USER MOD reduce.3.24.130724 H: found=0, std=0, add=1626, rem=0, adj=58 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 76 CYS SG : rot -44:sc= 0.392! USER MOD Set 1.2: B 80 SER OG : rot 154:sc= 1.19 USER MOD Set 1.3: B 84 MET CE :methyl -158:sc= -0.222 (180deg=-1.48!) USER MOD Set 2.1: A 80 SER OG : rot 155:sc= 1.26 USER MOD Set 2.2: A 84 MET CE :methyl -156:sc= -0.228 (180deg=-1.51) USER MOD Set 2.3: B 76 CYS SG : rot -49:sc= 0.516! USER MOD Set 3.1: B 31 LYS NZ :NH3+ -159:sc= -1.51 (180deg=-3.11!) USER MOD Set 3.2: B 61 ASN : amide:sc= -1.31 K(o=-2.8,f=-11!) USER MOD Set 4.1: B 50 THR OG1 : rot -98:sc= 0.657 USER MOD Set 4.2: B 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: B 20 SER OG : rot 6:sc= 0.638! USER MOD Set 5.2: B 26 LYS NZ :NH3+ -134:sc= -1.13 (180deg=-2.94!) USER MOD Set 6.1: A 50 THR OG1 : rot -97:sc= 0.668 USER MOD Set 6.2: A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 7.1: A 31 LYS NZ :NH3+ -163:sc= -1.37 (180deg=-2.69!) USER MOD Set 7.2: A 61 ASN : amide:sc= -1.34 K(o=-2.7,f=-11!) USER MOD Set 8.1: A 20 SER OG : rot 13:sc= 0.858 USER MOD Set 8.2: A 26 LYS NZ :NH3+ -136:sc= -1.06 (180deg=-2.95!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 162:sc= -0.865! (180deg=-2.15!) USER MOD Single : A 3 CYS SG : rot 170:sc= -0.595 USER MOD Single : A 7 LYS NZ :NH3+ 156:sc= -0.238 (180deg=-1.03) USER MOD Single : A 12 MET CE :methyl 158:sc= -0.216 (180deg=-1.48!) USER MOD Single : A 14 SER OG : rot 180:sc= -0.667 USER MOD Single : A 15 THR OG1 : rot -162:sc= 0.0548 USER MOD Single : A 17 HIS : no HE2:sc= -1.48 K(o=-1.5,f=-2.2) USER MOD Single : A 18 LYS NZ :NH3+ -161:sc= -0.0254 (180deg=-0.409) USER MOD Single : A 19 TYR OH : rot 165:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -151:sc= -0.117 (180deg=-0.932) USER MOD Single : A 30 ASN : amide:sc= -3.04! C(o=-3!,f=-12!) 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 87:sc= 1.21 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -155:sc= -0.0709 (180deg=-0.452) USER MOD Single : A 56 GLN : amide:sc= -0.0261 K(o=-0.026,f=-1.9!) USER MOD Single : A 57 LYS NZ :NH3+ 164:sc= -0.162 (180deg=-0.884) USER MOD Single : A 59 MET CE :methyl 154:sc= 0 (180deg=-0.178) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -99:sc= 0.515 USER MOD Single : A 65 ASN : amide:sc= -0.175 X(o=-0.17,f=-0.0023) USER MOD Single : A 68 ASN : amide:sc= -0.517 K(o=-0.52,f=-5.6!) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-1!) USER MOD Single : A 75 TYR OH : rot 180:sc= -0.401 USER MOD Single : A 81 CYS SG : rot 79:sc= 0.607 USER MOD Single : A 86 CYS SG : rot -54:sc= -0.062 USER MOD Single : A 87 ASN : amide:sc= -0.515! C(o=-0.51!,f=-10!) USER MOD Single : A 96 LYS NZ :NH3+ -162:sc= -0.0152 (180deg=-0.213) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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+ 159:sc= -0.773! (180deg=-2.1!) USER MOD Single : B 3 CYS SG : rot 170:sc= -0.589 USER MOD Single : B 7 LYS NZ :NH3+ 159:sc= -0.295 (180deg=-1.15) USER MOD Single : B 12 MET CE :methyl 159:sc= -0.216 (180deg=-1.43!) USER MOD Single : B 14 SER OG : rot 180:sc= -0.797 USER MOD Single : B 15 THR OG1 : rot -162:sc= 0.0548 USER MOD Single : B 17 HIS : no HE2:sc= -1.57 K(o=-1.6,f=-2.3) USER MOD Single : B 18 LYS NZ :NH3+ -162:sc= -0.032 (180deg=-0.343) USER MOD Single : B 19 TYR OH : rot 165:sc= 0 USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ -150:sc= -0.187 (180deg=-0.875) USER MOD Single : B 30 ASN : amide:sc= -3.15! C(o=-3.2!,f=-12!) 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 87:sc= 1.22 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ -154:sc= -0.0914 (180deg=-0.52) USER MOD Single : B 56 GLN : amide:sc= -0.0156 K(o=-0.016,f=-1.9!) USER MOD Single : B 57 LYS NZ :NH3+ 157:sc= -0.238 (180deg=-0.95) USER MOD Single : B 59 MET CE :methyl 161:sc= 0 (180deg=-0.163) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 64 SER OG : rot -97:sc= 0.5 USER MOD Single : B 65 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.0048) USER MOD Single : B 68 ASN : amide:sc= -0.524 K(o=-0.52,f=-5.6!) USER MOD Single : B 73 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : B 75 TYR OH : rot 180:sc= -0.335 USER MOD Single : B 81 CYS SG : rot 84:sc= 0.553 USER MOD Single : B 86 CYS SG : rot -57:sc=-0.00424 USER MOD Single : B 87 ASN : amide:sc= -0.638! C(o=-0.64!,f=-10!) USER MOD Single : B 96 LYS NZ :NH3+ -160:sc=-0.00832 (180deg=-0.269) USER MOD Single : B 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 79.987 0.193 -21.358 1.00 0.00 N ATOM 2 CA MET A 1 79.555 -0.867 -20.403 1.00 0.00 C ATOM 3 C MET A 1 78.229 -0.455 -19.755 1.00 0.00 C ATOM 4 O MET A 1 77.598 -1.230 -19.065 1.00 0.00 O ATOM 5 CB MET A 1 80.631 -1.053 -19.325 1.00 0.00 C ATOM 6 CG MET A 1 81.203 0.309 -18.919 1.00 0.00 C ATOM 7 SD MET A 1 82.423 0.843 -20.148 1.00 0.00 S ATOM 8 CE MET A 1 83.859 0.000 -19.437 1.00 0.00 C ATOM 0 H1 MET A 1 81.000 0.081 -21.566 1.00 0.00 H new ATOM 0 H2 MET A 1 79.441 0.110 -22.239 1.00 0.00 H new ATOM 0 H3 MET A 1 79.822 1.129 -20.936 1.00 0.00 H new ATOM 0 HA MET A 1 79.417 -1.809 -20.935 1.00 0.00 H new ATOM 0 HB2 MET A 1 80.204 -1.552 -18.455 1.00 0.00 H new ATOM 0 HB3 MET A 1 81.428 -1.694 -19.701 1.00 0.00 H new ATOM 0 HG2 MET A 1 80.402 1.044 -18.843 1.00 0.00 H new ATOM 0 HG3 MET A 1 81.668 0.242 -17.935 1.00 0.00 H new ATOM 0 HE1 MET A 1 84.738 0.199 -20.050 1.00 0.00 H new ATOM 0 HE2 MET A 1 84.032 0.366 -18.425 1.00 0.00 H new ATOM 0 HE3 MET A 1 83.673 -1.074 -19.407 1.00 0.00 H new ATOM 20 N ALA A 2 77.803 0.760 -19.978 1.00 0.00 N ATOM 21 CA ALA A 2 76.517 1.227 -19.383 1.00 0.00 C ATOM 22 C ALA A 2 76.581 1.130 -17.856 1.00 0.00 C ATOM 23 O ALA A 2 76.659 0.056 -17.293 1.00 0.00 O ATOM 24 CB ALA A 2 75.366 0.363 -19.906 1.00 0.00 C ATOM 0 H ALA A 2 78.292 1.451 -20.548 1.00 0.00 H new ATOM 0 HA ALA A 2 76.349 2.266 -19.667 1.00 0.00 H new ATOM 0 HB1 ALA A 2 74.427 0.705 -19.471 1.00 0.00 H new ATOM 0 HB2 ALA A 2 75.314 0.445 -20.992 1.00 0.00 H new ATOM 0 HB3 ALA A 2 75.537 -0.677 -19.629 1.00 0.00 H new ATOM 30 N CYS A 3 76.539 2.249 -17.183 1.00 0.00 N ATOM 31 CA CYS A 3 76.586 2.232 -15.693 1.00 0.00 C ATOM 32 C CYS A 3 77.814 1.447 -15.208 1.00 0.00 C ATOM 33 O CYS A 3 77.681 0.400 -14.605 1.00 0.00 O ATOM 34 CB CYS A 3 75.316 1.567 -15.160 1.00 0.00 C ATOM 35 SG CYS A 3 73.873 2.277 -15.992 1.00 0.00 S ATOM 0 H CYS A 3 76.474 3.176 -17.603 1.00 0.00 H new ATOM 0 HA CYS A 3 76.654 3.256 -15.326 1.00 0.00 H new ATOM 0 HB2 CYS A 3 75.356 0.491 -15.331 1.00 0.00 H new ATOM 0 HB3 CYS A 3 75.239 1.716 -14.083 1.00 0.00 H new ATOM 0 HG CYS A 3 72.817 1.575 -15.704 1.00 0.00 H new ATOM 41 N PRO A 4 79.006 1.944 -15.462 1.00 0.00 N ATOM 42 CA PRO A 4 80.244 1.240 -15.018 1.00 0.00 C ATOM 43 C PRO A 4 80.249 0.990 -13.503 1.00 0.00 C ATOM 44 O PRO A 4 81.102 0.300 -12.980 1.00 0.00 O ATOM 45 CB PRO A 4 81.362 2.215 -15.442 1.00 0.00 C ATOM 46 CG PRO A 4 80.734 3.344 -16.285 1.00 0.00 C ATOM 47 CD PRO A 4 79.199 3.225 -16.201 1.00 0.00 C ATOM 0 HA PRO A 4 80.352 0.247 -15.455 1.00 0.00 H new ATOM 0 HB2 PRO A 4 81.857 2.629 -14.563 1.00 0.00 H new ATOM 0 HB3 PRO A 4 82.123 1.690 -16.019 1.00 0.00 H new ATOM 0 HG2 PRO A 4 81.059 4.317 -15.916 1.00 0.00 H new ATOM 0 HG3 PRO A 4 81.063 3.270 -17.322 1.00 0.00 H new ATOM 0 HD2 PRO A 4 78.757 4.068 -15.671 1.00 0.00 H new ATOM 0 HD3 PRO A 4 78.741 3.194 -17.190 1.00 0.00 H new ATOM 55 N LEU A 5 79.298 1.542 -12.801 1.00 0.00 N ATOM 56 CA LEU A 5 79.238 1.337 -11.327 1.00 0.00 C ATOM 57 C LEU A 5 79.096 -0.157 -11.044 1.00 0.00 C ATOM 58 O LEU A 5 79.667 -0.682 -10.109 1.00 0.00 O ATOM 59 CB LEU A 5 78.033 2.097 -10.750 1.00 0.00 C ATOM 60 CG LEU A 5 77.950 1.899 -9.228 1.00 0.00 C ATOM 61 CD1 LEU A 5 79.222 2.434 -8.549 1.00 0.00 C ATOM 62 CD2 LEU A 5 76.723 2.648 -8.692 1.00 0.00 C ATOM 0 H LEU A 5 78.558 2.128 -13.187 1.00 0.00 H new ATOM 0 HA LEU A 5 80.148 1.714 -10.860 1.00 0.00 H new ATOM 0 HB2 LEU A 5 78.121 3.159 -10.980 1.00 0.00 H new ATOM 0 HB3 LEU A 5 77.115 1.744 -11.219 1.00 0.00 H new ATOM 0 HG LEU A 5 77.860 0.835 -9.008 1.00 0.00 H new ATOM 0 HD11 LEU A 5 79.149 2.287 -7.471 1.00 0.00 H new ATOM 0 HD12 LEU A 5 80.091 1.898 -8.930 1.00 0.00 H new ATOM 0 HD13 LEU A 5 79.329 3.497 -8.764 1.00 0.00 H new ATOM 0 HD21 LEU A 5 76.657 2.512 -7.612 1.00 0.00 H new ATOM 0 HD22 LEU A 5 76.817 3.710 -8.919 1.00 0.00 H new ATOM 0 HD23 LEU A 5 75.822 2.254 -9.163 1.00 0.00 H new ATOM 74 N GLU A 6 78.334 -0.844 -11.845 1.00 0.00 N ATOM 75 CA GLU A 6 78.145 -2.303 -11.627 1.00 0.00 C ATOM 76 C GLU A 6 79.506 -3.009 -11.711 1.00 0.00 C ATOM 77 O GLU A 6 79.821 -3.867 -10.911 1.00 0.00 O ATOM 78 CB GLU A 6 77.232 -2.840 -12.734 1.00 0.00 C ATOM 79 CG GLU A 6 76.935 -4.322 -12.498 1.00 0.00 C ATOM 80 CD GLU A 6 76.033 -4.844 -13.619 1.00 0.00 C ATOM 81 OE1 GLU A 6 75.542 -4.031 -14.385 1.00 0.00 O ATOM 82 OE2 GLU A 6 75.850 -6.048 -13.692 1.00 0.00 O ATOM 0 H GLU A 6 77.832 -0.457 -12.644 1.00 0.00 H new ATOM 0 HA GLU A 6 77.702 -2.484 -10.648 1.00 0.00 H new ATOM 0 HB2 GLU A 6 76.301 -2.273 -12.755 1.00 0.00 H new ATOM 0 HB3 GLU A 6 77.708 -2.707 -13.705 1.00 0.00 H new ATOM 0 HG2 GLU A 6 77.865 -4.891 -12.470 1.00 0.00 H new ATOM 0 HG3 GLU A 6 76.449 -4.458 -11.532 1.00 0.00 H new ATOM 89 N LYS A 7 80.318 -2.648 -12.671 1.00 0.00 N ATOM 90 CA LYS A 7 81.657 -3.288 -12.803 1.00 0.00 C ATOM 91 C LYS A 7 82.582 -2.762 -11.707 1.00 0.00 C ATOM 92 O LYS A 7 83.282 -3.510 -11.059 1.00 0.00 O ATOM 93 CB LYS A 7 82.244 -2.968 -14.178 1.00 0.00 C ATOM 94 CG LYS A 7 83.619 -3.631 -14.314 1.00 0.00 C ATOM 95 CD LYS A 7 84.092 -3.571 -15.774 1.00 0.00 C ATOM 96 CE LYS A 7 84.449 -2.132 -16.165 1.00 0.00 C ATOM 97 NZ LYS A 7 85.395 -1.554 -15.169 1.00 0.00 N ATOM 0 H LYS A 7 80.109 -1.935 -13.370 1.00 0.00 H new ATOM 0 HA LYS A 7 81.557 -4.369 -12.700 1.00 0.00 H new ATOM 0 HB2 LYS A 7 81.577 -3.326 -14.962 1.00 0.00 H new ATOM 0 HB3 LYS A 7 82.335 -1.889 -14.304 1.00 0.00 H new ATOM 0 HG2 LYS A 7 84.339 -3.128 -13.669 1.00 0.00 H new ATOM 0 HG3 LYS A 7 83.566 -4.668 -13.983 1.00 0.00 H new ATOM 0 HD2 LYS A 7 84.960 -4.216 -15.908 1.00 0.00 H new ATOM 0 HD3 LYS A 7 83.309 -3.949 -16.432 1.00 0.00 H new ATOM 0 HE2 LYS A 7 84.899 -2.117 -17.158 1.00 0.00 H new ATOM 0 HE3 LYS A 7 83.545 -1.525 -16.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 85.939 -0.786 -15.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 84.860 -1.178 -14.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 86.047 -2.294 -14.839 1.00 0.00 H new ATOM 111 N ALA A 8 82.573 -1.482 -11.473 1.00 0.00 N ATOM 112 CA ALA A 8 83.433 -0.933 -10.398 1.00 0.00 C ATOM 113 C ALA A 8 82.992 -1.600 -9.108 1.00 0.00 C ATOM 114 O ALA A 8 83.789 -1.994 -8.284 1.00 0.00 O ATOM 115 CB ALA A 8 83.264 0.578 -10.310 1.00 0.00 C ATOM 0 H ALA A 8 82.010 -0.797 -11.978 1.00 0.00 H new ATOM 0 HA ALA A 8 84.487 -1.129 -10.594 1.00 0.00 H new ATOM 0 HB1 ALA A 8 83.901 0.970 -9.517 1.00 0.00 H new ATOM 0 HB2 ALA A 8 83.547 1.032 -11.260 1.00 0.00 H new ATOM 0 HB3 ALA A 8 82.223 0.816 -10.090 1.00 0.00 H new ATOM 121 N LEU A 9 81.715 -1.786 -8.954 1.00 0.00 N ATOM 122 CA LEU A 9 81.232 -2.495 -7.753 1.00 0.00 C ATOM 123 C LEU A 9 81.868 -3.877 -7.793 1.00 0.00 C ATOM 124 O LEU A 9 82.317 -4.403 -6.793 1.00 0.00 O ATOM 125 CB LEU A 9 79.706 -2.612 -7.789 1.00 0.00 C ATOM 126 CG LEU A 9 79.200 -3.349 -6.542 1.00 0.00 C ATOM 127 CD1 LEU A 9 79.589 -2.581 -5.267 1.00 0.00 C ATOM 128 CD2 LEU A 9 77.675 -3.476 -6.627 1.00 0.00 C ATOM 0 H LEU A 9 80.992 -1.479 -9.605 1.00 0.00 H new ATOM 0 HA LEU A 9 81.498 -1.962 -6.840 1.00 0.00 H new ATOM 0 HB2 LEU A 9 79.259 -1.619 -7.839 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.396 -3.147 -8.687 1.00 0.00 H new ATOM 0 HG LEU A 9 79.655 -4.339 -6.499 1.00 0.00 H new ATOM 0 HD11 LEU A 9 79.222 -3.118 -4.392 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.674 -2.495 -5.211 1.00 0.00 H new ATOM 0 HD13 LEU A 9 79.147 -1.585 -5.293 1.00 0.00 H new ATOM 0 HD21 LEU A 9 77.304 -3.999 -5.745 1.00 0.00 H new ATOM 0 HD22 LEU A 9 77.229 -2.482 -6.674 1.00 0.00 H new ATOM 0 HD23 LEU A 9 77.406 -4.037 -7.522 1.00 0.00 H new ATOM 140 N ASP A 10 81.938 -4.455 -8.964 1.00 0.00 N ATOM 141 CA ASP A 10 82.579 -5.788 -9.090 1.00 0.00 C ATOM 142 C ASP A 10 84.076 -5.636 -8.809 1.00 0.00 C ATOM 143 O ASP A 10 84.701 -6.513 -8.246 1.00 0.00 O ATOM 144 CB ASP A 10 82.364 -6.349 -10.501 1.00 0.00 C ATOM 145 CG ASP A 10 82.799 -7.815 -10.539 1.00 0.00 C ATOM 146 OD1 ASP A 10 83.550 -8.213 -9.664 1.00 0.00 O ATOM 147 OD2 ASP A 10 82.371 -8.515 -11.442 1.00 0.00 O ATOM 0 H ASP A 10 81.579 -4.060 -9.833 1.00 0.00 H new ATOM 0 HA ASP A 10 82.134 -6.480 -8.375 1.00 0.00 H new ATOM 0 HB2 ASP A 10 81.314 -6.263 -10.782 1.00 0.00 H new ATOM 0 HB3 ASP A 10 82.937 -5.770 -11.225 1.00 0.00 H new ATOM 152 N VAL A 11 84.662 -4.527 -9.194 1.00 0.00 N ATOM 153 CA VAL A 11 86.123 -4.340 -8.936 1.00 0.00 C ATOM 154 C VAL A 11 86.367 -4.405 -7.424 1.00 0.00 C ATOM 155 O VAL A 11 87.321 -5.002 -6.964 1.00 0.00 O ATOM 156 CB VAL A 11 86.577 -2.972 -9.470 1.00 0.00 C ATOM 157 CG1 VAL A 11 88.010 -2.679 -9.017 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.517 -2.966 -11.000 1.00 0.00 C ATOM 0 H VAL A 11 84.198 -3.753 -9.670 1.00 0.00 H new ATOM 0 HA VAL A 11 86.689 -5.123 -9.441 1.00 0.00 H new ATOM 0 HB VAL A 11 85.912 -2.204 -9.076 1.00 0.00 H new ATOM 0 HG11 VAL A 11 88.321 -1.708 -9.401 1.00 0.00 H new ATOM 0 HG12 VAL A 11 88.053 -2.669 -7.928 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.678 -3.451 -9.399 1.00 0.00 H new ATOM 0 HG21 VAL A 11 86.840 -1.994 -11.373 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.174 -3.742 -11.393 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.494 -3.158 -11.325 1.00 0.00 H new ATOM 168 N MET A 12 85.502 -3.807 -6.648 1.00 0.00 N ATOM 169 CA MET A 12 85.674 -3.846 -5.166 1.00 0.00 C ATOM 170 C MET A 12 85.610 -5.299 -4.699 1.00 0.00 C ATOM 171 O MET A 12 86.338 -5.723 -3.824 1.00 0.00 O ATOM 172 CB MET A 12 84.533 -3.065 -4.512 1.00 0.00 C ATOM 173 CG MET A 12 84.700 -1.567 -4.784 1.00 0.00 C ATOM 174 SD MET A 12 83.110 -0.729 -4.553 1.00 0.00 S ATOM 175 CE MET A 12 82.656 -1.503 -2.982 1.00 0.00 C ATOM 0 H MET A 12 84.684 -3.293 -6.976 1.00 0.00 H new ATOM 0 HA MET A 12 86.632 -3.406 -4.890 1.00 0.00 H new ATOM 0 HB2 MET A 12 83.575 -3.409 -4.902 1.00 0.00 H new ATOM 0 HB3 MET A 12 84.524 -3.249 -3.438 1.00 0.00 H new ATOM 0 HG2 MET A 12 85.446 -1.145 -4.111 1.00 0.00 H new ATOM 0 HG3 MET A 12 85.062 -1.409 -5.800 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.931 -0.876 -2.464 1.00 0.00 H new ATOM 0 HE2 MET A 12 82.218 -2.483 -3.172 1.00 0.00 H new ATOM 0 HE3 MET A 12 83.545 -1.617 -2.362 1.00 0.00 H new ATOM 185 N VAL A 13 84.725 -6.057 -5.276 1.00 0.00 N ATOM 186 CA VAL A 13 84.582 -7.485 -4.883 1.00 0.00 C ATOM 187 C VAL A 13 85.666 -8.339 -5.552 1.00 0.00 C ATOM 188 O VAL A 13 86.296 -9.164 -4.921 1.00 0.00 O ATOM 189 CB VAL A 13 83.202 -7.983 -5.320 1.00 0.00 C ATOM 190 CG1 VAL A 13 83.039 -9.454 -4.925 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.110 -7.136 -4.650 1.00 0.00 C ATOM 0 H VAL A 13 84.088 -5.747 -6.010 1.00 0.00 H new ATOM 0 HA VAL A 13 84.690 -7.570 -3.802 1.00 0.00 H new ATOM 0 HB VAL A 13 83.109 -7.891 -6.402 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.056 -9.808 -5.237 1.00 0.00 H new ATOM 0 HG12 VAL A 13 83.810 -10.049 -5.413 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.134 -9.553 -3.844 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.129 -7.493 -4.963 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.198 -7.220 -3.567 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.227 -6.093 -4.944 1.00 0.00 H new ATOM 201 N SER A 14 85.872 -8.165 -6.832 1.00 0.00 N ATOM 202 CA SER A 14 86.897 -8.987 -7.543 1.00 0.00 C ATOM 203 C SER A 14 88.279 -8.759 -6.925 1.00 0.00 C ATOM 204 O SER A 14 89.011 -9.691 -6.656 1.00 0.00 O ATOM 205 CB SER A 14 86.926 -8.584 -9.017 1.00 0.00 C ATOM 206 OG SER A 14 87.541 -7.309 -9.142 1.00 0.00 O ATOM 0 H SER A 14 85.376 -7.491 -7.415 1.00 0.00 H new ATOM 0 HA SER A 14 86.639 -10.042 -7.450 1.00 0.00 H new ATOM 0 HB2 SER A 14 87.476 -9.325 -9.598 1.00 0.00 H new ATOM 0 HB3 SER A 14 85.913 -8.553 -9.418 1.00 0.00 H new ATOM 0 HG SER A 14 87.563 -7.047 -10.086 1.00 0.00 H new ATOM 212 N THR A 15 88.639 -7.528 -6.693 1.00 0.00 N ATOM 213 CA THR A 15 89.968 -7.235 -6.087 1.00 0.00 C ATOM 214 C THR A 15 90.023 -7.839 -4.685 1.00 0.00 C ATOM 215 O THR A 15 91.026 -8.368 -4.255 1.00 0.00 O ATOM 216 CB THR A 15 90.170 -5.714 -6.031 1.00 0.00 C ATOM 217 OG1 THR A 15 91.558 -5.427 -5.936 1.00 0.00 O ATOM 218 CG2 THR A 15 89.437 -5.105 -4.829 1.00 0.00 C ATOM 0 H THR A 15 88.068 -6.708 -6.898 1.00 0.00 H new ATOM 0 HA THR A 15 90.764 -7.673 -6.689 1.00 0.00 H new ATOM 0 HB THR A 15 89.759 -5.276 -6.941 1.00 0.00 H new ATOM 0 HG1 THR A 15 91.681 -4.506 -5.623 1.00 0.00 H new ATOM 0 HG21 THR A 15 89.597 -4.027 -4.813 1.00 0.00 H new ATOM 0 HG22 THR A 15 88.370 -5.313 -4.910 1.00 0.00 H new ATOM 0 HG23 THR A 15 89.823 -5.542 -3.908 1.00 0.00 H new ATOM 226 N PHE A 16 88.940 -7.743 -3.974 1.00 0.00 N ATOM 227 CA PHE A 16 88.891 -8.283 -2.585 1.00 0.00 C ATOM 228 C PHE A 16 89.172 -9.789 -2.608 1.00 0.00 C ATOM 229 O PHE A 16 89.867 -10.313 -1.760 1.00 0.00 O ATOM 230 CB PHE A 16 87.488 -8.039 -2.025 1.00 0.00 C ATOM 231 CG PHE A 16 87.384 -8.569 -0.615 1.00 0.00 C ATOM 232 CD1 PHE A 16 86.971 -9.888 -0.394 1.00 0.00 C ATOM 233 CD2 PHE A 16 87.687 -7.738 0.470 1.00 0.00 C ATOM 234 CE1 PHE A 16 86.863 -10.377 0.913 1.00 0.00 C ATOM 235 CE2 PHE A 16 87.575 -8.228 1.778 1.00 0.00 C ATOM 236 CZ PHE A 16 87.164 -9.547 1.998 1.00 0.00 C ATOM 0 H PHE A 16 88.075 -7.309 -4.296 1.00 0.00 H new ATOM 0 HA PHE A 16 89.640 -7.790 -1.965 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.266 -6.972 -2.036 1.00 0.00 H new ATOM 0 HB3 PHE A 16 86.747 -8.526 -2.659 1.00 0.00 H new ATOM 0 HD1 PHE A 16 86.736 -10.528 -1.232 1.00 0.00 H new ATOM 0 HD2 PHE A 16 88.007 -6.721 0.299 1.00 0.00 H new ATOM 0 HE1 PHE A 16 86.547 -11.396 1.084 1.00 0.00 H new ATOM 0 HE2 PHE A 16 87.806 -7.587 2.616 1.00 0.00 H new ATOM 0 HZ PHE A 16 87.079 -9.925 3.006 1.00 0.00 H new ATOM 246 N HIS A 17 88.645 -10.486 -3.575 1.00 0.00 N ATOM 247 CA HIS A 17 88.887 -11.956 -3.657 1.00 0.00 C ATOM 248 C HIS A 17 90.330 -12.212 -4.079 1.00 0.00 C ATOM 249 O HIS A 17 90.887 -13.256 -3.808 1.00 0.00 O ATOM 250 CB HIS A 17 87.943 -12.581 -4.684 1.00 0.00 C ATOM 251 CG HIS A 17 86.524 -12.453 -4.210 1.00 0.00 C ATOM 252 ND1 HIS A 17 86.132 -12.836 -2.934 1.00 0.00 N ATOM 253 CD2 HIS A 17 85.390 -11.991 -4.829 1.00 0.00 C ATOM 254 CE1 HIS A 17 84.811 -12.599 -2.829 1.00 0.00 C ATOM 255 NE2 HIS A 17 84.314 -12.085 -3.955 1.00 0.00 N ATOM 0 H HIS A 17 88.056 -10.102 -4.314 1.00 0.00 H new ATOM 0 HA HIS A 17 88.705 -12.403 -2.680 1.00 0.00 H new ATOM 0 HB2 HIS A 17 88.060 -12.087 -5.648 1.00 0.00 H new ATOM 0 HB3 HIS A 17 88.194 -13.631 -4.831 1.00 0.00 H new ATOM 0 HD1 HIS A 17 86.735 -13.226 -2.209 1.00 0.00 H new ATOM 0 HD2 HIS A 17 85.341 -11.613 -5.839 1.00 0.00 H new ATOM 0 HE1 HIS A 17 84.226 -12.800 -1.943 1.00 0.00 H new ATOM 264 N LYS A 18 90.946 -11.271 -4.741 1.00 0.00 N ATOM 265 CA LYS A 18 92.350 -11.484 -5.168 1.00 0.00 C ATOM 266 C LYS A 18 93.176 -11.712 -3.914 1.00 0.00 C ATOM 267 O LYS A 18 94.030 -12.576 -3.864 1.00 0.00 O ATOM 268 CB LYS A 18 92.856 -10.250 -5.909 1.00 0.00 C ATOM 269 CG LYS A 18 94.220 -10.555 -6.521 1.00 0.00 C ATOM 270 CD LYS A 18 94.731 -9.323 -7.264 1.00 0.00 C ATOM 271 CE LYS A 18 96.090 -9.639 -7.882 1.00 0.00 C ATOM 272 NZ LYS A 18 97.096 -9.810 -6.798 1.00 0.00 N ATOM 0 H LYS A 18 90.539 -10.373 -5.001 1.00 0.00 H new ATOM 0 HA LYS A 18 92.426 -12.340 -5.838 1.00 0.00 H new ATOM 0 HB2 LYS A 18 92.150 -9.965 -6.689 1.00 0.00 H new ATOM 0 HB3 LYS A 18 92.932 -9.406 -5.224 1.00 0.00 H new ATOM 0 HG2 LYS A 18 94.925 -10.841 -5.740 1.00 0.00 H new ATOM 0 HG3 LYS A 18 94.143 -11.400 -7.205 1.00 0.00 H new ATOM 0 HD2 LYS A 18 94.024 -9.032 -8.041 1.00 0.00 H new ATOM 0 HD3 LYS A 18 94.817 -8.480 -6.579 1.00 0.00 H new ATOM 0 HE2 LYS A 18 96.027 -10.547 -8.482 1.00 0.00 H new ATOM 0 HE3 LYS A 18 96.394 -8.835 -8.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 98.053 -9.704 -7.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 96.942 -9.089 -6.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 96.997 -10.757 -6.379 1.00 0.00 H new ATOM 286 N TYR A 19 92.894 -10.976 -2.881 1.00 0.00 N ATOM 287 CA TYR A 19 93.626 -11.191 -1.609 1.00 0.00 C ATOM 288 C TYR A 19 93.167 -12.527 -1.050 1.00 0.00 C ATOM 289 O TYR A 19 93.935 -13.280 -0.485 1.00 0.00 O ATOM 290 CB TYR A 19 93.301 -10.067 -0.623 1.00 0.00 C ATOM 291 CG TYR A 19 93.932 -8.784 -1.104 1.00 0.00 C ATOM 292 CD1 TYR A 19 95.233 -8.449 -0.708 1.00 0.00 C ATOM 293 CD2 TYR A 19 93.217 -7.929 -1.949 1.00 0.00 C ATOM 294 CE1 TYR A 19 95.817 -7.258 -1.157 1.00 0.00 C ATOM 295 CE2 TYR A 19 93.799 -6.738 -2.399 1.00 0.00 C ATOM 296 CZ TYR A 19 95.099 -6.402 -2.002 1.00 0.00 C ATOM 297 OH TYR A 19 95.673 -5.228 -2.446 1.00 0.00 O ATOM 0 H TYR A 19 92.191 -10.237 -2.862 1.00 0.00 H new ATOM 0 HA TYR A 19 94.703 -11.191 -1.774 1.00 0.00 H new ATOM 0 HB2 TYR A 19 92.221 -9.945 -0.536 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.674 -10.319 0.370 1.00 0.00 H new ATOM 0 HD1 TYR A 19 95.786 -9.109 -0.056 1.00 0.00 H new ATOM 0 HD2 TYR A 19 92.214 -8.188 -2.255 1.00 0.00 H new ATOM 0 HE1 TYR A 19 96.820 -7.000 -0.852 1.00 0.00 H new ATOM 0 HE2 TYR A 19 93.246 -6.079 -3.052 1.00 0.00 H new ATOM 0 HH TYR A 19 95.154 -4.874 -3.198 1.00 0.00 H new ATOM 307 N SER A 20 91.906 -12.829 -1.213 1.00 0.00 N ATOM 308 CA SER A 20 91.371 -14.119 -0.706 1.00 0.00 C ATOM 309 C SER A 20 91.774 -14.287 0.754 1.00 0.00 C ATOM 310 O SER A 20 91.612 -15.337 1.342 1.00 0.00 O ATOM 311 CB SER A 20 91.956 -15.258 -1.534 1.00 0.00 C ATOM 312 OG SER A 20 91.814 -16.480 -0.824 1.00 0.00 O ATOM 0 H SER A 20 91.223 -12.232 -1.679 1.00 0.00 H new ATOM 0 HA SER A 20 90.284 -14.131 -0.786 1.00 0.00 H new ATOM 0 HB2 SER A 20 91.446 -15.322 -2.495 1.00 0.00 H new ATOM 0 HB3 SER A 20 93.008 -15.067 -1.743 1.00 0.00 H new ATOM 0 HG SER A 20 91.198 -16.352 -0.073 1.00 0.00 H new ATOM 318 N GLY A 21 92.306 -13.253 1.337 1.00 0.00 N ATOM 319 CA GLY A 21 92.734 -13.336 2.761 1.00 0.00 C ATOM 320 C GLY A 21 94.111 -13.990 2.829 1.00 0.00 C ATOM 321 O GLY A 21 94.779 -13.940 3.840 1.00 0.00 O ATOM 0 H GLY A 21 92.464 -12.350 0.889 1.00 0.00 H new ATOM 0 HA2 GLY A 21 92.768 -12.340 3.202 1.00 0.00 H new ATOM 0 HA3 GLY A 21 92.013 -13.916 3.338 1.00 0.00 H new ATOM 325 N LYS A 22 94.527 -14.611 1.755 1.00 0.00 N ATOM 326 CA LYS A 22 95.861 -15.289 1.716 1.00 0.00 C ATOM 327 C LYS A 22 95.893 -16.427 2.742 1.00 0.00 C ATOM 328 O LYS A 22 96.730 -17.305 2.686 1.00 0.00 O ATOM 329 CB LYS A 22 96.977 -14.286 2.042 1.00 0.00 C ATOM 330 CG LYS A 22 96.824 -12.982 1.208 1.00 0.00 C ATOM 331 CD LYS A 22 97.718 -13.018 -0.047 1.00 0.00 C ATOM 332 CE LYS A 22 97.223 -14.084 -1.035 1.00 0.00 C ATOM 333 NZ LYS A 22 97.653 -13.715 -2.415 1.00 0.00 N ATOM 0 H LYS A 22 93.991 -14.679 0.890 1.00 0.00 H new ATOM 0 HA LYS A 22 96.019 -15.690 0.715 1.00 0.00 H new ATOM 0 HB2 LYS A 22 96.954 -14.046 3.105 1.00 0.00 H new ATOM 0 HB3 LYS A 22 97.947 -14.739 1.839 1.00 0.00 H new ATOM 0 HG2 LYS A 22 95.782 -12.856 0.913 1.00 0.00 H new ATOM 0 HG3 LYS A 22 97.088 -12.121 1.822 1.00 0.00 H new ATOM 0 HD2 LYS A 22 97.717 -12.040 -0.529 1.00 0.00 H new ATOM 0 HD3 LYS A 22 98.748 -13.231 0.240 1.00 0.00 H new ATOM 0 HE2 LYS A 22 97.625 -15.061 -0.765 1.00 0.00 H new ATOM 0 HE3 LYS A 22 96.137 -14.163 -0.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 97.319 -14.435 -3.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 97.249 -12.791 -2.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 98.691 -13.661 -2.452 1.00 0.00 H new ATOM 347 N GLU A 23 94.978 -16.421 3.668 1.00 0.00 N ATOM 348 CA GLU A 23 94.923 -17.500 4.698 1.00 0.00 C ATOM 349 C GLU A 23 94.001 -18.608 4.187 1.00 0.00 C ATOM 350 O GLU A 23 93.795 -19.617 4.829 1.00 0.00 O ATOM 351 CB GLU A 23 94.373 -16.913 6.003 1.00 0.00 C ATOM 352 CG GLU A 23 94.488 -17.940 7.131 1.00 0.00 C ATOM 353 CD GLU A 23 94.170 -17.264 8.465 1.00 0.00 C ATOM 354 OE1 GLU A 23 93.980 -16.058 8.464 1.00 0.00 O ATOM 355 OE2 GLU A 23 94.123 -17.961 9.465 1.00 0.00 O ATOM 0 H GLU A 23 94.256 -15.707 3.758 1.00 0.00 H new ATOM 0 HA GLU A 23 95.916 -17.909 4.884 1.00 0.00 H new ATOM 0 HB2 GLU A 23 94.924 -16.010 6.265 1.00 0.00 H new ATOM 0 HB3 GLU A 23 93.331 -16.623 5.870 1.00 0.00 H new ATOM 0 HG2 GLU A 23 93.800 -18.767 6.956 1.00 0.00 H new ATOM 0 HG3 GLU A 23 95.493 -18.361 7.154 1.00 0.00 H new ATOM 362 N GLY A 24 93.447 -18.421 3.018 1.00 0.00 N ATOM 363 CA GLY A 24 92.530 -19.445 2.433 1.00 0.00 C ATOM 364 C GLY A 24 91.078 -19.039 2.686 1.00 0.00 C ATOM 365 O GLY A 24 90.157 -19.628 2.156 1.00 0.00 O ATOM 0 H GLY A 24 93.592 -17.595 2.438 1.00 0.00 H new ATOM 0 HA2 GLY A 24 92.710 -19.540 1.362 1.00 0.00 H new ATOM 0 HA3 GLY A 24 92.728 -20.421 2.877 1.00 0.00 H new ATOM 369 N ASP A 25 90.862 -18.031 3.490 1.00 0.00 N ATOM 370 CA ASP A 25 89.465 -17.582 3.778 1.00 0.00 C ATOM 371 C ASP A 25 89.092 -16.440 2.829 1.00 0.00 C ATOM 372 O ASP A 25 89.624 -15.350 2.915 1.00 0.00 O ATOM 373 CB ASP A 25 89.386 -17.089 5.223 1.00 0.00 C ATOM 374 CG ASP A 25 90.364 -15.929 5.420 1.00 0.00 C ATOM 375 OD1 ASP A 25 91.283 -15.815 4.626 1.00 0.00 O ATOM 376 OD2 ASP A 25 90.178 -15.175 6.360 1.00 0.00 O ATOM 0 H ASP A 25 91.593 -17.498 3.961 1.00 0.00 H new ATOM 0 HA ASP A 25 88.774 -18.413 3.634 1.00 0.00 H new ATOM 0 HB2 ASP A 25 88.371 -16.766 5.453 1.00 0.00 H new ATOM 0 HB3 ASP A 25 89.625 -17.901 5.909 1.00 0.00 H new ATOM 381 N LYS A 26 88.180 -16.678 1.920 1.00 0.00 N ATOM 382 CA LYS A 26 87.774 -15.603 0.964 1.00 0.00 C ATOM 383 C LYS A 26 86.580 -14.836 1.528 1.00 0.00 C ATOM 384 O LYS A 26 86.282 -13.737 1.106 1.00 0.00 O ATOM 385 CB LYS A 26 87.387 -16.227 -0.380 1.00 0.00 C ATOM 386 CG LYS A 26 88.593 -16.959 -0.975 1.00 0.00 C ATOM 387 CD LYS A 26 88.200 -17.582 -2.319 1.00 0.00 C ATOM 388 CE LYS A 26 89.402 -18.316 -2.919 1.00 0.00 C ATOM 389 NZ LYS A 26 90.426 -17.322 -3.350 1.00 0.00 N ATOM 0 H LYS A 26 87.699 -17.569 1.799 1.00 0.00 H new ATOM 0 HA LYS A 26 88.610 -14.919 0.820 1.00 0.00 H new ATOM 0 HB2 LYS A 26 86.558 -16.922 -0.244 1.00 0.00 H new ATOM 0 HB3 LYS A 26 87.044 -15.453 -1.066 1.00 0.00 H new ATOM 0 HG2 LYS A 26 89.422 -16.265 -1.112 1.00 0.00 H new ATOM 0 HG3 LYS A 26 88.936 -17.734 -0.289 1.00 0.00 H new ATOM 0 HD2 LYS A 26 87.370 -18.275 -2.181 1.00 0.00 H new ATOM 0 HD3 LYS A 26 87.856 -16.807 -3.004 1.00 0.00 H new ATOM 0 HE2 LYS A 26 89.829 -18.999 -2.184 1.00 0.00 H new ATOM 0 HE3 LYS A 26 89.086 -18.920 -3.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 90.792 -17.585 -4.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 89.994 -16.377 -3.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 91.208 -17.310 -2.664 1.00 0.00 H new ATOM 403 N PHE A 27 85.894 -15.403 2.480 1.00 0.00 N ATOM 404 CA PHE A 27 84.721 -14.703 3.077 1.00 0.00 C ATOM 405 C PHE A 27 85.173 -13.927 4.310 1.00 0.00 C ATOM 406 O PHE A 27 84.384 -13.278 4.967 1.00 0.00 O ATOM 407 CB PHE A 27 83.656 -15.730 3.474 1.00 0.00 C ATOM 408 CG PHE A 27 82.951 -16.230 2.235 1.00 0.00 C ATOM 409 CD1 PHE A 27 81.862 -15.517 1.716 1.00 0.00 C ATOM 410 CD2 PHE A 27 83.387 -17.398 1.602 1.00 0.00 C ATOM 411 CE1 PHE A 27 81.210 -15.974 0.564 1.00 0.00 C ATOM 412 CE2 PHE A 27 82.736 -17.856 0.450 1.00 0.00 C ATOM 413 CZ PHE A 27 81.647 -17.144 -0.069 1.00 0.00 C ATOM 0 H PHE A 27 86.095 -16.323 2.872 1.00 0.00 H new ATOM 0 HA PHE A 27 84.297 -14.013 2.348 1.00 0.00 H new ATOM 0 HB2 PHE A 27 84.118 -16.563 4.003 1.00 0.00 H new ATOM 0 HB3 PHE A 27 82.937 -15.278 4.157 1.00 0.00 H new ATOM 0 HD1 PHE A 27 81.525 -14.615 2.205 1.00 0.00 H new ATOM 0 HD2 PHE A 27 84.226 -17.947 2.002 1.00 0.00 H new ATOM 0 HE1 PHE A 27 80.371 -15.424 0.164 1.00 0.00 H new ATOM 0 HE2 PHE A 27 83.073 -18.758 -0.038 1.00 0.00 H new ATOM 0 HZ PHE A 27 81.145 -17.497 -0.957 1.00 0.00 H new ATOM 423 N LYS A 28 86.439 -13.988 4.640 1.00 0.00 N ATOM 424 CA LYS A 28 86.931 -13.246 5.843 1.00 0.00 C ATOM 425 C LYS A 28 88.356 -12.739 5.605 1.00 0.00 C ATOM 426 O LYS A 28 89.169 -13.411 5.002 1.00 0.00 O ATOM 427 CB LYS A 28 86.936 -14.188 7.049 1.00 0.00 C ATOM 428 CG LYS A 28 85.493 -14.520 7.460 1.00 0.00 C ATOM 429 CD LYS A 28 85.489 -15.413 8.713 1.00 0.00 C ATOM 430 CE LYS A 28 85.719 -16.881 8.326 1.00 0.00 C ATOM 431 NZ LYS A 28 84.582 -17.359 7.491 1.00 0.00 N ATOM 0 H LYS A 28 87.150 -14.516 4.133 1.00 0.00 H new ATOM 0 HA LYS A 28 86.273 -12.397 6.029 1.00 0.00 H new ATOM 0 HB2 LYS A 28 87.473 -15.104 6.804 1.00 0.00 H new ATOM 0 HB3 LYS A 28 87.463 -13.723 7.882 1.00 0.00 H new ATOM 0 HG2 LYS A 28 84.943 -13.600 7.658 1.00 0.00 H new ATOM 0 HG3 LYS A 28 84.982 -15.027 6.642 1.00 0.00 H new ATOM 0 HD2 LYS A 28 86.267 -15.086 9.403 1.00 0.00 H new ATOM 0 HD3 LYS A 28 84.538 -15.313 9.235 1.00 0.00 H new ATOM 0 HE2 LYS A 28 86.655 -16.981 7.776 1.00 0.00 H new ATOM 0 HE3 LYS A 28 85.809 -17.495 9.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 84.455 -18.382 7.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 83.713 -16.862 7.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 84.783 -17.168 6.489 1.00 0.00 H new ATOM 445 N LEU A 29 88.671 -11.567 6.103 1.00 0.00 N ATOM 446 CA LEU A 29 90.052 -11.008 5.945 1.00 0.00 C ATOM 447 C LEU A 29 90.519 -10.546 7.322 1.00 0.00 C ATOM 448 O LEU A 29 89.718 -10.311 8.205 1.00 0.00 O ATOM 449 CB LEU A 29 90.026 -9.809 4.959 1.00 0.00 C ATOM 450 CG LEU A 29 90.921 -10.074 3.742 1.00 0.00 C ATOM 451 CD1 LEU A 29 90.295 -11.148 2.847 1.00 0.00 C ATOM 452 CD2 LEU A 29 91.073 -8.770 2.955 1.00 0.00 C ATOM 0 H LEU A 29 88.025 -10.968 6.617 1.00 0.00 H new ATOM 0 HA LEU A 29 90.731 -11.761 5.545 1.00 0.00 H new ATOM 0 HB2 LEU A 29 89.003 -9.628 4.629 1.00 0.00 H new ATOM 0 HB3 LEU A 29 90.361 -8.906 5.470 1.00 0.00 H new ATOM 0 HG LEU A 29 91.897 -10.428 4.075 1.00 0.00 H new ATOM 0 HD11 LEU A 29 90.940 -11.326 1.987 1.00 0.00 H new ATOM 0 HD12 LEU A 29 90.181 -12.072 3.413 1.00 0.00 H new ATOM 0 HD13 LEU A 29 89.317 -10.810 2.503 1.00 0.00 H new ATOM 0 HD21 LEU A 29 91.707 -8.942 2.085 1.00 0.00 H new ATOM 0 HD22 LEU A 29 90.092 -8.427 2.626 1.00 0.00 H new ATOM 0 HD23 LEU A 29 91.528 -8.012 3.592 1.00 0.00 H new ATOM 464 N ASN A 30 91.802 -10.403 7.509 1.00 0.00 N ATOM 465 CA ASN A 30 92.315 -9.934 8.827 1.00 0.00 C ATOM 466 C ASN A 30 92.593 -8.438 8.727 1.00 0.00 C ATOM 467 O ASN A 30 93.185 -7.967 7.779 1.00 0.00 O ATOM 468 CB ASN A 30 93.602 -10.687 9.191 1.00 0.00 C ATOM 469 CG ASN A 30 94.492 -10.848 7.956 1.00 0.00 C ATOM 470 OD1 ASN A 30 94.011 -11.105 6.870 1.00 0.00 O ATOM 471 ND2 ASN A 30 95.784 -10.720 8.083 1.00 0.00 N ATOM 0 H ASN A 30 92.517 -10.591 6.806 1.00 0.00 H new ATOM 0 HA ASN A 30 91.576 -10.126 9.605 1.00 0.00 H new ATOM 0 HB2 ASN A 30 94.141 -10.145 9.968 1.00 0.00 H new ATOM 0 HB3 ASN A 30 93.355 -11.667 9.599 1.00 0.00 H new ATOM 0 HD21 ASN A 30 96.390 -10.836 7.271 1.00 0.00 H new ATOM 0 HD22 ASN A 30 96.188 -10.504 8.994 1.00 0.00 H new ATOM 478 N LYS A 31 92.164 -7.683 9.694 1.00 0.00 N ATOM 479 CA LYS A 31 92.396 -6.219 9.649 1.00 0.00 C ATOM 480 C LYS A 31 93.863 -5.944 9.348 1.00 0.00 C ATOM 481 O LYS A 31 94.207 -4.928 8.803 1.00 0.00 O ATOM 482 CB LYS A 31 92.012 -5.579 10.985 1.00 0.00 C ATOM 483 CG LYS A 31 90.493 -5.621 11.154 1.00 0.00 C ATOM 484 CD LYS A 31 90.101 -4.984 12.486 1.00 0.00 C ATOM 485 CE LYS A 31 88.581 -5.034 12.638 1.00 0.00 C ATOM 486 NZ LYS A 31 88.165 -4.179 13.784 1.00 0.00 N ATOM 0 H LYS A 31 91.661 -8.018 10.516 1.00 0.00 H new ATOM 0 HA LYS A 31 91.777 -5.786 8.863 1.00 0.00 H new ATOM 0 HB2 LYS A 31 92.494 -6.109 11.806 1.00 0.00 H new ATOM 0 HB3 LYS A 31 92.364 -4.548 11.021 1.00 0.00 H new ATOM 0 HG2 LYS A 31 90.012 -5.091 10.332 1.00 0.00 H new ATOM 0 HG3 LYS A 31 90.142 -6.652 11.117 1.00 0.00 H new ATOM 0 HD2 LYS A 31 90.579 -5.513 13.311 1.00 0.00 H new ATOM 0 HD3 LYS A 31 90.449 -3.952 12.526 1.00 0.00 H new ATOM 0 HE2 LYS A 31 88.102 -4.689 11.721 1.00 0.00 H new ATOM 0 HE3 LYS A 31 88.255 -6.061 12.