USER MOD reduce.3.24.130724 H: found=0, std=0, add=1806, rem=0, adj=58 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 35 THR OG1 : rot 21:sc= 1.13 USER MOD Set 1.2: B 51 SER OG : rot 133:sc= 1.96 USER MOD Set 1.3: B 53 HIS : no HE2:sc= 0.0625 K(o=3.2,f=-0.22) USER MOD Set 2.1: B 21 TYR OH : rot -2:sc= 0.844 USER MOD Set 2.2: B 113 HIS : no HD1:sc= -1.22! C(o=-0.37!,f=-7.6!) USER MOD Set 3.1: B 18 THR OG1 : rot 88:sc= 1.48 USER MOD Set 3.2: B 37 SER OG : rot 156:sc= 0.374 USER MOD Set 4.1: A 43 ASN : amide:sc= 0 K(o=0.29,f=-0.84) USER MOD Set 4.2: B 3 HIS : no HE2:sc= 0.288 K(o=0.29,f=-1.3) USER MOD Set 5.1: A 81 THR OG1 : rot 78:sc= 1.92 USER MOD Set 5.2: B 1 MET CE :methyl -129:sc= -0.414 (180deg=-1.22) USER MOD Set 5.3: B 2 THR OG1 : rot 146:sc= 0.535 USER MOD Set 6.1: A 35 THR OG1 : rot 12:sc= 1.16 USER MOD Set 6.2: A 51 SER OG : rot 151:sc= 0.993 USER MOD Set 6.3: A 53 HIS : no HD1:sc= -0.245 X(o=1.9,f=1.8) USER MOD Set 7.1: A 21 TYR OH : rot -7:sc= 0.796 USER MOD Set 7.2: A 113 HIS : no HD1:sc= -1.4! C(o=-0.6!,f=-7.8!) USER MOD Set 8.1: A 18 THR OG1 : rot 89:sc= 1.38 USER MOD Set 8.2: A 37 SER OG : rot 156:sc= 0.288 USER MOD Set 9.1: A 7 THR OG1 : rot 45:sc= 0.488 USER MOD Set 9.2: B 7 THR OG1 : rot 45:sc= 0.411 USER MOD Set10.1: A 1 MET CE :methyl -134:sc= -0.0347 (180deg=-0.968) USER MOD Set10.2: A 2 THR OG1 : rot 145:sc= 0.822 USER MOD Set10.3: B 81 THR OG1 : rot 98:sc= 2.14 USER MOD Single : A 1 MET N :NH3+ -156:sc= 1.21 (180deg=0.306) USER MOD Single : A 3 HIS : no HE2:sc= 0.575 K(o=0.57,f=-1.8!) USER MOD Single : A 10 TYR OH : rot 0:sc= 0 USER MOD Single : A 13 ASN : amide:sc=-0.00682 K(o=-0.0068,f=-0.87) USER MOD Single : A 17 SER OG : rot -86:sc= 1.22 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 158:sc= 0.285 USER MOD Single : A 45 MET CE :methyl -119:sc= -0.0994 (180deg=-0.539) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot -35:sc= 0.656 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 40:sc= 0.0203 USER MOD Single : A 74 ASN : amide:sc= -1.2 X(o=-1.2,f=-1.6) USER MOD Single : A 77 GLN : amide:sc=-0.00663 K(o=-0.0066,f=-0.61) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot -34:sc= 0.625 USER MOD Single : A 92 MET CE :methyl 145:sc= -2.26! (180deg=-3.89) USER MOD Single : A 94 GLN : amide:sc= -0.486 K(o=-0.49,f=-1.2) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 98 LYS NZ :NH3+ 171:sc=-0.000522 (180deg=-0.0813) USER MOD Single : A 99 MET CE :methyl -143:sc= -0.408 (180deg=-1.98!) USER MOD Single : A 103 TYR OH : rot 180:sc= -0.039 USER MOD Single : A 104 THR OG1 : rot -150:sc= -0.0818 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 TYR OH : rot -38:sc= 0.836 USER MOD Single : B 1 MET N :NH3+ -158:sc= 0.977 (180deg=0.261) USER MOD Single : B 10 TYR OH : rot 0:sc= 0 USER MOD Single : B 13 ASN : amide:sc= -0.231 K(o=-0.23,f=-0.92) USER MOD Single : B 17 SER OG : rot -82:sc= 1.22 USER MOD Single : B 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 33 SER OG : rot 158:sc= 0.655 USER MOD Single : B 43 ASN : amide:sc= -0.937 K(o=-0.94,f=-0.21) USER MOD Single : B 45 MET CE :methyl 149:sc= -0.113 (180deg=-0.592) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 THR OG1 : rot -43:sc= 0.335 USER MOD Single : B 58 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00362) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot 40:sc= 0.0861 USER MOD Single : B 74 ASN : amide:sc= -1.33 K(o=-1.3,f=-2.6!) USER MOD Single : B 77 GLN : amide:sc= -0.0401 K(o=-0.04,f=-1.2) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 88 SER OG : rot 85:sc= 0.976 USER MOD Single : B 92 MET CE :methyl -153:sc= -1.96! (180deg=-2.72) USER MOD Single : B 94 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.3) USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : B 98 LYS NZ :NH3+ -118:sc= -0.603 (180deg=-2.61!) USER MOD Single : B 99 MET CE :methyl -117:sc= -0.884 (180deg=-3.08!) USER MOD Single : B 103 TYR OH : rot -49:sc= 0.0182 USER MOD Single : B 104 THR OG1 : rot -157:sc= -0.0904 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 112 SER OG : rot 180:sc= 0 USER MOD Single : B 118 TYR OH : rot -45:sc= 0.898 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.155 19.196 -5.342 1.00 0.00 N ATOM 2 CA MET A 1 5.898 18.735 -6.540 1.00 0.00 C ATOM 3 C MET A 1 5.557 17.277 -6.883 1.00 0.00 C ATOM 4 O MET A 1 5.601 16.888 -8.058 1.00 0.00 O ATOM 5 CB MET A 1 7.432 18.905 -6.342 1.00 0.00 C ATOM 6 CG MET A 1 8.041 18.038 -5.223 1.00 0.00 C ATOM 7 SD MET A 1 7.376 18.429 -3.586 1.00 0.00 S ATOM 8 CE MET A 1 8.199 17.209 -2.557 1.00 0.00 C ATOM 0 H1 MET A 1 5.071 20.232 -5.363 1.00 0.00 H new ATOM 0 H2 MET A 1 4.205 18.772 -5.338 1.00 0.00 H new ATOM 0 H3 MET A 1 5.667 18.907 -4.484 1.00 0.00 H new ATOM 0 HA MET A 1 5.588 19.358 -7.379 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.933 18.667 -7.280 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.642 19.952 -6.125 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.855 16.987 -5.443 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.122 18.175 -5.212 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.473 16.748 -1.888 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.647 16.443 -3.189 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.977 17.695 -1.968 1.00 0.00 H new ATOM 18 N THR A 2 5.193 16.473 -5.862 1.00 0.00 N ATOM 19 CA THR A 2 5.012 15.020 -6.024 1.00 0.00 C ATOM 20 C THR A 2 3.771 14.513 -5.263 1.00 0.00 C ATOM 21 O THR A 2 3.489 14.952 -4.142 1.00 0.00 O ATOM 22 CB THR A 2 6.292 14.272 -5.528 1.00 0.00 C ATOM 23 OG1 THR A 2 7.423 14.711 -6.297 1.00 0.00 O ATOM 24 CG2 THR A 2 6.167 12.751 -5.632 1.00 0.00 C ATOM 0 H THR A 2 5.019 16.810 -4.915 1.00 0.00 H new ATOM 0 HA THR A 2 4.855 14.814 -7.083 1.00 0.00 H new ATOM 0 HB THR A 2 6.422 14.513 -4.473 1.00 0.00 H new ATOM 0 HG1 THR A 2 8.218 14.735 -5.725 1.00 0.00 H new ATOM 0 HG21 THR A 2 7.085 12.285 -5.274 1.00 0.00 H new ATOM 0 HG22 THR A 2 5.327 12.413 -5.025 1.00 0.00 H new ATOM 0 HG23 THR A 2 5.999 12.470 -6.672 1.00 0.00 H new ATOM 32 N HIS A 3 3.033 13.579 -5.897 1.00 0.00 N ATOM 33 CA HIS A 3 1.880 12.879 -5.290 1.00 0.00 C ATOM 34 C HIS A 3 2.048 11.361 -5.520 1.00 0.00 C ATOM 35 O HIS A 3 2.650 10.961 -6.529 1.00 0.00 O ATOM 36 CB HIS A 3 0.540 13.374 -5.913 1.00 0.00 C ATOM 37 CG HIS A 3 0.400 14.873 -5.947 1.00 0.00 C ATOM 38 ND1 HIS A 3 0.626 15.674 -4.850 1.00 0.00 N ATOM 39 CD2 HIS A 3 0.120 15.713 -6.967 1.00 0.00 C ATOM 40 CE1 HIS A 3 0.500 16.939 -5.198 1.00 0.00 C ATOM 41 NE2 HIS A 3 0.189 16.988 -6.477 1.00 0.00 N ATOM 0 H HIS A 3 3.222 13.286 -6.855 1.00 0.00 H new ATOM 0 HA HIS A 3 1.848 13.093 -4.222 1.00 0.00 H new ATOM 0 HB2 HIS A 3 0.459 12.988 -6.929 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -0.290 12.954 -5.345 1.00 0.00 H new ATOM 0 HD1 HIS A 3 0.855 15.340 -3.914 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -0.115 15.430 -7.982 1.00 0.00 H new ATOM 0 HE1 HIS A 3 0.630 17.790 -4.546 1.00 0.00 H new ATOM 50 N PRO A 4 1.568 10.485 -4.587 1.00 0.00 N ATOM 51 CA PRO A 4 1.513 9.035 -4.828 1.00 0.00 C ATOM 52 C PRO A 4 0.212 8.616 -5.550 1.00 0.00 C ATOM 53 O PRO A 4 -0.855 9.190 -5.329 1.00 0.00 O ATOM 54 CB PRO A 4 1.604 8.446 -3.406 1.00 0.00 C ATOM 55 CG PRO A 4 0.910 9.459 -2.542 1.00 0.00 C ATOM 56 CD PRO A 4 1.087 10.820 -3.221 1.00 0.00 C ATOM 0 HA PRO A 4 2.306 8.681 -5.487 1.00 0.00 H new ATOM 0 HB2 PRO A 4 1.118 7.472 -3.347 1.00 0.00 H new ATOM 0 HB3 PRO A 4 2.640 8.304 -3.099 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -0.147 9.216 -2.435 1.00 0.00 H new ATOM 0 HG3 PRO A 4 1.338 9.469 -1.540 1.00 0.00 H new ATOM 0 HD2 PRO A 4 0.149 11.374 -3.254 1.00 0.00 H new ATOM 0 HD3 PRO A 4 1.806 11.441 -2.687 1.00 0.00 H new ATOM 64 N ASP A 5 0.338 7.634 -6.440 1.00 0.00 N ATOM 65 CA ASP A 5 -0.810 6.980 -7.113 1.00 0.00 C ATOM 66 C ASP A 5 -0.500 5.481 -7.291 1.00 0.00 C ATOM 67 O ASP A 5 -1.123 4.760 -8.078 1.00 0.00 O ATOM 68 CB ASP A 5 -1.100 7.689 -8.460 1.00 0.00 C ATOM 69 CG ASP A 5 -2.407 7.229 -9.123 1.00 0.00 C ATOM 70 OD1 ASP A 5 -3.481 7.412 -8.511 1.00 0.00 O ATOM 71 OD2 ASP A 5 -2.369 6.713 -10.261 1.00 0.00 O ATOM 0 H ASP A 5 1.242 7.258 -6.725 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.711 7.065 -6.506 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -1.145 8.765 -8.293 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -0.271 7.507 -9.144 1.00 0.00 H new ATOM 76 N PHE A 6 0.462 5.027 -6.489 1.00 0.00 N ATOM 77 CA PHE A 6 0.986 3.666 -6.508 1.00 0.00 C ATOM 78 C PHE A 6 1.301 3.266 -5.053 1.00 0.00 C ATOM 79 O PHE A 6 1.635 4.119 -4.220 1.00 0.00 O ATOM 80 CB PHE A 6 2.248 3.660 -7.432 1.00 0.00 C ATOM 81 CG PHE A 6 2.922 2.314 -7.754 1.00 0.00 C ATOM 82 CD1 PHE A 6 2.256 1.103 -7.669 1.00 0.00 C ATOM 83 CD2 PHE A 6 4.242 2.290 -8.201 1.00 0.00 C ATOM 84 CE1 PHE A 6 2.884 -0.075 -8.012 1.00 0.00 C ATOM 85 CE2 PHE A 6 4.872 1.111 -8.536 1.00 0.00 C ATOM 86 CZ PHE A 6 4.190 -0.075 -8.443 1.00 0.00 C ATOM 0 H PHE A 6 0.911 5.616 -5.787 1.00 0.00 H new ATOM 0 HA PHE A 6 0.278 2.939 -6.906 1.00 0.00 H new ATOM 0 HB2 PHE A 6 1.967 4.124 -8.378 1.00 0.00 H new ATOM 0 HB3 PHE A 6 2.998 4.303 -6.972 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.231 1.081 -7.329 1.00 0.00 H new ATOM 0 HD2 PHE A 6 4.785 3.219 -8.287 1.00 0.00 H new ATOM 0 HE1 PHE A 6 2.345 -1.008 -7.942 1.00 0.00 H new ATOM 0 HE2 PHE A 6 5.899 1.121 -8.870 1.00 0.00 H new ATOM 0 HZ PHE A 6 4.675 -1.003 -8.707 1.00 0.00 H new ATOM 96 N THR A 7 1.152 1.980 -4.752 1.00 0.00 N ATOM 97 CA THR A 7 1.470 1.404 -3.437 1.00 0.00 C ATOM 98 C THR A 7 1.861 -0.064 -3.626 1.00 0.00 C ATOM 99 O THR A 7 1.270 -0.773 -4.448 1.00 0.00 O ATOM 100 CB THR A 7 0.287 1.552 -2.416 1.00 0.00 C ATOM 101 OG1 THR A 7 0.581 0.854 -1.193 1.00 0.00 O ATOM 102 CG2 THR A 7 -1.045 1.051 -2.994 1.00 0.00 C ATOM 0 H THR A 7 0.802 1.293 -5.420 1.00 0.00 H new ATOM 0 HA THR A 7 2.305 1.957 -3.008 1.00 0.00 H new ATOM 0 HB THR A 7 0.180 2.617 -2.208 1.00 0.00 H new ATOM 0 HG1 THR A 7 1.501 1.049 -0.918 1.00 0.00 H new ATOM 0 HG21 THR A 7 -1.833 1.174 -2.251 1.00 0.00 H new ATOM 0 HG22 THR A 7 -1.294 1.626 -3.886 1.00 0.00 H new ATOM 0 HG23 THR A 7 -0.954 -0.003 -3.256 1.00 0.00 H new ATOM 110 N ILE A 8 2.891 -0.504 -2.893 1.00 0.00 N ATOM 111 CA ILE A 8 3.530 -1.820 -3.090 1.00 0.00 C ATOM 112 C ILE A 8 3.499 -2.618 -1.778 1.00 0.00 C ATOM 113 O ILE A 8 3.747 -2.063 -0.705 1.00 0.00 O ATOM 114 CB ILE A 8 5.020 -1.623 -3.570 1.00 0.00 C ATOM 115 CG1 ILE A 8 5.075 -0.737 -4.863 1.00 0.00 C ATOM 116 CG2 ILE A 8 5.760 -2.972 -3.773 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.472 -0.338 -5.305 1.00 0.00 C ATOM 0 H ILE A 8 3.310 0.043 -2.141 1.00 0.00 H new ATOM 0 HA ILE A 8 2.982 -2.374 -3.852 1.00 0.00 H new ATOM 0 HB ILE A 8 5.549 -1.098 -2.774 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.592 -1.278 -5.677 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.492 0.168 -4.691 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.781 -2.781 -4.103 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.780 -3.521 -2.832 1.00 0.00 H new ATOM 0 HG23 ILE A 8 5.239 -3.563 -4.527 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.408 0.272 -6.206 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.955 0.234 -4.513 1.00 0.00 H new ATOM 0 HD13 ILE A 8 7.057 -1.234 -5.514 1.00 0.00 H new ATOM 129 N LEU A 9 3.190 -3.916 -1.867 1.00 0.00 N ATOM 130 CA LEU A 9 3.228 -4.837 -0.718 1.00 0.00 C ATOM 131 C LEU A 9 4.545 -5.614 -0.800 1.00 0.00 C ATOM 132 O LEU A 9 4.896 -6.147 -1.857 1.00 0.00 O ATOM 133 CB LEU A 9 2.002 -5.807 -0.716 1.00 0.00 C ATOM 134 CG LEU A 9 0.595 -5.174 -0.458 1.00 0.00 C ATOM 135 CD1 LEU A 9 0.562 -4.379 0.864 1.00 0.00 C ATOM 136 CD2 LEU A 9 0.104 -4.331 -1.660 1.00 0.00 C ATOM 0 H LEU A 9 2.905 -4.362 -2.739 1.00 0.00 H new ATOM 0 HA LEU A 9 3.172 -4.274 0.214 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.972 -6.317 -1.679 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.175 -6.569 0.044 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.111 -5.998 -0.352 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -0.431 -3.954 1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 9 0.797 -5.045 1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 9 1.298 -3.576 0.824 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.877 -3.912 -1.434 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.809 -3.522 -1.849 1.00 0.00 H new ATOM 0 HD23 LEU A 9 0.033 -4.965 -2.544 1.00 0.00 H new ATOM 148 N TYR A 10 5.274 -5.649 0.325 1.00 0.00 N ATOM 149 CA TYR A 10 6.480 -6.464 0.475 1.00 0.00 C ATOM 150 C TYR A 10 6.088 -7.910 0.781 1.00 0.00 C ATOM 151 O TYR A 10 5.506 -8.161 1.828 1.00 0.00 O ATOM 152 CB TYR A 10 7.382 -5.925 1.619 1.00 0.00 C ATOM 153 CG TYR A 10 7.974 -4.532 1.376 1.00 0.00 C ATOM 154 CD1 TYR A 10 8.615 -4.231 0.176 1.00 0.00 C ATOM 155 CD2 TYR A 10 7.926 -3.538 2.357 1.00 0.00 C ATOM 156 CE1 TYR A 10 9.179 -2.994 -0.040 1.00 0.00 C ATOM 157 CE2 TYR A 10 8.502 -2.303 2.149 1.00 0.00 C ATOM 158 CZ TYR A 10 9.128 -2.034 0.950 1.00 0.00 C ATOM 159 OH TYR A 10 9.736 -0.807 0.753 1.00 0.00 O ATOM 0 H TYR A 10 5.039 -5.109 1.158 1.00 0.00 H new ATOM 0 HA TYR A 10 7.040 -6.417 -0.459 1.00 0.00 H new ATOM 0 HB2 TYR A 10 6.799 -5.900 2.540 1.00 0.00 H new ATOM 0 HB3 TYR A 10 8.200 -6.628 1.778 1.00 0.00 H new ATOM 0 HD1 TYR A 10 8.670 -4.982 -0.599 1.00 0.00 H new ATOM 0 HD2 TYR A 10 7.429 -3.741 3.294 1.00 0.00 H new ATOM 0 HE1 TYR A 10 9.660 -2.775 -0.982 1.00 0.00 H new ATOM 0 HE2 TYR A 10 8.463 -1.549 2.922 1.00 0.00 H new ATOM 0 HH TYR A 10 10.154 -0.787 -0.133 1.00 0.00 H new ATOM 169 N VAL A 11 6.403 -8.843 -0.132 1.00 0.00 N ATOM 170 CA VAL A 11 6.027 -10.274 -0.013 1.00 0.00 C ATOM 171 C VAL A 11 7.298 -11.119 0.152 1.00 0.00 C ATOM 172 O VAL A 11 8.397 -10.661 -0.147 1.00 0.00 O ATOM 173 CB VAL A 11 5.215 -10.770 -1.276 1.00 0.00 C ATOM 174 CG1 VAL A 11 3.910 -9.962 -1.463 1.00 0.00 C ATOM 175 CG2 VAL A 11 6.061 -10.751 -2.581 1.00 0.00 C ATOM 0 H VAL A 11 6.928 -8.632 -0.980 1.00 0.00 H new ATOM 0 HA VAL A 11 5.384 -10.387 0.860 1.00 0.00 H new ATOM 0 HB VAL A 11 4.953 -11.810 -1.078 1.00 0.00 H new ATOM 0 HG11 VAL A 11 3.377 -10.329 -2.340 1.00 0.00 H new ATOM 0 HG12 VAL A 11 3.280 -10.078 -0.581 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.151 -8.908 -1.600 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.452 -11.101 -3.414 1.00 0.00 H new ATOM 0 HG22 VAL A 11 6.399 -9.734 -2.781 1.00 0.00 H new ATOM 0 HG23 VAL A 11 6.926 -11.404 -2.464 1.00 0.00 H new ATOM 185 N ASP A 12 7.140 -12.351 0.663 1.00 0.00 N ATOM 186 CA ASP A 12 8.264 -13.252 0.949 1.00 0.00 C ATOM 187 C ASP A 12 8.469 -14.242 -0.210 1.00 0.00 C ATOM 188 O ASP A 12 9.551 -14.286 -0.796 1.00 0.00 O ATOM 189 CB ASP A 12 8.027 -14.000 2.284 1.00 0.00 C ATOM 190 CG ASP A 12 9.147 -14.988 2.635 1.00 0.00 C ATOM 191 OD1 ASP A 12 10.217 -14.543 3.094 1.00 0.00 O ATOM 192 OD2 ASP A 12 8.973 -16.209 2.444 1.00 0.00 O ATOM 0 H ASP A 12 6.228 -12.749 0.889 1.00 0.00 H new ATOM 0 HA ASP A 12 9.173 -12.658 1.049 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.930 -13.271 3.088 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.081 -14.539 2.227 1.00 0.00 H new ATOM 197 N ASN A 13 7.441 -15.051 -0.528 1.00 0.00 N ATOM 198 CA ASN A 13 7.544 -16.088 -1.591 1.00 0.00 C ATOM 199 C ASN A 13 6.929 -15.566 -2.912 1.00 0.00 C ATOM 200 O ASN A 13 5.699 -15.578 -3.047 1.00 0.00 O ATOM 201 CB ASN A 13 6.854 -17.409 -1.137 1.00 0.00 C ATOM 202 CG ASN A 13 7.070 -18.575 -2.119 1.00 0.00 C ATOM 203 OD1 ASN A 13 8.090 -18.646 -2.814 1.00 0.00 O ATOM 204 ND2 ASN A 13 6.125 -19.499 -2.168 1.00 0.00 N ATOM 0 H ASN A 13 6.530 -15.013 -0.070 1.00 0.00 H new ATOM 0 HA ASN A 13 8.598 -16.304 -1.767 1.00 0.00 H new ATOM 0 HB2 ASN A 13 7.237 -17.693 -0.157 1.00 0.00 H new ATOM 0 HB3 ASN A 13 5.785 -17.232 -1.023 1.00 0.00 H new ATOM 0 HD21 ASN A 13 6.226 -20.299 -2.792 1.00 0.00 H new ATOM 0 HD22 ASN A 13 5.295 -19.411 -1.582 1.00 0.00 H new ATOM 211 N PRO A 14 7.778 -15.101 -3.907 1.00 0.00 N ATOM 212 CA PRO A 14 7.299 -14.436 -5.149 1.00 0.00 C ATOM 213 C PRO A 14 6.192 -15.208 -5.944 1.00 0.00 C ATOM 214 O PRO A 14 5.152 -14.605 -6.201 1.00 0.00 O ATOM 215 CB PRO A 14 8.591 -14.203 -5.988 1.00 0.00 C ATOM 216 CG PRO A 14 9.695 -14.193 -4.973 1.00 0.00 C ATOM 217 CD PRO A 14 9.271 -15.161 -3.883 1.00 0.00 C ATOM 0 HA PRO A 14 6.779 -13.511 -4.901 1.00 0.00 H new ATOM 0 HB2 PRO A 14 8.735 -14.993 -6.725 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.545 -13.262 -6.536 1.00 0.00 H new ATOM 0 HG2 PRO A 14 10.640 -14.500 -5.421 1.00 0.00 H new ATOM 0 HG3 PRO A 14 9.844 -13.192 -4.569 1.00 0.00 H new ATOM 0 HD2 PRO A 14 9.633 -16.170 -4.082 1.00 0.00 H new ATOM 0 HD3 PRO A 14 9.667 -14.866 -2.911 1.00 0.00 H new ATOM 225 N PRO A 15 6.340 -16.548 -6.314 1.00 0.00 N ATOM 226 CA PRO A 15 5.309 -17.254 -7.129 1.00 0.00 C ATOM 227 C PRO A 15 3.920 -17.272 -6.444 1.00 0.00 C ATOM 228 O PRO A 15 2.917 -16.863 -7.029 1.00 0.00 O ATOM 229 CB PRO A 15 5.891 -18.688 -7.304 1.00 0.00 C ATOM 230 CG PRO A 15 6.870 -18.843 -6.179 1.00 0.00 C ATOM 231 CD PRO A 15 7.471 -17.469 -5.992 1.00 0.00 C ATOM 0 HA PRO A 15 5.127 -16.755 -8.081 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.106 -19.443 -7.252 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.379 -18.802 -8.272 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.376 -19.185 -5.270 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.636 -19.579 -6.421 1.00 0.00 H new ATOM 0 HD2 PRO A 15 7.830 -17.323 -4.973 1.00 0.00 H new ATOM 0 HD3 PRO A 15 8.321 -17.309 -6.656 1.00 0.00 H new ATOM 239 N ALA A 16 3.917 -17.688 -5.168 1.00 0.00 N ATOM 240 CA ALA A 16 2.691 -18.042 -4.436 1.00 0.00 C ATOM 241 C ALA A 16 1.896 -16.798 -4.040 1.00 0.00 C ATOM 242 O ALA A 16 0.661 -16.794 -4.110 1.00 0.00 O ATOM 243 CB ALA A 16 3.035 -18.868 -3.191 1.00 0.00 C ATOM 0 H ALA A 16 4.767 -17.789 -4.613 1.00 0.00 H new ATOM 0 HA ALA A 16 2.068 -18.640 -5.101 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.119 -19.123 -2.659 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.547 -19.782 -3.491 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.685 -18.287 -2.537 1.00 0.00 H new ATOM 249 N SER A 17 2.621 -15.733 -3.673 1.00 0.00 N ATOM 250 CA SER A 17 2.010 -14.489 -3.202 1.00 0.00 C ATOM 251 C SER A 17 1.460 -13.706 -4.397 1.00 0.00 C ATOM 252 O SER A 17 0.400 -13.099 -4.296 1.00 0.00 O ATOM 253 CB SER A 17 3.049 -13.634 -2.453 1.00 0.00 C ATOM 254 OG SER A 17 4.149 -13.315 -3.297 1.00 0.00 O ATOM 0 H SER A 17 3.641 -15.712 -3.695 1.00 0.00 H new ATOM 0 HA SER A 17 1.196 -14.730 -2.518 1.00 0.00 H new ATOM 0 HB2 SER A 17 2.581 -12.716 -2.096 1.00 0.00 H new ATOM 0 HB3 SER A 17 3.404 -14.173 -1.575 1.00 0.00 H new ATOM 0 HG SER A 17 4.804 -14.043 -3.269 1.00 0.00 H new ATOM 260 N THR A 18 2.169 -13.759 -5.542 1.00 0.00 N ATOM 261 CA THR A 18 1.733 -13.089 -6.769 1.00 0.00 C ATOM 262 C THR A 18 0.424 -13.641 -7.349 1.00 0.00 C ATOM 263 O THR A 18 -0.484 -12.881 -7.686 1.00 0.00 O ATOM 264 CB THR A 18 2.852 -13.113 -7.862 1.00 0.00 C ATOM 265 OG1 THR A 18 4.007 -12.402 -7.382 1.00 0.00 O ATOM 266 CG2 THR A 18 2.404 -12.500 -9.209 1.00 0.00 C ATOM 0 H THR A 18 3.050 -14.264 -5.636 1.00 0.00 H new ATOM 0 HA THR A 18 1.535 -12.059 -6.474 1.00 0.00 H new ATOM 0 HB THR A 18 3.086 -14.161 -8.048 1.00 0.00 H new ATOM 0 HG1 THR A 18 4.594 -13.020 -6.899 1.00 0.00 H new ATOM 0 HG21 THR A 18 3.227 -12.548 -9.922 1.00 0.00 H new ATOM 0 HG22 THR A 18 1.553 -13.059 -9.598 1.00 0.00 H new ATOM 0 HG23 THR A 18 2.116 -11.460 -9.057 1.00 0.00 H new ATOM 274 N GLN A 19 0.330 -14.997 -7.365 1.00 0.00 N ATOM 275 CA GLN A 19 -0.893 -15.727 -7.763 1.00 0.00 C ATOM 276 C GLN A 19 -2.023 -15.446 -6.770 1.00 0.00 C ATOM 277 O GLN A 19 -3.197 -15.360 -7.162 1.00 0.00 O ATOM 278 CB GLN A 19 -0.650 -17.252 -7.853 1.00 0.00 C ATOM 279 CG GLN A 19 0.376 -17.680 -8.912 1.00 0.00 C ATOM 280 CD GLN A 19 0.307 -19.171 -9.233 1.00 0.00 C ATOM 281 OE1 GLN A 19 0.992 -19.986 -8.624 1.00 0.00 O ATOM 282 NE2 GLN A 19 -0.550 -19.539 -10.175 1.00 0.00 N ATOM 0 H GLN A 19 1.102 -15.610 -7.102 1.00 0.00 H new ATOM 0 HA GLN A 19 -1.176 -15.371 -8.754 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -0.317 -17.611 -6.879 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -1.599 -17.745 -8.067 1.00 0.00 H new ATOM 0 HG2 GLN A 19 0.209 -17.108 -9.825 1.00 0.00 H new ATOM 0 HG3 GLN A 19 1.378 -17.435 -8.561 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -1.105 -18.836 -10.663 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -0.655 -20.526 -10.412 1.00 0.00 H new ATOM 291 N PHE A 20 -1.650 -15.296 -5.485 1.00 0.00 N ATOM 292 CA PHE A 20 -2.615 -15.037 -4.416 1.00 0.00 C ATOM 293 C PHE A 20 -3.250 -13.661 -4.622 1.00 0.00 C ATOM 294 O PHE A 20 -4.468 -13.544 -4.525 1.00 0.00 O ATOM 295 CB PHE A 20 -1.967 -15.118 -3.007 1.00 0.00 C ATOM 296 CG PHE A 20 -2.980 -14.950 -1.869 1.00 0.00 C ATOM 297 CD1 PHE A 20 -3.754 -16.031 -1.438 1.00 0.00 C ATOM 298 CD2 PHE A 20 -3.187 -13.710 -1.262 1.00 0.00 C ATOM 299 CE1 PHE A 20 -4.698 -15.872 -0.442 1.00 0.00 C ATOM 300 CE2 PHE A 20 -4.129 -13.560 -0.266 1.00 0.00 C ATOM 301 CZ PHE A 20 -4.885 -14.638 0.143 1.00 0.00 C ATOM 0 H PHE A 20 -0.682 -15.351 -5.168 1.00 0.00 H new ATOM 0 HA PHE A 20 -3.380 -15.812 -4.465 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -1.465 -16.079 -2.899 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -1.201 -14.347 -2.921 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -3.612 -17.002 -1.889 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -2.602 -12.858 -1.576 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -5.291 -16.716 -0.121 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -4.275 -12.594 0.195 1.00 0.00 H new ATOM 0 HZ PHE A 20 -5.623 -14.516 0.921 1.00 0.00 H new ATOM 311 N TYR A 21 -2.433 -12.643 -4.981 1.00 0.00 N ATOM 312 CA TYR A 21 -2.946 -11.296 -5.295 1.00 0.00 C ATOM 313 C TYR A 21 -3.721 -11.328 -6.625 1.00 0.00 C ATOM 314 O TYR A 21 -4.621 -10.507 -6.807 1.00 0.00 O ATOM 315 CB TYR A 21 -1.808 -10.241 -5.303 1.00 0.00 C ATOM 316 CG TYR A 21 -1.427 -9.721 -3.901 1.00 0.00 C ATOM 317 CD1 TYR A 21 -0.573 -10.440 -3.061 1.00 0.00 C ATOM 318 CD2 TYR A 21 -1.945 -8.516 -3.411 1.00 0.00 C ATOM 319 CE1 TYR A 21 -0.249 -9.983 -1.798 1.00 0.00 C ATOM 320 CE2 TYR A 21 -1.625 -8.058 -2.146 1.00 0.00 C ATOM 321 CZ TYR A 21 -0.780 -8.793 -1.346 1.00 0.00 C ATOM 322 OH TYR A 21 -0.463 -8.335 -0.085 1.00 0.00 O ATOM 0 H TYR A 21 -1.420 -12.732 -5.059 1.00 0.00 H new ATOM 0 HA TYR A 21 -3.638 -10.992 -4.509 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -0.925 -10.677 -5.770 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.113 -9.397 -5.922 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -0.157 -11.375 -3.407 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -2.608 -7.933 -4.033 1.00 0.00 H new ATOM 0 HE1 TYR A 21 0.417 -10.555 -1.168 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -2.037 -7.126 -1.787 1.00 0.00 H new ATOM 0 HH TYR A 21 0.045 -9.022 0.395 1.00 0.00 H new ATOM 332 N LYS A 22 -3.378 -12.245 -7.556 1.00 0.00 N ATOM 333 CA LYS A 22 -4.090 -12.345 -8.850 1.00 0.00 C ATOM 334 C LYS A 22 -5.601 -12.575 -8.656 1.00 0.00 C ATOM 335 O LYS A 22 -6.430 -11.860 -9.222 1.00 0.00 O ATOM 336 CB LYS A 22 -3.473 -13.433 -9.772 1.00 0.00 C ATOM 337 CG LYS A 22 -2.101 -13.052 -10.372 1.00 0.00 C ATOM 338 CD LYS A 22 -1.455 -14.193 -11.195 1.00 0.00 C ATOM 339 CE LYS A 22 -2.259 -14.575 -12.456 1.00 0.00 C ATOM 340 NZ LYS A 22 -1.655 -15.718 -13.192 1.00 0.00 N ATOM 0 H LYS A 22 -2.622 -12.919 -7.439 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.964 -11.384 -9.350 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -3.364 -14.356 -9.203 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -4.168 -13.640 -10.586 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -2.222 -12.176 -11.010 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.426 -12.768 -9.565 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -0.450 -13.892 -11.492 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -1.350 -15.073 -10.561 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.279 -14.830 -12.169 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -2.321 -13.712 -13.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -2.232 -15.935 -14.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -0.691 -15.468 -13.