU B 86 -18.201 -4.834 -8.441 1.00 0.00 C ATOM 0 H LEU B 86 -17.944 -9.293 -6.079 1.00 0.00 H new ATOM 0 HA LEU B 86 -19.701 -7.221 -4.990 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -18.174 -5.555 -5.579 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -17.389 -6.545 -6.793 1.00 0.00 H new ATOM 0 HG LEU B 86 -19.760 -6.285 -8.035 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -20.672 -4.017 -7.673 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -20.796 -5.002 -6.196 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -19.523 -3.767 -6.338 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -18.764 -4.328 -9.226 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -17.619 -4.101 -7.882 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -17.529 -5.565 -8.890 1.00 0.00 H new ATOM 3109 N PRO B 87 -21.244 -8.388 -6.507 1.00 0.00 N ATOM 3110 CA PRO B 87 -22.252 -8.972 -7.414 1.00 0.00 C ATOM 3111 C PRO B 87 -22.752 -7.897 -8.377 1.00 0.00 C ATOM 3112 O PRO B 87 -23.338 -6.913 -7.974 1.00 0.00 O ATOM 3113 CB PRO B 87 -23.363 -9.436 -6.468 1.00 0.00 C ATOM 3114 CG PRO B 87 -23.202 -8.612 -5.170 1.00 0.00 C ATOM 3115 CD PRO B 87 -21.742 -8.118 -5.143 1.00 0.00 C ATOM 0 HA PRO B 87 -21.873 -9.787 -8.030 1.00 0.00 H new ATOM 0 HB2 PRO B 87 -24.345 -9.273 -6.912 1.00 0.00 H new ATOM 0 HB3 PRO B 87 -23.279 -10.503 -6.264 1.00 0.00 H new ATOM 0 HG2 PRO B 87 -23.896 -7.772 -5.155 1.00 0.00 H new ATOM 0 HG3 PRO B 87 -23.421 -9.222 -4.294 1.00 0.00 H new ATOM 0 HD2 PRO B 87 -21.685 -7.057 -4.901 1.00 0.00 H new ATOM 0 HD3 PRO B 87 -21.156 -8.648 -4.393 1.00 0.00 H new ATOM 3123 N ILE B 88 -22.502 -8.062 -9.647 1.00 0.00 N ATOM 3124 CA ILE B 88 -22.943 -7.028 -10.622 1.00 0.00 C ATOM 3125 C ILE B 88 -23.742 -7.656 -11.756 1.00 0.00 C ATOM 3126 O ILE B 88 -24.244 -8.758 -11.662 1.00 0.00 O ATOM 3127 CB ILE B 88 -21.711 -6.344 -11.222 1.00 0.00 C ATOM 3128 CG1 ILE B 88 -21.069 -7.264 -12.265 1.00 0.00 C ATOM 3129 CG2 ILE B 88 -20.698 -6.063 -10.120 1.00 0.00 C ATOM 3130 CD1 ILE B 88 -19.718 -6.697 -12.688 1.00 0.00 C ATOM 0 H ILE B 88 -22.015 -8.863 -10.049 1.00 0.00 H new ATOM 0 HA ILE B 88 -23.571 -6.308 -10.097 1.00 0.00 H new ATOM 0 HB ILE B 88 -22.014 -5.409 -11.693 1.00 0.00 H new ATOM 0 HG12 ILE B 88 -20.941 -8.265 -11.852 1.00 0.00 H new ATOM 0 HG13 ILE B 88 -21.722 -7.358 -13.132 1.00 0.00 H new ATOM 0 HG21 ILE B 88 -19.821 -5.576 -10.547 1.00 0.00 H new ATOM 0 HG22 ILE B 88 -21.147 -5.410 -9.371 1.00 0.00 H new ATOM 0 HG23 ILE B 88 -20.400 -7.001 -9.652 1.00 0.00 H new ATOM 0 HD11 ILE B 88 -19.264 -7.354 -13.430 1.00 0.00 H new ATOM 0 HD12 ILE B 88 -19.858 -5.705 -13.118 1.00 0.00 H new ATOM 0 HD13 ILE B 88 -19.065 -6.626 -11.818 1.00 0.00 H new ATOM 3142 N VAL B 89 -23.820 -6.942 -12.840 1.00 0.00 N ATOM 3143 CA VAL B 89 -24.541 -7.424 -14.045 1.00 0.00 C ATOM 3144 C VAL B 89 -24.109 -6.554 -15.221 1.00 0.00 C ATOM 3145 O VAL B 89 -24.409 -5.381 -15.270 1.00 0.00 O ATOM 3146 CB VAL B 89 -26.054 -7.286 -13.866 1.00 0.00 C ATOM 3147 CG1 VAL B 89 -26.760 -8.054 -14.982 1.00 0.00 C ATOM 3148 CG2 VAL B 89 -26.484 -7.846 -12.508 1.00 0.00 C ATOM 0 H VAL B 89 -23.401 -6.018 -12.943 1.00 0.00 H new ATOM 0 HA VAL B 89 -24.306 -8.475 -14.213 1.00 0.00 H new ATOM 0 HB VAL B 89 -26.325 -6.231 -13.910 1.00 