USER MOD reduce.3.24.130724 H: found=0, std=0, add=1626, rem=0, adj=57 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 Set 1.1: A 73 GLN : amide:sc= -0.391 K(o=-1,f=-4.1) USER MOD Set 1.2: A 76 CYS SG : rot -53:sc= 0.00268 USER MOD Set 1.3: B 80 SER OG : rot 147:sc= 0.167 USER MOD Set 1.4: B 84 MET CE :methyl -167:sc= -0.804 (180deg=-0.925) USER MOD Set 2.1: A 80 SER OG : rot 150:sc= 0.111 USER MOD Set 2.2: A 84 MET CE :methyl -163:sc= -0.793 (180deg=-0.896) USER MOD Set 2.3: B 73 GLN : amide:sc= -0.937 K(o=-1.9,f=-3.2) USER MOD Set 2.4: B 76 CYS SG : rot -59:sc= -0.259! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 CYS SG : rot 79:sc= -2.15 USER MOD Single : A 7 LYS NZ :NH3+ -148:sc= -2.63 (180deg=-2.99) USER MOD Single : A 12 MET CE :methyl 159:sc= -0.225 (180deg=-1.39!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -152:sc= 0.766 USER MOD Single : A 17 HIS : no HE2:sc= -0.571 K(o=-0.57,f=-2.7!) USER MOD Single : A 18 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.214) USER MOD Single : A 19 TYR OH : rot 155:sc= -0.528 USER MOD Single : A 20 SER OG : rot 133:sc= -0.879 USER MOD Single : A 22 LYS NZ :NH3+ 168:sc= 0.703 (180deg=0.367) USER MOD Single : A 26 LYS NZ :NH3+ -148:sc= -0.917 (180deg=-2.13) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -1.9 X(o=-1.9,f=-1.5) USER MOD Single : A 31 LYS NZ :NH3+ -170:sc= -2.45! (180deg=-2.68) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -83:sc= 0.00371 USER MOD Single : A 44 SER OG : rot 180:sc= -0.0173 USER MOD Single : A 48 LYS NZ :NH3+ 160:sc= -0.101 (180deg=-0.592) USER MOD Single : A 50 THR OG1 : rot 160:sc= 0 USER MOD Single : A 56 GLN : amide:sc= 0 K(o=0,f=-1.6!) 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= -0.0695 K(o=-0.069,f=-1.7!) USER MOD Single : A 64 SER OG : rot -102:sc= 0.86 USER MOD Single : A 65 ASN : amide:sc= -0.0046 X(o=-0.0046,f=0) USER MOD Single : A 68 ASN : amide:sc= -0.383 X(o=-0.38,f=0) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot -25:sc= 0.00259 USER MOD Single : A 85 MET CE :methyl -119:sc=-0.00649 (180deg=-0.294) USER MOD Single : A 86 CYS SG : rot 32:sc= 0.122 USER MOD Single : A 87 ASN : amide:sc= -2.05 K(o=-2,f=-6.4!) USER MOD Single : A 96 LYS NZ :NH3+ -169:sc=-0.00438 (180deg=-0.191) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 100 LYS NZ :NH3+ 156:sc= -0.267 (180deg=-0.926) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 CYS SG : rot 78:sc= -2.4! USER MOD Single : B 7 LYS NZ :NH3+ -165:sc= -2.43 (180deg=-2.84) USER MOD Single : B 12 MET CE :methyl 159:sc= -0.186 (180deg=-1.31!) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot -116:sc= 0.774 USER MOD Single : B 17 HIS : no HE2:sc= 0.143 K(o=0.14,f=-2.4!) USER MOD Single : B 18 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.221) USER MOD Single : B 19 TYR OH : rot 150:sc= -0.547 USER MOD Single : B 20 SER OG : rot 131:sc= -0.904 USER MOD Single : B 22 LYS NZ :NH3+ 167:sc= 0.679 (180deg=0.155) USER MOD Single : B 26 LYS NZ :NH3+ -153:sc= -0.892 (180deg=-1.98!) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 ASN :FLIP amide:sc= -1.4 F(o=-2!,f=-1.4) USER MOD Single : B 31 LYS NZ :NH3+ -169:sc= -2.43! (180deg=-2.82) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot -84:sc= 0.00341 USER MOD Single : B 44 SER OG : rot 180:sc=-0.00796 USER MOD Single : B 48 LYS NZ :NH3+ 162:sc= -0.0744 (180deg=-0.46) USER MOD Single : B 50 THR OG1 : rot 160:sc= 0 USER MOD Single : B 56 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : B 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 ASN : amide:sc= -0.0612 K(o=-0.061,f=-1.7!) USER MOD Single : B 64 SER OG : rot -74:sc= 0.852 USER MOD Single : B 65 ASN : amide:sc=-0.00107 X(o=-0.0011,f=0) USER MOD Single : B 68 ASN : amide:sc= -0.339 X(o=-0.34,f=0) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 81 CYS SG : rot -22:sc= 0.00503 USER MOD Single : B 85 MET CE :methyl -124:sc=-0.00213 (180deg=-0.194) USER MOD Single : B 86 CYS SG : rot 25:sc= 0.151 USER MOD Single : B 87 ASN : amide:sc= -0.922 K(o=-0.92,f=-4.8!) USER MOD Single : B 96 LYS NZ :NH3+ -167:sc=-0.00565 (180deg=-0.194) USER MOD Single : B 97 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : B 100 LYS NZ :NH3+ 157:sc= -0.252 (180deg=-0.911) USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 79.770 2.041 -19.980 1.00 0.00 N ATOM 2 CA MET A 1 79.056 3.230 -20.522 1.00 0.00 C ATOM 3 C MET A 1 77.640 3.275 -19.943 1.00 0.00 C ATOM 4 O MET A 1 77.281 4.190 -19.228 1.00 0.00 O ATOM 5 CB MET A 1 78.991 3.126 -22.049 1.00 0.00 C ATOM 6 CG MET A 1 78.413 4.418 -22.631 1.00 0.00 C ATOM 7 SD MET A 1 79.595 5.766 -22.382 1.00 0.00 S ATOM 8 CE MET A 1 78.461 7.134 -22.722 1.00 0.00 C ATOM 0 H1 MET A 1 80.733 2.006 -20.371 1.00 0.00 H new ATOM 0 H2 MET A 1 79.819 2.108 -18.943 1.00 0.00 H new ATOM 0 H3 MET A 1 79.257 1.177 -20.247 1.00 0.00 H new ATOM 0 HA MET A 1 79.587 4.141 -20.245 1.00 0.00 H new ATOM 0 HB2 MET A 1 79.987 2.948 -22.454 1.00 0.00 H new ATOM 0 HB3 MET A 1 78.372 2.277 -22.339 1.00 0.00 H new ATOM 0 HG2 MET A 1 78.207 4.291 -23.694 1.00 0.00 H new ATOM 0 HG3 MET A 1 77.465 4.656 -22.148 1.00 0.00 H new ATOM 0 HE1 MET A 1 78.993 8.080 -22.623 1.00 0.00 H new ATOM 0 HE2 MET A 1 78.072 7.041 -23.736 1.00 0.00 H new ATOM 0 HE3 MET A 1 77.634 7.106 -22.012 1.00 0.00 H new ATOM 20 N ALA A 2 76.831 2.297 -20.247 1.00 0.00 N ATOM 21 CA ALA A 2 75.441 2.287 -19.709 1.00 0.00 C ATOM 22 C ALA A 2 75.479 2.266 -18.177 1.00 0.00 C ATOM 23 O ALA A 2 74.823 3.051 -17.522 1.00 0.00 O ATOM 24 CB ALA A 2 74.701 1.049 -20.220 1.00 0.00 C ATOM 0 H ALA A 2 77.072 1.506 -20.844 1.00 0.00 H new ATOM 0 HA ALA A 2 74.920 3.184 -20.044 1.00 0.00 H new ATOM 0 HB1 ALA A 2 73.685 1.044 -19.825 1.00 0.00 H new ATOM 0 HB2 ALA A 2 74.667 1.069 -21.309 1.00 0.00 H new ATOM 0 HB3 ALA A 2 75.223 0.151 -19.890 1.00 0.00 H new ATOM 30 N CYS A 3 76.242 1.373 -17.599 1.00 0.00 N ATOM 31 CA CYS A 3 76.321 1.299 -16.106 1.00 0.00 C ATOM 32 C CYS A 3 77.728 0.856 -15.683 1.00 0.00 C ATOM 33 O CYS A 3 77.917 -0.258 -15.235 1.00 0.00 O ATOM 34 CB CYS A 3 75.302 0.281 -15.590 1.00 0.00 C ATOM 35 SG CYS A 3 75.451 -1.253 -16.537 1.00 0.00 S ATOM 0 H CYS A 3 76.815 0.691 -18.096 1.00 0.00 H new ATOM 0 HA CYS A 3 76.106 2.282 -15.688 1.00 0.00 H new ATOM 0 HB2 CYS A 3 75.471 0.085 -14.531 1.00 0.00 H new ATOM 0 HB3 CYS A 3 74.293 0.682 -15.683 1.00 0.00 H new ATOM 0 HG CYS A 3 76.467 -1.936 -16.099 1.00 0.00 H new ATOM 41 N PRO A 4 78.710 1.713 -15.820 1.00 0.00 N ATOM 42 CA PRO A 4 80.103 1.354 -15.429 1.00 0.00 C ATOM 43 C PRO A 4 80.219 1.043 -13.927 1.00 0.00 C ATOM 44 O PRO A 4 81.163 0.420 -13.484 1.00 0.00 O ATOM 45 CB PRO A 4 80.905 2.613 -15.825 1.00 0.00 C ATOM 46 CG PRO A 4 79.943 3.616 -16.501 1.00 0.00 C ATOM 47 CD PRO A 4 78.506 3.083 -16.366 1.00 0.00 C ATOM 0 HA PRO A 4 80.464 0.447 -15.915 1.00 0.00 H new ATOM 0 HB2 PRO A 4 81.363 3.063 -14.944 1.00 0.00 H new ATOM 0 HB3 PRO A 4 81.715 2.348 -16.505 1.00 0.00 H new ATOM 0 HG2 PRO A 4 80.029 4.597 -16.033 1.00 0.00 H new ATOM 0 HG3 PRO A 4 80.203 3.741 -17.552 1.00 0.00 H new ATOM 0 HD2 PRO A 4 77.907 3.700 -15.696 1.00 0.00 H new ATOM 0 HD3 PRO A 4 77.991 3.063 -17.326 1.00 0.00 H new ATOM 55 N LEU A 5 79.264 1.472 -13.148 1.00 0.00 N ATOM 56 CA LEU A 5 79.315 1.202 -11.683 1.00 0.00 C ATOM 57 C LEU A 5 79.334 -0.310 -11.448 1.00 0.00 C ATOM 58 O LEU A 5 79.927 -0.792 -10.508 1.00 0.00 O ATOM 59 CB LEU A 5 78.088 1.827 -11.000 1.00 0.00 C ATOM 60 CG LEU A 5 78.074 1.497 -9.494 1.00 0.00 C ATOM 61 CD1 LEU A 5 79.338 2.045 -8.815 1.00 0.00 C ATOM 62 CD2 LEU A 5 76.836 2.143 -8.853 1.00 0.00 C ATOM 0 H LEU A 5 78.449 1.999 -13.463 1.00 0.00 H new ATOM 0 HA LEU A 5 80.218 1.643 -11.259 1.00 0.00 H new ATOM 0 HB2 LEU A 5 78.099 2.908 -11.140 1.00 0.00 H new ATOM 0 HB3 LEU A 5 77.177 1.454 -11.467 1.00 0.00 H new ATOM 0 HG LEU A 5 78.045 0.415 -9.366 1.00 0.00 H new ATOM 0 HD11 LEU A 5 79.314 1.804 -7.752 1.00 0.00 H new ATOM 0 HD12 LEU A 5 80.220 1.593 -9.269 1.00 0.00 H new ATOM 0 HD13 LEU A 5 79.379 3.127 -8.941 1.00 0.00 H new ATOM 0 HD21 LEU A 5 76.817 1.915 -7.787 1.00 0.00 H new ATOM 0 HD22 LEU A 5 76.876 3.223 -8.992 1.00 0.00 H new ATOM 0 HD23 LEU A 5 75.935 1.750 -9.324 1.00 0.00 H new ATOM 74 N GLU A 6 78.685 -1.059 -12.291 1.00 0.00 N ATOM 75 CA GLU A 6 78.653 -2.537 -12.104 1.00 0.00 C ATOM 76 C GLU A 6 80.076 -3.098 -12.128 1.00 0.00 C ATOM 77 O GLU A 6 80.418 -3.972 -11.357 1.00 0.00 O ATOM 78 CB GLU A 6 77.845 -3.151 -13.249 1.00 0.00 C ATOM 79 CG GLU A 6 76.367 -2.790 -13.087 1.00 0.00 C ATOM 80 CD GLU A 6 75.569 -3.367 -14.258 1.00 0.00 C ATOM 81 OE1 GLU A 6 76.190 -3.827 -15.203 1.00 0.00 O ATOM 82 OE2 GLU A 6 74.350 -3.334 -14.194 1.00 0.00 O ATOM 0 H GLU A 6 78.174 -0.713 -13.103 1.00 0.00 H new ATOM 0 HA GLU A 6 78.196 -2.778 -11.144 1.00 0.00 H new ATOM 0 HB2 GLU A 6 78.216 -2.785 -14.206 1.00 0.00 H new ATOM 0 HB3 GLU A 6 77.967 -4.234 -13.253 1.00 0.00 H new ATOM 0 HG2 GLU A 6 75.987 -3.184 -12.145 1.00 0.00 H new ATOM 0 HG3 GLU A 6 76.248 -1.707 -13.051 1.00 0.00 H new ATOM 89 N LYS A 7 80.913 -2.603 -12.993 1.00 0.00 N ATOM 90 CA LYS A 7 82.309 -3.109 -13.042 1.00 0.00 C ATOM 91 C LYS A 7 83.050 -2.602 -11.821 1.00 0.00 C ATOM 92 O LYS A 7 83.789 -3.320 -11.182 1.00 0.00 O ATOM 93 CB LYS A 7 83.005 -2.584 -14.296 1.00 0.00 C ATOM 94 CG LYS A 7 82.120 -2.847 -15.512 1.00 0.00 C ATOM 95 CD LYS A 7 82.950 -2.728 -16.792 1.00 0.00 C ATOM 96 CE LYS A 7 83.642 -1.364 -16.834 1.00 0.00 C ATOM 97 NZ LYS A 7 82.689 -0.308 -16.395 1.00 0.00 N ATOM 0 H LYS A 7 80.691 -1.871 -13.667 1.00 0.00 H new ATOM 0 HA LYS A 7 82.304 -4.199 -13.061 1.00 0.00 H new ATOM 0 HB2 LYS A 7 83.200 -1.516 -14.198 1.00 0.00 H new ATOM 0 HB3 LYS A 7 83.971 -3.074 -14.422 1.00 0.00 H new ATOM 0 HG2 LYS A 7 81.679 -3.842 -15.444 1.00 0.00 H new ATOM 0 HG3 LYS A 7 81.296 -2.134 -15.534 1.00 0.00 H new ATOM 0 HD2 LYS A 7 83.693 -3.525 -16.830 1.00 0.00 H new ATOM 0 HD3 LYS A 7 82.309 -2.848 -17.665 1.00 0.00 H new ATOM 0 HE2 LYS A 7 84.519 -1.369 -16.186 1.00 0.00 H new ATOM 0 HE3 LYS A 7 83.993 -1.154 -17.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 82.899 0.579 -16.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 81.717 -0.606 -16.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 82.785 -0.158 -15.370 1.00 0.00 H new ATOM 111 N ALA A 8 82.850 -1.364 -11.481 1.00 0.00 N ATOM 112 CA ALA A 8 83.551 -0.831 -10.290 1.00 0.00 C ATOM 113 C ALA A 8 83.121 -1.666 -9.097 1.00 0.00 C ATOM 114 O ALA A 8 83.925 -2.055 -8.274 1.00 0.00 O ATOM 115 CB ALA A 8 83.205 0.638 -10.073 1.00 0.00 C ATOM 0 H ALA A 8 82.241 -0.707 -11.969 1.00 0.00 H new ATOM 0 HA ALA A 8 84.631 -0.890 -10.426 1.00 0.00 H new ATOM 0 HB1 ALA A 8 83.730 1.009 -9.193 1.00 0.00 H new ATOM 0 HB2 ALA A 8 83.507 1.216 -10.947 1.00 0.00 H new ATOM 0 HB3 ALA A 8 82.130 0.740 -9.924 1.00 0.00 H new ATOM 121 N LEU A 9 81.867 -2.006 -9.022 1.00 0.00 N ATOM 122 CA LEU A 9 81.433 -2.885 -7.912 1.00 0.00 C ATOM 123 C LEU A 9 82.201 -4.177 -8.068 1.00 0.00 C ATOM 124 O LEU A 9 82.671 -4.761 -7.113 1.00 0.00 O ATOM 125 CB LEU A 9 79.933 -3.167 -7.992 1.00 0.00 C ATOM 126 CG LEU A 9 79.147 -1.900 -7.649 1.00 0.00 C ATOM 127 CD1 LEU A 9 77.664 -2.122 -7.970 1.00 0.00 C ATOM 128 CD2 LEU A 9 79.316 -1.552 -6.154 1.00 0.00 C ATOM 0 H LEU A 9 81.136 -1.717 -9.672 1.00 0.00 H new ATOM 0 HA LEU A 9 81.625 -2.411 -6.949 1.00 0.00 H new ATOM 0 HB2 LEU A 9 79.671 -3.508 -8.994 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.667 -3.968 -7.303 1.00 0.00 H new ATOM 0 HG LEU A 9 79.529 -1.070 -8.243 1.00 0.00 H new ATOM 0 HD11 LEU A 9 77.100 -1.221 -7.727 1.00 0.00 H new ATOM 0 HD12 LEU A 9 77.551 -2.346 -9.031 1.00 0.00 H new ATOM 0 HD13 LEU A 9 77.285 -2.957 -7.381 1.00 0.00 H new ATOM 0 HD21 LEU A 9 78.751 -0.648 -5.925 1.00 0.00 H new ATOM 0 HD22 LEU A 9 78.945 -2.376 -5.544 1.00 0.00 H new ATOM 0 HD23 LEU A 9 80.371 -1.386 -5.936 1.00 0.00 H new ATOM 140 N ASP A 10 82.353 -4.618 -9.285 1.00 0.00 N ATOM 141 CA ASP A 10 83.120 -5.863 -9.509 1.00 0.00 C ATOM 142 C ASP A 10 84.572 -5.601 -9.119 1.00 0.00 C ATOM 143 O ASP A 10 85.232 -6.442 -8.551 1.00 0.00 O ATOM 144 CB ASP A 10 83.028 -6.287 -10.976 1.00 0.00 C ATOM 145 CG ASP A 10 83.572 -7.708 -11.128 1.00 0.00 C ATOM 146 OD1 ASP A 10 84.200 -8.183 -10.196 1.00 0.00 O ATOM 147 OD2 ASP A 10 83.352 -8.298 -12.172 1.00 0.00 O ATOM 0 H ASP A 10 81.981 -4.172 -10.124 1.00 0.00 H new ATOM 0 HA ASP A 10 82.711 -6.671 -8.903 1.00 0.00 H new ATOM 0 HB2 ASP A 10 81.993 -6.244 -11.314 1.00 0.00 H new ATOM 0 HB3 ASP A 10 83.597 -5.599 -11.601 1.00 0.00 H new ATOM 152 N VAL A 11 85.076 -4.432 -9.416 1.00 0.00 N ATOM 153 CA VAL A 11 86.489 -4.127 -9.046 1.00 0.00 C ATOM 154 C VAL A 11 86.634 -4.232 -7.527 1.00 0.00 C ATOM 155 O VAL A 11 87.604 -4.760 -7.020 1.00 0.00 O ATOM 156 CB VAL A 11 86.838 -2.698 -9.489 1.00 0.00 C ATOM 157 CG1 VAL A 11 88.209 -2.295 -8.936 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.852 -2.607 -11.025 1.00 0.00 C ATOM 0 H VAL A 11 84.576 -3.682 -9.894 1.00 0.00 H new ATOM 0 HA VAL A 11 87.160 -4.832 -9.536 1.00 0.00 H new ATOM 0 HB VAL A 11 86.081 -2.018 -9.099 1.00 0.00 H new ATOM 0 HG11 VAL A 11 88.447 -1.280 -9.256 1.00 0.00 H new ATOM 0 HG12 VAL A 11 88.189 -2.337 -7.847 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.969 -2.981 -9.311 1.00 0.00 H new ATOM 0 HG21 VAL A 11 87.101 -1.590 -11.327 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.597 -3.296 -11.424 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.869 -2.871 -11.414 1.00 0.00 H new ATOM 168 N MET A 12 85.674 -3.733 -6.798 1.00 0.00 N ATOM 169 CA MET A 12 85.756 -3.807 -5.313 1.00 0.00 C ATOM 170 C MET A 12 85.730 -5.271 -4.885 1.00 0.00 C ATOM 171 O MET A 12 86.436 -5.686 -3.991 1.00 0.00 O ATOM 172 CB MET A 12 84.555 -3.081 -4.704 1.00 0.00 C ATOM 173 CG MET A 12 84.700 -1.570 -4.908 1.00 0.00 C ATOM 174 SD MET A 12 83.084 -0.774 -4.713 1.00 0.00 S ATOM 175 CE MET A 12 82.572 -1.624 -3.199 1.00 0.00 C ATOM 0 H MET A 12 84.838 -3.278 -7.166 1.00 0.00 H new ATOM 0 HA MET A 12 86.678 -3.338 -4.970 1.00 0.00 H new ATOM 0 HB2 MET A 12 83.633 -3.432 -5.168 1.00 0.00 H new ATOM 0 HB3 MET A 12 84.483 -3.308 -3.640 1.00 0.00 H new ATOM 0 HG2 MET A 12 85.408 -1.161 -4.187 1.00 0.00 H new ATOM 0 HG3 MET A 12 85.101 -1.363 -5.900 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.798 -1.042 -2.699 1.00 0.00 H new ATOM 0 HE2 MET A 12 82.179 -2.609 -3.450 1.00 0.00 H new ATOM 0 HE3 MET A 12 83.430 -1.733 -2.535 1.00 0.00 H new ATOM 185 N VAL A 13 84.901 -6.051 -5.515 1.00 0.00 N ATOM 186 CA VAL A 13 84.803 -7.491 -5.153 1.00 0.00 C ATOM 187 C VAL A 13 85.944 -8.290 -5.798 1.00 0.00 C ATOM 188 O VAL A 13 86.575 -9.109 -5.159 1.00 0.00 O ATOM 189 CB VAL A 13 83.460 -8.030 -5.637 1.00 0.00 C ATOM 190 CG1 VAL A 13 83.330 -9.505 -5.254 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.335 -7.226 -4.982 1.00 0.00 C ATOM 0 H VAL A 13 84.283 -5.752 -6.270 1.00 0.00 H new ATOM 0 HA VAL A 13 84.881 -7.595 -4.071 1.00 0.00 H new ATOM 0 HB VAL A 13 83.395 -7.937 -6.721 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.370 -9.888 -5.601 1.00 0.00 H new ATOM 0 HG12 VAL A 13 84.136 -10.074 -5.717 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.391 -9.606 -4.170 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.371 -7.605 -5.323 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.401 -7.324 -3.898 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.430 -6.176 -5.258 1.00 0.00 H new ATOM 201 N SER A 14 86.208 -8.074 -7.062 1.00 0.00 N ATOM 202 CA SER A 14 87.297 -8.842 -7.734 1.00 0.00 C ATOM 203 C SER A 14 88.625 -8.572 -7.029 1.00 0.00 C ATOM 204 O SER A 14 89.367 -9.481 -6.715 1.00 0.00 O ATOM 205 CB SER A 14 87.401 -8.410 -9.198 1.00 0.00 C ATOM 206 OG SER A 14 88.415 -9.173 -9.840 1.00 0.00 O ATOM 0 H SER A 14 85.719 -7.403 -7.654 1.00 0.00 H new ATOM 0 HA SER A 14 87.070 -9.907 -7.685 1.00 0.00 H new ATOM 0 HB2 SER A 14 86.445 -8.556 -9.702 1.00 0.00 H new ATOM 0 HB3 SER A 14 87.635 -7.347 -9.260 1.00 0.00 H new ATOM 0 HG SER A 14 88.484 -8.901 -10.779 1.00 0.00 H new ATOM 212 N THR A 15 88.925 -7.334 -6.767 1.00 0.00 N ATOM 213 CA THR A 15 90.198 -7.010 -6.071 1.00 0.00 C ATOM 214 C THR A 15 90.177 -7.635 -4.672 1.00 0.00 C ATOM 215 O THR A 15 91.162 -8.147 -4.190 1.00 0.00 O ATOM 216 CB THR A 15 90.352 -5.482 -5.991 1.00 0.00 C ATOM 217 OG1 THR A 15 91.728 -5.153 -5.896 1.00 0.00 O ATOM 218 CG2 THR A 15 89.606 -4.911 -4.780 1.00 0.00 C ATOM 0 H THR A 15 88.343 -6.531 -7.005 1.00 0.00 H new ATOM 0 HA THR A 15 91.048 -7.416 -6.619 1.00 0.00 H new ATOM 0 HB THR A 15 89.922 -5.046 -6.893 1.00 0.00 H new ATOM 0 HG1 THR A 15 91.829 -4.306 -5.413 1.00 0.00 H new ATOM 0 HG21 THR A 15 89.734 -3.829 -4.751 1.00 0.00 H new ATOM 0 HG22 THR A 15 88.545 -5.149 -4.861 1.00 0.00 H new ATOM 0 HG23 THR A 15 90.008 -5.348 -3.866 1.00 0.00 H new ATOM 226 N PHE A 16 89.049 -7.580 -4.026 1.00 0.00 N ATOM 227 CA PHE A 16 88.927 -8.142 -2.647 1.00 0.00 C ATOM 228 C PHE A 16 89.244 -9.640 -2.637 1.00 0.00 C ATOM 229 O PHE A 16 89.892 -10.136 -1.736 1.00 0.00 O ATOM 230 CB PHE A 16 87.485 -7.946 -2.173 1.00 0.00 C ATOM 231 CG PHE A 16 87.312 -8.517 -0.788 1.00 0.00 C ATOM 232 CD1 PHE A 16 87.068 -9.886 -0.626 1.00 0.00 C ATOM 233 CD2 PHE A 16 87.378 -7.680 0.330 1.00 0.00 C ATOM 234 CE1 PHE A 16 86.889 -10.418 0.656 1.00 0.00 C ATOM 235 CE2 PHE A 16 87.201 -8.212 1.613 1.00 0.00 C ATOM 236 CZ PHE A 16 86.957 -9.581 1.775 1.00 0.00 C ATOM 0 H PHE A 16 88.194 -7.165 -4.396 1.00 0.00 H new ATOM 0 HA PHE A 16 89.632 -7.630 -1.992 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.236 -6.885 -2.171 1.00 0.00 H new ATOM 0 HB3 PHE A 16 86.797 -8.434 -2.864 1.00 0.00 H new ATOM 0 HD1 PHE A 16 87.018 -10.532 -1.490 1.00 0.00 H new ATOM 0 HD2 PHE A 16 87.565 -6.624 0.204 1.00 0.00 H new ATOM 0 HE1 PHE A 16 86.699 -11.474 0.781 1.00 0.00 H new ATOM 0 HE2 PHE A 16 87.253 -7.567 2.477 1.00 0.00 H new ATOM 0 HZ PHE A 16 86.821 -9.991 2.765 1.00 0.00 H new ATOM 246 N HIS A 17 88.801 -10.364 -3.621 1.00 0.00 N ATOM 247 CA HIS A 17 89.084 -11.826 -3.651 1.00 0.00 C ATOM 248 C HIS A 17 90.584 -12.047 -3.840 1.00 0.00 C ATOM 249 O HIS A 17 91.141 -13.014 -3.361 1.00 0.00 O ATOM 250 CB HIS A 17 88.293 -12.489 -4.790 1.00 0.00 C ATOM 251 CG HIS A 17 86.893 -12.788 -4.323 1.00 0.00 C ATOM 252 ND1 HIS A 17 85.881 -11.838 -4.345 1.00 0.00 N ATOM 253 CD2 HIS A 17 86.329 -13.924 -3.797 1.00 0.00 C ATOM 254 CE1 HIS A 17 84.772 -12.418 -3.846 1.00 0.00 C ATOM 255 NE2 HIS A 17 84.994 -13.685 -3.498 1.00 0.00 N ATOM 0 H HIS A 17 88.255 -10.010 -4.407 1.00 0.00 H new ATOM 0 HA HIS A 17 88.775 -12.278 -2.709 1.00 0.00 H new ATOM 0 HB2 HIS A 17 88.265 -11.831 -5.658 1.00 0.00 H new ATOM 0 HB3 HIS A 17 88.787 -13.409 -5.103 1.00 0.00 H new ATOM 0 HD1 HIS A 17 85.962 -10.877 -4.678 1.00 0.00 H new ATOM 0 HD2 HIS A 17 86.845 -14.860 -3.640 1.00 0.00 H new ATOM 0 HE1 HIS A 17 83.821 -11.918 -3.741 1.00 0.00 H new ATOM 264 N LYS A 18 91.245 -11.161 -4.527 1.00 0.00 N ATOM 265 CA LYS A 18 92.706 -11.336 -4.729 1.00 0.00 C ATOM 266 C LYS A 18 93.390 -11.360 -3.361 1.00 0.00 C ATOM 267 O LYS A 18 94.260 -12.169 -3.106 1.00 0.00 O ATOM 268 CB LYS A 18 93.244 -10.160 -5.555 1.00 0.00 C ATOM 269 CG LYS A 18 94.755 -10.299 -5.791 1.00 0.00 C ATOM 270 CD LYS A 18 95.063 -11.588 -6.569 1.00 0.00 C ATOM 271 CE LYS A 18 96.431 -11.466 -7.247 1.00 0.00 C ATOM 272 NZ LYS A 18 97.467 -11.152 -6.222 1.00 0.00 N ATOM 0 H LYS A 18 90.840 -10.328 -4.955 1.00 0.00 H new ATOM 0 HA LYS A 18 92.906 -12.268 -5.257 1.00 0.00 H new ATOM 0 HB2 LYS A 18 92.725 -10.116 -6.513 1.00 0.00 H new ATOM 0 HB3 LYS A 18 93.038 -9.223 -5.038 1.00 0.00 H new ATOM 0 HG2 LYS A 18 95.123 -9.436 -6.346 1.00 0.00 H new ATOM 0 HG3 LYS A 18 95.279 -10.311 -4.835 1.00 0.00 H new ATOM 0 HD2 LYS A 18 95.056 -12.443 -5.893 1.00 0.00 H new ATOM 0 HD3 LYS A 18 94.290 -11.767 -7.317 1.00 0.00 H new ATOM 0 HE2 LYS A 18 96.680 -12.396 -7.758 1.00 0.00 H new ATOM 0 HE3 LYS A 18 96.405 -10.683 -8.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 98.409 -11.382 -6.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 97.426 -10.140 -5.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 97.290 -11.715 -5.366 1.00 0.00 H new ATOM 286 N TYR A 19 92.991 -10.487 -2.472 1.00 0.00 N ATOM 287 CA TYR A 19 93.611 -10.479 -1.112 1.00 0.00 C ATOM 288 C TYR A 19 92.999 -11.599 -0.279 1.00 0.00 C ATOM 289 O TYR A 19 93.670 -12.261 0.488 1.00 0.00 O ATOM 290 CB TYR A 19 93.360 -9.137 -0.421 1.00 0.00 C ATOM 291 CG TYR A 19 94.105 -8.057 -1.160 1.00 0.00 C ATOM 292 CD1 TYR A 19 95.446 -7.796 -0.860 1.00 0.00 C ATOM 293 CD2 TYR A 19 93.454 -7.324 -2.155 1.00 0.00 C ATOM 294 CE1 TYR A 19 96.139 -6.803 -1.561 1.00 0.00 C ATOM 295 CE2 TYR A 19 94.141 -6.329 -2.856 1.00 0.00 C ATOM 296 CZ TYR A 19 95.487 -6.068 -2.561 1.00 0.00 C ATOM 297 OH TYR A 19 96.172 -5.093 -3.255 1.00 0.00 O ATOM 0 H TYR A 19 92.268 -9.784 -2.627 1.00 0.00 H new ATOM 0 HA TYR A 19 94.686 -10.629 -1.209 1.00 0.00 H new ATOM 0 HB2 TYR A 19 92.293 -8.915 -0.406 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.691 -9.180 0.617 1.00 0.00 H new ATOM 0 HD1 TYR A 19 95.946 -8.361 -0.087 1.00 0.00 H new ATOM 0 HD2 TYR A 19 92.418 -7.526 -2.383 1.00 0.00 H new ATOM 0 HE1 TYR A 19 97.175 -6.603 -1.332 1.00 0.00 H new ATOM 0 HE2 TYR A 19 93.636 -5.762 -3.624 1.00 0.00 H new ATOM 0 HH TYR A 19 95.755 -4.962 -4.132 1.00 0.00 H new ATOM 307 N SER A 20 91.724 -11.813 -0.433 1.00 0.00 N ATOM 308 CA SER A 20 91.049 -12.886 0.338 1.00 0.00 C ATOM 309 C SER A 20 91.551 -14.233 -0.181 1.00 0.00 C ATOM 310 O SER A 20 91.317 -15.270 0.408 1.00 0.00 O ATOM 311 CB SER A 20 89.531 -12.759 0.146 1.00 0.00 C ATOM 312 OG SER A 20 88.870 -13.161 1.338 1.00 0.00 O ATOM 0 H SER A 20 91.119 -11.287 -1.064 1.00 0.00 H new ATOM 0 HA SER A 20 91.271 -12.804 1.402 1.00 0.00 H new ATOM 0 HB2 SER A 20 89.269 -11.730 -0.099 1.00 0.00 H new ATOM 0 HB3 SER A 20 89.206 -13.378 -0.690 1.00 0.00 H new ATOM 0 HG SER A 20 88.183 -12.502 1.569 1.00 0.00 H new ATOM 318 N GLY A 21 92.250 -14.216 -1.284 1.00 0.00 N ATOM 319 CA GLY A 21 92.783 -15.487 -1.854 1.00 0.00 C ATOM 320 C GLY A 21 94.111 -15.823 -1.176 1.00 0.00 C ATOM 321 O GLY A 21 94.508 -16.967 -1.093 1.00 0.00 O ATOM 0 H GLY A 21 92.475 -13.375 -1.816 1.00 0.00 H new ATOM 0 HA2 GLY A 21 92.068 -16.296 -1.702 1.00 0.00 H new ATOM 0 HA3 GLY A 21 92.925 -15.386 -2.930 1.00 0.00 H new ATOM 325 N LYS A 22 94.800 -14.829 -0.686 1.00 0.00 N ATOM 326 CA LYS A 22 96.100 -15.083 -0.005 1.00 0.00 C ATOM 327 C LYS A 22 95.858 -16.001 1.192 1.00 0.00 C ATOM 328 O LYS A 22 96.634 -16.893 1.477 1.00 0.00 O ATOM 329 CB LYS A 22 96.688 -13.760 0.489 1.00 0.00 C ATOM 330 CG LYS A 22 97.038 -12.873 -0.708 1.00 0.00 C ATOM 331 CD LYS A 22 97.908 -11.701 -0.244 1.00 0.00 C ATOM 332 CE LYS A 22 97.206 -10.942 0.885 1.00 0.00 C ATOM 333 NZ LYS A 22 97.840 -9.604 1.047 1.00 0.00 N ATOM 0 H LYS A 22 94.518 -13.850 -0.728 1.00 0.00 H new ATOM 0 HA LYS A 22 96.795 -15.550 -0.703 1.00 0.00 H new ATOM 0 HB2 LYS A 22 95.972 -13.251 1.134 1.00 0.00 H new ATOM 0 HB3 LYS A 22 97.579 -13.948 1.088 1.00 0.00 H new ATOM 0 HG2 LYS A 22 97.567 -13.455 -1.462 1.00 0.00 H new ATOM 0 HG3 LYS A 22 96.127 -12.500 -1.175 1.00 0.00 H new ATOM 0 HD2 LYS A 22 98.875 -12.069 0.100 1.00 0.00 H new ATOM 0 HD3 LYS A 22 98.102 -11.028 -1.080 1.00 0.00 H new ATOM 0 HE2 LYS A 22 96.146 -10.830 0.659 1.00 0.00 H new ATOM 0 HE3 LYS A 22 97.276 -11.505 1.