USER MOD reduce.3.24.130724 H: found=0, std=0, add=1626, rem=0, adj=63 USER MOD reduce.3.24.130724 removed 1626 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 Single : A 1 MET CE :methyl -116:sc= 0 (180deg=-0.131) USER MOD Single : A 1 MET N :NH3+ -174:sc= -0.808 (180deg=-0.913) USER MOD Single : A 3 CYS SG : rot 102:sc= -0.427 USER MOD Single : A 7 LYS NZ :NH3+ -145:sc= -1 (180deg=-2.01) USER MOD Single : A 12 MET CE :methyl 156:sc= -0.0364 (180deg=-0.991) USER MOD Single : A 14 SER OG : rot -60:sc= -0.149 USER MOD Single : A 15 THR OG1 : rot 170:sc= 1.1 USER MOD Single : A 17 HIS : no HD1:sc=-0.00857 X(o=-0.0086,f=-0.1) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 130:sc= -0.494 USER MOD Single : A 20 SER OG : rot -90:sc= -1.1 USER MOD Single : A 22 LYS NZ :NH3+ 159:sc= 0.163 (180deg=0.0204) USER MOD Single : A 26 LYS NZ :NH3+ 151:sc= -0.185 (180deg=-0.998) USER MOD Single : A 28 LYS NZ :NH3+ 152:sc= 0.66 (180deg=-0.19) USER MOD Single : A 30 ASN : amide:sc= -0.018 K(o=-0.018,f=-1.6!) USER MOD Single : A 31 LYS NZ :NH3+ 162:sc= 0.289 (180deg=-0.205) USER MOD Single : A 32 SER OG : rot 180:sc=-0.00327 USER MOD Single : A 35 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.151) USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.0241 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= -0.0101 K(o=-0.01,f=-1.3!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -2.44! C(o=-2.4!,f=-2.6!) USER MOD Single : A 64 SER OG : rot 180:sc= -0.0552 USER MOD Single : A 65 ASN : amide:sc= -0.292 K(o=-0.29,f=-3.5!) USER MOD Single : A 68 ASN : amide:sc= -1.33! C(o=-1.3!,f=-12!) USER MOD Single : A 73 GLN : amide:sc= -0.453 K(o=-0.45,f=-1.2) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 CYS SG : rot 90:sc= -0.311 USER MOD Single : A 80 SER OG : rot 75:sc= 0.987 USER MOD Single : A 81 CYS SG : rot -11:sc= 0.165 USER MOD Single : A 84 MET CE :methyl -146:sc= -0.681 (180deg=-4.53!) USER MOD Single : A 85 MET CE :methyl 164:sc=-0.00109 (180deg=-0.0185) USER MOD Single : A 86 CYS SG : rot 49:sc= -0.316! USER MOD Single : A 87 ASN :FLIP amide:sc= -0.991 F(o=-4!,f=-0.99) USER MOD Single : A 96 LYS NZ :NH3+ -166:sc= 1.13 (180deg=0.848) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 100 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.142) USER MOD Single : A 101 LYS NZ :NH3+ -158:sc= -0.13 (180deg=-0.726) USER MOD Single : B 1 MET CE :methyl -114:sc= 0 (180deg=-0.171) USER MOD Single : B 1 MET N :NH3+ -173:sc= -0.857 (180deg=-0.928) USER MOD Single : B 3 CYS SG : rot 102:sc= -0.583 USER MOD Single : B 7 LYS NZ :NH3+ -147:sc= -0.886 (180deg=-1.66) USER MOD Single : B 12 MET CE :methyl 157:sc= -0.0081 (180deg=-0.932) USER MOD Single : B 14 SER OG : rot -54:sc= -0.477 USER MOD Single : B 15 THR OG1 : rot 170:sc= 1.04 USER MOD Single : B 17 HIS : no HD1:sc= 0 X(o=0,f=-0.057) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot 130:sc= -0.499 USER MOD Single : B 20 SER OG : rot -90:sc= -0.974 USER MOD Single : B 22 LYS NZ :NH3+ 176:sc= 0.0401 (180deg=-0.0295) USER MOD Single : B 26 LYS NZ :NH3+ 134:sc= -0.241 (180deg=-1.28!) USER MOD Single : B 28 LYS NZ :NH3+ 149:sc= 0.641 (180deg=-0.424) USER MOD Single : B 30 ASN : amide:sc= -0.0372 K(o=-0.037,f=-1.6!) USER MOD Single : B 31 LYS NZ :NH3+ 162:sc= 0.399 (180deg=-0.0347) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.109) USER MOD Single : B 39 THR OG1 : rot 180:sc=-0.00651 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 56 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : B 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 MET CE :methyl 178:sc=-0.00237 (180deg=-0.00785) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 ASN : amide:sc= -2.39! C(o=-2.4!,f=-2.7!) USER MOD Single : B 64 SER OG : rot 180:sc= -0.0735 USER MOD Single : B 65 ASN : amide:sc= -0.365 K(o=-0.36,f=-3.6!) USER MOD Single : B 68 ASN : amide:sc= -1.25! C(o=-1.3!,f=-12!) USER MOD Single : B 73 GLN : amide:sc= -0.483 K(o=-0.48,f=-1.3) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 76 CYS SG : rot 78:sc= -0.147 USER MOD Single : B 80 SER OG : rot 73:sc= 1.13 USER MOD Single : B 81 CYS SG : rot -17:sc= 0.105 USER MOD Single : B 84 MET CE :methyl -142:sc= -0.653 (180deg=-4.68!) USER MOD Single : B 85 MET CE :methyl 158:sc=-0.00497 (180deg=-0.0966) USER MOD Single : B 86 CYS SG : rot 51:sc= -0.22! USER MOD Single : B 87 ASN :FLIP amide:sc= -0.898 F(o=-3.9!,f=-0.9) USER MOD Single : B 96 LYS NZ :NH3+ -155:sc= 1.2 (180deg=0.849) USER MOD Single : B 97 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : B 100 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.333) USER MOD Single : B 101 LYS NZ :NH3+ -158:sc= -0.0548 (180deg=-0.668) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 79.333 2.187 -20.988 1.00 0.00 N ATOM 2 CA MET A 1 79.618 2.995 -19.770 1.00 0.00 C ATOM 3 C MET A 1 78.308 3.546 -19.187 1.00 0.00 C ATOM 4 O MET A 1 78.299 4.544 -18.494 1.00 0.00 O ATOM 5 CB MET A 1 80.545 4.157 -20.135 1.00 0.00 C ATOM 6 CG MET A 1 81.895 3.611 -20.615 1.00 0.00 C ATOM 7 SD MET A 1 82.779 2.848 -19.226 1.00 0.00 S ATOM 8 CE MET A 1 83.432 4.362 -18.467 1.00 0.00 C ATOM 0 H1 MET A 1 80.210 1.735 -21.318 1.00 0.00 H new ATOM 0 H2 MET A 1 78.630 1.455 -20.762 1.00 0.00 H new ATOM 0 H3 MET A 1 78.960 2.806 -21.736 1.00 0.00 H new ATOM 0 HA MET A 1 80.101 2.362 -19.025 1.00 0.00 H new ATOM 0 HB2 MET A 1 80.090 4.766 -20.916 1.00 0.00 H new ATOM 0 HB3 MET A 1 80.690 4.804 -19.270 1.00 0.00 H new ATOM 0 HG2 MET A 1 81.740 2.878 -21.406 1.00 0.00 H new ATOM 0 HG3 MET A 1 82.493 4.417 -21.040 1.00 0.00 H new ATOM 0 HE1 MET A 1 84.521 4.352 -18.514 1.00 0.00 H new ATOM 0 HE2 MET A 1 83.053 5.231 -19.005 1.00 0.00 H new ATOM 0 HE3 MET A 1 83.115 4.413 -17.425 1.00 0.00 H new ATOM 20 N ALA A 2 77.204 2.904 -19.460 1.00 0.00 N ATOM 21 CA ALA A 2 75.900 3.392 -18.918 1.00 0.00 C ATOM 22 C ALA A 2 75.860 3.191 -17.401 1.00 0.00 C ATOM 23 O ALA A 2 75.334 4.010 -16.674 1.00 0.00 O ATOM 24 CB ALA A 2 74.747 2.616 -19.568 1.00 0.00 C ATOM 0 H ALA A 2 77.147 2.063 -20.034 1.00 0.00 H new ATOM 0 HA ALA A 2 75.795 4.453 -19.143 1.00 0.00 H new ATOM 0 HB1 ALA A 2 73.797 2.974 -19.170 1.00 0.00 H new ATOM 0 HB2 ALA A 2 74.769 2.768 -20.647 1.00 0.00 H new ATOM 0 HB3 ALA A 2 74.854 1.554 -19.349 1.00 0.00 H new ATOM 30 N CYS A 3 76.396 2.096 -16.919 1.00 0.00 N ATOM 31 CA CYS A 3 76.379 1.823 -15.446 1.00 0.00 C ATOM 32 C CYS A 3 77.781 1.407 -14.970 1.00 0.00 C ATOM 33 O CYS A 3 78.044 0.238 -14.766 1.00 0.00 O ATOM 34 CB CYS A 3 75.393 0.686 -15.169 1.00 0.00 C ATOM 35 SG CYS A 3 75.665 -0.652 -16.359 1.00 0.00 S ATOM 0 H CYS A 3 76.847 1.376 -17.484 1.00 0.00 H new ATOM 0 HA CYS A 3 76.077 2.724 -14.912 1.00 0.00 H new ATOM 0 HB2 CYS A 3 75.525 0.315 -14.152 1.00 0.00 H new ATOM 0 HB3 CYS A 3 74.369 1.052 -15.245 1.00 0.00 H new ATOM 0 HG CYS A 3 76.341 -1.607 -15.792 1.00 0.00 H new ATOM 41 N PRO A 4 78.680 2.352 -14.785 1.00 0.00 N ATOM 42 CA PRO A 4 80.056 2.024 -14.315 1.00 0.00 C ATOM 43 C PRO A 4 80.079 1.602 -12.836 1.00 0.00 C ATOM 44 O PRO A 4 81.015 0.983 -12.370 1.00 0.00 O ATOM 45 CB PRO A 4 80.811 3.352 -14.537 1.00 0.00 C ATOM 46 CG PRO A 4 79.780 4.451 -14.881 1.00 0.00 C ATOM 47 CD PRO A 4 78.396 3.793 -15.037 1.00 0.00 C ATOM 0 HA PRO A 4 80.496 1.178 -14.843 1.00 0.00 H new ATOM 0 HB2 PRO A 4 81.370 3.624 -13.642 1.00 0.00 H new ATOM 0 HB3 PRO A 4 81.535 3.246 -15.345 1.00 0.00 H new ATOM 0 HG2 PRO A 4 79.754 5.205 -14.095 1.00 0.00 H new ATOM 0 HG3 PRO A 4 80.063 4.961 -15.802 1.00 0.00 H new ATOM 0 HD2 PRO A 4 77.676 4.193 -14.323 1.00 0.00 H new ATOM 0 HD3 PRO A 4 77.982 3.955 -16.032 1.00 0.00 H new ATOM 55 N LEU A 5 79.053 1.934 -12.104 1.00 0.00 N ATOM 56 CA LEU A 5 79.012 1.563 -10.663 1.00 0.00 C ATOM 57 C LEU A 5 79.084 0.039 -10.543 1.00 0.00 C ATOM 58 O LEU A 5 79.637 -0.497 -9.601 1.00 0.00 O ATOM 59 CB LEU A 5 77.709 2.083 -10.043 1.00 0.00 C ATOM 60 CG LEU A 5 77.613 1.705 -8.554 1.00 0.00 C ATOM 61 CD1 LEU A 5 78.705 2.424 -7.748 1.00 0.00 C ATOM 62 CD2 LEU A 5 76.236 2.120 -8.016 1.00 0.00 C ATOM 0 H LEU A 5 78.239 2.447 -12.443 1.00 0.00 H new ATOM 0 HA LEU A 5 79.856 2.007 -10.134 1.00 0.00 H new ATOM 0 HB2 LEU A 5 77.659 3.167 -10.150 1.00 0.00 H new ATOM 0 HB3 LEU A 5 76.856 1.670 -10.582 1.00 0.00 H new ATOM 0 HG LEU A 5 77.748 0.628 -8.453 1.00 0.00 H new ATOM 0 HD11 LEU A 5 78.624 2.146 -6.697 1.00 0.00 H new ATOM 0 HD12 LEU A 5 79.686 2.134 -8.125 1.00 0.00 H new ATOM 0 HD13 LEU A 5 78.581 3.502 -7.849 1.00 0.00 H new ATOM 0 HD21 LEU A 5 76.162 1.855 -6.961 1.00 0.00 H new ATOM 0 HD22 LEU A 5 76.111 3.197 -8.129 1.00 0.00 H new ATOM 0 HD23 LEU A 5 75.456 1.603 -8.575 1.00 0.00 H new ATOM 74 N GLU A 6 78.518 -0.659 -11.484 1.00 0.00 N ATOM 75 CA GLU A 6 78.539 -2.148 -11.432 1.00 0.00 C ATOM 76 C GLU A 6 79.980 -2.658 -11.431 1.00 0.00 C ATOM 77 O GLU A 6 80.343 -3.518 -10.652 1.00 0.00 O ATOM 78 CB GLU A 6 77.823 -2.685 -12.671 1.00 0.00 C ATOM 79 CG GLU A 6 76.326 -2.398 -12.562 1.00 0.00 C ATOM 80 CD GLU A 6 75.645 -2.724 -13.892 1.00 0.00 C ATOM 81 OE1 GLU A 6 76.345 -3.113 -14.812 1.00 0.00 O ATOM 82 OE2 GLU A 6 74.436 -2.582 -13.967 1.00 0.00 O ATOM 0 H GLU A 6 78.039 -0.262 -12.292 1.00 0.00 H new ATOM 0 HA GLU A 6 78.043 -2.487 -10.522 1.00 0.00 H new ATOM 0 HB2 GLU A 6 78.229 -2.219 -13.569 1.00 0.00 H new ATOM 0 HB3 GLU A 6 77.992 -3.758 -12.765 1.00 0.00 H new ATOM 0 HG2 GLU A 6 75.888 -2.994 -11.761 1.00 0.00 H new ATOM 0 HG3 GLU A 6 76.164 -1.351 -12.305 1.00 0.00 H new ATOM 89 N LYS A 7 80.804 -2.140 -12.294 1.00 0.00 N ATOM 90 CA LYS A 7 82.213 -2.599 -12.338 1.00 0.00 C ATOM 91 C LYS A 7 82.918 -2.098 -11.096 1.00 0.00 C ATOM 92 O LYS A 7 83.686 -2.802 -10.484 1.00 0.00 O ATOM 93 CB LYS A 7 82.910 -2.030 -13.574 1.00 0.00 C ATOM 94 CG LYS A 7 82.025 -2.248 -14.798 1.00 0.00 C ATOM 95 CD LYS A 7 82.856 -2.140 -16.081 1.00 0.00 C ATOM 96 CE LYS A 7 83.484 -0.748 -16.187 1.00 0.00 C ATOM 97 NZ LYS A 7 82.430 0.291 -16.020 1.00 0.00 N ATOM 0 H LYS A 7 80.561 -1.417 -12.971 1.00 0.00 H new ATOM 0 HA LYS A 7 82.244 -3.688 -12.383 1.00 0.00 H new ATOM 0 HB2 LYS A 7 83.106 -0.966 -13.438 1.00 0.00 H new ATOM 0 HB3 LYS A 7 83.875 -2.516 -13.718 1.00 0.00 H new ATOM 0 HG2 LYS A 7 81.553 -3.229 -14.744 1.00 0.00 H new ATOM 0 HG3 LYS A 7 81.224 -1.509 -14.812 1.00 0.00 H new ATOM 0 HD2 LYS A 7 83.637 -2.901 -16.083 1.00 0.00 H new ATOM 0 HD3 LYS A 7 82.225 -2.329 -16.949 1.00 0.00 H new ATOM 0 HE2 LYS A 7 84.253 -0.626 -15.424 1.00 0.00 H new ATOM 0 HE3 LYS A 7 83.973 -0.632 -17.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 82.647 1.107 -16.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 81.507 -0.105 -16.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 82.399 0.598 -15.027 1.00 0.00 H new ATOM 111 N ALA A 8 82.658 -0.885 -10.707 1.00 0.00 N ATOM 112 CA ALA A 8 83.336 -0.371 -9.493 1.00 0.00 C ATOM 113 C ALA A 8 82.979 -1.299 -8.344 1.00 0.00 C ATOM 114 O ALA A 8 83.822 -1.681 -7.561 1.00 0.00 O ATOM 115 CB ALA A 8 82.891 1.055 -9.192 1.00 0.00 C ATOM 0 H ALA A 8 82.018 -0.238 -11.168 1.00 0.00 H new ATOM 0 HA ALA A 8 84.416 -0.347 -9.641 1.00 0.00 H new ATOM 0 HB1 ALA A 8 83.400 1.414 -8.297 1.00 0.00 H new ATOM 0 HB2 ALA A 8 83.141 1.700 -10.035 1.00 0.00 H new ATOM 0 HB3 ALA A 8 81.814 1.073 -9.028 1.00 0.00 H new ATOM 121 N LEU A 9 81.753 -1.731 -8.279 1.00 0.00 N ATOM 122 CA LEU A 9 81.394 -2.711 -7.227 1.00 0.00 C ATOM 123 C LEU A 9 82.257 -3.931 -7.490 1.00 0.00 C ATOM 124 O LEU A 9 82.784 -4.554 -6.592 1.00 0.00 O ATOM 125 CB LEU A 9 79.913 -3.085 -7.320 1.00 0.00 C ATOM 126 CG LEU A 9 79.057 -1.919 -6.819 1.00 0.00 C ATOM 127 CD1 LEU A 9 77.592 -2.177 -7.189 1.00 0.00 C ATOM 128 CD2 LEU A 9 79.188 -1.769 -5.282 1.00 0.00 C ATOM 0 H LEU A 9 80.995 -1.451 -8.901 1.00 0.00 H new ATOM 0 HA LEU A 9 81.560 -2.302 -6.230 1.00 0.00 H new ATOM 0 HB2 LEU A 9 79.652 -3.324 -8.351 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.715 -3.977 -6.726 1.00 0.00 H new ATOM 0 HG LEU A 9 79.402 -0.997 -7.287 1.00 0.00 H new ATOM 0 HD11 LEU A 9 76.976 -1.350 -6.835 1.00 0.00 H new ATOM 0 HD12 LEU A 9 77.500 -2.261 -8.272 1.00 0.00 H new ATOM 0 HD13 LEU A 9 77.257 -3.104 -6.724 1.00 0.00 H new ATOM 0 HD21 LEU A 9 78.573 -0.935 -4.944 1.00 0.00 H new ATOM 0 HD22 LEU A 9 78.854 -2.686 -4.797 1.00 0.00 H new ATOM 0 HD23 LEU A 9 80.230 -1.580 -5.022 1.00 0.00 H new ATOM 140 N ASP A 10 82.417 -4.256 -8.741 1.00 0.00 N ATOM 141 CA ASP A 10 83.270 -5.420 -9.098 1.00 0.00 C ATOM 142 C ASP A 10 84.720 -5.095 -8.723 1.00 0.00 C ATOM 143 O ASP A 10 85.460 -5.949 -8.286 1.00 0.00 O ATOM 144 CB ASP A 10 83.155 -5.712 -10.603 1.00 0.00 C ATOM 145 CG ASP A 10 83.584 -7.154 -10.891 1.00 0.00 C ATOM 146 OD1 ASP A 10 84.768 -7.431 -10.797 1.00 0.00 O ATOM 147 OD2 ASP A 10 82.719 -7.957 -11.206 1.00 0.00 O ATOM 0 H ASP A 10 81.995 -3.767 -9.530 1.00 0.00 H new ATOM 0 HA ASP A 10 82.943 -6.306 -8.554 1.00 0.00 H new ATOM 0 HB2 ASP A 10 82.128 -5.556 -10.935 1.00 0.00 H new ATOM 0 HB3 ASP A 10 83.780 -5.019 -11.165 1.00 0.00 H new ATOM 152 N VAL A 11 85.132 -3.866 -8.895 1.00 0.00 N ATOM 153 CA VAL A 11 86.537 -3.492 -8.547 1.00 0.00 C ATOM 154 C VAL A 11 86.781 -3.743 -7.057 1.00 0.00 C ATOM 155 O VAL A 11 87.817 -4.240 -6.664 1.00 0.00 O ATOM 156 CB VAL A 11 86.762 -2.007 -8.848 1.00 0.00 C ATOM 157 CG1 VAL A 11 88.117 -1.553 -8.296 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.721 -1.779 -10.360 1.00 0.00 C ATOM 0 H VAL A 11 84.558 -3.106 -9.261 1.00 0.00 H new ATOM 0 HA VAL A 11 87.226 -4.095 -9.138 1.00 0.00 H new ATOM 0 HB VAL A 11 85.974 -1.426 -8.369 1.00 0.00 H new ATOM 0 HG11 VAL A 11 88.264 -0.496 -8.517 1.00 0.00 H new ATOM 0 HG12 VAL A 11 88.140 -1.705 -7.217 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.913 -2.135 -8.761 1.00 0.00 H new ATOM 0 HG21 VAL A 11 86.881 -0.722 -10.573 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.503 -2.368 -10.838 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.749 -2.084 -10.748 1.00 0.00 H new ATOM 168 N MET A 12 85.837 -3.400 -6.226 1.00 0.00 N ATOM 169 CA MET A 12 86.025 -3.618 -4.765 1.00 0.00 C ATOM 170 C MET A 12 86.019 -5.121 -4.487 1.00 0.00 C ATOM 171 O MET A 12 86.775 -5.626 -3.684 1.00 0.00 O ATOM 172 CB MET A 12 84.893 -2.926 -3.989 1.00 0.00 C ATOM 173 CG MET A 12 85.081 -3.132 -2.479 1.00 0.00 C ATOM 174 SD MET A 12 84.324 -1.752 -1.581 1.00 0.00 S ATOM 175 CE MET A 12 82.702 -1.814 -2.380 1.00 0.00 C ATOM 0 H MET A 12 84.947 -2.980 -6.494 1.00 0.00 H new ATOM 0 HA MET A 12 86.976 -3.194 -4.442 1.00 0.00 H new ATOM 0 HB2 MET A 12 84.883 -1.861 -4.219 1.00 0.00 H new ATOM 0 HB3 MET A 12 83.929 -3.329 -4.301 1.00 0.00 H new ATOM 0 HG2 MET A 12 84.626 -4.073 -2.170 1.00 0.00 H new ATOM 0 HG3 MET A 12 86.142 -3.197 -2.240 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.956 -1.366 -1.724 1.00 0.00 H new ATOM 0 HE2 MET A 12 82.738 -1.262 -3.319 1.00 0.00 H new ATOM 0 HE3 MET A 12 82.434 -2.852 -2.579 1.00 0.00 H new ATOM 185 N VAL A 13 85.155 -5.835 -5.148 1.00 0.00 N ATOM 186 CA VAL A 13 85.073 -7.306 -4.940 1.00 0.00 C ATOM 187 C VAL A 13 86.212 -8.012 -5.680 1.00 0.00 C ATOM 188 O VAL A 13 86.803 -8.946 -5.174 1.00 0.00 O ATOM 189 CB VAL A 13 83.733 -7.801 -5.485 1.00 0.00 C ATOM 190 CG1 VAL A 13 83.615 -9.316 -5.274 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.581 -7.075 -4.772 1.00 0.00 C ATOM 0 H VAL A 13 84.496 -5.460 -5.830 1.00 0.00 H new ATOM 0 HA VAL A 13 85.157 -7.527 -3.876 1.00 0.00 H new ATOM 0 HB VAL A 13 83.677 -7.588 -6.552 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.659 -9.664 -5.664 1.00 0.00 H new ATOM 0 HG12 VAL A 13 84.426 -9.821 -5.799 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.676 -9.541 -4.209 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.628 -7.431 -5.164 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.631 -7.276 -3.702 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.665 -6.002 -4.944 1.00 0.00 H new ATOM 201 N SER A 14 86.519 -7.589 -6.879 1.00 0.00 N ATOM 202 CA SER A 14 87.610 -8.260 -7.640 1.00 0.00 C ATOM 203 C SER A 14 88.945 -8.009 -6.950 1.00 0.00 C ATOM 204 O SER A 14 89.720 -8.921 -6.741 1.00 0.00 O ATOM 205 CB SER A 14 87.664 -7.716 -9.067 1.00 0.00 C ATOM 206 OG SER A 14 87.911 -6.318 -9.030 1.00 0.00 O ATOM 0 H SER A 14 86.064 -6.813 -7.360 1.00 0.00 H new ATOM 0 HA SER A 14 87.412 -9.331 -7.673 1.00 0.00 H new ATOM 0 HB2 SER A 14 88.449 -8.220 -9.631 1.00 0.00 H new ATOM 0 HB3 SER A 14 86.724 -7.917 -9.580 1.00 0.00 H new ATOM 0 HG SER A 14 87.192 -5.872 -8.536 1.00 0.00 H new ATOM 212 N THR A 15 89.224 -6.790 -6.580 1.00 0.00 N ATOM 213 CA THR A 15 90.514 -6.520 -5.892 1.00 0.00 C ATOM 214 C THR A 15 90.536 -7.320 -4.588 1.00 0.00 C ATOM 215 O THR A 15 91.530 -7.909 -4.219 1.00 0.00 O ATOM 216 CB THR A 15 90.647 -5.012 -5.613 1.00 0.00 C ATOM 217 OG1 THR A 15 92.019 -4.686 -5.443 1.00 0.00 O ATOM 218 CG2 THR A 15 89.870 -4.612 -4.351 1.00 0.00 C ATOM 0 H THR A 15 88.622 -5.979 -6.723 1.00 0.00 H new ATOM 0 HA THR A 15 91.354 -6.821 -6.517 1.00 0.00 H new ATOM 0 HB THR A 15 90.231 -4.467 -6.460 1.00 0.00 H new ATOM 0 HG1 THR A 15 92.124 -3.712 -5.422 1.00 0.00 H new ATOM 0 HG21 THR A 15 89.982 -3.542 -4.179 1.00 0.00 H new ATOM 0 HG22 THR A 15 88.814 -4.850 -4.483 1.00 0.00 H new ATOM 0 HG23 THR A 15 90.261 -5.160 -3.494 1.00 0.00 H new ATOM 226 N PHE A 16 89.431 -7.331 -3.896 1.00 0.00 N ATOM 227 CA PHE A 16 89.342 -8.080 -2.607 1.00 0.00 C ATOM 228 C PHE A 16 89.628 -9.562 -2.850 1.00 0.00 C ATOM 229 O PHE A 16 90.299 -10.215 -2.077 1.00 0.00 O ATOM 230 CB PHE A 16 87.923 -7.907 -2.055 1.00 0.00 C ATOM 231 CG PHE A 16 87.761 -8.626 -0.734 1.00 0.00 C ATOM 232 CD1 PHE A 16 87.432 -9.989 -0.702 1.00 0.00 C ATOM 233 CD2 PHE A 16 87.916 -7.918 0.464 1.00 0.00 C ATOM 234 CE1 PHE A 16 87.261 -10.639 0.526 1.00 0.00 C ATOM 235 CE2 PHE A 16 87.740 -8.567 1.691 1.00 0.00 C ATOM 236 CZ PHE A 16 87.414 -9.928 1.722 1.00 0.00 C ATOM 0 H PHE A 16 88.575 -6.848 -4.170 1.00 0.00 H new ATOM 0 HA PHE A 16 90.073 -7.698 -1.895 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.707 -6.847 -1.924 1.00 0.00 H new ATOM 0 HB3 PHE A 16 87.200 -8.293 -2.774 1.00 0.00 H new ATOM 0 HD1 PHE A 16 87.311 -10.537 -1.625 1.00 0.00 H new ATOM 0 HD2 PHE A 16 88.172 -6.869 0.441 1.00 0.00 H new ATOM 0 HE1 PHE A 16 87.011 -11.689 0.551 1.00 0.00 H new ATOM 0 HE2 PHE A 16 87.856 -8.018 2.614 1.00 0.00 H new ATOM 0 HZ PHE A 16 87.280 -10.430 2.669 1.00 0.00 H new ATOM 246 N HIS A 17 89.123 -10.090 -3.925 1.00 0.00 N ATOM 247 CA HIS A 17 89.353 -11.523 -4.247 1.00 0.00 C ATOM 248 C HIS A 17 90.849 -11.769 -4.456 1.00 0.00 C ATOM 249 O HIS A 17 91.382 -12.795 -4.079 1.00 0.00 O ATOM 250 CB HIS A 17 88.588 -11.896 -5.518 1.00 0.00 C ATOM 251 CG HIS A 17 88.828 -13.346 -5.824 1.00 0.00 C ATOM 252 ND1 HIS A 17 88.569 -14.344 -4.895 1.00 0.00 N ATOM 253 CD2 HIS A 17 89.313 -13.984 -6.940 1.00 0.00 C ATOM 254 CE1 HIS A 17 88.898 -15.519 -5.462 1.00 0.00 C ATOM 255 NE2 HIS A 17 89.358 -15.352 -6.704 1.00 0.00 N ATOM 0 H HIS A 17 88.553 -9.584 -4.603 1.00 0.00 H new ATOM 0 HA HIS A 17 88.998 -12.139 -3.421 1.00 0.00 H new ATOM 0 HB2 HIS A 17 87.522 -11.711 -5.384 1.00 0.00 H new ATOM 0 HB3 HIS A 17 88.917 -11.276 -6.352 1.00 0.00 H new ATOM 0 HD2 HIS A 17 89.612 -13.498 -7.857 1.00 0.00 H new ATOM 0 HE1 HIS A 17 88.802 -16.477 -4.973 1.00 0.00 H new ATOM 0 HE2 HIS A 17 89.676 -16.078 -7.346 1.00 0.00 H new ATOM 264 N LYS A 18 91.520 -10.841 -5.080 1.00 0.00 N ATOM 265 CA LYS A 18 92.977 -11.010 -5.347 1.00 0.00 C ATOM 266 C LYS A 18 93.740 -11.163 -4.029 1.00 0.00 C ATOM 267 O LYS A 18 94.632 -11.978 -3.912 1.00 0.00 O ATOM 268 CB LYS A 18 93.485 -9.782 -6.103 1.00 0.00 C ATOM 269 CG LYS A 18 94.933 -10.002 -6.547 1.00 0.00 C ATOM 270 CD LYS A 18 95.418 -8.760 -7.302 1.00 0.00 C ATOM 271 CE LYS A 18 96.862 -8.968 -7.762 1.00 0.00 C ATOM 272 NZ LYS A 18 97.276 -7.821 -8.619 1.00 0.00 N ATOM 0 H LYS A 18 91.119 -9.966 -5.419 1.00 0.00 H new ATOM 0 HA LYS A 18 93.138 -11.906 -5.946 1.00 0.00 H new ATOM 0 HB2 LYS A 18 92.854 -9.593 -6.972 1.00 0.00 H new ATOM 0 HB3 LYS A 18 93.422 -8.900 -5.465 1.00 0.00 H new ATOM 0 HG2 LYS A 18 95.568 -10.188 -5.681 1.00 0.00 H new ATOM 0 HG3 LYS A 18 95.001 -10.882 -7.187 1.00 0.00 H new ATOM 0 HD2 LYS A 18 94.776 -8.571 -8.162 1.00 0.00 H new ATOM 0 HD3 LYS A 18 95.354 -7.883 -6.658 1.00 0.00 H new ATOM 0 HE2 LYS A 18 97.523 -9.049 -6.899 1.00 0.00 H new ATOM 0 HE3 LYS A 18 96.948 -9.902 -8.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 98.258 -7.959 -8.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 96.651 -7.764 -9.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 97.208 -6.938 -8.074 1.00 0.00 H new ATOM 286 N TYR A 19 93.395 -10.390 -3.035 1.00 0.00 N ATOM 287 CA TYR A 19 94.103 -10.507 -1.727 1.00 0.00 C ATOM 288 C TYR A 19 93.797 -11.875 -1.113 1.00 0.00 C ATOM 289 O TYR A 19 94.657 -12.521 -0.549 1.00 0.00 O ATOM 290 CB TYR A 19 93.644 -9.387 -0.785 1.00 0.00 C ATOM 291 CG TYR A 19 94.352 -8.093 -1.136 1.00 0.00 C ATOM 292 CD1 TYR A 19 95.639 -7.846 -0.641 1.00 0.00 C ATOM 293 CD2 TYR A 19 93.728 -7.145 -1.959 1.00 0.00 C ATOM 294 CE1 TYR A 19 96.299 -6.652 -0.959 1.00 0.00 C ATOM 295 CE2 TYR A 19 94.389 -5.950 -2.282 1.00 0.00 C ATOM 296 CZ TYR A 19 95.678 -5.706 -1.783 1.00 0.00 C ATOM 297 OH TYR A 19 96.336 -4.534 -2.099 1.00 0.00 O ATOM 0 H TYR A 19 92.658 -9.686 -3.071 1.00 0.00 H new ATOM 0 HA TYR A 19 95.178 -10.413 -1.880 1.00 0.00 H new ATOM 0 HB2 TYR A 19 92.565 -9.254 -0.863 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.857 -9.659 0.249 1.00 0.00 H new ATOM 0 HD1 TYR A 19 96.124 -8.578 -0.012 1.00 0.00 H new ATOM 0 HD2 TYR A 19 92.737 -7.335 -2.345 1.00 0.00 H new ATOM 0 HE1 TYR A 19 97.288 -6.461 -0.568 1.00 0.00 H new ATOM 0 HE2 TYR A 19 93.906 -5.219 -2.914 1.00 0.00 H new ATOM 0 HH TYR A 19 96.308 -4.395 -3.069 1.00 0.00 H new ATOM 307 N SER A 20 92.579 -12.321 -1.227 1.00 0.00 N ATOM 308 CA SER A 20 92.217 -13.650 -0.663 1.00 0.00 C ATOM 309 C SER A 20 93.080 -14.719 -1.330 1.00 0.00 C ATOM 310 O SER A 20 93.218 -15.819 -0.838 1.00 0.00 O ATOM 311 CB SER A 20 90.741 -13.945 -0.940 1.00 0.00 C ATOM 312 OG SER A 20 90.438 -15.270 -0.523 1.00 0.00 O ATOM 0 H SER A 20 91.817 -11.822 -1.687 1.00 0.00 H new ATOM 0 HA SER A 20 92.386 -13.650 0.414 1.00 0.00 H new ATOM 0 HB2 SER A 20 90.110 -13.232 -0.409 1.00 0.00 H new ATOM 0 HB3 SER A 20 90.529 -13.829 -2.003 1.00 0.00 H new ATOM 0 HG SER A 20 90.587 -15.889 -1.268 1.00 0.00 H new ATOM 318 N GLY A 21 93.659 -14.404 -2.456 1.00 0.00 N ATOM 319 CA GLY A 21 94.507 -15.414 -3.151 1.00 0.00 C ATOM 320 C GLY A 21 95.805 -15.617 -2.366 1.00 0.00 C ATOM 321 O GLY A 21 96.387 -16.683 -2.374 1.00 0.00 O ATOM 0 H GLY A 21 93.583 -13.500 -2.922 1.00 0.00 H new ATOM 0 HA2 GLY A 21 93.970 -16.359 -3.237 1.00 0.00 H new ATOM 0 HA3 GLY A 21 94.731 -15.081 -4.165 1.00 0.00 H new ATOM 325 N LYS A 22 96.263 -14.601 -1.690 1.00 0.00 N ATOM 326 CA LYS A 22 97.524 -14.736 -0.905 1.00 0.00 C ATOM 327 C LYS A 22 97.341 -15.806 0.168 1.00 0.00 C ATOM 328 O LYS A 22 98.171 -16.675 0.346 1.00 0.00 O ATOM 329 CB LYS A 22 97.838 -13.404 -0.223 1.00 0.00 C ATOM 330 CG LYS A 22 97.972 -12.306 -1.278 1.00 0.00 C ATOM 331 CD LYS A 22 98.619 -11.064 -0.660 1.00 0.00 C ATOM 332 CE LYS A 22 97.903 -10.680 0.638 1.00 0.00 C ATOM 333 NZ LYS A 22 98.259 -9.276 0.996 1.00 0.00 N ATOM 0 H LYS A 22 95.820 -13.683 -1.646 1.00 0.00 H new ATOM 0 HA LYS A 22 98.339 -15.015 -1.573 1.00 0.00 H new ATOM 0 HB2 LYS A 22 97.047 -13.150 0.482 1.00 0.00 H new ATOM 0 HB3 LYS A 22 98.762 -13.486 0.350 1.00 0.00 H new ATOM 0 HG2 LYS A 22 98.575 -12.664 -2.113 1.00 0.00 H new ATOM 0 HG3 LYS A 22 96.990 -12.054 -1.679 1.00 0.00 H new ATOM 0 HD2 LYS A 22 99.673 -11.257 -0.458 1.00 0.00 H new ATOM 0 HD3 LYS A 22 98.576 -10.234 -1.366 1.00 0.00 H new ATOM 0 HE2 LYS A 22 96.824 -10.774 0.514 1.00 0.00 H new ATOM 0 HE3 LYS A 22 98.192 -11.358 1.