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -1.620 -16.551 -12.571 1.00 0.00 H new ATOM 354 N ALA A 23 -5.933 -13.576 -7.827 1.00 0.00 N ATOM 355 CA ALA A 23 -7.337 -13.899 -7.479 1.00 0.00 C ATOM 356 C ALA A 23 -7.916 -12.874 -6.472 1.00 0.00 C ATOM 357 O ALA A 23 -9.109 -12.549 -6.515 1.00 0.00 O ATOM 358 CB ALA A 23 -7.422 -15.324 -6.904 1.00 0.00 C ATOM 0 H ALA A 23 -5.247 -14.184 -7.379 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.935 -13.846 -8.389 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.457 -15.553 -6.651 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -7.063 -16.038 -7.646 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.806 -15.392 -6.007 1.00 0.00 H new ATOM 364 N LEU A 24 -7.044 -12.390 -5.576 1.00 0.00 N ATOM 365 CA LEU A 24 -7.400 -11.485 -4.449 1.00 0.00 C ATOM 366 C LEU A 24 -7.981 -10.146 -4.934 1.00 0.00 C ATOM 367 O LEU A 24 -8.952 -9.638 -4.376 1.00 0.00 O ATOM 368 CB LEU A 24 -6.117 -11.177 -3.634 1.00 0.00 C ATOM 369 CG LEU A 24 -6.285 -10.433 -2.280 1.00 0.00 C ATOM 370 CD1 LEU A 24 -6.855 -11.377 -1.220 1.00 0.00 C ATOM 371 CD2 LEU A 24 -4.954 -9.800 -1.815 1.00 0.00 C ATOM 0 H LEU A 24 -6.050 -12.615 -5.606 1.00 0.00 H new ATOM 0 HA LEU A 24 -8.156 -11.991 -3.849 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.609 -12.121 -3.438 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.454 -10.583 -4.263 1.00 0.00 H new ATOM 0 HG LEU A 24 -6.994 -9.618 -2.426 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.967 -10.841 -0.278 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.828 -11.745 -1.546 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.177 -12.219 -1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.107 -9.288 -0.865 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.204 -10.581 -1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.611 -9.084 -2.562 1.00 0.00 H new ATOM 383 N LEU A 25 -7.352 -9.597 -5.977 1.00 0.00 N ATOM 384 CA LEU A 25 -7.785 -8.348 -6.628 1.00 0.00 C ATOM 385 C LEU A 25 -8.765 -8.706 -7.754 1.00 0.00 C ATOM 386 O LEU A 25 -9.794 -8.051 -7.928 1.00 0.00 O ATOM 387 CB LEU A 25 -6.540 -7.603 -7.181 1.00 0.00 C ATOM 388 CG LEU A 25 -5.317 -7.530 -6.208 1.00 0.00 C ATOM 389 CD1 LEU A 25 -4.093 -6.927 -6.907 1.00 0.00 C ATOM 390 CD2 LEU A 25 -5.648 -6.767 -4.914 1.00 0.00 C ATOM 0 H LEU A 25 -6.520 -10.007 -6.400 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.286 -7.690 -5.918 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.222 -8.094 -8.101 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -6.833 -6.587 -7.446 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.076 -8.553 -5.921 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.257 -6.888 -6.208 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.822 -7.545 -7.763 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.329 -5.919 -7.248 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.768 -6.743 -4.271 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.947 -5.748 -5.159 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.464 -7.269 -4.394 1.00 0.00 H new ATOM 402 N GLY A 26 -8.413 -9.761 -8.512 1.00 0.00 N ATOM 403 CA GLY A 26 -9.147 -10.168 -9.711 1.00 0.00 C ATOM 404 C GLY A 26 -8.462 -9.701 -10.993 1.00 0.00 C ATOM 405 O GLY A 26 -9.125 -9.471 -12.012 1.00 0.00 O ATOM 0 H GLY A 26 -7.609 -10.353 -8.304 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.241 -11.254 -9.726 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.157 -9.761 -9.672 1.00 0.00 H new ATOM 409 N VAL A 27 -7.115 -9.561 -10.932 1.00 0.00 N ATOM 410 CA VAL A 27 -6.281 -9.059 -12.056 1.00 0.00 C ATOM 411 C VAL A 27 -5.070 -9.991 -12.280 1.00 0.00 C ATOM 412 O VAL A 27 -4.849 -10.920 -11.514 1.00 0.00 O ATOM 413 CB VAL A 27 -5.764 -7.588 -11.797 1.00 0.00 C ATOM 414 CG1 VAL A 27 -6.943 -6.609 -11.595 1.00 0.00 C ATOM 415 CG2 VAL A 27 -4.775 -7.534 -10.602 1.00 0.00 C ATOM 0 H VAL A 27 -6.573 -9.793 -10.100 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.912 -9.047 -12.945 1.00 0.00 H new ATOM 0 HB VAL A 27 -5.218 -7.271 -12.686 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -6.556 -5.605 -11.419 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.570 -6.605 -12.487 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -7.536 -6.925 -10.737 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.440 -6.507 -10.453 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.275 -7.887 -9.700 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.915 -8.169 -10.813 1.00 0.00 H new ATOM 425 N ASP A 28 -4.302 -9.729 -13.344 1.00 0.00 N ATOM 426 CA ASP A 28 -3.045 -10.449 -13.655 1.00 0.00 C ATOM 427 C ASP A 28 -1.891 -9.422 -13.801 1.00 0.00 C ATOM 428 O ASP A 28 -2.150 -8.272 -14.178 1.00 0.00 O ATOM 429 CB ASP A 28 -3.223 -11.287 -14.954 1.00 0.00 C ATOM 430 CG ASP A 28 -3.594 -10.430 -16.180 1.00 0.00 C ATOM 431 OD1 ASP A 28 -4.780 -10.059 -16.316 1.00 0.00 O ATOM 432 OD2 ASP A 28 -2.707 -10.114 -17.004 1.00 0.00 O ATOM 0 H ASP A 28 -4.531 -9.005 -14.025 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.798 -11.135 -12.845 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -2.298 -11.826 -15.161 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -3.999 -12.035 -14.793 1.00 0.00 H new ATOM 437 N PRO A 29 -0.607 -9.801 -13.479 1.00 0.00 N ATOM 438 CA PRO A 29 0.545 -8.867 -13.517 1.00 0.00 C ATOM 439 C PRO A 29 0.894 -8.428 -14.953 1.00 0.00 C ATOM 440 O PRO A 29 1.236 -9.272 -15.791 1.00 0.00 O ATOM 441 CB PRO A 29 1.716 -9.673 -12.861 1.00 0.00 C ATOM 442 CG PRO A 29 1.058 -10.862 -12.227 1.00 0.00 C ATOM 443 CD PRO A 29 -0.168 -11.148 -13.063 1.00 0.00 C ATOM 0 HA PRO A 29 0.331 -7.937 -12.990 1.00 0.00 H new ATOM 0 HB2 PRO A 29 2.451 -9.979 -13.606 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.243 -9.072 -12.120 1.00 0.00 H new ATOM 0 HG2 PRO A 29 1.730 -11.720 -12.213 1.00 0.00 H new ATOM 0 HG3 PRO A 29 0.786 -10.653 -11.192 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.066 -11.779 -13.920 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -0.937 -11.664 -12.488 1.00 0.00 H new ATOM 451 N VAL A 30 0.788 -7.111 -15.218 1.00 0.00 N ATOM 452 CA VAL A 30 1.200 -6.509 -16.501 1.00 0.00 C ATOM 453 C VAL A 30 2.725 -6.653 -16.695 1.00 0.00 C ATOM 454 O VAL A 30 3.197 -6.977 -17.791 1.00 0.00 O ATOM 455 CB VAL A 30 0.754 -4.995 -16.608 1.00 0.00 C ATOM 456 CG1 VAL A 30 1.292 -4.129 -15.440 1.00 0.00 C ATOM 457 CG2 VAL A 30 1.130 -4.383 -17.988 1.00 0.00 C ATOM 0 H VAL A 30 0.415 -6.436 -14.550 1.00 0.00 H new ATOM 0 HA VAL A 30 0.695 -7.049 -17.302 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.333 -4.989 -16.526 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.955 -3.100 -15.565 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.918 -4.521 -14.494 1.00 0.00 H new ATOM 0 HG13 VAL A 30 2.382 -4.156 -15.439 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.808 -3.342 -18.024 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.210 -4.434 -18.126 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.636 -4.944 -18.781 1.00 0.00 H new ATOM 467 N GLU A 31 3.471 -6.458 -15.594 1.00 0.00 N ATOM 468 CA GLU A 31 4.929 -6.595 -15.549 1.00 0.00 C ATOM 469 C GLU A 31 5.299 -7.713 -14.574 1.00 0.00 C ATOM 470 O GLU A 31 4.609 -7.931 -13.569 1.00 0.00 O ATOM 471 CB GLU A 31 5.577 -5.254 -15.110 1.00 0.00 C ATOM 472 CG GLU A 31 5.283 -4.052 -16.031 1.00 0.00 C ATOM 473 CD GLU A 31 5.764 -4.281 -17.473 1.00 0.00 C ATOM 474 OE1 GLU A 31 6.990 -4.231 -17.707 1.00 0.00 O ATOM 475 OE2 GLU A 31 4.930 -4.526 -18.372 1.00 0.00 O ATOM 0 H GLU A 31 3.065 -6.196 -14.696 1.00 0.00 H new ATOM 0 HA GLU A 31 5.303 -6.847 -16.541 1.00 0.00 H new ATOM 0 HB2 GLU A 31 5.232 -5.014 -14.104 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.657 -5.392 -15.052 1.00 0.00 H new ATOM 0 HG2 GLU A 31 4.211 -3.857 -16.036 1.00 0.00 H new ATOM 0 HG3 GLU A 31 5.767 -3.163 -15.627 1.00 0.00 H new ATOM 482 N SER A 32 6.386 -8.423 -14.881 1.00 0.00 N ATOM 483 CA SER A 32 6.920 -9.486 -14.032 1.00 0.00 C ATOM 484 C SER A 32 8.451 -9.455 -14.110 1.00 0.00 C ATOM 485 O SER A 32 9.022 -9.293 -15.189 1.00 0.00 O ATOM 486 CB SER A 32 6.354 -10.860 -14.466 1.00 0.00 C ATOM 487 OG SER A 32 6.631 -11.130 -15.829 1.00 0.00 O ATOM 0 H SER A 32 6.924 -8.274 -15.734 1.00 0.00 H new ATOM 0 HA SER A 32 6.617 -9.327 -12.997 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.785 -11.645 -13.844 1.00 0.00 H new ATOM 0 HB3 SER A 32 5.277 -10.879 -14.302 1.00 0.00 H new ATOM 0 HG SER A 32 6.262 -12.005 -16.071 1.00 0.00 H new ATOM 493 N SER A 33 9.089 -9.572 -12.950 1.00 0.00 N ATOM 494 CA SER A 33 10.549 -9.488 -12.780 1.00 0.00 C ATOM 495 C SER A 33 10.977 -10.463 -11.653 1.00 0.00 C ATOM 496 O SER A 33 10.130 -10.816 -10.814 1.00 0.00 O ATOM 497 CB SER A 33 10.951 -8.020 -12.439 1.00 0.00 C ATOM 498 OG SER A 33 10.616 -7.126 -13.495 1.00 0.00 O ATOM 0 H SER A 33 8.596 -9.733 -12.071 1.00 0.00 H new ATOM 0 HA SER A 33 11.057 -9.771 -13.702 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.448 -7.708 -11.524 1.00 0.00 H new ATOM 0 HB3 SER A 33 12.023 -7.971 -12.246 1.00 0.00 H new ATOM 0 HG SER A 33 10.542 -6.215 -13.141 1.00 0.00 H new ATOM 504 N PRO A 34 12.289 -10.925 -11.611 1.00 0.00 N ATOM 505 CA PRO A 34 12.779 -11.928 -10.615 1.00 0.00 C ATOM 506 C PRO A 34 12.460 -11.562 -9.142 1.00 0.00 C ATOM 507 O PRO A 34 12.275 -12.458 -8.305 1.00 0.00 O ATOM 508 CB PRO A 34 14.325 -11.987 -10.877 1.00 0.00 C ATOM 509 CG PRO A 34 14.629 -10.768 -11.695 1.00 0.00 C ATOM 510 CD PRO A 34 13.393 -10.531 -12.534 1.00 0.00 C ATOM 0 HA PRO A 34 12.279 -12.888 -10.744 1.00 0.00 H new ATOM 0 HB2 PRO A 34 14.884 -11.983 -9.941 1.00 0.00 H new ATOM 0 HB3 PRO A 34 14.600 -12.898 -11.409 1.00 0.00 H new ATOM 0 HG2 PRO A 34 14.842 -9.910 -11.058 1.00 0.00 H new ATOM 0 HG3 PRO A 34 15.506 -10.924 -12.323 1.00 0.00 H new ATOM 0 HD2 PRO A 34 13.308 -9.490 -12.845 1.00 0.00 H new ATOM 0 HD3 PRO A 34 13.397 -11.135 -13.441 1.00 0.00 H new ATOM 518 N THR A 35 12.364 -10.248 -8.829 1.00 0.00 N ATOM 519 CA THR A 35 12.105 -9.789 -7.452 1.00 0.00 C ATOM 520 C THR A 35 10.876 -8.863 -7.343 1.00 0.00 C ATOM 521 O THR A 35 10.580 -8.354 -6.255 1.00 0.00 O ATOM 522 CB THR A 35 13.369 -9.093 -6.831 1.00 0.00 C ATOM 523 OG1 THR A 35 13.227 -8.985 -5.401 1.00 0.00 O ATOM 524 CG2 THR A 35 13.642 -7.699 -7.414 1.00 0.00 C ATOM 0 H THR A 35 12.462 -9.495 -9.510 1.00 0.00 H new ATOM 0 HA THR A 35 11.880 -10.688 -6.878 1.00 0.00 H new ATOM 0 HB THR A 35 14.219 -9.726 -7.086 1.00 0.00 H new ATOM 0 HG1 THR A 35 12.470 -9.533 -5.105 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.528 -7.274 -6.942 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.807 -7.780 -8.488 1.00 0.00 H new ATOM 0 HG23 THR A 35 12.785 -7.052 -7.226 1.00 0.00 H new ATOM 532 N PHE A 36 10.130 -8.664 -8.447 1.00 0.00 N ATOM 533 CA PHE A 36 9.017 -7.695 -8.447 1.00 0.00 C ATOM 534 C PHE A 36 7.925 -8.102 -9.452 1.00 0.00 C ATOM 535 O PHE A 36 8.219 -8.375 -10.610 1.00 0.00 O ATOM 536 CB PHE A 36 9.559 -6.268 -8.760 1.00 0.00 C ATOM 537 CG PHE A 36 8.594 -5.121 -8.426 1.00 0.00 C ATOM 538 CD1 PHE A 36 7.561 -4.760 -9.292 1.00 0.00 C ATOM 539 CD2 PHE A 36 8.726 -4.408 -7.236 1.00 0.00 C ATOM 540 CE1 PHE A 36 6.698 -3.730 -8.976 1.00 0.00 C ATOM 541 CE2 PHE A 36 7.864 -3.380 -6.925 1.00 0.00 C ATOM 542 CZ PHE A 36 6.848 -3.040 -7.795 1.00 0.00 C ATOM 0 H PHE A 36 10.273 -9.150 -9.332 1.00 0.00 H new ATOM 0 HA PHE A 36 8.562 -7.689 -7.457 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.485 -6.117 -8.205 1.00 0.00 H new ATOM 0 HB3 PHE A 36 9.810 -6.215 -9.819 1.00 0.00 H new ATOM 0 HD1 PHE A 36 7.435 -5.294 -10.222 1.00 0.00 H new ATOM 0 HD2 PHE A 36 9.517 -4.666 -6.547 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.903 -3.465 -9.657 1.00 0.00 H new ATOM 0 HE2 PHE A 36 7.983 -2.839 -5.998 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.172 -2.234 -7.549 1.00 0.00 H new ATOM 552 N SER A 37 6.665 -8.120 -8.996 1.00 0.00 N ATOM 553 CA SER A 37 5.489 -8.320 -9.857 1.00 0.00 C ATOM 554 C SER A 37 4.612 -7.064 -9.786 1.00 0.00 C ATOM 555 O SER A 37 4.309 -6.580 -8.694 1.00 0.00 O ATOM 556 CB SER A 37 4.711 -9.567 -9.391 1.00 0.00 C ATOM 557 OG SER A 37 5.540 -10.722 -9.419 1.00 0.00 O ATOM 0 H SER A 37 6.430 -7.995 -8.011 1.00 0.00 H new ATOM 0 HA SER A 37 5.796 -8.482 -10.890 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.335 -9.409 -8.380 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.844 -9.721 -10.034 1.00 0.00 H new ATOM 0 HG SER A 37 5.196 -11.387 -8.787 1.00 0.00 H new ATOM 563 N LEU A 38 4.207 -6.541 -10.947 1.00 0.00 N ATOM 564 CA LEU A 38 3.435 -5.292 -11.042 1.00 0.00 C ATOM 565 C LEU A 38 2.112 -5.576 -11.761 1.00 0.00 C ATOM 566 O LEU A 38 2.104 -6.192 -12.824 1.00 0.00 O ATOM 567 CB LEU A 38 4.280 -4.212 -11.780 1.00 0.00 C ATOM 568 CG LEU A 38 3.791 -2.716 -11.699 1.00 0.00 C ATOM 569 CD1 LEU A 38 4.943 -1.746 -12.029 1.00 0.00 C ATOM 570 CD2 LEU A 38 2.588 -2.428 -12.620 1.00 0.00 C ATOM 0 H LEU A 38 4.404 -6.970 -11.851 1.00 0.00 H new ATOM 0 HA LEU A 38 3.204 -4.907 -10.049 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.296 -4.254 -11.386 1.00 0.00 H new ATOM 0 HB3 LEU A 38 4.334 -4.490 -12.832 1.00 0.00 H new ATOM 0 HG LEU A 38 3.461 -2.557 -10.672 1.00 0.00 H new ATOM 0 HD11 LEU A 38 4.583 -0.719 -11.967 1.00 0.00 H new ATOM 0 HD12 LEU A 38 5.755 -1.889 -11.316 1.00 0.00 H new ATOM 0 HD13 LEU A 38 5.307 -1.943 -13.038 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.296 -1.382 -12.521 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.865 -2.631 -13.654 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.751 -3.067 -12.336 1.00 0.00 H new ATOM 582 N PHE A 39 1.017 -5.083 -11.178 1.00 0.00 N ATOM 583 CA PHE A 39 -0.315 -5.010 -11.811 1.00 0.00 C ATOM 584 C PHE A 39 -0.952 -3.651 -11.465 1.00 0.00 C ATOM 585 O PHE A 39 -0.677 -3.066 -10.422 1.00 0.00 O ATOM 586 CB PHE A 39 -1.232 -6.211 -11.384 1.00 0.00 C ATOM 587 CG PHE A 39 -0.908 -6.826 -10.016 1.00 0.00 C ATOM 588 CD1 PHE A 39 -1.005 -6.078 -8.843 1.00 0.00 C ATOM 589 CD2 PHE A 39 -0.488 -8.155 -9.909 1.00 0.00 C ATOM 590 CE1 PHE A 39 -0.690 -6.634 -7.621 1.00 0.00 C ATOM 591 CE2 PHE A 39 -0.181 -8.707 -8.683 1.00 0.00 C ATOM 592 CZ PHE A 39 -0.282 -7.943 -7.544 1.00 0.00 C ATOM 0 H PHE A 39 1.025 -4.712 -10.228 1.00 0.00 H new ATOM 0 HA PHE A 39 -0.203 -5.090 -12.892 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.268 -5.871 -11.376 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.158 -6.991 -12.142 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -1.331 -5.050 -8.892 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -0.403 -8.759 -10.800 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.764 -6.039 -6.723 1.00 0.00 H new ATOM 0 HE2 PHE A 39 0.138 -9.737 -8.618 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.039 -8.375 -6.584 1.00 0.00 H new ATOM 602 N VAL A 40 -1.798 -3.158 -12.364 1.00 0.00 N ATOM 603 CA VAL A 40 -2.518 -1.889 -12.203 1.00 0.00 C ATOM 604 C VAL A 40 -4.001 -2.131 -12.497 1.00 0.00 C ATOM 605 O VAL A 40 -4.346 -2.762 -13.503 1.00 0.00 O ATOM 606 CB VAL A 40 -1.911 -0.742 -13.112 1.00 0.00 C ATOM 607 CG1 VAL A 40 -1.634 -1.227 -14.557 1.00 0.00 C ATOM 608 CG2 VAL A 40 -2.794 0.542 -13.086 1.00 0.00 C ATOM 0 H VAL A 40 -2.009 -3.633 -13.241 1.00 0.00 H new ATOM 0 HA VAL A 40 -2.407 -1.539 -11.177 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.945 -0.475 -12.683 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.219 -0.407 -15.143 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -0.923 -2.053 -14.534 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.565 -1.563 -15.013 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.345 1.305 -13.721 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.792 0.305 -13.454 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.864 0.915 -12.064 1.00 0.00 H new ATOM 618 N LEU A 41 -4.863 -1.625 -11.610 1.00 0.00 N ATOM 619 CA LEU A 41 -6.276 -2.016 -11.544 1.00 0.00 C ATOM 620 C LEU A 41 -7.118 -1.171 -12.502 1.00 0.00 C ATOM 621 O LEU A 41 -6.743 -0.043 -12.845 1.00 0.00 O ATOM 622 CB LEU A 41 -6.793 -1.869 -10.092 1.00 0.00 C ATOM 623 CG LEU A 41 -5.950 -2.591 -8.987 1.00 0.00 C ATOM 624 CD1 LEU A 41 -6.619 -2.459 -7.625 1.00 0.00 C ATOM 625 CD2 LEU A 41 -5.691 -4.072 -9.326 1.00 0.00 C ATOM 0 H LEU A 41 -4.599 -0.928 -10.913 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.366 -3.059 -11.848 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.840 -0.807 -9.850 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.813 -2.251 -10.050 1.00 0.00 H new ATOM 0 HG LEU A 41 -4.980 -2.096 -8.949 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -6.016 -2.968 -6.873 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -6.710 -1.404 -7.365 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.611 -2.910 -7.661 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -5.103 -4.530 -8.531 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.642 -4.595 -9.421 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -5.144 -4.140 -10.266 1.00 0.00 H new ATOM 637 N ALA A 42 -8.269 -1.733 -12.906 1.00 0.00 N ATOM 638 CA ALA A 42 -9.232 -1.061 -13.803 1.00 0.00 C ATOM 639 C ALA A 42 -9.909 0.145 -13.112 1.00 0.00 C ATOM 640 O ALA A 42 -10.497 1.006 -13.776 1.00 0.00 O ATOM 641 CB ALA A 42 -10.279 -2.074 -14.290 1.00 0.00 C ATOM 0 H ALA A 42 -8.561 -2.668 -12.621 1.00 0.00 H new ATOM 0 HA ALA A 42 -8.686 -0.671 -14.662 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -10.988 -1.575 -14.951 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -9.782 -2.879 -14.831 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -10.811 -2.487 -13.433 1.00 0.00 H new ATOM 647 N ASN A 43 -9.814 0.185 -11.768 1.00 0.00 N ATOM 648 CA ASN A 43 -10.332 1.293 -10.930 1.00 0.00 C ATOM 649 C ASN A 43 -9.434 2.545 -11.035 1.00 0.00 C ATOM 650 O ASN A 43 -9.844 3.646 -10.647 1.00 0.00 O ATOM 651 CB ASN A 43 -10.440 0.828 -9.453 1.00 0.00 C ATOM 652 CG ASN A 43 -11.301 -0.419 -9.289 1.00 0.00 C ATOM 653 OD1 ASN A 43 -10.810 -1.541 -9.423 1.00 0.00 O ATOM 654 ND2 ASN A 43 -12.583 -0.233 -9.006 1.00 0.00 N ATOM 0 H ASN A 43 -9.372 -0.557 -11.225 1.00 0.00 H new ATOM 0 HA ASN A 43 -11.322 1.565 -11.296 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.441 0.628 -9.066 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.859 1.635 -8.852 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -13.202 -1.036 -8.891 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.951 0.713 -8.903 1.00 0.00 H new ATOM 661 N GLY A 44 -8.208 2.360 -11.567 1.00 0.00 N ATOM 662 CA GLY A 44 -7.286 3.461 -11.859 1.00 0.00 C ATOM 663 C GLY A 44 -6.086 3.525 -10.924 1.00 0.00 C ATOM 664 O GLY A 44 -5.074 4.146 -11.269 1.00 0.00 O ATOM 0 H GLY A 44 -7.836 1.440 -11.804 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -6.930 3.362 -12.885 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -7.831 4.403 -11.800 1.00 0.00 H new ATOM 668 N MET A 45 -6.188 2.890 -9.742 1.00 0.00 N ATOM 669 CA MET A 45 -5.072 2.825 -8.770 1.00 0.00 C ATOM 670 C MET A 45 -4.084 1.700 -9.174 1.00 0.00 C ATOM 671 O MET A 45 -4.409 0.868 -10.031 1.00 0.00 O ATOM 672 CB MET A 45 -5.644 2.629 -7.338 1.00 0.00 C ATOM 673 CG MET A 45 -6.147 1.211 -7.000 1.00 0.00 C ATOM 674 SD MET A 45 -4.834 0.122 -6.401 1.00 0.00 S ATOM 675 CE MET A 45 -4.447 0.855 -4.806 1.00 0.00 C ATOM 0 H MET A 45 -7.034 2.412 -9.433 1.00 0.00 H new ATOM 0 HA MET A 45 -4.511 3.760 -8.775 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.871 2.900 -6.619 1.00 0.00 H new ATOM 0 HB3 MET A 45 -6.468 3.328 -7.198 1.00 0.00 H new ATOM 0 HG2 MET A 45 -6.929 1.279 -6.243 1.00 0.00 H new ATOM 0 HG3 MET A 45 -6.600 0.771 -7.888 1.00 0.00 H new ATOM 0 HE1 MET A 45 -3.407 1.181 -4.798 1.00 0.00 H new ATOM 0 HE2 MET A 45 -5.097 1.713 -4.632 1.00 0.00 H new ATOM 0 HE3 MET A 45 -4.602 0.117 -4.019 1.00 0.00 H new ATOM 685 N LYS A 46 -2.895 1.657 -8.541 1.00 0.00 N ATOM 686 CA LYS A 46 -1.784 0.780 -8.989 1.00 0.00 C ATOM 687 C LYS A 46 -1.155 0.028 -7.790 1.00 0.00 C ATOM 688 O LYS A 46 -0.974 0.613 -6.712 1.00 0.00 O ATOM 689 CB LYS A 46 -0.749 1.658 -9.753 1.00 0.00 C ATOM 690 CG LYS A 46 0.279 0.893 -10.618 1.00 0.00 C ATOM 691 CD LYS A 46 0.986 1.831 -11.631 1.00 0.00 C ATOM 692 CE LYS A 46 1.934 1.092 -12.580 1.00 0.00 C ATOM 693 NZ LYS A 46 2.477 1.971 -13.650 1.00 0.00 N ATOM 0 H LYS A 46 -2.675 2.217 -7.718 1.00 0.00 H new ATOM 0 HA LYS A 46 -2.156 0.009 -9.664 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -1.293 2.349 -10.396 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.205 2.261 -9.025 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.023 0.427 -9.972 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -0.224 0.089 -11.156 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.232 2.356 -12.218 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.548 2.588 -11.084 1.00 0.00 H new ATOM 0 HE2 LYS A 46 2.760 0.672 -12.007 1.00 0.00 H new ATOM 0 HE3 LYS A 46 1.405 0.255 -13.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.112 1.420 -14.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 1.693 2.352 -14.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 3.006 2.756 -13.219 1.00 0.00 H new ATOM 707 N LEU A 47 -0.810 -1.263 -8.001 1.00 0.00 N ATOM 708 CA LEU A 47 -0.313 -2.170 -6.938 1.00 0.00 C ATOM 709 C LEU A 47 0.967 -2.918 -7.371 1.00 0.00 C ATOM 710 O LEU A 47 1.011 -3.554 -8.426 1.00 0.00 O ATOM 711 CB LEU A 47 -1.419 -3.188 -6.534 1.00 0.00 C ATOM 712 CG LEU A 47 -2.566 -2.626 -5.641 1.00 0.00 C ATOM 713 CD1 LEU A 47 -3.686 -3.659 -5.456 1.00 0.00 C ATOM 714 CD2 LEU A 47 -2.013 -2.165 -4.275 1.00 0.00 C ATOM 0 H LEU A 47 -0.868 -1.708 -8.917 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.059 -1.554 -6.075 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -1.859 -3.597 -7.443 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -0.948 -4.018 -6.007 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.994 -1.762 -6.149 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.471 -3.236 -4.828 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.102 -3.923 -6.428 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.282 -4.552 -4.980 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.828 -1.776 -3.665 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -1.550 -3.010 -3.766 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -1.269 -1.383 -4.429 1.00 0.00 H new ATOM 726 N GLY A 48 2.011 -2.812 -6.541 1.00 0.00 N ATOM 727 CA GLY A 48 3.259 -3.553 -6.728 1.00 0.00 C ATOM 728 C GLY A 48 3.332 -4.730 -5.773 1.00 0.00 C ATOM 729 O GLY A 48 2.570 -4.799 -4.804 1.00 0.00 O ATOM 0 H GLY A 48 2.012 -2.208 -5.719 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.326 -3.908 -7.756 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.109 -2.891 -6.563 1.00 0.00 H new ATOM 733 N LEU A 49 4.306 -5.621 -6.026 1.00 0.00 N ATOM 734 CA LEU A 49 4.766 -6.653 -5.080 1.00 0.00 C ATOM 735 C LEU A 49 6.300 -6.685 -5.158 1.00 0.00 C ATOM 736 O LEU A 49 6.845 -7.120 -6.173 1.00 0.00 O ATOM 737 CB LEU A 49 4.200 -8.063 -5.422 1.00 0.00 C ATOM 738 CG LEU A 49 2.654 -8.244 -5.384 1.00 0.00 C ATOM 739 CD1 LEU A 49 2.266 -9.691 -5.730 1.00 0.00 C ATOM 740 CD2 LEU A 49 2.051 -7.816 -4.029 1.00 0.00 C ATOM 0 H LEU A 49 4.807 -5.644 -6.914 1.00 0.00 H new ATOM 0 HA LEU A 49 4.412 -6.405 -4.079 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.546 -8.332 -6.420 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.640 -8.780 -4.729 1.00 0.00 H new ATOM 0 HG LEU A 49 2.232 -7.584 -6.142 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.181 -9.795 -5.697 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.624 -9.934 -6.730 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.717 -10.371 -5.008 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.971 -7.960 -4.050 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.482 -8.421 -3.231 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.273 -6.764 -3.848 1.00 0.00 H new ATOM 752 N TRP A 50 6.995 -6.196 -4.115 1.00 0.00 N ATOM 753 CA TRP A 50 8.469 -6.281 -4.024 1.00 0.00 C ATOM 754 C TRP A 50 8.819 -7.371 -3.013 1.00 0.00 C ATOM 755 O TRP A 50 8.450 -7.277 -1.845 1.00 0.00 O ATOM 756 CB TRP A 50 9.104 -4.914 -3.611 1.00 0.00 C ATOM 757 CG TRP A 50 10.610 -4.792 -3.850 1.00 0.00 C ATOM 758 CD1 TRP A 50 11.496 -5.773 -4.235 1.00 0.00 C ATOM 759 CD2 TRP A 50 11.399 -3.597 -3.715 1.00 0.00 C ATOM 760 NE1 TRP A 50 12.755 -5.258 -4.363 1.00 0.00 N ATOM 761 CE2 TRP A 50 12.726 -3.927 -4.052 1.00 0.00 C ATOM 762 CE3 TRP A 50 11.108 -2.279 -3.362 1.00 0.00 C ATOM 763 CZ2 TRP A 50 13.756 -2.992 -4.033 1.00 0.00 C ATOM 764 CZ3 TRP A 50 12.134 -1.351 -3.335 1.00 0.00 C ATOM 765 CH2 TRP A 50 13.443 -1.712 -3.669 1.00 0.00 C ATOM 0 H TRP A 50 6.558 -5.734 -3.317 1.00 0.00 H new ATOM 0 HA TRP A 50 8.878 -6.529 -5.004 1.00 0.00 H new ATOM 0 HB2 TRP A 50 8.600 -4.118 -4.160 1.00 0.00 H new ATOM 0 HB3 TRP A 50 8.906 -4.746 -2.552 1.00 0.00 H new ATOM 0 HD1 TRP A 50 11.233 -6.805 -4.411 1.00 0.00 H new ATOM 0 HE1 TRP A 50 13.583 -5.782 -4.645 1.00 0.00 H new ATOM 0 HE3 TRP A 50 10.098 -1.988 -3.114 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 14.767 -3.267 -4.296 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 11.920 -0.331 -3.051 1.00 0.00 H new ATOM 0 HH2 TRP A 50 14.222 -0.965 -3.639 1.00 0.00 H new ATOM 776 N SER A 51 9.517 -8.412 -3.471 1.00 0.00 N ATOM 777 CA SER A 51 9.930 -9.513 -2.613 1.00 0.00 C ATOM 778 C SER A 51 11.123 -9.075 -1.736 1.00 0.00 C ATOM 779 O SER A 51 12.145 -8.575 -2.241 1.00 0.00 O ATOM 780 CB SER A 51 10.223 -10.779 -3.447 1.00 0.00 C ATOM 781 OG SER A 51 11.104 -10.518 -4.507 1.00 0.00 O ATOM 0 H SER A 51 9.809 -8.511 -4.443 1.00 0.00 H new ATOM 0 HA SER A 51 9.115 -9.777 -1.939 1.00 0.00 H new ATOM 0 HB2 SER A 51 10.649 -11.547 -2.802 1.00 0.00 H new ATOM 0 HB3 SER A 51 9.288 -11.177 -3.842 1.00 0.00 H new ATOM 0 HG SER A 51 11.619 -11.327 -4.711 1.00 0.00 H new ATOM 787 N ARG A 52 10.975 -9.284 -0.420 1.00 0.00 N ATOM 788 CA ARG A 52 11.823 -8.684 0.630 1.00 0.00 C ATOM 789 C ARG A 52 13.237 -9.316 0.738 1.00 0.00 C ATOM 790 O ARG A 52 14.063 -8.848 1.537 1.00 0.00 O ATOM 791 CB ARG A 52 11.084 -8.790 1.994 1.00 0.00 C ATOM 792 CG ARG A 52 10.827 -10.242 2.462 1.00 0.00 C ATOM 793 CD ARG A 52 10.115 -10.320 3.818 1.00 0.00 C ATOM 794 NE ARG A 52 9.961 -11.716 4.273 1.00 0.00 N ATOM 795 CZ ARG A 52 9.385 -12.105 5.415 1.00 0.00 C ATOM 796 NH1 ARG A 52 8.904 -11.222 6.281 1.00 0.00 N ATOM 797 NH2 ARG A 52 9.302 -13.395 5.690 1.00 0.00 N ATOM 0 H ARG A 52 10.246 -9.889 -0.043 1.00 0.00 H new ATOM 0 HA ARG A 52 11.987 -7.643 0.351 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.670 -8.273 2.754 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.129 -8.269 1.919 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.226 -10.758 1.713 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.778 -10.770 2.527 1.00 0.00 H new ATOM 0 HD2 ARG A 52 10.681 -9.756 4.559 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.134 -9.852 3.742 1.00 0.00 H new ATOM 0 HE ARG A 52 10.326 -12.447 3.663 1.00 0.00 H new ATOM 0 HH11 ARG A 52 8.970 -10.224 6.081 1.00 0.00 H new ATOM 0 HH12 ARG A 52 8.468 -11.541 7.146 1.00 0.00 H new ATOM 0 HH21 ARG A 52 9.675 -14.081 5.034 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.865 -13.704 6.558 1.00 0.00 H new ATOM 811 N HIS A 53 13.518 -10.348 -0.076 1.00 0.00 N ATOM 812 CA HIS A 53 14.804 -11.083 -0.045 1.00 0.00 C ATOM 813 C HIS A 53 15.970 -10.222 -0.574 1.00 0.00 C ATOM 814 O HIS A 53 17.139 -10.524 -0.310 1.00 0.00 O ATOM 815 CB HIS A 53 14.704 -12.420 -0.841 1.00 0.00 C ATOM 816 CG HIS A 53 14.595 -12.291 -2.341 1.00 0.00 C ATOM 817 ND1 HIS A 53 15.381 -13.011 -3.215 1.00 0.00 N ATOM 818 CD2 HIS A 53 13.761 -11.558 -3.117 1.00 0.00 C ATOM 819 CE1 HIS A 53 15.039 -12.724 -4.453 1.00 0.00 C ATOM 820 NE2 HIS A 53 14.062 -11.844 -4.423 1.00 0.00 N ATOM 0 H HIS A 53 12.864 -10.699 -0.775 1.00 0.00 H new ATOM 0 HA HIS A 53 15.015 -11.318 0.998 1.00 0.00 H new ATOM 0 HB2 HIS A 53 15.582 -13.023 -0.611 1.00 0.00 H new ATOM 0 HB3 HIS A 53 13.836 -12.971 -0.480 1.00 0.00 H new ATOM 0 HD2 HIS A 53 13.000 -10.875 -2.771 1.00 0.00 H new ATOM 0 HE1 HIS A 53 15.485 -13.141 -5.344 1.00 0.00 H new ATOM 0 HE2 HIS A 53 13.603 -11.440 -5.239 1.00 0.00 H new ATOM 829 N THR A 54 15.643 -9.149 -1.320 1.00 0.00 N ATOM 830 CA THR A 54 16.647 -8.219 -1.866 1.00 0.00 C ATOM 831 C THR A 54 16.077 -6.784 -1.950 1.00 0.00 C ATOM 832 O THR A 54 16.590 -5.941 -2.694 1.00 0.00 O ATOM 833 CB THR A 54 17.162 -8.719 -3.264 1.00 0.00 C ATOM 834 OG1 THR A 54 18.224 -7.885 -3.752 1.00 0.00 O ATOM 835 CG2 THR A 54 16.048 -8.772 -4.304 1.00 0.00 C ATOM 0 H THR A 54 14.682 -8.905 -1.559 1.00 0.00 H new ATOM 0 HA THR A 54 17.500 -8.194 -1.189 1.00 0.00 H new ATOM 0 HB THR A 54 17.535 -9.731 -3.109 1.00 0.00 H new ATOM 0 HG1 THR A 54 18.059 -6.956 -3.486 1.00 0.00 H new ATOM 0 HG21 THR A 54 16.453 -9.123 -5.253 1.00 0.00 H new ATOM 0 HG22 THR A 54 15.268 -9.455 -3.967 1.00 0.00 H new ATOM 0 HG23 THR A 54 15.626 -7.776 -4.436 1.00 0.00 H new ATOM 843 N VAL A 55 15.027 -6.503 -1.146 1.00 0.00 N ATOM 844 CA VAL A 55 14.445 -5.144 -1.030 1.00 0.00 C ATOM 845 C VAL A 55 15.499 -4.120 -0.538 1.00 0.00 C ATOM 846 O VAL A 55 16.408 -4.469 0.204 1.00 0.00 O ATOM 847 CB VAL A 55 13.192 -5.120 -0.068 1.00 0.00 C ATOM 848 CG1 VAL A 55 13.564 -5.579 1.363 1.00 0.00 C ATOM 849 CG2 VAL A 55 12.514 -3.723 -0.048 1.00 0.00 C ATOM 0 H VAL A 55 14.563 -7.201 -0.565 1.00 0.00 H new ATOM 0 HA VAL A 55 14.116 -4.861 -2.030 1.00 0.00 H new ATOM 0 HB VAL A 55 12.469 -5.832 -0.466 1.00 0.00 H new ATOM 0 HG11 VAL A 55 12.677 -5.550 1.997 1.00 0.00 H new ATOM 0 HG12 VAL A 55 13.952 -6.597 1.329 1.00 0.00 H new ATOM 0 HG13 VAL A 55 14.325 -4.914 1.772 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.656 -3.744 0.624 1.00 0.00 H new ATOM 0 HG22 VAL A 55 13.229 -2.977 0.299 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.181 -3.466 -1.053 1.00 0.00 H new ATOM 859 N GLU A 56 15.392 -2.866 -0.996 1.00 0.00 N ATOM 860 CA GLU A 56 16.252 -1.761 -0.547 1.00 0.00 C ATOM 861 C GLU A 56 15.366 -0.609 -0.031 1.00 0.00 C ATOM 862 O GLU A 56 14.614 -0.015 -0.814 1.00 0.00 O ATOM 863 CB GLU A 56 17.206 -1.319 -1.677 1.00 0.00 C ATOM 864 CG GLU A 56 18.270 -2.390 -1.995 1.00 0.00 C ATOM 865 CD GLU A 56 19.169 -2.059 -3.181 1.00 0.00 C ATOM 866 OE1 GLU A 56 19.857 -1.010 -3.143 1.00 0.00 O ATOM 867 OE2 GLU A 56 19.212 -2.852 -4.147 1.00 0.00 O ATOM 0 H GLU A 56 14.702 -2.587 -1.693 1.00 0.00 H new ATOM 0 HA GLU A 56 16.886 -2.091 0.276 1.00 0.00 H new ATOM 0 HB2 GLU A 56 16.627 -1.106 -2.576 1.00 0.00 H new ATOM 0 HB3 GLU A 56 17.701 -0.392 -1.390 1.00 0.00 H new ATOM 0 HG2 GLU A 56 18.894 -2.537 -1.113 1.00 0.00 H new ATOM 0 HG3 GLU A 56 17.766 -3.337 -2.191 1.00 0.00 H new ATOM 874 N PRO A 57 15.405 -0.288 1.311 1.00 0.00 N ATOM 875 CA PRO A 57 16.331 -0.902 2.305 1.00 0.00 C ATOM 876 C PRO A 57 15.864 -2.317 2.756 1.00 0.00 C ATOM 877 O PRO A 57 14.653 -2.569 2.853 1.00 0.00 O ATOM 878 CB PRO A 57 16.333 0.123 3.483 1.00 0.00 C ATOM 879 CG PRO A 57 15.325 1.197 3.119 1.00 0.00 C ATOM 880 CD PRO A 57 14.494 0.659 1.977 1.00 0.00 C ATOM 0 HA PRO A 57 17.327 -1.075 1.897 1.00 0.00 H new ATOM 0 HB2 PRO A 57 16.062 -0.362 4.420 1.00 0.00 H new ATOM 0 HB3 PRO A 57 17.325 0.553 3.622 1.00 0.00 H new ATOM 0 HG2 PRO A 57 14.694 1.438 3.974 1.00 0.00 H new ATOM 0 HG3 PRO A 57 15.831 2.117 2.827 1.00 0.00 H new ATOM 0 HD2 PRO A 57 13.591 0.164 2.335 1.00 0.00 H new ATOM 0 HD3 PRO A 57 14.176 1.453 1.302 1.00 0.00 H new ATOM 888 N LYS A 58 16.843 -3.226 2.989 1.00 0.00 N ATOM 889 CA LYS A 58 16.595 -4.612 3.435 1.00 0.00 C ATOM 890 C LYS A 58 15.744 -4.653 4.716 1.00 0.00 C ATOM 891 O LYS A 58 16.137 -4.115 5.753 1.00 0.00 O ATOM 892 CB LYS A 58 17.934 -5.388 3.652 1.00 0.00 C ATOM 893 CG LYS A 58 18.642 -5.865 2.362 1.00 0.00 C ATOM 894 CD LYS A 58 17.774 -6.830 1.516 1.00 0.00 C ATOM 895 CE LYS A 58 17.440 -8.159 2.214 1.00 0.00 C ATOM 896 NZ LYS A 58 18.642 -9.014 2.399 1.00 0.00 N ATOM 0 H LYS A 58 17.833 -3.012 2.871 1.00 0.00 H new ATOM 0 HA LYS A 58 16.035 -5.105 2.640 1.00 0.00 H new ATOM 0 HB2 LYS A 58 18.620 -4.747 4.207 1.00 0.00 H new ATOM 0 HB3 LYS A 58 17.733 -6.257 4.278 1.00 0.00 H new ATOM 0 HG2 LYS A 58 18.906 -4.998 1.757 1.00 0.00 H new ATOM 0 HG3 LYS A 58 19.574 -6.363 2.629 1.00 0.00 H new ATOM 0 HD2 LYS A 58 16.843 -6.327 1.254 1.00 0.00 H new ATOM 0 HD3 LYS A 58 18.295 -7.044 0.583 1.00 0.00 H new ATOM 0 HE2 LYS A 58 16.989 -7.954 3.185 1.00 0.00 H new ATOM 0 HE3 LYS A 58 16.699 -8.700 1.