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 87.197 -4.428 14.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 88.812 -4.331 14.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 88.195 -3.179 13.500 1.00 0.00 H new ATOM 500 N SER A 32 94.743 -6.839 9.665 1.00 0.00 N ATOM 501 CA SER A 32 96.164 -6.574 9.337 1.00 0.00 C ATOM 502 C SER A 32 96.247 -6.405 7.833 1.00 0.00 C ATOM 503 O SER A 32 96.928 -5.536 7.325 1.00 0.00 O ATOM 504 CB SER A 32 97.053 -7.727 9.756 1.00 0.00 C ATOM 505 OG SER A 32 97.001 -7.880 11.168 1.00 0.00 O ATOM 0 H SER A 32 94.549 -7.727 10.128 1.00 0.00 H new ATOM 0 HA SER A 32 96.504 -5.685 9.868 1.00 0.00 H new ATOM 0 HB2 SER A 32 96.728 -8.646 9.268 1.00 0.00 H new ATOM 0 HB3 SER A 32 98.079 -7.543 9.438 1.00 0.00 H new ATOM 0 HG SER A 32 97.575 -8.627 11.437 1.00 0.00 H new ATOM 511 N GLU A 33 95.518 -7.213 7.111 1.00 0.00 N ATOM 512 CA GLU A 33 95.521 -7.065 5.638 1.00 0.00 C ATOM 513 C GLU A 33 95.020 -5.682 5.331 1.00 0.00 C ATOM 514 O GLU A 33 95.309 -5.138 4.296 1.00 0.00 O ATOM 515 CB GLU A 33 94.631 -8.119 4.968 1.00 0.00 C ATOM 516 CG GLU A 33 95.359 -9.464 4.943 1.00 0.00 C ATOM 517 CD GLU A 33 96.527 -9.396 3.957 1.00 0.00 C ATOM 518 OE1 GLU A 33 96.276 -9.148 2.789 1.00 0.00 O ATOM 519 OE2 GLU A 33 97.652 -9.590 4.386 1.00 0.00 O ATOM 0 H GLU A 33 94.928 -7.960 7.478 1.00 0.00 H new ATOM 0 HA GLU A 33 96.529 -7.211 5.249 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.690 -8.213 5.510 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.384 -7.809 3.953 1.00 0.00 H new ATOM 0 HG2 GLU A 33 95.725 -9.710 5.940 1.00 0.00 H new ATOM 0 HG3 GLU A 33 94.670 -10.257 4.652 1.00 0.00 H new ATOM 526 N LEU A 34 94.291 -5.075 6.222 1.00 0.00 N ATOM 527 CA LEU A 34 93.845 -3.700 5.903 1.00 0.00 C ATOM 528 C LEU A 34 95.100 -2.869 5.708 1.00 0.00 C ATOM 529 O LEU A 34 95.205 -2.128 4.767 1.00 0.00 O ATOM 530 CB LEU A 34 92.992 -3.092 7.031 1.00 0.00 C ATOM 531 CG LEU A 34 92.539 -1.646 6.657 1.00 0.00 C ATOM 532 CD1 LEU A 34 91.082 -1.405 7.106 1.00 0.00 C ATOM 533 CD2 LEU A 34 93.457 -0.601 7.339 1.00 0.00 C ATOM 0 H LEU A 34 93.995 -5.454 7.122 1.00 0.00 H new ATOM 0 HA LEU A 34 93.220 -3.715 5.010 1.00 0.00 H new ATOM 0 HB2 LEU A 34 92.118 -3.718 7.211 1.00 0.00 H new ATOM 0 HB3 LEU A 34 93.566 -3.071 7.958 1.00 0.00 H new ATOM 0 HG LEU A 34 92.607 -1.539 5.574 1.00 0.00 H new ATOM 0 HD11 LEU A 34 90.781 -0.392 6.838 1.00 0.00 H new ATOM 0 HD12 LEU A 34 90.426 -2.121 6.612 1.00 0.00 H new ATOM 0 HD13 LEU A 34 91.009 -1.531 8.186 1.00 0.00 H new ATOM 0 HD21 LEU A 34 93.129 0.403 7.069 1.00 0.00 H new ATOM 0 HD22 LEU A 34 93.404 -0.721 8.421 1.00 0.00 H new ATOM 0 HD23 LEU A 34 94.485 -0.748 7.007 1.00 0.00 H new ATOM 545 N LYS A 35 96.076 -3.004 6.569 1.00 0.00 N ATOM 546 CA LYS A 35 97.315 -2.203 6.370 1.00 0.00 C ATOM 547 C LYS A 35 97.973 -2.586 5.051 1.00 0.00 C ATOM 548 O LYS A 35 98.323 -1.743 4.251 1.00 0.00 O ATOM 549 CB LYS A 35 98.292 -2.459 7.525 1.00 0.00 C ATOM 550 CG LYS A 35 99.583 -1.658 7.317 1.00 0.00 C ATOM 551 CD LYS A 35 100.537 -1.928 8.482 1.00 0.00 C ATOM 552 CE LYS A 35 101.841 -1.160 8.264 1.00 0.00 C ATOM 553 NZ LYS A 35 102.705 -1.286 9.473 1.00 0.00 N ATOM 0 H LYS A 35 96.069 -3.620 7.382 1.00 0.00 H new ATOM 0 HA LYS A 35 97.053 -1.145 6.347 1.00 0.00 H new ATOM 0 HB2 LYS A 35 97.829 -2.177 8.471 1.00 0.00 H new ATOM 0 HB3 LYS A 35 98.522 -3.523 7.587 1.00 0.00 H new ATOM 0 HG2 LYS A 35 100.052 -1.940 6.374 1.00 0.00 H new ATOM 0 HG3 LYS A 35 99.358 -0.593 7.255 1.00 0.00 H new ATOM 0 HD2 LYS A 35 100.076 -1.623 9.421 1.00 0.00 H new ATOM 0 HD3 LYS A 35 100.740 -2.996 8.559 1.00 0.00 H new ATOM 0 HE2 LYS A 35 102.363 -1.550 7.390 1.00 0.00 H new ATOM 0 HE3 LYS A 35 101.627 -0.110 8.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 103.591 -0.763 9.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 102.207 -0.894 10.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 102.920 -2.289 9.643 1.00 0.00 H new ATOM 567 N GLU A 36 98.160 -3.850 4.826 1.00 0.00 N ATOM 568 CA GLU A 36 98.813 -4.280 3.564 1.00 0.00 C ATOM 569 C GLU A 36 97.892 -4.040 2.376 1.00 0.00 C ATOM 570 O GLU A 36 98.305 -3.556 1.343 1.00 0.00 O ATOM 571 CB GLU A 36 99.164 -5.763 3.675 1.00 0.00 C ATOM 572 CG GLU A 36 99.780 -6.249 2.368 1.00 0.00 C ATOM 573 CD GLU A 36 100.359 -7.649 2.577 1.00 0.00 C ATOM 574 OE1 GLU A 36 99.578 -8.578 2.705 1.00 0.00 O ATOM 575 OE2 GLU A 36 101.572 -7.769 2.611 1.00 0.00 O ATOM 0 H GLU A 36 97.890 -4.604 5.458 1.00 0.00 H new ATOM 0 HA GLU A 36 99.721 -3.697 3.406 1.00 0.00 H new ATOM 0 HB2 GLU A 36 99.862 -5.920 4.497 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.269 -6.342 3.903 1.00 0.00 H new ATOM 0 HG2 GLU A 36 99.026 -6.268 1.581 1.00 0.00 H new ATOM 0 HG3 GLU A 36 100.563 -5.563 2.043 1.00 0.00 H new ATOM 582 N LEU A 37 96.649 -4.359 2.515 1.00 0.00 N ATOM 583 CA LEU A 37 95.704 -4.139 1.400 1.00 0.00 C ATOM 584 C LEU A 37 95.497 -2.646 1.230 1.00 0.00 C ATOM 585 O LEU A 37 95.333 -2.152 0.132 1.00 0.00 O ATOM 586 CB LEU A 37 94.366 -4.827 1.724 1.00 0.00 C ATOM 587 CG LEU A 37 93.383 -4.722 0.524 1.00 0.00 C ATOM 588 CD1 LEU A 37 92.494 -5.971 0.461 1.00 0.00 C ATOM 589 CD2 LEU A 37 92.471 -3.491 0.668 1.00 0.00 C ATOM 0 H LEU A 37 96.242 -4.765 3.357 1.00 0.00 H new ATOM 0 HA LEU A 37 96.101 -4.560 0.476 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.541 -5.875 1.965 1.00 0.00 H new ATOM 0 HB3 LEU A 37 93.920 -4.367 2.606 1.00 0.00 H new ATOM 0 HG LEU A 37 93.978 -4.632 -0.385 1.00 0.00 H new ATOM 0 HD11 LEU A 37 91.809 -5.888 -0.383 1.00 0.00 H new ATOM 0 HD12 LEU A 37 93.118 -6.856 0.336 1.00 0.00 H new ATOM 0 HD13 LEU A 37 91.922 -6.058 1.385 1.00 0.00 H new ATOM 0 HD21 LEU A 37 91.792 -3.439 -0.183 1.00 0.00 H new ATOM 0 HD22 LEU A 37 91.893 -3.572 1.588 1.00 0.00 H new ATOM 0 HD23 LEU A 37 93.081 -2.588 0.701 1.00 0.00 H new ATOM 601 N LEU A 38 95.475 -1.917 2.310 1.00 0.00 N ATOM 602 CA LEU A 38 95.243 -0.445 2.174 1.00 0.00 C ATOM 603 C LEU A 38 96.454 0.239 1.528 1.00 0.00 C ATOM 604 O LEU A 38 96.311 1.080 0.663 1.00 0.00 O ATOM 605 CB LEU A 38 94.962 0.170 3.562 1.00 0.00 C ATOM 606 CG LEU A 38 94.736 1.698 3.498 1.00 0.00 C ATOM 607 CD1 LEU A 38 96.072 2.457 3.335 1.00 0.00 C ATOM 608 CD2 LEU A 38 93.780 2.057 2.349 1.00 0.00 C ATOM 0 H LEU A 38 95.604 -2.262 3.261 1.00 0.00 H new ATOM 0 HA LEU A 38 94.378 -0.287 1.529 1.00 0.00 H new ATOM 0 HB2 LEU A 38 94.083 -0.306 3.995 1.00 0.00 H new ATOM 0 HB3 LEU A 38 95.800 -0.043 4.226 1.00 0.00 H new ATOM 0 HG LEU A 38 94.284 2.004 4.441 1.00 0.00 H new ATOM 0 HD11 LEU A 38 95.879 3.529 3.293 1.00 0.00 H new ATOM 0 HD12 LEU A 38 96.721 2.238 4.183 1.00 0.00 H new ATOM 0 HD13 LEU A 38 96.560 2.140 2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 38 93.634 3.137 2.321 1.00 0.00 H new ATOM 0 HD22 LEU A 38 94.207 1.724 1.403 1.00 0.00 H new ATOM 0 HD23 LEU A 38 92.820 1.565 2.507 1.00 0.00 H new ATOM 620 N THR A 39 97.643 -0.089 1.949 1.00 0.00 N ATOM 621 CA THR A 39 98.844 0.589 1.373 1.00 0.00 C ATOM 622 C THR A 39 99.221 0.035 -0.007 1.00 0.00 C ATOM 623 O THR A 39 99.860 0.707 -0.793 1.00 0.00 O ATOM 624 CB THR A 39 100.028 0.406 2.325 1.00 0.00 C ATOM 625 OG1 THR A 39 99.595 0.614 3.661 1.00 0.00 O ATOM 626 CG2 THR A 39 101.121 1.418 1.978 1.00 0.00 C ATOM 0 H THR A 39 97.838 -0.792 2.662 1.00 0.00 H new ATOM 0 HA THR A 39 98.600 1.644 1.251 1.00 0.00 H new ATOM 0 HB THR A 39 100.424 -0.604 2.225 1.00 0.00 H new ATOM 0 HG1 THR A 39 99.247 -0.226 4.026 1.00 0.00 H new ATOM 0 HG21 THR A 39 101.965 1.289 2.656 1.00 0.00 H new ATOM 0 HG22 THR A 39 101.452 1.259 0.952 1.00 0.00 H new ATOM 0 HG23 THR A 39 100.726 2.429 2.079 1.00 0.00 H new ATOM 634 N ARG A 40 98.863 -1.175 -0.316 1.00 0.00 N ATOM 635 CA ARG A 40 99.252 -1.730 -1.645 1.00 0.00 C ATOM 636 C ARG A 40 98.488 -1.031 -2.764 1.00 0.00 C ATOM 637 O ARG A 40 99.020 -0.798 -3.831 1.00 0.00 O ATOM 638 CB ARG A 40 98.983 -3.244 -1.696 1.00 0.00 C ATOM 639 CG ARG A 40 100.136 -4.005 -1.028 1.00 0.00 C ATOM 640 CD ARG A 40 99.883 -5.508 -1.146 1.00 0.00 C ATOM 641 NE ARG A 40 101.007 -6.252 -0.507 1.00 0.00 N ATOM 642 CZ ARG A 40 100.895 -7.530 -0.276 1.00 0.00 C ATOM 643 NH1 ARG A 40 99.788 -8.151 -0.577 1.00 0.00 N ATOM 644 NH2 ARG A 40 101.889 -8.188 0.255 1.00 0.00 N ATOM 0 H ARG A 40 98.324 -1.801 0.283 1.00 0.00 H new ATOM 0 HA ARG A 40 100.319 -1.555 -1.786 1.00 0.00 H new ATOM 0 HB2 ARG A 40 98.045 -3.472 -1.190 1.00 0.00 H new ATOM 0 HB3 ARG A 40 98.874 -3.568 -2.731 1.00 0.00 H new ATOM 0 HG2 ARG A 40 101.082 -3.745 -1.503 1.00 0.00 H new ATOM 0 HG3 ARG A 40 100.217 -3.719 0.021 1.00 0.00 H new ATOM 0 HD2 ARG A 40 98.940 -5.768 -0.665 1.00 0.00 H new ATOM 0 HD3 ARG A 40 99.794 -5.792 -2.195 1.00 0.00 H new ATOM 0 HE ARG A 40 101.863 -5.761 -0.251 1.00 0.00 H new ATOM 0 HH11 ARG A 40 99.011 -7.637 -0.993 1.00 0.00 H new ATOM 0 HH12 ARG A 40 99.699 -9.151 -0.397 1.00 0.00 H new ATOM 0 HH21 ARG A 40 102.755 -7.702 0.490 1.00 0.00 H new ATOM 0 HH22 ARG A 40 101.800 -9.188 0.435 1.00 0.00 H new ATOM 658 N GLU A 41 97.245 -0.707 -2.544 1.00 0.00 N ATOM 659 CA GLU A 41 96.446 -0.038 -3.617 1.00 0.00 C ATOM 660 C GLU A 41 96.389 1.451 -3.370 1.00 0.00 C ATOM 661 O GLU A 41 96.083 2.215 -4.262 1.00 0.00 O ATOM 662 CB GLU A 41 95.025 -0.603 -3.627 1.00 0.00 C ATOM 663 CG GLU A 41 95.073 -2.106 -3.906 1.00 0.00 C ATOM 664 CD GLU A 41 93.649 -2.666 -3.932 1.00 0.00 C ATOM 665 OE1 GLU A 41 93.102 -2.892 -2.865 1.00 0.00 O ATOM 666 OE2 GLU A 41 93.130 -2.860 -5.019 1.00 0.00 O ATOM 0 H GLU A 41 96.745 -0.875 -1.671 1.00 0.00 H new ATOM 0 HA GLU A 41 96.922 -0.224 -4.580 1.00 0.00 H new ATOM 0 HB2 GLU A 41 94.542 -0.416 -2.668 1.00 0.00 H new ATOM 0 HB3 GLU A 41 94.428 -0.100 -4.388 1.00 0.00 H new ATOM 0 HG2 GLU A 41 95.567 -2.294 -4.859 1.00 0.00 H new ATOM 0 HG3 GLU A 41 95.660 -2.611 -3.138 1.00 0.00 H new ATOM 673 N LEU A 42 96.677 1.885 -2.175 1.00 0.00 N ATOM 674 CA LEU A 42 96.630 3.354 -1.903 1.00 0.00 C ATOM 675 C LEU A 42 97.753 3.736 -0.925 1.00 0.00 C ATOM 676 O LEU A 42 97.511 3.896 0.254 1.00 0.00 O ATOM 677 CB LEU A 42 95.279 3.708 -1.274 1.00 0.00 C ATOM 678 CG LEU A 42 94.132 3.551 -2.287 1.00 0.00 C ATOM 679 CD1 LEU A 42 92.797 3.728 -1.552 1.00 0.00 C ATOM 680 CD2 LEU A 42 94.249 4.610 -3.403 1.00 0.00 C ATOM 0 H LEU A 42 96.940 1.298 -1.383 1.00 0.00 H new ATOM 0 HA LEU A 42 96.760 3.898 -2.838 1.00 0.00 H new ATOM 0 HB2 LEU A 42 95.097 3.065 -0.413 1.00 0.00 H new ATOM 0 HB3 LEU A 42 95.304 4.734 -0.906 1.00 0.00 H new ATOM 0 HG LEU A 42 94.185 2.561 -2.741 1.00 0.00 H new ATOM 0 HD11 LEU A 42 91.975 3.619 -2.259 1.00 0.00 H new ATOM 0 HD12 LEU A 42 92.708 2.971 -0.773 1.00 0.00 H new ATOM 0 HD13 LEU A 42 92.759 4.720 -1.101 1.00 0.00 H new ATOM 0 HD21 LEU A 42 93.430 4.485 -4.111 1.00 0.00 H new ATOM 0 HD22 LEU A 42 94.201 5.607 -2.965 1.00 0.00 H new ATOM 0 HD23 LEU A 42 95.199 4.488 -3.922 1.00 0.00 H new ATOM 692 N PRO A 43 98.973 3.868 -1.391 1.00 0.00 N ATOM 693 CA PRO A 43 100.108 4.222 -0.487 1.00 0.00 C ATOM 694 C PRO A 43 100.147 5.717 -0.082 1.00 0.00 C ATOM 695 O PRO A 43 99.517 6.124 0.874 1.00 0.00 O ATOM 696 CB PRO A 43 101.322 3.822 -1.348 1.00 0.00 C ATOM 697 CG PRO A 43 100.858 3.751 -2.816 1.00 0.00 C ATOM 698 CD PRO A 43 99.320 3.666 -2.827 1.00 0.00 C ATOM 0 HA PRO A 43 100.051 3.721 0.479 1.00 0.00 H new ATOM 0 HB2 PRO A 43 102.125 4.550 -1.236 1.00 0.00 H new ATOM 0 HB3 PRO A 43 101.718 2.859 -1.026 1.00 0.00 H new ATOM 0 HG2 PRO A 43 101.195 4.631 -3.365 1.00 0.00 H new ATOM 0 HG3 PRO A 43 101.291 2.882 -3.311 1.00 0.00 H new ATOM 0 HD2 PRO A 43 98.876 4.432 -3.463 1.00 0.00 H new ATOM 0 HD3 PRO A 43 98.970 2.702 -3.197 1.00 0.00 H new ATOM 706 N SER A 44 100.908 6.523 -0.780 1.00 0.00 N ATOM 707 CA SER A 44 101.031 7.973 -0.425 1.00 0.00 C ATOM 708 C SER A 44 99.738 8.741 -0.718 1.00 0.00 C ATOM 709 O SER A 44 99.385 9.650 -0.001 1.00 0.00 O ATOM 710 CB SER A 44 102.177 8.590 -1.227 1.00 0.00 C ATOM 711 OG SER A 44 102.407 9.917 -0.770 1.00 0.00 O ATOM 0 H SER A 44 101.456 6.235 -1.591 1.00 0.00 H new ATOM 0 HA SER A 44 101.229 8.044 0.645 1.00 0.00 H new ATOM 0 HB2 SER A 44 103.081 7.991 -1.112 1.00 0.00 H new ATOM 0 HB3 SER A 44 101.932 8.596 -2.289 1.00 0.00 H new ATOM 0 HG SER A 44 103.142 10.316 -1.281 1.00 0.00 H new ATOM 717 N PHE A 45 99.047 8.401 -1.774 1.00 0.00 N ATOM 718 CA PHE A 45 97.785 9.128 -2.139 1.00 0.00 C ATOM 719 C PHE A 45 96.896 9.347 -0.908 1.00 0.00 C ATOM 720 O PHE A 45 95.935 10.090 -0.952 1.00 0.00 O ATOM 721 CB PHE A 45 97.016 8.275 -3.142 1.00 0.00 C ATOM 722 CG PHE A 45 97.703 8.324 -4.489 1.00 0.00 C ATOM 723 CD1 PHE A 45 98.724 7.415 -4.784 1.00 0.00 C ATOM 724 CD2 PHE A 45 97.322 9.280 -5.440 1.00 0.00 C ATOM 725 CE1 PHE A 45 99.363 7.457 -6.030 1.00 0.00 C ATOM 726 CE2 PHE A 45 97.962 9.322 -6.685 1.00 0.00 C ATOM 727 CZ PHE A 45 98.982 8.410 -6.980 1.00 0.00 C ATOM 0 H PHE A 45 99.302 7.644 -2.408 1.00 0.00 H new ATOM 0 HA PHE A 45 98.047 10.100 -2.557 1.00 0.00 H new ATOM 0 HB2 PHE A 45 96.959 7.245 -2.790 1.00 0.00 H new ATOM 0 HB3 PHE A 45 95.992 8.638 -3.232 1.00 0.00 H new ATOM 0 HD1 PHE A 45 99.020 6.680 -4.050 1.00 0.00 H new ATOM 0 HD2 PHE A 45 96.535 9.984 -5.213 1.00 0.00 H new ATOM 0 HE1 PHE A 45 100.150 6.753 -6.257 1.00 0.00 H new ATOM 0 HE2 PHE A 45 97.668 10.059 -7.418 1.00 0.00 H new ATOM 0 HZ PHE A 45 99.474 8.442 -7.941 1.00 0.00 H new ATOM 737 N LEU A 46 97.219 8.727 0.185 1.00 0.00 N ATOM 738 CA LEU A 46 96.410 8.908 1.437 1.00 0.00 C ATOM 739 C LEU A 46 97.154 9.877 2.328 1.00 0.00 C ATOM 740 O LEU A 46 96.838 11.048 2.402 1.00 0.00 O ATOM 741 CB LEU A 46 96.261 7.580 2.174 1.00 0.00 C ATOM 742 CG LEU A 46 95.524 6.571 1.299 1.00 0.00 C ATOM 743 CD1 LEU A 46 95.570 5.215 1.996 1.00 0.00 C ATOM 744 CD2 LEU A 46 94.059 6.996 1.093 1.00 0.00 C ATOM 0 H LEU A 46 98.014 8.095 0.276 1.00 0.00 H new ATOM 0 HA LEU A 46 95.417 9.280 1.183 1.00 0.00 H new ATOM 0 HB2 LEU A 46 97.244 7.192 2.440 1.00 0.00 H new ATOM 0 HB3 LEU A 46 95.715 7.732 3.105 1.00 0.00 H new ATOM 0 HG LEU A 46 96.002 6.518 0.321 1.00 0.00 H new ATOM 0 HD11 LEU A 46 95.048 4.476 1.388 1.00 0.00 H new ATOM 0 HD12 LEU A 46 96.608 4.909 2.128 1.00 0.00 H new ATOM 0 HD13 LEU A 46 95.087 5.290 2.970 1.00 0.00 H new ATOM 0 HD21 LEU A 46 93.552 6.262 0.466 1.00 0.00 H new ATOM 0 HD22 LEU A 46 93.558 7.056 2.059 1.00 0.00 H new ATOM 0 HD23 LEU A 46 94.028 7.971 0.607 1.00 0.00 H new ATOM 756 N GLY A 47 98.180 9.402 2.970 1.00 0.00 N ATOM 757 CA GLY A 47 98.992 10.299 3.816 1.00 0.00 C ATOM 758 C GLY A 47 99.777 11.210 2.880 1.00 0.00 C ATOM 759 O GLY A 47 100.812 11.740 3.231 1.00 0.00 O ATOM 0 H GLY A 47 98.488 8.430 2.943 1.00 0.00 H new ATOM 0 HA2 GLY A 47 98.355 10.885 4.479 1.00 0.00 H new ATOM 0 HA3 GLY A 47 99.667 9.724 4.450 1.00 0.00 H new ATOM 763 N LYS A 48 99.294 11.377 1.666 1.00 0.00 N ATOM 764 CA LYS A 48 100.013 12.230 0.685 1.00 0.00 C ATOM 765 C LYS A 48 100.420 13.536 1.379 1.00 0.00 C ATOM 766 O LYS A 48 101.557 13.960 1.331 1.00 0.00 O ATOM 767 CB LYS A 48 99.082 12.562 -0.492 1.00 0.00 C ATOM 768 CG LYS A 48 99.800 13.447 -1.525 1.00 0.00 C ATOM 769 CD LYS A 48 101.022 12.715 -2.099 1.00 0.00 C ATOM 770 CE LYS A 48 101.430 13.355 -3.429 1.00 0.00 C ATOM 771 NZ LYS A 48 100.428 13.008 -4.476 1.00 0.00 N ATOM 0 H LYS A 48 98.432 10.955 1.322 1.00 0.00 H new ATOM 0 HA LYS A 48 100.893 11.704 0.315 1.00 0.00 H new ATOM 0 HB2 LYS A 48 98.747 11.640 -0.967 1.00 0.00 H new ATOM 0 HB3 LYS A 48 98.192 13.073 -0.124 1.00 0.00 H new ATOM 0 HG2 LYS A 48 99.113 13.708 -2.330 1.00 0.00 H new ATOM 0 HG3 LYS A 48 100.113 14.381 -1.058 1.00 0.00 H new ATOM 0 HD2 LYS A 48 101.851 12.762 -1.393 1.00 0.00 H new ATOM 0 HD3 LYS A 48 100.789 11.661 -2.248 1.00 0.00 H new ATOM 0 HE2 LYS A 48 101.496 14.437 -3.319 1.00 0.00 H new ATOM 0 HE3 LYS A 48 102.418 13.004 -3.