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 97.539 -8.888 1.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 99.186 -9.262 1.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 98.300 -8.697 0.133 1.00 0.00 H new ATOM 347 N GLU A 23 96.254 -15.742 0.892 1.00 0.00 N ATOM 348 CA GLU A 23 96.003 -16.744 1.968 1.00 0.00 C ATOM 349 C GLU A 23 95.243 -17.943 1.389 1.00 0.00 C ATOM 350 O GLU A 23 95.807 -18.998 1.178 1.00 0.00 O ATOM 351 CB GLU A 23 95.184 -16.086 3.090 1.00 0.00 C ATOM 352 CG GLU A 23 95.334 -16.892 4.386 1.00 0.00 C ATOM 353 CD GLU A 23 94.729 -18.280 4.189 1.00 0.00 C ATOM 354 OE1 GLU A 23 93.557 -18.350 3.855 1.00 0.00 O ATOM 355 OE2 GLU A 23 95.448 -19.249 4.371 1.00 0.00 O ATOM 0 H GLU A 23 95.527 -15.035 0.783 1.00 0.00 H new ATOM 0 HA GLU A 23 96.952 -17.094 2.375 1.00 0.00 H new ATOM 0 HB2 GLU A 23 95.523 -15.062 3.247 1.00 0.00 H new ATOM 0 HB3 GLU A 23 94.134 -16.034 2.803 1.00 0.00 H new ATOM 0 HG2 GLU A 23 96.387 -16.976 4.656 1.00 0.00 H new ATOM 0 HG3 GLU A 23 94.835 -16.378 5.207 1.00 0.00 H new ATOM 362 N GLY A 24 93.969 -17.796 1.131 1.00 0.00 N ATOM 363 CA GLY A 24 93.181 -18.937 0.568 1.00 0.00 C ATOM 364 C GLY A 24 91.719 -18.819 1.009 1.00 0.00 C ATOM 365 O GLY A 24 90.811 -19.212 0.301 1.00 0.00 O ATOM 0 H GLY A 24 93.440 -16.938 1.285 1.00 0.00 H new ATOM 0 HA2 GLY A 24 93.244 -18.934 -0.520 1.00 0.00 H new ATOM 0 HA3 GLY A 24 93.599 -19.884 0.909 1.00 0.00 H new ATOM 369 N ASP A 25 91.487 -18.281 2.175 1.00 0.00 N ATOM 370 CA ASP A 25 90.086 -18.136 2.671 1.00 0.00 C ATOM 371 C ASP A 25 89.480 -16.839 2.124 1.00 0.00 C ATOM 372 O ASP A 25 89.912 -15.753 2.457 1.00 0.00 O ATOM 373 CB ASP A 25 90.100 -18.085 4.200 1.00 0.00 C ATOM 374 CG ASP A 25 90.932 -16.889 4.664 1.00 0.00 C ATOM 375 OD1 ASP A 25 91.873 -16.541 3.971 1.00 0.00 O ATOM 376 OD2 ASP A 25 90.617 -16.342 5.710 1.00 0.00 O ATOM 0 H ASP A 25 92.208 -17.934 2.808 1.00 0.00 H new ATOM 0 HA ASP A 25 89.488 -18.983 2.335 1.00 0.00 H new ATOM 0 HB2 ASP A 25 89.082 -18.003 4.581 1.00 0.00 H new ATOM 0 HB3 ASP A 25 90.517 -19.009 4.601 1.00 0.00 H new ATOM 381 N LYS A 26 88.479 -16.943 1.285 1.00 0.00 N ATOM 382 CA LYS A 26 87.834 -15.718 0.710 1.00 0.00 C ATOM 383 C LYS A 26 86.554 -15.404 1.482 1.00 0.00 C ATOM 384 O LYS A 26 85.836 -14.477 1.160 1.00 0.00 O ATOM 385 CB LYS A 26 87.494 -15.958 -0.765 1.00 0.00 C ATOM 386 CG LYS A 26 86.523 -17.142 -0.890 1.00 0.00 C ATOM 387 CD LYS A 26 86.315 -17.516 -2.368 1.00 0.00 C ATOM 388 CE LYS A 26 87.469 -18.398 -2.874 1.00 0.00 C ATOM 389 NZ LYS A 26 87.518 -19.667 -2.092 1.00 0.00 N ATOM 0 H LYS A 26 88.078 -17.827 0.971 1.00 0.00 H new ATOM 0 HA LYS A 26 88.523 -14.877 0.790 1.00 0.00 H new ATOM 0 HB2 LYS A 26 87.046 -15.062 -1.195 1.00 0.00 H new ATOM 0 HB3 LYS A 26 88.404 -16.161 -1.329 1.00 0.00 H new ATOM 0 HG2 LYS A 26 86.914 -18.000 -0.343 1.00 0.00 H new ATOM 0 HG3 LYS A 26 85.566 -16.884 -0.436 1.00 0.00 H new ATOM 0 HD2 LYS A 26 85.369 -18.044 -2.485 1.00 0.00 H new ATOM 0 HD3 LYS A 26 86.251 -16.611 -2.972 1.00 0.00 H new ATOM 0 HE2 LYS A 26 87.333 -18.618 -3.933 1.00 0.00 H new ATOM 0 HE3 LYS A 26 88.415 -17.865 -2.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 87.910 -20.426 -2.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 88.121 -19.536 -1.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 86.557 -19.926 -1.789 1.00 0.00 H new ATOM 403 N PHE A 27 86.249 -16.174 2.491 1.00 0.00 N ATOM 404 CA PHE A 27 85.006 -15.918 3.269 1.00 0.00 C ATOM 405 C PHE A 27 85.283 -14.878 4.354 1.00 0.00 C ATOM 406 O PHE A 27 84.374 -14.377 4.987 1.00 0.00 O ATOM 407 CB PHE A 27 84.542 -17.218 3.929 1.00 0.00 C ATOM 408 CG PHE A 27 84.263 -18.258 2.870 1.00 0.00 C ATOM 409 CD1 PHE A 27 83.032 -18.271 2.203 1.00 0.00 C ATOM 410 CD2 PHE A 27 85.237 -19.214 2.555 1.00 0.00 C ATOM 411 CE1 PHE A 27 82.777 -19.239 1.224 1.00 0.00 C ATOM 412 CE2 PHE A 27 84.981 -20.180 1.576 1.00 0.00 C ATOM 413 CZ PHE A 27 83.751 -20.193 0.911 1.00 0.00 C ATOM 0 H PHE A 27 86.806 -16.967 2.809 1.00 0.00 H new ATOM 0 HA PHE A 27 84.232 -15.548 2.597 1.00 0.00 H new ATOM 0 HB2 PHE A 27 85.307 -17.581 4.616 1.00 0.00 H new ATOM 0 HB3 PHE A 27 83.644 -17.037 4.519 1.00 0.00 H new ATOM 0 HD1 PHE A 27 82.279 -17.535 2.444 1.00 0.00 H new ATOM 0 HD2 PHE A 27 86.187 -19.205 3.069 1.00 0.00 H new ATOM 0 HE1 PHE A 27 81.827 -19.249 0.710 1.00 0.00 H new ATOM 0 HE2 PHE A 27 85.734 -20.916 1.334 1.00 0.00 H new ATOM 0 HZ PHE A 27 83.553 -20.939 0.156 1.00 0.00 H new ATOM 423 N LYS A 28 86.525 -14.541 4.582 1.00 0.00 N ATOM 424 CA LYS A 28 86.822 -13.528 5.638 1.00 0.00 C ATOM 425 C LYS A 28 88.202 -12.906 5.425 1.00 0.00 C ATOM 426 O LYS A 28 89.069 -13.471 4.788 1.00 0.00 O ATOM 427 CB LYS A 28 86.780 -14.207 7.010 1.00 0.00 C ATOM 428 CG LYS A 28 87.802 -15.353 7.039 1.00 0.00 C ATOM 429 CD LYS A 28 87.660 -16.152 8.339 1.00 0.00 C ATOM 430 CE LYS A 28 88.770 -17.207 8.424 1.00 0.00 C ATOM 431 NZ LYS A 28 90.094 -16.541 8.583 1.00 0.00 N ATOM 0 H LYS A 28 87.336 -14.917 4.091 1.00 0.00 H new ATOM 0 HA LYS A 28 86.074 -12.737 5.583 1.00 0.00 H new ATOM 0 HB2 LYS A 28 87.005 -13.484 7.794 1.00 0.00 H new ATOM 0 HB3 LYS A 28 85.779 -14.591 7.208 1.00 0.00 H new ATOM 0 HG2 LYS A 28 87.650 -16.008 6.182 1.00 0.00 H new ATOM 0 HG3 LYS A 28 88.812 -14.952 6.958 1.00 0.00 H new ATOM 0 HD2 LYS A 28 87.716 -15.482 9.197 1.00 0.00 H new ATOM 0 HD3 LYS A 28 86.683 -16.635 8.375 1.00 0.00 H new ATOM 0 HE2 LYS A 28 88.586 -17.874 9.266 1.00 0.00 H new ATOM 0 HE3 LYS A 28 88.769 -17.822 7.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 90.742 -17.174 9.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 90.489 -16.326 7.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 89.976 -15.658 9.120 1.00 0.00 H new ATOM 445 N LEU A 29 88.401 -11.740 5.982 1.00 0.00 N ATOM 446 CA LEU A 29 89.712 -11.028 5.865 1.00 0.00 C ATOM 447 C LEU A 29 90.149 -10.635 7.281 1.00 0.00 C ATOM 448 O LEU A 29 89.338 -10.368 8.144 1.00 0.00 O ATOM 449 CB LEU A 29 89.520 -9.770 4.965 1.00 0.00 C ATOM 450 CG LEU A 29 90.287 -9.864 3.630 1.00 0.00 C ATOM 451 CD1 LEU A 29 91.764 -9.575 3.881 1.00 0.00 C ATOM 452 CD2 LEU A 29 90.101 -11.244 2.961 1.00 0.00 C ATOM 0 H LEU A 29 87.697 -11.240 6.524 1.00 0.00 H new ATOM 0 HA LEU A 29 90.477 -11.657 5.410 1.00 0.00 H new ATOM 0 HB2 LEU A 29 88.458 -9.635 4.759 1.00 0.00 H new ATOM 0 HB3 LEU A 29 89.854 -8.886 5.509 1.00 0.00 H new ATOM 0 HG LEU A 29 89.883 -9.122 2.941 1.00 0.00 H new ATOM 0 HD11 LEU A 29 92.312 -9.640 2.941 1.00 0.00 H new ATOM 0 HD12 LEU A 29 91.873 -8.573 4.296 1.00 0.00 H new ATOM 0 HD13 LEU A 29 92.163 -10.305 4.585 1.00 0.00 H new ATOM 0 HD21 LEU A 29 90.656 -11.272 2.023 1.00 0.00 H new ATOM 0 HD22 LEU A 29 90.473 -12.024 3.626 1.00 0.00 H new ATOM 0 HD23 LEU A 29 89.043 -11.412 2.761 1.00 0.00 H new ATOM 464 N ASN A 30 91.426 -10.630 7.525 1.00 0.00 N ATOM 465 CA ASN A 30 91.939 -10.277 8.873 1.00 0.00 C ATOM 466 C ASN A 30 92.150 -8.763 8.965 1.00 0.00 C ATOM 467 O ASN A 30 92.610 -8.128 8.046 1.00 0.00 O ATOM 468 CB ASN A 30 93.271 -10.995 9.098 1.00 0.00 C ATOM 469 CG ASN A 30 93.023 -12.496 9.255 1.00 0.00 C ATOM 470 OD1 ASN A 30 91.953 -12.907 9.660 1.00 0.00 O ATOM 471 ND2 ASN A 30 93.973 -13.337 8.949 1.00 0.00 N ATOM 0 H ASN A 30 92.145 -10.858 6.839 1.00 0.00 H new ATOM 0 HA ASN A 30 91.220 -10.582 9.633 1.00 0.00 H new ATOM 0 HB2 ASN A 30 93.941 -10.813 8.258 1.00 0.00 H new ATOM 0 HB3 ASN A 30 93.762 -10.602 9.988 1.00 0.00 H new ATOM 0 HD21 ASN A 30 93.818 -14.340 9.050 1.00 0.00 H new ATOM 0 HD22 ASN A 30 94.870 -12.991 8.609 1.00 0.00 H new ATOM 478 N LYS A 31 91.821 -8.186 10.078 1.00 0.00 N ATOM 479 CA LYS A 31 91.997 -6.721 10.259 1.00 0.00 C ATOM 480 C LYS A 31 93.456 -6.336 10.002 1.00 0.00 C ATOM 481 O LYS A 31 93.744 -5.263 9.522 1.00 0.00 O ATOM 482 CB LYS A 31 91.589 -6.362 11.692 1.00 0.00 C ATOM 483 CG LYS A 31 90.058 -6.479 11.856 1.00 0.00 C ATOM 484 CD LYS A 31 89.379 -5.163 11.444 1.00 0.00 C ATOM 485 CE LYS A 31 87.855 -5.311 11.539 1.00 0.00 C ATOM 486 NZ LYS A 31 87.212 -3.972 11.395 1.00 0.00 N ATOM 0 H LYS A 31 91.431 -8.673 10.885 1.00 0.00 H new ATOM 0 HA LYS A 31 91.374 -6.173 9.552 1.00 0.00 H new ATOM 0 HB2 LYS A 31 92.089 -7.026 12.397 1.00 0.00 H new ATOM 0 HB3 LYS A 31 91.911 -5.347 11.926 1.00 0.00 H new ATOM 0 HG2 LYS A 31 89.681 -7.299 11.244 1.00 0.00 H new ATOM 0 HG3 LYS A 31 89.813 -6.715 12.891 1.00 0.00 H new ATOM 0 HD2 LYS A 31 89.716 -4.352 12.090 1.00 0.00 H new ATOM 0 HD3 LYS A 31 89.665 -4.899 10.426 1.00 0.00 H new ATOM 0 HE2 LYS A 31 87.496 -5.984 10.760 1.00 0.00 H new ATOM 0 HE3 LYS A 31 87.582 -5.756 12.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 86.207 -4.093 11.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 87.293 -3.450 12.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 87.687 -3.438 10.639 1.00 0.00 H new ATOM 500 N SER A 32 94.386 -7.190 10.276 1.00 0.00 N ATOM 501 CA SER A 32 95.792 -6.819 9.989 1.00 0.00 C ATOM 502 C SER A 32 95.912 -6.589 8.494 1.00 0.00 C ATOM 503 O SER A 32 96.580 -5.681 8.042 1.00 0.00 O ATOM 504 CB SER A 32 96.748 -7.917 10.408 1.00 0.00 C ATOM 505 OG SER A 32 96.365 -9.142 9.795 1.00 0.00 O ATOM 0 H SER A 32 94.242 -8.116 10.680 1.00 0.00 H new ATOM 0 HA SER A 32 96.052 -5.922 10.550 1.00 0.00 H new ATOM 0 HB2 SER A 32 97.766 -7.657 10.119 1.00 0.00 H new ATOM 0 HB3 SER A 32 96.742 -8.024 11.493 1.00 0.00 H new ATOM 0 HG SER A 32 96.985 -9.851 10.065 1.00 0.00 H new ATOM 511 N GLU A 33 95.242 -7.394 7.716 1.00 0.00 N ATOM 512 CA GLU A 33 95.293 -7.196 6.252 1.00 0.00 C ATOM 513 C GLU A 33 94.756 -5.815 5.969 1.00 0.00 C ATOM 514 O GLU A 33 95.057 -5.231 4.959 1.00 0.00 O ATOM 515 CB GLU A 33 94.463 -8.257 5.533 1.00 0.00 C ATOM 516 CG GLU A 33 95.137 -9.618 5.699 1.00 0.00 C ATOM 517 CD GLU A 33 96.426 -9.649 4.876 1.00 0.00 C ATOM 518 OE1 GLU A 33 96.484 -8.945 3.881 1.00 0.00 O ATOM 519 OE2 GLU A 33 97.332 -10.373 5.253 1.00 0.00 O ATOM 0 H GLU A 33 94.667 -8.174 8.034 1.00 0.00 H new ATOM 0 HA GLU A 33 96.316 -7.291 5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.453 -8.285 5.942 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.371 -8.010 4.475 1.00 0.00 H new ATOM 0 HG2 GLU A 33 95.359 -9.801 6.750 1.00 0.00 H new ATOM 0 HG3 GLU A 33 94.465 -10.412 5.373 1.00 0.00 H new ATOM 526 N LEU A 34 93.986 -5.253 6.857 1.00 0.00 N ATOM 527 CA LEU A 34 93.515 -3.872 6.568 1.00 0.00 C ATOM 528 C LEU A 34 94.762 -3.015 6.443 1.00 0.00 C ATOM 529 O LEU A 34 94.877 -2.202 5.555 1.00 0.00 O ATOM 530 CB LEU A 34 92.602 -3.333 7.693 1.00 0.00 C ATOM 531 CG LEU A 34 92.191 -1.859 7.450 1.00 0.00 C ATOM 532 CD1 LEU A 34 93.366 -0.877 7.741 1.00 0.00 C ATOM 533 CD2 LEU A 34 91.688 -1.685 6.007 1.00 0.00 C ATOM 0 H LEU A 34 93.673 -5.668 7.735 1.00 0.00 H new ATOM 0 HA LEU A 34 92.920 -3.855 5.655 1.00 0.00 H new ATOM 0 HB2 LEU A 34 91.708 -3.952 7.762 1.00 0.00 H new ATOM 0 HB3 LEU A 34 93.119 -3.412 8.649 1.00 0.00 H new ATOM 0 HG LEU A 34 91.385 -1.617 8.143 1.00 0.00 H new ATOM 0 HD11 LEU A 34 93.038 0.147 7.559 1.00 0.00 H new ATOM 0 HD12 LEU A 34 93.677 -0.979 8.781 1.00 0.00 H new ATOM 0 HD13 LEU A 34 94.206 -1.111 7.087 1.00 0.00 H new ATOM 0 HD21 LEU A 34 91.401 -0.646 5.844 1.00 0.00 H new ATOM 0 HD22 LEU A 34 92.481 -1.956 5.310 1.00 0.00 H new ATOM 0 HD23 LEU A 34 90.825 -2.330 5.842 1.00 0.00 H new ATOM 545 N LYS A 35 95.718 -3.209 7.311 1.00 0.00 N ATOM 546 CA LYS A 35 96.958 -2.397 7.198 1.00 0.00 C ATOM 547 C LYS A 35 97.699 -2.737 5.906 1.00 0.00 C ATOM 548 O LYS A 35 98.055 -1.864 5.139 1.00 0.00 O ATOM 549 CB LYS A 35 97.861 -2.693 8.394 1.00 0.00 C ATOM 550 CG LYS A 35 99.103 -1.808 8.345 1.00 0.00 C ATOM 551 CD LYS A 35 99.977 -2.121 9.556 1.00 0.00 C ATOM 552 CE LYS A 35 101.154 -1.153 9.592 1.00 0.00 C ATOM 553 NZ LYS A 35 102.096 -1.490 8.490 1.00 0.00 N ATOM 0 H LYS A 35 95.695 -3.881 8.078 1.00 0.00 H new ATOM 0 HA LYS A 35 96.692 -1.340 7.183 1.00 0.00 H new ATOM 0 HB2 LYS A 35 97.317 -2.518 9.322 1.00 0.00 H new ATOM 0 HB3 LYS A 35 98.153 -3.743 8.388 1.00 0.00 H new ATOM 0 HG2 LYS A 35 99.657 -1.986 7.423 1.00 0.00 H new ATOM 0 HG3 LYS A 35 98.817 -0.756 8.347 1.00 0.00 H new ATOM 0 HD2 LYS A 35 99.393 -2.035 10.472 1.00 0.00 H new ATOM 0 HD3 LYS A 35 100.338 -3.148 9.503 1.00 0.00 H new ATOM 0 HE2 LYS A 35 100.801 -0.127 9.484 1.00 0.00 H new ATOM 0 HE3 LYS A 35 101.663 -1.215 10.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 102.995 -0.989 8.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 102.269 -2.516 8.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 101.683 -1.202 7.580 1.00 0.00 H new ATOM 567 N GLU A 36 97.946 -3.992 5.665 1.00 0.00 N ATOM 568 CA GLU A 36 98.679 -4.378 4.424 1.00 0.00 C ATOM 569 C GLU A 36 97.799 -4.178 3.197 1.00 0.00 C ATOM 570 O GLU A 36 98.258 -3.735 2.165 1.00 0.00 O ATOM 571 CB GLU A 36 99.103 -5.850 4.516 1.00 0.00 C ATOM 572 CG GLU A 36 99.703 -6.311 3.180 1.00 0.00 C ATOM 573 CD GLU A 36 100.328 -7.696 3.354 1.00 0.00 C ATOM 574 OE1 GLU A 36 100.296 -8.205 4.463 1.00 0.00 O ATOM 575 OE2 GLU A 36 100.824 -8.227 2.374 1.00 0.00 O ATOM 0 H GLU A 36 97.674 -4.767 6.270 1.00 0.00 H new ATOM 0 HA GLU A 36 99.561 -3.745 4.328 1.00 0.00 H new ATOM 0 HB2 GLU A 36 99.834 -5.977 5.315 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.243 -6.469 4.770 1.00 0.00 H new ATOM 0 HG2 GLU A 36 98.929 -6.343 2.413 1.00 0.00 H new ATOM 0 HG3 GLU A 36 100.457 -5.600 2.843 1.00 0.00 H new ATOM 582 N LEU A 37 96.549 -4.504 3.292 1.00 0.00 N ATOM 583 CA LEU A 37 95.665 -4.338 2.121 1.00 0.00 C ATOM 584 C LEU A 37 95.479 -2.850 1.880 1.00 0.00 C ATOM 585 O LEU A 37 95.371 -2.406 0.755 1.00 0.00 O ATOM 586 CB LEU A 37 94.309 -5.022 2.392 1.00 0.00 C ATOM 587 CG LEU A 37 93.467 -5.137 1.088 1.00 0.00 C ATOM 588 CD1 LEU A 37 92.636 -6.429 1.110 1.00 0.00 C ATOM 589 CD2 LEU A 37 92.499 -3.953 0.969 1.00 0.00 C ATOM 0 H LEU A 37 96.102 -4.878 4.129 1.00 0.00 H new ATOM 0 HA LEU A 37 96.104 -4.801 1.237 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.476 -6.015 2.809 1.00 0.00 H new ATOM 0 HB3 LEU A 37 93.754 -4.453 3.138 1.00 0.00 H new ATOM 0 HG LEU A 37 94.155 -5.142 0.243 1.00 0.00 H new ATOM 0 HD11 LEU A 37 92.050 -6.501 0.194 1.00 0.00 H new ATOM 0 HD12 LEU A 37 93.302 -7.289 1.183 1.00 0.00 H new ATOM 0 HD13 LEU A 37 91.965 -6.416 1.969 1.00 0.00 H new ATOM 0 HD21 LEU A 37 91.918 -4.049 0.052 1.00 0.00 H new ATOM 0 HD22 LEU A 37 91.826 -3.946 1.826 1.00 0.00 H new ATOM 0 HD23 LEU A 37 93.065 -3.022 0.944 1.00 0.00 H new ATOM 601 N LEU A 38 95.437 -2.065 2.925 1.00 0.00 N ATOM 602 CA LEU A 38 95.249 -0.597 2.706 1.00 0.00 C ATOM 603 C LEU A 38 96.428 -0.020 1.916 1.00 0.00 C ATOM 604 O LEU A 38 96.245 0.678 0.945 1.00 0.00 O ATOM 605 CB LEU A 38 95.124 0.124 4.066 1.00 0.00 C ATOM 606 CG LEU A 38 94.974 1.660 3.913 1.00 0.00 C ATOM 607 CD1 LEU A 38 96.294 2.327 3.463 1.00 0.00 C ATOM 608 CD2 LEU A 38 93.853 1.981 2.913 1.00 0.00 C ATOM 0 H LEU A 38 95.522 -2.364 3.896 1.00 0.00 H new ATOM 0 HA LEU A 38 94.335 -0.442 2.132 1.00 0.00 H new ATOM 0 HB2 LEU A 38 94.262 -0.270 4.604 1.00 0.00 H new ATOM 0 HB3 LEU A 38 96.004 -0.093 4.671 1.00 0.00 H new ATOM 0 HG LEU A 38 94.718 2.066 4.892 1.00 0.00 H new ATOM 0 HD11 LEU A 38 96.144 3.403 3.368 1.00 0.00 H new ATOM 0 HD12 LEU A 38 97.071 2.132 4.203 1.00 0.00 H new ATOM 0 HD13 LEU A 38 96.599 1.917 2.500 1.00 0.00 H new ATOM 0 HD21 LEU A 38 93.754 3.062 2.812 1.00 0.00 H new ATOM 0 HD22 LEU A 38 94.095 1.546 1.943 1.00 0.00 H new ATOM 0 HD23 LEU A 38 92.913 1.563 3.274 1.00 0.00 H new ATOM 620 N THR A 39 97.640 -0.271 2.338 1.00 0.00 N ATOM 621 CA THR A 39 98.817 0.320 1.619 1.00 0.00 C ATOM 622 C THR A 39 99.124 -0.419 0.333 1.00 0.00 C ATOM 623 O THR A 39 99.612 0.152 -0.622 1.00 0.00 O ATOM 624 CB THR A 39 100.051 0.237 2.507 1.00 0.00 C ATOM 625 OG1 THR A 39 100.420 -1.126 2.680 1.00 0.00 O ATOM 626 CG2 THR A 39 99.726 0.849 3.849 1.00 0.00 C ATOM 0 H THR A 39 97.869 -0.855 3.143 1.00 0.00 H new ATOM 0 HA THR A 39 98.564 1.354 1.383 1.00 0.00 H new ATOM 0 HB THR A 39 100.879 0.775 2.046 1.00 0.00 H new ATOM 0 HG1 THR A 39 101.215 -1.180 3.250 1.00 0.00 H new ATOM 0 HG21 THR A 39 100.602 0.796 4.495 1.00 0.00 H new ATOM 0 HG22 THR A 39 99.438 1.891 3.713 1.00 0.00 H new ATOM 0 HG23 THR A 39 98.903 0.302 4.309 1.00 0.00 H new ATOM 634 N ARG A 40 98.887 -1.684 0.302 1.00 0.00 N ATOM 635 CA ARG A 40 99.217 -2.444 -0.916 1.00 0.00 C ATOM 636 C ARG A 40 98.304 -2.011 -2.051 1.00 0.00 C ATOM 637 O ARG A 40 98.692 -1.998 -3.201 1.00 0.00 O ATOM 638 CB ARG A 40 99.068 -3.941 -0.654 1.00 0.00 C ATOM 639 CG ARG A 40 100.244 -4.422 0.213 1.00 0.00 C ATOM 640 CD ARG A 40 101.567 -4.405 -0.594 1.00 0.00 C ATOM 641 NE ARG A 40 102.449 -3.321 -0.075 1.00 0.00 N ATOM 642 CZ ARG A 40 103.721 -3.306 -0.377 1.00 0.00 C ATOM 643 NH1 ARG A 40 104.216 -4.201 -1.190 1.00 0.00 N ATOM 644 NH2 ARG A 40 104.493 -2.383 0.128 1.00 0.00 N ATOM 0 H ARG A 40 98.480 -2.226 1.064 1.00 0.00 H new ATOM 0 HA ARG A 40 100.251 -2.243 -1.198 1.00 0.00 H new ATOM 0 HB2 ARG A 40 98.123 -4.142 -0.150 1.00 0.00 H new ATOM 0 HB3 ARG A 40 99.048 -4.487 -1.597 1.00 0.00 H new ATOM 0 HG2 ARG A 40 100.340 -3.782 1.090 1.00 0.00 H new ATOM 0 HG3 ARG A 40 100.046 -5.431 0.574 1.00 0.00 H new ATOM 0 HD2 ARG A 40 102.069 -5.369 -0.511 1.00 0.00 H new ATOM 0 HD3 ARG A 40 101.359 -4.244 -1.652 1.00 0.00 H new ATOM 0 HE ARG A 40 102.059 -2.588 0.518 1.00 0.00 H new ATOM 0 HH11 ARG A 40 103.609 -4.916 -1.592 1.00 0.00 H new ATOM 0 HH12 ARG A 40 105.209 -4.185 -1.423 1.00 0.00 H new ATOM 0 HH21 ARG A 40 104.103 -1.679 0.754 1.00 0.00 H new ATOM 0 HH22 ARG A 40 105.486 -2.366 -0.104 1.00 0.00 H new ATOM 658 N GLU A 41 97.090 -1.650 -1.736 1.00 0.00 N ATOM 659 CA GLU A 41 96.145 -1.212 -2.804 1.00 0.00 C ATOM 660 C GLU A 41 96.133 0.295 -2.853 1.00 0.00 C ATOM 661 O GLU A 41 95.781 0.891 -3.851 1.00 0.00 O ATOM 662 CB GLU A 41 94.744 -1.733 -2.487 1.00 0.00 C ATOM 663 CG GLU A 41 93.830 -1.518 -3.692 1.00 0.00 C ATOM 664 CD GLU A 41 92.538 -2.306 -3.490 1.00 0.00 C ATOM 665 OE1 GLU A 41 92.335 -2.812 -2.397 1.00 0.00 O ATOM 666 OE2 GLU A 41 91.774 -2.392 -4.432 1.00 0.00 O ATOM 0 H GLU A 41 96.712 -1.639 -0.789 1.00 0.00 H new ATOM 0 HA GLU A 41 96.461 -1.607 -3.769 1.00 0.00 H new ATOM 0 HB2 GLU A 41 94.788 -2.793 -2.236 1.00 0.00 H new ATOM 0 HB3 GLU A 41 94.342 -1.216 -1.616 1.00 0.00 H new ATOM 0 HG2 GLU A 41 93.608 -0.457 -3.811 1.00 0.00 H new ATOM 0 HG3 GLU A 41 94.329 -1.843 -4.605 1.00 0.00 H new ATOM 673 N LEU A 42 96.534 0.919 -1.786 1.00 0.00 N ATOM 674 CA LEU A 42 96.569 2.406 -1.760 1.00 0.00 C ATOM 675 C LEU A 42 97.804 2.848 -0.963 1.00 0.00 C ATOM 676 O LEU A 42 97.695 3.200 0.195 1.00 0.00 O ATOM 677 CB LEU A 42 95.304 2.935 -1.068 1.00 0.00 C ATOM 678 CG LEU A 42 94.075 2.818 -1.993 1.00 0.00 C ATOM 679 CD1 LEU A 42 92.801 2.787 -1.142 1.00 0.00 C ATOM 680 CD2 LEU A 42 94.011 4.019 -2.947 1.00 0.00 C ATOM 0 H LEU A 42 96.841 0.463 -0.927 1.00 0.00 H new ATOM 0 HA LEU A 42 96.614 2.798 -2.776 1.00 0.00 H new ATOM 0 HB2 LEU A 42 95.127 2.375 -0.150 1.00 0.00 H new ATOM 0 HB3 LEU A 42 95.450 3.977 -0.783 1.00 0.00 H new ATOM 0 HG LEU A 42 94.159 1.901 -2.577 1.00 0.00 H new ATOM 0 HD11 LEU A 42 91.931 2.704 -1.793 1.00 0.00 H new ATOM 0 HD12 LEU A 42 92.834 1.930 -0.469 1.00 0.00 H new ATOM 0 HD13 LEU A 42 92.731 3.705 -0.558 1.00 0.00 H new ATOM 0 HD21 LEU A 42 93.139 3.924 -3.594 1.00 0.00 H new ATOM 0 HD22 LEU A 42 93.935 4.940 -2.368 1.00 0.00 H new ATOM 0 HD23 LEU A 42 94.914 4.048 -3.557 1.00 0.00 H new ATOM 692 N PRO A 43 98.976 2.806 -1.553 1.00 0.00 N ATOM 693 CA PRO A 43 100.216 3.190 -0.826 1.00 0.00 C ATOM 694 C PRO A 43 100.390 4.718 -0.686 1.00 0.00 C ATOM 695 O PRO A 43 99.721 5.347 0.108 1.00 0.00 O ATOM 696 CB PRO A 43 101.299 2.536 -1.707 1.00 0.00 C ATOM 697 CG PRO A 43 100.689 2.295 -3.100 1.00 0.00 C ATOM 698 CD PRO A 43 99.156 2.382 -2.972 1.00 0.00 C ATOM 0 HA PRO A 43 100.236 2.861 0.213 1.00 0.00 H new ATOM 0 HB2 PRO A 43 102.174 3.182 -1.780 1.00 0.00 H new ATOM 0 HB3 PRO A 43 101.632 1.596 -1.268 1.00 0.00 H new ATOM 0 HG2 PRO A 43 101.055 3.037 -3.809 1.00 0.00 H new ATOM 0 HG3 PRO A 43 100.984 1.317 -3.481 1.00 0.00 H new ATOM 0 HD2 PRO A 43 98.731 3.104 -3.669 1.00 0.00 H new ATOM 0 HD3 PRO A 43 98.677 1.424 -3.174 1.00 0.00 H new ATOM 706 N SER A 44 101.287 5.318 -1.423 1.00 0.00 N ATOM 707 CA SER A 44 101.500 6.787 -1.292 1.00 0.00 C ATOM 708 C SER A 44 100.286 7.558 -1.805 1.00 0.00 C ATOM 709 O SER A 44 99.864 8.525 -1.212 1.00 0.00 O ATOM 710 CB SER A 44 102.719 7.189 -2.115 1.00 0.00 C ATOM 711 OG SER A 44 103.886 6.615 -1.543 1.00 0.00 O ATOM 0 H SER A 44 101.881 4.853 -2.110 1.00 0.00 H new ATOM 0 HA SER A 44 101.651 7.024 -0.239 1.00 0.00 H new ATOM 0 HB2 SER A 44 102.603 6.853 -3.145 1.00 0.00 H new ATOM 0 HB3 SER A 44 102.811 8.275 -2.143 1.00 0.00 H new ATOM 0 HG SER A 44 104.670 6.871 -2.072 1.00 0.00 H new ATOM 717 N PHE A 45 99.739 7.140 -2.911 1.00 0.00 N ATOM 718 CA PHE A 45 98.559 7.843 -3.507 1.00 0.00 C ATOM 719 C PHE A 45 97.507 8.166 -2.444 1.00 0.00 C ATOM 720 O PHE A 45 96.567 8.893 -2.694 1.00 0.00 O ATOM 721 CB PHE A 45 97.927 6.926 -4.540 1.00 0.00 C ATOM 722 CG PHE A 45 96.846 7.670 -5.288 1.00 0.00 C ATOM 723 CD1 PHE A 45 97.157 8.388 -6.450 1.00 0.00 C ATOM 724 CD2 PHE A 45 95.530 7.637 -4.816 1.00 0.00 C ATOM 725 CE1 PHE A 45 96.146 9.075 -7.139 1.00 0.00 C ATOM 726 CE2 PHE A 45 94.521 8.323 -5.503 1.00 0.00 C ATOM 727 CZ PHE A 45 94.829 9.041 -6.664 1.00 0.00 C ATOM 0 H PHE A 45 100.061 6.329 -3.439 1.00 0.00 H new ATOM 0 HA PHE A 45 98.901 8.777 -3.954 1.00 0.00 H new ATOM 0 HB2 PHE A 45 98.686 6.570 -5.237 1.00 0.00 H new ATOM 0 HB3 PHE A 45 97.506 6.047 -4.051 1.00 0.00 H new ATOM 0 HD1 PHE A 45 98.173 8.413 -6.815 1.00 0.00 H new ATOM 0 HD2 PHE A 45 95.292 7.082 -3.921 1.00 0.00 H new ATOM 0 HE1 PHE A 45 96.383 9.630 -8.035 1.00 0.00 H new ATOM 0 HE2 PHE A 45 93.505 8.298 -5.137 1.00 0.00 H new ATOM 0 HZ PHE A 45 94.050 9.569 -7.194 1.00 0.00 H new ATOM 737 N LEU A 46 97.659 7.633 -1.270 1.00 0.00 N ATOM 738 CA LEU A 46 96.678 7.886 -0.164 1.00 0.00 C ATOM 739 C LEU A 46 97.448 8.491 0.994 1.00 0.00 C ATOM 740 O LEU A 46 97.245 9.629 1.369 1.00 0.00 O ATOM 741 CB LEU A 46 96.048 6.545 0.237 1.00 0.00 C ATOM 742 CG LEU A 46 95.126 6.689 1.464 1.00 0.00 C ATOM 743 CD1 LEU A 46 93.835 7.422 1.077 1.00 0.00 C ATOM 744 CD2 LEU A 46 94.786 5.290 1.995 1.00 0.00 C ATOM 0 H LEU A 46 98.434 7.020 -1.017 1.00 0.00 H new ATOM 0 HA LEU A 46 95.883 8.567 -0.468 1.00 0.00 H new ATOM 0 HB2 LEU A 46 95.477 6.147 -0.602 1.00 0.00 H new ATOM 0 HB3 LEU A 46 96.836 5.825 0.457 1.00 0.00 H new ATOM 0 HG LEU A 46 95.636 7.267 2.234 1.00 0.00 H new ATOM 0 HD11 LEU A 46 93.194 7.516 1.953 1.00 0.00 H new ATOM 0 HD12 LEU A 46 94.080 8.414 0.698 1.00 0.00 H new ATOM 0 HD13 LEU A 46 93.313 6.857 0.305 1.00 0.00 H new ATOM 0 HD21 LEU A 46 94.134 5.379 2.864 1.00 0.00 H new ATOM 0 HD22 LEU A 46 94.279 4.719 1.217 1.00 0.00 H new ATOM 0 HD23 LEU A 46 95.704 4.777 2.282 1.00 0.00 H new ATOM 756 N GLY A 47 98.363 7.749 1.537 1.00 0.00 N ATOM 757 CA GLY A 47 99.189 8.283 2.641 1.00 0.00 C ATOM 758 C GLY A 47 100.257 9.169 2.019 1.00 0.00 C ATOM 759 O GLY A 47 101.349 9.306 2.535 1.00 0.00 O ATOM 0 H GLY A 47 98.574 6.790 1.261 1.00 0.00 H new ATOM 0 HA2 GLY A 47 98.576 8.853 3.339 1.00 0.00 H new ATOM 0 HA3 GLY A 47 99.645 7.471 3.207 1.00 0.00 H new ATOM 763 N LYS A 48 99.958 9.756 0.886 1.00 0.00 N ATOM 764 CA LYS A 48 100.969 10.610 0.211 1.00 0.00 C ATOM 765 C LYS A 48 101.574 11.588 1.225 1.00 0.00 C ATOM 766 O LYS A 48 102.770 11.608 1.443 1.00 0.00 O ATOM 767 CB LYS A 48 100.306 11.421 -0.918 1.00 0.00 C ATOM 768 CG LYS A 48 101.338 12.323 -1.617 1.00 0.00 C ATOM 769 CD LYS A 48 102.439 11.471 -2.265 1.00 0.00 C ATOM 770 CE LYS A 48 103.134 12.276 -3.363 1.00 0.00 C ATOM 771 NZ LYS A 48 104.220 11.456 -3.964 1.00 0.00 N ATOM 0 H LYS A 48 99.061 9.678 0.406 1.00 0.00 H new ATOM 0 HA LYS A 48 101.747 9.970 -0.205 1.00 0.00 H new ATOM 0 HB2 LYS A 48 99.857 10.743 -1.644 1.00 0.00 H new ATOM 0 HB3 LYS A 48 99.500 12.031 -0.510 1.00 0.00 H new ATOM 0 HG2 LYS A 48 100.845 12.931 -2.376 1.00 0.00 H new ATOM 0 HG3 LYS A 48 101.778 13.010 -0.895 1.00 0.00 H new ATOM 0 HD2 LYS A 48 103.164 11.163 -1.512 1.00 0.00 H new ATOM 0 HD3 LYS A 48 102.009 10.561 -2.684 1.00 0.00 H new ATOM 0 HE2 LYS A 48 102.414 12.564 -4.129 1.00 0.00 H new ATOM 0 HE3 LYS A 48 103.545 13.197 -2.