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 18.369 -9.899 2.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 19.059 -9.232 1.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 19.340 -8.510 2.982 1.00 0.00 H new ATOM 910 N ALA A 59 14.576 -5.296 4.606 1.00 0.00 N ATOM 911 CA ALA A 59 13.603 -5.419 5.686 1.00 0.00 C ATOM 912 C ALA A 59 12.930 -6.790 5.611 1.00 0.00 C ATOM 913 O ALA A 59 12.141 -7.048 4.689 1.00 0.00 O ATOM 914 CB ALA A 59 12.556 -4.293 5.581 1.00 0.00 C ATOM 0 H ALA A 59 14.279 -5.753 3.744 1.00 0.00 H new ATOM 0 HA ALA A 59 14.110 -5.328 6.647 1.00 0.00 H new ATOM 0 HB1 ALA A 59 11.833 -4.392 6.391 1.00 0.00 H new ATOM 0 HB2 ALA A 59 13.053 -3.326 5.654 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.040 -4.364 4.623 1.00 0.00 H new ATOM 920 N SER A 60 13.251 -7.679 6.561 1.00 0.00 N ATOM 921 CA SER A 60 12.566 -8.965 6.690 1.00 0.00 C ATOM 922 C SER A 60 11.387 -8.791 7.661 1.00 0.00 C ATOM 923 O SER A 60 11.487 -9.096 8.858 1.00 0.00 O ATOM 924 CB SER A 60 13.567 -10.034 7.183 1.00 0.00 C ATOM 925 OG SER A 60 14.663 -10.161 6.284 1.00 0.00 O ATOM 0 H SER A 60 13.985 -7.526 7.253 1.00 0.00 H new ATOM 0 HA SER A 60 12.177 -9.300 5.729 1.00 0.00 H new ATOM 0 HB2 SER A 60 13.934 -9.764 8.173 1.00 0.00 H new ATOM 0 HB3 SER A 60 13.060 -10.994 7.282 1.00 0.00 H new ATOM 0 HG SER A 60 15.283 -10.842 6.619 1.00 0.00 H new ATOM 931 N VAL A 61 10.273 -8.290 7.102 1.00 0.00 N ATOM 932 CA VAL A 61 9.027 -7.982 7.828 1.00 0.00 C ATOM 933 C VAL A 61 7.856 -8.034 6.829 1.00 0.00 C ATOM 934 O VAL A 61 7.945 -7.468 5.730 1.00 0.00 O ATOM 935 CB VAL A 61 9.032 -6.558 8.550 1.00 0.00 C ATOM 936 CG1 VAL A 61 9.909 -6.547 9.834 1.00 0.00 C ATOM 937 CG2 VAL A 61 9.472 -5.432 7.575 1.00 0.00 C ATOM 0 H VAL A 61 10.211 -8.082 6.105 1.00 0.00 H new ATOM 0 HA VAL A 61 8.926 -8.726 8.618 1.00 0.00 H new ATOM 0 HB VAL A 61 8.005 -6.364 8.859 1.00 0.00 H new ATOM 0 HG11 VAL A 61 9.879 -5.556 10.287 1.00 0.00 H new ATOM 0 HG12 VAL A 61 9.526 -7.282 10.542 1.00 0.00 H new ATOM 0 HG13 VAL A 61 10.938 -6.796 9.574 1.00 0.00 H new ATOM 0 HG21 VAL A 61 9.465 -4.475 8.097 1.00 0.00 H new ATOM 0 HG22 VAL A 61 10.478 -5.639 7.210 1.00 0.00 H new ATOM 0 HG23 VAL A 61 8.782 -5.390 6.732 1.00 0.00 H new ATOM 947 N THR A 62 6.788 -8.749 7.205 1.00 0.00 N ATOM 948 CA THR A 62 5.546 -8.860 6.422 1.00 0.00 C ATOM 949 C THR A 62 4.353 -8.950 7.399 1.00 0.00 C ATOM 950 O THR A 62 4.317 -9.854 8.249 1.00 0.00 O ATOM 951 CB THR A 62 5.568 -10.125 5.479 1.00 0.00 C ATOM 952 OG1 THR A 62 6.030 -11.272 6.207 1.00 0.00 O ATOM 953 CG2 THR A 62 6.439 -9.941 4.225 1.00 0.00 C ATOM 0 H THR A 62 6.760 -9.277 8.077 1.00 0.00 H new ATOM 0 HA THR A 62 5.451 -7.980 5.786 1.00 0.00 H new ATOM 0 HB THR A 62 4.542 -10.268 5.139 1.00 0.00 H new ATOM 0 HG1 THR A 62 5.653 -11.259 7.111 1.00 0.00 H new ATOM 0 HG21 THR A 62 6.407 -10.849 3.623 1.00 0.00 H new ATOM 0 HG22 THR A 62 6.060 -9.104 3.638 1.00 0.00 H new ATOM 0 HG23 THR A 62 7.468 -9.739 4.523 1.00 0.00 H new ATOM 961 N GLY A 63 3.390 -8.012 7.281 1.00 0.00 N ATOM 962 CA GLY A 63 2.209 -8.004 8.147 1.00 0.00 C ATOM 963 C GLY A 63 1.555 -6.636 8.231 1.00 0.00 C ATOM 964 O GLY A 63 0.747 -6.274 7.363 1.00 0.00 O ATOM 0 H GLY A 63 3.413 -7.257 6.596 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.484 -8.727 7.773 1.00 0.00 H new ATOM 0 HA3 GLY A 63 2.495 -8.328 9.148 1.00 0.00 H new ATOM 968 N GLY A 64 1.915 -5.875 9.279 1.00 0.00 N ATOM 969 CA GLY A 64 1.375 -4.532 9.502 1.00 0.00 C ATOM 970 C GLY A 64 2.233 -3.450 8.845 1.00 0.00 C ATOM 971 O GLY A 64 2.926 -3.723 7.856 1.00 0.00 O ATOM 0 H GLY A 64 2.584 -6.175 9.988 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.361 -4.479 9.106 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.310 -4.341 10.573 1.00 0.00 H new ATOM 975 N GLY A 65 2.180 -2.217 9.392 1.00 0.00 N ATOM 976 CA GLY A 65 2.874 -1.053 8.810 1.00 0.00 C ATOM 977 C GLY A 65 2.022 -0.354 7.750 1.00 0.00 C ATOM 978 O GLY A 65 1.865 0.877 7.773 1.00 0.00 O ATOM 0 H GLY A 65 1.659 -2.003 10.242 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.122 -0.345 9.601 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.815 -1.376 8.365 1.00 0.00 H new ATOM 982 N GLY A 66 1.462 -1.159 6.828 1.00 0.00 N ATOM 983 CA GLY A 66 0.521 -0.691 5.815 1.00 0.00 C ATOM 984 C GLY A 66 -0.428 -1.812 5.391 1.00 0.00 C ATOM 985 O GLY A 66 0.020 -2.942 5.148 1.00 0.00 O ATOM 0 H GLY A 66 1.657 -2.159 6.772 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.054 0.148 6.207 1.00 0.00 H new ATOM 0 HA3 GLY A 66 1.068 -0.325 4.946 1.00 0.00 H new ATOM 989 N GLU A 67 -1.744 -1.511 5.343 1.00 0.00 N ATOM 990 CA GLU A 67 -2.795 -2.458 4.916 1.00 0.00 C ATOM 991 C GLU A 67 -3.334 -2.091 3.517 1.00 0.00 C ATOM 992 O GLU A 67 -3.114 -0.973 3.024 1.00 0.00 O ATOM 993 CB GLU A 67 -3.948 -2.481 5.962 1.00 0.00 C ATOM 994 CG GLU A 67 -4.860 -1.246 5.991 1.00 0.00 C ATOM 995 CD GLU A 67 -5.890 -1.270 7.137 1.00 0.00 C ATOM 996 OE1 GLU A 67 -6.614 -2.274 7.277 1.00 0.00 O ATOM 997 OE2 GLU A 67 -5.987 -0.287 7.900 1.00 0.00 O ATOM 0 H GLU A 67 -2.109 -0.595 5.602 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.358 -3.455 4.853 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.566 -3.359 5.772 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.510 -2.607 6.952 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -4.244 -0.351 6.085 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.388 -1.171 5.040 1.00 0.00 H new ATOM 1004 N LEU A 68 -4.084 -3.027 2.898 1.00 0.00 N ATOM 1005 CA LEU A 68 -4.621 -2.863 1.538 1.00 0.00 C ATOM 1006 C LEU A 68 -6.164 -2.821 1.624 1.00 0.00 C ATOM 1007 O LEU A 68 -6.774 -3.864 1.844 1.00 0.00 O ATOM 1008 CB LEU A 68 -4.140 -4.030 0.607 1.00 0.00 C ATOM 1009 CG LEU A 68 -3.773 -3.661 -0.877 1.00 0.00 C ATOM 1010 CD1 LEU A 68 -3.678 -4.920 -1.764 1.00 0.00 C ATOM 1011 CD2 LEU A 68 -4.732 -2.611 -1.487 1.00 0.00 C ATOM 0 H LEU A 68 -4.332 -3.917 3.331 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.254 -1.933 1.104 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.265 -4.490 1.067 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.923 -4.788 0.583 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.787 -3.198 -0.845 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.423 -4.629 -2.783 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -2.907 -5.584 -1.372 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.637 -5.438 -1.764 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.431 -2.395 -2.512 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.750 -3.002 -1.483 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.692 -1.696 -0.897 1.00 0.00 H new ATOM 1023 N ALA A 69 -6.784 -1.645 1.467 1.00 0.00 N ATOM 1024 CA ALA A 69 -8.227 -1.474 1.757 1.00 0.00 C ATOM 1025 C ALA A 69 -9.114 -1.709 0.512 1.00 0.00 C ATOM 1026 O ALA A 69 -9.051 -0.961 -0.471 1.00 0.00 O ATOM 1027 CB ALA A 69 -8.472 -0.100 2.389 1.00 0.00 C ATOM 0 H ALA A 69 -6.318 -0.797 1.143 1.00 0.00 H new ATOM 0 HA ALA A 69 -8.520 -2.241 2.474 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.535 0.019 2.600 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.907 -0.021 3.318 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.149 0.680 1.700 1.00 0.00 H new ATOM 1033 N PHE A 70 -9.947 -2.770 0.581 1.00 0.00 N ATOM 1034 CA PHE A 70 -10.888 -3.170 -0.482 1.00 0.00 C ATOM 1035 C PHE A 70 -12.268 -2.586 -0.150 1.00 0.00 C ATOM 1036 O PHE A 70 -12.860 -2.916 0.891 1.00 0.00 O ATOM 1037 CB PHE A 70 -10.985 -4.724 -0.581 1.00 0.00 C ATOM 1038 CG PHE A 70 -9.720 -5.459 -1.042 1.00 0.00 C ATOM 1039 CD1 PHE A 70 -8.531 -5.388 -0.314 1.00 0.00 C ATOM 1040 CD2 PHE A 70 -9.729 -6.247 -2.192 1.00 0.00 C ATOM 1041 CE1 PHE A 70 -7.405 -6.070 -0.714 1.00 0.00 C ATOM 1042 CE2 PHE A 70 -8.599 -6.926 -2.594 1.00 0.00 C ATOM 1043 CZ PHE A 70 -7.438 -6.838 -1.855 1.00 0.00 C ATOM 0 H PHE A 70 -9.983 -3.384 1.395 1.00 0.00 H new ATOM 0 HA PHE A 70 -10.533 -2.792 -1.441 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -11.268 -5.112 0.398 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -11.794 -4.973 -1.268 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -8.494 -4.785 0.582 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -10.634 -6.326 -2.776 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -6.497 -6.003 -0.133 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -8.623 -7.529 -3.490 1.00 0.00 H new ATOM 0 HZ PHE A 70 -6.554 -7.372 -2.172 1.00 0.00 H new ATOM 1053 N ARG A 71 -12.750 -1.682 -1.007 1.00 0.00 N ATOM 1054 CA ARG A 71 -14.043 -1.009 -0.816 1.00 0.00 C ATOM 1055 C ARG A 71 -15.158 -1.701 -1.606 1.00 0.00 C ATOM 1056 O ARG A 71 -15.018 -1.998 -2.798 1.00 0.00 O ATOM 1057 CB ARG A 71 -13.952 0.460 -1.265 1.00 0.00 C ATOM 1058 CG ARG A 71 -12.854 1.275 -0.565 1.00 0.00 C ATOM 1059 CD ARG A 71 -13.006 2.766 -0.845 1.00 0.00 C ATOM 1060 NE ARG A 71 -12.583 3.133 -2.214 1.00 0.00 N ATOM 1061 CZ ARG A 71 -13.247 3.956 -3.037 1.00 0.00 C ATOM 1062 NH1 ARG A 71 -14.428 4.449 -2.703 1.00 0.00 N ATOM 1063 NH2 ARG A 71 -12.726 4.266 -4.205 1.00 0.00 N ATOM 0 H ARG A 71 -12.258 -1.394 -1.853 1.00 0.00 H new ATOM 0 HA ARG A 71 -14.282 -1.060 0.246 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -13.777 0.487 -2.340 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.914 0.941 -1.086 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -12.897 1.099 0.510 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -11.875 0.937 -0.905 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -14.047 3.055 -0.701 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -12.416 3.330 -0.123 1.00 0.00 H new ATOM 0 HE ARG A 71 -11.714 2.726 -2.560 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -14.848 4.204 -1.806 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -14.919 5.074 -3.342 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -11.822 3.880 -4.479 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -13.226 4.892 -4.836 1.00 0.00 H new ATOM 1077 N VAL A 72 -16.263 -1.956 -0.895 1.00 0.00 N ATOM 1078 CA VAL A 72 -17.445 -2.686 -1.426 1.00 0.00 C ATOM 1079 C VAL A 72 -18.728 -1.866 -1.249 1.00 0.00 C ATOM 1080 O VAL A 72 -18.755 -0.875 -0.509 1.00 0.00 O ATOM 1081 CB VAL A 72 -17.665 -4.075 -0.708 1.00 0.00 C ATOM 1082 CG1 VAL A 72 -16.440 -4.994 -0.838 1.00 0.00 C ATOM 1083 CG2 VAL A 72 -18.066 -3.904 0.776 1.00 0.00 C ATOM 0 H VAL A 72 -16.373 -1.663 0.076 1.00 0.00 H new ATOM 0 HA VAL A 72 -17.238 -2.853 -2.483 1.00 0.00 H new ATOM 0 HB VAL A 72 -18.496 -4.556 -1.224 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -16.637 -5.938 -0.329 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -16.239 -5.185 -1.892 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -15.574 -4.512 -0.385 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -18.207 -4.885 1.230 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -17.279 -3.368 1.306 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -18.995 -3.338 0.839 1.00 0.00 H new ATOM 1093 N GLU A 73 -19.784 -2.308 -1.955 1.00 0.00 N ATOM 1094 CA GLU A 73 -21.093 -1.642 -1.960 1.00 0.00 C ATOM 1095 C GLU A 73 -21.784 -1.688 -0.574 1.00 0.00 C ATOM 1096 O GLU A 73 -22.356 -0.677 -0.148 1.00 0.00 O ATOM 1097 CB GLU A 73 -22.000 -2.244 -3.077 1.00 0.00 C ATOM 1098 CG GLU A 73 -22.240 -3.760 -2.964 1.00 0.00 C ATOM 1099 CD GLU A 73 -23.124 -4.336 -4.075 1.00 0.00 C ATOM 1100 OE1 GLU A 73 -24.365 -4.285 -3.950 1.00 0.00 O ATOM 1101 OE2 GLU A 73 -22.585 -4.857 -5.075 1.00 0.00 O ATOM 0 H GLU A 73 -19.750 -3.142 -2.541 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.928 -0.587 -2.181 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -22.964 -1.735 -3.057 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -21.548 -2.033 -4.046 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -21.278 -4.272 -2.978 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -22.701 -3.974 -2.000 1.00 0.00 H new ATOM 1108 N ASN A 74 -21.715 -2.849 0.132 1.00 0.00 N ATOM 1109 CA ASN A 74 -22.343 -2.999 1.471 1.00 0.00 C ATOM 1110 C ASN A 74 -21.893 -4.287 2.184 1.00 0.00 C ATOM 1111 O ASN A 74 -21.092 -5.062 1.655 1.00 0.00 O ATOM 1112 CB ASN A 74 -23.898 -2.969 1.376 1.00 0.00 C ATOM 1113 CG ASN A 74 -24.492 -4.173 0.648 1.00 0.00 C ATOM 1114 OD1 ASN A 74 -24.810 -5.193 1.261 1.00 0.00 O ATOM 1115 ND2 ASN A 74 -24.622 -4.070 -0.660 1.00 0.00 N ATOM 0 H ASN A 74 -21.236 -3.686 -0.201 1.00 0.00 H new ATOM 0 HA ASN A 74 -22.007 -2.148 2.063 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -24.314 -2.923 2.383 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -24.204 -2.058 0.862 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -24.997 -4.851 -1.198 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -24.348 -3.209 -1.134 1.00 0.00 H new ATOM 1122 N ASP A 75 -22.457 -4.486 3.395 1.00 0.00 N ATOM 1123 CA ASP A 75 -21.985 -5.463 4.410 1.00 0.00 C ATOM 1124 C ASP A 75 -21.985 -6.902 3.895 1.00 0.00 C ATOM 1125 O ASP A 75 -21.170 -7.732 4.328 1.00 0.00 O ATOM 1126 CB ASP A 75 -22.857 -5.346 5.686 1.00 0.00 C ATOM 1127 CG ASP A 75 -24.345 -5.668 5.428 1.00 0.00 C ATOM 1128 OD1 ASP A 75 -25.074 -4.785 4.924 1.00 0.00 O ATOM 1129 OD2 ASP A 75 -24.792 -6.796 5.722 1.00 0.00 O ATOM 0 H ASP A 75 -23.274 -3.960 3.705 1.00 0.00 H new ATOM 0 HA ASP A 75 -20.949 -5.218 4.642 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -22.471 -6.023 6.448 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -22.773 -4.336 6.086 1.00 0.00 H new ATOM 1134 N ALA A 76 -22.921 -7.181 2.975 1.00 0.00 N ATOM 1135 CA ALA A 76 -23.095 -8.513 2.394 1.00 0.00 C ATOM 1136 C ALA A 76 -21.847 -8.906 1.591 1.00 0.00 C ATOM 1137 O ALA A 76 -21.312 -9.999 1.757 1.00 0.00 O ATOM 1138 CB ALA A 76 -24.353 -8.557 1.512 1.00 0.00 C ATOM 0 H ALA A 76 -23.576 -6.487 2.616 1.00 0.00 H new ATOM 0 HA ALA A 76 -23.226 -9.234 3.201 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -24.466 -9.555 1.089 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -25.229 -8.317 2.115 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -24.258 -7.830 0.706 1.00 0.00 H new ATOM 1144 N GLN A 77 -21.363 -7.951 0.773 1.00 0.00 N ATOM 1145 CA GLN A 77 -20.164 -8.126 -0.068 1.00 0.00 C ATOM 1146 C GLN A 77 -18.869 -8.250 0.762 1.00 0.00 C ATOM 1147 O GLN A 77 -17.884 -8.805 0.278 1.00 0.00 O ATOM 1148 CB GLN A 77 -20.024 -6.945 -1.065 1.00 0.00 C ATOM 1149 CG GLN A 77 -21.043 -6.937 -2.213 1.00 0.00 C ATOM 1150 CD GLN A 77 -20.911 -8.095 -3.209 1.00 0.00 C ATOM 1151 OE1 GLN A 77 -19.825 -8.646 -3.425 1.00 0.00 O ATOM 1152 NE2 GLN A 77 -22.012 -8.441 -3.859 1.00 0.00 N ATOM 0 H GLN A 77 -21.795 -7.032 0.677 1.00 0.00 H new ATOM 0 HA GLN A 77 -20.300 -9.060 -0.612 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -20.116 -6.010 -0.512 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -19.021 -6.966 -1.491 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -22.046 -6.957 -1.787 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -20.946 -5.998 -2.757 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -22.893 -7.968 -3.658 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -21.979 -9.181 -4.560 1.00 0.00 H new ATOM 1161 N VAL A 78 -18.887 -7.741 2.013 1.00 0.00 N ATOM 1162 CA VAL A 78 -17.768 -7.923 2.964 1.00 0.00 C ATOM 1163 C VAL A 78 -17.675 -9.411 3.368 1.00 0.00 C ATOM 1164 O VAL A 78 -16.593 -10.007 3.379 1.00 0.00 O ATOM 1165 CB VAL A 78 -17.936 -7.042 4.264 1.00 0.00 C ATOM 1166 CG1 VAL A 78 -16.761 -7.242 5.256 1.00 0.00 C ATOM 1167 CG2 VAL A 78 -18.095 -5.554 3.912 1.00 0.00 C ATOM 0 H VAL A 78 -19.666 -7.200 2.389 1.00 0.00 H new ATOM 0 HA VAL A 78 -16.856 -7.602 2.461 1.00 0.00 H new ATOM 0 HB VAL A 78 -18.847 -7.379 4.758 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -16.917 -6.617 6.136 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -16.714 -8.288 5.558 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -15.825 -6.961 4.773 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -18.209 -4.974 4.828 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -17.212 -5.211 3.372 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -18.977 -5.420 3.286 1.00 0.00 H new ATOM 1177 N ASP A 79 -18.861 -9.988 3.665 1.00 0.00 N ATOM 1178 CA ASP A 79 -19.024 -11.384 4.114 1.00 0.00 C ATOM 1179 C ASP A 79 -18.756 -12.383 2.966 1.00 0.00 C ATOM 1180 O ASP A 79 -18.260 -13.494 3.203 1.00 0.00 O ATOM 1181 CB ASP A 79 -20.455 -11.558 4.700 1.00 0.00 C ATOM 1182 CG ASP A 79 -20.764 -12.998 5.143 1.00 0.00 C ATOM 1183 OD1 ASP A 79 -20.294 -13.415 6.225 1.00 0.00 O ATOM 1184 OD2 ASP A 79 -21.472 -13.723 4.412 1.00 0.00 O ATOM 0 H ASP A 79 -19.746 -9.485 3.597 1.00 0.00 H new ATOM 0 HA ASP A 79 -18.289 -11.601 4.889 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -20.574 -10.890 5.553 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -21.186 -11.252 3.951 1.00 0.00 H new ATOM 1189 N GLU A 80 -19.081 -11.974 1.728 1.00 0.00 N ATOM 1190 CA GLU A 80 -18.822 -12.788 0.522 1.00 0.00 C ATOM 1191 C GLU A 80 -17.314 -12.897 0.271 1.00 0.00 C ATOM 1192 O GLU A 80 -16.784 -13.967 -0.049 1.00 0.00 O ATOM 1193 CB GLU A 80 -19.535 -12.190 -0.718 1.00 0.00 C ATOM 1194 CG GLU A 80 -21.078 -12.105 -0.606 1.00 0.00 C ATOM 1195 CD GLU A 80 -21.796 -12.433 -1.928 1.00 0.00 C ATOM 1196 OE1 GLU A 80 -21.936 -11.540 -2.789 1.00 0.00 O ATOM 1197 OE2 GLU A 80 -22.207 -13.595 -2.117 1.00 0.00 O ATOM 0 H GLU A 80 -19.527 -11.078 1.533 1.00 0.00 H new ATOM 0 HA GLU A 80 -19.224 -13.787 0.692 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -19.143 -11.189 -0.897 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -19.281 -12.792 -1.590 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -21.419 -12.794 0.167 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -21.359 -11.102 -0.286 1.00 0.00 H new ATOM 1204 N THR A 81 -16.640 -11.753 0.451 1.00 0.00 N ATOM 1205 CA THR A 81 -15.193 -11.621 0.271 1.00 0.00 C ATOM 1206 C THR A 81 -14.432 -12.320 1.424 1.00 0.00 C ATOM 1207 O THR A 81 -13.321 -12.815 1.229 1.00 0.00 O ATOM 1208 CB THR A 81 -14.820 -10.110 0.158 1.00 0.00 C ATOM 1209 OG1 THR A 81 -15.577 -9.529 -0.917 1.00 0.00 O ATOM 1210 CG2 THR A 81 -13.339 -9.879 -0.114 1.00 0.00 C ATOM 0 H THR A 81 -17.093 -10.883 0.730 1.00 0.00 H new ATOM 0 HA THR A 81 -14.894 -12.117 -0.653 1.00 0.00 H new ATOM 0 HB THR A 81 -15.052 -9.647 1.117 1.00 0.00 H new ATOM 0 HG1 THR A 81 -16.495 -9.363 -0.618 1.00 0.00 H new ATOM 0 HG21 THR A 81 -13.144 -8.809 -0.182 1.00 0.00 H new ATOM 0 HG22 THR A 81 -12.749 -10.305 0.698 1.00 0.00 H new ATOM 0 HG23 THR A 81 -13.062 -10.358 -1.053 1.00 0.00 H new ATOM 1218 N PHE A 82 -15.081 -12.386 2.608 1.00 0.00 N ATOM 1219 CA PHE A 82 -14.568 -13.108 3.786 1.00 0.00 C ATOM 1220 C PHE A 82 -14.358 -14.596 3.433 1.00 0.00 C ATOM 1221 O PHE A 82 -13.232 -15.106 3.417 1.00 0.00 O ATOM 1222 CB PHE A 82 -15.569 -12.955 4.980 1.00 0.00 C ATOM 1223 CG PHE A 82 -15.163 -13.650 6.295 1.00 0.00 C ATOM 1224 CD1 PHE A 82 -15.394 -15.014 6.499 1.00 0.00 C ATOM 1225 CD2 PHE A 82 -14.555 -12.939 7.325 1.00 0.00 C ATOM 1226 CE1 PHE A 82 -15.028 -15.633 7.678 1.00 0.00 C ATOM 1227 CE2 PHE A 82 -14.191 -13.562 8.506 1.00 0.00 C ATOM 1228 CZ PHE A 82 -14.427 -14.906 8.679 1.00 0.00 C ATOM 0 H PHE A 82 -15.982 -11.935 2.770 1.00 0.00 H new ATOM 0 HA PHE A 82 -13.609 -12.684 4.085 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -15.705 -11.892 5.181 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -16.537 -13.347 4.669 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -15.867 -15.594 5.720 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -14.364 -11.883 7.201 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -15.214 -16.688 7.814 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -13.721 -12.992 9.293 1.00 0.00 H new ATOM 0 HZ PHE A 82 -14.140 -15.390 9.601 1.00 0.00 H new ATOM 1238 N ALA A 83 -15.480 -15.251 3.073 1.00 0.00 N ATOM 1239 CA ALA A 83 -15.517 -16.697 2.777 1.00 0.00 C ATOM 1240 C ALA A 83 -14.778 -17.027 1.470 1.00 0.00 C ATOM 1241 O ALA A 83 -14.242 -18.128 1.316 1.00 0.00 O ATOM 1242 CB ALA A 83 -16.974 -17.172 2.705 1.00 0.00 C ATOM 0 H ALA A 83 -16.386 -14.792 2.979 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.004 -17.223 3.582 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -16.998 -18.240 2.486 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -17.465 -16.986 3.660 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -17.495 -16.628 1.917 1.00 0.00 H new ATOM 1248 N GLY A 84 -14.782 -16.061 0.540 1.00 0.00 N ATOM 1249 CA GLY A 84 -14.059 -16.176 -0.726 1.00 0.00 C ATOM 1250 C GLY A 84 -12.550 -16.315 -0.541 1.00 0.00 C ATOM 1251 O GLY A 84 -11.940 -17.258 -1.053 1.00 0.00 O ATOM 0 H GLY A 84 -15.287 -15.181 0.648 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -14.433 -17.040 -1.275 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -14.265 -15.297 -1.337 1.00 0.00 H new ATOM 1255 N TRP A 85 -11.964 -15.392 0.242 1.00 0.00 N ATOM 1256 CA TRP A 85 -10.527 -15.428 0.597 1.00 0.00 C ATOM 1257 C TRP A 85 -10.220 -16.681 1.422 1.00 0.00 C ATOM 1258 O TRP A 85 -9.160 -17.296 1.238 1.00 0.00 O ATOM 1259 CB TRP A 85 -10.131 -14.141 1.347 1.00 0.00 C ATOM 1260 CG TRP A 85 -10.165 -12.883 0.503 1.00 0.00 C ATOM 1261 CD1 TRP A 85 -10.479 -12.759 -0.832 1.00 0.00 C ATOM 1262 CD2 TRP A 85 -9.854 -11.564 0.954 1.00 0.00 C ATOM 1263 NE1 TRP A 85 -10.372 -11.450 -1.219 1.00 0.00 N ATOM 1264 CE2 TRP A 85 -9.992 -10.698 -0.142 1.00 0.00 C ATOM 1265 CE3 TRP A 85 -9.475 -11.038 2.181 1.00 0.00 C ATOM 1266 CZ2 TRP A 85 -9.751 -9.337 -0.051 1.00 0.00 C ATOM 1267 CZ3 TRP A 85 -9.240 -9.687 2.275 1.00 0.00 C ATOM 1268 CH2 TRP A 85 -9.377 -8.848 1.164 1.00 0.00 C ATOM 0 H TRP A 85 -12.467 -14.602 0.647 1.00 0.00 H new ATOM 0 HA TRP A 85 -9.932 -15.476 -0.315 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -10.801 -14.011 2.197 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -9.126 -14.266 1.750 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -10.767 -13.574 -1.479 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -10.547 -11.094 -2.158 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -9.367 -11.677 3.045 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -9.855 -8.690 -0.909 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -8.944 -9.265 3.224 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -9.182 -7.791 1.272 1.00 0.00 H new ATOM 1279 N LYS A 86 -11.128 -17.031 2.349 1.00 0.00 N ATOM 1280 CA LYS A 86 -10.978 -18.212 3.221 1.00 0.00 C ATOM 1281 C LYS A 86 -10.791 -19.487 2.386 1.00 0.00 C ATOM 1282 O LYS A 86 -9.887 -20.294 2.635 1.00 0.00 O ATOM 1283 CB LYS A 86 -12.208 -18.342 4.150 1.00 0.00 C ATOM 1284 CG LYS A 86 -12.164 -19.545 5.103 1.00 0.00 C ATOM 1285 CD LYS A 86 -13.266 -19.510 6.179 1.00 0.00 C ATOM 1286 CE LYS A 86 -14.679 -19.240 5.617 1.00 0.00 C ATOM 1287 NZ LYS A 86 -15.732 -19.550 6.612 1.00 0.00 N ATOM 0 H LYS A 86 -11.986 -16.505 2.516 1.00 0.00 H new ATOM 0 HA LYS A 86 -10.087 -18.081 3.835 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -12.299 -17.430 4.741 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -13.105 -18.415 3.535 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -12.261 -20.463 4.523 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -11.190 -19.578 5.591 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -13.272 -20.462 6.710 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -13.023 -18.739 6.910 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -14.758 -18.195 5.317 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -14.836 -19.841 4.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -16.667 -19.357 6.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -15.672 -20.553 6.