USER MOD reduce.3.24.130724 H: found=0, std=0, add=1806, rem=0, adj=63 USER MOD reduce.3.24.130724 removed 1802 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 21 TYR OH : rot 80:sc= -0.914! USER MOD Set 1.2: B 113 HIS : no HE2:sc= -2.2! C(o=-3.1!,f=-13!) USER MOD Set 2.1: B 35 THR OG1 : rot -40:sc= 0.483 USER MOD Set 2.2: B 51 SER OG : rot 103:sc= -0.924 USER MOD Set 2.3: B 53 HIS : no HD1:sc= -0.152 X(o=-0.59,f=-0.81) USER MOD Set 3.1: B 19 GLN : amide:sc= 0.261 K(o=0.92,f=-6.5!) USER MOD Set 3.2: B 22 LYS NZ :NH3+ 170:sc= 0.654 (180deg=0) USER MOD Set 4.1: A 43 ASN : amide:sc= -0.111 X(o=-0.29,f=-0.054) USER MOD Set 4.2: B 3 HIS : no HD1:sc= -0.175 X(o=-0.29,f=-0.66) USER MOD Set 5.1: A 118 TYR OH : rot -39:sc= 0.852 USER MOD Set 5.2: B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 81 THR OG1 : rot 98:sc= 2.29 USER MOD Set 6.2: B 2 THR OG1 : rot 166:sc= 1.24 USER MOD Set 7.1: A 46 LYS NZ :NH3+ -149:sc= 0.0836 (180deg=0) USER MOD Set 7.2: B 118 TYR OH : rot -35:sc= 1.1 USER MOD Set 8.1: A 35 THR OG1 : rot -41:sc= 0.354 USER MOD Set 8.2: A 51 SER OG : rot 103:sc= -0.755 USER MOD Set 8.3: A 53 HIS : no HD1:sc= -0.121 X(o=-0.52,f=-0.43) USER MOD Set 9.1: A 19 GLN : amide:sc= 0.365 K(o=1.1,f=-5.4!) USER MOD Set 9.2: A 22 LYS NZ :NH3+ 171:sc= 0.726 (180deg=0) USER MOD Set10.1: A 21 TYR OH : rot 78:sc= -0.927! USER MOD Set10.2: A 113 HIS : no HE2:sc= -2! C(o=-2.9!,f=-13!) USER MOD Set11.1: A 17 SER OG : rot -89:sc= 0.755 USER MOD Set11.2: A 18 THR OG1 : rot 98:sc= -0.134 USER MOD Set12.1: A 7 THR OG1 : rot 170:sc= 0.305 USER MOD Set12.2: B 7 THR OG1 : rot 25:sc= 0.288 USER MOD Set13.1: A 1 MET CE :methyl -162:sc= 0 (180deg=-0.256) USER MOD Set13.2: A 2 THR OG1 : rot 177:sc= 1.24 USER MOD Set13.3: B 81 THR OG1 : rot 80:sc= 2.29 USER MOD Single : A 1 MET N :NH3+ 178:sc= -0.0458 (180deg=-0.0548) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 TYR OH : rot -6:sc= -1.7 USER MOD Single : A 13 ASN : amide:sc= -0.788 K(o=-0.79,f=-6.4!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot -170:sc= -0.71 USER MOD Single : A 37 SER OG : rot -78:sc= -0.0179 USER MOD Single : A 45 MET CE :methyl 163:sc= -0.0293 (180deg=-0.344) USER MOD Single : A 54 THR OG1 : rot -41:sc= 0.236 USER MOD Single : A 58 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0326) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.842 USER MOD Single : A 74 ASN : amide:sc= -1.43! C(o=-1.4!,f=-3.4!) USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 86 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.173) USER MOD Single : A 88 SER OG : rot -20:sc= 0.414 USER MOD Single : A 92 MET CE :methyl -121:sc= -2.1 (180deg=-3.64!) USER MOD Single : A 94 GLN : amide:sc= 0.122 X(o=0.12,f=-0.19) USER MOD Single : A 95 GLN : amide:sc= -0.0012 K(o=-0.0012,f=-0.91) USER MOD Single : A 98 LYS NZ :NH3+ -132:sc= -0.0785 (180deg=-0.475) USER MOD Single : A 99 MET CE :methyl -120:sc= -0.0423 (180deg=-0.77) USER MOD Single : A 103 TYR OH : rot -54:sc= 0.261 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0.0191 USER MOD Single : A 106 THR OG1 : rot 137:sc= 0.441 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -174:sc= -0.101 (180deg=-0.176) USER MOD Single : B 1 MET N :NH3+ -140:sc= 0.0741 (180deg=0) USER MOD Single : B 10 TYR OH : rot -5:sc= -2.15! USER MOD Single : B 13 ASN : amide:sc= -0.901 K(o=-0.9,f=-5.3!) USER MOD Single : B 17 SER OG : rot 92:sc= 0.39 USER MOD Single : B 18 THR OG1 : rot 97:sc= 0.0123 USER MOD Single : B 32 SER OG : rot 36:sc= 0.03 USER MOD Single : B 33 SER OG : rot -120:sc= -0.251 USER MOD Single : B 37 SER OG : rot 101:sc= -0.0227 USER MOD Single : B 43 ASN : amide:sc= -3.98! C(o=-4!,f=-16!) USER MOD Single : B 45 MET CE :methyl 170:sc= 0 (180deg=-0.0859) USER MOD Single : B 54 THR OG1 : rot -42:sc= 0.372 USER MOD Single : B 58 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.003) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 ASN : amide:sc= -1.15 K(o=-1.1,f=-3!) USER MOD Single : B 77 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : B 86 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.312) USER MOD Single : B 88 SER OG : rot -36:sc= 0.42 USER MOD Single : B 92 MET CE :methyl -120:sc= -2.18 (180deg=-3.68!) USER MOD Single : B 94 GLN : amide:sc= -0.0385 X(o=-0.038,f=-0.3) USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : B 98 LYS NZ :NH3+ -164:sc= -0.0427 (180deg=-0.287) USER MOD Single : B 99 MET CE :methyl -121:sc= -0.153 (180deg=-0.621) USER MOD Single : B 103 TYR OH : rot -65:sc= 0.489 USER MOD Single : B 104 THR OG1 : rot 170:sc= 0 USER MOD Single : B 106 THR OG1 : rot 100:sc= 0.568 USER MOD Single : B 112 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.645 18.860 -8.162 1.00 0.00 N ATOM 2 CA MET A 1 6.807 17.950 -8.133 1.00 0.00 C ATOM 3 C MET A 1 6.359 16.471 -8.251 1.00 0.00 C ATOM 4 O MET A 1 6.418 15.893 -9.339 1.00 0.00 O ATOM 5 CB MET A 1 7.692 18.227 -6.864 1.00 0.00 C ATOM 6 CG MET A 1 6.911 18.366 -5.547 1.00 0.00 C ATOM 7 SD MET A 1 7.940 18.723 -4.112 1.00 0.00 S ATOM 8 CE MET A 1 8.822 17.184 -3.894 1.00 0.00 C ATOM 0 H1 MET A 1 5.970 19.841 -8.047 1.00 0.00 H new ATOM 0 H2 MET A 1 5.151 18.763 -9.072 1.00 0.00 H new ATOM 0 H3 MET A 1 4.995 18.618 -7.387 1.00 0.00 H new ATOM 0 HA MET A 1 7.434 18.147 -9.002 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.413 17.416 -6.758 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.262 19.141 -7.029 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.173 19.161 -5.657 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.361 17.443 -5.365 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.239 17.143 -2.888 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.137 16.348 -4.037 1.00 0.00 H new ATOM 0 HE3 MET A 1 9.629 17.121 -4.624 1.00 0.00 H new ATOM 18 N THR A 2 5.809 15.902 -7.159 1.00 0.00 N ATOM 19 CA THR A 2 5.752 14.447 -6.948 1.00 0.00 C ATOM 20 C THR A 2 4.401 14.035 -6.314 1.00 0.00 C ATOM 21 O THR A 2 3.905 14.718 -5.407 1.00 0.00 O ATOM 22 CB THR A 2 6.942 14.033 -6.021 1.00 0.00 C ATOM 23 OG1 THR A 2 8.149 14.660 -6.490 1.00 0.00 O ATOM 24 CG2 THR A 2 7.153 12.520 -6.003 1.00 0.00 C ATOM 0 H THR A 2 5.393 16.441 -6.400 1.00 0.00 H new ATOM 0 HA THR A 2 5.834 13.935 -7.907 1.00 0.00 H new ATOM 0 HB THR A 2 6.701 14.357 -5.009 1.00 0.00 H new ATOM 0 HG1 THR A 2 8.889 14.437 -5.887 1.00 0.00 H new ATOM 0 HG21 THR A 2 7.989 12.277 -5.347 1.00 0.00 H new ATOM 0 HG22 THR A 2 6.250 12.031 -5.637 1.00 0.00 H new ATOM 0 HG23 THR A 2 7.371 12.171 -7.012 1.00 0.00 H new ATOM 32 N HIS A 3 3.804 12.916 -6.796 1.00 0.00 N ATOM 33 CA HIS A 3 2.447 12.474 -6.376 1.00 0.00 C ATOM 34 C HIS A 3 2.391 10.944 -6.132 1.00 0.00 C ATOM 35 O HIS A 3 2.931 10.171 -6.930 1.00 0.00 O ATOM 36 CB HIS A 3 1.395 12.874 -7.451 1.00 0.00 C ATOM 37 CG HIS A 3 1.163 14.362 -7.579 1.00 0.00 C ATOM 38 ND1 HIS A 3 0.224 15.039 -6.835 1.00 0.00 N ATOM 39 CD2 HIS A 3 1.762 15.297 -8.354 1.00 0.00 C ATOM 40 CE1 HIS A 3 0.253 16.318 -7.146 1.00 0.00 C ATOM 41 NE2 HIS A 3 1.178 16.504 -8.062 1.00 0.00 N ATOM 0 H HIS A 3 4.243 12.299 -7.480 1.00 0.00 H new ATOM 0 HA HIS A 3 2.216 12.973 -5.435 1.00 0.00 H new ATOM 0 HB2 HIS A 3 1.716 12.485 -8.417 1.00 0.00 H new ATOM 0 HB3 HIS A 3 0.448 12.391 -7.211 1.00 0.00 H new ATOM 0 HD2 HIS A 3 2.553 15.125 -9.069 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -0.377 17.085 -6.720 1.00 0.00 H new ATOM 0 HE2 HIS A 3 1.422 17.399 -8.486 1.00 0.00 H new ATOM 50 N PRO A 4 1.753 10.477 -5.000 1.00 0.00 N ATOM 51 CA PRO A 4 1.525 9.045 -4.732 1.00 0.00 C ATOM 52 C PRO A 4 0.131 8.550 -5.211 1.00 0.00 C ATOM 53 O PRO A 4 -0.874 8.663 -4.501 1.00 0.00 O ATOM 54 CB PRO A 4 1.684 8.984 -3.198 1.00 0.00 C ATOM 55 CG PRO A 4 1.129 10.300 -2.704 1.00 0.00 C ATOM 56 CD PRO A 4 1.262 11.298 -3.857 1.00 0.00 C ATOM 0 HA PRO A 4 2.208 8.389 -5.271 1.00 0.00 H new ATOM 0 HB2 PRO A 4 1.138 8.140 -2.776 1.00 0.00 H new ATOM 0 HB3 PRO A 4 2.729 8.862 -2.912 1.00 0.00 H new ATOM 0 HG2 PRO A 4 0.086 10.192 -2.405 1.00 0.00 H new ATOM 0 HG3 PRO A 4 1.678 10.646 -1.828 1.00 0.00 H new ATOM 0 HD2 PRO A 4 0.307 11.769 -4.087 1.00 0.00 H new ATOM 0 HD3 PRO A 4 1.961 12.098 -3.612 1.00 0.00 H new ATOM 64 N ASP A 5 0.077 8.043 -6.449 1.00 0.00 N ATOM 65 CA ASP A 5 -1.121 7.345 -6.991 1.00 0.00 C ATOM 66 C ASP A 5 -0.891 5.822 -6.988 1.00 0.00 C ATOM 67 O ASP A 5 -1.698 5.041 -7.517 1.00 0.00 O ATOM 68 CB ASP A 5 -1.430 7.843 -8.419 1.00 0.00 C ATOM 69 CG ASP A 5 -0.308 7.533 -9.421 1.00 0.00 C ATOM 70 OD1 ASP A 5 0.676 8.309 -9.489 1.00 0.00 O ATOM 71 OD2 ASP A 5 -0.408 6.526 -10.156 1.00 0.00 O ATOM 0 H ASP A 5 0.853 8.099 -7.109 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.978 7.569 -6.356 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -2.356 7.383 -8.765 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -1.599 8.920 -8.393 1.00 0.00 H new ATOM 76 N PHE A 6 0.205 5.427 -6.339 1.00 0.00 N ATOM 77 CA PHE A 6 0.761 4.084 -6.390 1.00 0.00 C ATOM 78 C PHE A 6 1.069 3.638 -4.948 1.00 0.00 C ATOM 79 O PHE A 6 1.578 4.414 -4.130 1.00 0.00 O ATOM 80 CB PHE A 6 2.040 4.117 -7.296 1.00 0.00 C ATOM 81 CG PHE A 6 2.762 2.790 -7.607 1.00 0.00 C ATOM 82 CD1 PHE A 6 2.253 1.548 -7.255 1.00 0.00 C ATOM 83 CD2 PHE A 6 3.981 2.807 -8.290 1.00 0.00 C ATOM 84 CE1 PHE A 6 2.924 0.389 -7.567 1.00 0.00 C ATOM 85 CE2 PHE A 6 4.651 1.643 -8.596 1.00 0.00 C ATOM 86 CZ PHE A 6 4.125 0.437 -8.236 1.00 0.00 C ATOM 0 H PHE A 6 0.744 6.057 -5.745 1.00 0.00 H new ATOM 0 HA PHE A 6 0.065 3.365 -6.822 1.00 0.00 H new ATOM 0 HB2 PHE A 6 1.760 4.572 -8.246 1.00 0.00 H new ATOM 0 HB3 PHE A 6 2.762 4.783 -6.824 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.313 1.491 -6.726 1.00 0.00 H new ATOM 0 HD2 PHE A 6 4.408 3.754 -8.585 1.00 0.00 H new ATOM 0 HE1 PHE A 6 2.505 -0.566 -7.285 1.00 0.00 H new ATOM 0 HE2 PHE A 6 5.594 1.685 -9.121 1.00 0.00 H new ATOM 0 HZ PHE A 6 4.649 -0.476 -8.475 1.00 0.00 H new ATOM 96 N THR A 7 0.711 2.395 -4.648 1.00 0.00 N ATOM 97 CA THR A 7 1.034 1.726 -3.387 1.00 0.00 C ATOM 98 C THR A 7 1.604 0.347 -3.717 1.00 0.00 C ATOM 99 O THR A 7 1.178 -0.298 -4.678 1.00 0.00 O ATOM 100 CB THR A 7 -0.220 1.590 -2.461 1.00 0.00 C ATOM 101 OG1 THR A 7 0.143 0.948 -1.227 1.00 0.00 O ATOM 102 CG2 THR A 7 -1.371 0.804 -3.130 1.00 0.00 C ATOM 0 H THR A 7 0.176 1.808 -5.288 1.00 0.00 H new ATOM 0 HA THR A 7 1.764 2.324 -2.841 1.00 0.00 H new ATOM 0 HB THR A 7 -0.580 2.600 -2.268 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.602 1.012 -0.594 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.215 0.740 -2.443 1.00 0.00 H new ATOM 0 HG22 THR A 7 -1.682 1.318 -4.040 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.029 -0.201 -3.379 1.00 0.00 H new ATOM 110 N ILE A 8 2.596 -0.081 -2.939 1.00 0.00 N ATOM 111 CA ILE A 8 3.236 -1.389 -3.098 1.00 0.00 C ATOM 112 C ILE A 8 3.067 -2.181 -1.788 1.00 0.00 C ATOM 113 O ILE A 8 3.237 -1.637 -0.687 1.00 0.00 O ATOM 114 CB ILE A 8 4.764 -1.234 -3.464 1.00 0.00 C ATOM 115 CG1 ILE A 8 4.965 -0.363 -4.742 1.00 0.00 C ATOM 116 CG2 ILE A 8 5.463 -2.606 -3.617 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.416 -0.139 -5.147 1.00 0.00 C ATOM 0 H ILE A 8 2.982 0.473 -2.174 1.00 0.00 H new ATOM 0 HA ILE A 8 2.761 -1.927 -3.918 1.00 0.00 H new ATOM 0 HB ILE A 8 5.235 -0.715 -2.629 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.441 -0.836 -5.572 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.495 0.607 -4.580 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.512 -2.454 -3.869 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.391 -3.157 -2.680 1.00 0.00 H new ATOM 0 HG23 ILE A 8 4.978 -3.175 -4.411 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.452 0.477 -6.045 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.945 0.366 -4.339 1.00 0.00 H new ATOM 0 HD13 ILE A 8 6.890 -1.100 -5.347 1.00 0.00 H new ATOM 129 N LEU A 9 2.691 -3.458 -1.923 1.00 0.00 N ATOM 130 CA LEU A 9 2.619 -4.405 -0.810 1.00 0.00 C ATOM 131 C LEU A 9 4.029 -4.935 -0.573 1.00 0.00 C ATOM 132 O LEU A 9 4.714 -5.375 -1.501 1.00 0.00 O ATOM 133 CB LEU A 9 1.635 -5.545 -1.148 1.00 0.00 C ATOM 134 CG LEU A 9 0.157 -5.092 -1.362 1.00 0.00 C ATOM 135 CD1 LEU A 9 -0.702 -6.255 -1.867 1.00 0.00 C ATOM 136 CD2 LEU A 9 -0.440 -4.468 -0.076 1.00 0.00 C ATOM 0 H LEU A 9 2.426 -3.865 -2.820 1.00 0.00 H new ATOM 0 HA LEU A 9 2.250 -3.923 0.095 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.980 -6.048 -2.051 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.662 -6.280 -0.343 1.00 0.00 H new ATOM 0 HG LEU A 9 0.156 -4.316 -2.127 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -1.728 -5.915 -2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.305 -6.615 -2.816 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.685 -7.064 -1.136 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -1.470 -4.164 -0.263 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -0.419 -5.203 0.729 1.00 0.00 H new ATOM 0 HD23 LEU A 9 0.148 -3.597 0.213 1.00 0.00 H new ATOM 148 N TYR A 10 4.420 -4.909 0.700 1.00 0.00 N ATOM 149 CA TYR A 10 5.704 -5.410 1.174 1.00 0.00 C ATOM 150 C TYR A 10 5.556 -6.924 1.424 1.00 0.00 C ATOM 151 O TYR A 10 4.911 -7.336 2.393 1.00 0.00 O ATOM 152 CB TYR A 10 6.086 -4.644 2.466 1.00 0.00 C ATOM 153 CG TYR A 10 7.560 -4.717 2.858 1.00 0.00 C ATOM 154 CD1 TYR A 10 8.055 -5.750 3.652 1.00 0.00 C ATOM 155 CD2 TYR A 10 8.454 -3.732 2.439 1.00 0.00 C ATOM 156 CE1 TYR A 10 9.382 -5.792 4.005 1.00 0.00 C ATOM 157 CE2 TYR A 10 9.781 -3.777 2.791 1.00 0.00 C ATOM 158 CZ TYR A 10 10.239 -4.807 3.571 1.00 0.00 C ATOM 159 OH TYR A 10 11.557 -4.856 3.921 1.00 0.00 O ATOM 0 H TYR A 10 3.837 -4.530 1.446 1.00 0.00 H new ATOM 0 HA TYR A 10 6.499 -5.253 0.445 1.00 0.00 H new ATOM 0 HB2 TYR A 10 5.812 -3.596 2.342 1.00 0.00 H new ATOM 0 HB3 TYR A 10 5.488 -5.034 3.290 1.00 0.00 H new ATOM 0 HD1 TYR A 10 7.387 -6.527 3.994 1.00 0.00 H new ATOM 0 HD2 TYR A 10 8.096 -2.918 1.826 1.00 0.00 H new ATOM 0 HE1 TYR A 10 9.752 -6.597 4.622 1.00 0.00 H new ATOM 0 HE2 TYR A 10 10.459 -3.006 2.455 1.00 0.00 H new ATOM 0 HH TYR A 10 11.701 -5.593 4.550 1.00 0.00 H new ATOM 169 N VAL A 11 6.119 -7.734 0.515 1.00 0.00 N ATOM 170 CA VAL A 11 6.027 -9.211 0.555 1.00 0.00 C ATOM 171 C VAL A 11 7.439 -9.783 0.746 1.00 0.00 C ATOM 172 O VAL A 11 8.411 -9.035 0.843 1.00 0.00 O ATOM 173 CB VAL A 11 5.341 -9.798 -0.767 1.00 0.00 C ATOM 174 CG1 VAL A 11 4.121 -8.944 -1.190 1.00 0.00 C ATOM 175 CG2 VAL A 11 6.321 -9.968 -1.964 1.00 0.00 C ATOM 0 H VAL A 11 6.657 -7.384 -0.278 1.00 0.00 H new ATOM 0 HA VAL A 11 5.393 -9.507 1.390 1.00 0.00 H new ATOM 0 HB VAL A 11 5.006 -10.800 -0.499 1.00 0.00 H new ATOM 0 HG11 VAL A 11 3.676 -9.367 -2.091 1.00 0.00 H new ATOM 0 HG12 VAL A 11 3.383 -8.941 -0.388 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.444 -7.922 -1.390 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.782 -10.370 -2.822 1.00 0.00 H new ATOM 0 HG22 VAL A 11 6.748 -9.000 -2.225 1.00 0.00 H new ATOM 0 HG23 VAL A 11 7.121 -10.654 -1.685 1.00 0.00 H new ATOM 185 N ASP A 12 7.524 -11.108 0.872 1.00 0.00 N ATOM 186 CA ASP A 12 8.788 -11.850 0.906 1.00 0.00 C ATOM 187 C ASP A 12 8.886 -12.762 -0.327 1.00 0.00 C ATOM 188 O ASP A 12 9.844 -12.671 -1.108 1.00 0.00 O ATOM 189 CB ASP A 12 8.890 -12.696 2.205 1.00 0.00 C ATOM 190 CG ASP A 12 10.104 -13.648 2.188 1.00 0.00 C ATOM 191 OD1 ASP A 12 11.243 -13.178 2.383 1.00 0.00 O ATOM 192 OD2 ASP A 12 9.930 -14.863 1.954 1.00 0.00 O ATOM 0 H ASP A 12 6.703 -11.707 0.955 1.00 0.00 H new ATOM 0 HA ASP A 12 9.613 -11.138 0.894 1.00 0.00 H new ATOM 0 HB2 ASP A 12 8.965 -12.030 3.065 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.977 -13.277 2.330 1.00 0.00 H new ATOM 197 N ASN A 13 7.888 -13.650 -0.463 1.00 0.00 N ATOM 198 CA ASN A 13 7.843 -14.712 -1.481 1.00 0.00 C ATOM 199 C ASN A 13 7.163 -14.167 -2.759 1.00 0.00 C ATOM 200 O ASN A 13 5.944 -13.999 -2.754 1.00 0.00 O ATOM 201 CB ASN A 13 7.059 -15.918 -0.871 1.00 0.00 C ATOM 202 CG ASN A 13 6.958 -17.165 -1.764 1.00 0.00 C ATOM 203 OD1 ASN A 13 6.903 -17.087 -2.986 1.00 0.00 O ATOM 204 ND2 ASN A 13 6.913 -18.342 -1.153 1.00 0.00 N ATOM 0 H ASN A 13 7.070 -13.649 0.147 1.00 0.00 H new ATOM 0 HA ASN A 13 8.843 -15.043 -1.762 1.00 0.00 H new ATOM 0 HB2 ASN A 13 7.537 -16.202 0.066 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.050 -15.586 -0.626 1.00 0.00 H new ATOM 0 HD21 ASN A 13 6.832 -19.198 -1.701 1.00 0.00 H new ATOM 0 HD22 ASN A 13 6.960 -18.390 -0.135 1.00 0.00 H new ATOM 211 N PRO A 14 7.943 -13.875 -3.865 1.00 0.00 N ATOM 212 CA PRO A 14 7.386 -13.301 -5.119 1.00 0.00 C ATOM 213 C PRO A 14 6.244 -14.167 -5.756 1.00 0.00 C ATOM 214 O PRO A 14 5.151 -13.627 -5.927 1.00 0.00 O ATOM 215 CB PRO A 14 8.626 -13.107 -6.049 1.00 0.00 C ATOM 216 CG PRO A 14 9.818 -13.182 -5.131 1.00 0.00 C ATOM 217 CD PRO A 14 9.415 -14.073 -3.976 1.00 0.00 C ATOM 0 HA PRO A 14 6.875 -12.356 -4.935 1.00 0.00 H new ATOM 0 HB2 PRO A 14 8.669 -13.881 -6.816 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.586 -12.148 -6.566 1.00 0.00 H new ATOM 0 HG2 PRO A 14 10.684 -13.590 -5.652 1.00 0.00 H new ATOM 0 HG3 PRO A 14 10.098 -12.190 -4.776 1.00 0.00 H new ATOM 0 HD2 PRO A 14 9.664 -15.116 -4.171 1.00 0.00 H new ATOM 0 HD3 PRO A 14 9.926 -13.790 -3.056 1.00 0.00 H new ATOM 225 N PRO A 15 6.429 -15.515 -6.088 1.00 0.00 N ATOM 226 CA PRO A 15 5.317 -16.348 -6.624 1.00 0.00 C ATOM 227 C PRO A 15 4.081 -16.363 -5.694 1.00 0.00 C ATOM 228 O PRO A 15 3.052 -15.809 -6.051 1.00 0.00 O ATOM 229 CB PRO A 15 5.936 -17.765 -6.772 1.00 0.00 C ATOM 230 CG PRO A 15 7.402 -17.511 -6.919 1.00 0.00 C ATOM 231 CD PRO A 15 7.686 -16.327 -6.023 1.00 0.00 C ATOM 0 HA PRO A 15 4.940 -15.953 -7.567 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.725 -18.385 -5.901 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.533 -18.287 -7.640 1.00 0.00 H new ATOM 0 HG2 PRO A 15 7.985 -18.382 -6.619 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.663 -17.294 -7.955 1.00 0.00 H new ATOM 0 HD2 PRO A 15 7.906 -16.642 -5.003 1.00 0.00 H new ATOM 0 HD3 PRO A 15 8.547 -15.758 -6.374 1.00 0.00 H new ATOM 239 N ALA A 16 4.229 -16.947 -4.489 1.00 0.00 N ATOM 240 CA ALA A 16 3.082 -17.316 -3.615 1.00 0.00 C ATOM 241 C ALA A 16 2.198 -16.105 -3.246 1.00 0.00 C ATOM 242 O ALA A 16 0.955 -16.211 -3.271 1.00 0.00 O ATOM 243 CB ALA A 16 3.566 -18.044 -2.350 1.00 0.00 C ATOM 0 H ALA A 16 5.139 -17.178 -4.090 1.00 0.00 H new ATOM 0 HA ALA A 16 2.457 -17.997 -4.193 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.709 -18.303 -1.729 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.096 -18.953 -2.634 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.237 -17.393 -1.790 1.00 0.00 H new ATOM 249 N SER A 17 2.837 -14.941 -2.973 1.00 0.00 N ATOM 250 CA SER A 17 2.102 -13.701 -2.670 1.00 0.00 C ATOM 251 C SER A 17 1.280 -13.307 -3.911 1.00 0.00 C ATOM 252 O SER A 17 0.054 -13.193 -3.858 1.00 0.00 O ATOM 253 CB SER A 17 3.067 -12.559 -2.267 1.00 0.00 C ATOM 254 OG SER A 17 3.926 -12.185 -3.339 1.00 0.00 O ATOM 0 H SER A 17 3.852 -14.841 -2.958 1.00 0.00 H new ATOM 0 HA SER A 17 1.438 -13.872 -1.822 1.00 0.00 H new ATOM 0 HB2 SER A 17 2.489 -11.692 -1.946 1.00 0.00 H new ATOM 0 HB3 SER A 17 3.668 -12.876 -1.414 1.00 0.00 H new ATOM 0 HG SER A 17 4.739 -12.732 -3.313 1.00 0.00 H new ATOM 260 N THR A 18 1.994 -13.176 -5.041 1.00 0.00 N ATOM 261 CA THR A 18 1.471 -12.585 -6.270 1.00 0.00 C ATOM 262 C THR A 18 0.366 -13.396 -6.963 1.00 0.00 C ATOM 263 O THR A 18 -0.632 -12.837 -7.386 1.00 0.00 O ATOM 264 CB THR A 18 2.641 -12.329 -7.281 1.00 0.00 C ATOM 265 OG1 THR A 18 3.578 -11.404 -6.703 1.00 0.00 O ATOM 266 CG2 THR A 18 2.165 -11.786 -8.643 1.00 0.00 C ATOM 0 H THR A 18 2.963 -13.484 -5.121 1.00 0.00 H new ATOM 0 HA THR A 18 1.003 -11.650 -5.960 1.00 0.00 H new ATOM 0 HB THR A 18 3.109 -13.295 -7.471 1.00 0.00 H new ATOM 0 HG1 THR A 18 4.331 -11.899 -6.319 1.00 0.00 H new ATOM 0 HG21 THR A 18 3.026 -11.631 -9.294 1.00 0.00 H new ATOM 0 HG22 THR A 18 1.486 -12.503 -9.103 1.00 0.00 H new ATOM 0 HG23 THR A 18 1.647 -10.839 -8.496 1.00 0.00 H new ATOM 274 N GLN A 19 0.543 -14.736 -6.955 1.00 0.00 N ATOM 275 CA GLN A 19 -0.427 -15.719 -7.484 1.00 0.00 C ATOM 276 C GLN A 19 -1.732 -15.626 -6.689 1.00 0.00 C ATOM 277 O GLN A 19 -2.830 -15.677 -7.273 1.00 0.00 O ATOM 278 CB GLN A 19 0.164 -17.155 -7.409 1.00 0.00 C ATOM 279 CG GLN A 19 1.410 -17.409 -8.301 1.00 0.00 C ATOM 280 CD GLN A 19 1.111 -17.643 -9.790 1.00 0.00 C ATOM 281 OE1 GLN A 19 0.103 -17.183 -10.327 1.00 0.00 O ATOM 282 NE2 GLN A 19 2.005 -18.349 -10.474 1.00 0.00 N ATOM 0 H GLN A 19 1.382 -15.173 -6.573 1.00 0.00 H new ATOM 0 HA GLN A 19 -0.635 -15.495 -8.530 1.00 0.00 H new ATOM 0 HB2 GLN A 19 0.430 -17.367 -6.373 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -0.614 -17.865 -7.690 1.00 0.00 H new ATOM 0 HG2 GLN A 19 2.081 -16.555 -8.211 1.00 0.00 H new ATOM 0 HG3 GLN A 19 1.944 -18.276 -7.913 1.00 0.00 H new ATOM 0 HE21 GLN A 19 2.831 -18.718 -10.004 1.00 0.00 H new ATOM 0 HE22 GLN A 19 1.865 -18.522 -11.469 1.00 0.00 H new ATOM 291 N PHE A 20 -1.598 -15.472 -5.353 1.00 0.00 N ATOM 292 CA PHE A 20 -2.760 -15.374 -4.470 1.00 0.00 C ATOM 293 C PHE A 20 -3.549 -14.089 -4.777 1.00 0.00 C ATOM 294 O PHE A 20 -4.774 -14.145 -4.839 1.00 0.00 O ATOM 295 CB PHE A 20 -2.353 -15.403 -2.970 1.00 0.00 C ATOM 296 CG PHE A 20 -3.553 -15.334 -2.015 1.00 0.00 C ATOM 297 CD1 PHE A 20 -4.377 -16.443 -1.829 1.00 0.00 C ATOM 298 CD2 PHE A 20 -3.879 -14.154 -1.338 1.00 0.00 C ATOM 299 CE1 PHE A 20 -5.480 -16.378 -1.000 1.00 0.00 C ATOM 300 CE2 PHE A 20 -4.981 -14.096 -0.505 1.00 0.00 C ATOM 301 CZ PHE A 20 -5.781 -15.208 -0.339 1.00 0.00 C ATOM 0 H PHE A 20 -0.699 -15.414 -4.874 1.00 0.00 H new ATOM 0 HA PHE A 20 -3.390 -16.243 -4.658 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -1.791 -16.315 -2.771 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -1.686 -14.566 -2.765 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -4.150 -17.367 -2.341 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -3.262 -13.277 -1.468 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -6.108 -17.247 -0.870 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -5.216 -13.180 0.016 1.00 0.00 H new ATOM 0 HZ PHE A 20 -6.643 -15.161 0.309 1.00 0.00 H new ATOM 311 N TYR A 21 -2.853 -12.961 -5.045 1.00 0.00 N ATOM 312 CA TYR A 21 -3.520 -11.692 -5.429 1.00 0.00 C ATOM 313 C TYR A 21 -4.099 -11.794 -6.846 1.00 0.00 C ATOM 314 O TYR A 21 -5.106 -11.139 -7.131 1.00 0.00 O ATOM 315 CB TYR A 21 -2.548 -10.495 -5.300 1.00 0.00 C ATOM 316 CG TYR A 21 -2.281 -10.112 -3.841 1.00 0.00 C ATOM 317 CD1 TYR A 21 -3.253 -9.443 -3.099 1.00 0.00 C ATOM 318 CD2 TYR A 21 -1.088 -10.435 -3.199 1.00 0.00 C ATOM 319 CE1 TYR A 21 -3.040 -9.111 -1.780 1.00 0.00 C ATOM 320 CE2 TYR A 21 -0.871 -10.105 -1.876 1.00 0.00 C ATOM 321 CZ TYR A 21 -1.850 -9.445 -1.172 1.00 0.00 C ATOM 322 OH TYR A 21 -1.630 -9.103 0.133 1.00 0.00 O ATOM 0 H TYR A 21 -1.836 -12.901 -5.003 1.00 0.00 H new ATOM 0 HA TYR A 21 -4.348 -11.517 -4.742 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.604 -10.743 -5.786 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.962 -9.636 -5.828 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -4.190 -9.180 -3.567 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -0.316 -10.955 -3.748 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -3.804 -8.590 -1.223 1.00 0.00 H new ATOM 0 HE2 TYR A 21 0.062 -10.364 -1.397 1.00 0.00 H new ATOM 0 HH TYR A 21 -2.109 -9.725 0.719 1.00 0.00 H new ATOM 332 N LYS A 22 -3.459 -12.578 -7.733 1.00 0.00 N ATOM 333 CA LYS A 22 -3.922 -12.742 -9.126 1.00 0.00 C ATOM 334 C LYS A 22 -5.371 -13.241 -9.207 1.00 0.00 C ATOM 335 O LYS A 22 -6.179 -12.720 -9.971 1.00 0.00 O ATOM 336 CB LYS A 22 -2.974 -13.674 -9.919 1.00 0.00 C ATOM 337 CG LYS A 22 -1.625 -13.034 -10.308 1.00 0.00 C ATOM 338 CD LYS A 22 -0.633 -14.053 -10.909 1.00 0.00 C ATOM 339 CE LYS A 22 -1.105 -14.647 -12.249 1.00 0.00 C ATOM 340 NZ LYS A 22 -0.126 -15.624 -12.790 1.00 0.00 N ATOM 0 H LYS A 22 -2.618 -13.110 -7.510 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.900 -11.753 -9.584 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -2.780 -14.566 -9.323 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -3.482 -14.001 -10.826 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -1.801 -12.236 -11.029 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.178 -12.575 -9.426 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.332 -13.567 -11.055 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.478 -14.862 -10.196 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.069 -15.136 -12.111 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.255 -13.844 -12.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -0.541 -16.115 -13.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 0.736 -15.124 -13.