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 104.694 12.002 -4.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 104.911 11.203 -3.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 103.815 10.589 -4.372 1.00 0.00 H new ATOM 785 N ARG A 49 100.758 12.406 1.836 1.00 0.00 N ATOM 786 CA ARG A 49 101.280 13.395 2.824 1.00 0.00 C ATOM 787 C ARG A 49 100.105 14.104 3.502 1.00 0.00 C ATOM 788 O ARG A 49 100.234 14.660 4.575 1.00 0.00 O ATOM 789 CB ARG A 49 102.135 14.435 2.089 1.00 0.00 C ATOM 790 CG ARG A 49 102.815 15.358 3.100 1.00 0.00 C ATOM 791 CD ARG A 49 103.668 16.386 2.352 1.00 0.00 C ATOM 792 NE ARG A 49 104.834 15.696 1.729 1.00 0.00 N ATOM 793 CZ ARG A 49 105.539 16.303 0.811 1.00 0.00 C ATOM 794 NH1 ARG A 49 105.279 17.543 0.498 1.00 0.00 N ATOM 795 NH2 ARG A 49 106.513 15.672 0.215 1.00 0.00 N ATOM 0 H ARG A 49 99.748 12.432 1.692 1.00 0.00 H new ATOM 0 HA ARG A 49 101.881 12.881 3.574 1.00 0.00 H new ATOM 0 HB2 ARG A 49 102.886 13.935 1.478 1.00 0.00 H new ATOM 0 HB3 ARG A 49 101.511 15.019 1.413 1.00 0.00 H new ATOM 0 HG2 ARG A 49 102.066 15.864 3.709 1.00 0.00 H new ATOM 0 HG3 ARG A 49 103.438 14.776 3.779 1.00 0.00 H new ATOM 0 HD2 ARG A 49 103.072 16.882 1.586 1.00 0.00 H new ATOM 0 HD3 ARG A 49 104.012 17.159 3.039 1.00 0.00 H new ATOM 0 HE ARG A 49 105.081 14.750 2.019 1.00 0.00 H new ATOM 0 HH11 ARG A 49 104.524 18.041 0.970 1.00 0.00 H new ATOM 0 HH12 ARG A 49 105.831 18.014 -0.219 1.00 0.00 H new ATOM 0 HH21 ARG A 49 106.724 14.706 0.466 1.00 0.00 H new ATOM 0 HH22 ARG A 49 107.064 16.145 -0.502 1.00 0.00 H new ATOM 809 N THR A 50 98.963 14.101 2.873 1.00 0.00 N ATOM 810 CA THR A 50 97.781 14.789 3.467 1.00 0.00 C ATOM 811 C THR A 50 97.192 13.964 4.613 1.00 0.00 C ATOM 812 O THR A 50 96.922 12.788 4.472 1.00 0.00 O ATOM 813 CB THR A 50 96.709 14.984 2.390 1.00 0.00 C ATOM 814 OG1 THR A 50 97.234 15.781 1.334 1.00 0.00 O ATOM 815 CG2 THR A 50 95.490 15.675 3.005 1.00 0.00 C ATOM 0 H THR A 50 98.796 13.652 1.973 1.00 0.00 H new ATOM 0 HA THR A 50 98.104 15.755 3.857 1.00 0.00 H new ATOM 0 HB THR A 50 96.411 14.014 1.992 1.00 0.00 H new ATOM 0 HG1 THR A 50 96.548 15.904 0.645 1.00 0.00 H new ATOM 0 HG21 THR A 50 94.726 15.814 2.240 1.00 0.00 H new ATOM 0 HG22 THR A 50 95.089 15.058 3.809 1.00 0.00 H new ATOM 0 HG23 THR A 50 95.785 16.645 3.404 1.00 0.00 H new ATOM 823 N ASP A 51 96.974 14.587 5.740 1.00 0.00 N ATOM 824 CA ASP A 51 96.374 13.869 6.904 1.00 0.00 C ATOM 825 C ASP A 51 97.096 12.535 7.146 1.00 0.00 C ATOM 826 O ASP A 51 96.491 11.487 7.144 1.00 0.00 O ATOM 827 CB ASP A 51 94.886 13.616 6.635 1.00 0.00 C ATOM 828 CG ASP A 51 94.186 13.228 7.938 1.00 0.00 C ATOM 829 OD1 ASP A 51 94.879 13.009 8.919 1.00 0.00 O ATOM 830 OD2 ASP A 51 92.967 13.151 7.933 1.00 0.00 O ATOM 0 H ASP A 51 97.187 15.570 5.906 1.00 0.00 H new ATOM 0 HA ASP A 51 96.484 14.487 7.795 1.00 0.00 H new ATOM 0 HB2 ASP A 51 94.425 14.510 6.216 1.00 0.00 H new ATOM 0 HB3 ASP A 51 94.770 12.822 5.898 1.00 0.00 H new ATOM 835 N GLU A 52 98.381 12.566 7.351 1.00 0.00 N ATOM 836 CA GLU A 52 99.135 11.296 7.595 1.00 0.00 C ATOM 837 C GLU A 52 98.596 10.611 8.853 1.00 0.00 C ATOM 838 O GLU A 52 98.526 9.401 8.931 1.00 0.00 O ATOM 839 CB GLU A 52 100.621 11.602 7.797 1.00 0.00 C ATOM 840 CG GLU A 52 101.233 12.065 6.473 1.00 0.00 C ATOM 841 CD GLU A 52 102.722 12.372 6.670 1.00 0.00 C ATOM 842 OE1 GLU A 52 103.165 12.358 7.808 1.00 0.00 O ATOM 843 OE2 GLU A 52 103.391 12.626 5.683 1.00 0.00 O ATOM 0 H GLU A 52 98.947 13.414 7.361 1.00 0.00 H new ATOM 0 HA GLU A 52 99.010 10.641 6.733 1.00 0.00 H new ATOM 0 HB2 GLU A 52 100.744 12.374 8.556 1.00 0.00 H new ATOM 0 HB3 GLU A 52 101.140 10.714 8.159 1.00 0.00 H new ATOM 0 HG2 GLU A 52 101.109 11.292 5.714 1.00 0.00 H new ATOM 0 HG3 GLU A 52 100.714 12.953 6.112 1.00 0.00 H new ATOM 850 N ALA A 53 98.237 11.377 9.844 1.00 0.00 N ATOM 851 CA ALA A 53 97.726 10.772 11.108 1.00 0.00 C ATOM 852 C ALA A 53 96.518 9.882 10.811 1.00 0.00 C ATOM 853 O ALA A 53 96.253 8.930 11.516 1.00 0.00 O ATOM 854 CB ALA A 53 97.306 11.886 12.068 1.00 0.00 C ATOM 0 H ALA A 53 98.275 12.396 9.835 1.00 0.00 H new ATOM 0 HA ALA A 53 98.514 10.169 11.560 1.00 0.00 H new ATOM 0 HB1 ALA A 53 96.932 11.447 12.993 1.00 0.00 H new ATOM 0 HB2 ALA A 53 98.165 12.520 12.288 1.00 0.00 H new ATOM 0 HB3 ALA A 53 96.521 12.486 11.608 1.00 0.00 H new ATOM 860 N ALA A 54 95.782 10.178 9.779 1.00 0.00 N ATOM 861 CA ALA A 54 94.591 9.345 9.455 1.00 0.00 C ATOM 862 C ALA A 54 95.020 7.904 9.197 1.00 0.00 C ATOM 863 O ALA A 54 94.381 6.972 9.640 1.00 0.00 O ATOM 864 CB ALA A 54 93.921 9.899 8.207 1.00 0.00 C ATOM 0 H ALA A 54 95.952 10.959 9.146 1.00 0.00 H new ATOM 0 HA ALA A 54 93.895 9.368 10.294 1.00 0.00 H new ATOM 0 HB1 ALA A 54 93.048 9.294 7.964 1.00 0.00 H new ATOM 0 HB2 ALA A 54 93.610 10.928 8.387 1.00 0.00 H new ATOM 0 HB3 ALA A 54 94.624 9.873 7.374 1.00 0.00 H new ATOM 870 N PHE A 55 96.101 7.710 8.502 1.00 0.00 N ATOM 871 CA PHE A 55 96.570 6.322 8.246 1.00 0.00 C ATOM 872 C PHE A 55 96.829 5.661 9.591 1.00 0.00 C ATOM 873 O PHE A 55 96.505 4.511 9.815 1.00 0.00 O ATOM 874 CB PHE A 55 97.881 6.373 7.472 1.00 0.00 C ATOM 875 CG PHE A 55 98.466 4.979 7.341 1.00 0.00 C ATOM 876 CD1 PHE A 55 97.762 3.987 6.648 1.00 0.00 C ATOM 877 CD2 PHE A 55 99.715 4.678 7.912 1.00 0.00 C ATOM 878 CE1 PHE A 55 98.299 2.697 6.526 1.00 0.00 C ATOM 879 CE2 PHE A 55 100.251 3.389 7.788 1.00 0.00 C ATOM 880 CZ PHE A 55 99.544 2.399 7.096 1.00 0.00 C ATOM 0 H PHE A 55 96.679 8.448 8.101 1.00 0.00 H new ATOM 0 HA PHE A 55 95.825 5.768 7.675 1.00 0.00 H new ATOM 0 HB2 PHE A 55 97.712 6.799 6.483 1.00 0.00 H new ATOM 0 HB3 PHE A 55 98.589 7.026 7.983 1.00 0.00 H new ATOM 0 HD1 PHE A 55 96.803 4.216 6.206 1.00 0.00 H new ATOM 0 HD2 PHE A 55 100.262 5.441 8.447 1.00 0.00 H new ATOM 0 HE1 PHE A 55 97.753 1.933 5.993 1.00 0.00 H new ATOM 0 HE2 PHE A 55 101.211 3.159 8.227 1.00 0.00 H new ATOM 0 HZ PHE A 55 99.958 1.406 7.001 1.00 0.00 H new ATOM 890 N GLN A 56 97.410 6.399 10.489 1.00 0.00 N ATOM 891 CA GLN A 56 97.699 5.847 11.839 1.00 0.00 C ATOM 892 C GLN A 56 96.384 5.595 12.553 1.00 0.00 C ATOM 893 O GLN A 56 96.260 4.690 13.350 1.00 0.00 O ATOM 894 CB GLN A 56 98.535 6.844 12.643 1.00 0.00 C ATOM 895 CG GLN A 56 99.946 6.923 12.059 1.00 0.00 C ATOM 896 CD GLN A 56 100.744 7.999 12.797 1.00 0.00 C ATOM 897 OE1 GLN A 56 100.180 8.931 13.335 1.00 0.00 O ATOM 898 NE2 GLN A 56 102.046 7.908 12.847 1.00 0.00 N ATOM 0 H GLN A 56 97.699 7.367 10.346 1.00 0.00 H new ATOM 0 HA GLN A 56 98.258 4.916 11.743 1.00 0.00 H new ATOM 0 HB2 GLN A 56 98.066 7.828 12.620 1.00 0.00 H new ATOM 0 HB3 GLN A 56 98.580 6.536 13.688 1.00 0.00 H new ATOM 0 HG2 GLN A 56 100.444 5.958 12.152 1.00 0.00 H new ATOM 0 HG3 GLN A 56 99.898 7.156 10.995 1.00 0.00 H new ATOM 0 HE21 GLN A 56 102.520 7.126 12.396 1.00 0.00 H new ATOM 0 HE22 GLN A 56 102.588 8.619 13.337 1.00 0.00 H new ATOM 907 N LYS A 57 95.395 6.379 12.258 1.00 0.00 N ATOM 908 CA LYS A 57 94.075 6.168 12.916 1.00 0.00 C ATOM 909 C LYS A 57 93.482 4.872 12.387 1.00 0.00 C ATOM 910 O LYS A 57 92.900 4.093 13.114 1.00 0.00 O ATOM 911 CB LYS A 57 93.108 7.333 12.646 1.00 0.00 C ATOM 912 CG LYS A 57 93.560 8.590 13.413 1.00 0.00 C ATOM 913 CD LYS A 57 92.397 9.587 13.542 1.00 0.00 C ATOM 914 CE LYS A 57 92.122 10.256 12.196 1.00 0.00 C ATOM 915 NZ LYS A 57 91.012 11.240 12.351 1.00 0.00 N ATOM 0 H LYS A 57 95.437 7.153 11.595 1.00 0.00 H new ATOM 0 HA LYS A 57 94.224 6.116 13.995 1.00 0.00 H new ATOM 0 HB2 LYS A 57 93.071 7.544 11.577 1.00 0.00 H new ATOM 0 HB3 LYS A 57 92.099 7.056 12.951 1.00 0.00 H new ATOM 0 HG2 LYS A 57 93.919 8.310 14.403 1.00 0.00 H new ATOM 0 HG3 LYS A 57 94.395 9.060 12.893 1.00 0.00 H new ATOM 0 HD2 LYS A 57 91.502 9.070 13.889 1.00 0.00 H new ATOM 0 HD3 LYS A 57 92.638 10.343 14.289 1.00 0.00 H new ATOM 0 HE2 LYS A 57 93.020 10.758 11.836 1.00 0.00 H new ATOM 0 HE3 LYS A 57 91.856 9.505 11.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 90.823 11.697 11.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 90.155 10.748 12.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 91.283 11.962 13.049 1.00 0.00 H new ATOM 929 N LEU A 58 93.658 4.621 11.125 1.00 0.00 N ATOM 930 CA LEU A 58 93.135 3.357 10.554 1.00 0.00 C ATOM 931 C LEU A 58 93.939 2.247 11.178 1.00 0.00 C ATOM 932 O LEU A 58 93.432 1.213 11.555 1.00 0.00 O ATOM 933 CB LEU A 58 93.352 3.337 9.046 1.00 0.00 C ATOM 934 CG LEU A 58 92.473 4.394 8.374 1.00 0.00 C ATOM 935 CD1 LEU A 58 92.855 4.489 6.896 1.00 0.00 C ATOM 936 CD2 LEU A 58 90.984 4.017 8.499 1.00 0.00 C ATOM 0 H LEU A 58 94.139 5.234 10.467 1.00 0.00 H new ATOM 0 HA LEU A 58 92.068 3.251 10.751 1.00 0.00 H new ATOM 0 HB2 LEU A 58 94.401 3.528 8.819 1.00 0.00 H new ATOM 0 HB3 LEU A 58 93.114 2.350 8.650 1.00 0.00 H new ATOM 0 HG LEU A 58 92.629 5.355 8.865 1.00 0.00 H new ATOM 0 HD11 LEU A 58 92.234 5.240 6.407 1.00 0.00 H new ATOM 0 HD12 LEU A 58 93.904 4.773 6.809 1.00 0.00 H new ATOM 0 HD13 LEU A 58 92.700 3.522 6.417 1.00 0.00 H new ATOM 0 HD21 LEU A 58 90.374 4.780 8.016 1.00 0.00 H new ATOM 0 HD22 LEU A 58 90.811 3.055 8.017 1.00 0.00 H new ATOM 0 HD23 LEU A 58 90.713 3.949 9.553 1.00 0.00 H new ATOM 948 N MET A 59 95.201 2.485 11.313 1.00 0.00 N ATOM 949 CA MET A 59 96.076 1.480 11.946 1.00 0.00 C ATOM 950 C MET A 59 95.721 1.405 13.415 1.00 0.00 C ATOM 951 O MET A 59 95.696 0.347 14.012 1.00 0.00 O ATOM 952 CB MET A 59 97.541 1.888 11.799 1.00 0.00 C ATOM 953 CG MET A 59 98.438 0.750 12.289 1.00 0.00 C ATOM 954 SD MET A 59 100.177 1.228 12.123 1.00 0.00 S ATOM 955 CE MET A 59 100.874 -0.129 13.097 1.00 0.00 C ATOM 0 H MET A 59 95.669 3.339 11.010 1.00 0.00 H new ATOM 0 HA MET A 59 95.935 0.512 11.466 1.00 0.00 H new ATOM 0 HB2 MET A 59 97.763 2.118 10.757 1.00 0.00 H new ATOM 0 HB3 MET A 59 97.737 2.793 12.374 1.00 0.00 H new ATOM 0 HG2 MET A 59 98.212 0.519 13.330 1.00 0.00 H new ATOM 0 HG3 MET A 59 98.243 -0.154 11.712 1.00 0.00 H new ATOM 0 HE1 MET A 59 101.959 -0.033 13.130 1.00 0.00 H new ATOM 0 HE2 MET A 59 100.476 -0.091 14.111 1.00 0.00 H new ATOM 0 HE3 MET A 59 100.607 -1.081 12.638 1.00 0.00 H new ATOM 965 N SER A 60 95.441 2.528 14.003 1.00 0.00 N ATOM 966 CA SER A 60 95.078 2.520 15.442 1.00 0.00 C ATOM 967 C SER A 60 93.711 1.868 15.590 1.00 0.00 C ATOM 968 O SER A 60 93.362 1.358 16.636 1.00 0.00 O ATOM 969 CB SER A 60 95.046 3.946 15.986 1.00 0.00 C ATOM 970 OG SER A 60 95.035 3.910 17.408 1.00 0.00 O ATOM 0 H SER A 60 95.447 3.444 13.555 1.00 0.00 H new ATOM 0 HA SER A 60 95.820 1.958 16.009 1.00 0.00 H new ATOM 0 HB2 SER A 60 95.915 4.501 15.632 1.00 0.00 H new ATOM 0 HB3 SER A 60 94.163 4.468 15.618 1.00 0.00 H new ATOM 0 HG SER A 60 95.016 4.825 17.758 1.00 0.00 H new ATOM 976 N ASN A 61 92.934 1.863 14.541 1.00 0.00 N ATOM 977 CA ASN A 61 91.590 1.218 14.636 1.00 0.00 C ATOM 978 C ASN A 61 91.800 -0.275 14.805 1.00 0.00 C ATOM 979 O ASN A 61 91.117 -0.928 15.564 1.00 0.00 O ATOM 980 CB ASN A 61 90.746 1.501 13.390 1.00 0.00 C ATOM 981 CG ASN A 61 90.326 2.971 13.384 1.00 0.00 C ATOM 982 OD1 ASN A 61 90.251 3.588 12.340 1.00 0.00 O ATOM 983 ND2 ASN A 61 90.046 3.562 14.516 1.00 0.00 N ATOM 0 H ASN A 61 93.165 2.270 13.635 1.00 0.00 H new ATOM 0 HA ASN A 61 91.048 1.627 15.489 1.00 0.00 H new ATOM 0 HB2 ASN A 61 91.317 1.271 12.491 1.00 0.00 H new ATOM 0 HB3 ASN A 61 89.865 0.860 13.381 1.00 0.00 H new ATOM 0 HD21 ASN A 61 89.764 4.542 14.523 1.00 0.00 H new ATOM 0 HD22 ASN A 61 90.109 3.043 15.392 1.00 0.00 H new ATOM 990 N LEU A 62 92.767 -0.813 14.123 1.00 0.00 N ATOM 991 CA LEU A 62 93.054 -2.261 14.277 1.00 0.00 C ATOM 992 C LEU A 62 93.403 -2.465 15.750 1.00 0.00 C ATOM 993 O LEU A 62 93.129 -3.488 16.348 1.00 0.00 O ATOM 994 CB LEU A 62 94.237 -2.667 13.385 1.00 0.00 C ATOM 995 CG LEU A 62 94.152 -1.949 12.034 1.00 0.00 C ATOM 996 CD1 LEU A 62 95.318 -2.384 11.157 1.00 0.00 C ATOM 997 CD2 LEU A 62 92.840 -2.287 11.325 1.00 0.00 C ATOM 0 H LEU A 62 93.369 -0.315 13.468 1.00 0.00 H new ATOM 0 HA LEU A 62 92.202 -2.873 13.981 1.00 0.00 H new ATOM 0 HB2 LEU A 62 95.176 -2.418 13.879 1.00 0.00 H new ATOM 0 HB3 LEU A 62 94.233 -3.746 13.232 1.00 0.00 H new ATOM 0 HG LEU A 62 94.192 -0.874 12.208 1.00 0.00 H new ATOM 0 HD11 LEU A 62 95.260 -1.875 10.195 1.00 0.00 H new ATOM 0 HD12 LEU A 62 96.257 -2.128 11.647 1.00 0.00 H new ATOM 0 HD13 LEU A 62 95.273 -3.462 11.000 1.00 0.00 H new ATOM 0 HD21 LEU A 62 92.799 -1.767 10.368 1.00 0.00 H new ATOM 0 HD22 LEU A 62 92.784 -3.362 11.157 1.00 0.00 H new ATOM 0 HD23 LEU A 62 92.000 -1.973 11.945 1.00 0.00 H new ATOM 1009 N ASP A 63 93.989 -1.453 16.337 1.00 0.00 N ATOM 1010 CA ASP A 63 94.351 -1.499 17.778 1.00 0.00 C ATOM 1011 C ASP A 63 93.209 -0.864 18.567 1.00 0.00 C ATOM 1012 O ASP A 63 93.374 -0.445 19.696 1.00 0.00 O ATOM 1013 CB ASP A 63 95.628 -0.690 18.008 1.00 0.00 C ATOM 1014 CG ASP A 63 96.817 -1.409 17.368 1.00 0.00 C ATOM 1015 OD1 ASP A 63 96.694 -2.590 17.096 1.00 0.00 O ATOM 1016 OD2 ASP A 63 97.833 -0.763 17.161 1.00 0.00 O ATOM 0 H ASP A 63 94.235 -0.582 15.866 1.00 0.00 H new ATOM 0 HA ASP A 63 94.516 -2.528 18.097 1.00 0.00 H new ATOM 0 HB2 ASP A 63 95.520 0.307 17.580 1.00 0.00 H new ATOM 0 HB3 ASP A 63 95.801 -0.561 19.076 1.00 0.00 H new ATOM 1021 N SER A 64 92.051 -0.764 17.965 1.00 0.00 N ATOM 1022 CA SER A 64 90.896 -0.125 18.659 1.00 0.00 C ATOM 1023 C SER A 64 90.629 -0.832 19.989 1.00 0.00 C ATOM 1024 O SER A 64 91.033 -0.367 21.036 1.00 0.00 O ATOM 1025 CB SER A 64 89.645 -0.234 17.782 1.00 0.00 C ATOM 1026 OG SER A 64 88.494 -0.003 18.581 1.00 0.00 O ATOM 0 H SER A 64 91.857 -1.098 17.021 1.00 0.00 H new ATOM 0 HA SER A 64 91.132 0.923 18.843 1.00 0.00 H new ATOM 0 HB2 SER A 64 89.691 0.492 16.970 1.00 0.00 H new ATOM 0 HB3 SER A 64 89.592 -1.222 17.324 1.00 0.00 H new ATOM 0 HG SER A 64 87.690 -0.070 18.024 1.00 0.00 H new ATOM 1032 N ASN A 65 89.947 -1.948 19.959 1.00 0.00 N ATOM 1033 CA ASN A 65 89.644 -2.685 21.226 1.00 0.00 C ATOM 1034 C ASN A 65 89.811 -4.184 20.985 1.00 0.00 C ATOM 1035 O ASN A 65 90.790 -4.778 21.388 1.00 0.00 O ATOM 1036 CB ASN A 65 88.201 -2.385 21.640 1.00 0.00 C ATOM 1037 CG ASN A 65 87.950 -2.895 23.060 1.00 0.00 C ATOM 1038 OD1 ASN A 65 88.682 -3.727 23.560 1.00 0.00 O ATOM 1039 ND2 ASN A 65 86.939 -2.421 23.738 1.00 0.00 N ATOM 0 H ASN A 65 89.585 -2.383 19.110 1.00 0.00 H new ATOM 0 HA ASN A 65 90.324 -2.369 22.017 1.00 0.00 H new ATOM 0 HB2 ASN A 65 88.015 -1.312 21.591 1.00 0.00 H new ATOM 0 HB3 ASN A 65 87.508 -2.860 20.946 1.00 0.00 H new ATOM 0 HD21 ASN A 65 86.763 -2.749 24.688 1.00 0.00 H new ATOM 0 HD22 ASN A 65 86.325 -1.723 23.318 1.00 0.00 H new ATOM 1046 N ARG A 66 88.863 -4.795 20.316 1.00 0.00 N ATOM 1047 CA ARG A 66 88.949 -6.256 20.021 1.00 0.00 C ATOM 1048 C ARG A 66 88.797 -6.454 18.511 1.00 0.00 C ATOM 1049 O ARG A 66 87.741 -6.796 18.018 1.00 0.00 O ATOM 1050 CB ARG A 66 87.828 -6.989 20.769 1.00 0.00 C ATOM 1051 CG ARG A 66 88.020 -8.498 20.625 1.00 0.00 C ATOM 1052 CD ARG A 66 86.907 -9.235 21.374 1.00 0.00 C ATOM 1053 NE ARG A 66 87.186 -10.700 21.351 1.00 0.00 N ATOM 1054 CZ ARG A 66 86.528 -11.505 22.140 1.00 0.00 C ATOM 1055 NH1 ARG A 66 85.588 -11.035 22.914 1.00 0.00 N ATOM 1056 NH2 ARG A 66 86.802 -12.781 22.150 1.00 0.00 N ATOM 0 H ARG A 66 88.025 -4.336 19.959 1.00 0.00 H new ATOM 0 HA ARG A 66 89.909 -6.657 20.347 1.00 0.00 H new ATOM 0 HB2 ARG A 66 87.836 -6.710 21.823 1.00 0.00 H new ATOM 0 HB3 ARG A 66 86.857 -6.696 20.369 1.00 0.00 H new ATOM 0 HG2 ARG A 66 88.008 -8.777 19.571 1.00 0.00 H new ATOM 0 HG3 ARG A 66 88.993 -8.790 21.021 1.00 0.00 H new ATOM 0 HD2 ARG A 66 86.848 -8.880 22.403 1.00 0.00 H new ATOM 0 HD3 ARG A 66 85.942 -9.029 20.910 1.00 0.00 H new ATOM 0 HE ARG A 66 87.893 -11.074 20.717 1.00 0.00 H new ATOM 0 HH11 ARG A 66 85.368 -10.039 22.902 1.00 0.00 H new ATOM 0 HH12 ARG A 66 85.073 -11.664 23.531 1.00 0.00 H new ATOM 0 HH21 ARG A 66 87.532 -13.151 21.541 1.00 0.00 H new ATOM 0 HH22 ARG A 66 86.287 -13.408 22.767 1.00 0.00 H new ATOM 1070 N ASP A 67 89.856 -6.230 17.774 1.00 0.00 N ATOM 1071 CA ASP A 67 89.807 -6.389 16.288 1.00 0.00 C ATOM 1072 C ASP A 67 90.338 -7.773 15.923 1.00 0.00 C ATOM 1073 O ASP A 67 91.304 -8.239 16.490 1.00 0.00 O ATOM 1074 CB ASP A 67 90.681 -5.307 15.652 1.00 0.00 C ATOM 1075 CG ASP A 67 90.073 -3.939 15.949 1.00 0.00 C ATOM 1076 OD1 ASP A 67 88.884 -3.776 15.727 1.00 0.00 O ATOM 1077 OD2 ASP A 67 90.805 -3.079 16.402 1.00 0.00 O ATOM 0 H ASP A 67 90.762 -5.941 18.143 1.00 0.00 H new ATOM 0 HA ASP A 67 88.784 -6.289 15.924 1.00 0.00 H new ATOM 0 HB2 ASP A 67 91.695 -5.362 16.047 1.00 0.00 H new ATOM 0 HB3 ASP A 67 90.749 -5.463 14.575 1.00 0.00 H new ATOM 1082 N ASN A 68 89.712 -8.453 14.996 1.00 0.00 N ATOM 1083 CA ASN A 68 90.202 -9.815 14.646 1.00 0.00 C ATOM 1084 C ASN A 68 89.798 -10.204 13.221 1.00 0.00 C ATOM 1085 O ASN A 68 90.603 -10.723 12.473 1.00 0.00 O ATOM 1086 CB ASN A 68 89.611 -10.820 15.634 1.00 0.00 C ATOM 1087 CG ASN A 68 88.083 -10.803 15.539 1.00 0.00 C ATOM 1088 OD1 ASN A 68 87.499 -9.845 15.069 1.00 0.00 O ATOM 1089 ND2 ASN A 68 87.408 -11.837 15.968 1.00 0.00 N ATOM 0 H ASN A 68 88.897 -8.129 14.476 1.00 0.00 H new ATOM 0 HA ASN A 68 91.291 -9.818 14.700 1.00 0.00 H new ATOM 0 HB2 ASN A 68 89.987 -11.820 15.418 1.00 0.00 H new ATOM 0 HB3 ASN A 68 89.924 -10.574 16.649 1.00 0.00 H new ATOM 0 HD21 ASN A 68 86.390 -11.842 15.909 1.00 0.00 H new ATOM 0 HD22 ASN A 68 87.900 -12.639 16.362 1.00 0.00 H new ATOM 1096 N GLU A 69 88.555 -9.993 12.846 1.00 0.00 N ATOM 1097 CA GLU A 69 88.101 -10.390 11.470 1.00 0.00 C ATOM 1098 C GLU A 69 87.490 -9.199 10.724 1.00 0.00 C ATOM 1099 O GLU A 69 87.034 -8.230 11.300 1.00 0.00 O ATOM 1100 CB GLU A 69 87.061 -11.520 11.579 1.00 0.00 C ATOM 1101 CG GLU A 69 87.064 -12.352 10.292 1.00 0.00 C ATOM 1102 CD GLU A 69 88.353 -13.177 10.238 1.00 0.00 C ATOM 1103 OE1 GLU A 69 88.768 -13.662 11.279 1.00 0.00 O ATOM 1104 OE2 GLU A 69 88.909 -13.301 9.160 1.00 0.00 O ATOM 0 H GLU A 69 87.838 -9.565 13.431 1.00 0.00 H new ATOM 0 HA GLU A 69 88.969 -10.736 10.908 1.00 0.00 H new ATOM 0 HB2 GLU A 69 87.289 -12.156 12.435 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.070 -11.100 11.749 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.195 -13.009 10.266 1.00 0.00 H new ATOM 0 HG3 GLU A 69 86.997 -11.700 9.421 1.00 0.00 H new ATOM 1111 N VAL A 70 87.499 -9.298 9.429 1.00 0.00 N ATOM 1112 CA VAL A 70 86.959 -8.237 8.531 1.00 0.00 C ATOM 1113 C VAL A 70 85.826 -8.849 7.735 1.00 0.00 C ATOM 1114 O VAL A 70 86.033 -9.694 6.888 1.00 0.00 O ATOM 1115 CB VAL A 70 88.083 -7.862 7.573 1.00 0.00 C ATOM 1116 CG1 VAL A 70 87.708 -6.673 6.700 1.00 0.00 C ATOM 1117 CG2 VAL A 70 89.351 -7.521 8.354 1.00 0.00 C ATOM 0 H VAL A 70 87.875 -10.106 8.932 1.00 0.00 H new ATOM 0 HA VAL A 70 86.607 -7.366 9.084 1.00 0.00 H new ATOM 0 HB VAL A 70 88.258 -8.724 6.929 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.536 -6.437 6.031 1.00 0.00 H new ATOM 0 HG12 VAL A 70 86.824 -6.918 6.111 1.00 0.00 H new ATOM 0 HG13 VAL A 70 87.495 -5.811 7.332 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.146 -7.255 7.658 1.00 0.00 H new ATOM 0 HG22 VAL A 70 89.154 -6.680 9.019 1.00 0.00 H new ATOM 0 HG23 VAL A 70 89.659 -8.385 8.943 1.00 0.00 H new ATOM 1127 N ASP A 71 84.636 -8.420 7.979 1.00 0.00 N ATOM 1128 CA ASP A 71 83.497 -8.964 7.208 1.00 0.00 C ATOM 1129 C ASP A 71 83.401 -8.136 5.940 1.00 0.00 C ATOM 1130 O ASP A 71 84.031 -7.103 5.829 1.00 0.00 O ATOM 1131 CB ASP A 71 82.208 -8.824 8.021 1.00 0.00 C ATOM 1132 CG ASP A 71 81.110 -9.679 7.390 1.00 0.00 C ATOM 1133 OD1 ASP A 71 81.271 -10.068 6.245 1.00 0.00 O ATOM 1134 OD2 ASP A 71 80.126 -9.930 8.062 1.00 0.00 O ATOM 0 H ASP A 71 84.397 -7.716 8.678 1.00 0.00 H new ATOM 0 HA ASP A 71 83.639 -10.020 6.980 1.00 0.00 H new ATOM 0 HB2 ASP A 71 82.380 -9.137 9.051 1.00 0.00 H new ATOM 0 HB3 ASP A 71 81.897 -7.780 8.052 1.00 0.00 H new ATOM 1139 N PHE A 72 82.624 -8.540 4.983 1.00 0.00 N ATOM 1140 CA PHE A 72 82.520 -7.718 3.762 1.00 0.00 C ATOM 1141 C PHE A 72 82.136 -6.309 4.195 1.00 0.00 C ATOM 1142 O PHE A 72 82.609 -5.324 3.663 1.00 0.00 O ATOM 1143 CB PHE A 72 81.431 -8.277 2.852 1.00 0.00 C ATOM 1144 CG PHE A 72 81.508 -7.571 1.527 1.00 0.00 C ATOM 1145 CD1 PHE A 72 80.886 -6.331 1.366 1.00 0.00 C ATOM 1146 CD2 PHE A 72 82.213 -8.146 0.468 1.00 0.00 C ATOM 1147 CE1 PHE A 72 80.966 -5.663 0.144 1.00 0.00 C ATOM 1148 CE2 PHE A 72 82.295 -7.479 -0.755 1.00 0.00 C ATOM 1149 CZ PHE A 72 81.671 -6.235 -0.920 1.00 0.00 C ATOM 0 H PHE A 72 82.064 -9.393 4.994 1.00 0.00 H new ATOM 0 HA PHE A 72 83.465 -7.720 3.219 1.00 0.00 H new ATOM 0 HB2 PHE A 72 81.564 -9.350 2.718 1.00 0.00 H new ATOM 0 HB3 PHE A 72 80.449 -8.131 3.302 1.00 0.00 H new ATOM 0 HD1 PHE A 72 80.343 -5.889 2.188 1.00 0.00 H new ATOM 0 HD2 PHE A 72 82.694 -9.105 0.595 1.00 0.00 H new ATOM 0 HE1 PHE A 72 80.484 -4.705 0.020 1.00 0.00 H new ATOM 0 HE2 PHE A 72 82.840 -7.922 -1.575 1.00 0.00 H new ATOM 0 HZ PHE A 72 81.734 -5.719 -1.867 1.00 0.00 H new ATOM 1159 N GLN A 73 81.272 -6.222 5.167 1.00 0.00 N ATOM 1160 CA GLN A 73 80.830 -4.900 5.665 1.00 0.00 C ATOM 1161 C GLN A 73 81.965 -4.191 6.414 1.00 0.00 C ATOM 1162 O GLN A 73 82.122 -2.995 6.289 1.00 0.00 O ATOM 1163 CB GLN A 73 79.630 -5.080 6.606 1.00 0.00 C ATOM 1164 CG GLN A 73 79.122 -3.709 7.066 1.00 0.00 C ATOM 1165 CD GLN A 73 77.925 -3.887 8.002 1.00 0.00 C ATOM 1166 OE1 GLN A 73 76.792 -3.920 7.563 1.00 0.00 O ATOM 1167 NE2 GLN A 73 78.135 -4.017 9.286 1.00 0.00 N ATOM 0 H GLN A 73 80.851 -7.022 5.640 1.00 0.00 H new ATOM 0 HA GLN A 73 80.543 -4.288 4.810 1.00 0.00 H new ATOM 0 HB2 GLN A 73 78.833 -5.621 6.095 1.00 0.00 H new ATOM 0 HB3 GLN A 73 79.919 -5.679 7.469 1.00 0.00 H new ATOM 0 HG2 GLN A 73 79.918 -3.169 7.578 1.00 0.00 H new ATOM 0 HG3 GLN A 73 78.834 -3.109 6.203 1.00 0.00 H new ATOM 0 HE21 GLN A 73 79.086 -3.989 9.653 1.00 0.00 H new ATOM 0 HE22 GLN A 73 77.347 -4.146 9.921 1.00 0.00 H new ATOM 1176 N GLU A 74 82.756 -4.881 7.210 1.00 0.00 N ATOM 1177 CA GLU A 74 83.819 -4.157 7.942 1.00 0.00 C ATOM 1178 C GLU A 74 84.823 -3.596 6.955 1.00 0.00 C ATOM 1179 O GLU A 74 85.278 -2.480 7.103 1.00 0.00 O ATOM 1180 CB GLU A 74 84.521 -5.113 8.908 1.00 0.00 C ATOM 1181 CG GLU A 74 83.570 -5.504 10.045 1.00 0.00 C ATOM 1182 CD GLU A 74 83.329 -4.301 10.961 1.00 0.00 C ATOM 1183 OE1 GLU A 74 84.220 -3.475 11.067 1.00 0.00 O ATOM 1184 OE2 GLU A 74 82.260 -4.229 11.545 1.00 0.00 O ATOM 0 H GLU A 74 82.705 -5.887 7.374 1.00 0.00 H new ATOM 0 HA GLU A 74 83.375 -3.338 8.508 1.00 0.00 H new ATOM 0 HB2 GLU A 74 84.849 -6.005 8.375 1.00 0.00 H new ATOM 0 HB3 GLU A 74 85.414 -4.639 9.317 1.00 0.00 H new ATOM 0 HG2 GLU A 74 82.623 -5.855 9.634 1.00 0.00 H new ATOM 0 HG3 GLU A 74 83.994 -6.329 10.618 1.00 0.00 H new ATOM 1191 N TYR A 75 85.176 -4.329 5.940 1.00 0.00 N ATOM 1192 CA TYR A 75 86.147 -3.758 4.981 1.00 0.00 C ATOM 1193 C TYR A 75 85.533 -2.501 4.358 1.00 0.00 C ATOM 1194 O TYR A 75 86.190 -1.500 4.159 1.00 0.00 O ATOM 1195 CB TYR A 75 86.493 -4.760 3.875 1.00 0.00 C ATOM 1196 CG TYR A 75 87.405 -4.078 2.877 1.00 0.00 C ATOM 1197 CD1 TYR A 75 88.648 -3.581 3.291 1.00 0.00 C ATOM 1198 CD2 TYR A 75 86.997 -3.910 1.547 1.00 0.00 C ATOM 1199 CE1 TYR A 75 89.479 -2.921 2.382 1.00 0.00 C ATOM 1200 CE2 TYR A 75 87.834 -3.252 0.635 1.00 0.00 C ATOM 1201 CZ TYR A 75 89.074 -2.757 1.055 1.00 0.00 C ATOM 1202 OH TYR A 75 89.897 -2.104 0.157 1.00 0.00 O ATOM 0 H TYR A 75 84.844 -5.272 5.738 1.00 0.00 H new ATOM 0 HA TYR A 75 87.067 -3.515 5.513 1.00 0.00 H new ATOM 0 HB2 TYR A 75 86.983 -5.637 4.298 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.585 -5.109 3.382 1.00 0.00 H new ATOM 0 HD1 TYR A 75 88.965 -3.708 4.316 1.00 0.00 H new ATOM 0 HD2 TYR A 75 86.038 -4.287 1.225 1.00 0.00 H new ATOM 0 HE1 TYR A 75 90.435 -2.537 2.706 1.00 0.00 H new ATOM 0 HE2 TYR A 75 87.522 -3.127 -0.391 1.00 0.00 H new ATOM 0 HH TYR A 75 89.465 -2.077 -0.722 1.00 0.00 H new ATOM 1212 N CYS A 76 84.263 -2.562 4.057 1.00 0.00 N ATOM 1213 CA CYS A 76 83.556 -1.405 3.450 1.00 0.00 C ATOM 1214 C CYS A 76 83.464 -0.286 4.481 1.00 0.00 C ATOM 1215 O CYS A 76 83.634 0.873 4.164 1.00 0.00 O ATOM 1216 CB CYS A 76 82.153 -1.831 3.021 1.00 0.00 C ATOM 1217 SG CYS A 76 82.281 -3.260 1.916 1.00 0.00 S ATOM 0 H CYS A 76 83.678 -3.383 4.211 1.00 0.00 H new ATOM 0 HA CYS A 76 84.103 -1.053 2.575 1.00 0.00 H new ATOM 0 HB2 CYS A 76 81.553 -2.084 3.895 1.00 0.00 H new ATOM 0 HB3 CYS A 76 81.648 -1.008 2.515 1.00 0.00 H new ATOM 0 HG CYS A 76 82.254 -4.354 2.617 1.00 0.00 H new ATOM 1223 N VAL A 77 83.206 -0.614 5.722 1.00 0.00 N ATOM 1224 CA VAL A 77 83.136 0.462 6.740 1.00 0.00 C ATOM 1225 C VAL A 77 84.483 1.159 6.766 1.00 0.00 C ATOM 1226 O VAL A 77 84.572 2.370 6.806 1.00 0.00 O ATOM 1227 CB VAL A 77 82.822 -0.147 8.110 1.00 0.00 C ATOM 1228 CG1 VAL A 77 83.017 0.907 9.214 1.00 0.00 C ATOM 1229 CG2 VAL A 77 81.365 -0.637 8.108 1.00 0.00 C ATOM 0 H VAL A 77 83.045 -1.561 6.064 1.00 0.00 H new ATOM 0 HA VAL A 77 82.350 1.177 6.498 1.00 0.00 H new ATOM 0 HB VAL A 77 83.495 -0.982 8.305 1.00 0.00 H new ATOM 0 HG11 VAL A 77 82.791 0.464 10.184 1.00 0.00 H new ATOM 0 HG12 VAL A 77 84.050 1.256 9.206 1.00 0.00 H new ATOM 0 HG13 VAL A 77 82.348 1.749 9.035 1.00 0.00 H new ATOM 0 HG21 VAL A 77 81.127 -1.074 9.078 1.00 0.00 H new ATOM 0 HG22 VAL A 77 80.699 0.204 7.915 1.00 0.00 H new ATOM 0 HG23 VAL A 77 81.235 -1.389 7.330 1.00 0.00 H new ATOM 1239 N PHE A 78 85.540 0.403 6.705 1.00 0.00 N ATOM 1240 CA PHE A 78 86.877 1.029 6.689 1.00 0.00 C ATOM 1241 C PHE A 78 87.053 1.766 5.356 1.00 0.00 C ATOM 1242 O PHE A 78 87.563 2.862 5.318 1.00 0.00 O ATOM 1243 CB PHE A 78 87.952 -0.061 6.849 1.00 0.00 C ATOM 1244 CG PHE A 78 88.228 -0.320 8.319 1.00 0.00 C ATOM 1245 CD1 PHE A 78 87.233 -0.876 9.136 1.00 0.00 C ATOM 1246 CD2 PHE A 78 89.483 -0.012 8.861 1.00 0.00 C ATOM 1247 CE1 PHE A 78 87.493 -1.122 10.490 1.00 0.00 C ATOM 1248 CE2 PHE A 78 89.741 -0.261 10.215 1.00 0.00 C ATOM 1249 CZ PHE A 78 88.746 -0.817 11.028 1.00 0.00 C ATOM 0 H PHE A 78 85.532 -0.616 6.666 1.00 0.00 H new ATOM 0 HA PHE A 78 86.978 1.738 7.511 1.00 0.00 H new ATOM 0 HB2 PHE A 78 87.621 -0.981 6.367 1.00 0.00 H new ATOM 0 HB3 PHE A 78 88.870 0.248 6.349 1.00 0.00 H new ATOM 0 HD1 PHE A 78 86.265 -1.115 8.721 1.00 0.00 H new ATOM 0 HD2 PHE A 78 90.251 0.417 8.235 1.00 0.00 H new ATOM 0 HE1 PHE A 78 86.725 -1.548 11.119 1.00 0.00 H new ATOM 0 HE2 PHE A 78 90.708 -0.024 10.632 1.00 0.00 H new ATOM 0 HZ PHE A 78 88.947 -1.010 12.071 1.00 0.00 H new ATOM 1259 N LEU A 79 86.619 1.191 4.256 1.00 0.00 N ATOM 1260 CA LEU A 79 86.778 1.909 2.952 1.00 0.00 C ATOM 1261 C LEU A 79 85.895 3.157 2.967 1.00 0.00 C ATOM 1262 O LEU A 79 86.279 4.211 2.500 1.00 0.00 O ATOM 1263 CB LEU A 79 86.358 0.994 1.796 1.00 0.00 C ATOM 1264 CG LEU A 79 86.595 1.692 0.443 1.00 0.00 C ATOM 1265 CD1 LEU A 79 88.108 1.884 0.196 1.00 0.00 C ATOM 1266 CD2 LEU A 79 85.977 0.835 -0.676 1.00 0.00 C ATOM 0 H LEU A 79 86.171 0.276 4.205 1.00 0.00 H new ATOM 0 HA LEU A 79 87.821 2.192 2.814 1.00 0.00 H new ATOM 0 HB2 LEU A 79 86.925 0.064 1.836 1.00 0.00 H new ATOM 0 HB3 LEU A 79 85.305 0.731 1.897 1.00 0.00 H new ATOM 0 HG LEU A 79 86.124 2.675 0.453 1.00 0.00 H new ATOM 0 HD11 LEU A 79 88.260 2.378 -0.764 1.00 0.00 H new ATOM 0 HD12 LEU A 79 88.532 2.497 0.991 1.00 0.00 H new ATOM 0 HD13 LEU A 79 88.601 0.912 0.186 1.00 0.00 H new ATOM 0 HD21 LEU A 79 86.139 1.321 -1.638 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.446 -0.149 -0.682 1.00 0.00 H new ATOM 0 HD23 LEU A 79 84.907 0.725 -0.501 1.00 0.00 H new ATOM 1278 N SER A 80 84.714 3.039 3.509 1.00 0.00 N ATOM 1279 CA SER A 80 83.798 4.211 3.573 1.00 0.00 C ATOM 1280 C SER A 80 84.442 5.262 4.462 1.00 0.00 C ATOM 1281 O SER A 80 84.455 6.438 4.154 1.00 0.00 O ATOM 1282 CB SER A 80 82.454 3.787 4.168 1.00 0.00 C ATOM 1283 OG SER A 80 81.853 2.810 3.328 1.00 0.00 O ATOM 0 H SER A 80 84.343 2.178 3.911 1.00 0.00 H new ATOM 0 HA SER A 80 83.626 4.611 2.574 1.00 0.00 H new ATOM 0 HB2 SER A 80 82.599 3.382 5.170 1.00 0.00 H new ATOM 0 HB3 SER A 80 81.798 4.652 4.266 1.00 0.00 H new ATOM 0 HG SER A 80 82.314 1.953 3.442 1.00 0.00 H new ATOM 1289 N CYS A 81 85.009 4.833 5.554 1.00 0.00 N ATOM 1290 CA CYS A 81 85.692 5.784 6.463 1.00 0.00 C ATOM 1291 C CYS A 81 86.840 6.405 5.694 1.00 0.00 C ATOM 1292 O CYS A 81 87.167 7.561 5.864 1.00 0.00 O ATOM 1293 CB CYS A 81 86.237 5.039 7.685 1.00 0.00 C ATOM 1294 SG CYS A 81 87.255 6.164 8.674 1.00 0.00 S ATOM 0 H CYS A 81 85.027 3.858 5.855 1.00 0.00 H new ATOM 0 HA CYS A 81 84.996 6.549 6.807 1.00 0.00 H new ATOM 0 HB2 CYS A 81 85.414 4.653 8.286 1.00 0.00 H new ATOM 0 HB3 CYS A 81 86.829 4.181 7.367 1.00 0.00 H new ATOM 0 HG CYS A 81 87.468 7.258 8.005 1.00 0.00 H new ATOM 1300 N ILE A 82 87.453 5.643 4.835 1.00 0.00 N ATOM 1301 CA ILE A 82 88.573 6.210 4.041 1.00 0.00 C ATOM 1302 C ILE A 82 88.014 7.214 3.032 1.00 0.00 C ATOM 1303 O ILE A 82 88.580 8.265 2.804 1.00 0.00 O ATOM 1304 CB ILE A 82 89.327 5.083 3.332 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.119 4.285 4.380 1.00 0.00 C ATOM 1306 CG2 ILE A 82 90.289 5.676 2.299 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.607 2.954 3.795 1.00 0.00 C ATOM 0 H ILE A 82 87.231 4.665 4.650 1.00 0.00 H new ATOM 0 HA ILE A 82 89.273 6.726 4.698 1.00 0.00 H new ATOM 0 HB ILE A 82 88.621 4.427 2.822 1.00 0.00 H new ATOM 0 HG12 ILE A 82 90.972 4.871 4.722 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.491 4.096 5.251 1.00 0.00 H new ATOM 0 HG21 ILE A 82 90.824 4.871 1.796 1.00 0.00 H new ATOM 0 HG22 ILE A 82 89.725 6.251 1.565 1.00 0.00 H new ATOM 0 HG23 ILE A 82 91.004 6.329 2.800 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.165 2.406 4.554 1.00 0.00 H new ATOM 0 HD12 ILE A 82 89.750 2.361 3.476 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.253 3.148 2.939 1.00 0.00 H new ATOM 1319 N ALA A 83 86.905 6.899 2.424 1.00 0.00 N ATOM 1320 CA ALA A 83 86.312 7.836 1.432 1.00 0.00 C ATOM 1321 C ALA A 83 85.920 9.149 2.115 1.00 0.00 C ATOM 1322 O ALA A 83 86.258 10.220 1.654 1.00 0.00 O ATOM 1323 CB ALA A 83 85.073 7.190 0.804 1.00 0.00 C ATOM 0 H ALA A 83 86.385 6.034 2.571 1.00 0.00 H new ATOM 0 HA ALA A 83 87.047 8.050 0.656 1.00 0.00 H new ATOM 0 HB1 ALA A 83 84.635 7.874 0.076 1.00 0.00 H new ATOM 0 HB2 ALA A 83 85.359 6.264 0.306 1.00 0.00 H new ATOM 0 HB3 ALA A 83 84.342 6.972 1.583 1.00 0.00 H new ATOM 1329 N MET A 84 85.223 9.082 3.218 1.00 0.00 N ATOM 1330 CA MET A 84 84.831 10.343 3.907 1.00 0.00 C ATOM 1331 C MET A 84 86.101 11.018 4.395 1.00 0.00 C ATOM 1332 O MET A 84 86.214 12.226 4.406 1.00 0.00 O ATOM 1333 CB MET A 84 83.911 10.048 5.094 1.00 0.00 C ATOM 1334 CG MET A 84 82.545 9.574 4.584 1.00 0.00 C ATOM 1335 SD MET A 84 81.454 9.235 5.993 1.00 0.00 S ATOM 1336 CE MET A 84 82.428 7.902 6.733 1.00 0.00 C ATOM 0 H MET A 84 84.912 8.220 3.666 1.00 0.00 H new ATOM 0 HA MET A 84 84.289 10.990 3.217 1.00 0.00 H new ATOM 0 HB2 MET A 84 84.357 9.284 5.731 1.00 0.00 H new ATOM 0 HB3 MET A 84 83.791 10.943 5.705 1.00 0.00 H new ATOM 0 HG2 MET A 84 82.101 10.335 3.942 1.00 0.00 H new ATOM 0 HG3 MET A 84 82.663 8.676 3.978 1.00 0.00 H new ATOM 0 HE1 MET A 84 81.759 7.172 7.188 1.00 0.00 H new ATOM 0 HE2 MET A 84 83.025 7.416 5.961 1.00 0.00 H new ATOM 0 HE3 MET A 84 83.088 8.314 7.496 1.00 0.00 H new ATOM 1346 N MET A 85 87.072 10.238 4.775 1.00 0.00 N ATOM 1347 CA MET A 85 88.349 10.830 5.234 1.00 0.00 C ATOM 1348 C MET A 85 88.911 11.647 4.076 1.00 0.00 C ATOM 1349 O MET A 85 89.539 12.666 4.275 1.00 0.00 O ATOM 1350 CB MET A 85 89.329 9.715 5.640 1.00 0.00 C ATOM 1351 CG MET A 85 90.649 10.318 6.146 1.00 0.00 C ATOM 1352 SD MET A 85 91.741 10.676 4.748 1.00 0.00 S ATOM 1353 CE MET A 85 92.616 9.091 4.717 1.00 0.00 C ATOM 0 H MET A 85 87.033 9.219 4.786 1.00 0.00 H new ATOM 0 HA MET A 85 88.195 11.466 6.105 1.00 0.00 H new ATOM 0 HB2 MET A 85 88.883 9.096 6.418 1.00 0.00 H new ATOM 0 HB3 MET A 85 89.523 9.064 4.787 1.00 0.00 H new ATOM 0 HG2 MET A 85 90.450 11.232 6.706 1.00 0.00 H new ATOM 0 HG3 MET A 85 91.137 9.624 6.831 1.00 0.00 H new ATOM 0 HE1 MET A 85 93.135 8.981 3.765 1.00 0.00 H new ATOM 0 HE2 MET A 85 93.340 9.059 5.531 1.00 0.00 H new ATOM 0 HE3 MET A 85 91.900 8.278 4.836 1.00 0.00 H new ATOM 1363 N CYS A 86 88.665 11.223 2.855 1.00 0.00 N ATOM 1364 CA CYS A 86 89.168 12.008 1.695 1.00 0.00 C ATOM 1365 C CYS A 86 88.599 11.442 0.386 1.00 0.00 C ATOM 1366 O CYS A 86 89.286 10.781 -0.366 1.00 0.00 O ATOM 1367 CB CYS A 86 90.710 11.974 1.671 1.00 0.00 C ATOM 1368 SG CYS A 86 91.368 13.462 2.477 1.00 0.00 S ATOM 0 H CYS A 86 88.144 10.378 2.621 1.00 0.00 H new ATOM 0 HA CYS A 86 88.840 13.043 1.795 1.00 0.00 H new ATOM 0 HB2 CYS A 86 91.072 11.082 2.182 1.00 0.00 H new ATOM 0 HB3 CYS A 86 91.066 11.918 0.642 1.00 0.00 H new ATOM 0 HG CYS A 86 90.775 13.634 3.621 1.00 0.00 H new ATOM 1374 N ASN A 87 87.351 11.719 0.102 1.00 0.00 N ATOM 1375 CA ASN A 87 86.739 11.224 -1.173 1.00 0.00 C ATOM 1376 C ASN A 87 86.825 12.329 -2.227 1.00 0.00 C ATOM 1377 O ASN A 87 87.082 12.068 -3.385 1.00 0.00 O ATOM 1378 CB ASN A 87 85.263 10.863 -0.948 1.00 0.00 C ATOM 1379 CG ASN A 87 84.577 11.971 -0.145 1.00 0.00 C ATOM 1380 OD1 ASN A 87 84.930 12.174 1.094 1.00 0.00 O flip ATOM 1381 ND2 ASN A 87 83.706 12.654 -0.649 1.00 0.00 N flip ATOM 0 H ASN A 87 86.728 12.266 0.696 1.00 0.00 H new ATOM 0 HA ASN A 87 87.277 10.337 -1.507 1.00 0.00 H new ATOM 0 HB2 ASN A 87 84.761 10.731 -1.906 1.00 0.00 H new ATOM 0 HB3 ASN A 87 85.188 9.915 -0.416 1.00 0.00 H new ATOM 0 HD21 ASN A 87 83.430 12.495 -1.618 1.00 0.00 H new ATOM 0 HD22 ASN A 87 83.252 13.386 -0.103 1.00 0.00 H new ATOM 1388 N GLU A 88 86.622 13.560 -1.838 1.00 0.00 N ATOM 1389 CA GLU A 88 86.698 14.674 -2.828 1.00 0.00 C ATOM 1390 C GLU A 88 86.605 16.019 -2.100 1.00 0.00 C ATOM 1391 O GLU A 88 87.096 17.026 -2.574 1.00 0.00 O ATOM 1392 CB GLU A 88 85.542 14.552 -3.824 1.00 0.00 C ATOM 1393 CG GLU A 88 85.711 15.580 -4.944 1.00 0.00 C ATOM 1394 CD GLU A 88 84.592 15.399 -5.972 1.00 0.00 C ATOM 1395 OE1 GLU A 88 83.817 14.468 -5.818 1.00 0.00 O ATOM 1396 OE2 GLU A 88 84.528 16.195 -6.893 1.00 0.00 O ATOM 0 H GLU A 88 86.408 13.842 -0.881 1.00 0.00 H new ATOM 0 HA GLU A 88 87.647 14.618 -3.362 1.00 0.00 H new ATOM 0 HB2 GLU A 88 85.515 13.546 -4.243 1.00 0.00 H new ATOM 0 HB3 GLU A 88 84.592 14.710 -3.313 1.00 0.00 H new ATOM 0 HG2 GLU A 88 85.683 16.589 -4.534 1.00 0.00 H new ATOM 0 HG3 GLU A 88 86.683 15.457 -5.422 1.00 0.00 H new ATOM 1403 N PHE A 89 85.983 16.046 -0.951 1.00 0.00 N ATOM 1404 CA PHE A 89 85.865 17.329 -0.199 1.00 0.00 C ATOM 1405 C PHE A 89 87.262 17.835 0.157 1.00 0.00 C ATOM 1406 O PHE A 89 88.143 17.073 0.507 1.00 0.00 O ATOM 1407 CB PHE A 89 85.049 17.114 1.080 1.00 0.00 C ATOM 1408 CG PHE A 89 83.592 16.925 0.720 1.00 0.00 C ATOM 1409 CD1 PHE A 89 83.158 15.701 0.203 1.00 0.00 C ATOM 1410 CD2 PHE A 89 82.675 17.970 0.907 1.00 0.00 C ATOM 1411 CE1 PHE A 89 81.812 15.517 -0.127 1.00 0.00 C ATOM 1412 CE2 PHE A 89 81.327 17.786 0.574 1.00 0.00 C ATOM 1413 CZ PHE A 89 80.896 16.558 0.057 1.00 0.00 C ATOM 0 H PHE A 89 85.553 15.237 -0.502 1.00 0.00 H new ATOM 0 HA PHE A 89 85.357 18.067 -0.820 1.00 0.00 H new ATOM 0 HB2 PHE A 89 85.418 16.241 1.618 1.00 0.00 H new ATOM 0 HB3 PHE A 89 85.163 17.970 1.745 1.00 0.00 H new ATOM 0 HD1 PHE A 89 83.864 14.896 0.058 1.00 0.00 H new ATOM 0 HD2 PHE A 89 83.008 18.916 1.308 1.00 0.00 H new ATOM 0 HE1 PHE A 89 81.479 14.570 -0.525 1.00 0.00 H new ATOM 0 HE2 PHE A 89 80.621 18.591 0.716 1.00 0.00 H new ATOM 0 HZ PHE A 89 79.857 16.415 -0.200 1.00 0.00 H new ATOM 1423 N PHE A 90 87.476 19.114 0.056 1.00 0.00 N ATOM 1424 CA PHE A 90 88.817 19.674 0.375 1.00 0.00 C ATOM 1425 C PHE A 90 88.923 19.883 1.883 1.00 0.00 C ATOM 1426 O PHE A 90 89.984 20.136 2.418 1.00 0.00 O ATOM 1427 CB PHE A 90 88.963 21.011 -0.340 1.00 0.00 C ATOM 1428 CG PHE A 90 88.695 20.814 -1.810 1.00 0.00 C ATOM 1429 CD1 PHE A 90 89.725 20.401 -2.663 1.00 0.00 C ATOM 1430 CD2 PHE A 90 87.411 21.042 -2.318 1.00 0.00 C ATOM 1431 CE1 PHE A 90 89.470 20.219 -4.027 1.00 0.00 C ATOM 1432 CE2 PHE A 90 87.156 20.860 -3.681 1.00 0.00 C ATOM 1433 CZ PHE A 90 88.186 20.449 -4.537 1.00 0.00 C ATOM 0 H PHE A 90 86.778 19.799 -0.235 1.00 0.00 H new ATOM 0 HA PHE A 90 89.603 18.992 0.050 1.00 0.00 H new ATOM 0 HB2 PHE A 90 88.265 21.738 0.076 1.00 0.00 H new ATOM 0 HB3 PHE A 90 89.966 21.410 -0.191 1.00 0.00 H new ATOM 0 HD1 PHE A 90 90.715 20.223 -2.269 1.00 0.00 H new ATOM 0 HD2 PHE A 90 86.617 21.358 -1.658 1.00 0.00 H new ATOM 0 HE1 PHE A 90 90.264 19.901 -4.687 1.00 0.00 H new ATOM 0 HE2 PHE A 90 86.165 21.036 -4.073 1.00 0.00 H new ATOM 0 HZ PHE A 90 87.990 20.310 -5.590 1.00 0.00 H new ATOM 1443 N GLU A 91 87.822 19.768 2.568 1.00 0.00 N ATOM 1444 CA GLU A 91 87.834 19.946 4.046 1.00 0.00 C ATOM 1445 C GLU A 91 88.410 18.686 4.697 1.00 0.00 C ATOM 1446 O GLU A 91 88.014 17.581 4.382 1.00 0.00 O ATOM 1447 CB GLU A 91 86.402 20.163 4.535 1.00 0.00 C ATOM 1448 CG GLU A 91 85.846 21.455 3.931 1.00 0.00 C ATOM 1449 CD GLU A 91 86.588 22.658 4.516 1.00 0.00 C ATOM 1450 OE1 GLU A 91 87.052 22.553 5.640 1.00 0.00 O ATOM 1451 OE2 GLU A 91 86.682 23.663 3.829 1.00 0.00 O ATOM 0 H GLU A 91 86.909 19.557 2.166 1.00 0.00 H new ATOM 0 HA GLU A 91 88.446 20.808 4.313 1.00 0.00 H new ATOM 0 HB2 GLU A 91 85.777 19.317 4.249 1.00 0.00 H new ATOM 0 HB3 GLU A 91 86.383 20.220 5.623 1.00 0.00 H new ATOM 0 HG2 GLU A 91 85.958 21.439 2.847 1.00 0.00 H new ATOM 0 HG3 GLU A 91 84.779 21.536 4.140 1.00 0.00 H new ATOM 1458 N GLY A 92 89.338 18.839 5.600 1.00 0.00 N ATOM 1459 CA GLY A 92 89.928 17.645 6.263 1.00 0.00 C ATOM 1460 C GLY A 92 88.948 17.120 7.308 1.00 0.00 C ATOM 1461 O GLY A 92 88.933 17.559 8.443 1.00 0.00 O ATOM 0 H GLY A 92 89.712 19.737 5.906 1.00 0.00 H new ATOM 0 HA2 GLY A 92 90.141 16.872 5.525 1.00 0.00 H new ATOM 0 HA3 GLY A 92 90.876 17.906 6.734 1.00 0.00 H new ATOM 1465 N PHE A 93 88.122 16.182 6.930 1.00 0.00 N ATOM 1466 CA PHE A 93 87.131 15.618 7.887 1.00 0.00 C ATOM 1467 C PHE A 93 87.742 14.360 8.551 1.00 0.00 C ATOM 1468 O PHE A 93 88.237 13.494 7.857 1.00 0.00 O ATOM 1469 CB PHE A 93 85.873 15.227 7.105 1.00 0.00 C ATOM 1470 CG PHE A 93 84.856 14.616 8.040 1.00 0.00 C ATOM 1471 CD1 PHE A 93 84.058 15.442 8.845 1.00 0.00 C ATOM 1472 CD2 PHE A 93 84.709 13.225 8.101 1.00 0.00 C ATOM 1473 CE1 PHE A 93 83.114 14.875 9.709 1.00 0.00 C ATOM 1474 CE2 PHE A 93 83.765 12.659 8.966 1.00 0.00 C ATOM 1475 CZ PHE A 93 82.968 13.484 9.770 1.00 0.00 C ATOM 0 H PHE A 93 88.092 15.781 5.993 1.00 0.00 H new ATOM 0 HA PHE A 93 86.877 16.349 8.655 1.00 0.00 H new ATOM 0 HB2 PHE A 93 85.450 16.105 6.617 1.00 0.00 H new ATOM 0 HB3 PHE A 93 86.129 14.517 6.318 1.00 0.00 H new ATOM 0 HD1 PHE A 93 84.172 16.515 8.798 1.00 0.00 H new ATOM 0 HD2 PHE A 93 85.324 12.589 7.481 1.00 0.00 H new ATOM 0 HE1 PHE A 93 82.498 15.510 10.328 1.00 0.00 H new ATOM 0 HE2 PHE A 93 83.651 11.586 9.013 1.00 0.00 H new ATOM 0 HZ PHE A 93 82.240 13.047 10.437 1.00 0.00 H new ATOM 1485 N PRO A 94 87.733 14.236 9.871 1.00 0.00 N ATOM 1486 CA PRO A 94 88.327 13.028 10.521 1.00 0.00 C ATOM 1487 C PRO A 94 87.536 11.751 10.194 1.00 0.00 C ATOM 1488 O PRO A 94 86.833 11.684 9.206 1.00 0.00 O ATOM 1489 CB PRO A 94 88.242 13.382 12.021 1.00 0.00 C ATOM 1490 CG PRO A 94 87.306 14.593 12.174 1.00 0.00 C ATOM 1491 CD PRO A 94 87.147 15.254 10.796 1.00 0.00 C ATOM 0 HA PRO A 94 89.340 12.811 10.181 1.00 0.00 H new ATOM 0 HB2 PRO A 94 87.863 12.534 12.591 1.00 0.00 H new ATOM 0 HB3 PRO A 94 89.232 13.614 12.414 1.00 0.00 H new ATOM 0 HG2 PRO A 94 86.336 14.278 12.558 1.00 0.00 H new ATOM 0 HG3 PRO A 94 87.717 15.303 12.891 1.00 0.00 H new ATOM 0 HD2 PRO A 94 86.102 15.458 10.563 1.00 0.00 H new ATOM 0 HD3 PRO A 94 87.677 16.205 10.740 1.00 0.00 H new ATOM 1499 N ASP A 95 87.641 10.741 11.019 1.00 0.00 N ATOM 1500 CA ASP A 95 86.887 9.484 10.753 1.00 0.00 C ATOM 1501 C ASP A 95 85.406 9.731 11.047 1.00 0.00 C ATOM 1502 O ASP A 95 85.020 10.809 11.456 1.00 0.00 O ATOM 1503 CB ASP A 95 87.410 8.357 11.645 1.00 0.00 C ATOM 1504 CG ASP A 95 87.154 8.702 13.112 1.00 0.00 C ATOM 1505 OD1 ASP A 95 86.840 9.850 13.382 1.00 0.00 O ATOM 1506 OD2 ASP A 95 87.270 7.812 13.939 1.00 0.00 O ATOM 0 H ASP A 95 88.215 10.734 11.862 1.00 0.00 H new ATOM 0 HA ASP A 95 87.018 9.191 9.711 1.00 0.00 H new ATOM 0 HB2 ASP A 95 86.916 7.419 11.390 1.00 0.00 H new ATOM 0 HB3 ASP A 95 88.477 8.212 11.476 1.00 0.00 H new ATOM 1511 N LYS A 96 84.570 8.757 10.828 1.00 0.00 N ATOM 1512 CA LYS A 96 83.116 8.960 11.077 1.00 0.00 C ATOM 1513 C LYS A 96 82.826 8.948 12.593 1.00 0.00 C ATOM 1514 O LYS A 96 81.710 9.174 13.015 1.00 0.00 O ATOM 1515 CB LYS A 96 82.324 7.836 10.367 1.00 0.00 C ATOM 1516 CG LYS A 96 81.070 8.399 9.673 1.00 0.00 C ATOM 1517 CD LYS A 96 80.119 9.009 10.706 1.00 0.00 C ATOM 1518 CE LYS A 96 78.766 9.290 10.046 1.00 0.00 C ATOM 1519 NZ LYS A 96 78.943 10.267 8.933 1.00 0.00 N ATOM 0 H LYS A 96 84.829 7.831 10.488 1.00 0.00 H new ATOM 0 HA LYS A 96 82.808 9.928 10.681 1.00 0.00 H new ATOM 0 HB2 LYS A 96 82.962 7.345 9.632 1.00 0.00 H new ATOM 0 HB3 LYS A 96 82.033 7.077 11.093 1.00 0.00 H new ATOM 0 HG2 LYS A 96 81.359 9.155 8.943 1.00 0.00 H new ATOM 0 HG3 LYS A 96 80.562 7.605 9.125 1.00 0.00 H new ATOM 0 HD2 LYS A 96 79.992 8.327 11.547 1.00 0.00 H new ATOM 0 HD3 LYS A 96 80.540 9.932 11.105 1.00 0.00 H new ATOM 0 HE2 LYS A 96 78.337 8.363 9.665 1.00 0.00 H new ATOM 0 HE3 LYS A 96 78.066 9.686 10.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 78.015 10.636 8.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 79.543 11.053 9.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 79.395 9.794 8.124 1.00 0.00 H new ATOM 1533 N GLN A 97 83.812 8.682 13.416 1.00 0.00 N ATOM 1534 CA GLN A 97 83.565 8.655 14.893 1.00 0.00 C ATOM 1535 C GLN A 97 83.442 10.106 15.422 1.00 0.00 C ATOM 1536 O GLN A 97 84.263 10.941 15.092 1.00 0.00 O ATOM 1537 CB GLN A 97 84.739 7.949 15.594 1.00 0.00 C ATOM 1538 CG GLN A 97 84.436 7.785 17.091 1.00 0.00 C ATOM 1539 CD GLN A 97 85.670 7.230 17.809 1.00 0.00 C ATOM 1540 OE1 GLN A 97 86.602 6.772 17.177 1.00 0.00 O ATOM 1541 NE2 GLN A 97 85.716 7.248 19.116 1.00 0.00 N ATOM 0 H GLN A 97 84.771 8.484 13.132 1.00 0.00 H new ATOM 0 HA GLN A 97 82.641 8.115 15.099 1.00 0.00 H new ATOM 0 HB2 GLN A 97 84.910 6.973 15.140 1.00 0.00 H new ATOM 0 HB3 GLN A 97 85.653 8.527 15.461 1.00 0.00 H new ATOM 0 HG2 GLN A 97 84.154 8.745 17.522 1.00 0.00 H new ATOM 0 HG3 GLN A 97 83.590 7.112 17.229 1.00 0.00 H new ATOM 0 HE21 GLN A 97 84.935 7.632 19.649 1.00 0.00 H new ATOM 0 HE22 GLN A 97 86.533 6.878 19.603 1.00 0.00 H new ATOM 1550 N PRO A 98 82.444 10.431 16.237 1.00 0.00 N ATOM 1551 CA PRO A 98 82.313 11.825 16.762 1.00 0.00 C ATOM 1552 C PRO A 98 83.433 12.165 17.760 1.00 0.00 C ATOM 1553 O PRO A 98 84.151 11.297 18.215 1.00 0.00 O ATOM 1554 CB PRO A 98 80.937 11.787 17.454 1.00 0.00 C ATOM 1555 CG PRO A 98 80.563 10.313 17.671 1.00 0.00 C ATOM 1556 CD PRO A 98 81.399 9.464 16.700 1.00 0.00 C ATOM 0 HA PRO A 98 82.393 12.588 15.988 1.00 0.00 H new ATOM 0 HB2 PRO A 98 80.973 12.316 18.406 1.00 0.00 H new ATOM 0 HB3 PRO A 98 80.187 12.285 16.840 1.00 0.00 H new ATOM 0 HG2 PRO A 98 80.759 10.018 18.702 1.00 0.00 H new ATOM 0 HG3 PRO A 98 79.499 10.159 17.493 1.00 0.00 H new ATOM 0 HD2 PRO A 98 81.839 8.598 17.194 1.00 0.00 H new ATOM 0 HD3 PRO A 98 80.799 9.088 15.871 1.00 0.00 H new ATOM 1564 N ARG A 99 83.589 13.416 18.103 1.00 0.00 N ATOM 1565 CA ARG A 99 84.658 13.800 19.075 1.00 0.00 C ATOM 1566 C ARG A 99 84.101 13.743 20.496 1.00 0.00 C ATOM 1567 O ARG A 99 84.326 12.799 21.227 1.00 0.00 O ATOM 1568 CB ARG A 99 85.143 15.221 18.773 1.00 0.00 C ATOM 1569 CG ARG A 99 86.223 15.627 19.783 1.00 0.00 C ATOM 1570 CD ARG A 99 86.821 16.976 19.372 1.00 0.00 C ATOM 1571 NE ARG A 99 85.771 18.035 19.454 1.00 0.00 N ATOM 1572 CZ ARG A 99 86.106 19.299 19.499 1.00 0.00 C ATOM 1573 NH1 ARG A 99 87.363 19.648 19.508 1.00 0.00 N ATOM 1574 NH2 ARG A 99 85.180 20.216 19.538 1.00 0.00 N ATOM 0 H ARG A 99 83.023 14.189 17.753 1.00 0.00 H new ATOM 0 HA ARG A 99 85.494 13.106 18.984 1.00 0.00 H new ATOM 0 HB2 ARG A 99 85.542 15.271 17.760 1.00 0.00 H new ATOM 0 HB3 ARG A 99 84.307 15.918 18.821 1.00 0.00 H new ATOM 0 HG2 ARG A 99 85.794 15.696 20.783 1.00 0.00 H new ATOM 0 HG3 ARG A 99 87.004 14.867 19.823 1.00 0.00 H new ATOM 0 HD2 ARG A 99 87.658 17.228 20.024 1.00 0.00 H new ATOM 0 HD3 ARG A 99 87.214 16.917 18.357 1.00 0.00 H new ATOM 0 HE ARG A 99 84.786 17.771 19.475 1.00 0.00 H new ATOM 0 HH11 ARG A 99 88.091 18.934 19.480 1.00 0.00 H new ATOM 0 HH12 ARG A 99 87.618 20.635 19.543 1.00 0.00 H new ATOM 0 HH21 ARG A 99 84.196 19.948 19.533 1.00 0.00 H new ATOM 0 HH22 ARG A 99 85.440 21.202 19.573 1.00 0.00 H new ATOM 1588 N LYS A 100 83.380 14.756 20.895 1.00 0.00 N ATOM 1589 CA LYS A 100 82.811 14.776 22.274 1.00 0.00 C ATOM 1590 C LYS A 100 81.449 14.082 22.263 1.00 0.00 C ATOM 1591 O LYS A 100 80.953 13.640 23.278 1.00 0.00 O ATOM 1592 CB LYS A 100 82.635 16.237 22.707 1.00 0.00 C ATOM 1593 CG LYS A 100 82.244 16.332 24.192 1.00 0.00 C ATOM 1594 CD LYS A 100 83.441 15.980 25.093 1.00 0.00 C ATOM 1595 CE LYS A 100 83.183 16.497 26.512 1.00 0.00 C ATOM 1596 NZ LYS A 100 81.949 15.863 27.057 1.00 0.00 N ATOM 0 H LYS A 100 83.160 15.572 20.324 1.00 0.00 H new ATOM 0 HA LYS A 100 83.476 14.259 22.966 1.00 0.00 H new ATOM 0 HB2 LYS A 100 83.562 16.784 22.536 1.00 0.00 H new ATOM 0 HB3 LYS A 100 81.868 16.711 22.095 1.00 0.00 H new ATOM 0 HG2 LYS A 100 81.896 17.340 24.418 1.00 0.00 H new ATOM 0 HG3 LYS A 100 81.415 15.655 24.399 1.00 0.00 H new ATOM 0 HD2 LYS A 100 83.592 14.901 25.110 1.00 0.00 H new ATOM 0 HD3 LYS A 100 84.353 16.423 24.693 1.00 0.00 H new ATOM 0 HE2 LYS A 100 84.035 16.270 27.153 1.00 0.00 H new ATOM 0 HE3 LYS A 100 83.073 17.581 26.