0.00 H new ATOM 0 HG11 VAL B 89 -27.839 -7.961 -14.862 1.00 0.00 H new ATOM 0 HG12 VAL B 89 -26.466 -7.644 -15.948 1.00 0.00 H new ATOM 0 HG13 VAL B 89 -26.479 -9.106 -14.934 1.00 0.00 H new ATOM 0 HG21 VAL B 89 -27.563 -7.740 -12.396 1.00 0.00 H new ATOM 0 HG22 VAL B 89 -26.214 -8.900 -12.447 1.00 0.00 H new ATOM 0 HG23 VAL B 89 -25.981 -7.297 -11.712 1.00 0.00 H new ATOM 3158 N TYR B 90 -23.401 -7.104 -16.162 1.00 0.00 N ATOM 3159 CA TYR B 90 -22.952 -6.277 -17.311 1.00 0.00 C ATOM 3160 C TYR B 90 -23.407 -6.911 -18.621 1.00 0.00 C ATOM 3161 O TYR B 90 -24.133 -7.882 -18.636 1.00 0.00 O ATOM 3162 CB TYR B 90 -21.429 -6.174 -17.298 1.00 0.00 C ATOM 3163 CG TYR B 90 -20.827 -7.498 -16.890 1.00 0.00 C ATOM 3164 CD1 TYR B 90 -20.657 -7.799 -15.534 1.00 0.00 C ATOM 3165 CD2 TYR B 90 -20.433 -8.420 -17.866 1.00 0.00 C ATOM 3166 CE1 TYR B 90 -20.093 -9.023 -15.152 1.00 0.00 C ATOM 3167 CE2 TYR B 90 -19.869 -9.644 -17.484 1.00 0.00 C ATOM 3168 CZ TYR B 90 -19.700 -9.945 -16.128 1.00 0.00 C ATOM 3169 OH TYR B 90 -19.143 -11.151 -15.754 1.00 0.00 O ATOM 0 H TYR B 90 -23.115 -8.083 -16.186 1.00 0.00 H new ATOM 0 HA TYR B 90 -23.388 -5.282 -17.226 1.00 0.00 H new ATOM 0 HB2 TYR B 90 -21.067 -5.889 -18.286 1.00 0.00 H new ATOM 0 HB3 TYR B 90 -21.115 -5.393 -16.606 1.00 0.00 H new ATOM 0 HD1 TYR B 90 -20.961 -7.087 -14.781 1.00 0.00 H new ATOM 0 HD2 TYR B 90 -20.564 -8.188 -18.913 1.00 0.00 H new ATOM 0 HE1 TYR B 90 -19.962 -9.255 -14.105 1.00 0.00 H new ATOM 0 HE2 TYR B 90 -19.564 -10.356 -18.237 1.00 0.00 H new ATOM 0 HH TYR B 90 -18.313 -10.988 -15.258 1.00 0.00 H new ATOM 3179 N TYR B 91 -22.992 -6.360 -19.725 1.00 0.00 N ATOM 3180 CA TYR B 91 -23.405 -6.921 -21.038 1.00 0.00 C ATOM 3181 C TYR B 91 -22.180 -7.227 -21.898 1.00 0.00 C ATOM 3182 O TYR B 91 -21.368 -6.365 -22.168 1.00 0.00 O ATOM 3183 CB TYR B 91 -24.266 -5.898 -21.770 1.00 0.00 C ATOM 3184 CG TYR B 91 -25.718 -6.157 -21.479 1.00 0.00 C ATOM 3185 CD1 TYR B 91 -26.328 -5.541 -20.384 1.00 0.00 C ATOM 3186 CD2 TYR B 91 -26.455 -7.001 -22.312 1.00 0.00 C ATOM 3187 CE1 TYR B 91 -27.683 -5.772 -20.120 1.00 0.00 C ATOM 3188 CE2 TYR B 91 -27.808 -7.231 -22.054 1.00 0.00 C ATOM 3189 CZ TYR B 91 -28.425 -6.617 -20.957 1.00 0.00 C ATOM 3190 OH TYR B 91 -29.762 -6.843 -20.699 1.00 0.00 O ATOM 0 H TYR B 91 -22.383 -5.543 -19.774 1.00 0.00 H new ATOM 0 HA TYR B 91 -23.963 -7.841 -20.865 1.00 0.00 H new ATOM 0 HB2 TYR B 91 -23.996 -4.890 -21.456 1.00 0.00 H new ATOM 0 HB3 TYR B 91 -24.084 -5.957 -22.843 1.00 0.00 H new ATOM 0 HD1 TYR B 91 -25.755 -4.888 -19.742 1.00 0.00 H new ATOM 0 HD2 TYR B 91 -25.978 -7.476 -23.157 1.00 0.00 H new ATOM 0 HE1 TYR B 91 -28.157 -5.300 -19.272 1.00 0.00 H new ATOM 0 HE2 TYR B 91 -28.378 -7.882 -22.700 1.00 0.00 H new ATOM 0 HH TYR B 91 -30.127 -7.451 -21.375 1.00 0.00 H new ATOM 3200 N VAL B 92 -22.062 -8.439 -22.361 1.00 0.00 N ATOM 3201 CA VAL B 92 -20.915 -8.787 -23.240 1.00 0.00 C ATOM 3202 C VAL B 92 -21.401 -8.710 -24.680 1.00 0.00 C ATOM 3203 O VAL B 92 -21.920 -9.663 -25.224 1.00 0.00 O ATOM 3204 CB VAL B 92 -20.428 -10.200 -22.943 1.00 0.00 C ATOM 3205 CG1 VAL B 92 -18.939 -10.283 -23.271 1.00 0.00 C ATOM 3206 CG2 VAL B 92 -20.651 -10.519 -21.464 1.00 0.00 C ATOM 0 H VAL B 92 -22.710 -9.203 -22.168 1.00 0.00 H new ATOM 0 HA VAL B 