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 97.248 -9.011 1.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 98.781 -9.715 1.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 97.934 -9.150 0.116 1.00 0.00 H new ATOM 347 N GLU A 23 94.780 -15.781 1.900 1.00 0.00 N ATOM 348 CA GLU A 23 94.460 -16.622 3.092 1.00 0.00 C ATOM 349 C GLU A 23 93.497 -17.736 2.700 1.00 0.00 C ATOM 350 O GLU A 23 92.768 -17.637 1.733 1.00 0.00 O ATOM 351 CB GLU A 23 93.816 -15.748 4.172 1.00 0.00 C ATOM 352 CG GLU A 23 94.895 -14.896 4.830 1.00 0.00 C ATOM 353 CD GLU A 23 94.271 -14.014 5.913 1.00 0.00 C ATOM 354 OE1 GLU A 23 93.055 -13.954 5.974 1.00 0.00 O ATOM 355 OE2 GLU A 23 95.021 -13.409 6.660 1.00 0.00 O ATOM 0 H GLU A 23 94.101 -15.047 1.701 1.00 0.00 H new ATOM 0 HA GLU A 23 95.379 -17.064 3.476 1.00 0.00 H new ATOM 0 HB2 GLU A 23 93.049 -15.110 3.732 1.00 0.00 H new ATOM 0 HB3 GLU A 23 93.323 -16.372 4.917 1.00 0.00 H new ATOM 0 HG2 GLU A 23 95.661 -15.537 5.267 1.00 0.00 H new ATOM 0 HG3 GLU A 23 95.388 -14.275 4.082 1.00 0.00 H new ATOM 362 N GLY A 24 93.491 -18.797 3.452 1.00 0.00 N ATOM 363 CA GLY A 24 92.583 -19.928 3.138 1.00 0.00 C ATOM 364 C GLY A 24 91.134 -19.446 3.173 1.00 0.00 C ATOM 365 O GLY A 24 90.324 -19.829 2.352 1.00 0.00 O ATOM 0 H GLY A 24 94.079 -18.929 4.275 1.00 0.00 H new ATOM 0 HA2 GLY A 24 92.818 -20.334 2.154 1.00 0.00 H new ATOM 0 HA3 GLY A 24 92.726 -20.734 3.858 1.00 0.00 H new ATOM 369 N ASP A 25 90.795 -18.609 4.115 1.00 0.00 N ATOM 370 CA ASP A 25 89.396 -18.107 4.193 1.00 0.00 C ATOM 371 C ASP A 25 89.206 -16.985 3.167 1.00 0.00 C ATOM 372 O ASP A 25 89.899 -15.987 3.188 1.00 0.00 O ATOM 373 CB ASP A 25 89.131 -17.578 5.603 1.00 0.00 C ATOM 374 CG ASP A 25 90.341 -16.775 6.086 1.00 0.00 C ATOM 375 OD1 ASP A 25 90.699 -15.818 5.419 1.00 0.00 O ATOM 376 OD2 ASP A 25 90.892 -17.134 7.113 1.00 0.00 O ATOM 0 H ASP A 25 91.426 -18.252 4.833 1.00 0.00 H new ATOM 0 HA ASP A 25 88.696 -18.914 3.975 1.00 0.00 H new ATOM 0 HB2 ASP A 25 88.240 -16.950 5.605 1.00 0.00 H new ATOM 0 HB3 ASP A 25 88.937 -18.408 6.283 1.00 0.00 H new ATOM 381 N LYS A 26 88.282 -17.152 2.254 1.00 0.00 N ATOM 382 CA LYS A 26 88.050 -16.111 1.204 1.00 0.00 C ATOM 383 C LYS A 26 86.834 -15.258 1.569 1.00 0.00 C ATOM 384 O LYS A 26 86.462 -14.352 0.849 1.00 0.00 O ATOM 385 CB LYS A 26 87.776 -16.809 -0.130 1.00 0.00 C ATOM 386 CG LYS A 26 88.979 -17.671 -0.511 1.00 0.00 C ATOM 387 CD LYS A 26 88.701 -18.368 -1.844 1.00 0.00 C ATOM 388 CE LYS A 26 89.899 -19.239 -2.226 1.00 0.00 C ATOM 389 NZ LYS A 26 91.095 -18.379 -2.441 1.00 0.00 N ATOM 0 H LYS A 26 87.675 -17.969 2.190 1.00 0.00 H new ATOM 0 HA LYS A 26 88.930 -15.473 1.130 1.00 0.00 H new ATOM 0 HB2 LYS A 26 86.882 -17.428 -0.052 1.00 0.00 H new ATOM 0 HB3 LYS A 26 87.585 -16.069 -0.907 1.00 0.00 H new ATOM 0 HG2 LYS A 26 89.873 -17.053 -0.591 1.00 0.00 H new ATOM 0 HG3 LYS A 26 89.171 -18.411 0.266 1.00 0.00 H new ATOM 0 HD2 LYS A 26 87.803 -18.981 -1.765 1.00 0.00 H new ATOM 0 HD3 LYS A 26 88.514 -17.627 -2.621 1.00 0.00 H new ATOM 0 HE2 LYS A 26 90.098 -19.966 -1.439 1.00 0.00 H new ATOM 0 HE3 LYS A 26 89.677 -19.803 -3.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 91.702 -18.804 -3.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 90.792 -17.434 -2.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 91.628 -18.297 -1.552 1.00 0.00 H new ATOM 403 N PHE A 27 86.201 -15.551 2.671 1.00 0.00 N ATOM 404 CA PHE A 27 84.990 -14.773 3.080 1.00 0.00 C ATOM 405 C PHE A 27 85.375 -13.730 4.129 1.00 0.00 C ATOM 406 O PHE A 27 84.538 -13.007 4.631 1.00 0.00 O ATOM 407 CB PHE A 27 83.967 -15.740 3.681 1.00 0.00 C ATOM 408 CG PHE A 27 83.457 -16.665 2.603 1.00 0.00 C ATOM 409 CD1 PHE A 27 84.139 -17.855 2.318 1.00 0.00 C ATOM 410 CD2 PHE A 27 82.298 -16.337 1.892 1.00 0.00 C ATOM 411 CE1 PHE A 27 83.661 -18.714 1.322 1.00 0.00 C ATOM 412 CE2 PHE A 27 81.820 -17.195 0.895 1.00 0.00 C ATOM 413 CZ PHE A 27 82.502 -18.384 0.609 1.00 0.00 C ATOM 0 H PHE A 27 86.469 -16.299 3.311 1.00 0.00 H new ATOM 0 HA PHE A 27 84.567 -14.267 2.212 1.00 0.00 H new ATOM 0 HB2 PHE A 27 84.424 -16.317 4.484 1.00 0.00 H new ATOM 0 HB3 PHE A 27 83.139 -15.184 4.120 1.00 0.00 H new ATOM 0 HD1 PHE A 27 85.034 -18.109 2.867 1.00 0.00 H new ATOM 0 HD2 PHE A 27 81.771 -15.420 2.113 1.00 0.00 H new ATOM 0 HE1 PHE A 27 84.186 -19.632 1.103 1.00 0.00 H new ATOM 0 HE2 PHE A 27 80.925 -16.940 0.346 1.00 0.00 H new ATOM 0 HZ PHE A 27 82.134 -19.046 -0.161 1.00 0.00 H new ATOM 423 N LYS A 28 86.630 -13.653 4.476 1.00 0.00 N ATOM 424 CA LYS A 28 87.049 -12.659 5.509 1.00 0.00 C ATOM 425 C LYS A 28 88.558 -12.410 5.426 1.00 0.00 C ATOM 426 O LYS A 28 89.296 -13.208 4.882 1.00 0.00 O ATOM 427 CB LYS A 28 86.710 -13.212 6.891 1.00 0.00 C ATOM 428 CG LYS A 28 87.289 -14.621 7.019 1.00 0.00 C ATOM 429 CD LYS A 28 86.966 -15.196 8.398 1.00 0.00 C ATOM 430 CE LYS A 28 87.634 -16.564 8.547 1.00 0.00 C ATOM 431 NZ LYS A 28 87.422 -17.074 9.932 1.00 0.00 N ATOM 0 H LYS A 28 87.380 -14.229 4.094 1.00 0.00 H new ATOM 0 HA LYS A 28 86.525 -11.719 5.336 1.00 0.00 H new ATOM 0 HB2 LYS A 28 87.120 -12.565 7.666 1.00 0.00 H new ATOM 0 HB3 LYS A 28 85.630 -13.235 7.033 1.00 0.00 H new ATOM 0 HG2 LYS A 28 86.876 -15.264 6.242 1.00 0.00 H new ATOM 0 HG3 LYS A 28 88.369 -14.594 6.871 1.00 0.00 H new ATOM 0 HD2 LYS A 28 87.318 -14.520 9.178 1.00 0.00 H new ATOM 0 HD3 LYS A 28 85.887 -15.290 8.521 1.00 0.00 H new ATOM 0 HE2 LYS A 28 87.218 -17.264 7.823 1.00 0.00 H new ATOM 0 HE3 LYS A 28 88.701 -16.484 8.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 87.876 -18.004 10.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 87.839 -16.409 10.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 86.402 -17.165 10.116 1.00 0.00 H new ATOM 445 N LEU A 29 89.024 -11.314 5.988 1.00 0.00 N ATOM 446 CA LEU A 29 90.497 -11.012 5.975 1.00 0.00 C ATOM 447 C LEU A 29 90.930 -10.621 7.383 1.00 0.00 C ATOM 448 O LEU A 29 90.122 -10.438 8.271 1.00 0.00 O ATOM 449 CB LEU A 29 90.846 -9.829 5.037 1.00 0.00 C ATOM 450 CG LEU A 29 89.913 -9.760 3.828 1.00 0.00 C ATOM 451 CD1 LEU A 29 90.109 -8.402 3.136 1.00 0.00 C ATOM 452 CD2 LEU A 29 90.254 -10.890 2.849 1.00 0.00 C ATOM 0 H LEU A 29 88.447 -10.615 6.456 1.00 0.00 H new ATOM 0 HA LEU A 29 91.010 -11.905 5.618 1.00 0.00 H new ATOM 0 HB2 LEU A 29 90.786 -8.894 5.595 1.00 0.00 H new ATOM 0 HB3 LEU A 29 91.876 -9.930 4.694 1.00 0.00 H new ATOM 0 HG LEU A 29 88.877 -9.870 4.149 1.00 0.00 H new ATOM 0 HD11 LEU A 29 89.450 -8.336 2.270 1.00 0.00 H new ATOM 0 HD12 LEU A 29 89.871 -7.600 3.835 1.00 0.00 H new ATOM 0 HD13 LEU A 29 91.145 -8.305 2.811 1.00 0.00 H new ATOM 0 HD21 LEU A 29 89.588 -10.839 1.988 1.00 0.00 H new ATOM 0 HD22 LEU A 29 91.286 -10.784 2.516 1.00 0.00 H new ATOM 0 HD23 LEU A 29 90.131 -11.852 3.347 1.00 0.00 H new ATOM 464 N ASN A 30 92.208 -10.449 7.569 1.00 0.00 N ATOM 465 CA ASN A 30 92.731 -10.012 8.888 1.00 0.00 C ATOM 466 C ASN A 30 93.050 -8.518 8.765 1.00 0.00 C ATOM 467 O ASN A 30 93.638 -8.092 7.792 1.00 0.00 O ATOM 468 CB ASN A 30 94.015 -10.782 9.213 1.00 0.00 C ATOM 469 CG ASN A 30 93.721 -12.283 9.257 1.00 0.00 C ATOM 470 OD1 ASN A 30 94.625 -13.093 9.181 1.00 0.00 O ATOM 471 ND2 ASN A 30 92.488 -12.695 9.372 1.00 0.00 N ATOM 0 H ASN A 30 92.920 -10.595 6.853 1.00 0.00 H new ATOM 0 HA ASN A 30 92.005 -10.198 9.679 1.00 0.00 H new ATOM 0 HB2 ASN A 30 94.776 -10.573 8.461 1.00 0.00 H new ATOM 0 HB3 ASN A 30 94.415 -10.452 10.172 1.00 0.00 H new ATOM 0 HD21 ASN A 30 92.284 -13.694 9.398 1.00 0.00 H new ATOM 0 HD22 ASN A 30 91.728 -12.018 9.436 1.00 0.00 H new ATOM 478 N LYS A 31 92.662 -7.716 9.720 1.00 0.00 N ATOM 479 CA LYS A 31 92.945 -6.251 9.625 1.00 0.00 C ATOM 480 C LYS A 31 94.399 -6.048 9.208 1.00 0.00 C ATOM 481 O LYS A 31 94.763 -5.035 8.666 1.00 0.00 O ATOM 482 CB LYS A 31 92.671 -5.553 10.960 1.00 0.00 C ATOM 483 CG LYS A 31 91.160 -5.537 11.210 1.00 0.00 C ATOM 484 CD LYS A 31 90.848 -4.740 12.483 1.00 0.00 C ATOM 485 CE LYS A 31 89.337 -4.743 12.751 1.00 0.00 C ATOM 486 NZ LYS A 31 88.749 -6.055 12.356 1.00 0.00 N ATOM 0 H LYS A 31 92.163 -8.009 10.560 1.00 0.00 H new ATOM 0 HA LYS A 31 92.285 -5.810 8.878 1.00 0.00 H new ATOM 0 HB2 LYS A 31 93.182 -6.074 11.770 1.00 0.00 H new ATOM 0 HB3 LYS A 31 93.061 -4.535 10.940 1.00 0.00 H new ATOM 0 HG2 LYS A 31 90.647 -5.092 10.358 1.00 0.00 H new ATOM 0 HG3 LYS A 31 90.789 -6.557 11.309 1.00 0.00 H new ATOM 0 HD2 LYS A 31 91.376 -5.174 13.332 1.00 0.00 H new ATOM 0 HD3 LYS A 31 91.204 -3.715 12.376 1.00 0.00 H new ATOM 0 HE2 LYS A 31 89.147 -4.554 13.807 1.00 0.00 H new ATOM 0 HE3 LYS A 31 88.859 -3.938 12.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 87.711 -5.992 12.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 89.059 -6.299 11.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 89.066 -6.791 13.018 1.00 0.00 H new ATOM 500 N SER A 32 95.233 -7.022 9.410 1.00 0.00 N ATOM 501 CA SER A 32 96.643 -6.869 8.968 1.00 0.00 C ATOM 502 C SER A 32 96.589 -6.629 7.473 1.00 0.00 C ATOM 503 O SER A 32 97.291 -5.797 6.933 1.00 0.00 O ATOM 504 CB SER A 32 97.430 -8.137 9.247 1.00 0.00 C ATOM 505 OG SER A 32 97.435 -8.396 10.645 1.00 0.00 O ATOM 0 H SER A 32 95.005 -7.910 9.857 1.00 0.00 H new ATOM 0 HA SER A 32 97.132 -6.052 9.498 1.00 0.00 H new ATOM 0 HB2 SER A 32 96.987 -8.977 8.713 1.00 0.00 H new ATOM 0 HB3 SER A 32 98.452 -8.031 8.883 1.00 0.00 H new ATOM 0 HG SER A 32 97.942 -9.216 10.824 1.00 0.00 H new ATOM 511 N GLU A 33 95.708 -7.320 6.810 1.00 0.00 N ATOM 512 CA GLU A 33 95.549 -7.091 5.357 1.00 0.00 C ATOM 513 C GLU A 33 95.133 -5.652 5.180 1.00 0.00 C ATOM 514 O GLU A 33 95.397 -5.046 4.171 1.00 0.00 O ATOM 515 CB GLU A 33 94.484 -8.024 4.779 1.00 0.00 C ATOM 516 CG GLU A 33 95.005 -9.462 4.782 1.00 0.00 C ATOM 517 CD GLU A 33 96.146 -9.589 3.771 1.00 0.00 C ATOM 518 OE1 GLU A 33 95.929 -9.251 2.618 1.00 0.00 O ATOM 519 OE2 GLU A 33 97.215 -10.022 4.165 1.00 0.00 O ATOM 0 H GLU A 33 95.095 -8.029 7.212 1.00 0.00 H new ATOM 0 HA GLU A 33 96.482 -7.295 4.832 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.569 -7.957 5.368 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.232 -7.720 3.763 1.00 0.00 H new ATOM 0 HG2 GLU A 33 95.355 -9.732 5.778 1.00 0.00 H new ATOM 0 HG3 GLU A 33 94.201 -10.153 4.529 1.00 0.00 H new ATOM 526 N LEU A 34 94.513 -5.064 6.163 1.00 0.00 N ATOM 527 CA LEU A 34 94.158 -3.637 5.985 1.00 0.00 C ATOM 528 C LEU A 34 95.464 -2.898 5.771 1.00 0.00 C ATOM 529 O LEU A 34 95.554 -2.010 4.967 1.00 0.00 O ATOM 530 CB LEU A 34 93.427 -3.048 7.208 1.00 0.00 C ATOM 531 CG LEU A 34 92.946 -1.601 6.897 1.00 0.00 C ATOM 532 CD1 LEU A 34 91.514 -1.630 6.356 1.00 0.00 C ATOM 533 CD2 LEU A 34 92.983 -0.732 8.171 1.00 0.00 C ATOM 0 H LEU A 34 94.246 -5.492 7.049 1.00 0.00 H new ATOM 0 HA LEU A 34 93.474 -3.535 5.143 1.00 0.00 H new ATOM 0 HB2 LEU A 34 92.574 -3.675 7.469 1.00 0.00 H new ATOM 0 HB3 LEU A 34 94.093 -3.041 8.071 1.00 0.00 H new ATOM 0 HG LEU A 34 93.615 -1.173 6.150 1.00 0.00 H new ATOM 0 HD11 LEU A 34 91.186 -0.613 6.141 1.00 0.00 H new ATOM 0 HD12 LEU A 34 91.482 -2.222 5.442 1.00 0.00 H new ATOM 0 HD13 LEU A 34 90.853 -2.075 7.100 1.00 0.00 H new ATOM 0 HD21 LEU A 34 92.643 0.276 7.934 1.00 0.00 H new ATOM 0 HD22 LEU A 34 92.329 -1.167 8.927 1.00 0.00 H new ATOM 0 HD23 LEU A 34 94.003 -0.691 8.554 1.00 0.00 H new ATOM 545 N LYS A 35 96.493 -3.258 6.484 1.00 0.00 N ATOM 546 CA LYS A 35 97.777 -2.554 6.276 1.00 0.00 C ATOM 547 C LYS A 35 98.363 -2.946 4.925 1.00 0.00 C ATOM 548 O LYS A 35 98.724 -2.109 4.126 1.00 0.00 O ATOM 549 CB LYS A 35 98.755 -2.933 7.387 1.00 0.00 C ATOM 550 CG LYS A 35 100.063 -2.159 7.223 1.00 0.00 C ATOM 551 CD LYS A 35 101.023 -2.551 8.347 1.00 0.00 C ATOM 552 CE LYS A 35 102.325 -1.754 8.222 1.00 0.00 C ATOM 553 NZ LYS A 35 103.217 -2.408 7.223 1.00 0.00 N ATOM 0 H LYS A 35 96.498 -3.996 7.188 1.00 0.00 H new ATOM 0 HA LYS A 35 97.605 -1.478 6.297 1.00 0.00 H new ATOM 0 HB2 LYS A 35 98.314 -2.715 8.360 1.00 0.00 H new ATOM 0 HB3 LYS A 35 98.952 -4.005 7.359 1.00 0.00 H new ATOM 0 HG2 LYS A 35 100.510 -2.378 6.253 1.00 0.00 H new ATOM 0 HG3 LYS A 35 99.871 -1.086 7.250 1.00 0.00 H new ATOM 0 HD2 LYS A 35 100.561 -2.359 9.315 1.00 0.00 H new ATOM 0 HD3 LYS A 35 101.234 -3.619 8.301 1.00 0.00 H new ATOM 0 HE2 LYS A 35 102.109 -0.730 7.916 1.00 0.00 H new ATOM 0 HE3 LYS A 35 102.824 -1.699 9.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 104.101 -1.866 7.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 103.433 -3.377 7.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 102.740 -2.438 6.299 1.00 0.00 H new ATOM 567 N GLU A 36 98.484 -4.215 4.673 1.00 0.00 N ATOM 568 CA GLU A 36 99.076 -4.656 3.382 1.00 0.00 C ATOM 569 C GLU A 36 98.134 -4.359 2.219 1.00 0.00 C ATOM 570 O GLU A 36 98.561 -3.975 1.152 1.00 0.00 O ATOM 571 CB GLU A 36 99.357 -6.163 3.446 1.00 0.00 C ATOM 572 CG GLU A 36 99.979 -6.641 2.130 1.00 0.00 C ATOM 573 CD GLU A 36 101.367 -6.018 1.967 1.00 0.00 C ATOM 574 OE1 GLU A 36 101.881 -5.503 2.946 1.00 0.00 O ATOM 575 OE2 GLU A 36 101.894 -6.073 0.869 1.00 0.00 O ATOM 0 H GLU A 36 98.200 -4.966 5.302 1.00 0.00 H new ATOM 0 HA GLU A 36 100.004 -4.109 3.217 1.00 0.00 H new ATOM 0 HB2 GLU A 36 100.031 -6.380 4.275 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.431 -6.705 3.637 1.00 0.00 H new ATOM 0 HG2 GLU A 36 100.054 -7.728 2.124 1.00 0.00 H new ATOM 0 HG3 GLU A 36 99.342 -6.361 1.291 1.00 0.00 H new ATOM 582 N LEU A 37 96.867 -4.558 2.393 1.00 0.00 N ATOM 583 CA LEU A 37 95.933 -4.316 1.272 1.00 0.00 C ATOM 584 C LEU A 37 95.857 -2.822 0.989 1.00 0.00 C ATOM 585 O LEU A 37 95.663 -2.404 -0.133 1.00 0.00 O ATOM 586 CB LEU A 37 94.548 -4.862 1.650 1.00 0.00 C ATOM 587 CG LEU A 37 93.645 -5.004 0.406 1.00 0.00 C ATOM 588 CD1 LEU A 37 92.477 -5.941 0.744 1.00 0.00 C ATOM 589 CD2 LEU A 37 93.103 -3.629 -0.063 1.00 0.00 C ATOM 0 H LEU A 37 96.437 -4.877 3.261 1.00 0.00 H new ATOM 0 HA LEU A 37 96.285 -4.824 0.374 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.657 -5.831 2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 37 94.076 -4.195 2.371 1.00 0.00 H new ATOM 0 HG LEU A 37 94.237 -5.419 -0.409 1.00 0.00 H new ATOM 0 HD11 LEU A 37 91.832 -6.048 -0.128 1.00 0.00 H new ATOM 0 HD12 LEU A 37 92.866 -6.918 1.030 1.00 0.00 H new ATOM 0 HD13 LEU A 37 91.902 -5.523 1.570 1.00 0.00 H new ATOM 0 HD21 LEU A 37 92.471 -3.767 -0.941 1.00 0.00 H new ATOM 0 HD22 LEU A 37 92.518 -3.176 0.738 1.00 0.00 H new ATOM 0 HD23 LEU A 37 93.938 -2.976 -0.316 1.00 0.00 H new ATOM 601 N LEU A 38 95.991 -2.003 1.992 1.00 0.00 N ATOM 602 CA LEU A 38 95.889 -0.530 1.723 1.00 0.00 C ATOM 603 C LEU A 38 97.137 -0.017 1.009 1.00 0.00 C ATOM 604 O LEU A 38 97.051 0.804 0.122 1.00 0.00 O ATOM 605 CB LEU A 38 95.685 0.246 3.034 1.00 0.00 C ATOM 606 CG LEU A 38 94.186 0.311 3.424 1.00 0.00 C ATOM 607 CD1 LEU A 38 93.510 1.480 2.685 1.00 0.00 C ATOM 608 CD2 LEU A 38 93.439 -1.002 3.090 1.00 0.00 C ATOM 0 H LEU A 38 96.162 -2.271 2.961 1.00 0.00 H new ATOM 0 HA LEU A 38 95.027 -0.369 1.076 1.00 0.00 H new ATOM 0 HB2 LEU A 38 96.250 -0.232 3.834 1.00 0.00 H new ATOM 0 HB3 LEU A 38 96.079 1.257 2.926 1.00 0.00 H new ATOM 0 HG LEU A 38 94.135 0.460 4.503 1.00 0.00 H new ATOM 0 HD11 LEU A 38 92.456 1.524 2.960 1.00 0.00 H new ATOM 0 HD12 LEU A 38 93.997 2.415 2.961 1.00 0.00 H new ATOM 0 HD13 LEU A 38 93.598 1.330 1.609 1.00 0.00 H new ATOM 0 HD21 LEU A 38 92.393 -0.909 3.381 1.00 0.00 H new ATOM 0 HD22 LEU A 38 93.502 -1.194 2.019 1.00 0.00 H new ATOM 0 HD23 LEU A 38 93.895 -1.829 3.635 1.00 0.00 H new ATOM 620 N THR A 39 98.290 -0.464 1.389 1.00 0.00 N ATOM 621 CA THR A 39 99.519 0.039 0.714 1.00 0.00 C ATOM 622 C THR A 39 99.619 -0.548 -0.673 1.00 0.00 C ATOM 623 O THR A 39 100.183 0.038 -1.576 1.00 0.00 O ATOM 624 CB THR A 39 100.740 -0.372 1.514 1.00 0.00 C ATOM 625 OG1 THR A 39 100.811 -1.791 1.580 1.00 0.00 O ATOM 626 CG2 THR A 39 100.598 0.200 2.903 1.00 0.00 C ATOM 0 H THR A 39 98.442 -1.149 2.129 1.00 0.00 H new ATOM 0 HA THR A 39 99.468 1.126 0.647 1.00 0.00 H new ATOM 0 HB THR A 39 101.650 0.000 1.043 1.00 0.00 H new ATOM 0 HG1 THR A 39 100.238 -2.114 2.306 1.00 0.00 H new ATOM 0 HG21 THR A 39 101.464 -0.080 3.502 1.00 0.00 H new ATOM 0 HG22 THR A 39 100.534 1.287 2.844 1.00 0.00 H new ATOM 0 HG23 THR A 39 99.693 -0.192 3.367 1.00 0.00 H new ATOM 634 N ARG A 40 99.083 -1.710 -0.849 1.00 0.00 N ATOM 635 CA ARG A 40 99.152 -2.349 -2.174 1.00 0.00 C ATOM 636 C ARG A 40 98.236 -1.610 -3.146 1.00 0.00 C ATOM 637 O ARG A 40 98.504 -1.539 -4.329 1.00 0.00 O ATOM 638 CB ARG A 40 98.725 -3.817 -2.065 1.00 0.00 C ATOM 639 CG ARG A 40 99.788 -4.631 -1.304 1.00 0.00 C ATOM 640 CD ARG A 40 100.935 -5.039 -2.242 1.00 0.00 C ATOM 641 NE ARG A 40 101.821 -6.010 -1.540 1.00 0.00 N ATOM 642 CZ ARG A 40 102.655 -6.749 -2.220 1.00 0.00 C ATOM 643 NH1 ARG A 40 102.733 -6.620 -3.517 1.00 0.00 N ATOM 644 NH2 ARG A 40 103.410 -7.615 -1.604 1.00 0.00 N ATOM 0 H ARG A 40 98.598 -2.246 -0.129 1.00 0.00 H new ATOM 0 HA ARG A 40 100.176 -2.305 -2.544 1.00 0.00 H new ATOM 0 HB2 ARG A 40 97.767 -3.886 -1.549 1.00 0.00 H new ATOM 0 HB3 ARG A 40 98.582 -4.236 -3.061 1.00 0.00 H new ATOM 0 HG2 ARG A 40 100.181 -4.041 -0.476 1.00 0.00 H new ATOM 0 HG3 ARG A 40 99.331 -5.521 -0.872 1.00 0.00 H new ATOM 0 HD2 ARG A 40 100.535 -5.486 -3.152 1.00 0.00 H new ATOM 0 HD3 ARG A 40 101.505 -4.160 -2.543 1.00 0.00 H new ATOM 0 HE ARG A 40 101.776 -6.097 -0.525 1.00 0.00 H new ATOM 0 HH11 ARG A 40 102.142 -5.942 -3.999 1.00 0.00 H new ATOM 0 HH12 ARG A 40 103.385 -7.197 -4.049 1.00 0.00 H new ATOM 0 HH21 ARG A 40 103.349 -7.715 -0.591 1.00 0.00 H new ATOM 0 HH22 ARG A 40 104.062 -8.192 -2.135 1.00 0.00 H new ATOM 658 N GLU A 41 97.143 -1.071 -2.657 1.00 0.00 N ATOM 659 CA GLU A 41 96.185 -0.344 -3.555 1.00 0.00 C ATOM 660 C GLU A 41 96.208 1.140 -3.265 1.00 0.00 C ATOM 661 O GLU A 41 95.826 1.940 -4.097 1.00 0.00 O ATOM 662 CB GLU A 41 94.768 -0.880 -3.321 1.00 0.00 C ATOM 663 CG GLU A 41 94.617 -2.248 -3.983 1.00 0.00 C ATOM 664 CD GLU A 41 93.215 -2.787 -3.703 1.00 0.00 C ATOM 665 OE1 GLU A 41 92.571 -2.267 -2.807 1.00 0.00 O ATOM 666 OE2 GLU A 41 92.813 -3.715 -4.380 1.00 0.00 O ATOM 0 H GLU A 41 96.872 -1.103 -1.674 1.00 0.00 H new ATOM 0 HA GLU A 41 96.483 -0.506 -4.591 1.00 0.00 H new ATOM 0 HB2 GLU A 41 94.571 -0.959 -2.252 1.00 0.00 H new ATOM 0 HB3 GLU A 41 94.034 -0.185 -3.729 1.00 0.00 H new ATOM 0 HG2 GLU A 41 94.781 -2.166 -5.058 1.00 0.00 H new ATOM 0 HG3 GLU A 41 95.369 -2.937 -3.598 1.00 0.00 H new ATOM 673 N LEU A 42 96.624 1.526 -2.096 1.00 0.00 N ATOM 674 CA LEU A 42 96.641 2.982 -1.765 1.00 0.00 C ATOM 675 C LEU A 42 97.896 3.318 -0.939 1.00 0.00 C ATOM 676 O LEU A 42 97.830 3.397 0.270 1.00 0.00 O ATOM 677 CB LEU A 42 95.390 3.338 -0.943 1.00 0.00 C ATOM 678 CG LEU A 42 94.106 3.183 -1.786 1.00 0.00 C ATOM 679 CD1 LEU A 42 92.890 3.193 -0.859 1.00 0.00 C ATOM 680 CD2 LEU A 42 93.979 4.339 -2.794 1.00 0.00 C ATOM 0 H LEU A 42 96.952 0.905 -1.356 1.00 0.00 H new ATOM 0 HA LEU A 42 96.651 3.556 -2.692 1.00 0.00 H new ATOM 0 HB2 LEU A 42 95.332 2.694 -0.066 1.00 0.00 H new ATOM 0 HB3 LEU A 42 95.469 4.363 -0.581 1.00 0.00 H new ATOM 0 HG LEU A 42 94.157 2.241 -2.332 1.00 0.00 H new ATOM 0 HD11 LEU A 42 91.981 3.084 -1.450 1.00 0.00 H new ATOM 0 HD12 LEU A 42 92.965 2.367 -0.152 1.00 0.00 H new ATOM 0 HD13 LEU A 42 92.857 4.136 -0.313 1.00 0.00 H new ATOM 0 HD21 LEU A 42 93.068 4.213 -3.379 1.00 0.00 H new ATOM 0 HD22 LEU A 42 93.937 5.287 -2.257 1.00 0.00 H new ATOM 0 HD23 LEU A 42 94.842 4.337 -3.460 1.00 0.00 H new ATOM 692 N PRO A 43 99.033 3.507 -1.570 1.00 0.00 N ATOM 693 CA PRO A 43 100.282 3.828 -0.819 1.00 0.00 C ATOM 694 C PRO A 43 100.337 5.290 -0.340 1.00 0.00 C ATOM 695 O PRO A 43 99.991 5.599 0.783 1.00 0.00 O ATOM 696 CB PRO A 43 101.371 3.533 -1.870 1.00 0.00 C ATOM 697 CG PRO A 43 100.695 3.458 -3.255 1.00 0.00 C ATOM 698 CD PRO A 43 99.167 3.410 -3.051 1.00 0.00 C ATOM 0 HA PRO A 43 100.382 3.255 0.103 1.00 0.00 H new ATOM 0 HB2 PRO A 43 102.131 4.314 -1.860 1.00 0.00 H new ATOM 0 HB3 PRO A 43 101.876 2.594 -1.642 1.00 0.00 H new ATOM 0 HG2 PRO A 43 100.970 4.323 -3.858 1.00 0.00 H new ATOM 0 HG3 PRO A 43 101.033 2.573 -3.794 1.00 0.00 H new ATOM 0 HD2 PRO A 43 98.664 4.234 -3.558 1.00 0.00 H new ATOM 0 HD3 PRO A 43 98.735 2.487 -3.437 1.00 0.00 H new ATOM 706 N SER A 44 100.788 6.185 -1.179 1.00 0.00 N ATOM 707 CA SER A 44 100.890 7.617 -0.771 1.00 0.00 C ATOM 708 C SER A 44 99.495 8.226 -0.621 1.00 0.00 C ATOM 709 O SER A 44 99.274 9.082 0.205 1.00 0.00 O ATOM 710 CB SER A 44 101.665 8.393 -1.835 1.00 0.00 C ATOM 711 OG SER A 44 100.862 8.518 -3.001 1.00 0.00 O ATOM 0 H SER A 44 101.091 5.985 -2.132 1.00 0.00 H new ATOM 0 HA SER A 44 101.409 7.676 0.186 1.00 0.00 H new ATOM 0 HB2 SER A 44 101.935 9.379 -1.458 1.00 0.00 H new ATOM 0 HB3 SER A 44 102.595 7.877 -2.073 1.00 0.00 H new ATOM 0 HG SER A 44 101.355 9.017 -3.686 1.00 0.00 H new ATOM 717 N PHE A 45 98.560 7.797 -1.419 1.00 0.00 N ATOM 718 CA PHE A 45 97.176 8.356 -1.339 1.00 0.00 C ATOM 719 C PHE A 45 96.704 8.412 0.119 1.00 0.00 C ATOM 720 O PHE A 45 95.702 9.025 0.434 1.00 0.00 O ATOM 721 CB PHE A 45 96.235 7.440 -2.112 1.00 0.00 C ATOM 722 CG PHE A 45 94.890 8.110 -2.265 1.00 0.00 C ATOM 723 CD1 PHE A 45 93.921 7.975 -1.264 1.00 0.00 C ATOM 724 CD2 PHE A 45 94.612 8.867 -3.410 1.00 0.00 C ATOM 725 CE1 PHE A 45 92.675 8.598 -1.407 1.00 0.00 C ATOM 726 CE2 PHE A 45 93.366 9.490 -3.553 1.00 0.00 C ATOM 727 CZ PHE A 45 92.399 9.355 -2.551 1.00 0.00 C ATOM 0 H PHE A 45 98.692 7.078 -2.130 1.00 0.00 H new ATOM 0 HA PHE A 45 97.175 9.363 -1.757 1.00 0.00 H new ATOM 0 HB2 PHE A 45 96.654 7.215 -3.093 1.00 0.00 H new ATOM 0 HB3 PHE A 45 96.123 6.491 -1.588 1.00 0.00 H new ATOM 0 HD1 PHE A 45 94.134 7.390 -0.381 1.00 0.00 H new ATOM 0 HD2 PHE A 45 95.359 8.970 -4.183 1.00 0.00 H new ATOM 0 HE1 PHE A 45 91.927 8.494 -0.635 1.00 0.00 H new ATOM 0 HE2 PHE A 45 93.152 10.074 -4.436 1.00 0.00 H new ATOM 0 HZ PHE A 45 91.438 9.836 -2.661 1.00 0.00 H new ATOM 737 N LEU A 46 97.416 7.771 1.002 1.00 0.00 N ATOM 738 CA LEU A 46 97.028 7.763 2.455 1.00 0.00 C ATOM 739 C LEU A 46 98.244 8.166 3.269 1.00 0.00 C ATOM 740 O LEU A 46 98.186 9.022 4.130 1.00 0.00 O ATOM 741 CB LEU A 46 96.605 6.352 2.865 1.00 0.00 C ATOM 742 CG LEU A 46 95.450 5.870 1.984 1.00 0.00 C ATOM 743 CD1 LEU A 46 95.258 4.369 2.199 1.00 0.00 C ATOM 744 CD2 LEU A 46 94.152 6.601 2.354 1.00 0.00 C ATOM 0 H LEU A 46 98.262 7.244 0.784 1.00 0.00 H new ATOM 0 HA LEU A 46 96.201 8.452 2.626 1.00 0.00 H new ATOM 0 HB2 LEU A 46 97.450 5.670 2.774 1.00 0.00 H new ATOM 0 HB3 LEU A 46 96.301 6.345 3.912 1.00 0.00 H new ATOM 0 HG LEU A 46 95.686 6.078 0.940 1.00 0.00 H new ATOM 0 HD11 LEU A 46 94.437 4.014 1.576 1.00 0.00 H new ATOM 0 HD12 LEU A 46 96.173 3.843 1.928 1.00 0.00 H new ATOM 0 HD13 LEU A 46 95.027 4.178 3.247 1.00 0.00 H new ATOM 0 HD21 LEU A 46 93.341 6.246 1.718 1.00 0.00 H new ATOM 0 HD22 LEU A 46 93.908 6.403 3.398 1.00 0.00 H new ATOM 0 HD23 LEU A 46 94.284 7.673 2.209 1.00 0.00 H new ATOM 756 N GLY A 47 99.359 7.577 2.958 1.00 0.00 N ATOM 757 CA GLY A 47 100.618 7.936 3.657 1.00 0.00 C ATOM 758 C GLY A 47 101.136 9.179 2.962 1.00 0.00 C ATOM 759 O GLY A 47 102.305 9.508 2.998 1.00 0.00 O ATOM 0 H GLY A 47 99.453 6.856 2.243 1.00 0.00 H new ATOM 0 HA2 GLY A 47 100.437 8.126 4.715 1.00 0.00 H new ATOM 0 HA3 GLY A 47 101.343 7.124 3.598 1.00 0.00 H new ATOM 763 N LYS A 48 100.241 9.849 2.292 1.00 0.00 N ATOM 764 CA LYS A 48 100.599 11.063 1.532 1.00 0.00 C ATOM 765 C LYS A 48 101.523 11.953 2.373 1.00 0.00 C ATOM 766 O LYS A 48 102.183 12.831 1.862 1.00 0.00 O ATOM 767 CB LYS A 48 99.315 11.830 1.204 1.00 0.00 C ATOM 768 CG LYS A 48 99.567 12.814 0.067 1.00 0.00 C ATOM 769 CD LYS A 48 98.227 13.388 -0.378 1.00 0.00 C ATOM 770 CE LYS A 48 98.448 14.401 -1.504 1.00 0.00 C ATOM 771 NZ LYS A 48 99.099 13.723 -2.661 1.00 0.00 N ATOM 0 H LYS A 48 99.255 9.594 2.243 1.00 0.00 H new ATOM 0 HA LYS A 48 101.117 10.783 0.614 1.00 0.00 H new ATOM 0 HB2 LYS A 48 98.527 11.131 0.923 1.00 0.00 H new ATOM 0 HB3 LYS A 48 98.966 12.365 2.087 1.00 0.00 H new ATOM 0 HG2 LYS A 48 100.231 13.613 0.397 1.00 0.00 H new ATOM 0 HG3 LYS A 48 100.060 12.313 -0.766 1.00 0.00 H new ATOM 0 HD2 LYS A 48 97.573 12.586 -0.720 1.00 0.00 H new ATOM 0 HD3 LYS A 48 97.729 13.869 0.464 1.00 0.00 H new ATOM 0 HE2 LYS A 48 97.496 14.833 -1.811 1.00 0.00 H new ATOM 0 HE3 LYS A 48 99.072 15.222 -1.