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 81.918 15.993 28.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 81.112 16.306 26.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 81.954 14.847 26.836 1.00 0.00 H new ATOM 1610 N LYS A 101 80.843 13.976 21.112 1.00 0.00 N ATOM 1611 CA LYS A 101 79.513 13.306 21.015 1.00 0.00 C ATOM 1612 C LYS A 101 79.719 11.810 20.765 1.00 0.00 C ATOM 1613 O LYS A 101 80.862 11.383 20.756 1.00 0.00 O ATOM 1614 CB LYS A 101 78.731 13.919 19.849 1.00 0.00 C ATOM 1615 CG LYS A 101 78.321 15.351 20.198 1.00 0.00 C ATOM 1616 CD LYS A 101 77.571 15.974 19.019 1.00 0.00 C ATOM 1617 CE LYS A 101 77.192 17.412 19.365 1.00 0.00 C ATOM 1618 NZ LYS A 101 76.332 17.409 20.580 1.00 0.00 N ATOM 1619 OXT LYS A 101 78.732 11.116 20.584 1.00 0.00 O ATOM 0 H LYS A 101 81.214 14.327 20.229 1.00 0.00 H new ATOM 0 HA LYS A 101 78.957 13.444 21.942 1.00 0.00 H new ATOM 0 HB2 LYS A 101 79.343 13.915 18.947 1.00 0.00 H new ATOM 0 HB3 LYS A 101 77.846 13.319 19.637 1.00 0.00 H new ATOM 0 HG2 LYS A 101 77.688 15.352 21.086 1.00 0.00 H new ATOM 0 HG3 LYS A 101 79.204 15.945 20.435 1.00 0.00 H new ATOM 0 HD2 LYS A 101 78.195 15.955 18.125 1.00 0.00 H new ATOM 0 HD3 LYS A 101 76.676 15.394 18.795 1.00 0.00 H new ATOM 0 HE2 LYS A 101 78.089 18.006 19.541 1.00 0.00 H new ATOM 0 HE3 LYS A 101 76.663 17.873 18.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 75.775 18.287 20.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 75.689 16.592 20.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 76.930 17.346 21.428 1.00 0.00 H new TER 1633 LYS A 101 ATOM 1634 N MET B 1 96.435 1.096 -14.799 1.00 0.00 N ATOM 1635 CA MET B 1 95.452 0.212 -14.112 1.00 0.00 C ATOM 1636 C MET B 1 96.095 -0.411 -12.865 1.00 0.00 C ATOM 1637 O MET B 1 95.675 -1.449 -12.392 1.00 0.00 O ATOM 1638 CB MET B 1 94.998 -0.893 -15.079 1.00 0.00 C ATOM 1639 CG MET B 1 94.253 -0.269 -16.266 1.00 0.00 C ATOM 1640 SD MET B 1 92.659 0.396 -15.707 1.00 0.00 S ATOM 1641 CE MET B 1 91.724 -1.159 -15.645 1.00 0.00 C ATOM 0 H1 MET B 1 95.962 1.606 -15.572 1.00 0.00 H new ATOM 0 H2 MET B 1 96.822 1.780 -14.118 1.00 0.00 H new ATOM 0 H3 MET B 1 97.208 0.519 -15.187 1.00 0.00 H new ATOM 0 HA MET B 1 94.587 0.799 -13.805 1.00 0.00 H new ATOM 0 HB2 MET B 1 95.861 -1.455 -15.434 1.00 0.00 H new ATOM 0 HB3 MET B 1 94.349 -1.599 -14.561 1.00 0.00 H new ATOM 0 HG2 MET B 1 94.854 0.525 -16.708 1.00 0.00 H new ATOM 0 HG3 MET B 1 94.094 -1.018 -17.042 1.00 0.00 H new ATOM 0 HE1 MET B 1 90.936 -1.140 -16.398 1.00 0.00 H new ATOM 0 HE2 MET B 1 92.395 -1.995 -15.843 1.00 0.00 H new ATOM 0 HE3 MET B 1 91.279 -1.277 -14.657 1.00 0.00 H new ATOM 1653 N ALA B 2 97.110 0.219 -12.325 1.00 0.00 N ATOM 1654 CA ALA B 2 97.773 -0.334 -11.105 1.00 0.00 C ATOM 1655 C ALA B 2 96.824 -0.234 -9.907 1.00 0.00 C ATOM 1656 O ALA B 2 96.778 -1.112 -9.069 1.00 0.00 O ATOM 1657 CB ALA B 2 99.048 0.460 -10.796 1.00 0.00 C ATOM 0 H ALA B 2 97.507 1.091 -12.676 1.00 0.00 H new ATOM 0 HA ALA B 2 98.027 -1.378 -11.288 1.00 0.00 H new ATOM 0 HB1 ALA B 2 99.525 0.050 -9.906 1.00 0.00 H new ATOM 0 HB2 ALA B 2 99.734 0.389 -11.640 1.00 0.00 H new ATOM 0 HB3 ALA B 2 98.793 1.505 -10.622 1.00 0.00 H new ATOM 1663 N CYS B 3 96.084 0.846 -9.811 1.00 0.00 N ATOM 1664 CA CYS B 3 95.143 1.028 -8.658 1.00 0.00 C ATOM 1665 C CYS B 3 93.754 1.447 -9.170 1.00 0.00 C ATOM 1666 O CYS B 3 93.402 2.609 -9.122 1.00 0.00 O ATOM 1667 CB CYS B 3 95.698 2.122 -7.747 1.00 0.00 C ATOM 1668 SG CYS B 3 96.197 3.545 -8.750 1.00 0.00 S ATOM 0 H CYS B 3 96.091 1.612 -10.484 1.00 0.00 H new ATOM 0 HA CYS B 3 95.048 0.090 -8.111 1.00 0.00 H new ATOM 0 HB2 CYS B 3 94.944 2.422 -7.020 1.00 0.00 H new ATOM 0 HB3 CYS B 3 96.551 1.743 -7.184 1.00 0.00 H new ATOM 0 HG CYS B 3 95.287 4.471 -8.673 1.00 0.00 H new ATOM 1674 N PRO B 4 92.963 0.510 -9.652 1.00 0.00 N ATOM 1675 CA PRO B 4 91.600 0.836 -10.164 1.00 0.00 C ATOM 1676 C PRO B 4 90.625 1.177 -9.024 1.00 0.00 C ATOM 1677 O PRO B 4 89.595 1.785 -9.233 1.00 0.00 O ATOM 1678 CB PRO B 4 91.190 -0.468 -10.886 1.00 0.00 C ATOM 1679 CG PRO B 4 92.260 -1.546 -10.597 1.00 0.00 C ATOM 1680 CD PRO B 4 93.367 -0.921 -9.724 1.00 0.00 C ATOM 0 HA PRO B 4 91.585 1.714 -10.809 1.00 0.00 H new ATOM 0 HB2 PRO B 4 90.212 -0.802 -10.539 1.00 0.00 H new ATOM 0 HB3 PRO B 4 91.105 -0.296 -11.959 1.00 0.00 H new ATOM 0 HG2 PRO B 4 91.811 -2.397 -10.085 1.00 0.00 H new ATOM 0 HG3 PRO B 4 92.681 -1.921 -11.530 1.00 0.00 H new ATOM 0 HD2 PRO B 4 93.410 -1.379 -8.736 1.00 0.00 H new ATOM 0 HD3 PRO B 4 94.353 -1.041 -10.174 1.00 0.00 H new ATOM 1688 N LEU B 5 90.951 0.782 -7.825 1.00 0.00 N ATOM 1689 CA LEU B 5 90.054 1.060 -6.666 1.00 0.00 C ATOM 1690 C LEU B 5 89.882 2.573 -6.523 1.00 0.00 C ATOM 1691 O LEU B 5 88.836 3.057 -6.135 1.00 0.00 O ATOM 1692 CB LEU B 5 90.687 0.481 -5.396 1.00 0.00 C ATOM 1693 CG LEU B 5 89.791 0.740 -4.172 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.444 0.005 -4.332 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.504 0.237 -2.909 1.00 0.00 C ATOM 0 H LEU B 5 91.806 0.275 -7.596 1.00 0.00 H new ATOM 0 HA LEU B 5 89.078 0.600 -6.823 1.00 0.00 H new ATOM 0 HB2 LEU B 5 90.843 -0.591 -5.518 1.00 0.00 H new ATOM 0 HB3 LEU B 5 91.668 0.929 -5.236 1.00 0.00 H new ATOM 0 HG LEU B 5 89.600 1.810 -4.088 1.00 0.00 H new ATOM 0 HD11 LEU B 5 87.819 0.196 -3.460 1.00 0.00 H new ATOM 0 HD12 LEU B 5 87.937 0.365 -5.227 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.623 -1.066 -4.422 1.00 0.00 H new ATOM 0 HD21 LEU B 5 89.873 0.418 -2.039 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.697 -0.832 -3.001 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.449 0.767 -2.789 1.00 0.00 H new ATOM 1707 N GLU B 6 90.903 3.319 -6.827 1.00 0.00 N ATOM 1708 CA GLU B 6 90.817 4.800 -6.702 1.00 0.00 C ATOM 1709 C GLU B 6 89.698 5.341 -7.600 1.00 0.00 C ATOM 1710 O GLU B 6 88.897 6.154 -7.187 1.00 0.00 O ATOM 1711 CB GLU B 6 92.147 5.394 -7.167 1.00 0.00 C ATOM 1712 CG GLU B 6 93.241 5.065 -6.149 1.00 0.00 C ATOM 1713 CD GLU B 6 94.604 5.462 -6.716 1.00 0.00 C ATOM 1714 OE1 GLU B 6 94.642 5.924 -7.843 1.00 0.00 O ATOM 1715 OE2 GLU B 6 95.588 5.303 -6.011 1.00 0.00 O ATOM 0 H GLU B 6 91.800 2.966 -7.159 1.00 0.00 H new ATOM 0 HA GLU B 6 90.607 5.069 -5.667 1.00 0.00 H new ATOM 0 HB2 GLU B 6 92.414 4.993 -8.145 1.00 0.00 H new ATOM 0 HB3 GLU B 6 92.055 6.474 -7.280 1.00 0.00 H new ATOM 0 HG2 GLU B 6 93.055 5.596 -5.216 1.00 0.00 H new ATOM 0 HG3 GLU B 6 93.228 4.000 -5.917 1.00 0.00 H new ATOM 1722 N LYS B 7 89.637 4.897 -8.823 1.00 0.00 N ATOM 1723 CA LYS B 7 88.574 5.388 -9.737 1.00 0.00 C ATOM 1724 C LYS B 7 87.247 4.819 -9.282 1.00 0.00 C ATOM 1725 O LYS B 7 86.240 5.490 -9.286 1.00 0.00 O ATOM 1726 CB LYS B 7 88.853 4.925 -11.169 1.00 0.00 C ATOM 1727 CG LYS B 7 90.312 5.219 -11.517 1.00 0.00 C ATOM 1728 CD LYS B 7 90.518 5.178 -13.039 1.00 0.00 C ATOM 1729 CE LYS B 7 90.085 3.820 -13.606 1.00 0.00 C ATOM 1730 NZ LYS B 7 90.750 2.714 -12.859 1.00 0.00 N ATOM 0 H LYS B 7 90.278 4.215 -9.228 1.00 0.00 H new ATOM 0 HA LYS B 7 88.551 6.478 -9.716 1.00 0.00 H new ATOM 0 HB2 LYS B 7 88.652 3.858 -11.265 1.00 0.00 H new ATOM 0 HB3 LYS B 7 88.190 5.438 -11.866 1.00 0.00 H new ATOM 0 HG2 LYS B 7 90.594 6.199 -11.132 1.00 0.00 H new ATOM 0 HG3 LYS B 7 90.962 4.488 -11.036 1.00 0.00 H new ATOM 0 HD2 LYS B 7 89.943 5.975 -13.511 1.00 0.00 H new ATOM 0 HD3 LYS B 7 91.567 5.359 -13.274 1.00 0.00 H new ATOM 0 HE2 LYS B 7 89.002 3.717 -13.535 1.00 0.00 H new ATOM 0 HE3 LYS B 7 90.342 3.761 -14.664 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 90.931 1.919 -13.504 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 91.651 3.053 -12.466 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 90.132 2.398 -12.085 1.00 0.00 H new ATOM 1744 N ALA B 8 87.232 3.580 -8.877 1.00 0.00 N ATOM 1745 CA ALA B 8 85.944 2.999 -8.424 1.00 0.00 C ATOM 1746 C ALA B 8 85.451 3.850 -7.267 1.00 0.00 C ATOM 1747 O ALA B 8 84.294 4.205 -7.186 1.00 0.00 O ATOM 1748 CB ALA B 8 86.121 1.553 -7.979 1.00 0.00 C ATOM 0 H ALA B 8 88.039 2.958 -8.841 1.00 0.00 H new ATOM 0 HA ALA B 8 85.224 2.996 -9.242 1.00 0.00 H new ATOM 0 HB1 ALA B 8 85.161 1.153 -7.652 1.00 0.00 H new ATOM 0 HB2 ALA B 8 86.497 0.959 -8.812 1.00 0.00 H new ATOM 0 HB3 ALA B 8 86.832 1.511 -7.154 1.00 0.00 H new ATOM 1754 N LEU B 9 86.337 4.251 -6.404 1.00 0.00 N ATOM 1755 CA LEU B 9 85.915 5.155 -5.312 1.00 0.00 C ATOM 1756 C LEU B 9 85.397 6.408 -5.985 1.00 0.00 C ATOM 1757 O LEU B 9 84.403 6.984 -5.592 1.00 0.00 O ATOM 1758 CB LEU B 9 87.102 5.508 -4.416 1.00 0.00 C ATOM 1759 CG LEU B 9 87.475 4.302 -3.548 1.00 0.00 C ATOM 1760 CD1 LEU B 9 88.819 4.575 -2.859 1.00 0.00 C ATOM 1761 CD2 LEU B 9 86.387 4.052 -2.477 1.00 0.00 C ATOM 0 H LEU B 9 87.324 3.994 -6.409 1.00 0.00 H new ATOM 0 HA LEU B 9 85.158 4.684 -4.684 1.00 0.00 H new ATOM 0 HB2 LEU B 9 87.954 5.805 -5.027 1.00 0.00 H new ATOM 0 HB3 LEU B 9 86.851 6.359 -3.783 1.00 0.00 H new ATOM 0 HG LEU B 9 87.553 3.418 -4.180 1.00 0.00 H new ATOM 0 HD11 LEU B 9 89.090 3.720 -2.239 1.00 0.00 H new ATOM 0 HD12 LEU B 9 89.589 4.735 -3.614 1.00 0.00 H new ATOM 0 HD13 LEU B 9 88.733 5.464 -2.234 1.00 0.00 H new ATOM 0 HD21 LEU B 9 86.666 3.192 -1.868 1.00 0.00 H new ATOM 0 HD22 LEU B 9 86.294 4.932 -1.841 1.00 0.00 H new ATOM 0 HD23 LEU B 9 85.433 3.856 -2.966 1.00 0.00 H new ATOM 1773 N ASP B 10 86.069 6.816 -7.022 1.00 0.00 N ATOM 1774 CA ASP B 10 85.623 8.022 -7.764 1.00 0.00 C ATOM 1775 C ASP B 10 84.277 7.713 -8.428 1.00 0.00 C ATOM 1776 O ASP B 10 83.407 8.554 -8.506 1.00 0.00 O ATOM 1777 CB ASP B 10 86.671 8.401 -8.819 1.00 0.00 C ATOM 1778 CG ASP B 10 86.499 9.869 -9.225 1.00 0.00 C ATOM 1779 OD1 ASP B 10 85.536 10.166 -9.910 1.00 0.00 O ATOM 1780 OD2 ASP B 10 87.340 10.670 -8.846 1.00 0.00 O ATOM 0 H ASP B 10 86.908 6.366 -7.387 1.00 0.00 H new ATOM 0 HA ASP B 10 85.508 8.864 -7.082 1.00 0.00 H new ATOM 0 HB2 ASP B 10 87.673 8.240 -8.422 1.00 0.00 H new ATOM 0 HB3 ASP B 10 86.567 7.759 -9.694 1.00 0.00 H new ATOM 1785 N VAL B 11 84.103 6.510 -8.911 1.00 0.00 N ATOM 1786 CA VAL B 11 82.811 6.151 -9.567 1.00 0.00 C ATOM 1787 C VAL B 11 81.663 6.312 -8.566 1.00 0.00 C ATOM 1788 O VAL B 11 80.604 6.812 -8.893 1.00 0.00 O ATOM 1789 CB VAL B 11 82.871 4.692 -10.043 1.00 0.00 C ATOM 1790 CG1 VAL B 11 81.484 4.225 -10.496 1.00 0.00 C ATOM 1791 CG2 VAL B 11 83.860 4.562 -11.210 1.00 0.00 C ATOM 0 H VAL B 11 84.797 5.763 -8.880 1.00 0.00 H new ATOM 0 HA VAL B 11 82.642 6.809 -10.419 1.00 0.00 H new ATOM 0 HB VAL B 11 83.205 4.069 -9.213 1.00 0.00 H new ATOM 0 HG11 VAL B 11 81.540 3.189 -10.831 1.00 0.00 H new ATOM 0 HG12 VAL B 11 80.785 4.299 -9.663 1.00 0.00 H new ATOM 0 HG13 VAL B 11 81.139 4.854 -11.317 1.00 0.00 H new ATOM 0 HG21 VAL B 11 83.897 3.524 -11.542 1.00 0.00 H new ATOM 0 HG22 VAL B 11 83.534 5.196 -12.035 1.00 0.00 H new ATOM 0 HG23 VAL B 11 84.852 4.874 -10.883 1.00 0.00 H new ATOM 1801 N MET B 12 81.860 5.889 -7.350 1.00 0.00 N ATOM 1802 CA MET B 12 80.777 6.020 -6.335 1.00 0.00 C ATOM 1803 C MET B 12 80.568 7.500 -6.018 1.00 0.00 C ATOM 1804 O MET B 12 79.462 7.969 -5.844 1.00 0.00 O ATOM 1805 CB MET B 12 81.166 5.254 -5.064 1.00 0.00 C ATOM 1806 CG MET B 12 80.040 5.360 -4.023 1.00 0.00 C ATOM 1807 SD MET B 12 80.079 3.907 -2.943 1.00 0.00 S ATOM 1808 CE MET B 12 81.821 4.006 -2.479 1.00 0.00 C ATOM 0 H MET B 12 82.722 5.459 -7.014 1.00 0.00 H new ATOM 0 HA MET B 12 79.850 5.601 -6.725 1.00 0.00 H new ATOM 0 HB2 MET B 12 81.354 4.207 -5.303 1.00 0.00 H new ATOM 0 HB3 MET B 12 82.091 5.659 -4.654 1.00 0.00 H new ATOM 0 HG2 MET B 12 80.160 6.269 -3.433 1.00 0.00 H new ATOM 0 HG3 MET B 12 79.074 5.430 -4.522 1.00 0.00 H new ATOM 0 HE1 MET B 12 81.976 3.485 -1.535 1.00 0.00 H new ATOM 0 HE2 MET B 12 82.431 3.542 -3.254 1.00 0.00 H new ATOM 0 HE3 MET B 12 82.109 5.051 -2.368 1.00 0.00 H new ATOM 1818 N VAL B 13 81.636 8.232 -5.925 1.00 0.00 N ATOM 1819 CA VAL B 13 81.532 9.681 -5.609 1.00 0.00 C ATOM 1820 C VAL B 13 81.120 10.468 -6.857 1.00 0.00 C ATOM 1821 O VAL B 13 80.320 11.380 -6.789 1.00 0.00 O ATOM 1822 CB VAL B 13 82.896 10.165 -5.111 1.00 0.00 C ATOM 1823 CG1 VAL B 13 82.818 11.655 -4.757 1.00 0.00 C ATOM 1824 CG2 VAL B 13 83.311 9.347 -3.869 1.00 0.00 C ATOM 0 H VAL B 13 82.587 7.887 -6.055 1.00 0.00 H new ATOM 0 HA VAL B 13 80.775 9.839 -4.841 1.00 0.00 H new ATOM 0 HB VAL B 13 83.640 10.026 -5.895 1.00 0.00 H new ATOM 0 HG11 VAL B 13 83.791 11.996 -4.403 1.00 0.00 H new ATOM 0 HG12 VAL B 13 82.534 12.225 -5.642 1.00 0.00 H new ATOM 0 HG13 VAL B 13 82.074 11.805 -3.975 1.00 0.00 H new ATOM 0 HG21 VAL B 13 84.282 9.692 -3.514 1.00 0.00 H new ATOM 0 HG22 VAL B 13 82.569 9.480 -3.081 1.00 0.00 H new ATOM 0 HG23 VAL B 13 83.375 8.291 -4.133 1.00 0.00 H new ATOM 1834 N SER B 14 81.665 10.131 -7.992 1.00 0.00 N ATOM 1835 CA SER B 14 81.308 10.869 -9.235 1.00 0.00 C ATOM 1836 C SER B 14 79.844 10.608 -9.582 1.00 0.00 C ATOM 1837 O SER B 14 79.094 11.519 -9.874 1.00 0.00 O ATOM 1838 CB SER B 14 82.200 10.395 -10.378 1.00 0.00 C ATOM 1839 OG SER B 14 81.950 9.022 -10.631 1.00 0.00 O ATOM 0 H SER B 14 82.342 9.377 -8.113 1.00 0.00 H new ATOM 0 HA SER B 14 81.455 11.938 -9.080 1.00 0.00 H new ATOM 0 HB2 SER B 14 82.004 10.983 -11.275 1.00 0.00 H new ATOM 0 HB3 SER B 14 83.249 10.544 -10.122 1.00 0.00 H new ATOM 0 HG SER B 14 82.061 8.511 -9.802 1.00 0.00 H new ATOM 1845 N THR B 15 79.418 9.376 -9.544 1.00 0.00 N ATOM 1846 CA THR B 15 77.991 9.100 -9.865 1.00 0.00 C ATOM 1847 C THR B 15 77.117 9.810 -8.830 1.00 0.00 C ATOM 1848 O THR B 15 76.105 10.398 -9.144 1.00 0.00 O ATOM 1849 CB THR B 15 77.738 7.583 -9.841 1.00 0.00 C ATOM 1850 OG1 THR B 15 76.573 7.289 -10.600 1.00 0.00 O ATOM 1851 CG2 THR B 15 77.549 7.076 -8.406 1.00 0.00 C ATOM 0 H THR B 15 79.985 8.561 -9.309 1.00 0.00 H new ATOM 0 HA THR B 15 77.747 9.469 -10.861 1.00 0.00 H new ATOM 0 HB THR B 15 78.606 7.083 -10.271 1.00 0.00 H new ATOM 0 HG1 THR B 15 76.496 6.319 -10.719 1.00 0.00 H new ATOM 0 HG21 THR B 15 77.372 6.001 -8.420 1.00 0.00 H new ATOM 0 HG22 THR B 15 78.446 7.288 -7.824 1.00 0.00 H new ATOM 0 HG23 THR B 15 76.695 7.578 -7.952 1.00 0.00 H new ATOM 1859 N PHE B 16 77.523 9.754 -7.595 1.00 0.00 N ATOM 1860 CA PHE B 16 76.747 10.411 -6.505 1.00 0.00 C ATOM 1861 C PHE B 16 76.655 11.911 -6.780 1.00 0.00 C ATOM 1862 O PHE B 16 75.627 12.530 -6.588 1.00 0.00 O ATOM 1863 CB PHE B 16 77.476 10.163 -5.183 1.00 0.00 C ATOM 1864 CG PHE B 16 76.737 10.796 -4.028 1.00 0.00 C ATOM 1865 CD1 PHE B 16 76.942 12.144 -3.707 1.00 0.00 C ATOM 1866 CD2 PHE B 16 75.861 10.022 -3.261 1.00 0.00 C ATOM 1867 CE1 PHE B 16 76.266 12.716 -2.620 1.00 0.00 C ATOM 1868 CE2 PHE B 16 75.193 10.587 -2.174 1.00 0.00 C ATOM 1869 CZ PHE B 16 75.392 11.936 -1.853 1.00 0.00 C ATOM 0 H PHE B 16 78.370 9.275 -7.289 1.00 0.00 H new ATOM 0 HA PHE B 16 75.738 10.003 -6.454 1.00 0.00 H new ATOM 0 HB2 PHE B 16 77.573 9.091 -5.013 1.00 0.00 H new ATOM 0 HB3 PHE B 16 78.486 10.569 -5.239 1.00 0.00 H new ATOM 0 HD1 PHE B 16 77.621 12.743 -4.297 1.00 0.00 H new ATOM 0 HD2 PHE B 16 75.701 8.984 -3.511 1.00 0.00 H new ATOM 0 HE1 PHE B 16 76.419 13.757 -2.375 1.00 0.00 H new ATOM 0 HE2 PHE B 16 74.522 9.984 -1.580 1.00 0.00 H new ATOM 0 HZ PHE B 16 74.872 12.374 -1.014 1.00 0.00 H new ATOM 1879 N HIS B 17 77.724 12.495 -7.236 1.00 0.00 N ATOM 1880 CA HIS B 17 77.716 13.950 -7.542 1.00 0.00 C ATOM 1881 C HIS B 17 76.697 14.239 -8.650 1.00 0.00 C ATOM 1882 O HIS B 17 76.018 15.246 -8.639 1.00 0.00 O ATOM 1883 CB HIS B 17 79.111 14.394 -7.991 1.00 0.00 C ATOM 1884 CG HIS B 17 79.088 15.865 -8.302 1.00 0.00 C ATOM 1885 ND1 HIS B 17 78.653 16.809 -7.380 1.00 0.00 N ATOM 1886 CD2 HIS B 17 79.434 16.570 -9.428 1.00 0.00 C ATOM 1887 CE1 HIS B 17 78.745 18.017 -7.964 1.00 0.00 C ATOM 1888 NE2 HIS B 17 79.214 17.925 -9.209 1.00 0.00 N ATOM 0 H HIS B 17 78.611 12.023 -7.412 1.00 0.00 H new ATOM 0 HA HIS B 17 77.438 14.503 -6.645 1.00 0.00 H new ATOM 0 HB2 HIS B 17 79.841 14.188 -7.208 1.00 0.00 H new ATOM 0 HB3 HIS B 17 79.419 13.829 -8.871 1.00 0.00 H new ATOM 0 HD2 HIS B 17 79.817 16.139 -10.341 1.00 0.00 H new ATOM 0 HE1 HIS B 17 78.473 18.946 -7.485 1.00 0.00 H new ATOM 0 HE2 HIS B 17 79.377 18.690 -9.864 1.00 0.00 H new ATOM 1897 N LYS B 18 76.606 13.370 -9.617 1.00 0.00 N ATOM 1898 CA LYS B 18 75.655 13.597 -10.743 1.00 0.00 C ATOM 1899 C LYS B 18 74.218 13.677 -10.217 1.00 0.00 C ATOM 1900 O LYS B 18 73.435 14.498 -10.652 1.00 0.00 O ATOM 1901 CB LYS B 18 75.778 12.439 -11.729 1.00 0.00 C ATOM 1902 CG LYS B 18 74.908 12.710 -12.955 1.00 0.00 C ATOM 1903 CD LYS B 18 75.073 11.558 -13.947 1.00 0.00 C ATOM 1904 CE LYS B 18 74.272 11.851 -15.214 1.00 0.00 C ATOM 1905 NZ LYS B 18 74.463 10.743 -16.191 1.00 0.00 N ATOM 0 H LYS B 18 77.150 12.509 -9.677 1.00 0.00 H new ATOM 0 HA LYS B 18 75.895 14.538 -11.238 1.00 0.00 H new ATOM 0 HB2 LYS B 18 76.818 12.314 -12.030 1.00 0.00 H new ATOM 0 HB3 LYS B 18 75.471 11.509 -11.252 1.00 0.00 H new ATOM 0 HG2 LYS B 18 73.863 12.807 -12.661 1.00 0.00 H new ATOM 0 HG3 LYS B 18 75.197 13.652 -13.421 1.00 0.00 H new ATOM 0 HD2 LYS B 18 76.126 11.426 -14.194 1.00 0.00 H new ATOM 0 HD3 LYS B 18 74.732 10.626 -13.497 1.00 0.00 H new ATOM 0 HE2 LYS B 18 73.215 11.958 -14.972 1.00 0.00 H new ATOM 0 HE3 LYS B 18 74.596 12.795 -15.651 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 73.917 10.943 -17.054 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 75.472 10.661 -16.430 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 74.133 9.850 -15.772 1.00 0.00 H new ATOM 1919 N TYR B 19 73.864 12.841 -9.279 1.00 0.00 N ATOM 1920 CA TYR B 19 72.476 12.891 -8.732 1.00 0.00 C ATOM 1921 C TYR B 19 72.283 14.212 -7.986 1.00 0.00 C ATOM 1922 O TYR B 19 71.246 14.840 -8.070 1.00 0.00 O ATOM 1923 CB TYR B 19 72.241 11.708 -7.783 1.00 0.00 C ATOM 1924 CG TYR B 19 71.954 10.450 -8.586 1.00 0.00 C ATOM 1925 CD1 TYR B 19 70.654 10.200 -9.044 1.00 0.00 C ATOM 1926 CD2 TYR B 19 72.982 9.544 -8.873 1.00 0.00 C ATOM 1927 CE1 TYR B 19 70.382 9.048 -9.789 1.00 0.00 C ATOM 1928 CE2 TYR B 19 72.714 8.390 -9.623 1.00 0.00 C ATOM 1929 CZ TYR B 19 71.409 8.144 -10.081 1.00 0.00 C ATOM 1930 OH TYR B 19 71.136 7.013 -10.825 1.00 0.00 O ATOM 0 H TYR B 19 74.470 12.130 -8.870 1.00 0.00 H new ATOM 0 HA TYR B 19 71.757 12.825 -9.549 1.00 0.00 H new ATOM 0 HB2 TYR B 19 73.118 11.556 -7.153 1.00 0.00 H new ATOM 0 HB3 TYR B 19 71.405 11.924 -7.118 1.00 0.00 H new ATOM 0 HD1 TYR B 19 69.860 10.898 -8.821 1.00 0.00 H new ATOM 0 HD2 TYR B 19 73.983 9.734 -8.516 1.00 0.00 H new ATOM 0 HE1 TYR B 19 69.378 8.856 -10.139 1.00 0.00 H new ATOM 0 HE2 TYR B 19 73.508 7.693 -9.848 1.00 0.00 H new ATOM 0 HH TYR B 19 71.784 6.938 -11.556 1.00 0.00 H new ATOM 1940 N SER B 20 73.278 14.640 -7.264 1.00 0.00 N ATOM 1941 CA SER B 20 73.164 15.924 -6.521 1.00 0.00 C ATOM 1942 C SER B 20 72.905 17.045 -7.522 1.00 0.00 C ATOM 1943 O SER B 20 72.449 18.115 -7.172 1.00 0.00 O ATOM 1944 CB SER B 20 74.471 16.203 -5.778 1.00 0.00 C ATOM 1945 OG SER B 20 74.413 17.497 -5.189 1.00 0.00 O ATOM 0 H SER B 20 74.169 14.155 -7.156 1.00 0.00 H new ATOM 0 HA SER B 20 72.347 15.865 -5.802 1.00 0.00 H new ATOM 0 HB2 SER B 20 74.633 15.448 -5.009 1.00 0.00 H new ATOM 0 HB3 SER B 20 75.314 16.142 -6.467 1.00 0.00 H new ATOM 0 HG SER B 20 74.760 18.160 -5.822 1.00 0.00 H new ATOM 1951 N GLY B 21 73.195 16.807 -8.769 1.00 0.00 N ATOM 1952 CA GLY B 21 72.965 17.866 -9.794 1.00 0.00 C ATOM 1953 C GLY B 21 71.461 18.057 -9.995 1.00 0.00 C ATOM 1954 O GLY B 21 70.997 19.140 -10.288 1.00 0.00 O ATOM 0 H GLY B 21 73.579 15.931 -9.124 1.00 0.00 H new ATOM 0 HA2 GLY B 21 73.423 18.802 -9.475 1.00 0.00 H new ATOM 0 HA3 GLY B 21 73.437 17.585 -10.736 1.00 0.00 H new ATOM 1958 N LYS B 22 70.699 17.010 -9.847 1.00 0.00 N ATOM 1959 CA LYS B 22 69.226 17.127 -10.035 1.00 0.00 C ATOM 1960 C LYS B 22 68.659 18.127 -9.029 1.00 0.00 C ATOM 1961 O LYS B 22 67.884 19.000 -9.372 1.00 0.00 O ATOM 1962 CB LYS B 22 68.580 15.764 -9.786 1.00 0.00 C ATOM 1963 CG LYS B 22 69.161 14.739 -10.760 1.00 0.00 C ATOM 1964 CD LYS B 22 68.299 13.471 -10.761 1.00 0.00 C ATOM 1965 CE LYS B 22 68.066 12.989 -9.326 1.00 0.00 C ATOM 1966 NZ LYS B 22 67.601 11.572 -9.346 1.00 0.00 N ATOM 0 H LYS B 22 71.033 16.077 -9.604 1.00 0.00 H new ATOM 0 HA LYS B 22 69.017 17.465 -11.050 1.00 0.00 H new ATOM 0 HB2 LYS B 22 68.759 15.447 -8.759 1.00 0.00 H new ATOM 0 HB3 LYS B 22 67.500 15.833 -9.915 1.00 0.00 H new ATOM 0 HG2 LYS B 22 69.202 15.162 -11.764 1.00 0.00 H new ATOM 0 HG3 LYS B 22 70.184 14.493 -10.475 1.00 0.00 H new ATOM 0 HD2 LYS B 22 67.343 13.673 -11.244 1.00 0.00 H new ATOM 0 HD3 LYS B 22 68.790 12.689 -11.340 1.00 0.00 H new ATOM 0 HE2 LYS B 22 68.987 13.072 -8.749 1.00 0.00 H new ATOM 0 HE3 LYS B 22 67.324 13.619 -8.835 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 67.508 11.223 -8.371 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 66.679 11.516 -9.823 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 68.292 10.987 -9.858 1.00 0.00 H new ATOM 1980 N GLU B 23 69.036 18.001 -7.783 1.00 0.00 N ATOM 1981 CA GLU B 23 68.515 18.930 -6.737 1.00 0.00 C ATOM 1982 C GLU B 23 69.448 20.144 -6.621 1.00 0.00 C ATOM 1983 O GLU B 23 69.138 21.218 -7.098 1.00 0.00 O ATOM 1984 CB GLU B 23 68.442 18.184 -5.395 1.00 0.00 C ATOM 1985 CG GLU B 23 67.470 18.900 -4.453 1.00 0.00 C ATOM 1986 CD GLU B 23 68.024 20.286 -4.117 1.00 0.00 C ATOM 1987 OE1 GLU B 23 69.138 20.354 -3.626 1.00 0.00 O ATOM 1988 OE2 GLU B 23 67.326 21.255 -4.363 1.00 0.00 O ATOM 0 H GLU B 23 69.685 17.291 -7.444 1.00 0.00 H new ATOM 0 HA GLU B 23 67.518 19.278 -7.009 1.00 0.00 H new ATOM 0 HB2 GLU B 23 68.115 17.157 -5.557 1.00 0.00 H new ATOM 0 HB3 GLU B 23 69.432 18.135 -4.942 1.00 0.00 H new ATOM 0 HG2 GLU B 23 66.490 18.991 -4.922 1.00 0.00 H new ATOM 0 HG3 GLU B 23 67.334 18.319 -3.541 1.00 0.00 H new ATOM 1995 N GLY B 24 70.587 19.986 -5.995 1.00 0.00 N ATOM 1996 CA GLY B 24 71.534 21.135 -5.858 1.00 0.00 C ATOM 1997 C GLY B 24 72.371 20.948 -4.594 1.00 0.00 C ATOM 1998 O GLY B 24 73.516 21.352 -4.530 1.00 0.00 O ATOM 0 H GLY B 24 70.902 19.112 -5.573 1.00 0.00 H new ATOM 0 HA2 GLY B 24 72.182 21.194 -6.732 1.00 0.00 H new ATOM 0 HA3 GLY B 24 70.981 22.073 -5.807 1.00 0.00 H new ATOM 2002 N ASP B 25 71.807 20.338 -3.585 1.00 0.00 N ATOM 2003 CA ASP B 25 72.564 20.123 -2.319 1.00 0.00 C ATOM 2004 C ASP B 25 73.409 18.847 -2.429 1.00 0.00 C ATOM 2005 O ASP B 25 72.890 17.752 -2.511 1.00 0.00 O ATOM 2006 CB ASP B 25 71.578 19.981 -1.155 1.00 0.00 C ATOM 2007 CG ASP B 25 70.654 18.786 -1.403 1.00 0.00 C ATOM 2008 OD1 ASP B 25 70.374 18.506 -2.556 1.00 0.00 O ATOM 2009 OD2 ASP B 25 70.240 18.174 -0.433 1.00 0.00 O ATOM 0 H ASP B 25 70.852 19.979 -3.584 1.00 0.00 H new ATOM 0 HA ASP B 25 73.220 20.975 -2.143 1.00 0.00 H new ATOM 0 HB2 ASP B 25 72.122 19.845 -0.220 1.00 0.00 H new ATOM 0 HB3 ASP B 25 70.989 20.893 -1.051 1.00 0.00 H new ATOM 2014 N LYS B 26 74.710 18.986 -2.431 