92 -20.088 -8.098 -23.068 1.00 0.00 H new ATOM 0 HB VAL B 92 -20.980 -10.920 -23.547 1.00 0.00 H new ATOM 0 HG11 VAL B 92 -18.576 -11.290 -23.063 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -18.785 -10.052 -24.325 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -18.391 -9.566 -22.659 1.00 0.00 H new ATOM 0 HG21 VAL B 92 -20.302 -11.530 -21.253 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -20.096 -9.809 -20.851 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -21.714 -10.446 -21.232 1.00 0.00 H new ATOM 3216 N GLY B 93 -21.262 -7.573 -25.290 1.00 0.00 N ATOM 3217 CA GLY B 93 -21.748 -7.417 -26.687 1.00 0.00 C ATOM 3218 C GLY B 93 -23.268 -7.226 -26.652 1.00 0.00 C ATOM 3219 O GLY B 93 -23.768 -6.128 -26.789 1.00 0.00 O ATOM 0 H GLY B 93 -20.833 -6.742 -24.883 1.00 0.00 H new ATOM 0 HA2 GLY B 93 -21.269 -6.561 -27.162 1.00 0.00 H new ATOM 0 HA3 GLY B 93 -21.490 -8.295 -27.279 1.00 0.00 H new ATOM 3223 N ARG B 94 -24.005 -8.291 -26.473 1.00 0.00 N ATOM 3224 CA ARG B 94 -25.494 -8.174 -26.432 1.00 0.00 C ATOM 3225 C ARG B 94 -26.093 -9.169 -25.430 1.00 0.00 C ATOM 3226 O ARG B 94 -27.292 -9.211 -25.234 1.00 0.00 O ATOM 3227 CB ARG B 94 -26.041 -8.488 -27.817 1.00 0.00 C ATOM 3228 CG ARG B 94 -25.375 -7.579 -28.852 1.00 0.00 C ATOM 3229 CD ARG B 94 -26.003 -7.819 -30.225 1.00 0.00 C ATOM 3230 NE ARG B 94 -25.233 -7.077 -31.262 1.00 0.00 N ATOM 3231 CZ ARG B 94 -25.232 -5.772 -31.269 1.00 0.00 C ATOM 3232 NH1 ARG B 94 -26.009 -5.110 -30.455 1.00 0.00 N ATOM 3233 NH2 ARG B 94 -24.451 -5.126 -32.092 1.00 0.00 N ATOM 0 H ARG B 94 -23.641 -9.236 -26.353 1.00 0.00 H new ATOM 0 HA ARG B 94 -25.761 -7.163 -26.124 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -25.855 -9.533 -28.064 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -27.121 -8.344 -27.833 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -25.494 -6.535 -28.564 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -24.304 -7.779 -28.891 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -26.007 -8.885 -30.453 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -27.042 -7.490 -30.224 1.00 0.00 H new ATOM 0 HE ARG B 94 -24.705 -7.590 -31.968 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -26.619 -5.613 -29.811 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -26.006 -4.090 -30.463 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -23.843 -5.641 -32.728 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -24.449 -4.106 -32.099 1.00 0.00 H new ATOM 3247 N LYS B 95 -25.286 -9.975 -24.804 1.00 0.00 N ATOM 3248 CA LYS B 95 -25.832 -10.965 -23.833 1.00 0.00 C ATOM 3249 C LYS B 95 -25.662 -10.437 -22.404 1.00 0.00 C ATOM 3250 O LYS B 95 -24.584 -10.032 -22.027 1.00 0.00 O ATOM 3251 CB LYS B 95 -25.068 -12.284 -23.977 1.00 0.00 C ATOM 3252 CG LYS B 95 -24.905 -12.626 -25.460 1.00 0.00 C ATOM 3253 CD LYS B 95 -23.457 -13.045 -25.730 1.00 0.00 C ATOM 3254 CE LYS B 95 -23.085 -12.728 -27.183 1.00 0.00 C ATOM 3255 NZ LYS B 95 -24.309 -12.734 -28.034 1.00 0.00 N ATOM 0 H LYS B 95 -24.273 -9.993 -24.921 1.00 0.00 H new ATOM 0 HA LYS B 95 -26.891 -11.125 -24.035 1.00 0.00 H new ATOM 0 HB2 LYS B 95 -24.090 -12.203 -23.503 1.00 0.00 H new ATOM 0 HB3 LYS B 95 -25.604 -13.084 -23.466 1.00 0.00 H new ATOM 0 HG2 LYS B 95 -25.586 -13.432 -25.736 1.00 0.00 H new ATOM 0 HG3 LYS B 95 -25.166 -11.764 -26.074 1.00 0.00 H new ATOM 0 HD2 LYS B 95 -22.785 -12.521 -25.051 1.00 0.00 H new ATOM 0 HD3 LYS B 95 -23.336 -14.111 -25.539 1.00 0.00 H new ATOM 0 HE2 LYS B 95 -22.598 -11.754 -27.239 1.00 0.00 H new ATOM 0 HE3 LYS B 95 -22.371 -13.463 -27.553 1.00 0.00 H new ATOM 0 HZ1 LYS B 95 -24.043 -12.909 -29.024 1.00 0.00 H new ATOM 0 HZ2 LYS B 95 -24.953 -13.484 -27.711 1.00 0.00 H new ATOM 0 HZ3 LYS B 95 -24.787 -11.813 -27.962 1.00 0.00 H new ATOM 3269 N PRO B 96 -26.728 -10.464 -21.644 1.00 0.00 N ATOM 3270 CA PRO B 96 -26.710 -9.995 -20.248 1.00 0.00 C ATOM 3271 C PRO B 96 -26.088 -11.069 -19.346 1.00 0.00 C ATOM 3272 O PRO B 96 -26.391 -12.239 -19.468 1.00 0.00 O ATOM 3273 CB PRO B 96 -28.190 -9.798 -19.915 1.00 0.00 C ATOM 3274 CG PRO B 96 -28.980 -10.686 -20.906 1.00 0.00 C ATOM 3275 CD PRO B 96 -28.043 -10.959 -22.098 1.00 0.00 C ATOM 0 HA PRO B 96 -26.124 -9.087 -20.103 1.00 0.00 H new ATOM 0 HB2 PRO B 96 -28.398 -10.085 -18.884 1.00 0.00 H new ATOM 0 HB3 PRO B 96 -28.476 -8.751 -20.018 1.00 0.00 H new ATOM 0 HG2 PRO B 96 -29.285 -11.619 -20.432 1.00 0.00 H new ATOM 0 HG3 PRO B 96 -29.890 -10.184 -21.236 1.00 0.00 H new ATOM 0 HD2 PRO B 96 -28.007 -12.021 -22.341 1.00 0.00 H new ATOM 0 HD3 PRO B 96 -28.377 -10.438 -22.995 1.00 0.00 H new ATOM 3283 N LYS B 97 -25.224 -10.687 -18.444 1.00 0.00 N ATOM 3284 CA LYS B 97 -24.592 -11.700 -17.550 1.00 0.00 C ATOM 3285 C LYS B 97 -24.358 -11.097 -16.161 1.00 0.00 C ATOM 3286 O LYS B 97 -24.123 -9.914 -16.018 1.00 0.00 O ATOM 3287 CB LYS B 97 -23.250 -12.134 -18.144 1.00 0.00 C ATOM 3288 CG LYS B 97 -23.425 -12.458 -19.629 1.00 0.00 C ATOM 3289 CD LYS B 97 -22.391 -13.504 -20.049 1.00 0.00 C ATOM 3290 CE LYS B 97 -22.792 -14.107 -21.398 1.00 0.00 C ATOM 3291 NZ LYS B 97 -24.104 -14.802 -21.262 1.00 0.00 N ATOM 0 H LYS B 97 -24.930 -9.723 -18.288 1.00 0.00 H new ATOM 0 HA LYS B 97 -25.254 -12.562 -17.462 1.00 0.00 H new ATOM 0 HB2 LYS B 97 -22.513 -11.341 -18.019 1.00 0.00 H new ATOM 0 HB3 LYS B 97 -22.872 -13.008 -17.613 1.00 0.00 H new ATOM 0 HG2 LYS B 97 -24.432 -12.832 -19.814 1.00 0.00 H new ATOM 0 HG3 LYS B 97 -23.306 -11.554 -20.226 1.00 0.00 H new ATOM 0 HD2 LYS B 97 -21.404 -13.046 -20.122 1.00 0.00 H new ATOM 0 HD3 LYS B 97 -22.324 -14.288 -19.294 1.00 0.00 H new ATOM 0 HE2 LYS B 97 -22.860 -13.323 -22.153 1.00 0.00 H new ATOM 0 HE3 LYS B 97 -22.030 -14.809 -21.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 -24.176 -15.551 -21.980 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 -24.177 -15.223 -20.314 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 -24.875 -14.117 -21.397 1.00 0.00 H new ATOM 3305 N VAL B 98 -24.408 -11.909 -15.141 1.00 0.00 N ATOM 3306 CA VAL B 98 -24.174 -11.396 -13.761 1.00 0.00 C ATOM 3307 C VAL B 98 -22.943 -12.086 -13.179 1.00 0.00 C ATOM 3308 O VAL B 98 -22.766 -13.279 -13.327 1.00 0.00 O ATOM 3309 CB VAL B 98 -25.382 -11.711 -12.877 1.00 0.00 C ATOM 3310 CG1 VAL B 98 -25.076 -11.301 -11.434 1.00 0.00 C ATOM 3311 CG2 VAL B 98 -26.598 -10.935 -13.381 1.00 0.00 C ATOM 0 H VAL B 98 -24.601 -12.909 -15.204 1.00 0.00 H new ATOM 0 HA VAL B 98 -24.023 -10.317 -13.797 1.00 0.00 H new ATOM 0 HB VAL B 98 -25.593 -12.780 -12.915 1.00 0.00 H new ATOM 0 HG11 VAL B 