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 0.114 -16.319 -12.054 1.00 0.00 H new ATOM 354 N ALA A 23 -5.666 -14.271 -8.395 1.00 0.00 N ATOM 355 CA ALA A 23 -7.027 -14.831 -8.258 1.00 0.00 C ATOM 356 C ALA A 23 -7.917 -13.932 -7.366 1.00 0.00 C ATOM 357 O ALA A 23 -9.110 -13.757 -7.640 1.00 0.00 O ATOM 358 CB ALA A 23 -6.946 -16.253 -7.684 1.00 0.00 C ATOM 0 H ALA A 23 -4.970 -14.740 -7.815 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.486 -14.870 -9.246 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -7.951 -16.663 -7.584 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -6.362 -16.883 -8.355 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.467 -16.224 -6.705 1.00 0.00 H new ATOM 364 N LEU A 24 -7.299 -13.365 -6.308 1.00 0.00 N ATOM 365 CA LEU A 24 -7.995 -12.568 -5.257 1.00 0.00 C ATOM 366 C LEU A 24 -8.645 -11.294 -5.818 1.00 0.00 C ATOM 367 O LEU A 24 -9.669 -10.819 -5.310 1.00 0.00 O ATOM 368 CB LEU A 24 -6.962 -12.134 -4.176 1.00 0.00 C ATOM 369 CG LEU A 24 -7.535 -11.626 -2.823 1.00 0.00 C ATOM 370 CD1 LEU A 24 -8.097 -12.805 -2.023 1.00 0.00 C ATOM 371 CD2 LEU A 24 -6.487 -10.830 -2.011 1.00 0.00 C ATOM 0 H LEU A 24 -6.294 -13.444 -6.152 1.00 0.00 H new ATOM 0 HA LEU A 24 -8.778 -13.203 -4.841 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.308 -12.982 -3.971 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.339 -11.346 -4.599 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.347 -10.931 -3.035 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.497 -12.444 -1.076 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.892 -13.286 -2.593 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -7.302 -13.526 -1.830 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -6.931 -10.495 -1.074 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.630 -11.469 -1.798 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.160 -9.965 -2.588 1.00 0.00 H new ATOM 383 N LEU A 25 -8.020 -10.750 -6.866 1.00 0.00 N ATOM 384 CA LEU A 25 -8.492 -9.552 -7.573 1.00 0.00 C ATOM 385 C LEU A 25 -9.112 -9.970 -8.914 1.00 0.00 C ATOM 386 O LEU A 25 -10.123 -9.403 -9.349 1.00 0.00 O ATOM 387 CB LEU A 25 -7.293 -8.588 -7.768 1.00 0.00 C ATOM 388 CG LEU A 25 -6.473 -8.270 -6.467 1.00 0.00 C ATOM 389 CD1 LEU A 25 -5.328 -7.287 -6.742 1.00 0.00 C ATOM 390 CD2 LEU A 25 -7.380 -7.754 -5.344 1.00 0.00 C ATOM 0 H LEU A 25 -7.159 -11.134 -7.254 1.00 0.00 H new ATOM 0 HA LEU A 25 -9.259 -9.034 -6.998 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.618 -9.018 -8.508 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.664 -7.651 -8.182 1.00 0.00 H new ATOM 0 HG LEU A 25 -6.028 -9.208 -6.134 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.785 -7.093 -5.817 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.649 -7.717 -7.478 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.736 -6.352 -7.127 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.780 -7.544 -4.459 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -7.878 -6.841 -5.669 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -8.128 -8.510 -5.104 1.00 0.00 H new ATOM 402 N GLY A 26 -8.504 -10.977 -9.558 1.00 0.00 N ATOM 403 CA GLY A 26 -8.879 -11.389 -10.915 1.00 0.00 C ATOM 404 C GLY A 26 -8.098 -10.617 -11.973 1.00 0.00 C ATOM 405 O GLY A 26 -8.612 -10.353 -13.068 1.00 0.00 O ATOM 0 H GLY A 26 -7.744 -11.524 -9.155 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -8.697 -12.457 -11.035 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.947 -11.229 -11.062 1.00 0.00 H new ATOM 409 N VAL A 27 -6.836 -10.273 -11.634 1.00 0.00 N ATOM 410 CA VAL A 27 -5.937 -9.472 -12.496 1.00 0.00 C ATOM 411 C VAL A 27 -4.581 -10.192 -12.666 1.00 0.00 C ATOM 412 O VAL A 27 -4.228 -11.051 -11.853 1.00 0.00 O ATOM 413 CB VAL A 27 -5.702 -8.020 -11.911 1.00 0.00 C ATOM 414 CG1 VAL A 27 -7.041 -7.258 -11.728 1.00 0.00 C ATOM 415 CG2 VAL A 27 -4.889 -8.050 -10.588 1.00 0.00 C ATOM 0 H VAL A 27 -6.409 -10.545 -10.748 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.421 -9.368 -13.467 1.00 0.00 H new ATOM 0 HB VAL A 27 -5.106 -7.476 -12.644 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -6.842 -6.265 -11.325 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.541 -7.165 -12.692 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -7.681 -7.808 -11.039 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.751 -7.032 -10.222 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.429 -8.634 -9.842 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.915 -8.505 -10.770 1.00 0.00 H new ATOM 425 N ASP A 28 -3.836 -9.836 -13.722 1.00 0.00 N ATOM 426 CA ASP A 28 -2.475 -10.354 -13.975 1.00 0.00 C ATOM 427 C ASP A 28 -1.446 -9.212 -13.811 1.00 0.00 C ATOM 428 O ASP A 28 -1.782 -8.045 -14.064 1.00 0.00 O ATOM 429 CB ASP A 28 -2.390 -10.979 -15.397 1.00 0.00 C ATOM 430 CG ASP A 28 -2.554 -9.959 -16.541 1.00 0.00 C ATOM 431 OD1 ASP A 28 -3.686 -9.496 -16.785 1.00 0.00 O ATOM 432 OD2 ASP A 28 -1.549 -9.625 -17.214 1.00 0.00 O ATOM 0 H ASP A 28 -4.158 -9.177 -14.431 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.247 -11.136 -13.251 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -1.428 -11.480 -15.506 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -3.160 -11.744 -15.493 1.00 0.00 H new ATOM 437 N PRO A 29 -0.183 -9.514 -13.360 1.00 0.00 N ATOM 438 CA PRO A 29 0.894 -8.511 -13.271 1.00 0.00 C ATOM 439 C PRO A 29 1.324 -8.035 -14.670 1.00 0.00 C ATOM 440 O PRO A 29 1.958 -8.788 -15.417 1.00 0.00 O ATOM 441 CB PRO A 29 2.049 -9.242 -12.518 1.00 0.00 C ATOM 442 CG PRO A 29 1.405 -10.468 -11.943 1.00 0.00 C ATOM 443 CD PRO A 29 0.294 -10.838 -12.898 1.00 0.00 C ATOM 0 HA PRO A 29 0.583 -7.607 -12.747 1.00 0.00 H new ATOM 0 HB2 PRO A 29 2.863 -9.502 -13.195 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.474 -8.613 -11.736 1.00 0.00 H new ATOM 0 HG2 PRO A 29 2.126 -11.280 -11.849 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.013 -10.272 -10.945 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.656 -11.450 -13.724 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -0.495 -11.404 -12.403 1.00 0.00 H new ATOM 451 N VAL A 30 0.956 -6.784 -15.007 1.00 0.00 N ATOM 452 CA VAL A 30 1.272 -6.176 -16.311 1.00 0.00 C ATOM 453 C VAL A 30 2.802 -6.038 -16.493 1.00 0.00 C ATOM 454 O VAL A 30 3.320 -6.203 -17.598 1.00 0.00 O ATOM 455 CB VAL A 30 0.537 -4.788 -16.490 1.00 0.00 C ATOM 456 CG1 VAL A 30 0.907 -3.792 -15.365 1.00 0.00 C ATOM 457 CG2 VAL A 30 0.780 -4.182 -17.899 1.00 0.00 C ATOM 0 H VAL A 30 0.433 -6.169 -14.384 1.00 0.00 H new ATOM 0 HA VAL A 30 0.902 -6.839 -17.093 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.532 -4.982 -16.407 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.381 -2.851 -15.525 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.619 -4.209 -14.400 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.982 -3.613 -15.376 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.258 -3.229 -17.980 1.00 0.00 H new ATOM 0 HG22 VAL A 30 1.848 -4.024 -18.048 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.405 -4.867 -18.659 1.00 0.00 H new ATOM 467 N GLU A 31 3.516 -5.769 -15.379 1.00 0.00 N ATOM 468 CA GLU A 31 4.990 -5.829 -15.309 1.00 0.00 C ATOM 469 C GLU A 31 5.385 -6.947 -14.328 1.00 0.00 C ATOM 470 O GLU A 31 5.535 -6.711 -13.121 1.00 0.00 O ATOM 471 CB GLU A 31 5.582 -4.454 -14.881 1.00 0.00 C ATOM 472 CG GLU A 31 5.282 -3.291 -15.856 1.00 0.00 C ATOM 473 CD GLU A 31 5.988 -3.432 -17.224 1.00 0.00 C ATOM 474 OE1 GLU A 31 5.416 -4.040 -18.151 1.00 0.00 O ATOM 475 OE2 GLU A 31 7.118 -2.923 -17.375 1.00 0.00 O ATOM 0 H GLU A 31 3.081 -5.502 -14.496 1.00 0.00 H new ATOM 0 HA GLU A 31 5.401 -6.053 -16.293 1.00 0.00 H new ATOM 0 HB2 GLU A 31 5.191 -4.196 -13.897 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.662 -4.555 -14.778 1.00 0.00 H new ATOM 0 HG2 GLU A 31 4.206 -3.231 -16.017 1.00 0.00 H new ATOM 0 HG3 GLU A 31 5.588 -2.352 -15.394 1.00 0.00 H new ATOM 482 N SER A 32 5.452 -8.189 -14.848 1.00 0.00 N ATOM 483 CA SER A 32 5.868 -9.370 -14.070 1.00 0.00 C ATOM 484 C SER A 32 7.403 -9.513 -14.104 1.00 0.00 C ATOM 485 O SER A 32 8.019 -9.475 -15.178 1.00 0.00 O ATOM 486 CB SER A 32 5.161 -10.638 -14.611 1.00 0.00 C ATOM 487 OG SER A 32 5.309 -10.780 -16.010 1.00 0.00 O ATOM 0 H SER A 32 5.219 -8.400 -15.818 1.00 0.00 H new ATOM 0 HA SER A 32 5.571 -9.243 -13.029 1.00 0.00 H new ATOM 0 HB2 SER A 32 5.568 -11.518 -14.114 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.101 -10.594 -14.363 1.00 0.00 H new ATOM 0 HG SER A 32 4.849 -11.593 -16.307 1.00 0.00 H new ATOM 493 N SER A 33 8.005 -9.668 -12.917 1.00 0.00 N ATOM 494 CA SER A 33 9.468 -9.694 -12.738 1.00 0.00 C ATOM 495 C SER A 33 9.841 -10.826 -11.737 1.00 0.00 C ATOM 496 O SER A 33 9.014 -11.166 -10.884 1.00 0.00 O ATOM 497 CB SER A 33 9.921 -8.293 -12.241 1.00 0.00 C ATOM 498 OG SER A 33 11.319 -8.112 -12.366 1.00 0.00 O ATOM 0 H SER A 33 7.488 -9.780 -12.045 1.00 0.00 H new ATOM 0 HA SER A 33 9.982 -9.908 -13.675 1.00 0.00 H new ATOM 0 HB2 SER A 33 9.403 -7.521 -12.811 1.00 0.00 H new ATOM 0 HB3 SER A 33 9.631 -8.167 -11.198 1.00 0.00 H new ATOM 0 HG SER A 33 11.585 -7.291 -11.902 1.00 0.00 H new ATOM 504 N PRO A 34 11.071 -11.457 -11.844 1.00 0.00 N ATOM 505 CA PRO A 34 11.500 -12.591 -10.971 1.00 0.00 C ATOM 506 C PRO A 34 11.310 -12.349 -9.446 1.00 0.00 C ATOM 507 O PRO A 34 10.857 -13.255 -8.731 1.00 0.00 O ATOM 508 CB PRO A 34 13.008 -12.790 -11.336 1.00 0.00 C ATOM 509 CG PRO A 34 13.381 -11.580 -12.138 1.00 0.00 C ATOM 510 CD PRO A 34 12.120 -11.165 -12.849 1.00 0.00 C ATOM 0 HA PRO A 34 10.881 -13.470 -11.152 1.00 0.00 H new ATOM 0 HB2 PRO A 34 13.622 -12.873 -10.440 1.00 0.00 H new ATOM 0 HB3 PRO A 34 13.157 -13.704 -11.910 1.00 0.00 H new ATOM 0 HG2 PRO A 34 13.750 -10.781 -11.495 1.00 0.00 H new ATOM 0 HG3 PRO A 34 14.175 -11.809 -12.849 1.00 0.00 H new ATOM 0 HD2 PRO A 34 12.137 -10.110 -13.122 1.00 0.00 H new ATOM 0 HD3 PRO A 34 11.969 -11.730 -13.769 1.00 0.00 H new ATOM 518 N THR A 35 11.652 -11.139 -8.949 1.00 0.00 N ATOM 519 CA THR A 35 11.541 -10.818 -7.504 1.00 0.00 C ATOM 520 C THR A 35 10.726 -9.520 -7.250 1.00 0.00 C ATOM 521 O THR A 35 10.839 -8.885 -6.187 1.00 0.00 O ATOM 522 CB THR A 35 12.969 -10.765 -6.836 1.00 0.00 C ATOM 523 OG1 THR A 35 12.856 -10.662 -5.401 1.00 0.00 O ATOM 524 CG2 THR A 35 13.848 -9.620 -7.369 1.00 0.00 C ATOM 0 H THR A 35 12.005 -10.372 -9.521 1.00 0.00 H new ATOM 0 HA THR A 35 10.980 -11.622 -7.028 1.00 0.00 H new ATOM 0 HB THR A 35 13.462 -11.699 -7.104 1.00 0.00 H new ATOM 0 HG1 THR A 35 12.132 -10.042 -5.174 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.816 -9.641 -6.868 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.992 -9.742 -8.443 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.359 -8.665 -7.174 1.00 0.00 H new ATOM 532 N PHE A 36 9.846 -9.173 -8.206 1.00 0.00 N ATOM 533 CA PHE A 36 8.943 -8.010 -8.082 1.00 0.00 C ATOM 534 C PHE A 36 7.689 -8.252 -8.942 1.00 0.00 C ATOM 535 O PHE A 36 7.740 -8.969 -9.937 1.00 0.00 O ATOM 536 CB PHE A 36 9.672 -6.699 -8.515 1.00 0.00 C ATOM 537 CG PHE A 36 8.885 -5.396 -8.263 1.00 0.00 C ATOM 538 CD1 PHE A 36 8.960 -4.741 -7.034 1.00 0.00 C ATOM 539 CD2 PHE A 36 8.077 -4.825 -9.254 1.00 0.00 C ATOM 540 CE1 PHE A 36 8.258 -3.570 -6.805 1.00 0.00 C ATOM 541 CE2 PHE A 36 7.379 -3.654 -9.020 1.00 0.00 C ATOM 542 CZ PHE A 36 7.468 -3.028 -7.796 1.00 0.00 C ATOM 0 H PHE A 36 9.739 -9.686 -9.081 1.00 0.00 H new ATOM 0 HA PHE A 36 8.644 -7.892 -7.040 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.623 -6.639 -7.985 1.00 0.00 H new ATOM 0 HB3 PHE A 36 9.903 -6.765 -9.578 1.00 0.00 H new ATOM 0 HD1 PHE A 36 9.576 -5.154 -6.248 1.00 0.00 H new ATOM 0 HD2 PHE A 36 7.998 -5.307 -10.217 1.00 0.00 H new ATOM 0 HE1 PHE A 36 8.330 -3.079 -5.846 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.763 -3.229 -9.799 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.920 -2.115 -7.613 1.00 0.00 H new ATOM 552 N SER A 37 6.566 -7.652 -8.554 1.00 0.00 N ATOM 553 CA SER A 37 5.307 -7.721 -9.313 1.00 0.00 C ATOM 554 C SER A 37 4.691 -6.329 -9.398 1.00 0.00 C ATOM 555 O SER A 37 4.788 -5.548 -8.452 1.00 0.00 O ATOM 556 CB SER A 37 4.329 -8.704 -8.638 1.00 0.00 C ATOM 557 OG SER A 37 3.060 -8.719 -9.282 1.00 0.00 O ATOM 0 H SER A 37 6.497 -7.099 -7.699 1.00 0.00 H new ATOM 0 HA SER A 37 5.512 -8.083 -10.320 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.755 -9.707 -8.653 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.201 -8.427 -7.591 1.00 0.00 H new ATOM 0 HG SER A 37 2.544 -7.932 -9.007 1.00 0.00 H new ATOM 563 N LEU A 38 4.088 -6.011 -10.543 1.00 0.00 N ATOM 564 CA LEU A 38 3.333 -4.776 -10.739 1.00 0.00 C ATOM 565 C LEU A 38 2.103 -5.107 -11.582 1.00 0.00 C ATOM 566 O LEU A 38 2.234 -5.623 -12.691 1.00 0.00 O ATOM 567 CB LEU A 38 4.252 -3.692 -11.389 1.00 0.00 C ATOM 568 CG LEU A 38 3.667 -2.251 -11.628 1.00 0.00 C ATOM 569 CD1 LEU A 38 3.013 -2.093 -13.013 1.00 0.00 C ATOM 570 CD2 LEU A 38 2.683 -1.840 -10.518 1.00 0.00 C ATOM 0 H LEU A 38 4.111 -6.610 -11.368 1.00 0.00 H new ATOM 0 HA LEU A 38 2.993 -4.357 -9.792 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.137 -3.590 -10.761 1.00 0.00 H new ATOM 0 HB3 LEU A 38 4.587 -4.077 -12.352 1.00 0.00 H new ATOM 0 HG LEU A 38 4.522 -1.576 -11.595 1.00 0.00 H new ATOM 0 HD11 LEU A 38 2.628 -1.079 -13.120 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.754 -2.283 -13.789 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.193 -2.805 -13.112 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.303 -0.839 -10.721 1.00 0.00 H new ATOM 0 HD22 LEU A 38 1.852 -2.545 -10.489 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.197 -1.845 -9.557 1.00 0.00 H new ATOM 582 N PHE A 39 0.917 -4.810 -11.041 1.00 0.00 N ATOM 583 CA PHE A 39 -0.339 -4.752 -11.803 1.00 0.00 C ATOM 584 C PHE A 39 -1.050 -3.425 -11.495 1.00 0.00 C ATOM 585 O PHE A 39 -0.956 -2.891 -10.389 1.00 0.00 O ATOM 586 CB PHE A 39 -1.256 -5.988 -11.541 1.00 0.00 C ATOM 587 CG PHE A 39 -1.369 -6.462 -10.090 1.00 0.00 C ATOM 588 CD1 PHE A 39 -2.115 -5.749 -9.157 1.00 0.00 C ATOM 589 CD2 PHE A 39 -0.748 -7.646 -9.665 1.00 0.00 C ATOM 590 CE1 PHE A 39 -2.235 -6.192 -7.860 1.00 0.00 C ATOM 591 CE2 PHE A 39 -0.874 -8.082 -8.364 1.00 0.00 C ATOM 592 CZ PHE A 39 -1.618 -7.356 -7.461 1.00 0.00 C ATOM 0 H PHE A 39 0.799 -4.600 -10.050 1.00 0.00 H new ATOM 0 HA PHE A 39 -0.104 -4.791 -12.867 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.257 -5.752 -11.901 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.888 -6.819 -12.143 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.607 -4.835 -9.455 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -0.164 -8.223 -10.366 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -2.817 -5.623 -7.150 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -0.388 -8.995 -8.052 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.717 -7.699 -6.442 1.00 0.00 H new ATOM 602 N VAL A 40 -1.748 -2.891 -12.502 1.00 0.00 N ATOM 603 CA VAL A 40 -2.471 -1.616 -12.402 1.00 0.00 C ATOM 604 C VAL A 40 -3.954 -1.899 -12.645 1.00 0.00 C ATOM 605 O VAL A 40 -4.289 -2.647 -13.570 1.00 0.00 O ATOM 606 CB VAL A 40 -1.964 -0.556 -13.460 1.00 0.00 C ATOM 607 CG1 VAL A 40 -2.480 0.869 -13.119 1.00 0.00 C ATOM 608 CG2 VAL A 40 -0.422 -0.575 -13.597 1.00 0.00 C ATOM 0 H VAL A 40 -1.829 -3.334 -13.417 1.00 0.00 H new ATOM 0 HA VAL A 40 -2.298 -1.194 -11.412 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.379 -0.840 -14.427 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.115 1.576 -13.864 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.570 0.871 -13.120 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.117 1.161 -12.133 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.113 0.167 -14.333 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.032 -0.342 -12.634 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.098 -1.564 -13.921 1.00 0.00 H new ATOM 618 N LEU A 41 -4.828 -1.321 -11.817 1.00 0.00 N ATOM 619 CA LEU A 41 -6.263 -1.671 -11.792 1.00 0.00 C ATOM 620 C LEU A 41 -7.073 -0.686 -12.651 1.00 0.00 C ATOM 621 O LEU A 41 -6.625 0.439 -12.904 1.00 0.00 O ATOM 622 CB LEU A 41 -6.774 -1.704 -10.324 1.00 0.00 C ATOM 623 CG LEU A 41 -5.955 -2.603 -9.330 1.00 0.00 C ATOM 624 CD1 LEU A 41 -6.636 -2.669 -7.952 1.00 0.00 C ATOM 625 CD2 LEU A 41 -5.705 -4.020 -9.901 1.00 0.00 C ATOM 0 H LEU A 41 -4.569 -0.599 -11.145 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.397 -2.665 -12.220 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.780 -0.684 -9.939 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.808 -2.050 -10.328 1.00 0.00 H new ATOM 0 HG LEU A 41 -4.980 -2.134 -9.201 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -6.047 -3.298 -7.285 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -6.709 -1.665 -7.534 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.635 -3.091 -8.060 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -5.135 -4.607 -9.181 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.660 -4.509 -10.093 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -5.143 -3.943 -10.832 1.00 0.00 H new ATOM 637 N ALA A 42 -8.279 -1.121 -13.077 1.00 0.00 N ATOM 638 CA ALA A 42 -9.173 -0.343 -13.975 1.00 0.00 C ATOM 639 C ALA A 42 -9.715 0.938 -13.303 1.00 0.00 C ATOM 640 O ALA A 42 -10.150 1.869 -13.989 1.00 0.00 O ATOM 641 CB ALA A 42 -10.332 -1.232 -14.450 1.00 0.00 C ATOM 0 H ALA A 42 -8.665 -2.026 -12.808 1.00 0.00 H new ATOM 0 HA ALA A 42 -8.581 -0.023 -14.832 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -10.985 -0.658 -15.108 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -9.934 -2.090 -14.992 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -10.901 -1.580 -13.588 1.00 0.00 H new ATOM 647 N ASN A 43 -9.693 0.956 -11.958 1.00 0.00 N ATOM 648 CA ASN A 43 -10.073 2.137 -11.138 1.00 0.00 C ATOM 649 C ASN A 43 -9.064 3.290 -11.311 1.00 0.00 C ATOM 650 O ASN A 43 -9.377 4.454 -11.025 1.00 0.00 O ATOM 651 CB ASN A 43 -10.167 1.736 -9.645 1.00 0.00 C ATOM 652 CG ASN A 43 -11.187 0.633 -9.399 1.00 0.00 C ATOM 653 OD1 ASN A 43 -10.862 -0.552 -9.438 1.00 0.00 O ATOM 654 ND2 ASN A 43 -12.427 1.013 -9.153 1.00 0.00 N ATOM 0 H ASN A 43 -9.411 0.151 -11.400 1.00 0.00 H new ATOM 0 HA ASN A 43 -11.046 2.487 -11.482 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.188 1.404 -9.299 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.434 2.612 -9.053 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -13.151 0.314 -8.988 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.661 2.006 -9.128 1.00 0.00 H new ATOM 661 N GLY A 44 -7.848 2.946 -11.767 1.00 0.00 N ATOM 662 CA GLY A 44 -6.797 3.920 -12.062 1.00 0.00 C ATOM 663 C GLY A 44 -5.679 3.925 -11.034 1.00 0.00 C ATOM 664 O GLY A 44 -4.621 4.517 -11.281 1.00 0.00 O ATOM 0 H GLY A 44 -7.571 1.980 -11.940 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -6.377 3.705 -13.045 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -7.238 4.916 -12.115 1.00 0.00 H new ATOM 668 N MET A 45 -5.910 3.289 -9.867 1.00 0.00 N ATOM 669 CA MET A 45 -4.864 3.121 -8.837 1.00 0.00 C ATOM 670 C MET A 45 -3.842 2.066 -9.308 1.00 0.00 C ATOM 671 O MET A 45 -4.167 1.189 -10.124 1.00 0.00 O ATOM 672 CB MET A 45 -5.499 2.738 -7.466 1.00 0.00 C ATOM 673 CG MET A 45 -6.099 1.316 -7.382 1.00 0.00 C ATOM 674 SD MET A 45 -4.853 0.019 -7.159 1.00 0.00 S ATOM 675 CE MET A 45 -4.277 0.339 -5.492 1.00 0.00 C ATOM 0 H MET A 45 -6.811 2.883 -9.614 1.00 0.00 H new ATOM 0 HA MET A 45 -4.340 4.066 -8.695 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.737 2.838 -6.693 1.00 0.00 H new ATOM 0 HB3 MET A 45 -6.284 3.458 -7.235 1.00 0.00 H new ATOM 0 HG2 MET A 45 -6.806 1.277 -6.553 1.00 0.00 H new ATOM 0 HG3 MET A 45 -6.664 1.114 -8.292 1.00 0.00 H new ATOM 0 HE1 MET A 45 -3.748 -0.536 -5.116 1.00 0.00 H new ATOM 0 HE2 MET A 45 -3.603 1.196 -5.498 1.00 0.00 H new ATOM 0 HE3 MET A 45 -5.129 0.552 -4.847 1.00 0.00 H new ATOM 685 N LYS A 46 -2.616 2.157 -8.790 1.00 0.00 N ATOM 686 CA LYS A 46 -1.502 1.291 -9.203 1.00 0.00 C ATOM 687 C LYS A 46 -1.010 0.487 -7.982 1.00 0.00 C ATOM 688 O LYS A 46 -0.936 1.035 -6.873 1.00 0.00 O ATOM 689 CB LYS A 46 -0.404 2.189 -9.834 1.00 0.00 C ATOM 690 CG LYS A 46 0.729 1.437 -10.557 1.00 0.00 C ATOM 691 CD LYS A 46 1.620 2.385 -11.395 1.00 0.00 C ATOM 692 CE LYS A 46 2.811 1.663 -12.041 1.00 0.00 C ATOM 693 NZ LYS A 46 3.605 2.557 -12.922 1.00 0.00 N ATOM 0 H LYS A 46 -2.363 2.834 -8.070 1.00 0.00 H new ATOM 0 HA LYS A 46 -1.805 0.562 -9.954 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.877 2.868 -10.543 1.00 0.00 H new ATOM 0 HB3 LYS A 46 0.035 2.804 -9.048 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.345 0.918 -9.822 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.299 0.675 -11.208 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.016 2.850 -12.174 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.990 3.188 -10.757 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.456 1.261 -11.260 1.00 0.00 H new ATOM 0 HE3 LYS A 46 2.447 0.815 -12.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 4.020 2.001 -13.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 2.987 3.294 -13.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 4.366 3.002 -12.370 1.00 0.00 H new ATOM 707 N LEU A 47 -0.682 -0.809 -8.187 1.00 0.00 N ATOM 708 CA LEU A 47 -0.441 -1.756 -7.072 1.00 0.00 C ATOM 709 C LEU A 47 0.799 -2.648 -7.370 1.00 0.00 C ATOM 710 O LEU A 47 0.800 -3.450 -8.307 1.00 0.00 O ATOM 711 CB LEU A 47 -1.746 -2.594 -6.847 1.00 0.00 C ATOM 712 CG LEU A 47 -2.032 -3.117 -5.395 1.00 0.00 C ATOM 713 CD1 LEU A 47 -3.466 -3.685 -5.296 1.00 0.00 C ATOM 714 CD2 LEU A 47 -0.996 -4.166 -4.931 1.00 0.00 C ATOM 0 H LEU A 47 -0.578 -1.224 -9.113 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.213 -1.217 -6.153 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.595 -1.984 -7.158 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -1.711 -3.456 -7.514 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.942 -2.263 -4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.646 -4.043 -4.282 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.185 -2.902 -5.538 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.579 -4.511 -5.998 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.239 -4.495 -3.921 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -1.017 -5.021 -5.606 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -0.001 -3.722 -4.938 1.00 0.00 H new ATOM 726 N GLY A 48 1.846 -2.487 -6.535 1.00 0.00 N ATOM 727 CA GLY A 48 3.093 -3.265 -6.622 1.00 0.00 C ATOM 728 C GLY A 48 3.133 -4.378 -5.578 1.00 0.00 C ATOM 729 O GLY A 48 2.288 -4.436 -4.682 1.00 0.00 O ATOM 0 H GLY A 48 1.847 -1.806 -5.775 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.185 -3.696 -7.619 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.947 -2.602 -6.482 1.00 0.00 H new ATOM 733 N LEU A 49 4.142 -5.263 -5.705 1.00 0.00 N ATOM 734 CA LEU A 49 4.561 -6.235 -4.671 1.00 0.00 C ATOM 735 C LEU A 49 6.105 -6.264 -4.684 1.00 0.00 C ATOM 736 O LEU A 49 6.702 -6.777 -5.637 1.00 0.00 O ATOM 737 CB LEU A 49 4.001 -7.680 -4.912 1.00 0.00 C ATOM 738 CG LEU A 49 2.449 -7.903 -4.777 1.00 0.00 C ATOM 739 CD1 LEU A 49 1.666 -7.419 -6.014 1.00 0.00 C ATOM 740 CD2 LEU A 49 2.115 -9.379 -4.482 1.00 0.00 C ATOM 0 H LEU A 49 4.705 -5.324 -6.553 1.00 0.00 H new ATOM 0 HA LEU A 49 4.159 -5.918 -3.709 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.297 -7.990 -5.914 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.497 -8.352 -4.211 1.00 0.00 H new ATOM 0 HG LEU A 49 2.131 -7.294 -3.931 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.601 -7.598 -5.864 1.00 0.00 H new ATOM 0 HD12 LEU A 49 1.837 -6.352 -6.159 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.005 -7.964 -6.895 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.035 -9.497 -4.395 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.484 -10.005 -5.294 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.589 -9.680 -3.548 1.00 0.00 H new ATOM 752 N TRP A 50 6.748 -5.689 -3.648 1.00 0.00 N ATOM 753 CA TRP A 50 8.221 -5.656 -3.521 1.00 0.00 C ATOM 754 C TRP A 50 8.643 -6.678 -2.453 1.00 0.00 C ATOM 755 O TRP A 50 8.172 -6.620 -1.313 1.00 0.00 O ATOM 756 CB TRP A 50 8.705 -4.221 -3.147 1.00 0.00 C ATOM 757 CG TRP A 50 10.166 -3.906 -3.425 1.00 0.00 C ATOM 758 CD1 TRP A 50 11.253 -4.715 -3.239 1.00 0.00 C ATOM 759 CD2 TRP A 50 10.692 -2.663 -3.922 1.00 0.00 C ATOM 760 NE1 TRP A 50 12.401 -4.061 -3.591 1.00 0.00 N ATOM 761 CE2 TRP A 50 12.088 -2.795 -3.992 1.00 0.00 C ATOM 762 CE3 TRP A 50 10.109 -1.447 -4.295 1.00 0.00 C ATOM 763 CZ2 TRP A 50 12.914 -1.763 -4.426 1.00 0.00 C ATOM 764 CZ3 TRP A 50 10.927 -0.419 -4.727 1.00 0.00 C ATOM 765 CH2 TRP A 50 12.319 -0.584 -4.788 1.00 0.00 C ATOM 0 H TRP A 50 6.262 -5.234 -2.875 1.00 0.00 H new ATOM 0 HA TRP A 50 8.683 -5.917 -4.473 1.00 0.00 H new ATOM 0 HB2 TRP A 50 8.091 -3.501 -3.689 1.00 0.00 H new ATOM 0 HB3 TRP A 50 8.518 -4.063 -2.085 1.00 0.00 H new ATOM 0 HD1 TRP A 50 11.211 -5.728 -2.867 1.00 0.00 H new ATOM 0 HE1 TRP A 50 13.341 -4.456 -3.559 1.00 0.00 H new ATOM 0 HE3 TRP A 50 9.038 -1.313 -4.246 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 13.986 -1.887 -4.476 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 10.489 0.523 -5.021 1.00 0.00 H new ATOM 0 HH2 TRP A 50 12.934 0.236 -5.128 1.00 0.00 H new ATOM 776 N SER A 51 9.528 -7.608 -2.842 1.00 0.00 N ATOM 777 CA SER A 51 10.034 -8.664 -1.954 1.00 0.00 C ATOM 778 C SER A 51 11.095 -8.108 -0.976 1.00 0.00 C ATOM 779 O SER A 51 11.951 -7.310 -1.376 1.00 0.00 O ATOM 780 CB SER A 51 10.608 -9.813 -2.801 1.00 0.00 C ATOM 781 OG SER A 51 9.652 -10.270 -3.745 1.00 0.00 O ATOM 0 H SER A 51 9.914 -7.648 -3.785 1.00 0.00 H new ATOM 0 HA SER A 51 9.210 -9.046 -1.352 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.505 -9.475 -3.320 1.00 0.00 H new ATOM 0 HB3 SER A 51 10.906 -10.636 -2.151 1.00 0.00 H new ATOM 0 HG SER A 51 9.871 -9.914 -4.631 1.00 0.00 H new ATOM 787 N ARG A 52 11.045 -8.549 0.294 1.00 0.00 N ATOM 788 CA ARG A 52 11.902 -8.007 1.374 1.00 0.00 C ATOM 789 C ARG A 52 13.366 -8.464 1.241 1.00 0.00 C ATOM 790 O ARG A 52 14.253 -7.909 1.891 1.00 0.00 O ATOM 791 CB ARG A 52 11.350 -8.403 2.772 1.00 0.00 C ATOM 792 CG ARG A 52 11.487 -9.895 3.138 1.00 0.00 C ATOM 793 CD ARG A 52 10.989 -10.212 4.557 1.00 0.00 C ATOM 794 NE ARG A 52 11.188 -11.638 4.888 1.00 0.00 N ATOM 795 CZ ARG A 52 10.789 -12.247 6.010 1.00 0.00 C ATOM 796 NH1 ARG A 52 10.243 -11.562 7.001 1.00 0.00 N ATOM 797 NH2 ARG A 52 10.956 -13.550 6.144 1.00 0.00 N ATOM 0 H ARG A 52 10.414 -9.288 0.604 1.00 0.00 H new ATOM 0 HA ARG A 52 11.881 -6.922 1.275 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.866 -7.812 3.529 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.296 -8.130 2.818 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.926 -10.493 2.420 1.00 0.00 H new ATOM 0 HG3 ARG A 52 12.533 -10.191 3.051 1.00 0.00 H new ATOM 0 HD2 ARG A 52 11.520 -9.591 5.279 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.931 -9.961 4.638 1.00 0.00 H new ATOM 0 HE ARG A 52 11.674 -12.210 4.198 1.00 0.00 H new ATOM 0 HH11 ARG A 52 10.120 -10.553 6.917 1.00 0.00 H new ATOM 0 HH12 ARG A 52 9.944 -12.043 7.850 1.00 0.00 H new ATOM 0 HH21 ARG A 52 11.388 -14.089 5.393 1.00 0.00 H new ATOM 0 HH22 ARG A 52 10.653 -14.018 6.998 1.00 0.00 H new ATOM 811 N HIS A 53 13.612 -9.491 0.406 1.00 0.00 N ATOM 812 CA HIS A 53 14.971 -10.007 0.164 1.00 0.00 C ATOM 813 C HIS A 53 15.684 -9.203 -0.953 1.00 0.00 C ATOM 814 O HIS A 53 16.872 -9.410 -1.203 1.00 0.00 O ATOM 815 CB HIS A 53 14.956 -11.538 -0.126 1.00 0.00 C ATOM 816 CG HIS A 53 14.361 -11.970 -1.439 1.00 0.00 C ATOM 817 ND1 HIS A 53 15.126 -12.175 -2.564 1.00 0.00 N ATOM 818 CD2 HIS A 53 13.088 -12.291 -1.789 1.00 0.00 C ATOM 819 CE1 HIS A 53 14.361 -12.596 -3.545 1.00 0.00 C ATOM 820 NE2 HIS A 53 13.122 -12.677 -3.106 1.00 0.00 N ATOM 0 H HIS A 53 12.884 -9.981 -0.114 1.00 0.00 H new ATOM 0 HA HIS A 53 15.551 -9.867 1.076 1.00 0.00 H new ATOM 0 HB2 HIS A 53 15.982 -11.903 -0.080 1.00 0.00 H new ATOM 0 HB3 HIS A 53 14.406 -12.031 0.676 1.00 0.00 H new ATOM 0 HD2 HIS A 53 12.216 -12.250 -1.153 1.00 0.00 H new ATOM 0 HE1 HIS A 53 14.693 -12.836 -4.545 1.00 0.00 H new ATOM 0 HE2 HIS A 53 12.317 -12.978 -3.656 1.00 0.00 H new ATOM 829 N THR A 54 14.948 -8.277 -1.617 1.00 0.00 N ATOM 830 CA THR A 54 15.496 -7.421 -2.697 1.00 0.00 C ATOM 831 C THR A 54 15.168 -5.925 -2.441 1.00 0.00 C ATOM 832 O THR A 54 15.411 -5.070 -3.306 1.00 0.00 O ATOM 833 CB THR A 54 14.937 -7.884 -4.095 1.00 0.00 C ATOM 834 OG1 THR A 54 15.678 -7.279 -5.173 1.00 0.00 O ATOM 835 CG2 THR A 54 13.438 -7.564 -4.268 1.00 0.00 C ATOM 0 H THR A 54 13.962 -8.104 -1.419 1.00 0.00 H new ATOM 0 HA THR A 54 16.581 -7.528 -2.703 1.00 0.00 H new ATOM 0 HB THR A 54 15.058 -8.967 -4.127 1.00 0.00 H new ATOM 0 HG1 THR A 54 15.859 -6.340 -4.959 1.00 0.00 H new ATOM 0 HG21 THR A 54 13.104 -7.904 -5.248 1.00 0.00 H new ATOM 0 HG22 THR A 54 12.865 -8.073 -3.493 1.00 0.00 H new ATOM 0 HG23 THR A 54 13.284 -6.488 -4.185 1.00 0.00 H new ATOM 843 N VAL A 55 14.624 -5.608 -1.249 1.00 0.00 N ATOM 844 CA VAL A 55 14.197 -4.234 -0.896 1.00 0.00 C ATOM 845 C VAL A 55 15.406 -3.318 -0.596 1.00 0.00 C ATOM 846 O VAL A 55 16.455 -3.788 -0.150 1.00 0.00 O ATOM 847 CB VAL A 55 13.197 -4.239 0.325 1.00 0.00 C ATOM 848 CG1 VAL A 55 13.862 -4.807 1.596 1.00 0.00 C ATOM 849 CG2 VAL A 55 12.614 -2.837 0.602 1.00 0.00 C ATOM 0 H VAL A 55 14.468 -6.290 -0.507 1.00 0.00 H new ATOM 0 HA VAL A 55 13.677 -3.831 -1.765 1.00 0.00 H new ATOM 0 HB VAL A 55 12.370 -4.893 0.049 1.00 0.00 H new ATOM 0 HG11 VAL A 55 13.146 -4.796 2.417 1.00 0.00 H new ATOM 0 HG12 VAL A 55 14.186 -5.831 1.411 1.00 0.00 H new ATOM 0 HG13 VAL A 55 14.725 -4.196 1.859 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.931 -2.888 1.450 1.00 0.00 H new ATOM 0 HG22 VAL A 55 13.424 -2.144 0.829 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.074 -2.487 -0.278 1.00 0.00 H new ATOM 859 N GLU A 56 15.256 -2.012 -0.898 1.00 0.00 N ATOM 860 CA GLU A 56 16.226 -0.967 -0.525 1.00 0.00 C ATOM 861 C GLU A 56 15.492 0.187 0.198 1.00 0.00 C ATOM 862 O GLU A 56 14.640 0.833 -0.414 1.00 0.00 O ATOM 863 CB GLU A 56 17.013 -0.477 -1.769 1.00 0.00 C ATOM 864 CG GLU A 56 18.100 -1.479 -2.221 1.00 0.00 C ATOM 865 CD GLU A 56 19.019 -0.988 -3.347 1.00 0.00 C ATOM 866 OE1 GLU A 56 19.322 0.225 -3.404 1.00 0.00 O ATOM 867 OE2 GLU A 56 19.466 -1.825 -4.165 1.00 0.00 O ATOM 0 H GLU A 56 14.451 -1.652 -1.412 1.00 0.00 H new ATOM 0 HA GLU A 56 16.961 -1.381 0.165 1.00 0.00 H new ATOM 0 HB2 GLU A 56 16.317 -0.308 -2.590 1.00 0.00 H new ATOM 0 HB3 GLU A 56 17.480 0.482 -1.544 1.00 0.00 H new ATOM 0 HG2 GLU A 56 18.715 -1.735 -1.359 1.00 0.00 H new ATOM 0 HG3 GLU A 56 17.611 -2.397 -2.548 1.00 0.00 H new ATOM 874 N PRO A 57 15.789 0.465 1.524 1.00 0.00 N ATOM 875 CA PRO A 57 16.807 -0.261 2.330 1.00 0.00 C ATOM 876 C PRO A 57 16.311 -1.646 2.814 1.00 0.00 C ATOM 877 O PRO A 57 15.113 -1.827 3.083 1.00 0.00 O ATOM 878 CB PRO A 57 17.062 0.704 3.516 1.00 0.00 C ATOM 879 CG PRO A 57 15.743 1.388 3.722 1.00 0.00 C ATOM 880 CD PRO A 57 15.131 1.533 2.334 1.00 0.00 C ATOM 0 HA PRO A 57 17.705 -0.492 1.757 1.00 0.00 H new ATOM 0 HB2 PRO A 57 17.374 0.163 4.409 1.00 0.00 H new ATOM 0 HB3 PRO A 57 17.850 1.420 3.285 1.00 0.00 H new ATOM 0 HG2 PRO A 57 15.096 0.802 4.376 1.00 0.00 H new ATOM 0 HG3 PRO A 57 15.876 2.361 4.194 1.00 0.00 H new ATOM 0 HD2 PRO A 57 14.049 1.401 2.361 1.00 0.00 H new ATOM 0 HD3 PRO A 57 15.322 2.522 1.917 1.00 0.00 H new ATOM 888 N LYS A 58 17.247 -2.621 2.860 1.00 0.00 N ATOM 889 CA LYS A 58 16.995 -3.972 3.393 1.00 0.00 C ATOM 890 C LYS A 58 16.400 -3.917 4.819 1.00 0.00 C ATOM 891 O LYS A 58 17.056 -3.459 5.763 1.00 0.00 O ATOM 892 CB LYS A 58 18.296 -4.830 3.361 1.00 0.00 C ATOM 893 CG LYS A 58 18.694 -5.360 1.960 1.00 0.00 C ATOM 894 CD LYS A 58 17.656 -6.350 1.375 1.00 0.00 C ATOM 895 CE LYS A 58 17.504 -7.638 2.201 1.00 0.00 C ATOM 896 NZ LYS A 58 18.768 -8.418 2.278 1.00 0.00 N ATOM 0 H LYS A 58 18.202 -2.488 2.526 1.00 0.00 H new ATOM 0 HA LYS A 58 16.256 -4.450 2.750 1.00 0.00 H new ATOM 0 HB2 LYS A 58 19.118 -4.232 3.754 1.00 0.00 H new ATOM 0 HB3 LYS A 58 18.170 -5.679 4.032 1.00 0.00 H new ATOM 0 HG2 LYS A 58 18.811 -4.518 1.278 1.00 0.00 H new ATOM 0 HG3 LYS A 58 19.663 -5.854 2.025 1.00 0.00 H new ATOM 0 HD2 LYS A 58 16.688 -5.853 1.310 1.00 0.00 H new ATOM 0 HD3 LYS A 58 17.949 -6.612 0.358 1.00 0.00 H new ATOM 0 HE2 LYS A 58 17.176 -7.383 3.209 1.00 0.00 H new ATOM 0 HE3 LYS A 58 16.724 -8.259 1.