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 98.948 14.285 -3.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 100.119 13.632 -2.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 98.685 12.778 -2.787 1.00 0.00 H new ATOM 785 N ARG A 49 101.553 11.725 3.661 1.00 0.00 N ATOM 786 CA ARG A 49 102.410 12.539 4.579 1.00 0.00 C ATOM 787 C ARG A 49 101.715 13.876 4.867 1.00 0.00 C ATOM 788 O ARG A 49 102.212 14.693 5.615 1.00 0.00 O ATOM 789 CB ARG A 49 103.792 12.787 3.944 1.00 0.00 C ATOM 790 CG ARG A 49 104.835 13.045 5.039 1.00 0.00 C ATOM 791 CD ARG A 49 106.204 13.266 4.392 1.00 0.00 C ATOM 792 NE ARG A 49 106.129 14.435 3.469 1.00 0.00 N ATOM 793 CZ ARG A 49 107.223 14.979 3.010 1.00 0.00 C ATOM 794 NH1 ARG A 49 108.387 14.500 3.356 1.00 0.00 N ATOM 795 NH2 ARG A 49 107.152 16.002 2.203 1.00 0.00 N ATOM 0 H ARG A 49 101.010 10.996 4.125 1.00 0.00 H new ATOM 0 HA ARG A 49 102.554 11.995 5.512 1.00 0.00 H new ATOM 0 HB2 ARG A 49 104.086 11.925 3.346 1.00 0.00 H new ATOM 0 HB3 ARG A 49 103.743 13.641 3.269 1.00 0.00 H new ATOM 0 HG2 ARG A 49 104.553 13.918 5.627 1.00 0.00 H new ATOM 0 HG3 ARG A 49 104.876 12.199 5.724 1.00 0.00 H new ATOM 0 HD2 ARG A 49 106.958 13.442 5.159 1.00 0.00 H new ATOM 0 HD3 ARG A 49 106.509 12.374 3.844 1.00 0.00 H new ATOM 0 HE ARG A 49 105.221 14.810 3.196 1.00 0.00 H new ATOM 0 HH11 ARG A 49 108.442 13.700 3.986 1.00 0.00 H new ATOM 0 HH12 ARG A 49 109.241 14.926 2.997 1.00 0.00 H new ATOM 0 HH21 ARG A 49 106.242 16.375 1.932 1.00 0.00 H new ATOM 0 HH22 ARG A 49 108.006 16.428 1.843 1.00 0.00 H new ATOM 809 N THR A 50 100.557 14.098 4.293 1.00 0.00 N ATOM 810 CA THR A 50 99.817 15.376 4.548 1.00 0.00 C ATOM 811 C THR A 50 98.763 15.136 5.630 1.00 0.00 C ATOM 812 O THR A 50 98.303 16.056 6.278 1.00 0.00 O ATOM 813 CB THR A 50 99.120 15.840 3.265 1.00 0.00 C ATOM 814 OG1 THR A 50 98.224 14.830 2.823 1.00 0.00 O ATOM 815 CG2 THR A 50 100.160 16.117 2.177 1.00 0.00 C ATOM 0 H THR A 50 100.091 13.449 3.658 1.00 0.00 H new ATOM 0 HA THR A 50 100.521 16.142 4.873 1.00 0.00 H new ATOM 0 HB THR A 50 98.566 16.756 3.468 1.00 0.00 H new ATOM 0 HG1 THR A 50 97.560 15.223 2.219 1.00 0.00 H new ATOM 0 HG21 THR A 50 99.657 16.446 1.268 1.00 0.00 H new ATOM 0 HG22 THR A 50 100.843 16.896 2.516 1.00 0.00 H new ATOM 0 HG23 THR A 50 100.722 15.206 1.971 1.00 0.00 H new ATOM 823 N ASP A 51 98.376 13.905 5.834 1.00 0.00 N ATOM 824 CA ASP A 51 97.351 13.600 6.877 1.00 0.00 C ATOM 825 C ASP A 51 97.586 12.187 7.417 1.00 0.00 C ATOM 826 O ASP A 51 96.711 11.345 7.387 1.00 0.00 O ATOM 827 CB ASP A 51 95.954 13.688 6.254 1.00 0.00 C ATOM 828 CG ASP A 51 94.897 13.625 7.356 1.00 0.00 C ATOM 829 OD1 ASP A 51 95.232 13.194 8.447 1.00 0.00 O ATOM 830 OD2 ASP A 51 93.770 14.010 7.092 1.00 0.00 O ATOM 0 H ASP A 51 98.726 13.095 5.322 1.00 0.00 H new ATOM 0 HA ASP A 51 97.429 14.318 7.693 1.00 0.00 H new ATOM 0 HB2 ASP A 51 95.853 14.616 5.692 1.00 0.00 H new ATOM 0 HB3 ASP A 51 95.807 12.871 5.548 1.00 0.00 H new ATOM 835 N GLU A 52 98.767 11.924 7.904 1.00 0.00 N ATOM 836 CA GLU A 52 99.079 10.569 8.444 1.00 0.00 C ATOM 837 C GLU A 52 98.319 10.329 9.750 1.00 0.00 C ATOM 838 O GLU A 52 98.057 9.204 10.129 1.00 0.00 O ATOM 839 CB GLU A 52 100.582 10.469 8.715 1.00 0.00 C ATOM 840 CG GLU A 52 100.975 11.417 9.865 1.00 0.00 C ATOM 841 CD GLU A 52 100.762 10.721 11.215 1.00 0.00 C ATOM 842 OE1 GLU A 52 101.233 9.606 11.365 1.00 0.00 O ATOM 843 OE2 GLU A 52 100.133 11.318 12.073 1.00 0.00 O ATOM 0 H GLU A 52 99.535 12.594 7.952 1.00 0.00 H new ATOM 0 HA GLU A 52 98.777 9.819 7.713 1.00 0.00 H new ATOM 0 HB2 GLU A 52 100.846 9.443 8.972 1.00 0.00 H new ATOM 0 HB3 GLU A 52 101.140 10.726 7.815 1.00 0.00 H new ATOM 0 HG2 GLU A 52 102.018 11.715 9.761 1.00 0.00 H new ATOM 0 HG3 GLU A 52 100.377 12.327 9.817 1.00 0.00 H new ATOM 850 N ALA A 53 97.980 11.373 10.449 1.00 0.00 N ATOM 851 CA ALA A 53 97.262 11.202 11.743 1.00 0.00 C ATOM 852 C ALA A 53 95.937 10.467 11.520 1.00 0.00 C ATOM 853 O ALA A 53 95.625 9.520 12.211 1.00 0.00 O ATOM 854 CB ALA A 53 96.982 12.578 12.353 1.00 0.00 C ATOM 0 H ALA A 53 98.169 12.339 10.181 1.00 0.00 H new ATOM 0 HA ALA A 53 97.884 10.616 12.420 1.00 0.00 H new ATOM 0 HB1 ALA A 53 96.457 12.456 13.300 1.00 0.00 H new ATOM 0 HB2 ALA A 53 97.924 13.098 12.525 1.00 0.00 H new ATOM 0 HB3 ALA A 53 96.366 13.161 11.669 1.00 0.00 H new ATOM 860 N ALA A 54 95.152 10.882 10.567 1.00 0.00 N ATOM 861 CA ALA A 54 93.856 10.183 10.325 1.00 0.00 C ATOM 862 C ALA A 54 94.120 8.722 9.967 1.00 0.00 C ATOM 863 O ALA A 54 93.495 7.819 10.487 1.00 0.00 O ATOM 864 CB ALA A 54 93.123 10.861 9.179 1.00 0.00 C ATOM 0 H ALA A 54 95.347 11.669 9.948 1.00 0.00 H new ATOM 0 HA ALA A 54 93.246 10.229 11.227 1.00 0.00 H new ATOM 0 HB1 ALA A 54 92.176 10.352 9.001 1.00 0.00 H new ATOM 0 HB2 ALA A 54 92.932 11.903 9.435 1.00 0.00 H new ATOM 0 HB3 ALA A 54 93.735 10.815 8.278 1.00 0.00 H new ATOM 870 N PHE A 55 95.053 8.480 9.094 1.00 0.00 N ATOM 871 CA PHE A 55 95.373 7.077 8.721 1.00 0.00 C ATOM 872 C PHE A 55 95.810 6.337 9.970 1.00 0.00 C ATOM 873 O PHE A 55 95.464 5.195 10.195 1.00 0.00 O ATOM 874 CB PHE A 55 96.532 7.088 7.740 1.00 0.00 C ATOM 875 CG PHE A 55 96.912 5.670 7.377 1.00 0.00 C ATOM 876 CD1 PHE A 55 96.208 4.984 6.381 1.00 0.00 C ATOM 877 CD2 PHE A 55 97.970 5.040 8.045 1.00 0.00 C ATOM 878 CE1 PHE A 55 96.562 3.669 6.053 1.00 0.00 C ATOM 879 CE2 PHE A 55 98.324 3.726 7.717 1.00 0.00 C ATOM 880 CZ PHE A 55 97.621 3.040 6.720 1.00 0.00 C ATOM 0 H PHE A 55 95.609 9.193 8.622 1.00 0.00 H new ATOM 0 HA PHE A 55 94.503 6.595 8.275 1.00 0.00 H new ATOM 0 HB2 PHE A 55 96.255 7.641 6.842 1.00 0.00 H new ATOM 0 HB3 PHE A 55 97.387 7.602 8.179 1.00 0.00 H new ATOM 0 HD1 PHE A 55 95.392 5.468 5.865 1.00 0.00 H new ATOM 0 HD2 PHE A 55 98.513 5.569 8.814 1.00 0.00 H new ATOM 0 HE1 PHE A 55 96.018 3.140 5.285 1.00 0.00 H new ATOM 0 HE2 PHE A 55 99.140 3.242 8.233 1.00 0.00 H new ATOM 0 HZ PHE A 55 97.895 2.027 6.465 1.00 0.00 H new ATOM 890 N GLN A 56 96.572 6.997 10.788 1.00 0.00 N ATOM 891 CA GLN A 56 97.043 6.362 12.041 1.00 0.00 C ATOM 892 C GLN A 56 95.826 5.991 12.868 1.00 0.00 C ATOM 893 O GLN A 56 95.798 4.983 13.536 1.00 0.00 O ATOM 894 CB GLN A 56 97.937 7.336 12.812 1.00 0.00 C ATOM 895 CG GLN A 56 98.428 6.685 14.106 1.00 0.00 C ATOM 896 CD GLN A 56 99.380 7.645 14.822 1.00 0.00 C ATOM 897 OE1 GLN A 56 99.778 8.650 14.266 1.00 0.00 O ATOM 898 NE2 GLN A 56 99.780 7.370 16.033 1.00 0.00 N ATOM 0 H GLN A 56 96.890 7.955 10.641 1.00 0.00 H new ATOM 0 HA GLN A 56 97.627 5.468 11.820 1.00 0.00 H new ATOM 0 HB2 GLN A 56 98.788 7.626 12.196 1.00 0.00 H new ATOM 0 HB3 GLN A 56 97.384 8.247 13.041 1.00 0.00 H new ATOM 0 HG2 GLN A 56 97.582 6.445 14.750 1.00 0.00 H new ATOM 0 HG3 GLN A 56 98.937 5.747 13.885 1.00 0.00 H new ATOM 0 HE21 GLN A 56 99.447 6.527 16.501 1.00 0.00 H new ATOM 0 HE22 GLN A 56 100.426 7.998 16.512 1.00 0.00 H new ATOM 907 N LYS A 57 94.810 6.796 12.806 1.00 0.00 N ATOM 908 CA LYS A 57 93.569 6.476 13.570 1.00 0.00 C ATOM 909 C LYS A 57 92.920 5.281 12.903 1.00 0.00 C ATOM 910 O LYS A 57 92.435 4.371 13.547 1.00 0.00 O ATOM 911 CB LYS A 57 92.595 7.668 13.573 1.00 0.00 C ATOM 912 CG LYS A 57 93.185 8.831 14.389 1.00 0.00 C ATOM 913 CD LYS A 57 92.076 9.800 14.830 1.00 0.00 C ATOM 914 CE LYS A 57 91.558 10.593 13.626 1.00 0.00 C ATOM 915 NZ LYS A 57 90.514 11.558 14.078 1.00 0.00 N ATOM 0 H LYS A 57 94.779 7.659 12.264 1.00 0.00 H new ATOM 0 HA LYS A 57 93.820 6.258 14.608 1.00 0.00 H new ATOM 0 HB2 LYS A 57 92.402 7.992 12.550 1.00 0.00 H new ATOM 0 HB3 LYS A 57 91.638 7.365 13.997 1.00 0.00 H new ATOM 0 HG2 LYS A 57 93.704 8.441 15.265 1.00 0.00 H new ATOM 0 HG3 LYS A 57 93.924 9.364 13.791 1.00 0.00 H new ATOM 0 HD2 LYS A 57 91.258 9.244 15.288 1.00 0.00 H new ATOM 0 HD3 LYS A 57 92.460 10.484 15.587 1.00 0.00 H new ATOM 0 HE2 LYS A 57 92.379 11.127 13.148 1.00 0.00 H new ATOM 0 HE3 LYS A 57 91.143 9.914 12.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 90.162 12.097 13.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 89.727 11.038 14.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 90.925 12.213 14.774 1.00 0.00 H new ATOM 929 N LEU A 58 92.942 5.268 11.607 1.00 0.00 N ATOM 930 CA LEU A 58 92.368 4.124 10.871 1.00 0.00 C ATOM 931 C LEU A 58 93.252 2.932 11.167 1.00 0.00 C ATOM 932 O LEU A 58 92.797 1.836 11.413 1.00 0.00 O ATOM 933 CB LEU A 58 92.381 4.434 9.371 1.00 0.00 C ATOM 934 CG LEU A 58 91.792 3.261 8.584 1.00 0.00 C ATOM 935 CD1 LEU A 58 90.328 3.022 8.994 1.00 0.00 C ATOM 936 CD2 LEU A 58 91.870 3.578 7.087 1.00 0.00 C ATOM 0 H LEU A 58 93.336 6.006 11.024 1.00 0.00 H new ATOM 0 HA LEU A 58 91.339 3.925 11.170 1.00 0.00 H new ATOM 0 HB2 LEU A 58 91.806 5.339 9.174 1.00 0.00 H new ATOM 0 HB3 LEU A 58 93.402 4.627 9.041 1.00 0.00 H new ATOM 0 HG LEU A 58 92.361 2.357 8.801 1.00 0.00 H new ATOM 0 HD11 LEU A 58 89.923 2.185 8.426 1.00 0.00 H new ATOM 0 HD12 LEU A 58 90.281 2.794 10.059 1.00 0.00 H new ATOM 0 HD13 LEU A 58 89.742 3.918 8.788 1.00 0.00 H new ATOM 0 HD21 LEU A 58 91.453 2.748 6.517 1.00 0.00 H new ATOM 0 HD22 LEU A 58 91.302 4.484 6.877 1.00 0.00 H new ATOM 0 HD23 LEU A 58 92.911 3.728 6.801 1.00 0.00 H new ATOM 948 N MET A 59 94.528 3.162 11.177 1.00 0.00 N ATOM 949 CA MET A 59 95.473 2.070 11.495 1.00 0.00 C ATOM 950 C MET A 59 95.358 1.756 12.982 1.00 0.00 C ATOM 951 O MET A 59 95.510 0.631 13.407 1.00 0.00 O ATOM 952 CB MET A 59 96.906 2.493 11.150 1.00 0.00 C ATOM 953 CG MET A 59 97.796 1.251 11.059 1.00 0.00 C ATOM 954 SD MET A 59 99.524 1.754 10.859 1.00 0.00 S ATOM 955 CE MET A 59 99.937 1.863 12.617 1.00 0.00 C ATOM 0 H MET A 59 94.959 4.065 10.977 1.00 0.00 H new ATOM 0 HA MET A 59 95.232 1.184 10.908 1.00 0.00 H new ATOM 0 HB2 MET A 59 96.919 3.033 10.203 1.00 0.00 H new ATOM 0 HB3 MET A 59 97.289 3.173 11.911 1.00 0.00 H new ATOM 0 HG2 MET A 59 97.685 0.645 11.958 1.00 0.00 H new ATOM 0 HG3 MET A 59 97.487 0.631 10.217 1.00 0.00 H new ATOM 0 HE1 MET A 59 100.979 2.165 12.728 1.00 0.00 H new ATOM 0 HE2 MET A 59 99.293 2.599 13.097 1.00 0.00 H new ATOM 0 HE3 MET A 59 99.789 0.890 13.086 1.00 0.00 H new ATOM 965 N SER A 60 95.076 2.742 13.788 1.00 0.00 N ATOM 966 CA SER A 60 94.939 2.463 15.242 1.00 0.00 C ATOM 967 C SER A 60 93.845 1.418 15.409 1.00 0.00 C ATOM 968 O SER A 60 93.870 0.612 16.317 1.00 0.00 O ATOM 969 CB SER A 60 94.560 3.739 15.995 1.00 0.00 C ATOM 970 OG SER A 60 94.567 3.479 17.393 1.00 0.00 O ATOM 0 H SER A 60 94.937 3.713 13.508 1.00 0.00 H new ATOM 0 HA SER A 60 95.883 2.101 15.648 1.00 0.00 H new ATOM 0 HB2 SER A 60 95.264 4.537 15.758 1.00 0.00 H new ATOM 0 HB3 SER A 60 93.573 4.080 15.682 1.00 0.00 H new ATOM 0 HG SER A 60 94.326 4.295 17.879 1.00 0.00 H new ATOM 976 N ASN A 61 92.900 1.407 14.511 1.00 0.00 N ATOM 977 CA ASN A 61 91.823 0.381 14.599 1.00 0.00 C ATOM 978 C ASN A 61 92.453 -0.961 14.267 1.00 0.00 C ATOM 979 O ASN A 61 92.183 -1.962 14.895 1.00 0.00 O ATOM 980 CB ASN A 61 90.684 0.691 13.623 1.00 0.00 C ATOM 981 CG ASN A 61 89.923 1.928 14.098 1.00 0.00 C ATOM 982 OD1 ASN A 61 89.883 2.217 15.278 1.00 0.00 O ATOM 983 ND2 ASN A 61 89.311 2.677 13.223 1.00 0.00 N ATOM 0 H ASN A 61 92.826 2.056 13.728 1.00 0.00 H new ATOM 0 HA ASN A 61 91.392 0.373 15.600 1.00 0.00 H new ATOM 0 HB2 ASN A 61 91.084 0.860 12.623 1.00 0.00 H new ATOM 0 HB3 ASN A 61 90.007 -0.161 13.556 1.00 0.00 H new ATOM 0 HD21 ASN A 61 88.799 3.505 13.529 1.00 0.00 H new ATOM 0 HD22 ASN A 61 89.344 2.435 12.233 1.00 0.00 H new ATOM 990 N LEU A 62 93.328 -0.984 13.302 1.00 0.00 N ATOM 991 CA LEU A 62 94.013 -2.253 12.969 1.00 0.00 C ATOM 992 C LEU A 62 94.714 -2.700 14.254 1.00 0.00 C ATOM 993 O LEU A 62 94.874 -3.872 14.531 1.00 0.00 O ATOM 994 CB LEU A 62 94.989 -2.000 11.793 1.00 0.00 C ATOM 995 CG LEU A 62 96.270 -2.841 11.894 1.00 0.00 C ATOM 996 CD1 LEU A 62 95.937 -4.347 11.860 1.00 0.00 C ATOM 997 CD2 LEU A 62 97.192 -2.483 10.711 1.00 0.00 C ATOM 0 H LEU A 62 93.595 -0.180 12.734 1.00 0.00 H new ATOM 0 HA LEU A 62 93.337 -3.041 12.639 1.00 0.00 H new ATOM 0 HB2 LEU A 62 94.485 -2.225 10.853 1.00 0.00 H new ATOM 0 HB3 LEU A 62 95.254 -0.943 11.767 1.00 0.00 H new ATOM 0 HG LEU A 62 96.769 -2.624 12.838 1.00 0.00 H new ATOM 0 HD11 LEU A 62 96.858 -4.925 11.933 1.00 0.00 H new ATOM 0 HD12 LEU A 62 95.286 -4.595 12.698 1.00 0.00 H new ATOM 0 HD13 LEU A 62 95.431 -4.587 10.925 1.00 0.00 H new ATOM 0 HD21 LEU A 62 98.106 -3.074 10.771 1.00 0.00 H new ATOM 0 HD22 LEU A 62 96.681 -2.699 9.773 1.00 0.00 H new ATOM 0 HD23 LEU A 62 97.442 -1.423 10.752 1.00 0.00 H new ATOM 1009 N ASP A 63 95.074 -1.749 15.072 1.00 0.00 N ATOM 1010 CA ASP A 63 95.703 -2.070 16.379 1.00 0.00 C ATOM 1011 C ASP A 63 94.584 -2.200 17.417 1.00 0.00 C ATOM 1012 O ASP A 63 94.823 -2.220 18.607 1.00 0.00 O ATOM 1013 CB ASP A 63 96.661 -0.949 16.791 1.00 0.00 C ATOM 1014 CG ASP A 63 97.884 -0.959 15.872 1.00 0.00 C ATOM 1015 OD1 ASP A 63 98.132 -1.984 15.259 1.00 0.00 O ATOM 1016 OD2 ASP A 63 98.556 0.057 15.802 1.00 0.00 O ATOM 0 H ASP A 63 94.957 -0.753 14.886 1.00 0.00 H new ATOM 0 HA ASP A 63 96.271 -2.998 16.307 1.00 0.00 H new ATOM 0 HB2 ASP A 63 96.156 0.015 16.732 1.00 0.00 H new ATOM 0 HB3 ASP A 63 96.971 -1.083 17.827 1.00 0.00 H new ATOM 1021 N SER A 64 93.353 -2.267 16.964 1.00 0.00 N ATOM 1022 CA SER A 64 92.207 -2.371 17.912 1.00 0.00 C ATOM 1023 C SER A 64 92.360 -3.625 18.775 1.00 0.00 C ATOM 1024 O SER A 64 92.743 -4.676 18.297 1.00 0.00 O ATOM 1025 CB SER A 64 90.894 -2.487 17.135 1.00 0.00 C ATOM 1026 OG SER A 64 91.004 -3.532 16.178 1.00 0.00 O ATOM 0 H SER A 64 93.097 -2.254 15.977 1.00 0.00 H new ATOM 0 HA SER A 64 92.196 -1.479 18.538 1.00 0.00 H new ATOM 0 HB2 SER A 64 90.070 -2.690 17.819 1.00 0.00 H new ATOM 0 HB3 SER A 64 90.669 -1.544 16.636 1.00 0.00 H new ATOM 0 HG SER A 64 91.154 -3.147 15.289 1.00 0.00 H new ATOM 1032 N ASN A 65 92.046 -3.533 20.037 1.00 0.00 N ATOM 1033 CA ASN A 65 92.155 -4.728 20.919 1.00 0.00 C ATOM 1034 C ASN A 65 91.034 -5.708 20.564 1.00 0.00 C ATOM 1035 O ASN A 65 91.103 -6.885 20.857 1.00 0.00 O ATOM 1036 CB ASN A 65 92.028 -4.301 22.384 1.00 0.00 C ATOM 1037 CG ASN A 65 92.387 -5.481 23.289 1.00 0.00 C ATOM 1038 OD1 ASN A 65 91.542 -6.010 23.984 1.00 0.00 O ATOM 1039 ND2 ASN A 65 93.615 -5.925 23.302 1.00 0.00 N ATOM 0 H ASN A 65 91.719 -2.683 20.496 1.00 0.00 H new ATOM 0 HA ASN A 65 93.123 -5.208 20.775 1.00 0.00 H new ATOM 0 HB2 ASN A 65 92.689 -3.458 22.587 1.00 0.00 H new ATOM 0 HB3 ASN A 65 91.011 -3.966 22.590 1.00 0.00 H new ATOM 0 HD21 ASN A 65 93.865 -6.716 23.896 1.00 0.00 H new ATOM 0 HD22 ASN A 65 94.324 -5.481 22.719 1.00 0.00 H new ATOM 1046 N ARG A 66 89.999 -5.223 19.931 1.00 0.00 N ATOM 1047 CA ARG A 66 88.862 -6.109 19.546 1.00 0.00 C ATOM 1048 C ARG A 66 89.287 -7.047 18.412 1.00 0.00 C ATOM 1049 O ARG A 66 90.359 -6.917 17.854 1.00 0.00 O ATOM 1050 CB ARG A 66 87.673 -5.257 19.094 1.00 0.00 C ATOM 1051 CG ARG A 66 87.063 -4.548 20.306 1.00 0.00 C ATOM 1052 CD ARG A 66 85.865 -3.711 19.849 1.00 0.00 C ATOM 1053 NE ARG A 66 85.330 -2.905 20.997 1.00 0.00 N ATOM 1054 CZ ARG A 66 84.897 -3.470 22.094 1.00 0.00 C ATOM 1055 NH1 ARG A 66 84.770 -4.766 22.169 1.00 0.00 N ATOM 1056 NH2 ARG A 66 84.539 -2.727 23.105 1.00 0.00 N ATOM 0 H ARG A 66 89.892 -4.245 19.663 1.00 0.00 H new ATOM 0 HA ARG A 66 88.570 -6.707 20.410 1.00 0.00 H new ATOM 0 HB2 ARG A 66 87.997 -4.524 18.356 1.00 0.00 H new ATOM 0 HB3 ARG A 66 86.924 -5.885 18.612 1.00 0.00 H new ATOM 0 HG2 ARG A 66 86.748 -5.280 21.050 1.00 0.00 H new ATOM 0 HG3 ARG A 66 87.808 -3.910 20.782 1.00 0.00 H new ATOM 0 HD2 ARG A 66 86.163 -3.048 19.037 1.00 0.00 H new ATOM 0 HD3 ARG A 66 85.084 -4.363 19.457 1.00 0.00 H new ATOM 0 HE ARG A 66 85.303 -1.888 20.919 1.00 0.00 H new ATOM 0 HH11 ARG A 66 85.009 -5.349 21.367 1.00 0.00 H new ATOM 0 HH12 ARG A 66 84.431 -5.196 23.030 1.00 0.00 H new ATOM 0 HH21 ARG A 66 84.598 -1.711 23.037 1.00 0.00 H new ATOM 0 HH22 ARG A 66 84.200 -3.162 23.963 1.00 0.00 H new ATOM 1070 N ASP A 67 88.451 -8.000 18.083 1.00 0.00 N ATOM 1071 CA ASP A 67 88.784 -8.974 16.997 1.00 0.00 C ATOM 1072 C ASP A 67 89.449 -8.257 15.819 1.00 0.00 C ATOM 1073 O ASP A 67 89.281 -7.070 15.626 1.00 0.00 O ATOM 1074 CB ASP A 67 87.501 -9.657 16.522 1.00 0.00 C ATOM 1075 CG ASP A 67 87.000 -10.616 17.605 1.00 0.00 C ATOM 1076 OD1 ASP A 67 87.807 -11.029 18.423 1.00 0.00 O ATOM 1077 OD2 ASP A 67 85.819 -10.924 17.596 1.00 0.00 O ATOM 0 H ASP A 67 87.543 -8.146 18.524 1.00 0.00 H new ATOM 0 HA ASP A 67 89.478 -9.718 17.389 1.00 0.00 H new ATOM 0 HB2 ASP A 67 86.739 -8.909 16.303 1.00 0.00 H new ATOM 0 HB3 ASP A 67 87.688 -10.202 15.597 1.00 0.00 H new ATOM 1082 N ASN A 68 90.228 -8.979 15.046 1.00 0.00 N ATOM 1083 CA ASN A 68 90.948 -8.367 13.883 1.00 0.00 C ATOM 1084 C ASN A 68 90.492 -9.009 12.570 1.00 0.00 C ATOM 1085 O ASN A 68 91.293 -9.273 11.698 1.00 0.00 O ATOM 1086 CB ASN A 68 92.451 -8.599 14.057 1.00 0.00 C ATOM 1087 CG ASN A 68 92.918 -7.954 15.363 1.00 0.00 C ATOM 1088 OD1 ASN A 68 93.659 -8.550 16.117 1.00 0.00 O ATOM 1089 ND2 ASN A 68 92.508 -6.752 15.666 1.00 0.00 N ATOM 0 H ASN A 68 90.397 -9.977 15.174 1.00 0.00 H new ATOM 0 HA ASN A 68 90.726 -7.300 13.848 1.00 0.00 H new ATOM 0 HB2 ASN A 68 92.666 -9.668 14.069 1.00 0.00 H new ATOM 0 HB3 ASN A 68 92.996 -8.174 13.214 1.00 0.00 H new ATOM 0 HD21 ASN A 68 92.811 -6.314 16.536 1.00 0.00 H new ATOM 0 HD22 ASN A 68 91.885 -6.251 15.033 1.00 0.00 H new ATOM 1096 N GLU A 69 89.216 -9.267 12.421 1.00 0.00 N ATOM 1097 CA GLU A 69 88.709 -9.900 11.160 1.00 0.00 C ATOM 1098 C GLU A 69 88.027 -8.843 10.288 1.00 0.00 C ATOM 1099 O GLU A 69 87.403 -7.926 10.781 1.00 0.00 O ATOM 1100 CB GLU A 69 87.692 -10.985 11.514 1.00 0.00 C ATOM 1101 CG GLU A 69 87.172 -11.655 10.242 1.00 0.00 C ATOM 1102 CD GLU A 69 86.157 -12.736 10.616 1.00 0.00 C ATOM 1103 OE1 GLU A 69 86.060 -13.050 11.793 1.00 0.00 O ATOM 1104 OE2 GLU A 69 85.482 -13.222 9.722 1.00 0.00 O ATOM 0 H GLU A 69 88.500 -9.066 13.120 1.00 0.00 H new ATOM 0 HA GLU A 69 89.546 -10.337 10.615 1.00 0.00 H new ATOM 0 HB2 GLU A 69 88.154 -11.729 12.163 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.862 -10.549 12.070 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.708 -10.914 9.591 1.00 0.00 H new ATOM 0 HG3 GLU A 69 87.999 -12.095 9.685 1.00 0.00 H new ATOM 1111 N VAL A 70 88.142 -8.980 8.990 1.00 0.00 N ATOM 1112 CA VAL A 70 87.501 -8.002 8.052 1.00 0.00 C ATOM 1113 C VAL A 70 86.515 -8.738 7.162 1.00 0.00 C ATOM 1114 O VAL A 70 86.887 -9.468 6.263 1.00 0.00 O ATOM 1115 CB VAL A 70 88.586 -7.359 7.177 1.00 0.00 C ATOM 1116 CG1 VAL A 70 88.112 -6.001 6.656 1.00 0.00 C ATOM 1117 CG2 VAL A 70 89.850 -7.171 8.007 1.00 0.00 C ATOM 0 H VAL A 70 88.657 -9.734 8.535 1.00 0.00 H new ATOM 0 HA VAL A 70 86.981 -7.232 8.621 1.00 0.00 H new ATOM 0 HB VAL A 70 88.792 -8.009 6.327 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.891 -5.557 6.037 1.00 0.00 H new ATOM 0 HG12 VAL A 70 87.208 -6.135 6.061 1.00 0.00 H new ATOM 0 HG13 VAL A 70 87.898 -5.343 7.498 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.625 -6.715 7.391 1.00 0.00 H new ATOM 0 HG22 VAL A 70 89.634 -6.524 8.857 1.00 0.00 H new ATOM 0 HG23 VAL A 70 90.196 -8.140 8.367 1.00 0.00 H new ATOM 1127 N ASP A 71 85.262 -8.511 7.378 1.00 0.00 N ATOM 1128 CA ASP A 71 84.237 -9.147 6.519 1.00 0.00 C ATOM 1129 C ASP A 71 84.106 -8.263 5.290 1.00 0.00 C ATOM 1130 O ASP A 71 84.649 -7.176 5.251 1.00 0.00 O ATOM 1131 CB ASP A 71 82.896 -9.213 7.256 1.00 0.00 C ATOM 1132 CG ASP A 71 82.984 -10.231 8.394 1.00 0.00 C ATOM 1133 OD1 ASP A 71 83.869 -11.070 8.347 1.00 0.00 O ATOM 1134 OD2 ASP A 71 82.165 -10.153 9.296 1.00 0.00 O ATOM 0 H ASP A 71 84.898 -7.909 8.116 1.00 0.00 H new ATOM 0 HA ASP A 71 84.521 -10.165 6.253 1.00 0.00 H new ATOM 0 HB2 ASP A 71 82.639 -8.231 7.653 1.00 0.00 H new ATOM 0 HB3 ASP A 71 82.103 -9.495 6.564 1.00 0.00 H new ATOM 1139 N PHE A 72 83.397 -8.679 4.291 1.00 0.00 N ATOM 1140 CA PHE A 72 83.264 -7.806 3.110 1.00 0.00 C ATOM 1141 C PHE A 72 82.672 -6.483 3.590 1.00 0.00 C ATOM 1142 O PHE A 72 83.044 -5.415 3.146 1.00 0.00 O ATOM 1143 CB PHE A 72 82.330 -8.461 2.097 1.00 0.00 C ATOM 1144 CG PHE A 72 82.208 -7.560 0.904 1.00 0.00 C ATOM 1145 CD1 PHE A 72 83.098 -7.696 -0.163 1.00 0.00 C ATOM 1146 CD2 PHE A 72 81.212 -6.582 0.868 1.00 0.00 C ATOM 1147 CE1 PHE A 72 82.995 -6.852 -1.269 1.00 0.00 C ATOM 1148 CE2 PHE A 72 81.105 -5.737 -0.238 1.00 0.00 C ATOM 1149 CZ PHE A 72 81.997 -5.871 -1.310 1.00 0.00 C ATOM 0 H PHE A 72 82.910 -9.574 4.241 1.00 0.00 H new ATOM 0 HA PHE A 72 84.229 -7.642 2.631 1.00 0.00 H new ATOM 0 HB2 PHE A 72 82.720 -9.434 1.798 1.00 0.00 H new ATOM 0 HB3 PHE A 72 81.350 -8.633 2.542 1.00 0.00 H new ATOM 0 HD1 PHE A 72 83.866 -8.455 -0.132 1.00 0.00 H new ATOM 0 HD2 PHE A 72 80.525 -6.479 1.695 1.00 0.00 H new ATOM 0 HE1 PHE A 72 83.685 -6.955 -2.093 1.00 0.00 H new ATOM 0 HE2 PHE A 72 80.335 -4.980 -0.267 1.00 0.00 H new ATOM 0 HZ PHE A 72 81.915 -5.219 -2.167 1.00 0.00 H new ATOM 1159 N GLN A 73 81.748 -6.565 4.506 1.00 0.00 N ATOM 1160 CA GLN A 73 81.105 -5.340 5.051 1.00 0.00 C ATOM 1161 C GLN A 73 82.104 -4.500 5.865 1.00 0.00 C ATOM 1162 O GLN A 73 82.083 -3.291 5.791 1.00 0.00 O ATOM 1163 CB GLN A 73 79.937 -5.747 5.957 1.00 0.00 C ATOM 1164 CG GLN A 73 79.183 -4.495 6.415 1.00 0.00 C ATOM 1165 CD GLN A 73 77.925 -4.905 7.184 1.00 0.00 C ATOM 1166 OE1 GLN A 73 76.877 -5.098 6.600 1.00 0.00 O ATOM 1167 NE2 GLN A 73 77.980 -5.040 8.482 1.00 0.00 N ATOM 0 H GLN A 73 81.408 -7.440 4.904 1.00 0.00 H new ATOM 0 HA GLN A 73 80.750 -4.737 4.215 1.00 0.00 H new ATOM 0 HB2 GLN A 73 79.263 -6.414 5.420 1.00 0.00 H new ATOM 0 HB3 GLN A 73 80.308 -6.297 6.822 1.00 0.00 H new ATOM 0 HG2 GLN A 73 79.825 -3.883 7.048 1.00 0.00 H new ATOM 0 HG3 GLN A 73 78.912 -3.886 5.553 1.00 0.00 H new ATOM 0 HE21 GLN A 73 78.858 -4.879 8.975 1.00 0.00 H new ATOM 0 HE22 GLN A 73 77.145 -5.307 9.003 1.00 0.00 H new ATOM 1176 N GLU A 74 82.970 -5.097 6.654 1.00 0.00 N ATOM 1177 CA GLU A 74 83.906 -4.259 7.445 1.00 0.00 C ATOM 1178 C GLU A 74 84.916 -3.613 6.509 1.00 0.00 C ATOM 1179 O GLU A 74 85.282 -2.467 6.673 1.00 0.00 