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 100.875 13.055 -5.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 100.072 12.045 -4.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 99.636 13.681 -4.436 1.00 0.00 H new ATOM 785 N ARG A 49 99.479 14.160 2.039 1.00 0.00 N ATOM 786 CA ARG A 49 99.762 15.428 2.768 1.00 0.00 C ATOM 787 C ARG A 49 98.607 15.690 3.738 1.00 0.00 C ATOM 788 O ARG A 49 98.643 16.597 4.546 1.00 0.00 O ATOM 789 CB ARG A 49 99.883 16.586 1.768 1.00 0.00 C ATOM 790 CG ARG A 49 100.394 17.839 2.487 1.00 0.00 C ATOM 791 CD ARG A 49 100.662 18.943 1.463 1.00 0.00 C ATOM 792 NE ARG A 49 101.387 20.078 2.127 1.00 0.00 N ATOM 793 CZ ARG A 49 100.883 20.709 3.154 1.00 0.00 C ATOM 794 NH1 ARG A 49 99.649 20.499 3.522 1.00 0.00 N ATOM 795 NH2 ARG A 49 101.604 21.594 3.786 1.00 0.00 N ATOM 0 H ARG A 49 98.513 13.838 2.103 1.00 0.00 H new ATOM 0 HA ARG A 49 100.700 15.347 3.318 1.00 0.00 H new ATOM 0 HB2 ARG A 49 100.565 16.314 0.963 1.00 0.00 H new ATOM 0 HB3 ARG A 49 98.914 16.787 1.311 1.00 0.00 H new ATOM 0 HG2 ARG A 49 99.659 18.177 3.218 1.00 0.00 H new ATOM 0 HG3 ARG A 49 101.307 17.609 3.036 1.00 0.00 H new ATOM 0 HD2 ARG A 49 101.256 18.551 0.638 1.00 0.00 H new ATOM 0 HD3 ARG A 49 99.722 19.296 1.039 1.00 0.00 H new ATOM 0 HE ARG A 49 102.297 20.364 1.767 1.00 0.00 H new ATOM 0 HH11 ARG A 49 99.069 19.837 3.007 1.00 0.00 H new ATOM 0 HH12 ARG A 49 99.265 20.997 4.325 1.00 0.00 H new ATOM 0 HH21 ARG A 49 102.556 21.790 3.478 1.00 0.00 H new ATOM 0 HH22 ARG A 49 101.215 22.090 4.588 1.00 0.00 H new ATOM 809 N THR A 50 97.582 14.886 3.666 1.00 0.00 N ATOM 810 CA THR A 50 96.419 15.069 4.578 1.00 0.00 C ATOM 811 C THR A 50 96.856 14.809 6.019 1.00 0.00 C ATOM 812 O THR A 50 97.969 15.109 6.402 1.00 0.00 O ATOM 813 CB THR A 50 95.312 14.081 4.198 1.00 0.00 C ATOM 814 OG1 THR A 50 95.764 12.755 4.439 1.00 0.00 O ATOM 815 CG2 THR A 50 94.961 14.243 2.718 1.00 0.00 C ATOM 0 H THR A 50 97.500 14.107 3.012 1.00 0.00 H new ATOM 0 HA THR A 50 96.045 16.089 4.488 1.00 0.00 H new ATOM 0 HB THR A 50 94.425 14.280 4.799 1.00 0.00 H new ATOM 0 HG1 THR A 50 96.102 12.368 3.604 1.00 0.00 H new ATOM 0 HG21 THR A 50 94.173 13.538 2.452 1.00 0.00 H new ATOM 0 HG22 THR A 50 94.615 15.260 2.535 1.00 0.00 H new ATOM 0 HG23 THR A 50 95.845 14.046 2.111 1.00 0.00 H new ATOM 823 N ASP A 51 95.986 14.260 6.824 1.00 0.00 N ATOM 824 CA ASP A 51 96.350 13.987 8.244 1.00 0.00 C ATOM 825 C ASP A 51 97.037 12.623 8.342 1.00 0.00 C ATOM 826 O ASP A 51 96.422 11.587 8.175 1.00 0.00 O ATOM 827 CB ASP A 51 95.079 13.989 9.097 1.00 0.00 C ATOM 828 CG ASP A 51 95.452 13.915 10.578 1.00 0.00 C ATOM 829 OD1 ASP A 51 96.548 13.467 10.872 1.00 0.00 O ATOM 830 OD2 ASP A 51 94.636 14.313 11.394 1.00 0.00 O ATOM 0 H ASP A 51 95.039 13.989 6.559 1.00 0.00 H new ATOM 0 HA ASP A 51 97.032 14.757 8.605 1.00 0.00 H new ATOM 0 HB2 ASP A 51 94.500 14.892 8.903 1.00 0.00 H new ATOM 0 HB3 ASP A 51 94.448 13.142 8.828 1.00 0.00 H new ATOM 835 N GLU A 52 98.313 12.624 8.612 1.00 0.00 N ATOM 836 CA GLU A 52 99.068 11.344 8.725 1.00 0.00 C ATOM 837 C GLU A 52 98.591 10.564 9.954 1.00 0.00 C ATOM 838 O GLU A 52 98.586 9.349 9.966 1.00 0.00 O ATOM 839 CB GLU A 52 100.561 11.652 8.861 1.00 0.00 C ATOM 840 CG GLU A 52 101.355 10.345 8.896 1.00 0.00 C ATOM 841 CD GLU A 52 102.849 10.659 8.977 1.00 0.00 C ATOM 842 OE1 GLU A 52 103.199 11.816 8.816 1.00 0.00 O ATOM 843 OE2 GLU A 52 103.618 9.737 9.190 1.00 0.00 O ATOM 0 H GLU A 52 98.870 13.465 8.761 1.00 0.00 H new ATOM 0 HA GLU A 52 98.896 10.741 7.833 1.00 0.00 H new ATOM 0 HB2 GLU A 52 100.893 12.268 8.025 1.00 0.00 H new ATOM 0 HB3 GLU A 52 100.743 12.224 9.771 1.00 0.00 H new ATOM 0 HG2 GLU A 52 101.051 9.745 9.754 1.00 0.00 H new ATOM 0 HG3 GLU A 52 101.144 9.755 8.004 1.00 0.00 H new ATOM 850 N ALA A 53 98.206 11.251 10.993 1.00 0.00 N ATOM 851 CA ALA A 53 97.750 10.550 12.225 1.00 0.00 C ATOM 852 C ALA A 53 96.553 9.651 11.904 1.00 0.00 C ATOM 853 O ALA A 53 96.443 8.554 12.411 1.00 0.00 O ATOM 854 CB ALA A 53 97.342 11.582 13.278 1.00 0.00 C ATOM 0 H ALA A 53 98.188 12.270 11.042 1.00 0.00 H new ATOM 0 HA ALA A 53 98.566 9.937 12.608 1.00 0.00 H new ATOM 0 HB1 ALA A 53 97.008 11.069 14.180 1.00 0.00 H new ATOM 0 HB2 ALA A 53 98.196 12.216 13.516 1.00 0.00 H new ATOM 0 HB3 ALA A 53 96.531 12.197 12.889 1.00 0.00 H new ATOM 860 N ALA A 54 95.649 10.095 11.074 1.00 0.00 N ATOM 861 CA ALA A 54 94.477 9.231 10.757 1.00 0.00 C ATOM 862 C ALA A 54 94.963 7.925 10.133 1.00 0.00 C ATOM 863 O ALA A 54 94.405 6.872 10.354 1.00 0.00 O ATOM 864 CB ALA A 54 93.538 9.923 9.787 1.00 0.00 C ATOM 0 H ALA A 54 95.669 11.002 10.609 1.00 0.00 H new ATOM 0 HA ALA A 54 93.938 9.031 11.683 1.00 0.00 H new ATOM 0 HB1 ALA A 54 92.691 9.271 9.572 1.00 0.00 H new ATOM 0 HB2 ALA A 54 93.178 10.852 10.229 1.00 0.00 H new ATOM 0 HB3 ALA A 54 94.069 10.144 8.861 1.00 0.00 H new ATOM 870 N PHE A 55 96.014 7.968 9.367 1.00 0.00 N ATOM 871 CA PHE A 55 96.520 6.705 8.773 1.00 0.00 C ATOM 872 C PHE A 55 96.839 5.780 9.931 1.00 0.00 C ATOM 873 O PHE A 55 96.567 4.596 9.908 1.00 0.00 O ATOM 874 CB PHE A 55 97.807 6.980 8.006 1.00 0.00 C ATOM 875 CG PHE A 55 98.322 5.696 7.400 1.00 0.00 C ATOM 876 CD1 PHE A 55 99.139 4.847 8.159 1.00 0.00 C ATOM 877 CD2 PHE A 55 97.992 5.354 6.083 1.00 0.00 C ATOM 878 CE1 PHE A 55 99.622 3.658 7.602 1.00 0.00 C ATOM 879 CE2 PHE A 55 98.477 4.162 5.527 1.00 0.00 C ATOM 880 CZ PHE A 55 99.292 3.315 6.287 1.00 0.00 C ATOM 0 H PHE A 55 96.538 8.810 9.129 1.00 0.00 H new ATOM 0 HA PHE A 55 95.785 6.272 8.094 1.00 0.00 H new ATOM 0 HB2 PHE A 55 97.625 7.716 7.223 1.00 0.00 H new ATOM 0 HB3 PHE A 55 98.556 7.404 8.674 1.00 0.00 H new ATOM 0 HD1 PHE A 55 99.396 5.111 9.174 1.00 0.00 H new ATOM 0 HD2 PHE A 55 97.364 6.008 5.496 1.00 0.00 H new ATOM 0 HE1 PHE A 55 100.251 3.004 8.188 1.00 0.00 H new ATOM 0 HE2 PHE A 55 98.222 3.897 4.512 1.00 0.00 H new ATOM 0 HZ PHE A 55 99.666 2.397 5.858 1.00 0.00 H new ATOM 890 N GLN A 56 97.396 6.343 10.960 1.00 0.00 N ATOM 891 CA GLN A 56 97.724 5.542 12.162 1.00 0.00 C ATOM 892 C GLN A 56 96.422 5.162 12.859 1.00 0.00 C ATOM 893 O GLN A 56 96.342 4.175 13.550 1.00 0.00 O ATOM 894 CB GLN A 56 98.619 6.355 13.107 1.00 0.00 C ATOM 895 CG GLN A 56 98.952 5.518 14.345 1.00 0.00 C ATOM 896 CD GLN A 56 100.026 6.228 15.171 1.00 0.00 C ATOM 897 OE1 GLN A 56 100.610 7.197 14.725 1.00 0.00 O ATOM 898 NE2 GLN A 56 100.317 5.783 16.363 1.00 0.00 N ATOM 0 H GLN A 56 97.640 7.332 11.019 1.00 0.00 H new ATOM 0 HA GLN A 56 98.264 4.640 11.875 1.00 0.00 H new ATOM 0 HB2 GLN A 56 99.536 6.646 12.595 1.00 0.00 H new ATOM 0 HB3 GLN A 56 98.113 7.274 13.402 1.00 0.00 H new ATOM 0 HG2 GLN A 56 98.056 5.368 14.947 1.00 0.00 H new ATOM 0 HG3 GLN A 56 99.303 4.531 14.045 1.00 0.00 H new ATOM 0 HE21 GLN A 56 99.827 4.970 16.738 1.00 0.00 H new ATOM 0 HE22 GLN A 56 101.034 6.248 16.920 1.00 0.00 H new ATOM 907 N LYS A 57 95.400 5.949 12.670 1.00 0.00 N ATOM 908 CA LYS A 57 94.080 5.646 13.308 1.00 0.00 C ATOM 909 C LYS A 57 93.477 4.424 12.645 1.00 0.00 C ATOM 910 O LYS A 57 92.925 3.556 13.294 1.00 0.00 O ATOM 911 CB LYS A 57 93.132 6.844 13.156 1.00 0.00 C ATOM 912 CG LYS A 57 91.780 6.535 13.809 1.00 0.00 C ATOM 913 CD LYS A 57 91.026 7.836 14.115 1.00 0.00 C ATOM 914 CE LYS A 57 90.639 8.538 12.812 1.00 0.00 C ATOM 915 NZ LYS A 57 89.841 7.609 11.964 1.00 0.00 N ATOM 0 H LYS A 57 95.418 6.794 12.099 1.00 0.00 H new ATOM 0 HA LYS A 57 94.228 5.451 14.370 1.00 0.00 H new ATOM 0 HB2 LYS A 57 93.574 7.727 13.617 1.00 0.00 H new ATOM 0 HB3 LYS A 57 92.990 7.073 12.100 1.00 0.00 H new ATOM 0 HG2 LYS A 57 91.183 5.908 13.146 1.00 0.00 H new ATOM 0 HG3 LYS A 57 91.933 5.971 14.729 1.00 0.00 H new ATOM 0 HD2 LYS A 57 90.132 7.619 14.699 1.00 0.00 H new ATOM 0 HD3 LYS A 57 91.650 8.494 14.720 1.00 0.00 H new ATOM 0 HE2 LYS A 57 90.061 9.436 13.029 1.00 0.00 H new ATOM 0 HE3 LYS A 57 91.535 8.856 12.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 89.354 8.149 11.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 90.473 6.909 11.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 89.138 7.119 12.553 1.00 0.00 H new ATOM 929 N LEU A 58 93.607 4.326 11.358 1.00 0.00 N ATOM 930 CA LEU A 58 93.071 3.135 10.669 1.00 0.00 C ATOM 931 C LEU A 58 93.938 1.986 11.115 1.00 0.00 C ATOM 932 O LEU A 58 93.472 0.906 11.407 1.00 0.00 O ATOM 933 CB LEU A 58 93.167 3.306 9.151 1.00 0.00 C ATOM 934 CG LEU A 58 92.343 4.520 8.704 1.00 0.00 C ATOM 935 CD1 LEU A 58 92.568 4.754 7.207 1.00 0.00 C ATOM 936 CD2 LEU A 58 90.847 4.274 8.972 1.00 0.00 C ATOM 0 H LEU A 58 94.059 5.016 10.758 1.00 0.00 H new ATOM 0 HA LEU A 58 92.021 2.972 10.910 1.00 0.00 H new ATOM 0 HB2 LEU A 58 94.209 3.436 8.857 1.00 0.00 H new ATOM 0 HB3 LEU A 58 92.804 2.407 8.652 1.00 0.00 H new ATOM 0 HG LEU A 58 92.659 5.398 9.267 1.00 0.00 H new ATOM 0 HD11 LEU A 58 91.985 5.616 6.882 1.00 0.00 H new ATOM 0 HD12 LEU A 58 93.626 4.941 7.023 1.00 0.00 H new ATOM 0 HD13 LEU A 58 92.253 3.872 6.649 1.00 0.00 H new ATOM 0 HD21 LEU A 58 90.272 5.143 8.651 1.00 0.00 H new ATOM 0 HD22 LEU A 58 90.518 3.395 8.417 1.00 0.00 H new ATOM 0 HD23 LEU A 58 90.691 4.110 10.038 1.00 0.00 H new ATOM 948 N MET A 59 95.206 2.248 11.212 1.00 0.00 N ATOM 949 CA MET A 59 96.145 1.208 11.688 1.00 0.00 C ATOM 950 C MET A 59 95.847 0.953 13.156 1.00 0.00 C ATOM 951 O MET A 59 95.880 -0.158 13.632 1.00 0.00 O ATOM 952 CB MET A 59 97.583 1.699 11.532 1.00 0.00 C ATOM 953 CG MET A 59 98.560 0.544 11.756 1.00 0.00 C ATOM 954 SD MET A 59 98.689 0.193 13.526 1.00 0.00 S ATOM 955 CE MET A 59 99.988 1.396 13.905 1.00 0.00 C ATOM 0 H MET A 59 95.634 3.144 10.980 1.00 0.00 H new ATOM 0 HA MET A 59 96.027 0.293 11.108 1.00 0.00 H new ATOM 0 HB2 MET A 59 97.726 2.119 10.536 1.00 0.00 H new ATOM 0 HB3 MET A 59 97.782 2.498 12.246 1.00 0.00 H new ATOM 0 HG2 MET A 59 98.218 -0.343 11.223 1.00 0.00 H new ATOM 0 HG3 MET A 59 99.540 0.800 11.353 1.00 0.00 H new ATOM 0 HE1 MET A 59 99.917 1.690 14.952 1.00 0.00 H new ATOM 0 HE2 MET A 59 100.964 0.948 13.720 1.00 0.00 H new ATOM 0 HE3 MET A 59 99.866 2.275 13.272 1.00 0.00 H new ATOM 965 N SER A 60 95.550 1.988 13.878 1.00 0.00 N ATOM 966 CA SER A 60 95.243 1.806 15.323 1.00 0.00 C ATOM 967 C SER A 60 94.090 0.820 15.450 1.00 0.00 C ATOM 968 O SER A 60 93.944 0.146 16.450 1.00 0.00 O ATOM 969 CB SER A 60 94.842 3.139 15.954 1.00 0.00 C ATOM 970 OG SER A 60 94.726 2.971 17.362 1.00 0.00 O ATOM 0 H SER A 60 95.505 2.948 13.537 1.00 0.00 H new ATOM 0 HA SER A 60 96.127 1.429 15.838 1.00 0.00 H new ATOM 0 HB2 SER A 60 95.586 3.902 15.726 1.00 0.00 H new ATOM 0 HB3 SER A 60 93.895 3.483 15.537 1.00 0.00 H new ATOM 0 HG SER A 60 94.470 3.823 17.773 1.00 0.00 H new ATOM 976 N ASN A 61 93.275 0.713 14.438 1.00 0.00 N ATOM 977 CA ASN A 61 92.145 -0.253 14.516 1.00 0.00 C ATOM 978 C ASN A 61 92.741 -1.652 14.492 1.00 0.00 C ATOM 979 O ASN A 61 92.293 -2.548 15.174 1.00 0.00 O ATOM 980 CB ASN A 61 91.194 -0.061 13.334 1.00 0.00 C ATOM 981 CG ASN A 61 89.924 -0.882 13.566 1.00 0.00 C ATOM 982 OD1 ASN A 61 89.986 -1.996 14.047 1.00 0.00 O ATOM 983 ND2 ASN A 61 88.765 -0.372 13.252 1.00 0.00 N ATOM 0 H ASN A 61 93.341 1.246 13.571 1.00 0.00 H new ATOM 0 HA ASN A 61 91.571 -0.095 15.429 1.00 0.00 H new ATOM 0 HB2 ASN A 61 90.943 0.994 13.222 1.00 0.00 H new ATOM 0 HB3 ASN A 61 91.678 -0.373 12.409 1.00 0.00 H new ATOM 0 HD21 ASN A 61 87.912 -0.908 13.410 1.00 0.00 H new ATOM 0 HD22 ASN A 61 88.712 0.563 12.848 1.00 0.00 H new ATOM 990 N LEU A 62 93.780 -1.835 13.733 1.00 0.00 N ATOM 991 CA LEU A 62 94.433 -3.168 13.702 1.00 0.00 C ATOM 992 C LEU A 62 94.917 -3.436 15.120 1.00 0.00 C ATOM 993 O LEU A 62 94.952 -4.555 15.588 1.00 0.00 O ATOM 994 CB LEU A 62 95.607 -3.166 12.717 1.00 0.00 C ATOM 995 CG LEU A 62 95.075 -3.225 11.281 1.00 0.00 C ATOM 996 CD1 LEU A 62 93.999 -2.158 11.061 1.00 0.00 C ATOM 997 CD2 LEU A 62 96.230 -2.977 10.308 1.00 0.00 C ATOM 0 H LEU A 62 94.203 -1.124 13.136 1.00 0.00 H new ATOM 0 HA LEU A 62 93.742 -3.943 13.370 1.00 0.00 H new ATOM 0 HB2 LEU A 62 96.209 -2.268 12.856 1.00 0.00 H new ATOM 0 HB3 LEU A 62 96.258 -4.019 12.910 1.00 0.00 H new ATOM 0 HG LEU A 62 94.638 -4.208 11.108 1.00 0.00 H new ATOM 0 HD11 LEU A 62 93.634 -2.216 10.036 1.00 0.00 H new ATOM 0 HD12 LEU A 62 93.172 -2.327 11.751 1.00 0.00 H new ATOM 0 HD13 LEU A 62 94.424 -1.170 11.240 1.00 0.00 H new ATOM 0 HD21 LEU A 62 95.858 -3.018 9.284 1.00 0.00 H new ATOM 0 HD22 LEU A 62 96.662 -1.994 10.499 1.00 0.00 H new ATOM 0 HD23 LEU A 62 96.994 -3.742 10.447 1.00 0.00 H new ATOM 1009 N ASP A 63 95.241 -2.380 15.819 1.00 0.00 N ATOM 1010 CA ASP A 63 95.676 -2.502 17.235 1.00 0.00 C ATOM 1011 C ASP A 63 94.422 -2.403 18.102 1.00 0.00 C ATOM 1012 O ASP A 63 94.473 -2.048 19.262 1.00 0.00 O ATOM 1013 CB ASP A 63 96.641 -1.365 17.588 1.00 0.00 C ATOM 1014 CG ASP A 63 97.971 -1.577 16.863 1.00 0.00 C ATOM 1015 OD1 ASP A 63 98.251 -2.709 16.500 1.00 0.00 O ATOM 1016 OD2 ASP A 63 98.688 -0.607 16.685 1.00 0.00 O ATOM 0 H ASP A 63 95.221 -1.425 15.460 1.00 0.00 H new ATOM 0 HA ASP A 63 96.191 -3.448 17.400 1.00 0.00 H new ATOM 0 HB2 ASP A 63 96.209 -0.406 17.303 1.00 0.00 H new ATOM 0 HB3 ASP A 63 96.804 -1.334 18.665 1.00 0.00 H new ATOM 1021 N SER A 64 93.286 -2.706 17.523 1.00 0.00 N ATOM 1022 CA SER A 64 92.007 -2.625 18.279 1.00 0.00 C ATOM 1023 C SER A 64 92.113 -3.488 19.539 1.00 0.00 C ATOM 1024 O SER A 64 93.071 -4.211 19.728 1.00 0.00 O ATOM 1025 CB SER A 64 90.860 -3.138 17.403 1.00 0.00 C ATOM 1026 OG SER A 64 91.289 -4.295 16.697 1.00 0.00 O ATOM 0 H SER A 64 93.194 -3.007 16.553 1.00 0.00 H new ATOM 0 HA SER A 64 91.811 -1.590 18.558 1.00 0.00 H new ATOM 0 HB2 SER A 64 89.994 -3.375 18.020 1.00 0.00 H new ATOM 0 HB3 SER A 64 90.549 -2.364 16.701 1.00 0.00 H new ATOM 0 HG SER A 64 91.552 -4.044 15.787 1.00 0.00 H new ATOM 1032 N ASN A 65 91.146 -3.407 20.408 1.00 0.00 N ATOM 1033 CA ASN A 65 91.202 -4.207 21.663 1.00 0.00 C ATOM 1034 C ASN A 65 91.263 -5.703 21.343 1.00 0.00 C ATOM 1035 O ASN A 65 91.974 -6.447 21.988 1.00 0.00 O ATOM 1036 CB ASN A 65 89.955 -3.920 22.505 1.00 0.00 C ATOM 1037 CG ASN A 65 90.088 -2.548 23.169 1.00 0.00 C ATOM 1038 OD1 ASN A 65 89.235 -1.696 23.011 1.00 0.00 O ATOM 1039 ND2 ASN A 65 91.131 -2.298 23.913 1.00 0.00 N ATOM 0 H ASN A 65 90.318 -2.821 20.304 1.00 0.00 H new ATOM 0 HA ASN A 65 92.098 -3.928 22.217 1.00 0.00 H new ATOM 0 HB2 ASN A 65 89.065 -3.946 21.876 1.00 0.00 H new ATOM 0 HB3 ASN A 65 89.831 -4.692 23.264 1.00 0.00 H new ATOM 0 HD21 ASN A 65 91.231 -1.388 24.362 1.00 0.00 H new ATOM 0 HD22 ASN A 65 91.846 -3.013 24.045 1.00 0.00 H new ATOM 1046 N ARG A 66 90.529 -6.164 20.365 1.00 0.00 N ATOM 1047 CA ARG A 66 90.578 -7.623 20.053 1.00 0.00 C ATOM 1048 C ARG A 66 90.010 -7.892 18.655 1.00 0.00 C ATOM 1049 O ARG A 66 90.157 -8.973 18.119 1.00 0.00 O ATOM 1050 CB ARG A 66 89.754 -8.379 21.099 1.00 0.00 C ATOM 1051 CG ARG A 66 90.048 -9.877 21.006 1.00 0.00 C ATOM 1052 CD ARG A 66 89.280 -10.615 22.104 1.00 0.00 C ATOM 1053 NE ARG A 66 89.567 -12.074 22.017 1.00 0.00 N ATOM 1054 CZ ARG A 66 89.286 -12.857 23.022 1.00 0.00 C ATOM 1055 NH1 ARG A 66 88.781 -12.361 24.118 1.00 0.00 N ATOM 1056 NH2 ARG A 66 89.520 -14.137 22.933 1.00 0.00 N ATOM 0 H ARG A 66 89.909 -5.606 19.778 1.00 0.00 H new ATOM 0 HA ARG A 66 91.614 -7.962 20.075 1.00 0.00 H new ATOM 0 HB2 ARG A 66 89.993 -8.013 22.098 1.00 0.00 H new ATOM 0 HB3 ARG A 66 88.691 -8.197 20.939 1.00 0.00 H new ATOM 0 HG2 ARG A 66 89.757 -10.256 20.026 1.00 0.00 H new ATOM 0 HG3 ARG A 66 91.118 -10.056 21.112 1.00 0.00 H new ATOM 0 HD2 ARG A 66 89.570 -10.234 23.084 1.00 0.00 H new ATOM 0 HD3 ARG A 66 88.210 -10.437 21.996 1.00 0.00 H new ATOM 0 HE ARG A 66 89.984 -12.461 21.171 1.00 0.00 H new ATOM 0 HH11 ARG A 66 88.605 -11.359 24.191 1.00 0.00 H new ATOM 0 HH12 ARG A 66 88.562 -12.975 24.902 1.00 0.00 H new ATOM 0 HH21 ARG A 66 89.922 -14.524 22.079 1.00 0.00 H new ATOM 0 HH22 ARG A 66 89.301 -14.751 23.717 1.00 0.00 H new ATOM 1070 N ASP A 67 89.360 -6.932 18.056 1.00 0.00 N ATOM 1071 CA ASP A 67 88.788 -7.165 16.699 1.00 0.00 C ATOM 1072 C ASP A 67 89.921 -7.344 15.687 1.00 0.00 C ATOM 1073 O ASP A 67 90.834 -6.545 15.615 1.00 0.00 O ATOM 1074 CB ASP A 67 87.931 -5.966 16.292 1.00 0.00 C ATOM 1075 CG ASP A 67 86.661 -5.932 17.144 1.00 0.00 C ATOM 1076 OD1 ASP A 67 86.346 -6.947 17.744 1.00 0.00 O ATOM 1077 OD2 ASP A 67 86.022 -4.895 17.178 1.00 0.00 O ATOM 0 H ASP A 67 89.201 -6.002 18.444 1.00 0.00 H new ATOM 0 HA ASP A 67 88.172 -8.064 16.718 1.00 0.00 H new ATOM 0 HB2 ASP A 67 88.494 -5.042 16.423 1.00 0.00 H new ATOM 0 HB3 ASP A 67 87.671 -6.034 15.236 1.00 0.00 H new ATOM 1082 N ASN A 68 89.873 -8.392 14.905 1.00 0.00 N ATOM 1083 CA ASN A 68 90.951 -8.631 13.896 1.00 0.00 C ATOM 1084 C ASN A 68 90.361 -9.254 12.625 1.00 0.00 C ATOM 1085 O ASN A 68 91.070 -9.882 11.865 1.00 0.00 O ATOM 1086 CB ASN A 68 91.989 -9.587 14.489 1.00 0.00 C ATOM 1087 CG ASN A 68 91.368 -10.976 14.661 1.00 0.00 C ATOM 1088 OD1 ASN A 68 90.163 -11.111 14.741 1.00 0.00 O ATOM 1089 ND2 ASN A 68 92.145 -12.023 14.711 1.00 0.00 N ATOM 0 H ASN A 68 89.133 -9.094 14.921 1.00 0.00 H new ATOM 0 HA ASN A 68 91.418 -7.680 13.641 1.00 0.00 H new ATOM 0 HB2 ASN A 68 92.860 -9.645 13.836 1.00 0.00 H new ATOM 0 HB3 ASN A 68 92.337 -9.211 15.451 1.00 0.00 H new ATOM 0 HD21 ASN A 68 91.741 -12.953 14.817 1.00 0.00 H new ATOM 0 HD22 ASN A 68 93.157 -11.911 14.644 1.00 0.00 H new ATOM 1096 N GLU A 69 89.076 -9.108 12.394 1.00 0.00 N ATOM 1097 CA GLU A 69 88.446 -9.720 11.173 1.00 0.00 C ATOM 1098 C GLU A 69 87.800 -8.640 10.306 1.00 0.00 C ATOM 1099 O GLU A 69 87.280 -7.653 10.789 1.00 0.00 O ATOM 1100 CB GLU A 69 87.386 -10.736 11.599 1.00 0.00 C ATOM 1101 CG GLU A 69 86.772 -11.400 10.362 1.00 0.00 C ATOM 1102 CD GLU A 69 85.735 -12.437 10.800 1.00 0.00 C ATOM 1103 OE1 GLU A 69 85.676 -12.723 11.985 1.00 0.00 O ATOM 1104 OE2 GLU A 69 85.017 -12.927 9.943 1.00 0.00 O ATOM 0 H GLU A 69 88.435 -8.592 12.997 1.00 0.00 H new ATOM 0 HA GLU A 69 89.221 -10.219 10.591 1.00 0.00 H new ATOM 0 HB2 GLU A 69 87.833 -11.492 12.244 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.608 -10.241 12.180 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.304 -10.648 9.727 1.00 0.00 H new ATOM 0 HG3 GLU A 69 87.551 -11.878 9.768 1.00 0.00 H new ATOM 1111 N VAL A 70 87.836 -8.841 9.017 1.00 0.00 N ATOM 1112 CA VAL A 70 87.238 -7.864 8.059 1.00 0.00 C ATOM 1113 C VAL A 70 86.136 -8.548 7.268 1.00 0.00 C ATOM 1114 O VAL A 70 86.385 -9.403 6.441 1.00 0.00 O ATOM 1115 CB VAL A 70 88.315 -7.419 7.072 1.00 0.00 C ATOM 1116 CG1 VAL A 70 87.851 -6.177 6.335 1.00 0.00 C ATOM 1117 CG2 VAL A 70 89.609 -7.110 7.810 1.00 0.00 C ATOM 0 H VAL A 70 88.263 -9.657 8.578 1.00 0.00 H new ATOM 0 HA VAL A 70 86.839 -7.012 8.610 1.00 0.00 H new ATOM 0 HB VAL A 70 88.492 -8.225 6.360 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.622 -5.862 5.632 1.00 0.00 H new ATOM 0 HG12 VAL A 70 86.932 -6.398 5.792 1.00 0.00 H new ATOM 0 HG13 VAL A 70 87.665 -5.377 7.052 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.369 -6.794 7.095 1.00 0.00 H new ATOM 0 HG22 VAL A 70 89.435 -6.312 8.531 1.00 0.00 H new ATOM 0 HG23 VAL A 70 89.952 -8.003 8.333 1.00 0.00 H new ATOM 1127 N ASP A 71 84.931 -8.139 7.472 1.00 0.00 N ATOM 1128 CA ASP A 71 83.813 -8.713 6.689 1.00 0.00 C ATOM 1129 C ASP A 71 83.652 -7.804 5.484 1.00 0.00 C ATOM 1130 O ASP A 71 84.262 -6.756 5.420 1.00 0.00 O ATOM 1131 CB ASP A 71 82.533 -8.712 7.526 1.00 0.00 C ATOM 1132 CG ASP A 71 82.660 -9.743 8.648 1.00 0.00 C ATOM 1133 OD1 ASP A 71 83.481 -10.636 8.514 1.00 0.00 O ATOM 1134 OD2 ASP A 71 81.933 -9.625 9.620 1.00 0.00 O ATOM 0 H ASP A 71 84.665 -7.426 8.152 1.00 0.00 H new ATOM 0 HA ASP A 71 84.009 -9.744 6.394 1.00 0.00 H new ATOM 0 HB2 ASP A 71 82.360 -7.721 7.946 1.00 0.00 H new ATOM 0 HB3 ASP A 71 81.674 -8.946 6.897 1.00 0.00 H new ATOM 1139 N PHE A 72 82.854 -8.157 4.530 1.00 0.00 N ATOM 1140 CA PHE A 72 82.705 -7.258 3.371 1.00 0.00 C ATOM 1141 C PHE A 72 82.256 -5.896 3.895 1.00 0.00 C ATOM 1142 O PHE A 72 82.680 -4.860 3.422 1.00 0.00 O ATOM 1143 CB PHE A 72 81.663 -7.828 2.414 1.00 0.00 C ATOM 1144 CG PHE A 72 81.526 -6.900 1.243 1.00 0.00 C ATOM 1145 CD1 PHE A 72 82.336 -7.078 0.121 1.00 0.00 C ATOM 1146 CD2 PHE A 72 80.593 -5.862 1.282 1.00 0.00 C ATOM 1147 CE1 PHE A 72 82.215 -6.213 -0.967 1.00 0.00 C ATOM 1148 CE2 PHE A 72 80.471 -4.998 0.193 1.00 0.00 C ATOM 1149 CZ PHE A 72 81.282 -5.171 -0.934 1.00 0.00 C ATOM 0 H PHE A 72 82.306 -9.017 4.502 1.00 0.00 H new ATOM 0 HA PHE A 72 83.647 -7.160 2.831 1.00 0.00 H new ATOM 0 HB2 PHE A 72 81.963 -8.820 2.077 1.00 0.00 H new ATOM 0 HB3 PHE A 72 80.705 -7.940 2.922 1.00 0.00 H new ATOM 0 HD1 PHE A 72 83.055 -7.883 0.095 1.00 0.00 H new ATOM 0 HD2 PHE A 72 79.968 -5.728 2.152 1.00 0.00 H new ATOM 0 HE1 PHE A 72 82.842 -6.348 -1.836 1.00 0.00 H new ATOM 0 HE2 PHE A 72 79.750 -4.195 0.220 1.00 0.00 H new ATOM 0 HZ PHE A 72 81.188 -4.502 -1.776 1.00 0.00 H new ATOM 1159 N GLN A 73 81.402 -5.898 4.879 1.00 0.00 N ATOM 1160 CA GLN A 73 80.919 -4.616 5.453 1.00 0.00 C ATOM 1161 C GLN A 73 82.060 -3.866 6.153 1.00 0.00 C ATOM 1162 O GLN A 73 82.148 -2.664 6.058 1.00 0.00 O ATOM 1163 CB GLN A 73 79.798 -4.887 6.463 1.00 0.00 C ATOM 1164 CG GLN A 73 79.294 -3.558 7.036 1.00 0.00 C ATOM 1165 CD GLN A 73 78.042 -3.803 7.883 1.00 0.00 C ATOM 1166 OE1 GLN A 73 77.743 -4.925 8.237 1.00 0.00 O ATOM 1167 NE2 GLN A 73 77.292 -2.790 8.224 1.00 0.00 N ATOM 0 H GLN A 73 81.017 -6.738 5.311 1.00 0.00 H new ATOM 0 HA GLN A 73 80.541 -3.999 4.638 1.00 0.00 H new ATOM 0 HB2 GLN A 73 78.980 -5.420 5.980 1.00 0.00 H new ATOM 0 HB3 GLN A 73 80.164 -5.526 7.266 1.00 0.00 H new ATOM 0 HG2 GLN A 73 80.071 -3.095 7.644 1.00 0.00 H new ATOM 0 HG3 GLN A 73 79.067 -2.864 6.226 1.00 0.00 H new ATOM 0 HE21 GLN A 73 77.543 -1.847 7.927 1.00 0.00 H new ATOM 0 HE22 GLN A 73 76.455 -2.942 8.788 1.00 0.00 H new ATOM 1176 N GLU A 74 82.934 -4.532 6.869 1.00 0.00 N ATOM 1177 CA GLU A 74 84.014 -3.773 7.550 1.00 0.00 C ATOM 1178 C GLU A 74 84.990 -3.232 6.522 1.00 0.00 C ATOM 1179 O GLU A 74 85.457 -2.116 6.630 1.00 0.00 O ATOM 1180 CB GLU A 74 84.746 -4.687 8.532 1.00 0.00 C ATOM 1181 CG GLU A 74 83.824 -5.004 9.708 1.00 0.00 C ATOM 1182 CD GLU A 74 84.548 -5.920 10.695 1.00 0.00 C ATOM 1183 OE1 GLU A 74 85.217 -5.402 11.573 1.00 0.00 O ATOM 1184 OE2 GLU A 74 84.420 -7.126 10.557 1.00 0.00 O ATOM 0 H GLU A 74 82.944 -5.543 7.006 1.00 0.00 H new ATOM 0 HA GLU A 74 83.576 -2.938 8.097 1.00 0.00 H new ATOM 0 HB2 GLU A 74 85.049 -5.608 8.033 1.00 0.00 H new ATOM 0 HB3 GLU A 74 85.656 -4.204 8.888 1.00 0.00 H new ATOM 0 HG2 GLU A 74 83.523 -4.082 10.206 1.00 0.00 H new ATOM 0 HG3 GLU A 74 82.914 -5.485 9.350 1.00 0.00 H new ATOM 1191 N TYR A 75 85.305 -3.998 5.522 1.00 0.00 N ATOM 1192 CA TYR A 75 86.255 -3.490 4.505 1.00 0.00 C ATOM 1193 C TYR A 75 85.665 -2.227 3.871 1.00 0.00 C ATOM 1194 O TYR A 75 86.360 -1.265 3.609 1.00 0.00 O ATOM 1195 CB TYR A 75 86.492 -4.553 3.423 1.00 0.00 C ATOM 1196 CG TYR A 75 87.253 -3.948 2.255 1.00 0.00 C ATOM 1197 CD1 TYR A 75 88.468 -3.276 2.470 1.00 0.00 C ATOM 1198 CD2 TYR A 75 86.737 -4.058 0.955 1.00 0.00 C ATOM 1199 CE1 TYR A 75 89.159 -2.719 1.386 1.00 0.00 C ATOM 1200 CE2 TYR A 75 87.432 -3.500 -0.124 1.00 0.00 C ATOM 1201 CZ TYR A 75 88.641 -2.832 0.091 1.00 0.00 C ATOM 1202 OH TYR A 75 89.324 -2.283 -0.975 1.00 0.00 O ATOM 0 H TYR A 75 84.951 -4.942 5.366 1.00 0.00 H new ATOM 0 HA TYR A 75 87.210 -3.260 4.978 1.00 0.00 H new ATOM 0 HB2 TYR A 75 87.054 -5.389 3.840 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.538 -4.951 3.078 1.00 0.00 H new ATOM 0 HD1 TYR A 75 88.869 -3.189 3.469 1.00 0.00 H new ATOM 0 HD2 TYR A 75 85.803 -4.574 0.787 1.00 0.00 H new ATOM 0 HE1 TYR A 75 90.093 -2.202 1.550 1.00 0.00 H new ATOM 0 HE2 TYR A 75 87.034 -3.586 -1.124 1.00 0.00 H new ATOM 0 HH TYR A 75 88.828 -2.452 -1.803 1.00 0.00 H new ATOM 1212 N CYS A 76 84.383 -2.230 3.624 1.00 0.00 N ATOM 1213 CA CYS A 76 83.732 -1.047 3.011 1.00 0.00 C ATOM 1214 C CYS A 76 83.719 0.090 4.023 1.00 0.00 C ATOM 1215 O CYS A 76 83.941 1.235 3.680 1.00 0.00 O ATOM 1216 CB CYS A 76 82.299 -1.395 2.574 1.00 0.00 C ATOM 1217 SG CYS A 76 81.158 -1.287 3.978 1.00 0.00 S ATOM 0 H CYS A 76 83.757 -3.010 3.824 1.00 0.00 H new ATOM 0 HA CYS A 76 84.290 -0.739 2.127 1.00 0.00 H new ATOM 0 HB2 CYS A 76 81.979 -0.714 1.785 1.00 0.00 H new ATOM 0 HB3 CYS A 76 82.275 -2.401 2.156 1.00 0.00 H new ATOM 0 HG CYS A 76 81.698 -1.847 5.020 1.00 0.00 H new ATOM 1223 N VAL A 77 83.479 -0.203 5.274 1.00 0.00 N ATOM 1224 CA VAL A 77 83.485 0.894 6.264 1.00 0.00 C ATOM 1225 C VAL A 77 84.867 1.525 6.236 1.00 0.00 C ATOM 1226 O VAL A 77 85.010 2.732 6.261 1.00 0.00 O ATOM 1227 CB VAL A 77 83.183 0.333 7.658 1.00 0.00 C ATOM 1228 CG1 VAL A 77 83.438 1.407 8.720 1.00 0.00 C ATOM 1229 CG2 VAL A 77 81.712 -0.100 7.720 1.00 0.00 C ATOM 0 H VAL A 77 83.284 -1.135 5.640 1.00 0.00 H new ATOM 0 HA VAL A 77 82.725 1.638 6.027 1.00 0.00 H new ATOM 0 HB VAL A 77 83.831 -0.522 7.850 1.00 0.00 H new ATOM 0 HG11 VAL A 77 83.221 1.001 9.708 1.00 0.00 H new ATOM 0 HG12 VAL A 77 84.481 1.720 8.678 1.00 0.00 H new ATOM 0 HG13 VAL A 77 82.793 2.266 8.531 1.00 0.00 H new ATOM 0 HG21 VAL A 77 81.492 -0.500 8.710 1.00 0.00 H new ATOM 0 HG22 VAL A 77 81.071 0.760 7.525 1.00 0.00 H new ATOM 0 HG23 VAL A 77 81.527 -0.868 6.969 1.00 0.00 H new ATOM 1239 N PHE A 78 85.890 0.723 6.154 1.00 0.00 N ATOM 1240 CA PHE A 78 87.252 1.301 6.092 1.00 0.00 C ATOM 1241 C PHE A 78 87.449 1.989 4.744 1.00 0.00 C ATOM 1242 O PHE A 78 88.040 3.042 4.665 1.00 0.00 O ATOM 1243 CB PHE A 78 88.305 0.201 6.249 1.00 0.00 C ATOM 1244 CG PHE A 78 88.291 -0.326 7.670 1.00 0.00 C ATOM 1245 CD1 PHE A 78 88.605 0.525 8.740 1.00 0.00 C ATOM 1246 CD2 PHE A 78 87.957 -1.665 7.918 1.00 0.00 C ATOM 1247 CE1 PHE A 78 88.582 0.038 10.051 1.00 0.00 C ATOM 1248 CE2 PHE A 78 87.938 -2.150 9.231 1.00 0.00 C ATOM 1249 CZ PHE A 78 88.248 -1.299 10.296 1.00 0.00 C ATOM 0 H PHE A 78 85.840 -0.295 6.128 1.00 0.00 H new ATOM 0 HA PHE A 78 87.365 2.022 6.902 1.00 0.00 H new ATOM 0 HB2 PHE A 78 88.104 -0.610 5.549 1.00 0.00 H new ATOM 0 HB3 PHE A 78 89.293 0.593 6.007 1.00 0.00 H new ATOM 0 HD1 PHE A 78 88.865 1.556 8.552 1.00 0.00 H new ATOM 0 HD2 PHE A 78 87.714 -2.322 7.096 1.00 0.00 H new ATOM 0 HE1 PHE A 78 88.822 0.694 10.875 1.00 0.00 H new ATOM 0 HE2 PHE A 78 87.684 -3.182 9.421 1.00 0.00 H new ATOM 0 HZ PHE A 78 88.230 -1.674 11.309 1.00 0.00 H new ATOM 1259 N LEU A 79 86.964 1.410 3.676 1.00 0.00 N ATOM 1260 CA LEU A 79 87.159 2.062 2.347 1.00 0.00 C ATOM 1261 C LEU A 79 86.368 3.371 2.301 1.00 0.00 C ATOM 1262 O LEU A 79 86.817 4.365 1.767 1.00 0.00 O ATOM 1263 CB LEU A 79 86.697 1.124 1.228 1.00 0.00 C ATOM 1264 CG LEU A 79 86.929 1.767 -0.149 1.00 0.00 C ATOM 1265 CD1 LEU A 79 88.425 2.086 -0.347 1.00 0.00 C ATOM 1266 CD2 LEU A 79 86.464 0.783 -1.235 1.00 0.00 C ATOM 0 H LEU A 79 86.450 0.529 3.665 1.00 0.00 H new ATOM 0 HA LEU A 79 88.218 2.278 2.203 1.00 0.00 H new ATOM 0 HB2 LEU A 79 87.239 0.180 1.290 1.00 0.00 H new ATOM 0 HB3 LEU A 79 85.639 0.893 1.354 1.00 0.00 H new ATOM 0 HG LEU A 79 86.365 2.697 -0.216 1.00 0.00 H new ATOM 0 HD11 LEU A 79 88.574 2.541 -1.326 1.00 0.00 H new ATOM 0 HD12 LEU A 79 88.755 2.778 0.428 1.00 0.00 H new ATOM 0 HD13 LEU A 79 89.005 1.165 -0.283 1.00 0.00 H new ATOM 0 HD21 LEU A 79 86.622 1.225 -2.219 1.00 0.00 H new ATOM 0 HD22 LEU A 79 87.035 -0.142 -1.157 1.00 0.00 H new ATOM 0 HD23 LEU A 79 85.404 0.567 -1.101 1.00 0.00 H new ATOM 1278 N SER A 80 85.189 3.376 2.861 1.00 0.00 N ATOM 1279 CA SER A 80 84.365 4.616 2.854 1.00 0.00 C ATOM 1280 C SER A 80 85.020 5.638 3.768 1.00 0.00 C ATOM 1281 O SER A 80 85.146 6.801 3.437 1.00 0.00 O ATOM 1282 CB SER A 80 82.958 4.305 3.364 1.00 0.00 C ATOM 1283 OG SER A 80 82.145 5.464 3.230 1.00 0.00 O ATOM 0 H SER A 80 84.761 2.574 3.323 1.00 0.00 H new ATOM 0 HA SER A 80 84.296 5.009 1.840 1.00 0.00 H new ATOM 0 HB2 SER A 80 82.528 3.478 2.799 1.00 0.00 H new ATOM 0 HB3 SER A 80 82.997 3.992 4.407 1.00 0.00 H new ATOM 0 HG SER A 80 81.205 5.197 3.158 1.00 0.00 H new ATOM 1289 N CYS A 81 85.464 5.205 4.912 1.00 0.00 N ATOM 1290 CA CYS A 81 86.143 6.138 5.838 1.00 0.00 C ATOM 1291 C CYS A 81 87.361 6.692 5.119 1.00 0.00 C ATOM 1292 O CYS A 81 87.700 7.852 5.240 1.00 0.00 O ATOM 1293 CB CYS A 81 86.590 5.391 7.096 1.00 0.00 C ATOM 1294 SG CYS A 81 85.143 4.976 8.100 1.00 0.00 S ATOM 0 H CYS A 81 85.384 4.243 5.243 1.00 0.00 H new ATOM 0 HA CYS A 81 85.467 6.941 6.133 1.00 0.00 H new ATOM 0 HB2 CYS A 81 87.127 4.483 6.821 1.00 0.00 H new ATOM 0 HB3 CYS A 81 87.280 6.008 7.672 1.00 0.00 H new ATOM 0 HG CYS A 81 84.553 3.931 7.600 1.00 0.00 H new ATOM 1300 N ILE A 82 88.019 5.862 4.357 1.00 0.00 N ATOM 1301 CA ILE A 82 89.217 6.346 3.615 1.00 0.00 C ATOM 1302 C ILE A 82 88.770 7.334 2.537 1.00 0.00 C ATOM 1303 O ILE A 82 89.397 8.350 2.317 1.00 0.00 O ATOM 1304 CB ILE A 82 89.945 5.156 2.974 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.623 4.310 4.070 1.00 0.00 C ATOM 1306 CG2 ILE A 82 91.009 5.665 1.993 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.901 2.893 3.546 1.00 0.00 C ATOM 0 H ILE A 82 87.782 4.880 4.217 1.00 0.00 H new ATOM 0 HA ILE A 82 89.901 6.845 4.302 1.00 0.00 H new ATOM 0 HB ILE A 82 89.221 4.543 2.437 1.00 0.00 H new ATOM 0 HG12 ILE A 82 91.556 4.781 4.379 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.983 4.261 4.951 1.00 0.00 H new ATOM 0 HG21 ILE A 82 91.523 4.817 1.541 1.00 0.00 H new ATOM 0 HG22 ILE A 82 90.531 6.257 1.213 1.00 0.00 H new ATOM 0 HG23 ILE A 82 91.730 6.283 2.527 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.380 2.303 4.328 1.00 0.00 H new ATOM 0 HD12 ILE A 82 89.962 2.420 3.259 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.559 2.948 2.679 1.00 0.00 H new ATOM 1319 N ALA A 83 87.688 7.048 1.869 1.00 0.00 N ATOM 1320 CA ALA A 83 87.208 7.981 0.816 1.00 0.00 C ATOM 1321 C ALA A 83 86.838 9.318 1.455 1.00 0.00 C ATOM 1322 O ALA A 83 87.241 10.363 0.998 1.00 0.00 O ATOM 1323 CB ALA A 83 85.981 7.393 0.127 1.00 0.00 C ATOM 0 H ALA A 83 87.119 6.213 2.006 1.00 0.00 H new ATOM 0 HA ALA A 83 87.998 8.131 0.080 1.00 0.00 H new ATOM 0 HB1 ALA A 83 85.632 8.080 -0.644 1.00 0.00 H new