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 18.592 -9.316 2.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 19.114 -8.614 1.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 19.483 -7.870 2.799 1.00 0.00 H new ATOM 910 N ALA A 59 15.143 -4.369 4.935 1.00 0.00 N ATOM 911 CA ALA A 59 14.367 -4.348 6.183 1.00 0.00 C ATOM 912 C ALA A 59 13.756 -5.737 6.429 1.00 0.00 C ATOM 913 O ALA A 59 13.196 -6.351 5.512 1.00 0.00 O ATOM 914 CB ALA A 59 13.279 -3.262 6.109 1.00 0.00 C ATOM 0 H ALA A 59 14.628 -4.767 4.150 1.00 0.00 H new ATOM 0 HA ALA A 59 15.022 -4.107 7.020 1.00 0.00 H new ATOM 0 HB1 ALA A 59 12.709 -3.254 7.038 1.00 0.00 H new ATOM 0 HB2 ALA A 59 13.746 -2.288 5.961 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.610 -3.473 5.275 1.00 0.00 H new ATOM 920 N SER A 60 13.900 -6.239 7.661 1.00 0.00 N ATOM 921 CA SER A 60 13.378 -7.549 8.062 1.00 0.00 C ATOM 922 C SER A 60 12.033 -7.369 8.785 1.00 0.00 C ATOM 923 O SER A 60 11.998 -7.189 10.009 1.00 0.00 O ATOM 924 CB SER A 60 14.423 -8.255 8.960 1.00 0.00 C ATOM 925 OG SER A 60 15.659 -8.417 8.281 1.00 0.00 O ATOM 0 H SER A 60 14.384 -5.745 8.411 1.00 0.00 H new ATOM 0 HA SER A 60 13.202 -8.174 7.187 1.00 0.00 H new ATOM 0 HB2 SER A 60 14.578 -7.673 9.868 1.00 0.00 H new ATOM 0 HB3 SER A 60 14.043 -9.230 9.267 1.00 0.00 H new ATOM 0 HG SER A 60 16.301 -8.864 8.872 1.00 0.00 H new ATOM 931 N VAL A 61 10.927 -7.376 8.011 1.00 0.00 N ATOM 932 CA VAL A 61 9.564 -7.154 8.546 1.00 0.00 C ATOM 933 C VAL A 61 8.492 -7.791 7.626 1.00 0.00 C ATOM 934 O VAL A 61 8.467 -7.533 6.424 1.00 0.00 O ATOM 935 CB VAL A 61 9.278 -5.607 8.773 1.00 0.00 C ATOM 936 CG1 VAL A 61 9.594 -4.763 7.513 1.00 0.00 C ATOM 937 CG2 VAL A 61 7.829 -5.356 9.282 1.00 0.00 C ATOM 0 H VAL A 61 10.951 -7.535 7.004 1.00 0.00 H new ATOM 0 HA VAL A 61 9.506 -7.647 9.517 1.00 0.00 H new ATOM 0 HB VAL A 61 9.959 -5.274 9.556 1.00 0.00 H new ATOM 0 HG11 VAL A 61 9.383 -3.713 7.716 1.00 0.00 H new ATOM 0 HG12 VAL A 61 10.646 -4.878 7.252 1.00 0.00 H new ATOM 0 HG13 VAL A 61 8.975 -5.103 6.683 1.00 0.00 H new ATOM 0 HG21 VAL A 61 7.674 -4.287 9.425 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.116 -5.732 8.549 1.00 0.00 H new ATOM 0 HG23 VAL A 61 7.682 -5.874 10.230 1.00 0.00 H new ATOM 947 N THR A 62 7.649 -8.664 8.220 1.00 0.00 N ATOM 948 CA THR A 62 6.434 -9.249 7.590 1.00 0.00 C ATOM 949 C THR A 62 5.411 -9.581 8.703 1.00 0.00 C ATOM 950 O THR A 62 5.679 -9.353 9.893 1.00 0.00 O ATOM 951 CB THR A 62 6.729 -10.548 6.739 1.00 0.00 C ATOM 952 OG1 THR A 62 7.620 -11.408 7.454 1.00 0.00 O ATOM 953 CG2 THR A 62 7.296 -10.244 5.333 1.00 0.00 C ATOM 0 H THR A 62 7.794 -8.993 9.175 1.00 0.00 H new ATOM 0 HA THR A 62 6.040 -8.508 6.894 1.00 0.00 H new ATOM 0 HB THR A 62 5.771 -11.045 6.585 1.00 0.00 H new ATOM 0 HG1 THR A 62 7.797 -12.211 6.921 1.00 0.00 H new ATOM 0 HG21 THR A 62 7.476 -11.179 4.803 1.00 0.00 H new ATOM 0 HG22 THR A 62 6.579 -9.642 4.774 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.233 -9.696 5.429 1.00 0.00 H new ATOM 961 N GLY A 63 4.227 -10.099 8.308 1.00 0.00 N ATOM 962 CA GLY A 63 3.165 -10.462 9.261 1.00 0.00 C ATOM 963 C GLY A 63 2.135 -9.351 9.431 1.00 0.00 C ATOM 964 O GLY A 63 0.949 -9.612 9.677 1.00 0.00 O ATOM 0 H GLY A 63 3.986 -10.274 7.332 1.00 0.00 H new ATOM 0 HA2 GLY A 63 2.666 -11.368 8.917 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.611 -10.692 10.229 1.00 0.00 H new ATOM 968 N GLY A 64 2.611 -8.105 9.302 1.00 0.00 N ATOM 969 CA GLY A 64 1.784 -6.912 9.398 1.00 0.00 C ATOM 970 C GLY A 64 2.505 -5.705 8.822 1.00 0.00 C ATOM 971 O GLY A 64 3.596 -5.849 8.249 1.00 0.00 O ATOM 0 H GLY A 64 3.595 -7.903 9.126 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.847 -7.070 8.864 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.529 -6.725 10.441 1.00 0.00 H new ATOM 975 N GLY A 65 1.910 -4.514 8.992 1.00 0.00 N ATOM 976 CA GLY A 65 2.452 -3.285 8.411 1.00 0.00 C ATOM 977 C GLY A 65 2.024 -3.128 6.954 1.00 0.00 C ATOM 978 O GLY A 65 2.342 -3.982 6.115 1.00 0.00 O ATOM 0 H GLY A 65 1.053 -4.380 9.528 1.00 0.00 H new ATOM 0 HA2 GLY A 65 2.110 -2.425 8.988 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.540 -3.299 8.474 1.00 0.00 H new ATOM 982 N GLY A 66 1.311 -2.031 6.658 1.00 0.00 N ATOM 983 CA GLY A 66 0.722 -1.795 5.346 1.00 0.00 C ATOM 984 C GLY A 66 -0.515 -2.650 5.115 1.00 0.00 C ATOM 985 O GLY A 66 -0.461 -3.884 5.236 1.00 0.00 O ATOM 0 H GLY A 66 1.130 -1.284 7.329 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.458 -0.742 5.251 1.00 0.00 H new ATOM 0 HA3 GLY A 66 1.460 -2.009 4.573 1.00 0.00 H new ATOM 989 N GLU A 67 -1.635 -2.002 4.778 1.00 0.00 N ATOM 990 CA GLU A 67 -2.917 -2.678 4.577 1.00 0.00 C ATOM 991 C GLU A 67 -3.566 -2.225 3.270 1.00 0.00 C ATOM 992 O GLU A 67 -3.462 -1.053 2.871 1.00 0.00 O ATOM 993 CB GLU A 67 -3.852 -2.459 5.794 1.00 0.00 C ATOM 994 CG GLU A 67 -3.942 -1.029 6.295 1.00 0.00 C ATOM 995 CD GLU A 67 -4.901 -0.880 7.479 1.00 0.00 C ATOM 996 OE1 GLU A 67 -6.132 -0.739 7.238 1.00 0.00 O ATOM 997 OE2 GLU A 67 -4.434 -0.919 8.641 1.00 0.00 O ATOM 0 H GLU A 67 -1.676 -0.993 4.637 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.736 -3.750 4.497 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.853 -2.797 5.527 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.510 -3.092 6.613 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -2.950 -0.688 6.591 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.272 -0.383 5.481 1.00 0.00 H new ATOM 1004 N LEU A 68 -4.257 -3.168 2.615 1.00 0.00 N ATOM 1005 CA LEU A 68 -4.863 -2.962 1.304 1.00 0.00 C ATOM 1006 C LEU A 68 -6.377 -2.898 1.494 1.00 0.00 C ATOM 1007 O LEU A 68 -6.995 -3.932 1.769 1.00 0.00 O ATOM 1008 CB LEU A 68 -4.452 -4.106 0.334 1.00 0.00 C ATOM 1009 CG LEU A 68 -4.919 -3.949 -1.147 1.00 0.00 C ATOM 1010 CD1 LEU A 68 -4.392 -2.639 -1.777 1.00 0.00 C ATOM 1011 CD2 LEU A 68 -4.525 -5.187 -1.987 1.00 0.00 C ATOM 0 H LEU A 68 -4.409 -4.104 2.990 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.515 -2.030 0.858 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.365 -4.191 0.344 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.849 -5.044 0.722 1.00 0.00 H new ATOM 0 HG LEU A 68 -6.007 -3.884 -1.145 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.738 -2.566 -2.808 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.763 -1.787 -1.208 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.302 -2.640 -1.760 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.862 -5.052 -3.015 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -3.442 -5.306 -1.973 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.993 -6.077 -1.566 1.00 0.00 H new ATOM 1023 N ALA A 69 -6.967 -1.701 1.428 1.00 0.00 N ATOM 1024 CA ALA A 69 -8.382 -1.510 1.780 1.00 0.00 C ATOM 1025 C ALA A 69 -9.286 -1.748 0.556 1.00 0.00 C ATOM 1026 O ALA A 69 -9.197 -1.046 -0.456 1.00 0.00 O ATOM 1027 CB ALA A 69 -8.587 -0.125 2.400 1.00 0.00 C ATOM 0 H ALA A 69 -6.489 -0.849 1.135 1.00 0.00 H new ATOM 0 HA ALA A 69 -8.669 -2.248 2.529 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.638 0.007 2.657 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.979 -0.036 3.300 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.290 0.642 1.684 1.00 0.00 H new ATOM 1033 N PHE A 70 -10.144 -2.768 0.663 1.00 0.00 N ATOM 1034 CA PHE A 70 -11.094 -3.161 -0.377 1.00 0.00 C ATOM 1035 C PHE A 70 -12.451 -2.540 -0.026 1.00 0.00 C ATOM 1036 O PHE A 70 -13.053 -2.882 1.002 1.00 0.00 O ATOM 1037 CB PHE A 70 -11.245 -4.707 -0.434 1.00 0.00 C ATOM 1038 CG PHE A 70 -10.043 -5.519 -0.930 1.00 0.00 C ATOM 1039 CD1 PHE A 70 -8.831 -5.517 -0.246 1.00 0.00 C ATOM 1040 CD2 PHE A 70 -10.154 -6.336 -2.054 1.00 0.00 C ATOM 1041 CE1 PHE A 70 -7.771 -6.291 -0.666 1.00 0.00 C ATOM 1042 CE2 PHE A 70 -9.095 -7.103 -2.476 1.00 0.00 C ATOM 1043 CZ PHE A 70 -7.901 -7.085 -1.781 1.00 0.00 C ATOM 0 H PHE A 70 -10.196 -3.355 1.495 1.00 0.00 H new ATOM 0 HA PHE A 70 -10.737 -2.816 -1.347 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -11.497 -5.057 0.567 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -12.095 -4.938 -1.076 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -8.719 -4.897 0.631 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -11.085 -6.367 -2.601 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -6.839 -6.274 -0.120 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -9.196 -7.723 -3.355 1.00 0.00 H new ATOM 0 HZ PHE A 70 -7.072 -7.693 -2.113 1.00 0.00 H new ATOM 1053 N ARG A 71 -12.896 -1.590 -0.847 1.00 0.00 N ATOM 1054 CA ARG A 71 -14.172 -0.894 -0.643 1.00 0.00 C ATOM 1055 C ARG A 71 -15.324 -1.603 -1.359 1.00 0.00 C ATOM 1056 O ARG A 71 -15.183 -2.044 -2.506 1.00 0.00 O ATOM 1057 CB ARG A 71 -14.095 0.547 -1.179 1.00 0.00 C ATOM 1058 CG ARG A 71 -12.979 1.407 -0.579 1.00 0.00 C ATOM 1059 CD ARG A 71 -13.281 2.898 -0.722 1.00 0.00 C ATOM 1060 NE ARG A 71 -13.371 3.323 -2.128 1.00 0.00 N ATOM 1061 CZ ARG A 71 -14.484 3.752 -2.751 1.00 0.00 C ATOM 1062 NH1 ARG A 71 -15.663 3.762 -2.127 1.00 0.00 N ATOM 1063 NH2 ARG A 71 -14.417 4.119 -4.018 1.00 0.00 N ATOM 0 H ARG A 71 -12.385 -1.279 -1.673 1.00 0.00 H new ATOM 0 HA ARG A 71 -14.359 -0.892 0.431 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -13.961 0.509 -2.260 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -15.050 1.038 -0.993 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -12.855 1.160 0.475 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -12.035 1.177 -1.074 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -14.220 3.125 -0.216 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -12.502 3.473 -0.221 1.00 0.00 H new ATOM 0 HE ARG A 71 -12.514 3.289 -2.679 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -15.732 3.441 -1.161 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -16.496 4.091 -2.616 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -13.527 4.076 -4.515 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -15.255 4.446 -4.499 1.00 0.00 H new ATOM 1077 N VAL A 72 -16.445 -1.736 -0.622 1.00 0.00 N ATOM 1078 CA VAL A 72 -17.703 -2.349 -1.117 1.00 0.00 C ATOM 1079 C VAL A 72 -18.930 -1.548 -0.661 1.00 0.00 C ATOM 1080 O VAL A 72 -18.822 -0.621 0.153 1.00 0.00 O ATOM 1081 CB VAL A 72 -17.914 -3.835 -0.625 1.00 0.00 C ATOM 1082 CG1 VAL A 72 -16.902 -4.806 -1.195 1.00 0.00 C ATOM 1083 CG2 VAL A 72 -17.968 -3.929 0.916 1.00 0.00 C ATOM 0 H VAL A 72 -16.507 -1.418 0.345 1.00 0.00 H new ATOM 0 HA VAL A 72 -17.604 -2.342 -2.203 1.00 0.00 H new ATOM 0 HB VAL A 72 -18.885 -4.137 -1.017 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -17.105 -5.808 -0.816 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -16.973 -4.808 -2.283 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -15.898 -4.502 -0.897 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -18.114 -4.968 1.212 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -17.032 -3.560 1.336 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -18.796 -3.326 1.289 1.00 0.00 H new ATOM 1093 N GLU A 73 -20.099 -1.956 -1.184 1.00 0.00 N ATOM 1094 CA GLU A 73 -21.366 -1.236 -0.981 1.00 0.00 C ATOM 1095 C GLU A 73 -21.969 -1.421 0.432 1.00 0.00 C ATOM 1096 O GLU A 73 -22.380 -0.426 1.044 1.00 0.00 O ATOM 1097 CB GLU A 73 -22.392 -1.634 -2.074 1.00 0.00 C ATOM 1098 CG GLU A 73 -22.739 -3.123 -2.103 1.00 0.00 C ATOM 1099 CD GLU A 73 -23.710 -3.528 -3.217 1.00 0.00 C ATOM 1100 OE1 GLU A 73 -23.264 -3.699 -4.370 1.00 0.00 O ATOM 1101 OE2 GLU A 73 -24.914 -3.694 -2.936 1.00 0.00 O ATOM 0 H GLU A 73 -20.191 -2.794 -1.759 1.00 0.00 H new ATOM 0 HA GLU A 73 -21.133 -0.175 -1.067 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -23.308 -1.063 -1.921 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -21.997 -1.347 -3.048 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -21.818 -3.695 -2.215 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -23.172 -3.401 -1.142 1.00 0.00 H new ATOM 1108 N ASN A 74 -22.009 -2.672 0.967 1.00 0.00 N ATOM 1109 CA ASN A 74 -22.652 -2.929 2.277 1.00 0.00 C ATOM 1110 C ASN A 74 -22.133 -4.214 2.942 1.00 0.00 C ATOM 1111 O ASN A 74 -21.346 -4.966 2.356 1.00 0.00 O ATOM 1112 CB ASN A 74 -24.207 -2.989 2.140 1.00 0.00 C ATOM 1113 CG ASN A 74 -24.743 -4.302 1.557 1.00 0.00 C ATOM 1114 OD1 ASN A 74 -25.026 -5.248 2.291 1.00 0.00 O ATOM 1115 ND2 ASN A 74 -24.908 -4.367 0.253 1.00 0.00 N ATOM 0 H ASN A 74 -21.612 -3.498 0.520 1.00 0.00 H new ATOM 0 HA ASN A 74 -22.385 -2.091 2.921 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -24.652 -2.834 3.123 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -24.536 -2.164 1.508 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -25.279 -5.217 -0.172 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -24.665 -3.568 -0.332 1.00 0.00 H new ATOM 1122 N ASP A 75 -22.622 -4.426 4.183 1.00 0.00 N ATOM 1123 CA ASP A 75 -22.097 -5.413 5.152 1.00 0.00 C ATOM 1124 C ASP A 75 -22.118 -6.840 4.604 1.00 0.00 C ATOM 1125 O ASP A 75 -21.258 -7.664 4.940 1.00 0.00 O ATOM 1126 CB ASP A 75 -22.897 -5.330 6.478 1.00 0.00 C ATOM 1127 CG ASP A 75 -24.390 -5.689 6.313 1.00 0.00 C ATOM 1128 OD1 ASP A 75 -25.168 -4.830 5.838 1.00 0.00 O ATOM 1129 OD2 ASP A 75 -24.789 -6.827 6.649 1.00 0.00 O ATOM 0 H ASP A 75 -23.416 -3.900 4.549 1.00 0.00 H new ATOM 0 HA ASP A 75 -21.053 -5.162 5.339 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -22.447 -6.002 7.209 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -22.815 -4.321 6.881 1.00 0.00 H new ATOM 1134 N ALA A 76 -23.128 -7.110 3.758 1.00 0.00 N ATOM 1135 CA ALA A 76 -23.351 -8.426 3.167 1.00 0.00 C ATOM 1136 C ALA A 76 -22.200 -8.791 2.229 1.00 0.00 C ATOM 1137 O ALA A 76 -21.670 -9.894 2.305 1.00 0.00 O ATOM 1138 CB ALA A 76 -24.690 -8.466 2.417 1.00 0.00 C ATOM 0 H ALA A 76 -23.812 -6.411 3.468 1.00 0.00 H new ATOM 0 HA ALA A 76 -23.390 -9.161 3.971 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -24.835 -9.456 1.985 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -25.502 -8.250 3.111 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -24.684 -7.720 1.622 1.00 0.00 H new ATOM 1144 N GLN A 77 -21.791 -7.812 1.384 1.00 0.00 N ATOM 1145 CA GLN A 77 -20.697 -7.976 0.416 1.00 0.00 C ATOM 1146 C GLN A 77 -19.339 -8.212 1.109 1.00 0.00 C ATOM 1147 O GLN A 77 -18.461 -8.855 0.540 1.00 0.00 O ATOM 1148 CB GLN A 77 -20.578 -6.709 -0.474 1.00 0.00 C ATOM 1149 CG GLN A 77 -21.795 -6.384 -1.351 1.00 0.00 C ATOM 1150 CD GLN A 77 -21.933 -7.240 -2.605 1.00 0.00 C ATOM 1151 OE1 GLN A 77 -20.946 -7.709 -3.174 1.00 0.00 O ATOM 1152 NE2 GLN A 77 -23.153 -7.394 -3.085 1.00 0.00 N ATOM 0 H GLN A 77 -22.218 -6.886 1.361 1.00 0.00 H new ATOM 0 HA GLN A 77 -20.937 -8.851 -0.188 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -20.382 -5.853 0.172 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -19.709 -6.825 -1.122 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -22.697 -6.498 -0.750 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -21.740 -5.337 -1.648 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -23.950 -6.993 -2.590 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -23.299 -7.914 -3.951 1.00 0.00 H new ATOM 1161 N VAL A 78 -19.209 -7.728 2.365 1.00 0.00 N ATOM 1162 CA VAL A 78 -18.004 -7.949 3.195 1.00 0.00 C ATOM 1163 C VAL A 78 -17.946 -9.422 3.654 1.00 0.00 C ATOM 1164 O VAL A 78 -16.883 -10.053 3.661 1.00 0.00 O ATOM 1165 CB VAL A 78 -17.991 -7.012 4.468 1.00 0.00 C ATOM 1166 CG1 VAL A 78 -16.725 -7.214 5.337 1.00 0.00 C ATOM 1167 CG2 VAL A 78 -18.143 -5.534 4.073 1.00 0.00 C ATOM 0 H VAL A 78 -19.931 -7.177 2.829 1.00 0.00 H new ATOM 0 HA VAL A 78 -17.135 -7.709 2.582 1.00 0.00 H new ATOM 0 HB VAL A 78 -18.850 -7.300 5.074 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -16.765 -6.547 6.198 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -16.680 -8.248 5.680 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -15.838 -6.989 4.745 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -18.130 -4.915 4.970 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -17.319 -5.245 3.421 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -19.088 -5.393 3.548 1.00 0.00 H new ATOM 1177 N ASP A 79 -19.140 -9.954 3.997 1.00 0.00 N ATOM 1178 CA ASP A 79 -19.331 -11.339 4.458 1.00 0.00 C ATOM 1179 C ASP A 79 -19.136 -12.330 3.291 1.00 0.00 C ATOM 1180 O ASP A 79 -18.659 -13.457 3.490 1.00 0.00 O ATOM 1181 CB ASP A 79 -20.748 -11.474 5.075 1.00 0.00 C ATOM 1182 CG ASP A 79 -21.055 -12.879 5.619 1.00 0.00 C ATOM 1183 OD1 ASP A 79 -20.690 -13.168 6.772 1.00 0.00 O ATOM 1184 OD2 ASP A 79 -21.659 -13.697 4.891 1.00 0.00 O ATOM 0 H ASP A 79 -20.009 -9.421 3.959 1.00 0.00 H new ATOM 0 HA ASP A 79 -18.587 -11.579 5.218 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -20.853 -10.750 5.883 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -21.490 -11.217 4.319 1.00 0.00 H new ATOM 1189 N GLU A 80 -19.498 -11.887 2.071 1.00 0.00 N ATOM 1190 CA GLU A 80 -19.289 -12.670 0.840 1.00 0.00 C ATOM 1191 C GLU A 80 -17.787 -12.825 0.576 1.00 0.00 C ATOM 1192 O GLU A 80 -17.301 -13.902 0.217 1.00 0.00 O ATOM 1193 CB GLU A 80 -20.007 -12.011 -0.369 1.00 0.00 C ATOM 1194 CG GLU A 80 -21.515 -11.770 -0.144 1.00 0.00 C ATOM 1195 CD GLU A 80 -22.309 -11.558 -1.443 1.00 0.00 C ATOM 1196 OE1 GLU A 80 -22.637 -12.569 -2.110 1.00 0.00 O ATOM 1197 OE2 GLU A 80 -22.601 -10.398 -1.810 1.00 0.00 O ATOM 0 H GLU A 80 -19.941 -10.982 1.913 1.00 0.00 H new ATOM 0 HA GLU A 80 -19.724 -13.660 0.974 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -19.526 -11.058 -0.590 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -19.877 -12.645 -1.246 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -21.934 -12.622 0.392 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -21.643 -10.897 0.496 1.00 0.00 H new ATOM 1204 N THR A 81 -17.066 -11.718 0.804 1.00 0.00 N ATOM 1205 CA THR A 81 -15.613 -11.644 0.625 1.00 0.00 C ATOM 1206 C THR A 81 -14.883 -12.445 1.724 1.00 0.00 C ATOM 1207 O THR A 81 -13.802 -12.979 1.485 1.00 0.00 O ATOM 1208 CB THR A 81 -15.157 -10.153 0.629 1.00 0.00 C ATOM 1209 OG1 THR A 81 -15.999 -9.397 -0.248 1.00 0.00 O ATOM 1210 CG2 THR A 81 -13.715 -9.976 0.164 1.00 0.00 C ATOM 0 H THR A 81 -17.481 -10.842 1.121 1.00 0.00 H new ATOM 0 HA THR A 81 -15.354 -12.088 -0.336 1.00 0.00 H new ATOM 0 HB THR A 81 -15.229 -9.804 1.659 1.00 0.00 H new ATOM 0 HG1 THR A 81 -16.698 -8.950 0.274 1.00 0.00 H new ATOM 0 HG21 THR A 81 -13.452 -8.918 0.187 1.00 0.00 H new ATOM 0 HG22 THR A 81 -13.049 -10.530 0.825 1.00 0.00 H new ATOM 0 HG23 THR A 81 -13.612 -10.353 -0.853 1.00 0.00 H new ATOM 1218 N PHE A 82 -15.508 -12.545 2.919 1.00 0.00 N ATOM 1219 CA PHE A 82 -14.996 -13.360 4.038 1.00 0.00 C ATOM 1220 C PHE A 82 -14.889 -14.833 3.599 1.00 0.00 C ATOM 1221 O PHE A 82 -13.802 -15.408 3.532 1.00 0.00 O ATOM 1222 CB PHE A 82 -15.924 -13.204 5.285 1.00 0.00 C ATOM 1223 CG PHE A 82 -15.551 -14.063 6.506 1.00 0.00 C ATOM 1224 CD1 PHE A 82 -16.043 -15.364 6.654 1.00 0.00 C ATOM 1225 CD2 PHE A 82 -14.713 -13.572 7.505 1.00 0.00 C ATOM 1226 CE1 PHE A 82 -15.710 -16.136 7.750 1.00 0.00 C ATOM 1227 CE2 PHE A 82 -14.382 -14.346 8.604 1.00 0.00 C ATOM 1228 CZ PHE A 82 -14.880 -15.627 8.723 1.00 0.00 C ATOM 0 H PHE A 82 -16.381 -12.062 3.132 1.00 0.00 H new ATOM 0 HA PHE A 82 -14.001 -13.013 4.317 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -15.923 -12.157 5.587 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -16.944 -13.450 4.989 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -16.696 -15.773 5.897 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -14.315 -12.571 7.421 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -16.101 -17.139 7.843 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -13.733 -13.946 9.369 1.00 0.00 H new ATOM 0 HZ PHE A 82 -14.619 -16.231 9.580 1.00 0.00 H new ATOM 1238 N ALA A 83 -16.051 -15.398 3.237 1.00 0.00 N ATOM 1239 CA ALA A 83 -16.193 -16.822 2.882 1.00 0.00 C ATOM 1240 C ALA A 83 -15.449 -17.161 1.578 1.00 0.00 C ATOM 1241 O ALA A 83 -14.875 -18.250 1.446 1.00 0.00 O ATOM 1242 CB ALA A 83 -17.678 -17.184 2.767 1.00 0.00 C ATOM 0 H ALA A 83 -16.926 -14.877 3.181 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.740 -17.415 3.676 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -17.776 -18.237 2.504 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -18.172 -17.000 3.721 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -18.143 -16.572 1.994 1.00 0.00 H new ATOM 1248 N GLY A 84 -15.475 -16.206 0.633 1.00 0.00 N ATOM 1249 CA GLY A 84 -14.773 -16.333 -0.647 1.00 0.00 C ATOM 1250 C GLY A 84 -13.259 -16.469 -0.506 1.00 0.00 C ATOM 1251 O GLY A 84 -12.668 -17.400 -1.055 1.00 0.00 O ATOM 0 H GLY A 84 -15.983 -15.328 0.738 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -15.159 -17.203 -1.178 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -14.995 -15.460 -1.261 1.00 0.00 H new ATOM 1255 N TRP A 85 -12.643 -15.555 0.275 1.00 0.00 N ATOM 1256 CA TRP A 85 -11.185 -15.572 0.558 1.00 0.00 C ATOM 1257 C TRP A 85 -10.805 -16.847 1.318 1.00 0.00 C ATOM 1258 O TRP A 85 -9.758 -17.446 1.043 1.00 0.00 O ATOM 1259 CB TRP A 85 -10.771 -14.313 1.351 1.00 0.00 C ATOM 1260 CG TRP A 85 -10.775 -13.030 0.549 1.00 0.00 C ATOM 1261 CD1 TRP A 85 -11.327 -12.803 -0.690 1.00 0.00 C ATOM 1262 CD2 TRP A 85 -10.198 -11.789 0.955 1.00 0.00 C ATOM 1263 NE1 TRP A 85 -11.086 -11.513 -1.079 1.00 0.00 N ATOM 1264 CE2 TRP A 85 -10.407 -10.867 -0.081 1.00 0.00 C ATOM 1265 CE3 TRP A 85 -9.520 -11.375 2.095 1.00 0.00 C ATOM 1266 CZ2 TRP A 85 -9.952 -9.560 -0.013 1.00 0.00 C ATOM 1267 CZ3 TRP A 85 -9.080 -10.076 2.171 1.00 0.00 C ATOM 1268 CH2 TRP A 85 -9.291 -9.180 1.121 1.00 0.00 C ATOM 0 H TRP A 85 -13.137 -14.786 0.727 1.00 0.00 H new ATOM 0 HA TRP A 85 -10.646 -15.566 -0.390 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -11.445 -14.197 2.200 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -9.771 -14.468 1.757 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -11.870 -13.534 -1.270 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -11.367 -11.100 -1.968 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -9.342 -12.063 2.908 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -10.114 -8.868 -0.826 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -8.562 -9.742 3.058 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -8.925 -8.168 1.207 1.00 0.00 H new ATOM 1279 N LYS A 86 -11.637 -17.209 2.302 1.00 0.00 N ATOM 1280 CA LYS A 86 -11.430 -18.402 3.144 1.00 0.00 C ATOM 1281 C LYS A 86 -11.295 -19.665 2.267 1.00 0.00 C ATOM 1282 O LYS A 86 -10.356 -20.453 2.426 1.00 0.00 O ATOM 1283 CB LYS A 86 -12.604 -18.516 4.146 1.00 0.00 C ATOM 1284 CG LYS A 86 -12.595 -19.769 5.042 1.00 0.00 C ATOM 1285 CD LYS A 86 -13.716 -19.749 6.110 1.00 0.00 C ATOM 1286 CE LYS A 86 -15.108 -19.412 5.523 1.00 0.00 C ATOM 1287 NZ LYS A 86 -16.192 -19.554 6.520 1.00 0.00 N ATOM 0 H LYS A 86 -12.478 -16.683 2.541 1.00 0.00 H new ATOM 0 HA LYS A 86 -10.501 -18.307 3.707 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -12.599 -17.634 4.786 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -13.539 -18.498 3.586 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -12.708 -20.656 4.419 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -11.628 -19.849 5.538 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -13.761 -20.722 6.600 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -13.465 -19.017 6.878 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -15.101 -18.391 5.142 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -15.310 -20.067 4.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -17.065 -19.128 6.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -16.355 -20.563 6.