O ATOM 1180 CB GLU A 74 84.614 -5.123 8.484 1.00 0.00 C ATOM 1181 CG GLU A 74 85.381 -4.232 9.462 1.00 0.00 C ATOM 1182 CD GLU A 74 86.017 -5.102 10.545 1.00 0.00 C ATOM 1183 OE1 GLU A 74 85.712 -6.282 10.582 1.00 0.00 O ATOM 1184 OE2 GLU A 74 86.793 -4.575 11.322 1.00 0.00 O ATOM 0 H GLU A 74 83.062 -6.105 6.778 1.00 0.00 H new ATOM 0 HA GLU A 74 83.354 -3.475 7.963 1.00 0.00 H new ATOM 0 HB2 GLU A 74 83.886 -5.729 9.024 1.00 0.00 H new ATOM 0 HB3 GLU A 74 85.300 -5.812 7.991 1.00 0.00 H new ATOM 0 HG2 GLU A 74 86.150 -3.670 8.933 1.00 0.00 H new ATOM 0 HG3 GLU A 74 84.707 -3.504 9.913 1.00 0.00 H new ATOM 1191 N TYR A 75 85.370 -4.326 5.520 1.00 0.00 N ATOM 1192 CA TYR A 75 86.350 -3.714 4.591 1.00 0.00 C ATOM 1193 C TYR A 75 85.706 -2.490 3.944 1.00 0.00 C ATOM 1194 O TYR A 75 86.331 -1.463 3.776 1.00 0.00 O ATOM 1195 CB TYR A 75 86.745 -4.712 3.501 1.00 0.00 C ATOM 1196 CG TYR A 75 87.693 -4.035 2.541 1.00 0.00 C ATOM 1197 CD1 TYR A 75 89.072 -4.052 2.782 1.00 0.00 C ATOM 1198 CD2 TYR A 75 87.187 -3.377 1.413 1.00 0.00 C ATOM 1199 CE1 TYR A 75 89.945 -3.413 1.891 1.00 0.00 C ATOM 1200 CE2 TYR A 75 88.059 -2.739 0.524 1.00 0.00 C ATOM 1201 CZ TYR A 75 89.438 -2.758 0.762 1.00 0.00 C ATOM 1202 OH TYR A 75 90.298 -2.128 -0.117 1.00 0.00 O ATOM 0 H TYR A 75 85.109 -5.291 5.318 1.00 0.00 H new ATOM 0 HA TYR A 75 87.245 -3.428 5.144 1.00 0.00 H new ATOM 0 HB2 TYR A 75 87.219 -5.587 3.945 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.859 -5.063 2.972 1.00 0.00 H new ATOM 0 HD1 TYR A 75 89.463 -4.557 3.653 1.00 0.00 H new ATOM 0 HD2 TYR A 75 86.123 -3.362 1.229 1.00 0.00 H new ATOM 0 HE1 TYR A 75 91.009 -3.426 2.075 1.00 0.00 H new ATOM 0 HE2 TYR A 75 87.668 -2.232 -0.346 1.00 0.00 H new ATOM 0 HH TYR A 75 89.783 -1.724 -0.846 1.00 0.00 H new ATOM 1212 N CYS A 76 84.449 -2.587 3.599 1.00 0.00 N ATOM 1213 CA CYS A 76 83.752 -1.428 2.985 1.00 0.00 C ATOM 1214 C CYS A 76 83.610 -0.329 4.037 1.00 0.00 C ATOM 1215 O CYS A 76 83.784 0.840 3.751 1.00 0.00 O ATOM 1216 CB CYS A 76 82.372 -1.862 2.458 1.00 0.00 C ATOM 1217 SG CYS A 76 81.127 -1.791 3.777 1.00 0.00 S ATOM 0 H CYS A 76 83.877 -3.423 3.718 1.00 0.00 H new ATOM 0 HA CYS A 76 84.329 -1.047 2.142 1.00 0.00 H new ATOM 0 HB2 CYS A 76 82.072 -1.215 1.634 1.00 0.00 H new ATOM 0 HB3 CYS A 76 82.431 -2.876 2.062 1.00 0.00 H new ATOM 0 HG CYS A 76 81.546 -2.466 4.806 1.00 0.00 H new ATOM 1223 N VAL A 77 83.310 -0.690 5.261 1.00 0.00 N ATOM 1224 CA VAL A 77 83.183 0.353 6.310 1.00 0.00 C ATOM 1225 C VAL A 77 84.523 1.066 6.407 1.00 0.00 C ATOM 1226 O VAL A 77 84.597 2.276 6.484 1.00 0.00 O ATOM 1227 CB VAL A 77 82.843 -0.311 7.649 1.00 0.00 C ATOM 1228 CG1 VAL A 77 82.955 0.719 8.784 1.00 0.00 C ATOM 1229 CG2 VAL A 77 81.413 -0.872 7.594 1.00 0.00 C ATOM 0 H VAL A 77 83.151 -1.649 5.570 1.00 0.00 H new ATOM 0 HA VAL A 77 82.392 1.062 6.065 1.00 0.00 H new ATOM 0 HB VAL A 77 83.543 -1.125 7.837 1.00 0.00 H new ATOM 0 HG11 VAL A 77 82.712 0.242 9.734 1.00 0.00 H new ATOM 0 HG12 VAL A 77 83.972 1.108 8.823 1.00 0.00 H new ATOM 0 HG13 VAL A 77 82.260 1.538 8.602 1.00 0.00 H new ATOM 0 HG21 VAL A 77 81.171 -1.344 8.546 1.00 0.00 H new ATOM 0 HG22 VAL A 77 80.711 -0.061 7.402 1.00 0.00 H new ATOM 0 HG23 VAL A 77 81.342 -1.610 6.795 1.00 0.00 H new ATOM 1239 N PHE A 78 85.587 0.317 6.366 1.00 0.00 N ATOM 1240 CA PHE A 78 86.931 0.938 6.411 1.00 0.00 C ATOM 1241 C PHE A 78 87.166 1.681 5.090 1.00 0.00 C ATOM 1242 O PHE A 78 87.708 2.766 5.070 1.00 0.00 O ATOM 1243 CB PHE A 78 87.995 -0.154 6.610 1.00 0.00 C ATOM 1244 CG PHE A 78 88.166 -0.452 8.090 1.00 0.00 C ATOM 1245 CD1 PHE A 78 87.087 -0.941 8.839 1.00 0.00 C ATOM 1246 CD2 PHE A 78 89.405 -0.238 8.712 1.00 0.00 C ATOM 1247 CE1 PHE A 78 87.245 -1.215 10.202 1.00 0.00 C ATOM 1248 CE2 PHE A 78 89.562 -0.514 10.075 1.00 0.00 C ATOM 1249 CZ PHE A 78 88.483 -1.002 10.821 1.00 0.00 C ATOM 0 H PHE A 78 85.581 -0.701 6.303 1.00 0.00 H new ATOM 0 HA PHE A 78 86.999 1.641 7.241 1.00 0.00 H new ATOM 0 HB2 PHE A 78 87.701 -1.060 6.080 1.00 0.00 H new ATOM 0 HB3 PHE A 78 88.944 0.170 6.184 1.00 0.00 H new ATOM 0 HD1 PHE A 78 86.132 -1.107 8.363 1.00 0.00 H new ATOM 0 HD2 PHE A 78 90.238 0.140 8.139 1.00 0.00 H new ATOM 0 HE1 PHE A 78 86.412 -1.591 10.777 1.00 0.00 H new ATOM 0 HE2 PHE A 78 90.517 -0.350 10.552 1.00 0.00 H new ATOM 0 HZ PHE A 78 88.605 -1.214 11.873 1.00 0.00 H new ATOM 1259 N LEU A 79 86.754 1.113 3.980 1.00 0.00 N ATOM 1260 CA LEU A 79 86.957 1.813 2.676 1.00 0.00 C ATOM 1261 C LEU A 79 86.113 3.086 2.672 1.00 0.00 C ATOM 1262 O LEU A 79 86.525 4.127 2.198 1.00 0.00 O ATOM 1263 CB LEU A 79 86.524 0.904 1.518 1.00 0.00 C ATOM 1264 CG LEU A 79 87.018 1.465 0.167 1.00 0.00 C ATOM 1265 CD1 LEU A 79 88.565 1.466 0.121 1.00 0.00 C ATOM 1266 CD2 LEU A 79 86.445 0.604 -0.991 1.00 0.00 C ATOM 0 H LEU A 79 86.292 0.206 3.923 1.00 0.00 H new ATOM 0 HA LEU A 79 88.011 2.060 2.550 1.00 0.00 H new ATOM 0 HB2 LEU A 79 86.923 -0.099 1.668 1.00 0.00 H new ATOM 0 HB3 LEU A 79 85.438 0.816 1.505 1.00 0.00 H new ATOM 0 HG LEU A 79 86.670 2.492 0.056 1.00 0.00 H new ATOM 0 HD11 LEU A 79 88.900 1.864 -0.837 1.00 0.00 H new ATOM 0 HD12 LEU A 79 88.953 2.088 0.928 1.00 0.00 H new ATOM 0 HD13 LEU A 79 88.933 0.447 0.239 1.00 0.00 H new ATOM 0 HD21 LEU A 79 86.793 0.999 -1.945 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.783 -0.426 -0.880 1.00 0.00 H new ATOM 0 HD23 LEU A 79 85.356 0.634 -0.962 1.00 0.00 H new ATOM 1278 N SER A 80 84.933 2.999 3.212 1.00 0.00 N ATOM 1279 CA SER A 80 84.035 4.183 3.267 1.00 0.00 C ATOM 1280 C SER A 80 84.623 5.188 4.247 1.00 0.00 C ATOM 1281 O SER A 80 84.638 6.374 4.001 1.00 0.00 O ATOM 1282 CB SER A 80 82.647 3.748 3.740 1.00 0.00 C ATOM 1283 OG SER A 80 81.819 4.894 3.884 1.00 0.00 O ATOM 0 H SER A 80 84.547 2.149 3.622 1.00 0.00 H new ATOM 0 HA SER A 80 83.946 4.636 2.280 1.00 0.00 H new ATOM 0 HB2 SER A 80 82.207 3.055 3.023 1.00 0.00 H new ATOM 0 HB3 SER A 80 82.723 3.219 4.690 1.00 0.00 H new ATOM 0 HG SER A 80 80.886 4.647 3.713 1.00 0.00 H new ATOM 1289 N CYS A 81 85.146 4.718 5.343 1.00 0.00 N ATOM 1290 CA CYS A 81 85.763 5.650 6.315 1.00 0.00 C ATOM 1291 C CYS A 81 86.888 6.365 5.591 1.00 0.00 C ATOM 1292 O CYS A 81 87.136 7.538 5.793 1.00 0.00 O ATOM 1293 CB CYS A 81 86.335 4.874 7.502 1.00 0.00 C ATOM 1294 SG CYS A 81 86.988 6.041 8.722 1.00 0.00 S ATOM 0 H CYS A 81 85.171 3.732 5.604 1.00 0.00 H new ATOM 0 HA CYS A 81 85.022 6.355 6.693 1.00 0.00 H new ATOM 0 HB2 CYS A 81 85.560 4.254 7.953 1.00 0.00 H new ATOM 0 HB3 CYS A 81 87.125 4.202 7.165 1.00 0.00 H new ATOM 0 HG CYS A 81 87.318 7.150 8.129 1.00 0.00 H new ATOM 1300 N ILE A 82 87.551 5.664 4.717 1.00 0.00 N ATOM 1301 CA ILE A 82 88.644 6.308 3.941 1.00 0.00 C ATOM 1302 C ILE A 82 88.012 7.298 2.966 1.00 0.00 C ATOM 1303 O ILE A 82 88.520 8.379 2.741 1.00 0.00 O ATOM 1304 CB ILE A 82 89.465 5.260 3.182 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.276 4.437 4.186 1.00 0.00 C ATOM 1306 CG2 ILE A 82 90.425 5.958 2.214 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.917 3.241 3.480 1.00 0.00 C ATOM 0 H ILE A 82 87.385 4.680 4.507 1.00 0.00 H new ATOM 0 HA ILE A 82 89.323 6.826 4.618 1.00 0.00 H new ATOM 0 HB ILE A 82 88.794 4.610 2.621 1.00 0.00 H new ATOM 0 HG12 ILE A 82 91.047 5.059 4.640 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.630 4.091 4.992 1.00 0.00 H new ATOM 0 HG21 ILE A 82 91.007 5.210 1.676 1.00 0.00 H new ATOM 0 HG22 ILE A 82 89.854 6.554 1.502 1.00 0.00 H new ATOM 0 HG23 ILE A 82 91.098 6.607 2.774 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.493 2.659 4.200 1.00 0.00 H new ATOM 0 HD12 ILE A 82 90.138 2.614 3.047 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.578 3.597 2.689 1.00 0.00 H new ATOM 1319 N ALA A 83 86.909 6.927 2.379 1.00 0.00 N ATOM 1320 CA ALA A 83 86.242 7.837 1.409 1.00 0.00 C ATOM 1321 C ALA A 83 85.893 9.156 2.097 1.00 0.00 C ATOM 1322 O ALA A 83 86.184 10.212 1.590 1.00 0.00 O ATOM 1323 CB ALA A 83 84.958 7.188 0.902 1.00 0.00 C ATOM 0 H ALA A 83 86.441 6.033 2.529 1.00 0.00 H new ATOM 0 HA ALA A 83 86.917 8.026 0.574 1.00 0.00 H new ATOM 0 HB1 ALA A 83 84.469 7.855 0.191 1.00 0.00 H new ATOM 0 HB2 ALA A 83 85.197 6.245 0.410 1.00 0.00 H new ATOM 0 HB3 ALA A 83 84.289 7.000 1.742 1.00 0.00 H new ATOM 1329 N MET A 84 85.286 9.116 3.252 1.00 0.00 N ATOM 1330 CA MET A 84 84.953 10.400 3.941 1.00 0.00 C ATOM 1331 C MET A 84 86.245 11.115 4.295 1.00 0.00 C ATOM 1332 O MET A 84 86.352 12.320 4.173 1.00 0.00 O ATOM 1333 CB MET A 84 84.139 10.142 5.214 1.00 0.00 C ATOM 1334 CG MET A 84 82.689 9.780 4.858 1.00 0.00 C ATOM 1335 SD MET A 84 82.611 8.077 4.258 1.00 0.00 S ATOM 1336 CE MET A 84 82.491 7.269 5.875 1.00 0.00 C ATOM 0 H MET A 84 85.009 8.266 3.743 1.00 0.00 H new ATOM 0 HA MET A 84 84.352 11.017 3.273 1.00 0.00 H new ATOM 0 HB2 MET A 84 84.593 9.332 5.786 1.00 0.00 H new ATOM 0 HB3 MET A 84 84.154 11.028 5.849 1.00 0.00 H new ATOM 0 HG2 MET A 84 82.050 9.896 5.734 1.00 0.00 H new ATOM 0 HG3 MET A 84 82.311 10.461 4.096 1.00 0.00 H new ATOM 0 HE1 MET A 84 82.732 6.211 5.772 1.00 0.00 H new ATOM 0 HE2 MET A 84 83.192 7.735 6.568 1.00 0.00 H new ATOM 0 HE3 MET A 84 81.477 7.374 6.260 1.00 0.00 H new ATOM 1346 N MET A 85 87.240 10.391 4.715 1.00 0.00 N ATOM 1347 CA MET A 85 88.518 11.056 5.046 1.00 0.00 C ATOM 1348 C MET A 85 88.973 11.796 3.795 1.00 0.00 C ATOM 1349 O MET A 85 89.678 12.782 3.864 1.00 0.00 O ATOM 1350 CB MET A 85 89.567 10.018 5.449 1.00 0.00 C ATOM 1351 CG MET A 85 90.801 10.732 6.008 1.00 0.00 C ATOM 1352 SD MET A 85 92.042 9.507 6.504 1.00 0.00 S ATOM 1353 CE MET A 85 92.649 9.042 4.860 1.00 0.00 C ATOM 0 H MET A 85 87.222 9.379 4.841 1.00 0.00 H new ATOM 0 HA MET A 85 88.390 11.743 5.882 1.00 0.00 H new ATOM 0 HB2 MET A 85 89.155 9.340 6.197 1.00 0.00 H new ATOM 0 HB3 MET A 85 89.844 9.411 4.587 1.00 0.00 H new ATOM 0 HG2 MET A 85 91.217 11.402 5.256 1.00 0.00 H new ATOM 0 HG3 MET A 85 90.521 11.347 6.863 1.00 0.00 H new ATOM 0 HE1 MET A 85 92.469 7.980 4.693 1.00 0.00 H new ATOM 0 HE2 MET A 85 92.125 9.623 4.101 1.00 0.00 H new ATOM 0 HE3 MET A 85 93.718 9.243 4.797 1.00 0.00 H new ATOM 1363 N CYS A 86 88.544 11.341 2.642 1.00 0.00 N ATOM 1364 CA CYS A 86 88.929 12.042 1.387 1.00 0.00 C ATOM 1365 C CYS A 86 87.963 11.670 0.261 1.00 0.00 C ATOM 1366 O CYS A 86 88.320 10.991 -0.681 1.00 0.00 O ATOM 1367 CB CYS A 86 90.365 11.664 0.998 1.00 0.00 C ATOM 1368 SG CYS A 86 91.535 12.700 1.913 1.00 0.00 S ATOM 0 H CYS A 86 87.949 10.521 2.521 1.00 0.00 H new ATOM 0 HA CYS A 86 88.878 13.118 1.551 1.00 0.00 H new ATOM 0 HB2 CYS A 86 90.547 10.612 1.217 1.00 0.00 H new ATOM 0 HB3 CYS A 86 90.509 11.796 -0.074 1.00 0.00 H new ATOM 0 HG CYS A 86 91.035 12.996 3.076 1.00 0.00 H new ATOM 1374 N ASN A 87 86.745 12.122 0.348 1.00 0.00 N ATOM 1375 CA ASN A 87 85.757 11.807 -0.723 1.00 0.00 C ATOM 1376 C ASN A 87 85.997 12.744 -1.904 1.00 0.00 C ATOM 1377 O ASN A 87 86.216 12.317 -3.019 1.00 0.00 O ATOM 1378 CB ASN A 87 84.342 12.024 -0.180 1.00 0.00 C ATOM 1379 CG ASN A 87 83.319 11.477 -1.177 1.00 0.00 C ATOM 1380 OD1 ASN A 87 82.892 12.177 -2.073 1.00 0.00 O ATOM 1381 ND2 ASN A 87 82.894 10.251 -1.047 1.00 0.00 N ATOM 0 H ASN A 87 86.389 12.696 1.113 1.00 0.00 H new ATOM 0 HA ASN A 87 85.869 10.771 -1.044 1.00 0.00 H new ATOM 0 HB2 ASN A 87 84.230 11.524 0.782 1.00 0.00 H new ATOM 0 HB3 ASN A 87 84.166 13.086 -0.009 1.00 0.00 H new ATOM 0 HD21 ASN A 87 82.202 9.879 -1.698 1.00 0.00 H new ATOM 0 HD22 ASN A 87 83.253 9.664 -0.294 1.00 0.00 H new ATOM 1388 N GLU A 88 85.972 14.024 -1.650 1.00 0.00 N ATOM 1389 CA GLU A 88 86.208 15.024 -2.727 1.00 0.00 C ATOM 1390 C GLU A 88 86.214 16.417 -2.094 1.00 0.00 C ATOM 1391 O GLU A 88 87.032 17.254 -2.416 1.00 0.00 O ATOM 1392 CB GLU A 88 85.090 14.945 -3.776 1.00 0.00 C ATOM 1393 CG GLU A 88 85.348 15.975 -4.881 1.00 0.00 C ATOM 1394 CD GLU A 88 84.245 15.881 -5.935 1.00 0.00 C ATOM 1395 OE1 GLU A 88 83.442 14.967 -5.845 1.00 0.00 O ATOM 1396 OE2 GLU A 88 84.226 16.721 -6.820 1.00 0.00 O ATOM 0 H GLU A 88 85.795 14.424 -0.728 1.00 0.00 H new ATOM 0 HA GLU A 88 87.161 14.822 -3.217 1.00 0.00 H new ATOM 0 HB2 GLU A 88 85.047 13.943 -4.202 1.00 0.00 H new ATOM 0 HB3 GLU A 88 84.124 15.134 -3.308 1.00 0.00 H new ATOM 0 HG2 GLU A 88 85.376 16.979 -4.457 1.00 0.00 H new ATOM 0 HG3 GLU A 88 86.320 15.796 -5.340 1.00 0.00 H new ATOM 1403 N PHE A 89 85.300 16.667 -1.193 1.00 0.00 N ATOM 1404 CA PHE A 89 85.245 18.003 -0.536 1.00 0.00 C ATOM 1405 C PHE A 89 86.506 18.220 0.302 1.00 0.00 C ATOM 1406 O PHE A 89 86.993 17.323 0.961 1.00 0.00 O ATOM 1407 CB PHE A 89 84.009 18.086 0.366 1.00 0.00 C ATOM 1408 CG PHE A 89 84.047 16.981 1.396 1.00 0.00 C ATOM 1409 CD1 PHE A 89 84.768 17.150 2.585 1.00 0.00 C ATOM 1410 CD2 PHE A 89 83.350 15.788 1.165 1.00 0.00 C ATOM 1411 CE1 PHE A 89 84.792 16.127 3.541 1.00 0.00 C ATOM 1412 CE2 PHE A 89 83.375 14.766 2.121 1.00 0.00 C ATOM 1413 CZ PHE A 89 84.097 14.935 3.309 1.00 0.00 C ATOM 0 H PHE A 89 84.590 16.003 -0.885 1.00 0.00 H new ATOM 0 HA PHE A 89 85.185 18.775 -1.303 1.00 0.00 H new ATOM 0 HB2 PHE A 89 83.975 19.056 0.862 1.00 0.00 H new ATOM 0 HB3 PHE A 89 83.103 18.003 -0.235 1.00 0.00 H new ATOM 0 HD1 PHE A 89 85.305 18.069 2.764 1.00 0.00 H new ATOM 0 HD2 PHE A 89 82.793 15.657 0.249 1.00 0.00 H new ATOM 0 HE1 PHE A 89 85.347 16.258 4.458 1.00 0.00 H new ATOM 0 HE2 PHE A 89 82.837 13.847 1.942 1.00 0.00 H new ATOM 0 HZ PHE A 89 84.117 14.146 4.046 1.00 0.00 H new ATOM 1423 N PHE A 90 87.039 19.413 0.276 1.00 0.00 N ATOM 1424 CA PHE A 90 88.272 19.715 1.062 1.00 0.00 C ATOM 1425 C PHE A 90 87.861 20.294 2.413 1.00 0.00 C ATOM 1426 O PHE A 90 88.686 20.647 3.232 1.00 0.00 O ATOM 1427 CB PHE A 90 89.109 20.741 0.299 1.00 0.00 C ATOM 1428 CG PHE A 90 89.342 20.232 -1.100 1.00 0.00 C ATOM 1429 CD1 PHE A 90 90.454 19.431 -1.384 1.00 0.00 C ATOM 1430 CD2 PHE A 90 88.433 20.552 -2.113 1.00 0.00 C ATOM 1431 CE1 PHE A 90 90.655 18.950 -2.683 1.00 0.00 C ATOM 1432 CE2 PHE A 90 88.633 20.075 -3.409 1.00 0.00 C ATOM 1433 CZ PHE A 90 89.744 19.273 -3.697 1.00 0.00 C ATOM 0 H PHE A 90 86.670 20.198 -0.261 1.00 0.00 H new ATOM 0 HA PHE A 90 88.857 18.808 1.212 1.00 0.00 H new ATOM 0 HB2 PHE A 90 88.595 21.702 0.271 1.00 0.00 H new ATOM 0 HB3 PHE A 90 90.061 20.904 0.805 1.00 0.00 H new ATOM 0 HD1 PHE A 90 91.156 19.184 -0.602 1.00 0.00 H new ATOM 0 HD2 PHE A 90 87.575 21.169 -1.892 1.00 0.00 H new ATOM 0 HE1 PHE A 90 91.512 18.330 -2.903 1.00 0.00 H new ATOM 0 HE2 PHE A 90 87.930 20.325 -4.190 1.00 0.00 H new ATOM 0 HZ PHE A 90 89.898 18.904 -4.700 1.00 0.00 H new ATOM 1443 N GLU A 91 86.584 20.404 2.638 1.00 0.00 N ATOM 1444 CA GLU A 91 86.091 20.975 3.926 1.00 0.00 C ATOM 1445 C GLU A 91 86.641 20.162 5.103 1.00 0.00 C ATOM 1446 O GLU A 91 86.630 18.947 5.097 1.00 0.00 O ATOM 1447 CB GLU A 91 84.562 20.921 3.941 1.00 0.00 C ATOM 1448 CG GLU A 91 84.009 21.911 2.915 1.00 0.00 C ATOM 1449 CD GLU A 91 82.480 21.855 2.930 1.00 0.00 C ATOM 1450 OE1 GLU A 91 81.946 20.955 3.556 1.00 0.00 O ATOM 1451 OE2 GLU A 91 81.870 22.710 2.308 1.00 0.00 O ATOM 0 H GLU A 91 85.854 20.122 1.984 1.00 0.00 H new ATOM 0 HA GLU A 91 86.429 22.007 4.019 1.00 0.00 H new ATOM 0 HB2 GLU A 91 84.220 19.912 3.710 1.00 0.00 H new ATOM 0 HB3 GLU A 91 84.188 21.164 4.936 1.00 0.00 H new ATOM 0 HG2 GLU A 91 84.350 22.920 3.146 1.00 0.00 H new ATOM 0 HG3 GLU A 91 84.383 21.669 1.920 1.00 0.00 H new ATOM 1458 N GLY A 92 87.129 20.836 6.114 1.00 0.00 N ATOM 1459 CA GLY A 92 87.692 20.128 7.303 1.00 0.00 C ATOM 1460 C GLY A 92 86.586 19.859 8.329 1.00 0.00 C ATOM 1461 O GLY A 92 86.851 19.654 9.496 1.00 0.00 O ATOM 0 H GLY A 92 87.161 21.854 6.166 1.00 0.00 H new ATOM 0 HA2 GLY A 92 88.148 19.188 6.994 1.00 0.00 H new ATOM 0 HA3 GLY A 92 88.480 20.731 7.755 1.00 0.00 H new ATOM 1465 N PHE A 93 85.349 19.867 7.913 1.00 0.00 N ATOM 1466 CA PHE A 93 84.242 19.620 8.882 1.00 0.00 C ATOM 1467 C PHE A 93 84.304 18.152 9.356 1.00 0.00 C ATOM 1468 O PHE A 93 84.779 17.297 8.634 1.00 0.00 O ATOM 1469 CB PHE A 93 82.893 19.890 8.190 1.00 0.00 C ATOM 1470 CG PHE A 93 82.561 21.369 8.265 1.00 0.00 C ATOM 1471 CD1 PHE A 93 83.402 22.307 7.652 1.00 0.00 C ATOM 1472 CD2 PHE A 93 81.417 21.798 8.951 1.00 0.00 C ATOM 1473 CE1 PHE A 93 83.099 23.672 7.727 1.00 0.00 C ATOM 1474 CE2 PHE A 93 81.115 23.162 9.024 1.00 0.00 C ATOM 1475 CZ PHE A 93 81.956 24.100 8.413 1.00 0.00 C ATOM 0 H PHE A 93 85.057 20.033 6.950 1.00 0.00 H new ATOM 0 HA PHE A 93 84.344 20.282 9.742 1.00 0.00 H new ATOM 0 HB2 PHE A 93 82.938 19.571 7.149 1.00 0.00 H new ATOM 0 HB3 PHE A 93 82.106 19.307 8.668 1.00 0.00 H new ATOM 0 HD1 PHE A 93 84.283 21.977 7.122 1.00 0.00 H new ATOM 0 HD2 PHE A 93 80.768 21.075 9.424 1.00 0.00 H new ATOM 0 HE1 PHE A 93 83.748 24.395 7.255 1.00 0.00 H new ATOM 0 HE2 PHE A 93 80.232 23.492 9.552 1.00 0.00 H new ATOM 0 HZ PHE A 93 81.723 25.153 8.471 1.00 0.00 H new ATOM 1485 N PRO A 94 83.835 17.845 10.554 1.00 0.00 N ATOM 1486 CA PRO A 94 83.877 16.438 11.055 1.00 0.00 C ATOM 1487 C PRO A 94 82.896 15.530 10.300 1.00 0.00 C ATOM 1488 O PRO A 94 81.823 15.219 10.777 1.00 0.00 O ATOM 1489 CB PRO A 94 83.465 16.607 12.530 1.00 0.00 C ATOM 1490 CG PRO A 94 82.783 17.976 12.669 1.00 0.00 C ATOM 1491 CD PRO A 94 83.239 18.850 11.488 1.00 0.00 C ATOM 0 HA PRO A 94 84.847 15.960 10.920 1.00 0.00 H new ATOM 0 HB2 PRO A 94 82.786 15.809 12.832 1.00 0.00 H new ATOM 0 HB3 PRO A 94 84.338 16.546 13.180 1.00 0.00 H new ATOM 0 HG2 PRO A 94 81.699 17.865 12.666 1.00 0.00 H new ATOM 0 HG3 PRO A 94 83.053 18.443 13.616 1.00 0.00 H new ATOM 0 HD2 PRO A 94 82.405 19.383 11.032 1.00 0.00 H new ATOM 0 HD3 PRO A 94 83.967 19.600 11.796 1.00 0.00 H new ATOM 1499 N ASP A 95 83.262 15.102 9.123 1.00 0.00 N ATOM 1500 CA ASP A 95 82.362 14.213 8.330 1.00 0.00 C ATOM 1501 C ASP A 95 82.780 12.754 8.540 1.00 0.00 C ATOM 1502 O ASP A 95 82.024 11.837 8.287 1.00 0.00 O ATOM 1503 CB ASP A 95 82.498 14.566 6.848 1.00 0.00 C ATOM 1504 CG ASP A 95 81.402 13.860 6.049 1.00 0.00 C ATOM 1505 OD1 ASP A 95 81.367 12.640 6.079 1.00 0.00 O ATOM 1506 OD2 ASP A 95 80.619 14.550 5.419 1.00 0.00 O ATOM 0 H ASP A 95 84.149 15.330 8.674 1.00 0.00 H new ATOM 0 HA ASP A 95 81.329 14.348 8.652 1.00 0.00 H new ATOM 0 HB2 ASP A 95 82.423 15.645 6.713 1.00 0.00 H new ATOM 0 HB3 ASP A 95 83.480 14.266 6.481 1.00 0.00 H new ATOM 1511 N LYS A 96 83.985 12.540 8.996 1.00 0.00 N ATOM 1512 CA LYS A 96 84.484 11.148 9.226 1.00 0.00 C ATOM 1513 C LYS A 96 84.404 10.802 10.715 1.00 0.00 C ATOM 1514 O LYS A 96 85.030 9.867 11.174 1.00 0.00 O ATOM 1515 CB LYS A 96 85.942 11.061 8.752 1.00 0.00 C ATOM 1516 CG LYS A 96 86.847 11.873 9.688 1.00 0.00 C ATOM 1517 CD LYS A 96 88.245 11.989 9.078 1.00 0.00 C ATOM 1518 CE LYS A 96 89.206 12.578 10.115 1.00 0.00 C ATOM 1519 NZ LYS A 96 88.799 13.979 10.426 1.00 0.00 N ATOM 0 H LYS A 96 84.654 13.276 9.222 1.00 0.00 H new ATOM 0 HA LYS A 96 83.869 10.441 8.669 1.00 0.00 H new ATOM 0 HB2 LYS A 96 86.265 10.020 8.733 1.00 0.00 H new ATOM 0 HB3 LYS A 96 86.025 11.440 7.733 1.00 0.00 H new ATOM 0 HG2 LYS A 96 86.425 12.865 9.847 1.00 0.00 H new ATOM 0 HG3 LYS A 96 86.904 11.391 10.664 1.00 0.00 H new ATOM 0 HD2 LYS A 96 88.596 11.008 8.757 1.00 0.00 H new ATOM 0 HD3 LYS A 96 88.216 12.623 8.192 1.00 0.00 H new ATOM 0 HE2 LYS A 96 89.195 11.974 11.022 1.00 0.00 H new ATOM 0 HE3 LYS A 96 90.227 12.560 9.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 89.547 14.443 10.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 88.651 14.502 9.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 87.916 13.970 10.975 1.00 0.00 H new ATOM 1533 N GLN A 97 83.661 11.552 11.481 1.00 0.00 N ATOM 1534 CA GLN A 97 83.579 11.256 12.938 1.00 0.00 C ATOM 1535 C GLN A 97 82.795 9.944 13.144 1.00 0.00 C ATOM 1536 O GLN A 97 81.915 9.633 12.365 1.00 0.00 O ATOM 1537 CB GLN A 97 82.852 12.407 13.641 1.00 0.00 C ATOM 1538 CG GLN A 97 81.424 12.516 13.103 1.00 0.00 C ATOM 1539 CD GLN A 97 80.787 13.813 13.609 1.00 0.00 C ATOM 1540 OE1 GLN A 97 81.331 14.474 14.472 1.00 0.00 O ATOM 1541 NE2 GLN A 97 79.650 14.209 13.106 1.00 0.00 N ATOM 0 H GLN A 97 83.111 12.351 11.164 1.00 0.00 H new ATOM 0 HA GLN A 97 84.580 11.149 13.355 1.00 0.00 H new ATOM 0 HB2 GLN A 97 82.834 12.236 14.717 1.00 0.00 H new ATOM 0 HB3 GLN A 97 83.386 13.343 13.476 1.00 0.00 H new ATOM 0 HG2 GLN A 97 81.432 12.503 12.013 1.00 0.00 H new ATOM 0 HG3 GLN A 97 80.835 11.658 13.427 1.00 0.00 H new ATOM 0 HE21 GLN A 97 79.192 13.655 12.382 1.00 0.00 H new ATOM 0 HE22 GLN A 97 79.219 15.072 13.437 1.00 0.00 H new ATOM 1550 N PRO A 98 83.089 9.171 14.177 1.00 0.00 N ATOM 1551 CA PRO A 98 82.347 7.897 14.413 1.00 0.00 C ATOM 1552 C PRO A 98 80.890 8.138 14.831 1.00 0.00 C ATOM 1553 O PRO A 98 80.512 9.229 15.209 1.00 0.00 O ATOM 1554 CB PRO A 98 83.155 7.253 15.554 1.00 0.00 C ATOM 1555 CG PRO A 98 84.025 8.348 16.189 1.00 0.00 C ATOM 1556 CD PRO A 98 84.163 9.491 15.169 1.00 0.00 C ATOM 0 HA PRO A 98 82.271 7.278 13.519 1.00 0.00 H new ATOM 0 HB2 PRO A 98 82.487 6.817 16.297 1.00 0.00 H new ATOM 0 HB3 PRO A 98 83.778 6.444 15.172 1.00 0.00 H new ATOM 0 HG2 PRO A 98 83.569 8.711 17.110 1.00 0.00 H new ATOM 0 HG3 PRO A 98 85.005 7.951 16.453 1.00 0.00 H new ATOM 0 HD2 PRO A 98 84.012 10.467 15.630 1.00 0.00 H new ATOM 0 HD3 PRO A 98 85.150 9.506 14.707 1.00 0.00 H new ATOM 1564 N ARG A 99 80.076 7.119 14.769 1.00 0.00 N ATOM 1565 CA ARG A 99 78.646 7.269 15.169 1.00 0.00 C ATOM 1566 C ARG A 99 78.506 6.944 16.659 1.00 0.00 C ATOM 1567 O ARG A 99 77.444 7.072 17.237 1.00 0.00 O ATOM 1568 CB ARG A 99 77.791 6.296 14.354 1.00 0.00 C ATOM 1569 CG ARG A 99 77.752 6.750 12.894 1.00 0.00 C ATOM 1570 CD ARG A 99 76.897 5.779 12.079 1.00 0.00 C ATOM 1571 NE ARG A 99 75.490 5.828 12.564 1.00 0.00 N ATOM 1572 CZ ARG A 99 74.529 5.343 11.826 1.00 0.00 C ATOM 1573 NH1 ARG A 99 74.801 4.825 10.660 1.00 0.00 N ATOM 1574 NH2 ARG A 99 73.296 5.379 12.255 1.00 0.00 N ATOM 0 H ARG A 99 80.341 6.185 14.457 1.00 0.00 H new ATOM 0 HA ARG A 99 78.314 8.291 14.983 1.00 0.00 H new ATOM 0 HB2 ARG A 99 78.203 5.289 14.422 1.00 0.00 H new ATOM 0 HB3 ARG A 99 76.780 6.255 14.760 1.00 0.00 H new ATOM 0 HG2 ARG A 99 77.341 7.757 12.826 1.00 0.00 H new ATOM 0 HG3 ARG A 99 78.763 6.790 12.488 1.00 0.00 H new ATOM 0 HD2 ARG A 99 76.938 6.041 11.022 1.00 0.00 H new ATOM 0 HD3 ARG A 99 77.290 4.766 12.172 1.00 0.00 H new ATOM 0 HE ARG A 99 75.277 6.240 13.472 1.00 0.00 H new ATOM 0 HH11 ARG A 99 75.764 4.799 10.326 1.00 0.00 H new ATOM 0 HH12 ARG A 99 74.050 4.446 10.083 1.00 0.00 H new ATOM 0 HH21 ARG A 99 73.085 5.786 13.166 1.00 0.00 H new ATOM 0 HH22 ARG A 99 72.544 5.000 11.679 1.00 0.00 H new ATOM 1588 N LYS A 100 79.572 6.516 17.281 1.00 0.00 N ATOM 1589 CA LYS A 100 79.512 6.168 18.730 1.00 0.00 C ATOM 1590 C LYS A 100 79.374 7.442 19.567 1.00 0.00 C ATOM 1591 O LYS A 100 79.862 8.493 19.201 1.00 0.00 O ATOM 1592 CB LYS A 100 80.801 5.445 19.126 1.00 0.00 C ATOM 1593 CG LYS A 100 80.920 4.142 18.334 1.00 0.00 C ATOM 1594 CD LYS A 100 82.342 3.582 18.465 1.00 0.00 C ATOM 1595 CE LYS A 100 82.647 3.255 19.931 1.00 0.00 C ATOM 1596 NZ LYS A 100 81.491 2.532 20.533 1.00 0.00 N ATOM 0 H LYS A 100 80.486 6.392 16.845 1.00 0.00 H new ATOM 0 HA LYS A 100 78.651 5.524 18.910 1.00 0.00 H new ATOM 0 HB2 LYS A 100 81.663 6.082 18.929 1.00 0.00 H new ATOM 0 HB3 LYS A 100 80.798 5.234 20.195 1.00 0.00 H new ATOM 0 HG2 LYS A 100 80.197 3.414 18.703 1.00 0.00 H new ATOM 0 HG3 LYS A 100 80.685 4.321 17.285 1.00 0.00 H new ATOM 0 HD2 LYS A 100 82.445 2.684 17.855 1.00 0.00 H new ATOM 0 HD3 LYS A 100 83.063 4.308 18.089 1.00 0.00 H new ATOM 0 HE2 LYS A 100 83.546 2.643 19.998 1.00 0.00 H new ATOM 0 HE3 LYS A 100 82.844 4.173 20.