ATOM 0 HB2 ALA A 83 86.242 6.438 -0.329 1.00 0.00 H new ATOM 0 HB3 ALA A 83 85.190 7.240 0.861 1.00 0.00 H new ATOM 1329 N MET A 84 86.080 9.299 2.518 1.00 0.00 N ATOM 1330 CA MET A 84 85.711 10.586 3.171 1.00 0.00 C ATOM 1331 C MET A 84 86.977 11.246 3.690 1.00 0.00 C ATOM 1332 O MET A 84 87.116 12.452 3.666 1.00 0.00 O ATOM 1333 CB MET A 84 84.731 10.342 4.318 1.00 0.00 C ATOM 1334 CG MET A 84 83.379 9.916 3.743 1.00 0.00 C ATOM 1335 SD MET A 84 82.193 9.676 5.090 1.00 0.00 S ATOM 1336 CE MET A 84 82.991 8.243 5.854 1.00 0.00 C ATOM 0 H MET A 84 85.705 8.459 2.958 1.00 0.00 H new ATOM 0 HA MET A 84 85.224 11.239 2.447 1.00 0.00 H new ATOM 0 HB2 MET A 84 85.116 9.569 4.983 1.00 0.00 H new ATOM 0 HB3 MET A 84 84.617 11.248 4.914 1.00 0.00 H new ATOM 0 HG2 MET A 84 83.011 10.675 3.052 1.00 0.00 H new ATOM 0 HG3 MET A 84 83.489 8.993 3.174 1.00 0.00 H new ATOM 0 HE1 MET A 84 82.252 7.672 6.416 1.00 0.00 H new ATOM 0 HE2 MET A 84 83.424 7.611 5.078 1.00 0.00 H new ATOM 0 HE3 MET A 84 83.778 8.581 6.528 1.00 0.00 H new ATOM 1346 N MET A 85 87.917 10.466 4.132 1.00 0.00 N ATOM 1347 CA MET A 85 89.181 11.060 4.618 1.00 0.00 C ATOM 1348 C MET A 85 89.783 11.831 3.449 1.00 0.00 C ATOM 1349 O MET A 85 90.428 12.845 3.626 1.00 0.00 O ATOM 1350 CB MET A 85 90.145 9.957 5.067 1.00 0.00 C ATOM 1351 CG MET A 85 91.436 10.586 5.599 1.00 0.00 C ATOM 1352 SD MET A 85 92.580 9.277 6.104 1.00 0.00 S ATOM 1353 CE MET A 85 94.111 10.216 5.876 1.00 0.00 C ATOM 0 H MET A 85 87.863 9.448 4.177 1.00 0.00 H new ATOM 0 HA MET A 85 89.001 11.714 5.471 1.00 0.00 H new ATOM 0 HB2 MET A 85 89.680 9.347 5.842 1.00 0.00 H new ATOM 0 HB3 MET A 85 90.369 9.294 4.231 1.00 0.00 H new ATOM 0 HG2 MET A 85 91.894 11.208 4.830 1.00 0.00 H new ATOM 0 HG3 MET A 85 91.215 11.237 6.445 1.00 0.00 H new ATOM 0 HE1 MET A 85 94.964 9.589 6.135 1.00 0.00 H new ATOM 0 HE2 MET A 85 94.194 10.530 4.835 1.00 0.00 H new ATOM 0 HE3 MET A 85 94.098 11.095 6.520 1.00 0.00 H new ATOM 1363 N CYS A 86 89.558 11.368 2.243 1.00 0.00 N ATOM 1364 CA CYS A 86 90.102 12.100 1.067 1.00 0.00 C ATOM 1365 C CYS A 86 89.524 11.523 -0.224 1.00 0.00 C ATOM 1366 O CYS A 86 90.184 10.806 -0.948 1.00 0.00 O ATOM 1367 CB CYS A 86 91.627 11.992 1.047 1.00 0.00 C ATOM 1368 SG CYS A 86 92.264 12.744 -0.471 1.00 0.00 S ATOM 0 H CYS A 86 89.027 10.524 2.028 1.00 0.00 H new ATOM 0 HA CYS A 86 89.819 13.150 1.143 1.00 0.00 H new ATOM 0 HB2 CYS A 86 92.049 12.492 1.919 1.00 0.00 H new ATOM 0 HB3 CYS A 86 91.929 10.946 1.102 1.00 0.00 H new ATOM 0 HG CYS A 86 91.671 12.215 -1.500 1.00 0.00 H new ATOM 1374 N ASN A 87 88.294 11.836 -0.514 1.00 0.00 N ATOM 1375 CA ASN A 87 87.667 11.311 -1.757 1.00 0.00 C ATOM 1376 C ASN A 87 88.310 11.976 -2.973 1.00 0.00 C ATOM 1377 O ASN A 87 88.601 11.330 -3.958 1.00 0.00 O ATOM 1378 CB ASN A 87 86.170 11.633 -1.740 1.00 0.00 C ATOM 1379 CG ASN A 87 85.978 13.151 -1.770 1.00 0.00 C ATOM 1380 OD1 ASN A 87 86.762 13.884 -1.199 1.00 0.00 O ATOM 1381 ND2 ASN A 87 84.966 13.659 -2.418 1.00 0.00 N ATOM 0 H ASN A 87 87.695 12.433 0.056 1.00 0.00 H new ATOM 0 HA ASN A 87 87.813 10.232 -1.812 1.00 0.00 H new ATOM 0 HB2 ASN A 87 85.678 11.176 -2.599 1.00 0.00 H new ATOM 0 HB3 ASN A 87 85.706 11.214 -0.847 1.00 0.00 H new ATOM 0 HD21 ASN A 87 84.833 14.670 -2.445 1.00 0.00 H new ATOM 0 HD22 ASN A 87 84.307 13.045 -2.898 1.00 0.00 H new ATOM 1388 N GLU A 88 88.542 13.262 -2.904 1.00 0.00 N ATOM 1389 CA GLU A 88 89.171 13.973 -4.056 1.00 0.00 C ATOM 1390 C GLU A 88 89.427 15.434 -3.673 1.00 0.00 C ATOM 1391 O GLU A 88 90.538 15.922 -3.744 1.00 0.00 O ATOM 1392 CB GLU A 88 88.229 13.922 -5.268 1.00 0.00 C ATOM 1393 CG GLU A 88 88.872 14.637 -6.459 1.00 0.00 C ATOM 1394 CD GLU A 88 87.941 14.545 -7.669 1.00 0.00 C ATOM 1395 OE1 GLU A 88 86.975 13.804 -7.593 1.00 0.00 O ATOM 1396 OE2 GLU A 88 88.214 15.213 -8.653 1.00 0.00 O ATOM 0 H GLU A 88 88.323 13.850 -2.100 1.00 0.00 H new ATOM 0 HA GLU A 88 90.115 13.490 -4.309 1.00 0.00 H new ATOM 0 HB2 GLU A 88 88.013 12.886 -5.528 1.00 0.00 H new ATOM 0 HB3 GLU A 88 87.278 14.393 -5.020 1.00 0.00 H new ATOM 0 HG2 GLU A 88 89.062 15.681 -6.211 1.00 0.00 H new ATOM 0 HG3 GLU A 88 89.836 14.184 -6.692 1.00 0.00 H new ATOM 1403 N PHE A 89 88.399 16.139 -3.281 1.00 0.00 N ATOM 1404 CA PHE A 89 88.564 17.573 -2.910 1.00 0.00 C ATOM 1405 C PHE A 89 89.373 17.695 -1.615 1.00 0.00 C ATOM 1406 O PHE A 89 89.247 16.892 -0.712 1.00 0.00 O ATOM 1407 CB PHE A 89 87.185 18.205 -2.719 1.00 0.00 C ATOM 1408 CG PHE A 89 86.488 18.298 -4.056 1.00 0.00 C ATOM 1409 CD1 PHE A 89 85.686 17.240 -4.501 1.00 0.00 C ATOM 1410 CD2 PHE A 89 86.648 19.439 -4.853 1.00 0.00 C ATOM 1411 CE1 PHE A 89 85.042 17.323 -5.741 1.00 0.00 C ATOM 1412 CE2 PHE A 89 86.003 19.521 -6.093 1.00 0.00 C ATOM 1413 CZ PHE A 89 85.200 18.464 -6.538 1.00 0.00 C ATOM 0 H PHE A 89 87.447 15.780 -3.202 1.00 0.00 H new ATOM 0 HA PHE A 89 89.099 18.091 -3.706 1.00 0.00 H new ATOM 0 HB2 PHE A 89 86.591 17.607 -2.027 1.00 0.00 H new ATOM 0 HB3 PHE A 89 87.285 19.197 -2.278 1.00 0.00 H new ATOM 0 HD1 PHE A 89 85.564 16.360 -3.887 1.00 0.00 H new ATOM 0 HD2 PHE A 89 87.268 20.254 -4.511 1.00 0.00 H new ATOM 0 HE1 PHE A 89 84.423 16.507 -6.083 1.00 0.00 H new ATOM 0 HE2 PHE A 89 86.125 20.401 -6.707 1.00 0.00 H new ATOM 0 HZ PHE A 89 84.703 18.528 -7.495 1.00 0.00 H new ATOM 1423 N PHE A 90 90.210 18.696 -1.528 1.00 0.00 N ATOM 1424 CA PHE A 90 91.044 18.885 -0.304 1.00 0.00 C ATOM 1425 C PHE A 90 90.270 19.725 0.714 1.00 0.00 C ATOM 1426 O PHE A 90 90.693 19.905 1.838 1.00 0.00 O ATOM 1427 CB PHE A 90 92.329 19.619 -0.695 1.00 0.00 C ATOM 1428 CG PHE A 90 92.987 18.882 -1.834 1.00 0.00 C ATOM 1429 CD1 PHE A 90 92.639 19.192 -3.154 1.00 0.00 C ATOM 1430 CD2 PHE A 90 93.935 17.886 -1.575 1.00 0.00 C ATOM 1431 CE1 PHE A 90 93.237 18.507 -4.214 1.00 0.00 C ATOM 1432 CE2 PHE A 90 94.536 17.201 -2.638 1.00 0.00 C ATOM 1433 CZ PHE A 90 94.185 17.511 -3.958 1.00 0.00 C ATOM 0 H PHE A 90 90.352 19.395 -2.257 1.00 0.00 H new ATOM 0 HA PHE A 90 91.285 17.917 0.136 1.00 0.00 H new ATOM 0 HB2 PHE A 90 92.103 20.644 -0.990 1.00 0.00 H new ATOM 0 HB3 PHE A 90 93.005 19.675 0.158 1.00 0.00 H new ATOM 0 HD1 PHE A 90 91.908 19.961 -3.353 1.00 0.00 H new ATOM 0 HD2 PHE A 90 94.203 17.646 -0.557 1.00 0.00 H new ATOM 0 HE1 PHE A 90 92.967 18.746 -5.232 1.00 0.00 H new ATOM 0 HE2 PHE A 90 95.270 16.434 -2.440 1.00 0.00 H new ATOM 0 HZ PHE A 90 94.646 16.981 -4.778 1.00 0.00 H new ATOM 1443 N GLU A 91 89.137 20.240 0.323 1.00 0.00 N ATOM 1444 CA GLU A 91 88.328 21.073 1.262 1.00 0.00 C ATOM 1445 C GLU A 91 87.949 20.237 2.488 1.00 0.00 C ATOM 1446 O GLU A 91 87.716 19.049 2.394 1.00 0.00 O ATOM 1447 CB GLU A 91 87.056 21.554 0.554 1.00 0.00 C ATOM 1448 CG GLU A 91 86.255 22.480 1.481 1.00 0.00 C ATOM 1449 CD GLU A 91 87.065 23.745 1.773 1.00 0.00 C ATOM 1450 OE1 GLU A 91 87.965 24.040 1.003 1.00 0.00 O ATOM 1451 OE2 GLU A 91 86.769 24.401 2.758 1.00 0.00 O ATOM 0 H GLU A 91 88.735 20.121 -0.607 1.00 0.00 H new ATOM 0 HA GLU A 91 88.913 21.936 1.579 1.00 0.00 H new ATOM 0 HB2 GLU A 91 87.318 22.082 -0.363 1.00 0.00 H new ATOM 0 HB3 GLU A 91 86.445 20.699 0.265 1.00 0.00 H new ATOM 0 HG2 GLU A 91 85.306 22.744 1.015 1.00 0.00 H new ATOM 0 HG3 GLU A 91 86.020 21.964 2.412 1.00 0.00 H new ATOM 1458 N GLY A 92 87.889 20.851 3.641 1.00 0.00 N ATOM 1459 CA GLY A 92 87.528 20.090 4.871 1.00 0.00 C ATOM 1460 C GLY A 92 86.265 19.271 4.607 1.00 0.00 C ATOM 1461 O GLY A 92 85.341 19.724 3.963 1.00 0.00 O ATOM 0 H GLY A 92 88.074 21.844 3.783 1.00 0.00 H new ATOM 0 HA2 GLY A 92 88.348 19.432 5.159 1.00 0.00 H new ATOM 0 HA3 GLY A 92 87.363 20.776 5.702 1.00 0.00 H new ATOM 1465 N PHE A 93 86.225 18.058 5.090 1.00 0.00 N ATOM 1466 CA PHE A 93 85.031 17.195 4.858 1.00 0.00 C ATOM 1467 C PHE A 93 83.999 17.441 5.975 1.00 0.00 C ATOM 1468 O PHE A 93 84.372 17.741 7.091 1.00 0.00 O ATOM 1469 CB PHE A 93 85.483 15.736 4.884 1.00 0.00 C ATOM 1470 CG PHE A 93 86.737 15.610 4.054 1.00 0.00 C ATOM 1471 CD1 PHE A 93 87.986 15.904 4.617 1.00 0.00 C ATOM 1472 CD2 PHE A 93 86.649 15.215 2.715 1.00 0.00 C ATOM 1473 CE1 PHE A 93 89.145 15.803 3.839 1.00 0.00 C ATOM 1474 CE2 PHE A 93 87.808 15.111 1.938 1.00 0.00 C ATOM 1475 CZ PHE A 93 89.057 15.406 2.500 1.00 0.00 C ATOM 0 H PHE A 93 86.970 17.627 5.637 1.00 0.00 H new ATOM 0 HA PHE A 93 84.574 17.427 3.896 1.00 0.00 H new ATOM 0 HB2 PHE A 93 85.673 15.416 5.909 1.00 0.00 H new ATOM 0 HB3 PHE A 93 84.700 15.089 4.488 1.00 0.00 H new ATOM 0 HD1 PHE A 93 88.054 16.208 5.651 1.00 0.00 H new ATOM 0 HD2 PHE A 93 85.686 14.990 2.281 1.00 0.00 H new ATOM 0 HE1 PHE A 93 90.108 16.032 4.272 1.00 0.00 H new ATOM 0 HE2 PHE A 93 87.740 14.803 0.905 1.00 0.00 H new ATOM 0 HZ PHE A 93 89.952 15.327 1.900 1.00 0.00 H new ATOM 1485 N PRO A 94 82.711 17.318 5.703 1.00 0.00 N ATOM 1486 CA PRO A 94 81.688 17.545 6.765 1.00 0.00 C ATOM 1487 C PRO A 94 81.786 16.494 7.885 1.00 0.00 C ATOM 1488 O PRO A 94 80.796 15.963 8.346 1.00 0.00 O ATOM 1489 CB PRO A 94 80.363 17.433 5.981 1.00 0.00 C ATOM 1490 CG PRO A 94 80.674 16.807 4.610 1.00 0.00 C ATOM 1491 CD PRO A 94 82.184 16.954 4.352 1.00 0.00 C ATOM 0 HA PRO A 94 81.802 18.498 7.282 1.00 0.00 H new ATOM 0 HB2 PRO A 94 79.648 16.818 6.527 1.00 0.00 H new ATOM 0 HB3 PRO A 94 79.909 18.416 5.857 1.00 0.00 H new ATOM 0 HG2 PRO A 94 80.386 15.756 4.597 1.00 0.00 H new ATOM 0 HG3 PRO A 94 80.103 17.304 3.826 1.00 0.00 H new ATOM 0 HD2 PRO A 94 82.624 16.028 3.981 1.00 0.00 H new ATOM 0 HD3 PRO A 94 82.396 17.726 3.613 1.00 0.00 H new ATOM 1499 N ASP A 95 82.984 16.198 8.321 1.00 0.00 N ATOM 1500 CA ASP A 95 83.168 15.192 9.407 1.00 0.00 C ATOM 1501 C ASP A 95 82.641 13.831 8.948 1.00 0.00 C ATOM 1502 O ASP A 95 81.621 13.737 8.294 1.00 0.00 O ATOM 1503 CB ASP A 95 82.417 15.642 10.666 1.00 0.00 C ATOM 1504 CG ASP A 95 82.666 17.133 10.900 1.00 0.00 C ATOM 1505 OD1 ASP A 95 83.764 17.583 10.613 1.00 0.00 O ATOM 1506 OD2 ASP A 95 81.755 17.801 11.362 1.00 0.00 O ATOM 0 H ASP A 95 83.846 16.613 7.968 1.00 0.00 H new ATOM 0 HA ASP A 95 84.230 15.105 9.637 1.00 0.00 H new ATOM 0 HB2 ASP A 95 81.349 15.454 10.553 1.00 0.00 H new ATOM 0 HB3 ASP A 95 82.753 15.066 11.528 1.00 0.00 H new ATOM 1511 N LYS A 96 83.334 12.775 9.281 1.00 0.00 N ATOM 1512 CA LYS A 96 82.879 11.420 8.860 1.00 0.00 C ATOM 1513 C LYS A 96 81.550 11.093 9.542 1.00 0.00 C ATOM 1514 O LYS A 96 80.662 10.518 8.944 1.00 0.00 O ATOM 1515 CB LYS A 96 83.919 10.370 9.274 1.00 0.00 C ATOM 1516 CG LYS A 96 85.185 10.488 8.408 1.00 0.00 C ATOM 1517 CD LYS A 96 86.070 11.643 8.894 1.00 0.00 C ATOM 1518 CE LYS A 96 87.457 11.522 8.254 1.00 0.00 C ATOM 1519 NZ LYS A 96 88.224 10.440 8.935 1.00 0.00 N ATOM 0 H LYS A 96 84.196 12.793 9.827 1.00 0.00 H new ATOM 0 HA LYS A 96 82.755 11.408 7.777 1.00 0.00 H new ATOM 0 HB2 LYS A 96 84.178 10.501 10.325 1.00 0.00 H new ATOM 0 HB3 LYS A 96 83.495 9.371 9.173 1.00 0.00 H new ATOM 0 HG2 LYS A 96 85.745 9.554 8.445 1.00 0.00 H new ATOM 0 HG3 LYS A 96 84.906 10.651 7.367 1.00 0.00 H new ATOM 0 HD2 LYS A 96 85.617 12.599 8.630 1.00 0.00 H new ATOM 0 HD3 LYS A 96 86.155 11.619 9.980 1.00 0.00 H new ATOM 0 HE2 LYS A 96 87.361 11.301 7.191 1.00 0.00 H new ATOM 0 HE3 LYS A 96 87.991 12.469 8.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 89.237 10.550 8.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 88.071 10.500 9.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 87.899 9.514 8.590 1.00 0.00 H new ATOM 1533 N GLN A 97 81.404 11.449 10.791 1.00 0.00 N ATOM 1534 CA GLN A 97 80.128 11.152 11.507 1.00 0.00 C ATOM 1535 C GLN A 97 79.109 12.270 11.206 1.00 0.00 C ATOM 1536 O GLN A 97 79.494 13.406 11.014 1.00 0.00 O ATOM 1537 CB GLN A 97 80.396 11.099 13.012 1.00 0.00 C ATOM 1538 CG GLN A 97 81.318 9.916 13.325 1.00 0.00 C ATOM 1539 CD GLN A 97 81.445 9.750 14.841 1.00 0.00 C ATOM 1540 OE1 GLN A 97 80.816 8.889 15.424 1.00 0.00 O ATOM 1541 NE2 GLN A 97 82.240 10.542 15.508 1.00 0.00 N ATOM 0 H GLN A 97 82.111 11.931 11.346 1.00 0.00 H new ATOM 0 HA GLN A 97 79.730 10.194 11.174 1.00 0.00 H new ATOM 0 HB2 GLN A 97 80.856 12.030 13.343 1.00 0.00 H new ATOM 0 HB3 GLN A 97 79.457 10.996 13.556 1.00 0.00 H new ATOM 0 HG2 GLN A 97 80.919 9.004 12.881 1.00 0.00 H new ATOM 0 HG3 GLN A 97 82.301 10.081 12.884 1.00 0.00 H new ATOM 0 HE21 GLN A 97 82.768 11.265 15.019 1.00 0.00 H new ATOM 0 HE22 GLN A 97 82.333 10.438 16.518 1.00 0.00 H new ATOM 1550 N PRO A 98 77.821 11.979 11.168 1.00 0.00 N ATOM 1551 CA PRO A 98 76.809 13.042 10.886 1.00 0.00 C ATOM 1552 C PRO A 98 76.654 14.015 12.071 1.00 0.00 C ATOM 1553 O PRO A 98 75.602 14.122 12.669 1.00 0.00 O ATOM 1554 CB PRO A 98 75.532 12.210 10.666 1.00 0.00 C ATOM 1555 CG PRO A 98 75.757 10.840 11.320 1.00 0.00 C ATOM 1556 CD PRO A 98 77.275 10.605 11.393 1.00 0.00 C ATOM 0 HA PRO A 98 77.070 13.683 10.044 1.00 0.00 H new ATOM 0 HB2 PRO A 98 74.669 12.708 11.107 1.00 0.00 H new ATOM 0 HB3 PRO A 98 75.326 12.098 9.602 1.00 0.00 H new ATOM 0 HG2 PRO A 98 75.317 10.814 12.317 1.00 0.00 H new ATOM 0 HG3 PRO A 98 75.275 10.054 10.739 1.00 0.00 H new ATOM 0 HD2 PRO A 98 77.578 10.200 12.359 1.00 0.00 H new ATOM 0 HD3 PRO A 98 77.615 9.903 10.632 1.00 0.00 H new ATOM 1564 N ARG A 99 77.698 14.724 12.423 1.00 0.00 N ATOM 1565 CA ARG A 99 77.599 15.678 13.570 1.00 0.00 C ATOM 1566 C ARG A 99 77.159 17.055 13.067 1.00 0.00 C ATOM 1567 O ARG A 99 76.006 17.425 13.169 1.00 0.00 O ATOM 1568 CB ARG A 99 78.963 15.801 14.256 1.00 0.00 C ATOM 1569 CG ARG A 99 78.818 16.634 15.532 1.00 0.00 C ATOM 1570 CD ARG A 99 80.180 16.759 16.220 1.00 0.00 C ATOM 1571 NE ARG A 99 80.008 17.359 17.585 1.00 0.00 N ATOM 1572 CZ ARG A 99 79.438 18.523 17.761 1.00 0.00 C ATOM 1573 NH1 ARG A 99 79.171 19.293 16.740 1.00 0.00 N ATOM 1574 NH2 ARG A 99 79.184 18.942 18.970 1.00 0.00 N ATOM 0 H ARG A 99 78.610 14.684 11.968 1.00 0.00 H new ATOM 0 HA ARG A 99 76.864 15.302 14.282 1.00 0.00 H new ATOM 0 HB2 ARG A 99 79.352 14.812 14.497 1.00 0.00 H new ATOM 0 HB3 ARG A 99 79.680 16.270 13.582 1.00 0.00 H new ATOM 0 HG2 ARG A 99 78.429 17.623 15.291 1.00 0.00 H new ATOM 0 HG3 ARG A 99 78.101 16.165 16.205 1.00 0.00 H new ATOM 0 HD2 ARG A 99 80.648 15.778 16.301 1.00 0.00 H new ATOM 0 HD3 ARG A 99 80.845 17.381 15.621 1.00 0.00 H new ATOM 0 HE ARG A 99 80.345 16.844 18.399 1.00 0.00 H new ATOM 0 HH11 ARG A 99 79.407 18.988 15.796 1.00 0.00 H new ATOM 0 HH12 ARG A 99 78.726 20.199 16.887 1.00 0.00 H new ATOM 0 HH21 ARG A 99 79.430 18.363 19.773 1.00 0.00 H new ATOM 0 HH22 ARG A 99 78.740 19.849 19.113 1.00 0.00 H new ATOM 1588 N LYS A 100 78.068 17.819 12.531 1.00 0.00 N ATOM 1589 CA LYS A 100 77.709 19.177 12.032 1.00 0.00 C ATOM 1590 C LYS A 100 76.853 19.063 10.768 1.00 0.00 C ATOM 1591 O LYS A 100 77.053 18.190 9.946 1.00 0.00 O ATOM 1592 CB LYS A 100 78.985 19.955 11.708 1.00 0.00 C ATOM 1593 CG LYS A 100 79.803 20.147 12.987 1.00 0.00 C ATOM 1594 CD LYS A 100 81.087 20.926 12.673 1.00 0.00 C ATOM 1595 CE LYS A 100 80.762 22.395 12.368 1.00 0.00 C ATOM 1596 NZ LYS A 100 81.989 23.218 12.564 1.00 0.00 N ATOM 0 H LYS A 100 79.048 17.561 12.416 1.00 0.00 H new ATOM 0 HA LYS A 100 77.143 19.700 12.803 1.00 0.00 H new ATOM 0 HB2 LYS A 100 79.573 19.417 10.965 1.00 0.00 H new ATOM 0 HB3 LYS A 100 78.734 20.923 11.275 1.00 0.00 H new ATOM 0 HG2 LYS A 100 79.213 20.685 13.729 1.00 0.00 H new ATOM 0 HG3 LYS A 100 80.052 19.178 13.419 1.00 0.00 H new ATOM 0 HD2 LYS A 100 81.772 20.867 13.519 1.00 0.00 H new ATOM 0 HD3 LYS A 100 81.594 20.475 11.820 1.00 0.00 H new ATOM 0 HE2 LYS A 100 80.402 22.495 11.344 1.00 0.00 H new ATOM 0 HE3 LYS A 100 79.965 22.747 13.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 81.775 24.215 12.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 82.313 23.129 13.