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -15.920 -19.071 7.400 1.00 0.00 H new ATOM 1301 N ALA A 87 -12.221 -19.790 1.306 1.00 0.00 N ATOM 1302 CA ALA A 87 -12.257 -20.899 0.341 1.00 0.00 C ATOM 1303 C ALA A 87 -11.200 -20.740 -0.782 1.00 0.00 C ATOM 1304 O ALA A 87 -10.893 -21.699 -1.497 1.00 0.00 O ATOM 1305 CB ALA A 87 -13.665 -20.990 -0.264 1.00 0.00 C ATOM 0 H ALA A 87 -12.975 -19.116 1.175 1.00 0.00 H new ATOM 0 HA ALA A 87 -12.014 -21.818 0.874 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.701 -21.810 -0.981 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -14.391 -21.170 0.529 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -13.905 -20.055 -0.770 1.00 0.00 H new ATOM 1311 N SER A 88 -10.645 -19.518 -0.912 1.00 0.00 N ATOM 1312 CA SER A 88 -9.592 -19.185 -1.898 1.00 0.00 C ATOM 1313 C SER A 88 -8.172 -19.361 -1.309 1.00 0.00 C ATOM 1314 O SER A 88 -7.165 -19.170 -2.004 1.00 0.00 O ATOM 1315 CB SER A 88 -9.790 -17.723 -2.391 1.00 0.00 C ATOM 1316 OG SER A 88 -8.808 -17.321 -3.340 1.00 0.00 O ATOM 0 H SER A 88 -10.917 -18.725 -0.330 1.00 0.00 H new ATOM 0 HA SER A 88 -9.683 -19.876 -2.736 1.00 0.00 H new ATOM 0 HB2 SER A 88 -10.780 -17.626 -2.837 1.00 0.00 H new ATOM 0 HB3 SER A 88 -9.758 -17.049 -1.535 1.00 0.00 H new ATOM 0 HG SER A 88 -8.027 -17.909 -3.272 1.00 0.00 H new ATOM 1322 N GLY A 89 -8.113 -19.728 -0.011 1.00 0.00 N ATOM 1323 CA GLY A 89 -6.862 -20.118 0.649 1.00 0.00 C ATOM 1324 C GLY A 89 -6.185 -18.984 1.409 1.00 0.00 C ATOM 1325 O GLY A 89 -4.962 -18.810 1.311 1.00 0.00 O ATOM 0 H GLY A 89 -8.929 -19.760 0.600 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -7.067 -20.934 1.341 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.171 -20.502 -0.101 1.00 0.00 H new ATOM 1329 N VAL A 90 -6.976 -18.202 2.162 1.00 0.00 N ATOM 1330 CA VAL A 90 -6.442 -17.178 3.089 1.00 0.00 C ATOM 1331 C VAL A 90 -6.418 -17.775 4.523 1.00 0.00 C ATOM 1332 O VAL A 90 -7.237 -18.652 4.837 1.00 0.00 O ATOM 1333 CB VAL A 90 -7.293 -15.838 3.015 1.00 0.00 C ATOM 1334 CG1 VAL A 90 -8.553 -15.867 3.909 1.00 0.00 C ATOM 1335 CG2 VAL A 90 -6.432 -14.590 3.308 1.00 0.00 C ATOM 0 H VAL A 90 -7.994 -18.257 2.150 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.426 -16.910 2.800 1.00 0.00 H new ATOM 0 HB VAL A 90 -7.644 -15.770 1.985 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -9.089 -14.923 3.813 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.201 -16.686 3.598 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.258 -16.013 4.948 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -7.054 -13.697 3.247 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.007 -14.668 4.308 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.627 -14.523 2.576 1.00 0.00 H new ATOM 1345 N ALA A 91 -5.476 -17.318 5.373 1.00 0.00 N ATOM 1346 CA ALA A 91 -5.306 -17.850 6.753 1.00 0.00 C ATOM 1347 C ALA A 91 -6.511 -17.501 7.655 1.00 0.00 C ATOM 1348 O ALA A 91 -6.883 -18.299 8.528 1.00 0.00 O ATOM 1349 CB ALA A 91 -3.996 -17.342 7.370 1.00 0.00 C ATOM 0 H ALA A 91 -4.816 -16.579 5.132 1.00 0.00 H new ATOM 0 HA ALA A 91 -5.258 -18.937 6.683 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -3.890 -17.742 8.379 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -3.155 -17.670 6.759 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -4.012 -16.253 7.411 1.00 0.00 H new ATOM 1355 N MET A 92 -7.078 -16.286 7.453 1.00 0.00 N ATOM 1356 CA MET A 92 -8.377 -15.872 8.037 1.00 0.00 C ATOM 1357 C MET A 92 -8.348 -15.758 9.589 1.00 0.00 C ATOM 1358 O MET A 92 -8.676 -16.717 10.299 1.00 0.00 O ATOM 1359 CB MET A 92 -9.519 -16.831 7.564 1.00 0.00 C ATOM 1360 CG MET A 92 -10.923 -16.448 8.047 1.00 0.00 C ATOM 1361 SD MET A 92 -11.418 -14.827 7.448 1.00 0.00 S ATOM 1362 CE MET A 92 -11.652 -15.159 5.709 1.00 0.00 C ATOM 0 H MET A 92 -6.645 -15.563 6.878 1.00 0.00 H new ATOM 0 HA MET A 92 -8.579 -14.867 7.667 1.00 0.00 H new ATOM 0 HB2 MET A 92 -9.521 -16.861 6.474 1.00 0.00 H new ATOM 0 HB3 MET A 92 -9.294 -17.840 7.910 1.00 0.00 H new ATOM 0 HG2 MET A 92 -11.640 -17.195 7.707 1.00 0.00 H new ATOM 0 HG3 MET A 92 -10.947 -16.455 9.137 1.00 0.00 H new ATOM 0 HE1 MET A 92 -10.991 -14.520 5.124 1.00 0.00 H new ATOM 0 HE2 MET A 92 -11.421 -16.204 5.504 1.00 0.00 H new ATOM 0 HE3 MET A 92 -12.688 -14.956 5.436 1.00 0.00 H new ATOM 1372 N LEU A 93 -7.872 -14.602 10.118 1.00 0.00 N ATOM 1373 CA LEU A 93 -7.930 -14.313 11.572 1.00 0.00 C ATOM 1374 C LEU A 93 -8.463 -12.877 11.844 1.00 0.00 C ATOM 1375 O LEU A 93 -7.691 -11.921 12.017 1.00 0.00 O ATOM 1376 CB LEU A 93 -6.559 -14.615 12.319 1.00 0.00 C ATOM 1377 CG LEU A 93 -5.180 -14.393 11.574 1.00 0.00 C ATOM 1378 CD1 LEU A 93 -4.887 -15.489 10.535 1.00 0.00 C ATOM 1379 CD2 LEU A 93 -5.067 -12.992 10.945 1.00 0.00 C ATOM 0 H LEU A 93 -7.447 -13.860 9.562 1.00 0.00 H new ATOM 0 HA LEU A 93 -8.650 -15.007 12.005 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.541 -14.003 13.221 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -6.589 -15.656 12.640 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.415 -14.465 12.347 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -3.930 -15.288 10.054 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.847 -16.459 11.031 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.676 -15.498 9.783 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -4.102 -12.893 10.447 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.867 -12.854 10.217 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -5.152 -12.235 11.725 1.00 0.00 H new ATOM 1391 N GLN A 94 -9.807 -12.777 11.896 1.00 0.00 N ATOM 1392 CA GLN A 94 -10.562 -11.565 12.282 1.00 0.00 C ATOM 1393 C GLN A 94 -12.063 -11.873 12.193 1.00 0.00 C ATOM 1394 O GLN A 94 -12.532 -12.352 11.154 1.00 0.00 O ATOM 1395 CB GLN A 94 -10.232 -10.329 11.382 1.00 0.00 C ATOM 1396 CG GLN A 94 -11.077 -9.052 11.638 1.00 0.00 C ATOM 1397 CD GLN A 94 -10.942 -8.456 13.045 1.00 0.00 C ATOM 1398 OE1 GLN A 94 -9.897 -8.564 13.688 1.00 0.00 O ATOM 1399 NE2 GLN A 94 -12.006 -7.828 13.536 1.00 0.00 N ATOM 0 H GLN A 94 -10.417 -13.561 11.664 1.00 0.00 H new ATOM 0 HA GLN A 94 -10.270 -11.304 13.299 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -9.180 -10.077 11.517 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.358 -10.620 10.339 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -10.791 -8.293 10.910 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.126 -9.287 11.458 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.857 -7.755 12.979 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -11.971 -7.419 14.470 1.00 0.00 H new ATOM 1408 N GLN A 95 -12.793 -11.621 13.288 1.00 0.00 N ATOM 1409 CA GLN A 95 -14.258 -11.602 13.292 1.00 0.00 C ATOM 1410 C GLN A 95 -14.706 -10.235 12.725 1.00 0.00 C ATOM 1411 O GLN A 95 -14.462 -9.208 13.374 1.00 0.00 O ATOM 1412 CB GLN A 95 -14.798 -11.794 14.737 1.00 0.00 C ATOM 1413 CG GLN A 95 -14.330 -13.079 15.454 1.00 0.00 C ATOM 1414 CD GLN A 95 -14.689 -13.100 16.951 1.00 0.00 C ATOM 1415 OE1 GLN A 95 -14.788 -12.049 17.597 1.00 0.00 O ATOM 1416 NE2 GLN A 95 -14.856 -14.285 17.520 1.00 0.00 N ATOM 0 H GLN A 95 -12.380 -11.424 14.199 1.00 0.00 H new ATOM 0 HA GLN A 95 -14.653 -12.415 12.683 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.498 -10.934 15.336 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -15.887 -11.794 14.703 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -14.779 -13.944 14.967 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -13.250 -13.176 15.344 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -14.769 -15.135 16.963 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -15.072 -14.347 18.515 1.00 0.00 H new ATOM 1425 N PRO A 96 -15.302 -10.188 11.483 1.00 0.00 N ATOM 1426 CA PRO A 96 -15.804 -8.929 10.880 1.00 0.00 C ATOM 1427 C PRO A 96 -16.785 -8.211 11.830 1.00 0.00 C ATOM 1428 O PRO A 96 -17.813 -8.782 12.219 1.00 0.00 O ATOM 1429 CB PRO A 96 -16.496 -9.395 9.572 1.00 0.00 C ATOM 1430 CG PRO A 96 -15.828 -10.691 9.240 1.00 0.00 C ATOM 1431 CD PRO A 96 -15.508 -11.339 10.570 1.00 0.00 C ATOM 0 HA PRO A 96 -15.014 -8.203 10.690 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -17.569 -9.526 9.715 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -16.367 -8.665 8.773 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -16.481 -11.326 8.642 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -14.922 -10.526 8.657 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -16.323 -11.979 10.910 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -14.617 -11.964 10.507 1.00 0.00 H new ATOM 1439 N ALA A 97 -16.436 -6.983 12.228 1.00 0.00 N ATOM 1440 CA ALA A 97 -17.136 -6.253 13.292 1.00 0.00 C ATOM 1441 C ALA A 97 -17.560 -4.868 12.809 1.00 0.00 C ATOM 1442 O ALA A 97 -16.875 -4.244 11.988 1.00 0.00 O ATOM 1443 CB ALA A 97 -16.227 -6.146 14.527 1.00 0.00 C ATOM 0 H ALA A 97 -15.658 -6.465 11.820 1.00 0.00 H new ATOM 0 HA ALA A 97 -18.039 -6.800 13.563 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -16.748 -5.604 15.316 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.973 -7.146 14.880 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -15.314 -5.613 14.262 1.00 0.00 H new ATOM 1449 N LYS A 98 -18.709 -4.411 13.315 1.00 0.00 N ATOM 1450 CA LYS A 98 -19.206 -3.061 13.080 1.00 0.00 C ATOM 1451 C LYS A 98 -18.388 -2.054 13.901 1.00 0.00 C ATOM 1452 O LYS A 98 -18.547 -1.935 15.118 1.00 0.00 O ATOM 1453 CB LYS A 98 -20.723 -2.975 13.397 1.00 0.00 C ATOM 1454 CG LYS A 98 -21.623 -3.512 12.275 1.00 0.00 C ATOM 1455 CD LYS A 98 -21.527 -2.670 10.979 1.00 0.00 C ATOM 1456 CE LYS A 98 -22.307 -1.358 11.062 1.00 0.00 C ATOM 1457 NZ LYS A 98 -23.754 -1.591 11.320 1.00 0.00 N ATOM 0 H LYS A 98 -19.322 -4.975 13.903 1.00 0.00 H new ATOM 0 HA LYS A 98 -19.085 -2.810 12.026 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -20.926 -3.533 14.311 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -20.985 -1.935 13.594 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -21.347 -4.543 12.055 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -22.657 -3.526 12.619 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -20.480 -2.451 10.771 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -21.903 -3.258 10.141 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -21.891 -0.738 11.856 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -22.188 -0.805 10.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -24.320 -1.026 10.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -23.972 -2.600 11.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -23.982 -1.310 12.295 1.00 0.00 H new ATOM 1471 N MET A 99 -17.475 -1.385 13.192 1.00 0.00 N ATOM 1472 CA MET A 99 -16.596 -0.328 13.731 1.00 0.00 C ATOM 1473 C MET A 99 -17.202 1.051 13.385 1.00 0.00 C ATOM 1474 O MET A 99 -18.224 1.117 12.685 1.00 0.00 O ATOM 1475 CB MET A 99 -15.158 -0.529 13.135 1.00 0.00 C ATOM 1476 CG MET A 99 -14.046 0.373 13.703 1.00 0.00 C ATOM 1477 SD MET A 99 -12.387 -0.111 13.160 1.00 0.00 S ATOM 1478 CE MET A 99 -12.147 -1.652 14.061 1.00 0.00 C ATOM 0 H MET A 99 -17.318 -1.564 12.200 1.00 0.00 H new ATOM 0 HA MET A 99 -16.516 -0.382 14.817 1.00 0.00 H new ATOM 0 HB2 MET A 99 -14.867 -1.568 13.290 1.00 0.00 H new ATOM 0 HB3 MET A 99 -15.210 -0.369 12.058 1.00 0.00 H new ATOM 0 HG2 MET A 99 -14.234 1.404 13.402 1.00 0.00 H new ATOM 0 HG3 MET A 99 -14.087 0.347 14.792 1.00 0.00 H new ATOM 0 HE1 MET A 99 -11.278 -1.561 14.713 1.00 0.00 H new ATOM 0 HE2 MET A 99 -13.031 -1.863 14.663 1.00 0.00 H new ATOM 0 HE3 MET A 99 -11.986 -2.466 13.354 1.00 0.00 H new ATOM 1488 N GLU A 100 -16.590 2.138 13.892 1.00 0.00 N ATOM 1489 CA GLU A 100 -17.000 3.535 13.602 1.00 0.00 C ATOM 1490 C GLU A 100 -17.090 3.816 12.080 1.00 0.00 C ATOM 1491 O GLU A 100 -18.018 4.477 11.613 1.00 0.00 O ATOM 1492 CB GLU A 100 -15.996 4.523 14.259 1.00 0.00 C ATOM 1493 CG GLU A 100 -15.771 4.296 15.768 1.00 0.00 C ATOM 1494 CD GLU A 100 -14.745 5.265 16.382 1.00 0.00 C ATOM 1495 OE1 GLU A 100 -13.553 5.192 16.003 1.00 0.00 O ATOM 1496 OE2 GLU A 100 -15.116 6.110 17.224 1.00 0.00 O ATOM 0 H GLU A 100 -15.789 2.076 14.521 1.00 0.00 H new ATOM 0 HA GLU A 100 -17.996 3.678 14.021 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.038 4.443 13.745 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -16.355 5.541 14.107 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -16.721 4.405 16.291 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -15.434 3.272 15.928 1.00 0.00 H new ATOM 1503 N PHE A 101 -16.125 3.264 11.320 1.00 0.00 N ATOM 1504 CA PHE A 101 -16.031 3.449 9.846 1.00 0.00 C ATOM 1505 C PHE A 101 -16.781 2.340 9.085 1.00 0.00 C ATOM 1506 O PHE A 101 -16.685 2.241 7.855 1.00 0.00 O ATOM 1507 CB PHE A 101 -14.537 3.517 9.439 1.00 0.00 C ATOM 1508 CG PHE A 101 -13.791 4.577 10.242 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -13.893 5.928 9.907 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -13.050 4.228 11.375 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -13.270 6.893 10.669 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -12.439 5.193 12.138 1.00 0.00 C ATOM 1513 CZ PHE A 101 -12.549 6.526 11.788 1.00 0.00 C ATOM 0 H PHE A 101 -15.385 2.676 11.704 1.00 0.00 H new ATOM 0 HA PHE A 101 -16.515 4.386 9.573 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -14.071 2.544 9.596 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -14.458 3.741 8.375 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -14.467 6.221 9.040 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -12.957 3.189 11.653 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -13.346 7.934 10.391 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -11.872 4.910 13.013 1.00 0.00 H new ATOM 0 HZ PHE A 101 -12.070 7.282 12.392 1.00 0.00 H new ATOM 1523 N GLY A 102 -17.503 1.494 9.839 1.00 0.00 N ATOM 1524 CA GLY A 102 -18.449 0.540 9.274 1.00 0.00 C ATOM 1525 C GLY A 102 -18.035 -0.902 9.488 1.00 0.00 C ATOM 1526 O GLY A 102 -17.155 -1.175 10.310 1.00 0.00 O ATOM 0 H GLY A 102 -17.441 1.459 10.857 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -19.430 0.701 9.722 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -18.552 0.728 8.205 1.00 0.00 H new ATOM 1530 N TYR A 103 -18.645 -1.826 8.732 1.00 0.00 N ATOM 1531 CA TYR A 103 -18.416 -3.268 8.900 1.00 0.00 C ATOM 1532 C TYR A 103 -17.062 -3.637 8.292 1.00 0.00 C ATOM 1533 O TYR A 103 -16.962 -3.763 7.076 1.00 0.00 O ATOM 1534 CB TYR A 103 -19.561 -4.076 8.219 1.00 0.00 C ATOM 1535 CG TYR A 103 -19.697 -5.503 8.754 1.00 0.00 C ATOM 1536 CD1 TYR A 103 -19.864 -5.700 10.113 1.00 0.00 C ATOM 1537 CD2 TYR A 103 -19.683 -6.631 7.931 1.00 0.00 C ATOM 1538 CE1 TYR A 103 -20.013 -6.936 10.652 1.00 0.00 C ATOM 1539 CE2 TYR A 103 -19.831 -7.900 8.466 1.00 0.00 C ATOM 1540 CZ TYR A 103 -19.998 -8.048 9.831 1.00 0.00 C ATOM 1541 OH TYR A 103 -20.143 -9.308 10.376 1.00 0.00 O ATOM 0 H TYR A 103 -19.307 -1.597 7.991 1.00 0.00 H new ATOM 0 HA TYR A 103 -18.410 -3.516 9.961 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -20.504 -3.549 8.365 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -19.380 -4.114 7.145 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -19.876 -4.841 10.767 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -19.555 -6.513 6.865 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -20.143 -7.051 11.718 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -19.816 -8.767 7.822 1.00 0.00 H new ATOM 0 HH TYR A 103 -19.474 -9.439 11.080 1.00 0.00 H new ATOM 1551 N THR A 104 -16.030 -3.826 9.134 1.00 0.00 N ATOM 1552 CA THR A 104 -14.640 -3.997 8.674 1.00 0.00 C ATOM 1553 C THR A 104 -14.144 -5.422 8.972 1.00 0.00 C ATOM 1554 O THR A 104 -14.547 -6.047 9.961 1.00 0.00 O ATOM 1555 CB THR A 104 -13.684 -2.926 9.322 1.00 0.00 C ATOM 1556 OG1 THR A 104 -12.375 -2.983 8.714 1.00 0.00 O ATOM 1557 CG2 THR A 104 -13.553 -3.097 10.852 1.00 0.00 C ATOM 0 H THR A 104 -16.135 -3.864 10.148 1.00 0.00 H new ATOM 0 HA THR A 104 -14.624 -3.843 7.595 1.00 0.00 H new ATOM 0 HB THR A 104 -14.135 -1.951 9.137 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.793 -2.311 9.126 1.00 0.00 H new ATOM 0 HG21 THR A 104 -12.883 -2.334 11.247 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.534 -2.994 11.315 1.00 0.00 H new ATOM 0 HG23 THR A 104 -13.149 -4.085 11.074 1.00 0.00 H new ATOM 1565 N PHE A 105 -13.274 -5.914 8.087 1.00 0.00 N ATOM 1566 CA PHE A 105 -12.727 -7.274 8.122 1.00 0.00 C ATOM 1567 C PHE A 105 -11.258 -7.249 7.670 1.00 0.00 C ATOM 1568 O PHE A 105 -10.938 -6.521 6.742 1.00 0.00 O ATOM 1569 CB PHE A 105 -13.615 -8.187 7.205 1.00 0.00 C ATOM 1570 CG PHE A 105 -12.937 -9.421 6.599 1.00 0.00 C ATOM 1571 CD1 PHE A 105 -12.424 -10.438 7.405 1.00 0.00 C ATOM 1572 CD2 PHE A 105 -12.806 -9.549 5.212 1.00 0.00 C ATOM 1573 CE1 PHE A 105 -11.803 -11.531 6.841 1.00 0.00 C ATOM 1574 CE2 PHE A 105 -12.184 -10.642 4.654 1.00 0.00 C ATOM 1575 CZ PHE A 105 -11.685 -11.631 5.466 1.00 0.00 C ATOM 0 H PHE A 105 -12.920 -5.363 7.305 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.746 -7.680 9.133 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.473 -8.522 7.787 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.002 -7.576 6.389 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -12.514 -10.368 8.479 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -13.200 -8.776 4.568 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -11.407 -12.312 7.474 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -12.088 -10.722 3.581 1.00 0.00 H new ATOM 0 HZ PHE A 105 -11.198 -12.491 5.029 1.00 0.00 H new ATOM 1585 N THR A 106 -10.363 -8.002 8.325 1.00 0.00 N ATOM 1586 CA THR A 106 -8.933 -8.021 7.953 1.00 0.00 C ATOM 1587 C THR A 106 -8.405 -9.465 7.920 1.00 0.00 C ATOM 1588 O THR A 106 -8.428 -10.164 8.928 1.00 0.00 O ATOM 1589 CB THR A 106 -8.079 -7.148 8.933 1.00 0.00 C ATOM 1590 OG1 THR A 106 -8.652 -5.831 9.040 1.00 0.00 O ATOM 1591 CG2 THR A 106 -6.601 -7.019 8.478 1.00 0.00 C ATOM 0 H THR A 106 -10.599 -8.605 9.113 1.00 0.00 H new ATOM 0 HA THR A 106 -8.841 -7.592 6.955 1.00 0.00 H new ATOM 0 HB THR A 106 -8.090 -7.652 9.900 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.644 -5.546 9.978 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.053 -6.404 9.192 1.00 0.00 H new ATOM 0 HG22 THR A 106 -6.148 -8.009 8.429 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.563 -6.553 7.493 1.00 0.00 H new ATOM 1599 N ALA A 107 -7.922 -9.898 6.753 1.00 0.00 N ATOM 1600 CA ALA A 107 -7.395 -11.257 6.560 1.00 0.00 C ATOM 1601 C ALA A 107 -5.864 -11.243 6.454 1.00 0.00 C ATOM 1602 O ALA A 107 -5.262 -10.191 6.187 1.00 0.00 O ATOM 1603 CB ALA A 107 -8.024 -11.887 5.313 1.00 0.00 C ATOM 0 H ALA A 107 -7.884 -9.319 5.914 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.659 -11.860 7.428 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -7.629 -12.894 5.176 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -9.106 -11.935 5.436 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -7.785 -11.281 4.439 1.00 0.00 H new ATOM 1609 N ALA A 108 -5.243 -12.409 6.670 1.00 0.00 N ATOM 1610 CA ALA A 108 -3.804 -12.612 6.458 1.00 0.00 C ATOM 1611 C ALA A 108 -3.619 -13.671 5.368 1.00 0.00 C ATOM 1612 O ALA A 108 -4.042 -14.810 5.543 1.00 0.00 O ATOM 1613 CB ALA A 108 -3.117 -13.047 7.762 1.00 0.00 C ATOM 0 H ALA A 108 -5.728 -13.244 6.999 1.00 0.00 H new ATOM 0 HA ALA A 108 -3.343 -11.676 6.144 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -2.052 -13.192 7.581 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -3.255 -12.277 8.521 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.556 -13.982 8.110 1.00 0.00 H new ATOM 1619 N ASP A 109 -3.054 -13.261 4.232 1.00 0.00 N ATOM 1620 CA ASP A 109 -2.726 -14.158 3.095 1.00 0.00 C ATOM 1621 C ASP A 109 -1.534 -15.112 3.447 1.00 0.00 C ATOM 1622 O ASP A 109 -1.025 -15.040 4.569 1.00 0.00 O ATOM 1623 CB ASP A 109 -2.426 -13.267 1.858 1.00 0.00 C ATOM 1624 CG ASP A 109 -1.281 -12.287 2.087 1.00 0.00 C ATOM 1625 OD1 ASP A 109 -1.529 -11.214 2.676 1.00 0.00 O ATOM 1626 OD2 ASP A 109 -0.132 -12.590 1.708 1.00 0.00 O ATOM 0 H ASP A 109 -2.803 -12.287 4.062 1.00 0.00 H new ATOM 0 HA ASP A 109 -3.569 -14.812 2.872 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -2.185 -13.906 1.008 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.325 -12.710 1.593 1.00 0.00 H new ATOM 1631 N PRO A 110 -1.115 -16.080 2.540 1.00 0.00 N ATOM 1632 CA PRO A 110 0.103 -16.933 2.732 1.00 0.00 C ATOM 1633 C PRO A 110 1.359 -16.179 3.263 1.00 0.00 C ATOM 1634 O PRO A 110 2.069 -16.698 4.132 1.00 0.00 O ATOM 1635 CB PRO A 110 0.359 -17.527 1.305 1.00 0.00 C ATOM 1636 CG PRO A 110 -0.685 -16.911 0.409 1.00 0.00 C ATOM 1637 CD PRO A 110 -1.829 -16.525 1.315 1.00 0.00 C ATOM 0 HA PRO A 110 -0.071 -17.680 3.506 1.00 0.00 H new ATOM 0 HB2 PRO A 110 1.364 -17.288 0.956 1.00 0.00 H new ATOM 0 HB3 PRO A 110 0.275 -18.614 1.313 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -0.288 -16.040 -0.112 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.012 -17.618 -0.354 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -2.439 -15.730 0.886 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -2.494 -17.365 1.513 1.00 0.00 H new ATOM 1645 N ASP A 111 1.620 -14.966 2.744 1.00 0.00 N ATOM 1646 CA ASP A 111 2.789 -14.145 3.172 1.00 0.00 C ATOM 1647 C ASP A 111 2.485 -13.449 4.517 1.00 0.00 C ATOM 1648 O ASP A 111 3.404 -13.115 5.279 1.00 0.00 O ATOM 1649 CB ASP A 111 3.123 -13.077 2.091 1.00 0.00 C ATOM 1650 CG ASP A 111 4.578 -12.586 2.115 1.00 0.00 C ATOM 1651 OD1 ASP A 111 4.891 -11.619 2.848 1.00 0.00 O ATOM 1652 OD2 ASP A 111 5.409 -13.158 1.376 1.00 0.00 O ATOM 0 H ASP A 111 1.043 -14.525 2.028 1.00 0.00 H new ATOM 0 HA ASP A 111 3.649 -14.803 3.297 1.00 0.00 H new ATOM 0 HB2 ASP A 111 2.909 -13.494 1.107 1.00 0.00 H new ATOM 0 HB3 ASP A 111 2.461 -12.222 2.226 1.00 0.00 H new ATOM 1657 N SER A 112 1.172 -13.240 4.752 1.00 0.00 N ATOM 1658 CA SER A 112 0.606 -12.582 5.934 1.00 0.00 C ATOM 1659 C SER A 112 0.862 -11.075 5.867 1.00 0.00 C ATOM 1660 O SER A 112 1.892 -10.569 6.329 1.00 0.00 O ATOM 1661 CB SER A 112 1.086 -13.208 7.273 1.00 0.00 C ATOM 1662 OG SER A 112 0.416 -12.647 8.393 1.00 0.00 O ATOM 0 H SER A 112 0.454 -13.540 4.093 1.00 0.00 H new ATOM 0 HA SER A 112 -0.471 -12.749 5.919 1.00 0.00 H new ATOM 0 HB2 SER A 112 0.917 -14.285 7.251 1.00 0.00 H new ATOM 0 HB3 SER A 112 2.160 -13.056 7.380 1.00 0.00 H new ATOM 0 HG SER A 112 0.744 -13.067 9.215 1.00 0.00 H new ATOM 1668 N HIS A 113 -0.048 -10.386 5.182 1.00 0.00 N ATOM 1669 CA HIS A 113 -0.134 -8.921 5.175 1.00 0.00 C ATOM 1670 C HIS A 113 -1.453 -8.542 5.861 1.00 0.00 C ATOM 1671 O HIS A 113 -2.143 -9.409 6.427 1.00 0.00 O ATOM 1672 CB HIS A 113 -0.090 -8.376 3.720 1.00 0.00 C ATOM 1673 CG HIS A 113 0.958 -9.012 2.836 1.00 0.00 C ATOM 1674 ND1 HIS A 113 0.648 -9.618 1.647 1.00 0.00 N ATOM 1675 CD2 HIS A 113 2.303 -9.115 2.955 1.00 0.00 C ATOM 1676 CE1 HIS A 113 1.738 -10.039 1.065 1.00 0.00 C ATOM 1677 NE2 HIS A 113 2.761 -9.747 1.835 1.00 0.00 N ATOM 0 H HIS A 113 -0.760 -10.834 4.605 1.00 0.00 H new ATOM 0 HA HIS A 113 0.712 -8.483 5.705 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -1.068 -8.522 3.262 1.00 0.00 H new ATOM 0 HB3 HIS A 113 0.088 -7.301 3.755 1.00 0.00 H new ATOM 0 HD1 HIS A 113 -0.295 -9.724 1.272 1.00 0.00 H new ATOM 0 HD2 HIS A 113 2.902 -8.763 3.782 1.00 0.00 H new ATOM 0 HE1 HIS A 113 1.790 -10.543 0.111 1.00 0.00 H new ATOM 1686 N ARG A 114 -1.795 -7.251 5.855 1.00 0.00 N ATOM 1687 CA ARG A 114 -3.094 -6.775 6.357 1.00 0.00 C ATOM 1688 C ARG A 114 -4.014 -6.523 5.142 1.00 0.00 C ATOM 1689 O ARG A 114 -3.720 -5.659 4.316 1.00 0.00 O ATOM 1690 CB ARG A 114 -2.892 -5.491 7.209 1.00 0.00 C ATOM 1691 CG ARG A 114 -1.794 -5.553 8.308 1.00 0.00 C ATOM 1692 CD ARG A 114 -2.107 -6.524 9.468 1.00 0.00 C ATOM 1693 NE ARG A 114 -2.065 -7.941 9.073 1.00 0.00 N ATOM 1694 CZ ARG A 114 -2.410 -8.978 9.837 1.00 0.00 C ATOM 1695 NH1 ARG A 114 -2.773 -8.811 11.105 1.00 0.00 N ATOM 1696 NH2 ARG A 114 -2.387 -10.181 9.304 1.00 0.00 N ATOM 0 H ARG A 114 -1.188 -6.509 5.506 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.560 -7.518 7.004 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -2.654 -4.668 6.535 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -3.840 -5.247 7.688 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -0.852 -5.849 7.847 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -1.649 -4.553 8.716 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -1.392 -6.358 10.274 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -3.095 -6.295 9.867 1.00 0.00 H new ATOM 0 HE ARG A 114 -1.742 -8.149 8.128 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -2.791 -7.876 11.511 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -3.033 -9.618 11.672 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -2.110 -10.302 8.330 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -2.646 -10.992 9.865 1.00 0.00 H new ATOM 1710 N LEU A 115 -5.078 -7.325 4.993 1.00 0.00 N ATOM 1711 CA LEU A 115 -6.019 -7.208 3.854 1.00 0.00 C ATOM 1712 C LEU A 115 -7.407 -6.792 4.355 1.00 0.00 C ATOM 1713 O LEU A 115 -8.143 -7.613 4.897 1.00 0.00 O ATOM 1714 CB LEU A 115 -6.082 -8.554 3.083 1.00 0.00 C ATOM 1715 CG LEU A 115 -4.775 -8.984 2.349 1.00 0.00 C ATOM 1716 CD1 LEU A 115 -4.953 -10.343 1.632 1.00 0.00 C ATOM 1717 CD2 LEU A 115 -4.310 -7.875 1.375 1.00 0.00 C ATOM 0 H LEU A 115 -5.315 -8.069 5.649 1.00 0.00 H new ATOM 0 HA LEU A 115 -5.664 -6.437 3.170 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.355 -9.340 3.787 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.884 -8.491 2.348 1.00 0.00 H new ATOM 0 HG LEU A 115 -3.992 -9.120 3.095 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -4.024 -10.614 1.130 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.207 -11.110 2.364 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -5.753 -10.264 0.896 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -3.397 -8.192 0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -5.088 -7.692 0.634 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -4.117 -6.958 1.933 1.00 0.00 H new ATOM 1729 N ARG A 116 -7.755 -5.512 4.160 1.00 0.00 N ATOM 1730 CA ARG A 116 -8.999 -4.927 4.687 1.00 0.00 C ATOM 1731 C ARG A 116 -10.141 -5.065 3.669 1.00 0.00 C ATOM 1732 O ARG A 116 -9.913 -4.941 2.485 1.00 0.00 O ATOM 1733 CB ARG A 116 -8.778 -3.431 5.040 1.00 0.00 C ATOM 1734 CG ARG A 116 -9.900 -2.818 5.914 1.00 0.00 C ATOM 1735 CD ARG A 116 -9.581 -1.389 6.373 1.00 0.00 C ATOM 1736 NE ARG A 116 -10.582 -0.887 7.338 1.00 0.00 N ATOM 1737 CZ ARG A 116 -10.382 0.107 8.222 1.00 0.00 C ATOM 1738 NH1 ARG A 116 -9.194 0.695 8.332 1.00 0.00 N ATOM 1739 NH2 ARG A 116 -11.370 0.472 9.030 1.00 0.00 N ATOM 0 H ARG A 116 -7.183 -4.852 3.633 1.00 0.00 H new ATOM 0 HA ARG A 116 -9.277 -5.469 5.591 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -7.827 -3.328 5.563 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -8.697 -2.858 4.116 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -10.833 -2.814 5.350 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -10.059 -3.449 6.789 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -8.592 -1.366 6.830 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -9.547 -0.728 5.507 1.00 0.00 H new ATOM 0 HE ARG A 116 -11.500 -1.331 7.333 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -8.419 0.393 7.741 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -9.058 1.447 9.007 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -12.273 -0.000 8.978 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -11.227 1.225 9.703 1.00 0.00 H new ATOM 1753 N VAL A 117 -11.350 -5.374 4.150 1.00 0.00 N ATOM 1754 CA VAL A 117 -12.613 -5.220 3.397 1.00 