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 81.818 1.967 21.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 80.781 3.220 20.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 81.066 1.903 19.822 1.00 0.00 H new ATOM 1610 N LYS A 101 78.720 7.354 20.695 1.00 0.00 N ATOM 1611 CA LYS A 101 78.562 8.559 21.560 1.00 0.00 C ATOM 1612 C LYS A 101 79.915 8.906 22.186 1.00 0.00 C ATOM 1613 O LYS A 101 80.680 7.990 22.442 1.00 0.00 O ATOM 1614 CB LYS A 101 77.541 8.271 22.667 1.00 0.00 C ATOM 1615 CG LYS A 101 77.357 9.519 23.542 1.00 0.00 C ATOM 1616 CD LYS A 101 76.337 9.231 24.647 1.00 0.00 C ATOM 1617 CE LYS A 101 76.177 10.473 25.527 1.00 0.00 C ATOM 1618 NZ LYS A 101 75.100 10.237 26.531 1.00 0.00 N ATOM 1619 OXT LYS A 101 80.162 10.080 22.404 1.00 0.00 O ATOM 0 H LYS A 101 78.289 6.502 21.054 1.00 0.00 H new ATOM 0 HA LYS A 101 78.209 9.397 20.959 1.00 0.00 H new ATOM 0 HB2 LYS A 101 76.587 7.980 22.228 1.00 0.00 H new ATOM 0 HB3 LYS A 101 77.879 7.434 23.278 1.00 0.00 H new ATOM 0 HG2 LYS A 101 78.311 9.810 23.982 1.00 0.00 H new ATOM 0 HG3 LYS A 101 77.019 10.356 22.931 1.00 0.00 H new ATOM 0 HD2 LYS A 101 75.378 8.956 24.209 1.00 0.00 H new ATOM 0 HD3 LYS A 101 76.666 8.385 25.250 1.00 0.00 H new ATOM 0 HE2 LYS A 101 77.117 10.697 26.032 1.00 0.00 H new ATOM 0 HE3 LYS A 101 75.932 11.338 24.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 74.992 11.081 27.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 74.204 10.043 26.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 75.352 9.422 27.126 1.00 0.00 H new TER 1633 LYS A 101 ATOM 1634 N MET B 1 95.695 0.302 -13.930 1.00 0.00 N ATOM 1635 CA MET B 1 96.602 -0.880 -13.917 1.00 0.00 C ATOM 1636 C MET B 1 97.282 -0.975 -12.549 1.00 0.00 C ATOM 1637 O MET B 1 97.092 -1.925 -11.816 1.00 0.00 O ATOM 1638 CB MET B 1 97.659 -0.719 -15.015 1.00 0.00 C ATOM 1639 CG MET B 1 98.500 -1.995 -15.117 1.00 0.00 C ATOM 1640 SD MET B 1 97.480 -3.334 -15.782 1.00 0.00 S ATOM 1641 CE MET B 1 98.571 -4.701 -15.320 1.00 0.00 C ATOM 0 H1 MET B 1 95.230 0.372 -14.857 1.00 0.00 H new ATOM 0 H2 MET B 1 94.974 0.195 -13.188 1.00 0.00 H new ATOM 0 H3 MET B 1 96.247 1.165 -13.754 1.00 0.00 H new ATOM 0 HA MET B 1 96.031 -1.790 -14.100 1.00 0.00 H new ATOM 0 HB2 MET B 1 97.176 -0.514 -15.970 1.00 0.00 H new ATOM 0 HB3 MET B 1 98.301 0.134 -14.793 1.00 0.00 H new ATOM 0 HG2 MET B 1 99.362 -1.825 -15.762 1.00 0.00 H new ATOM 0 HG3 MET B 1 98.885 -2.270 -14.135 1.00 0.00 H new ATOM 0 HE1 MET B 1 98.128 -5.644 -15.641 1.00 0.00 H new ATOM 0 HE2 MET B 1 99.540 -4.572 -15.802 1.00 0.00 H new ATOM 0 HE3 MET B 1 98.703 -4.712 -14.238 1.00 0.00 H new ATOM 1653 N ALA B 2 98.075 0.001 -12.200 1.00 0.00 N ATOM 1654 CA ALA B 2 98.763 -0.037 -10.879 1.00 0.00 C ATOM 1655 C ALA B 2 97.721 -0.082 -9.756 1.00 0.00 C ATOM 1656 O ALA B 2 97.792 -0.902 -8.865 1.00 0.00 O ATOM 1657 CB ALA B 2 99.632 1.212 -10.718 1.00 0.00 C ATOM 0 H ALA B 2 98.276 0.822 -12.772 1.00 0.00 H new ATOM 0 HA ALA B 2 99.391 -0.926 -10.826 1.00 0.00 H new ATOM 0 HB1 ALA B 2 100.135 1.183 -9.751 1.00 0.00 H new ATOM 0 HB2 ALA B 2 100.376 1.242 -11.514 1.00 0.00 H new ATOM 0 HB3 ALA B 2 99.005 2.102 -10.774 1.00 0.00 H new ATOM 1663 N CYS B 3 96.753 0.800 -9.789 1.00 0.00 N ATOM 1664 CA CYS B 3 95.707 0.810 -8.718 1.00 0.00 C ATOM 1665 C CYS B 3 94.363 1.257 -9.310 1.00 0.00 C ATOM 1666 O CYS B 3 93.907 2.354 -9.053 1.00 0.00 O ATOM 1667 CB CYS B 3 96.121 1.785 -7.614 1.00 0.00 C ATOM 1668 SG CYS B 3 96.583 3.370 -8.353 1.00 0.00 S ATOM 0 H CYS B 3 96.641 1.513 -10.510 1.00 0.00 H new ATOM 0 HA CYS B 3 95.605 -0.194 -8.305 1.00 0.00 H new ATOM 0 HB2 CYS B 3 95.300 1.925 -6.911 1.00 0.00 H new ATOM 0 HB3 CYS B 3 96.959 1.377 -7.049 1.00 0.00 H new ATOM 0 HG CYS B 3 95.509 4.027 -8.678 1.00 0.00 H new ATOM 1674 N PRO B 4 93.729 0.423 -10.099 1.00 0.00 N ATOM 1675 CA PRO B 4 92.422 0.790 -10.712 1.00 0.00 C ATOM 1676 C PRO B 4 91.337 1.036 -9.650 1.00 0.00 C ATOM 1677 O PRO B 4 90.325 1.654 -9.914 1.00 0.00 O ATOM 1678 CB PRO B 4 92.103 -0.433 -11.600 1.00 0.00 C ATOM 1679 CG PRO B 4 93.278 -1.433 -11.501 1.00 0.00 C ATOM 1680 CD PRO B 4 94.264 -0.927 -10.432 1.00 0.00 C ATOM 0 HA PRO B 4 92.459 1.724 -11.273 1.00 0.00 H new ATOM 0 HB2 PRO B 4 91.176 -0.905 -11.275 1.00 0.00 H new ATOM 0 HB3 PRO B 4 91.957 -0.122 -12.634 1.00 0.00 H new ATOM 0 HG2 PRO B 4 92.910 -2.424 -11.237 1.00 0.00 H new ATOM 0 HG3 PRO B 4 93.779 -1.525 -12.465 1.00 0.00 H new ATOM 0 HD2 PRO B 4 94.284 -1.580 -9.560 1.00 0.00 H new ATOM 0 HD3 PRO B 4 95.283 -0.875 -10.815 1.00 0.00 H new ATOM 1688 N LEU B 5 91.547 0.558 -8.454 1.00 0.00 N ATOM 1689 CA LEU B 5 90.537 0.764 -7.377 1.00 0.00 C ATOM 1690 C LEU B 5 90.342 2.264 -7.149 1.00 0.00 C ATOM 1691 O LEU B 5 89.269 2.715 -6.811 1.00 0.00 O ATOM 1692 CB LEU B 5 91.023 0.096 -6.081 1.00 0.00 C ATOM 1693 CG LEU B 5 90.028 0.351 -4.935 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.640 -0.196 -5.302 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.534 -0.356 -3.671 1.00 0.00 C ATOM 0 H LEU B 5 92.376 0.033 -8.176 1.00 0.00 H new ATOM 0 HA LEU B 5 89.588 0.317 -7.673 1.00 0.00 H new ATOM 0 HB2 LEU B 5 91.137 -0.976 -6.239 1.00 0.00 H new ATOM 0 HB3 LEU B 5 92.005 0.485 -5.811 1.00 0.00 H new ATOM 0 HG LEU B 5 89.948 1.424 -4.761 1.00 0.00 H new ATOM 0 HD11 LEU B 5 87.947 -0.009 -4.482 1.00 0.00 H new ATOM 0 HD12 LEU B 5 88.280 0.301 -6.203 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.708 -1.269 -5.482 1.00 0.00 H new ATOM 0 HD21 LEU B 5 89.836 -0.182 -2.852 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.612 -1.427 -3.860 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.514 0.037 -3.402 1.00 0.00 H new ATOM 1707 N GLU B 6 91.375 3.039 -7.321 1.00 0.00 N ATOM 1708 CA GLU B 6 91.251 4.507 -7.093 1.00 0.00 C ATOM 1709 C GLU B 6 90.188 5.093 -8.027 1.00 0.00 C ATOM 1710 O GLU B 6 89.405 5.938 -7.635 1.00 0.00 O ATOM 1711 CB GLU B 6 92.606 5.156 -7.390 1.00 0.00 C ATOM 1712 CG GLU B 6 93.613 4.762 -6.307 1.00 0.00 C ATOM 1713 CD GLU B 6 94.975 5.377 -6.632 1.00 0.00 C ATOM 1714 OE1 GLU B 6 95.124 5.889 -7.729 1.00 0.00 O ATOM 1715 OE2 GLU B 6 95.847 5.320 -5.780 1.00 0.00 O ATOM 0 H GLU B 6 92.300 2.721 -7.610 1.00 0.00 H new ATOM 0 HA GLU B 6 90.956 4.699 -6.062 1.00 0.00 H new ATOM 0 HB2 GLU B 6 92.966 4.838 -8.368 1.00 0.00 H new ATOM 0 HB3 GLU B 6 92.501 6.240 -7.426 1.00 0.00 H new ATOM 0 HG2 GLU B 6 93.269 5.107 -5.332 1.00 0.00 H new ATOM 0 HG3 GLU B 6 93.696 3.677 -6.250 1.00 0.00 H new ATOM 1722 N LYS B 7 90.138 4.650 -9.251 1.00 0.00 N ATOM 1723 CA LYS B 7 89.111 5.177 -10.191 1.00 0.00 C ATOM 1724 C LYS B 7 87.756 4.632 -9.786 1.00 0.00 C ATOM 1725 O LYS B 7 86.770 5.335 -9.765 1.00 0.00 O ATOM 1726 CB LYS B 7 89.427 4.710 -11.611 1.00 0.00 C ATOM 1727 CG LYS B 7 90.884 5.029 -11.932 1.00 0.00 C ATOM 1728 CD LYS B 7 91.111 4.960 -13.444 1.00 0.00 C ATOM 1729 CE LYS B 7 90.636 3.609 -13.982 1.00 0.00 C ATOM 1730 NZ LYS B 7 91.104 2.517 -13.082 1.00 0.00 N ATOM 0 H LYS B 7 90.764 3.946 -9.642 1.00 0.00 H new ATOM 0 HA LYS B 7 89.108 6.267 -10.158 1.00 0.00 H new ATOM 0 HB2 LYS B 7 89.248 3.639 -11.702 1.00 0.00 H new ATOM 0 HB3 LYS B 7 88.768 5.205 -12.324 1.00 0.00 H new ATOM 0 HG2 LYS B 7 91.138 6.022 -11.562 1.00 0.00 H new ATOM 0 HG3 LYS B 7 91.541 4.322 -11.424 1.00 0.00 H new ATOM 0 HD2 LYS B 7 90.572 5.768 -13.938 1.00 0.00 H new ATOM 0 HD3 LYS B 7 92.169 5.099 -13.668 1.00 0.00 H new ATOM 0 HE2 LYS B 7 89.548 3.596 -14.050 1.00 0.00 H new ATOM 0 HE3 LYS B 7 91.020 3.453 -14.990 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 91.007 1.602 -13.567 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 92.102 2.674 -12.835 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 90.530 2.512 -12.215 1.00 0.00 H new ATOM 1744 N ALA B 8 87.700 3.377 -9.454 1.00 0.00 N ATOM 1745 CA ALA B 8 86.396 2.804 -9.047 1.00 0.00 C ATOM 1746 C ALA B 8 85.917 3.578 -7.830 1.00 0.00 C ATOM 1747 O ALA B 8 84.763 3.945 -7.727 1.00 0.00 O ATOM 1748 CB ALA B 8 86.539 1.319 -8.723 1.00 0.00 C ATOM 0 H ALA B 8 88.490 2.732 -9.447 1.00 0.00 H new ATOM 0 HA ALA B 8 85.672 2.888 -9.858 1.00 0.00 H new ATOM 0 HB1 ALA B 8 85.571 0.916 -8.426 1.00 0.00 H new ATOM 0 HB2 ALA B 8 86.898 0.787 -9.604 1.00 0.00 H new ATOM 0 HB3 ALA B 8 87.250 1.191 -7.907 1.00 0.00 H new ATOM 1754 N LEU B 9 86.807 3.895 -6.933 1.00 0.00 N ATOM 1755 CA LEU B 9 86.389 4.718 -5.776 1.00 0.00 C ATOM 1756 C LEU B 9 85.894 6.029 -6.343 1.00 0.00 C ATOM 1757 O LEU B 9 84.899 6.579 -5.911 1.00 0.00 O ATOM 1758 CB LEU B 9 87.569 4.981 -4.839 1.00 0.00 C ATOM 1759 CG LEU B 9 87.942 3.690 -4.109 1.00 0.00 C ATOM 1760 CD1 LEU B 9 89.250 3.906 -3.340 1.00 0.00 C ATOM 1761 CD2 LEU B 9 86.815 3.286 -3.133 1.00 0.00 C ATOM 0 H LEU B 9 87.790 3.623 -6.953 1.00 0.00 H new ATOM 0 HA LEU B 9 85.619 4.206 -5.199 1.00 0.00 H new ATOM 0 HB2 LEU B 9 88.423 5.349 -5.408 1.00 0.00 H new ATOM 0 HB3 LEU B 9 87.308 5.756 -4.118 1.00 0.00 H new ATOM 0 HG LEU B 9 88.075 2.889 -4.836 1.00 0.00 H new ATOM 0 HD11 LEU B 9 89.521 2.988 -2.818 1.00 0.00 H new ATOM 0 HD12 LEU B 9 90.043 4.173 -4.039 1.00 0.00 H new ATOM 0 HD13 LEU B 9 89.118 4.710 -2.616 1.00 0.00 H new ATOM 0 HD21 LEU B 9 87.092 2.365 -2.619 1.00 0.00 H new ATOM 0 HD22 LEU B 9 86.666 4.080 -2.401 1.00 0.00 H new ATOM 0 HD23 LEU B 9 85.891 3.127 -3.689 1.00 0.00 H new ATOM 1773 N ASP B 10 86.574 6.522 -7.339 1.00 0.00 N ATOM 1774 CA ASP B 10 86.126 7.787 -7.963 1.00 0.00 C ATOM 1775 C ASP B 10 84.782 7.533 -8.643 1.00 0.00 C ATOM 1776 O ASP B 10 83.897 8.360 -8.615 1.00 0.00 O ATOM 1777 CB ASP B 10 87.155 8.273 -8.987 1.00 0.00 C ATOM 1778 CG ASP B 10 86.822 9.707 -9.396 1.00 0.00 C ATOM 1779 OD1 ASP B 10 85.728 10.149 -9.088 1.00 0.00 O ATOM 1780 OD2 ASP B 10 87.666 10.340 -10.006 1.00 0.00 O ATOM 0 H ASP B 10 87.413 6.105 -7.742 1.00 0.00 H new ATOM 0 HA ASP B 10 86.022 8.560 -7.202 1.00 0.00 H new ATOM 0 HB2 ASP B 10 88.158 8.227 -8.562 1.00 0.00 H new ATOM 0 HB3 ASP B 10 87.150 7.623 -9.862 1.00 0.00 H new ATOM 1785 N VAL B 11 84.617 6.386 -9.249 1.00 0.00 N ATOM 1786 CA VAL B 11 83.317 6.088 -9.917 1.00 0.00 C ATOM 1787 C VAL B 11 82.200 6.128 -8.873 1.00 0.00 C ATOM 1788 O VAL B 11 81.129 6.650 -9.112 1.00 0.00 O ATOM 1789 CB VAL B 11 83.375 4.687 -10.543 1.00 0.00 C ATOM 1790 CG1 VAL B 11 81.992 4.281 -11.055 1.00 0.00 C ATOM 1791 CG2 VAL B 11 84.382 4.666 -11.704 1.00 0.00 C ATOM 0 H VAL B 11 85.320 5.649 -9.310 1.00 0.00 H new ATOM 0 HA VAL B 11 83.124 6.827 -10.695 1.00 0.00 H new ATOM 0 HB VAL B 11 83.696 3.978 -9.779 1.00 0.00 H new ATOM 0 HG11 VAL B 11 82.045 3.286 -11.497 1.00 0.00 H new ATOM 0 HG12 VAL B 11 81.285 4.272 -10.225 1.00 0.00 H new ATOM 0 HG13 VAL B 11 81.659 4.995 -11.808 1.00 0.00 H new ATOM 0 HG21 VAL B 11 84.414 3.667 -12.140 1.00 0.00 H new ATOM 0 HG22 VAL B 11 84.075 5.384 -12.465 1.00 0.00 H new ATOM 0 HG23 VAL B 11 85.372 4.932 -11.332 1.00 0.00 H new ATOM 1801 N MET B 12 82.446 5.585 -7.710 1.00 0.00 N ATOM 1802 CA MET B 12 81.401 5.599 -6.648 1.00 0.00 C ATOM 1803 C MET B 12 81.117 7.043 -6.246 1.00 0.00 C ATOM 1804 O MET B 12 79.990 7.432 -6.027 1.00 0.00 O ATOM 1805 CB MET B 12 81.912 4.828 -5.428 1.00 0.00 C ATOM 1806 CG MET B 12 81.978 3.331 -5.746 1.00 0.00 C ATOM 1807 SD MET B 12 83.076 2.505 -4.565 1.00 0.00 S ATOM 1808 CE MET B 12 82.419 3.265 -3.059 1.00 0.00 C ATOM 0 H MET B 12 83.323 5.134 -7.451 1.00 0.00 H new ATOM 0 HA MET B 12 80.489 5.133 -7.021 1.00 0.00 H new ATOM 0 HB2 MET B 12 82.900 5.192 -5.145 1.00 0.00 H new ATOM 0 HB3 MET B 12 81.253 4.999 -4.577 1.00 0.00 H new ATOM 0 HG2 MET B 12 80.980 2.894 -5.697 1.00 0.00 H new ATOM 0 HG3 MET B 12 82.342 3.181 -6.762 1.00 0.00 H new ATOM 0 HE1 MET B 12 82.677 2.648 -2.198 1.00 0.00 H new ATOM 0 HE2 MET B 12 82.849 4.259 -2.935 1.00 0.00 H new ATOM 0 HE3 MET B 12 81.335 3.346 -3.136 1.00 0.00 H new ATOM 1818 N VAL B 13 82.143 7.834 -6.138 1.00 0.00 N ATOM 1819 CA VAL B 13 81.956 9.259 -5.742 1.00 0.00 C ATOM 1820 C VAL B 13 81.513 10.101 -6.944 1.00 0.00 C ATOM 1821 O VAL B 13 80.607 10.904 -6.847 1.00 0.00 O ATOM 1822 CB VAL B 13 83.276 9.796 -5.198 1.00 0.00 C ATOM 1823 CG1 VAL B 13 83.097 11.251 -4.762 1.00 0.00 C ATOM 1824 CG2 VAL B 13 83.703 8.946 -4.003 1.00 0.00 C ATOM 0 H VAL B 13 83.110 7.556 -6.307 1.00 0.00 H new ATOM 0 HA VAL B 13 81.182 9.319 -4.977 1.00 0.00 H new ATOM 0 HB VAL B 13 84.042 9.749 -5.972 1.00 0.00 H new ATOM 0 HG11 VAL B 13 84.041 11.633 -4.374 1.00 0.00 H new ATOM 0 HG12 VAL B 13 82.787 11.852 -5.617 1.00 0.00 H new ATOM 0 HG13 VAL B 13 82.335 11.307 -3.984 1.00 0.00 H new ATOM 0 HG21 VAL B 13 84.646 9.323 -3.607 1.00 0.00 H new ATOM 0 HG22 VAL B 13 82.938 8.997 -3.228 1.00 0.00 H new ATOM 0 HG23 VAL B 13 83.830 7.911 -4.320 1.00 0.00 H new ATOM 1834 N SER B 14 82.151 9.938 -8.076 1.00 0.00 N ATOM 1835 CA SER B 14 81.767 10.750 -9.268 1.00 0.00 C ATOM 1836 C SER B 14 80.309 10.475 -9.623 1.00 0.00 C ATOM 1837 O SER B 14 79.528 11.383 -9.832 1.00 0.00 O ATOM 1838 CB SER B 14 82.656 10.371 -10.454 1.00 0.00 C ATOM 1839 OG SER B 14 82.340 11.202 -11.563 1.00 0.00 O ATOM 0 H SER B 14 82.917 9.281 -8.225 1.00 0.00 H new ATOM 0 HA SER B 14 81.895 11.808 -9.040 1.00 0.00 H new ATOM 0 HB2 SER B 14 83.707 10.486 -10.187 1.00 0.00 H new ATOM 0 HB3 SER B 14 82.506 9.324 -10.715 1.00 0.00 H new ATOM 0 HG SER B 14 82.909 10.962 -12.324 1.00 0.00 H new ATOM 1845 N THR B 15 79.934 9.231 -9.687 1.00 0.00 N ATOM 1846 CA THR B 15 78.523 8.897 -10.018 1.00 0.00 C ATOM 1847 C THR B 15 77.605 9.463 -8.930 1.00 0.00 C ATOM 1848 O THR B 15 76.539 9.968 -9.197 1.00 0.00 O ATOM 1849 CB THR B 15 78.379 7.370 -10.123 1.00 0.00 C ATOM 1850 OG1 THR B 15 77.284 7.059 -10.971 1.00 0.00 O ATOM 1851 CG2 THR B 15 78.155 6.736 -8.745 1.00 0.00 C ATOM 0 H THR B 15 80.544 8.430 -9.524 1.00 0.00 H new ATOM 0 HA THR B 15 78.240 9.338 -10.974 1.00 0.00 H new ATOM 0 HB THR B 15 79.303 6.966 -10.537 1.00 0.00 H new ATOM 0 HG1 THR B 15 76.592 6.595 -10.455 1.00 0.00 H new ATOM 0 HG21 THR B 15 78.057 5.656 -8.853 1.00 0.00 H new ATOM 0 HG22 THR B 15 79.004 6.961 -8.099 1.00 0.00 H new ATOM 0 HG23 THR B 15 77.245 7.140 -8.302 1.00 0.00 H new ATOM 1859 N PHE B 16 78.026 9.361 -7.703 1.00 0.00 N ATOM 1860 CA PHE B 16 77.198 9.865 -6.562 1.00 0.00 C ATOM 1861 C PHE B 16 76.926 11.366 -6.698 1.00 0.00 C ATOM 1862 O PHE B 16 75.838 11.832 -6.426 1.00 0.00 O ATOM 1863 CB PHE B 16 77.969 9.624 -5.264 1.00 0.00 C ATOM 1864 CG PHE B 16 77.175 10.134 -4.086 1.00 0.00 C ATOM 1865 CD1 PHE B 16 77.222 11.493 -3.746 1.00 0.00 C ATOM 1866 CD2 PHE B 16 76.408 9.248 -3.323 1.00 0.00 C ATOM 1867 CE1 PHE B 16 76.501 11.963 -2.643 1.00 0.00 C ATOM 1868 CE2 PHE B 16 75.685 9.719 -2.220 1.00 0.00 C ATOM 1869 CZ PHE B 16 75.732 11.076 -1.880 1.00 0.00 C ATOM 0 H PHE B 16 78.918 8.946 -7.433 1.00 0.00 H new ATOM 0 HA PHE B 16 76.244 9.338 -6.560 1.00 0.00 H new ATOM 0 HB2 PHE B 16 78.170 8.559 -5.144 1.00 0.00 H new ATOM 0 HB3 PHE B 16 78.935 10.128 -5.307 1.00 0.00 H new ATOM 0 HD1 PHE B 16 77.815 12.177 -4.335 1.00 0.00 H new ATOM 0 HD2 PHE B 16 76.373 8.201 -3.584 1.00 0.00 H new ATOM 0 HE1 PHE B 16 76.538 13.010 -2.380 1.00 0.00 H new ATOM 0 HE2 PHE B 16 75.091 9.035 -1.632 1.00 0.00 H new ATOM 0 HZ PHE B 16 75.175 11.439 -1.029 1.00 0.00 H new ATOM 1879 N HIS B 17 77.894 12.126 -7.117 1.00 0.00 N ATOM 1880 CA HIS B 17 77.676 13.591 -7.262 1.00 0.00 C ATOM 1881 C HIS B 17 76.672 13.843 -8.385 1.00 0.00 C ATOM 1882 O HIS B 17 75.921 14.799 -8.353 1.00 0.00 O ATOM 1883 CB HIS B 17 79.012 14.290 -7.562 1.00 0.00 C ATOM 1884 CG HIS B 17 79.750 14.543 -6.271 1.00 0.00 C ATOM 1885 ND1 HIS B 17 80.549 13.581 -5.667 1.00 0.00 N ATOM 1886 CD2 HIS B 17 79.799 15.641 -5.449 1.00 0.00 C ATOM 1887 CE1 HIS B 17 81.037 14.117 -4.531 1.00 0.00 C ATOM 1888 NE2 HIS B 17 80.610 15.367 -4.354 1.00 0.00 N ATOM 0 H HIS B 17 78.827 11.798 -7.366 1.00 0.00 H new ATOM 0 HA HIS B 17 77.277 13.998 -6.333 1.00 0.00 H new ATOM 0 HB2 HIS B 17 79.618 13.671 -8.224 1.00 0.00 H new ATOM 0 HB3 HIS B 17 78.833 15.232 -8.081 1.00 0.00 H new ATOM 0 HD1 HIS B 17 80.733 12.641 -6.019 1.00 0.00 H new ATOM 0 HD2 HIS B 17 79.286 16.575 -5.626 1.00 0.00 H new ATOM 0 HE1 HIS B 17 81.693 13.598 -3.848 1.00 0.00 H new ATOM 1897 N LYS B 18 76.645 12.999 -9.374 1.00 0.00 N ATOM 1898 CA LYS B 18 75.678 13.204 -10.486 1.00 0.00 C ATOM 1899 C LYS B 18 74.260 13.179 -9.911 1.00 0.00 C ATOM 1900 O LYS B 18 73.426 13.991 -10.257 1.00 0.00 O ATOM 1901 CB LYS B 18 75.841 12.075 -11.511 1.00 0.00 C ATOM 1902 CG LYS B 18 74.857 12.249 -12.677 1.00 0.00 C ATOM 1903 CD LYS B 18 75.133 13.569 -13.416 1.00 0.00 C ATOM 1904 CE LYS B 18 74.550 13.499 -14.830 1.00 0.00 C ATOM 1905 NZ LYS B 18 73.097 13.181 -14.753 1.00 0.00 N ATOM 0 H LYS B 18 77.247 12.180 -9.462 1.00 0.00 H new ATOM 0 HA LYS B 18 75.861 14.161 -10.975 1.00 0.00 H new ATOM 0 HB2 LYS B 18 76.863 12.067 -11.890 1.00 0.00 H new ATOM 0 HB3 LYS B 18 75.673 11.112 -11.028 1.00 0.00 H new ATOM 0 HG2 LYS B 18 74.950 11.411 -13.368 1.00 0.00 H new ATOM 0 HG3 LYS B 18 73.833 12.241 -12.302 1.00 0.00 H new ATOM 0 HD2 LYS B 18 74.690 14.402 -12.870 1.00 0.00 H new ATOM 0 HD3 LYS B 18 76.206 13.753 -13.463 1.00 0.00 H new ATOM 0 HE2 LYS B 18 74.699 14.449 -15.343 1.00 0.00 H new ATOM 0 HE3 LYS B 18 75.069 12.738 -15.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 72.646 13.396 -15.665 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 72.974 12.172 -14.535 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 72.656 13.753 -14.005 1.00 0.00 H new ATOM 1919 N TYR B 19 73.987 12.263 -9.020 1.00 0.00 N ATOM 1920 CA TYR B 19 72.626 12.205 -8.408 1.00 0.00 C ATOM 1921 C TYR B 19 72.518 13.279 -7.333 1.00 0.00 C ATOM 1922 O TYR B 19 71.498 13.919 -7.173 1.00 0.00 O ATOM 1923 CB TYR B 19 72.388 10.830 -7.781 1.00 0.00 C ATOM 1924 CG TYR B 19 72.333 9.793 -8.872 1.00 0.00 C ATOM 1925 CD1 TYR B 19 71.132 9.538 -9.542 1.00 0.00 C ATOM 1926 CD2 TYR B 19 73.490 9.097 -9.220 1.00 0.00 C ATOM 1927 CE1 TYR B 19 71.093 8.584 -10.566 1.00 0.00 C ATOM 1928 CE2 TYR B 19 73.456 8.142 -10.239 1.00 0.00 C ATOM 1929 CZ TYR B 19 72.257 7.887 -10.917 1.00 0.00 C ATOM 1930 OH TYR B 19 72.220 6.951 -11.928 1.00 0.00 O ATOM 0 H TYR B 19 74.644 11.555 -8.690 1.00 0.00 H new ATOM 0 HA TYR B 19 71.876 12.375 -9.181 1.00 0.00 H new ATOM 0 HB2 TYR B 19 73.187 10.594 -7.078 1.00 0.00 H new ATOM 0 HB3 TYR B 19 71.456 10.831 -7.216 1.00 0.00 H new ATOM 0 HD1 TYR B 19 70.236 10.076 -9.270 1.00 0.00 H new ATOM 0 HD2 TYR B 19 74.415 9.297 -8.700 1.00 0.00 H new ATOM 0 HE1 TYR B 19 70.167 8.385 -11.085 1.00 0.00 H new ATOM 0 HE2 TYR B 19 74.353 7.601 -10.504 1.00 0.00 H new ATOM 0 HH TYR B 19 73.094 6.911 -12.369 1.00 0.00 H new ATOM 1940 N SER B 20 73.571 13.476 -6.594 1.00 0.00 N ATOM 1941 CA SER B 20 73.550 14.505 -5.526 1.00 0.00 C ATOM 1942 C SER B 20 73.490 15.881 -6.190 1.00 0.00 C ATOM 1943 O SER B 20 73.259 16.887 -5.549 1.00 0.00 O ATOM 1944 CB SER B 20 74.819 14.368 -4.671 1.00 0.00 C ATOM 1945 OG SER B 20 74.517 14.704 -3.324 1.00 0.00 O ATOM 0 H SER B 20 74.449 12.965 -6.686 1.00 0.00 H new ATOM 0 HA SER B 20 72.682 14.378 -4.878 1.00 0.00 H new ATOM 0 HB2 SER B 20 75.200 13.348 -4.727 1.00 0.00 H new ATOM 0 HB3 SER B 20 75.602 15.022 -5.054 1.00 0.00 H new ATOM 0 HG SER B 20 74.862 14.007 -2.728 1.00 0.00 H new ATOM 1951 N GLY B 21 73.697 15.923 -7.479 1.00 0.00 N ATOM 1952 CA GLY B 21 73.651 17.226 -8.202 1.00 0.00 C ATOM 1953 C GLY B 21 72.202 17.552 -8.561 1.00 0.00 C ATOM 1954 O GLY B 21 71.830 18.700 -8.713 1.00 0.00 O ATOM 0 H GLY B 21 73.896 15.110 -8.063 1.00 0.00 H new ATOM 0 HA2 GLY B 21 74.070 18.016 -7.579 1.00 0.00 H new ATOM 0 HA3 GLY B 21 74.259 17.176 -9.105 1.00 0.00 H new ATOM 1958 N LYS B 22 71.377 16.548 -8.688 1.00 0.00 N ATOM 1959 CA LYS B 22 69.949 16.792 -9.025 1.00 0.00 C ATOM 1960 C LYS B 22 69.325 17.655 -7.928 1.00 0.00 C ATOM 1961 O LYS B 22 68.540 18.546 -8.189 1.00 0.00 O ATOM 1962 CB LYS B 22 69.206 15.457 -9.096 1.00 0.00 C ATOM 1963 CG LYS B 22 69.735 14.636 -10.275 1.00 0.00 C ATOM 1964 CD LYS B 22 68.802 13.452 -10.543 1.00 0.00 C ATOM 1965 CE LYS B 22 68.602 12.642 -9.258 1.00 0.00 C ATOM 1966 NZ LYS B 22 68.052 11.299 -9.597 1.00 0.00 N ATOM 0 H LYS B 22 71.633 15.567 -8.572 1.00 0.00 H new ATOM 0 HA LYS B 22 69.878 17.299 -9.988 1.00 0.00 H new ATOM 0 HB2 LYS B 22 69.341 14.905 -8.166 1.00 0.00 H new ATOM 0 HB3 LYS B 22 68.136 15.631 -9.212 1.00 0.00 H new ATOM 0 HG2 LYS B 22 69.806 15.263 -11.164 1.00 0.00 H new ATOM 0 HG3 LYS B 22 70.741 14.276 -10.057 1.00 0.00 H new ATOM 0 HD2 LYS B 22 67.841 13.812 -10.909 1.00 0.00 H new ATOM 0 HD3 LYS B 22 69.222 12.816 -11.322 1.00 0.00 H new ATOM 0 HE2 LYS B 22 69.550 12.536 -8.731 1.00 0.00 H new ATOM 0 HE3 LYS B 22 67.922 13.167 -8.587 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 68.121 10.676 -8.767 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 67.055 11.393 -9.877 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 68.595 10.890 -10.384 1.00 0.00 H new ATOM 1980 N GLU B 23 69.669 17.387 -6.695 1.00 0.00 N ATOM 1981 CA GLU B 23 69.107 18.173 -5.557 1.00 0.00 C ATOM 1982 C GLU B 23 70.073 19.286 -5.164 1.00 0.00 C ATOM 1983 O GLU B 23 71.262 19.214 -5.407 1.00 0.00 O ATOM 1984 CB GLU B 23 68.887 17.246 -4.359 1.00 0.00 C ATOM 1985 CG GLU B 23 67.664 16.373 -4.620 1.00 0.00 C ATOM 1986 CD GLU B 23 67.431 15.440 -3.430 1.00 0.00 C ATOM 1987 OE1 GLU B 23 68.300 15.370 -2.577 1.00 0.00 O ATOM 1988 OE2 GLU B 23 66.388 14.807 -3.395 1.00 0.00 O ATOM 0 H GLU B 23 70.321 16.650 -6.426 1.00 0.00 H new ATOM 0 HA GLU B 23 68.158 18.614 -5.862 1.00 0.00 H new ATOM 0 HB2 GLU B 23 69.767 16.622 -4.200 1.00 0.00 H new ATOM 0 HB3 GLU B 23 68.743 17.832 -3.451 1.00 0.00 H new ATOM 0 HG2 GLU B 23 66.786 16.999 -4.781 1.00 0.00 H new ATOM 0 HG3 GLU B 23 67.810 15.789 -5.529 1.00 0.00 H new ATOM 1995 N GLY B 24 69.562 20.317 -4.556 1.00 0.00 N ATOM 1996 CA GLY B 24 70.432 21.447 -4.141 1.00 0.00 C ATOM 1997 C GLY B 24 71.505 20.944 -3.175 1.00 0.00 C ATOM 1998 O GLY B 24 72.648 21.354 -3.235 1.00 0.00 O ATOM 0 H GLY B 24 68.574 20.425 -4.328 1.00 0.00 H new ATOM 0 HA2 GLY B 24 70.900 21.899 -5.016 1.00 0.00 H new ATOM 0 HA3 GLY B 24 69.834 22.223 -3.663 1.00 0.00 H new ATOM 2002 N ASP B 25 71.151 20.059 -2.285 1.00 0.00 N ATOM 2003 CA ASP B 25 72.159 19.533 -1.321 1.00 0.00 C ATOM 2004 C ASP B 25 72.997 18.454 -2.010 1.00 0.00 C ATOM 2005 O ASP B 25 72.480 17.463 -2.487 1.00 0.00 O ATOM 2006 CB ASP B 25 71.434 18.938 -0.113 1.00 0.00 C ATOM 2007 CG ASP B 25 70.215 18.141 -0.586 1.00 0.00 C ATOM 2008 OD1 ASP B 25 70.399 17.219 -1.366 1.00 0.00 O ATOM 2009 OD2 ASP B 25 69.118 18.469 -0.166 1.00 0.00 O ATOM 0 H ASP B 25 70.210 19.678 -2.183 1.00 0.00 H new ATOM 0 HA ASP B 25 72.814 20.338 -0.987 1.00 0.00 H new ATOM 0 HB2 ASP B 25 72.109 18.291 0.446 1.00 0.00 H new ATOM 0 HB3 ASP B 25 71.121 19.733 0.564 1.00 0.00 H new ATOM 2014 N LYS B 26 74.291 18.646 -2.081 1.00 0.00 N ATOM 2015 CA LYS B 26 75.173 17.645 -2.755 1.00 0.00 C ATOM 2016 C LYS B 26 75.857 16.756 -1.714 1.00 0.00 C ATOM 2017 O LYS B 26 76.620 15.872 -2.045 1.00 0.00 O ATOM 2018 CB LYS B 26 76.247 18.394 -3.543 1.00 0.00 C ATOM 2019 CG LYS B 26 75.582 19.289 -4.588 1.00 0.00 C ATOM 2020 CD LYS B 26 76.658 20.036 -5.374 1.00 0.00 C ATOM 2021 CE LYS B 26 76.001 20.943 -6.416 1.00 0.00 C ATOM 2022 NZ LYS B 26 75.267 20.113 -7.412 1.00 0.00 N ATOM 0 H LYS B 26 74.776 19.458 -1.699 1.00 0.00 H new ATOM 0 HA LYS B 26 74.571 17.022 -3.417 1.00 0.00 H new ATOM 0 HB2 LYS B 26 76.855 18.996 -2.868 1.00 0.00 H new ATOM 0 HB3 LYS B 26 76.917 17.685 -4.029 1.00 0.00 H new ATOM 0 HG2 LYS B 26 74.974 18.688 -5.264 1.00 0.00 H new ATOM 0 HG3 LYS B 26 74.912 19.999 -4.102 1.00 0.00 H new ATOM 0 HD2 LYS B 26 77.271 20.630 -4.696 1.00 0.00 H new ATOM 0 HD3 LYS B 26 77.323 19.325 -5.864 1.00 0.00 H new ATOM 0 HE2 LYS B 26 75.315 21.635 -5.929 1.00 0.00 H new ATOM 0 HE3 LYS B 26 76.759 21.545 -6.918 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 75.218 20.621 -8.318 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 75.766 19.211 -7.547 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 74.304 19.928 -7.067 1.00 0.00 H new ATOM 2036 N PHE B 27 75.605 16.996 -0.457 1.00 0.00 N ATOM 2037 CA PHE B 27 76.252 16.183 0.617 1.00 0.00 C ATOM 2038 C PHE B 27 75.287 15.101 1.102 1.00 0.00 C ATOM 2039 O PHE B 27 75.595 14.342 2.001 1.00 0.00 O ATOM 2040 CB PHE B 27 76.603 17.107 1.782 1.00 0.00 C ATOM 2041 CG PHE B 27 77.686 18.065 1.353 1.00 0.00 C ATOM 2042 CD1 PHE B 27 77.344 19.270 0.725 1.00 0.00 C ATOM 2043 CD2 PHE B 27 79.030 17.753 1.586 1.00 0.00 C ATOM 2044 CE1 PHE B 27 78.347 20.162 0.331 1.00 0.00 C ATOM 2045 CE2 PHE B 27 80.033 18.646 1.191 1.00 0.00 C ATOM 2046 CZ PHE B 27 79.692 19.850 0.564 1.00 0.00 C ATOM 0 H PHE B 27 74.975 17.725 -0.123 1.00 0.00 H new ATOM 0 HA PHE B 27 77.152 15.707 0.228 1.00 0.00 H new ATOM 0 HB2 PHE B 27 75.719 17.659 2.101 1.00 0.00 H new ATOM 0 HB3 PHE B 27 76.939 16.521 2.637 1.00 0.00 H new ATOM 0 HD1 PHE B 27 76.306 19.510 0.545 1.00 0.00 H new ATOM 0 HD2 PHE B 27 79.293 16.824 2.070 1.00 0.00 H new ATOM 0 HE1 PHE B 27 78.084 21.091 -0.153 1.00 0.00 H new ATOM 0 HE2 PHE B 27 81.071 18.406 1.370 1.00 0.00 H new ATOM 0 HZ PHE B 27 80.466 20.539 0.260 1.00 0.00 H new ATOM 2056 N LYS B 28 74.116 15.028 0.530 1.00 0.00 N ATOM 2057 CA LYS B 28 73.137 13.997 0.985 1.00 0.00 C ATOM 2058 C LYS B 28 72.065 13.773 -0.086 1.00 0.00 C ATOM 2059 O LYS B 28 71.859 14.604 -0.947 1.00 0.00 O ATOM 2060 CB LYS B 28 72.467 14.483 2.267 1.00 0.00 C ATOM 2061 CG LYS B 28 71.927 15.895 2.043 1.00 0.00 C ATOM 2062 CD LYS B 28 71.246 16.401 3.313 1.00 0.00 C ATOM 2063 CE LYS B 28 70.637 17.780 3.049 1.00 0.00 C ATOM 2064 NZ LYS B 28 69.870 18.221 4.247 1.00 0.00 N ATOM 0 H LYS B 28 73.795 15.632 -0.227 1.00 0.00 H new ATOM 0 HA LYS B 28 73.662 13.059 1.163 1.00 0.00 H new ATOM 0 HB2 LYS B 28 71.656 13.810 2.546 1.00 0.00 H new ATOM 0 HB3 LYS B 28 73.182 14.480 3.090 1.00 0.00 H new ATOM 0 HG2 LYS B 28 72.741 16.565 1.765 1.00 0.00 H new ATOM 0 HG3 LYS B 28 71.218 15.895 1.215 1.00 0.00 H new ATOM 0 HD2 LYS B 28 70.470 15.702 3.626 1.00 0.00 H new ATOM 0 HD3 LYS B 28 71.968 16.460 4.127 1.00 0.00 H new ATOM 0 HE2 LYS B 28 71.424 18.500 2.822 1.00 0.00 H new ATOM 0 HE3 LYS B 28 69.982 17.740 2.179 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 69.456 19.158 4.068 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 69.110 17.538 4.