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -15.597 -18.958 7.456 1.00 0.00 H new ATOM 1301 N ALA A 87 -11.637 -19.611 1.361 1.00 0.00 N ATOM 1302 CA ALA A 87 -11.626 -20.744 0.424 1.00 0.00 C ATOM 1303 C ALA A 87 -10.440 -20.670 -0.568 1.00 0.00 C ATOM 1304 O ALA A 87 -10.035 -21.682 -1.153 1.00 0.00 O ATOM 1305 CB ALA A 87 -12.958 -20.780 -0.344 1.00 0.00 C ATOM 0 H ALA A 87 -12.359 -18.921 1.153 1.00 0.00 H new ATOM 0 HA ALA A 87 -11.502 -21.659 1.003 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -12.954 -21.619 -1.040 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -13.781 -20.897 0.361 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -13.084 -19.850 -0.898 1.00 0.00 H new ATOM 1311 N SER A 88 -9.880 -19.452 -0.725 1.00 0.00 N ATOM 1312 CA SER A 88 -8.750 -19.172 -1.634 1.00 0.00 C ATOM 1313 C SER A 88 -7.393 -19.139 -0.886 1.00 0.00 C ATOM 1314 O SER A 88 -6.370 -18.742 -1.450 1.00 0.00 O ATOM 1315 CB SER A 88 -9.007 -17.820 -2.349 1.00 0.00 C ATOM 1316 OG SER A 88 -8.006 -17.506 -3.313 1.00 0.00 O ATOM 0 H SER A 88 -10.203 -18.628 -0.219 1.00 0.00 H new ATOM 0 HA SER A 88 -8.687 -19.979 -2.364 1.00 0.00 H new ATOM 0 HB2 SER A 88 -9.980 -17.853 -2.840 1.00 0.00 H new ATOM 0 HB3 SER A 88 -9.052 -17.024 -1.606 1.00 0.00 H new ATOM 0 HG SER A 88 -7.140 -17.848 -3.009 1.00 0.00 H new ATOM 1322 N GLY A 89 -7.406 -19.572 0.392 1.00 0.00 N ATOM 1323 CA GLY A 89 -6.178 -19.842 1.149 1.00 0.00 C ATOM 1324 C GLY A 89 -5.592 -18.637 1.874 1.00 0.00 C ATOM 1325 O GLY A 89 -4.374 -18.415 1.837 1.00 0.00 O ATOM 0 H GLY A 89 -8.263 -19.741 0.919 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -6.384 -20.623 1.881 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.427 -20.237 0.465 1.00 0.00 H new ATOM 1329 N VAL A 90 -6.453 -17.847 2.525 1.00 0.00 N ATOM 1330 CA VAL A 90 -6.021 -16.772 3.441 1.00 0.00 C ATOM 1331 C VAL A 90 -6.019 -17.334 4.889 1.00 0.00 C ATOM 1332 O VAL A 90 -6.742 -18.297 5.176 1.00 0.00 O ATOM 1333 CB VAL A 90 -6.963 -15.504 3.315 1.00 0.00 C ATOM 1334 CG1 VAL A 90 -8.271 -15.655 4.113 1.00 0.00 C ATOM 1335 CG2 VAL A 90 -6.238 -14.198 3.698 1.00 0.00 C ATOM 0 H VAL A 90 -7.466 -17.930 2.436 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.016 -16.443 3.177 1.00 0.00 H new ATOM 0 HB VAL A 90 -7.231 -15.440 2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -8.877 -14.758 3.991 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -8.824 -16.519 3.745 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.039 -15.795 5.169 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.924 -13.357 3.596 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.894 -14.262 4.730 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.382 -14.050 3.039 1.00 0.00 H new ATOM 1345 N ALA A 91 -5.187 -16.766 5.774 1.00 0.00 N ATOM 1346 CA ALA A 91 -5.162 -17.139 7.204 1.00 0.00 C ATOM 1347 C ALA A 91 -6.345 -16.495 7.946 1.00 0.00 C ATOM 1348 O ALA A 91 -7.163 -17.207 8.543 1.00 0.00 O ATOM 1349 CB ALA A 91 -3.837 -16.732 7.842 1.00 0.00 C ATOM 0 H ALA A 91 -4.515 -16.040 5.526 1.00 0.00 H new ATOM 0 HA ALA A 91 -5.257 -18.222 7.281 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -3.838 -17.015 8.895 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -3.017 -17.237 7.331 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -3.708 -15.653 7.756 1.00 0.00 H new ATOM 1355 N MET A 92 -6.400 -15.137 7.915 1.00 0.00 N ATOM 1356 CA MET A 92 -7.563 -14.360 8.407 1.00 0.00 C ATOM 1357 C MET A 92 -7.747 -14.460 9.932 1.00 0.00 C ATOM 1358 O MET A 92 -8.430 -15.369 10.425 1.00 0.00 O ATOM 1359 CB MET A 92 -8.864 -14.722 7.631 1.00 0.00 C ATOM 1360 CG MET A 92 -10.146 -14.030 8.115 1.00 0.00 C ATOM 1361 SD MET A 92 -11.393 -13.910 6.816 1.00 0.00 S ATOM 1362 CE MET A 92 -11.365 -15.524 6.066 1.00 0.00 C ATOM 0 H MET A 92 -5.644 -14.557 7.551 1.00 0.00 H new ATOM 0 HA MET A 92 -7.345 -13.312 8.202 1.00 0.00 H new ATOM 0 HB2 MET A 92 -8.717 -14.477 6.579 1.00 0.00 H new ATOM 0 HB3 MET A 92 -9.011 -15.800 7.690 1.00 0.00 H new ATOM 0 HG2 MET A 92 -10.557 -14.582 8.960 1.00 0.00 H new ATOM 0 HG3 MET A 92 -9.903 -13.030 8.475 1.00 0.00 H new ATOM 0 HE1 MET A 92 -12.373 -15.798 5.753 1.00 0.00 H new ATOM 0 HE2 MET A 92 -10.707 -15.510 5.197 1.00 0.00 H new ATOM 0 HE3 MET A 92 -10.998 -16.254 6.787 1.00 0.00 H new ATOM 1372 N LEU A 93 -7.029 -13.604 10.685 1.00 0.00 N ATOM 1373 CA LEU A 93 -7.194 -13.493 12.149 1.00 0.00 C ATOM 1374 C LEU A 93 -7.806 -12.115 12.528 1.00 0.00 C ATOM 1375 O LEU A 93 -7.090 -11.173 12.885 1.00 0.00 O ATOM 1376 CB LEU A 93 -5.849 -13.806 12.933 1.00 0.00 C ATOM 1377 CG LEU A 93 -4.458 -13.480 12.260 1.00 0.00 C ATOM 1378 CD1 LEU A 93 -4.113 -14.456 11.110 1.00 0.00 C ATOM 1379 CD2 LEU A 93 -4.354 -12.010 11.804 1.00 0.00 C ATOM 0 H LEU A 93 -6.324 -12.975 10.301 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.900 -14.261 12.466 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -5.889 -13.264 13.878 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -5.853 -14.869 13.175 1.00 0.00 H new ATOM 0 HG LEU A 93 -3.709 -13.627 13.038 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -3.147 -14.187 10.682 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.068 -15.474 11.498 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -4.881 -14.396 10.339 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -3.379 -11.839 11.348 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.137 -11.799 11.076 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.473 -11.353 12.665 1.00 0.00 H new ATOM 1391 N GLN A 94 -9.150 -12.050 12.478 1.00 0.00 N ATOM 1392 CA GLN A 94 -9.959 -10.860 12.837 1.00 0.00 C ATOM 1393 C GLN A 94 -11.449 -11.186 12.643 1.00 0.00 C ATOM 1394 O GLN A 94 -11.842 -11.721 11.598 1.00 0.00 O ATOM 1395 CB GLN A 94 -9.577 -9.609 11.985 1.00 0.00 C ATOM 1396 CG GLN A 94 -10.478 -8.359 12.143 1.00 0.00 C ATOM 1397 CD GLN A 94 -10.490 -7.767 13.553 1.00 0.00 C ATOM 1398 OE1 GLN A 94 -9.512 -7.862 14.292 1.00 0.00 O ATOM 1399 NE2 GLN A 94 -11.598 -7.143 13.933 1.00 0.00 N ATOM 0 H GLN A 94 -9.721 -12.841 12.180 1.00 0.00 H new ATOM 0 HA GLN A 94 -9.755 -10.617 13.880 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -8.555 -9.326 12.236 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -9.579 -9.899 10.934 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -10.144 -7.593 11.443 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -11.498 -8.623 11.864 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.392 -7.081 13.296 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -11.655 -6.725 14.862 1.00 0.00 H new ATOM 1408 N GLN A 95 -12.258 -10.864 13.658 1.00 0.00 N ATOM 1409 CA GLN A 95 -13.713 -10.967 13.591 1.00 0.00 C ATOM 1410 C GLN A 95 -14.279 -9.660 12.992 1.00 0.00 C ATOM 1411 O GLN A 95 -14.049 -8.587 13.564 1.00 0.00 O ATOM 1412 CB GLN A 95 -14.291 -11.242 15.009 1.00 0.00 C ATOM 1413 CG GLN A 95 -13.823 -12.575 15.630 1.00 0.00 C ATOM 1414 CD GLN A 95 -14.425 -12.858 17.009 1.00 0.00 C ATOM 1415 OE1 GLN A 95 -14.689 -11.941 17.789 1.00 0.00 O ATOM 1416 NE2 GLN A 95 -14.649 -14.131 17.311 1.00 0.00 N ATOM 0 H GLN A 95 -11.915 -10.522 14.555 1.00 0.00 H new ATOM 0 HA GLN A 95 -14.004 -11.799 12.950 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.006 -10.425 15.671 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -15.380 -11.242 14.953 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -14.083 -13.391 14.956 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -12.736 -12.565 15.713 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -14.417 -14.863 16.639 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -15.053 -14.377 18.215 1.00 0.00 H new ATOM 1425 N PRO A 96 -14.972 -9.729 11.795 1.00 0.00 N ATOM 1426 CA PRO A 96 -15.569 -8.544 11.126 1.00 0.00 C ATOM 1427 C PRO A 96 -16.465 -7.719 12.080 1.00 0.00 C ATOM 1428 O PRO A 96 -17.574 -8.138 12.426 1.00 0.00 O ATOM 1429 CB PRO A 96 -16.387 -9.149 9.952 1.00 0.00 C ATOM 1430 CG PRO A 96 -15.719 -10.454 9.660 1.00 0.00 C ATOM 1431 CD PRO A 96 -15.193 -10.966 10.990 1.00 0.00 C ATOM 0 HA PRO A 96 -14.809 -7.838 10.790 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -17.432 -9.292 10.229 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -16.375 -8.494 9.081 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -16.422 -11.162 9.221 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -14.907 -10.325 8.944 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -15.909 -11.632 11.472 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -14.269 -11.529 10.863 1.00 0.00 H new ATOM 1439 N ALA A 97 -15.936 -6.567 12.512 1.00 0.00 N ATOM 1440 CA ALA A 97 -16.543 -5.714 13.546 1.00 0.00 C ATOM 1441 C ALA A 97 -17.232 -4.495 12.913 1.00 0.00 C ATOM 1442 O ALA A 97 -16.800 -4.003 11.871 1.00 0.00 O ATOM 1443 CB ALA A 97 -15.455 -5.276 14.548 1.00 0.00 C ATOM 0 H ALA A 97 -15.059 -6.194 12.148 1.00 0.00 H new ATOM 0 HA ALA A 97 -17.307 -6.282 14.077 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -15.901 -4.644 15.316 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.014 -6.157 15.014 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -14.680 -4.717 14.023 1.00 0.00 H new ATOM 1449 N LYS A 98 -18.301 -4.016 13.552 1.00 0.00 N ATOM 1450 CA LYS A 98 -19.039 -2.830 13.113 1.00 0.00 C ATOM 1451 C LYS A 98 -18.414 -1.593 13.804 1.00 0.00 C ATOM 1452 O LYS A 98 -18.693 -1.325 14.973 1.00 0.00 O ATOM 1453 CB LYS A 98 -20.570 -2.992 13.469 1.00 0.00 C ATOM 1454 CG LYS A 98 -21.563 -2.878 12.284 1.00 0.00 C ATOM 1455 CD LYS A 98 -21.317 -1.635 11.412 1.00 0.00 C ATOM 1456 CE LYS A 98 -22.412 -1.422 10.357 1.00 0.00 C ATOM 1457 NZ LYS A 98 -23.728 -1.080 10.959 1.00 0.00 N ATOM 0 H LYS A 98 -18.682 -4.444 14.396 1.00 0.00 H new ATOM 0 HA LYS A 98 -18.971 -2.703 12.033 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -20.711 -3.964 13.942 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -20.832 -2.236 14.209 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -21.485 -3.771 11.664 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -22.581 -2.847 12.672 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -21.259 -0.754 12.051 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -20.352 -1.732 10.914 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -22.108 -0.624 9.680 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -22.515 -2.327 9.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -24.390 -0.798 10.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -24.106 -1.909 11.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -23.609 -0.293 11.629 1.00 0.00 H new ATOM 1471 N MET A 99 -17.545 -0.868 13.079 1.00 0.00 N ATOM 1472 CA MET A 99 -16.817 0.311 13.614 1.00 0.00 C ATOM 1473 C MET A 99 -17.429 1.634 13.123 1.00 0.00 C ATOM 1474 O MET A 99 -18.453 1.638 12.440 1.00 0.00 O ATOM 1475 CB MET A 99 -15.313 0.236 13.231 1.00 0.00 C ATOM 1476 CG MET A 99 -14.530 -0.839 13.978 1.00 0.00 C ATOM 1477 SD MET A 99 -12.781 -0.822 13.531 1.00 0.00 S ATOM 1478 CE MET A 99 -12.167 -2.175 14.524 1.00 0.00 C ATOM 0 H MET A 99 -17.323 -1.077 12.106 1.00 0.00 H new ATOM 0 HA MET A 99 -16.911 0.290 14.700 1.00 0.00 H new ATOM 0 HB2 MET A 99 -15.231 0.051 12.160 1.00 0.00 H new ATOM 0 HB3 MET A 99 -14.852 1.205 13.423 1.00 0.00 H new ATOM 0 HG2 MET A 99 -14.633 -0.684 15.052 1.00 0.00 H new ATOM 0 HG3 MET A 99 -14.953 -1.819 13.755 1.00 0.00 H new ATOM 0 HE1 MET A 99 -11.172 -1.931 14.896 1.00 0.00 H new ATOM 0 HE2 MET A 99 -12.838 -2.342 15.366 1.00 0.00 H new ATOM 0 HE3 MET A 99 -12.116 -3.078 13.916 1.00 0.00 H new ATOM 1488 N GLU A 100 -16.750 2.749 13.478 1.00 0.00 N ATOM 1489 CA GLU A 100 -17.179 4.135 13.186 1.00 0.00 C ATOM 1490 C GLU A 100 -17.415 4.382 11.684 1.00 0.00 C ATOM 1491 O GLU A 100 -18.358 5.069 11.301 1.00 0.00 O ATOM 1492 CB GLU A 100 -16.091 5.114 13.701 1.00 0.00 C ATOM 1493 CG GLU A 100 -15.819 5.039 15.216 1.00 0.00 C ATOM 1494 CD GLU A 100 -16.987 5.559 16.069 1.00 0.00 C ATOM 1495 OE1 GLU A 100 -17.060 6.778 16.310 1.00 0.00 O ATOM 1496 OE2 GLU A 100 -17.834 4.755 16.496 1.00 0.00 O ATOM 0 H GLU A 100 -15.867 2.708 13.988 1.00 0.00 H new ATOM 0 HA GLU A 100 -18.130 4.300 13.692 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.161 4.914 13.169 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -16.390 6.132 13.450 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -15.610 4.005 15.490 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -14.924 5.617 15.447 1.00 0.00 H new ATOM 1503 N PHE A 101 -16.537 3.811 10.850 1.00 0.00 N ATOM 1504 CA PHE A 101 -16.578 3.989 9.381 1.00 0.00 C ATOM 1505 C PHE A 101 -17.472 2.936 8.708 1.00 0.00 C ATOM 1506 O PHE A 101 -17.678 2.988 7.500 1.00 0.00 O ATOM 1507 CB PHE A 101 -15.134 3.957 8.807 1.00 0.00 C ATOM 1508 CG PHE A 101 -14.285 5.146 9.271 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -13.616 5.117 10.497 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -14.188 6.303 8.496 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -12.884 6.204 10.929 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -13.451 7.388 8.926 1.00 0.00 C ATOM 1513 CZ PHE A 101 -12.799 7.340 10.143 1.00 0.00 C ATOM 0 H PHE A 101 -15.776 3.211 11.168 1.00 0.00 H new ATOM 0 HA PHE A 101 -17.019 4.962 9.163 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -14.648 3.029 9.109 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -15.181 3.952 7.718 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.672 4.233 11.114 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -14.698 6.350 7.545 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -12.377 6.168 11.882 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -13.384 8.274 8.312 1.00 0.00 H new ATOM 0 HZ PHE A 101 -12.223 8.189 10.481 1.00 0.00 H new ATOM 1523 N GLY A 102 -17.989 1.977 9.493 1.00 0.00 N ATOM 1524 CA GLY A 102 -18.943 0.980 9.001 1.00 0.00 C ATOM 1525 C GLY A 102 -18.535 -0.452 9.312 1.00 0.00 C ATOM 1526 O GLY A 102 -17.706 -0.674 10.203 1.00 0.00 O ATOM 0 H GLY A 102 -17.757 1.874 10.481 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -19.921 1.175 9.442 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -19.051 1.093 7.922 1.00 0.00 H new ATOM 1530 N TYR A 103 -19.097 -1.428 8.577 1.00 0.00 N ATOM 1531 CA TYR A 103 -18.847 -2.855 8.845 1.00 0.00 C ATOM 1532 C TYR A 103 -17.502 -3.260 8.236 1.00 0.00 C ATOM 1533 O TYR A 103 -17.417 -3.525 7.034 1.00 0.00 O ATOM 1534 CB TYR A 103 -19.996 -3.731 8.284 1.00 0.00 C ATOM 1535 CG TYR A 103 -19.969 -5.173 8.798 1.00 0.00 C ATOM 1536 CD1 TYR A 103 -20.045 -5.421 10.167 1.00 0.00 C ATOM 1537 CD2 TYR A 103 -19.878 -6.274 7.942 1.00 0.00 C ATOM 1538 CE1 TYR A 103 -20.034 -6.695 10.671 1.00 0.00 C ATOM 1539 CE2 TYR A 103 -19.864 -7.565 8.439 1.00 0.00 C ATOM 1540 CZ TYR A 103 -19.942 -7.775 9.805 1.00 0.00 C ATOM 1541 OH TYR A 103 -19.931 -9.062 10.306 1.00 0.00 O ATOM 0 H TYR A 103 -19.727 -1.255 7.794 1.00 0.00 H new ATOM 0 HA TYR A 103 -18.810 -3.014 9.923 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -20.951 -3.277 8.548 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -19.938 -3.740 7.196 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -20.114 -4.587 10.849 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -19.818 -6.114 6.876 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -20.097 -6.858 11.737 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -19.793 -8.405 7.764 1.00 0.00 H new ATOM 0 HH TYR A 103 -19.863 -9.701 9.566 1.00 0.00 H new ATOM 1551 N THR A 104 -16.465 -3.338 9.073 1.00 0.00 N ATOM 1552 CA THR A 104 -15.081 -3.521 8.633 1.00 0.00 C ATOM 1553 C THR A 104 -14.574 -4.923 8.983 1.00 0.00 C ATOM 1554 O THR A 104 -15.041 -5.558 9.935 1.00 0.00 O ATOM 1555 CB THR A 104 -14.148 -2.434 9.266 1.00 0.00 C ATOM 1556 OG1 THR A 104 -12.823 -2.552 8.737 1.00 0.00 O ATOM 1557 CG2 THR A 104 -14.082 -2.525 10.798 1.00 0.00 C ATOM 0 H THR A 104 -16.564 -3.275 10.086 1.00 0.00 H new ATOM 0 HA THR A 104 -15.059 -3.409 7.549 1.00 0.00 H new ATOM 0 HB THR A 104 -14.579 -1.467 9.007 1.00 0.00 H new ATOM 0 HG1 THR A 104 -12.175 -2.254 9.409 1.00 0.00 H new ATOM 0 HG21 THR A 104 -13.421 -1.747 11.181 1.00 0.00 H new ATOM 0 HG22 THR A 104 -15.080 -2.389 11.214 1.00 0.00 H new ATOM 0 HG23 THR A 104 -13.698 -3.503 11.088 1.00 0.00 H new ATOM 1565 N PHE A 105 -13.610 -5.373 8.193 1.00 0.00 N ATOM 1566 CA PHE A 105 -13.003 -6.697 8.294 1.00 0.00 C ATOM 1567 C PHE A 105 -11.539 -6.633 7.832 1.00 0.00 C ATOM 1568 O PHE A 105 -11.223 -5.849 6.940 1.00 0.00 O ATOM 1569 CB PHE A 105 -13.855 -7.709 7.442 1.00 0.00 C ATOM 1570 CG PHE A 105 -13.104 -8.892 6.821 1.00 0.00 C ATOM 1571 CD1 PHE A 105 -12.463 -9.839 7.614 1.00 0.00 C ATOM 1572 CD2 PHE A 105 -13.004 -9.022 5.434 1.00 0.00 C ATOM 1573 CE1 PHE A 105 -11.763 -10.872 7.037 1.00 0.00 C ATOM 1574 CE2 PHE A 105 -12.298 -10.055 4.861 1.00 0.00 C ATOM 1575 CZ PHE A 105 -11.675 -10.976 5.661 1.00 0.00 C ATOM 0 H PHE A 105 -13.215 -4.811 7.439 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.998 -7.043 9.328 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.647 -8.105 8.077 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.338 -7.154 6.638 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -12.516 -9.762 8.690 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -13.491 -8.297 4.798 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -11.279 -11.607 7.663 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -12.235 -10.139 3.786 1.00 0.00 H new ATOM 0 HZ PHE A 105 -11.114 -11.785 5.216 1.00 0.00 H new ATOM 1585 N THR A 106 -10.643 -7.415 8.449 1.00 0.00 N ATOM 1586 CA THR A 106 -9.229 -7.461 8.044 1.00 0.00 C ATOM 1587 C THR A 106 -8.727 -8.924 8.053 1.00 0.00 C ATOM 1588 O THR A 106 -8.926 -9.653 9.016 1.00 0.00 O ATOM 1589 CB THR A 106 -8.346 -6.564 8.983 1.00 0.00 C ATOM 1590 OG1 THR A 106 -8.958 -5.267 9.154 1.00 0.00 O ATOM 1591 CG2 THR A 106 -6.920 -6.374 8.424 1.00 0.00 C ATOM 0 H THR A 106 -10.872 -8.026 9.233 1.00 0.00 H new ATOM 0 HA THR A 106 -9.144 -7.066 7.032 1.00 0.00 H new ATOM 0 HB THR A 106 -8.275 -7.077 9.942 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.400 -4.717 9.742 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.343 -5.747 9.104 1.00 0.00 H new ATOM 0 HG22 THR A 106 -6.435 -7.345 8.326 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.973 -5.895 7.446 1.00 0.00 H new ATOM 1599 N ALA A 107 -8.113 -9.354 6.953 1.00 0.00 N ATOM 1600 CA ALA A 107 -7.541 -10.703 6.803 1.00 0.00 C ATOM 1601 C ALA A 107 -6.012 -10.648 6.853 1.00 0.00 C ATOM 1602 O ALA A 107 -5.422 -9.564 6.923 1.00 0.00 O ATOM 1603 CB ALA A 107 -8.029 -11.348 5.495 1.00 0.00 C ATOM 0 H ALA A 107 -7.994 -8.771 6.125 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.881 -11.321 7.634 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -7.598 -12.344 5.398 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -9.116 -11.423 5.510 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -7.719 -10.735 4.649 1.00 0.00 H new ATOM 1609 N ALA A 108 -5.381 -11.824 6.839 1.00 0.00 N ATOM 1610 CA ALA A 108 -3.927 -11.960 6.766 1.00 0.00 C ATOM 1611 C ALA A 108 -3.609 -13.144 5.854 1.00 0.00 C ATOM 1612 O ALA A 108 -4.076 -14.238 6.117 1.00 0.00 O ATOM 1613 CB ALA A 108 -3.351 -12.163 8.174 1.00 0.00 C ATOM 0 H ALA A 108 -5.872 -12.717 6.878 1.00 0.00 H new ATOM 0 HA ALA A 108 -3.472 -11.058 6.356 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -2.267 -12.264 8.113 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -3.601 -11.304 8.797 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.775 -13.066 8.614 1.00 0.00 H new ATOM 1619 N ASP A 109 -2.893 -12.902 4.747 1.00 0.00 N ATOM 1620 CA ASP A 109 -2.479 -13.961 3.786 1.00 0.00 C ATOM 1621 C ASP A 109 -1.320 -14.840 4.371 1.00 0.00 C ATOM 1622 O ASP A 109 -1.026 -14.718 5.563 1.00 0.00 O ATOM 1623 CB ASP A 109 -2.097 -13.276 2.437 1.00 0.00 C ATOM 1624 CG ASP A 109 -0.885 -12.356 2.525 1.00 0.00 C ATOM 1625 OD1 ASP A 109 -1.024 -11.287 3.119 1.00 0.00 O ATOM 1626 OD2 ASP A 109 0.205 -12.700 2.018 1.00 0.00 O ATOM 0 H ASP A 109 -2.579 -11.968 4.483 1.00 0.00 H new ATOM 0 HA ASP A 109 -3.304 -14.650 3.606 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -1.900 -14.048 1.693 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -2.951 -12.700 2.080 1.00 0.00 H new ATOM 1631 N PRO A 110 -0.716 -15.821 3.600 1.00 0.00 N ATOM 1632 CA PRO A 110 0.582 -16.477 3.961 1.00 0.00 C ATOM 1633 C PRO A 110 1.646 -15.525 4.578 1.00 0.00 C ATOM 1634 O PRO A 110 2.225 -15.825 5.635 1.00 0.00 O ATOM 1635 CB PRO A 110 1.047 -17.029 2.599 1.00 0.00 C ATOM 1636 CG PRO A 110 -0.230 -17.473 1.942 1.00 0.00 C ATOM 1637 CD PRO A 110 -1.307 -16.495 2.399 1.00 0.00 C ATOM 0 HA PRO A 110 0.453 -17.223 4.746 1.00 0.00 H new ATOM 0 HB2 PRO A 110 1.556 -16.266 2.010 1.00 0.00 H new ATOM 0 HB3 PRO A 110 1.745 -17.858 2.719 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -0.132 -17.465 0.856 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -0.482 -18.493 2.232 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -1.546 -15.774 1.617 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -2.233 -17.013 2.650 1.00 0.00 H new ATOM 1645 N ASP A 111 1.868 -14.364 3.925 1.00 0.00 N ATOM 1646 CA ASP A 111 2.839 -13.340 4.386 1.00 0.00 C ATOM 1647 C ASP A 111 2.174 -12.325 5.338 1.00 0.00 C ATOM 1648 O ASP A 111 2.788 -11.332 5.727 1.00 0.00 O ATOM 1649 CB ASP A 111 3.497 -12.624 3.177 1.00 0.00 C ATOM 1650 CG ASP A 111 4.202 -13.571 2.191 1.00 0.00 C ATOM 1651 OD1 ASP A 111 4.782 -14.587 2.636 1.00 0.00 O ATOM 1652 OD2 ASP A 111 4.187 -13.300 0.966 1.00 0.00 O ATOM 0 H ASP A 111 1.382 -14.108 3.066 1.00 0.00 H new ATOM 0 HA ASP A 111 3.623 -13.850 4.946 1.00 0.00 H new ATOM 0 HB2 ASP A 111 2.732 -12.063 2.641 1.00 0.00 H new ATOM 0 HB3 ASP A 111 4.222 -11.899 3.548 1.00 0.00 H new ATOM 1657 N SER A 112 0.891 -12.563 5.658 1.00 0.00 N ATOM 1658 CA SER A 112 0.199 -11.963 6.815 1.00 0.00 C ATOM 1659 C SER A 112 -0.108 -10.464 6.642 1.00 0.00 C ATOM 1660 O SER A 112 -0.425 -9.793 7.631 1.00 0.00 O ATOM 1661 CB SER A 112 1.002 -12.228 8.121 1.00 0.00 C ATOM 1662 OG SER A 112 1.310 -13.610 8.256 1.00 0.00 O ATOM 0 H SER A 112 0.295 -13.187 5.113 1.00 0.00 H new ATOM 0 HA SER A 112 -0.772 -12.453 6.885 1.00 0.00 H new ATOM 0 HB2 SER A 112 1.923 -11.645 8.111 1.00 0.00 H new ATOM 0 HB3 SER A 112 0.423 -11.894 8.982 1.00 0.00 H new ATOM 0 HG SER A 112 1.816 -13.753 9.083 1.00 0.00 H new ATOM 1668 N HIS A 113 -0.041 -9.943 5.397 1.00 0.00 N ATOM 1669 CA HIS A 113 -0.410 -8.533 5.101 1.00 0.00 C ATOM 1670 C HIS A 113 -1.865 -8.305 5.509 1.00 0.00 C ATOM 1671 O HIS A 113 -2.722 -9.170 5.273 1.00 0.00 O ATOM 1672 CB HIS A 113 -0.264 -8.160 3.599 1.00 0.00 C ATOM 1673 CG HIS A 113 0.990 -8.641 2.959 1.00 0.00 C ATOM 1674 ND1 HIS A 113 0.996 -9.637 2.017 1.00 0.00 N ATOM 1675 CD2 HIS A 113 2.276 -8.284 3.135 1.00 0.00 C ATOM 1676 CE1 HIS A 113 2.216 -9.871 1.637 1.00 0.00 C ATOM 1677 NE2 HIS A 113 3.022 -9.069 2.296 1.00 0.00 N ATOM 0 H HIS A 113 0.264 -10.473 4.580 1.00 0.00 H new ATOM 0 HA HIS A 113 0.278 -7.903 5.665 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -1.114 -8.568 3.053 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -0.313 -7.075 3.501 1.00 0.00 H new ATOM 0 HD2 HIS A 113 2.648 -7.525 3.808 1.00 0.00 H new ATOM 0 HE1 HIS A 113 2.518 -10.603 0.902 1.00 0.00 H new ATOM 0 HE2 HIS A 113 4.037 -9.036 2.199 1.00 0.00 H new ATOM 1686 N ARG A 114 -2.123 -7.168 6.138 1.00 0.00 N ATOM 1687 CA ARG A 114 -3.465 -6.796 6.560 1.00 0.00 C ATOM 1688 C ARG A 114 -4.312 -6.449 5.320 1.00 0.00 C ATOM 1689 O ARG A 114 -4.172 -5.380 4.731 1.00 0.00 O ATOM 1690 CB ARG A 114 -3.386 -5.626 7.569 1.00 0.00 C ATOM 1691 CG ARG A 114 -2.579 -5.942 8.844 1.00 0.00 C ATOM 1692 CD ARG A 114 -3.158 -7.118 9.645 1.00 0.00 C ATOM 1693 NE ARG A 114 -2.408 -7.333 10.887 1.00 0.00 N ATOM 1694 CZ ARG A 114 -1.450 -8.254 11.069 1.00 0.00 C ATOM 1695 NH1 ARG A 114 -1.149 -9.132 10.121 1.00 0.00 N ATOM 1696 NH2 ARG A 114 -0.802 -8.291 12.207 1.00 0.00 N ATOM 0 H ARG A 114 -1.409 -6.478 6.370 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.951 -7.629 7.068 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -2.938 -4.764 7.074 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -4.398 -5.339 7.855 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -1.549 -6.169 8.568 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -2.551 -5.056 9.479 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -4.205 -6.923 9.878 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -3.130 -8.023 9.039 1.00 0.00 H new ATOM 0 HE ARG A 114 -2.634 -6.731 11.679 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -1.650 -9.115 9.233 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -0.417 -9.824 10.281 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -1.028 -7.623 12.944 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -0.072 -8.987 12.356 1.00 0.00 H new ATOM 1710 N LEU A 115 -5.132 -7.412 4.883 1.00 0.00 N ATOM 1711 CA LEU A 115 -5.985 -7.269 3.700 1.00 0.00 C ATOM 1712 C LEU A 115 -7.382 -6.844 4.164 1.00 0.00 C ATOM 1713 O LEU A 115 -8.169 -7.653 4.647 1.00 0.00 O ATOM 1714 CB LEU A 115 -6.020 -8.614 2.940 1.00 0.00 C ATOM 1715 CG LEU A 115 -4.634 -9.177 2.487 1.00 0.00 C ATOM 1716 CD1 LEU A 115 -4.779 -10.595 1.907 1.00 0.00 C ATOM 1717 CD2 LEU A 115 -3.934 -8.216 1.493 1.00 0.00 C ATOM 0 H LEU A 115 -5.222 -8.317 5.344 1.00 0.00 H new ATOM 0 HA LEU A 115 -5.598 -6.510 3.020 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.502 -9.356 3.576 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.648 -8.494 2.057 1.00 0.00 H new ATOM 0 HG LEU A 115 -3.995 -9.248 3.367 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -3.801 -10.964 1.599 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.195 -11.258 2.666 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -5.445 -10.569 1.044 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -2.973 -8.636 1.197 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.560 -8.086 0.611 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -3.776 -7.250 1.972 1.00 0.00 H new ATOM 1729 N ARG A 116 -7.661 -5.565 4.004 1.00 0.00 N ATOM 1730 CA ARG A 116 -8.847 -4.901 4.553 1.00 0.00 C ATOM 1731 C ARG A 116 -10.032 -5.014 3.579 1.00 0.00 C ATOM 1732 O ARG A 116 -9.835 -4.980 2.380 1.00 0.00 O ATOM 1733 CB ARG A 116 -8.469 -3.420 4.777 1.00 0.00 C ATOM 1734 CG ARG A 116 -9.572 -2.494 5.316 1.00 0.00 C ATOM 1735 CD ARG A 116 -9.926 -2.771 6.780 1.00 0.00 C ATOM 1736 NE ARG A 116 -10.720 -1.673 7.351 1.00 0.00 N ATOM 1737 CZ ARG A 116 -10.216 -0.591 7.956 1.00 0.00 C ATOM 1738 NH1 ARG A 116 -8.902 -0.418 8.046 1.00 0.00 N ATOM 1739 NH2 ARG A 116 -11.037 0.317 8.467 1.00 0.00 N ATOM 0 H ARG A 116 -7.058 -4.934 3.476 1.00 0.00 H new ATOM 0 HA ARG A 116 -9.154 -5.369 5.488 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -7.629 -3.386 5.470 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -8.117 -3.013 3.829 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -9.249 -1.458 5.216 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -10.466 -2.610 4.704 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -10.486 -3.704 6.852 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -9.012 -2.902 7.359 1.00 0.00 H new ATOM 0 HE ARG A 116 -11.735 -1.741 7.280 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -8.268 -1.113 7.652 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -8.527 0.410 8.509 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -12.046 0.188 8.398 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -10.659 1.144 8.929 1.00 0.00 H new ATOM 1753 N VAL A 117 -11.246 -5.197 4.114 1.00 0.00 N ATOM 1754 CA VAL A 117 -12.520 -5.026 3.382 1.00 0.00 C ATOM 1755 C VAL A 117 -13.482 -4.318 4.329 1.00 0.00 C ATOM 1756 O VAL A 117 -13.648 -4.768 5.463 1.00 0.00 O ATOM 1757 CB VAL A 117 -13.184 -6.386 2.926 1.00 0.00 C ATOM 1758 CG1 VAL A 117 -14.441 -6.136 2.055 1.00 0.00 C ATOM 1759 CG2 VAL