1.00 0.00 N ATOM 2015 CA LYS B 26 75.610 17.792 -2.530 1.00 0.00 C ATOM 2016 C LYS B 26 76.101 17.398 -1.139 1.00 0.00 C ATOM 2017 O LYS B 26 76.866 16.470 -0.979 1.00 0.00 O ATOM 2018 CB LYS B 26 76.813 18.118 -3.420 1.00 0.00 C ATOM 2019 CG LYS B 26 77.605 19.292 -2.823 1.00 0.00 C ATOM 2020 CD LYS B 26 78.716 19.731 -3.796 1.00 0.00 C ATOM 2021 CE LYS B 26 78.149 20.671 -4.870 1.00 0.00 C ATOM 2022 NZ LYS B 26 77.556 21.870 -4.213 1.00 0.00 N ATOM 0 H LYS B 26 75.193 19.882 -2.368 1.00 0.00 H new ATOM 0 HA LYS B 26 75.052 16.964 -2.966 1.00 0.00 H new ATOM 0 HB2 LYS B 26 77.457 17.243 -3.511 1.00 0.00 H new ATOM 0 HB3 LYS B 26 76.475 18.370 -4.425 1.00 0.00 H new ATOM 0 HG2 LYS B 26 76.935 20.128 -2.623 1.00 0.00 H new ATOM 0 HG3 LYS B 26 78.042 18.998 -1.869 1.00 0.00 H new ATOM 0 HD2 LYS B 26 79.511 20.235 -3.246 1.00 0.00 H new ATOM 0 HD3 LYS B 26 79.161 18.855 -4.269 1.00 0.00 H new ATOM 0 HE2 LYS B 26 78.938 20.973 -5.559 1.00 0.00 H new ATOM 0 HE3 LYS B 26 77.392 20.154 -5.459 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 77.869 22.728 -4.710 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 76.518 21.808 -4.249 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 77.867 21.912 -3.221 1.00 0.00 H new ATOM 2036 N PHE B 27 75.678 18.105 -0.129 1.00 0.00 N ATOM 2037 CA PHE B 27 76.133 17.776 1.250 1.00 0.00 C ATOM 2038 C PHE B 27 75.255 16.670 1.841 1.00 0.00 C ATOM 2039 O PHE B 27 75.568 16.106 2.871 1.00 0.00 O ATOM 2040 CB PHE B 27 76.014 19.024 2.123 1.00 0.00 C ATOM 2041 CG PHE B 27 76.892 20.115 1.563 1.00 0.00 C ATOM 2042 CD1 PHE B 27 78.261 20.121 1.850 1.00 0.00 C ATOM 2043 CD2 PHE B 27 76.339 21.120 0.760 1.00 0.00 C ATOM 2044 CE1 PHE B 27 79.080 21.131 1.338 1.00 0.00 C ATOM 2045 CE2 PHE B 27 77.161 22.132 0.245 1.00 0.00 C ATOM 2046 CZ PHE B 27 78.531 22.137 0.534 1.00 0.00 C ATOM 0 H PHE B 27 75.037 18.896 -0.199 1.00 0.00 H new ATOM 0 HA PHE B 27 77.168 17.435 1.216 1.00 0.00 H new ATOM 0 HB2 PHE B 27 74.977 19.359 2.158 1.00 0.00 H new ATOM 0 HB3 PHE B 27 76.309 18.794 3.147 1.00 0.00 H new ATOM 0 HD1 PHE B 27 78.686 19.344 2.468 1.00 0.00 H new ATOM 0 HD2 PHE B 27 75.282 21.115 0.538 1.00 0.00 H new ATOM 0 HE1 PHE B 27 80.136 21.135 1.563 1.00 0.00 H new ATOM 0 HE2 PHE B 27 76.737 22.908 -0.375 1.00 0.00 H new ATOM 0 HZ PHE B 27 79.164 22.917 0.137 1.00 0.00 H new ATOM 2056 N LYS B 28 74.155 16.351 1.208 1.00 0.00 N ATOM 2057 CA LYS B 28 73.279 15.282 1.766 1.00 0.00 C ATOM 2058 C LYS B 28 72.381 14.692 0.676 1.00 0.00 C ATOM 2059 O LYS B 28 72.123 15.306 -0.340 1.00 0.00 O ATOM 2060 CB LYS B 28 72.408 15.884 2.872 1.00 0.00 C ATOM 2061 CG LYS B 28 71.548 17.010 2.292 1.00 0.00 C ATOM 2062 CD LYS B 28 70.874 17.776 3.433 1.00 0.00 C ATOM 2063 CE LYS B 28 69.927 18.830 2.855 1.00 0.00 C ATOM 2064 NZ LYS B 28 68.823 18.156 2.113 1.00 0.00 N ATOM 0 H LYS B 28 73.830 16.779 0.341 1.00 0.00 H new ATOM 0 HA LYS B 28 73.904 14.484 2.167 1.00 0.00 H new ATOM 0 HB2 LYS B 28 71.771 15.114 3.307 1.00 0.00 H new ATOM 0 HB3 LYS B 28 73.037 16.269 3.675 1.00 0.00 H new ATOM 0 HG2 LYS B 28 72.166 17.686 1.701 1.00 0.00 H new ATOM 0 HG3 LYS B 28 70.794 16.598 1.621 1.00 0.00 H new ATOM 0 HD2 LYS B 28 70.321 17.086 4.071 1.00 0.00 H new ATOM 0 HD3 LYS B 28 71.628 18.254 4.059 1.00 0.00 H new ATOM 0 HE2 LYS B 28 69.518 19.445 3.657 1.00 0.00 H new ATOM 0 HE3 LYS B 28 70.473 19.498 2.188 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 67.960 18.733 2.175 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 69.093 18.044 1.115 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 68.645 17.220 2.531 1.00 0.00 H new ATOM 2078 N LEU B 29 71.884 13.504 0.910 1.00 0.00 N ATOM 2079 CA LEU B 29 70.973 12.830 -0.070 1.00 0.00 C ATOM 2080 C LEU B 29 69.734 12.375 0.706 1.00 0.00 C ATOM 2081 O LEU B 29 69.801 12.059 1.877 1.00 0.00 O ATOM 2082 CB LEU B 29 71.703 11.613 -0.713 1.00 0.00 C ATOM 2083 CG LEU B 29 71.976 11.811 -2.219 1.00 0.00 C ATOM 2084 CD1 LEU B 29 70.687 11.565 -2.993 1.00 0.00 C ATOM 2085 CD2 LEU B 29 72.538 13.214 -2.525 1.00 0.00 C ATOM 0 H LEU B 29 72.073 12.962 1.753 1.00 0.00 H new ATOM 0 HA LEU B 29 70.685 13.506 -0.875 1.00 0.00 H new ATOM 0 HB2 LEU B 29 72.648 11.446 -0.195 1.00 0.00 H new ATOM 0 HB3 LEU B 29 71.099 10.716 -0.572 1.00 0.00 H new ATOM 0 HG LEU B 29 72.737 11.095 -2.530 1.00 0.00 H new ATOM 0 HD11 LEU B 29 70.871 11.703 -4.059 1.00 0.00 H new ATOM 0 HD12 LEU B 29 70.343 10.547 -2.813 1.00 0.00 H new ATOM 0 HD13 LEU B 29 69.924 12.270 -2.662 1.00 0.00 H new ATOM 0 HD21 LEU B 29 72.715 13.309 -3.596 1.00 0.00 H new ATOM 0 HD22 LEU B 29 71.821 13.971 -2.207 1.00 0.00 H new ATOM 0 HD23 LEU B 29 73.476 13.355 -1.988 1.00 0.00 H new ATOM 2097 N ASN B 30 68.604 12.356 0.064 1.00 0.00 N ATOM 2098 CA ASN B 30 67.354 11.938 0.748 1.00 0.00 C ATOM 2099 C ASN B 30 67.161 10.429 0.592 1.00 0.00 C ATOM 2100 O ASN B 30 67.407 9.858 -0.445 1.00 0.00 O ATOM 2101 CB ASN B 30 66.168 12.673 0.118 1.00 0.00 C ATOM 2102 CG ASN B 30 66.223 14.155 0.497 1.00 0.00 C ATOM 2103 OD1 ASN B 30 66.779 14.513 1.518 1.00 0.00 O ATOM 2104 ND2 ASN B 30 65.669 15.039 -0.287 1.00 0.00 N ATOM 0 H ASN B 30 68.492 12.615 -0.916 1.00 0.00 H new ATOM 0 HA ASN B 30 67.418 12.183 1.808 1.00 0.00 H new ATOM 0 HB2 ASN B 30 66.193 12.563 -0.966 1.00 0.00 H new ATOM 0 HB3 ASN B 30 65.231 12.234 0.461 1.00 0.00 H new ATOM 0 HD21 ASN B 30 65.703 16.029 -0.043 1.00 0.00 H new ATOM 0 HD22 ASN B 30 65.203 14.740 -1.143 1.00 0.00 H new ATOM 2111 N LYS B 31 66.715 9.787 1.618 1.00 0.00 N ATOM 2112 CA LYS B 31 66.492 8.319 1.553 1.00 0.00 C ATOM 2113 C LYS B 31 65.548 7.989 0.395 1.00 0.00 C ATOM 2114 O LYS B 31 65.665 6.966 -0.236 1.00 0.00 O ATOM 2115 CB LYS B 31 65.885 7.871 2.883 1.00 0.00 C ATOM 2116 CG LYS B 31 66.953 7.930 3.994 1.00 0.00 C ATOM 2117 CD LYS B 31 67.737 6.614 4.045 1.00 0.00 C ATOM 2118 CE LYS B 31 68.852 6.735 5.082 1.00 0.00 C ATOM 2119 NZ LYS B 31 69.458 5.398 5.325 1.00 0.00 N ATOM 0 H LYS B 31 66.490 10.217 2.515 1.00 0.00 H new ATOM 0 HA LYS B 31 67.433 7.797 1.382 1.00 0.00 H new ATOM 0 HB2 LYS B 31 65.042 8.512 3.142 1.00 0.00 H new ATOM 0 HB3 LYS B 31 65.498 6.856 2.792 1.00 0.00 H new ATOM 0 HG2 LYS B 31 67.634 8.761 3.810 1.00 0.00 H new ATOM 0 HG3 LYS B 31 66.477 8.116 4.957 1.00 0.00 H new ATOM 0 HD2 LYS B 31 67.072 5.790 4.303 1.00 0.00 H new ATOM 0 HD3 LYS B 31 68.158 6.389 3.065 1.00 0.00 H new ATOM 0 HE2 LYS B 31 69.613 7.432 4.732 1.00 0.00 H new ATOM 0 HE3 LYS B 31 68.454 7.139 6.013 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 70.387 5.515 5.778 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 68.837 4.843 5.947 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 69.575 4.900 4.419 1.00 0.00 H new ATOM 2133 N SER B 32 64.632 8.846 0.077 1.00 0.00 N ATOM 2134 CA SER B 32 63.743 8.536 -1.069 1.00 0.00 C ATOM 2135 C SER B 32 64.620 8.395 -2.301 1.00 0.00 C ATOM 2136 O SER B 32 64.416 7.531 -3.131 1.00 0.00 O ATOM 2137 CB SER B 32 62.727 9.639 -1.301 1.00 0.00 C ATOM 2138 OG SER B 32 63.392 10.889 -1.416 1.00 0.00 O ATOM 0 H SER B 32 64.459 9.733 0.549 1.00 0.00 H new ATOM 0 HA SER B 32 63.191 7.619 -0.861 1.00 0.00 H new ATOM 0 HB2 SER B 32 62.156 9.436 -2.207 1.00 0.00 H new ATOM 0 HB3 SER B 32 62.015 9.670 -0.476 1.00 0.00 H new ATOM 0 HG SER B 32 62.732 11.598 -1.567 1.00 0.00 H new ATOM 2144 N GLU B 33 65.618 9.230 -2.416 1.00 0.00 N ATOM 2145 CA GLU B 33 66.522 9.124 -3.581 1.00 0.00 C ATOM 2146 C GLU B 33 67.143 7.750 -3.544 1.00 0.00 C ATOM 2147 O GLU B 33 67.566 7.237 -4.550 1.00 0.00 O ATOM 2148 CB GLU B 33 67.599 10.210 -3.535 1.00 0.00 C ATOM 2149 CG GLU B 33 66.954 11.575 -3.779 1.00 0.00 C ATOM 2150 CD GLU B 33 66.493 11.669 -5.232 1.00 0.00 C ATOM 2151 OE1 GLU B 33 67.104 11.027 -6.068 1.00 0.00 O ATOM 2152 OE2 GLU B 33 65.537 12.384 -5.483 1.00 0.00 O ATOM 0 H GLU B 33 65.840 9.974 -1.755 1.00 0.00 H new ATOM 0 HA GLU B 33 65.967 9.267 -4.508 1.00 0.00 H new ATOM 0 HB2 GLU B 33 68.100 10.200 -2.567 1.00 0.00 H new ATOM 0 HB3 GLU B 33 68.360 10.015 -4.290 1.00 0.00 H new ATOM 0 HG2 GLU B 33 66.106 11.714 -3.108 1.00 0.00 H new ATOM 0 HG3 GLU B 33 67.667 12.370 -3.560 1.00 0.00 H new ATOM 2159 N LEU B 34 67.183 7.114 -2.404 1.00 0.00 N ATOM 2160 CA LEU B 34 67.760 5.742 -2.414 1.00 0.00 C ATOM 2161 C LEU B 34 66.899 4.924 -3.358 1.00 0.00 C ATOM 2162 O LEU B 34 67.393 4.161 -4.156 1.00 0.00 O ATOM 2163 CB LEU B 34 67.758 5.107 -1.002 1.00 0.00 C ATOM 2164 CG LEU B 34 68.273 3.642 -1.022 1.00 0.00 C ATOM 2165 CD1 LEU B 34 67.209 2.664 -1.599 1.00 0.00 C ATOM 2166 CD2 LEU B 34 69.576 3.557 -1.831 1.00 0.00 C ATOM 0 H LEU B 34 66.857 7.466 -1.504 1.00 0.00 H new ATOM 0 HA LEU B 34 68.801 5.772 -2.737 1.00 0.00 H new ATOM 0 HB2 LEU B 34 68.383 5.702 -0.336 1.00 0.00 H new ATOM 0 HB3 LEU B 34 66.747 5.130 -0.595 1.00 0.00 H new ATOM 0 HG LEU B 34 68.467 3.340 0.007 1.00 0.00 H new ATOM 0 HD11 LEU B 34 67.608 1.650 -1.596 1.00 0.00 H new ATOM 0 HD12 LEU B 34 66.309 2.702 -0.985 1.00 0.00 H new ATOM 0 HD13 LEU B 34 66.964 2.954 -2.621 1.00 0.00 H new ATOM 0 HD21 LEU B 34 69.932 2.527 -1.841 1.00 0.00 H new ATOM 0 HD22 LEU B 34 69.392 3.887 -2.853 1.00 0.00 H new ATOM 0 HD23 LEU B 34 70.331 4.197 -1.374 1.00 0.00 H new ATOM 2178 N LYS B 35 65.606 5.098 -3.304 1.00 0.00 N ATOM 2179 CA LYS B 35 64.743 4.324 -4.235 1.00 0.00 C ATOM 2180 C LYS B 35 64.999 4.751 -5.679 1.00 0.00 C ATOM 2181 O LYS B 35 65.244 3.933 -6.545 1.00 0.00 O ATOM 2182 CB LYS B 35 63.274 4.574 -3.888 1.00 0.00 C ATOM 2183 CG LYS B 35 62.373 3.696 -4.755 1.00 0.00 C ATOM 2184 CD LYS B 35 60.915 3.951 -4.380 1.00 0.00 C ATOM 2185 CE LYS B 35 60.015 3.012 -5.179 1.00 0.00 C ATOM 2186 NZ LYS B 35 59.968 3.464 -6.596 1.00 0.00 N ATOM 0 H LYS B 35 65.119 5.730 -2.668 1.00 0.00 H new ATOM 0 HA LYS B 35 64.976 3.264 -4.133 1.00 0.00 H new ATOM 0 HB2 LYS B 35 63.099 4.358 -2.834 1.00 0.00 H new ATOM 0 HB3 LYS B 35 63.029 5.625 -4.043 1.00 0.00 H new ATOM 0 HG2 LYS B 35 62.534 3.918 -5.810 1.00 0.00 H new ATOM 0 HG3 LYS B 35 62.620 2.644 -4.609 1.00 0.00 H new ATOM 0 HD2 LYS B 35 60.769 3.791 -3.312 1.00 0.00 H new ATOM 0 HD3 LYS B 35 60.651 4.988 -4.586 1.00 0.00 H new ATOM 0 HE2 LYS B 35 60.394 1.991 -5.123 1.00 0.00 H new ATOM 0 HE3 LYS B 35 59.011 3.003 -4.755 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 59.219 2.948 -7.100 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 59.768 4.484 -6.629 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 60.884 3.276 -7.051 1.00 0.00 H new ATOM 2200 N GLU B 36 64.933 6.020 -5.950 1.00 0.00 N ATOM 2201 CA GLU B 36 65.159 6.493 -7.344 1.00 0.00 C ATOM 2202 C GLU B 36 66.624 6.347 -7.733 1.00 0.00 C ATOM 2203 O GLU B 36 66.943 5.975 -8.842 1.00 0.00 O ATOM 2204 CB GLU B 36 64.740 7.963 -7.453 1.00 0.00 C ATOM 2205 CG GLU B 36 65.136 8.524 -8.825 1.00 0.00 C ATOM 2206 CD GLU B 36 64.504 9.904 -9.010 1.00 0.00 C ATOM 2207 OE1 GLU B 36 63.802 10.336 -8.111 1.00 0.00 O ATOM 2208 OE2 GLU B 36 64.742 10.510 -10.042 1.00 0.00 O ATOM 0 H GLU B 36 64.733 6.752 -5.269 1.00 0.00 H new ATOM 0 HA GLU B 36 64.561 5.885 -8.023 1.00 0.00 H new ATOM 0 HB2 GLU B 36 63.663 8.054 -7.312 1.00 0.00 H new ATOM 0 HB3 GLU B 36 65.215 8.544 -6.663 1.00 0.00 H new ATOM 0 HG2 GLU B 36 66.221 8.595 -8.902 1.00 0.00 H new ATOM 0 HG3 GLU B 36 64.804 7.851 -9.615 1.00 0.00 H new ATOM 2215 N LEU B 37 67.517 6.651 -6.845 1.00 0.00 N ATOM 2216 CA LEU B 37 68.945 6.540 -7.191 1.00 0.00 C ATOM 2217 C LEU B 37 69.280 5.064 -7.342 1.00 0.00 C ATOM 2218 O LEU B 37 70.095 4.686 -8.158 1.00 0.00 O ATOM 2219 CB LEU B 37 69.790 7.196 -6.081 1.00 0.00 C ATOM 2220 CG LEU B 37 71.273 7.350 -6.519 1.00 0.00 C ATOM 2221 CD1 LEU B 37 71.866 8.634 -5.910 1.00 0.00 C ATOM 2222 CD2 LEU B 37 72.104 6.150 -6.039 1.00 0.00 C ATOM 0 H LEU B 37 67.318 6.971 -5.897 1.00 0.00 H new ATOM 0 HA LEU B 37 69.165 7.054 -8.127 1.00 0.00 H new ATOM 0 HB2 LEU B 37 69.377 8.175 -5.837 1.00 0.00 H new ATOM 0 HB3 LEU B 37 69.737 6.592 -5.175 1.00 0.00 H new ATOM 0 HG LEU B 37 71.304 7.401 -7.607 1.00 0.00 H new ATOM 0 HD11 LEU B 37 72.906 8.737 -6.220 1.00 0.00 H new ATOM 0 HD12 LEU B 37 71.297 9.497 -6.256 1.00 0.00 H new ATOM 0 HD13 LEU B 37 71.816 8.578 -4.823 1.00 0.00 H new ATOM 0 HD21 LEU B 37 73.140 6.275 -6.355 1.00 0.00 H new ATOM 0 HD22 LEU B 37 72.061 6.089 -4.952 1.00 0.00 H new ATOM 0 HD23 LEU B 37 71.702 5.233 -6.470 1.00 0.00 H new ATOM 2234 N LEU B 38 68.662 4.218 -6.563 1.00 0.00 N ATOM 2235 CA LEU B 38 68.980 2.762 -6.696 1.00 0.00 C ATOM 2236 C LEU B 38 68.587 2.254 -8.088 1.00 0.00 C ATOM 2237 O LEU B 38 69.357 1.595 -8.750 1.00 0.00 O ATOM 2238 CB LEU B 38 68.226 1.964 -5.611 1.00 0.00 C ATOM 2239 CG LEU B 38 68.472 0.439 -5.720 1.00 0.00 C ATOM 2240 CD1 LEU B 38 67.744 -0.178 -6.934 1.00 0.00 C ATOM 2241 CD2 LEU B 38 69.980 0.152 -5.807 1.00 0.00 C ATOM 0 H LEU B 38 67.967 4.460 -5.856 1.00 0.00 H new ATOM 0 HA LEU B 38 70.053 2.622 -6.566 1.00 0.00 H new ATOM 0 HB2 LEU B 38 68.539 2.310 -4.626 1.00 0.00 H new ATOM 0 HB3 LEU B 38 67.158 2.164 -5.694 1.00 0.00 H new ATOM 0 HG LEU B 38 68.064 -0.025 -4.822 1.00 0.00 H new ATOM 0 HD11 LEU B 38 67.944 -1.249 -6.972 1.00 0.00 H new ATOM 0 HD12 LEU B 38 66.671 -0.012 -6.838 1.00 0.00 H new ATOM 0 HD13 LEU B 38 68.103 0.291 -7.850 1.00 0.00 H new ATOM 0 HD21 LEU B 38 70.142 -0.923 -5.883 1.00 0.00 H new ATOM 0 HD22 LEU B 38 70.394 0.645 -6.687 1.00 0.00 H new ATOM 0 HD23 LEU B 38 70.475 0.531 -4.913 1.00 0.00 H new ATOM 2253 N THR B 39 67.387 2.522 -8.526 1.00 0.00 N ATOM 2254 CA THR B 39 66.951 1.997 -9.857 1.00 0.00 C ATOM 2255 C THR B 39 67.517 2.815 -11.000 1.00 0.00 C ATOM 2256 O THR B 39 67.755 2.309 -12.079 1.00 0.00 O ATOM 2257 CB THR B 39 65.431 2.051 -9.948 1.00 0.00 C ATOM 2258 OG1 THR B 39 65.005 3.406 -9.979 1.00 0.00 O ATOM 2259 CG2 THR B 39 64.851 1.361 -8.734 1.00 0.00 C ATOM 0 H THR B 39 66.692 3.077 -8.026 1.00 0.00 H new ATOM 0 HA THR B 39 67.318 0.974 -9.941 1.00 0.00 H new ATOM 0 HB THR B 39 65.092 1.552 -10.856 1.00 0.00 H new ATOM 0 HG1 THR B 39 64.027 3.440 -10.039 1.00 0.00 H new ATOM 0 HG21 THR B 39 63.763 1.391 -8.784 1.00 0.00 H new ATOM 0 HG22 THR B 39 65.185 0.324 -8.711 1.00 0.00 H new ATOM 0 HG23 THR B 39 65.187 1.870 -7.831 1.00 0.00 H new ATOM 2267 N ARG B 40 67.704 4.075 -10.797 1.00 0.00 N ATOM 2268 CA ARG B 40 68.215 4.908 -11.902 1.00 0.00 C ATOM 2269 C ARG B 40 69.652 4.520 -12.214 1.00 0.00 C ATOM 2270 O ARG B 40 70.089 4.579 -13.345 1.00 0.00 O ATOM 2271 CB ARG B 40 68.138 6.385 -11.524 1.00 0.00 C ATOM 2272 CG ARG B 40 66.671 6.844 -11.574 1.00 0.00 C ATOM 2273 CD ARG B 40 66.164 6.903 -13.038 1.00 0.00 C ATOM 2274 NE ARG B 40 65.155 5.828 -13.258 1.00 0.00 N ATOM 2275 CZ ARG B 40 64.387 5.858 -14.317 1.00 0.00 C ATOM 2276 NH1 ARG B 40 64.500 6.830 -15.183 1.00 0.00 N ATOM 2277 NH2 ARG B 40 63.507 4.913 -14.512 1.00 0.00 N ATOM 0 H ARG B 40 67.527 4.564 -9.920 1.00 0.00 H new ATOM 0 HA ARG B 40 67.602 4.743 -12.788 1.00 0.00 H new ATOM 0 HB2 ARG B 40 68.546 6.539 -10.525 1.00 0.00 H new ATOM 0 HB3 ARG B 40 68.741 6.980 -12.210 1.00 0.00 H new ATOM 0 HG2 ARG B 40 66.051 6.159 -10.997 1.00 0.00 H new ATOM 0 HG3 ARG B 40 66.576 7.826 -11.111 1.00 0.00 H new ATOM 0 HD2 ARG B 40 65.722 7.878 -13.242 1.00 0.00 H new ATOM 0 HD3 ARG B 40 66.998 6.780 -13.728 1.00 0.00 H new ATOM 0 HE ARG B 40 65.063 5.069 -12.583 1.00 0.00 H new ATOM 0 HH11 ARG B 40 65.188 7.568 -15.034 1.00 0.00 H new ATOM 0 HH12 ARG B 40 63.900 6.851 -16.008 1.00 0.00 H new ATOM 0 HH21 ARG B 40 63.418 4.152 -13.839 1.00 0.00 H new ATOM 0 HH22 ARG B 40 62.908 4.936 -15.337 1.00 0.00 H new ATOM 2291 N GLU B 41 70.393 4.120 -11.216 1.00 0.00 N ATOM 2292 CA GLU B 41 71.814 3.722 -11.454 1.00 0.00 C ATOM 2293 C GLU B 41 71.886 2.219 -11.569 1.00 0.00 C ATOM 2294 O GLU B 41 72.808 1.672 -12.140 1.00 0.00 O ATOM 2295 CB GLU B 41 72.674 4.197 -10.281 1.00 0.00 C ATOM 2296 CG GLU B 41 74.154 4.043 -10.624 1.00 0.00 C ATOM 2297 CD GLU B 41 74.992 4.793 -9.591 1.00 0.00 C ATOM 2298 OE1 GLU B 41 74.428 5.238 -8.604 1.00 0.00 O ATOM 2299 OE2 GLU B 41 76.182 4.912 -9.808 1.00 0.00 O ATOM 0 H GLU B 41 70.079 4.051 -10.248 1.00 0.00 H new ATOM 0 HA GLU B 41 72.183 4.176 -12.374 1.00 0.00 H new ATOM 0 HB2 GLU B 41 72.451 5.240 -10.054 1.00 0.00 H new ATOM 0 HB3 GLU B 41 72.437 3.619 -9.388 1.00 0.00 H new ATOM 0 HG2 GLU B 41 74.429 2.988 -10.635 1.00 0.00 H new ATOM 0 HG3 GLU B 41 74.350 4.434 -11.622 1.00 0.00 H new ATOM 2306 N LEU B 42 70.907 1.543 -11.048 1.00 0.00 N ATOM 2307 CA LEU B 42 70.895 0.058 -11.139 1.00 0.00 C ATOM 2308 C LEU B 42 69.444 -0.402 -11.348 1.00 0.00 C ATOM 2309 O LEU B 42 68.793 -0.825 -10.413 1.00 0.00 O ATOM 2310 CB LEU B 42 71.430 -0.548 -9.837 1.00 0.00 C ATOM 2311 CG LEU B 42 72.964 -0.403 -9.741 1.00 0.00 C ATOM 2312 CD1 LEU B 42 73.392 -0.504 -8.273 1.00 0.00 C ATOM 2313 CD2 LEU B 42 73.661 -1.516 -10.540 1.00 0.00 C ATOM 0 H LEU B 42 70.111 1.954 -10.561 1.00 0.00 H new ATOM 0 HA LEU B 42 71.524 -0.267 -11.968 1.00 0.00 H new ATOM 0 HB2 LEU B 42 70.962 -0.056 -8.985 1.00 0.00 H new ATOM 0 HB3 LEU B 42 71.158 -1.602 -9.785 1.00 0.00 H new ATOM 0 HG LEU B 42 73.250 0.565 -10.153 1.00 0.00 H new ATOM 0 HD11 LEU B 42 74.475 -0.402 -8.202 1.00 0.00 H new ATOM 0 HD12 LEU B 42 72.914 0.290 -7.699 1.00 0.00 H new ATOM 0 HD13 LEU B 42 73.092 -1.472 -7.872 1.00 0.00 H new ATOM 0 HD21 LEU B 42 74.742 -1.398 -10.461 1.00 0.00 H new ATOM 0 HD22 LEU B 42 73.372 -2.487 -10.139 1.00 0.00 H new ATOM 0 HD23 LEU B 42 73.364 -1.453 -11.587 1.00 0.00 H new ATOM 2325 N PRO B 43 68.921 -0.296 -12.546 1.00 0.00 N ATOM 2326 CA PRO B 43 67.508 -0.693 -12.806 1.00 0.00 C ATOM 2327 C PRO B 43 67.319 -2.225 -12.910 1.00 0.00 C ATOM 2328 O PRO B 43 67.360 -2.922 -11.915 1.00 0.00 O ATOM 2329 CB PRO B 43 67.232 0.040 -14.130 1.00 0.00 C ATOM 2330 CG PRO B 43 68.591 0.324 -14.801 1.00 0.00 C ATOM 2331 CD PRO B 43 69.683 0.218 -13.717 1.00 0.00 C ATOM 0 HA PRO B 43 66.819 -0.429 -12.003 1.00 0.00 H new ATOM 0 HB2 PRO B 43 66.604 -0.569 -14.781 1.00 0.00 H new ATOM 0 HB3 PRO B 43 66.694 0.970 -13.947 1.00 0.00 H new ATOM 0 HG2 PRO B 43 68.778 -0.390 -15.603 1.00 0.00 H new ATOM 0 HG3 PRO B 43 68.595 1.317 -15.251 1.00 0.00 H new ATOM 0 HD2 PRO B 43 70.483 -0.461 -14.011 1.00 0.00 H new ATOM 0 HD3 PRO B 43 70.145 1.183 -13.509 1.00 0.00 H new ATOM 2339 N SER B 44 67.092 -2.754 -14.085 1.00 0.00 N ATOM 2340 CA SER B 44 66.880 -4.226 -14.211 1.00 0.00 C ATOM 2341 C SER B 44 68.168 -4.989 -13.886 1.00 0.00 C ATOM 2342 O SER B 44 68.144 -5.997 -13.219 1.00 0.00 O ATOM 2343 CB SER B 44 66.454 -4.553 -15.641 1.00 0.00 C ATOM 2344 OG SER B 44 65.205 -3.934 -15.912 1.00 0.00 O ATOM 0 H SER B 44 67.044 -2.232 -14.960 1.00 0.00 H new ATOM 0 HA SER B 44 66.105 -4.528 -13.507 1.00 0.00 H new ATOM 0 HB2 SER B 44 67.207 -4.202 -16.346 1.00 0.00 H new ATOM 0 HB3 SER B 44 66.374 -5.632 -15.771 1.00 0.00 H new ATOM 0 HG SER B 44 64.930 -4.141 -16.830 1.00 0.00 H new ATOM 2350 N PHE B 45 69.285 -4.515 -14.365 1.00 0.00 N ATOM 2351 CA PHE B 45 70.593 -5.204 -14.116 1.00 0.00 C ATOM 2352 C PHE B 45 70.736 -5.611 -12.643 1.00 0.00 C ATOM 2353 O PHE B 45 71.639 -6.340 -12.277 1.00 0.00 O ATOM 2354 CB PHE B 45 71.718 -4.236 -14.457 1.00 0.00 C ATOM 2355 CG PHE B 45 73.051 -4.950 -14.380 1.00 0.00 C ATOM 2356 CD1 PHE B 45 73.582 -5.588 -15.512 1.00 0.00 C ATOM 2357 CD2 PHE B 45 73.760 -4.971 -13.171 1.00 0.00 C ATOM 2358 CE1 PHE B 45 74.817 -6.245 -15.431 1.00 0.00 C ATOM 2359 CE2 PHE B 45 74.993 -5.626 -13.092 1.00 0.00 C ATOM 2360 CZ PHE B 45 75.522 -6.262 -14.221 1.00 0.00 C ATOM 0 H PHE B 45 69.352 -3.667 -14.927 1.00 0.00 H new ATOM 0 HA PHE B 45 70.637 -6.102 -14.732 1.00 0.00 H new ATOM 0 HB2 PHE B 45 71.570 -3.830 -15.458 1.00 0.00 H new ATOM 0 HB3 PHE B 45 71.706 -3.393 -13.766 1.00 0.00 H new ATOM 0 HD1 PHE B 45 73.039 -5.572 -16.445 1.00 0.00 H new ATOM 0 HD2 PHE B 45 73.353 -4.480 -12.299 1.00 0.00 H new ATOM 0 HE1 PHE B 45 75.225 -6.738 -16.301 1.00 0.00 H new ATOM 0 HE2 PHE B 45 75.537 -5.641 -12.159 1.00 0.00 H new ATOM 0 HZ PHE B 45 76.475 -6.766 -14.159 1.00 0.00 H new ATOM 2370 N LEU B 46 69.854 -5.150 -11.805 1.00 0.00 N ATOM 2371 CA LEU B 46 69.908 -5.492 -10.343 1.00 0.00 C ATOM 2372 C LEU B 46 68.594 -6.157 -9.982 1.00 0.00 C ATOM 2373 O LEU B 46 68.540 -7.322 -9.642 1.00 0.00 O ATOM 2374 CB LEU B 46 70.097 -4.194 -9.543 1.00 0.00 C ATOM 2375 CG LEU B 46 70.044 -4.434 -8.019 1.00 0.00 C ATOM 2376 CD1 LEU B 46 71.305 -5.174 -7.552 1.00 0.00 C ATOM 2377 CD2 LEU B 46 69.961 -3.077 -7.305 1.00 0.00 C ATOM 0 H LEU B 46 69.081 -4.539 -12.068 1.00 0.00 H new ATOM 0 HA LEU B 46 70.735 -6.165 -10.116 1.00 0.00 H new ATOM 0 HB2 LEU B 46 71.055 -3.744 -9.805 1.00 0.00 H new ATOM 0 HB3 LEU B 46 69.322 -3.480 -9.824 1.00 0.00 H new ATOM 0 HG LEU B 46 69.170 -5.041 -7.781 1.00 0.00 H new ATOM 0 HD11 LEU B 46 71.254 -5.336 -6.475 1.00 0.00 H new ATOM 0 HD12 LEU B 46 71.372 -6.135 -8.061 1.00 0.00 H new ATOM 0 HD13 LEU B 46 72.186 -4.576 -7.787 1.00 0.00 H new ATOM 0 HD21 LEU B 46 69.923 -3.235 -6.227 1.00 0.00 H new ATOM 0 HD22 LEU B 46 70.839 -2.481 -7.554 1.00 0.00 H new ATOM 0 HD23 LEU B 46 69.062 -2.551 -7.627 1.00 0.00 H new ATOM 2389 N GLY B 47 67.526 -5.431 -10.098 1.00 0.00 N ATOM 2390 CA GLY B 47 66.198 -6.021 -9.810 1.00 0.00 C ATOM 2391 C GLY B 47 65.789 -6.833 -11.031 1.00 0.00 C ATOM 2392 O GLY B 47 64.624 -6.974 -11.342 1.00 0.00 O ATOM 0 H GLY B 47 67.515 -4.451 -10.381 1.00 0.00 H new ATOM 0 HA2 GLY B 47 66.243 -6.655 -8.924 1.00 0.00 H new ATOM 0 HA3 GLY B 47 65.466 -5.239 -9.606 1.00 0.00 H new ATOM 2396 N LYS B 48 66.756 -7.352 -11.748 1.00 0.00 N ATOM 2397 CA LYS B 48 66.432 -8.135 -12.970 1.00 0.00 C ATOM 2398 C LYS B 48 65.341 -9.161 -12.645 1.00 0.00 C ATOM 2399 O LYS B 48 64.278 -9.161 -13.233 1.00 0.00 O ATOM 2400 CB LYS B 48 67.684 -8.890 -13.455 1.00 0.00 C ATOM 2401 CG LYS B 48 67.378 -9.713 -14.721 1.00 0.00 C ATOM 2402 CD LYS B 48 66.966 -8.795 -15.881 1.00 0.00 C ATOM 2403 CE LYS B 48 67.087 -9.557 -17.203 1.00 0.00 C ATOM 2404 NZ LYS B 48 66.626 -8.687 -18.324 1.00 0.00 N ATOM 0 H LYS B 48 67.750 -7.265 -11.537 1.00 0.00 H new ATOM 0 HA LYS B 48 66.088 -7.452 -13.746 1.00 0.00 H new ATOM 0 HB2 LYS B 48 68.483 -8.179 -13.664 1.00 0.00 H new ATOM 0 HB3 LYS B 48 68.043 -9.551 -12.666 1.00 0.00 H new ATOM 0 HG2 LYS B 48 68.256 -10.293 -15.004 1.00 0.00 H new ATOM 0 HG3 LYS B 48 66.579 -10.425 -14.513 1.00 0.00 H new ATOM 0 HD2 LYS B 48 65.941 -8.451 -15.740 1.00 0.00 H new ATOM 0 HD3 LYS B 48 67.600 -7.909 -15.900 1.00 0.00 H new ATOM 0 HE2 LYS B 48 68.121 -9.861 -17.366 1.00 0.00 H new ATOM 0 HE3 LYS B 48 66.489 -10.468 -17.166 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 66.708 -9.205 -19.222 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 65.633 -8.418 -18.169 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 67.215 -7.830 -18.363 1.00 0.00 H new ATOM 2418 N ARG B 49 65.605 -10.047 -11.716 1.00 0.00 N ATOM 2419 CA ARG B 49 64.593 -11.084 -11.357 1.00 0.00 C ATOM 2420 C ARG B 49 65.065 -11.859 -10.122 1.00 0.00 C ATOM 2421 O ARG B 49 64.283 -12.471 -9.422 1.00 0.00 O ATOM 2422 CB ARG B 49 64.440 -12.058 -12.528 1.00 0.00 C ATOM 2423 CG ARG B 49 63.276 -13.008 -12.252 1.00 0.00 C ATOM 2424 CD ARG B 49 63.099 -13.965 -13.432 1.00 0.00 C ATOM 2425 NE ARG B 49 62.641 -13.199 -14.630 1.00 0.00 N ATOM 2426 CZ ARG B 49 62.675 -13.752 -15.812 1.00 0.00 C ATOM 2427 NH1 ARG B 49 63.063 -14.990 -15.940 1.00 0.00 N ATOM 2428 NH2 ARG B 49 62.318 -13.069 -16.866 1.00 0.00 