0.00 C ATOM 1755 C VAL A 117 -13.603 -4.559 4.349 1.00 0.00 C ATOM 1756 O VAL A 117 -13.879 -5.116 5.417 1.00 0.00 O ATOM 1757 CB VAL A 117 -13.220 -6.589 2.885 1.00 0.00 C ATOM 1758 CG1 VAL A 117 -14.481 -6.362 1.998 1.00 0.00 C ATOM 1759 CG2 VAL A 117 -12.165 -7.422 2.130 1.00 0.00 C ATOM 0 H VAL A 117 -11.488 -5.745 5.090 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.416 -4.629 2.503 1.00 0.00 H new ATOM 0 HB VAL A 117 -13.530 -7.152 3.765 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.870 -7.324 1.665 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.245 -5.843 2.577 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -14.212 -5.760 1.130 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.613 -8.356 1.791 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.805 -6.859 1.269 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.330 -7.641 2.795 1.00 0.00 H new ATOM 1769 N TYR A 118 -14.123 -3.372 4.002 1.00 0.00 N ATOM 1770 CA TYR A 118 -15.041 -2.643 4.896 1.00 0.00 C ATOM 1771 C TYR A 118 -16.328 -2.228 4.175 1.00 0.00 C ATOM 1772 O TYR A 118 -16.366 -2.207 2.942 1.00 0.00 O ATOM 1773 CB TYR A 118 -14.347 -1.446 5.604 1.00 0.00 C ATOM 1774 CG TYR A 118 -14.135 -0.198 4.741 1.00 0.00 C ATOM 1775 CD1 TYR A 118 -13.102 -0.135 3.807 1.00 0.00 C ATOM 1776 CD2 TYR A 118 -14.970 0.921 4.871 1.00 0.00 C ATOM 1777 CE1 TYR A 118 -12.911 0.992 3.042 1.00 0.00 C ATOM 1778 CE2 TYR A 118 -14.781 2.046 4.103 1.00 0.00 C ATOM 1779 CZ TYR A 118 -13.751 2.081 3.191 1.00 0.00 C ATOM 1780 OH TYR A 118 -13.558 3.213 2.428 1.00 0.00 O ATOM 0 H TYR A 118 -13.928 -2.899 3.120 1.00 0.00 H new ATOM 0 HA TYR A 118 -15.332 -3.337 5.685 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -14.942 -1.167 6.474 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -13.377 -1.779 5.974 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -12.443 -0.982 3.683 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -15.777 0.899 5.588 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -12.105 1.027 2.324 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -15.437 2.897 4.215 1.00 0.00 H new ATOM 0 HH TYR A 118 -12.598 3.386 2.337 1.00 0.00 H new ATOM 1790 N ALA A 119 -17.348 -1.847 4.941 1.00 0.00 N ATOM 1791 CA ALA A 119 -18.578 -1.251 4.412 1.00 0.00 C ATOM 1792 C ALA A 119 -18.943 -0.062 5.288 1.00 0.00 C ATOM 1793 O ALA A 119 -19.345 -0.253 6.434 1.00 0.00 O ATOM 1794 CB ALA A 119 -19.704 -2.285 4.412 1.00 0.00 C ATOM 0 H ALA A 119 -17.346 -1.943 5.956 1.00 0.00 H new ATOM 0 HA ALA A 119 -18.427 -0.920 3.384 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -20.614 -1.832 4.017 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -19.420 -3.132 3.788 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -19.882 -2.629 5.431 1.00 0.00 H new ATOM 1800 N PHE A 120 -18.833 1.155 4.743 1.00 0.00 N ATOM 1801 CA PHE A 120 -19.030 2.388 5.514 1.00 0.00 C ATOM 1802 C PHE A 120 -20.535 2.648 5.649 1.00 0.00 C ATOM 1803 O PHE A 120 -21.224 2.857 4.641 1.00 0.00 O ATOM 1804 CB PHE A 120 -18.317 3.588 4.825 1.00 0.00 C ATOM 1805 CG PHE A 120 -18.319 4.893 5.637 1.00 0.00 C ATOM 1806 CD1 PHE A 120 -17.288 5.177 6.536 1.00 0.00 C ATOM 1807 CD2 PHE A 120 -19.345 5.835 5.501 1.00 0.00 C ATOM 1808 CE1 PHE A 120 -17.284 6.351 7.266 1.00 0.00 C ATOM 1809 CE2 PHE A 120 -19.340 7.007 6.229 1.00 0.00 C ATOM 1810 CZ PHE A 120 -18.310 7.264 7.112 1.00 0.00 C ATOM 0 H PHE A 120 -18.606 1.313 3.761 1.00 0.00 H new ATOM 0 HA PHE A 120 -18.591 2.275 6.505 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -17.284 3.308 4.617 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -18.797 3.774 3.864 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -16.482 4.469 6.663 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -20.155 5.641 4.814 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -16.479 6.555 7.957 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -20.140 7.722 6.108 1.00 0.00 H new ATOM 0 HZ PHE A 120 -18.306 8.180 7.683 1.00 0.00 H new ATOM 1820 N ALA A 121 -21.040 2.575 6.897 1.00 0.00 N ATOM 1821 CA ALA A 121 -22.440 2.876 7.214 1.00 0.00 C ATOM 1822 C ALA A 121 -22.679 4.383 7.054 1.00 0.00 C ATOM 1823 O ALA A 121 -22.443 5.163 7.976 1.00 0.00 O ATOM 1824 CB ALA A 121 -22.774 2.389 8.639 1.00 0.00 C ATOM 0 H ALA A 121 -20.485 2.305 7.709 1.00 0.00 H new ATOM 0 HA ALA A 121 -23.103 2.351 6.527 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -23.815 2.616 8.866 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -22.616 1.312 8.702 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -22.127 2.894 9.357 1.00 0.00 H new ATOM 1830 N GLY A 122 -23.107 4.768 5.844 1.00 0.00 N ATOM 1831 CA GLY A 122 -23.306 6.163 5.464 1.00 0.00 C ATOM 1832 C GLY A 122 -23.160 6.360 3.950 1.00 0.00 C ATOM 1833 O GLY A 122 -22.706 7.435 3.517 1.00 0.00 O ATOM 1834 OXT GLY A 122 -23.495 5.427 3.186 1.00 0.00 O ATOM 0 H GLY A 122 -23.326 4.108 5.097 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -24.297 6.490 5.780 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -22.582 6.790 5.985 1.00 0.00 H new TER 1838 GLY A 122 ATOM 1839 N MET B 1 -18.283 -6.837 -7.906 1.00 0.00 N ATOM 1840 CA MET B 1 -17.583 -7.540 -6.797 1.00 0.00 C ATOM 1841 C MET B 1 -16.666 -6.537 -6.056 1.00 0.00 C ATOM 1842 O MET B 1 -16.569 -5.365 -6.444 1.00 0.00 O ATOM 1843 CB MET B 1 -16.775 -8.782 -7.345 1.00 0.00 C ATOM 1844 CG MET B 1 -16.998 -10.113 -6.586 1.00 0.00 C ATOM 1845 SD MET B 1 -16.445 -10.085 -4.866 1.00 0.00 S ATOM 1846 CE MET B 1 -14.646 -10.122 -4.990 1.00 0.00 C ATOM 0 H1 MET B 1 -19.268 -7.168 -7.960 1.00 0.00 H new ATOM 0 H2 MET B 1 -18.271 -5.812 -7.730 1.00 0.00 H new ATOM 0 H3 MET B 1 -17.800 -7.039 -8.805 1.00 0.00 H new ATOM 0 HA MET B 1 -18.315 -7.926 -6.088 1.00 0.00 H new ATOM 0 HB2 MET B 1 -17.040 -8.932 -8.391 1.00 0.00 H new ATOM 0 HB3 MET B 1 -15.712 -8.542 -7.317 1.00 0.00 H new ATOM 0 HG2 MET B 1 -18.060 -10.359 -6.611 1.00 0.00 H new ATOM 0 HG3 MET B 1 -16.473 -10.911 -7.112 1.00 0.00 H new ATOM 0 HE1 MET B 1 -14.214 -10.215 -3.993 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.341 -10.973 -5.599 1.00 0.00 H new ATOM 0 HE3 MET B 1 -14.294 -9.200 -5.453 1.00 0.00 H new ATOM 1856 N THR B 2 -16.008 -7.025 -4.996 1.00 0.00 N ATOM 1857 CA THR B 2 -15.129 -6.239 -4.109 1.00 0.00 C ATOM 1858 C THR B 2 -13.848 -5.761 -4.835 1.00 0.00 C ATOM 1859 O THR B 2 -13.221 -6.547 -5.554 1.00 0.00 O ATOM 1860 CB THR B 2 -14.753 -7.140 -2.888 1.00 0.00 C ATOM 1861 OG1 THR B 2 -15.953 -7.588 -2.255 1.00 0.00 O ATOM 1862 CG2 THR B 2 -13.857 -6.449 -1.859 1.00 0.00 C ATOM 0 H THR B 2 -16.072 -8.005 -4.721 1.00 0.00 H new ATOM 0 HA THR B 2 -15.658 -5.343 -3.785 1.00 0.00 H new ATOM 0 HB THR B 2 -14.174 -7.976 -3.280 1.00 0.00 H new ATOM 0 HG1 THR B 2 -15.744 -8.321 -1.639 1.00 0.00 H new ATOM 0 HG21 THR B 2 -13.641 -7.139 -1.043 1.00 0.00 H new ATOM 0 HG22 THR B 2 -12.924 -6.145 -2.334 1.00 0.00 H new ATOM 0 HG23 THR B 2 -14.366 -5.570 -1.465 1.00 0.00 H new ATOM 1870 N HIS B 3 -13.460 -4.476 -4.633 1.00 0.00 N ATOM 1871 CA HIS B 3 -12.325 -3.852 -5.364 1.00 0.00 C ATOM 1872 C HIS B 3 -11.433 -3.015 -4.401 1.00 0.00 C ATOM 1873 O HIS B 3 -11.963 -2.263 -3.567 1.00 0.00 O ATOM 1874 CB HIS B 3 -12.862 -2.962 -6.531 1.00 0.00 C ATOM 1875 CG HIS B 3 -13.392 -1.603 -6.122 1.00 0.00 C ATOM 1876 ND1 HIS B 3 -14.509 -1.427 -5.339 1.00 0.00 N ATOM 1877 CD2 HIS B 3 -12.911 -0.361 -6.354 1.00 0.00 C ATOM 1878 CE1 HIS B 3 -14.686 -0.141 -5.108 1.00 0.00 C ATOM 1879 NE2 HIS B 3 -13.735 0.526 -5.711 1.00 0.00 N ATOM 0 H HIS B 3 -13.917 -3.850 -3.969 1.00 0.00 H new ATOM 0 HA HIS B 3 -11.708 -4.647 -5.784 1.00 0.00 H new ATOM 0 HB2 HIS B 3 -12.059 -2.817 -7.254 1.00 0.00 H new ATOM 0 HB3 HIS B 3 -13.657 -3.504 -7.042 1.00 0.00 H new ATOM 0 HD2 HIS B 3 -12.038 -0.113 -6.939 1.00 0.00 H new ATOM 0 HE1 HIS B 3 -15.483 0.290 -4.520 1.00 0.00 H new ATOM 0 HE2 HIS B 3 -13.625 1.540 -5.704 1.00 0.00 H new ATOM 1888 N PRO B 4 -10.066 -3.136 -4.487 1.00 0.00 N ATOM 1889 CA PRO B 4 -9.132 -2.284 -3.732 1.00 0.00 C ATOM 1890 C PRO B 4 -8.644 -1.050 -4.537 1.00 0.00 C ATOM 1891 O PRO B 4 -7.680 -1.118 -5.305 1.00 0.00 O ATOM 1892 CB PRO B 4 -7.993 -3.276 -3.417 1.00 0.00 C ATOM 1893 CG PRO B 4 -7.932 -4.186 -4.622 1.00 0.00 C ATOM 1894 CD PRO B 4 -9.316 -4.155 -5.276 1.00 0.00 C ATOM 0 HA PRO B 4 -9.579 -1.828 -2.848 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -7.047 -2.757 -3.265 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -8.198 -3.838 -2.506 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -7.167 -3.849 -5.322 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -7.668 -5.201 -4.326 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -9.254 -3.878 -6.328 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -9.801 -5.130 -5.231 1.00 0.00 H new ATOM 1902 N ASP B 5 -9.343 0.080 -4.374 1.00 0.00 N ATOM 1903 CA ASP B 5 -8.913 1.394 -4.925 1.00 0.00 C ATOM 1904 C ASP B 5 -8.356 2.272 -3.791 1.00 0.00 C ATOM 1905 O ASP B 5 -8.055 3.461 -3.973 1.00 0.00 O ATOM 1906 CB ASP B 5 -10.105 2.093 -5.627 1.00 0.00 C ATOM 1907 CG ASP B 5 -11.217 2.528 -4.655 1.00 0.00 C ATOM 1908 OD1 ASP B 5 -11.760 1.662 -3.929 1.00 0.00 O ATOM 1909 OD2 ASP B 5 -11.550 3.730 -4.598 1.00 0.00 O ATOM 0 H ASP B 5 -10.223 0.121 -3.859 1.00 0.00 H new ATOM 0 HA ASP B 5 -8.127 1.237 -5.664 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -9.739 2.968 -6.164 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -10.527 1.417 -6.371 1.00 0.00 H new ATOM 1914 N PHE B 6 -8.182 1.634 -2.632 1.00 0.00 N ATOM 1915 CA PHE B 6 -7.896 2.280 -1.361 1.00 0.00 C ATOM 1916 C PHE B 6 -6.729 1.524 -0.693 1.00 0.00 C ATOM 1917 O PHE B 6 -6.670 0.289 -0.709 1.00 0.00 O ATOM 1918 CB PHE B 6 -9.203 2.261 -0.496 1.00 0.00 C ATOM 1919 CG PHE B 6 -9.201 3.003 0.851 1.00 0.00 C ATOM 1920 CD1 PHE B 6 -8.141 3.791 1.281 1.00 0.00 C ATOM 1921 CD2 PHE B 6 -10.306 2.905 1.695 1.00 0.00 C ATOM 1922 CE1 PHE B 6 -8.186 4.444 2.488 1.00 0.00 C ATOM 1923 CE2 PHE B 6 -10.344 3.561 2.905 1.00 0.00 C ATOM 1924 CZ PHE B 6 -9.287 4.327 3.300 1.00 0.00 C ATOM 0 H PHE B 6 -8.239 0.618 -2.556 1.00 0.00 H new ATOM 0 HA PHE B 6 -7.595 3.320 -1.483 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -10.008 2.676 -1.102 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -9.456 1.219 -0.300 1.00 0.00 H new ATOM 0 HD1 PHE B 6 -7.267 3.892 0.655 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -11.150 2.302 1.394 1.00 0.00 H new ATOM 0 HE1 PHE B 6 -7.351 5.053 2.800 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -11.211 3.469 3.542 1.00 0.00 H new ATOM 0 HZ PHE B 6 -9.316 4.841 4.250 1.00 0.00 H new ATOM 1934 N THR B 7 -5.785 2.293 -0.157 1.00 0.00 N ATOM 1935 CA THR B 7 -4.673 1.785 0.649 1.00 0.00 C ATOM 1936 C THR B 7 -4.585 2.625 1.921 1.00 0.00 C ATOM 1937 O THR B 7 -4.852 3.829 1.902 1.00 0.00 O ATOM 1938 CB THR B 7 -3.315 1.826 -0.125 1.00 0.00 C ATOM 1939 OG1 THR B 7 -2.272 1.213 0.659 1.00 0.00 O ATOM 1940 CG2 THR B 7 -2.888 3.262 -0.503 1.00 0.00 C ATOM 0 H THR B 7 -5.769 3.306 -0.272 1.00 0.00 H new ATOM 0 HA THR B 7 -4.862 0.739 0.890 1.00 0.00 H new ATOM 0 HB THR B 7 -3.468 1.270 -1.050 1.00 0.00 H new ATOM 0 HG1 THR B 7 -2.667 0.569 1.283 1.00 0.00 H new ATOM 0 HG21 THR B 7 -1.939 3.230 -1.038 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.649 3.712 -1.140 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.774 3.858 0.403 1.00 0.00 H new ATOM 1948 N ILE B 8 -4.252 1.974 3.034 1.00 0.00 N ATOM 1949 CA ILE B 8 -4.096 2.630 4.331 1.00 0.00 C ATOM 1950 C ILE B 8 -2.667 2.390 4.841 1.00 0.00 C ATOM 1951 O ILE B 8 -2.139 1.270 4.744 1.00 0.00 O ATOM 1952 CB ILE B 8 -5.173 2.101 5.359 1.00 0.00 C ATOM 1953 CG1 ILE B 8 -6.615 2.337 4.818 1.00 0.00 C ATOM 1954 CG2 ILE B 8 -4.997 2.720 6.764 1.00 0.00 C ATOM 1955 CD1 ILE B 8 -7.738 1.929 5.746 1.00 0.00 C ATOM 0 H ILE B 8 -4.082 0.969 3.061 1.00 0.00 H new ATOM 0 HA ILE B 8 -4.258 3.702 4.222 1.00 0.00 H new ATOM 0 HB ILE B 8 -5.016 1.028 5.466 1.00 0.00 H new ATOM 0 HG12 ILE B 8 -6.727 3.396 4.585 1.00 0.00 H new ATOM 0 HG13 ILE B 8 -6.726 1.791 3.881 1.00 0.00 H new ATOM 0 HG21 ILE B 8 -5.761 2.325 7.434 1.00 0.00 H new ATOM 0 HG22 ILE B 8 -4.010 2.469 7.151 1.00 0.00 H new ATOM 0 HG23 ILE B 8 -5.096 3.804 6.699 1.00 0.00 H new ATOM 0 HD11 ILE B 8 -8.697 2.137 5.270 1.00 0.00 H new ATOM 0 HD12 ILE B 8 -7.663 0.863 5.961 1.00 0.00 H new ATOM 0 HD13 ILE B 8 -7.665 2.493 6.676 1.00 0.00 H new ATOM 1967 N LEU B 9 -2.038 3.460 5.336 1.00 0.00 N ATOM 1968 CA LEU B 9 -0.733 3.401 5.993 1.00 0.00 C ATOM 1969 C LEU B 9 -0.969 2.969 7.436 1.00 0.00 C ATOM 1970 O LEU B 9 -1.812 3.528 8.145 1.00 0.00 O ATOM 1971 CB LEU B 9 -0.042 4.780 5.923 1.00 0.00 C ATOM 1972 CG LEU B 9 0.265 5.288 4.480 1.00 0.00 C ATOM 1973 CD1 LEU B 9 0.796 6.722 4.506 1.00 0.00 C ATOM 1974 CD2 LEU B 9 1.241 4.337 3.740 1.00 0.00 C ATOM 0 H LEU B 9 -2.427 4.402 5.290 1.00 0.00 H new ATOM 0 HA LEU B 9 -0.075 2.688 5.497 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -0.675 5.513 6.424 1.00 0.00 H new ATOM 0 HB3 LEU B 9 0.893 4.731 6.482 1.00 0.00 H new ATOM 0 HG LEU B 9 -0.671 5.289 3.922 1.00 0.00 H new ATOM 0 HD11 LEU B 9 1.002 7.052 3.488 1.00 0.00 H new ATOM 0 HD12 LEU B 9 0.051 7.378 4.956 1.00 0.00 H new ATOM 0 HD13 LEU B 9 1.714 6.759 5.092 1.00 0.00 H new ATOM 0 HD21 LEU B 9 1.433 4.721 2.738 1.00 0.00 H new ATOM 0 HD22 LEU B 9 2.179 4.277 4.292 1.00 0.00 H new ATOM 0 HD23 LEU B 9 0.798 3.344 3.669 1.00 0.00 H new ATOM 1986 N TYR B 10 -0.178 1.984 7.853 1.00 0.00 N ATOM 1987 CA TYR B 10 -0.187 1.440 9.207 1.00 0.00 C ATOM 1988 C TYR B 10 0.736 2.321 10.074 1.00 0.00 C ATOM 1989 O TYR B 10 1.968 2.259 9.940 1.00 0.00 O ATOM 1990 CB TYR B 10 0.294 -0.029 9.146 1.00 0.00 C ATOM 1991 CG TYR B 10 -0.062 -0.879 10.359 1.00 0.00 C ATOM 1992 CD1 TYR B 10 0.781 -0.950 11.468 1.00 0.00 C ATOM 1993 CD2 TYR B 10 -1.243 -1.625 10.382 1.00 0.00 C ATOM 1994 CE1 TYR B 10 0.461 -1.734 12.545 1.00 0.00 C ATOM 1995 CE2 TYR B 10 -1.562 -2.406 11.463 1.00 0.00 C ATOM 1996 CZ TYR B 10 -0.708 -2.457 12.542 1.00 0.00 C ATOM 1997 OH TYR B 10 -1.023 -3.235 13.618 1.00 0.00 O ATOM 0 H TYR B 10 0.503 1.531 7.244 1.00 0.00 H new ATOM 0 HA TYR B 10 -1.184 1.446 9.648 1.00 0.00 H new ATOM 0 HB2 TYR B 10 -0.130 -0.497 8.257 1.00 0.00 H new ATOM 0 HB3 TYR B 10 1.377 -0.035 9.023 1.00 0.00 H new ATOM 0 HD1 TYR B 10 1.698 -0.379 11.478 1.00 0.00 H new ATOM 0 HD2 TYR B 10 -1.914 -1.586 9.537 1.00 0.00 H new ATOM 0 HE1 TYR B 10 1.126 -1.784 13.395 1.00 0.00 H new ATOM 0 HE2 TYR B 10 -2.478 -2.978 11.468 1.00 0.00 H new ATOM 0 HH TYR B 10 -0.281 -3.225 14.258 1.00 0.00 H new ATOM 2007 N VAL B 11 0.129 3.162 10.924 1.00 0.00 N ATOM 2008 CA VAL B 11 0.846 4.124 11.787 1.00 0.00 C ATOM 2009 C VAL B 11 0.598 3.747 13.255 1.00 0.00 C ATOM 2010 O VAL B 11 -0.103 2.776 13.542 1.00 0.00 O ATOM 2011 CB VAL B 11 0.398 5.632 11.494 1.00 0.00 C ATOM 2012 CG1 VAL B 11 0.263 5.891 9.973 1.00 0.00 C ATOM 2013 CG2 VAL B 11 -0.906 6.059 12.230 1.00 0.00 C ATOM 0 H VAL B 11 -0.884 3.197 11.036 1.00 0.00 H new ATOM 0 HA VAL B 11 1.913 4.071 11.570 1.00 0.00 H new ATOM 0 HB VAL B 11 1.197 6.253 11.899 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -0.043 6.924 9.805 1.00 0.00 H new ATOM 0 HG12 VAL B 11 1.222 5.713 9.487 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -0.486 5.219 9.554 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -1.143 7.093 11.980 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.727 5.413 11.919 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -0.762 5.970 13.307 1.00 0.00 H new ATOM 2023 N ASP B 12 1.237 4.485 14.169 1.00 0.00 N ATOM 2024 CA ASP B 12 1.000 4.378 15.614 1.00 0.00 C ATOM 2025 C ASP B 12 0.404 5.688 16.140 1.00 0.00 C ATOM 2026 O ASP B 12 -0.684 5.693 16.734 1.00 0.00 O ATOM 2027 CB ASP B 12 2.324 4.059 16.364 1.00 0.00 C ATOM 2028 CG ASP B 12 2.171 4.127 17.899 1.00 0.00 C ATOM 2029 OD1 ASP B 12 1.283 3.432 18.450 1.00 0.00 O ATOM 2030 OD2 ASP B 12 2.936 4.865 18.562 1.00 0.00 O ATOM 0 H ASP B 12 1.941 5.181 13.924 1.00 0.00 H new ATOM 0 HA ASP B 12 0.297 3.564 15.793 1.00 0.00 H new ATOM 0 HB2 ASP B 12 2.666 3.064 16.081 1.00 0.00 H new ATOM 0 HB3 ASP B 12 3.094 4.763 16.048 1.00 0.00 H new ATOM 2035 N ASN B 13 1.141 6.787 15.913 1.00 0.00 N ATOM 2036 CA ASN B 13 0.830 8.124 16.446 1.00 0.00 C ATOM 2037 C ASN B 13 -0.079 8.879 15.446 1.00 0.00 C ATOM 2038 O ASN B 13 0.413 9.301 14.396 1.00 0.00 O ATOM 2039 CB ASN B 13 2.172 8.878 16.685 1.00 0.00 C ATOM 2040 CG ASN B 13 2.043 10.239 17.393 1.00 0.00 C ATOM 2041 OD1 ASN B 13 1.078 10.981 17.215 1.00 0.00 O ATOM 2042 ND2 ASN B 13 3.028 10.577 18.210 1.00 0.00 N ATOM 0 H ASN B 13 1.986 6.771 15.343 1.00 0.00 H new ATOM 0 HA ASN B 13 0.293 8.053 17.392 1.00 0.00 H new ATOM 0 HB2 ASN B 13 2.828 8.240 17.277 1.00 0.00 H new ATOM 0 HB3 ASN B 13 2.660 9.032 15.723 1.00 0.00 H new ATOM 0 HD21 ASN B 13 2.996 11.468 18.706 1.00 0.00 H new ATOM 0 HD22 ASN B 13 3.819 9.947 18.343 1.00 0.00 H new ATOM 2049 N PRO B 14 -1.421 9.039 15.745 1.00 0.00 N ATOM 2050 CA PRO B 14 -2.378 9.703 14.829 1.00 0.00 C ATOM 2051 C PRO B 14 -1.968 11.160 14.436 1.00 0.00 C ATOM 2052 O PRO B 14 -1.834 11.407 13.238 1.00 0.00 O ATOM 2053 CB PRO B 14 -3.756 9.612 15.563 1.00 0.00 C ATOM 2054 CG PRO B 14 -3.567 8.529 16.581 1.00 0.00 C ATOM 2055 CD PRO B 14 -2.109 8.569 16.978 1.00 0.00 C ATOM 0 HA PRO B 14 -2.409 9.209 13.858 1.00 0.00 H new ATOM 0 HB2 PRO B 14 -4.018 10.559 16.035 1.00 0.00 H new ATOM 0 HB3 PRO B 14 -4.560 9.368 14.869 1.00 0.00 H new ATOM 0 HG2 PRO B 14 -4.210 8.692 17.446 1.00 0.00 H new ATOM 0 HG3 PRO B 14 -3.831 7.556 16.167 1.00 0.00 H new ATOM 0 HD2 PRO B 14 -1.940 9.247 17.814 1.00 0.00 H new ATOM 0 HD3 PRO B 14 -1.751 7.587 17.287 1.00 0.00 H new ATOM 2063 N PRO B 15 -1.724 12.153 15.395 1.00 0.00 N ATOM 2064 CA PRO B 15 -1.254 13.513 15.010 1.00 0.00 C ATOM 2065 C PRO B 15 0.042 13.481 14.170 1.00 0.00 C ATOM 2066 O PRO B 15 -0.001 13.785 12.988 1.00 0.00 O ATOM 2067 CB PRO B 15 -1.041 14.244 16.365 1.00 0.00 C ATOM 2068 CG PRO B 15 -1.961 13.533 17.304 1.00 0.00 C ATOM 2069 CD PRO B 15 -1.912 12.081 16.879 1.00 0.00 C ATOM 0 HA PRO B 15 -1.976 14.019 14.369 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -0.004 14.179 16.695 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -1.286 15.303 16.291 1.00 0.00 H new ATOM 0 HG2 PRO B 15 -1.638 13.652 18.338 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -2.974 13.929 17.239 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -1.092 11.550 17.361 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -2.830 11.555 17.142 1.00 0.00 H new ATOM 2077 N ALA B 16 1.158 13.036 14.777 1.00 0.00 N ATOM 2078 CA ALA B 16 2.521 13.233 14.214 1.00 0.00 C ATOM 2079 C ALA B 16 2.692 12.617 12.809 1.00 0.00 C ATOM 2080 O ALA B 16 3.288 13.255 11.915 1.00 0.00 O ATOM 2081 CB ALA B 16 3.592 12.696 15.177 1.00 0.00 C ATOM 0 H ALA B 16 1.149 12.533 15.664 1.00 0.00 H new ATOM 0 HA ALA B 16 2.654 14.309 14.098 1.00 0.00 H new ATOM 0 HB1 ALA B 16 4.581 12.851 14.745 1.00 0.00 H new ATOM 0 HB2 ALA B 16 3.525 13.225 16.128 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.431 11.631 15.343 1.00 0.00 H new ATOM 2087 N SER B 17 2.107 11.412 12.593 1.00 0.00 N ATOM 2088 CA SER B 17 2.125 10.760 11.271 1.00 0.00 C ATOM 2089 C SER B 17 1.368 11.650 10.270 1.00 0.00 C ATOM 2090 O SER B 17 1.926 12.086 9.259 1.00 0.00 O ATOM 2091 CB SER B 17 1.486 9.356 11.338 1.00 0.00 C ATOM 2092 OG SER B 17 2.184 8.516 12.236 1.00 0.00 O ATOM 0 H SER B 17 1.622 10.880 13.315 1.00 0.00 H new ATOM 0 HA SER B 17 3.158 10.635 10.945 1.00 0.00 H new ATOM 0 HB2 SER B 17 0.446 9.442 11.651 1.00 0.00 H new ATOM 0 HB3 SER B 17 1.483 8.908 10.345 1.00 0.00 H new ATOM 0 HG SER B 17 1.778 8.579 13.126 1.00 0.00 H new ATOM 2098 N THR B 18 0.110 11.952 10.618 1.00 0.00 N ATOM 2099 CA THR B 18 -0.854 12.575 9.717 1.00 0.00 C ATOM 2100 C THR B 18 -0.525 14.019 9.307 1.00 0.00 C ATOM 2101 O THR B 18 -0.640 14.371 8.146 1.00 0.00 O ATOM 2102 CB THR B 18 -2.285 12.530 10.349 1.00 0.00 C ATOM 2103 OG1 THR B 18 -2.674 11.162 10.555 1.00 0.00 O ATOM 2104 CG2 THR B 18 -3.356 13.239 9.498 1.00 0.00 C ATOM 0 H THR B 18 -0.267 11.766 11.547 1.00 0.00 H new ATOM 0 HA THR B 18 -0.806 11.987 8.800 1.00 0.00 H new ATOM 0 HB THR B 18 -2.225 13.069 11.295 1.00 0.00 H new ATOM 0 HG1 THR B 18 -2.493 10.907 11.484 1.00 0.00 H new ATOM 0 HG21 THR B 18 -4.323 13.168 9.997 1.00 0.00 H new ATOM 0 HG22 THR B 18 -3.087 14.288 9.375 1.00 0.00 H new ATOM 0 HG23 THR B 18 -3.417 12.763 8.519 1.00 0.00 H new ATOM 2112 N GLN B 19 -0.015 14.795 10.291 1.00 0.00 N ATOM 2113 CA GLN B 19 0.451 16.190 10.111 1.00 0.00 C ATOM 2114 C GLN B 19 1.622 16.208 9.126 1.00 0.00 C ATOM 2115 O GLN B 19 1.708 17.092 8.261 1.00 0.00 O ATOM 2116 CB GLN B 19 0.887 16.800 11.474 1.00 0.00 C ATOM 2117 CG GLN B 19 -0.199 16.854 12.575 1.00 0.00 C ATOM 2118 CD GLN B 19 -1.233 17.971 12.433 1.00 0.00 C ATOM 2119 OE1 GLN B 19 -1.564 18.404 11.337 1.00 0.00 O ATOM 2120 NE2 GLN B 19 -1.761 18.439 13.556 1.00 0.00 N ATOM 0 H GLN B 19 0.086 14.463 11.250 1.00 0.00 H new ATOM 0 HA GLN B 19 -0.367 16.792 9.715 1.00 0.00 H new ATOM 0 HB2 GLN B 19 1.731 16.224 11.853 1.00 0.00 H new ATOM 0 HB3 GLN B 19 1.246 17.814 11.297 1.00 0.00 H new ATOM 0 HG2 GLN B 19 -0.723 15.899 12.589 1.00 0.00 H new ATOM 0 HG3 GLN B 19 0.294 16.961 13.541 1.00 0.00 H new ATOM 0 HE21 GLN B 19 -1.466 18.059 14.455 1.00 0.00 H new ATOM 0 HE22 GLN B 19 -2.462 19.179 13.520 1.00 0.00 H new ATOM 2129 N PHE B 20 2.527 15.214 9.270 1.00 0.00 N ATOM 2130 CA PHE B 20 3.704 15.110 8.408 1.00 0.00 C ATOM 2131 C PHE B 20 3.273 14.832 6.958 1.00 0.00 C ATOM 2132 O PHE B 20 3.812 15.451 6.046 1.00 0.00 O ATOM 2133 CB PHE B 20 4.679 14.005 8.903 1.00 0.00 C ATOM 2134 CG PHE B 20 5.939 13.865 8.036 1.00 0.00 C ATOM 2135 CD1 PHE B 20 6.982 14.784 8.146 1.00 0.00 C ATOM 2136 CD2 PHE B 20 6.062 12.843 7.090 1.00 0.00 C ATOM 2137 CE1 PHE B 20 8.105 14.683 7.350 1.00 0.00 C ATOM 2138 CE2 PHE B 20 7.186 12.748 6.292 1.00 0.00 C ATOM 2139 CZ PHE B 20 8.205 13.670 6.422 1.00 0.00 C ATOM 0 H PHE B 20 2.457 14.480 9.975 1.00 0.00 H new ATOM 0 HA PHE B 20 4.235 16.061 8.449 1.00 0.00 H new ATOM 0 HB2 PHE B 20 4.976 14.227 9.928 1.00 0.00 H new ATOM 0 HB3 PHE B 20 4.153 13.050 8.923 1.00 0.00 H new ATOM 0 HD1 PHE B 20 6.910 15.587 8.865 1.00 0.00 H new ATOM 0 HD2 PHE B 20 5.268 12.119 6.982 1.00 0.00 H new ATOM 0 HE1 PHE B 20 8.906 15.399 7.455 1.00 0.00 H new ATOM 0 HE2 PHE B 20 7.267 11.952 5.566 1.00 0.00 H new ATOM 0 HZ PHE B 20 9.082 13.597 5.795 1.00 0.00 H new ATOM 2149 N TYR B 21 2.253 13.966 6.753 1.00 0.00 N ATOM 2150 CA TYR B 21 1.708 13.686 5.400 1.00 0.00 C ATOM 2151 C TYR B 21 0.923 14.897 4.875 1.00 0.00 C ATOM 2152 O TYR B 21 0.882 15.103 3.659 1.00 0.00 O ATOM 2153 CB TYR B 21 0.836 12.408 5.405 1.00 0.00 C ATOM 2154 CG TYR B 21 1.673 11.131 5.523 1.00 0.00 C ATOM 2155 CD1 TYR B 21 2.400 10.661 4.429 1.00 0.00 C ATOM 2156 CD2 TYR B 21 1.762 10.416 6.714 1.00 0.00 C ATOM 2157 CE1 TYR B 21 3.177 9.531 4.522 1.00 0.00 C ATOM 2158 CE2 TYR B 21 2.541 9.282 6.814 1.00 0.00 C ATOM 2159 CZ TYR B 21 3.244 8.844 5.717 1.00 0.00 C ATOM 2160 OH TYR B 21 4.007 7.708 5.805 1.00 0.00 O ATOM 0 H TYR B 21 1.791 13.450 7.502 1.00 0.00 H new ATOM 0 HA TYR B 21 2.544 13.508 4.724 1.00 0.00 H new ATOM 0 HB2 TYR B 21 0.131 12.455 6.235 1.00 0.00 H new ATOM 0 HB3 TYR B 21 0.247 12.370 4.489 1.00 0.00 H new ATOM 0 HD1 TYR B 21 2.351 11.195 3.492 1.00 0.00 H new ATOM 0 HD2 TYR B 21 1.210 10.756 7.578 1.00 0.00 H new ATOM 0 HE1 TYR B 21 3.732 9.182 3.664 1.00 0.00 H new ATOM 0 HE2 TYR B 21 2.598 8.742 7.748 1.00 0.00 H new ATOM 0 HH TYR B 21 4.949 7.954 5.919 1.00 0.00 H new ATOM 2170 N LYS B 22 0.286 15.672 5.771 1.00 0.00 N ATOM 2171 CA LYS B 22 -0.507 16.860 5.380 1.00 0.00 C ATOM 2172 C LYS B 22 0.314 17.871 4.569 1.00 0.00 C ATOM 2173 O LYS B 22 -0.126 18.362 3.533 1.00 0.00 O ATOM 2174 CB LYS B 22 -1.146 17.540 6.621 1.00 0.00 C ATOM 2175 CG LYS B 22 -2.346 16.775 7.214 1.00 0.00 C ATOM 2176 CD LYS B 22 -2.818 17.348 8.568 1.00 0.00 C ATOM 2177 CE LYS B 22 -3.302 18.803 8.478 1.00 0.00 C ATOM 2178 NZ LYS B 22 -3.870 19.295 9.757 1.00 0.00 N ATOM 0 H LYS B 22 0.303 15.499 6.776 1.00 0.00 H new ATOM 0 HA LYS B 22 -1.307 16.502 4.731 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -0.384 17.652 7.392 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -1.470 18.543 6.345 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -3.174 16.803 6.505 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -2.074 15.728 7.344 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -3.626 16.727 8.955 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -1.999 17.289 9.285 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -2.469 19.442 8.185 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -4.056 18.884 7.695 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -4.024 20.322 9.696 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -4.776 18.819 9.940 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -3.208 19.090 10.533 1.00 0.00 H new ATOM 2192 N ALA B 23 1.528 18.152 5.076 1.00 0.00 N ATOM 2193 CA ALA B 23 2.509 19.025 4.389 1.00 0.00 C ATOM 2194 C ALA B 23 3.216 18.283 3.232 1.00 0.00 C ATOM 2195 O ALA B 23 3.484 18.871 2.175 1.00 0.00 O ATOM 2196 CB ALA B 23 3.538 19.544 5.402 1.00 0.00 C ATOM 0 H ALA B 23 1.859 17.785 5.968 1.00 0.00 H new ATOM 0 HA ALA B 23 1.971 19.868 3.956 1.00 0.00 H new ATOM 0 HB1 ALA B 23 4.258 20.185 4.893 1.00 0.00 H new ATOM 0 HB2 ALA B 23 3.028 20.115 6.178 1.00 0.00 H new ATOM 0 HB3 ALA B 23 4.060 18.701 5.855 1.00 0.00 H new ATOM 2202 N LEU B 24 3.500 16.986 3.457 1.00 0.00 N ATOM 2203 CA LEU B 24 4.282 16.121 2.530 1.00 0.00 C ATOM 2204 C LEU B 24 3.590 15.939 1.167 1.00 0.00 C ATOM 2205 O LEU B 24 4.253 15.773 0.134 1.00 0.00 O ATOM 2206 CB LEU B 24 4.452 14.709 3.163 1.00 0.00 C ATOM 2207 CG LEU B 24 5.540 13.787 2.540 1.00 0.00 C ATOM 2208 CD1 LEU B 24 6.933 14.281 2.943 1.00 0.00 C ATOM 2209 CD2 LEU B 24 5.330 12.299 2.919 1.00 0.00 C ATOM 0 H LEU B 24 3.192 16.496 4.297 1.00 0.00 H new ATOM 0 HA LEU B 24 5.241 16.614 2.371 1.00 0.00 H new ATOM 0 HB2 LEU B 24 4.680 14.836 4.221 1.00 0.00 H new ATOM 0 HB3 LEU B 24 3.494 14.192 3.103 1.00 0.00 H new ATOM 0 HG LEU B 24 5.451 13.841 1.455 1.00 0.00 H new ATOM 0 HD11 LEU B 24 7.690 13.632 2.504 1.00 0.00 H new ATOM 0 HD12 LEU B 24 7.076 15.300 2.583 1.00 0.00 H new ATOM 0 HD13 LEU B 24 7.025 14.263 4.029 1.00 0.00 H new ATOM 0 HD21 LEU B 24 6.112 11.693 2.462 1.00 0.00 H new ATOM 0 HD22 LEU B 24 5.373 12.190 4.003 1.00 0.00 H new ATOM 0 HD23 LEU B 24 4.357 11.966 2.559 1.00 0.00 H new ATOM 2221 N LEU B 25 2.256 15.972 1.196 1.00 0.00 N ATOM 2222 CA LEU B 25 1.406 15.858 0.001 1.00 0.00 C ATOM 2223 C LEU B 25 0.842 17.246 -0.349 1.00 0.00 C ATOM 2224 O LEU B 25 0.725 17.599 -1.528 1.00 0.00 O ATOM 2225 CB LEU B 25 0.275 14.834 0.288 1.00 0.00 C ATOM 2226 CG LEU B 25 0.753 13.452 0.859 1.00 0.00 C ATOM 2227 CD1 LEU B 25 -0.429 12.505 1.128 1.00 0.00 C ATOM 2228 CD2 LEU B 25 1.785 12.792 -0.063 1.00 0.00 C ATOM 0 H LEU B 25 1.725 16.080 2.060 1.00 0.00 H new ATOM 0 HA LEU B 25 1.981 15.502 -0.854 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -0.425 15.279 0.995 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -0.275 