A 117 -12.188 -7.285 2.185 1.00 0.00 C ATOM 0 H VAL A 117 -11.379 -5.474 5.087 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.311 -4.464 2.472 1.00 0.00 H new ATOM 0 HB VAL A 117 -13.494 -6.907 3.832 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.874 -7.091 1.758 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.174 -5.568 2.628 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -14.161 -5.572 1.165 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.683 -8.210 1.888 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.822 -6.769 1.298 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.349 -7.517 2.841 1.00 0.00 H new ATOM 1769 N TYR A 118 -14.118 -3.222 3.894 1.00 0.00 N ATOM 1770 CA TYR A 118 -15.110 -2.531 4.738 1.00 0.00 C ATOM 1771 C TYR A 118 -16.368 -2.154 3.950 1.00 0.00 C ATOM 1772 O TYR A 118 -16.322 -2.021 2.722 1.00 0.00 O ATOM 1773 CB TYR A 118 -14.503 -1.317 5.495 1.00 0.00 C ATOM 1774 CG TYR A 118 -14.193 -0.089 4.646 1.00 0.00 C ATOM 1775 CD1 TYR A 118 -13.141 -0.098 3.735 1.00 0.00 C ATOM 1776 CD2 TYR A 118 -14.947 1.087 4.771 1.00 0.00 C ATOM 1777 CE1 TYR A 118 -12.856 1.011 2.978 1.00 0.00 C ATOM 1778 CE2 TYR A 118 -14.664 2.199 4.013 1.00 0.00 C ATOM 1779 CZ TYR A 118 -13.619 2.159 3.119 1.00 0.00 C ATOM 1780 OH TYR A 118 -13.332 3.273 2.356 1.00 0.00 O ATOM 0 H TYR A 118 -13.969 -2.798 2.978 1.00 0.00 H new ATOM 0 HA TYR A 118 -15.419 -3.243 5.503 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -15.195 -1.023 6.285 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -13.583 -1.640 5.981 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -12.541 -0.989 3.622 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -15.765 1.120 5.476 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -12.038 0.989 2.273 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -15.257 3.096 4.119 1.00 0.00 H new ATOM 0 HH TYR A 118 -12.361 3.365 2.264 1.00 0.00 H new ATOM 1790 N ALA A 119 -17.463 -1.943 4.668 1.00 0.00 N ATOM 1791 CA ALA A 119 -18.713 -1.412 4.133 1.00 0.00 C ATOM 1792 C ALA A 119 -18.955 -0.076 4.816 1.00 0.00 C ATOM 1793 O ALA A 119 -19.160 -0.059 6.034 1.00 0.00 O ATOM 1794 CB ALA A 119 -19.864 -2.380 4.437 1.00 0.00 C ATOM 0 H ALA A 119 -17.509 -2.142 5.667 1.00 0.00 H new ATOM 0 HA ALA A 119 -18.656 -1.289 3.051 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -20.794 -1.977 4.035 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -19.658 -3.346 3.977 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -19.959 -2.505 5.516 1.00 0.00 H new ATOM 1800 N PHE A 120 -18.896 1.042 4.071 1.00 0.00 N ATOM 1801 CA PHE A 120 -19.015 2.364 4.687 1.00 0.00 C ATOM 1802 C PHE A 120 -20.494 2.658 4.986 1.00 0.00 C ATOM 1803 O PHE A 120 -21.316 2.754 4.062 1.00 0.00 O ATOM 1804 CB PHE A 120 -18.399 3.493 3.810 1.00 0.00 C ATOM 1805 CG PHE A 120 -18.241 4.816 4.586 1.00 0.00 C ATOM 1806 CD1 PHE A 120 -19.291 5.736 4.685 1.00 0.00 C ATOM 1807 CD2 PHE A 120 -17.053 5.108 5.261 1.00 0.00 C ATOM 1808 CE1 PHE A 120 -19.155 6.897 5.422 1.00 0.00 C ATOM 1809 CE2 PHE A 120 -16.922 6.267 6.004 1.00 0.00 C ATOM 1810 CZ PHE A 120 -17.970 7.162 6.086 1.00 0.00 C ATOM 0 H PHE A 120 -18.769 1.052 3.059 1.00 0.00 H new ATOM 0 HA PHE A 120 -18.445 2.349 5.616 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -17.425 3.172 3.441 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -19.032 3.659 2.938 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -20.223 5.535 4.177 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -16.224 4.418 5.202 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -19.974 7.598 5.480 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -15.997 6.473 6.522 1.00 0.00 H new ATOM 0 HZ PHE A 120 -17.865 8.067 6.667 1.00 0.00 H new ATOM 1820 N ALA A 121 -20.806 2.769 6.291 1.00 0.00 N ATOM 1821 CA ALA A 121 -22.156 3.050 6.789 1.00 0.00 C ATOM 1822 C ALA A 121 -22.556 4.494 6.434 1.00 0.00 C ATOM 1823 O ALA A 121 -22.194 5.450 7.138 1.00 0.00 O ATOM 1824 CB ALA A 121 -22.226 2.788 8.308 1.00 0.00 C ATOM 0 H ALA A 121 -20.115 2.664 7.034 1.00 0.00 H new ATOM 0 HA ALA A 121 -22.870 2.381 6.308 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -23.233 3.000 8.668 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -21.981 1.745 8.509 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -21.514 3.434 8.822 1.00 0.00 H new ATOM 1830 N GLY A 122 -23.243 4.634 5.294 1.00 0.00 N ATOM 1831 CA GLY A 122 -23.723 5.922 4.822 1.00 0.00 C ATOM 1832 C GLY A 122 -24.203 5.844 3.380 1.00 0.00 C ATOM 1833 O GLY A 122 -25.360 5.447 3.151 1.00 0.00 O ATOM 1834 OXT GLY A 122 -23.431 6.183 2.465 1.00 0.00 O ATOM 0 H GLY A 122 -23.477 3.854 4.680 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -24.538 6.264 5.460 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -22.925 6.660 4.902 1.00 0.00 H new TER 1838 GLY A 122 ATOM 1839 N MET B 1 -15.590 -10.090 -7.382 1.00 0.00 N ATOM 1840 CA MET B 1 -16.687 -9.435 -6.627 1.00 0.00 C ATOM 1841 C MET B 1 -16.230 -8.074 -6.071 1.00 0.00 C ATOM 1842 O MET B 1 -17.032 -7.143 -5.961 1.00 0.00 O ATOM 1843 CB MET B 1 -17.212 -10.355 -5.479 1.00 0.00 C ATOM 1844 CG MET B 1 -16.205 -10.658 -4.349 1.00 0.00 C ATOM 1845 SD MET B 1 -14.707 -11.488 -4.931 1.00 0.00 S ATOM 1846 CE MET B 1 -13.817 -11.788 -3.400 1.00 0.00 C ATOM 0 H1 MET B 1 -15.991 -10.786 -8.043 1.00 0.00 H new ATOM 0 H2 MET B 1 -15.059 -9.372 -7.915 1.00 0.00 H new ATOM 0 H3 MET B 1 -14.950 -10.571 -6.718 1.00 0.00 H new ATOM 0 HA MET B 1 -17.511 -9.263 -7.319 1.00 0.00 H new ATOM 0 HB2 MET B 1 -18.094 -9.889 -5.039 1.00 0.00 H new ATOM 0 HB3 MET B 1 -17.535 -11.300 -5.915 1.00 0.00 H new ATOM 0 HG2 MET B 1 -15.928 -9.725 -3.858 1.00 0.00 H new ATOM 0 HG3 MET B 1 -16.689 -11.282 -3.598 1.00 0.00 H new ATOM 0 HE1 MET B 1 -12.795 -11.422 -3.496 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.314 -11.267 -2.582 1.00 0.00 H new ATOM 0 HE3 MET B 1 -13.801 -12.858 -3.192 1.00 0.00 H new ATOM 1856 N THR B 2 -14.923 -7.959 -5.757 1.00 0.00 N ATOM 1857 CA THR B 2 -14.364 -6.819 -5.012 1.00 0.00 C ATOM 1858 C THR B 2 -12.980 -6.415 -5.560 1.00 0.00 C ATOM 1859 O THR B 2 -12.172 -7.277 -5.924 1.00 0.00 O ATOM 1860 CB THR B 2 -14.261 -7.183 -3.492 1.00 0.00 C ATOM 1861 OG1 THR B 2 -15.578 -7.471 -2.986 1.00 0.00 O ATOM 1862 CG2 THR B 2 -13.631 -6.059 -2.654 1.00 0.00 C ATOM 0 H THR B 2 -14.226 -8.658 -6.015 1.00 0.00 H new ATOM 0 HA THR B 2 -15.032 -5.966 -5.137 1.00 0.00 H new ATOM 0 HB THR B 2 -13.611 -8.054 -3.408 1.00 0.00 H new ATOM 0 HG1 THR B 2 -15.519 -8.167 -2.298 1.00 0.00 H new ATOM 0 HG21 THR B 2 -13.585 -6.366 -1.609 1.00 0.00 H new ATOM 0 HG22 THR B 2 -12.624 -5.855 -3.017 1.00 0.00 H new ATOM 0 HG23 THR B 2 -14.237 -5.157 -2.741 1.00 0.00 H new ATOM 1870 N HIS B 3 -12.722 -5.094 -5.612 1.00 0.00 N ATOM 1871 CA HIS B 3 -11.418 -4.517 -5.985 1.00 0.00 C ATOM 1872 C HIS B 3 -11.012 -3.480 -4.917 1.00 0.00 C ATOM 1873 O HIS B 3 -11.894 -2.866 -4.304 1.00 0.00 O ATOM 1874 CB HIS B 3 -11.489 -3.827 -7.374 1.00 0.00 C ATOM 1875 CG HIS B 3 -11.939 -4.709 -8.502 1.00 0.00 C ATOM 1876 ND1 HIS B 3 -11.230 -5.807 -8.934 1.00 0.00 N ATOM 1877 CD2 HIS B 3 -13.026 -4.631 -9.298 1.00 0.00 C ATOM 1878 CE1 HIS B 3 -11.868 -6.369 -9.942 1.00 0.00 C ATOM 1879 NE2 HIS B 3 -12.961 -5.672 -10.183 1.00 0.00 N ATOM 0 H HIS B 3 -13.425 -4.388 -5.393 1.00 0.00 H new ATOM 0 HA HIS B 3 -10.681 -5.318 -6.041 1.00 0.00 H new ATOM 0 HB2 HIS B 3 -12.168 -2.977 -7.306 1.00 0.00 H new ATOM 0 HB3 HIS B 3 -10.503 -3.429 -7.616 1.00 0.00 H new ATOM 0 HD1 HIS B 3 -10.349 -6.134 -8.537 1.00 0.00 H new ATOM 0 HD2 HIS B 3 -13.804 -3.884 -9.246 1.00 0.00 H new ATOM 0 HE1 HIS B 3 -11.549 -7.250 -10.479 1.00 0.00 H new ATOM 1888 N PRO B 4 -9.689 -3.290 -4.632 1.00 0.00 N ATOM 1889 CA PRO B 4 -9.217 -2.183 -3.783 1.00 0.00 C ATOM 1890 C PRO B 4 -8.976 -0.884 -4.589 1.00 0.00 C ATOM 1891 O PRO B 4 -8.562 -0.921 -5.747 1.00 0.00 O ATOM 1892 CB PRO B 4 -7.913 -2.738 -3.193 1.00 0.00 C ATOM 1893 CG PRO B 4 -7.366 -3.637 -4.262 1.00 0.00 C ATOM 1894 CD PRO B 4 -8.561 -4.159 -5.060 1.00 0.00 C ATOM 0 HA PRO B 4 -9.945 -1.892 -3.025 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -7.214 -1.937 -2.953 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -8.098 -3.287 -2.270 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -6.678 -3.093 -4.909 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -6.805 -4.462 -3.823 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -8.386 -4.086 -6.133 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -8.760 -5.208 -4.840 1.00 0.00 H new ATOM 1902 N ASP B 5 -9.321 0.250 -3.979 1.00 0.00 N ATOM 1903 CA ASP B 5 -9.001 1.596 -4.512 1.00 0.00 C ATOM 1904 C ASP B 5 -8.631 2.529 -3.344 1.00 0.00 C ATOM 1905 O ASP B 5 -8.643 3.760 -3.447 1.00 0.00 O ATOM 1906 CB ASP B 5 -10.221 2.115 -5.336 1.00 0.00 C ATOM 1907 CG ASP B 5 -9.913 3.318 -6.250 1.00 0.00 C ATOM 1908 OD1 ASP B 5 -9.116 3.159 -7.198 1.00 0.00 O ATOM 1909 OD2 ASP B 5 -10.475 4.413 -6.032 1.00 0.00 O ATOM 0 H ASP B 5 -9.833 0.273 -3.097 1.00 0.00 H new ATOM 0 HA ASP B 5 -8.142 1.561 -5.182 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -10.603 1.298 -5.949 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -11.017 2.394 -4.645 1.00 0.00 H new ATOM 1914 N PHE B 6 -8.259 1.886 -2.231 1.00 0.00 N ATOM 1915 CA PHE B 6 -7.925 2.535 -0.968 1.00 0.00 C ATOM 1916 C PHE B 6 -6.766 1.741 -0.322 1.00 0.00 C ATOM 1917 O PHE B 6 -6.649 0.525 -0.518 1.00 0.00 O ATOM 1918 CB PHE B 6 -9.219 2.563 -0.088 1.00 0.00 C ATOM 1919 CG PHE B 6 -9.173 3.298 1.257 1.00 0.00 C ATOM 1920 CD1 PHE B 6 -8.252 4.295 1.533 1.00 0.00 C ATOM 1921 CD2 PHE B 6 -10.104 2.991 2.245 1.00 0.00 C ATOM 1922 CE1 PHE B 6 -8.265 4.948 2.742 1.00 0.00 C ATOM 1923 CE2 PHE B 6 -10.112 3.644 3.457 1.00 0.00 C ATOM 1924 CZ PHE B 6 -9.191 4.623 3.705 1.00 0.00 C ATOM 0 H PHE B 6 -8.181 0.870 -2.188 1.00 0.00 H new ATOM 0 HA PHE B 6 -7.590 3.565 -1.093 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -10.015 3.010 -0.683 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -9.509 1.531 0.108 1.00 0.00 H new ATOM 0 HD1 PHE B 6 -7.515 4.562 0.790 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -10.838 2.222 2.056 1.00 0.00 H new ATOM 0 HE1 PHE B 6 -7.540 5.725 2.938 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -10.843 3.384 4.208 1.00 0.00 H new ATOM 0 HZ PHE B 6 -9.191 5.139 4.654 1.00 0.00 H new ATOM 1934 N THR B 7 -5.904 2.444 0.410 1.00 0.00 N ATOM 1935 CA THR B 7 -4.782 1.849 1.151 1.00 0.00 C ATOM 1936 C THR B 7 -4.470 2.735 2.360 1.00 0.00 C ATOM 1937 O THR B 7 -4.523 3.965 2.271 1.00 0.00 O ATOM 1938 CB THR B 7 -3.514 1.638 0.249 1.00 0.00 C ATOM 1939 OG1 THR B 7 -2.397 1.196 1.041 1.00 0.00 O ATOM 1940 CG2 THR B 7 -3.132 2.909 -0.524 1.00 0.00 C ATOM 0 H THR B 7 -5.962 3.457 0.510 1.00 0.00 H new ATOM 0 HA THR B 7 -5.073 0.854 1.489 1.00 0.00 H new ATOM 0 HB THR B 7 -3.769 0.869 -0.481 1.00 0.00 H new ATOM 0 HG1 THR B 7 -2.692 0.498 1.662 1.00 0.00 H new ATOM 0 HG21 THR B 7 -2.250 2.713 -1.133 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.959 3.205 -1.169 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.915 3.712 0.181 1.00 0.00 H new ATOM 1948 N ILE B 8 -4.184 2.098 3.502 1.00 0.00 N ATOM 1949 CA ILE B 8 -4.060 2.775 4.806 1.00 0.00 C ATOM 1950 C ILE B 8 -2.682 2.480 5.419 1.00 0.00 C ATOM 1951 O ILE B 8 -2.214 1.341 5.373 1.00 0.00 O ATOM 1952 CB ILE B 8 -5.200 2.282 5.779 1.00 0.00 C ATOM 1953 CG1 ILE B 8 -6.606 2.401 5.098 1.00 0.00 C ATOM 1954 CG2 ILE B 8 -5.162 3.009 7.149 1.00 0.00 C ATOM 1955 CD1 ILE B 8 -7.763 1.857 5.915 1.00 0.00 C ATOM 0 H ILE B 8 -4.030 1.091 3.551 1.00 0.00 H new ATOM 0 HA ILE B 8 -4.161 3.850 4.660 1.00 0.00 H new ATOM 0 HB ILE B 8 -5.015 1.228 5.986 1.00 0.00 H new ATOM 0 HG12 ILE B 8 -6.799 3.451 4.878 1.00 0.00 H new ATOM 0 HG13 ILE B 8 -6.576 1.875 4.144 1.00 0.00 H new ATOM 0 HG21 ILE B 8 -5.966 2.634 7.782 1.00 0.00 H new ATOM 0 HG22 ILE B 8 -4.203 2.824 7.633 1.00 0.00 H new ATOM 0 HG23 ILE B 8 -5.290 4.081 6.996 1.00 0.00 H new ATOM 0 HD11 ILE B 8 -8.692 1.985 5.360 1.00 0.00 H new ATOM 0 HD12 ILE B 8 -7.602 0.797 6.114 1.00 0.00 H new ATOM 0 HD13 ILE B 8 -7.827 2.398 6.859 1.00 0.00 H new ATOM 1967 N LEU B 9 -2.041 3.508 5.990 1.00 0.00 N ATOM 1968 CA LEU B 9 -0.770 3.357 6.722 1.00 0.00 C ATOM 1969 C LEU B 9 -1.103 3.321 8.217 1.00 0.00 C ATOM 1970 O LEU B 9 -1.848 4.166 8.716 1.00 0.00 O ATOM 1971 CB LEU B 9 0.224 4.523 6.398 1.00 0.00 C ATOM 1972 CG LEU B 9 0.834 4.562 4.953 1.00 0.00 C ATOM 1973 CD1 LEU B 9 1.522 3.230 4.590 1.00 0.00 C ATOM 1974 CD2 LEU B 9 -0.207 4.988 3.888 1.00 0.00 C ATOM 0 H LEU B 9 -2.386 4.468 5.959 1.00 0.00 H new ATOM 0 HA LEU B 9 -0.273 2.436 6.417 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -0.293 5.467 6.572 1.00 0.00 H new ATOM 0 HB3 LEU B 9 1.047 4.474 7.111 1.00 0.00 H new ATOM 0 HG LEU B 9 1.606 5.332 4.955 1.00 0.00 H new ATOM 0 HD11 LEU B 9 1.932 3.295 3.582 1.00 0.00 H new ATOM 0 HD12 LEU B 9 2.327 3.032 5.297 1.00 0.00 H new ATOM 0 HD13 LEU B 9 0.793 2.420 4.633 1.00 0.00 H new ATOM 0 HD21 LEU B 9 0.263 5.000 2.904 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -1.036 4.280 3.886 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -0.582 5.984 4.123 1.00 0.00 H new ATOM 1986 N TYR B 10 -0.553 2.313 8.912 1.00 0.00 N ATOM 1987 CA TYR B 10 -0.636 2.208 10.372 1.00 0.00 C ATOM 1988 C TYR B 10 0.414 3.116 11.012 1.00 0.00 C ATOM 1989 O TYR B 10 1.599 2.874 10.833 1.00 0.00 O ATOM 1990 CB TYR B 10 -0.400 0.747 10.839 1.00 0.00 C ATOM 1991 CG TYR B 10 -1.470 -0.250 10.403 1.00 0.00 C ATOM 1992 CD1 TYR B 10 -2.822 0.033 10.587 1.00 0.00 C ATOM 1993 CD2 TYR B 10 -1.129 -1.488 9.855 1.00 0.00 C ATOM 1994 CE1 TYR B 10 -3.790 -0.873 10.225 1.00 0.00 C ATOM 1995 CE2 TYR B 10 -2.097 -2.400 9.506 1.00 0.00 C ATOM 1996 CZ TYR B 10 -3.426 -2.093 9.699 1.00 0.00 C ATOM 1997 OH TYR B 10 -4.395 -3.028 9.392 1.00 0.00 O ATOM 0 H TYR B 10 -0.038 1.549 8.474 1.00 0.00 H new ATOM 0 HA TYR B 10 -1.635 2.516 10.680 1.00 0.00 H new ATOM 0 HB2 TYR B 10 0.565 0.411 10.459 1.00 0.00 H new ATOM 0 HB3 TYR B 10 -0.335 0.735 11.927 1.00 0.00 H new ATOM 0 HD1 TYR B 10 -3.113 0.978 11.020 1.00 0.00 H new ATOM 0 HD2 TYR B 10 -0.088 -1.733 9.703 1.00 0.00 H new ATOM 0 HE1 TYR B 10 -4.834 -0.629 10.353 1.00 0.00 H new ATOM 0 HE2 TYR B 10 -1.817 -3.353 9.082 1.00 0.00 H new ATOM 0 HH TYR B 10 -5.279 -2.666 9.609 1.00 0.00 H new ATOM 2007 N VAL B 11 -0.031 4.141 11.755 1.00 0.00 N ATOM 2008 CA VAL B 11 0.859 5.150 12.385 1.00 0.00 C ATOM 2009 C VAL B 11 0.767 5.024 13.910 1.00 0.00 C ATOM 2010 O VAL B 11 -0.170 4.426 14.434 1.00 0.00 O ATOM 2011 CB VAL B 11 0.476 6.620 11.943 1.00 0.00 C ATOM 2012 CG1 VAL B 11 0.579 6.798 10.409 1.00 0.00 C ATOM 2013 CG2 VAL B 11 -0.931 7.049 12.448 1.00 0.00 C ATOM 0 H VAL B 11 -1.021 4.301 11.941 1.00 0.00 H new ATOM 0 HA VAL B 11 1.880 4.960 12.055 1.00 0.00 H new ATOM 0 HB VAL B 11 1.205 7.278 12.416 1.00 0.00 H new ATOM 0 HG11 VAL B 11 0.309 7.820 10.142 1.00 0.00 H new ATOM 0 HG12 VAL B 11 1.601 6.597 10.087 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -0.100 6.103 9.916 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -1.142 8.066 12.116 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.684 6.372 12.045 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -0.954 7.011 13.537 1.00 0.00 H new ATOM 2023 N ASP B 12 1.773 5.562 14.617 1.00 0.00 N ATOM 2024 CA ASP B 12 1.861 5.456 16.081 1.00 0.00 C ATOM 2025 C ASP B 12 1.308 6.724 16.753 1.00 0.00 C ATOM 2026 O ASP B 12 0.376 6.640 17.548 1.00 0.00 O ATOM 2027 CB ASP B 12 3.321 5.185 16.524 1.00 0.00 C ATOM 2028 CG ASP B 12 3.467 5.036 18.047 1.00 0.00 C ATOM 2029 OD1 ASP B 12 3.068 3.986 18.588 1.00 0.00 O ATOM 2030 OD2 ASP B 12 3.975 5.968 18.712 1.00 0.00 O ATOM 0 H ASP B 12 2.543 6.079 14.193 1.00 0.00 H new ATOM 0 HA ASP B 12 1.250 4.612 16.400 1.00 0.00 H new ATOM 0 HB2 ASP B 12 3.680 4.277 16.039 1.00 0.00 H new ATOM 0 HB3 ASP B 12 3.957 6.002 16.181 1.00 0.00 H new ATOM 2035 N ASN B 13 1.890 7.899 16.438 1.00 0.00 N ATOM 2036 CA ASN B 13 1.484 9.186 17.066 1.00 0.00 C ATOM 2037 C ASN B 13 0.516 9.954 16.130 1.00 0.00 C ATOM 2038 O ASN B 13 0.984 10.585 15.174 1.00 0.00 O ATOM 2039 CB ASN B 13 2.753 10.032 17.388 1.00 0.00 C ATOM 2040 CG ASN B 13 2.478 11.377 18.068 1.00 0.00 C ATOM 2041 OD1 ASN B 13 1.452 11.573 18.714 1.00 0.00 O ATOM 2042 ND2 ASN B 13 3.419 12.303 17.951 1.00 0.00 N ATOM 0 H ASN B 13 2.642 7.990 15.755 1.00 0.00 H new ATOM 0 HA ASN B 13 0.957 8.988 17.999 1.00 0.00 H new ATOM 0 HB2 ASN B 13 3.410 9.445 18.030 1.00 0.00 H new ATOM 0 HB3 ASN B 13 3.295 10.215 16.460 1.00 0.00 H new ATOM 0 HD21 ASN B 13 3.302 13.209 18.405 1.00 0.00 H new ATOM 0 HD22 ASN B 13 4.260 12.110 17.407 1.00 0.00 H new ATOM 2049 N PRO B 14 -0.848 9.907 16.392 1.00 0.00 N ATOM 2050 CA PRO B 14 -1.878 10.469 15.473 1.00 0.00 C ATOM 2051 C PRO B 14 -1.643 11.952 15.028 1.00 0.00 C ATOM 2052 O PRO B 14 -1.624 12.189 13.821 1.00 0.00 O ATOM 2053 CB PRO B 14 -3.224 10.271 16.232 1.00 0.00 C ATOM 2054 CG PRO B 14 -2.950 9.141 17.181 1.00 0.00 C ATOM 2055 CD PRO B 14 -1.495 9.281 17.588 1.00 0.00 C ATOM 0 HA PRO B 14 -1.851 9.951 14.514 1.00 0.00 H new ATOM 0 HB2 PRO B 14 -3.518 11.176 16.764 1.00 0.00 H new ATOM 0 HB3 PRO B 14 -4.036 10.027 15.546 1.00 0.00 H new ATOM 0 HG2 PRO B 14 -3.605 9.194 18.050 1.00 0.00 H new ATOM 0 HG3 PRO B 14 -3.131 8.178 16.704 1.00 0.00 H new ATOM 0 HD2 PRO B 14 -1.386 9.906 18.475 1.00 0.00 H new ATOM 0 HD3 PRO B 14 -1.051 8.314 17.823 1.00 0.00 H new ATOM 2063 N PRO B 15 -1.418 12.978 15.950 1.00 0.00 N ATOM 2064 CA PRO B 15 -1.256 14.400 15.521 1.00 0.00 C ATOM 2065 C PRO B 15 -0.077 14.592 14.538 1.00 0.00 C ATOM 2066 O PRO B 15 -0.244 15.133 13.442 1.00 0.00 O ATOM 2067 CB PRO B 15 -1.039 15.178 16.853 1.00 0.00 C ATOM 2068 CG PRO B 15 -0.596 14.139 17.840 1.00 0.00 C ATOM 2069 CD PRO B 15 -1.320 12.874 17.436 1.00 0.00 C ATOM 0 HA PRO B 15 -2.123 14.759 14.967 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -0.287 15.958 16.737 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -1.957 15.667 17.179 1.00 0.00 H new ATOM 0 HG2 PRO B 15 0.485 14.001 17.808 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -0.851 14.430 18.859 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -0.769 11.984 17.739 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -2.305 12.812 17.898 1.00 0.00 H new ATOM 2077 N ALA B 16 1.087 14.066 14.932 1.00 0.00 N ATOM 2078 CA ALA B 16 2.373 14.373 14.287 1.00 0.00 C ATOM 2079 C ALA B 16 2.501 13.684 12.930 1.00 0.00 C ATOM 2080 O ALA B 16 3.016 14.275 11.975 1.00 0.00 O ATOM 2081 CB ALA B 16 3.532 13.963 15.202 1.00 0.00 C ATOM 0 H ALA B 16 1.167 13.412 15.711 1.00 0.00 H new ATOM 0 HA ALA B 16 2.413 15.449 14.116 1.00 0.00 H new ATOM 0 HB1 ALA B 16 4.479 14.194 14.715 1.00 0.00 H new ATOM 0 HB2 ALA B 16 3.464 14.510 16.142 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.478 12.893 15.400 1.00 0.00 H new ATOM 2087 N SER B 17 1.989 12.450 12.849 1.00 0.00 N ATOM 2088 CA SER B 17 2.089 11.628 11.638 1.00 0.00 C ATOM 2089 C SER B 17 1.080 12.123 10.602 1.00 0.00 C ATOM 2090 O SER B 17 1.382 12.140 9.411 1.00 0.00 O ATOM 2091 CB SER B 17 1.819 10.152 11.972 1.00 0.00 C ATOM 2092 OG SER B 17 0.533 9.992 12.545 1.00 0.00 O ATOM 0 H SER B 17 1.496 11.995 13.617 1.00 0.00 H new ATOM 0 HA SER B 17 3.097 11.713 11.231 1.00 0.00 H new ATOM 0 HB2 SER B 17 1.896 9.550 11.067 1.00 0.00 H new ATOM 0 HB3 SER B 17 2.578 9.786 12.664 1.00 0.00 H new ATOM 0 HG SER B 17 0.574 10.197 13.502 1.00 0.00 H new ATOM 2098 N THR B 18 -0.107 12.563 11.062 1.00 0.00 N ATOM 2099 CA THR B 18 -1.146 13.093 10.176 1.00 0.00 C ATOM 2100 C THR B 18 -0.752 14.395 9.463 1.00 0.00 C ATOM 2101 O THR B 18 -0.920 14.525 8.252 1.00 0.00 O ATOM 2102 CB THR B 18 -2.506 13.297 10.923 1.00 0.00 C ATOM 2103 OG1 THR B 18 -2.971 12.032 11.435 1.00 0.00 O ATOM 2104 CG2 THR B 18 -3.605 13.901 10.013 1.00 0.00 C ATOM 0 H THR B 18 -0.365 12.559 12.049 1.00 0.00 H new ATOM 0 HA THR B 18 -1.266 12.328 9.409 1.00 0.00 H new ATOM 0 HB THR B 18 -2.320 14.002 11.733 1.00 0.00 H new ATOM 0 HG1 THR B 18 -2.590 11.879 12.325 1.00 0.00 H new ATOM 0 HG21 THR B 18 -4.526 14.020 10.584 1.00 0.00 H new ATOM 0 HG22 THR B 18 -3.278 14.873 9.644 1.00 0.00 H new ATOM 0 HG23 THR B 18 -3.785 13.235 9.169 1.00 0.00 H new ATOM 2112 N GLN B 19 -0.128 15.311 10.249 1.00 0.00 N ATOM 2113 CA GLN B 19 0.447 16.576 9.732 1.00 0.00 C ATOM 2114 C GLN B 19 1.613 16.268 8.788 1.00 0.00 C ATOM 2115 O GLN B 19 1.814 16.973 7.789 1.00 0.00 O ATOM 2116 CB GLN B 19 0.940 17.497 10.879 1.00 0.00 C ATOM 2117 CG GLN B 19 -0.141 17.891 11.893 1.00 0.00 C ATOM 2118 CD GLN B 19 0.339 18.923 12.916 1.00 0.00 C ATOM 2119 OE1 GLN B 19 0.844 18.575 13.981 1.00 0.00 O ATOM 2120 NE2 GLN B 19 0.200 20.200 12.586 1.00 0.00 N ATOM 0 H GLN B 19 -0.011 15.192 11.255 1.00 0.00 H new ATOM 0 HA GLN B 19 -0.342 17.102 9.194 1.00 0.00 H new ATOM 0 HB2 GLN B 19 1.749 16.994 11.408 1.00 0.00 H new ATOM 0 HB3 GLN B 19 1.359 18.404 10.444 1.00 0.00 H new ATOM 0 HG2 GLN B 19 -1.002 18.292 11.359 1.00 0.00 H new ATOM 0 HG3 GLN B 19 -0.480 16.998 12.419 1.00 0.00 H new ATOM 0 HE21 GLN B 19 -0.224 20.453 11.693 1.00 0.00 H new ATOM 0 HE22 GLN B 19 0.517 20.929 13.225 1.00 0.00 H new ATOM 2129 N PHE B 20 2.371 15.202 9.111 1.00 0.00 N ATOM 2130 CA PHE B 20 3.528 14.795 8.313 1.00 0.00 C ATOM 2131 C PHE B 20 3.061 14.329 6.932 1.00 0.00 C ATOM 2132 O PHE B 20 3.649 14.730 5.934 1.00 0.00 O ATOM 2133 CB PHE B 20 4.352 13.670 9.006 1.00 0.00 C ATOM 2134 CG PHE B 20 5.628 13.302 8.245 1.00 0.00 C ATOM 2135 CD1 PHE B 20 6.785 14.070 8.382 1.00 0.00 C ATOM 2136 CD2 PHE B 20 5.660 12.223 7.357 1.00 0.00 C ATOM 2137 CE1 PHE B 20 7.925 13.769 7.669 1.00 0.00 C ATOM 2138 CE2 PHE B 20 6.800 11.933 6.639 1.00 0.00 C ATOM 2139 CZ PHE B 20 7.933 12.704 6.795 1.00 0.00 C ATOM 0 H PHE B 20 2.196 14.610 9.923 1.00 0.00 H new ATOM 0 HA PHE B 20 4.183 15.660 8.211 1.00 0.00 H new ATOM 0 HB2 PHE B 20 4.617 13.991 10.013 1.00 0.00 H new ATOM 0 HB3 PHE B 20 3.728 12.782 9.108 1.00 0.00 H new ATOM 0 HD1 PHE B 20 6.787 14.913 9.057 1.00 0.00 H new ATOM 0 HD2 PHE B 20 4.780 11.609 7.232 1.00 0.00 H new ATOM 0 HE1 PHE B 20 8.814 14.369 7.796 1.00 0.00 H new ATOM 0 HE2 PHE B 20 6.806 11.100 5.952 1.00 0.00 H new ATOM 0 HZ PHE B 20 8.826 12.473 6.233 1.00 0.00 H new ATOM 2149 N TYR B 21 1.963 13.537 6.877 1.00 0.00 N ATOM 2150 CA TYR B 21 1.367 13.097 5.600 1.00 0.00 C ATOM 2151 C TYR B 21 0.714 14.295 4.890 1.00 0.00 C ATOM 2152 O TYR B 21 0.627 14.280 3.662 1.00 0.00 O ATOM 2153 CB TYR B 21 0.380 11.916 5.807 1.00 0.00 C ATOM 2154 CG TYR B 21 1.074 10.541 5.902 1.00 0.00 C ATOM 2155 CD1 TYR B 21 1.671 10.106 7.088 1.00 0.00 C ATOM 2156 CD2 TYR B 21 1.149 9.685 4.792 1.00 0.00 C ATOM 2157 CE1 TYR B 21 2.318 8.886 7.167 1.00 0.00 C ATOM 2158 CE2 TYR B 21 1.789 8.462 4.872 1.00 0.00 C ATOM 2159 CZ TYR B 21 2.373 8.070 6.060 1.00 0.00 C ATOM 2160 OH TYR B 21 3.027 6.861 6.131 1.00 0.00 O ATOM 0 H TYR B 21 1.475 13.192 7.704 1.00 0.00 H new ATOM 0 HA TYR B 21 2.158 12.716 4.954 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -0.193 12.088 6.718 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -0.331 11.899 4.981 1.00 0.00 H new ATOM 0 HD1 TYR B 21 1.626 10.737 7.963 1.00 0.00 H new ATOM 0 HD2 TYR B 21 0.698 9.987 3.858 1.00 0.00 H new ATOM 0 HE1 TYR B 21 2.778 8.575 8.093 1.00 0.00 H new ATOM 0 HE2 TYR B 21 1.832 7.815 4.008 1.00 0.00 H new ATOM 0 HH TYR B 21 3.420 6.754 7.022 1.00 0.00 H new ATOM 2170 N LYS B 22 0.236 15.313 5.638 1.00 0.00 N ATOM 2171 CA LYS B 22 -0.388 16.504 5.020 1.00 0.00 C ATOM 2172 C LYS B 22 0.560 17.207 4.028 1.00 0.00 C ATOM 2173 O LYS B 22 0.191 17.476 2.882 1.00 0.00 O ATOM 2174 CB LYS B 22 -0.912 17.501 6.083 1.00 0.00 C ATOM 2175 CG LYS B 22 -2.179 17.026 6.822 1.00 0.00 C ATOM 2176 CD LYS B 22 -2.658 18.032 7.888 1.00 0.00 C ATOM 2177 CE LYS B 22 -3.040 19.400 7.283 1.00 0.00 C ATOM 2178 NZ LYS B 22 -3.489 20.373 8.305 1.00 0.00 N ATOM 0 H LYS B 22 0.269 15.335 6.657 1.00 0.00 H new ATOM 0 HA LYS B 22 -1.246 16.142 4.454 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -0.125 17.683 6.814 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -1.123 18.454 5.598 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -2.977 16.862 6.098 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -1.979 16.066 7.298 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -3.519 17.618 8.413 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -1.871 18.173 8.629 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -2.182 19.809 6.750 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -3.833 19.259 6.549 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -3.733 21.273 7.844 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -4.325 19.999 8.797 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -2.725 20.532 8.992 1.00 0.00 H new ATOM 2192 N ALA B 23 1.789 17.478 4.493 1.00 0.00 N ATOM 2193 CA ALA B 23 2.850 18.083 3.652 1.00 0.00 C ATOM 2194 C ALA B 23 3.447 17.053 2.662 1.00 0.00 C ATOM 2195 O ALA B 23 3.810 17.401 1.533 1.00 0.00 O ATOM 2196 CB ALA B 23 3.961 18.669 4.543 1.00 0.00 C ATOM 0 H ALA B 23 2.080 17.289 5.452 1.00 0.00 H new ATOM 0 HA ALA B 23 2.398 18.884 3.067 1.00 0.00 H new ATOM 0 HB1 ALA B 23 4.735 19.111 3.916 1.00 0.00 H new ATOM 0 HB2 ALA B 23 3.540 19.436 5.193 1.00 0.00 H new ATOM 0 HB3 ALA B 23 4.396 17.876 5.151 1.00 0.00 H new ATOM 2202 N LEU B 24 3.525 15.792 3.120 1.00 0.00 N ATOM 2203 CA LEU B 24 4.161 14.664 2.386 1.00 0.00 C ATOM 2204 C LEU B 24 3.472 14.370 1.044 1.00 0.00 C ATOM 2205 O LEU B 24 4.129 14.137 0.027 1.00 0.00 O ATOM 2206 CB LEU B 24 4.061 13.388 3.259 1.00 0.00 C ATOM 2207 CG LEU B 24 4.869 12.141 2.809 1.00 0.00 C ATOM 2208 CD1 LEU B 24 6.361 12.345 3.079 1.00 0.00 C ATOM 2209 CD2 LEU B 24 4.347 10.852 3.483 1.00 0.00 C ATOM 0 H LEU B 24 3.144 15.514 4.025 1.00 0.00 H new ATOM 0 HA LEU B 24 5.194 14.947 2.184 1.00 0.00 H new ATOM 0 HB2 LEU B 24 4.379 13.647 4.269 1.00 0.00 H new ATOM 0 HB3 LEU B 24 3.010 13.104 3.318 1.00 0.00 H new ATOM 0 HG LEU B 24 4.730 12.019 1.735 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.913 11.462 2.758 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.715 13.215 2.526 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.519 12.504 4.146 1.00 0.00 H new ATOM 0 HD21 LEU B 24 4.936 10.000 3.144 1.00 0.00 H new ATOM 0 HD22 LEU B 24 4.434 10.946 4.565 1.00 0.00 H new ATOM 0 HD23 LEU B 24 3.301 10.699 3.215 1.00 0.00 H new ATOM 2221 N LEU B 25 2.136 14.392 1.072 1.00 0.00 N ATOM 2222 CA LEU B 25 1.289 14.196 -0.114 1.00 0.00 C ATOM 2223 C LEU B 25 1.021 15.567 -0.755 1.00 0.00 C ATOM 2224 O LEU B 25 1.077 15.715 -1.978 1.00 0.00 O ATOM 2225 CB LEU B 25 -0.037 13.512 0.314 1.00 0.00 C ATOM 2226 CG LEU B 25 0.119 12.306 1.298 1.00 0.00 C ATOM 2227 CD1 LEU B 25 -1.248 11.812 1.789 1.00 0.00 C ATOM 2228 CD2 LEU B 25 0.943 11.161 0.684 1.00 0.00 C ATOM 0 H LEU B 25 1.604 14.548 1.928 1.00 0.00 H new ATOM 0 HA LEU B 25 1.785 13.555 -0.843 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -0.678 14.260 0.781 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -0.553 13.165 -0.581 1.00 0.00 H new ATOM 0 HG LEU B 25 0.675 12.667 2.163 