N ATOM 0 H ARG B 49 66.479 -10.095 -11.192 1.00 0.00 H new ATOM 0 HA ARG B 49 63.639 -10.602 -11.142 1.00 0.00 H new ATOM 0 HB2 ARG B 49 64.263 -11.507 -13.452 1.00 0.00 H new ATOM 0 HB3 ARG B 49 65.361 -12.625 -12.666 1.00 0.00 H new ATOM 0 HG2 ARG B 49 63.464 -13.573 -11.339 1.00 0.00 H new ATOM 0 HG3 ARG B 49 62.360 -12.439 -12.092 1.00 0.00 H new ATOM 0 HD2 ARG B 49 64.040 -14.471 -13.648 1.00 0.00 H new ATOM 0 HD3 ARG B 49 62.372 -14.738 -13.181 1.00 0.00 H new ATOM 0 HE ARG B 49 62.301 -12.243 -14.524 1.00 0.00 H new ATOM 0 HH11 ARG B 49 63.340 -15.525 -15.117 1.00 0.00 H new ATOM 0 HH12 ARG B 49 63.090 -15.423 -16.863 1.00 0.00 H new ATOM 0 HH21 ARG B 49 62.012 -12.101 -16.767 1.00 0.00 H new ATOM 0 HH22 ARG B 49 62.345 -13.503 -17.789 1.00 0.00 H new ATOM 2442 N THR B 50 66.342 -11.849 -9.865 1.00 0.00 N ATOM 2443 CA THR B 50 66.880 -12.597 -8.693 1.00 0.00 C ATOM 2444 C THR B 50 66.577 -11.849 -7.392 1.00 0.00 C ATOM 2445 O THR B 50 66.853 -10.672 -7.257 1.00 0.00 O ATOM 2446 CB THR B 50 68.395 -12.744 -8.841 1.00 0.00 C ATOM 2447 OG1 THR B 50 68.686 -13.454 -10.037 1.00 0.00 O ATOM 2448 CG2 THR B 50 68.955 -13.510 -7.641 1.00 0.00 C ATOM 0 H THR B 50 67.041 -11.353 -10.418 1.00 0.00 H new ATOM 0 HA THR B 50 66.406 -13.578 -8.657 1.00 0.00 H new ATOM 0 HB THR B 50 68.854 -11.756 -8.884 1.00 0.00 H new ATOM 0 HG1 THR B 50 69.657 -13.547 -10.134 1.00 0.00 H new ATOM 0 HG21 THR B 50 70.035 -13.614 -7.748 1.00 0.00 H new ATOM 0 HG22 THR B 50 68.732 -12.964 -6.724 1.00 0.00 H new ATOM 0 HG23 THR B 50 68.498 -14.498 -7.595 1.00 0.00 H new ATOM 2456 N ASP B 51 66.033 -12.540 -6.424 1.00 0.00 N ATOM 2457 CA ASP B 51 65.732 -11.900 -5.109 1.00 0.00 C ATOM 2458 C ASP B 51 64.992 -10.574 -5.312 1.00 0.00 C ATOM 2459 O ASP B 51 65.436 -9.534 -4.870 1.00 0.00 O ATOM 2460 CB ASP B 51 67.041 -11.648 -4.352 1.00 0.00 C ATOM 2461 CG ASP B 51 66.738 -11.384 -2.875 1.00 0.00 C ATOM 2462 OD1 ASP B 51 65.573 -11.227 -2.547 1.00 0.00 O ATOM 2463 OD2 ASP B 51 67.675 -11.343 -2.096 1.00 0.00 O ATOM 0 H ASP B 51 65.783 -13.527 -6.489 1.00 0.00 H new ATOM 0 HA ASP B 51 65.095 -12.569 -4.531 1.00 0.00 H new ATOM 0 HB2 ASP B 51 67.701 -12.510 -4.450 1.00 0.00 H new ATOM 0 HB3 ASP B 51 67.564 -10.795 -4.784 1.00 0.00 H new ATOM 2468 N GLU B 52 63.865 -10.598 -5.969 1.00 0.00 N ATOM 2469 CA GLU B 52 63.098 -9.336 -6.188 1.00 0.00 C ATOM 2470 C GLU B 52 62.697 -8.741 -4.840 1.00 0.00 C ATOM 2471 O GLU B 52 62.675 -7.541 -4.656 1.00 0.00 O ATOM 2472 CB GLU B 52 61.837 -9.627 -7.002 1.00 0.00 C ATOM 2473 CG GLU B 52 62.228 -9.980 -8.434 1.00 0.00 C ATOM 2474 CD GLU B 52 60.972 -10.269 -9.253 1.00 0.00 C ATOM 2475 OE1 GLU B 52 59.903 -10.318 -8.667 1.00 0.00 O ATOM 2476 OE2 GLU B 52 61.099 -10.434 -10.454 1.00 0.00 O ATOM 0 H GLU B 52 63.441 -11.437 -6.364 1.00 0.00 H new ATOM 0 HA GLU B 52 63.725 -8.630 -6.732 1.00 0.00 H new ATOM 0 HB2 GLU B 52 61.282 -10.450 -6.552 1.00 0.00 H new ATOM 0 HB3 GLU B 52 61.179 -8.758 -6.997 1.00 0.00 H new ATOM 0 HG2 GLU B 52 62.785 -9.158 -8.883 1.00 0.00 H new ATOM 0 HG3 GLU B 52 62.885 -10.850 -8.438 1.00 0.00 H new ATOM 2483 N ALA B 53 62.361 -9.574 -3.901 1.00 0.00 N ATOM 2484 CA ALA B 53 61.940 -9.069 -2.569 1.00 0.00 C ATOM 2485 C ALA B 53 63.044 -8.193 -1.968 1.00 0.00 C ATOM 2486 O ALA B 53 62.774 -7.293 -1.201 1.00 0.00 O ATOM 2487 CB ALA B 53 61.669 -10.261 -1.647 1.00 0.00 C ATOM 0 H ALA B 53 62.360 -10.589 -3.999 1.00 0.00 H new ATOM 0 HA ALA B 53 61.035 -8.471 -2.676 1.00 0.00 H new ATOM 0 HB1 ALA B 53 61.359 -9.899 -0.666 1.00 0.00 H new ATOM 0 HB2 ALA B 53 60.878 -10.878 -2.073 1.00 0.00 H new ATOM 0 HB3 ALA B 53 62.577 -10.855 -1.544 1.00 0.00 H new ATOM 2493 N ALA B 54 64.285 -8.441 -2.306 1.00 0.00 N ATOM 2494 CA ALA B 54 65.388 -7.611 -1.734 1.00 0.00 C ATOM 2495 C ALA B 54 65.193 -6.147 -2.121 1.00 0.00 C ATOM 2496 O ALA B 54 65.373 -5.259 -1.311 1.00 0.00 O ATOM 2497 CB ALA B 54 66.731 -8.107 -2.270 1.00 0.00 C ATOM 0 H ALA B 54 64.580 -9.176 -2.948 1.00 0.00 H new ATOM 0 HA ALA B 54 65.374 -7.698 -0.648 1.00 0.00 H new ATOM 0 HB1 ALA B 54 67.535 -7.501 -1.853 1.00 0.00 H new ATOM 0 HB2 ALA B 54 66.875 -9.149 -1.983 1.00 0.00 H new ATOM 0 HB3 ALA B 54 66.742 -8.025 -3.357 1.00 0.00 H new ATOM 2503 N PHE B 55 64.801 -5.882 -3.333 1.00 0.00 N ATOM 2504 CA PHE B 55 64.572 -4.468 -3.739 1.00 0.00 C ATOM 2505 C PHE B 55 63.494 -3.886 -2.837 1.00 0.00 C ATOM 2506 O PHE B 55 63.565 -2.756 -2.394 1.00 0.00 O ATOM 2507 CB PHE B 55 64.058 -4.446 -5.173 1.00 0.00 C ATOM 2508 CG PHE B 55 63.656 -3.035 -5.561 1.00 0.00 C ATOM 2509 CD1 PHE B 55 64.613 -2.011 -5.583 1.00 0.00 C ATOM 2510 CD2 PHE B 55 62.323 -2.752 -5.899 1.00 0.00 C ATOM 2511 CE1 PHE B 55 64.237 -0.707 -5.939 1.00 0.00 C ATOM 2512 CE2 PHE B 55 61.949 -1.450 -6.254 1.00 0.00 C ATOM 2513 CZ PHE B 55 62.906 -0.428 -6.275 1.00 0.00 C ATOM 0 H PHE B 55 64.630 -6.579 -4.058 1.00 0.00 H new ATOM 0 HA PHE B 55 65.496 -3.895 -3.661 1.00 0.00 H new ATOM 0 HB2 PHE B 55 64.830 -4.812 -5.850 1.00 0.00 H new ATOM 0 HB3 PHE B 55 63.204 -5.116 -5.272 1.00 0.00 H new ATOM 0 HD1 PHE B 55 65.640 -2.226 -5.326 1.00 0.00 H new ATOM 0 HD2 PHE B 55 61.585 -3.540 -5.885 1.00 0.00 H new ATOM 0 HE1 PHE B 55 64.974 0.082 -5.954 1.00 0.00 H new ATOM 0 HE2 PHE B 55 60.923 -1.234 -6.512 1.00 0.00 H new ATOM 0 HZ PHE B 55 62.618 0.576 -6.550 1.00 0.00 H new ATOM 2523 N GLN B 56 62.499 -4.672 -2.560 1.00 0.00 N ATOM 2524 CA GLN B 56 61.394 -4.208 -1.679 1.00 0.00 C ATOM 2525 C GLN B 56 61.934 -4.023 -0.274 1.00 0.00 C ATOM 2526 O GLN B 56 61.494 -3.173 0.468 1.00 0.00 O ATOM 2527 CB GLN B 56 60.267 -5.247 -1.667 1.00 0.00 C ATOM 2528 CG GLN B 56 59.533 -5.220 -3.009 1.00 0.00 C ATOM 2529 CD GLN B 56 58.474 -6.326 -3.036 1.00 0.00 C ATOM 2530 OE1 GLN B 56 58.592 -7.315 -2.342 1.00 0.00 O ATOM 2531 NE2 GLN B 56 57.432 -6.192 -3.812 1.00 0.00 N ATOM 0 H GLN B 56 62.401 -5.626 -2.908 1.00 0.00 H new ATOM 0 HA GLN B 56 60.998 -3.263 -2.051 1.00 0.00 H new ATOM 0 HB2 GLN B 56 60.676 -6.241 -1.484 1.00 0.00 H new ATOM 0 HB3 GLN B 56 59.571 -5.035 -0.855 1.00 0.00 H new ATOM 0 HG2 GLN B 56 59.063 -4.248 -3.159 1.00 0.00 H new ATOM 0 HG3 GLN B 56 60.241 -5.360 -3.826 1.00 0.00 H new ATOM 0 HE21 GLN B 56 57.334 -5.361 -4.395 1.00 0.00 H new ATOM 0 HE22 GLN B 56 56.717 -6.919 -3.835 1.00 0.00 H new ATOM 2540 N LYS B 57 62.903 -4.801 0.085 1.00 0.00 N ATOM 2541 CA LYS B 57 63.490 -4.658 1.442 1.00 0.00 C ATOM 2542 C LYS B 57 64.258 -3.350 1.488 1.00 0.00 C ATOM 2543 O LYS B 57 64.230 -2.633 2.469 1.00 0.00 O ATOM 2544 CB LYS B 57 64.429 -5.828 1.774 1.00 0.00 C ATOM 2545 CG LYS B 57 63.617 -7.115 2.009 1.00 0.00 C ATOM 2546 CD LYS B 57 64.455 -8.143 2.786 1.00 0.00 C ATOM 2547 CE LYS B 57 65.550 -8.727 1.892 1.00 0.00 C ATOM 2548 NZ LYS B 57 66.329 -9.729 2.668 1.00 0.00 N ATOM 0 H LYS B 57 63.317 -5.529 -0.497 1.00 0.00 H new ATOM 0 HA LYS B 57 62.689 -4.663 2.182 1.00 0.00 H new ATOM 0 HB2 LYS B 57 65.135 -5.979 0.958 1.00 0.00 H new ATOM 0 HB3 LYS B 57 65.015 -5.592 2.662 1.00 0.00 H new ATOM 0 HG2 LYS B 57 62.708 -6.883 2.564 1.00 0.00 H new ATOM 0 HG3 LYS B 57 63.307 -7.537 1.053 1.00 0.00 H new ATOM 0 HD2 LYS B 57 64.904 -7.670 3.659 1.00 0.00 H new ATOM 0 HD3 LYS B 57 63.812 -8.943 3.153 1.00 0.00 H new ATOM 0 HE2 LYS B 57 65.108 -9.194 1.012 1.00 0.00 H new ATOM 0 HE3 LYS B 57 66.207 -7.934 1.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 67.076 -10.130 2.066 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 66.761 -9.269 3.494 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 65.696 -10.490 2.987 1.00 0.00 H new ATOM 2562 N LEU B 58 64.923 -3.014 0.420 1.00 0.00 N ATOM 2563 CA LEU B 58 65.661 -1.729 0.398 1.00 0.00 C ATOM 2564 C LEU B 58 64.616 -0.644 0.434 1.00 0.00 C ATOM 2565 O LEU B 58 64.742 0.353 1.111 1.00 0.00 O ATOM 2566 CB LEU B 58 66.488 -1.596 -0.884 1.00 0.00 C ATOM 2567 CG LEU B 58 67.594 -2.655 -0.918 1.00 0.00 C ATOM 2568 CD1 LEU B 58 68.258 -2.655 -2.300 1.00 0.00 C ATOM 2569 CD2 LEU B 58 68.654 -2.355 0.158 1.00 0.00 C ATOM 0 H LEU B 58 64.986 -3.571 -0.432 1.00 0.00 H new ATOM 0 HA LEU B 58 66.349 -1.665 1.241 1.00 0.00 H new ATOM 0 HB2 LEU B 58 65.842 -1.708 -1.755 1.00 0.00 H new ATOM 0 HB3 LEU B 58 66.927 -0.600 -0.939 1.00 0.00 H new ATOM 0 HG LEU B 58 67.154 -3.632 -0.719 1.00 0.00 H new ATOM 0 HD11 LEU B 58 69.045 -3.408 -2.325 1.00 0.00 H new ATOM 0 HD12 LEU B 58 67.513 -2.883 -3.062 1.00 0.00 H new ATOM 0 HD13 LEU B 58 68.689 -1.673 -2.497 1.00 0.00 H new ATOM 0 HD21 LEU B 58 69.434 -3.116 0.122 1.00 0.00 H new ATOM 0 HD22 LEU B 58 69.094 -1.375 -0.028 1.00 0.00 H new ATOM 0 HD23 LEU B 58 68.185 -2.362 1.142 1.00 0.00 H new ATOM 2581 N MET B 59 63.565 -0.859 -0.287 1.00 0.00 N ATOM 2582 CA MET B 59 62.466 0.125 -0.296 1.00 0.00 C ATOM 2583 C MET B 59 61.797 0.099 1.063 1.00 0.00 C ATOM 2584 O MET B 59 61.418 1.117 1.607 1.00 0.00 O ATOM 2585 CB MET B 59 61.446 -0.234 -1.377 1.00 0.00 C ATOM 2586 CG MET B 59 60.412 0.885 -1.503 1.00 0.00 C ATOM 2587 SD MET B 59 59.198 0.443 -2.770 1.00 0.00 S ATOM 2588 CE MET B 59 57.993 1.742 -2.398 1.00 0.00 C ATOM 0 H MET B 59 63.419 -1.680 -0.875 1.00 0.00 H new ATOM 0 HA MET B 59 62.859 1.119 -0.508 1.00 0.00 H new ATOM 0 HB2 MET B 59 61.951 -0.385 -2.331 1.00 0.00 H new ATOM 0 HB3 MET B 59 60.951 -1.173 -1.126 1.00 0.00 H new ATOM 0 HG2 MET B 59 59.914 1.044 -0.547 1.00 0.00 H new ATOM 0 HG3 MET B 59 60.904 1.821 -1.766 1.00 0.00 H new ATOM 0 HE1 MET B 59 57.160 1.677 -3.099 1.00 0.00 H new ATOM 0 HE2 MET B 59 57.622 1.614 -1.381 1.00 0.00 H new ATOM 0 HE3 MET B 59 58.470 2.718 -2.490 1.00 0.00 H new ATOM 2598 N SER B 60 61.659 -1.064 1.623 1.00 0.00 N ATOM 2599 CA SER B 60 61.017 -1.154 2.960 1.00 0.00 C ATOM 2600 C SER B 60 61.956 -0.541 3.990 1.00 0.00 C ATOM 2601 O SER B 60 61.543 -0.113 5.050 1.00 0.00 O ATOM 2602 CB SER B 60 60.745 -2.614 3.319 1.00 0.00 C ATOM 2603 OG SER B 60 59.813 -2.668 4.390 1.00 0.00 O ATOM 0 H SER B 60 61.960 -1.951 1.218 1.00 0.00 H new ATOM 0 HA SER B 60 60.068 -0.617 2.947 1.00 0.00 H new ATOM 0 HB2 SER B 60 60.352 -3.146 2.453 1.00 0.00 H new ATOM 0 HB3 SER B 60 61.673 -3.109 3.604 1.00 0.00 H new ATOM 0 HG SER B 60 59.635 -3.603 4.622 1.00 0.00 H new ATOM 2609 N ASN B 61 63.222 -0.481 3.682 1.00 0.00 N ATOM 2610 CA ASN B 61 64.174 0.123 4.658 1.00 0.00 C ATOM 2611 C ASN B 61 63.879 1.608 4.744 1.00 0.00 C ATOM 2612 O ASN B 61 63.918 2.199 5.800 1.00 0.00 O ATOM 2613 CB ASN B 61 65.627 -0.103 4.231 1.00 0.00 C ATOM 2614 CG ASN B 61 65.986 -1.580 4.397 1.00 0.00 C ATOM 2615 OD1 ASN B 61 66.718 -2.134 3.601 1.00 0.00 O ATOM 2616 ND2 ASN B 61 65.500 -2.248 5.408 1.00 0.00 N ATOM 0 H ASN B 61 63.634 -0.818 2.812 1.00 0.00 H new ATOM 0 HA ASN B 61 64.045 -0.351 5.631 1.00 0.00 H new ATOM 0 HB2 ASN B 61 65.763 0.200 3.193 1.00 0.00 H new ATOM 0 HB3 ASN B 61 66.294 0.514 4.833 1.00 0.00 H new ATOM 0 HD21 ASN B 61 65.735 -3.233 5.529 1.00 0.00 H new ATOM 0 HD22 ASN B 61 64.885 -1.785 6.077 1.00 0.00 H new ATOM 2623 N LEU B 62 63.547 2.207 3.638 1.00 0.00 N ATOM 2624 CA LEU B 62 63.203 3.647 3.661 1.00 0.00 C ATOM 2625 C LEU B 62 61.993 3.768 4.585 1.00 0.00 C ATOM 2626 O LEU B 62 61.810 4.742 5.287 1.00 0.00 O ATOM 2627 CB LEU B 62 62.846 4.122 2.243 1.00 0.00 C ATOM 2628 CG LEU B 62 63.806 3.503 1.216 1.00 0.00 C ATOM 2629 CD1 LEU B 62 63.457 4.033 -0.170 1.00 0.00 C ATOM 2630 CD2 LEU B 62 65.264 3.855 1.536 1.00 0.00 C ATOM 0 H LEU B 62 63.500 1.761 2.722 1.00 0.00 H new ATOM 0 HA LEU B 62 64.034 4.260 4.010 1.00 0.00 H new ATOM 0 HB2 LEU B 62 61.819 3.842 2.006 1.00 0.00 H new ATOM 0 HB3 LEU B 62 62.900 5.209 2.192 1.00 0.00 H new ATOM 0 HG LEU B 62 63.699 2.419 1.251 1.00 0.00 H new ATOM 0 HD11 LEU B 62 64.133 3.599 -0.906 1.00 0.00 H new ATOM 0 HD12 LEU B 62 62.430 3.761 -0.416 1.00 0.00 H new ATOM 0 HD13 LEU B 62 63.557 5.118 -0.180 1.00 0.00 H new ATOM 0 HD21 LEU B 62 65.919 3.403 0.792 1.00 0.00 H new ATOM 0 HD22 LEU B 62 65.389 4.938 1.519 1.00 0.00 H new ATOM 0 HD23 LEU B 62 65.521 3.475 2.525 1.00 0.00 H new ATOM 2642 N ASP B 63 61.185 2.739 4.596 1.00 0.00 N ATOM 2643 CA ASP B 63 59.987 2.704 5.475 1.00 0.00 C ATOM 2644 C ASP B 63 60.373 1.984 6.765 1.00 0.00 C ATOM 2645 O ASP B 63 59.533 1.483 7.484 1.00 0.00 O ATOM 2646 CB ASP B 63 58.873 1.914 4.787 1.00 0.00 C ATOM 2647 CG ASP B 63 58.367 2.689 3.572 1.00 0.00 C ATOM 2648 OD1 ASP B 63 58.625 3.878 3.505 1.00 0.00 O ATOM 2649 OD2 ASP B 63 57.726 2.079 2.732 1.00 0.00 O ATOM 0 H ASP B 63 61.312 1.907 4.020 1.00 0.00 H new ATOM 0 HA ASP B 63 59.640 3.717 5.681 1.00 0.00 H new ATOM 0 HB2 ASP B 63 59.244 0.937 4.478 1.00 0.00 H new ATOM 0 HB3 ASP B 63 58.054 1.738 5.485 1.00 0.00 H new ATOM 2654 N SER B 64 61.647 1.901 7.047 1.00 0.00 N ATOM 2655 CA SER B 64 62.092 1.180 8.274 1.00 0.00 C ATOM 2656 C SER B 64 61.431 1.793 9.508 1.00 0.00 C ATOM 2657 O SER B 64 60.450 1.282 10.010 1.00 0.00 O ATOM 2658 CB SER B 64 63.610 1.293 8.414 1.00 0.00 C ATOM 2659 OG SER B 64 63.981 0.994 9.754 1.00 0.00 O ATOM 0 H SER B 64 62.396 2.301 6.482 1.00 0.00 H new ATOM 0 HA SER B 64 61.805 0.132 8.191 1.00 0.00 H new ATOM 0 HB2 SER B 64 64.103 0.606 7.726 1.00 0.00 H new ATOM 0 HB3 SER B 64 63.938 2.298 8.149 1.00 0.00 H new ATOM 0 HG SER B 64 64.954 1.064 9.847 1.00 0.00 H new ATOM 2665 N ASN B 65 61.959 2.884 10.002 1.00 0.00 N ATOM 2666 CA ASN B 65 61.366 3.536 11.210 1.00 0.00 C ATOM 2667 C ASN B 65 61.361 5.053 11.012 1.00 0.00 C ATOM 2668 O ASN B 65 60.336 5.645 10.736 1.00 0.00 O ATOM 2669 CB ASN B 65 62.213 3.181 12.437 1.00 0.00 C ATOM 2670 CG ASN B 65 61.472 3.601 13.707 1.00 0.00 C ATOM 2671 OD1 ASN B 65 60.578 4.419 13.661 1.00 0.00 O ATOM 2672 ND2 ASN B 65 61.808 3.072 14.850 1.00 0.00 N ATOM 0 H ASN B 65 62.779 3.354 9.619 1.00 0.00 H new ATOM 0 HA ASN B 65 60.344 3.186 11.358 1.00 0.00 H new ATOM 0 HB2 ASN B 65 62.412 2.110 12.457 1.00 0.00 H new ATOM 0 HB3 ASN B 65 63.179 3.684 12.383 1.00 0.00 H new ATOM 0 HD21 ASN B 65 61.319 3.346 15.702 1.00 0.00 H new ATOM 0 HD22 ASN B 65 62.560 2.384 14.892 1.00 0.00 H new ATOM 2679 N ARG B 66 62.506 5.680 11.140 1.00 0.00 N ATOM 2680 CA ARG B 66 62.598 7.164 10.953 1.00 0.00 C ATOM 2681 C ARG B 66 63.668 7.458 9.897 1.00 0.00 C ATOM 2682 O ARG B 66 64.779 7.835 10.212 1.00 0.00 O ATOM 2683 CB ARG B 66 62.983 7.824 12.282 1.00 0.00 C ATOM 2684 CG ARG B 66 62.896 9.345 12.138 1.00 0.00 C ATOM 2685 CD ARG B 66 63.261 10.013 13.468 1.00 0.00 C ATOM 2686 NE ARG B 66 62.977 11.473 13.371 1.00 0.00 N ATOM 2687 CZ ARG B 66 62.988 12.221 14.440 1.00 0.00 C ATOM 2688 NH1 ARG B 66 63.236 11.693 15.608 1.00 0.00 N ATOM 2689 NH2 ARG B 66 62.747 13.500 14.339 1.00 0.00 N ATOM 0 H ARG B 66 63.389 5.223 11.368 1.00 0.00 H new ATOM 0 HA ARG B 66 61.637 7.562 10.626 1.00 0.00 H new ATOM 0 HB2 ARG B 66 62.318 7.484 13.076 1.00 0.00 H new ATOM 0 HB3 ARG B 66 63.994 7.532 12.566 1.00 0.00 H new ATOM 0 HG2 ARG B 66 63.571 9.684 11.352 1.00 0.00 H new ATOM 0 HG3 ARG B 66 61.888 9.634 11.839 1.00 0.00 H new ATOM 0 HD2 ARG B 66 62.686 9.571 14.282 1.00 0.00 H new ATOM 0 HD3 ARG B 66 64.314 9.848 13.696 1.00 0.00 H new ATOM 0 HE ARG B 66 62.773 11.890 12.463 1.00 0.00 H new ATOM 0 HH11 ARG B 66 63.422 10.693 15.687 1.00 0.00 H new ATOM 0 HH12 ARG B 66 63.244 12.280 16.442 1.00 0.00 H new ATOM 0 HH21 ARG B 66 62.551 13.912 13.427 1.00 0.00 H new ATOM 0 HH22 ARG B 66 62.755 14.088 15.173 1.00 0.00 H new ATOM 2703 N ASP B 67 63.336 7.284 8.642 1.00 0.00 N ATOM 2704 CA ASP B 67 64.318 7.545 7.544 1.00 0.00 C ATOM 2705 C ASP B 67 64.103 8.963 7.014 1.00 0.00 C ATOM 2706 O ASP B 67 62.985 9.408 6.853 1.00 0.00 O ATOM 2707 CB ASP B 67 64.091 6.526 6.426 1.00 0.00 C ATOM 2708 CG ASP B 67 64.397 5.128 6.959 1.00 0.00 C ATOM 2709 OD1 ASP B 67 65.457 4.954 7.536 1.00 0.00 O ATOM 2710 OD2 ASP B 67 63.560 4.263 6.792 1.00 0.00 O ATOM 0 H ASP B 67 62.418 6.969 8.328 1.00 0.00 H new ATOM 0 HA ASP B 67 65.339 7.451 7.915 1.00 0.00 H new ATOM 0 HB2 ASP B 67 63.061 6.577 6.073 1.00 0.00 H new ATOM 0 HB3 ASP B 67 64.732 6.753 5.574 1.00 0.00 H new ATOM 2715 N ASN B 68 65.160 9.691 6.761 1.00 0.00 N ATOM 2716 CA ASN B 68 64.984 11.088 6.268 1.00 0.00 C ATOM 2717 C ASN B 68 66.200 11.549 5.455 1.00 0.00 C ATOM 2718 O ASN B 68 66.049 12.137 4.400 1.00 0.00 O ATOM 2719 CB ASN B 68 64.799 12.017 7.473 1.00 0.00 C ATOM 2720 CG ASN B 68 66.036 11.947 8.373 1.00 0.00 C ATOM 2721 OD1 ASN B 68 66.798 11.004 8.306 1.00 0.00 O ATOM 2722 ND2 ASN B 68 66.270 12.912 9.221 1.00 0.00 N ATOM 0 H ASN B 68 66.126 9.383 6.873 1.00 0.00 H new ATOM 0 HA ASN B 68 64.109 11.121 5.619 1.00 0.00 H new ATOM 0 HB2 ASN B 68 64.641 13.041 7.134 1.00 0.00 H new ATOM 0 HB3 ASN B 68 63.911 11.727 8.035 1.00 0.00 H new ATOM 0 HD21 ASN B 68 67.091 12.872 9.825 1.00 0.00 H new ATOM 0 HD22 ASN B 68 65.632 13.705 9.280 1.00 0.00 H new ATOM 2729 N GLU B 69 67.400 11.327 5.948 1.00 0.00 N ATOM 2730 CA GLU B 69 68.621 11.797 5.211 1.00 0.00 C ATOM 2731 C GLU B 69 69.608 10.649 4.960 1.00 0.00 C ATOM 2732 O GLU B 69 69.634 9.647 5.645 1.00 0.00 O ATOM 2733 CB GLU B 69 69.305 12.897 6.038 1.00 0.00 C ATOM 2734 CG GLU B 69 70.111 13.825 5.124 1.00 0.00 C ATOM 2735 CD GLU B 69 69.145 14.667 4.286 1.00 0.00 C ATOM 2736 OE1 GLU B 69 68.138 15.090 4.830 1.00 0.00 O ATOM 2737 OE2 GLU B 69 69.424 14.870 3.115 1.00 0.00 O ATOM 0 H GLU B 69 67.585 10.842 6.826 1.00 0.00 H new ATOM 0 HA GLU B 69 68.312 12.184 4.240 1.00 0.00 H new ATOM 0 HB2 GLU B 69 68.555 13.472 6.582 1.00 0.00 H new ATOM 0 HB3 GLU B 69 69.963 12.447 6.782 1.00 0.00 H new ATOM 0 HG2 GLU B 69 70.755 14.473 5.719 1.00 0.00 H new ATOM 0 HG3 GLU B 69 70.761 13.240 4.474 1.00 0.00 H new ATOM 2744 N VAL B 70 70.410 10.832 3.958 1.00 0.00 N ATOM 2745 CA VAL B 70 71.435 9.829 3.550 1.00 0.00 C ATOM 2746 C VAL B 70 72.803 10.463 3.707 1.00 0.00 C ATOM 2747 O VAL B 70 73.170 11.358 2.972 1.00 0.00 O ATOM 2748 CB VAL B 70 71.208 9.547 2.074 1.00 0.00 C ATOM 2749 CG1 VAL B 70 72.113 8.431 1.586 1.00 0.00 C ATOM 2750 CG2 VAL B 70 69.752 9.159 1.820 1.00 0.00 C ATOM 0 H VAL B 70 70.400 11.671 3.378 1.00 0.00 H new ATOM 0 HA VAL B 70 71.369 8.919 4.147 1.00 0.00 H new ATOM 0 HB VAL B 70 71.443 10.459 1.525 1.00 0.00 H new ATOM 0 HG11 VAL B 70 71.929 8.250 0.527 1.00 0.00 H new ATOM 0 HG12 VAL B 70 73.155 8.718 1.730 1.00 0.00 H new ATOM 0 HG13 VAL B 70 71.906 7.522 2.150 1.00 0.00 H new ATOM 0 HG21 VAL B 70 69.608 8.961 0.758 1.00 0.00 H new ATOM 0 HG22 VAL B 70 69.509 8.264 2.392 1.00 0.00 H new ATOM 0 HG23 VAL B 70 69.099 9.975 2.128 1.00 0.00 H new ATOM 2760 N ASP B 71 73.569 9.997 4.631 1.00 0.00 N ATOM 2761 CA ASP B 71 74.927 10.557 4.805 1.00 0.00 C ATOM 2762 C ASP B 71 75.829 9.801 3.843 1.00 0.00 C ATOM 2763 O ASP B 71 75.442 8.781 3.309 1.00 0.00 O ATOM 2764 CB ASP B 71 75.396 10.331 6.245 1.00 0.00 C ATOM 2765 CG ASP B 71 76.627 11.194 6.521 1.00 0.00 C ATOM 2766 OD1 ASP B 71 77.234 11.650 5.568 1.00 0.00 O ATOM 2767 OD2 ASP B 71 76.942 11.383 7.685 1.00 0.00 O ATOM 0 H ASP B 71 73.318 9.250 5.278 1.00 0.00 H new ATOM 0 HA ASP B 71 74.946 11.629 4.606 1.00 0.00 H new ATOM 0 HB2 ASP B 71 74.598 10.584 6.943 1.00 0.00 H new ATOM 0 HB3 ASP B 71 75.634 9.279 6.400 1.00 0.00 H new ATOM 2772 N PHE B 72 77.024 10.252 3.616 1.00 0.00 N ATOM 2773 CA PHE B 72 77.902 9.501 2.697 1.00 0.00 C ATOM 2774 C PHE B 72 77.959 8.059 3.196 1.00 0.00 C ATOM 2775 O PHE B 72 77.969 7.118 2.429 1.00 0.00 O ATOM 2776 CB PHE B 72 79.303 10.101 2.722 1.00 0.00 C ATOM 2777 CG PHE B 72 80.117 9.471 1.627 1.00 0.00 C ATOM 2778 CD1 PHE B 72 80.740 8.239 1.838 1.00 0.00 C ATOM 2779 CD2 PHE B 72 80.235 10.114 0.393 1.00 0.00 C ATOM 2780 CE1 PHE B 72 81.484 7.650 0.814 1.00 0.00 C ATOM 2781 CE2 PHE B 72 80.978 9.528 -0.630 1.00 0.00 C ATOM 2782 CZ PHE B 72 81.604 8.293 -0.423 1.00 0.00 C ATOM 0 H PHE B 72 77.425 11.097 4.022 1.00 0.00 H new ATOM 0 HA PHE B 72 77.520 9.545 1.677 1.00 0.00 H new ATOM 0 HB2 PHE B 72 79.254 11.181 2.583 1.00 0.00 H new ATOM 0 HB3 PHE B 72 79.772 9.925 3.690 1.00 0.00 H new ATOM 0 HD1 PHE B 72 80.646 7.742 2.792 1.00 0.00 H new ATOM 0 HD2 PHE B 72 79.750 11.066 0.231 1.00 0.00 H new ATOM 0 HE1 PHE B 72 81.967 6.698 0.977 1.00 0.00 H new ATOM 0 HE2 PHE B 72 81.071 10.027 -1.583 1.00 0.00 H new ATOM 0 HZ PHE B 72 82.178 7.838 -1.216 1.00 0.00 H new ATOM 2792 N GLN B 73 77.988 7.896 4.490 1.00 0.00 N ATOM 2793 CA GLN B 73 78.041 6.534 5.075 1.00 0.00 C ATOM 2794 C GLN B 73 76.710 5.798 4.873 1.00 0.00 C ATOM 2795 O GLN B 73 76.704 4.616 4.599 1.00 0.00 O ATOM 2796 CB GLN B 73 78.330 6.630 6.577 1.00 0.00 C ATOM 2797 CG GLN B 73 78.509 5.219 7.153 1.00 0.00 C ATOM 2798 CD GLN B 73 78.833 5.306 8.648 1.00 0.00 C ATOM 2799 OE1 GLN B 73 79.984 5.340 9.029 1.00 0.00 O ATOM 2800 NE2 GLN B 73 77.860 5.352 9.517 1.00 0.00 N ATOM 0 H GLN B 73 77.977 8.657 5.170 1.00 0.00 H new ATOM 0 HA GLN B 73 78.833 5.979 4.572 1.00 0.00 H new ATOM 0 HB2 GLN B 73 79.229 7.221 6.748 1.00 0.00 H new ATOM 0 HB3 GLN B 73 77.511 7.141 7.084 1.00 0.00 H new ATOM 0 HG2 GLN B 73 77.600 4.637 7.002 1.00 0.00 H new ATOM 0 HG3 GLN B 73 79.311 4.701 6.627 1.00 0.00 H new ATOM 0 HE21 GLN B 73 76.891 5.324 9.200 1.00 0.00 H new ATOM 0 HE22 GLN B 73 78.069 5.416 10.513 1.00 0.00 H new ATOM 2809 N GLU B 74 75.578 6.450 5.020 1.00 0.00 N ATOM 2810 CA GLU B 74 74.308 5.709 4.853 1.00 0.00 C ATOM 2811 C GLU B 74 74.184 5.236 3.419 1.00 0.00 C ATOM 2812 O GLU B 74 73.768 4.126 3.168 1.00 0.00 O ATOM 2813 CB GLU B 74 73.134 6.625 5.205 1.00 0.00 C ATOM 2814 CG GLU B 74 73.130 6.915 6.711 1.00 0.00 C ATOM 2815 CD GLU B 74 72.736 5.656 7.486 1.00 0.00 C ATOM 2816 OE1 GLU B 74 72.006 4.848 6.934 1.00 0.00 O ATOM 2817 OE2 GLU B 74 73.165 5.525 8.619 1.00 0.00 O ATOM 0 H GLU B 74 75.489 7.441 5.243 1.00 0.00 H new ATOM 0 HA GLU B 74 74.298 4.844 5.516 1.00 0.00 H new ATOM 0 HB2 GLU B 74 73.210 7.558 4.647 1.00 0.00 H new ATOM 0 HB3 GLU B 74 72.195 6.155 4.914 1.00 0.00 H new ATOM 0 HG2 GLU B 74 74.117 7.252 7.027 1.00 0.00 H new ATOM 0 HG3 GLU B 74 72.431 7.722 6.932 1.00 0.00 H new ATOM 2824 N TYR B 75 74.553 6.039 2.464 1.00 0.00 N ATOM 2825 CA TYR B 75 74.434 5.551 1.074 1.00 0.00 C ATOM 2826 C TYR B 75 75.333 4.321 0.911 1.00 0.00 C ATOM 2827 O TYR B 75 74.979 3.349 0.274 1.00 0.00 O ATOM 2828 CB TYR B 75 74.856 6.624 0.065 1.00 0.00 C ATOM 2829 CG TYR B 75 74.809 6.022 -1.326 1.00 0.00 C ATOM 2830 CD1 TYR B 75 73.600 5.531 -1.838 1.00 0.00 C ATOM 2831 CD2 TYR B 75 75.979 5.925 -2.092 1.00 0.00 C ATOM 2832 CE1 TYR B 75 73.561 4.951 -3.111 1.00 0.00 C ATOM 2833 CE2 TYR B 75 75.938 5.349 -3.368 1.00 0.00 C ATOM 2834 CZ TYR B 75 74.729 4.862 -3.878 1.00 0.00 C ATOM 2835 OH TYR B 75 74.691 4.291 -5.133 1.00 0.00 O ATOM 0 H TYR B 75 74.921 6.983 2.582 1.00 0.00 H new ATOM 0 HA TYR B 75 73.391 5.299 0.880 1.00 0.00 H new ATOM 0 HB2 TYR B 75 74.191 7.485 0.128 1.00 0.00 H new ATOM 0 HB3 TYR B 75 75.861 6.981 0.290 1.00 0.00 H new ATOM 0 HD1 TYR B 75 72.697 5.600 -1.249 1.00 0.00 H new ATOM 0 HD2 TYR B 75 76.914 6.295 -1.697 1.00 0.00 H new ATOM 0 HE1 TYR B 75 72.629 4.572 -3.502 1.00 0.00 H new ATOM 0 HE2 TYR B 75 76.840 5.281 -3.959 1.00 0.00 H new ATOM 0 HH TYR B 75 75.587 4.311 -5.529 1.00 0.00 H new ATOM 2845 N CYS B 76 76.498 4.371 1.497 1.00 0.00 N ATOM 2846 CA CYS B 76 77.452 3.236 1.410 1.00 0.00 C ATOM 2847 C CYS B 76 76.895 2.056 2.193 1.00 0.00 C ATOM 2848 O CYS B 76 76.988 0.921 1.767 1.00 0.00 O ATOM 2849 CB CYS B 76 78.798 3.655 2.003 1.00 0.00 C ATOM 2850 SG CYS B 76 79.380 5.150 1.164 1.00 0.00 S ATOM 0 H CYS B 76 76.832 5.166 2.041 1.00 0.00 H new ATOM 0 HA CYS