14.656 -0.636 1.00 0.00 H new ATOM 0 HG LEU B 25 1.237 13.653 1.815 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.056 11.560 1.522 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -1.102 12.960 1.854 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.968 12.323 0.198 1.00 0.00 H new ATOM 0 HD21 LEU B 25 2.095 11.837 0.362 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.342 12.625 -1.045 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.653 13.443 -0.163 1.00 0.00 H new ATOM 2240 N GLY B 26 0.502 18.025 0.693 1.00 0.00 N ATOM 2241 CA GLY B 26 -0.192 19.307 0.529 1.00 0.00 C ATOM 2242 C GLY B 26 -1.705 19.133 0.536 1.00 0.00 C ATOM 2243 O GLY B 26 -2.426 19.865 -0.148 1.00 0.00 O ATOM 0 H GLY B 26 0.700 17.783 1.664 1.00 0.00 H new ATOM 0 HA2 GLY B 26 0.100 19.984 1.331 1.00 0.00 H new ATOM 0 HA3 GLY B 26 0.117 19.771 -0.408 1.00 0.00 H new ATOM 2247 N VAL B 27 -2.179 18.144 1.325 1.00 0.00 N ATOM 2248 CA VAL B 27 -3.610 17.769 1.416 1.00 0.00 C ATOM 2249 C VAL B 27 -4.051 17.728 2.895 1.00 0.00 C ATOM 2250 O VAL B 27 -3.215 17.602 3.792 1.00 0.00 O ATOM 2251 CB VAL B 27 -3.899 16.371 0.731 1.00 0.00 C ATOM 2252 CG1 VAL B 27 -3.448 16.380 -0.752 1.00 0.00 C ATOM 2253 CG2 VAL B 27 -3.251 15.193 1.510 1.00 0.00 C ATOM 0 H VAL B 27 -1.576 17.578 1.922 1.00 0.00 H new ATOM 0 HA VAL B 27 -4.183 18.526 0.881 1.00 0.00 H new ATOM 0 HB VAL B 27 -4.977 16.213 0.759 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -3.657 15.409 -1.202 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -3.992 17.155 -1.293 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -2.378 16.582 -0.806 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -3.476 14.254 1.003 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -2.171 15.334 1.550 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -3.651 15.163 2.523 1.00 0.00 H new ATOM 2263 N ASP B 28 -5.364 17.845 3.137 1.00 0.00 N ATOM 2264 CA ASP B 28 -5.969 17.729 4.486 1.00 0.00 C ATOM 2265 C ASP B 28 -6.804 16.429 4.573 1.00 0.00 C ATOM 2266 O ASP B 28 -7.353 15.988 3.553 1.00 0.00 O ATOM 2267 CB ASP B 28 -6.862 18.965 4.789 1.00 0.00 C ATOM 2268 CG ASP B 28 -8.087 19.088 3.853 1.00 0.00 C ATOM 2269 OD1 ASP B 28 -7.970 19.708 2.778 1.00 0.00 O ATOM 2270 OD2 ASP B 28 -9.176 18.564 4.185 1.00 0.00 O ATOM 0 H ASP B 28 -6.048 18.024 2.401 1.00 0.00 H new ATOM 0 HA ASP B 28 -5.172 17.692 5.229 1.00 0.00 H new ATOM 0 HB2 ASP B 28 -7.208 18.909 5.821 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -6.258 19.869 4.704 1.00 0.00 H new ATOM 2275 N PRO B 29 -6.902 15.779 5.780 1.00 0.00 N ATOM 2276 CA PRO B 29 -7.775 14.609 5.984 1.00 0.00 C ATOM 2277 C PRO B 29 -9.260 14.992 5.869 1.00 0.00 C ATOM 2278 O PRO B 29 -9.799 15.668 6.752 1.00 0.00 O ATOM 2279 CB PRO B 29 -7.412 14.096 7.411 1.00 0.00 C ATOM 2280 CG PRO B 29 -6.115 14.774 7.736 1.00 0.00 C ATOM 2281 CD PRO B 29 -6.163 16.106 7.023 1.00 0.00 C ATOM 0 HA PRO B 29 -7.623 13.839 5.227 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -8.186 14.353 8.134 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -7.308 13.011 7.428 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -6.002 14.909 8.812 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -5.266 14.179 7.399 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -6.678 16.864 7.614 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -5.165 16.490 6.812 1.00 0.00 H new ATOM 2289 N VAL B 30 -9.900 14.565 4.762 1.00 0.00 N ATOM 2290 CA VAL B 30 -11.320 14.848 4.490 1.00 0.00 C ATOM 2291 C VAL B 30 -12.221 14.194 5.565 1.00 0.00 C ATOM 2292 O VAL B 30 -13.244 14.761 5.953 1.00 0.00 O ATOM 2293 CB VAL B 30 -11.740 14.385 3.040 1.00 0.00 C ATOM 2294 CG1 VAL B 30 -11.451 12.882 2.801 1.00 0.00 C ATOM 2295 CG2 VAL B 30 -13.226 14.729 2.743 1.00 0.00 C ATOM 0 H VAL B 30 -9.446 14.015 4.033 1.00 0.00 H new ATOM 0 HA VAL B 30 -11.458 15.928 4.536 1.00 0.00 H new ATOM 0 HB VAL B 30 -11.122 14.944 2.337 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -11.756 12.609 1.791 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -10.384 12.693 2.922 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -12.009 12.285 3.522 1.00 0.00 H new ATOM 0 HG21 VAL B 30 -13.482 14.397 1.737 1.00 0.00 H new ATOM 0 HG22 VAL B 30 -13.868 14.225 3.466 1.00 0.00 H new ATOM 0 HG23 VAL B 30 -13.372 15.807 2.817 1.00 0.00 H new ATOM 2305 N GLU B 31 -11.807 13.006 6.056 1.00 0.00 N ATOM 2306 CA GLU B 31 -12.414 12.350 7.225 1.00 0.00 C ATOM 2307 C GLU B 31 -11.348 12.281 8.340 1.00 0.00 C ATOM 2308 O GLU B 31 -10.588 11.304 8.432 1.00 0.00 O ATOM 2309 CB GLU B 31 -12.936 10.920 6.874 1.00 0.00 C ATOM 2310 CG GLU B 31 -13.861 10.821 5.642 1.00 0.00 C ATOM 2311 CD GLU B 31 -15.117 11.702 5.719 1.00 0.00 C ATOM 2312 OE1 GLU B 31 -15.991 11.426 6.568 1.00 0.00 O ATOM 2313 OE2 GLU B 31 -15.245 12.652 4.918 1.00 0.00 O ATOM 0 H GLU B 31 -11.038 12.476 5.647 1.00 0.00 H new ATOM 0 HA GLU B 31 -13.277 12.927 7.558 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -12.076 10.271 6.711 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -13.472 10.528 7.738 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -13.293 11.096 4.753 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -14.168 9.783 5.516 1.00 0.00 H new ATOM 2320 N SER B 32 -11.242 13.369 9.124 1.00 0.00 N ATOM 2321 CA SER B 32 -10.313 13.457 10.269 1.00 0.00 C ATOM 2322 C SER B 32 -10.980 12.883 11.535 1.00 0.00 C ATOM 2323 O SER B 32 -12.101 13.266 11.881 1.00 0.00 O ATOM 2324 CB SER B 32 -9.879 14.924 10.479 1.00 0.00 C ATOM 2325 OG SER B 32 -11.001 15.796 10.582 1.00 0.00 O ATOM 0 H SER B 32 -11.797 14.213 8.983 1.00 0.00 H new ATOM 0 HA SER B 32 -9.422 12.865 10.061 1.00 0.00 H new ATOM 0 HB2 SER B 32 -9.276 14.999 11.384 1.00 0.00 H new ATOM 0 HB3 SER B 32 -9.248 15.239 9.648 1.00 0.00 H new ATOM 0 HG SER B 32 -11.725 15.342 11.061 1.00 0.00 H new ATOM 2331 N SER B 33 -10.273 11.977 12.217 1.00 0.00 N ATOM 2332 CA SER B 33 -10.790 11.226 13.374 1.00 0.00 C ATOM 2333 C SER B 33 -9.700 11.168 14.480 1.00 0.00 C ATOM 2334 O SER B 33 -8.509 11.220 14.148 1.00 0.00 O ATOM 2335 CB SER B 33 -11.206 9.808 12.885 1.00 0.00 C ATOM 2336 OG SER B 33 -11.566 8.946 13.946 1.00 0.00 O ATOM 0 H SER B 33 -9.310 11.738 11.980 1.00 0.00 H new ATOM 0 HA SER B 33 -11.664 11.714 13.806 1.00 0.00 H new ATOM 0 HB2 SER B 33 -12.045 9.898 12.196 1.00 0.00 H new ATOM 0 HB3 SER B 33 -10.381 9.365 12.327 1.00 0.00 H new ATOM 0 HG SER B 33 -10.975 8.164 13.947 1.00 0.00 H new ATOM 2342 N PRO B 34 -10.079 11.096 15.811 1.00 0.00 N ATOM 2343 CA PRO B 34 -9.109 11.087 16.952 1.00 0.00 C ATOM 2344 C PRO B 34 -7.944 10.062 16.809 1.00 0.00 C ATOM 2345 O PRO B 34 -6.789 10.399 17.102 1.00 0.00 O ATOM 2346 CB PRO B 34 -10.005 10.775 18.197 1.00 0.00 C ATOM 2347 CG PRO B 34 -11.328 10.336 17.634 1.00 0.00 C ATOM 2348 CD PRO B 34 -11.475 11.075 16.327 1.00 0.00 C ATOM 0 HA PRO B 34 -8.581 12.038 17.017 1.00 0.00 H new ATOM 0 HB2 PRO B 34 -9.562 9.994 18.815 1.00 0.00 H new ATOM 0 HB3 PRO B 34 -10.119 11.655 18.830 1.00 0.00 H new ATOM 0 HG2 PRO B 34 -11.350 9.257 17.480 1.00 0.00 H new ATOM 0 HG3 PRO B 34 -12.144 10.577 18.315 1.00 0.00 H new ATOM 0 HD2 PRO B 34 -12.152 10.562 15.644 1.00 0.00 H new ATOM 0 HD3 PRO B 34 -11.870 12.081 16.471 1.00 0.00 H new ATOM 2356 N THR B 35 -8.244 8.824 16.357 1.00 0.00 N ATOM 2357 CA THR B 35 -7.217 7.758 16.219 1.00 0.00 C ATOM 2358 C THR B 35 -7.216 7.133 14.796 1.00 0.00 C ATOM 2359 O THR B 35 -6.728 6.008 14.591 1.00 0.00 O ATOM 2360 CB THR B 35 -7.376 6.679 17.356 1.00 0.00 C ATOM 2361 OG1 THR B 35 -6.294 5.731 17.317 1.00 0.00 O ATOM 2362 CG2 THR B 35 -8.721 5.937 17.293 1.00 0.00 C ATOM 0 H THR B 35 -9.183 8.536 16.082 1.00 0.00 H new ATOM 0 HA THR B 35 -6.236 8.217 16.344 1.00 0.00 H new ATOM 0 HB THR B 35 -7.350 7.224 18.299 1.00 0.00 H new ATOM 0 HG1 THR B 35 -6.085 5.511 16.385 1.00 0.00 H new ATOM 0 HG21 THR B 35 -8.772 5.207 18.101 1.00 0.00 H new ATOM 0 HG22 THR B 35 -9.537 6.652 17.398 1.00 0.00 H new ATOM 0 HG23 THR B 35 -8.809 5.425 16.335 1.00 0.00 H new ATOM 2370 N PHE B 36 -7.700 7.899 13.804 1.00 0.00 N ATOM 2371 CA PHE B 36 -7.698 7.473 12.387 1.00 0.00 C ATOM 2372 C PHE B 36 -7.677 8.720 11.488 1.00 0.00 C ATOM 2373 O PHE B 36 -8.153 9.777 11.882 1.00 0.00 O ATOM 2374 CB PHE B 36 -8.942 6.583 12.085 1.00 0.00 C ATOM 2375 CG PHE B 36 -8.983 5.932 10.690 1.00 0.00 C ATOM 2376 CD1 PHE B 36 -8.363 4.705 10.455 1.00 0.00 C ATOM 2377 CD2 PHE B 36 -9.645 6.541 9.618 1.00 0.00 C ATOM 2378 CE1 PHE B 36 -8.400 4.110 9.207 1.00 0.00 C ATOM 2379 CE2 PHE B 36 -9.682 5.945 8.370 1.00 0.00 C ATOM 2380 CZ PHE B 36 -9.059 4.731 8.166 1.00 0.00 C ATOM 0 H PHE B 36 -8.101 8.824 13.956 1.00 0.00 H new ATOM 0 HA PHE B 36 -6.809 6.875 12.184 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -8.989 5.793 12.834 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -9.838 7.192 12.207 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -7.844 4.210 11.263 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -10.135 7.492 9.767 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -7.913 3.159 9.047 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -10.199 6.430 7.555 1.00 0.00 H new ATOM 0 HZ PHE B 36 -9.087 4.267 7.191 1.00 0.00 H new ATOM 2390 N SER B 37 -7.124 8.589 10.286 1.00 0.00 N ATOM 2391 CA SER B 37 -7.104 9.667 9.285 1.00 0.00 C ATOM 2392 C SER B 37 -7.489 9.099 7.924 1.00 0.00 C ATOM 2393 O SER B 37 -7.144 7.961 7.606 1.00 0.00 O ATOM 2394 CB SER B 37 -5.702 10.309 9.227 1.00 0.00 C ATOM 2395 OG SER B 37 -5.617 11.300 8.215 1.00 0.00 O ATOM 0 H SER B 37 -6.673 7.730 9.971 1.00 0.00 H new ATOM 0 HA SER B 37 -7.822 10.438 9.565 1.00 0.00 H new ATOM 0 HB2 SER B 37 -5.466 10.755 10.193 1.00 0.00 H new ATOM 0 HB3 SER B 37 -4.956 9.536 9.042 1.00 0.00 H new ATOM 0 HG SER B 37 -5.695 12.189 8.620 1.00 0.00 H new ATOM 2401 N LEU B 38 -8.235 9.882 7.146 1.00 0.00 N ATOM 2402 CA LEU B 38 -8.568 9.553 5.766 1.00 0.00 C ATOM 2403 C LEU B 38 -8.507 10.839 4.944 1.00 0.00 C ATOM 2404 O LEU B 38 -9.202 11.801 5.256 1.00 0.00 O ATOM 2405 CB LEU B 38 -9.964 8.855 5.706 1.00 0.00 C ATOM 2406 CG LEU B 38 -10.478 8.347 4.306 1.00 0.00 C ATOM 2407 CD1 LEU B 38 -11.239 9.426 3.518 1.00 0.00 C ATOM 2408 CD2 LEU B 38 -9.335 7.782 3.451 1.00 0.00 C ATOM 0 H LEU B 38 -8.627 10.769 7.461 1.00 0.00 H new ATOM 0 HA LEU B 38 -7.855 8.845 5.344 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -9.939 8.001 6.383 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -10.703 9.553 6.100 1.00 0.00 H new ATOM 0 HG LEU B 38 -11.182 7.545 4.527 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -11.567 9.016 2.563 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -12.107 9.751 4.091 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -10.582 10.278 3.340 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -9.730 7.442 2.494 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -8.590 8.559 3.281 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -8.872 6.943 3.971 1.00 0.00 H new ATOM 2420 N PHE B 39 -7.674 10.832 3.898 1.00 0.00 N ATOM 2421 CA PHE B 39 -7.712 11.824 2.815 1.00 0.00 C ATOM 2422 C PHE B 39 -7.728 11.092 1.464 1.00 0.00 C ATOM 2423 O PHE B 39 -7.151 10.017 1.311 1.00 0.00 O ATOM 2424 CB PHE B 39 -6.549 12.862 2.913 1.00 0.00 C ATOM 2425 CG PHE B 39 -5.170 12.324 3.312 1.00 0.00 C ATOM 2426 CD1 PHE B 39 -4.416 11.552 2.434 1.00 0.00 C ATOM 2427 CD2 PHE B 39 -4.614 12.623 4.565 1.00 0.00 C ATOM 2428 CE1 PHE B 39 -3.166 11.095 2.788 1.00 0.00 C ATOM 2429 CE2 PHE B 39 -3.362 12.162 4.912 1.00 0.00 C ATOM 2430 CZ PHE B 39 -2.637 11.399 4.023 1.00 0.00 C ATOM 0 H PHE B 39 -6.945 10.129 3.777 1.00 0.00 H new ATOM 0 HA PHE B 39 -8.626 12.410 2.910 1.00 0.00 H new ATOM 0 HB2 PHE B 39 -6.453 13.356 1.946 1.00 0.00 H new ATOM 0 HB3 PHE B 39 -6.837 13.626 3.635 1.00 0.00 H new ATOM 0 HD1 PHE B 39 -4.816 11.308 1.461 1.00 0.00 H new ATOM 0 HD2 PHE B 39 -5.174 13.222 5.267 1.00 0.00 H new ATOM 0 HE1 PHE B 39 -2.597 10.495 2.093 1.00 0.00 H new ATOM 0 HE2 PHE B 39 -2.949 12.399 5.881 1.00 0.00 H new ATOM 0 HZ PHE B 39 -1.655 11.040 4.294 1.00 0.00 H new ATOM 2440 N VAL B 40 -8.421 11.692 0.488 1.00 0.00 N ATOM 2441 CA VAL B 40 -8.566 11.136 -0.865 1.00 0.00 C ATOM 2442 C VAL B 40 -7.946 12.127 -1.852 1.00 0.00 C ATOM 2443 O VAL B 40 -8.185 13.334 -1.742 1.00 0.00 O ATOM 2444 CB VAL B 40 -10.078 10.903 -1.262 1.00 0.00 C ATOM 2445 CG1 VAL B 40 -10.192 10.031 -2.544 1.00 0.00 C ATOM 2446 CG2 VAL B 40 -10.890 10.299 -0.091 1.00 0.00 C ATOM 0 H VAL B 40 -8.901 12.583 0.615 1.00 0.00 H new ATOM 0 HA VAL B 40 -8.067 10.167 -0.892 1.00 0.00 H new ATOM 0 HB VAL B 40 -10.513 11.878 -1.484 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -11.243 9.887 -2.794 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -9.688 10.532 -3.371 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -9.725 9.062 -2.368 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -11.924 10.153 -0.402 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -10.458 9.340 0.194 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -10.860 10.978 0.761 1.00 0.00 H new ATOM 2456 N LEU B 41 -7.148 11.624 -2.795 1.00 0.00 N ATOM 2457 CA LEU B 41 -6.315 12.466 -3.674 1.00 0.00 C ATOM 2458 C LEU B 41 -7.031 12.726 -5.017 1.00 0.00 C ATOM 2459 O LEU B 41 -7.925 11.965 -5.408 1.00 0.00 O ATOM 2460 CB LEU B 41 -4.933 11.786 -3.876 1.00 0.00 C ATOM 2461 CG LEU B 41 -4.112 11.488 -2.572 1.00 0.00 C ATOM 2462 CD1 LEU B 41 -2.754 10.832 -2.897 1.00 0.00 C ATOM 2463 CD2 LEU B 41 -3.922 12.760 -1.712 1.00 0.00 C ATOM 0 H LEU B 41 -7.057 10.624 -2.976 1.00 0.00 H new ATOM 0 HA LEU B 41 -6.154 13.438 -3.207 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -5.087 10.846 -4.406 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -4.329 12.422 -4.524 1.00 0.00 H new ATOM 0 HG LEU B 41 -4.693 10.778 -1.984 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -2.212 10.640 -1.971 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -2.921 9.891 -3.422 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -2.169 11.501 -3.528 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -3.349 12.513 -0.818 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -3.386 13.513 -2.290 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -4.897 13.152 -1.421 1.00 0.00 H new ATOM 2475 N ALA B 42 -6.618 13.810 -5.710 1.00 0.00 N ATOM 2476 CA ALA B 42 -7.234 14.271 -6.982 1.00 0.00 C ATOM 2477 C ALA B 42 -7.031 13.267 -8.140 1.00 0.00 C ATOM 2478 O ALA B 42 -7.781 13.283 -9.120 1.00 0.00 O ATOM 2479 CB ALA B 42 -6.675 15.658 -7.362 1.00 0.00 C ATOM 0 H ALA B 42 -5.842 14.397 -5.403 1.00 0.00 H new ATOM 0 HA ALA B 42 -8.309 14.343 -6.817 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -7.130 15.991 -8.295 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -6.905 16.372 -6.571 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -5.594 15.593 -7.489 1.00 0.00 H new ATOM 2485 N ASN B 43 -6.001 12.411 -8.012 1.00 0.00 N ATOM 2486 CA ASN B 43 -5.717 11.303 -8.967 1.00 0.00 C ATOM 2487 C ASN B 43 -6.823 10.217 -8.933 1.00 0.00 C ATOM 2488 O ASN B 43 -6.968 9.435 -9.880 1.00 0.00 O ATOM 2489 CB ASN B 43 -4.323 10.678 -8.656 1.00 0.00 C ATOM 2490 CG ASN B 43 -4.125 10.325 -7.183 1.00 0.00 C ATOM 2491 OD1 ASN B 43 -5.084 10.063 -6.472 1.00 0.00 O ATOM 2492 ND2 ASN B 43 -2.884 10.313 -6.711 1.00 0.00 N ATOM 0 H ASN B 43 -5.334 12.461 -7.242 1.00 0.00 H new ATOM 0 HA ASN B 43 -5.706 11.721 -9.974 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -4.196 9.778 -9.257 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -3.545 11.377 -8.961 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -2.713 10.081 -5.733 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -2.102 10.536 -7.327 1.00 0.00 H new ATOM 2499 N GLY B 44 -7.583 10.184 -7.819 1.00 0.00 N ATOM 2500 CA GLY B 44 -8.723 9.280 -7.652 1.00 0.00 C ATOM 2501 C GLY B 44 -8.444 8.134 -6.695 1.00 0.00 C ATOM 2502 O GLY B 44 -9.378 7.439 -6.288 1.00 0.00 O ATOM 0 H GLY B 44 -7.417 10.787 -7.013 1.00 0.00 H new ATOM 0 HA2 GLY B 44 -9.579 9.849 -7.288 1.00 0.00 H new ATOM 0 HA3 GLY B 44 -9.001 8.873 -8.624 1.00 0.00 H new ATOM 2506 N MET B 45 -7.156 7.918 -6.341 1.00 0.00 N ATOM 2507 CA MET B 45 -6.774 6.914 -5.325 1.00 0.00 C ATOM 2508 C MET B 45 -7.151 7.434 -3.926 1.00 0.00 C ATOM 2509 O MET B 45 -7.245 8.654 -3.707 1.00 0.00 O ATOM 2510 CB MET B 45 -5.254 6.550 -5.415 1.00 0.00 C ATOM 2511 CG MET B 45 -4.250 7.578 -4.842 1.00 0.00 C ATOM 2512 SD MET B 45 -4.134 7.589 -3.037 1.00 0.00 S ATOM 2513 CE MET B 45 -3.239 6.072 -2.722 1.00 0.00 C ATOM 0 H MET B 45 -6.367 8.424 -6.743 1.00 0.00 H new ATOM 0 HA MET B 45 -7.323 5.993 -5.518 1.00 0.00 H new ATOM 0 HB2 MET B 45 -5.101 5.603 -4.897 1.00 0.00 H new ATOM 0 HB3 MET B 45 -5.007 6.384 -6.464 1.00 0.00 H new ATOM 0 HG2 MET B 45 -3.263 7.372 -5.255 1.00 0.00 H new ATOM 0 HG3 MET B 45 -4.536 8.574 -5.181 1.00 0.00 H new ATOM 0 HE1 MET B 45 -2.941 6.036 -1.674 1.00 0.00 H new ATOM 0 HE2 MET B 45 -3.879 5.219 -2.947 1.00 0.00 H new ATOM 0 HE3 MET B 45 -2.351 6.036 -3.353 1.00 0.00 H new ATOM 2523 N LYS B 46 -7.352 6.508 -2.987 1.00 0.00 N ATOM 2524 CA LYS B 46 -7.804 6.834 -1.627 1.00 0.00 C ATOM 2525 C LYS B 46 -6.738 6.368 -0.616 1.00 0.00 C ATOM 2526 O LYS B 46 -6.156 5.288 -0.791 1.00 0.00 O ATOM 2527 CB LYS B 46 -9.183 6.167 -1.404 1.00 0.00 C ATOM 2528 CG LYS B 46 -9.936 6.620 -0.144 1.00 0.00 C ATOM 2529 CD LYS B 46 -11.416 6.173 -0.153 1.00 0.00 C ATOM 2530 CE LYS B 46 -12.181 6.616 1.103 1.00 0.00 C ATOM 2531 NZ LYS B 46 -13.631 6.330 1.006 1.00 0.00 N ATOM 0 H LYS B 46 -7.207 5.511 -3.144 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.926 7.908 -1.486 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -9.810 6.367 -2.273 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -9.042 5.087 -1.354 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -9.441 6.214 0.738 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -9.887 7.706 -0.065 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -11.908 6.582 -1.035 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -11.462 5.087 -0.236 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -11.770 6.107 1.975 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -12.033 7.685 1.258 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -14.106 6.646 1.876 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -14.031 6.836 0.190 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -13.776 5.307 0.884 1.00 0.00 H new ATOM 2545 N LEU B 47 -6.484 7.180 0.434 1.00 0.00 N ATOM 2546 CA LEU B 47 -5.320 6.984 1.332 1.00 0.00 C ATOM 2547 C LEU B 47 -5.731 7.191 2.817 1.00 0.00 C ATOM 2548 O LEU B 47 -6.096 8.294 3.231 1.00 0.00 O ATOM 2549 CB LEU B 47 -4.178 7.957 0.879 1.00 0.00 C ATOM 2550 CG LEU B 47 -2.695 7.515 1.149 1.00 0.00 C ATOM 2551 CD1 LEU B 47 -1.709 8.451 0.417 1.00 0.00 C ATOM 2552 CD2 LEU B 47 -2.363 7.446 2.658 1.00 0.00 C ATOM 0 H LEU B 47 -7.069 7.978 0.682 1.00 0.00 H new ATOM 0 HA LEU B 47 -4.950 5.961 1.262 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -4.288 8.128 -0.192 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -4.338 8.915 1.373 1.00 0.00 H new ATOM 0 HG LEU B 47 -2.586 6.505 0.754 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -0.687 8.130 0.616 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.899 8.413 -0.656 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -1.844 9.472 0.774 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -1.326 7.136 2.789 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -2.507 8.428 3.108 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.021 6.725 3.143 1.00 0.00 H new ATOM 2564 N GLY B 48 -5.642 6.101 3.607 1.00 0.00 N ATOM 2565 CA GLY B 48 -5.942 6.101 5.047 1.00 0.00 C ATOM 2566 C GLY B 48 -4.669 6.145 5.885 1.00 0.00 C ATOM 2567 O GLY B 48 -3.560 5.994 5.365 1.00 0.00 O ATOM 0 H GLY B 48 -5.356 5.187 3.255 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -6.568 6.960 5.289 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -6.514 5.209 5.300 1.00 0.00 H new ATOM 2571 N LEU B 49 -4.849 6.343 7.209 1.00 0.00 N ATOM 2572 CA LEU B 49 -3.818 6.133 8.248 1.00 0.00 C ATOM 2573 C LEU B 49 -4.525 5.472 9.450 1.00 0.00 C ATOM 2574 O LEU B 49 -5.313 6.134 10.136 1.00 0.00 O ATOM 2575 CB LEU B 49 -3.116 7.459 8.703 1.00 0.00 C ATOM 2576 CG LEU B 49 -2.297 8.260 7.624 1.00 0.00 C ATOM 2577 CD1 LEU B 49 -3.202 9.109 6.707 1.00 0.00 C ATOM 2578 CD2 LEU B 49 -1.211 9.140 8.276 1.00 0.00 C ATOM 0 H LEU B 49 -5.738 6.661 7.594 1.00 0.00 H new ATOM 0 HA LEU B 49 -3.026 5.507 7.838 1.00 0.00 H new ATOM 0 HB2 LEU B 49 -3.881 8.123 9.104 1.00 0.00 H new ATOM 0 HB3 LEU B 49 -2.442 7.217 9.524 1.00 0.00 H new ATOM 0 HG LEU B 49 -1.806 7.515 6.998 1.00 0.00 H new ATOM 0 HD11 LEU B 49 -2.587 9.641 5.981 1.00 0.00 H new ATOM 0 HD12 LEU B 49 -3.901 8.458 6.182 1.00 0.00 H new ATOM 0 HD13 LEU B 49 -3.757 9.828 7.309 1.00 0.00 H new ATOM 0 HD21 LEU B 49 -0.665 9.678 7.501 1.00 0.00 H new ATOM 0 HD22 LEU B 49 -1.680 9.854 8.953 1.00 0.00 H new ATOM 0 HD23 LEU B 49 -0.519 8.510 8.835 1.00 0.00 H new ATOM 2590 N TRP B 50 -4.275 4.164 9.685 1.00 0.00 N ATOM 2591 CA TRP B 50 -4.866 3.422 10.821 1.00 0.00 C ATOM 2592 C TRP B 50 -3.790 3.218 11.896 1.00 0.00 C ATOM 2593 O TRP B 50 -2.717 2.681 11.612 1.00 0.00 O ATOM 2594 CB TRP B 50 -5.460 2.041 10.376 1.00 0.00 C ATOM 2595 CG TRP B 50 -6.489 1.440 11.353 1.00 0.00 C ATOM 2596 CD1 TRP B 50 -6.910 1.964 12.552 1.00 0.00 C ATOM 2597 CD2 TRP B 50 -7.241 0.214 11.196 1.00 0.00 C ATOM 2598 NE1 TRP B 50 -7.868 1.165 13.118 1.00 0.00 N ATOM 2599 CE2 TRP B 50 -8.088 0.090 12.308 1.00 0.00 C ATOM 2600 CE3 TRP B 50 -7.285 -0.782 10.226 1.00 0.00 C ATOM 2601 CZ2 TRP B 50 -8.964 -0.980 12.468 1.00 0.00 C ATOM 2602 CZ3 TRP B 50 -8.150 -1.849 10.383 1.00 0.00 C ATOM 2603 CH2 TRP B 50 -8.982 -1.941 11.496 1.00 0.00 C ATOM 0 H TRP B 50 -3.663 3.597 9.098 1.00 0.00 H new ATOM 0 HA TRP B 50 -5.692 4.009 11.223 1.00 0.00 H new ATOM 0 HB2 TRP B 50 -5.932 2.161 9.401 1.00 0.00 H new ATOM 0 HB3 TRP B 50 -4.642 1.332 10.250 1.00 0.00 H new ATOM 0 HD1 TRP B 50 -6.537 2.879 12.988 1.00 0.00 H new ATOM 0 HE1 TRP B 50 -8.341 1.345 14.004 1.00 0.00 H new ATOM 0 HE3 TRP B 50 -6.648 -0.722 9.356 1.00 0.00 H new ATOM 0 HZ2 TRP B 50 -9.608 -1.049 13.332 1.00 0.00 H new ATOM 0 HZ3 TRP B 50 -8.181 -2.623 9.631 1.00 0.00 H new ATOM 0 HH2 TRP B 50 -9.651 -2.783 11.593 1.00 0.00 H new ATOM 2614 N SER B 51 -4.090 3.668 13.123 1.00 0.00 N ATOM 2615 CA SER B 51 -3.177 3.566 14.265 1.00 0.00 C ATOM 2616 C SER B 51 -3.157 2.128 14.827 1.00 0.00 C ATOM 2617 O SER B 51 -4.210 1.489 14.941 1.00 0.00 O ATOM 2618 CB SER B 51 -3.596 4.582 15.340 1.00 0.00 C ATOM 2619 OG SER B 51 -3.726 5.877 14.779 1.00 0.00 O ATOM 0 H SER B 51 -4.978 4.115 13.350 1.00 0.00 H new ATOM 0 HA SER B 51 -2.163 3.797 13.939 1.00 0.00 H new ATOM 0 HB2 SER B 51 -4.542 4.277 15.787 1.00 0.00 H new ATOM 0 HB3 SER B 51 -2.856 4.599 16.140 1.00 0.00 H new ATOM 0 HG SER B 51 -4.675 6.083 14.647 1.00 0.00 H new ATOM 2625 N ARG B 52 -1.959 1.635 15.198 1.00 0.00 N ATOM 2626 CA ARG B 52 -1.755 0.233 15.625 1.00 0.00 C ATOM 2627 C ARG B 52 -2.337 -0.043 17.026 1.00 0.00 C ATOM 2628 O ARG B 52 -2.494 -1.203 17.414 1.00 0.00 O ATOM 2629 CB ARG B 52 -0.248 -0.126 15.604 1.00 0.00 C ATOM 2630 CG ARG B 52 0.593 0.605 16.669 1.00 0.00 C ATOM 2631 CD ARG B 52 2.067 0.189 16.665 1.00 0.00 C ATOM 2632 NE ARG B 52 2.797 0.797 17.798 1.00 0.00 N ATOM 2633 CZ ARG B 52 4.026 0.452 18.206 1.00 0.00 C ATOM 2634 NH1 ARG B 52 4.712 -0.478 17.567 1.00 0.00 N ATOM 2635 NH2 ARG B 52 4.570 1.052 19.249 1.00 0.00 N ATOM 0 H ARG B 52 -1.106 2.194 15.211 1.00 0.00 H new ATOM 0 HA ARG B 52 -2.291 -0.396 14.914 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -0.141 -1.201 15.748 1.00 0.00 H new ATOM 0 HB3 ARG B 52 0.155 0.105 14.618 1.00 0.00 H new ATOM 0 HG2 ARG B 52 0.525 1.680 16.501 1.00 0.00 H new ATOM 0 HG3 ARG B 52 0.170 0.409 17.654 1.00 0.00 H new ATOM 0 HD2 ARG B 52 2.141 -0.897 16.722 1.00 0.00 H new ATOM 0 HD3 ARG B 52 2.530 0.491 15.726 1.00 0.00 H new ATOM 0 HE ARG B 52 2.326 1.541 18.312 1.00 0.00 H new ATOM 0 HH11 ARG B 52 4.307 -0.942 16.754 1.00 0.00 H new ATOM 0 HH12 ARG B 52 5.647 -0.732 17.887 1.00 0.00 H new ATOM 0 HH21 ARG B 52 4.055 1.779 19.745 1.00 0.00 H new ATOM 0 HH22 ARG B 52 5.505 0.788 19.558 1.00 0.00 H new ATOM 2649 N HIS B 53 -2.645 1.030 17.779 1.00 0.00 N ATOM 2650 CA HIS B 53 -3.228 0.915 19.132 1.00 0.00 C ATOM 2651 C HIS B 53 -4.772 0.786 19.058 1.00 0.00 C ATOM 2652 O HIS B 53 -5.423 0.557 20.078 1.00 0.00 O ATOM 2653 CB HIS B 53 -2.784 2.098 20.046 1.00 0.00 C ATOM 2654 CG HIS B 53 -3.387 3.445 19.731 1.00 0.00 C ATOM 2655 ND1 HIS B 53 -4.540 3.898 20.335 1.00 0.00 N ATOM 2656 CD2 HIS B 53 -2.984 4.445 18.905 1.00 0.00 C ATOM 2657 CE1 HIS B 53 -4.820 5.107 19.903 1.00 0.00 C ATOM 2658 NE2 HIS B 53 -3.892 5.466 19.035 1.00 0.00 N ATOM 0 H HIS B 53 -2.499 1.992 17.472 1.00 0.00 H new ATOM 0 HA HIS B 53 -2.845 0.003 19.589 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -3.030 1.845 21.077 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -1.699 2.186 19.989 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -2.113 4.438 18.266 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -5.666 5.706 20.207 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -3.856 6.358 18.541 1.00 0.00 H new ATOM 2667 N THR B 54 -5.348 0.930 17.842 1.00 0.00 N ATOM 2668 CA THR B 54 -6.811 0.818 17.610 1.00 0.00 C ATOM 2669 C THR B 54 -7.120 -0.154 16.440 1.00 0.00 C ATOM 2670 O THR B 54 -8.278 -0.275 16.010 1.00 0.00 O ATOM 2671 CB THR B 54 -7.426 2.241 17.339 1.00 0.00 C ATOM 2672 OG1 THR B 54 -8.863 2.199 17.320 1.00 0.00 O ATOM 2673 CG2 THR B 54 -6.928 2.856 16.023 1.00 0.00 C ATOM 0 H THR B 54 -4.815 1.127 16.995 1.00 0.00 H new ATOM 0 HA THR B 54 -7.272 0.406 18.508 1.00 0.00 H new ATOM 0 HB THR B 54 -7.090 2.870 18.163 1.00 0.00 H new ATOM 0 HG1 THR B 54 -9.161 1.406 16.827 1.00 0.00 H new ATOM 0 HG21 THR B 54 -7.383 3.837 15.885 1.00 0.00 H new ATOM 0 HG22 THR B 54 -5.844 2.960 16.058 1.00 0.00 H new ATOM 0 HG23 THR B 54 -7.204 2.208 15.191 1.00 0.00 H new ATOM 2681 N VAL B 55 -6.082 -0.854 15.936 1.00 0.00 N ATOM 2682 CA VAL B 55 -6.224 -1.766 14.779 1.00 0.00 C ATOM 2683 C VAL B 55 -6.939 -3.085 15.166 1.00 0.00 C ATOM 2684 O VAL B 55 -6.867 -3.532 16.312 1.00 0.00 O ATOM 2685 CB VAL B 55 -4.829 -2.059 14.101 1.00 0.00 C ATOM 2686 CG1 VAL B 55 -3.924 -2.943 14.986 1.00 0.00 C ATOM 2687 CG2 VAL B 55 -5.007 -2.651 12.675 1.00 0.00 C ATOM 0 H VAL B 55 -5.135 -0.806 16.312 1.00 0.00 H new ATOM 0 HA VAL B 55 -6.852 -1.256 14.049 1.00 0.00 H new ATOM 0 HB VAL B 55 -4.316 -1.103 13.995 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -2.976 -3.117 14.477 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -3.740 -2.440 15.935 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -4.417 -3.897 15.171 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -4.028 -2.842 12.235 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -5.565 -3.585 12.736 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -5.553 -1.942 12.052 1.00 0.00 H new ATOM 2697 N GLU B 56 -7.665 -3.672 14.198 1.00 0.00 N ATOM 2698 CA GLU B 56 -8.290 -5.005 14.322 1.00 0.00 C