98 -25.936 -11.525 -10.802 1.00 0.00 H new ATOM 0 HG12 VAL B 98 -24.208 -11.854 -11.075 1.00 0.00 H new ATOM 0 HG13 VAL B 98 -24.866 -10.232 -11.396 1.00 0.00 H new ATOM 0 HG21 VAL B 98 -27.459 -11.159 -12.751 1.00 0.00 H new ATOM 0 HG22 VAL B 98 -26.389 -9.866 -13.343 1.00 0.00 H new ATOM 0 HG23 VAL B 98 -26.815 -11.226 -14.409 1.00 0.00 H new ATOM 3321 N GLU B 99 -22.086 -11.358 -12.518 1.00 0.00 N ATOM 3322 CA GLU B 99 -20.879 -12.002 -11.942 1.00 0.00 C ATOM 3323 C GLU B 99 -20.654 -11.499 -10.523 1.00 0.00 C ATOM 3324 O GLU B 99 -21.539 -10.964 -9.884 1.00 0.00 O ATOM 3325 CB GLU B 99 -19.659 -11.654 -12.786 1.00 0.00 C ATOM 3326 CG GLU B 99 -18.980 -12.939 -13.263 1.00 0.00 C ATOM 3327 CD GLU B 99 -17.460 -12.772 -13.185 1.00 0.00 C ATOM 3328 OE1 GLU B 99 -16.931 -12.859 -12.090 1.00 0.00 O ATOM 3329 OE2 GLU B 99 -16.854 -12.558 -14.221 1.00 0.00 O ATOM 0 H GLU B 99 -22.170 -10.355 -12.354 1.00 0.00 H new ATOM 0 HA GLU B 99 -21.026 -13.082 -11.931 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -19.957 -11.049 -13.642 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -18.959 -11.056 -12.202 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -19.296 -13.781 -12.647 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -19.280 -13.163 -14.287 1.00 0.00 H new ATOM 3336 N GLN B 100 -19.463 -11.666 -10.037 1.00 0.00 N ATOM 3337 CA GLN B 100 -19.132 -11.204 -8.666 1.00 0.00 C ATOM 3338 C GLN B 100 -17.682 -10.736 -8.655 1.00 0.00 C ATOM 3339 O GLN B 100 -16.783 -11.476 -8.306 1.00 0.00 O ATOM 3340 CB GLN B 100 -19.287 -12.359 -7.686 1.00 0.00 C ATOM 3341 CG GLN B 100 -20.689 -12.959 -7.807 1.00 0.00 C ATOM 3342 CD GLN B 100 -20.644 -14.184 -8.722 1.00 0.00 C ATOM 3343 OE1 GLN B 100 -20.024 -14.154 -9.766 1.00 0.00 O ATOM 3344 NE2 GLN B 100 -21.279 -15.269 -8.371 1.00 0.00 N ATOM 0 H GLN B 100 -18.693 -12.109 -10.538 1.00 0.00 H new ATOM 0 HA GLN B 100 -19.799 -10.392 -8.376 1.00 0.00 H new ATOM 0 HB2 GLN B 100 -18.536 -13.123 -7.889 1.00 0.00 H new ATOM 0 HB3 GLN B 100 -19.118 -12.009 -6.668 1.00 0.00 H new ATOM 0 HG2 GLN B 100 -21.061 -13.241 -6.822 1.00 0.00 H new ATOM 0 HG3 GLN B 100 -21.380 -12.218 -8.208 1.00 0.00 H new ATOM 0 HE21 GLN B 100 -21.800 -15.294 -7.494 1.00 0.00 H new ATOM 0 HE22 GLN B 100 -21.255 -16.092 -8.973 1.00 0.00 H new ATOM 3353 N LEU B 101 -17.444 -9.522 -9.050 1.00 0.00 N ATOM 3354 CA LEU B 101 -16.051 -9.014 -9.078 1.00 0.00 C ATOM 3355 C LEU B 101 -15.336 -9.424 -7.799 1.00 0.00 C ATOM 3356 O LEU B 101 -15.920 -9.498 -6.737 1.00 0.00 O ATOM 3357 CB LEU B 101 -16.051 -7.491 -9.209 1.00 0.00 C ATOM 3358 CG LEU B 101 -16.826 -7.067 -10.465 1.00 0.00 C ATOM 3359 CD1 LEU B 101 -16.339 -5.690 -10.922 1.00 0.00 C ATOM 3360 CD2 LEU B 101 -16.601 -8.080 -11.593 1.00 0.00 C ATOM 0 H LEU B 101 -18.156 -8.858 -9.355 1.00 0.00 H new ATOM 0 HA LEU B 101 -15.531 -9.440 -9.936 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -16.504 -7.043 -8.325 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -15.026 -7.123 -9.264 1.00 0.00 H new ATOM 0 HG LEU B 101 -17.889 -7.026 -10.228 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -16.888 -5.387 -11.814 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -16.507 -4.963 -10.128 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -15.274 -5.738 -11.150 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -17.156 -7.768 -12.478 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -15.538 -8.131 -11.830 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -16.949 -9.063 -11.274 1.00 0.00 H new ATOM 3372 N SER B 102 -14.075 -9.709 -7.902 1.00 0.00 N ATOM 3373 CA SER B 102 -13.305 -10.141 -6.699 1.00 0.00 C ATOM 3374 C SER B 102 -12.471 -8.979 -6.157 1.00 0.00 C ATOM 3375 O SER B 102 -11.920 -8.198 -6.906 1.00 0.00 O ATOM 3376 CB SER B 102 -12.377 -11.295 -7.078 1.00 0.00 C ATOM 3377 OG SER B 102 -13.143 -12.483 -7.228 1.00 0.00 O ATOM 0 H SER B 102 -13.537 -9.663 -8.768 1.00 0.00 H new ATOM 0 HA SER B 102 -14.005 -10.465 -5.929 1.00 0.00 H new ATOM 0 HB2 SER B 102 -11.854 -11.066 -8.006 1.00 0.00 H new ATOM 0 HB3 SER B 102 -11.617 -11.433 -6.309 1.00 0.00 H new ATOM 0 HG SER B 102 -12.551 -13.225 -7.473 1.00 0.00 H new ATOM 3383 N ASN B 103 -12.365 -8.864 -4.858 1.00 0.00 N ATOM 3384 CA ASN B 103 -11.552 -7.754 -4.276 1.00 0.00 C ATOM 3385 C ASN B 103 -12.046 -6.419 -4.824 1.00 0.00 C ATOM 3386 O ASN B 103 -11.291 -5.478 -4.972 1.00 0.00 O ATOM 3387 CB ASN B 103 -10.083 -7.947 -4.659 1.00 0.00 C ATOM 3388 CG ASN B 103 -9.387 -8.811 -3.606 1.00 0.00 C ATOM 3389 OD1 ASN B 103 -8.222 -8.618 -3.319 1.00 0.00 O ATOM 3390 ND2 ASN B 103 -10.054 -9.765 -3.016 1.00 0.00 N ATOM 0 H ASN B 103 -12.803 -9.486 -4.179 1.00 0.00 H new ATOM 0 HA ASN B 103 -11.652 -7.761 -3.191 1.00 0.00 H new ATOM 0 HB2 ASN B 103 -10.011 -8.421 -5.638 1.00 0.00 H new ATOM 0 HB3 ASN B 103 -9.587 -6.980 -4.736 1.00 0.00 H new ATOM 0 HD21 ASN B 103 -9.597 -10.348 -2.315 1.00 0.00 H new ATOM 0 HD22 ASN B 103 -11.032 -9.928 -3.256 1.00 0.00 H new ATOM 3397 N MET B 104 -13.310 -6.324 -5.121 1.00 0.00 N ATOM 3398 CA MET B 104 -13.854 -5.048 -5.652 1.00 0.00 C ATOM 3399 C MET B 104 -14.404 -4.224 -4.489 1.00 0.00 C ATOM 3400 O MET B 104 -15.233 -3.355 -4.667 1.00 0.00 O ATOM 3401 CB MET B 104 -14.975 -5.345 -6.648 1.00 0.00 C ATOM 3402 CG MET B 104 -14.858 -4.399 -7.843 1.00 0.00 C ATOM 3403 SD MET B 104 -15.817 -2.899 -7.521 1.00 0.00 S ATOM 3404 CE MET B 104 -16.216 -2.517 -9.243 1.00 0.00 C ATOM 0 H MET B 104 -13.990 -7.077 -5.018 1.00 0.00 H new ATOM 0 HA MET B 104 -13.066 -4.491 -6.158 1.00 0.00 H new ATOM 0 HB2 MET B 104 -14.914 -6.380 -6.983 1.00 0.00 H new ATOM 0 HB3 MET B 104 -15.945 -5.222 -6.167 1.00 0.00 H new ATOM 0 HG2 MET B 104 -13.813 -4.145 -8.018 1.00 0.00 H new ATOM 0 HG3 MET B 104 -15.222 -4.889 -8.746 1.00 0.00 H new ATOM 0 HE1 MET B 104 -16.214 -1.436 -9.386 1.00 0.00 H new ATOM 0 HE2 MET B 104 -15.472 -2.971 -9.898 1.00 0.00 H new ATOM 0 HE3 MET B 104 -17.202 -2.913 -9.484 1.00 0.00 H new ATOM 3414 N ILE B 105 -13.943 -4.494 -3.297 1.00 0.00 N ATOM 3415 CA ILE B 105 -14.430 -3.729 -2.115 1.00 0.00 C ATOM 3416 C ILE B 105 -13.365 -3.766 -1.019 1.00 0.00 C ATOM 3417 O ILE B 105 -12.436 -4.547 -1.070 1.00 0.00 O ATOM 3418 CB ILE B 105 -15.716 -4.360 -1.583 1.00 0.00 C ATOM 3419 CG1 ILE B 105 -16.799 -4.302 -2.661 1.00 0.00 C ATOM 3420 CG2 ILE B 105 -16.185 -3.589 -0.347 1.00 0.00 C ATOM 3421 CD1 ILE B 105 -18.118 -4.816 -2.085 1.00 0.00 C ATOM 0 H ILE B 105 -13.249 -5.213 -3.092 1.00 0.00 H new ATOM 0 HA ILE B 105 -14.627 -2.698 -2.410 1.00 0.00 H new ATOM 0 HB ILE B 105 -15.527 -5.400 -1.316 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -16.919 -3.279 -3.016 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -16.505 -4.905 -3.520 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -17.102 -4.037 0.035 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -15.414 -3.630 0.422 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -16.373 -2.550 -0.616 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -18.891 -4.775 -2.853 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -17.992 -5.846 -1.751 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -18.413 -4.194 -1.240 1.00 0.00 H new ATOM 3433 N VAL B 106 -13.492 -2.932 -0.026 1.00 0.00 N ATOM 3434 CA VAL B 106 -12.490 -2.924 1.070 1.00 0.00 C ATOM 3435 C VAL B 106 -13.171 -3.341 2.378 1.00 0.00 C ATOM 3436 O VAL B 106 -14.343 -3.097 2.586 1.00 0.00 O ATOM 3437 CB VAL B 106 -11.913 -1.513 1.206 1.00 0.00 C ATOM 3438 CG1 VAL B 106 -11.243 -1.358 2.570 1.00 0.00 C ATOM 3439 CG2 VAL B 106 -10.877 -1.279 0.104 1.00 0.00 C ATOM 0 H VAL B 106 -14.249 -2.255 0.072 1.00 0.00 H new ATOM 0 HA VAL B 106 -11.684 -3.624 0.848 1.00 0.00 H new ATOM 0 HB VAL B 106 -12.719 -0.785 1.114 1.00 0.00 H new ATOM 0 HG11 VAL B 106 -10.834 -0.352 2.662 1.00 0.00 H new ATOM 0 HG12 VAL B 106 -11.978 -1.524 3.357 1.00 0.00 H new ATOM 0 HG13 VAL B 106 -10.438 -2.087 2.665 1.00 0.00 H new ATOM 0 HG21 VAL B 106 -10.465 -0.274 0.199 1.00 0.00 H new ATOM 0 HG22 VAL B 106 -10.075 -2.011 0.198 1.00 0.00 H new ATOM 0 HG23 VAL B 106 -11.353 -1.385 -0.871 1.00 0.00 H new ATOM 3449 N ARG B 107 -12.441 -3.965 3.262 1.00 0.00 N ATOM 3450 CA ARG B 107 -13.040 -4.395 4.556 1.00 0.00 C ATOM 3451 C ARG B 107 -12.011 -4.210 5.673 1.00 0.00 C ATOM 3452 O ARG B 107 -12.177 -4.700 6.773 1.00 0.00 O ATOM 3453 CB ARG B 107 -13.442 -5.869 4.470 1.00 0.00 C ATOM 3454 CG ARG B 107 -14.715 -6.100 5.287 1.00 0.00 C ATOM 3455 CD ARG B 107 -14.398 -7.004 6.480 1.00 0.00 C ATOM 3456 NE ARG B 107 -15.663 -7.579 7.018 1.00 0.00 N ATOM 3457 CZ ARG B 107 -15.622 -8.456 7.983 1.00 0.00 C ATOM 3458 NH1 ARG B 107 -14.761 -8.318 8.953 1.00 0.00 N ATOM 3459 NH2 ARG B 107 -16.443 -9.471 7.977 1.00 0.00 N ATOM 0 H ARG B 107 -11.455 -4.196 3.143 1.00 0.00 H new ATOM 0 HA ARG B 107 -13.923 -3.793 4.768 1.00 0.00 H new ATOM 0 HB2 ARG B 107 -13.608 -6.151 3.430 1.00 0.00 H new ATOM 0 HB3 ARG B 107 -12.636 -6.499 4.847 1.00 0.00 H new ATOM 0 HG2 ARG B 107 -15.115 -5.147 5.635 1.00 0.00 H new ATOM 0 HG3 ARG B 107 -15.482 -6.559 4.663 1.00 0.00 H new ATOM 0 HD2 ARG B 107 -13.724 -7.804 6.175 1.00 0.00 H new ATOM 0 HD3 ARG B 107 -13.886 -6.434 7.256 1.00 0.00 H new ATOM 0 HE ARG B 107 -16.561 -7.287 6.632 1.00 0.00 H new ATOM 0 HH11 ARG B 107 -14.120 -7.525 8.957 1.00 0.00 H new ATOM 0 HH12 ARG B 107 -14.729 -9.003 9.708 1.00 0.00 H new ATOM 0 HH21 ARG B 107 -17.116 -9.578 7.218 1.00 0.00 H new ATOM 0 HH22 ARG B 107 -16.411 -10.157 8.731 1.00 0.00 H new ATOM 3473 N SER B 108 -10.948 -3.506 5.394 1.00 0.00 N ATOM 3474 CA SER B 108 -9.900 -3.284 6.429 1.00 0.00 C ATOM 3475 C SER B 108 -8.613 -2.825 5.743 1.00 0.00 C ATOM 3476 O SER B 108 -8.140 -3.447 4.812 1.00 0.00 O ATOM 3477 CB SER B 108 -9.640 -4.590 7.182 1.00 0.00 C ATOM 3478 OG SER B 108 -10.017 -5.688 6.363 1.00 0.00 O ATOM 0 H SER B 108 -10.760 -3.073 4.490 1.00 0.00 H new ATOM 0 HA SER B 108 -10.234 -2.523 7.134 1.00 0.00 H new ATOM 0 HB2 SER B 108 -8.586 -4.666 7.449 1.00 0.00 H new ATOM 0 HB3 SER B 108 -10.206 -4.605 8.113 1.00 0.00 H new ATOM 0 HG SER B 108 -10.892 -6.024 6.649 1.00 0.00 H new ATOM 3484 N CYS B 109 -8.044 -1.737 6.185 1.00 0.00 N ATOM 3485 CA CYS B 109 -6.792 -1.242 5.541 1.00 0.00 C ATOM 3486 C CYS B 109 -5.569 -1.765 6.301 1.00 0.00 C ATOM 3487 O CYS B 109 -5.672 -2.648 7.129 1.00 0.00 O ATOM 3488 CB CYS B 109 -6.782 0.287 5.555 1.00 0.00 C ATOM 3489 SG CYS B 109 -8.043 0.910 4.416 1.00 0.00 S ATOM 0 H CYS B 109 -8.389 -1.171 6.960 1.00 0.00 H new ATOM 0 HA CYS B 109 -6.755 -1.601 4.512 1.00 0.00 H new ATOM 0 HB2 CYS B 109 -6.975 0.653 6.563 1.00 0.00 H new ATOM 0 HB3 CYS B 109 -5.799 0.657 5.264 1.00 0.00 H new ATOM 3494 N LYS B 110 -4.409 -1.227 6.021 1.00 0.00 N ATOM 3495 CA LYS B 110 -3.179 -1.692 6.718 1.00 0.00 C ATOM 3496 C LYS B 110 -2.037 -0.728 6.391 1.00 0.00 C ATOM 3497 O LYS B 110 -2.238 0.462 6.282 1.00 0.00 O ATOM 3498 CB LYS B 110 -2.822 -3.101 6.238 1.00 0.00 C ATOM 3499 CG LYS B 110 -2.220 -3.898 7.396 1.00 0.00 C ATOM 3500 CD LYS B 110 -3.104 -5.110 7.696 1.00 0.00 C ATOM 3501 CE LYS B 110 -3.725 -4.958 9.086 1.00 0.00 C ATOM 3502 NZ LYS B 110 -4.817 -5.958 9.253 1.00 0.00 N ATOM 0 H LYS B 110 -4.264 -0.484 5.337 1.00 0.00 H new ATOM 0 HA LYS B 110 -3.345 -1.716 7.795 1.00 0.00 H new ATOM 0 HB2 LYS B 110 -3.712 -3.604 5.860 1.00 0.00 H new ATOM 0 HB3 LYS B 110 -2.112 -3.046 5.413 1.00 0.00 H new ATOM 0 HG2 LYS B 110 -1.212 -4.224 7.141 1.00 0.00 H new ATOM 0 HG3 LYS B 110 -2.137 -3.267 8.281 1.00 0.00 H new ATOM 0 HD2 LYS B 110 -3.888 -5.197 6.944 1.00 0.00 H new ATOM 0 HD3 LYS B 110 -2.513 -6.025 7.648 1.00 0.00 H new ATOM 0 HE2 LYS B 110 -2.965 -5.102 9.854 1.00 0.00 H new ATOM 0 HE3 LYS B 110 -4.118 -3.949 9.212 1.00 0.00 H new ATOM 0 HZ1 LYS B 110 -5.240 -5.856 10.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 110 -5.546 -5.800 8.528 1.00 0.00 H new ATOM 0 HZ3 LYS B 110 -4.428 -6.917 9.150 1.00 0.00 H new ATOM 3516 N CYS B 111 -0.841 -1.220 6.227 1.00 0.00 N ATOM 3517 CA CYS B 111 0.291 -0.306 5.903 1.00 0.00 C ATOM 3518 C CYS B 111 1.357 -1.071 5.117 1.00 0.00 C ATOM 3519 O CYS B 111 2.330 -1.544 5.669 1.00 0.00 O ATOM 3520 CB CYS B 111 0.891 0.240 7.203 1.00 0.00 C ATOM 3521 SG CYS B 111 -0.158 1.580 7.827 1.00 0.00 S ATOM 0 H CYS B 111 -0.599 -2.208 6.302 1.00 0.00 H new ATOM 0 HA CYS B 111 -0.070 0.525 5.297 1.00 0.00 H new ATOM 0 HB2 CYS B 111 0.966 -0.555 7.945 1.00 0.00 H new ATOM 0 HB3 CYS B 111 1.902 0.606 7.025 1.00 0.00 H new ATOM 3526 N SER B 112 1.180 -1.198 3.828 1.00 0.00 N ATOM 3527 CA SER B 112 2.182 -1.933 3.010 1.00 0.00 C ATOM 3528 C SER B 112 3.310 -0.982 2.605 1.00 0.00 C ATOM 3529 O SER B 112 4.456 -1.394 2.667 1.00 0.00 O ATOM 3530 CB SER B 112 1.507 -2.484 1.753 1.00 0.00 C ATOM 3531 OG SER B 112 2.134 -3.704 1.380 1.00 0.00 O ATOM 3532 OXT SER B 112 3.007 0.143 2.241 1.00 0.00 O ATOM 0 H SER B 112 0.385 -0.824 3.309 1.00 0.00 H new ATOM 0 HA SER B 112 2.593 -2.756 3.595 1.00 0.00 H new ATOM 0 HB2 SER B 112 0.446 -2.649 1.939 1.00 0.00 H new ATOM 0 HB3 SER B 112 1.580 -1.761 0.941 1.00 0.00 H new ATOM 0 HG SER B 112 1.583 -4.164 0.713 1.00 0.00 H new TER 3538 SER B 112