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -1.108 10.973 2.471 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -1.762 12.621 2.308 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -1.846 11.490 0.937 1.00 0.00 H new ATOM 0 HD21 LEU B 25 1.025 10.346 1.403 1.00 0.00 H new ATOM 0 HD22 LEU B 25 0.449 10.801 -0.218 1.00 0.00 H new ATOM 0 HD23 LEU B 25 1.939 11.524 0.432 1.00 0.00 H new ATOM 2240 N GLY B 26 0.740 16.561 0.109 1.00 0.00 N ATOM 2241 CA GLY B 26 0.335 17.903 -0.316 1.00 0.00 C ATOM 2242 C GLY B 26 -1.175 18.097 -0.225 1.00 0.00 C ATOM 2243 O GLY B 26 -1.753 18.882 -0.986 1.00 0.00 O ATOM 0 H GLY B 26 0.789 16.450 1.122 1.00 0.00 H new ATOM 0 HA2 GLY B 26 0.835 18.647 0.305 1.00 0.00 H new ATOM 0 HA3 GLY B 26 0.662 18.073 -1.342 1.00 0.00 H new ATOM 2247 N VAL B 27 -1.813 17.374 0.728 1.00 0.00 N ATOM 2248 CA VAL B 27 -3.285 17.389 0.940 1.00 0.00 C ATOM 2249 C VAL B 27 -3.616 17.595 2.435 1.00 0.00 C ATOM 2250 O VAL B 27 -2.722 17.605 3.272 1.00 0.00 O ATOM 2251 CB VAL B 27 -3.966 16.057 0.436 1.00 0.00 C ATOM 2252 CG1 VAL B 27 -3.693 15.818 -1.068 1.00 0.00 C ATOM 2253 CG2 VAL B 27 -3.529 14.833 1.286 1.00 0.00 C ATOM 0 H VAL B 27 -1.319 16.760 1.376 1.00 0.00 H new ATOM 0 HA VAL B 27 -3.682 18.220 0.357 1.00 0.00 H new ATOM 0 HB VAL B 27 -5.042 16.177 0.564 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -4.176 14.893 -1.383 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -4.092 16.651 -1.647 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -2.619 15.742 -1.235 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -4.018 13.935 0.909 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -2.448 14.712 1.220 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -3.814 14.992 2.326 1.00 0.00 H new ATOM 2263 N ASP B 28 -4.911 17.751 2.752 1.00 0.00 N ATOM 2264 CA ASP B 28 -5.412 17.847 4.144 1.00 0.00 C ATOM 2265 C ASP B 28 -6.500 16.765 4.369 1.00 0.00 C ATOM 2266 O ASP B 28 -7.181 16.387 3.409 1.00 0.00 O ATOM 2267 CB ASP B 28 -5.954 19.282 4.421 1.00 0.00 C ATOM 2268 CG ASP B 28 -7.177 19.664 3.572 1.00 0.00 C ATOM 2269 OD1 ASP B 28 -7.001 20.010 2.385 1.00 0.00 O ATOM 2270 OD2 ASP B 28 -8.317 19.617 4.085 1.00 0.00 O ATOM 0 H ASP B 28 -5.649 17.815 2.051 1.00 0.00 H new ATOM 0 HA ASP B 28 -4.599 17.666 4.848 1.00 0.00 H new ATOM 0 HB2 ASP B 28 -6.218 19.362 5.476 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -5.157 20.002 4.236 1.00 0.00 H new ATOM 2275 N PRO B 29 -6.678 16.239 5.631 1.00 0.00 N ATOM 2276 CA PRO B 29 -7.649 15.160 5.912 1.00 0.00 C ATOM 2277 C PRO B 29 -9.116 15.624 5.759 1.00 0.00 C ATOM 2278 O PRO B 29 -9.558 16.544 6.454 1.00 0.00 O ATOM 2279 CB PRO B 29 -7.320 14.736 7.372 1.00 0.00 C ATOM 2280 CG PRO B 29 -6.691 15.950 7.988 1.00 0.00 C ATOM 2281 CD PRO B 29 -5.945 16.644 6.863 1.00 0.00 C ATOM 0 HA PRO B 29 -7.561 14.335 5.205 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -8.220 14.440 7.911 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -6.641 13.884 7.393 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -7.447 16.606 8.419 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -6.012 15.672 8.795 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -5.950 17.726 6.991 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -4.901 16.332 6.826 1.00 0.00 H new ATOM 2289 N VAL B 30 -9.848 14.986 4.825 1.00 0.00 N ATOM 2290 CA VAL B 30 -11.293 15.221 4.628 1.00 0.00 C ATOM 2291 C VAL B 30 -12.088 14.756 5.869 1.00 0.00 C ATOM 2292 O VAL B 30 -13.014 15.438 6.319 1.00 0.00 O ATOM 2293 CB VAL B 30 -11.820 14.509 3.318 1.00 0.00 C ATOM 2294 CG1 VAL B 30 -11.552 12.974 3.330 1.00 0.00 C ATOM 2295 CG2 VAL B 30 -13.321 14.835 3.057 1.00 0.00 C ATOM 0 H VAL B 30 -9.456 14.294 4.186 1.00 0.00 H new ATOM 0 HA VAL B 30 -11.447 16.293 4.501 1.00 0.00 H new ATOM 0 HB VAL B 30 -11.248 14.915 2.484 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -11.932 12.531 2.409 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -10.480 12.792 3.404 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -12.056 12.523 4.185 1.00 0.00 H new ATOM 0 HG21 VAL B 30 -13.651 14.330 2.149 1.00 0.00 H new ATOM 0 HG22 VAL B 30 -13.920 14.492 3.901 1.00 0.00 H new ATOM 0 HG23 VAL B 30 -13.444 15.911 2.938 1.00 0.00 H new ATOM 2305 N GLU B 31 -11.670 13.611 6.431 1.00 0.00 N ATOM 2306 CA GLU B 31 -12.252 13.029 7.645 1.00 0.00 C ATOM 2307 C GLU B 31 -11.171 12.972 8.728 1.00 0.00 C ATOM 2308 O GLU B 31 -9.983 12.784 8.432 1.00 0.00 O ATOM 2309 CB GLU B 31 -12.800 11.602 7.355 1.00 0.00 C ATOM 2310 CG GLU B 31 -14.028 11.534 6.423 1.00 0.00 C ATOM 2311 CD GLU B 31 -15.311 12.061 7.088 1.00 0.00 C ATOM 2312 OE1 GLU B 31 -15.886 11.349 7.932 1.00 0.00 O ATOM 2313 OE2 GLU B 31 -15.756 13.180 6.769 1.00 0.00 O ATOM 0 H GLU B 31 -10.905 13.056 6.046 1.00 0.00 H new ATOM 0 HA GLU B 31 -13.083 13.647 7.985 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -11.999 11.008 6.915 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -13.060 11.133 8.304 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -13.827 12.113 5.522 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -14.184 10.502 6.110 1.00 0.00 H new ATOM 2320 N SER B 32 -11.596 13.131 9.979 1.00 0.00 N ATOM 2321 CA SER B 32 -10.726 13.044 11.148 1.00 0.00 C ATOM 2322 C SER B 32 -11.510 12.399 12.296 1.00 0.00 C ATOM 2323 O SER B 32 -12.680 12.717 12.520 1.00 0.00 O ATOM 2324 CB SER B 32 -10.193 14.445 11.529 1.00 0.00 C ATOM 2325 OG SER B 32 -11.249 15.375 11.701 1.00 0.00 O ATOM 0 H SER B 32 -12.569 13.327 10.212 1.00 0.00 H new ATOM 0 HA SER B 32 -9.857 12.424 10.926 1.00 0.00 H new ATOM 0 HB2 SER B 32 -9.614 14.377 12.450 1.00 0.00 H new ATOM 0 HB3 SER B 32 -9.516 14.801 10.752 1.00 0.00 H new ATOM 0 HG SER B 32 -10.879 16.249 11.943 1.00 0.00 H new ATOM 2331 N SER B 33 -10.855 11.464 12.979 1.00 0.00 N ATOM 2332 CA SER B 33 -11.429 10.649 14.065 1.00 0.00 C ATOM 2333 C SER B 33 -10.329 10.388 15.123 1.00 0.00 C ATOM 2334 O SER B 33 -9.140 10.451 14.775 1.00 0.00 O ATOM 2335 CB SER B 33 -11.974 9.314 13.476 1.00 0.00 C ATOM 2336 OG SER B 33 -12.993 9.538 12.513 1.00 0.00 O ATOM 0 H SER B 33 -9.878 11.239 12.792 1.00 0.00 H new ATOM 0 HA SER B 33 -12.258 11.172 14.542 1.00 0.00 H new ATOM 0 HB2 SER B 33 -11.156 8.759 13.017 1.00 0.00 H new ATOM 0 HB3 SER B 33 -12.366 8.695 14.283 1.00 0.00 H new ATOM 0 HG SER B 33 -13.059 8.761 11.920 1.00 0.00 H new ATOM 2342 N PRO B 34 -10.696 10.093 16.428 1.00 0.00 N ATOM 2343 CA PRO B 34 -9.721 9.865 17.542 1.00 0.00 C ATOM 2344 C PRO B 34 -8.595 8.845 17.210 1.00 0.00 C ATOM 2345 O PRO B 34 -7.472 8.973 17.716 1.00 0.00 O ATOM 2346 CB PRO B 34 -10.620 9.373 18.730 1.00 0.00 C ATOM 2347 CG PRO B 34 -11.950 9.052 18.113 1.00 0.00 C ATOM 2348 CD PRO B 34 -12.088 10.004 16.950 1.00 0.00 C ATOM 0 HA PRO B 34 -9.164 10.775 17.765 1.00 0.00 H new ATOM 0 HB2 PRO B 34 -10.189 8.496 19.213 1.00 0.00 H new ATOM 0 HB3 PRO B 34 -10.717 10.143 19.495 1.00 0.00 H new ATOM 0 HG2 PRO B 34 -11.989 8.015 17.780 1.00 0.00 H new ATOM 0 HG3 PRO B 34 -12.760 9.187 18.830 1.00 0.00 H new ATOM 0 HD2 PRO B 34 -12.779 9.625 16.197 1.00 0.00 H new ATOM 0 HD3 PRO B 34 -12.464 10.977 17.266 1.00 0.00 H new ATOM 2356 N THR B 35 -8.883 7.852 16.341 1.00 0.00 N ATOM 2357 CA THR B 35 -7.896 6.805 15.989 1.00 0.00 C ATOM 2358 C THR B 35 -7.662 6.691 14.468 1.00 0.00 C ATOM 2359 O THR B 35 -6.917 5.802 14.031 1.00 0.00 O ATOM 2360 CB THR B 35 -8.321 5.413 16.577 1.00 0.00 C ATOM 2361 OG1 THR B 35 -7.259 4.455 16.398 1.00 0.00 O ATOM 2362 CG2 THR B 35 -9.614 4.872 15.943 1.00 0.00 C ATOM 0 H THR B 35 -9.784 7.752 15.873 1.00 0.00 H new ATOM 0 HA THR B 35 -6.951 7.110 16.438 1.00 0.00 H new ATOM 0 HB THR B 35 -8.516 5.564 17.639 1.00 0.00 H new ATOM 0 HG1 THR B 35 -6.411 4.928 16.268 1.00 0.00 H new ATOM 0 HG21 THR B 35 -9.861 3.908 16.387 1.00 0.00 H new ATOM 0 HG22 THR B 35 -10.429 5.573 16.123 1.00 0.00 H new ATOM 0 HG23 THR B 35 -9.470 4.751 14.869 1.00 0.00 H new ATOM 2370 N PHE B 36 -8.253 7.590 13.659 1.00 0.00 N ATOM 2371 CA PHE B 36 -8.165 7.462 12.190 1.00 0.00 C ATOM 2372 C PHE B 36 -8.257 8.838 11.508 1.00 0.00 C ATOM 2373 O PHE B 36 -9.164 9.610 11.789 1.00 0.00 O ATOM 2374 CB PHE B 36 -9.283 6.507 11.668 1.00 0.00 C ATOM 2375 CG PHE B 36 -9.078 5.991 10.237 1.00 0.00 C ATOM 2376 CD1 PHE B 36 -9.413 6.765 9.123 1.00 0.00 C ATOM 2377 CD2 PHE B 36 -8.548 4.721 10.009 1.00 0.00 C ATOM 2378 CE1 PHE B 36 -9.225 6.287 7.840 1.00 0.00 C ATOM 2379 CE2 PHE B 36 -8.361 4.246 8.729 1.00 0.00 C ATOM 2380 CZ PHE B 36 -8.700 5.030 7.645 1.00 0.00 C ATOM 0 H PHE B 36 -8.785 8.396 13.986 1.00 0.00 H new ATOM 0 HA PHE B 36 -7.195 7.034 11.939 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -9.353 5.652 12.340 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -10.238 7.029 11.717 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -9.825 7.753 9.267 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -8.280 4.099 10.850 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -9.490 6.900 6.991 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -7.949 3.260 8.574 1.00 0.00 H new ATOM 0 HZ PHE B 36 -8.553 4.657 6.642 1.00 0.00 H new ATOM 2390 N SER B 37 -7.310 9.123 10.600 1.00 0.00 N ATOM 2391 CA SER B 37 -7.345 10.313 9.736 1.00 0.00 C ATOM 2392 C SER B 37 -7.439 9.852 8.274 1.00 0.00 C ATOM 2393 O SER B 37 -6.666 8.991 7.845 1.00 0.00 O ATOM 2394 CB SER B 37 -6.078 11.164 9.967 1.00 0.00 C ATOM 2395 OG SER B 37 -5.952 11.540 11.329 1.00 0.00 O ATOM 0 H SER B 37 -6.494 8.531 10.444 1.00 0.00 H new ATOM 0 HA SER B 37 -8.212 10.930 9.974 1.00 0.00 H new ATOM 0 HB2 SER B 37 -5.197 10.600 9.660 1.00 0.00 H new ATOM 0 HB3 SER B 37 -6.118 12.057 9.343 1.00 0.00 H new ATOM 0 HG SER B 37 -5.011 11.721 11.533 1.00 0.00 H new ATOM 2401 N LEU B 38 -8.378 10.421 7.516 1.00 0.00 N ATOM 2402 CA LEU B 38 -8.641 10.032 6.123 1.00 0.00 C ATOM 2403 C LEU B 38 -8.463 11.248 5.207 1.00 0.00 C ATOM 2404 O LEU B 38 -9.007 12.317 5.483 1.00 0.00 O ATOM 2405 CB LEU B 38 -10.075 9.452 5.998 1.00 0.00 C ATOM 2406 CG LEU B 38 -10.588 9.186 4.545 1.00 0.00 C ATOM 2407 CD1 LEU B 38 -9.670 8.209 3.788 1.00 0.00 C ATOM 2408 CD2 LEU B 38 -12.056 8.712 4.553 1.00 0.00 C ATOM 0 H LEU B 38 -8.983 11.170 7.851 1.00 0.00 H new ATOM 0 HA LEU B 38 -7.932 9.261 5.819 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -10.115 8.514 6.552 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -10.766 10.140 6.485 1.00 0.00 H new ATOM 0 HG LEU B 38 -10.555 10.131 4.003 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -10.059 8.049 2.782 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -8.665 8.628 3.726 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -9.635 7.258 4.319 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -12.387 8.535 3.530 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -12.137 7.788 5.126 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -12.683 9.478 5.009 1.00 0.00 H new ATOM 2420 N PHE B 39 -7.718 11.055 4.116 1.00 0.00 N ATOM 2421 CA PHE B 39 -7.628 11.998 2.985 1.00 0.00 C ATOM 2422 C PHE B 39 -7.662 11.192 1.675 1.00 0.00 C ATOM 2423 O PHE B 39 -7.235 10.042 1.622 1.00 0.00 O ATOM 2424 CB PHE B 39 -6.351 12.907 3.081 1.00 0.00 C ATOM 2425 CG PHE B 39 -5.177 12.305 3.867 1.00 0.00 C ATOM 2426 CD1 PHE B 39 -4.549 11.133 3.446 1.00 0.00 C ATOM 2427 CD2 PHE B 39 -4.713 12.908 5.041 1.00 0.00 C ATOM 2428 CE1 PHE B 39 -3.508 10.586 4.171 1.00 0.00 C ATOM 2429 CE2 PHE B 39 -3.669 12.359 5.756 1.00 0.00 C ATOM 2430 CZ PHE B 39 -3.069 11.199 5.317 1.00 0.00 C ATOM 0 H PHE B 39 -7.145 10.221 3.986 1.00 0.00 H new ATOM 0 HA PHE B 39 -8.479 12.679 3.013 1.00 0.00 H new ATOM 0 HB2 PHE B 39 -6.011 13.137 2.071 1.00 0.00 H new ATOM 0 HB3 PHE B 39 -6.632 13.852 3.546 1.00 0.00 H new ATOM 0 HD1 PHE B 39 -4.881 10.646 2.541 1.00 0.00 H new ATOM 0 HD2 PHE B 39 -5.179 13.817 5.393 1.00 0.00 H new ATOM 0 HE1 PHE B 39 -3.039 9.673 3.835 1.00 0.00 H new ATOM 0 HE2 PHE B 39 -3.322 12.838 6.660 1.00 0.00 H new ATOM 0 HZ PHE B 39 -2.251 10.771 5.877 1.00 0.00 H new ATOM 2440 N VAL B 40 -8.182 11.813 0.618 1.00 0.00 N ATOM 2441 CA VAL B 40 -8.265 11.217 -0.722 1.00 0.00 C ATOM 2442 C VAL B 40 -7.702 12.216 -1.737 1.00 0.00 C ATOM 2443 O VAL B 40 -8.047 13.401 -1.710 1.00 0.00 O ATOM 2444 CB VAL B 40 -9.740 10.777 -1.087 1.00 0.00 C ATOM 2445 CG1 VAL B 40 -10.774 11.898 -0.837 1.00 0.00 C ATOM 2446 CG2 VAL B 40 -9.831 10.235 -2.541 1.00 0.00 C ATOM 0 H VAL B 40 -8.564 12.758 0.665 1.00 0.00 H new ATOM 0 HA VAL B 40 -7.670 10.304 -0.744 1.00 0.00 H new ATOM 0 HB VAL B 40 -9.995 9.961 -0.411 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -11.769 11.542 -1.104 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -10.760 12.178 0.216 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -10.524 12.766 -1.447 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -10.859 9.942 -2.757 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -9.521 11.013 -3.239 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -9.177 9.369 -2.648 1.00 0.00 H new ATOM 2456 N LEU B 41 -6.840 11.718 -2.629 1.00 0.00 N ATOM 2457 CA LEU B 41 -5.969 12.557 -3.459 1.00 0.00 C ATOM 2458 C LEU B 41 -6.687 12.994 -4.735 1.00 0.00 C ATOM 2459 O LEU B 41 -7.611 12.314 -5.199 1.00 0.00 O ATOM 2460 CB LEU B 41 -4.678 11.775 -3.811 1.00 0.00 C ATOM 2461 CG LEU B 41 -3.875 11.174 -2.611 1.00 0.00 C ATOM 2462 CD1 LEU B 41 -2.561 10.561 -3.096 1.00 0.00 C ATOM 2463 CD2 LEU B 41 -3.617 12.210 -1.501 1.00 0.00 C ATOM 0 H LEU B 41 -6.726 10.718 -2.796 1.00 0.00 H new ATOM 0 HA LEU B 41 -5.707 13.453 -2.896 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -4.946 10.960 -4.484 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -4.016 12.441 -4.364 1.00 0.00 H new ATOM 0 HG LEU B 41 -4.491 10.387 -2.175 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -2.017 10.148 -2.247 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -2.772 9.767 -3.812 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -1.956 11.330 -3.576 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -3.056 11.743 -0.691 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -3.043 13.043 -1.907 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -4.569 12.578 -1.118 1.00 0.00 H new ATOM 2475 N ALA B 42 -6.228 14.122 -5.303 1.00 0.00 N ATOM 2476 CA ALA B 42 -6.767 14.685 -6.558 1.00 0.00 C ATOM 2477 C ALA B 42 -6.448 13.777 -7.763 1.00 0.00 C ATOM 2478 O ALA B 42 -7.065 13.905 -8.826 1.00 0.00 O ATOM 2479 CB ALA B 42 -6.215 16.108 -6.774 1.00 0.00 C ATOM 0 H ALA B 42 -5.468 14.674 -4.904 1.00 0.00 H new ATOM 0 HA ALA B 42 -7.852 14.740 -6.474 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -6.616 16.517 -7.701 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -6.510 16.743 -5.939 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -5.127 16.071 -6.835 1.00 0.00 H new ATOM 2485 N ASN B 43 -5.476 12.856 -7.576 1.00 0.00 N ATOM 2486 CA ASN B 43 -5.072 11.871 -8.600 1.00 0.00 C ATOM 2487 C ASN B 43 -6.114 10.727 -8.716 1.00 0.00 C ATOM 2488 O ASN B 43 -6.106 9.963 -9.690 1.00 0.00 O ATOM 2489 CB ASN B 43 -3.656 11.302 -8.273 1.00 0.00 C ATOM 2490 CG ASN B 43 -2.852 11.008 -9.543 1.00 0.00 C ATOM 2491 OD1 ASN B 43 -2.015 11.806 -9.962 1.00 0.00 O ATOM 2492 ND2 ASN B 43 -3.141 9.896 -10.185 1.00 0.00 N ATOM 0 H ASN B 43 -4.949 12.776 -6.706 1.00 0.00 H new ATOM 0 HA ASN B 43 -5.028 12.378 -9.564 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -3.111 12.016 -7.656 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -3.758 10.388 -7.688 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -2.665 9.673 -11.059 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -3.841 9.257 -9.808 1.00 0.00 H new ATOM 2499 N GLY B 44 -7.012 10.634 -7.711 1.00 0.00 N ATOM 2500 CA GLY B 44 -8.145 9.701 -7.730 1.00 0.00 C ATOM 2501 C GLY B 44 -8.003 8.540 -6.757 1.00 0.00 C ATOM 2502 O GLY B 44 -9.005 7.913 -6.401 1.00 0.00 O ATOM 0 H GLY B 44 -6.966 11.206 -6.868 1.00 0.00 H new ATOM 0 HA2 GLY B 44 -9.058 10.249 -7.496 1.00 0.00 H new ATOM 0 HA3 GLY B 44 -8.260 9.305 -8.739 1.00 0.00 H new ATOM 2506 N MET B 45 -6.765 8.251 -6.313 1.00 0.00 N ATOM 2507 CA MET B 45 -6.498 7.191 -5.314 1.00 0.00 C ATOM 2508 C MET B 45 -6.772 7.725 -3.887 1.00 0.00 C ATOM 2509 O MET B 45 -6.919 8.941 -3.698 1.00 0.00 O ATOM 2510 CB MET B 45 -5.044 6.670 -5.485 1.00 0.00 C ATOM 2511 CG MET B 45 -3.931 7.598 -4.954 1.00 0.00 C ATOM 2512 SD MET B 45 -3.607 7.374 -3.189 1.00 0.00 S ATOM 2513 CE MET B 45 -2.900 5.725 -3.149 1.00 0.00 C ATOM 0 H MET B 45 -5.927 8.738 -6.631 1.00 0.00 H new ATOM 0 HA MET B 45 -7.170 6.348 -5.473 1.00 0.00 H new ATOM 0 HB2 MET B 45 -4.961 5.708 -4.979 1.00 0.00 H new ATOM 0 HB3 MET B 45 -4.865 6.489 -6.545 1.00 0.00 H new ATOM 0 HG2 MET B 45 -3.014 7.413 -5.513 1.00 0.00 H new ATOM 0 HG3 MET B 45 -4.212 8.635 -5.138 1.00 0.00 H new ATOM 0 HE1 MET B 45 -2.185 5.655 -2.329 1.00 0.00 H new ATOM 0 HE2 MET B 45 -3.694 4.992 -3.002 1.00 0.00 H new ATOM 0 HE3 MET B 45 -2.391 5.524 -4.092 1.00 0.00 H new ATOM 2523 N LYS B 46 -6.816 6.827 -2.882 1.00 0.00 N ATOM 2524 CA LYS B 46 -7.291 7.177 -1.521 1.00 0.00 C ATOM 2525 C LYS B 46 -6.333 6.623 -0.440 1.00 0.00 C ATOM 2526 O LYS B 46 -5.838 5.494 -0.560 1.00 0.00 O ATOM 2527 CB LYS B 46 -8.741 6.641 -1.355 1.00 0.00 C ATOM 2528 CG LYS B 46 -9.524 7.186 -0.140 1.00 0.00 C ATOM 2529 CD LYS B 46 -11.037 6.883 -0.253 1.00 0.00 C ATOM 2530 CE LYS B 46 -11.852 7.432 0.920 1.00 0.00 C ATOM 2531 NZ LYS B 46 -13.297 7.137 0.770 1.00 0.00 N ATOM 0 H LYS B 46 -6.529 5.853 -2.984 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.299 8.259 -1.392 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -9.301 6.877 -2.260 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.700 5.554 -1.279 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -9.131 6.743 0.775 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -9.373 8.263 -0.063 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -11.418 7.308 -1.182 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -11.181 5.804 -0.314 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -11.487 6.999 1.851 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -11.706 8.510 0.991 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -13.817 7.524 1.583 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -13.651 7.572 -0.106 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -13.439 6.108 0.727 1.00 0.00 H new ATOM 2545 N LEU B 47 -6.092 7.431 0.624 1.00 0.00 N ATOM 2546 CA LEU B 47 -5.102 7.125 1.687 1.00 0.00 C ATOM 2547 C LEU B 47 -5.699 7.306 3.098 1.00 0.00 C ATOM 2548 O LEU B 47 -6.256 8.353 3.430 1.00 0.00 O ATOM 2549 CB LEU B 47 -3.836 8.015 1.520 1.00 0.00 C ATOM 2550 CG LEU B 47 -2.853 7.588 0.391 1.00 0.00 C ATOM 2551 CD1 LEU B 47 -1.734 8.622 0.198 1.00 0.00 C ATOM 2552 CD2 LEU B 47 -2.271 6.191 0.692 1.00 0.00 C ATOM 0 H LEU B 47 -6.580 8.315 0.768 1.00 0.00 H new ATOM 0 HA LEU B 47 -4.821 6.077 1.580 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -4.157 9.039 1.328 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -3.293 8.023 2.465 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.411 7.538 -0.544 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.066 8.291 -0.598 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -2.170 9.584 -0.070 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -1.170 8.725 1.125 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -1.585 5.903 -0.105 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.735 6.217 1.641 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.081 5.465 0.753 1.00 0.00 H new ATOM 2564 N GLY B 48 -5.586 6.253 3.915 1.00 0.00 N ATOM 2565 CA GLY B 48 -5.984 6.286 5.322 1.00 0.00 C ATOM 2566 C GLY B 48 -4.766 6.411 6.220 1.00 0.00 C ATOM 2567 O GLY B 48 -3.636 6.186 5.774 1.00 0.00 O ATOM 0 H GLY B 48 -5.214 5.352 3.615 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -6.658 7.125 5.495 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -6.534 5.379 5.571 1.00 0.00 H new ATOM 2571 N LEU B 49 -5.022 6.707 7.508 1.00 0.00 N ATOM 2572 CA LEU B 49 -4.051 6.570 8.609 1.00 0.00 C ATOM 2573 C LEU B 49 -4.805 5.958 9.802 1.00 0.00 C ATOM 2574 O LEU B 49 -5.653 6.632 10.390 1.00 0.00 O ATOM 2575 CB LEU B 49 -3.438 7.938 9.033 1.00 0.00 C ATOM 2576 CG LEU B 49 -2.616 8.720 7.966 1.00 0.00 C ATOM 2577 CD1 LEU B 49 -2.069 10.031 8.554 1.00 0.00 C ATOM 2578 CD2 LEU B 49 -1.479 7.865 7.365 1.00 0.00 C ATOM 0 H LEU B 49 -5.929 7.055 7.818 1.00 0.00 H new ATOM 0 HA LEU B 49 -3.223 5.942 8.279 1.00 0.00 H new ATOM 0 HB2 LEU B 49 -4.251 8.581 9.369 1.00 0.00 H new ATOM 0 HB3 LEU B 49 -2.793 7.765 9.894 1.00 0.00 H new ATOM 0 HG LEU B 49 -3.295 8.964 7.149 1.00 0.00 H new ATOM 0 HD11 LEU B 49 -1.498 10.561 7.792 1.00 0.00 H new ATOM 0 HD12 LEU B 49 -2.899 10.655 8.886 1.00 0.00 H new ATOM 0 HD13 LEU B 49 -1.422 9.807 9.402 1.00 0.00 H new ATOM 0 HD21 LEU B 49 -0.934 8.452 6.626 1.00 0.00 H new ATOM 0 HD22 LEU B 49 -0.798 7.556 8.158 1.00 0.00 H new ATOM 0 HD23 LEU B 49 -1.902 6.982 6.886 1.00 0.00 H new ATOM 2590 N TRP B 50 -4.532 4.681 10.131 1.00 0.00 N ATOM 2591 CA TRP B 50 -5.111 4.026 11.324 1.00 0.00 C ATOM 2592 C TRP B 50 -4.017 3.936 12.385 1.00 0.00 C ATOM 2593 O TRP B 50 -2.989 3.300 12.164 1.00 0.00 O ATOM 2594 CB TRP B 50 -5.686 2.609 10.993 1.00 0.00 C ATOM 2595 CG TRP B 50 -6.616 2.014 12.054 1.00 0.00 C ATOM 2596 CD1 TRP B 50 -6.887 2.494 13.318 1.00 0.00 C ATOM 2597 CD2 TRP B 50 -7.406 0.823 11.920 1.00 0.00 C ATOM 2598 NE1 TRP B 50 -7.790 1.684 13.952 1.00 0.00 N ATOM 2599 CE2 TRP B 50 -8.126 0.658 13.118 1.00 0.00 C ATOM 2600 CE3 TRP B 50 -7.574 -0.116 10.903 1.00 0.00 C ATOM 2601 CZ2 TRP B 50 -8.994 -0.411 13.324 1.00 0.00 C ATOM 2602 CZ3 TRP B 50 -8.439 -1.175 11.105 1.00 0.00 C ATOM 2603 CH2 TRP B 50 -9.143 -1.314 12.306 1.00 0.00 C ATOM 0 H TRP B 50 -3.913 4.080 9.587 1.00 0.00 H new ATOM 0 HA TRP B 50 -5.950 4.617 11.690 1.00 0.00 H new ATOM 0 HB2 TRP B 50 -6.229 2.667 10.050 1.00 0.00 H new ATOM 0 HB3 TRP B 50 -4.852 1.924 10.839 1.00 0.00 H new ATOM 0 HD1 TRP B 50 -6.449 3.383 13.747 1.00 0.00 H new ATOM 0 HE1 TRP B 50 -8.153 1.825 14.895 1.00 0.00 H new ATOM 0 HE3 TRP B 50 -7.036 -0.017 9.972 1.00 0.00 H new ATOM 0 HZ2 TRP B 50 -9.531 -0.524 14.254 1.00 0.00 H new ATOM 0 HZ3 TRP B 50 -8.574 -1.907 10.323 1.00 0.00 H new ATOM 0 HH2 TRP B 50 -9.816 -2.149 12.432 1.00 0.00 H new ATOM 2614 N SER B 51 -4.237 4.584 13.531 1.00 0.00 N ATOM 2615 CA SER B 51 -3.289 4.561 14.637 1.00 0.00 C ATOM 2616 C SER B 51 -3.353 3.195 15.364 1.00 0.00 C ATOM 2617 O SER B 51 -4.434 2.733 15.774 1.00 0.00 O ATOM 2618 CB SER B 51 -3.528 5.757 15.575 1.00 0.00 C ATOM 2619 OG SER B 51 -4.850 5.800 16.032 1.00 0.00 O ATOM 0 H SER B 51 -5.075 5.136 13.714 1.00 0.00 H new ATOM 0 HA SER B 51 -2.274 4.667 14.254 1.00 0.00 H new ATOM 0 HB2 SER B 51 -2.850 5.693 16.426 1.00 0.00 H new ATOM 0 HB3 SER B 51 -3.294 6.683 15.050 1.00 0.00 H new ATOM 0 HG SER B 51 -4.857 5.953 17.000 1.00 0.00 H new ATOM 2625 N ARG B 52 -2.176 2.572 15.518 1.00 0.00 N ATOM 2626 CA ARG B 52 -2.019 1.149 15.892 1.00 0.00 C ATOM 2627 C ARG B 52 -2.310 0.854 17.388 1.00 0.00 C ATOM 2628 O ARG B 52 -2.286 -0.310 17.805 1.00 0.00 O ATOM 2629 CB ARG B 52 -0.585 0.688 15.519 1.00 0.00 C ATOM 2630 CG ARG B 52 0.532 1.460 16.244 1.00 0.00 C ATOM 2631 CD ARG B 52 1.931 0.920 15.927 1.00 0.00 C ATOM 2632 NE ARG B 52 2.946 1.583 16.756 1.00 0.00 N ATOM 2633 CZ ARG B 52 4.226 1.209 16.886 1.00 0.00 C ATOM 2634 NH1 ARG B 52 4.734 0.213 16.175 1.00 0.00 N ATOM 2635 NH2 ARG B 52 4.998 1.857 17.731 1.00 0.00 N ATOM 0 H ARG B 52 -1.284 3.049 15.384 1.00 0.00 H new ATOM 0 HA ARG B 52 -2.767 0.586 15.334 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -0.485 -0.373 15.747 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -0.448 0.797 14.443 1.00 0.00 H new ATOM 0 HG2 ARG B 52 0.482 2.512 15.963 1.00 0.00 H new ATOM 0 HG3 ARG B 52 0.363 1.409 17.320 1.00 0.00 H new ATOM 0 HD2 ARG B 52 1.959 -0.156 16.101 1.00 0.00 H new ATOM 0 HD3 ARG B 52 2.156 1.078 14.872 1.00 0.00 H new ATOM 0 HE ARG B 52 2.649 2.405 17.282 1.00 0.00 H new ATOM 0 HH11 ARG B 52 4.147 -0.289 15.509 1.00 0.00 H new ATOM 0 HH12 ARG B 52 5.712 -0.051 16.294 1.00 0.00 H new ATOM 0 HH21 ARG B 52 4.620 2.632 18.276 1.00 0.00 H new ATOM 0 HH22 ARG B 52 5.975 1.584 17.841 1.00 0.00 H new ATOM 2649 N HIS B 53 -2.604 1.904 18.176 1.00 0.00 N ATOM 2650 CA HIS B 53 -2.862 1.791 19.633 1.00 0.00 C ATOM 2651 C HIS B 53 -4.185 1.049 19.929 1.00 0.00 C ATOM 2652 O HIS B 53 -4.380 0.557 21.042 1.00 0.00 O ATOM 2653 CB HIS B 53 -2.849 3.200 20.318 1.00 0.00 C ATOM 2654 CG HIS B 53 -3.893 4.194 19.841 1.00 0.00 C ATOM 2655 ND1 HIS B 53 -4.226 5.329 20.545 1.00 0.00 N ATOM 2656 CD2 HIS B 53 -4.651 4.235 18.725 1.00 0.00 C ATOM 2657 CE1 HIS B 53 -5.135 6.015 19.884 1.00 0.00 C ATOM 2658 NE2 HIS B 53 -5.411 5.376 18.773 1.00 0.00 N ATOM 0 H HIS B 53 -2.671 2.859 17.825 1.00 0.00 H new ATOM 0 HA HIS B 53 -2.053 1.196 20.057 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -2.977 3.059 21.391 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -1.864 3.642 20.170 1.00 0.00 H new ATOM 0 HD1 HIS B 53 -3.828 5.598 21.445 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -4.658 3.500 17.934 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -5.578 6.947 20.203 1.00 0.00 H new ATOM 2667 N THR B 54 -5.084 0.978 18.925 1.00 0.00 N ATOM 2668 CA THR B 54 -6.378 0.282 19.056 1.00 0.00 C ATOM 2669 C THR B 54 -6.807 -0.331 17.701 1.00 0.00 C ATOM 2670 O THR B 54 -7.990 -0.626 17.486 1.00 0.00 O ATOM 2671 CB THR B 54 -7.475 1.252 19.636 1.00 0.00 C ATOM 2672 OG1 THR B 54 -8.660 0.525 20.003 1.00 0.00 O ATOM 2673 CG2 THR B 54 -7.842 2.374 18.653 1.00 0.00 C ATOM 0 H THR B 54 -4.934 1.399 18.008 1.00 0.00 H new ATOM 0 HA THR B 54 -6.263 -0.539 19.764 1.00 0.00 H new ATOM 0 HB THR B 54 -7.043 1.713 20.524 1.00 0.00 H new ATOM 0 HG1 THR B 54 -8.867 -0.136 19.309 1.00 0.00 H new ATOM 0 HG21 THR B 54 -8.602 3.015 19.100 1.00 0.00 H new ATOM 0 HG22 THR B 54 -6.954 2.966 18.428 1.00 0.00 H new ATOM 0 HG23 THR B 54 -8.231 1.939 17.732 1.00 0.00 H new ATOM 2681 N VAL B 55 -5.824 -0.551 16.801 1.00 0.00 N ATOM 2682 CA VAL B 55 -6.060 -1.233 15.506 1.00 0.00 C ATOM 2683 C VAL B 55 -6.614 -2.664 15.722 1.00 0.00 C ATOM 2684 O VAL B 55 -6.303 -3.312 16.718 1.00 0.00 O ATOM 2685 CB VAL B 55 -4.753 -1.293 14.624 1.00 0.00 C ATOM 2686 CG1 VAL B 55 -3.623 -2.075 15.334 1.00 0.00 C ATOM 2687 CG2 VAL B 55 -5.044 -1.878 13.218 1.00 0.00 C ATOM 0 H VAL B 55 -4.856 -0.266 16.947 1.00 0.00 H new ATOM 0 HA VAL B 55 -6.803 -0.642 14.971 1.00 0.00 H new ATOM 0 HB VAL B 55 -4.407 -0.268 14.489 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -2.739 -2.096 14.697 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -3.379 -1.586 16.277 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -3.953 -3.095 15.529 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -4.122 -1.905 12.637 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -5.439 -2.889 13.319 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -5.776 -1.252 12.708 1.00 0.00 H new ATOM 2697 N GLU B 56 -7.469 -3.124 14.803 1.00 0.00 N ATOM 2698 CA GLU B 56 -7.996 -4.497 14.801 1.00 0.00 C ATOM 2699 C GLU B 56 -7.683 -5.168 13.442 1.00 0.00 C ATOM 