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 70.508 18.275 5.067 1.00 0.00 H new ATOM 2078 N LEU B 29 71.359 12.664 -0.018 1.00 0.00 N ATOM 2079 CA LEU B 29 70.269 12.386 -1.015 1.00 0.00 C ATOM 2080 C LEU B 29 69.017 11.949 -0.264 1.00 0.00 C ATOM 2081 O LEU B 29 69.035 11.724 0.930 1.00 0.00 O ATOM 2082 CB LEU B 29 70.645 11.249 -1.998 1.00 0.00 C ATOM 2083 CG LEU B 29 72.145 11.218 -2.296 1.00 0.00 C ATOM 2084 CD1 LEU B 29 72.474 9.895 -3.006 1.00 0.00 C ATOM 2085 CD2 LEU B 29 72.514 12.393 -3.208 1.00 0.00 C ATOM 0 H LEU B 29 71.491 11.938 0.686 1.00 0.00 H new ATOM 0 HA LEU B 29 70.109 13.301 -1.586 1.00 0.00 H new ATOM 0 HB2 LEU B 29 70.340 10.291 -1.577 1.00 0.00 H new ATOM 0 HB3 LEU B 29 70.094 11.378 -2.929 1.00 0.00 H new ATOM 0 HG LEU B 29 72.711 11.297 -1.368 1.00 0.00 H new ATOM 0 HD11 LEU B 29 73.541 9.856 -3.226 1.00 0.00 H new ATOM 0 HD12 LEU B 29 72.206 9.059 -2.360 1.00 0.00 H new ATOM 0 HD13 LEU B 29 71.909 9.831 -3.936 1.00 0.00 H new ATOM 0 HD21 LEU B 29 73.583 12.368 -3.419 1.00 0.00 H new ATOM 0 HD22 LEU B 29 71.958 12.317 -4.143 1.00 0.00 H new ATOM 0 HD23 LEU B 29 72.263 13.331 -2.712 1.00 0.00 H new ATOM 2097 N ASN B 30 67.941 11.781 -0.979 1.00 0.00 N ATOM 2098 CA ASN B 30 66.682 11.300 -0.356 1.00 0.00 C ATOM 2099 C ASN B 30 66.551 9.818 -0.718 1.00 0.00 C ATOM 2100 O ASN B 30 66.762 9.441 -1.852 1.00 0.00 O ATOM 2101 CB ASN B 30 65.491 12.076 -0.929 1.00 0.00 C ATOM 2102 CG ASN B 30 65.662 13.568 -0.638 1.00 0.00 C ATOM 2103 OD1 ASN B 30 66.516 13.950 0.271 1.00 0.00 O flip ATOM 2104 ND2 ASN B 30 65.015 14.394 -1.248 1.00 0.00 N flip ATOM 0 H ASN B 30 67.882 11.959 -1.982 1.00 0.00 H new ATOM 0 HA ASN B 30 66.697 11.444 0.724 1.00 0.00 H new ATOM 0 HB2 ASN B 30 65.420 11.911 -2.004 1.00 0.00 H new ATOM 0 HB3 ASN B 30 64.562 11.714 -0.489 1.00 0.00 H new ATOM 0 HD21 ASN B 30 64.347 14.095 -1.959 1.00 0.00 H new ATOM 0 HD22 ASN B 30 65.139 15.387 -1.050 1.00 0.00 H new ATOM 2111 N LYS B 31 66.224 8.971 0.221 1.00 0.00 N ATOM 2112 CA LYS B 31 66.106 7.517 -0.099 1.00 0.00 C ATOM 2113 C LYS B 31 65.294 7.354 -1.381 1.00 0.00 C ATOM 2114 O LYS B 31 65.394 6.371 -2.070 1.00 0.00 O ATOM 2115 CB LYS B 31 65.441 6.752 1.048 1.00 0.00 C ATOM 2116 CG LYS B 31 66.395 6.720 2.245 1.00 0.00 C ATOM 2117 CD LYS B 31 65.811 5.841 3.357 1.00 0.00 C ATOM 2118 CE LYS B 31 66.753 5.824 4.572 1.00 0.00 C ATOM 2119 NZ LYS B 31 67.455 7.133 4.694 1.00 0.00 N ATOM 0 H LYS B 31 66.034 9.220 1.192 1.00 0.00 H new ATOM 0 HA LYS B 31 67.105 7.104 -0.238 1.00 0.00 H new ATOM 0 HB2 LYS B 31 64.503 7.232 1.327 1.00 0.00 H new ATOM 0 HB3 LYS B 31 65.198 5.737 0.733 1.00 0.00 H new ATOM 0 HG2 LYS B 31 67.366 6.333 1.936 1.00 0.00 H new ATOM 0 HG3 LYS B 31 66.559 7.731 2.617 1.00 0.00 H new ATOM 0 HD2 LYS B 31 64.832 6.218 3.652 1.00 0.00 H new ATOM 0 HD3 LYS B 31 65.663 4.826 2.988 1.00 0.00 H new ATOM 0 HE2 LYS B 31 66.185 5.621 5.480 1.00 0.00 H new ATOM 0 HE3 LYS B 31 67.482 5.020 4.466 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 68.219 7.053 5.395 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 67.857 7.398 3.772 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 66.779 7.862 5.000 1.00 0.00 H new ATOM 2133 N SER B 32 64.517 8.330 -1.738 1.00 0.00 N ATOM 2134 CA SER B 32 63.752 8.215 -3.005 1.00 0.00 C ATOM 2135 C SER B 32 64.781 8.034 -4.102 1.00 0.00 C ATOM 2136 O SER B 32 64.621 7.241 -5.007 1.00 0.00 O ATOM 2137 CB SER B 32 62.954 9.481 -3.266 1.00 0.00 C ATOM 2138 OG SER B 32 62.016 9.676 -2.216 1.00 0.00 O ATOM 0 H SER B 32 64.378 9.195 -1.215 1.00 0.00 H new ATOM 0 HA SER B 32 63.049 7.383 -2.960 1.00 0.00 H new ATOM 0 HB2 SER B 32 63.624 10.338 -3.333 1.00 0.00 H new ATOM 0 HB3 SER B 32 62.435 9.406 -4.222 1.00 0.00 H new ATOM 0 HG SER B 32 61.503 10.494 -2.384 1.00 0.00 H new ATOM 2144 N GLU B 33 65.872 8.736 -3.987 1.00 0.00 N ATOM 2145 CA GLU B 33 66.952 8.570 -4.984 1.00 0.00 C ATOM 2146 C GLU B 33 67.405 7.134 -4.905 1.00 0.00 C ATOM 2147 O GLU B 33 67.884 6.578 -5.860 1.00 0.00 O ATOM 2148 CB GLU B 33 68.118 9.513 -4.676 1.00 0.00 C ATOM 2149 CG GLU B 33 67.697 10.956 -4.956 1.00 0.00 C ATOM 2150 CD GLU B 33 67.503 11.143 -6.461 1.00 0.00 C ATOM 2151 OE1 GLU B 33 68.429 10.847 -7.200 1.00 0.00 O ATOM 2152 OE2 GLU B 33 66.432 11.580 -6.852 1.00 0.00 O ATOM 0 H GLU B 33 66.058 9.414 -3.248 1.00 0.00 H new ATOM 0 HA GLU B 33 66.594 8.812 -5.985 1.00 0.00 H new ATOM 0 HB2 GLU B 33 68.419 9.407 -3.634 1.00 0.00 H new ATOM 0 HB3 GLU B 33 68.982 9.251 -5.286 1.00 0.00 H new ATOM 0 HG2 GLU B 33 66.772 11.186 -4.427 1.00 0.00 H new ATOM 0 HG3 GLU B 33 68.455 11.646 -4.587 1.00 0.00 H new ATOM 2159 N LEU B 34 67.232 6.496 -3.784 1.00 0.00 N ATOM 2160 CA LEU B 34 67.641 5.071 -3.742 1.00 0.00 C ATOM 2161 C LEU B 34 66.813 4.362 -4.797 1.00 0.00 C ATOM 2162 O LEU B 34 67.294 3.514 -5.498 1.00 0.00 O ATOM 2163 CB LEU B 34 67.393 4.422 -2.366 1.00 0.00 C ATOM 2164 CG LEU B 34 67.975 2.979 -2.341 1.00 0.00 C ATOM 2165 CD1 LEU B 34 69.409 3.003 -1.798 1.00 0.00 C ATOM 2166 CD2 LEU B 34 67.115 2.063 -1.445 1.00 0.00 C ATOM 0 H LEU B 34 66.840 6.882 -2.925 1.00 0.00 H new ATOM 0 HA LEU B 34 68.712 4.992 -3.926 1.00 0.00 H new ATOM 0 HB2 LEU B 34 67.856 5.023 -1.583 1.00 0.00 H new ATOM 0 HB3 LEU B 34 66.324 4.395 -2.156 1.00 0.00 H new ATOM 0 HG LEU B 34 67.971 2.592 -3.360 1.00 0.00 H new ATOM 0 HD11 LEU B 34 69.810 1.989 -1.784 1.00 0.00 H new ATOM 0 HD12 LEU B 34 70.030 3.630 -2.438 1.00 0.00 H new ATOM 0 HD13 LEU B 34 69.408 3.407 -0.786 1.00 0.00 H new ATOM 0 HD21 LEU B 34 67.538 1.058 -1.440 1.00 0.00 H new ATOM 0 HD22 LEU B 34 67.102 2.456 -0.429 1.00 0.00 H new ATOM 0 HD23 LEU B 34 66.097 2.027 -1.833 1.00 0.00 H new ATOM 2178 N LYS B 35 65.565 4.708 -4.927 1.00 0.00 N ATOM 2179 CA LYS B 35 64.750 4.034 -5.961 1.00 0.00 C ATOM 2180 C LYS B 35 65.196 4.493 -7.345 1.00 0.00 C ATOM 2181 O LYS B 35 65.472 3.696 -8.217 1.00 0.00 O ATOM 2182 CB LYS B 35 63.275 4.378 -5.755 1.00 0.00 C ATOM 2183 CG LYS B 35 62.416 3.654 -6.793 1.00 0.00 C ATOM 2184 CD LYS B 35 60.943 3.989 -6.550 1.00 0.00 C ATOM 2185 CE LYS B 35 60.065 3.224 -7.544 1.00 0.00 C ATOM 2186 NZ LYS B 35 60.050 3.943 -8.850 1.00 0.00 N ATOM 0 H LYS B 35 65.084 5.416 -4.371 1.00 0.00 H new ATOM 0 HA LYS B 35 64.883 2.955 -5.880 1.00 0.00 H new ATOM 0 HB2 LYS B 35 62.964 4.092 -4.750 1.00 0.00 H new ATOM 0 HB3 LYS B 35 63.130 5.455 -5.839 1.00 0.00 H new ATOM 0 HG2 LYS B 35 62.709 3.956 -7.799 1.00 0.00 H new ATOM 0 HG3 LYS B 35 62.572 2.577 -6.725 1.00 0.00 H new ATOM 0 HD2 LYS B 35 60.665 3.727 -5.529 1.00 0.00 H new ATOM 0 HD3 LYS B 35 60.782 5.061 -6.659 1.00 0.00 H new ATOM 0 HE2 LYS B 35 60.446 2.212 -7.678 1.00 0.00 H new ATOM 0 HE3 LYS B 35 59.051 3.133 -7.155 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 59.454 3.424 -9.525 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 59.667 4.900 -8.715 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 61.019 4.007 -9.222 1.00 0.00 H new ATOM 2200 N GLU B 36 65.249 5.773 -7.562 1.00 0.00 N ATOM 2201 CA GLU B 36 65.653 6.279 -8.901 1.00 0.00 C ATOM 2202 C GLU B 36 67.133 6.018 -9.161 1.00 0.00 C ATOM 2203 O GLU B 36 67.525 5.688 -10.259 1.00 0.00 O ATOM 2204 CB GLU B 36 65.375 7.786 -8.975 1.00 0.00 C ATOM 2205 CG GLU B 36 65.768 8.330 -10.353 1.00 0.00 C ATOM 2206 CD GLU B 36 64.841 7.738 -11.418 1.00 0.00 C ATOM 2207 OE1 GLU B 36 63.819 7.188 -11.044 1.00 0.00 O ATOM 2208 OE2 GLU B 36 65.166 7.853 -12.587 1.00 0.00 O ATOM 0 H GLU B 36 65.031 6.492 -6.872 1.00 0.00 H new ATOM 0 HA GLU B 36 65.075 5.754 -9.662 1.00 0.00 H new ATOM 0 HB2 GLU B 36 64.318 7.978 -8.788 1.00 0.00 H new ATOM 0 HB3 GLU B 36 65.936 8.305 -8.198 1.00 0.00 H new ATOM 0 HG2 GLU B 36 65.699 9.418 -10.360 1.00 0.00 H new ATOM 0 HG3 GLU B 36 66.804 8.075 -10.575 1.00 0.00 H new ATOM 2215 N LEU B 37 67.965 6.189 -8.185 1.00 0.00 N ATOM 2216 CA LEU B 37 69.412 5.982 -8.418 1.00 0.00 C ATOM 2217 C LEU B 37 69.682 4.501 -8.641 1.00 0.00 C ATOM 2218 O LEU B 37 70.581 4.130 -9.368 1.00 0.00 O ATOM 2219 CB LEU B 37 70.190 6.493 -7.195 1.00 0.00 C ATOM 2220 CG LEU B 37 71.689 6.661 -7.526 1.00 0.00 C ATOM 2221 CD1 LEU B 37 72.335 7.556 -6.459 1.00 0.00 C ATOM 2222 CD2 LEU B 37 72.414 5.290 -7.584 1.00 0.00 C ATOM 0 H LEU B 37 67.708 6.463 -7.237 1.00 0.00 H new ATOM 0 HA LEU B 37 69.734 6.531 -9.303 1.00 0.00 H new ATOM 0 HB2 LEU B 37 69.776 7.447 -6.869 1.00 0.00 H new ATOM 0 HB3 LEU B 37 70.073 5.795 -6.366 1.00 0.00 H new ATOM 0 HG LEU B 37 71.782 7.122 -8.509 1.00 0.00 H new ATOM 0 HD11 LEU B 37 73.394 7.682 -6.682 1.00 0.00 H new ATOM 0 HD12 LEU B 37 71.846 8.530 -6.457 1.00 0.00 H new ATOM 0 HD13 LEU B 37 72.224 7.092 -5.479 1.00 0.00 H new ATOM 0 HD21 LEU B 37 73.467 5.445 -7.819 1.00 0.00 H new ATOM 0 HD22 LEU B 37 72.327 4.791 -6.619 1.00 0.00 H new ATOM 0 HD23 LEU B 37 71.958 4.669 -8.355 1.00 0.00 H new ATOM 2234 N LEU B 38 68.931 3.642 -8.015 1.00 0.00 N ATOM 2235 CA LEU B 38 69.211 2.179 -8.209 1.00 0.00 C ATOM 2236 C LEU B 38 68.757 1.719 -9.592 1.00 0.00 C ATOM 2237 O LEU B 38 69.424 0.941 -10.237 1.00 0.00 O ATOM 2238 CB LEU B 38 68.505 1.344 -7.127 1.00 0.00 C ATOM 2239 CG LEU B 38 69.374 1.235 -5.845 1.00 0.00 C ATOM 2240 CD1 LEU B 38 70.388 0.083 -6.001 1.00 0.00 C ATOM 2241 CD2 LEU B 38 70.136 2.548 -5.545 1.00 0.00 C ATOM 0 H LEU B 38 68.156 3.871 -7.393 1.00 0.00 H new ATOM 0 HA LEU B 38 70.288 2.031 -8.125 1.00 0.00 H new ATOM 0 HB2 LEU B 38 67.545 1.799 -6.881 1.00 0.00 H new ATOM 0 HB3 LEU B 38 68.295 0.346 -7.513 1.00 0.00 H new ATOM 0 HG LEU B 38 68.702 1.039 -5.010 1.00 0.00 H new ATOM 0 HD11 LEU B 38 70.996 0.009 -5.100 1.00 0.00 H new ATOM 0 HD12 LEU B 38 69.853 -0.854 -6.156 1.00 0.00 H new ATOM 0 HD13 LEU B 38 71.032 0.279 -6.858 1.00 0.00 H new ATOM 0 HD21 LEU B 38 70.730 2.425 -4.640 1.00 0.00 H new ATOM 0 HD22 LEU B 38 70.793 2.786 -6.381 1.00 0.00 H new ATOM 0 HD23 LEU B 38 69.422 3.359 -5.403 1.00 0.00 H new ATOM 2253 N THR B 39 67.631 2.164 -10.050 1.00 0.00 N ATOM 2254 CA THR B 39 67.163 1.710 -11.388 1.00 0.00 C ATOM 2255 C THR B 39 67.995 2.359 -12.470 1.00 0.00 C ATOM 2256 O THR B 39 68.176 1.821 -13.544 1.00 0.00 O ATOM 2257 CB THR B 39 65.711 2.107 -11.577 1.00 0.00 C ATOM 2258 OG1 THR B 39 65.590 3.523 -11.521 1.00 0.00 O ATOM 2259 CG2 THR B 39 64.906 1.477 -10.463 1.00 0.00 C ATOM 0 H THR B 39 67.015 2.817 -9.565 1.00 0.00 H new ATOM 0 HA THR B 39 67.263 0.626 -11.452 1.00 0.00 H new ATOM 0 HB THR B 39 65.346 1.766 -12.546 1.00 0.00 H new ATOM 0 HG1 THR B 39 65.519 3.809 -10.586 1.00 0.00 H new ATOM 0 HG21 THR B 39 63.856 1.747 -10.575 1.00 0.00 H new ATOM 0 HG22 THR B 39 65.009 0.393 -10.508 1.00 0.00 H new ATOM 0 HG23 THR B 39 65.272 1.836 -9.501 1.00 0.00 H new ATOM 2267 N ARG B 40 68.494 3.519 -12.201 1.00 0.00 N ATOM 2268 CA ARG B 40 69.303 4.214 -13.216 1.00 0.00 C ATOM 2269 C ARG B 40 70.645 3.502 -13.370 1.00 0.00 C ATOM 2270 O ARG B 40 71.228 3.485 -14.436 1.00 0.00 O ATOM 2271 CB ARG B 40 69.533 5.668 -12.793 1.00 0.00 C ATOM 2272 CG ARG B 40 68.224 6.474 -12.885 1.00 0.00 C ATOM 2273 CD ARG B 40 67.959 6.924 -14.328 1.00 0.00 C ATOM 2274 NE ARG B 40 66.829 7.896 -14.339 1.00 0.00 N ATOM 2275 CZ ARG B 40 66.634 8.663 -15.377 1.00 0.00 C ATOM 2276 NH1 ARG B 40 67.417 8.568 -16.415 1.00 0.00 N ATOM 2277 NH2 ARG B 40 65.657 9.528 -15.374 1.00 0.00 N ATOM 0 H ARG B 40 68.376 4.017 -11.319 1.00 0.00 H new ATOM 0 HA ARG B 40 68.774 4.202 -14.169 1.00 0.00 H new ATOM 0 HB2 ARG B 40 69.914 5.699 -11.772 1.00 0.00 H new ATOM 0 HB3 ARG B 40 70.291 6.122 -13.431 1.00 0.00 H new ATOM 0 HG2 ARG B 40 67.392 5.866 -12.531 1.00 0.00 H new ATOM 0 HG3 ARG B 40 68.282 7.345 -12.233 1.00 0.00 H new ATOM 0 HD2 ARG B 40 68.854 7.383 -14.748 1.00 0.00 H new ATOM 0 HD3 ARG B 40 67.720 6.063 -14.952 1.00 0.00 H new ATOM 0 HE ARG B 40 66.207 7.962 -13.534 1.00 0.00 H new ATOM 0 HH11 ARG B 40 68.183 7.894 -16.416 1.00 0.00 H new ATOM 0 HH12 ARG B 40 67.264 9.168 -17.226 1.00 0.00 H new ATOM 0 HH21 ARG B 40 65.046 9.605 -14.561 1.00 0.00 H new ATOM 0 HH22 ARG B 40 65.504 10.128 -16.185 1.00 0.00 H new ATOM 2291 N GLU B 41 71.151 2.928 -12.301 1.00 0.00 N ATOM 2292 CA GLU B 41 72.477 2.227 -12.370 1.00 0.00 C ATOM 2293 C GLU B 41 72.295 0.732 -12.230 1.00 0.00 C ATOM 2294 O GLU B 41 73.143 -0.036 -12.641 1.00 0.00 O ATOM 2295 CB GLU B 41 73.376 2.732 -11.235 1.00 0.00 C ATOM 2296 CG GLU B 41 73.915 4.117 -11.581 1.00 0.00 C ATOM 2297 CD GLU B 41 74.767 4.627 -10.419 1.00 0.00 C ATOM 2298 OE1 GLU B 41 74.668 4.057 -9.344 1.00 0.00 O ATOM 2299 OE2 GLU B 41 75.497 5.579 -10.620 1.00 0.00 O ATOM 0 H GLU B 41 70.704 2.915 -11.384 1.00 0.00 H new ATOM 0 HA GLU B 41 72.936 2.438 -13.336 1.00 0.00 H new ATOM 0 HB2 GLU B 41 72.812 2.773 -10.303 1.00 0.00 H new ATOM 0 HB3 GLU B 41 74.202 2.039 -11.077 1.00 0.00 H new ATOM 0 HG2 GLU B 41 74.511 4.072 -12.493 1.00 0.00 H new ATOM 0 HG3 GLU B 41 73.091 4.804 -11.773 1.00 0.00 H new ATOM 2306 N LEU B 42 71.217 0.302 -11.644 1.00 0.00 N ATOM 2307 CA LEU B 42 71.009 -1.168 -11.471 1.00 0.00 C ATOM 2308 C LEU B 42 69.528 -1.518 -11.697 1.00 0.00 C ATOM 2309 O LEU B 42 68.778 -1.650 -10.752 1.00 0.00 O ATOM 2310 CB LEU B 42 71.407 -1.580 -10.043 1.00 0.00 C ATOM 2311 CG LEU B 42 72.923 -1.405 -9.816 1.00 0.00 C ATOM 2312 CD1 LEU B 42 73.222 -1.495 -8.318 1.00 0.00 C ATOM 2313 CD2 LEU B 42 73.708 -2.503 -10.557 1.00 0.00 C ATOM 0 H LEU B 42 70.473 0.896 -11.278 1.00 0.00 H new ATOM 0 HA LEU B 42 71.625 -1.700 -12.196 1.00 0.00 H new ATOM 0 HB2 LEU B 42 70.856 -0.978 -9.321 1.00 0.00 H new ATOM 0 HB3 LEU B 42 71.128 -2.619 -9.870 1.00 0.00 H new ATOM 0 HG LEU B 42 73.228 -0.432 -10.201 1.00 0.00 H new ATOM 0 HD11 LEU B 42 74.292 -1.372 -8.153 1.00 0.00 H new ATOM 0 HD12 LEU B 42 72.681 -0.709 -7.791 1.00 0.00 H new ATOM 0 HD13 LEU B 42 72.906 -2.468 -7.942 1.00 0.00 H new ATOM 0 HD21 LEU B 42 74.776 -2.365 -10.386 1.00 0.00 H new ATOM 0 HD22 LEU B 42 73.405 -3.481 -10.185 1.00 0.00 H new ATOM 0 HD23 LEU B 42 73.500 -2.441 -11.625 1.00 0.00 H new ATOM 2325 N PRO B 43 69.095 -1.662 -12.930 1.00 0.00 N ATOM 2326 CA PRO B 43 67.668 -1.996 -13.206 1.00 0.00 C ATOM 2327 C PRO B 43 67.336 -3.478 -12.946 1.00 0.00 C ATOM 2328 O PRO B 43 66.866 -3.842 -11.885 1.00 0.00 O ATOM 2329 CB PRO B 43 67.538 -1.638 -14.701 1.00 0.00 C ATOM 2330 CG PRO B 43 68.960 -1.491 -15.289 1.00 0.00 C ATOM 2331 CD PRO B 43 69.972 -1.499 -14.124 1.00 0.00 C ATOM 0 HA PRO B 43 66.974 -1.462 -12.557 1.00 0.00 H new ATOM 0 HB2 PRO B 43 66.986 -2.414 -15.231 1.00 0.00 H new ATOM 0 HB3 PRO B 43 66.979 -0.710 -14.822 1.00 0.00 H new ATOM 0 HG2 PRO B 43 69.171 -2.307 -15.980 1.00 0.00 H new ATOM 0 HG3 PRO B 43 69.042 -0.564 -15.856 1.00 0.00 H new ATOM 0 HD2 PRO B 43 70.688 -2.316 -14.215 1.00 0.00 H new ATOM 0 HD3 PRO B 43 70.547 -0.574 -14.081 1.00 0.00 H new ATOM 2339 N SER B 44 67.558 -4.326 -13.914 1.00 0.00 N ATOM 2340 CA SER B 44 67.238 -5.773 -13.738 1.00 0.00 C ATOM 2341 C SER B 44 68.195 -6.411 -12.728 1.00 0.00 C ATOM 2342 O SER B 44 67.829 -7.307 -12.002 1.00 0.00 O ATOM 2343 CB SER B 44 67.376 -6.484 -15.084 1.00 0.00 C ATOM 2344 OG SER B 44 68.754 -6.599 -15.415 1.00 0.00 O ATOM 0 H SER B 44 67.949 -4.078 -14.823 1.00 0.00 H new ATOM 0 HA SER B 44 66.218 -5.869 -13.366 1.00 0.00 H new ATOM 0 HB2 SER B 44 66.918 -7.472 -15.035 1.00 0.00 H new ATOM 0 HB3 SER B 44 66.849 -5.927 -15.859 1.00 0.00 H new ATOM 0 HG SER B 44 68.846 -7.056 -16.277 1.00 0.00 H new ATOM 2350 N PHE B 45 69.417 -5.964 -12.688 1.00 0.00 N ATOM 2351 CA PHE B 45 70.411 -6.550 -11.737 1.00 0.00 C ATOM 2352 C PHE B 45 69.805 -6.674 -10.336 1.00 0.00 C ATOM 2353 O PHE B 45 70.359 -7.312 -9.464 1.00 0.00 O ATOM 2354 CB PHE B 45 71.614 -5.617 -11.658 1.00 0.00 C ATOM 2355 CG PHE B 45 72.734 -6.298 -10.907 1.00 0.00 C ATOM 2356 CD1 PHE B 45 72.799 -6.214 -9.511 1.00 0.00 C ATOM 2357 CD2 PHE B 45 73.709 -7.013 -11.611 1.00 0.00 C ATOM 2358 CE1 PHE B 45 73.840 -6.848 -8.820 1.00 0.00 C ATOM 2359 CE2 PHE B 45 74.750 -7.646 -10.922 1.00 0.00 C ATOM 2360 CZ PHE B 45 74.815 -7.564 -9.526 1.00 0.00 C ATOM 0 H PHE B 45 69.777 -5.212 -13.276 1.00 0.00 H new ATOM 0 HA PHE B 45 70.702 -7.539 -12.091 1.00 0.00 H new ATOM 0 HB2 PHE B 45 71.946 -5.349 -12.661 1.00 0.00 H new ATOM 0 HB3 PHE B 45 71.336 -4.690 -11.156 1.00 0.00 H new ATOM 0 HD1 PHE B 45 72.047 -5.661 -8.967 1.00 0.00 H new ATOM 0 HD2 PHE B 45 73.658 -7.077 -12.688 1.00 0.00 H new ATOM 0 HE1 PHE B 45 73.891 -6.785 -7.743 1.00 0.00 H new ATOM 0 HE2 PHE B 45 75.502 -8.197 -11.467 1.00 0.00 H new ATOM 0 HZ PHE B 45 75.617 -8.053 -8.993 1.00 0.00 H new ATOM 2370 N LEU B 46 68.675 -6.061 -10.118 1.00 0.00 N ATOM 2371 CA LEU B 46 68.009 -6.118 -8.772 1.00 0.00 C ATOM 2372 C LEU B 46 66.565 -6.536 -8.980 1.00 0.00 C ATOM 2373 O LEU B 46 66.054 -7.428 -8.332 1.00 0.00 O ATOM 2374 CB LEU B 46 68.034 -4.732 -8.125 1.00 0.00 C ATOM 2375 CG LEU B 46 69.477 -4.236 -7.996 1.00 0.00 C ATOM 2376 CD1 LEU B 46 69.460 -2.745 -7.657 1.00 0.00 C ATOM 2377 CD2 LEU B 46 70.205 -4.992 -6.877 1.00 0.00 C ATOM 0 H LEU B 46 68.174 -5.515 -10.819 1.00 0.00 H new ATOM 0 HA LEU B 46 68.530 -6.825 -8.127 1.00 0.00 H new ATOM 0 HB2 LEU B 46 67.453 -4.032 -8.725 1.00 0.00 H new ATOM 0 HB3 LEU B 46 67.566 -4.773 -7.141 1.00 0.00 H new ATOM 0 HG LEU B 46 69.998 -4.408 -8.938 1.00 0.00 H new ATOM 0 HD11 LEU B 46 70.483 -2.382 -7.563 1.00 0.00 H new ATOM 0 HD12 LEU B 46 68.952 -2.197 -8.451 1.00 0.00 H new ATOM 0 HD13 LEU B 46 68.933 -2.592 -6.715 1.00 0.00 H new ATOM 0 HD21 LEU B 46 71.229 -4.628 -6.798 1.00 0.00 H new ATOM 0 HD22 LEU B 46 69.688 -4.829 -5.931 1.00 0.00 H new ATOM 0 HD23 LEU B 46 70.216 -6.058 -7.105 1.00 0.00 H new ATOM 2389 N GLY B 47 65.925 -5.919 -9.925 1.00 0.00 N ATOM 2390 CA GLY B 47 64.524 -6.285 -10.250 1.00 0.00 C ATOM 2391 C GLY B 47 64.615 -7.489 -11.165 1.00 0.00 C ATOM 2392 O GLY B 47 63.718 -7.800 -11.924 1.00 0.00 O ATOM 0 H GLY B 47 66.316 -5.168 -10.493 1.00 0.00 H new ATOM 0 HA2 GLY B 47 63.962 -6.522 -9.347 1.00 0.00 H new ATOM 0 HA3 GLY B 47 64.007 -5.460 -10.740 1.00 0.00 H new ATOM 2396 N LYS B 48 65.740 -8.143 -11.104 1.00 0.00 N ATOM 2397 CA LYS B 48 65.994 -9.315 -11.963 1.00 0.00 C ATOM 2398 C LYS B 48 64.761 -10.228 -11.983 1.00 0.00 C ATOM 2399 O LYS B 48 64.621 -11.072 -12.842 1.00 0.00 O ATOM 2400 CB LYS B 48 67.186 -10.089 -11.391 1.00 0.00 C ATOM 2401 CG LYS B 48 67.762 -11.018 -12.453 1.00 0.00 C ATOM 2402 CD LYS B 48 69.062 -11.611 -11.922 1.00 0.00 C ATOM 2403 CE LYS B 48 69.658 -12.566 -12.959 1.00 0.00 C ATOM 2404 NZ LYS B 48 69.955 -11.826 -14.218 1.00 0.00 N ATOM 0 H LYS B 48 66.508 -7.903 -10.477 1.00 0.00 H new ATOM 0 HA LYS B 48 66.207 -8.985 -12.980 1.00 0.00 H new ATOM 0 HB2 LYS B 48 67.953 -9.393 -11.050 1.00 0.00 H new ATOM 0 HB3 LYS B 48 66.872 -10.667 -10.522 1.00 0.00 H new ATOM 0 HG2 LYS B 48 67.052 -11.811 -12.688 1.00 0.00 H new ATOM 0 HG3 LYS B 48 67.945 -10.470 -13.377 1.00 0.00 H new ATOM 0 HD2 LYS B 48 69.771 -10.814 -11.698 1.00 0.00 H new ATOM 0 HD3 LYS B 48 68.875 -12.143 -10.989 1.00 0.00 H new ATOM 0 HE2 LYS B 48 70.570 -13.018 -12.569 1.00 0.00 H new ATOM 0 HE3 LYS B 48 68.961 -13.379 -13.161 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 70.621 -12.377 -14.796 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 69.074 -11.679 -14.751 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 70.377 -10.904 -13.987 1.00 0.00 H new ATOM 2418 N ARG B 49 63.884 -10.059 -11.026 1.00 0.00 N ATOM 2419 CA ARG B 49 62.648 -10.899 -10.940 1.00 0.00 C ATOM 2420 C ARG B 49 63.000 -12.258 -10.322 1.00 0.00 C ATOM 2421 O ARG B 49 62.145 -13.099 -10.124 1.00 0.00 O ATOM 2422 CB ARG B 49 62.034 -11.095 -12.340 1.00 0.00 C ATOM 2423 CG ARG B 49 60.535 -11.395 -12.217 1.00 0.00 C ATOM 2424 CD ARG B 49 59.936 -11.564 -13.614 1.00 0.00 C ATOM 2425 NE ARG B 49 60.621 -12.693 -14.307 1.00 0.00 N ATOM 2426 CZ ARG B 49 60.117 -13.192 -15.403 1.00 0.00 C ATOM 2427 NH1 ARG B 49 59.014 -12.701 -15.897 1.00 0.00 N ATOM 2428 NH2 ARG B 49 60.718 -14.182 -16.004 1.00 0.00 N ATOM 0 H ARG B 49 63.973 -9.362 -10.287 1.00 0.00 H new ATOM 0 HA ARG