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 82.736 22.885 11.922 1.00 0.00 H new ATOM 1610 N LYS A 101 75.901 19.949 10.606 1.00 0.00 N ATOM 1611 CA LYS A 101 75.025 19.914 9.396 1.00 0.00 C ATOM 1612 C LYS A 101 75.508 20.963 8.391 1.00 0.00 C ATOM 1613 O LYS A 101 76.460 21.660 8.705 1.00 0.00 O ATOM 1614 CB LYS A 101 73.583 20.227 9.803 1.00 0.00 C ATOM 1615 CG LYS A 101 73.047 19.096 10.683 1.00 0.00 C ATOM 1616 CD LYS A 101 71.606 19.407 11.092 1.00 0.00 C ATOM 1617 CE LYS A 101 71.068 18.277 11.972 1.00 0.00 C ATOM 1618 NZ LYS A 101 69.657 18.574 12.346 1.00 0.00 N ATOM 1619 OXT LYS A 101 74.920 21.051 7.326 1.00 0.00 O ATOM 0 H LYS A 101 75.693 20.699 11.265 1.00 0.00 H new ATOM 0 HA LYS A 101 75.069 18.924 8.942 1.00 0.00 H new ATOM 0 HB2 LYS A 101 73.543 21.173 10.343 1.00 0.00 H new ATOM 0 HB3 LYS A 101 72.959 20.340 8.916 1.00 0.00 H new ATOM 0 HG2 LYS A 101 73.087 18.150 10.142 1.00 0.00 H new ATOM 0 HG3 LYS A 101 73.672 18.983 11.569 1.00 0.00 H new ATOM 0 HD2 LYS A 101 71.567 20.353 11.632 1.00 0.00 H new ATOM 0 HD3 LYS A 101 70.982 19.520 10.206 1.00 0.00 H new ATOM 0 HE2 LYS A 101 71.123 17.328 11.439 1.00 0.00 H new ATOM 0 HE3 LYS A 101 71.680 18.175 12.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 69.288 17.808 12.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 69.618 19.472 12.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 69.078 18.650 11.485 1.00 0.00 H new TER 1633 LYS A 101 ATOM 1634 N MET B 1 96.580 0.320 -15.235 1.00 0.00 N ATOM 1635 CA MET B 1 96.333 1.472 -14.322 1.00 0.00 C ATOM 1636 C MET B 1 96.910 1.156 -12.938 1.00 0.00 C ATOM 1637 O MET B 1 96.976 2.007 -12.073 1.00 0.00 O ATOM 1638 CB MET B 1 94.823 1.720 -14.218 1.00 0.00 C ATOM 1639 CG MET B 1 94.081 0.380 -14.169 1.00 0.00 C ATOM 1640 SD MET B 1 93.932 -0.291 -15.844 1.00 0.00 S ATOM 1641 CE MET B 1 92.401 0.559 -16.302 1.00 0.00 C ATOM 0 H1 MET B 1 95.912 0.359 -16.031 1.00 0.00 H new ATOM 0 H2 MET B 1 97.554 0.367 -15.597 1.00 0.00 H new ATOM 0 H3 MET B 1 96.447 -0.570 -14.714 1.00 0.00 H new ATOM 0 HA MET B 1 96.817 2.366 -14.714 1.00 0.00 H new ATOM 0 HB2 MET B 1 94.601 2.302 -13.324 1.00 0.00 H new ATOM 0 HB3 MET B 1 94.481 2.305 -15.072 1.00 0.00 H new ATOM 0 HG2 MET B 1 94.618 -0.322 -13.531 1.00 0.00 H new ATOM 0 HG3 MET B 1 93.092 0.516 -13.731 1.00 0.00 H new ATOM 0 HE1 MET B 1 92.122 0.283 -17.319 1.00 0.00 H new ATOM 0 HE2 MET B 1 91.605 0.270 -15.616 1.00 0.00 H new ATOM 0 HE3 MET B 1 92.553 1.637 -16.248 1.00 0.00 H new ATOM 1653 N ALA B 2 97.336 -0.060 -12.727 1.00 0.00 N ATOM 1654 CA ALA B 2 97.917 -0.431 -11.405 1.00 0.00 C ATOM 1655 C ALA B 2 96.883 -0.203 -10.296 1.00 0.00 C ATOM 1656 O ALA B 2 96.495 0.912 -10.011 1.00 0.00 O ATOM 1657 CB ALA B 2 99.163 0.424 -11.142 1.00 0.00 C ATOM 0 H ALA B 2 97.307 -0.813 -13.414 1.00 0.00 H new ATOM 0 HA ALA B 2 98.195 -1.485 -11.414 1.00 0.00 H new ATOM 0 HB1 ALA B 2 99.591 0.156 -10.176 1.00 0.00 H new ATOM 0 HB2 ALA B 2 99.898 0.246 -11.927 1.00 0.00 H new ATOM 0 HB3 ALA B 2 98.886 1.478 -11.136 1.00 0.00 H new ATOM 1663 N CYS B 3 96.440 -1.259 -9.664 1.00 0.00 N ATOM 1664 CA CYS B 3 95.439 -1.117 -8.569 1.00 0.00 C ATOM 1665 C CYS B 3 94.221 -0.322 -9.066 1.00 0.00 C ATOM 1666 O CYS B 3 93.977 0.781 -8.619 1.00 0.00 O ATOM 1667 CB CYS B 3 96.082 -0.378 -7.392 1.00 0.00 C ATOM 1668 SG CYS B 3 97.705 -1.100 -7.040 1.00 0.00 S ATOM 0 H CYS B 3 96.731 -2.217 -9.861 1.00 0.00 H new ATOM 0 HA CYS B 3 95.112 -2.107 -8.252 1.00 0.00 H new ATOM 0 HB2 CYS B 3 96.187 0.681 -7.627 1.00 0.00 H new ATOM 0 HB3 CYS B 3 95.443 -0.448 -6.512 1.00 0.00 H new ATOM 0 HG CYS B 3 98.340 -0.347 -6.192 1.00 0.00 H new ATOM 1674 N PRO B 4 93.457 -0.876 -9.982 1.00 0.00 N ATOM 1675 CA PRO B 4 92.254 -0.169 -10.511 1.00 0.00 C ATOM 1676 C PRO B 4 91.276 0.214 -9.389 1.00 0.00 C ATOM 1677 O PRO B 4 90.309 0.917 -9.606 1.00 0.00 O ATOM 1678 CB PRO B 4 91.642 -1.209 -11.472 1.00 0.00 C ATOM 1679 CG PRO B 4 92.641 -2.374 -11.627 1.00 0.00 C ATOM 1680 CD PRO B 4 93.729 -2.231 -10.545 1.00 0.00 C ATOM 0 HA PRO B 4 92.493 0.777 -10.997 1.00 0.00 H new ATOM 0 HB2 PRO B 4 90.692 -1.573 -11.082 1.00 0.00 H new ATOM 0 HB3 PRO B 4 91.435 -0.755 -12.441 1.00 0.00 H new ATOM 0 HG2 PRO B 4 92.127 -3.330 -11.524 1.00 0.00 H new ATOM 0 HG3 PRO B 4 93.090 -2.359 -12.620 1.00 0.00 H new ATOM 0 HD2 PRO B 4 93.649 -3.008 -9.785 1.00 0.00 H new ATOM 0 HD3 PRO B 4 94.731 -2.300 -10.967 1.00 0.00 H new ATOM 1688 N LEU B 5 91.527 -0.247 -8.196 1.00 0.00 N ATOM 1689 CA LEU B 5 90.624 0.082 -7.059 1.00 0.00 C ATOM 1690 C LEU B 5 90.595 1.600 -6.882 1.00 0.00 C ATOM 1691 O LEU B 5 89.572 2.186 -6.591 1.00 0.00 O ATOM 1692 CB LEU B 5 91.150 -0.579 -5.777 1.00 0.00 C ATOM 1693 CG LEU B 5 90.230 -0.252 -4.591 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.815 -0.798 -4.852 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.808 -0.891 -3.321 1.00 0.00 C ATOM 0 H LEU B 5 92.322 -0.840 -7.959 1.00 0.00 H new ATOM 0 HA LEU B 5 89.619 -0.287 -7.261 1.00 0.00 H new ATOM 0 HB2 LEU B 5 91.208 -1.659 -5.914 1.00 0.00 H new ATOM 0 HB3 LEU B 5 92.161 -0.230 -5.568 1.00 0.00 H new ATOM 0 HG LEU B 5 90.168 0.829 -4.466 1.00 0.00 H new ATOM 0 HD11 LEU B 5 88.171 -0.561 -4.005 1.00 0.00 H new ATOM 0 HD12 LEU B 5 88.410 -0.341 -5.755 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.860 -1.879 -4.981 1.00 0.00 H new ATOM 0 HD21 LEU B 5 90.162 -0.664 -2.473 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.869 -1.971 -3.452 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.805 -0.492 -3.134 1.00 0.00 H new ATOM 1707 N GLU B 6 91.718 2.237 -7.053 1.00 0.00 N ATOM 1708 CA GLU B 6 91.772 3.715 -6.890 1.00 0.00 C ATOM 1709 C GLU B 6 90.817 4.371 -7.897 1.00 0.00 C ATOM 1710 O GLU B 6 90.087 5.286 -7.569 1.00 0.00 O ATOM 1711 CB GLU B 6 93.202 4.177 -7.185 1.00 0.00 C ATOM 1712 CG GLU B 6 93.328 5.684 -6.948 1.00 0.00 C ATOM 1713 CD GLU B 6 94.763 6.127 -7.247 1.00 0.00 C ATOM 1714 OE1 GLU B 6 95.605 5.263 -7.427 1.00 0.00 O ATOM 1715 OE2 GLU B 6 94.993 7.324 -7.292 1.00 0.00 O ATOM 0 H GLU B 6 92.604 1.796 -7.300 1.00 0.00 H new ATOM 0 HA GLU B 6 91.481 3.994 -5.877 1.00 0.00 H new ATOM 0 HB2 GLU B 6 93.904 3.641 -6.547 1.00 0.00 H new ATOM 0 HB3 GLU B 6 93.463 3.940 -8.216 1.00 0.00 H new ATOM 0 HG2 GLU B 6 92.628 6.224 -7.587 1.00 0.00 H new ATOM 0 HG3 GLU B 6 93.069 5.924 -5.917 1.00 0.00 H new ATOM 1722 N LYS B 7 90.810 3.906 -9.117 1.00 0.00 N ATOM 1723 CA LYS B 7 89.898 4.491 -10.140 1.00 0.00 C ATOM 1724 C LYS B 7 88.469 4.036 -9.862 1.00 0.00 C ATOM 1725 O LYS B 7 87.543 4.817 -9.883 1.00 0.00 O ATOM 1726 CB LYS B 7 90.328 4.029 -11.534 1.00 0.00 C ATOM 1727 CG LYS B 7 89.388 4.632 -12.585 1.00 0.00 C ATOM 1728 CD LYS B 7 89.974 4.440 -13.991 1.00 0.00 C ATOM 1729 CE LYS B 7 89.920 2.961 -14.397 1.00 0.00 C ATOM 1730 NZ LYS B 7 88.537 2.436 -14.213 1.00 0.00 N ATOM 0 H LYS B 7 91.399 3.143 -9.450 1.00 0.00 H new ATOM 0 HA LYS B 7 89.946 5.579 -10.094 1.00 0.00 H new ATOM 0 HB2 LYS B 7 91.355 4.337 -11.730 1.00 0.00 H new ATOM 0 HB3 LYS B 7 90.305 2.941 -11.591 1.00 0.00 H new ATOM 0 HG2 LYS B 7 88.409 4.157 -12.523 1.00 0.00 H new ATOM 0 HG3 LYS B 7 89.241 5.694 -12.386 1.00 0.00 H new ATOM 0 HD2 LYS B 7 89.416 5.041 -14.709 1.00 0.00 H new ATOM 0 HD3 LYS B 7 91.005 4.792 -14.013 1.00 0.00 H new ATOM 0 HE2 LYS B 7 90.226 2.849 -15.437 1.00 0.00 H new ATOM 0 HE3 LYS B 7 90.621 2.383 -13.795 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 88.408 1.586 -14.798 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 88.388 2.194 -13.213 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 87.849 3.161 -14.500 1.00 0.00 H new ATOM 1744 N ALA B 8 88.280 2.782 -9.570 1.00 0.00 N ATOM 1745 CA ALA B 8 86.910 2.308 -9.266 1.00 0.00 C ATOM 1746 C ALA B 8 86.436 3.097 -8.061 1.00 0.00 C ATOM 1747 O ALA B 8 85.307 3.536 -7.986 1.00 0.00 O ATOM 1748 CB ALA B 8 86.920 0.815 -8.965 1.00 0.00 C ATOM 0 H ALA B 8 89.011 2.071 -9.529 1.00 0.00 H new ATOM 0 HA ALA B 8 86.243 2.459 -10.115 1.00 0.00 H new ATOM 0 HB1 ALA B 8 85.906 0.482 -8.744 1.00 0.00 H new ATOM 0 HB2 ALA B 8 87.300 0.272 -9.830 1.00 0.00 H new ATOM 0 HB3 ALA B 8 87.561 0.621 -8.105 1.00 0.00 H new ATOM 1754 N LEU B 9 87.314 3.333 -7.133 1.00 0.00 N ATOM 1755 CA LEU B 9 86.927 4.157 -5.972 1.00 0.00 C ATOM 1756 C LEU B 9 86.515 5.510 -6.531 1.00 0.00 C ATOM 1757 O LEU B 9 85.543 6.106 -6.113 1.00 0.00 O ATOM 1758 CB LEU B 9 88.118 4.312 -5.022 1.00 0.00 C ATOM 1759 CG LEU B 9 87.721 5.168 -3.813 1.00 0.00 C ATOM 1760 CD1 LEU B 9 86.566 4.503 -3.041 1.00 0.00 C ATOM 1761 CD2 LEU B 9 88.941 5.322 -2.900 1.00 0.00 C ATOM 0 H LEU B 9 88.275 2.992 -7.131 1.00 0.00 H new ATOM 0 HA LEU B 9 86.114 3.700 -5.408 1.00 0.00 H new ATOM 0 HB2 LEU B 9 88.456 3.331 -4.687 1.00 0.00 H new ATOM 0 HB3 LEU B 9 88.954 4.775 -5.547 1.00 0.00 H new ATOM 0 HG LEU B 9 87.385 6.147 -4.153 1.00 0.00 H new ATOM 0 HD11 LEU B 9 86.296 5.123 -2.186 1.00 0.00 H new ATOM 0 HD12 LEU B 9 85.703 4.396 -3.698 1.00 0.00 H new ATOM 0 HD13 LEU B 9 86.881 3.520 -2.692 1.00 0.00 H new ATOM 0 HD21 LEU B 9 88.674 5.929 -2.035 1.00 0.00 H new ATOM 0 HD22 LEU B 9 89.271 4.339 -2.565 1.00 0.00 H new ATOM 0 HD23 LEU B 9 89.747 5.808 -3.449 1.00 0.00 H new ATOM 1773 N ASP B 10 87.240 5.981 -7.514 1.00 0.00 N ATOM 1774 CA ASP B 10 86.877 7.278 -8.141 1.00 0.00 C ATOM 1775 C ASP B 10 85.550 7.103 -8.886 1.00 0.00 C ATOM 1776 O ASP B 10 84.738 8.007 -8.942 1.00 0.00 O ATOM 1777 CB ASP B 10 87.975 7.720 -9.116 1.00 0.00 C ATOM 1778 CG ASP B 10 87.717 9.161 -9.556 1.00 0.00 C ATOM 1779 OD1 ASP B 10 86.595 9.615 -9.409 1.00 0.00 O ATOM 1780 OD2 ASP B 10 88.649 9.789 -10.033 1.00 0.00 O ATOM 0 H ASP B 10 88.063 5.523 -7.905 1.00 0.00 H new ATOM 0 HA ASP B 10 86.774 8.045 -7.373 1.00 0.00 H new ATOM 0 HB2 ASP B 10 88.952 7.644 -8.639 1.00 0.00 H new ATOM 0 HB3 ASP B 10 87.992 7.061 -9.984 1.00 0.00 H new ATOM 1785 N VAL B 11 85.315 5.946 -9.461 1.00 0.00 N ATOM 1786 CA VAL B 11 84.030 5.738 -10.194 1.00 0.00 C ATOM 1787 C VAL B 11 82.867 5.929 -9.214 1.00 0.00 C ATOM 1788 O VAL B 11 81.864 6.534 -9.535 1.00 0.00 O ATOM 1789 CB VAL B 11 83.982 4.314 -10.773 1.00 0.00 C ATOM 1790 CG1 VAL B 11 82.590 4.022 -11.334 1.00 0.00 C ATOM 1791 CG2 VAL B 11 85.016 4.171 -11.891 1.00 0.00 C ATOM 0 H VAL B 11 85.950 5.148 -9.454 1.00 0.00 H new ATOM 0 HA VAL B 11 83.954 6.456 -11.011 1.00 0.00 H new ATOM 0 HB VAL B 11 84.207 3.605 -9.976 1.00 0.00 H new ATOM 0 HG11 VAL B 11 82.567 3.011 -11.742 1.00 0.00 H new ATOM 0 HG12 VAL B 11 81.851 4.109 -10.537 1.00 0.00 H new ATOM 0 HG13 VAL B 11 82.359 4.737 -12.124 1.00 0.00 H new ATOM 0 HG21 VAL B 11 84.976 3.160 -12.296 1.00 0.00 H new ATOM 0 HG22 VAL B 11 84.798 4.888 -12.682 1.00 0.00 H new ATOM 0 HG23 VAL B 11 86.012 4.363 -11.492 1.00 0.00 H new ATOM 1801 N MET B 12 83.003 5.429 -8.014 1.00 0.00 N ATOM 1802 CA MET B 12 81.915 5.594 -7.006 1.00 0.00 C ATOM 1803 C MET B 12 81.711 7.084 -6.736 1.00 0.00 C ATOM 1804 O MET B 12 80.605 7.561 -6.586 1.00 0.00 O ATOM 1805 CB MET B 12 82.332 4.907 -5.706 1.00 0.00 C ATOM 1806 CG MET B 12 82.330 3.385 -5.893 1.00 0.00 C ATOM 1807 SD MET B 12 83.358 2.617 -4.613 1.00 0.00 S ATOM 1808 CE MET B 12 82.709 3.539 -3.198 1.00 0.00 C ATOM 0 H MET B 12 83.821 4.913 -7.688 1.00 0.00 H new ATOM 0 HA MET B 12 80.991 5.152 -7.380 1.00 0.00 H new ATOM 0 HB2 MET B 12 83.325 5.244 -5.409 1.00 0.00 H new ATOM 0 HB3 MET B 12 81.649 5.184 -4.903 1.00 0.00 H new ATOM 0 HG2 MET B 12 81.311 3.002 -5.834 1.00 0.00 H new ATOM 0 HG3 MET B 12 82.710 3.129 -6.882 1.00 0.00 H new ATOM 0 HE1 MET B 12 82.917 2.990 -2.280 1.00 0.00 H new ATOM 0 HE2 MET B 12 83.187 4.518 -3.151 1.00 0.00 H new ATOM 0 HE3 MET B 12 81.632 3.666 -3.309 1.00 0.00 H new ATOM 1818 N VAL B 13 82.784 7.816 -6.661 1.00 0.00 N ATOM 1819 CA VAL B 13 82.684 9.276 -6.394 1.00 0.00 C ATOM 1820 C VAL B 13 82.321 10.035 -7.678 1.00 0.00 C ATOM 1821 O VAL B 13 81.459 10.891 -7.679 1.00 0.00 O ATOM 1822 CB VAL B 13 84.032 9.778 -5.872 1.00 0.00 C ATOM 1823 CG1 VAL B 13 83.945 11.283 -5.599 1.00 0.00 C ATOM 1824 CG2 VAL B 13 84.396 9.034 -4.578 1.00 0.00 C ATOM 0 H VAL B 13 83.734 7.463 -6.774 1.00 0.00 H new ATOM 0 HA VAL B 13 81.903 9.450 -5.654 1.00 0.00 H new ATOM 0 HB VAL B 13 84.803 9.591 -6.619 1.00 0.00 H new ATOM 0 HG11 VAL B 13 84.905 11.641 -5.227 1.00 0.00 H new ATOM 0 HG12 VAL B 13 83.695 11.806 -6.522 1.00 0.00 H new ATOM 0 HG13 VAL B 13 83.173 11.474 -4.853 1.00 0.00 H new ATOM 0 HG21 VAL B 13 85.356 9.394 -4.209 1.00 0.00 H new ATOM 0 HG22 VAL B 13 83.628 9.215 -3.826 1.00 0.00 H new ATOM 0 HG23 VAL B 13 84.462 7.965 -4.779 1.00 0.00 H new ATOM 1834 N SER B 14 82.987 9.744 -8.766 1.00 0.00 N ATOM 1835 CA SER B 14 82.694 10.467 -10.040 1.00 0.00 C ATOM 1836 C SER B 14 81.235 10.251 -10.448 1.00 0.00 C ATOM 1837 O SER B 14 80.533 11.180 -10.796 1.00 0.00 O ATOM 1838 CB SER B 14 83.609 9.936 -11.142 1.00 0.00 C ATOM 1839 OG SER B 14 83.192 8.629 -11.511 1.00 0.00 O ATOM 0 H SER B 14 83.720 9.038 -8.827 1.00 0.00 H new ATOM 0 HA SER B 14 82.867 11.533 -9.892 1.00 0.00 H new ATOM 0 HB2 SER B 14 83.577 10.598 -12.007 1.00 0.00 H new ATOM 0 HB3 SER B 14 84.642 9.916 -10.794 1.00 0.00 H new ATOM 0 HG SER B 14 83.777 8.287 -12.219 1.00 0.00 H new ATOM 1845 N THR B 15 80.770 9.036 -10.402 1.00 0.00 N ATOM 1846 CA THR B 15 79.355 8.759 -10.778 1.00 0.00 C ATOM 1847 C THR B 15 78.429 9.483 -9.803 1.00 0.00 C ATOM 1848 O THR B 15 77.404 10.019 -10.172 1.00 0.00 O ATOM 1849 CB THR B 15 79.109 7.244 -10.737 1.00 0.00 C ATOM 1850 OG1 THR B 15 77.983 6.926 -11.540 1.00 0.00 O ATOM 1851 CG2 THR B 15 78.867 6.765 -9.300 1.00 0.00 C ATOM 0 H THR B 15 81.310 8.218 -10.119 1.00 0.00 H new ATOM 0 HA THR B 15 79.154 9.118 -11.787 1.00 0.00 H new ATOM 0 HB THR B 15 79.995 6.740 -11.123 1.00 0.00 H new ATOM 0 HG1 THR B 15 77.654 6.034 -11.303 1.00 0.00 H new ATOM 0 HG21 THR B 15 78.695 5.689 -9.299 1.00 0.00 H new ATOM 0 HG22 THR B 15 79.740 6.994 -8.688 1.00 0.00 H new ATOM 0 HG23 THR B 15 77.994 7.272 -8.890 1.00 0.00 H new ATOM 1859 N PHE B 16 78.791 9.481 -8.555 1.00 0.00 N ATOM 1860 CA PHE B 16 77.949 10.143 -7.518 1.00 0.00 C ATOM 1861 C PHE B 16 77.804 11.632 -7.848 1.00 0.00 C ATOM 1862 O PHE B 16 76.745 12.209 -7.701 1.00 0.00 O ATOM 1863 CB PHE B 16 78.644 9.987 -6.162 1.00 0.00 C ATOM 1864 CG PHE B 16 77.829 10.643 -5.073 1.00 0.00 C ATOM 1865 CD1 PHE B 16 78.047 11.987 -4.752 1.00 0.00 C ATOM 1866 CD2 PHE B 16 76.866 9.903 -4.376 1.00 0.00 C ATOM 1867 CE1 PHE B 16 77.300 12.593 -3.734 1.00 0.00 C ATOM 1868 CE2 PHE B 16 76.122 10.508 -3.357 1.00 0.00 C ATOM 1869 CZ PHE B 16 76.339 11.854 -3.036 1.00 0.00 C ATOM 0 H PHE B 16 79.643 9.045 -8.202 1.00 0.00 H new ATOM 0 HA PHE B 16 76.959 9.687 -7.490 1.00 0.00 H new ATOM 0 HB2 PHE B 16 78.780 8.929 -5.936 1.00 0.00 H new ATOM 0 HB3 PHE B 16 79.637 10.435 -6.202 1.00 0.00 H new ATOM 0 HD1 PHE B 16 78.791 12.557 -5.289 1.00 0.00 H new ATOM 0 HD2 PHE B 16 76.698 8.866 -4.625 1.00 0.00 H new ATOM 0 HE1 PHE B 16 77.466 13.631 -3.488 1.00 0.00 H new ATOM 0 HE2 PHE B 16 75.380 9.937 -2.818 1.00 0.00 H new ATOM 0 HZ PHE B 16 75.765 12.321 -2.250 1.00 0.00 H new ATOM 1879 N HIS B 17 78.855 12.256 -8.299 1.00 0.00 N ATOM 1880 CA HIS B 17 78.774 13.704 -8.646 1.00 0.00 C ATOM 1881 C HIS B 17 77.957 13.876 -9.922 1.00 0.00 C ATOM 1882 O HIS B 17 77.390 14.923 -10.169 1.00 0.00 O ATOM 1883 CB HIS B 17 80.177 14.271 -8.865 1.00 0.00 C ATOM 1884 CG HIS B 17 80.945 14.225 -7.576 1.00 0.00 C ATOM 1885 ND1 HIS B 17 80.429 14.722 -6.387 1.00 0.00 N ATOM 1886 CD2 HIS B 17 82.197 13.750 -7.273 1.00 0.00 C ATOM 1887 CE1 HIS B 17 81.360 14.535 -5.432 1.00 0.00 C ATOM 1888 NE2 HIS B 17 82.453 13.947 -5.922 