2700 O GLU B 56 -8.193 -4.721 12.405 1.00 0.00 O ATOM 2701 CB GLU B 56 -9.511 -4.517 15.128 1.00 0.00 C ATOM 2702 CG GLU B 56 -9.827 -4.237 16.618 1.00 0.00 C ATOM 2703 CD GLU B 56 -11.300 -4.459 17.003 1.00 0.00 C ATOM 2704 OE1 GLU B 56 -11.845 -5.537 16.682 1.00 0.00 O ATOM 2705 OE2 GLU B 56 -11.911 -3.582 17.654 1.00 0.00 O ATOM 0 H GLU B 56 -7.818 -2.552 14.034 1.00 0.00 H new ATOM 0 HA GLU B 56 -7.504 -5.071 15.586 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -10.017 -3.774 14.512 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -9.920 -5.490 14.855 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -9.201 -4.879 17.237 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -9.554 -3.207 16.848 1.00 0.00 H new ATOM 2712 N PRO B 57 -6.825 -6.257 13.412 1.00 0.00 N ATOM 2713 CA PRO B 57 -6.210 -6.881 14.620 1.00 0.00 C ATOM 2714 C PRO B 57 -5.021 -6.052 15.194 1.00 0.00 C ATOM 2715 O PRO B 57 -4.281 -5.415 14.435 1.00 0.00 O ATOM 2716 CB PRO B 57 -5.759 -8.265 14.089 1.00 0.00 C ATOM 2717 CG PRO B 57 -5.424 -8.021 12.649 1.00 0.00 C ATOM 2718 CD PRO B 57 -6.405 -6.962 12.169 1.00 0.00 C ATOM 0 HA PRO B 57 -6.899 -6.942 15.462 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -4.896 -8.640 14.640 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.550 -9.007 14.193 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -4.395 -7.679 12.539 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -5.520 -8.936 12.065 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -5.936 -6.277 11.463 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -7.257 -7.411 11.660 1.00 0.00 H new ATOM 2726 N LYS B 58 -4.905 -6.030 16.547 1.00 0.00 N ATOM 2727 CA LYS B 58 -3.830 -5.319 17.273 1.00 0.00 C ATOM 2728 C LYS B 58 -2.433 -5.718 16.776 1.00 0.00 C ATOM 2729 O LYS B 58 -2.048 -6.885 16.861 1.00 0.00 O ATOM 2730 CB LYS B 58 -3.941 -5.555 18.808 1.00 0.00 C ATOM 2731 CG LYS B 58 -5.044 -4.746 19.523 1.00 0.00 C ATOM 2732 CD LYS B 58 -4.825 -3.215 19.464 1.00 0.00 C ATOM 2733 CE LYS B 58 -3.541 -2.744 20.162 1.00 0.00 C ATOM 2734 NZ LYS B 58 -3.557 -3.016 21.626 1.00 0.00 N ATOM 0 H LYS B 58 -5.560 -6.509 17.165 1.00 0.00 H new ATOM 0 HA LYS B 58 -3.963 -4.257 17.069 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -4.120 -6.616 18.984 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -2.982 -5.314 19.266 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -6.008 -4.985 19.073 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -5.093 -5.058 20.566 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -4.796 -2.902 18.420 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -5.680 -2.717 19.922 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -2.683 -3.243 19.712 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -3.412 -1.675 19.995 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -2.684 -2.650 22.057 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -4.379 -2.547 22.057 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -3.619 -4.041 21.788 1.00 0.00 H new ATOM 2748 N ALA B 59 -1.695 -4.725 16.269 1.00 0.00 N ATOM 2749 CA ALA B 59 -0.359 -4.903 15.708 1.00 0.00 C ATOM 2750 C ALA B 59 0.493 -3.678 16.043 1.00 0.00 C ATOM 2751 O ALA B 59 0.255 -2.587 15.507 1.00 0.00 O ATOM 2752 CB ALA B 59 -0.459 -5.111 14.185 1.00 0.00 C ATOM 0 H ALA B 59 -2.019 -3.758 16.238 1.00 0.00 H new ATOM 0 HA ALA B 59 0.114 -5.785 16.139 1.00 0.00 H new ATOM 0 HB1 ALA B 59 0.540 -5.244 13.770 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -1.059 -5.997 13.977 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -0.929 -4.240 13.729 1.00 0.00 H new ATOM 2758 N SER B 60 1.462 -3.846 16.953 1.00 0.00 N ATOM 2759 CA SER B 60 2.438 -2.801 17.258 1.00 0.00 C ATOM 2760 C SER B 60 3.652 -3.002 16.338 1.00 0.00 C ATOM 2761 O SER B 60 4.658 -3.606 16.728 1.00 0.00 O ATOM 2762 CB SER B 60 2.831 -2.869 18.753 1.00 0.00 C ATOM 2763 OG SER B 60 1.683 -2.785 19.591 1.00 0.00 O ATOM 0 H SER B 60 1.588 -4.703 17.492 1.00 0.00 H new ATOM 0 HA SER B 60 2.019 -1.811 17.081 1.00 0.00 H new ATOM 0 HB2 SER B 60 3.361 -3.801 18.950 1.00 0.00 H new ATOM 0 HB3 SER B 60 3.517 -2.056 18.989 1.00 0.00 H new ATOM 0 HG SER B 60 1.959 -2.832 20.530 1.00 0.00 H new ATOM 2769 N VAL B 61 3.516 -2.475 15.106 1.00 0.00 N ATOM 2770 CA VAL B 61 4.524 -2.568 14.032 1.00 0.00 C ATOM 2771 C VAL B 61 4.314 -1.389 13.064 1.00 0.00 C ATOM 2772 O VAL B 61 3.176 -1.106 12.658 1.00 0.00 O ATOM 2773 CB VAL B 61 4.467 -3.936 13.213 1.00 0.00 C ATOM 2774 CG1 VAL B 61 5.116 -5.114 13.985 1.00 0.00 C ATOM 2775 CG2 VAL B 61 3.011 -4.281 12.796 1.00 0.00 C ATOM 0 H VAL B 61 2.682 -1.960 14.823 1.00 0.00 H new ATOM 0 HA VAL B 61 5.504 -2.535 14.507 1.00 0.00 H new ATOM 0 HB VAL B 61 5.056 -3.785 12.308 1.00 0.00 H new ATOM 0 HG11 VAL B 61 5.051 -6.022 13.385 1.00 0.00 H new ATOM 0 HG12 VAL B 61 6.163 -4.885 14.185 1.00 0.00 H new ATOM 0 HG13 VAL B 61 4.591 -5.264 14.928 1.00 0.00 H new ATOM 0 HG21 VAL B 61 3.004 -5.218 12.240 1.00 0.00 H new ATOM 0 HG22 VAL B 61 2.392 -4.384 13.687 1.00 0.00 H new ATOM 0 HG23 VAL B 61 2.614 -3.483 12.168 1.00 0.00 H new ATOM 2785 N THR B 62 5.411 -0.692 12.733 1.00 0.00 N ATOM 2786 CA THR B 62 5.426 0.423 11.772 1.00 0.00 C ATOM 2787 C THR B 62 6.769 0.396 11.010 1.00 0.00 C ATOM 2788 O THR B 62 7.837 0.462 11.638 1.00 0.00 O ATOM 2789 CB THR B 62 5.239 1.814 12.497 1.00 0.00 C ATOM 2790 OG1 THR B 62 6.104 1.898 13.640 1.00 0.00 O ATOM 2791 CG2 THR B 62 3.797 2.078 12.949 1.00 0.00 C ATOM 0 H THR B 62 6.329 -0.890 13.132 1.00 0.00 H new ATOM 0 HA THR B 62 4.594 0.304 11.078 1.00 0.00 H new ATOM 0 HB THR B 62 5.495 2.574 11.759 1.00 0.00 H new ATOM 0 HG1 THR B 62 6.975 1.505 13.421 1.00 0.00 H new ATOM 0 HG21 THR B 62 3.741 3.050 13.439 1.00 0.00 H new ATOM 0 HG22 THR B 62 3.137 2.070 12.082 1.00 0.00 H new ATOM 0 HG23 THR B 62 3.487 1.301 13.648 1.00 0.00 H new ATOM 2799 N GLY B 63 6.717 0.291 9.669 1.00 0.00 N ATOM 2800 CA GLY B 63 7.929 0.266 8.847 1.00 0.00 C ATOM 2801 C GLY B 63 7.699 -0.372 7.487 1.00 0.00 C ATOM 2802 O GLY B 63 7.243 0.300 6.548 1.00 0.00 O ATOM 0 H GLY B 63 5.849 0.223 9.138 1.00 0.00 H new ATOM 0 HA2 GLY B 63 8.292 1.285 8.710 1.00 0.00 H new ATOM 0 HA3 GLY B 63 8.710 -0.282 9.374 1.00 0.00 H new ATOM 2806 N GLY B 64 8.008 -1.675 7.389 1.00 0.00 N ATOM 2807 CA GLY B 64 7.841 -2.433 6.146 1.00 0.00 C ATOM 2808 C GLY B 64 6.466 -3.093 6.055 1.00 0.00 C ATOM 2809 O GLY B 64 5.501 -2.610 6.661 1.00 0.00 O ATOM 0 H GLY B 64 8.377 -2.226 8.164 1.00 0.00 H new ATOM 0 HA2 GLY B 64 7.980 -1.767 5.294 1.00 0.00 H new ATOM 0 HA3 GLY B 64 8.615 -3.198 6.082 1.00 0.00 H new ATOM 2813 N GLY B 65 6.375 -4.201 5.287 1.00 0.00 N ATOM 2814 CA GLY B 65 5.096 -4.888 5.019 1.00 0.00 C ATOM 2815 C GLY B 65 4.368 -4.293 3.813 1.00 0.00 C ATOM 2816 O GLY B 65 3.918 -5.026 2.922 1.00 0.00 O ATOM 0 H GLY B 65 7.180 -4.640 4.840 1.00 0.00 H new ATOM 0 HA2 GLY B 65 5.283 -5.947 4.843 1.00 0.00 H new ATOM 0 HA3 GLY B 65 4.456 -4.819 5.899 1.00 0.00 H new ATOM 2820 N GLY B 66 4.268 -2.954 3.804 1.00 0.00 N ATOM 2821 CA GLY B 66 3.714 -2.196 2.686 1.00 0.00 C ATOM 2822 C GLY B 66 4.316 -0.792 2.623 1.00 0.00 C ATOM 2823 O GLY B 66 4.414 -0.116 3.655 1.00 0.00 O ATOM 0 H GLY B 66 4.574 -2.369 4.581 1.00 0.00 H new ATOM 0 HA2 GLY B 66 3.911 -2.722 1.752 1.00 0.00 H new ATOM 0 HA3 GLY B 66 2.631 -2.127 2.790 1.00 0.00 H new ATOM 2827 N GLU B 67 4.757 -0.374 1.419 1.00 0.00 N ATOM 2828 CA GLU B 67 5.328 0.967 1.169 1.00 0.00 C ATOM 2829 C GLU B 67 4.334 1.850 0.384 1.00 0.00 C ATOM 2830 O GLU B 67 3.362 1.347 -0.205 1.00 0.00 O ATOM 2831 CB GLU B 67 6.676 0.837 0.400 1.00 0.00 C ATOM 2832 CG GLU B 67 6.569 0.423 -1.070 1.00 0.00 C ATOM 2833 CD GLU B 67 7.936 0.183 -1.734 1.00 0.00 C ATOM 2834 OE1 GLU B 67 8.820 1.057 -1.632 1.00 0.00 O ATOM 2835 OE2 GLU B 67 8.147 -0.888 -2.344 1.00 0.00 O ATOM 0 H GLU B 67 4.727 -0.962 0.586 1.00 0.00 H new ATOM 0 HA GLU B 67 5.517 1.449 2.128 1.00 0.00 H new ATOM 0 HB2 GLU B 67 7.195 1.794 0.451 1.00 0.00 H new ATOM 0 HB3 GLU B 67 7.299 0.108 0.918 1.00 0.00 H new ATOM 0 HG2 GLU B 67 5.973 -0.487 -1.142 1.00 0.00 H new ATOM 0 HG3 GLU B 67 6.036 1.198 -1.621 1.00 0.00 H new ATOM 2842 N LEU B 68 4.611 3.168 0.333 1.00 0.00 N ATOM 2843 CA LEU B 68 3.741 4.157 -0.327 1.00 0.00 C ATOM 2844 C LEU B 68 4.488 4.772 -1.521 1.00 0.00 C ATOM 2845 O LEU B 68 5.399 5.572 -1.309 1.00 0.00 O ATOM 2846 CB LEU B 68 3.280 5.252 0.678 1.00 0.00 C ATOM 2847 CG LEU B 68 2.304 6.336 0.104 1.00 0.00 C ATOM 2848 CD1 LEU B 68 1.081 5.694 -0.593 1.00 0.00 C ATOM 2849 CD2 LEU B 68 1.869 7.331 1.207 1.00 0.00 C ATOM 0 H LEU B 68 5.448 3.576 0.750 1.00 0.00 H new ATOM 0 HA LEU B 68 2.843 3.659 -0.692 1.00 0.00 H new ATOM 0 HB2 LEU B 68 2.794 4.763 1.522 1.00 0.00 H new ATOM 0 HB3 LEU B 68 4.164 5.756 1.068 1.00 0.00 H new ATOM 0 HG LEU B 68 2.847 6.897 -0.656 1.00 0.00 H new ATOM 0 HD11 LEU B 68 0.428 6.478 -0.977 1.00 0.00 H new ATOM 0 HD12 LEU B 68 1.420 5.067 -1.418 1.00 0.00 H new ATOM 0 HD13 LEU B 68 0.532 5.084 0.124 1.00 0.00 H new ATOM 0 HD21 LEU B 68 1.192 8.072 0.782 1.00 0.00 H new ATOM 0 HD22 LEU B 68 1.360 6.790 2.005 1.00 0.00 H new ATOM 0 HD23 LEU B 68 2.748 7.832 1.612 1.00 0.00 H new ATOM 2861 N ALA B 69 4.148 4.387 -2.757 1.00 0.00 N ATOM 2862 CA ALA B 69 4.966 4.735 -3.944 1.00 0.00 C ATOM 2863 C ALA B 69 4.514 6.062 -4.598 1.00 0.00 C ATOM 2864 O ALA B 69 3.402 6.164 -5.135 1.00 0.00 O ATOM 2865 CB ALA B 69 4.966 3.572 -4.942 1.00 0.00 C ATOM 0 H ALA B 69 3.316 3.836 -2.970 1.00 0.00 H new ATOM 0 HA ALA B 69 5.991 4.900 -3.612 1.00 0.00 H new ATOM 0 HB1 ALA B 69 5.569 3.837 -5.810 1.00 0.00 H new ATOM 0 HB2 ALA B 69 5.384 2.685 -4.467 1.00 0.00 H new ATOM 0 HB3 ALA B 69 3.944 3.365 -5.260 1.00 0.00 H new ATOM 2871 N PHE B 70 5.415 7.065 -4.567 1.00 0.00 N ATOM 2872 CA PHE B 70 5.205 8.405 -5.144 1.00 0.00 C ATOM 2873 C PHE B 70 5.842 8.435 -6.546 1.00 0.00 C ATOM 2874 O PHE B 70 7.060 8.250 -6.690 1.00 0.00 O ATOM 2875 CB PHE B 70 5.867 9.501 -4.257 1.00 0.00 C ATOM 2876 CG PHE B 70 5.257 9.727 -2.871 1.00 0.00 C ATOM 2877 CD1 PHE B 70 5.266 8.728 -1.903 1.00 0.00 C ATOM 2878 CD2 PHE B 70 4.720 10.968 -2.521 1.00 0.00 C ATOM 2879 CE1 PHE B 70 4.744 8.943 -0.647 1.00 0.00 C ATOM 2880 CE2 PHE B 70 4.190 11.182 -1.267 1.00 0.00 C ATOM 2881 CZ PHE B 70 4.213 10.170 -0.326 1.00 0.00 C ATOM 0 H PHE B 70 6.330 6.961 -4.129 1.00 0.00 H new ATOM 0 HA PHE B 70 4.135 8.608 -5.199 1.00 0.00 H new ATOM 0 HB2 PHE B 70 6.919 9.245 -4.128 1.00 0.00 H new ATOM 0 HB3 PHE B 70 5.834 10.445 -4.801 1.00 0.00 H new ATOM 0 HD1 PHE B 70 5.691 7.764 -2.141 1.00 0.00 H new ATOM 0 HD2 PHE B 70 4.720 11.771 -3.243 1.00 0.00 H new ATOM 0 HE1 PHE B 70 4.752 8.149 0.085 1.00 0.00 H new ATOM 0 HE2 PHE B 70 3.757 12.140 -1.020 1.00 0.00 H new ATOM 0 HZ PHE B 70 3.814 10.343 0.662 1.00 0.00 H new ATOM 2891 N ARG B 71 5.006 8.612 -7.572 1.00 0.00 N ATOM 2892 CA ARG B 71 5.444 8.624 -8.979 1.00 0.00 C ATOM 2893 C ARG B 71 5.661 10.061 -9.480 1.00 0.00 C ATOM 2894 O ARG B 71 4.804 10.933 -9.314 1.00 0.00 O ATOM 2895 CB ARG B 71 4.384 7.933 -9.870 1.00 0.00 C ATOM 2896 CG ARG B 71 3.948 6.536 -9.389 1.00 0.00 C ATOM 2897 CD ARG B 71 3.075 5.810 -10.420 1.00 0.00 C ATOM 2898 NE ARG B 71 1.756 6.449 -10.615 1.00 0.00 N ATOM 2899 CZ ARG B 71 1.264 6.870 -11.794 1.00 0.00 C ATOM 2900 NH1 ARG B 71 2.007 6.834 -12.899 1.00 0.00 N ATOM 2901 NH2 ARG B 71 0.032 7.337 -11.860 1.00 0.00 N ATOM 0 H ARG B 71 4.002 8.752 -7.455 1.00 0.00 H new ATOM 0 HA ARG B 71 6.389 8.084 -9.039 1.00 0.00 H new ATOM 0 HB2 ARG B 71 3.504 8.574 -9.927 1.00 0.00 H new ATOM 0 HB3 ARG B 71 4.781 7.846 -10.882 1.00 0.00 H new ATOM 0 HG2 ARG B 71 4.832 5.935 -9.178 1.00 0.00 H new ATOM 0 HG3 ARG B 71 3.397 6.632 -8.453 1.00 0.00 H new ATOM 0 HD2 ARG B 71 3.601 5.777 -11.374 1.00 0.00 H new ATOM 0 HD3 ARG B 71 2.929 4.778 -10.101 1.00 0.00 H new ATOM 0 HE ARG B 71 1.172 6.581 -9.789 1.00 0.00 H new ATOM 0 HH11 ARG B 71 2.964 6.483 -12.859 1.00 0.00 H new ATOM 0 HH12 ARG B 71 1.619 7.157 -13.785 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -0.544 7.378 -11.019 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -0.345 7.657 -12.752 1.00 0.00 H new ATOM 2915 N VAL B 72 6.853 10.282 -10.065 1.00 0.00 N ATOM 2916 CA VAL B 72 7.292 11.602 -10.581 1.00 0.00 C ATOM 2917 C VAL B 72 7.654 11.535 -12.072 1.00 0.00 C ATOM 2918 O VAL B 72 7.810 10.445 -12.640 1.00 0.00 O ATOM 2919 CB VAL B 72 8.563 12.141 -9.815 1.00 0.00 C ATOM 2920 CG1 VAL B 72 8.306 12.314 -8.313 1.00 0.00 C ATOM 2921 CG2 VAL B 72 9.806 11.256 -10.062 1.00 0.00 C ATOM 0 H VAL B 72 7.548 9.547 -10.196 1.00 0.00 H new ATOM 0 HA VAL B 72 6.447 12.273 -10.425 1.00 0.00 H new ATOM 0 HB VAL B 72 8.771 13.128 -10.227 1.00 0.00 H new ATOM 0 HG11 VAL B 72 9.209 12.687 -7.830 1.00 0.00 H new ATOM 0 HG12 VAL B 72 7.494 13.025 -8.162 1.00 0.00 H new ATOM 0 HG13 VAL B 72 8.032 11.353 -7.878 1.00 0.00 H new ATOM 0 HG21 VAL B 72 10.657 11.663 -9.516 1.00 0.00 H new ATOM 0 HG22 VAL B 72 9.605 10.242 -9.716 1.00 0.00 H new ATOM 0 HG23 VAL B 72 10.034 11.238 -11.128 1.00 0.00 H new ATOM 2931 N GLU B 73 7.797 12.729 -12.678 1.00 0.00 N ATOM 2932 CA GLU B 73 8.102 12.874 -14.109 1.00 0.00 C ATOM 2933 C GLU B 73 9.514 12.347 -14.465 1.00 0.00 C ATOM 2934 O GLU B 73 9.664 11.673 -15.492 1.00 0.00 O ATOM 2935 CB GLU B 73 7.918 14.353 -14.560 1.00 0.00 C ATOM 2936 CG GLU B 73 8.794 15.369 -13.819 1.00 0.00 C ATOM 2937 CD GLU B 73 8.643 16.812 -14.329 1.00 0.00 C ATOM 2938 OE1 GLU B 73 9.334 17.177 -15.305 1.00 0.00 O ATOM 2939 OE2 GLU B 73 7.855 17.584 -13.752 1.00 0.00 O ATOM 0 H GLU B 73 7.704 13.618 -12.187 1.00 0.00 H new ATOM 0 HA GLU B 73 7.392 12.255 -14.658 1.00 0.00 H new ATOM 0 HB2 GLU B 73 8.132 14.421 -15.627 1.00 0.00 H new ATOM 0 HB3 GLU B 73 6.873 14.631 -14.426 1.00 0.00 H new ATOM 0 HG2 GLU B 73 8.547 15.341 -12.758 1.00 0.00 H new ATOM 0 HG3 GLU B 73 9.838 15.069 -13.911 1.00 0.00 H new ATOM 2946 N ASN B 74 10.533 12.620 -13.604 1.00 0.00 N ATOM 2947 CA ASN B 74 11.923 12.166 -13.857 1.00 0.00 C ATOM 2948 C ASN B 74 12.827 12.327 -12.619 1.00 0.00 C ATOM 2949 O ASN B 74 12.391 12.804 -11.567 1.00 0.00 O ATOM 2950 CB ASN B 74 12.552 12.932 -15.064 1.00 0.00 C ATOM 2951 CG ASN B 74 12.850 14.405 -14.749 1.00 0.00 C ATOM 2952 OD1 ASN B 74 13.941 14.750 -14.299 1.00 0.00 O ATOM 2953 ND2 ASN B 74 11.890 15.279 -14.980 1.00 0.00 N ATOM 0 H ASN B 74 10.417 13.147 -12.738 1.00 0.00 H new ATOM 0 HA ASN B 74 11.861 11.104 -14.094 1.00 0.00 H new ATOM 0 HB2 ASN B 74 13.476 12.435 -15.361 1.00 0.00 H new ATOM 0 HB3 ASN B 74 11.873 12.878 -15.915 1.00 0.00 H new ATOM 0 HD21 ASN B 74 12.043 16.268 -14.785 1.00 0.00 H new ATOM 0 HD22 ASN B 74 10.994 14.966 -15.354 1.00 0.00 H new ATOM 2960 N ASP B 75 14.108 11.933 -12.799 1.00 0.00 N ATOM 2961 CA ASP B 75 15.101 11.718 -11.716 1.00 0.00 C ATOM 2962 C ASP B 75 15.331 12.967 -10.863 1.00 0.00 C ATOM 2963 O ASP B 75 15.657 12.871 -9.667 1.00 0.00 O ATOM 2964 CB ASP B 75 16.437 11.217 -12.324 1.00 0.00 C ATOM 2965 CG ASP B 75 17.024 12.198 -13.347 1.00 0.00 C ATOM 2966 OD1 ASP B 75 16.629 12.143 -14.528 1.00 0.00 O ATOM 2967 OD2 ASP B 75 17.873 13.037 -12.980 1.00 0.00 O ATOM 0 H ASP B 75 14.492 11.750 -13.726 1.00 0.00 H new ATOM 0 HA ASP B 75 14.694 10.960 -11.047 1.00 0.00 H new ATOM 0 HB2 ASP B 75 17.159 11.057 -11.523 1.00 0.00 H new ATOM 0 HB3 ASP B 75 16.274 10.252 -12.804 1.00 0.00 H new ATOM 2972 N ALA B 76 15.182 14.135 -11.504 1.00 0.00 N ATOM 2973 CA ALA B 76 15.394 15.430 -10.858 1.00 0.00 C ATOM 2974 C ALA B 76 14.375 15.625 -9.731 1.00 0.00 C ATOM 2975 O ALA B 76 14.742 15.959 -8.612 1.00 0.00 O ATOM 2976 CB ALA B 76 15.311 16.570 -11.885 1.00 0.00 C ATOM 0 H ALA B 76 14.911 14.204 -12.485 1.00 0.00 H new ATOM 0 HA ALA B 76 16.394 15.449 -10.425 1.00 0.00 H new ATOM 0 HB1 ALA B 76 15.472 17.524 -11.383 1.00 0.00 H new ATOM 0 HB2 ALA B 76 16.076 16.428 -12.648 1.00 0.00 H new ATOM 0 HB3 ALA B 76 14.327 16.567 -12.353 1.00 0.00 H new ATOM 2982 N GLN B 77 13.099 15.318 -10.041 1.00 0.00 N ATOM 2983 CA GLN B 77 11.971 15.433 -9.095 1.00 0.00 C ATOM 2984 C GLN B 77 12.064 14.415 -7.938 1.00 0.00 C ATOM 2985 O GLN B 77 11.482 14.637 -6.881 1.00 0.00 O ATOM 2986 CB GLN B 77 10.626 15.244 -9.837 1.00 0.00 C ATOM 2987 CG GLN B 77 10.276 16.353 -10.840 1.00 0.00 C ATOM 2988 CD GLN B 77 9.924 17.709 -10.219 1.00 0.00 C ATOM 2989 OE1 GLN B 77 9.432 17.796 -9.089 1.00 0.00 O ATOM 2990 NE2 GLN B 77 10.132 18.778 -10.978 1.00 0.00 N ATOM 0 H GLN B 77 12.821 14.981 -10.962 1.00 0.00 H new ATOM 0 HA GLN B 77 12.023 16.433 -8.664 1.00 0.00 H new ATOM 0 HB2 GLN B 77 10.651 14.291 -10.366 1.00 0.00 H new ATOM 0 HB3 GLN B 77 9.827 15.178 -9.098 1.00 0.00 H new ATOM 0 HG2 GLN B 77 11.121 16.489 -11.515 1.00 0.00 H new ATOM 0 HG3 GLN B 77 9.434 16.020 -11.446 1.00 0.00 H new ATOM 0 HE21 GLN B 77 10.540 18.672 -11.907 1.00 0.00 H new ATOM 0 HE22 GLN B 77 9.884 19.705 -10.632 1.00 0.00 H new ATOM 2999 N VAL B 78 12.816 13.312 -8.144 1.00 0.00 N ATOM 3000 CA VAL B 78 13.115 12.336 -7.070 1.00 0.00 C ATOM 3001 C VAL B 78 14.035 12.993 -6.018 1.00 0.00 C ATOM 3002 O VAL B 78 13.808 12.880 -4.809 1.00 0.00 O ATOM 3003 CB VAL B 78 13.815 11.031 -7.625 1.00 0.00 C ATOM 3004 CG1 VAL B 78 14.126 10.015 -6.494 1.00 0.00 C ATOM 3005 CG2 VAL B 78 12.973 10.370 -8.729 1.00 0.00 C ATOM 0 H VAL B 78 13.229 13.074 -9.046 1.00 0.00 H new ATOM 0 HA VAL B 78 12.166 12.042 -6.622 1.00 0.00 H new ATOM 0 HB VAL B 78 14.765 11.343 -8.060 1.00 0.00 H new ATOM 0 HG11 VAL B 78 14.606 9.133 -6.919 1.00 0.00 H new ATOM 0 HG12 VAL B 78 14.792 10.475 -5.765 1.00 0.00 H new ATOM 0 HG13 VAL B 78 13.198 9.722 -6.003 1.00 0.00 H new ATOM 0 HG21 VAL B 78 13.482 9.476 -9.089 1.00 0.00 H new ATOM 0 HG22 VAL B 78 11.998 10.095 -8.327 1.00 0.00 H new ATOM 0 HG23 VAL B 78 12.841 11.070 -9.554 1.00 0.00 H new ATOM 3015 N ASP B 79 15.052 13.723 -6.531 1.00 0.00 N ATOM 3016 CA ASP B 79 16.095 14.384 -5.730 1.00 0.00 C ATOM 3017 C ASP B 79 15.533 15.628 -5.009 1.00 0.00 C ATOM 3018 O ASP B 79 15.979 15.975 -3.904 1.00 0.00 O ATOM 3019 CB ASP B 79 17.274 14.756 -6.672 1.00 0.00 C ATOM 3020 CG ASP B 79 18.482 15.357 -5.939 1.00 0.00 C ATOM 3021 OD1 ASP B 79 19.276 14.588 -5.355 1.00 0.00 O ATOM 3022 OD2 ASP B 79 18.636 16.597 -5.937 1.00 0.00 O ATOM 0 H ASP B 79 15.168 13.869 -7.534 1.00 0.00 H new ATOM 0 HA ASP B 79 16.452 13.707 -4.954 1.00 0.00 H new ATOM 0 HB2 ASP B 79 17.594 13.863 -7.210 1.00 0.00 H new ATOM 0 HB3 ASP B 79 16.921 15.468 -7.418 1.00 0.00 H new ATOM 3027 N GLU B 80 14.535 16.275 -5.635 1.00 0.00 N ATOM 3028 CA GLU B 80 13.840 17.441 -5.051 1.00 0.00 C ATOM 3029 C GLU B 80 12.995 17.006 -3.852 1.00 0.00 C ATOM 3030 O GLU B 80 12.971 17.658 -2.805 1.00 0.00 O ATOM 3031 CB GLU B 80 12.974 18.145 -6.119 1.00 0.00 C ATOM 3032 CG GLU B 80 13.779 18.575 -7.355 1.00 0.00 C ATOM 3033 CD GLU B 80 12.986 19.421 -8.352 1.00 0.00 C ATOM 3034 OE1 GLU B 80 12.522 20.514 -7.968 1.00 0.00 O ATOM 3035 OE2 GLU B 80 12.825 19.005 -9.524 1.00 0.00 O ATOM 0 H GLU B 80 14.187 16.008 -6.556 1.00 0.00 H new ATOM 0 HA GLU B 80 14.584 18.156 -4.700 1.00 0.00 H new ATOM 0 HB2 GLU B 80 12.173 17.474 -6.429 1.00 0.00 H new ATOM 0 HB3 GLU B 80 12.502 19.022 -5.676 1.00 0.00 H new ATOM 0 HG2 GLU B 80 14.652 19.140 -7.028 1.00 0.00 H new ATOM 0 HG3 GLU B 80 14.148 17.684 -7.863 1.00 0.00 H new ATOM 3042 N THR B 81 12.319 15.865 -4.042 1.00 0.00 N ATOM 3043 CA THR B 81 11.458 15.248 -3.030 1.00 0.00 C ATOM 3044 C THR B 81 12.305 14.636 -1.889 1.00 0.00 C ATOM 3045 O THR B 81 11.860 14.573 -0.741 1.00 0.00 O ATOM 3046 CB THR B 81 10.548 14.176 -3.704 1.00 0.00 C ATOM 3047 OG1 THR B 81 9.821 14.786 -4.784 1.00 0.00 O ATOM 3048 CG2 THR B 81 9.542 13.561 -2.735 1.00 0.00 C ATOM 0 H THR B 81 12.357 15.339 -4.915 1.00 0.00 H new ATOM 0 HA THR B 81 10.821 16.012 -2.585 1.00 0.00 H new ATOM 0 HB THR B 81 11.201 13.379 -4.059 1.00 0.00 H new ATOM 0 HG1 THR B 81 10.279 14.604 -5.631 1.00 0.00 H new ATOM 0 HG21 THR B 81 8.936 12.822 -3.260 1.00 0.00 H new ATOM 0 HG22 THR B 81 10.074 13.078 -1.916 1.00 0.00 H new ATOM 0 HG23 THR B 81 8.896 14.343 -2.337 1.00 0.00 H new ATOM 3056 N PHE B 82 13.547 14.222 -2.226 1.00 0.00 N ATOM 3057 CA PHE B 82 14.542 13.723 -1.255 1.00 0.00 C ATOM 3058 C PHE B 82 14.812 14.809 -0.197 1.00 0.00 C ATOM 3059 O PHE B 82 14.496 14.647 0.985 1.00 0.00 O ATOM 3060 CB PHE B 82 15.851 13.334 -2.025 1.00 0.00 C ATOM 3061 CG PHE B 82 17.055 12.850 -1.190 1.00 0.00 C ATOM 3062 CD1 PHE B 82 17.835 13.746 -0.446 1.00 0.00 C ATOM 3063 CD2 PHE B 82 17.426 11.506 -1.171 1.00 0.00 C ATOM 3064 CE1 PHE B 82 18.922 13.314 0.285 1.00 0.00 C ATOM 3065 CE2 PHE B 82 18.520 11.080 -0.440 1.00 0.00 C ATOM 3066 CZ PHE B 82 19.265 11.982 0.287 1.00 0.00 C ATOM 0 H PHE B 82 13.888 14.226 -3.187 1.00 0.00 H new ATOM 0 HA PHE B 82 14.167 12.838 -0.741 1.00 0.00 H new ATOM 0 HB2 PHE B 82 15.600 12.549 -2.739 1.00 0.00 H new ATOM 0 HB3 PHE B 82 16.170 14.201 -2.604 1.00 0.00 H new ATOM 0 HD1 PHE B 82 17.580 14.795 -0.445 1.00 0.00 H new ATOM 0 HD2 PHE B 82 16.851 10.787 -1.735 1.00 0.00 H new ATOM 0 HE1 PHE B 82 19.504 14.022 0.856 1.00 0.00 H new ATOM 0 HE2 PHE B 82 18.792 10.035 -0.439 1.00 0.00 H new ATOM 0 HZ PHE B 82 20.117 11.644 0.858 1.00 0.00 H new ATOM 3076 N ALA B 83 15.338 15.951 -0.679 1.00 0.00 N ATOM 3077 CA ALA B 83 15.761 17.078 0.175 1.00 0.00 C ATOM 3078 C ALA B 83 14.556 17.779 0.822 1.00 0.00 C ATOM 3079 O ALA B 83 14.669 18.332 1.917 1.00 0.00 O ATOM 3080 CB ALA B 83 16.590 18.074 -0.645 1.00 0.00 C ATOM 0 H ALA B 83 15.482 16.119 -1.675 1.00 0.00 H new ATOM 0 HA ALA B 83 16.378 16.680 0.981 1.00 0.00 H new ATOM 0 HB1 ALA B 83 16.898 18.903 -0.007 1.00 0.00 H new ATOM 0 HB2 ALA B 83 17.473 17.573 -1.041 1.00 0.00 H new ATOM 0 HB3 ALA B 83 15.989 18.455 -1.470 1.00 0.00 H new ATOM 3086 N GLY B 84 13.416 17.742 0.113 1.00 0.00 N ATOM 3087 CA GLY B 84 12.152 18.283 0.615 1.00 0.00 C ATOM 3088 C GLY B 84 11.665 17.585 1.879 1.00 0.00 C ATOM 3089 O GLY B 84 11.418 18.238 2.894 1.00 0.00 O ATOM 0 H GLY B 84 13.349 17.337 -0.821 1.00 0.00 H new ATOM 0 HA2 GLY B 84 12.274 19.347 0.818 1.00 0.00 H new ATOM 0 HA3 GLY B 84 11.391 18.192 -0.160 1.00 0.00 H new ATOM 3093 N TRP B 85 11.592 16.246 1.829 1.00 0.00 N ATOM 3094 CA TRP B 85 11.217 15.412 2.994 1.00 0.00 C ATOM 3095 C TRP B 85 12.262 15.561 4.106 1.00 0.00 C ATOM 3096 O TRP B 85 11.906 15.598 5.292 1.00 0.00 O ATOM 3097 CB TRP B 85 11.055 13.941 2.562 1.00 0.00 C ATOM 3098 CG TRP B 85 9.869 13.675 1.662 1.00 0.00 C ATOM 3099 CD1 TRP B 85 8.918 14.565 1.221 1.00 0.00 C ATOM 3100 CD2 TRP B 85 9.510 12.411 1.104 1.00 0.00 C ATOM 3101 NE1 TRP B 85 8.000 13.920 0.438 1.00 0.00 N ATOM 3102 CE2 TRP B 85 8.339 12.599 0.353 1.00 0.00 C ATOM 3103 CE3 TRP B 85 10.065 11.141 1.175 1.00 0.00 C ATOM 3104 CZ2 TRP B 85 7.716 11.560 -0.320 1.00 0.00 C ATOM 3105 CZ3 TRP B 85 9.447 10.114 0.507 1.00 0.00 C ATOM 3106 CH2 TRP B 85 8.278 10.325 -0.226 1.00 0.00 C ATOM 0 H TRP B 85 11.789 15.707 0.986 1.00 0.00 H new ATOM 0 HA TRP B 85 10.259 15.751 3.388 1.00 0.00 H new ATOM 0 HB2 TRP B 85 11.963 13.625 2.048 1.00 0.00 H new ATOM 0 HB3 TRP B 85 10.963 13.322 3.455 1.00 0.00 H new ATOM 0 HD1 TRP B 85 8.899 15.619 1.458 1.00 0.00 H new ATOM 0 HE1 TRP B 85 7.193 14.355 -0.010 1.00 0.00 H new ATOM 0 HE3 TRP B 85 10.965 10.964 1.745 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 6.818 11.725 -0.897 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 9.874 9.123 0.549 1.00 0.00 H new ATOM 0 HH2 TRP B 85 7.811 9.491 -0.728 1.00 0.00 H new ATOM 3117 N LYS B 86 13.551 15.602 3.723 1.00 0.00 N ATOM 3118 CA LYS B 86 14.675 15.739 4.672 1.00 0.00 C ATOM 3119 C LYS B 86 14.506 17.002 5.535 1.00 0.00 C ATOM 3120 O LYS B 86 14.648 16.965 6.763 1.00 0.00 O ATOM 3121 CB LYS B 86 16.005 15.762 3.883 1.00 0.00 C ATOM 3122 CG LYS B 86 17.273 15.918 4.735 1.00 0.00 C ATOM 3123 CD LYS B 86 18.576 15.724 3.924 1.00 0.00 C ATOM 3124 CE LYS B 86 18.641 16.600 2.654 1.00 0.00 C ATOM 3125 NZ LYS B 86 20.011 16.696 2.098 1.00 0.00 N ATOM 0 H LYS B 86 13.844 15.541 2.748 1.00 0.00 H new ATOM 0 HA LYS B 86 14.687 14.887 5.351 1.00 0.00 H new ATOM 0 HB2 LYS B 86 16.084 14.838 3.310 1.00 0.00 H new ATOM 0 HB3 LYS B 86 15.967 16.581 3.164 1.00 0.00 H new ATOM 0 HG2 LYS B 86 17.279 16.909 5.189 1.00 0.00 H new ATOM 0 HG3 LYS B 86 17.248 15.194 5.550 1.00 0.00 H new ATOM 0 HD2 LYS B 86 19.430 15.955 4.561 1.00 0.00 H new ATOM 0 HD3 LYS B 86 18.666 14.676 3.639 1.00 0.00 H new ATOM 0 HE2 LYS B 86 17.974 16.187 1.897 1.00 0.00 H new ATOM 0 HE3 LYS B 86 18.277 17.600 2.888 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 19.999 17.294 1.248 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 20.645 17.115 2.808 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 20.352 15.746 1.848 1.00 0.00 H new ATOM 3139 N ALA B 87 14.152 18.099 4.857 1.00 0.00 N ATOM 3140 CA ALA B 87 13.919 19.405 5.487 1.00 0.00 C ATOM 3141 C ALA B 87 12.581 19.450 6.258 1.00 0.00 C ATOM 3142 O ALA B 87 12.388 20.283 7.146 1.00 0.00 O ATOM 3143 CB ALA B 87 13.952 20.505 4.413 1.00 0.00 C ATOM 0 H ALA B 87 14.018 18.106 3.846 1.00 0.00 H new ATOM 0 HA ALA B 87 14.713 19.573 6.214 1.00 0.00 H new ATOM 0 HB1 ALA B 87 13.779 21.475 4.880 1.00 0.00 H new ATOM 0 HB2 ALA B 87 14.926 20.506 3.923 1.00 0.00 H new ATOM 0 HB3 ALA B 87 13.174 20.315 3.673 1.00 0.00 H new ATOM 3149 N SER B 88 11.668 18.527 5.898 1.00 0.00 N ATOM 3150 CA SER B 88 10.323 18.410 6.503 1.00 0.00 C ATOM 3151 C SER B 88 10.257 17.315 7.592 1.00 0.00 C ATOM 3152 O SER B 88 9.170 16.958 8.065 1.00 0.00 O ATOM 3153 CB SER B 88 9.291 18.123 5.395 1.00 0.00 C ATOM 3154 OG SER B 88 9.284 19.169 4.445 1.00 0.00 O ATOM 0 H SER B 88 11.844 17.833 5.171 1.00 0.00 H new ATOM 0 HA SER B 88 10.095 19.356 6.994 1.00 0.00 H new ATOM 0 HB2 SER B 88 9.528 17.179 4.904 1.00 0.00 H new ATOM 0 HB3 SER B 88 8.299 18.014 5.833 1.00 0.00 H new ATOM 0 HG SER B 88 9.984 19.009 3.778 1.00 0.00 H new ATOM 3160 N GLY B 89 11.439 16.799 7.991 1.00 0.00 N ATOM 3161 CA GLY B 89 11.566 15.959 9.184 1.00 0.00 C ATOM 3162 C GLY B 89 11.332 14.469 8.944 1.00 0.00 C ATOM 3163 O GLY B 89 10.656 13.807 9.742 1.00 0.00 O ATOM 0 H GLY B 89 12.318 16.955 7.497 1.00 0.00 H new ATOM 0 HA2 GLY B 89 12.564 16.093 9.602 1.00 0.00 H new ATOM 0 HA3 GLY B 89 10.857 16.308 9.934 1.00 0.00 H new ATOM 3167 N VAL B 90 11.886 13.940 7.846 1.00 0.00 N ATOM 3168 CA VAL B 90 11.928 12.485 7.590 1.00 0.00 C ATOM 3169 C VAL B 90 13.288 11.936 8.094 1.00 0.00 C ATOM 3170 O VAL B 90 14.268 12.688 8.168 1.00 0.00 O ATOM 3171 CB VAL B 90 11.712 12.173 6.050 1.00 0.00 C ATOM 3172 CG1 VAL B 90 13.007 12.340 5.223 1.00 0.00 C ATOM 3173 CG2 VAL B 90 11.099 10.778 5.821 1.00 0.00 C ATOM 0 H VAL B 90 12.317 14.500 7.111 1.00 0.00 H new ATOM 0 HA VAL B 90 11.118 11.992 8.128 1.00 0.00 H new ATOM 0 HB VAL B 90 10.999 12.916 5.694 1.00 0.00 H new ATOM 0 HG11 VAL B 90 12.802 12.114 4.177 1.00 0.00 H new ATOM 0 HG12 VAL B 90 13.364 13.366 5.310 1.00 0.00 H new ATOM 0 HG13 VAL B 90 13.769 11.658 5.599 1.00 0.00 H new ATOM 0 HG21 VAL B 90 10.969 10.609 4.752 1.00 0.00 H new ATOM 0 HG22 VAL B 90 11.763 10.017 6.231 1.00 0.00 H new ATOM 0 HG23 VAL B 90 10.130 10.720 6.318 1.00 0.00 H new ATOM 3183 N ALA B 91 13.333 10.646 8.466 1.00 0.00 N ATOM 3184 CA ALA B 91 14.587 9.970 8.865 1.00 0.00 C ATOM 