ATOM 2699 C GLU B 56 -7.892 -5.872 13.102 1.00 0.00 C ATOM 2700 O GLU B 56 -8.246 -5.520 11.974 1.00 0.00 O ATOM 2701 CB GLU B 56 -9.833 -4.901 14.469 1.00 0.00 C ATOM 2702 CG GLU B 56 -10.296 -4.453 15.870 1.00 0.00 C ATOM 2703 CD GLU B 56 -11.809 -4.599 16.114 1.00 0.00 C ATOM 2704 OE1 GLU B 56 -12.365 -5.681 15.815 1.00 0.00 O ATOM 2705 OE2 GLU B 56 -12.432 -3.669 16.664 1.00 0.00 O ATOM 0 H GLU B 56 -7.838 -3.230 13.295 1.00 0.00 H new ATOM 0 HA GLU B 56 -7.924 -5.484 15.230 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -10.212 -4.197 13.729 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -10.276 -5.871 14.243 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -9.761 -5.035 16.620 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -10.015 -3.410 16.016 1.00 0.00 H new ATOM 2712 N PRO B 57 -7.128 -7.013 13.295 1.00 0.00 N ATOM 2713 CA PRO B 57 -6.663 -7.505 14.620 1.00 0.00 C ATOM 2714 C PRO B 57 -5.453 -6.702 15.165 1.00 0.00 C ATOM 2715 O PRO B 57 -4.618 -6.225 14.390 1.00 0.00 O ATOM 2716 CB PRO B 57 -6.284 -8.977 14.324 1.00 0.00 C ATOM 2717 CG PRO B 57 -5.805 -8.956 12.901 1.00 0.00 C ATOM 2718 CD PRO B 57 -6.657 -7.909 12.198 1.00 0.00 C ATOM 0 HA PRO B 57 -7.420 -7.396 15.396 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -5.506 -9.332 15.001 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -7.140 -9.641 14.446 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -4.747 -8.701 12.847 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -5.921 -9.934 12.434 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -6.078 -7.358 11.457 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -7.495 -8.367 11.672 1.00 0.00 H new ATOM 2726 N LYS B 58 -5.429 -6.504 16.498 1.00 0.00 N ATOM 2727 CA LYS B 58 -4.301 -5.867 17.210 1.00 0.00 C ATOM 2728 C LYS B 58 -2.954 -6.541 16.864 1.00 0.00 C ATOM 2729 O LYS B 58 -2.732 -7.720 17.175 1.00 0.00 O ATOM 2730 CB LYS B 58 -4.543 -5.868 18.749 1.00 0.00 C ATOM 2731 CG LYS B 58 -5.584 -4.839 19.247 1.00 0.00 C ATOM 2732 CD LYS B 58 -5.176 -3.371 18.968 1.00 0.00 C ATOM 2733 CE LYS B 58 -3.916 -2.925 19.726 1.00 0.00 C ATOM 2734 NZ LYS B 58 -4.116 -2.876 21.197 1.00 0.00 N ATOM 0 H LYS B 58 -6.193 -6.782 17.114 1.00 0.00 H new ATOM 0 HA LYS B 58 -4.245 -4.832 16.873 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -4.866 -6.864 19.050 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -3.595 -5.675 19.251 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -6.542 -5.040 18.767 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -5.731 -4.971 20.319 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -5.009 -3.247 17.898 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -6.004 -2.715 19.239 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -3.099 -3.609 19.498 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -3.614 -1.939 19.372 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -3.240 -2.553 21.656 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -4.888 -2.216 21.421 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -4.360 -3.825 21.546 1.00 0.00 H new ATOM 2748 N ALA B 59 -2.087 -5.764 16.198 1.00 0.00 N ATOM 2749 CA ALA B 59 -0.775 -6.214 15.715 1.00 0.00 C ATOM 2750 C ALA B 59 0.302 -5.206 16.145 1.00 0.00 C ATOM 2751 O ALA B 59 0.125 -3.989 16.000 1.00 0.00 O ATOM 2752 CB ALA B 59 -0.803 -6.379 14.189 1.00 0.00 C ATOM 0 H ALA B 59 -2.282 -4.788 15.976 1.00 0.00 H new ATOM 0 HA ALA B 59 -0.536 -7.184 16.152 1.00 0.00 H new ATOM 0 HB1 ALA B 59 0.175 -6.713 13.841 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -1.557 -7.118 13.917 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -1.047 -5.424 13.724 1.00 0.00 H new ATOM 2758 N SER B 60 1.406 -5.721 16.698 1.00 0.00 N ATOM 2759 CA SER B 60 2.531 -4.898 17.165 1.00 0.00 C ATOM 2760 C SER B 60 3.633 -4.879 16.089 1.00 0.00 C ATOM 2761 O SER B 60 4.508 -5.754 16.065 1.00 0.00 O ATOM 2762 CB SER B 60 3.050 -5.463 18.509 1.00 0.00 C ATOM 2763 OG SER B 60 2.011 -5.513 19.477 1.00 0.00 O ATOM 0 H SER B 60 1.546 -6.722 16.835 1.00 0.00 H new ATOM 0 HA SER B 60 2.209 -3.870 17.331 1.00 0.00 H new ATOM 0 HB2 SER B 60 3.456 -6.463 18.354 1.00 0.00 H new ATOM 0 HB3 SER B 60 3.866 -4.841 18.878 1.00 0.00 H new ATOM 0 HG SER B 60 2.363 -5.875 20.317 1.00 0.00 H new ATOM 2769 N VAL B 61 3.545 -3.899 15.164 1.00 0.00 N ATOM 2770 CA VAL B 61 4.485 -3.771 14.026 1.00 0.00 C ATOM 2771 C VAL B 61 4.547 -2.312 13.514 1.00 0.00 C ATOM 2772 O VAL B 61 3.519 -1.709 13.215 1.00 0.00 O ATOM 2773 CB VAL B 61 4.116 -4.770 12.849 1.00 0.00 C ATOM 2774 CG1 VAL B 61 2.619 -4.671 12.447 1.00 0.00 C ATOM 2775 CG2 VAL B 61 5.052 -4.593 11.615 1.00 0.00 C ATOM 0 H VAL B 61 2.825 -3.177 15.183 1.00 0.00 H new ATOM 0 HA VAL B 61 5.476 -4.043 14.391 1.00 0.00 H new ATOM 0 HB VAL B 61 4.279 -5.776 13.234 1.00 0.00 H new ATOM 0 HG11 VAL B 61 2.412 -5.372 11.638 1.00 0.00 H new ATOM 0 HG12 VAL B 61 1.995 -4.914 13.307 1.00 0.00 H new ATOM 0 HG13 VAL B 61 2.398 -3.657 12.113 1.00 0.00 H new ATOM 0 HG21 VAL B 61 4.762 -5.297 10.835 1.00 0.00 H new ATOM 0 HG22 VAL B 61 4.965 -3.575 11.236 1.00 0.00 H new ATOM 0 HG23 VAL B 61 6.084 -4.783 11.911 1.00 0.00 H new ATOM 2785 N THR B 62 5.778 -1.756 13.470 1.00 0.00 N ATOM 2786 CA THR B 62 6.106 -0.446 12.853 1.00 0.00 C ATOM 2787 C THR B 62 7.581 -0.474 12.386 1.00 0.00 C ATOM 2788 O THR B 62 8.277 -1.483 12.573 1.00 0.00 O ATOM 2789 CB THR B 62 5.879 0.770 13.840 1.00 0.00 C ATOM 2790 OG1 THR B 62 6.330 0.413 15.160 1.00 0.00 O ATOM 2791 CG2 THR B 62 4.410 1.243 13.899 1.00 0.00 C ATOM 0 H THR B 62 6.594 -2.216 13.873 1.00 0.00 H new ATOM 0 HA THR B 62 5.432 -0.295 12.009 1.00 0.00 H new ATOM 0 HB THR B 62 6.461 1.605 13.450 1.00 0.00 H new ATOM 0 HG1 THR B 62 6.190 1.168 15.769 1.00 0.00 H new ATOM 0 HG21 THR B 62 4.324 2.079 14.594 1.00 0.00 H new ATOM 0 HG22 THR B 62 4.090 1.562 12.907 1.00 0.00 H new ATOM 0 HG23 THR B 62 3.777 0.423 14.238 1.00 0.00 H new ATOM 2799 N GLY B 63 8.045 0.631 11.761 1.00 0.00 N ATOM 2800 CA GLY B 63 9.428 0.742 11.264 1.00 0.00 C ATOM 2801 C GLY B 63 9.550 0.379 9.786 1.00 0.00 C ATOM 2802 O GLY B 63 10.405 0.915 9.064 1.00 0.00 O ATOM 0 H GLY B 63 7.476 1.460 11.590 1.00 0.00 H new ATOM 0 HA2 GLY B 63 9.784 1.761 11.415 1.00 0.00 H new ATOM 0 HA3 GLY B 63 10.075 0.089 11.850 1.00 0.00 H new ATOM 2806 N GLY B 64 8.692 -0.550 9.355 1.00 0.00 N ATOM 2807 CA GLY B 64 8.632 -1.013 7.976 1.00 0.00 C ATOM 2808 C GLY B 64 7.329 -1.747 7.715 1.00 0.00 C ATOM 2809 O GLY B 64 6.446 -1.780 8.588 1.00 0.00 O ATOM 0 H GLY B 64 8.013 -1.004 9.966 1.00 0.00 H new ATOM 0 HA2 GLY B 64 8.720 -0.164 7.298 1.00 0.00 H new ATOM 0 HA3 GLY B 64 9.475 -1.673 7.771 1.00 0.00 H new ATOM 2813 N GLY B 65 7.214 -2.357 6.524 1.00 0.00 N ATOM 2814 CA GLY B 65 5.978 -3.020 6.107 1.00 0.00 C ATOM 2815 C GLY B 65 4.984 -2.017 5.530 1.00 0.00 C ATOM 2816 O GLY B 65 4.559 -1.087 6.228 1.00 0.00 O ATOM 0 H GLY B 65 7.966 -2.402 5.836 1.00 0.00 H new ATOM 0 HA2 GLY B 65 6.204 -3.782 5.361 1.00 0.00 H new ATOM 0 HA3 GLY B 65 5.530 -3.531 6.959 1.00 0.00 H new ATOM 2820 N GLY B 66 4.607 -2.214 4.259 1.00 0.00 N ATOM 2821 CA GLY B 66 3.764 -1.277 3.524 1.00 0.00 C ATOM 2822 C GLY B 66 4.529 -0.037 3.093 1.00 0.00 C ATOM 2823 O GLY B 66 5.145 0.649 3.923 1.00 0.00 O ATOM 0 H GLY B 66 4.882 -3.032 3.715 1.00 0.00 H new ATOM 0 HA2 GLY B 66 3.353 -1.773 2.645 1.00 0.00 H new ATOM 0 HA3 GLY B 66 2.920 -0.983 4.148 1.00 0.00 H new ATOM 2827 N GLU B 67 4.483 0.264 1.798 1.00 0.00 N ATOM 2828 CA GLU B 67 5.235 1.368 1.196 1.00 0.00 C ATOM 2829 C GLU B 67 4.326 2.190 0.282 1.00 0.00 C ATOM 2830 O GLU B 67 3.461 1.641 -0.417 1.00 0.00 O ATOM 2831 CB GLU B 67 6.478 0.813 0.446 1.00 0.00 C ATOM 2832 CG GLU B 67 6.219 -0.515 -0.281 1.00 0.00 C ATOM 2833 CD GLU B 67 7.472 -1.126 -0.905 1.00 0.00 C ATOM 2834 OE1 GLU B 67 7.848 -0.712 -2.021 1.00 0.00 O ATOM 2835 OE2 GLU B 67 8.108 -1.991 -0.273 1.00 0.00 O ATOM 0 H GLU B 67 3.917 -0.256 1.127 1.00 0.00 H new ATOM 0 HA GLU B 67 5.595 2.037 1.978 1.00 0.00 H new ATOM 0 HB2 GLU B 67 6.815 1.554 -0.279 1.00 0.00 H new ATOM 0 HB3 GLU B 67 7.290 0.674 1.160 1.00 0.00 H new ATOM 0 HG2 GLU B 67 5.790 -1.227 0.424 1.00 0.00 H new ATOM 0 HG3 GLU B 67 5.476 -0.353 -1.062 1.00 0.00 H new ATOM 2842 N LEU B 68 4.549 3.510 0.281 1.00 0.00 N ATOM 2843 CA LEU B 68 3.721 4.469 -0.448 1.00 0.00 C ATOM 2844 C LEU B 68 4.534 4.981 -1.638 1.00 0.00 C ATOM 2845 O LEU B 68 5.486 5.743 -1.435 1.00 0.00 O ATOM 2846 CB LEU B 68 3.280 5.628 0.488 1.00 0.00 C ATOM 2847 CG LEU B 68 2.291 6.669 -0.127 1.00 0.00 C ATOM 2848 CD1 LEU B 68 0.984 5.996 -0.609 1.00 0.00 C ATOM 2849 CD2 LEU B 68 2.006 7.819 0.867 1.00 0.00 C ATOM 0 H LEU B 68 5.318 3.943 0.792 1.00 0.00 H new ATOM 0 HA LEU B 68 2.809 3.993 -0.810 1.00 0.00 H new ATOM 0 HB2 LEU B 68 2.816 5.196 1.374 1.00 0.00 H new ATOM 0 HB3 LEU B 68 4.172 6.158 0.822 1.00 0.00 H new ATOM 0 HG LEU B 68 2.770 7.102 -1.005 1.00 0.00 H new ATOM 0 HD11 LEU B 68 0.320 6.751 -1.031 1.00 0.00 H new ATOM 0 HD12 LEU B 68 1.217 5.252 -1.370 1.00 0.00 H new ATOM 0 HD13 LEU B 68 0.492 5.511 0.234 1.00 0.00 H new ATOM 0 HD21 LEU B 68 1.315 8.529 0.413 1.00 0.00 H new ATOM 0 HD22 LEU B 68 1.564 7.413 1.776 1.00 0.00 H new ATOM 0 HD23 LEU B 68 2.939 8.327 1.113 1.00 0.00 H new ATOM 2861 N ALA B 69 4.229 4.511 -2.850 1.00 0.00 N ATOM 2862 CA ALA B 69 5.068 4.794 -4.025 1.00 0.00 C ATOM 2863 C ALA B 69 4.647 6.116 -4.694 1.00 0.00 C ATOM 2864 O ALA B 69 3.519 6.257 -5.176 1.00 0.00 O ATOM 2865 CB ALA B 69 5.036 3.610 -4.999 1.00 0.00 C ATOM 0 H ALA B 69 3.411 3.934 -3.047 1.00 0.00 H new ATOM 0 HA ALA B 69 6.101 4.921 -3.701 1.00 0.00 H new ATOM 0 HB1 ALA B 69 5.661 3.833 -5.864 1.00 0.00 H new ATOM 0 HB2 ALA B 69 5.413 2.718 -4.499 1.00 0.00 H new ATOM 0 HB3 ALA B 69 4.011 3.436 -5.327 1.00 0.00 H new ATOM 2871 N PHE B 70 5.571 7.085 -4.695 1.00 0.00 N ATOM 2872 CA PHE B 70 5.383 8.410 -5.288 1.00 0.00 C ATOM 2873 C PHE B 70 6.004 8.387 -6.691 1.00 0.00 C ATOM 2874 O PHE B 70 7.224 8.227 -6.836 1.00 0.00 O ATOM 2875 CB PHE B 70 6.090 9.504 -4.443 1.00 0.00 C ATOM 2876 CG PHE B 70 5.505 9.828 -3.067 1.00 0.00 C ATOM 2877 CD1 PHE B 70 5.446 8.872 -2.053 1.00 0.00 C ATOM 2878 CD2 PHE B 70 5.067 11.120 -2.769 1.00 0.00 C ATOM 2879 CE1 PHE B 70 4.968 9.189 -0.799 1.00 0.00 C ATOM 2880 CE2 PHE B 70 4.582 11.430 -1.519 1.00 0.00 C ATOM 2881 CZ PHE B 70 4.534 10.466 -0.532 1.00 0.00 C ATOM 0 H PHE B 70 6.491 6.964 -4.273 1.00 0.00 H new ATOM 0 HA PHE B 70 4.319 8.642 -5.326 1.00 0.00 H new ATOM 0 HB2 PHE B 70 7.128 9.202 -4.303 1.00 0.00 H new ATOM 0 HB3 PHE B 70 6.102 10.424 -5.028 1.00 0.00 H new ATOM 0 HD1 PHE B 70 5.781 7.865 -2.254 1.00 0.00 H new ATOM 0 HD2 PHE B 70 5.109 11.886 -3.529 1.00 0.00 H new ATOM 0 HE1 PHE B 70 4.935 8.435 -0.027 1.00 0.00 H new ATOM 0 HE2 PHE B 70 4.237 12.432 -1.309 1.00 0.00 H new ATOM 0 HZ PHE B 70 4.156 10.715 0.449 1.00 0.00 H new ATOM 2891 N ARG B 71 5.158 8.491 -7.714 1.00 0.00 N ATOM 2892 CA ARG B 71 5.594 8.470 -9.116 1.00 0.00 C ATOM 2893 C ARG B 71 5.882 9.879 -9.638 1.00 0.00 C ATOM 2894 O ARG B 71 5.132 10.830 -9.363 1.00 0.00 O ATOM 2895 CB ARG B 71 4.506 7.832 -10.004 1.00 0.00 C ATOM 2896 CG ARG B 71 4.100 6.399 -9.604 1.00 0.00 C ATOM 2897 CD ARG B 71 3.465 5.631 -10.771 1.00 0.00 C ATOM 2898 NE ARG B 71 2.262 6.288 -11.294 1.00 0.00 N ATOM 2899 CZ ARG B 71 1.874 6.317 -12.578 1.00 0.00 C ATOM 2900 NH1 ARG B 71 2.675 5.903 -13.556 1.00 0.00 N ATOM 2901 NH2 ARG B 71 0.683 6.825 -12.876 1.00 0.00 N ATOM 0 H ARG B 71 4.150 8.592 -7.598 1.00 0.00 H new ATOM 0 HA ARG B 71 6.511 7.882 -9.159 1.00 0.00 H new ATOM 0 HB2 ARG B 71 3.619 8.466 -9.979 1.00 0.00 H new ATOM 0 HB3 ARG B 71 4.860 7.819 -11.035 1.00 0.00 H new ATOM 0 HG2 ARG B 71 4.979 5.859 -9.251 1.00 0.00 H new ATOM 0 HG3 ARG B 71 3.396 6.441 -8.773 1.00 0.00 H new ATOM 0 HD2 ARG B 71 4.196 5.528 -11.573 1.00 0.00 H new ATOM 0 HD3 ARG B 71 3.210 4.624 -10.442 1.00 0.00 H new ATOM 0 HE ARG B 71 1.666 6.767 -10.619 1.00 0.00 H new ATOM 0 HH11 ARG B 71 3.608 5.553 -13.338 1.00 0.00 H new ATOM 0 HH12 ARG B 71 2.356 5.935 -14.524 1.00 0.00 H new ATOM 0 HH21 ARG B 71 0.082 7.184 -12.134 1.00 0.00 H new ATOM 0 HH22 ARG B 71 0.370 6.856 -13.846 1.00 0.00 H new ATOM 2915 N VAL B 72 7.023 9.997 -10.350 1.00 0.00 N ATOM 2916 CA VAL B 72 7.471 11.254 -10.954 1.00 0.00 C ATOM 2917 C VAL B 72 8.081 11.014 -12.347 1.00 0.00 C ATOM 2918 O VAL B 72 8.255 9.868 -12.776 1.00 0.00 O ATOM 2919 CB VAL B 72 8.498 11.977 -9.998 1.00 0.00 C ATOM 2920 CG1 VAL B 72 9.966 11.502 -10.180 1.00 0.00 C ATOM 2921 CG2 VAL B 72 8.327 13.501 -10.048 1.00 0.00 C ATOM 0 H VAL B 72 7.656 9.215 -10.518 1.00 0.00 H new ATOM 0 HA VAL B 72 6.606 11.903 -11.086 1.00 0.00 H new ATOM 0 HB VAL B 72 8.252 11.668 -8.982 1.00 0.00 H new ATOM 0 HG11 VAL B 72 10.612 12.044 -9.489 1.00 0.00 H new ATOM 0 HG12 VAL B 72 10.031 10.433 -9.975 1.00 0.00 H new ATOM 0 HG13 VAL B 72 10.287 11.695 -11.204 1.00 0.00 H new ATOM 0 HG21 VAL B 72 9.048 13.970 -9.379 1.00 0.00 H new ATOM 0 HG22 VAL B 72 8.494 13.853 -11.066 1.00 0.00 H new ATOM 0 HG23 VAL B 72 7.317 13.764 -9.734 1.00 0.00 H new ATOM 2931 N GLU B 73 8.387 12.119 -13.035 1.00 0.00 N ATOM 2932 CA GLU B 73 8.806 12.097 -14.445 1.00 0.00 C ATOM 2933 C GLU B 73 10.256 11.598 -14.656 1.00 0.00 C ATOM 2934 O GLU B 73 10.480 10.762 -15.539 1.00 0.00 O ATOM 2935 CB GLU B 73 8.606 13.489 -15.104 1.00 0.00 C ATOM 2936 CG GLU B 73 9.339 14.653 -14.422 1.00 0.00 C ATOM 2937 CD GLU B 73 9.297 15.948 -15.242 1.00 0.00 C ATOM 2938 OE1 GLU B 73 10.178 16.134 -16.110 1.00 0.00 O ATOM 2939 OE2 GLU B 73 8.381 16.777 -15.036 1.00 0.00 O ATOM 0 H GLU B 73 8.352 13.055 -12.632 1.00 0.00 H new ATOM 0 HA GLU B 73 8.160 11.370 -14.936 1.00 0.00 H new ATOM 0 HB2 GLU B 73 8.937 13.432 -16.141 1.00 0.00 H new ATOM 0 HB3 GLU B 73 7.540 13.714 -15.121 1.00 0.00 H new ATOM 0 HG2 GLU B 73 8.893 14.834 -13.444 1.00 0.00 H new ATOM 0 HG3 GLU B 73 10.378 14.371 -14.251 1.00 0.00 H new ATOM 2946 N ASN B 74 11.236 12.080 -13.847 1.00 0.00 N ATOM 2947 CA ASN B 74 12.658 11.716 -14.053 1.00 0.00 C ATOM 2948 C ASN B 74 13.494 11.890 -12.778 1.00 0.00 C ATOM 2949 O ASN B 74 13.005 12.393 -11.759 1.00 0.00 O ATOM 2950 CB ASN B 74 13.288 12.539 -15.219 1.00 0.00 C ATOM 2951 CG ASN B 74 13.637 13.987 -14.845 1.00 0.00 C ATOM 2952 OD1 ASN B 74 14.762 14.279 -14.442 1.00 0.00 O ATOM 2953 ND2 ASN B 74 12.686 14.900 -14.966 1.00 0.00 N ATOM 0 H ASN B 74 11.070 12.709 -13.062 1.00 0.00 H new ATOM 0 HA ASN B 74 12.671 10.659 -14.318 1.00 0.00 H new ATOM 0 HB2 ASN B 74 14.192 12.034 -15.559 1.00 0.00 H new ATOM 0 HB3 ASN B 74 12.594 12.549 -16.059 1.00 0.00 H new ATOM 0 HD21 ASN B 74 12.878 15.872 -14.723 1.00 0.00 H new ATOM 0 HD22 ASN B 74 11.761 14.632 -15.303 1.00 0.00 H new ATOM 2960 N ASP B 75 14.774 11.470 -12.893 1.00 0.00 N ATOM 2961 CA ASP B 75 15.705 11.256 -11.766 1.00 0.00 C ATOM 2962 C ASP B 75 15.918 12.524 -10.937 1.00 0.00 C ATOM 2963 O ASP B 75 16.133 12.460 -9.718 1.00 0.00 O ATOM 2964 CB ASP B 75 17.064 10.715 -12.293 1.00 0.00 C ATOM 2965 CG ASP B 75 17.834 11.725 -13.171 1.00 0.00 C ATOM 2966 OD1 ASP B 75 17.343 12.065 -14.270 1.00 0.00 O ATOM 2967 OD2 ASP B 75 18.931 12.181 -12.780 1.00 0.00 O ATOM 0 H ASP B 75 15.198 11.265 -13.798 1.00 0.00 H new ATOM 0 HA ASP B 75 15.252 10.517 -11.105 1.00 0.00 H new ATOM 0 HB2 ASP B 75 17.688 10.435 -11.444 1.00 0.00 H new ATOM 0 HB3 ASP B 75 16.885 9.808 -12.870 1.00 0.00 H new ATOM 2972 N ALA B 76 15.850 13.673 -11.630 1.00 0.00 N ATOM 2973 CA ALA B 76 16.077 14.987 -11.031 1.00 0.00 C ATOM 2974 C ALA B 76 14.981 15.304 -10.014 1.00 0.00 C ATOM 2975 O ALA B 76 15.274 15.720 -8.901 1.00 0.00 O ATOM 2976 CB ALA B 76 16.132 16.073 -12.113 1.00 0.00 C ATOM 0 H ALA B 76 15.635 13.710 -12.626 1.00 0.00 H new ATOM 0 HA ALA B 76 17.037 14.968 -10.515 1.00 0.00 H new ATOM 0 HB1 ALA B 76 16.302 17.043 -11.646 1.00 0.00 H new ATOM 0 HB2 ALA B 76 16.946 15.856 -12.805 1.00 0.00 H new ATOM 0 HB3 ALA B 76 15.188 16.092 -12.657 1.00 0.00 H new ATOM 2982 N GLN B 77 13.720 15.032 -10.409 1.00 0.00 N ATOM 2983 CA GLN B 77 12.538 15.261 -9.560 1.00 0.00 C ATOM 2984 C GLN B 77 12.534 14.370 -8.294 1.00 0.00 C ATOM 2985 O GLN B 77 11.961 14.750 -7.275 1.00 0.00 O ATOM 2986 CB GLN B 77 11.253 15.002 -10.376 1.00 0.00 C ATOM 2987 CG GLN B 77 10.938 16.011 -11.499 1.00 0.00 C ATOM 2988 CD GLN B 77 10.436 17.374 -11.001 1.00 0.00 C ATOM 2989 OE1 GLN B 77 9.836 17.483 -9.927 1.00 0.00 O ATOM 2990 NE2 GLN B 77 10.649 18.416 -11.789 1.00 0.00 N ATOM 0 H GLN B 77 13.495 14.647 -11.327 1.00 0.00 H new ATOM 0 HA GLN B 77 12.575 16.299 -9.229 1.00 0.00 H new ATOM 0 HB2 GLN B 77 11.324 14.009 -10.819 1.00 0.00 H new ATOM 0 HB3 GLN B 77 10.409 14.983 -9.687 1.00 0.00 H new ATOM 0 HG2 GLN B 77 11.837 16.164 -12.097 1.00 0.00 H new ATOM 0 HG3 GLN B 77 10.186 15.579 -12.159 1.00 0.00 H new ATOM 0 HE21 GLN B 77 11.148 18.295 -12.670 1.00 0.00 H new ATOM 0 HE22 GLN B 77 10.314 19.340 -11.515 1.00 0.00 H new ATOM 2999 N VAL B 78 13.227 13.213 -8.369 1.00 0.00 N ATOM 3000 CA VAL B 78 13.412 12.302 -7.215 1.00 0.00 C ATOM 3001 C VAL B 78 14.385 12.938 -6.200 1.00 0.00 C ATOM 3002 O VAL B 78 14.177 12.865 -4.980 1.00 0.00 O ATOM 3003 CB VAL B 78 13.966 10.896 -7.673 1.00 0.00 C ATOM 3004 CG1 VAL B 78 14.172 9.924 -6.481 1.00 0.00 C ATOM 3005 CG2 VAL B 78 13.053 10.260 -8.740 1.00 0.00 C ATOM 0 H VAL B 78 13.672 12.884 -9.226 1.00 0.00 H new ATOM 0 HA VAL B 78 12.439 12.147 -6.748 1.00 0.00 H new ATOM 0 HB VAL B 78 14.946 11.076 -8.116 1.00 0.00 H new ATOM 0 HG11 VAL B 78 14.554 8.972 -6.850 1.00 0.00 H new ATOM 0 HG12 VAL B 78 14.887 10.355 -5.780 1.00 0.00 H new ATOM 0 HG13 VAL B 78 13.220 9.762 -5.975 1.00 0.00 H new ATOM 0 HG21 VAL B 78 13.459 9.293 -9.037 1.00 0.00 H new ATOM 0 HG22 VAL B 78 12.053 10.123 -8.328 1.00 0.00 H new ATOM 0 HG23 VAL B 78 13.001 10.914 -9.611 1.00 0.00 H new ATOM 3015 N ASP B 79 15.431 13.593 -6.746 1.00 0.00 N ATOM 3016 CA ASP B 79 16.477 14.280 -5.971 1.00 0.00 C ATOM 3017 C ASP B 79 15.914 15.555 -5.314 1.00 0.00 C ATOM 3018 O ASP B 79 16.339 15.940 -4.216 1.00 0.00 O ATOM 3019 CB ASP B 79 17.669 14.613 -6.914 1.00 0.00 C ATOM 3020 CG ASP B 79 18.809 15.389 -6.225 1.00 0.00 C ATOM 3021 OD1 ASP B 79 19.654 14.761 -5.550 1.00 0.00 O ATOM 3022 OD2 ASP B 79 18.863 16.630 -6.348 1.00 0.00 O ATOM 0 H ASP B 79 15.572 13.658 -7.754 1.00 0.00 H new ATOM 0 HA ASP B 79 16.828 13.629 -5.171 1.00 0.00 H new ATOM 0 HB2 ASP B 79 18.069 13.684 -7.321 1.00 0.00 H new ATOM 0 HB3 ASP B 79 17.301 15.198 -7.757 1.00 0.00 H new ATOM 3027 N GLU B 80 14.946 16.194 -5.995 1.00 0.00 N ATOM 3028 CA GLU B 80 14.236 17.376 -5.468 1.00 0.00 C ATOM 3029 C GLU B 80 13.410 16.977 -4.239 1.00 0.00 C ATOM 3030 O GLU B 80 13.365 17.688 -3.231 1.00 0.00 O ATOM 3031 CB GLU B 80 13.336 18.014 -6.555 1.00 0.00 C ATOM 3032 CG GLU B 80 14.092 18.355 -7.852 1.00 0.00 C ATOM 3033 CD GLU B 80 13.305 19.205 -8.856 1.00 0.00 C ATOM 3034 OE1 GLU B 80 12.749 20.243 -8.451 1.00 0.00 O ATOM 3035 OE2 GLU B 80 13.264 18.863 -10.062 1.00 0.00 O ATOM 0 H GLU B 80 14.634 15.908 -6.923 1.00 0.00 H new ATOM 0 HA GLU B 80 14.972 18.124 -5.171 1.00 0.00 H new ATOM 0 HB2 GLU B 80 12.520 17.330 -6.788 1.00 0.00 H new ATOM 0 HB3 GLU B 80 12.886 18.923 -6.156 1.00 0.00 H new ATOM 0 HG2 GLU B 80 15.009 18.883 -7.592 1.00 0.00 H new ATOM 0 HG3 GLU B 80 14.387 17.425 -8.338 1.00 0.00 H new ATOM 3042 N THR B 81 12.779 15.795 -4.360 1.00 0.00 N ATOM 3043 CA THR B 81 11.941 15.212 -3.313 1.00 0.00 C ATOM 3044 C THR B 81 12.802 14.720 -2.132 1.00 0.00 C ATOM 3045 O THR B 81 12.350 14.737 -0.990 1.00 0.00 O ATOM 3046 CB THR B 81 11.087 14.042 -3.894 1.00 0.00 C ATOM 3047 OG1 THR B 81 10.469 14.456 -5.114 1.00 0.00 O ATOM 3048 CG2 THR B 81 9.984 13.597 -2.935 1.00 0.00 C ATOM 0 H THR B 81 12.841 15.217 -5.198 1.00 0.00 H new ATOM 0 HA THR B 81 11.268 15.984 -2.941 1.00 0.00 H new ATOM 0 HB THR B 81 11.766 13.205 -4.057 1.00 0.00 H new ATOM 0 HG1 THR B 81 11.118 14.398 -5.846 1.00 0.00 H new ATOM 0 HG21 THR B 81 9.418 12.781 -3.385 1.00 0.00 H new ATOM 0 HG22 THR B 81 10.430 13.257 -2.000 1.00 0.00 H new ATOM 0 HG23 THR B 81 9.316 14.435 -2.735 1.00 0.00 H new ATOM 3056 N PHE B 82 14.059 14.315 -2.426 1.00 0.00 N ATOM 3057 CA PHE B 82 15.041 13.907 -1.403 1.00 0.00 C ATOM 3058 C PHE B 82 15.293 15.081 -0.435 1.00 0.00 C ATOM 3059 O PHE B 82 14.988 15.010 0.757 1.00 0.00 O ATOM 3060 CB PHE B 82 16.365 13.435 -2.080 1.00 0.00 C ATOM 3061 CG PHE B 82 17.471 12.983 -1.110 1.00 0.00 C ATOM 3062 CD1 PHE B 82 18.329 13.910 -0.503 1.00 0.00 C ATOM 3063 CD2 PHE B 82 17.648 11.638 -0.793 1.00 0.00 C ATOM 3064 CE1 PHE B 82 19.308 13.510 0.373 1.00 0.00 C ATOM 3065 CE2 PHE B 82 18.633 11.239 0.088 1.00 0.00 C ATOM 3066 CZ PHE B 82 19.461 12.175 0.670 1.00 0.00 C ATOM 0 H PHE B 82 14.418 14.263 -3.379 1.00 0.00 H new ATOM 0 HA PHE B 82 14.645 13.067 -0.832 1.00 0.00 H new ATOM 0 HB2 PHE B 82 16.136 12.610 -2.754 1.00 0.00 H new ATOM 0 HB3 PHE B 82 16.752 14.249 -2.693 1.00 0.00 H new ATOM 0 HD1 PHE B 82 18.218 14.960 -0.729 1.00 0.00 H new ATOM 0 HD2 PHE B 82 17.005 10.896 -1.243 1.00 0.00 H new ATOM 0 HE1 PHE B 82 19.958 14.243 0.829 1.00 0.00 H new ATOM 0 HE2 PHE B 82 18.755 10.192 0.322 1.00 0.00 H new ATOM 0 HZ PHE B 82 20.230 11.860 1.360 1.00 0.00 H new ATOM 3076 N ALA B 83 15.796 16.185 -1.013 1.00 0.00 N ATOM 3077 CA ALA B 83 16.209 17.385 -0.261 1.00 0.00 C ATOM 3078 C ALA B 83 15.006 18.087 0.395 1.00 0.00 C ATOM 3079 O ALA B 83 15.114 18.610 1.514 1.00 0.00 O ATOM 3080 CB ALA B 83 16.957 18.349 -1.195 1.00 0.00 C ATOM 0 H ALA B 83 15.929 16.272 -2.021 1.00 0.00 H new ATOM 0 HA ALA B 83 16.876 17.072 0.542 1.00 0.00 H new ATOM 0 HB1 ALA B 83 17.261 19.234 -0.637 1.00 0.00 H new ATOM 0 HB2 ALA B 83 17.840 17.853 -1.598 1.00 0.00 H new ATOM 0 HB3 ALA B 83 16.301 18.644 -2.014 1.00 0.00 H new ATOM 3086 N GLY B 84 13.871 18.081 -0.325 1.00 0.00 N ATOM 3087 CA GLY B 84 12.612 18.651 0.159 1.00 0.00 C ATOM 3088 C GLY B 84 12.082 17.978 1.428 1.00 0.00 C ATOM 3089 O GLY B 84 11.785 18.662 2.410 1.00 0.00 O ATOM 0 H GLY B 84 13.806 17.679 -1.260 1.00 0.00 H new ATOM 0 HA2 GLY B 84 12.755 19.714 0.354 1.00 0.00 H new ATOM 0 HA3 GLY B 84 11.860 18.570 -0.626 1.00 0.00 H new ATOM 3093 N TRP B 85 12.003 16.631 1.404 1.00 0.00 N ATOM 3094 CA TRP B 85 11.557 15.820 2.569 1.00 0.00 C ATOM 3095 C TRP B 85 12.527 15.994 3.738 1.00 0.00 C ATOM 3096 O TRP B 85 12.094 16.089 4.895 1.00 0.00 O ATOM 3097 CB TRP B 85 11.431 14.332 2.172 1.00 0.00 C ATOM 3098 CG TRP B 85 10.255 14.012 1.281 1.00 0.00 C ATOM 3099 CD1 TRP B 85 9.442 14.884 0.596 1.00 0.00 C ATOM 3100 CD2 TRP B 85 9.769 12.703 0.980 1.00 0.00 C ATOM 3101 NE1 TRP B 85 8.470 14.188 -0.071 1.00 0.00 N ATOM 3102 CE2 TRP B 85 8.657 12.849 0.139 1.00 0.00 C ATOM 3103 CE3 TRP B 85 10.169 11.425 1.348 1.00 0.00 C ATOM 3104 CZ2 TRP B 85 7.939 11.764 -0.333 1.00 0.00 C ATOM 3105 CZ3 TRP B 85 9.463 10.346 0.871 1.00 0.00 C ATOM 3106 CH2 TRP B 85 8.351 10.520 0.045 1.00 0.00 C ATOM 0 H TRP B 85 12.244 16.073 0.585 1.00 0.00 H new ATOM 0 HA TRP B 85 10.575 16.170 2.886 1.00 0.00 H new ATOM 0 HB2 TRP B 85 12.347 14.027 1.665 1.00 0.00 H new ATOM 0 HB3 TRP B 85 11.355 13.733 3.080 1.00 0.00 H new ATOM 0 HD1 TRP B 85 9.554 15.958 0.586 1.00 0.00 H new ATOM 0 HE1 TRP B 85 7.726 14.601 -0.634 1.00 0.00 H new ATOM 0 HE3 TRP B 85 11.020 11.281 1.998 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 7.083 11.898 -0.978 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 9.774 9.347 1.140 1.00 0.00 H new ATOM 0 HH2 TRP B 85 7.807 9.654 -0.301 1.00 0.00 H new ATOM 3117 N LYS B 86 13.833 15.972 3.431 1.00 0.00 N ATOM 3118 CA LYS B 86 14.911 16.124 4.425 1.00 0.00 C ATOM 3119 C LYS B 86 14.721 17.422 5.237 1.00 0.00 C ATOM 3120 O LYS B 86 14.752 17.414 6.474 1.00 0.00 O ATOM 3121 CB LYS B 86 16.272 16.093 3.684 1.00 0.00 C ATOM 3122 CG LYS B 86 17.515 16.348 4.552 1.00 0.00 C ATOM 3123 CD LYS B 86 18.843 16.131 3.780 1.00 0.00 C ATOM 3124 CE LYS B 86 18.892 16.863 2.420 1.00 0.00 C ATOM 3125 NZ LYS B 86 20.225 16.767 1.776 1.00 0.00 N ATOM 0 H LYS B 86 14.175 15.847 2.478 1.00 0.00 H new ATOM 0 HA LYS B 86 14.884 15.303 5.141 1.00 0.00 H new ATOM 0 HB2 LYS B 86 16.381 15.120 3.205 1.00 0.00 H new ATOM 0 HB3 LYS B 86 16.248 16.839 2.889 1.00 0.00 H new ATOM 0 HG2 LYS B 86 17.484 17.369 4.932 1.00 0.00 H new ATOM 0 HG3 LYS B 86 17.491 15.685 5.417 1.00 0.00 H new ATOM 0 HD2 LYS B 86 19.673 16.473 4.398 1.00 0.00 H new ATOM 0 HD3 LYS B 86 18.988 15.063 3.614 1.00 0.00 H new ATOM 0 HE2 LYS B 86 18.139 16.440 1.755 1.00 0.00 H new ATOM 0 HE3 LYS B 86 18.636 17.912 2.565 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 20.139 16.992 0.764 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 20.877 17.440 2.226 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 20.595 15.801 1.885 1.00 0.00 H new ATOM 3139 N ALA B 87 14.462 18.511 4.507 1.00 0.00 N ATOM 3140 CA ALA B 87 14.213 19.842 5.080 1.00 0.00 C ATOM 3141 C ALA B 87 12.792 19.976 5.678 1.00 0.00 C ATOM 3142 O ALA B 87 12.521 20.908 6.443 1.00 0.00 O ATOM 3143 CB ALA B 87 14.431 20.900 3.995 1.00 0.00 C ATOM 0 H ALA B 87 14.418 18.495 3.488 1.00 0.00 H new ATOM 0 HA ALA B 87 14.913 19.989 5.902 1.00 0.00 H new ATOM 0 HB1 ALA B 87 14.248 21.891 4.411 1.00 0.00 H new ATOM 0 HB2 ALA B 87 15.457 20.842 3.632 1.00 0.00 H new ATOM 0 HB3 ALA B 87 13.743 20.721 3.169 1.00 0.00 H new ATOM 3149 N SER B 88 11.899 19.034 5.318 1.00 0.00 N ATOM 3150 CA SER B 88 10.507 18.977 5.821 1.00 0.00 C ATOM 3151 C SER B 88 10.381 18.084 7.082 1.00 0.00 C ATOM 3152 O SER B 88 9.292 17.948 7.657 1.00 0.00 O ATOM 3153 CB SER B 88 9.563 18.453 4.701 1.00 0.00 C ATOM 3154 OG SER B 88 8.192 18.469 5.092 1.00 0.00 O ATOM 0 H SER B 88 12.122 18.283 4.664 1.00 0.00 H new ATOM 0 HA SER B 88 10.216 19.988 6.106 1.00 0.00 H new ATOM 0 HB2 SER B 88 9.690 19.064 3.808 1.00 0.00 H new ATOM 0 HB3 SER B 88 9.850 17.436 4.435 1.00 0.00 H new ATOM 0 HG SER B 88 8.120 18.239 6.042 1.00 0.00 H new ATOM 3160 N GLY B 89 11.519 17.480 7.495 1.00 0.00 N ATOM 3161 CA GLY B 89 11.618 16.764 8.769 1.00 0.00 C ATOM 3162 C GLY B 89 11.403 15.259 8.658 1.00 0.00 C ATOM 3163 O GLY B 89 10.688 14.668 9.480 1.00 0.00 O ATOM 0 H GLY B 89 12.383 17.480 6.953 1.00 0.00 H new ATOM 0 HA2 GLY B 89 12.602 16.948 9.201 1.00 0.00 H new ATOM 0 HA3 GLY B 89 10.883 17.175 9.462 1.00 0.00 H new ATOM 3167 N VAL B 90 12.005 14.635 7.629 1.00 0.00 N ATOM 3168 CA VAL B 90 12.031 13.162 7.485 1.00 0.00 C ATOM 3169 C VAL B 90 13.385 12.634 8.024 1.00 0.00 C ATOM 3170 O VAL B 90 14.385 13.363 7.983 1.00 0.00 O ATOM 3171 CB VAL B 90 11.782 12.727 5.978 1.00 0.00 C ATOM 3172 CG1 VAL B 90 13.069 12.757 5.117 1.00 0.00 C ATOM 3173 CG2 VAL B 90 11.077 11.357 5.880 1.00 0.00 C ATOM 0 H VAL B 90 12.485 15.130 6.877 1.00 0.00 H new ATOM 0 HA VAL B 90 11.222 12.722 8.068 1.00 0.00 H new ATOM 0 HB VAL B 90 11.111 13.478 5.562 1.00 0.00 H new ATOM 0 HG11 VAL B 90 12.833 12.450 4.098 1.00 0.00 H new ATOM 0 HG12 VAL B 90 13.476 13.768 5.106 1.00 0.00 H new ATOM 0 HG13 VAL B 90 13.806 12.074 5.540 1.00 0.00 H new ATOM 0 HG21 VAL B 90 10.927 11.099 4.832 1.00 0.00 H new ATOM 0 HG22 VAL B 90 11.694 10.595 6.356 1.00 0.00 H new ATOM 0 HG23 VAL B 90 10.111 11.408 6.383 1.00 0.00 H new ATOM 3183 N ALA B 91 13.408 11.392 8.550 1.00 0.00 N ATOM 3184 CA ALA B 91 14.627 10.793 9.157 