B 76 77.591 2.951 0.367 1.00 0.00 H new ATOM 0 HB2 CYS B 76 78.696 3.840 3.072 1.00 0.00 H new ATOM 0 HB3 CYS B 76 79.526 2.852 1.887 1.00 0.00 H new ATOM 0 HG CYS B 76 78.738 6.183 1.623 1.00 0.00 H new ATOM 2856 N VAL B 77 76.291 2.301 3.328 1.00 0.00 N ATOM 2857 CA VAL B 77 75.734 1.162 4.093 1.00 0.00 C ATOM 2858 C VAL B 77 74.691 0.495 3.202 1.00 0.00 C ATOM 2859 O VAL B 77 74.630 -0.715 3.097 1.00 0.00 O ATOM 2860 CB VAL B 77 75.077 1.680 5.381 1.00 0.00 C ATOM 2861 CG1 VAL B 77 74.289 0.547 6.047 1.00 0.00 C ATOM 2862 CG2 VAL B 77 76.162 2.202 6.344 1.00 0.00 C ATOM 0 H VAL B 77 76.164 3.223 3.746 1.00 0.00 H new ATOM 0 HA VAL B 77 76.514 0.453 4.371 1.00 0.00 H new ATOM 0 HB VAL B 77 74.395 2.495 5.137 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.823 0.916 6.961 1.00 0.00 H new ATOM 0 HG12 VAL B 77 73.517 0.191 5.365 1.00 0.00 H new ATOM 0 HG13 VAL B 77 74.965 -0.273 6.290 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.692 2.569 7.257 1.00 0.00 H new ATOM 0 HG22 VAL B 77 76.850 1.393 6.590 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.712 3.014 5.867 1.00 0.00 H new ATOM 2872 N PHE B 78 73.898 1.278 2.523 1.00 0.00 N ATOM 2873 CA PHE B 78 72.892 0.684 1.607 1.00 0.00 C ATOM 2874 C PHE B 78 73.629 0.038 0.428 1.00 0.00 C ATOM 2875 O PHE B 78 73.288 -1.043 0.001 1.00 0.00 O ATOM 2876 CB PHE B 78 71.935 1.780 1.098 1.00 0.00 C ATOM 2877 CG PHE B 78 70.776 1.960 2.066 1.00 0.00 C ATOM 2878 CD1 PHE B 78 71.009 2.456 3.354 1.00 0.00 C ATOM 2879 CD2 PHE B 78 69.471 1.633 1.673 1.00 0.00 C ATOM 2880 CE1 PHE B 78 69.947 2.629 4.247 1.00 0.00 C ATOM 2881 CE2 PHE B 78 68.407 1.807 2.563 1.00 0.00 C ATOM 2882 CZ PHE B 78 68.645 2.306 3.852 1.00 0.00 C ATOM 0 H PHE B 78 73.905 2.297 2.564 1.00 0.00 H new ATOM 0 HA PHE B 78 72.305 -0.069 2.133 1.00 0.00 H new ATOM 0 HB2 PHE B 78 72.475 2.721 0.987 1.00 0.00 H new ATOM 0 HB3 PHE B 78 71.556 1.512 0.112 1.00 0.00 H new ATOM 0 HD1 PHE B 78 72.014 2.706 3.660 1.00 0.00 H new ATOM 0 HD2 PHE B 78 69.287 1.246 0.682 1.00 0.00 H new ATOM 0 HE1 PHE B 78 70.132 3.011 5.240 1.00 0.00 H new ATOM 0 HE2 PHE B 78 67.402 1.557 2.258 1.00 0.00 H new ATOM 0 HZ PHE B 78 67.823 2.441 4.539 1.00 0.00 H new ATOM 2892 N LEU B 79 74.651 0.674 -0.098 1.00 0.00 N ATOM 2893 CA LEU B 79 75.381 0.046 -1.241 1.00 0.00 C ATOM 2894 C LEU B 79 76.075 -1.225 -0.748 1.00 0.00 C ATOM 2895 O LEU B 79 76.103 -2.236 -1.424 1.00 0.00 O ATOM 2896 CB LEU B 79 76.432 1.017 -1.786 1.00 0.00 C ATOM 2897 CG LEU B 79 77.126 0.419 -3.021 1.00 0.00 C ATOM 2898 CD1 LEU B 79 76.128 0.293 -4.191 1.00 0.00 C ATOM 2899 CD2 LEU B 79 78.288 1.335 -3.426 1.00 0.00 C ATOM 0 H LEU B 79 75.003 1.581 0.208 1.00 0.00 H new ATOM 0 HA LEU B 79 74.674 -0.197 -2.034 1.00 0.00 H new ATOM 0 HB2 LEU B 79 75.960 1.964 -2.049 1.00 0.00 H new ATOM 0 HB3 LEU B 79 77.171 1.233 -1.015 1.00 0.00 H new ATOM 0 HG LEU B 79 77.501 -0.576 -2.780 1.00 0.00 H new ATOM 0 HD11 LEU B 79 76.635 -0.132 -5.057 1.00 0.00 H new ATOM 0 HD12 LEU B 79 75.304 -0.357 -3.898 1.00 0.00 H new ATOM 0 HD13 LEU B 79 75.739 1.279 -4.445 1.00 0.00 H new ATOM 0 HD21 LEU B 79 78.789 0.922 -4.301 1.00 0.00 H new ATOM 0 HD22 LEU B 79 77.904 2.327 -3.662 1.00 0.00 H new ATOM 0 HD23 LEU B 79 78.998 1.408 -2.602 1.00 0.00 H new ATOM 2911 N SER B 80 76.628 -1.177 0.431 1.00 0.00 N ATOM 2912 CA SER B 80 77.324 -2.370 0.986 1.00 0.00 C ATOM 2913 C SER B 80 76.282 -3.456 1.201 1.00 0.00 C ATOM 2914 O SER B 80 76.494 -4.610 0.888 1.00 0.00 O ATOM 2915 CB SER B 80 77.983 -2.013 2.321 1.00 0.00 C ATOM 2916 OG SER B 80 78.929 -0.970 2.117 1.00 0.00 O ATOM 0 H SER B 80 76.628 -0.357 1.038 1.00 0.00 H new ATOM 0 HA SER B 80 78.098 -2.713 0.300 1.00 0.00 H new ATOM 0 HB2 SER B 80 77.227 -1.697 3.040 1.00 0.00 H new ATOM 0 HB3 SER B 80 78.476 -2.889 2.741 1.00 0.00 H new ATOM 0 HG SER B 80 78.456 -0.126 1.957 1.00 0.00 H new ATOM 2922 N CYS B 81 75.140 -3.078 1.700 1.00 0.00 N ATOM 2923 CA CYS B 81 74.057 -4.067 1.904 1.00 0.00 C ATOM 2924 C CYS B 81 73.676 -4.616 0.542 1.00 0.00 C ATOM 2925 O CYS B 81 73.345 -5.775 0.394 1.00 0.00 O ATOM 2926 CB CYS B 81 72.840 -3.394 2.545 1.00 0.00 C ATOM 2927 SG CYS B 81 71.435 -4.536 2.515 1.00 0.00 S ATOM 0 H CYS B 81 74.913 -2.122 1.975 1.00 0.00 H new ATOM 0 HA CYS B 81 74.394 -4.866 2.565 1.00 0.00 H new ATOM 0 HB2 CYS B 81 73.068 -3.108 3.572 1.00 0.00 H new ATOM 0 HB3 CYS B 81 72.591 -2.480 2.007 1.00 0.00 H new ATOM 0 HG CYS B 81 71.669 -5.489 1.662 1.00 0.00 H new ATOM 2933 N ILE B 82 73.733 -3.788 -0.464 1.00 0.00 N ATOM 2934 CA ILE B 82 73.391 -4.279 -1.825 1.00 0.00 C ATOM 2935 C ILE B 82 74.491 -5.232 -2.304 1.00 0.00 C ATOM 2936 O ILE B 82 74.229 -6.252 -2.911 1.00 0.00 O ATOM 2937 CB ILE B 82 73.236 -3.095 -2.791 1.00 0.00 C ATOM 2938 CG1 ILE B 82 71.939 -2.342 -2.446 1.00 0.00 C ATOM 2939 CG2 ILE B 82 73.171 -3.607 -4.239 1.00 0.00 C ATOM 2940 CD1 ILE B 82 71.912 -0.971 -3.132 1.00 0.00 C ATOM 0 H ILE B 82 73.998 -2.805 -0.403 1.00 0.00 H new ATOM 0 HA ILE B 82 72.443 -4.815 -1.796 1.00 0.00 H new ATOM 0 HB ILE B 82 74.090 -2.425 -2.694 1.00 0.00 H new ATOM 0 HG12 ILE B 82 71.076 -2.929 -2.761 1.00 0.00 H new ATOM 0 HG13 ILE B 82 71.862 -2.216 -1.366 1.00 0.00 H new ATOM 0 HG21 ILE B 82 73.061 -2.762 -4.919 1.00 0.00 H new ATOM 0 HG22 ILE B 82 74.088 -4.146 -4.476 1.00 0.00 H new ATOM 0 HG23 ILE B 82 72.318 -4.276 -4.350 1.00 0.00 H new ATOM 0 HD11 ILE B 82 70.987 -0.454 -2.876 1.00 0.00 H new ATOM 0 HD12 ILE B 82 72.764 -0.379 -2.796 1.00 0.00 H new ATOM 0 HD13 ILE B 82 71.966 -1.104 -4.213 1.00 0.00 H new ATOM 2952 N ALA B 83 75.724 -4.908 -2.031 1.00 0.00 N ATOM 2953 CA ALA B 83 76.845 -5.788 -2.466 1.00 0.00 C ATOM 2954 C ALA B 83 76.726 -7.153 -1.785 1.00 0.00 C ATOM 2955 O ALA B 83 76.787 -8.184 -2.425 1.00 0.00 O ATOM 2956 CB ALA B 83 78.171 -5.144 -2.072 1.00 0.00 C ATOM 0 H ALA B 83 76.005 -4.069 -1.524 1.00 0.00 H new ATOM 0 HA ALA B 83 76.803 -5.919 -3.547 1.00 0.00 H new ATOM 0 HB1 ALA B 83 78.995 -5.784 -2.388 1.00 0.00 H new ATOM 0 HB2 ALA B 83 78.261 -4.171 -2.556 1.00 0.00 H new ATOM 0 HB3 ALA B 83 78.206 -5.016 -0.990 1.00 0.00 H new ATOM 2962 N MET B 84 76.561 -7.173 -0.490 1.00 0.00 N ATOM 2963 CA MET B 84 76.440 -8.480 0.211 1.00 0.00 C ATOM 2964 C MET B 84 75.170 -9.155 -0.266 1.00 0.00 C ATOM 2965 O MET B 84 75.097 -10.362 -0.392 1.00 0.00 O ATOM 2966 CB MET B 84 76.382 -8.269 1.724 1.00 0.00 C ATOM 2967 CG MET B 84 77.744 -7.793 2.232 1.00 0.00 C ATOM 2968 SD MET B 84 77.682 -7.607 4.032 1.00 0.00 S ATOM 2969 CE MET B 84 76.458 -6.276 4.092 1.00 0.00 C ATOM 0 H MET B 84 76.505 -6.348 0.107 1.00 0.00 H new ATOM 0 HA MET B 84 77.307 -9.103 -0.011 1.00 0.00 H new ATOM 0 HB2 MET B 84 75.615 -7.534 1.969 1.00 0.00 H new ATOM 0 HB3 MET B 84 76.103 -9.199 2.220 1.00 0.00 H new ATOM 0 HG2 MET B 84 78.518 -8.509 1.956 1.00 0.00 H new ATOM 0 HG3 MET B 84 78.007 -6.843 1.766 1.00 0.00 H new ATOM 0 HE1 MET B 84 76.721 -5.575 4.884 1.00 0.00 H new ATOM 0 HE2 MET B 84 76.442 -5.753 3.136 1.00 0.00 H new ATOM 0 HE3 MET B 84 75.473 -6.697 4.292 1.00 0.00 H new ATOM 2979 N MET B 85 74.172 -8.378 -0.556 1.00 0.00 N ATOM 2980 CA MET B 85 72.909 -8.960 -1.055 1.00 0.00 C ATOM 2981 C MET B 85 73.236 -9.702 -2.346 1.00 0.00 C ATOM 2982 O MET B 85 72.640 -10.713 -2.659 1.00 0.00 O ATOM 2983 CB MET B 85 71.886 -7.846 -1.315 1.00 0.00 C ATOM 2984 CG MET B 85 70.553 -8.445 -1.791 1.00 0.00 C ATOM 2985 SD MET B 85 70.602 -8.691 -3.584 1.00 0.00 S ATOM 2986 CE MET B 85 69.891 -7.092 -4.055 1.00 0.00 C ATOM 0 H MET B 85 74.179 -7.362 -0.468 1.00 0.00 H new ATOM 0 HA MET B 85 72.475 -9.642 -0.324 1.00 0.00 H new ATOM 0 HB2 MET B 85 71.728 -7.268 -0.404 1.00 0.00 H new ATOM 0 HB3 MET B 85 72.272 -7.157 -2.067 1.00 0.00 H new ATOM 0 HG2 MET B 85 70.370 -9.395 -1.289 1.00 0.00 H new ATOM 0 HG3 MET B 85 69.730 -7.781 -1.527 1.00 0.00 H new ATOM 0 HE1 MET B 85 70.175 -6.855 -5.080 1.00 0.00 H new ATOM 0 HE2 MET B 85 68.805 -7.141 -3.981 1.00 0.00 H new ATOM 0 HE3 MET B 85 70.265 -6.316 -3.387 1.00 0.00 H new ATOM 2996 N CYS B 86 74.201 -9.217 -3.093 1.00 0.00 N ATOM 2997 CA CYS B 86 74.576 -9.914 -4.351 1.00 0.00 C ATOM 2998 C CYS B 86 75.835 -9.278 -4.948 1.00 0.00 C ATOM 2999 O CYS B 86 75.769 -8.531 -5.906 1.00 0.00 O ATOM 3000 CB CYS B 86 73.410 -9.836 -5.357 1.00 0.00 C ATOM 3001 SG CYS B 86 72.407 -11.343 -5.258 1.00 0.00 S ATOM 0 H CYS B 86 74.737 -8.375 -2.883 1.00 0.00 H new ATOM 0 HA CYS B 86 74.785 -10.961 -4.132 1.00 0.00 H new ATOM 0 HB2 CYS B 86 72.793 -8.963 -5.144 1.00 0.00 H new ATOM 0 HB3 CYS B 86 73.798 -9.713 -6.368 1.00 0.00 H new ATOM 0 HG CYS B 86 72.092 -11.574 -4.018 1.00 0.00 H new ATOM 3007 N ASN B 87 76.982 -9.586 -4.403 1.00 0.00 N ATOM 3008 CA ASN B 87 78.255 -9.021 -4.954 1.00 0.00 C ATOM 3009 C ASN B 87 78.893 -10.048 -5.889 1.00 0.00 C ATOM 3010 O ASN B 87 79.431 -9.706 -6.921 1.00 0.00 O ATOM 3011 CB ASN B 87 79.228 -8.705 -3.813 1.00 0.00 C ATOM 3012 CG ASN B 87 79.265 -9.864 -2.817 1.00 0.00 C ATOM 3013 OD1 ASN B 87 78.191 -10.162 -2.138 1.00 0.00 O flip ATOM 3014 ND2 ASN B 87 80.283 -10.507 -2.656 1.00 0.00 N flip ATOM 0 H ASN B 87 77.095 -10.204 -3.600 1.00 0.00 H new ATOM 0 HA ASN B 87 78.035 -8.103 -5.499 1.00 0.00 H new ATOM 0 HB2 ASN B 87 80.226 -8.528 -4.214 1.00 0.00 H new ATOM 0 HB3 ASN B 87 78.922 -7.790 -3.306 1.00 0.00 H new ATOM 0 HD21 ASN B 87 81.122 -10.274 -3.187 1.00 0.00 H new ATOM 0 HD22 ASN B 87 80.298 -11.280 -1.990 1.00 0.00 H new ATOM 3021 N GLU B 88 78.830 -11.304 -5.541 1.00 0.00 N ATOM 3022 CA GLU B 88 79.431 -12.348 -6.421 1.00 0.00 C ATOM 3023 C GLU B 88 79.056 -13.732 -5.892 1.00 0.00 C ATOM 3024 O GLU B 88 79.000 -14.695 -6.631 1.00 0.00 O ATOM 3025 CB GLU B 88 80.956 -12.202 -6.423 1.00 0.00 C ATOM 3026 CG GLU B 88 81.559 -13.122 -7.486 1.00 0.00 C ATOM 3027 CD GLU B 88 83.073 -12.917 -7.532 1.00 0.00 C ATOM 3028 OE1 GLU B 88 83.555 -12.042 -6.829 1.00 0.00 O ATOM 3029 OE2 GLU B 88 83.726 -13.634 -8.269 1.00 0.00 O ATOM 0 H GLU B 88 78.390 -11.652 -4.689 1.00 0.00 H new ATOM 0 HA GLU B 88 79.054 -12.228 -7.437 1.00 0.00 H new ATOM 0 HB2 GLU B 88 81.232 -11.167 -6.625 1.00 0.00 H new ATOM 0 HB3 GLU B 88 81.357 -12.453 -5.441 1.00 0.00 H new ATOM 0 HG2 GLU B 88 81.328 -14.162 -7.256 1.00 0.00 H new ATOM 0 HG3 GLU B 88 81.122 -12.906 -8.461 1.00 0.00 H new ATOM 3036 N PHE B 89 78.799 -13.840 -4.617 1.00 0.00 N ATOM 3037 CA PHE B 89 78.429 -15.166 -4.046 1.00 0.00 C ATOM 3038 C PHE B 89 77.141 -15.659 -4.700 1.00 0.00 C ATOM 3039 O PHE B 89 76.224 -14.902 -4.948 1.00 0.00 O ATOM 3040 CB PHE B 89 78.228 -15.037 -2.532 1.00 0.00 C ATOM 3041 CG PHE B 89 79.571 -14.870 -1.859 1.00 0.00 C ATOM 3042 CD1 PHE B 89 80.228 -13.636 -1.913 1.00 0.00 C ATOM 3043 CD2 PHE B 89 80.162 -15.948 -1.186 1.00 0.00 C ATOM 3044 CE1 PHE B 89 81.475 -13.479 -1.297 1.00 0.00 C ATOM 3045 CE2 PHE B 89 81.409 -15.792 -0.569 1.00 0.00 C ATOM 3046 CZ PHE B 89 82.067 -14.556 -0.626 1.00 0.00 C ATOM 0 H PHE B 89 78.829 -13.070 -3.948 1.00 0.00 H new ATOM 0 HA PHE B 89 79.228 -15.882 -4.240 1.00 0.00 H new ATOM 0 HB2 PHE B 89 77.589 -14.182 -2.311 1.00 0.00 H new ATOM 0 HB3 PHE B 89 77.722 -15.922 -2.145 1.00 0.00 H new ATOM 0 HD1 PHE B 89 79.773 -12.804 -2.430 1.00 0.00 H new ATOM 0 HD2 PHE B 89 79.655 -16.900 -1.143 1.00 0.00 H new ATOM 0 HE1 PHE B 89 81.981 -12.526 -1.339 1.00 0.00 H new ATOM 0 HE2 PHE B 89 81.863 -16.623 -0.050 1.00 0.00 H new ATOM 0 HZ PHE B 89 83.030 -14.434 -0.153 1.00 0.00 H new ATOM 3056 N PHE B 90 77.073 -16.925 -4.992 1.00 0.00 N ATOM 3057 CA PHE B 90 75.856 -17.483 -5.642 1.00 0.00 C ATOM 3058 C PHE B 90 74.816 -17.785 -4.570 1.00 0.00 C ATOM 3059 O PHE B 90 73.669 -18.066 -4.856 1.00 0.00 O ATOM 3060 CB PHE B 90 76.243 -18.773 -6.362 1.00 0.00 C ATOM 3061 CG PHE B 90 77.390 -18.484 -7.296 1.00 0.00 C ATOM 3062 CD1 PHE B 90 77.140 -17.989 -8.579 1.00 0.00 C ATOM 3063 CD2 PHE B 90 78.706 -18.707 -6.874 1.00 0.00 C ATOM 3064 CE1 PHE B 90 78.205 -17.717 -9.443 1.00 0.00 C ATOM 3065 CE2 PHE B 90 79.770 -18.434 -7.737 1.00 0.00 C ATOM 3066 CZ PHE B 90 79.521 -17.940 -9.023 1.00 0.00 C ATOM 0 H PHE B 90 77.813 -17.603 -4.807 1.00 0.00 H new ATOM 0 HA PHE B 90 75.442 -16.771 -6.355 1.00 0.00 H new ATOM 0 HB2 PHE B 90 76.529 -19.537 -5.639 1.00 0.00 H new ATOM 0 HB3 PHE B 90 75.392 -19.164 -6.920 1.00 0.00 H new ATOM 0 HD1 PHE B 90 76.124 -17.817 -8.903 1.00 0.00 H new ATOM 0 HD2 PHE B 90 78.898 -19.090 -5.883 1.00 0.00 H new ATOM 0 HE1 PHE B 90 78.012 -17.335 -10.434 1.00 0.00 H new ATOM 0 HE2 PHE B 90 80.786 -18.604 -7.412 1.00 0.00 H new ATOM 0 HZ PHE B 90 80.344 -17.731 -9.690 1.00 0.00 H new ATOM 3076 N GLU B 91 75.217 -17.720 -3.335 1.00 0.00 N ATOM 3077 CA GLU B 91 74.270 -17.992 -2.221 1.00 0.00 C ATOM 3078 C GLU B 91 73.381 -16.765 -2.004 1.00 0.00 C ATOM 3079 O GLU B 91 73.861 -15.653 -1.903 1.00 0.00 O ATOM 3080 CB GLU B 91 75.067 -18.275 -0.947 1.00 0.00 C ATOM 3081 CG GLU B 91 75.899 -19.545 -1.137 1.00 0.00 C ATOM 3082 CD GLU B 91 74.974 -20.761 -1.231 1.00 0.00 C ATOM 3083 OE1 GLU B 91 73.907 -20.716 -0.643 1.00 0.00 O ATOM 3084 OE2 GLU B 91 75.352 -21.719 -1.888 1.00 0.00 O ATOM 0 H GLU B 91 76.167 -17.488 -3.046 1.00 0.00 H new ATOM 0 HA GLU B 91 73.648 -18.853 -2.464 1.00 0.00 H new ATOM 0 HB2 GLU B 91 75.718 -17.432 -0.718 1.00 0.00 H new ATOM 0 HB3 GLU B 91 74.390 -18.394 -0.101 1.00 0.00 H new ATOM 0 HG2 GLU B 91 76.502 -19.464 -2.042 1.00 0.00 H new ATOM 0 HG3 GLU B 91 76.590 -19.666 -0.303 1.00 0.00 H new ATOM 3091 N GLY B 92 72.092 -16.954 -1.930 1.00 0.00 N ATOM 3092 CA GLY B 92 71.186 -15.792 -1.716 1.00 0.00 C ATOM 3093 C GLY B 92 71.264 -15.360 -0.253 1.00 0.00 C ATOM 3094 O GLY B 92 70.566 -15.878 0.598 1.00 0.00 O ATOM 0 H GLY B 92 71.629 -17.860 -2.008 1.00 0.00 H new ATOM 0 HA2 GLY B 92 71.473 -14.967 -2.368 1.00 0.00 H new ATOM 0 HA3 GLY B 92 70.162 -16.061 -1.975 1.00 0.00 H new ATOM 3098 N PHE B 93 72.111 -14.413 0.044 1.00 0.00 N ATOM 3099 CA PHE B 93 72.250 -13.932 1.449 1.00 0.00 C ATOM 3100 C PHE B 93 71.322 -12.712 1.646 1.00 0.00 C ATOM 3101 O PHE B 93 71.367 -11.789 0.855 1.00 0.00 O ATOM 3102 CB PHE B 93 73.703 -13.508 1.673 1.00 0.00 C ATOM 3103 CG PHE B 93 73.879 -12.995 3.085 1.00 0.00 C ATOM 3104 CD1 PHE B 93 73.983 -13.892 4.158 1.00 0.00 C ATOM 3105 CD2 PHE B 93 73.935 -11.614 3.319 1.00 0.00 C ATOM 3106 CE1 PHE B 93 74.143 -13.405 5.462 1.00 0.00 C ATOM 3107 CE2 PHE B 93 74.097 -11.130 4.620 1.00 0.00 C ATOM 3108 CZ PHE B 93 74.199 -12.023 5.692 1.00 0.00 C ATOM 0 H PHE B 93 72.718 -13.948 -0.631 1.00 0.00 H new ATOM 0 HA PHE B 93 71.980 -14.718 2.155 1.00 0.00 H new ATOM 0 HB2 PHE B 93 74.368 -14.354 1.499 1.00 0.00 H new ATOM 0 HB3 PHE B 93 73.979 -12.733 0.958 1.00 0.00 H new ATOM 0 HD1 PHE B 93 73.940 -14.956 3.980 1.00 0.00 H new ATOM 0 HD2 PHE B 93 73.853 -10.923 2.493 1.00 0.00 H new ATOM 0 HE1 PHE B 93 74.223 -14.094 6.290 1.00 0.00 H new ATOM 0 HE2 PHE B 93 74.143 -10.066 4.798 1.00 0.00 H new ATOM 0 HZ PHE B 93 74.321 -11.648 6.697 1.00 0.00 H new ATOM 3118 N PRO B 94 70.481 -12.675 2.668 1.00 0.00 N ATOM 3119 CA PRO B 94 69.583 -11.496 2.859 1.00 0.00 C ATOM 3120 C PRO B 94 70.375 -10.223 3.195 1.00 0.00 C ATOM 3121 O PRO B 94 71.542 -10.106 2.876 1.00 0.00 O ATOM 3122 CB PRO B 94 68.688 -11.942 4.033 1.00 0.00 C ATOM 3123 CG PRO B 94 69.331 -13.181 4.680 1.00 0.00 C ATOM 3124 CD PRO B 94 70.356 -13.761 3.690 1.00 0.00 C ATOM 0 HA PRO B 94 69.020 -11.234 1.964 1.00 0.00 H new ATOM 0 HB2 PRO B 94 68.590 -11.139 4.763 1.00 0.00 H new ATOM 0 HB3 PRO B 94 67.684 -12.175 3.679 1.00 0.00 H new ATOM 0 HG2 PRO B 94 69.818 -12.911 5.617 1.00 0.00 H new ATOM 0 HG3 PRO B 94 68.570 -13.924 4.918 1.00 0.00 H new ATOM 0 HD2 PRO B 94 71.310 -13.973 4.173 1.00 0.00 H new ATOM 0 HD3 PRO B 94 70.008 -14.694 3.248 1.00 0.00 H new ATOM 3132 N ASP B 95 69.753 -9.271 3.836 1.00 0.00 N ATOM 3133 CA ASP B 95 70.474 -8.017 4.190 1.00 0.00 C ATOM 3134 C ASP B 95 71.423 -8.302 5.355 1.00 0.00 C ATOM 3135 O ASP B 95 71.484 -9.406 5.857 1.00 0.00 O ATOM 3136 CB ASP B 95 69.463 -6.940 4.585 1.00 0.00 C ATOM 3137 CG ASP B 95 68.736 -7.368 5.861 1.00 0.00 C ATOM 3138 OD1 ASP B 95 68.820 -8.537 6.200 1.00 0.00 O ATOM 3139 OD2 ASP B 95 68.107 -6.524 6.476 1.00 0.00 O ATOM 0 H ASP B 95 68.777 -9.308 4.129 1.00 0.00 H new ATOM 0 HA ASP B 95 71.048 -7.662 3.334 1.00 0.00 H new ATOM 0 HB2 ASP B 95 69.972 -5.989 4.745 1.00 0.00 H new ATOM 0 HB3 ASP B 95 68.746 -6.786 3.779 1.00 0.00 H new ATOM 3144 N LYS B 96 72.183 -7.329 5.777 1.00 0.00 N ATOM 3145 CA LYS B 96 73.143 -7.575 6.892 1.00 0.00 C ATOM 3146 C LYS B 96 72.390 -7.672 8.236 1.00 0.00 C ATOM 3147 O LYS B 96 72.979 -7.951 9.260 1.00 0.00 O ATOM 3148 CB LYS B 96 74.178 -6.422 6.944 1.00 0.00 C ATOM 3149 CG LYS B 96 75.597 -6.981 7.148 1.00 0.00 C ATOM 3150 CD LYS B 96 75.684 -7.680 8.505 1.00 0.00 C ATOM 3151 CE LYS B 96 77.146 -7.983 8.845 1.00 0.00 C ATOM 3152 NZ LYS B 96 77.743 -8.849 7.787 1.00 0.00 N ATOM 0 H LYS B 96 72.182 -6.381 5.402 1.00 0.00 H new ATOM 0 HA LYS B 96 73.660 -8.518 6.717 1.00 0.00 H new ATOM 0 HB2 LYS B 96 74.137 -5.846 6.019 1.00 0.00 H new ATOM 0 HB3 LYS B 96 73.930 -5.739 7.756 1.00 0.00 H new ATOM 0 HG2 LYS B 96 75.840 -7.683 6.350 1.00 0.00 H new ATOM 0 HG3 LYS B 96 76.328 -6.174 7.096 1.00 0.00 H new ATOM 0 HD2 LYS B 96 75.246 -7.048 9.278 1.00 0.00 H new ATOM 0 HD3 LYS B 96 75.108 -8.605 8.485 1.00 0.00 H new ATOM 0 HE2 LYS B 96 77.710 -7.054 8.928 1.00 0.00 H new ATOM 0 HE3 LYS B 96 77.208 -8.481 9.813 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 78.537 -9.389 8.187 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 77.022 -9.508 7.430 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 78.087 -8.255 7.006 1.00 0.00 H new ATOM 3166 N GLN B 97 71.103 -7.437 8.246 1.00 0.00 N ATOM 3167 CA GLN B 97 70.341 -7.510 9.532 1.00 0.00 C ATOM 3168 C GLN B 97 70.129 -8.992 9.925 1.00 0.00 C ATOM 3169 O GLN B 97 69.732 -9.785 9.094 1.00 0.00 O ATOM 3170 CB GLN B 97 68.975 -6.835 9.344 1.00 0.00 C ATOM 3171 CG GLN B 97 68.255 -6.744 10.693 1.00 0.00 C ATOM 3172 CD GLN B 97 66.834 -6.217 10.486 1.00 0.00 C ATOM 3173 OE1 GLN B 97 66.511 -5.701 9.435 1.00 0.00 O ATOM 3174 NE2 GLN B 97 65.961 -6.331 11.451 1.00 0.00 N ATOM 0 H GLN B 97 70.548 -7.199 7.424 1.00 0.00 H new ATOM 0 HA GLN B 97 70.900 -7.003 10.318 1.00 0.00 H new ATOM 0 HB2 GLN B 97 69.106 -5.838 8.923 1.00 0.00 H new ATOM 0 HB3 GLN B 97 68.372 -7.404 8.636 1.00 0.00 H new ATOM 0 HG2 GLN B 97 68.224 -7.726 11.166 1.00 0.00 H new ATOM 0 HG3 GLN B 97 68.804 -6.084 11.365 1.00 0.00 H new ATOM 0 HE21 GLN B 97 66.231 -6.764 12.334 1.00 0.00 H new ATOM 0 HE22 GLN B 97 65.010 -5.987 11.321 1.00 0.00 H new ATOM 3183 N PRO B 98 70.378 -9.387 11.168 1.00 0.00 N ATOM 3184 CA PRO B 98 70.173 -10.815 11.564 1.00 0.00 C ATOM 3185 C PRO B 98 68.682 -11.193 11.588 1.00 0.00 C ATOM 3186 O PRO B 98 67.820 -10.340 11.524 1.00 0.00 O ATOM 3187 CB PRO B 98 70.786 -10.855 12.975 1.00 0.00 C ATOM 3188 CG PRO B 98 70.893 -9.408 13.481 1.00 0.00 C ATOM 3189 CD PRO B 98 70.863 -8.478 12.256 1.00 0.00 C ATOM 0 HA PRO B 98 70.624 -11.525 10.870 1.00 0.00 H new ATOM 0 HB2 PRO B 98 70.164 -11.449 13.645 1.00 0.00 H new ATOM 0 HB3 PRO B 98 71.769 -11.325 12.951 1.00 0.00 H new ATOM 0 HG2 PRO B 98 70.069 -9.177 14.156 1.00 0.00 H new ATOM 0 HG3 PRO B 98 71.815 -9.268 14.045 1.00 0.00 H new ATOM 0 HD2 PRO B 98 70.193 -7.632 12.406 1.00 0.00 H new ATOM 0 HD3 PRO B 98 71.848 -8.069 12.033 1.00 0.00 H new ATOM 3197 N ARG B 99 68.373 -12.464 11.679 1.00 0.00 N ATOM 3198 CA ARG B 99 66.936 -12.884 11.713 1.00 0.00 C ATOM 3199 C ARG B 99 66.449 -12.925 13.160 1.00 0.00 C ATOM 3200 O ARG B 99 65.803 -12.015 13.640 1.00 0.00 O ATOM 3201 CB ARG B 99 66.797 -14.281 11.100 1.00 0.00 C ATOM 3202 CG ARG B 99 65.333 -14.728 11.152 1.00 0.00 C ATOM 3203 CD ARG B 99 65.163 -16.039 10.378 1.00 0.00 C ATOM 3204 NE ARG B 99 65.943 -17.118 11.047 1.00 0.00 N ATOM 3205 CZ ARG B 99 65.699 -18.368 10.766 1.00 0.00 C ATOM 3206 NH1 ARG B 99 64.742 -18.676 9.933 1.00 0.00 N ATOM 3207 NH2 ARG B 99 66.397 -19.312 11.336 1.00 0.00 N ATOM 0 H ARG B 99 69.050 -13.226 11.731 1.00 0.00 H new ATOM 0 HA ARG B 99 66.340 -12.170 11.144 1.00 0.00 H new ATOM 0 HB2 ARG B 99 67.147 -14.272 10.068 1.00 0.00 H new ATOM 0 HB3 ARG B 99 67.423 -14.990 11.642 1.00 0.00 H new ATOM 0 HG2 ARG B 99 65.021 -14.863 12.188 1.00 0.00 H new ATOM 0 HG3 ARG B 99 64.692 -13.957 10.724 1.00 0.00 H new ATOM 0 HD2 ARG B 99 64.109 -16.313 10.333 1.00 0.00 H new ATOM 0 HD3 ARG B 99 65.504 -15.913 9.350 1.00 0.00 H new ATOM 0 HE ARG B 99 66.667 -16.879 11.724 1.00 0.00 H new ATOM 0 HH11 ARG B 99 64.185 -17.939 9.501 1.00 0.00 H new ATOM 0 HH12 ARG B 99 64.552 -19.654 9.714 1.00 0.00 H new ATOM 0 HH21 ARG B 99 67.133 -19.072 12.001 1.00 0.00 H new ATOM 0 HH22 ARG B 99 66.207 -20.290 11.117 1.00 0.00 H new ATOM 3221 N LYS B 100 66.766 -13.982 13.858 1.00 0.00 N ATOM 3222 CA LYS B 100 66.339 -14.103 15.282 1.00 0.00 C ATOM 3223 C LYS B 100 67.371 -13.425 16.180 1.00 0.00 C ATOM 3224 O LYS B 100 67.085 -13.048 17.301 1.00 0.00 O ATOM 3225 CB LYS B 100 66.252 -15.588 15.653 1.00 0.00 C ATOM 3226 CG LYS B 100 65.584 -15.772 17.025 1.00 0.00 C ATOM 3227 CD LYS B 100 64.076 -15.483 16.941 1.00 0.00 C ATOM 3228 CE LYS B 100 63.376 -16.057 18.175 1.00 0.00 C ATOM 3229 NZ LYS B 100 64.012 -15.513 19.408 1.00 0.00 N ATOM 0 H LYS B 100 67.305 -14.771 13.501 1.00 0.00 H new ATOM 0 HA LYS B 100 65.367 -13.627 15.416 1.00 0.00 H new ATOM 0 HB2 LYS B 100 65.684 -16.124 14.893 1.00 0.00 H new ATOM 0 HB3 LYS B 100 67.252 -16.022 15.670 1.00 0.00 H new ATOM 0 HG2 LYS B 100 65.745 -16.790 17.379 1.00 0.00 H new ATOM 0 HG3 LYS B 100 66.047 -15.105 17.752 1.00 0.00 H new ATOM 0 HD2 LYS B 100 63.904 -14.408 16.879 1.00 0.00 H new ATOM 0 HD3 LYS B 100 63.660 -15.925 16.036 1.00 0.00 H new ATOM 0 HE2 LYS B 100 62.317 -15.801 18.157 1.00 0.00 H new ATOM 0 HE3 LYS B 100 63.441 -17.145 18.170 1.00 0.00 H new ATOM 0 HZ1 LYS B 100 63.379 -15.661 20.220 1.00 0.00 H new ATOM 0 HZ2 LYS B 100 64.914 -16.002 19.578 1.00 0.00 H new ATOM 0 HZ3 LYS B 100 64.188 -14.495 19.288 1.00 0.00 H new ATOM 3243 N LYS B 101 68.572 -13.269 15.697 1.00 0.00 N ATOM 3244 CA LYS B 101 69.635 -12.622 16.520 1.00 0.00 C ATOM 3245 C LYS B 101 69.602 -11.111 16.292 1.00 0.00 C ATOM 3246 O LYS B 101 68.718 -10.658 15.584 1.00 0.00 O ATOM 3247 CB LYS B 101 71.000 -13.168 16.101 1.00 0.00 C ATOM 3248 CG LYS B 101 71.114 -14.636 16.516 1.00 0.00 C ATOM 3249 CD LYS B 101 72.483 -15.173 16.097 1.00 0.00 C ATOM 3250 CE LYS B 101 72.587 -16.649 16.475 1.00 0.00 C ATOM 3251 NZ LYS B 101 72.429 -16.788 17.949 1.00 0.00 N ATOM 3252 OXT LYS B 101 70.462 -10.434 16.829 1.00 0.00 O ATOM 0 H LYS B 101 68.865 -13.562 14.765 1.00 0.00 H new ATOM 0 HA LYS B 101 69.463 -12.836 17.575 1.00 0.00 H new ATOM 0 HB2 LYS B 101 71.125 -13.074 15.022 1.00 0.00 H new ATOM 0 HB3 LYS B 101 71.795 -12.585 16.566 1.00 0.00 H new ATOM 0 HG2 LYS B 101 70.987 -14.732 17.594 1.00 0.00 H new ATOM 0 HG3 LYS B 101 70.322 -15.221 16.048 1.00 0.00 H new ATOM 0 HD2 LYS B 101 72.620 -15.051 15.023 1.00 0.00 H new ATOM 0 HD3 LYS B 101 73.274 -14.604 16.586 1.00 0.00 H new ATOM 0 HE2 LYS B 101 71.818 -17.224 15.959 1.00 0.00 H new ATOM 0 HE3 LYS B 101 73.550 -17.050 16.161 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 72.854 -17.684 18.261 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 72.904 -15.995 18.425 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 71.418 -16.782 18.192 1.00 0.00 H new TER 3266 LYS B 101