3185 C ALA B 91 15.426 9.620 7.622 1.00 0.00 C ATOM 3186 O ALA B 91 16.575 10.077 7.498 1.00 0.00 O ATOM 3187 CB ALA B 91 14.286 8.712 9.687 1.00 0.00 C ATOM 0 H ALA B 91 12.511 10.043 8.500 1.00 0.00 H new ATOM 0 HA ALA B 91 15.164 10.653 9.489 1.00 0.00 H new ATOM 0 HB1 ALA B 91 15.222 8.230 9.970 1.00 0.00 H new ATOM 0 HB2 ALA B 91 13.733 8.988 10.585 1.00 0.00 H new ATOM 0 HB3 ALA B 91 13.688 8.022 9.091 1.00 0.00 H new ATOM 3193 N MET B 92 14.836 8.800 6.715 1.00 0.00 N ATOM 3194 CA MET B 92 15.408 8.512 5.378 1.00 0.00 C ATOM 3195 C MET B 92 16.721 7.696 5.462 1.00 0.00 C ATOM 3196 O MET B 92 17.816 8.271 5.548 1.00 0.00 O ATOM 3197 CB MET B 92 15.620 9.815 4.555 1.00 0.00 C ATOM 3198 CG MET B 92 16.253 9.622 3.168 1.00 0.00 C ATOM 3199 SD MET B 92 16.938 11.153 2.509 1.00 0.00 S ATOM 3200 CE MET B 92 15.518 12.237 2.546 1.00 0.00 C ATOM 0 H MET B 92 13.952 8.322 6.891 1.00 0.00 H new ATOM 0 HA MET B 92 14.677 7.895 4.856 1.00 0.00 H new ATOM 0 HB2 MET B 92 14.655 10.307 4.430 1.00 0.00 H new ATOM 0 HB3 MET B 92 16.250 10.491 5.133 1.00 0.00 H new ATOM 0 HG2 MET B 92 17.041 8.872 3.232 1.00 0.00 H new ATOM 0 HG3 MET B 92 15.502 9.237 2.479 1.00 0.00 H new ATOM 0 HE1 MET B 92 15.623 13.001 1.776 1.00 0.00 H new ATOM 0 HE2 MET B 92 14.613 11.658 2.362 1.00 0.00 H new ATOM 0 HE3 MET B 92 15.450 12.714 3.524 1.00 0.00 H new ATOM 3210 N LEU B 93 16.598 6.360 5.550 1.00 0.00 N ATOM 3211 CA LEU B 93 17.764 5.448 5.500 1.00 0.00 C ATOM 3212 C LEU B 93 17.741 4.599 4.196 1.00 0.00 C ATOM 3213 O LEU B 93 17.288 3.452 4.190 1.00 0.00 O ATOM 3214 CB LEU B 93 17.881 4.558 6.809 1.00 0.00 C ATOM 3215 CG LEU B 93 16.576 4.129 7.583 1.00 0.00 C ATOM 3216 CD1 LEU B 93 15.932 5.305 8.354 1.00 0.00 C ATOM 3217 CD2 LEU B 93 15.551 3.425 6.669 1.00 0.00 C ATOM 0 H LEU B 93 15.703 5.883 5.656 1.00 0.00 H new ATOM 0 HA LEU B 93 18.668 6.057 5.475 1.00 0.00 H new ATOM 0 HB2 LEU B 93 18.412 3.646 6.536 1.00 0.00 H new ATOM 0 HB3 LEU B 93 18.515 5.097 7.513 1.00 0.00 H new ATOM 0 HG LEU B 93 16.897 3.398 8.325 1.00 0.00 H new ATOM 0 HD11 LEU B 93 15.037 4.956 8.869 1.00 0.00 H new ATOM 0 HD12 LEU B 93 16.642 5.694 9.084 1.00 0.00 H new ATOM 0 HD13 LEU B 93 15.662 6.095 7.653 1.00 0.00 H new ATOM 0 HD21 LEU B 93 14.672 3.151 7.252 1.00 0.00 H new ATOM 0 HD22 LEU B 93 15.257 4.099 5.865 1.00 0.00 H new ATOM 0 HD23 LEU B 93 15.999 2.527 6.244 1.00 0.00 H new ATOM 3229 N GLN B 94 18.274 5.196 3.106 1.00 0.00 N ATOM 3230 CA GLN B 94 18.419 4.554 1.783 1.00 0.00 C ATOM 3231 C GLN B 94 19.095 5.545 0.822 1.00 0.00 C ATOM 3232 O GLN B 94 18.700 6.722 0.750 1.00 0.00 O ATOM 3233 CB GLN B 94 17.047 4.104 1.181 1.00 0.00 C ATOM 3234 CG GLN B 94 17.099 3.509 -0.256 1.00 0.00 C ATOM 3235 CD GLN B 94 17.945 2.237 -0.383 1.00 0.00 C ATOM 3236 OE1 GLN B 94 18.045 1.447 0.556 1.00 0.00 O ATOM 3237 NE2 GLN B 94 18.580 2.039 -1.537 1.00 0.00 N ATOM 0 H GLN B 94 18.621 6.155 3.123 1.00 0.00 H new ATOM 0 HA GLN B 94 19.025 3.658 1.913 1.00 0.00 H new ATOM 0 HB2 GLN B 94 16.607 3.361 1.846 1.00 0.00 H new ATOM 0 HB3 GLN B 94 16.376 4.963 1.174 1.00 0.00 H new ATOM 0 HG2 GLN B 94 16.083 3.289 -0.582 1.00 0.00 H new ATOM 0 HG3 GLN B 94 17.495 4.264 -0.935 1.00 0.00 H new ATOM 0 HE21 GLN B 94 18.478 2.711 -2.297 1.00 0.00 H new ATOM 0 HE22 GLN B 94 19.168 1.215 -1.660 1.00 0.00 H new ATOM 3246 N GLN B 95 20.114 5.063 0.102 1.00 0.00 N ATOM 3247 CA GLN B 95 20.783 5.814 -0.958 1.00 0.00 C ATOM 3248 C GLN B 95 20.011 5.605 -2.279 1.00 0.00 C ATOM 3249 O GLN B 95 19.869 4.455 -2.722 1.00 0.00 O ATOM 3250 CB GLN B 95 22.265 5.364 -1.064 1.00 0.00 C ATOM 3251 CG GLN B 95 23.076 5.621 0.232 1.00 0.00 C ATOM 3252 CD GLN B 95 24.542 5.186 0.148 1.00 0.00 C ATOM 3253 OE1 GLN B 95 24.888 4.239 -0.557 1.00 0.00 O ATOM 3254 NE2 GLN B 95 25.414 5.881 0.867 1.00 0.00 N ATOM 0 H GLN B 95 20.499 4.129 0.243 1.00 0.00 H new ATOM 0 HA GLN B 95 20.787 6.880 -0.733 1.00 0.00 H new ATOM 0 HB2 GLN B 95 22.299 4.301 -1.301 1.00 0.00 H new ATOM 0 HB3 GLN B 95 22.739 5.891 -1.892 1.00 0.00 H new ATOM 0 HG2 GLN B 95 23.037 6.684 0.468 1.00 0.00 H new ATOM 0 HG3 GLN B 95 22.598 5.094 1.058 1.00 0.00 H new ATOM 0 HE21 GLN B 95 25.095 6.661 1.441 1.00 0.00 H new ATOM 0 HE22 GLN B 95 26.404 5.635 0.845 1.00 0.00 H new ATOM 3263 N PRO B 96 19.448 6.706 -2.889 1.00 0.00 N ATOM 3264 CA PRO B 96 18.674 6.637 -4.159 1.00 0.00 C ATOM 3265 C PRO B 96 19.456 5.913 -5.278 1.00 0.00 C ATOM 3266 O PRO B 96 20.414 6.455 -5.833 1.00 0.00 O ATOM 3267 CB PRO B 96 18.387 8.127 -4.509 1.00 0.00 C ATOM 3268 CG PRO B 96 19.280 8.936 -3.611 1.00 0.00 C ATOM 3269 CD PRO B 96 19.509 8.100 -2.373 1.00 0.00 C ATOM 0 HA PRO B 96 17.758 6.055 -4.055 1.00 0.00 H new ATOM 0 HB2 PRO B 96 18.600 8.330 -5.559 1.00 0.00 H new ATOM 0 HB3 PRO B 96 17.338 8.373 -4.343 1.00 0.00 H new ATOM 0 HG2 PRO B 96 20.224 9.165 -4.106 1.00 0.00 H new ATOM 0 HG3 PRO B 96 18.815 9.888 -3.356 1.00 0.00 H new ATOM 0 HD2 PRO B 96 20.473 8.317 -1.913 1.00 0.00 H new ATOM 0 HD3 PRO B 96 18.746 8.283 -1.616 1.00 0.00 H new ATOM 3277 N ALA B 97 19.045 4.673 -5.556 1.00 0.00 N ATOM 3278 CA ALA B 97 19.756 3.749 -6.457 1.00 0.00 C ATOM 3279 C ALA B 97 19.051 3.665 -7.817 1.00 0.00 C ATOM 3280 O ALA B 97 17.831 3.808 -7.903 1.00 0.00 O ATOM 3281 CB ALA B 97 19.841 2.360 -5.800 1.00 0.00 C ATOM 0 H ALA B 97 18.196 4.272 -5.157 1.00 0.00 H new ATOM 0 HA ALA B 97 20.765 4.125 -6.630 1.00 0.00 H new ATOM 0 HB1 ALA B 97 20.367 1.675 -6.465 1.00 0.00 H new ATOM 0 HB2 ALA B 97 20.381 2.436 -4.856 1.00 0.00 H new ATOM 0 HB3 ALA B 97 18.835 1.984 -5.613 1.00 0.00 H new ATOM 3287 N LYS B 98 19.833 3.436 -8.874 1.00 0.00 N ATOM 3288 CA LYS B 98 19.317 3.274 -10.235 1.00 0.00 C ATOM 3289 C LYS B 98 19.016 1.772 -10.461 1.00 0.00 C ATOM 3290 O LYS B 98 19.929 0.989 -10.721 1.00 0.00 O ATOM 3291 CB LYS B 98 20.371 3.812 -11.272 1.00 0.00 C ATOM 3292 CG LYS B 98 19.837 4.798 -12.337 1.00 0.00 C ATOM 3293 CD LYS B 98 18.501 4.361 -12.965 1.00 0.00 C ATOM 3294 CE LYS B 98 18.165 5.155 -14.231 1.00 0.00 C ATOM 3295 NZ LYS B 98 18.193 6.633 -14.018 1.00 0.00 N ATOM 0 H LYS B 98 20.848 3.357 -8.809 1.00 0.00 H new ATOM 0 HA LYS B 98 18.400 3.847 -10.373 1.00 0.00 H new ATOM 0 HB2 LYS B 98 21.174 4.303 -10.722 1.00 0.00 H new ATOM 0 HB3 LYS B 98 20.813 2.958 -11.786 1.00 0.00 H new ATOM 0 HG2 LYS B 98 19.711 5.780 -11.881 1.00 0.00 H new ATOM 0 HG3 LYS B 98 20.582 4.907 -13.126 1.00 0.00 H new ATOM 0 HD2 LYS B 98 18.546 3.299 -13.206 1.00 0.00 H new ATOM 0 HD3 LYS B 98 17.701 4.489 -12.236 1.00 0.00 H new ATOM 0 HE2 LYS B 98 18.874 4.893 -15.016 1.00 0.00 H new ATOM 0 HE3 LYS B 98 17.176 4.863 -14.584 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 17.247 7.027 -14.196 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 18.474 6.837 -13.038 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 18.877 7.065 -14.671 1.00 0.00 H new ATOM 3309 N MET B 99 17.737 1.380 -10.333 1.00 0.00 N ATOM 3310 CA MET B 99 17.300 -0.034 -10.467 1.00 0.00 C ATOM 3311 C MET B 99 16.632 -0.298 -11.829 1.00 0.00 C ATOM 3312 O MET B 99 16.589 0.581 -12.691 1.00 0.00 O ATOM 3313 CB MET B 99 16.334 -0.413 -9.312 1.00 0.00 C ATOM 3314 CG MET B 99 16.982 -0.467 -7.928 1.00 0.00 C ATOM 3315 SD MET B 99 15.799 -0.967 -6.660 1.00 0.00 S ATOM 3316 CE MET B 99 16.723 -0.655 -5.158 1.00 0.00 C ATOM 0 H MET B 99 16.974 2.027 -10.134 1.00 0.00 H new ATOM 0 HA MET B 99 18.190 -0.660 -10.408 1.00 0.00 H new ATOM 0 HB2 MET B 99 15.518 0.309 -9.288 1.00 0.00 H new ATOM 0 HB3 MET B 99 15.893 -1.386 -9.530 1.00 0.00 H new ATOM 0 HG2 MET B 99 17.817 -1.167 -7.944 1.00 0.00 H new ATOM 0 HG3 MET B 99 17.391 0.512 -7.679 1.00 0.00 H new ATOM 0 HE1 MET B 99 16.880 -1.593 -4.626 1.00 0.00 H new ATOM 0 HE2 MET B 99 17.688 -0.214 -5.409 1.00 0.00 H new ATOM 0 HE3 MET B 99 16.164 0.033 -4.523 1.00 0.00 H new ATOM 3326 N GLU B 100 16.089 -1.525 -11.967 1.00 0.00 N ATOM 3327 CA GLU B 100 15.466 -2.044 -13.204 1.00 0.00 C ATOM 3328 C GLU B 100 14.311 -1.158 -13.699 1.00 0.00 C ATOM 3329 O GLU B 100 14.151 -0.945 -14.900 1.00 0.00 O ATOM 3330 CB GLU B 100 14.942 -3.481 -12.935 1.00 0.00 C ATOM 3331 CG GLU B 100 15.959 -4.420 -12.254 1.00 0.00 C ATOM 3332 CD GLU B 100 17.250 -4.622 -13.065 1.00 0.00 C ATOM 3333 OE1 GLU B 100 17.258 -5.469 -13.976 1.00 0.00 O ATOM 3334 OE2 GLU B 100 18.259 -3.934 -12.792 1.00 0.00 O ATOM 0 H GLU B 100 16.071 -2.200 -11.203 1.00 0.00 H new ATOM 0 HA GLU B 100 16.225 -2.046 -13.986 1.00 0.00 H new ATOM 0 HB2 GLU B 100 14.051 -3.417 -12.310 1.00 0.00 H new ATOM 0 HB3 GLU B 100 14.636 -3.925 -13.882 1.00 0.00 H new ATOM 0 HG2 GLU B 100 16.215 -4.016 -11.275 1.00 0.00 H new ATOM 0 HG3 GLU B 100 15.490 -5.389 -12.086 1.00 0.00 H new ATOM 3341 N PHE B 101 13.512 -0.654 -12.747 1.00 0.00 N ATOM 3342 CA PHE B 101 12.315 0.164 -13.035 1.00 0.00 C ATOM 3343 C PHE B 101 12.666 1.657 -13.131 1.00 0.00 C ATOM 3344 O PHE B 101 11.804 2.472 -13.447 1.00 0.00 O ATOM 3345 CB PHE B 101 11.232 -0.087 -11.951 1.00 0.00 C ATOM 3346 CG PHE B 101 10.788 -1.548 -11.875 1.00 0.00 C ATOM 3347 CD1 PHE B 101 11.522 -2.486 -11.145 1.00 0.00 C ATOM 3348 CD2 PHE B 101 9.655 -1.988 -12.561 1.00 0.00 C ATOM 3349 CE1 PHE B 101 11.139 -3.810 -11.106 1.00 0.00 C ATOM 3350 CE2 PHE B 101 9.277 -3.317 -12.523 1.00 0.00 C ATOM 3351 CZ PHE B 101 10.017 -4.226 -11.796 1.00 0.00 C ATOM 0 H PHE B 101 13.675 -0.800 -11.751 1.00 0.00 H new ATOM 0 HA PHE B 101 11.917 -0.135 -14.005 1.00 0.00 H new ATOM 0 HB2 PHE B 101 11.620 0.220 -10.980 1.00 0.00 H new ATOM 0 HB3 PHE B 101 10.365 0.540 -12.160 1.00 0.00 H new ATOM 0 HD1 PHE B 101 12.401 -2.170 -10.604 1.00 0.00 H new ATOM 0 HD2 PHE B 101 9.067 -1.282 -13.128 1.00 0.00 H new ATOM 0 HE1 PHE B 101 11.717 -4.522 -10.536 1.00 0.00 H new ATOM 0 HE2 PHE B 101 8.401 -3.644 -13.063 1.00 0.00 H new ATOM 0 HZ PHE B 101 9.719 -5.264 -11.766 1.00 0.00 H new ATOM 3361 N GLY B 102 13.936 2.001 -12.842 1.00 0.00 N ATOM 3362 CA GLY B 102 14.432 3.369 -12.998 1.00 0.00 C ATOM 3363 C GLY B 102 15.108 3.911 -11.746 1.00 0.00 C ATOM 3364 O GLY B 102 15.507 3.128 -10.877 1.00 0.00 O ATOM 0 H GLY B 102 14.635 1.342 -12.498 1.00 0.00 H new ATOM 0 HA2 GLY B 102 15.140 3.399 -13.827 1.00 0.00 H new ATOM 0 HA3 GLY B 102 13.601 4.021 -13.265 1.00 0.00 H new ATOM 3368 N TYR B 103 15.226 5.247 -11.638 1.00 0.00 N ATOM 3369 CA TYR B 103 15.946 5.876 -10.517 1.00 0.00 C ATOM 3370 C TYR B 103 15.028 5.926 -9.289 1.00 0.00 C ATOM 3371 O TYR B 103 14.178 6.809 -9.178 1.00 0.00 O ATOM 3372 CB TYR B 103 16.438 7.297 -10.903 1.00 0.00 C ATOM 3373 CG TYR B 103 17.482 7.858 -9.933 1.00 0.00 C ATOM 3374 CD1 TYR B 103 18.650 7.139 -9.678 1.00 0.00 C ATOM 3375 CD2 TYR B 103 17.315 9.080 -9.284 1.00 0.00 C ATOM 3376 CE1 TYR B 103 19.612 7.613 -8.820 1.00 0.00 C ATOM 3377 CE2 TYR B 103 18.276 9.564 -8.422 1.00 0.00 C ATOM 3378 CZ TYR B 103 19.425 8.830 -8.190 1.00 0.00 C ATOM 3379 OH TYR B 103 20.385 9.315 -7.327 1.00 0.00 O ATOM 0 H TYR B 103 14.834 5.908 -12.309 1.00 0.00 H new ATOM 0 HA TYR B 103 16.827 5.280 -10.278 1.00 0.00 H new ATOM 0 HB2 TYR B 103 16.863 7.267 -11.906 1.00 0.00 H new ATOM 0 HB3 TYR B 103 15.584 7.973 -10.938 1.00 0.00 H new ATOM 0 HD1 TYR B 103 18.801 6.188 -10.167 1.00 0.00 H new ATOM 0 HD2 TYR B 103 16.419 9.657 -9.459 1.00 0.00 H new ATOM 0 HE1 TYR B 103 20.509 7.039 -8.638 1.00 0.00 H new ATOM 0 HE2 TYR B 103 18.132 10.514 -7.929 1.00 0.00 H new ATOM 0 HH TYR B 103 20.631 8.617 -6.685 1.00 0.00 H new ATOM 3389 N THR B 104 15.230 4.989 -8.356 1.00 0.00 N ATOM 3390 CA THR B 104 14.326 4.774 -7.225 1.00 0.00 C ATOM 3391 C THR B 104 14.978 5.225 -5.912 1.00 0.00 C ATOM 3392 O THR B 104 16.203 5.244 -5.770 1.00 0.00 O ATOM 3393 CB THR B 104 13.903 3.269 -7.129 1.00 0.00 C ATOM 3394 OG1 THR B 104 12.927 3.096 -6.099 1.00 0.00 O ATOM 3395 CG2 THR B 104 15.092 2.345 -6.845 1.00 0.00 C ATOM 0 H THR B 104 16.030 4.356 -8.366 1.00 0.00 H new ATOM 0 HA THR B 104 13.432 5.375 -7.392 1.00 0.00 H new ATOM 0 HB THR B 104 13.486 2.997 -8.099 1.00 0.00 H new ATOM 0 HG1 THR B 104 12.934 2.165 -5.794 1.00 0.00 H new ATOM 0 HG21 THR B 104 14.745 1.313 -6.788 1.00 0.00 H new ATOM 0 HG22 THR B 104 15.825 2.438 -7.647 1.00 0.00 H new ATOM 0 HG23 THR B 104 15.553 2.626 -5.898 1.00 0.00 H new ATOM 3403 N PHE B 105 14.117 5.580 -4.966 1.00 0.00 N ATOM 3404 CA PHE B 105 14.499 6.094 -3.651 1.00 0.00 C ATOM 3405 C PHE B 105 13.438 5.691 -2.613 1.00 0.00 C ATOM 3406 O PHE B 105 12.260 5.606 -2.954 1.00 0.00 O ATOM 3407 CB PHE B 105 14.650 7.651 -3.743 1.00 0.00 C ATOM 3408 CG PHE B 105 14.566 8.407 -2.413 1.00 0.00 C ATOM 3409 CD1 PHE B 105 15.532 8.230 -1.424 1.00 0.00 C ATOM 3410 CD2 PHE B 105 13.493 9.265 -2.144 1.00 0.00 C ATOM 3411 CE1 PHE B 105 15.428 8.888 -0.217 1.00 0.00 C ATOM 3412 CE2 PHE B 105 13.390 9.918 -0.935 1.00 0.00 C ATOM 3413 CZ PHE B 105 14.356 9.730 0.027 1.00 0.00 C ATOM 0 H PHE B 105 13.107 5.518 -5.093 1.00 0.00 H new ATOM 0 HA PHE B 105 15.452 5.670 -3.335 1.00 0.00 H new ATOM 0 HB2 PHE B 105 15.609 7.878 -4.208 1.00 0.00 H new ATOM 0 HB3 PHE B 105 13.875 8.034 -4.407 1.00 0.00 H new ATOM 0 HD1 PHE B 105 16.369 7.572 -1.605 1.00 0.00 H new ATOM 0 HD2 PHE B 105 12.733 9.418 -2.896 1.00 0.00 H new ATOM 0 HE1 PHE B 105 16.185 8.746 0.540 1.00 0.00 H new ATOM 0 HE2 PHE B 105 12.554 10.575 -0.743 1.00 0.00 H new ATOM 0 HZ PHE B 105 14.278 10.241 0.975 1.00 0.00 H new ATOM 3423 N THR B 106 13.845 5.412 -1.368 1.00 0.00 N ATOM 3424 CA THR B 106 12.898 5.065 -0.294 1.00 0.00 C ATOM 3425 C THR B 106 13.314 5.773 1.016 1.00 0.00 C ATOM 3426 O THR B 106 14.468 5.718 1.417 1.00 0.00 O ATOM 3427 CB THR B 106 12.821 3.511 -0.089 1.00 0.00 C ATOM 3428 OG1 THR B 106 12.694 2.845 -1.361 1.00 0.00 O ATOM 3429 CG2 THR B 106 11.632 3.107 0.803 1.00 0.00 C ATOM 0 H THR B 106 14.823 5.419 -1.077 1.00 0.00 H new ATOM 0 HA THR B 106 11.904 5.407 -0.581 1.00 0.00 H new ATOM 0 HB THR B 106 13.744 3.208 0.405 1.00 0.00 H new ATOM 0 HG1 THR B 106 12.648 1.876 -1.220 1.00 0.00 H new ATOM 0 HG21 THR B 106 11.616 2.023 0.919 1.00 0.00 H new ATOM 0 HG22 THR B 106 11.736 3.575 1.782 1.00 0.00 H new ATOM 0 HG23 THR B 106 10.702 3.436 0.340 1.00 0.00 H new ATOM 3437 N ALA B 107 12.367 6.464 1.651 1.00 0.00 N ATOM 3438 CA ALA B 107 12.573 7.167 2.924 1.00 0.00 C ATOM 3439 C ALA B 107 11.883 6.425 4.074 1.00 0.00 C ATOM 3440 O ALA B 107 11.192 5.421 3.853 1.00 0.00 O ATOM 3441 CB ALA B 107 12.062 8.613 2.821 1.00 0.00 C ATOM 0 H ALA B 107 11.417 6.554 1.291 1.00 0.00 H new ATOM 0 HA ALA B 107 13.642 7.193 3.136 1.00 0.00 H new ATOM 0 HB1 ALA B 107 12.220 9.123 3.771 1.00 0.00 H new ATOM 0 HB2 ALA B 107 12.605 9.136 2.033 1.00 0.00 H new ATOM 0 HB3 ALA B 107 10.998 8.607 2.585 1.00 0.00 H new ATOM 3447 N ALA B 108 12.097 6.909 5.299 1.00 0.00 N ATOM 3448 CA ALA B 108 11.428 6.396 6.495 1.00 0.00 C ATOM 3449 C ALA B 108 11.089 7.582 7.390 1.00 0.00 C ATOM 3450 O ALA B 108 11.983 8.329 7.747 1.00 0.00 O ATOM 3451 CB ALA B 108 12.343 5.403 7.215 1.00 0.00 C ATOM 0 H ALA B 108 12.744 7.674 5.490 1.00 0.00 H new ATOM 0 HA ALA B 108 10.512 5.868 6.230 1.00 0.00 H new ATOM 0 HB1 ALA B 108 11.840 5.024 8.105 1.00 0.00 H new ATOM 0 HB2 ALA B 108 12.575 4.573 6.548 1.00 0.00 H new ATOM 0 HB3 ALA B 108 13.266 5.904 7.506 1.00 0.00 H new ATOM 3457 N ASP B 109 9.802 7.787 7.691 1.00 0.00 N ATOM 3458 CA ASP B 109 9.325 8.892 8.566 1.00 0.00 C ATOM 3459 C ASP B 109 9.622 8.580 10.078 1.00 0.00 C ATOM 3460 O ASP B 109 10.362 7.628 10.352 1.00 0.00 O ATOM 3461 CB ASP B 109 7.811 9.119 8.272 1.00 0.00 C ATOM 3462 CG ASP B 109 6.940 7.890 8.506 1.00 0.00 C ATOM 3463 OD1 ASP B 109 6.912 7.029 7.624 1.00 0.00 O ATOM 3464 OD2 ASP B 109 6.282 7.782 9.562 1.00 0.00 O ATOM 0 H ASP B 109 9.050 7.195 7.339 1.00 0.00 H new ATOM 0 HA ASP B 109 9.861 9.816 8.351 1.00 0.00 H new ATOM 0 HB2 ASP B 109 7.448 9.933 8.900 1.00 0.00 H new ATOM 0 HB3 ASP B 109 7.697 9.440 7.237 1.00 0.00 H new ATOM 3469 N PRO B 110 9.157 9.420 11.080 1.00 0.00 N ATOM 3470 CA PRO B 110 9.141 9.045 12.527 1.00 0.00 C ATOM 3471 C PRO B 110 8.718 7.576 12.808 1.00 0.00 C ATOM 3472 O PRO B 110 9.399 6.850 13.546 1.00 0.00 O ATOM 3473 CB PRO B 110 8.114 10.041 13.111 1.00 0.00 C ATOM 3474 CG PRO B 110 8.327 11.291 12.320 1.00 0.00 C ATOM 3475 CD PRO B 110 8.719 10.846 10.919 1.00 0.00 C ATOM 0 HA PRO B 110 10.137 9.098 12.967 1.00 0.00 H new ATOM 0 HB2 PRO B 110 7.094 9.671 13.004 1.00 0.00 H new ATOM 0 HB3 PRO B 110 8.282 10.209 14.175 1.00 0.00 H new ATOM 0 HG2 PRO B 110 7.421 11.896 12.297 1.00 0.00 H new ATOM 0 HG3 PRO B 110 9.109 11.905 12.766 1.00 0.00 H new ATOM 0 HD2 PRO B 110 7.879 10.927 10.229 1.00 0.00 H new ATOM 0 HD3 PRO B 110 9.522 11.464 10.518 1.00 0.00 H new ATOM 3483 N ASP B 111 7.605 7.142 12.180 1.00 0.00 N ATOM 3484 CA ASP B 111 7.069 5.766 12.330 1.00 0.00 C ATOM 3485 C ASP B 111 7.662 4.813 11.270 1.00 0.00 C ATOM 3486 O ASP B 111 7.250 3.660 11.161 1.00 0.00 O ATOM 3487 CB ASP B 111 5.516 5.768 12.264 1.00 0.00 C ATOM 3488 CG ASP B 111 4.858 6.653 13.338 1.00 0.00 C ATOM 3489 OD1 ASP B 111 5.352 6.677 14.483 1.00 0.00 O ATOM 3490 OD2 ASP B 111 3.835 7.316 13.051 1.00 0.00 O ATOM 0 H ASP B 111 7.052 7.730 11.556 1.00 0.00 H new ATOM 0 HA ASP B 111 7.369 5.398 13.311 1.00 0.00 H new ATOM 0 HB2 ASP B 111 5.202 6.112 11.278 1.00 0.00 H new ATOM 0 HB3 ASP B 111 5.154 4.746 12.375 1.00 0.00 H new ATOM 3495 N SER B 112 8.600 5.338 10.466 1.00 0.00 N ATOM 3496 CA SER B 112 9.552 4.539 9.669 1.00 0.00 C ATOM 3497 C SER B 112 8.907 3.816 8.473 1.00 0.00 C ATOM 3498 O SER B 112 9.518 2.897 7.913 1.00 0.00 O ATOM 3499 CB SER B 112 10.320 3.546 10.587 1.00 0.00 C ATOM 3500 OG SER B 112 10.968 4.240 11.644 1.00 0.00 O ATOM 0 H SER B 112 8.722 6.344 10.348 1.00 0.00 H new ATOM 0 HA SER B 112 10.260 5.243 9.231 1.00 0.00 H new ATOM 0 HB2 SER B 112 9.627 2.812 10.998 1.00 0.00 H new ATOM 0 HB3 SER B 112 11.056 2.996 10.001 1.00 0.00 H new ATOM 0 HG SER B 112 11.445 3.599 12.212 1.00 0.00 H new ATOM 3506 N HIS B 113 7.693 4.251 8.055 1.00 0.00 N ATOM 3507 CA HIS B 113 7.020 3.685 6.860 1.00 0.00 C ATOM 3508 C HIS B 113 7.904 3.928 5.637 1.00 0.00 C ATOM 3509 O HIS B 113 8.496 5.007 5.500 1.00 0.00 O ATOM 3510 CB HIS B 113 5.624 4.310 6.583 1.00 0.00 C ATOM 3511 CG HIS B 113 4.765 4.458 7.791 1.00 0.00 C ATOM 3512 ND1 HIS B 113 4.455 5.682 8.321 1.00 0.00 N ATOM 3513 CD2 HIS B 113 4.174 3.545 8.581 1.00 0.00 C ATOM 3514 CE1 HIS B 113 3.712 5.526 9.371 1.00 0.00 C ATOM 3515 NE2 HIS B 113 3.524 4.241 9.568 1.00 0.00 N ATOM 0 H HIS B 113 7.163 4.986 8.524 1.00 0.00 H new ATOM 0 HA HIS B 113 6.869 2.623 7.055 1.00 0.00 H new ATOM 0 HB2 HIS B 113 5.762 5.291 6.128 1.00 0.00 H new ATOM 0 HB3 HIS B 113 5.101 3.692 5.854 1.00 0.00 H new ATOM 0 HD2 HIS B 113 4.205 2.472 8.462 1.00 0.00 H new ATOM 0 HE1 HIS B 113 3.313 6.321 9.983 1.00 0.00 H new ATOM 0 HE2 HIS B 113 2.984 3.829 10.329 1.00 0.00 H new ATOM 3524 N ARG B 114 8.015 2.917 4.783 1.00 0.00 N ATOM 3525 CA ARG B 114 8.797 3.010 3.560 1.00 0.00 C ATOM 3526 C ARG B 114 8.078 3.936 2.561 1.00 0.00 C ATOM 3527 O ARG B 114 7.093 3.559 1.936 1.00 0.00 O ATOM 3528 CB ARG B 114 9.052 1.581 3.001 1.00 0.00 C ATOM 3529 CG ARG B 114 9.939 0.707 3.927 1.00 0.00 C ATOM 3530 CD ARG B 114 11.354 1.296 4.111 1.00 0.00 C ATOM 3531 NE ARG B 114 12.131 0.613 5.166 1.00 0.00 N ATOM 3532 CZ ARG B 114 12.401 1.132 6.377 1.00 0.00 C ATOM 3533 NH1 ARG B 114 11.914 2.306 6.739 1.00 0.00 N ATOM 3534 NH2 ARG B 114 13.153 0.462 7.229 1.00 0.00 N ATOM 0 H ARG B 114 7.565 2.012 4.920 1.00 0.00 H new ATOM 0 HA ARG B 114 9.774 3.453 3.754 1.00 0.00 H new ATOM 0 HB2 ARG B 114 8.095 1.082 2.850 1.00 0.00 H new ATOM 0 HB3 ARG B 114 9.528 1.661 2.024 1.00 0.00 H new ATOM 0 HG2 ARG B 114 9.459 0.611 4.901 1.00 0.00 H new ATOM 0 HG3 ARG B 114 10.017 -0.297 3.509 1.00 0.00 H new ATOM 0 HD2 ARG B 114 11.895 1.228 3.167 1.00 0.00 H new ATOM 0 HD3 ARG B 114 11.272 2.355 4.356 1.00 0.00 H new ATOM 0 HE ARG B 114 12.489 -0.320 4.961 1.00 0.00 H new ATOM 0 HH11 ARG B 114 11.323 2.833 6.096 1.00 0.00 H new ATOM 0 HH12 ARG B 114 12.129 2.685 7.661 1.00 0.00 H new ATOM 0 HH21 ARG B 114 13.530 -0.450 6.969 1.00 0.00 H new ATOM 0 HH22 ARG B 114 13.358 0.856 8.147 1.00 0.00 H new ATOM 3548 N LEU B 115 8.539 5.195 2.497 1.00 0.00 N ATOM 3549 CA LEU B 115 7.956 6.222 1.632 1.00 0.00 C ATOM 3550 C LEU B 115 8.779 6.277 0.340 1.00 0.00 C ATOM 3551 O LEU B 115 9.867 6.844 0.296 1.00 0.00 O ATOM 3552 CB LEU B 115 7.973 7.578 2.376 1.00 0.00 C ATOM 3553 CG LEU B 115 7.226 7.611 3.747 1.00 0.00 C ATOM 3554 CD1 LEU B 115 7.459 8.949 4.469 1.00 0.00 C ATOM 3555 CD2 LEU B 115 5.716 7.304 3.579 1.00 0.00 C ATOM 0 H LEU B 115 9.331 5.527 3.048 1.00 0.00 H new ATOM 0 HA LEU B 115 6.921 5.991 1.381 1.00 0.00 H new ATOM 0 HB2 LEU B 115 9.011 7.867 2.542 1.00 0.00 H new ATOM 0 HB3 LEU B 115 7.532 8.333 1.725 1.00 0.00 H new ATOM 0 HG LEU B 115 7.643 6.823 4.373 1.00 0.00 H new ATOM 0 HD11 LEU B 115 6.928 8.946 5.421 1.00 0.00 H new ATOM 0 HD12 LEU B 115 8.525 9.085 4.649 1.00 0.00 H new ATOM 0 HD13 LEU B 115 7.089 9.766 3.850 1.00 0.00 H new ATOM 0 HD21 LEU B 115 5.228 7.335 4.553 1.00 0.00 H new ATOM 0 HD22 LEU B 115 5.264 8.048 2.922 1.00 0.00 H new ATOM 0 HD23 LEU B 115 5.593 6.313 3.143 1.00 0.00 H new ATOM 3567 N ARG B 116 8.215 5.686 -0.702 1.00 0.00 N ATOM 3568 CA ARG B 116 8.889 5.437 -1.977 1.00 0.00 C ATOM 3569 C ARG B 116 8.763 6.662 -2.901 1.00 0.00 C ATOM 3570 O ARG B 116 7.731 7.307 -2.901 1.00 0.00 O ATOM 3571 CB ARG B 116 8.238 4.190 -2.610 1.00 0.00 C ATOM 3572 CG ARG B 116 8.777 3.743 -3.980 1.00 0.00 C ATOM 3573 CD ARG B 116 10.184 3.144 -3.906 1.00 0.00 C ATOM 3574 NE ARG B 116 10.520 2.427 -5.148 1.00 0.00 N ATOM 3575 CZ ARG B 116 10.301 1.127 -5.371 1.00 0.00 C ATOM 3576 NH1 ARG B 116 9.698 0.374 -4.458 1.00 0.00 N ATOM 3577 NH2 ARG B 116 10.680 0.587 -6.520 1.00 0.00 N ATOM 0 H ARG B 116 7.250 5.356 -0.689 1.00 0.00 H new ATOM 0 HA ARG B 116 9.954 5.263 -1.823 1.00 0.00 H new ATOM 0 HB2 ARG B 116 8.350 3.359 -1.914 1.00 0.00 H new ATOM 0 HB3 ARG B 116 7.169 4.380 -2.711 1.00 0.00 H new ATOM 0 HG2 ARG B 116 8.097 3.006 -4.408 1.00 0.00 H new ATOM 0 HG3 ARG B 116 8.788 4.598 -4.656 1.00 0.00 H new ATOM 0 HD2 ARG B 116 10.912 3.937 -3.732 1.00 0.00 H new ATOM 0 HD3 ARG B 116 10.248 2.461 -3.059 1.00 0.00 H new ATOM 0 HE ARG B 116 10.954 2.965 -5.898 1.00 0.00 H new ATOM 0 HH11 ARG B 116 9.396 0.786 -3.575 1.00 0.00 H new ATOM 0 HH12 ARG B 116 9.536 -0.617 -4.640 1.00 0.00 H new ATOM 0 HH21 ARG B 116 11.136 1.162 -7.228 1.00 0.00 H new ATOM 0 HH22 ARG B 116 10.516 -0.404 -6.696 1.00 0.00 H new ATOM 3591 N VAL B 117 9.814 6.975 -3.669 1.00 0.00 N ATOM 3592 CA VAL B 117 9.760 7.893 -4.827 1.00 0.00 C ATOM 3593 C VAL B 117 10.617 7.271 -5.923 1.00 0.00 C ATOM 3594 O VAL B 117 11.764 6.917 -5.649 1.00 0.00 O ATOM 3595 CB VAL B 117 10.326 9.341 -4.530 1.00 0.00 C ATOM 3596 CG1 VAL B 117 10.093 10.294 -5.732 1.00 0.00 C ATOM 3597 CG2 VAL B 117 9.733 9.933 -3.247 1.00 0.00 C ATOM 0 H VAL B 117 10.746 6.593 -3.505 1.00 0.00 H new ATOM 0 HA VAL B 117 8.713 8.018 -5.102 1.00 0.00 H new ATOM 0 HB VAL B 117 11.401 9.238 -4.380 1.00 0.00 H new ATOM 0 HG11 VAL B 117 10.493 11.280 -5.497 1.00 0.00 H new ATOM 0 HG12 VAL B 117 10.598 9.898 -6.613 1.00 0.00 H new ATOM 0 HG13 VAL B 117 9.024 10.374 -5.931 1.00 0.00 H new ATOM 0 HG21 VAL B 117 10.147 10.927 -3.080 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.650 10.003 -3.346 1.00 0.00 H new ATOM 0 HG23 VAL B 117 9.979 9.290 -2.402 1.00 0.00 H new ATOM 3607 N TYR B 118 10.096 7.128 -7.148 1.00 0.00 N ATOM 3608 CA TYR B 118 10.904 6.592 -8.264 1.00 0.00 C ATOM 3609 C TYR B 118 10.713 7.409 -9.547 1.00 0.00 C ATOM 3610 O TYR B 118 9.685 8.075 -9.720 1.00 0.00 O ATOM 3611 CB TYR B 118 10.647 5.079 -8.496 1.00 0.00 C ATOM 3612 CG TYR B 118 9.276 4.738 -9.082 1.00 0.00 C ATOM 3613 CD1 TYR B 118 8.126 4.790 -8.294 1.00 0.00 C ATOM 3614 CD2 TYR B 118 9.133 4.371 -10.426 1.00 0.00 C ATOM 3615 CE1 TYR B 118 6.894 4.487 -8.822 1.00 0.00 C ATOM 3616 CE2 TYR B 118 7.898 4.069 -10.957 1.00 0.00 C ATOM 3617 CZ TYR B 118 6.782 4.129 -10.156 1.00 0.00 C ATOM 3618 OH TYR B 118 5.550 3.818 -10.682 1.00 0.00 O ATOM 0 H TYR B 118 9.136 7.370 -7.395 1.00 0.00 H new ATOM 0 HA TYR B 118 11.950 6.691 -7.975 1.00 0.00 H new ATOM 0 HB2 TYR B 118 11.417 4.693 -9.164 1.00 0.00 H new ATOM 0 HB3 TYR B 118 10.759 4.557 -7.546 1.00 0.00 H new ATOM 0 HD1 TYR B 118 8.205 5.072 -7.255 1.00 0.00 H new ATOM 0 HD2 TYR B 118 10.007 4.324 -11.058 1.00 0.00 H new ATOM 0 HE1 TYR B 118 6.014 4.528 -8.198 1.00 0.00 H new ATOM 0 HE2 TYR B 118 7.807 3.787 -11.996 1.00 0.00 H new ATOM 0 HH TYR B 118 5.072 3.225 -10.066 1.00 0.00 H new ATOM 3628 N ALA B 119 11.681 7.301 -10.450 1.00 0.00 N ATOM 3629 CA ALA B 119 11.614 7.850 -11.799 1.00 0.00 C ATOM 3630 C ALA B 119 11.670 6.672 -12.757 1.00 0.00 C ATOM 3631 O ALA B 119 12.702 5.997 -12.814 1.00 0.00 O ATOM 3632 CB ALA B 119 12.802 8.791 -12.038 1.00 0.00 C ATOM 0 H ALA B 119 12.558 6.816 -10.259 1.00 0.00 H new ATOM 0 HA ALA B 119 10.700 8.424 -11.947 1.00 0.00 H new ATOM 0 HB1 ALA B 119 12.746 9.198 -13.048 1.00 0.00 H new ATOM 0 HB2 ALA B 119 12.771 9.607 -11.316 1.00 0.00 H new ATOM 0 HB3 ALA B 119 13.734 8.238 -11.921 1.00 0.00 H new ATOM 3638 N PHE B 120 10.575 6.396 -13.483 1.00 0.00 N ATOM 3639 CA PHE B 120 10.514 5.231 -14.369 1.00 0.00 C ATOM 3640 C PHE B 120 11.313 5.531 -15.642 1.00 0.00 C ATOM 3641 O PHE B 120 10.914 6.382 -16.448 1.00 0.00 O ATOM 3642 CB PHE B 120 9.051 4.839 -14.699 1.00 0.00 C ATOM 3643 CG PHE B 120 8.926 3.610 -15.608 1.00 0.00 C ATOM 3644 CD1 PHE B 120 9.009 2.325 -15.077 1.00 0.00 C ATOM 3645 CD2 PHE B 120 8.747 3.741 -16.991 1.00 0.00 C ATOM 3646 CE1 PHE B 120 8.918 1.218 -15.891 1.00 0.00 C ATOM 3647 CE2 PHE B 120 8.654 2.630 -17.802 1.00 0.00 C ATOM 3648 CZ PHE B 120 8.741 1.370 -17.253 1.00 0.00 C ATOM 0 H PHE B 120 9.727 6.962 -13.472 1.00 0.00 H new ATOM 0 HA PHE B 120 10.956 4.374 -13.860 1.00 0.00 H new ATOM 0 HB2 PHE B 120 8.518 4.646 -13.768 1.00 0.00 H new ATOM 0 HB3 PHE B 120 8.558 5.685 -15.178 1.00 0.00 H new ATOM 0 HD1 PHE B 120 9.146 2.195 -14.014 1.00 0.00 H new ATOM 0 HD2 PHE B 120 8.681 4.726 -17.428 1.00 0.00 H new ATOM 0 HE1 PHE B 120 8.985 0.228 -15.464 1.00 0.00 H new ATOM 0 HE2 PHE B 120 8.513 2.748 -18.866 1.00 0.00 H new ATOM 0 HZ PHE B 120 8.671 0.499 -17.888 1.00 0.00 H new ATOM 3658 N ALA B 121 12.470 4.871 -15.783 1.00 0.00 N ATOM 3659 CA ALA B 121 13.314 4.988 -16.972 1.00 0.00 C ATOM 3660 C ALA B 121 12.740 4.090 -18.072 1.00 0.00 C ATOM 3661 O ALA B 121 12.871 2.863 -18.017 1.00 0.00 O ATOM 3662 CB ALA B 121 14.778 4.634 -16.641 1.00 0.00 C ATOM 0 H ALA B 121 12.845 4.241 -15.073 1.00 0.00 H new ATOM 0 HA ALA B 121 13.317 6.018 -17.328 1.00 0.00 H new ATOM 0 HB1 ALA B 121 15.387 4.728 -17.540 1.00 0.00 H new ATOM 0 HB2 ALA B 121 15.153 5.314 -15.876 1.00 0.00 H new ATOM 0 HB3 ALA B 121 14.830 3.609 -16.273 1.00 0.00 H new ATOM 3668 N GLY B 122 12.033 4.713 -19.021 1.00 0.00 N ATOM 3669 CA GLY B 122 11.493 4.021 -20.181 1.00 0.00 C ATOM 3670 C GLY B 122 10.778 5.003 -21.105 1.00 0.00 C ATOM 3671 O GLY B 122 11.451 5.644 -21.936 1.00 0.00 O ATOM 3672 OXT GLY B 122 9.547 5.159 -20.995 1.00 0.00 O ATOM 0 H GLY B 122 11.823 5.711 -19.000 1.00 0.00 H new ATOM 0 HA2 GLY B 122 12.298 3.524 -20.722 1.00 0.00 H new ATOM 0 HA3 GLY B 122 10.799 3.245 -19.858 1.00 0.00 H new TER 3676 GLY B 122