B 49 61.914 -10.394 -10.311 1.00 0.00 H new ATOM 0 HB2 ARG B 49 62.186 -10.199 -12.942 1.00 0.00 H new ATOM 0 HB3 ARG B 49 62.536 -11.914 -12.855 1.00 0.00 H new ATOM 0 HG2 ARG B 49 60.381 -12.301 -11.631 1.00 0.00 H new ATOM 0 HG3 ARG B 49 60.032 -10.584 -11.689 1.00 0.00 H new ATOM 0 HD2 ARG B 49 58.866 -11.760 -13.543 1.00 0.00 H new ATOM 0 HD3 ARG B 49 60.054 -10.644 -14.187 1.00 0.00 H new ATOM 0 HE ARG B 49 61.485 -13.076 -13.924 1.00 0.00 H new ATOM 0 HH11 ARG B 49 58.545 -11.927 -15.427 1.00 0.00 H new ATOM 0 HH12 ARG B 49 58.621 -13.091 -16.753 1.00 0.00 H new ATOM 0 HH21 ARG B 49 61.581 -14.565 -15.617 1.00 0.00 H new ATOM 0 HH22 ARG B 49 60.325 -14.573 -16.860 1.00 0.00 H new ATOM 2442 N THR B 50 64.252 -12.474 -9.997 1.00 0.00 N ATOM 2443 CA THR B 50 64.660 -13.771 -9.371 1.00 0.00 C ATOM 2444 C THR B 50 64.728 -13.598 -7.852 1.00 0.00 C ATOM 2445 O THR B 50 64.660 -14.553 -7.104 1.00 0.00 O ATOM 2446 CB THR B 50 66.042 -14.186 -9.890 1.00 0.00 C ATOM 2447 OG1 THR B 50 66.986 -13.170 -9.580 1.00 0.00 O ATOM 2448 CG2 THR B 50 65.992 -14.396 -11.406 1.00 0.00 C ATOM 0 H THR B 50 65.010 -11.807 -10.139 1.00 0.00 H new ATOM 0 HA THR B 50 63.930 -14.539 -9.627 1.00 0.00 H new ATOM 0 HB THR B 50 66.339 -15.120 -9.413 1.00 0.00 H new ATOM 0 HG1 THR B 50 67.891 -13.545 -9.609 1.00 0.00 H new ATOM 0 HG21 THR B 50 66.978 -14.690 -11.765 1.00 0.00 H new ATOM 0 HG22 THR B 50 65.271 -15.179 -11.641 1.00 0.00 H new ATOM 0 HG23 THR B 50 65.691 -13.468 -11.892 1.00 0.00 H new ATOM 2456 N ASP B 51 64.865 -12.382 -7.392 1.00 0.00 N ATOM 2457 CA ASP B 51 64.939 -12.138 -5.919 1.00 0.00 C ATOM 2458 C ASP B 51 64.383 -10.746 -5.610 1.00 0.00 C ATOM 2459 O ASP B 51 65.043 -9.918 -5.014 1.00 0.00 O ATOM 2460 CB ASP B 51 66.399 -12.215 -5.468 1.00 0.00 C ATOM 2461 CG ASP B 51 66.464 -12.215 -3.939 1.00 0.00 C ATOM 2462 OD1 ASP B 51 65.486 -11.827 -3.323 1.00 0.00 O ATOM 2463 OD2 ASP B 51 67.493 -12.606 -3.411 1.00 0.00 O ATOM 0 H ASP B 51 64.929 -11.546 -7.973 1.00 0.00 H new ATOM 0 HA ASP B 51 64.354 -12.890 -5.391 1.00 0.00 H new ATOM 0 HB2 ASP B 51 66.865 -13.118 -5.862 1.00 0.00 H new ATOM 0 HB3 ASP B 51 66.958 -11.368 -5.866 1.00 0.00 H new ATOM 2468 N GLU B 52 63.171 -10.485 -6.015 1.00 0.00 N ATOM 2469 CA GLU B 52 62.561 -9.148 -5.757 1.00 0.00 C ATOM 2470 C GLU B 52 62.264 -8.978 -4.267 1.00 0.00 C ATOM 2471 O GLU B 52 62.183 -7.875 -3.764 1.00 0.00 O ATOM 2472 CB GLU B 52 61.252 -9.034 -6.543 1.00 0.00 C ATOM 2473 CG GLU B 52 60.212 -10.025 -5.984 1.00 0.00 C ATOM 2474 CD GLU B 52 59.468 -9.394 -4.802 1.00 0.00 C ATOM 2475 OE1 GLU B 52 58.998 -8.277 -4.951 1.00 0.00 O ATOM 2476 OE2 GLU B 52 59.382 -10.037 -3.769 1.00 0.00 O ATOM 0 H GLU B 52 62.573 -11.142 -6.516 1.00 0.00 H new ATOM 0 HA GLU B 52 63.260 -8.373 -6.072 1.00 0.00 H new ATOM 0 HB2 GLU B 52 60.867 -8.016 -6.479 1.00 0.00 H new ATOM 0 HB3 GLU B 52 61.433 -9.241 -7.598 1.00 0.00 H new ATOM 0 HG2 GLU B 52 59.503 -10.300 -6.765 1.00 0.00 H new ATOM 0 HG3 GLU B 52 60.707 -10.942 -5.665 1.00 0.00 H new ATOM 2483 N ALA B 53 62.075 -10.055 -3.563 1.00 0.00 N ATOM 2484 CA ALA B 53 61.752 -9.945 -2.111 1.00 0.00 C ATOM 2485 C ALA B 53 62.884 -9.224 -1.373 1.00 0.00 C ATOM 2486 O ALA B 53 62.648 -8.311 -0.610 1.00 0.00 O ATOM 2487 CB ALA B 53 61.573 -11.345 -1.522 1.00 0.00 C ATOM 0 H ALA B 53 62.129 -11.007 -3.926 1.00 0.00 H new ATOM 0 HA ALA B 53 60.830 -9.375 -1.994 1.00 0.00 H new ATOM 0 HB1 ALA B 53 61.337 -11.266 -0.461 1.00 0.00 H new ATOM 0 HB2 ALA B 53 60.760 -11.855 -2.038 1.00 0.00 H new ATOM 0 HB3 ALA B 53 62.495 -11.913 -1.647 1.00 0.00 H new ATOM 2493 N ALA B 54 64.107 -9.614 -1.589 1.00 0.00 N ATOM 2494 CA ALA B 54 65.232 -8.929 -0.889 1.00 0.00 C ATOM 2495 C ALA B 54 65.241 -7.450 -1.265 1.00 0.00 C ATOM 2496 O ALA B 54 65.349 -6.582 -0.423 1.00 0.00 O ATOM 2497 CB ALA B 54 66.549 -9.565 -1.312 1.00 0.00 C ATOM 0 H ALA B 54 64.378 -10.372 -2.215 1.00 0.00 H new ATOM 0 HA ALA B 54 65.105 -9.029 0.189 1.00 0.00 H new ATOM 0 HB1 ALA B 54 67.374 -9.067 -0.802 1.00 0.00 H new ATOM 0 HB2 ALA B 54 66.544 -10.622 -1.047 1.00 0.00 H new ATOM 0 HB3 ALA B 54 66.673 -9.462 -2.390 1.00 0.00 H new ATOM 2503 N PHE B 55 65.112 -7.155 -2.525 1.00 0.00 N ATOM 2504 CA PHE B 55 65.095 -5.733 -2.957 1.00 0.00 C ATOM 2505 C PHE B 55 63.929 -5.039 -2.279 1.00 0.00 C ATOM 2506 O PHE B 55 64.024 -3.914 -1.829 1.00 0.00 O ATOM 2507 CB PHE B 55 64.882 -5.681 -4.462 1.00 0.00 C ATOM 2508 CG PHE B 55 64.809 -4.243 -4.922 1.00 0.00 C ATOM 2509 CD1 PHE B 55 65.983 -3.523 -5.170 1.00 0.00 C ATOM 2510 CD2 PHE B 55 63.562 -3.629 -5.095 1.00 0.00 C ATOM 2511 CE1 PHE B 55 65.911 -2.190 -5.593 1.00 0.00 C ATOM 2512 CE2 PHE B 55 63.490 -2.296 -5.516 1.00 0.00 C ATOM 2513 CZ PHE B 55 64.664 -1.576 -5.765 1.00 0.00 C ATOM 0 H PHE B 55 65.017 -7.838 -3.276 1.00 0.00 H new ATOM 0 HA PHE B 55 66.034 -5.246 -2.693 1.00 0.00 H new ATOM 0 HB2 PHE B 55 65.698 -6.194 -4.971 1.00 0.00 H new ATOM 0 HB3 PHE B 55 63.963 -6.204 -4.726 1.00 0.00 H new ATOM 0 HD1 PHE B 55 66.945 -3.995 -5.035 1.00 0.00 H new ATOM 0 HD2 PHE B 55 62.656 -4.184 -4.903 1.00 0.00 H new ATOM 0 HE1 PHE B 55 66.817 -1.635 -5.787 1.00 0.00 H new ATOM 0 HE2 PHE B 55 62.528 -1.823 -5.649 1.00 0.00 H new ATOM 0 HZ PHE B 55 64.608 -0.547 -6.090 1.00 0.00 H new ATOM 2523 N GLN B 56 62.829 -5.720 -2.196 1.00 0.00 N ATOM 2524 CA GLN B 56 61.639 -5.132 -1.539 1.00 0.00 C ATOM 2525 C GLN B 56 62.001 -4.819 -0.098 1.00 0.00 C ATOM 2526 O GLN B 56 61.564 -3.843 0.466 1.00 0.00 O ATOM 2527 CB GLN B 56 60.474 -6.126 -1.600 1.00 0.00 C ATOM 2528 CG GLN B 56 59.241 -5.525 -0.924 1.00 0.00 C ATOM 2529 CD GLN B 56 58.069 -6.500 -1.054 1.00 0.00 C ATOM 2530 OE1 GLN B 56 58.153 -7.476 -1.775 1.00 0.00 O ATOM 2531 NE2 GLN B 56 56.965 -6.268 -0.398 1.00 0.00 N ATOM 0 H GLN B 56 62.702 -6.665 -2.557 1.00 0.00 H new ATOM 0 HA GLN B 56 61.332 -4.217 -2.046 1.00 0.00 H new ATOM 0 HB2 GLN B 56 60.247 -6.371 -2.638 1.00 0.00 H new ATOM 0 HB3 GLN B 56 60.753 -7.057 -1.106 1.00 0.00 H new ATOM 0 HG2 GLN B 56 59.449 -5.326 0.127 1.00 0.00 H new ATOM 0 HG3 GLN B 56 58.988 -4.570 -1.385 1.00 0.00 H new ATOM 0 HE21 GLN B 56 56.894 -5.450 0.207 1.00 0.00 H new ATOM 0 HE22 GLN B 56 56.174 -6.905 -0.490 1.00 0.00 H new ATOM 2540 N LYS B 57 62.820 -5.636 0.493 1.00 0.00 N ATOM 2541 CA LYS B 57 63.241 -5.368 1.900 1.00 0.00 C ATOM 2542 C LYS B 57 64.150 -4.157 1.879 1.00 0.00 C ATOM 2543 O LYS B 57 64.072 -3.280 2.717 1.00 0.00 O ATOM 2544 CB LYS B 57 63.987 -6.575 2.496 1.00 0.00 C ATOM 2545 CG LYS B 57 63.026 -7.762 2.658 1.00 0.00 C ATOM 2546 CD LYS B 57 63.579 -8.770 3.679 1.00 0.00 C ATOM 2547 CE LYS B 57 64.785 -9.509 3.090 1.00 0.00 C ATOM 2548 NZ LYS B 57 65.282 -10.511 4.076 1.00 0.00 N ATOM 0 H LYS B 57 63.217 -6.475 0.070 1.00 0.00 H new ATOM 0 HA LYS B 57 62.364 -5.189 2.522 1.00 0.00 H new ATOM 0 HB2 LYS B 57 64.817 -6.855 1.848 1.00 0.00 H new ATOM 0 HB3 LYS B 57 64.413 -6.308 3.463 1.00 0.00 H new ATOM 0 HG2 LYS B 57 62.049 -7.404 2.984 1.00 0.00 H new ATOM 0 HG3 LYS B 57 62.881 -8.253 1.696 1.00 0.00 H new ATOM 0 HD2 LYS B 57 63.871 -8.251 4.592 1.00 0.00 H new ATOM 0 HD3 LYS B 57 62.803 -9.485 3.953 1.00 0.00 H new ATOM 0 HE2 LYS B 57 64.503 -10.005 2.161 1.00 0.00 H new ATOM 0 HE3 LYS B 57 65.576 -8.800 2.845 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 66.101 -11.014 3.678 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 65.566 -10.026 4.951 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 64.527 -11.194 4.288 1.00 0.00 H new ATOM 2562 N LEU B 58 64.989 -4.090 0.893 1.00 0.00 N ATOM 2563 CA LEU B 58 65.887 -2.923 0.770 1.00 0.00 C ATOM 2564 C LEU B 58 65.004 -1.729 0.460 1.00 0.00 C ATOM 2565 O LEU B 58 65.166 -0.652 0.991 1.00 0.00 O ATOM 2566 CB LEU B 58 66.876 -3.165 -0.373 1.00 0.00 C ATOM 2567 CG LEU B 58 67.814 -1.964 -0.526 1.00 0.00 C ATOM 2568 CD1 LEU B 58 68.649 -1.770 0.751 1.00 0.00 C ATOM 2569 CD2 LEU B 58 68.738 -2.202 -1.726 1.00 0.00 C ATOM 0 H LEU B 58 65.091 -4.797 0.165 1.00 0.00 H new ATOM 0 HA LEU B 58 66.459 -2.754 1.683 1.00 0.00 H new ATOM 0 HB2 LEU B 58 67.457 -4.066 -0.176 1.00 0.00 H new ATOM 0 HB3 LEU B 58 66.333 -3.332 -1.303 1.00 0.00 H new ATOM 0 HG LEU B 58 67.223 -1.063 -0.689 1.00 0.00 H new ATOM 0 HD11 LEU B 58 69.311 -0.913 0.626 1.00 0.00 H new ATOM 0 HD12 LEU B 58 67.984 -1.596 1.597 1.00 0.00 H new ATOM 0 HD13 LEU B 58 69.245 -2.664 0.936 1.00 0.00 H new ATOM 0 HD21 LEU B 58 69.410 -1.351 -1.842 1.00 0.00 H new ATOM 0 HD22 LEU B 58 69.323 -3.107 -1.561 1.00 0.00 H new ATOM 0 HD23 LEU B 58 68.139 -2.318 -2.629 1.00 0.00 H new ATOM 2581 N MET B 59 64.045 -1.939 -0.386 1.00 0.00 N ATOM 2582 CA MET B 59 63.107 -0.847 -0.726 1.00 0.00 C ATOM 2583 C MET B 59 62.206 -0.598 0.479 1.00 0.00 C ATOM 2584 O MET B 59 61.791 0.511 0.742 1.00 0.00 O ATOM 2585 CB MET B 59 62.267 -1.234 -1.948 1.00 0.00 C ATOM 2586 CG MET B 59 61.644 0.025 -2.558 1.00 0.00 C ATOM 2587 SD MET B 59 60.484 -0.442 -3.868 1.00 0.00 S ATOM 2588 CE MET B 59 59.012 -0.603 -2.828 1.00 0.00 C ATOM 0 H MET B 59 63.870 -2.825 -0.859 1.00 0.00 H new ATOM 0 HA MET B 59 63.660 0.060 -0.970 1.00 0.00 H new ATOM 0 HB2 MET B 59 62.890 -1.739 -2.686 1.00 0.00 H new ATOM 0 HB3 MET B 59 61.485 -1.936 -1.658 1.00 0.00 H new ATOM 0 HG2 MET B 59 61.127 0.596 -1.787 1.00 0.00 H new ATOM 0 HG3 MET B 59 62.425 0.669 -2.963 1.00 0.00 H new ATOM 0 HE1 MET B 59 58.161 -0.891 -3.445 1.00 0.00 H new ATOM 0 HE2 MET B 59 59.185 -1.366 -2.069 1.00 0.00 H new ATOM 0 HE3 MET B 59 58.803 0.351 -2.343 1.00 0.00 H new ATOM 2598 N SER B 60 61.904 -1.621 1.228 1.00 0.00 N ATOM 2599 CA SER B 60 61.041 -1.406 2.419 1.00 0.00 C ATOM 2600 C SER B 60 61.733 -0.383 3.309 1.00 0.00 C ATOM 2601 O SER B 60 61.100 0.384 4.006 1.00 0.00 O ATOM 2602 CB SER B 60 60.852 -2.716 3.185 1.00 0.00 C ATOM 2603 OG SER B 60 59.908 -2.517 4.230 1.00 0.00 O ATOM 0 H SER B 60 62.212 -2.581 1.070 1.00 0.00 H new ATOM 0 HA SER B 60 60.057 -1.051 2.112 1.00 0.00 H new ATOM 0 HB2 SER B 60 60.505 -3.499 2.510 1.00 0.00 H new ATOM 0 HB3 SER B 60 61.804 -3.050 3.598 1.00 0.00 H new ATOM 0 HG SER B 60 59.783 -3.355 4.722 1.00 0.00 H new ATOM 2609 N ASN B 61 63.035 -0.348 3.262 1.00 0.00 N ATOM 2610 CA ASN B 61 63.769 0.655 4.083 1.00 0.00 C ATOM 2611 C ASN B 61 63.496 2.022 3.474 1.00 0.00 C ATOM 2612 O ASN B 61 63.260 2.988 4.165 1.00 0.00 O ATOM 2613 CB ASN B 61 65.273 0.365 4.089 1.00 0.00 C ATOM 2614 CG ASN B 61 65.551 -0.905 4.894 1.00 0.00 C ATOM 2615 OD1 ASN B 61 64.806 -1.243 5.794 1.00 0.00 O ATOM 2616 ND2 ASN B 61 66.598 -1.627 4.609 1.00 0.00 N ATOM 0 H ASN B 61 63.619 -0.964 2.696 1.00 0.00 H new ATOM 0 HA ASN B 61 63.431 0.616 5.118 1.00 0.00 H new ATOM 0 HB2 ASN B 61 65.634 0.246 3.067 1.00 0.00 H new ATOM 0 HB3 ASN B 61 65.814 1.207 4.522 1.00 0.00 H new ATOM 0 HD21 ASN B 61 66.793 -2.475 5.141 1.00 0.00 H new ATOM 0 HD22 ASN B 61 67.223 -1.344 3.854 1.00 0.00 H new ATOM 2623 N LEU B 62 63.475 2.100 2.173 1.00 0.00 N ATOM 2624 CA LEU B 62 63.155 3.394 1.526 1.00 0.00 C ATOM 2625 C LEU B 62 61.770 3.790 2.045 1.00 0.00 C ATOM 2626 O LEU B 62 61.444 4.951 2.200 1.00 0.00 O ATOM 2627 CB LEU B 62 63.204 3.204 -0.012 1.00 0.00 C ATOM 2628 CG LEU B 62 62.160 4.056 -0.750 1.00 0.00 C ATOM 2629 CD1 LEU B 62 62.427 5.552 -0.517 1.00 0.00 C ATOM 2630 CD2 LEU B 62 62.252 3.749 -2.255 1.00 0.00 C ATOM 0 H LEU B 62 63.665 1.326 1.536 1.00 0.00 H new ATOM 0 HA LEU B 62 63.863 4.189 1.759 1.00 0.00 H new ATOM 0 HB2 LEU B 62 64.199 3.463 -0.374 1.00 0.00 H new ATOM 0 HB3 LEU B 62 63.042 2.153 -0.249 1.00 0.00 H new ATOM 0 HG LEU B 62 61.166 3.817 -0.373 1.00 0.00 H new ATOM 0 HD11 LEU B 62 61.679 6.142 -1.046 1.00 0.00 H new ATOM 0 HD12 LEU B 62 62.372 5.770 0.550 1.00 0.00 H new ATOM 0 HD13 LEU B 62 63.419 5.807 -0.889 1.00 0.00 H new ATOM 0 HD21 LEU B 62 61.517 4.346 -2.794 1.00 0.00 H new ATOM 0 HD22 LEU B 62 63.251 3.992 -2.616 1.00 0.00 H new ATOM 0 HD23 LEU B 62 62.053 2.691 -2.423 1.00 0.00 H new ATOM 2642 N ASP B 63 60.977 2.809 2.378 1.00 0.00 N ATOM 2643 CA ASP B 63 59.634 3.081 2.957 1.00 0.00 C ATOM 2644 C ASP B 63 59.784 3.152 4.479 1.00 0.00 C ATOM 2645 O ASP B 63 58.817 3.131 5.213 1.00 0.00 O ATOM 2646 CB ASP B 63 58.668 1.955 2.587 1.00 0.00 C ATOM 2647 CG ASP B 63 58.351 2.025 1.092 1.00 0.00 C ATOM 2648 OD1 ASP B 63 58.551 3.081 0.513 1.00 0.00 O ATOM 2649 OD2 ASP B 63 57.913 1.023 0.551 1.00 0.00 O ATOM 0 H ASP B 63 61.206 1.821 2.272 1.00 0.00 H new ATOM 0 HA ASP B 63 59.238 4.019 2.567 1.00 0.00 H new ATOM 0 HB2 ASP B 63 59.109 0.988 2.831 1.00 0.00 H new ATOM 0 HB3 ASP B 63 57.750 2.043 3.169 1.00 0.00 H new ATOM 2654 N SER B 64 61.004 3.214 4.953 1.00 0.00 N ATOM 2655 CA SER B 64 61.237 3.261 6.427 1.00 0.00 C ATOM 2656 C SER B 64 60.532 4.479 7.027 1.00 0.00 C ATOM 2657 O SER B 64 60.544 5.554 6.462 1.00 0.00 O ATOM 2658 CB SER B 64 62.734 3.396 6.715 1.00 0.00 C ATOM 2659 OG SER B 64 63.259 4.487 5.972 1.00 0.00 O ATOM 0 H SER B 64 61.848 3.234 4.381 1.00 0.00 H new ATOM 0 HA SER B 64 60.848 2.342 6.865 1.00 0.00 H new ATOM 0 HB2 SER B 64 62.898 3.555 7.781 1.00 0.00 H new ATOM 0 HB3 SER B 64 63.252 2.475 6.446 1.00 0.00 H new ATOM 0 HG SER B 64 63.336 4.233 5.029 1.00 0.00 H new ATOM 2665 N ASN B 65 59.937 4.330 8.177 1.00 0.00 N ATOM 2666 CA ASN B 65 59.254 5.489 8.816 1.00 0.00 C ATOM 2667 C ASN B 65 60.313 6.466 9.333 1.00 0.00 C ATOM 2668 O ASN B 65 60.046 7.629 9.560 1.00 0.00 O ATOM 2669 CB ASN B 65 58.388 4.999 9.978 1.00 0.00 C ATOM 2670 CG ASN B 65 57.499 6.143 10.472 1.00 0.00 C ATOM 2671 OD1 ASN B 65 57.666 6.624 11.575 1.00 0.00 O ATOM 2672 ND2 ASN B 65 56.558 6.605 9.694 1.00 0.00 N ATOM 0 H ASN B 65 59.894 3.457 8.702 1.00 0.00 H new ATOM 0 HA ASN B 65 58.617 5.991 8.088 1.00 0.00 H new ATOM 0 HB2 ASN B 65 57.772 4.159 9.657 1.00 0.00 H new ATOM 0 HB3 ASN B 65 59.020 4.639 10.790 1.00 0.00 H new ATOM 0 HD21 ASN B 65 55.963 7.370 10.012 1.00 0.00 H new ATOM 0 HD22 ASN B 65 56.418 6.201 8.768 1.00 0.00 H new ATOM 2679 N ARG B 66 61.518 5.994 9.523 1.00 0.00 N ATOM 2680 CA ARG B 66 62.608 6.881 10.026 1.00 0.00 C ATOM 2681 C ARG B 66 63.023 7.874 8.935 1.00 0.00 C ATOM 2682 O ARG B 66 62.589 7.786 7.804 1.00 0.00 O ATOM 2683 CB ARG B 66 63.815 6.033 10.438 1.00 0.00 C ATOM 2684 CG ARG B 66 63.485 5.263 11.720 1.00 0.00 C ATOM 2685 CD ARG B 66 64.694 4.417 12.127 1.00 0.00 C ATOM 2686 NE ARG B 66 64.343 3.556 13.308 1.00 0.00 N ATOM 2687 CZ ARG B 66 63.944 4.068 14.443 1.00 0.00 C ATOM 2688 NH1 ARG B 66 63.982 5.357 14.641 1.00 0.00 N ATOM 2689 NH2 ARG B 66 63.552 3.279 15.406 1.00 0.00 N ATOM 0 H ARG B 66 61.795 5.028 9.350 1.00 0.00 H new ATOM 0 HA ARG B 66 62.244 7.435 10.891 1.00 0.00 H new ATOM 0 HB2 ARG B 66 64.074 5.337 9.640 1.00 0.00 H new ATOM 0 HB3 ARG B 66 64.684 6.672 10.598 1.00 0.00 H new ATOM 0 HG2 ARG B 66 63.227 5.958 12.519 1.00 0.00 H new ATOM 0 HG3 ARG B 66 62.616 4.624 11.561 1.00 0.00 H new ATOM 0 HD2 ARG B 66 65.009 3.792 11.291 1.00 0.00 H new ATOM 0 HD3 ARG B 66 65.535 5.065 12.375 1.00 0.00 H new ATOM 0 HE ARG B 66 64.418 2.542 13.221 1.00 0.00 H new ATOM 0 HH11 ARG B 66 64.325 5.976 13.907 1.00 0.00 H new ATOM 0 HH12 ARG B 66 63.668 5.746 15.530 1.00 0.00 H new ATOM 0 HH21 ARG B 66 63.558 2.268 15.271 1.00 0.00 H new ATOM 0 HH22 ARG B 66 63.240 3.673 16.293 1.00 0.00 H new ATOM 2703 N ASP B 67 63.853 8.828 9.280 1.00 0.00 N ATOM 2704 CA ASP B 67 64.303 9.851 8.284 1.00 0.00 C ATOM 2705 C ASP B 67 64.594 9.192 6.933 1.00 0.00 C ATOM 2706 O ASP B 67 64.869 8.011 6.852 1.00 0.00 O ATOM 2707 CB ASP B 67 65.570 10.535 8.804 1.00 0.00 C ATOM 2708 CG ASP B 67 65.214 11.432 9.992 1.00 0.00 C ATOM 2709 OD1 ASP B 67 64.062 11.822 10.090 1.00 0.00 O ATOM 2710 OD2 ASP B 67 66.099 11.717 10.782 1.00 0.00 O ATOM 0 H ASP B 67 64.241 8.943 10.216 1.00 0.00 H new ATOM 0 HA ASP B 67 63.511 10.588 8.149 1.00 0.00 H new ATOM 0 HB2 ASP B 67 66.302 9.786 9.106 1.00 0.00 H new ATOM 0 HB3 ASP B 67 66.028 11.127 8.012 1.00 0.00 H new ATOM 2715 N ASN B 68 64.509 9.954 5.866 1.00 0.00 N ATOM 2716 CA ASN B 68 64.749 9.398 4.494 1.00 0.00 C ATOM 2717 C ASN B 68 65.947 10.091 3.838 1.00 0.00 C ATOM 2718 O ASN B 68 65.919 10.405 2.667 1.00 0.00 O ATOM 2719 CB ASN B 68 63.505 9.639 3.636 1.00 0.00 C ATOM 2720 CG ASN B 68 62.299 8.960 4.284 1.00 0.00 C ATOM 2721 OD1 ASN B 68 61.241 9.546 4.393 1.00 0.00 O ATOM 2722 ND2 ASN B 68 62.415 7.736 4.722 1.00 0.00 N ATOM 0 H ASN B 68 64.281 10.948 5.888 1.00 0.00 H new ATOM 0 HA ASN B 68 64.957 8.331 4.575 1.00 0.00 H new ATOM 0 HB2 ASN B 68 63.322 10.709 3.534 1.00 0.00 H new ATOM 0 HB3 ASN B 68 63.661 9.245 2.632 1.00 0.00 H new ATOM 0 HD21 ASN B 68 61.617 7.272 5.156 1.00 0.00 H new ATOM 0 HD22 ASN B 68 63.304 7.244 4.630 1.00 0.00 H new ATOM 2729 N GLU B 69 66.998 10.337 4.581 1.00 0.00 N ATOM 2730 CA GLU B 69 68.202 11.019 3.999 1.00 0.00 C ATOM 2731 C GLU B 69 69.308 9.991 3.753 1.00 0.00 C ATOM 2732 O GLU B 69 69.467 9.044 4.495 1.00 0.00 O ATOM 2733 CB GLU B 69 68.713 12.071 4.983 1.00 0.00 C ATOM 2734 CG GLU B 69 69.930 12.790 4.399 1.00 0.00 C ATOM 2735 CD GLU B 69 70.427 13.838 5.396 1.00 0.00 C ATOM 2736 OE1 GLU B 69 69.722 14.096 6.356 1.00 0.00 O ATOM 2737 OE2 GLU B 69 71.515 14.352 5.192 1.00 0.00 O ATOM 0 H GLU B 69 67.077 10.095 5.569 1.00 0.00 H new ATOM 0 HA GLU B 69 67.926 11.493 3.057 1.00 0.00 H new ATOM 0 HB2 GLU B 69 67.924 12.792 5.199 1.00 0.00 H new ATOM 0 HB3 GLU B 69 68.980 11.597 5.928 1.00 0.00 H new ATOM 0 HG2 GLU B 69 70.722 12.072 4.184 1.00 0.00 H new ATOM 0 HG3 GLU B 69 69.666 13.266 3.455 1.00 0.00 H new ATOM 2744 N VAL B 70 70.077 10.184 2.712 1.00 0.00 N ATOM 2745 CA VAL B 70 71.194 9.238 2.390 1.00 0.00 C ATOM 2746 C VAL B 70 72.511 9.994 2.407 1.00 0.00 C ATOM 2747 O VAL B 70 72.816 10.766 1.518 1.00 0.00 O ATOM 2748 CB VAL B 70 70.967 8.655 0.989 1.00 0.00 C ATOM 2749 CG1 VAL B 70 71.689 7.316 0.846 1.00 0.00 C ATOM 2750 CG2 VAL B 70 69.476 8.449 0.777 1.00 0.00 C ATOM 0 H VAL B 70 69.979 10.965 2.063 1.00 0.00 H new ATOM 0 HA VAL B 70 71.222 8.435 3.127 1.00 0.00 H new ATOM 0 HB VAL B 70 71.362 9.347 0.245 1.00 0.00 H new ATOM 0 HG11 VAL B 70 71.518 6.915 -0.153 1.00 0.00 H new ATOM 0 HG12 VAL B 70 72.758 7.461 1.001 1.00 0.00 H new ATOM 0 HG13 VAL B 70 71.306 6.615 1.588 1.00 0.00 H new ATOM 0 HG21 VAL B 70 69.304 8.035 -0.216 1.00 0.00 H new ATOM 0 HG22 VAL B 70 69.093 7.759 1.529 1.00 0.00 H new ATOM 0 HG23 VAL B 70 68.960 9.405 0.866 1.00 0.00 H new ATOM 2760 N ASP B 71 73.312 9.740 3.388 1.00 0.00 N ATOM 2761 CA ASP B 71 74.639 10.395 3.446 1.00 0.00 C ATOM 2762 C ASP B 71 75.564 9.564 2.575 1.00 0.00 C ATOM 2763 O ASP B 71 75.202 8.488 2.142 1.00 0.00 O ATOM 2764 CB ASP B 71 75.159 10.410 4.887 1.00 0.00 C ATOM 2765 CG ASP B 71 74.327 11.380 5.728 1.00 0.00 C ATOM 2766 OD1 ASP B 71 73.684 12.237 5.146 1.00 0.00 O ATOM 2767 OD2 ASP B 71 74.348 11.249 6.941 1.00 0.00 O ATOM 0 H ASP B 71 73.107 9.104 4.158 1.00 0.00 H new ATOM 0 HA ASP B 71 74.583 11.427 3.101 1.00 0.00 H new ATOM 0 HB2 ASP B 71 75.107 9.408 5.313 1.00 0.00 H new ATOM 0 HB3 ASP B 71 76.207 10.708 4.902 1.00 0.00 H new ATOM 2772 N PHE B 72 76.750 10.013 2.314 1.00 0.00 N ATOM 2773 CA PHE B 72 77.646 9.191 1.481 1.00 0.00 C ATOM 2774 C PHE B 72 77.793 7.840 2.176 1.00 0.00 C ATOM 2775 O PHE B 72 77.820 6.796 1.551 1.00 0.00 O ATOM 2776 CB PHE B 72 79.007 9.873 1.372 1.00 0.00 C ATOM 2777 CG PHE B 72 79.902 9.022 0.521 1.00 0.00 C ATOM 2778 CD1 PHE B 72 80.687 8.025 1.106 1.00 0.00 C ATOM 2779 CD2 PHE B 72 79.938 9.223 -0.860 1.00 0.00 C ATOM 2780 CE1 PHE B 72 81.510 7.229 0.307 1.00 0.00 C ATOM 2781 CE2 PHE B 72 80.758 8.429 -1.661 1.00 0.00 C ATOM 2782 CZ PHE B 72 81.547 7.429 -1.079 1.00 0.00 C ATOM 0 H PHE B 72 77.132 10.902 2.637 1.00 0.00 H new ATOM 0 HA PHE B 72 77.243 9.064 0.476 1.00 0.00 H new ATOM 0 HB2 PHE B 72 78.899 10.865 0.933 1.00 0.00 H new ATOM 0 HB3 PHE B 72 79.443 10.008 2.362 1.00 0.00 H new ATOM 0 HD1 PHE B 72 80.657 7.870 2.174 1.00 0.00 H new ATOM 0 HD2 PHE B 72 79.330 9.995 -1.309 1.00 0.00 H new ATOM 0 HE1 PHE B 72 82.118 6.459 0.758 1.00 0.00 H new ATOM 0 HE2 PHE B 72 80.785 8.585 -2.729 1.00 0.00 H new ATOM 0 HZ PHE B 72 82.183 6.813 -1.698 1.00 0.00 H new ATOM 2792 N GLN B 73 77.883 7.866 3.476 1.00 0.00 N ATOM 2793 CA GLN B 73 78.021 6.609 4.257 1.00 0.00 C ATOM 2794 C GLN B 73 76.749 5.751 4.168 1.00 0.00 C ATOM 2795 O GLN B 73 76.833 4.547 4.073 1.00 0.00 O ATOM 2796 CB GLN B 73 78.284 6.953 5.725 1.00 0.00 C ATOM 2797 CG GLN B 73 78.596 5.671 6.504 1.00 0.00 C ATOM 2798 CD GLN B 73 79.011 6.030 7.933 1.00 0.00 C ATOM 2799 OE1 GLN B 73 80.178 6.233 8.204 1.00 0.00 O ATOM 2800 NE2 GLN B 73 78.102 6.110 8.865 1.00 0.00 N ATOM 0 H GLN B 73 77.866 8.718 4.037 1.00 0.00 H new ATOM 0 HA GLN B 73 78.852 6.040 3.840 1.00 0.00 H new ATOM 0 HB2 GLN B 73 79.119 7.650 5.802 1.00 0.00 H new ATOM 0 HB3 GLN B 73 77.414 7.449 6.155 1.00 0.00 H new ATOM 0 HG2 GLN B 73 77.721 5.021 6.520 1.00 0.00 H new ATOM 0 HG3 GLN B 73 79.395 5.118 6.010 1.00 0.00 H new ATOM 0 HE21 GLN B 73 77.122 5.940 8.638 1.00 0.00 H new ATOM 0 HE22 GLN B 73 78.371 6.343 9.821 1.00 0.00 H new ATOM 2809 N GLU B 74 75.569 6.328 4.212 1.00 0.00 N ATOM 2810 CA GLU B 74 74.357 5.473 4.147 1.00 0.00 C ATOM 2811 C GLU B 74 74.225 4.882 2.754 1.00 0.00 C ATOM 2812 O GLU B 74 73.864 3.735 2.591 1.00 0.00 O ATOM 2813 CB GLU B 74 73.125 6.300 4.499 1.00 0.00 C ATOM 2814 CG GLU B 74 71.916 5.379 4.676 1.00 0.00 C ATOM 2815 CD GLU B 74 70.710 6.210 5.114 1.00 0.00 C ATOM 2816 OE1 GLU B 74 70.894 7.381 5.397 1.00 0.00 O ATOM 2817 OE2 GLU B 74 69.624 5.660 5.164 1.00 0.00 O ATOM 0 H GLU B 74 75.402 7.331 4.288 1.00 0.00 H new ATOM 0 HA GLU B 74 74.445 4.658 4.865 1.00 0.00 H new ATOM 0 HB2 GLU B 74 73.303 6.862 5.416 1.00 0.00 H new ATOM 0 HB3 GLU B 74 72.927 7.028 3.712 1.00 0.00 H new ATOM 0 HG2 GLU B 74 71.697 4.863 3.741 1.00 0.00 H new ATOM 0 HG3 GLU B 74 72.134 4.612 5.420 1.00 0.00 H new ATOM 2824 N TYR B 75 74.524 5.642 1.745 1.00 0.00 N ATOM 2825 CA TYR B 75 74.412 5.087 0.375 1.00 0.00 C ATOM 2826 C TYR B 75 75.344 3.882 0.268 1.00 0.00 C ATOM 2827 O TYR B 75 75.007 2.873 -0.320 1.00 0.00 O ATOM 2828 CB TYR B 75 74.819 6.138 -0.658 1.00 0.00 C ATOM 2829 CG TYR B 75 74.756 5.519 -2.033 1.00 0.00 C ATOM 2830 CD1 TYR B 75 73.563 5.547 -2.766 1.00 0.00 C ATOM 2831 CD2 TYR B 75 75.894 4.903 -2.571 1.00 0.00 C ATOM 2832 CE1 TYR B 75 73.510 4.961 -4.037 1.00 0.00 C ATOM 2833 CE2 TYR B 75 75.839 4.319 -3.842 1.00 0.00 C ATOM 2834 CZ TYR B 75 74.648 4.347 -4.575 1.00 0.00 C ATOM 2835 OH TYR B 75 74.597 3.770 -5.827 1.00 0.00 O ATOM 0 H TYR B 75 74.837 6.611 1.807 1.00 0.00 H new ATOM 0 HA TYR B 75 73.381 4.792 0.182 1.00 0.00 H new ATOM 0 HB2 TYR B 75 74.154 7.000 -0.601 1.00 0.00 H new ATOM 0 HB3 TYR B 75 75.827 6.499 -0.452 1.00 0.00 H new ATOM 0 HD1 TYR B 75 72.685 6.020 -2.352 1.00 0.00 H new ATOM 0 HD2 TYR B 75 76.813 4.879 -2.005 1.00 0.00 H new ATOM 0 HE1 TYR B 75 72.590 4.983 -4.603 1.00 0.00 H new ATOM 0 HE2 TYR B 75 76.717 3.846 -4.257 1.00 0.00 H new ATOM 0 HH TYR B 75 75.473 3.390 -6.048 1.00 0.00 H new ATOM 2845 N CYS B 76 76.512 3.977 0.844 1.00 0.00 N ATOM 2846 CA CYS B 76 77.464 2.837 0.793 1.00 0.00 C ATOM 2847 C CYS B 76 76.897 1.687 1.626 1.00 0.00 C ATOM 2848 O CYS B 76 76.977 0.536 1.245 1.00 0.00 O ATOM 2849 CB CYS B 76 78.837 3.275 1.332 1.00 0.00 C ATOM 2850 SG CYS B 76 78.902 3.107 3.136 1.00 0.00 S ATOM 0 H CYS B 76 76.846 4.798 1.348 1.00 0.00 H new ATOM 0 HA CYS B 76 77.596 2.505 -0.237 1.00 0.00 H new ATOM 0 HB2 CYS B 76 79.621 2.670 0.877 1.00 0.00 H new ATOM 0 HB3 CYS B 76 79.030 4.310 1.051 1.00 0.00 H new ATOM 0 HG CYS B 76 77.966 3.832 3.673 1.00 0.00 H new ATOM 2856 N VAL B 77 76.309 1.988 2.760 1.00 0.00 N ATOM 2857 CA VAL B 77 75.730 0.898 3.584 1.00 0.00 C ATOM 2858 C VAL B 77 74.673 0.204 2.738 1.00 0.00 C ATOM 2859 O VAL B 77 74.582 -1.007 2.695 1.00 0.00 O ATOM 2860 CB VAL B 77 75.090 1.496 4.840 1.00 0.00 C ATOM 2861 CG1 VAL B 77 74.279 0.422 5.571 1.00 0.00 C ATOM 2862 CG2 VAL B 77 76.190 2.024 5.771 1.00 0.00 C ATOM 0 H VAL B 77 76.209 2.929 3.140 1.00 0.00 H new ATOM 0 HA VAL B 77 76.497 0.188 3.893 1.00 0.00 H new ATOM 0 HB VAL B 77 74.429 2.313 4.552 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.826 0.853 6.464 1.00 0.00 H new ATOM 0 HG12 VAL B 77 73.496 0.046 4.912 1.00 0.00 H new ATOM 0 HG13 VAL B 77 74.937 -0.398 5.858 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.736 2.450 6.666 1.00 0.00 H new ATOM 0 HG22 VAL B 77 76.851 1.205 6.054 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.765 2.793 5.255 1.00 0.00 H new ATOM 2872 N PHE B 78 73.890 0.972 2.036 1.00 0.00 N ATOM 2873 CA PHE B 78 72.859 0.372 1.157 1.00 0.00 C ATOM 2874 C PHE B 78 73.569 -0.309 -0.020 1.00 0.00 C ATOM 2875 O PHE B 78 73.192 -1.383 -0.438 1.00 0.00 O ATOM 2876 CB PHE B 78 71.912 1.472 0.648 1.00 0.00 C ATOM 2877 CG PHE B 78 70.800 1.709 1.655 1.00 0.00 C ATOM 2878 CD1 PHE B 78 71.107 2.146 2.951 1.00 0.00 C ATOM 2879 CD2 PHE B 78 69.463 1.487 1.293 1.00 0.00 C ATOM 2880 CE1 PHE B 78 70.081 2.363 3.880 1.00 0.00 C ATOM 2881 CE2 PHE B 78 68.440 1.704 2.223 1.00 0.00 C ATOM 2882 CZ PHE B 78 68.748 2.142 3.515 1.00 0.00 C ATOM 0 H PHE B 78 73.922 1.991 2.035 1.00 0.00 H new ATOM 0 HA PHE B 78 72.269 -0.362 1.706 1.00 0.00 H new ATOM 0 HB2 PHE B 78 72.468 2.395 0.485 1.00 0.00 H new ATOM 0 HB3 PHE B 78 71.487 1.181 -0.313 1.00 0.00 H new ATOM 0 HD1 PHE B 78 72.135 2.316 3.234 1.00 0.00 H new ATOM 0 HD2 PHE B 78 69.223 1.148 0.296 1.00 0.00 H new ATOM 0 HE1 PHE B 78 70.319 2.701 4.878 1.00 0.00 H new ATOM 0 HE2 PHE B 78 67.411 1.533 1.943 1.00 0.00 H new ATOM 0 HZ PHE B 78 67.957 2.310 4.231 1.00 0.00 H new ATOM 2892 N LEU B 79 74.603 0.299 -0.552 1.00 0.00 N ATOM 2893 CA LEU B 79 75.323 -0.342 -1.693 1.00 0.00 C ATOM 2894 C LEU B 79 75.978 -1.626 -1.188 1.00 0.00 C ATOM 2895 O LEU B 79 76.000 -2.639 -1.857 1.00 0.00 O ATOM 2896 CB LEU B 79 76.395 0.611 -2.238 1.00 0.00 C ATOM 2897 CG LEU B 79 76.929 0.114 -3.599 1.00 0.00 C ATOM 2898 CD1 LEU B 79 75.801 0.137 -4.659 1.00 0.00 C ATOM 2899 CD2 LEU B 79 78.114 1.014 -4.052 1.00 0.00 C ATOM 0 H LEU B 79 74.974 1.199 -0.249 1.00 0.00 H new ATOM 0 HA LEU B 79 74.622 -0.570 -2.496 1.00 0.00 H new ATOM 0 HB2 LEU B 79 75.976 1.611 -2.350 1.00 0.00 H new ATOM 0 HB3 LEU B 79 77.217 0.687 -1.526 1.00 0.00 H new ATOM 0 HG LEU B 79 77.280 -0.913 -3.493 1.00 0.00 H new ATOM 0 HD11 LEU B 79 76.191 -0.216 -5.614 1.00 0.00 H new ATOM 0 HD12 LEU B 79 74.987 -0.512 -4.338 1.00 0.00 H new ATOM 0 HD13 LEU B 79 75.430 1.155 -4.773 1.00 0.00 H new ATOM 0 HD21 LEU B 79 78.491 0.663 -5.013 1.00 0.00 H new ATOM 0 HD22 LEU B 79 77.771 2.044 -4.151 1.00 0.00 H new ATOM 0 HD23 LEU B 79 78.911 0.966 -3.310 1.00 0.00 H new ATOM 2911 N SER B 80 76.505 -1.578 0.001 1.00 0.00 N ATOM 2912 CA SER B 80 77.159 -2.774 0.591 1.00 0.00 C ATOM 2913 C SER B 80 76.089 -3.814 0.883 1.00 0.00 C ATOM 2914 O SER B 80 76.264 -4.987 0.634 1.00 0.00 O ATOM 2915 CB SER B 80 77.859 -2.386 1.893 1.00 0.00 C ATOM 2916 OG SER B 80 78.446 -3.543 2.473 1.00 0.00 O ATOM 0 H SER B 80 76.510 -0.750 0.596 1.00 0.00 H new ATOM 0 HA SER B 80 77.896 -3.177 -0.104 1.00 0.00 H new ATOM 0 HB2 SER B 80 78.624 -1.635 1.698 1.00 0.00 H new ATOM 0 HB3 SER B 80 77.144 -1.941 2.585 1.00 0.00 H new ATOM 0 HG SER B 80 79.268 -3.292 2.944 1.00 0.00 H new ATOM 2922 N CYS B 81 74.963 -3.387 1.380 1.00 0.00 N ATOM 2923 CA CYS B 81 73.875 -4.354 1.660 1.00 0.00 C ATOM 2924 C CYS B 81 73.521 -5.015 0.342 1.00 0.00 C ATOM 2925 O CYS B 81 73.221 -6.192 0.278 1.00 0.00 O ATOM 2926 CB CYS B 81 72.650 -3.622 2.211 1.00 0.00 C ATOM 2927 SG CYS B 81 71.362 -4.828 2.616 1.00 0.00 S ATOM 0 H CYS B 81 74.752 -2.414 1.603 1.00 0.00 H new ATOM 0 HA CYS B 81 74.193 -5.090 2.399 1.00 0.00 H new ATOM 0 HB2 CYS B 81 72.922 -3.052 3.099 1.00 0.00 H new ATOM 0 HB3 CYS B 81 72.278 -2.909 1.476 1.00 0.00 H new ATOM 0 HG CYS B 81 71.566 -5.923 1.945 1.00 0.00 H new ATOM 2933 N ILE B 82 73.588 -4.266 -0.719 1.00 0.00 N ATOM 2934 CA ILE B 82 73.290 -4.858 -2.051 1.00 0.00 C ATOM 2935 C ILE B 82 74.424 -5.813 -2.407 1.00 0.00 C ATOM 2936 O ILE B 82 74.212 -6.874 -2.960 1.00 0.00 O ATOM 2937 CB ILE B 82 73.156 -3.764 -3.118 1.00 0.00 C ATOM 2938 CG1 ILE B 82 71.868 -2.974 -2.864 1.00 0.00 C ATOM 2939 CG2 ILE B 82 73.086 -4.405 -4.508 1.00 0.00 C ATOM 2940 CD1 ILE B 82 71.826 -1.740 -3.767 1.00 0.00 C ATOM 0 H ILE B 82 73.834 -3.276 -0.724 1.00 0.00 H new ATOM 0 HA ILE B 82 72.342 -5.394 -2.014 1.00 0.00 H new ATOM 0 HB ILE B 82 74.018 -3.099 -3.069 1.00 0.00 H new ATOM 0 HG12 ILE B 82 71.000 -3.605 -3.056 1.00 0.00 H new ATOM 0 HG13 ILE B 82 71.817 -2.672 -1.818 1.00 0.00 H new ATOM 0 HG21 ILE B 82 72.991 -3.625 -5.264 1.00 0.00 H new ATOM 0 HG22 ILE B 82 73.995 -4.978 -4.690 1.00 0.00 H new ATOM 0 HG23 ILE B 82 72.222 -5.068 -4.560 1.00 0.00 H new ATOM 0 HD11 ILE B 82 70.907 -1.184 -3.580 1.00 0.00 H new ATOM 0 HD12 ILE B 82 72.685 -1.104 -3.554 1.00 0.00 H new ATOM 0 HD13 ILE B 82 71.856 -2.052 -4.811 1.00 0.00 H new ATOM 2952 N ALA B 83 75.635 -5.437 -2.100 1.00 0.00 N ATOM 2953 CA ALA B 83 76.789 -6.314 -2.427 1.00 0.00 C ATOM 2954 C ALA B 83 76.617 -7.669 -1.740 1.00 0.00 C ATOM 2955 O ALA B 83 76.746 -8.696 -2.363 1.00 0.00 O ATOM 2956 CB ALA B 83 78.078 -5.664 -1.932 1.00 0.00 C ATOM 0 H ALA B 83 75.873 -4.560 -1.637 1.00 0.00 H new ATOM 0 HA ALA B 83 76.837 -6.455 -3.507 1.00 0.00 H new ATOM 0 HB1 ALA B 83 78.925 -6.307 -2.172 1.00 0.00 H new ATOM 0 HB2 ALA B 83 78.208 -4.697 -2.418 1.00 0.00 H new ATOM 0 HB3 ALA B 83 78.023 -5.523 -0.853 1.00 0.00 H new ATOM 2962 N MET B 84 76.317 -7.690 -0.471 1.00 0.00 N ATOM 2963 CA MET B 84 76.134 -9.007 0.210 1.00 0.00 C ATOM 2964 C MET B 84 74.943 -9.717 -0.408 1.00 0.00 C ATOM 2965 O MET B 84 74.963 -10.914 -0.617 1.00 0.00 O ATOM 2966 CB MET B 84 75.899 -8.817 1.713 1.00 0.00 C ATOM 2967 CG MET B 84 77.216 -8.461 2.419 1.00 0.00 C ATOM 2968 SD MET B 84 77.639 -6.734 2.100 1.00 0.00 S ATOM 2969 CE MET B 84 76.642 -6.001 3.422 1.00 0.00 C ATOM 0 H MET B 84 76.192 -6.867 0.118 1.00 0.00 H new ATOM 0 HA MET B 84 77.037 -9.603 0.080 1.00 0.00 H new ATOM 0 HB2 MET B 84 75.166 -8.027 1.876 1.00 0.00 H new ATOM 0 HB3 MET B 84 75.484 -9.730 2.141 1.00 0.00 H new ATOM 0 HG2 MET B 84 77.120 -8.629 3.492 1.00 0.00 H new ATOM 0 HG3 MET B 84 78.016 -9.112 2.065 1.00 0.00 H new ATOM 0 HE1 MET B 84 76.570 -4.924 3.269 1.00 0.00 H new ATOM 0 HE2 MET B 84 75.643 -6.437 3.408 1.00 0.00 H new ATOM 0 HE3 MET B 84 77.112 -6.200 4.385 1.00 0.00 H new ATOM 2979 N MET B 85 73.909 -8.997 -0.723 1.00 0.00 N ATOM 2980 CA MET B 85 72.741 -9.656 -1.343 1.00 0.00 C ATOM 2981 C MET B 85 73.236 -10.332 -2.615 1.00 0.00 C ATOM 2982 O MET B 85 72.676 -11.308 -3.071 1.00 0.00 O ATOM 2983 CB MET B 85 71.664 -8.619 -1.675 1.00 0.00 C ATOM 2984 CG MET B 85 70.391 -9.331 -2.140 1.00 0.00 C ATOM 2985 SD MET B 85 69.105 -8.107 -2.507 1.00 0.00 S ATOM 2986 CE MET B 85 69.714 -7.578 -4.130 1.00 0.00 C ATOM 0 H MET B 85 73.824 -7.991 -0.579 1.00 0.00 H new ATOM 0 HA MET B 85 72.298 -10.385 -0.664 1.00 0.00 H new ATOM 0 HB2 MET B 85 71.451 -8.008 -0.798 1.00 0.00 H new ATOM 0 HB3 MET B 85 72.021 -7.946 -2.454 1.00 0.00 H new ATOM 0 HG2 MET B 85 70.601 -9.929 -3.027 1.00 0.00 H new ATOM 0 HG3 MET B 85 70.044 -10.017 -1.367 1.00 0.00 H new ATOM 0 HE1 MET B 85 69.867 -6.499 -4.127 1.00 0.00 H new ATOM 0 HE2 MET B 85 70.659 -8.078 -4.345 1.00 0.00 H new ATOM 0 HE3 MET B 85 68.983 -7.839 -4.896 1.00 0.00 H new ATOM 2996 N CYS B 86 74.313 -9.834 -3.178 1.00 0.00 N ATOM 2997 CA CYS B 86 74.864 -10.475 -4.403 1.00 0.00 C ATOM 2998 C CYS B 86 76.328 -10.071 -4.592 1.00 0.00 C ATOM 2999 O CYS B 86 76.672 -9.348 -5.506 1.00 0.00 O ATOM 3000 CB CYS B 86 74.040 -10.056 -5.628 1.00 0.00 C ATOM 3001 SG CYS B 86 72.562 -11.093 -5.750 1.00 0.00 S ATOM 0 H CYS B 86 74.826 -9.019 -2.842 1.00 0.00 H new ATOM 0 HA CYS B 86 74.809 -11.558 -4.293 1.00 0.00 H new ATOM 0 HB2 CYS B 86 73.755 -9.007 -5.545 1.00 0.00 H new ATOM 0 HB3 CYS B 86 74.640 -10.153 -6.533 1.00 0.00 H new ATOM 0 HG CYS B 86 72.254 -11.550 -4.573 1.00 0.00 H new ATOM 3007 N ASN B 87 77.191 -10.542 -3.740 1.00 0.00 N ATOM 3008 CA ASN B 87 78.632 -10.198 -3.875 1.00 0.00 C ATOM 3009 C ASN B 87 79.247 -11.082 -4.958 1.00 0.00 C ATOM 3010 O ASN B 87 79.811 -10.605 -5.921 1.00 0.00 O ATOM 3011 CB ASN B 87 79.338 -10.461 -2.544 1.00 0.00 C ATOM 3012 CG ASN B 87 80.754 -9.888 -2.596 1.00 0.00 C ATOM 3013 OD1 ASN B 87 81.679 -10.559 -3.008 1.00 0.00 O ATOM 3014 ND2 ASN B 87 80.966 -8.670 -2.183 1.00 0.00 N ATOM 0 H ASN B 87 76.961 -11.151 -2.955 1.00 0.00 H new ATOM 0 HA ASN B 87 78.744 -9.148 -4.144 1.00 0.00 H new ATOM 0 HB2 ASN B 87 78.779 -10.004 -1.727 1.00 0.00 H new ATOM 0 HB3 ASN B 87 79.375 -11.532 -2.345 1.00 0.00 H new ATOM 0 HD21 ASN B 87 81.908 -8.281 -2.206 1.00 0.00 H new ATOM 0 HD22 ASN B 87 80.189 -8.106 -1.837 1.00 0.00 H new ATOM 3021 N GLU B 88 79.119 -12.371 -4.802 1.00 0.00 N ATOM 3022 CA GLU B 88 79.670 -13.320 -5.807 1.00 0.00 C ATOM 3023 C GLU B 88 79.273 -14.737 -5.396 1.00 0.00 C ATOM 3024 O GLU B 88 78.888 -15.550 -6.215 1.00 0.00 O ATOM 3025 CB GLU B 88 81.200 -13.212 -5.852 1.00 0.00 C ATOM 3026 CG GLU B 88 81.754 -14.185 -6.898 1.00 0.00 C ATOM 3027 CD GLU B 88 83.277 -14.064 -6.955 1.00 0.00 C ATOM 3028 OE1 GLU B 88 83.806 -13.172 -6.310 1.00 0.00 O ATOM 3029 OE2 GLU B 88 83.889 -14.860 -7.647 1.00 0.00 O ATOM 0 H GLU B 88 78.650 -12.811 -4.010 1.00 0.00 H new ATOM 0 HA GLU B 88 79.274 -13.083 -6.795 1.00 0.00 H new ATOM 0 HB2 GLU B 88 81.495 -12.192 -6.097 1.00 0.00 H new ATOM 0 HB3 GLU B 88 81.620 -13.439 -4.872 1.00 0.00 H new ATOM 0 HG2 GLU B 88 81.469 -15.207 -6.646 1.00 0.00 H new ATOM 0 HG3 GLU B 88 81.325 -13.967 -7.876 1.00 0.00 H new ATOM 3036 N PHE B 89 79.363 -15.040 -4.128 1.00 0.00 N ATOM 3037 CA PHE B 89 78.995 -16.403 -3.659 1.00 0.00 C ATOM 3038 C PHE B 89 77.499 -16.636 -3.875 1.00 0.00 C ATOM 3039 O PHE B 89 76.684 -15.762 -3.660 1.00 0.00 O ATOM 3040 CB PHE B 89 79.327 -16.548 -2.170 1.00 0.00 C ATOM 3041 CG PHE B 89 78.602 -15.485 -1.377 1.00 0.00 C ATOM 3042 CD1 PHE B 89 77.278 -15.691 -0.971 1.00 0.00 C ATOM 3043 CD2 PHE B 89 79.261 -14.298 -1.038 1.00 0.00 C ATOM 3044 CE1 PHE B 89 76.613 -14.708 -0.227 1.00 0.00 C ATOM 3045 CE2 PHE B 89 78.596 -13.314 -0.297 1.00 0.00 C ATOM 3046 CZ PHE B 89 77.272 -13.520 0.109 1.00 0.00 C ATOM 0 H PHE B 89 79.676 -14.400 -3.398 1.00 0.00 H new ATOM 0 HA PHE B 89 79.562 -17.141 -4.227 1.00 0.00 H new ATOM 0 HB2 PHE B 89 79.037 -17.538 -1.818 1.00 0.00 H new ATOM 0 HB3 PHE B 89 80.403 -16.458 -2.018 1.00 0.00 H new ATOM 0 HD1 PHE B 89 76.770 -16.608 -1.231 1.00 0.00 H new ATOM 0 HD2 PHE B 89 80.283 -14.141 -1.348 1.00 0.00 H new ATOM 0 HE1 PHE B 89 75.592 -14.867 0.087 1.00 0.00 H new ATOM 0 HE2 PHE B 89 79.104 -12.397 -0.039 1.00 0.00 H new ATOM 0 HZ PHE B 89 76.759 -12.762 0.682 1.00 0.00 H new ATOM 3056 N PHE B 90 77.137 -17.816 -4.299 1.00 0.00 N ATOM 3057 CA PHE B 90 75.699 -18.133 -4.537 1.00 0.00 C ATOM 3058 C PHE B 90 75.125 -18.774 -3.278 1.00 0.00 C ATOM 3059 O PHE B 90 73.972 -19.154 -3.223 1.00 0.00 O ATOM 3060 CB PHE B 90 75.593 -19.114 -5.703 1.00 0.00 C ATOM 3061 CG PHE B 90 76.337 -18.543 -6.883 1.00 0.00 C ATOM 3062 CD1 PHE B 90 75.678 -17.709 -7.791 1.00 0.00 C ATOM 3063 CD2 PHE B 90 77.693 -18.839 -7.059 1.00 0.00 C ATOM 3064 CE1 PHE B 90 76.376 -17.169 -8.876 1.00 0.00 C ATOM 3065 CE2 PHE B 90 78.390 -18.303 -8.144 1.00 0.00 C ATOM 3066 CZ PHE B 90 77.733 -17.465 -9.055 1.00 0.00 C ATOM 0 H PHE B 90 77.782 -18.582 -4.493 1.00 0.00 H new ATOM 0 HA PHE B 90 75.145 -17.225 -4.774 1.00 0.00 H new ATOM 0 HB2 PHE B 90 76.012 -20.080 -5.423 1.00 0.00 H new ATOM 0 HB3 PHE B 90 74.548 -19.283 -5.961 1.00 0.00 H new ATOM 0 HD1 PHE B 90 74.631 -17.482 -7.655 1.00 0.00 H new ATOM 0 HD2 PHE B 90 78.201 -19.482 -6.356 1.00 0.00 H new ATOM 0 HE1 PHE B 90 75.868 -16.523 -9.577 1.00 0.00 H new ATOM 0 HE2 PHE B 90 79.436 -18.534 -8.281 1.00 0.00 H new ATOM 0 HZ PHE B 90 78.272 -17.048 -9.893 1.00 0.00 H new ATOM 3076 N GLU B 91 75.939 -18.913 -2.271 1.00 0.00 N ATOM 3077 CA GLU B 91 75.470 -19.547 -1.004 1.00 0.00 C ATOM 3078 C GLU B 91 74.262 -18.781 -0.452 1.00 0.00 C ATOM 3079 O GLU B 91 74.249 -17.568 -0.403 1.00 0.00 O ATOM 3080 CB GLU B 91 76.606 -19.514 0.019 1.00 0.00 C ATOM 3081 CG GLU B 91 77.709 -20.479 -0.420 1.00 0.00 C ATOM 3082 CD GLU B 91 78.848 -20.450 0.599 1.00 0.00 C ATOM 3083 OE1 GLU B 91 78.826 -19.584 1.458 1.00 0.00 O ATOM 3084 OE2 GLU B 91 79.724 -21.294 0.503 1.00 0.00 O ATOM 0 H GLU B 91 76.914 -18.614 -2.269 1.00 0.00 H new ATOM 0 HA GLU B 91 75.176 -20.578 -1.200 1.00 0.00 H new ATOM 0 HB2 GLU B 91 77.004 -18.503 0.105 1.00 0.00 H new ATOM 0 HB3 GLU B 91 76.232 -19.794 1.004 1.00 0.00 H new ATOM 0 HG2 GLU B 91 77.310 -21.490 -0.506 1.00 0.00 H new ATOM 0 HG3 GLU B 91 78.081 -20.198 -1.405 1.00 0.00 H new ATOM 3091 N GLY B 92 73.244 -19.492 -0.039 1.00 0.00 N ATOM 3092 CA GLY B 92 72.023 -18.828 0.509 1.00 0.00 C ATOM 3093 C GLY B 92 72.167 -18.625 2.020 1.00 0.00 C ATOM 3094 O GLY B 92 71.190 -18.474 2.727 1.00 0.00 O ATOM 0 H GLY B 92 73.206 -20.511 -0.058 1.00 0.00 H new ATOM 0 HA2 GLY B 92 71.871 -17.867 0.018 1.00 0.00 H new ATOM 0 HA3 GLY B 92 71.143 -19.436 0.298 1.00 0.00 H new ATOM 3098 N PHE B 93 73.370 -18.627 2.525 1.00 0.00 N ATOM 3099 CA PHE B 93 73.551 -18.441 3.993 1.00 0.00 C ATOM 3100 C PHE B 93 73.166 -16.994 4.367 1.00 0.00 C ATOM 3101 O PHE B 93 73.268 -16.105 3.546 1.00 0.00 O ATOM 3102 CB PHE B 93 75.023 -18.702 4.359 1.00 0.00 C ATOM 3103 CG PHE B 93 75.248 -20.188 4.567 1.00 0.00 C ATOM 3104 CD1 PHE B 93 75.047 -21.085 3.509 1.00 0.00 C ATOM 3105 CD2 PHE B 93 75.655 -20.669 5.821 1.00 0.00 C ATOM 3106 CE1 PHE B 93 75.249 -22.456 3.705 1.00 0.00 C ATOM 3107 CE2 PHE B 93 75.857 -22.040 6.014 1.00 0.00 C ATOM 3108 CZ PHE B 93 75.654 -22.934 4.957 1.00 0.00 C ATOM 0 H PHE B 93 74.230 -18.748 1.990 1.00 0.00 H new ATOM 0 HA PHE B 93 72.916 -19.138 4.540 1.00 0.00 H new ATOM 0 HB2 PHE B 93 75.675 -18.334 3.566 1.00 0.00 H new ATOM 0 HB3 PHE B 93 75.284 -18.156 5.265 1.00 0.00 H new ATOM 0 HD1 PHE B 93 74.736 -20.718 2.542 1.00 0.00 H new ATOM 0 HD2 PHE B 93 75.812 -19.980 6.638 1.00 0.00 H new ATOM 0 HE1 PHE B 93 75.092 -23.146 2.889 1.00 0.00 H new ATOM 0 HE2 PHE B 93 76.170 -22.409 6.980 1.00 0.00 H new ATOM 0 HZ PHE B 93 75.810 -23.992 5.107 1.00 0.00 H new ATOM 3118 N PRO B 94 72.726 -16.746 5.589 1.00 0.00 N ATOM 3119 CA PRO B 94 72.337 -15.361 5.996 1.00 0.00 C ATOM 3120 C PRO B 94 73.557 -14.433 6.119 1.00 0.00 C ATOM 3121 O PRO B 94 74.039 -14.159 7.200 1.00 0.00 O ATOM 3122 CB PRO B 94 71.672 -15.602 7.362 1.00 0.00 C ATOM 3123 CG PRO B 94 72.125 -16.981 7.864 1.00 0.00 C ATOM 3124 CD PRO B 94 72.583 -17.797 6.644 1.00 0.00 C ATOM 0 HA PRO B 94 71.691 -14.863 5.273 1.00 0.00 H new ATOM 0 HB2 PRO B 94 71.959 -14.824 8.070 1.00 0.00 H new ATOM 0 HB3 PRO B 94 70.586 -15.566 7.271 1.00 0.00 H new ATOM 0 HG2 PRO B 94 72.939 -16.878 8.582 1.00 0.00 H new ATOM 0 HG3 PRO B 94 71.308 -17.488 8.378 1.00 0.00 H new ATOM 0 HD2 PRO B 94 73.524 -18.315 6.832 1.00 0.00 H new ATOM 0 HD3 PRO B 94 71.852 -18.556 6.365 1.00 0.00 H new ATOM 3132 N ASP B 95 74.054 -13.948 5.013 1.00 0.00 N ATOM 3133 CA ASP B 95 75.237 -13.039 5.049 1.00 0.00 C ATOM 3134 C ASP B 95 74.761 -11.586 4.989 1.00 0.00 C ATOM 3135 O ASP B 95 75.477 -10.669 5.341 1.00 0.00 O ATOM 3136 CB ASP B 95 76.123 -13.335 3.838 1.00 0.00 C ATOM 3137 CG ASP B 95 77.459 -12.605 3.984 1.00 0.00 C ATOM 3138 OD1 ASP B 95 77.442 -11.389 4.073 1.00 0.00 O ATOM 3139 OD2 ASP B 95 78.478 -13.276 4.001 1.00 0.00 O ATOM 0 H ASP B 95 73.689 -14.143 4.081 1.00 0.00 H new ATOM 0 HA ASP B 95 75.801 -13.197 5.968 1.00 0.00 H new ATOM 0 HB2 ASP B 95 76.292 -14.408 3.753 1.00 0.00 H new ATOM 0 HB3 ASP B 95 75.623 -13.018 2.923 1.00 0.00 H new ATOM 3144 N LYS B 96 73.550 -11.372 4.544 1.00 0.00 N ATOM 3145 CA LYS B 96 73.000 -9.984 4.447 1.00 0.00 C ATOM 3146 C LYS B 96 72.071 -9.707 5.632 1.00 0.00 C ATOM 3147 O LYS B 96 71.282 -8.783 5.604 1.00 0.00 O ATOM 3148 CB LYS B 96 72.209 -9.845 3.139 1.00 0.00 C ATOM 3149 CG LYS B 96 70.938 -10.701 3.202 1.00 0.00 C ATOM 3150 CD LYS B 96 70.286 -10.755 1.820 1.00 0.00 C ATOM 3151 CE LYS B 96 68.900 -11.393 1.937 1.00 0.00 C ATOM 3152 NZ LYS B 96 69.039 -12.811 2.372 1.00 0.00 N ATOM 0 H LYS B 96 72.911 -12.107 4.240 1.00 0.00 H new ATOM 0 HA LYS B 96 73.822 -9.269 4.462 1.00 0.00 H new ATOM 0 HB2 LYS B 96 71.946 -8.800 2.973 1.00 0.00 H new ATOM 0 HB3 LYS B 96 72.826 -10.157 2.296 1.00 0.00 H new ATOM 0 HG2 LYS B 96 71.182 -11.708 3.539 1.00 0.00 H new ATOM 0 HG3 LYS B 96 70.241 -10.282 3.928 1.00 0.00 H new ATOM 0 HD2 LYS B 96 70.202 -9.750 1.406 1.00 0.00 H new ATOM 0 HD3 LYS B 96 70.907 -11.332 1.135 1.00 0.00 H new ATOM 0 HE2 LYS B 96 68.293 -10.840 2.654 1.00 0.00 H new ATOM 0 HE3 LYS B 96 68.384 -11.345 0.978 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 68.133 -13.305 2.241 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 69.774 -13.278 1.803 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 69.308 -12.841 3.376 1.00 0.00 H new ATOM 3166 N GLN B 97 72.136 -10.502 6.665 1.00 0.00 N ATOM 3167 CA GLN B 97 71.229 -10.269 7.824 1.00 0.00 C ATOM 3168 C GLN B 97 71.660 -8.981 8.552 1.00 0.00 C ATOM 3169 O GLN B 97 72.831 -8.651 8.564 1.00 0.00 O ATOM 3170 CB GLN B 97 71.329 -11.461 8.784 1.00 0.00 C ATOM 3171 CG GLN B 97 72.759 -11.569 9.322 1.00 0.00 C ATOM 3172 CD GLN B 97 72.926 -12.897 10.062 1.00 0.00 C ATOM 3173 OE1 GLN B 97 71.959 -13.587 10.323 1.00 0.00 O ATOM 3174 NE2 GLN B 97 74.121 -13.289 10.415 1.00 0.00 N ATOM 0 H GLN B 97 72.771 -11.295 6.757 1.00 0.00 H new ATOM 0 HA GLN B 97 70.201 -10.164 7.478 1.00 0.00 H new ATOM 0 HB2 GLN B 97 70.628 -11.336 9.609 1.00 0.00 H new ATOM 0 HB3 GLN B 97 71.053 -12.381 8.268 1.00 0.00 H new ATOM 0 HG2 GLN B 97 73.474 -11.505 8.501 1.00 0.00 H new ATOM 0 HG3 GLN B 97 72.970 -10.737 9.994 1.00 0.00 H new ATOM 0 HE21 GLN B 97 74.933 -12.711 10.197 1.00 0.00 H new ATOM 0 HE22 GLN B 97 74.243 -14.173 10.909 1.00 0.00 H new ATOM 3183 N PRO B 98 70.744 -8.249 9.162 1.00 0.00 N ATOM 3184 CA PRO B 98 71.125 -6.997 9.883 1.00 0.00 C ATOM 3185 C PRO B 98 71.945 -7.279 11.149 1.00 0.00 C ATOM 3186 O PRO B 98 71.996 -8.392 11.636 1.00 0.00 O ATOM 3187 CB PRO B 98 69.752 -6.394 10.234 1.00 0.00 C ATOM 3188 CG PRO B 98 68.707 -7.510 10.106 1.00 0.00 C ATOM 3189 CD PRO B 98 69.287 -8.590 9.179 1.00 0.00 C ATOM 0 HA PRO B 98 71.762 -6.341 9.289 1.00 0.00 H new ATOM 0 HB2 PRO B 98 69.759 -5.991 11.247 1.00 0.00 H new ATOM 0 HB3 PRO B 98 69.514 -5.568 9.563 1.00 0.00 H new ATOM 0 HG2 PRO B 98 68.475 -7.930 11.084 1.00 0.00 H new ATOM 0 HG3 PRO B 98 67.775 -7.117 9.699 1.00 0.00 H new ATOM 0 HD2 PRO B 98 69.109 -9.594 9.564 1.00 0.00 H new ATOM 0 HD3 PRO B 98 68.848 -8.548 8.182 1.00 0.00 H new ATOM 3197 N ARG B 99 72.580 -6.271 11.688 1.00 0.00 N ATOM 3198 CA ARG B 99 73.389 -6.462 12.927 1.00 0.00 C ATOM 3199 C ARG B 99 72.502 -6.205 14.149 1.00 0.00 C ATOM 3200 O ARG B 99 72.910 -6.395 15.278 1.00 0.00 O ATOM 3201 CB ARG B 99 74.559 -5.473 12.926 1.00 0.00 C ATOM 3202 CG ARG B 99 75.553 -5.860 11.829 1.00 0.00 C ATOM 3203 CD ARG B 99 76.723 -4.873 11.823 1.00 0.00 C ATOM 3204 NE ARG B 99 77.452 -4.957 13.120 1.00 0.00 N ATOM 3205 CZ ARG B 99 78.652 -4.457 13.227 1.00 0.00 C ATOM 3206 NH1 ARG B 99 79.218 -3.888 12.196 1.00 0.00 N ATOM 3207 NH2 ARG B 99 79.290 -4.529 14.363 1.00 0.00 N ATOM 0 H ARG B 99 72.573 -5.319 11.321 1.00 0.00 H new ATOM 0 HA ARG B 99 73.776 -7.480 12.963 1.00 0.00 H new ATOM 0 HB2 ARG B 99 74.193 -4.460 12.759 1.00 0.00 H new ATOM 0 HB3 ARG B 99 75.053 -5.477 13.897 1.00 0.00 H new ATOM 0 HG2 ARG B 99 75.919 -6.873 11.997 1.00 0.00 H new ATOM 0 HG3 ARG B 99 75.057 -5.858 10.858 1.00 0.00 H new ATOM 0 HD2 ARG B 99 77.399 -5.099 10.999 1.00 0.00 H new ATOM 0 HD3 ARG B 99 76.356 -3.859 11.665 1.00 0.00 H new ATOM 0 HE ARG B 99 77.013 -5.405 13.924 1.00 0.00 H new ATOM 0 HH11 ARG B 99 78.721 -3.835 11.307 1.00 0.00 H new ATOM 0 HH12 ARG B 99 80.156 -3.497 12.281 1.00 0.00 H new ATOM 0 HH21 ARG B 99 78.850 -4.976 15.167 1.00 0.00 H new ATOM 0 HH22 ARG B 99 80.228 -4.138 14.447 1.00 0.00 H new ATOM 3221 N LYS B 100 71.290 -5.769 13.929 1.00 0.00 N ATOM 3222 CA LYS B 100 70.367 -5.493 15.070 1.00 0.00 C ATOM 3223 C LYS B 100 69.943 -6.808 15.733 1.00 0.00 C ATOM 3224 O LYS B 100 69.848 -7.836 15.091 1.00 0.00 O ATOM 3225 CB LYS B 100 69.124 -4.762 14.552 1.00 0.00 C ATOM 3226 CG LYS B 100 69.542 -3.442 13.902 1.00 0.00 C ATOM 3227 CD LYS B 100 68.372 -2.867 13.095 1.00 0.00 C ATOM 3228 CE LYS B 100 67.178 -2.595 14.016 1.00 0.00 C ATOM 3229 NZ LYS B 100 67.646 -1.930 15.265 1.00 0.00 N ATOM 0 H LYS B 100 70.898 -5.591 13.004 1.00 0.00 H new ATOM 0 HA LYS B 100 70.882 -4.873 15.804 1.00 0.00 H new ATOM 0 HB2 LYS B 100 68.598 -5.385 13.829 1.00 0.00 H new ATOM 0 HB3 LYS B 100 68.432 -4.572 15.373 1.00 0.00 H new ATOM 0 HG2 LYS B 100 69.852 -2.731 14.668 1.00 0.00 H new ATOM 0 HG3 LYS B 100 70.401 -3.603 13.250 1.00 0.00 H new ATOM 0 HD2 LYS B 100 68.679 -1.944 12.603 1.00 0.00 H new ATOM 0 HD3 LYS B 100 68.084 -3.566 12.310 1.00 0.00 H new ATOM 0 HE2 LYS B 100 66.451 -1.963 13.507 1.00 0.00 H new ATOM 0 HE3 LYS B 100 66.673 -3.530 14.258 1.00 0.00 H new ATOM 0 HZ1 LYS B 100 66.857 -1.407 15.696 1.00 0.00 H new ATOM 0 HZ2 LYS B 100 67.991 -2.649 15.933 1.00 0.00 H new ATOM 0 HZ3 LYS B 100 68.417 -1.269 15.039 1.00 0.00 H new ATOM 3243 N LYS B 101 69.674 -6.781 17.011 1.00 0.00 N ATOM 3244 CA LYS B 101 69.246 -8.026 17.712 1.00 0.00 C ATOM 3245 C LYS B 101 67.821 -8.377 17.277 1.00 0.00 C ATOM 3246 O LYS B 101 67.067 -7.459 16.997 1.00 0.00 O ATOM 3247 CB LYS B 101 69.283 -7.803 19.230 1.00 0.00 C ATOM 3248 CG LYS B 101 68.859 -9.087 19.956 1.00 0.00 C ATOM 3249 CD LYS B 101 68.897 -8.862 21.469 1.00 0.00 C ATOM 3250 CE LYS B 101 68.472 -10.147 22.183 1.00 0.00 C ATOM 3251 NZ LYS B 101 68.569 -9.958 23.659 1.00 0.00 N ATOM 3252 OXT LYS B 101 67.509 -9.554 17.235 1.00 0.00 O ATOM 0 H LYS B 101 69.732 -5.950 17.600 1.00 0.00 H new ATOM 0 HA LYS B 101 69.921 -8.843 17.456 1.00 0.00 H new ATOM 0 HB2 LYS B 101 70.287 -7.514 19.540 1.00 0.00 H new ATOM 0 HB3 LYS B 101 68.618 -6.984 19.503 1.00 0.00 H new ATOM 0 HG2 LYS B 101 67.854 -9.376 19.647 1.00 0.00 H new ATOM 0 HG3 LYS B 101 69.524 -9.906 19.684 1.00 0.00 H new ATOM 0 HD2 LYS B 101 69.901 -8.575 21.780 1.00 0.00 H new ATOM 0 HD3 LYS B 101 68.232 -8.043 21.743 1.00 0.00 H new ATOM 0 HE2 LYS B 101 67.450 -10.407 21.906 1.00 0.00 H new ATOM 0 HE3 LYS B 101 69.108 -10.975 21.870 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 68.280 -10.833 24.141 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 69.551 -9.730 23.916 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 67.945 -9.179 23.951 1.00 0.00 H new TER 3266 LYS B 101