1.00 0.00 C ATOM 3185 C ALA B 91 15.727 10.534 8.100 1.00 0.00 C ATOM 3186 O ALA B 91 16.923 10.674 8.401 1.00 0.00 O ATOM 3187 CB ALA B 91 14.273 9.503 9.909 1.00 0.00 C ATOM 0 H ALA B 91 12.594 10.777 8.569 1.00 0.00 H new ATOM 0 HA ALA B 91 15.030 11.512 9.871 1.00 0.00 H new ATOM 0 HB1 ALA B 91 15.176 9.078 10.347 1.00 0.00 H new ATOM 0 HB2 ALA B 91 13.557 9.728 10.700 1.00 0.00 H new ATOM 0 HB3 ALA B 91 13.834 8.786 9.215 1.00 0.00 H new ATOM 3193 N MET B 92 15.301 10.136 6.878 1.00 0.00 N ATOM 3194 CA MET B 92 16.177 10.082 5.678 1.00 0.00 C ATOM 3195 C MET B 92 17.310 9.022 5.791 1.00 0.00 C ATOM 3196 O MET B 92 18.429 9.339 6.219 1.00 0.00 O ATOM 3197 CB MET B 92 16.758 11.498 5.359 1.00 0.00 C ATOM 3198 CG MET B 92 17.628 11.567 4.096 1.00 0.00 C ATOM 3199 SD MET B 92 16.697 11.128 2.620 1.00 0.00 S ATOM 3200 CE MET B 92 15.599 12.532 2.477 1.00 0.00 C ATOM 0 H MET B 92 14.342 9.843 6.694 1.00 0.00 H new ATOM 0 HA MET B 92 15.549 9.761 4.847 1.00 0.00 H new ATOM 0 HB2 MET B 92 15.930 12.199 5.252 1.00 0.00 H new ATOM 0 HB3 MET B 92 17.351 11.832 6.210 1.00 0.00 H new ATOM 0 HG2 MET B 92 18.030 12.574 3.986 1.00 0.00 H new ATOM 0 HG3 MET B 92 18.479 10.894 4.203 1.00 0.00 H new ATOM 0 HE1 MET B 92 14.565 12.192 2.531 1.00 0.00 H new ATOM 0 HE2 MET B 92 15.794 13.231 3.290 1.00 0.00 H new ATOM 0 HE3 MET B 92 15.768 13.030 1.522 1.00 0.00 H new ATOM 3210 N LEU B 93 17.000 7.741 5.479 1.00 0.00 N ATOM 3211 CA LEU B 93 18.027 6.670 5.400 1.00 0.00 C ATOM 3212 C LEU B 93 17.850 5.816 4.112 1.00 0.00 C ATOM 3213 O LEU B 93 17.205 4.754 4.122 1.00 0.00 O ATOM 3214 CB LEU B 93 18.101 5.780 6.713 1.00 0.00 C ATOM 3215 CG LEU B 93 16.803 5.556 7.582 1.00 0.00 C ATOM 3216 CD1 LEU B 93 16.455 6.791 8.433 1.00 0.00 C ATOM 3217 CD2 LEU B 93 15.595 5.108 6.733 1.00 0.00 C ATOM 0 H LEU B 93 16.052 7.423 5.278 1.00 0.00 H new ATOM 0 HA LEU B 93 18.995 7.166 5.334 1.00 0.00 H new ATOM 0 HB2 LEU B 93 18.469 4.797 6.419 1.00 0.00 H new ATOM 0 HB3 LEU B 93 18.856 6.222 7.364 1.00 0.00 H new ATOM 0 HG LEU B 93 17.036 4.740 8.266 1.00 0.00 H new ATOM 0 HD11 LEU B 93 15.555 6.591 9.014 1.00 0.00 H new ATOM 0 HD12 LEU B 93 17.281 7.012 9.109 1.00 0.00 H new ATOM 0 HD13 LEU B 93 16.282 7.646 7.780 1.00 0.00 H new ATOM 0 HD21 LEU B 93 14.728 4.968 7.379 1.00 0.00 H new ATOM 0 HD22 LEU B 93 15.372 5.871 5.987 1.00 0.00 H new ATOM 0 HD23 LEU B 93 15.830 4.169 6.233 1.00 0.00 H new ATOM 3229 N GLN B 94 18.461 6.315 3.021 1.00 0.00 N ATOM 3230 CA GLN B 94 18.580 5.623 1.718 1.00 0.00 C ATOM 3231 C GLN B 94 19.337 6.542 0.749 1.00 0.00 C ATOM 3232 O GLN B 94 18.958 7.709 0.577 1.00 0.00 O ATOM 3233 CB GLN B 94 17.194 5.254 1.094 1.00 0.00 C ATOM 3234 CG GLN B 94 17.232 4.594 -0.310 1.00 0.00 C ATOM 3235 CD GLN B 94 17.938 3.234 -0.357 1.00 0.00 C ATOM 3236 OE1 GLN B 94 17.937 2.485 0.616 1.00 0.00 O ATOM 3237 NE2 GLN B 94 18.545 2.908 -1.489 1.00 0.00 N ATOM 0 H GLN B 94 18.899 7.236 3.019 1.00 0.00 H new ATOM 0 HA GLN B 94 19.113 4.688 1.887 1.00 0.00 H new ATOM 0 HB2 GLN B 94 16.679 4.578 1.777 1.00 0.00 H new ATOM 0 HB3 GLN B 94 16.594 6.162 1.030 1.00 0.00 H new ATOM 0 HG2 GLN B 94 16.209 4.470 -0.667 1.00 0.00 H new ATOM 0 HG3 GLN B 94 17.731 5.272 -1.002 1.00 0.00 H new ATOM 0 HE21 GLN B 94 18.528 3.551 -2.280 1.00 0.00 H new ATOM 0 HE22 GLN B 94 19.029 2.014 -1.569 1.00 0.00 H new ATOM 3246 N GLN B 95 20.411 6.015 0.144 1.00 0.00 N ATOM 3247 CA GLN B 95 21.075 6.649 -0.996 1.00 0.00 C ATOM 3248 C GLN B 95 20.259 6.325 -2.265 1.00 0.00 C ATOM 3249 O GLN B 95 20.192 5.149 -2.655 1.00 0.00 O ATOM 3250 CB GLN B 95 22.545 6.157 -1.118 1.00 0.00 C ATOM 3251 CG GLN B 95 23.405 6.448 0.140 1.00 0.00 C ATOM 3252 CD GLN B 95 24.886 6.084 -0.022 1.00 0.00 C ATOM 3253 OE1 GLN B 95 25.241 5.169 -0.772 1.00 0.00 O ATOM 3254 NE2 GLN B 95 25.764 6.795 0.685 1.00 0.00 N ATOM 0 H GLN B 95 20.841 5.137 0.434 1.00 0.00 H new ATOM 0 HA GLN B 95 21.117 7.730 -0.859 1.00 0.00 H new ATOM 0 HB2 GLN B 95 22.545 5.084 -1.307 1.00 0.00 H new ATOM 0 HB3 GLN B 95 23.008 6.633 -1.982 1.00 0.00 H new ATOM 0 HG2 GLN B 95 23.326 7.507 0.385 1.00 0.00 H new ATOM 0 HG3 GLN B 95 22.995 5.894 0.984 1.00 0.00 H new ATOM 0 HE21 GLN B 95 25.439 7.545 1.296 1.00 0.00 H new ATOM 0 HE22 GLN B 95 26.761 6.590 0.615 1.00 0.00 H new ATOM 3263 N PRO B 96 19.568 7.345 -2.886 1.00 0.00 N ATOM 3264 CA PRO B 96 18.766 7.139 -4.117 1.00 0.00 C ATOM 3265 C PRO B 96 19.637 6.519 -5.229 1.00 0.00 C ATOM 3266 O PRO B 96 20.659 7.095 -5.617 1.00 0.00 O ATOM 3267 CB PRO B 96 18.259 8.569 -4.479 1.00 0.00 C ATOM 3268 CG PRO B 96 19.136 9.507 -3.702 1.00 0.00 C ATOM 3269 CD PRO B 96 19.521 8.765 -2.446 1.00 0.00 C ATOM 0 HA PRO B 96 17.937 6.444 -3.986 1.00 0.00 H new ATOM 0 HB2 PRO B 96 18.336 8.754 -5.550 1.00 0.00 H new ATOM 0 HB3 PRO B 96 17.211 8.695 -4.208 1.00 0.00 H new ATOM 0 HG2 PRO B 96 20.019 9.785 -4.278 1.00 0.00 H new ATOM 0 HG3 PRO B 96 18.607 10.430 -3.464 1.00 0.00 H new ATOM 0 HD2 PRO B 96 20.485 9.099 -2.061 1.00 0.00 H new ATOM 0 HD3 PRO B 96 18.791 8.915 -1.651 1.00 0.00 H new ATOM 3277 N ALA B 97 19.245 5.326 -5.696 1.00 0.00 N ATOM 3278 CA ALA B 97 20.068 4.505 -6.596 1.00 0.00 C ATOM 3279 C ALA B 97 19.285 4.106 -7.842 1.00 0.00 C ATOM 3280 O ALA B 97 18.063 3.911 -7.789 1.00 0.00 O ATOM 3281 CB ALA B 97 20.563 3.263 -5.844 1.00 0.00 C ATOM 0 H ALA B 97 18.348 4.902 -5.461 1.00 0.00 H new ATOM 0 HA ALA B 97 20.927 5.092 -6.922 1.00 0.00 H new ATOM 0 HB1 ALA B 97 21.173 2.653 -6.510 1.00 0.00 H new ATOM 0 HB2 ALA B 97 21.160 3.571 -4.986 1.00 0.00 H new ATOM 0 HB3 ALA B 97 19.708 2.681 -5.501 1.00 0.00 H new ATOM 3287 N LYS B 98 20.001 4.020 -8.966 1.00 0.00 N ATOM 3288 CA LYS B 98 19.467 3.504 -10.222 1.00 0.00 C ATOM 3289 C LYS B 98 19.284 1.983 -10.135 1.00 0.00 C ATOM 3290 O LYS B 98 20.246 1.220 -10.206 1.00 0.00 O ATOM 3291 CB LYS B 98 20.384 3.908 -11.413 1.00 0.00 C ATOM 3292 CG LYS B 98 20.088 5.295 -12.008 1.00 0.00 C ATOM 3293 CD LYS B 98 18.666 5.383 -12.604 1.00 0.00 C ATOM 3294 CE LYS B 98 18.521 4.568 -13.892 1.00 0.00 C ATOM 3295 NZ LYS B 98 19.425 5.058 -14.969 1.00 0.00 N ATOM 0 H LYS B 98 20.977 4.310 -9.027 1.00 0.00 H new ATOM 0 HA LYS B 98 18.487 3.947 -10.401 1.00 0.00 H new ATOM 0 HB2 LYS B 98 21.422 3.884 -11.080 1.00 0.00 H new ATOM 0 HB3 LYS B 98 20.285 3.161 -12.200 1.00 0.00 H new ATOM 0 HG2 LYS B 98 20.203 6.053 -11.233 1.00 0.00 H new ATOM 0 HG3 LYS B 98 20.820 5.519 -12.784 1.00 0.00 H new ATOM 0 HD2 LYS B 98 17.944 5.027 -11.869 1.00 0.00 H new ATOM 0 HD3 LYS B 98 18.425 6.426 -12.808 1.00 0.00 H new ATOM 0 HE2 LYS B 98 18.740 3.521 -13.684 1.00 0.00 H new ATOM 0 HE3 LYS B 98 17.488 4.616 -14.237 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 19.114 4.674 -15.884 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 19.395 6.097 -15.001 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 20.398 4.745 -14.775 1.00 0.00 H new ATOM 3309 N MET B 99 18.027 1.590 -9.928 1.00 0.00 N ATOM 3310 CA MET B 99 17.582 0.182 -9.865 1.00 0.00 C ATOM 3311 C MET B 99 16.986 -0.212 -11.241 1.00 0.00 C ATOM 3312 O MET B 99 16.894 0.638 -12.142 1.00 0.00 O ATOM 3313 CB MET B 99 16.548 0.040 -8.698 1.00 0.00 C ATOM 3314 CG MET B 99 16.094 -1.392 -8.365 1.00 0.00 C ATOM 3315 SD MET B 99 15.118 -1.501 -6.849 1.00 0.00 S ATOM 3316 CE MET B 99 16.345 -1.119 -5.591 1.00 0.00 C ATOM 0 H MET B 99 17.264 2.253 -9.795 1.00 0.00 H new ATOM 0 HA MET B 99 18.411 -0.495 -9.659 1.00 0.00 H new ATOM 0 HB2 MET B 99 16.982 0.480 -7.800 1.00 0.00 H new ATOM 0 HB3 MET B 99 15.666 0.630 -8.948 1.00 0.00 H new ATOM 0 HG2 MET B 99 15.506 -1.781 -9.196 1.00 0.00 H new ATOM 0 HG3 MET B 99 16.972 -2.031 -8.270 1.00 0.00 H new ATOM 0 HE1 MET B 99 16.424 -1.954 -4.894 1.00 0.00 H new ATOM 0 HE2 MET B 99 17.312 -0.950 -6.065 1.00 0.00 H new ATOM 0 HE3 MET B 99 16.044 -0.222 -5.050 1.00 0.00 H new ATOM 3326 N GLU B 100 16.626 -1.501 -11.411 1.00 0.00 N ATOM 3327 CA GLU B 100 15.975 -2.022 -12.639 1.00 0.00 C ATOM 3328 C GLU B 100 14.719 -1.211 -13.028 1.00 0.00 C ATOM 3329 O GLU B 100 14.491 -0.937 -14.207 1.00 0.00 O ATOM 3330 CB GLU B 100 15.607 -3.519 -12.440 1.00 0.00 C ATOM 3331 CG GLU B 100 16.823 -4.450 -12.301 1.00 0.00 C ATOM 3332 CD GLU B 100 16.438 -5.907 -12.019 1.00 0.00 C ATOM 3333 OE1 GLU B 100 16.205 -6.257 -10.843 1.00 0.00 O ATOM 3334 OE2 GLU B 100 16.351 -6.709 -12.970 1.00 0.00 O ATOM 0 H GLU B 100 16.778 -2.216 -10.699 1.00 0.00 H new ATOM 0 HA GLU B 100 16.687 -1.921 -13.458 1.00 0.00 H new ATOM 0 HB2 GLU B 100 14.986 -3.614 -11.549 1.00 0.00 H new ATOM 0 HB3 GLU B 100 15.004 -3.850 -13.286 1.00 0.00 H new ATOM 0 HG2 GLU B 100 17.412 -4.407 -13.217 1.00 0.00 H new ATOM 0 HG3 GLU B 100 17.461 -4.087 -11.495 1.00 0.00 H new ATOM 3341 N PHE B 101 13.922 -0.824 -12.016 1.00 0.00 N ATOM 3342 CA PHE B 101 12.665 -0.053 -12.206 1.00 0.00 C ATOM 3343 C PHE B 101 12.908 1.466 -12.159 1.00 0.00 C ATOM 3344 O PHE B 101 11.958 2.256 -12.156 1.00 0.00 O ATOM 3345 CB PHE B 101 11.621 -0.497 -11.150 1.00 0.00 C ATOM 3346 CG PHE B 101 11.245 -1.970 -11.289 1.00 0.00 C ATOM 3347 CD1 PHE B 101 10.324 -2.378 -12.256 1.00 0.00 C ATOM 3348 CD2 PHE B 101 11.837 -2.947 -10.485 1.00 0.00 C ATOM 3349 CE1 PHE B 101 10.007 -3.711 -12.414 1.00 0.00 C ATOM 3350 CE2 PHE B 101 11.514 -4.277 -10.641 1.00 0.00 C ATOM 3351 CZ PHE B 101 10.601 -4.660 -11.606 1.00 0.00 C ATOM 0 H PHE B 101 14.126 -1.034 -11.039 1.00 0.00 H new ATOM 0 HA PHE B 101 12.274 -0.269 -13.201 1.00 0.00 H new ATOM 0 HB2 PHE B 101 12.020 -0.319 -10.151 1.00 0.00 H new ATOM 0 HB3 PHE B 101 10.725 0.115 -11.249 1.00 0.00 H new ATOM 0 HD1 PHE B 101 9.854 -1.640 -12.889 1.00 0.00 H new ATOM 0 HD2 PHE B 101 12.556 -2.656 -9.733 1.00 0.00 H new ATOM 0 HE1 PHE B 101 9.295 -4.012 -13.169 1.00 0.00 H new ATOM 0 HE2 PHE B 101 11.975 -5.022 -10.009 1.00 0.00 H new ATOM 0 HZ PHE B 101 10.352 -5.704 -11.728 1.00 0.00 H new ATOM 3361 N GLY B 102 14.191 1.856 -12.101 1.00 0.00 N ATOM 3362 CA GLY B 102 14.606 3.241 -12.293 1.00 0.00 C ATOM 3363 C GLY B 102 15.210 3.850 -11.043 1.00 0.00 C ATOM 3364 O GLY B 102 15.568 3.120 -10.114 1.00 0.00 O ATOM 0 H GLY B 102 14.964 1.215 -11.919 1.00 0.00 H new ATOM 0 HA2 GLY B 102 15.333 3.289 -13.103 1.00 0.00 H new ATOM 0 HA3 GLY B 102 13.745 3.834 -12.602 1.00 0.00 H new ATOM 3368 N TYR B 103 15.298 5.186 -11.003 1.00 0.00 N ATOM 3369 CA TYR B 103 15.963 5.899 -9.910 1.00 0.00 C ATOM 3370 C TYR B 103 15.035 5.925 -8.692 1.00 0.00 C ATOM 3371 O TYR B 103 14.105 6.724 -8.659 1.00 0.00 O ATOM 3372 CB TYR B 103 16.327 7.345 -10.353 1.00 0.00 C ATOM 3373 CG TYR B 103 17.452 7.957 -9.524 1.00 0.00 C ATOM 3374 CD1 TYR B 103 18.692 7.340 -9.514 1.00 0.00 C ATOM 3375 CD2 TYR B 103 17.292 9.114 -8.765 1.00 0.00 C ATOM 3376 CE1 TYR B 103 19.736 7.831 -8.793 1.00 0.00 C ATOM 3377 CE2 TYR B 103 18.341 9.623 -8.030 1.00 0.00 C ATOM 3378 CZ TYR B 103 19.569 8.977 -8.047 1.00 0.00 C ATOM 3379 OH TYR B 103 20.623 9.477 -7.311 1.00 0.00 O ATOM 0 H TYR B 103 14.913 5.797 -11.723 1.00 0.00 H new ATOM 0 HA TYR B 103 16.887 5.385 -9.646 1.00 0.00 H new ATOM 0 HB2 TYR B 103 16.621 7.334 -11.403 1.00 0.00 H new ATOM 0 HB3 TYR B 103 15.442 7.976 -10.276 1.00 0.00 H new ATOM 0 HD1 TYR B 103 18.834 6.442 -10.096 1.00 0.00 H new ATOM 0 HD2 TYR B 103 16.336 9.617 -8.752 1.00 0.00 H new ATOM 0 HE1 TYR B 103 20.690 7.325 -8.805 1.00 0.00 H new ATOM 0 HE2 TYR B 103 18.208 10.520 -7.444 1.00 0.00 H new ATOM 0 HH TYR B 103 20.857 8.842 -6.602 1.00 0.00 H new ATOM 3389 N THR B 104 15.293 5.065 -7.692 1.00 0.00 N ATOM 3390 CA THR B 104 14.372 4.842 -6.561 1.00 0.00 C ATOM 3391 C THR B 104 14.996 5.351 -5.250 1.00 0.00 C ATOM 3392 O THR B 104 16.218 5.309 -5.063 1.00 0.00 O ATOM 3393 CB THR B 104 13.977 3.324 -6.432 1.00 0.00 C ATOM 3394 OG1 THR B 104 13.012 3.137 -5.380 1.00 0.00 O ATOM 3395 CG2 THR B 104 15.192 2.420 -6.165 1.00 0.00 C ATOM 0 H THR B 104 16.144 4.505 -7.644 1.00 0.00 H new ATOM 0 HA THR B 104 13.461 5.407 -6.757 1.00 0.00 H new ATOM 0 HB THR B 104 13.545 3.036 -7.390 1.00 0.00 H new ATOM 0 HG1 THR B 104 12.659 2.224 -5.419 1.00 0.00 H new ATOM 0 HG21 THR B 104 14.864 1.384 -6.085 1.00 0.00 H new ATOM 0 HG22 THR B 104 15.902 2.513 -6.987 1.00 0.00 H new ATOM 0 HG23 THR B 104 15.672 2.722 -5.234 1.00 0.00 H new ATOM 3403 N PHE B 105 14.127 5.834 -4.363 1.00 0.00 N ATOM 3404 CA PHE B 105 14.494 6.446 -3.081 1.00 0.00 C ATOM 3405 C PHE B 105 13.459 6.062 -2.012 1.00 0.00 C ATOM 3406 O PHE B 105 12.277 6.021 -2.319 1.00 0.00 O ATOM 3407 CB PHE B 105 14.592 7.999 -3.280 1.00 0.00 C ATOM 3408 CG PHE B 105 14.370 8.860 -2.034 1.00 0.00 C ATOM 3409 CD1 PHE B 105 15.211 8.762 -0.925 1.00 0.00 C ATOM 3410 CD2 PHE B 105 13.293 9.752 -1.967 1.00 0.00 C ATOM 3411 CE1 PHE B 105 14.982 9.526 0.198 1.00 0.00 C ATOM 3412 CE2 PHE B 105 13.067 10.512 -0.843 1.00 0.00 C ATOM 3413 CZ PHE B 105 13.909 10.399 0.238 1.00 0.00 C ATOM 0 H PHE B 105 13.119 5.811 -4.518 1.00 0.00 H new ATOM 0 HA PHE B 105 15.463 6.083 -2.738 1.00 0.00 H new ATOM 0 HB2 PHE B 105 15.578 8.230 -3.684 1.00 0.00 H new ATOM 0 HB3 PHE B 105 13.862 8.294 -4.034 1.00 0.00 H new ATOM 0 HD1 PHE B 105 16.049 8.081 -0.947 1.00 0.00 H new ATOM 0 HD2 PHE B 105 12.628 9.845 -2.813 1.00 0.00 H new ATOM 0 HE1 PHE B 105 15.641 9.444 1.049 1.00 0.00 H new ATOM 0 HE2 PHE B 105 12.231 11.195 -0.810 1.00 0.00 H new ATOM 0 HZ PHE B 105 13.732 10.994 1.122 1.00 0.00 H new ATOM 3423 N THR B 106 13.883 5.745 -0.779 1.00 0.00 N ATOM 3424 CA THR B 106 12.946 5.351 0.292 1.00 0.00 C ATOM 3425 C THR B 106 13.302 6.067 1.603 1.00 0.00 C ATOM 3426 O THR B 106 14.395 5.889 2.132 1.00 0.00 O ATOM 3427 CB THR B 106 12.954 3.803 0.500 1.00 0.00 C ATOM 3428 OG1 THR B 106 12.858 3.162 -0.775 1.00 0.00 O ATOM 3429 CG2 THR B 106 11.805 3.321 1.422 1.00 0.00 C ATOM 0 H THR B 106 14.863 5.753 -0.497 1.00 0.00 H new ATOM 0 HA THR B 106 11.942 5.648 -0.009 1.00 0.00 H new ATOM 0 HB THR B 106 13.889 3.537 0.994 1.00 0.00 H new ATOM 0 HG1 THR B 106 13.748 2.869 -1.062 1.00 0.00 H new ATOM 0 HG21 THR B 106 11.857 2.238 1.533 1.00 0.00 H new ATOM 0 HG22 THR B 106 11.902 3.791 2.401 1.00 0.00 H new ATOM 0 HG23 THR B 106 10.846 3.595 0.982 1.00 0.00 H new ATOM 3437 N ALA B 107 12.363 6.858 2.130 1.00 0.00 N ATOM 3438 CA ALA B 107 12.563 7.617 3.372 1.00 0.00 C ATOM 3439 C ALA B 107 11.769 6.994 4.532 1.00 0.00 C ATOM 3440 O ALA B 107 10.833 6.215 4.301 1.00 0.00 O ATOM 3441 CB ALA B 107 12.167 9.080 3.159 1.00 0.00 C ATOM 0 H ALA B 107 11.443 6.991 1.710 1.00 0.00 H new ATOM 0 HA ALA B 107 13.619 7.577 3.639 1.00 0.00 H new ATOM 0 HB1 ALA B 107 12.318 9.636 4.084 1.00 0.00 H new ATOM 0 HB2 ALA B 107 12.783 9.513 2.371 1.00 0.00 H new ATOM 0 HB3 ALA B 107 11.117 9.134 2.870 1.00 0.00 H new ATOM 3447 N ALA B 108 12.161 7.325 5.768 1.00 0.00 N ATOM 3448 CA ALA B 108 11.420 6.953 6.983 1.00 0.00 C ATOM 3449 C ALA B 108 10.959 8.236 7.675 1.00 0.00 C ATOM 3450 O ALA B 108 11.786 9.044 8.087 1.00 0.00 O ATOM 3451 CB ALA B 108 12.300 6.111 7.921 1.00 0.00 C ATOM 0 H ALA B 108 13.007 7.862 5.956 1.00 0.00 H new ATOM 0 HA ALA B 108 10.555 6.345 6.719 1.00 0.00 H new ATOM 0 HB1 ALA B 108 11.732 5.847 8.813 1.00 0.00 H new ATOM 0 HB2 ALA B 108 12.613 5.202 7.408 1.00 0.00 H new ATOM 0 HB3 ALA B 108 13.180 6.686 8.208 1.00 0.00 H new ATOM 3457 N ASP B 109 9.641 8.438 7.739 1.00 0.00 N ATOM 3458 CA ASP B 109 9.006 9.581 8.440 1.00 0.00 C ATOM 3459 C ASP B 109 9.152 9.447 9.996 1.00 0.00 C ATOM 3460 O ASP B 109 9.755 8.472 10.456 1.00 0.00 O ATOM 3461 CB ASP B 109 7.522 9.649 7.982 1.00 0.00 C ATOM 3462 CG ASP B 109 6.742 8.369 8.276 1.00 0.00 C ATOM 3463 OD1 ASP B 109 6.832 7.422 7.467 1.00 0.00 O ATOM 3464 OD2 ASP B 109 6.051 8.300 9.313 1.00 0.00 O ATOM 0 H ASP B 109 8.966 7.809 7.303 1.00 0.00 H new ATOM 0 HA ASP B 109 9.505 10.515 8.181 1.00 0.00 H new ATOM 0 HB2 ASP B 109 7.033 10.487 8.479 1.00 0.00 H new ATOM 0 HB3 ASP B 109 7.488 9.850 6.911 1.00 0.00 H new ATOM 3469 N PRO B 110 8.665 10.448 10.833 1.00 0.00 N ATOM 3470 CA PRO B 110 8.629 10.331 12.328 1.00 0.00 C ATOM 3471 C PRO B 110 8.133 8.962 12.875 1.00 0.00 C ATOM 3472 O PRO B 110 8.706 8.432 13.833 1.00 0.00 O ATOM 3473 CB PRO B 110 7.670 11.475 12.738 1.00 0.00 C ATOM 3474 CG PRO B 110 7.930 12.541 11.720 1.00 0.00 C ATOM 3475 CD PRO B 110 8.204 11.811 10.415 1.00 0.00 C ATOM 0 HA PRO B 110 9.633 10.400 12.746 1.00 0.00 H new ATOM 0 HB2 PRO B 110 6.630 11.150 12.721 1.00 0.00 H new ATOM 0 HB3 PRO B 110 7.877 11.828 13.748 1.00 0.00 H new ATOM 0 HG2 PRO B 110 7.072 13.206 11.623 1.00 0.00 H new ATOM 0 HG3 PRO B 110 8.781 13.158 12.009 1.00 0.00 H new ATOM 0 HD2 PRO B 110 7.308 11.754 9.797 1.00 0.00 H new ATOM 0 HD3 PRO B 110 8.965 12.324 9.826 1.00 0.00 H new ATOM 3483 N ASP B 111 7.079 8.393 12.256 1.00 0.00 N ATOM 3484 CA ASP B 111 6.518 7.078 12.680 1.00 0.00 C ATOM 3485 C ASP B 111 7.391 5.926 12.140 1.00 0.00 C ATOM 3486 O ASP B 111 7.407 4.824 12.708 1.00 0.00 O ATOM 3487 CB ASP B 111 5.060 6.900 12.178 1.00 0.00 C ATOM 3488 CG ASP B 111 4.218 5.952 13.056 1.00 0.00 C ATOM 3489 OD1 ASP B 111 3.674 6.416 14.088 1.00 0.00 O ATOM 3490 OD2 ASP B 111 4.094 4.752 12.725 1.00 0.00 O ATOM 0 H ASP B 111 6.595 8.815 11.463 1.00 0.00 H new ATOM 0 HA ASP B 111 6.515 7.055 13.770 1.00 0.00 H new ATOM 0 HB2 ASP B 111 4.575 7.875 12.142 1.00 0.00 H new ATOM 0 HB3 ASP B 111 5.080 6.516 11.158 1.00 0.00 H new ATOM 3495 N SER B 112 8.085 6.226 11.024 1.00 0.00 N ATOM 3496 CA SER B 112 8.972 5.314 10.295 1.00 0.00 C ATOM 3497 C SER B 112 8.145 4.276 9.539 1.00 0.00 C ATOM 3498 O SER B 112 7.802 3.210 10.057 1.00 0.00 O ATOM 3499 CB SER B 112 10.055 4.666 11.200 1.00 0.00 C ATOM 3500 OG SER B 112 10.993 3.904 10.450 1.00 0.00 O ATOM 0 H SER B 112 8.037 7.149 10.593 1.00 0.00 H new ATOM 0 HA SER B 112 9.530 5.904 9.568 1.00 0.00 H new ATOM 0 HB2 SER B 112 10.580 5.446 11.751 1.00 0.00 H new ATOM 0 HB3 SER B 112 9.574 4.024 11.937 1.00 0.00 H new ATOM 0 HG SER B 112 11.657 3.515 11.056 1.00 0.00 H new ATOM 3506 N HIS B 113 7.737 4.665 8.331 1.00 0.00 N ATOM 3507 CA HIS B 113 7.134 3.767 7.342 1.00 0.00 C ATOM 3508 C HIS B 113 8.109 3.672 6.158 1.00 0.00 C ATOM 3509 O HIS B 113 9.246 4.178 6.234 1.00 0.00 O ATOM 3510 CB HIS B 113 5.749 4.311 6.885 1.00 0.00 C ATOM 3511 CG HIS B 113 4.866 4.797 8.010 1.00 0.00 C ATOM 3512 ND1 HIS B 113 4.350 6.070 8.042 1.00 0.00 N ATOM 3513 CD2 HIS B 113 4.390 4.187 9.120 1.00 0.00 C ATOM 3514 CE1 HIS B 113 3.592 6.214 9.094 1.00 0.00 C ATOM 3515 NE2 HIS B 113 3.598 5.088 9.776 1.00 0.00 N ATOM 0 H HIS B 113 7.817 5.628 8.005 1.00 0.00 H new ATOM 0 HA HIS B 113 6.963 2.779 7.769 1.00 0.00 H new ATOM 0 HB2 HIS B 113 5.908 5.131 6.184 1.00 0.00 H new ATOM 0 HB3 HIS B 113 5.225 3.525 6.342 1.00 0.00 H new ATOM 0 HD1 HIS B 113 4.532 6.794 7.347 1.00 0.00 H new ATOM 0 HD2 HIS B 113 4.598 3.174 9.431 1.00 0.00 H new ATOM 0 HE1 HIS B 113 3.049 7.109 9.361 1.00 0.00 H new ATOM 3524 N ARG B 114 7.700 2.999 5.081 1.00 0.00 N ATOM 3525 CA ARG B 114 8.474 2.963 3.830 1.00 0.00 C ATOM 3526 C ARG B 114 7.844 3.969 2.844 1.00 0.00 C ATOM 3527 O ARG B 114 6.697 3.801 2.438 1.00 0.00 O ATOM 3528 CB ARG B 114 8.481 1.523 3.247 1.00 0.00 C ATOM 3529 CG ARG B 114 9.005 0.390 4.174 1.00 0.00 C ATOM 3530 CD ARG B 114 10.511 0.488 4.519 1.00 0.00 C ATOM 3531 NE ARG B 114 10.812 1.541 5.512 1.00 0.00 N ATOM 3532 CZ ARG B 114 12.004 1.749 6.079 1.00 0.00 C ATOM 3533 NH1 ARG B 114 13.058 0.997 5.766 1.00 0.00 N ATOM 3534 NH2 ARG B 114 12.135 2.713 6.973 1.00 0.00 N ATOM 0 H ARG B 114 6.831 2.466 5.046 1.00 0.00 H new ATOM 0 HA ARG B 114 9.512 3.243 4.013 1.00 0.00 H new ATOM 0 HB2 ARG B 114 7.463 1.273 2.949 1.00 0.00 H new ATOM 0 HB3 ARG B 114 9.087 1.527 2.341 1.00 0.00 H new ATOM 0 HG2 ARG B 114 8.431 0.402 5.101 1.00 0.00 H new ATOM 0 HG3 ARG B 114 8.817 -0.571 3.695 1.00 0.00 H new ATOM 0 HD2 ARG B 114 10.853 -0.473 4.903 1.00 0.00 H new ATOM 0 HD3 ARG B 114 11.074 0.686 3.607 1.00 0.00 H new ATOM 0 HE ARG B 114 10.048 2.159 5.787 1.00 0.00 H new ATOM 0 HH11 ARG B 114 12.964 0.246 5.082 1.00 0.00 H new ATOM 0 HH12 ARG B 114 13.959 1.172 6.210 1.00 0.00 H new ATOM 0 HH21 ARG B 114 11.331 3.289 7.224 1.00 0.00 H new ATOM 0 HH22 ARG B 114 13.040 2.881 7.413 1.00 0.00 H new ATOM 3548 N LEU B 115 8.569 5.052 2.512 1.00 0.00 N ATOM 3549 CA LEU B 115 8.069 6.101 1.598 1.00 0.00 C ATOM 3550 C LEU B 115 8.923 6.135 0.321 1.00 0.00 C ATOM 3551 O LEU B 115 10.042 6.643 0.329 1.00 0.00 O ATOM 3552 CB LEU B 115 8.090 7.478 2.318 1.00 0.00 C ATOM 3553 CG LEU B 115 7.119 7.628 3.526 1.00 0.00 C ATOM 3554 CD1 LEU B 115 7.235 9.028 4.175 1.00 0.00 C ATOM 3555 CD2 LEU B 115 5.665 7.313 3.101 1.00 0.00 C ATOM 0 H LEU B 115 9.510 5.226 2.865 1.00 0.00 H new ATOM 0 HA LEU B 115 7.041 5.876 1.314 1.00 0.00 H new ATOM 0 HB2 LEU B 115 9.105 7.669 2.667 1.00 0.00 H new ATOM 0 HB3 LEU B 115 7.853 8.252 1.588 1.00 0.00 H new ATOM 0 HG LEU B 115 7.409 6.901 4.285 1.00 0.00 H new ATOM 0 HD11 LEU B 115 6.544 9.098 5.015 1.00 0.00 H new ATOM 0 HD12 LEU B 115 8.254 9.181 4.530 1.00 0.00 H new ATOM 0 HD13 LEU B 115 6.989 9.792 3.438 1.00 0.00 H new ATOM 0 HD21 LEU B 115 5.003 7.424 3.960 1.00 0.00 H new ATOM 0 HD22 LEU B 115 5.358 8.003 2.315 1.00 0.00 H new ATOM 0 HD23 LEU B 115 5.608 6.290 2.729 1.00 0.00 H new ATOM 3567 N ARG B 116 8.364 5.594 -0.775 1.00 0.00 N ATOM 3568 CA ARG B 116 9.074 5.437 -2.058 1.00 0.00 C ATOM 3569 C ARG B 116 8.917 6.693 -2.922 1.00 0.00 C ATOM 3570 O ARG B 116 7.841 7.257 -2.958 1.00 0.00 O ATOM 3571 CB ARG B 116 8.532 4.219 -2.842 1.00 0.00 C ATOM 3572 CG ARG B 116 8.544 2.889 -2.088 1.00 0.00 C ATOM 3573 CD ARG B 116 9.960 2.446 -1.712 1.00 0.00 C ATOM 3574 NE ARG B 116 9.961 1.066 -1.234 1.00 0.00 N ATOM 3575 CZ ARG B 116 10.978 0.223 -1.301 1.00 0.00 C ATOM 3576 NH1 ARG B 116 12.194 0.642 -1.596 1.00 0.00 N ATOM 3577 NH2 ARG B 116 10.751 -1.052 -1.072 1.00 0.00 N ATOM 0 H ARG B 116 7.403 5.252 -0.797 1.00 0.00 H new ATOM 0 HA ARG B 116 10.129 5.281 -1.831 1.00 0.00 H new ATOM 0 HB2 ARG B 116 7.508 4.433 -3.148 1.00 0.00 H new ATOM 0 HB3 ARG B 116 9.120 4.105 -3.753 1.00 0.00 H new ATOM 0 HG2 ARG B 116 7.943 2.981 -1.184 1.00 0.00 H new ATOM 0 HG3 ARG B 116 8.077 2.121 -2.704 1.00 0.00 H new ATOM 0 HD2 ARG B 116 10.616 2.536 -2.578 1.00 0.00 H new ATOM 0 HD3 ARG B 116 10.359 3.104 -0.940 1.00 0.00 H new ATOM 0 HE ARG B 116 9.100 0.721 -0.810 1.00 0.00 H new ATOM 0 HH11 ARG B 116 12.363 1.632 -1.777 1.00 0.00 H new ATOM 0 HH12 ARG B 116 12.965 -0.024 -1.643 1.00 0.00 H new ATOM 0 HH21 ARG B 116 9.808 -1.370 -0.849 1.00 0.00 H new ATOM 0 HH22 ARG B 116 11.518 -1.723 -1.117 1.00 0.00 H new ATOM 3591 N VAL B 117 9.975 7.099 -3.623 1.00 0.00 N ATOM 3592 CA VAL B 117 9.903 8.030 -4.769 1.00 0.00 C ATOM 3593 C VAL B 117 10.798 7.445 -5.850 1.00 0.00 C ATOM 3594 O VAL B 117 11.995 7.262 -5.607 1.00 0.00 O ATOM 3595 CB VAL B 117 10.396 9.492 -4.428 1.00 0.00 C ATOM 3596 CG1 VAL B 117 10.260 10.442 -5.657 1.00 0.00 C ATOM 3597 CG2 VAL B 117 9.658 10.056 -3.200 1.00 0.00 C ATOM 0 H VAL B 117 10.925 6.791 -3.414 1.00 0.00 H new ATOM 0 HA VAL B 117 8.862 8.128 -5.076 1.00 0.00 H new ATOM 0 HB VAL B 117 11.455 9.431 -4.179 1.00 0.00 H new ATOM 0 HG11 VAL B 117 10.608 11.439 -5.387 1.00 0.00 H new ATOM 0 HG12 VAL B 117 10.861 10.059 -6.481 1.00 0.00 H new ATOM 0 HG13 VAL B 117 9.215 10.493 -5.963 1.00 0.00 H new ATOM 0 HG21 VAL B 117 10.018 11.063 -2.990 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.587 10.089 -3.402 1.00 0.00 H new ATOM 0 HG23 VAL B 117 9.845 9.416 -2.338 1.00 0.00 H new ATOM 3607 N TYR B 118 10.249 7.139 -7.037 1.00 0.00 N ATOM 3608 CA TYR B 118 11.046 6.524 -8.114 1.00 0.00 C ATOM 3609 C TYR B 118 10.899 7.283 -9.439 1.00 0.00 C ATOM 3610 O TYR B 118 9.960 8.078 -9.606 1.00 0.00 O ATOM 3611 CB TYR B 118 10.755 5.007 -8.269 1.00 0.00 C ATOM 3612 CG TYR B 118 9.441 4.653 -8.963 1.00 0.00 C ATOM 3613 CD1 TYR B 118 8.226 4.721 -8.283 1.00 0.00 C ATOM 3614 CD2 TYR B 118 9.424 4.237 -10.302 1.00 0.00 C ATOM 3615 CE1 TYR B 118 7.050 4.384 -8.910 1.00 0.00 C ATOM 3616 CE2 TYR B 118 8.246 3.904 -10.929 1.00 0.00 C ATOM 3617 CZ TYR B 118 7.063 3.977 -10.230 1.00 0.00 C ATOM 3618 OH TYR B 118 5.886 3.629 -10.847 1.00 0.00 O ATOM 0 H TYR B 118 9.271 7.304 -7.275 1.00 0.00 H new ATOM 0 HA TYR B 118 12.092 6.607 -7.818 1.00 0.00 H new ATOM 0 HB2 TYR B 118 11.574 4.554 -8.828 1.00 0.00 H new ATOM 0 HB3 TYR B 118 10.756 4.552 -7.278 1.00 0.00 H new ATOM 0 HD1 TYR B 118 8.208 5.042 -7.252 1.00 0.00 H new ATOM 0 HD2 TYR B 118 10.352 4.177 -10.851 1.00 0.00 H new ATOM 0 HE1 TYR B 118 6.116 4.437 -8.371 1.00 0.00 H new ATOM 0 HE2 TYR B 118 8.249 3.588 -11.962 1.00 0.00 H new ATOM 0 HH TYR B 118 5.295 3.191 -10.200 1.00 0.00 H new ATOM 3628 N ALA B 119 11.793 7.000 -10.384 1.00 0.00 N ATOM 3629 CA ALA B 119 11.696 7.492 -11.759 1.00 0.00 C ATOM 3630 C ALA B 119 12.023 6.338 -12.699 1.00 0.00 C ATOM 3631 O ALA B 119 13.179 5.929 -12.775 1.00 0.00 O ATOM 3632 CB ALA B 119 12.668 8.653 -11.970 1.00 0.00 C ATOM 0 H ALA B 119 12.613 6.417 -10.217 1.00 0.00 H new ATOM 0 HA ALA B 119 10.690 7.859 -11.962 1.00 0.00 H new ATOM 0 HB1 ALA B 119 12.588 9.012 -12.996 1.00 0.00 H new ATOM 0 HB2 ALA B 119 12.423 9.462 -11.282 1.00 0.00 H new ATOM 0 HB3 ALA B 119 13.687 8.313 -11.782 1.00 0.00 H new ATOM 3638 N PHE B 120 11.019 5.848 -13.437 1.00 0.00 N ATOM 3639 CA PHE B 120 11.165 4.668 -14.302 1.00 0.00 C ATOM 3640 C PHE B 120 11.850 5.097 -15.604 1.00 0.00 C ATOM 3641 O PHE B 120 11.284 5.885 -16.368 1.00 0.00 O ATOM 3642 CB PHE B 120 9.781 4.013 -14.591 1.00 0.00 C ATOM 3643 CG PHE B 120 9.861 2.749 -15.462 1.00 0.00 C ATOM 3644 CD1 PHE B 120 10.167 1.510 -14.894 1.00 0.00 C ATOM 3645 CD2 PHE B 120 9.653 2.803 -16.845 1.00 0.00 C ATOM 3646 CE1 PHE B 120 10.265 0.373 -15.674 1.00 0.00 C ATOM 3647 CE2 PHE B 120 9.748 1.666 -17.622 1.00 0.00 C ATOM 3648 CZ PHE B 120 10.055 0.452 -17.038 1.00 0.00 C ATOM 0 H PHE B 120 10.084 6.256 -13.452 1.00 0.00 H new ATOM 0 HA PHE B 120 11.776 3.920 -13.797 1.00 0.00 H new ATOM 0 HB2 PHE B 120 9.305 3.760 -13.644 1.00 0.00 H new ATOM 0 HB3 PHE B 120 9.140 4.743 -15.085 1.00 0.00 H new ATOM 0 HD1 PHE B 120 10.330 1.439 -13.829 1.00 0.00 H new ATOM 0 HD2 PHE B 120 9.415 3.748 -17.311 1.00 0.00 H new ATOM 0 HE1 PHE B 120 10.505 -0.576 -15.218 1.00 0.00 H new ATOM 0 HE2 PHE B 120 9.582 1.725 -18.688 1.00 0.00 H new ATOM 0 HZ PHE B 120 10.131 -0.436 -17.648 1.00 0.00 H new ATOM 3658 N ALA B 121 13.085 4.609 -15.824 1.00 0.00 N ATOM 3659 CA ALA B 121 13.862 4.917 -17.029 1.00 0.00 C ATOM 3660 C ALA B 121 13.185 4.288 -18.263 1.00 0.00 C ATOM 3661 O ALA B 121 13.235 3.069 -18.465 1.00 0.00 O ATOM 3662 CB ALA B 121 15.318 4.429 -16.863 1.00 0.00 C ATOM 0 H ALA B 121 13.567 3.992 -15.170 1.00 0.00 H new ATOM 0 HA ALA B 121 13.892 5.996 -17.178 1.00 0.00 H new ATOM 0 HB1 ALA B 121 15.885 4.663 -17.764 1.00 0.00 H new ATOM 0 HB2 ALA B 121 15.774 4.928 -16.008 1.00 0.00 H new ATOM 0 HB3 ALA B 121 15.324 3.351 -16.700 1.00 0.00 H new ATOM 3668 N GLY B 122 12.500 5.140 -19.049 1.00 0.00 N ATOM 3669 CA GLY B 122 11.775 4.715 -20.243 1.00 0.00 C ATOM 3670 C GLY B 122 11.406 5.917 -21.122 1.00 0.00 C ATOM 3671 O GLY B 122 10.322 6.503 -20.930 1.00 0.00 O ATOM 3672 OXT GLY B 122 12.219 6.307 -21.983 1.00 0.00 O ATOM 0 H GLY B 122 12.439 6.142 -18.867 1.00 0.00 H new ATOM 0 HA2 GLY B 122 12.387 4.017 -20.814 1.00 0.00 H new ATOM 0 HA3 GLY B 122 10.870 4.182 -19.952 1.00 0.00 H new TER 3676 GLY B 122