1.00 0.00 N ATOM 0 H HIS B 17 79.769 11.826 -8.443 1.00 0.00 H new ATOM 0 HA HIS B 17 78.295 14.239 -7.826 1.00 0.00 H new ATOM 0 HB2 HIS B 17 80.697 13.696 -9.631 1.00 0.00 H new ATOM 0 HB3 HIS B 17 80.113 15.298 -9.226 1.00 0.00 H new ATOM 0 HD1 HIS B 17 79.512 15.151 -6.260 1.00 0.00 H new ATOM 0 HD2 HIS B 17 82.878 13.294 -7.976 1.00 0.00 H new ATOM 0 HE1 HIS B 17 81.237 14.825 -4.399 1.00 0.00 H new ATOM 1897 N LYS B 18 77.884 12.862 -10.739 1.00 0.00 N ATOM 1898 CA LYS B 18 77.097 12.992 -11.988 1.00 0.00 C ATOM 1899 C LYS B 18 75.663 13.305 -11.591 1.00 0.00 C ATOM 1900 O LYS B 18 75.009 14.142 -12.182 1.00 0.00 O ATOM 1901 CB LYS B 18 77.154 11.685 -12.776 1.00 0.00 C ATOM 1902 CG LYS B 18 76.509 11.894 -14.144 1.00 0.00 C ATOM 1903 CD LYS B 18 76.567 10.588 -14.935 1.00 0.00 C ATOM 1904 CE LYS B 18 75.941 10.802 -16.310 1.00 0.00 C ATOM 1905 NZ LYS B 18 74.481 11.047 -16.157 1.00 0.00 N ATOM 0 H LYS B 18 78.333 11.958 -10.594 1.00 0.00 H new ATOM 0 HA LYS B 18 77.499 13.784 -12.619 1.00 0.00 H new ATOM 0 HB2 LYS B 18 78.189 11.363 -12.894 1.00 0.00 H new ATOM 0 HB3 LYS B 18 76.634 10.896 -12.232 1.00 0.00 H new ATOM 0 HG2 LYS B 18 75.474 12.215 -14.026 1.00 0.00 H new ATOM 0 HG3 LYS B 18 77.028 12.684 -14.686 1.00 0.00 H new ATOM 0 HD2 LYS B 18 77.601 10.259 -15.041 1.00 0.00 H new ATOM 0 HD3 LYS B 18 76.036 9.801 -14.399 1.00 0.00 H new ATOM 0 HE2 LYS B 18 76.413 11.649 -16.808 1.00 0.00 H new ATOM 0 HE3 LYS B 18 76.110 9.928 -16.939 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 74.005 10.891 -17.069 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 74.092 10.394 -15.447 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 74.324 12.028 -15.848 1.00 0.00 H new ATOM 1919 N TYR B 19 75.184 12.673 -10.561 1.00 0.00 N ATOM 1920 CA TYR B 19 73.809 12.978 -10.092 1.00 0.00 C ATOM 1921 C TYR B 19 73.842 14.374 -9.491 1.00 0.00 C ATOM 1922 O TYR B 19 72.918 15.151 -9.634 1.00 0.00 O ATOM 1923 CB TYR B 19 73.376 11.959 -9.038 1.00 0.00 C ATOM 1924 CG TYR B 19 73.165 10.621 -9.702 1.00 0.00 C ATOM 1925 CD1 TYR B 19 71.906 10.281 -10.215 1.00 0.00 C ATOM 1926 CD2 TYR B 19 74.229 9.719 -9.806 1.00 0.00 C ATOM 1927 CE1 TYR B 19 71.714 9.037 -10.831 1.00 0.00 C ATOM 1928 CE2 TYR B 19 74.039 8.478 -10.422 1.00 0.00 C ATOM 1929 CZ TYR B 19 72.781 8.136 -10.935 1.00 0.00 C ATOM 1930 OH TYR B 19 72.593 6.911 -11.543 1.00 0.00 O ATOM 0 H TYR B 19 75.682 11.962 -10.026 1.00 0.00 H new ATOM 0 HA TYR B 19 73.097 12.928 -10.916 1.00 0.00 H new ATOM 0 HB2 TYR B 19 74.135 11.877 -8.260 1.00 0.00 H new ATOM 0 HB3 TYR B 19 72.457 12.287 -8.553 1.00 0.00 H new ATOM 0 HD1 TYR B 19 71.084 10.977 -10.136 1.00 0.00 H new ATOM 0 HD2 TYR B 19 75.199 9.981 -9.410 1.00 0.00 H new ATOM 0 HE1 TYR B 19 70.744 8.773 -11.225 1.00 0.00 H new ATOM 0 HE2 TYR B 19 74.862 7.783 -10.502 1.00 0.00 H new ATOM 0 HH TYR B 19 73.464 6.511 -11.749 1.00 0.00 H new ATOM 1940 N SER B 20 74.916 14.699 -8.819 1.00 0.00 N ATOM 1941 CA SER B 20 75.040 16.046 -8.204 1.00 0.00 C ATOM 1942 C SER B 20 73.794 16.331 -7.377 1.00 0.00 C ATOM 1943 O SER B 20 73.568 17.435 -6.924 1.00 0.00 O ATOM 1944 CB SER B 20 75.169 17.090 -9.308 1.00 0.00 C ATOM 1945 OG SER B 20 74.854 18.373 -8.784 1.00 0.00 O ATOM 0 H SER B 20 75.715 14.083 -8.671 1.00 0.00 H new ATOM 0 HA SER B 20 75.921 16.083 -7.563 1.00 0.00 H new ATOM 0 HB2 SER B 20 76.183 17.088 -9.709 1.00 0.00 H new ATOM 0 HB3 SER B 20 74.499 16.848 -10.133 1.00 0.00 H new ATOM 0 HG SER B 20 74.720 18.307 -7.815 1.00 0.00 H new ATOM 1951 N GLY B 21 72.979 15.336 -7.187 1.00 0.00 N ATOM 1952 CA GLY B 21 71.733 15.530 -6.397 1.00 0.00 C ATOM 1953 C GLY B 21 70.665 16.146 -7.295 1.00 0.00 C ATOM 1954 O GLY B 21 69.500 16.163 -6.959 1.00 0.00 O ATOM 0 H GLY B 21 73.121 14.392 -7.546 1.00 0.00 H new ATOM 0 HA2 GLY B 21 71.386 14.576 -6.000 1.00 0.00 H new ATOM 0 HA3 GLY B 21 71.926 16.179 -5.543 1.00 0.00 H new ATOM 1958 N LYS B 22 71.066 16.659 -8.432 1.00 0.00 N ATOM 1959 CA LYS B 22 70.097 17.289 -9.383 1.00 0.00 C ATOM 1960 C LYS B 22 69.448 18.511 -8.726 1.00 0.00 C ATOM 1961 O LYS B 22 68.882 19.359 -9.386 1.00 0.00 O ATOM 1962 CB LYS B 22 69.001 16.284 -9.768 1.00 0.00 C ATOM 1963 CG LYS B 22 69.611 14.916 -10.184 1.00 0.00 C ATOM 1964 CD LYS B 22 69.741 14.811 -11.716 1.00 0.00 C ATOM 1965 CE LYS B 22 70.790 15.800 -12.241 1.00 0.00 C ATOM 1966 NZ LYS B 22 71.329 15.302 -13.538 1.00 0.00 N ATOM 0 H LYS B 22 72.036 16.668 -8.746 1.00 0.00 H new ATOM 0 HA LYS B 22 70.637 17.595 -10.279 1.00 0.00 H new ATOM 0 HB2 LYS B 22 68.323 16.142 -8.926 1.00 0.00 H new ATOM 0 HB3 LYS B 22 68.409 16.686 -10.590 1.00 0.00 H new ATOM 0 HG2 LYS B 22 70.592 14.796 -9.723 1.00 0.00 H new ATOM 0 HG3 LYS B 22 68.983 14.106 -9.813 1.00 0.00 H new ATOM 0 HD2 LYS B 22 70.021 13.795 -11.993 1.00 0.00 H new ATOM 0 HD3 LYS B 22 68.777 15.014 -12.182 1.00 0.00 H new ATOM 0 HE2 LYS B 22 70.343 16.785 -12.374 1.00 0.00 H new ATOM 0 HE3 LYS B 22 71.597 15.911 -11.517 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 72.041 15.970 -13.897 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 71.769 14.370 -13.396 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 70.554 15.218 -14.227 1.00 0.00 H new ATOM 1980 N GLU B 23 69.540 18.610 -7.431 1.00 0.00 N ATOM 1981 CA GLU B 23 68.952 19.775 -6.710 1.00 0.00 C ATOM 1982 C GLU B 23 70.023 20.862 -6.593 1.00 0.00 C ATOM 1983 O GLU B 23 69.797 21.929 -6.060 1.00 0.00 O ATOM 1984 CB GLU B 23 68.507 19.321 -5.314 1.00 0.00 C ATOM 1985 CG GLU B 23 67.728 20.439 -4.619 1.00 0.00 C ATOM 1986 CD GLU B 23 67.084 19.891 -3.345 1.00 0.00 C ATOM 1987 OE1 GLU B 23 67.186 18.697 -3.121 1.00 0.00 O ATOM 1988 OE2 GLU B 23 66.501 20.675 -2.615 1.00 0.00 O ATOM 0 H GLU B 23 70.003 17.926 -6.833 1.00 0.00 H new ATOM 0 HA GLU B 23 68.090 20.168 -7.249 1.00 0.00 H new ATOM 0 HB2 GLU B 23 67.885 18.430 -5.395 1.00 0.00 H new ATOM 0 HB3 GLU B 23 69.378 19.049 -4.717 1.00 0.00 H new ATOM 0 HG2 GLU B 23 68.395 21.266 -4.376 1.00 0.00 H new ATOM 0 HG3 GLU B 23 66.962 20.833 -5.287 1.00 0.00 H new ATOM 1995 N GLY B 24 71.195 20.591 -7.102 1.00 0.00 N ATOM 1996 CA GLY B 24 72.305 21.591 -7.039 1.00 0.00 C ATOM 1997 C GLY B 24 73.235 21.251 -5.871 1.00 0.00 C ATOM 1998 O GLY B 24 74.299 21.819 -5.728 1.00 0.00 O ATOM 0 H GLY B 24 71.435 19.713 -7.563 1.00 0.00 H new ATOM 0 HA2 GLY B 24 72.864 21.589 -7.975 1.00 0.00 H new ATOM 0 HA3 GLY B 24 71.898 22.594 -6.913 1.00 0.00 H new ATOM 2002 N ASP B 25 72.844 20.326 -5.034 1.00 0.00 N ATOM 2003 CA ASP B 25 73.708 19.945 -3.875 1.00 0.00 C ATOM 2004 C ASP B 25 74.567 18.736 -4.252 1.00 0.00 C ATOM 2005 O ASP B 25 74.070 17.643 -4.434 1.00 0.00 O ATOM 2006 CB ASP B 25 72.818 19.580 -2.685 1.00 0.00 C ATOM 2007 CG ASP B 25 71.903 18.419 -3.074 1.00 0.00 C ATOM 2008 OD1 ASP B 25 71.713 18.212 -4.261 1.00 0.00 O ATOM 2009 OD2 ASP B 25 71.408 17.754 -2.179 1.00 0.00 O ATOM 0 H ASP B 25 71.963 19.817 -5.102 1.00 0.00 H new ATOM 0 HA ASP B 25 74.355 20.782 -3.611 1.00 0.00 H new ATOM 0 HB2 ASP B 25 73.432 19.302 -1.829 1.00 0.00 H new ATOM 0 HB3 ASP B 25 72.223 20.442 -2.384 1.00 0.00 H new ATOM 2014 N LYS B 26 75.856 18.922 -4.373 1.00 0.00 N ATOM 2015 CA LYS B 26 76.748 17.781 -4.742 1.00 0.00 C ATOM 2016 C LYS B 26 77.266 17.100 -3.476 1.00 0.00 C ATOM 2017 O LYS B 26 77.726 15.976 -3.509 1.00 0.00 O ATOM 2018 CB LYS B 26 77.932 18.304 -5.557 1.00 0.00 C ATOM 2019 CG LYS B 26 77.425 18.932 -6.857 1.00 0.00 C ATOM 2020 CD LYS B 26 78.615 19.453 -7.667 1.00 0.00 C ATOM 2021 CE LYS B 26 78.115 20.082 -8.968 1.00 0.00 C ATOM 2022 NZ LYS B 26 77.593 19.015 -9.868 1.00 0.00 N ATOM 0 H LYS B 26 76.330 19.814 -4.232 1.00 0.00 H new ATOM 0 HA LYS B 26 76.184 17.061 -5.335 1.00 0.00 H new ATOM 0 HB2 LYS B 26 78.487 19.042 -4.978 1.00 0.00 H new ATOM 0 HB3 LYS B 26 78.621 17.489 -5.780 1.00 0.00 H new ATOM 0 HG2 LYS B 26 76.870 18.195 -7.438 1.00 0.00 H new ATOM 0 HG3 LYS B 26 76.736 19.747 -6.636 1.00 0.00 H new ATOM 0 HD2 LYS B 26 79.169 20.189 -7.085 1.00 0.00 H new ATOM 0 HD3 LYS B 26 79.303 18.637 -7.887 1.00 0.00 H new ATOM 0 HE2 LYS B 26 77.331 20.809 -8.755 1.00 0.00 H new ATOM 0 HE3 LYS B 26 78.925 20.622 -9.458 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 77.961 19.161 -10.830 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 77.899 18.085 -9.518 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 76.554 19.053 -9.886 1.00 0.00 H new ATOM 2036 N PHE B 27 77.194 17.768 -2.360 1.00 0.00 N ATOM 2037 CA PHE B 27 77.678 17.157 -1.089 1.00 0.00 C ATOM 2038 C PHE B 27 76.510 16.477 -0.380 1.00 0.00 C ATOM 2039 O PHE B 27 76.665 15.912 0.683 1.00 0.00 O ATOM 2040 CB PHE B 27 78.267 18.246 -0.185 1.00 0.00 C ATOM 2041 CG PHE B 27 79.622 18.655 -0.710 1.00 0.00 C ATOM 2042 CD1 PHE B 27 80.762 17.930 -0.341 1.00 0.00 C ATOM 2043 CD2 PHE B 27 79.739 19.753 -1.569 1.00 0.00 C ATOM 2044 CE1 PHE B 27 82.019 18.303 -0.830 1.00 0.00 C ATOM 2045 CE2 PHE B 27 80.997 20.127 -2.058 1.00 0.00 C ATOM 2046 CZ PHE B 27 82.136 19.401 -1.689 1.00 0.00 C ATOM 0 H PHE B 27 76.820 18.713 -2.272 1.00 0.00 H new ATOM 0 HA PHE B 27 78.450 16.419 -1.310 1.00 0.00 H new ATOM 0 HB2 PHE B 27 77.601 19.108 -0.155 1.00 0.00 H new ATOM 0 HB3 PHE B 27 78.357 17.877 0.837 1.00 0.00 H new ATOM 0 HD1 PHE B 27 80.671 17.082 0.322 1.00 0.00 H new ATOM 0 HD2 PHE B 27 78.860 20.312 -1.855 1.00 0.00 H new ATOM 0 HE1 PHE B 27 82.898 17.744 -0.545 1.00 0.00 H new ATOM 0 HE2 PHE B 27 81.089 20.976 -2.720 1.00 0.00 H new ATOM 0 HZ PHE B 27 83.106 19.689 -2.068 1.00 0.00 H new ATOM 2056 N LYS B 28 75.335 16.530 -0.955 1.00 0.00 N ATOM 2057 CA LYS B 28 74.158 15.880 -0.296 1.00 0.00 C ATOM 2058 C LYS B 28 73.208 15.313 -1.356 1.00 0.00 C ATOM 2059 O LYS B 28 73.004 15.903 -2.398 1.00 0.00 O ATOM 2060 CB LYS B 28 73.403 16.920 0.536 1.00 0.00 C ATOM 2061 CG LYS B 28 74.246 17.335 1.751 1.00 0.00 C ATOM 2062 CD LYS B 28 73.468 18.338 2.621 1.00 0.00 C ATOM 2063 CE LYS B 28 73.604 19.760 2.057 1.00 0.00 C ATOM 2064 NZ LYS B 28 75.031 20.187 2.110 1.00 0.00 N ATOM 0 H LYS B 28 75.139 16.990 -1.844 1.00 0.00 H new ATOM 0 HA LYS B 28 74.514 15.072 0.344 1.00 0.00 H new ATOM 0 HB2 LYS B 28 73.178 17.793 -0.076 1.00 0.00 H new ATOM 0 HB3 LYS B 28 72.449 16.509 0.868 1.00 0.00 H new ATOM 0 HG2 LYS B 28 74.505 16.455 2.341 1.00 0.00 H new ATOM 0 HG3 LYS B 28 75.182 17.782 1.417 1.00 0.00 H new ATOM 0 HD2 LYS B 28 72.416 18.055 2.660 1.00 0.00 H new ATOM 0 HD3 LYS B 28 73.844 18.309 3.644 1.00 0.00 H new ATOM 0 HE2 LYS B 28 73.243 19.790 1.029 1.00 0.00 H new ATOM 0 HE3 LYS B 28 72.986 20.450 2.632 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 75.080 21.219 2.229 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 75.503 19.723 2.913 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 75.507 19.917 1.226 1.00 0.00 H new ATOM 2078 N LEU B 29 72.604 14.183 -1.080 1.00 0.00 N ATOM 2079 CA LEU B 29 71.633 13.572 -2.046 1.00 0.00 C ATOM 2080 C LEU B 29 70.372 13.213 -1.266 1.00 0.00 C ATOM 2081 O LEU B 29 70.404 13.064 -0.061 1.00 0.00 O ATOM 2082 CB LEU B 29 72.254 12.298 -2.678 1.00 0.00 C ATOM 2083 CG LEU B 29 72.360 12.424 -4.204 1.00 0.00 C ATOM 2084 CD1 LEU B 29 73.454 13.431 -4.575 1.00 0.00 C ATOM 2085 CD2 LEU B 29 72.710 11.052 -4.790 1.00 0.00 C ATOM 0 H LEU B 29 72.742 13.652 -0.220 1.00 0.00 H new ATOM 0 HA LEU B 29 71.396 14.269 -2.850 1.00 0.00 H new ATOM 0 HB2 LEU B 29 73.244 12.126 -2.256 1.00 0.00 H new ATOM 0 HB3 LEU B 29 71.645 11.430 -2.425 1.00 0.00 H new ATOM 0 HG LEU B 29 71.409 12.773 -4.607 1.00 0.00 H new ATOM 0 HD11 LEU B 29 73.521 13.513 -5.660 1.00 0.00 H new ATOM 0 HD12 LEU B 29 73.210 14.406 -4.152 1.00 0.00 H new ATOM 0 HD13 LEU B 29 74.411 13.092 -4.177 1.00 0.00 H new ATOM 0 HD21 LEU B 29 72.788 11.129 -5.874 1.00 0.00 H new ATOM 0 HD22 LEU B 29 73.662 10.714 -4.381 1.00 0.00 H new ATOM 0 HD23 LEU B 29 71.929 10.336 -4.532 1.00 0.00 H new ATOM 2097 N ASN B 30 69.266 13.062 -1.941 1.00 0.00 N ATOM 2098 CA ASN B 30 68.008 12.691 -1.235 1.00 0.00 C ATOM 2099 C ASN B 30 67.812 11.181 -1.365 1.00 0.00 C ATOM 2100 O ASN B 30 67.963 10.612 -2.426 1.00 0.00 O ATOM 2101 CB ASN B 30 66.817 13.432 -1.857 1.00 0.00 C ATOM 2102 CG ASN B 30 66.944 13.460 -3.382 1.00 0.00 C ATOM 2103 OD1 ASN B 30 68.021 13.640 -3.915 1.00 0.00 O ATOM 2104 ND2 ASN B 30 65.874 13.292 -4.111 1.00 0.00 N ATOM 0 H ASN B 30 69.179 13.179 -2.950 1.00 0.00 H new ATOM 0 HA ASN B 30 68.073 12.970 -0.183 1.00 0.00 H new ATOM 0 HB2 ASN B 30 65.886 12.941 -1.572 1.00 0.00 H new ATOM 0 HB3 ASN B 30 66.772 14.450 -1.471 1.00 0.00 H new ATOM 0 HD21 ASN B 30 65.942 13.312 -5.129 1.00 0.00 H new ATOM 0 HD22 ASN B 30 64.970 13.141 -3.663 1.00 0.00 H new ATOM 2111 N LYS B 31 67.484 10.525 -0.292 1.00 0.00 N ATOM 2112 CA LYS B 31 67.289 9.053 -0.349 1.00 0.00 C ATOM 2113 C LYS B 31 66.356 8.709 -1.502 1.00 0.00 C ATOM 2114 O LYS B 31 66.414 7.641 -2.050 1.00 0.00 O ATOM 2115 CB LYS B 31 66.696 8.547 0.967 1.00 0.00 C ATOM 2116 CG LYS B 31 67.746 8.647 2.074 1.00 0.00 C ATOM 2117 CD LYS B 31 67.159 8.142 3.391 1.00 0.00 C ATOM 2118 CE LYS B 31 68.220 8.247 4.489 1.00 0.00 C ATOM 2119 NZ LYS B 31 67.744 7.539 5.711 1.00 0.00 N ATOM 0 H LYS B 31 67.342 10.946 0.626 1.00 0.00 H new ATOM 0 HA LYS B 31 68.254 8.571 -0.506 1.00 0.00 H new ATOM 0 HB2 LYS B 31 65.817 9.135 1.231 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.367 7.514 0.856 1.00 0.00 H new ATOM 0 HG2 LYS B 31 68.625 8.060 1.808 1.00 0.00 H new ATOM 0 HG3 LYS B 31 68.074 9.681 2.184 1.00 0.00 H new ATOM 0 HD2 LYS B 31 66.281 8.729 3.660 1.00 0.00 H new ATOM 0 HD3 LYS B 31 66.831 7.108 3.284 1.00 0.00 H new ATOM 0 HE2 LYS B 31 69.158 7.811 4.146 1.00 0.00 H new ATOM 0 HE3 LYS B 31 68.420 9.294 4.717 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 68.262 7.892 6.541 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 66.726 7.712 5.838 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 67.911 6.518 5.608 1.00 0.00 H new ATOM 2133 N SER B 32 65.514 9.602 -1.908 1.00 0.00 N ATOM 2134 CA SER B 32 64.633 9.272 -3.053 1.00 0.00 C ATOM 2135 C SER B 32 65.538 8.970 -4.234 1.00 0.00 C ATOM 2136 O SER B 32 65.315 8.041 -4.984 1.00 0.00 O ATOM 2137 CB SER B 32 63.736 10.441 -3.402 1.00 0.00 C ATOM 2138 OG SER B 32 62.837 10.688 -2.328 1.00 0.00 O ATOM 0 H SER B 32 65.395 10.532 -1.507 1.00 0.00 H new ATOM 0 HA SER B 32 63.996 8.424 -2.802 1.00 0.00 H new ATOM 0 HB2 SER B 32 64.338 11.329 -3.598 1.00 0.00 H new ATOM 0 HB3 SER B 32 63.179 10.226 -4.314 1.00 0.00 H new ATOM 0 HG SER B 32 62.258 11.446 -2.554 1.00 0.00 H new ATOM 2144 N GLU B 33 66.589 9.729 -4.378 1.00 0.00 N ATOM 2145 CA GLU B 33 67.536 9.453 -5.483 1.00 0.00 C ATOM 2146 C GLU B 33 68.068 8.062 -5.273 1.00 0.00 C ATOM 2147 O GLU B 33 68.500 7.422 -6.198 1.00 0.00 O ATOM 2148 CB GLU B 33 68.683 10.470 -5.503 1.00 0.00 C ATOM 2149 CG GLU B 33 68.191 11.788 -6.106 1.00 0.00 C ATOM 2150 CD GLU B 33 67.938 11.599 -7.605 1.00 0.00 C ATOM 2151 OE1 GLU B 33 68.878 11.258 -8.305 1.00 0.00 O ATOM 2152 OE2 GLU B 33 66.810 11.797 -8.025 1.00 0.00 O ATOM 0 H GLU B 33 66.828 10.521 -3.781 1.00 0.00 H new ATOM 0 HA GLU B 33 67.027 9.536 -6.443 1.00 0.00 H new ATOM 0 HB2 GLU B 33 69.052 10.637 -4.491 1.00 0.00 H new ATOM 0 HB3 GLU B 33 69.517 10.081 -6.086 1.00 0.00 H new ATOM 0 HG2 GLU B 33 67.275 12.109 -5.609 1.00 0.00 H new ATOM 0 HG3 GLU B 33 68.931 12.572 -5.947 1.00 0.00 H new ATOM 2159 N LEU B 34 68.025 7.558 -4.075 1.00 0.00 N ATOM 2160 CA LEU B 34 68.521 6.172 -3.908 1.00 0.00 C ATOM 2161 C LEU B 34 67.662 5.293 -4.798 1.00 0.00 C ATOM 2162 O LEU B 34 68.166 4.473 -5.519 1.00 0.00 O ATOM 2163 CB LEU B 34 68.411 5.692 -2.451 1.00 0.00 C ATOM 2164 CG LEU B 34 68.958 4.240 -2.308 1.00 0.00 C ATOM 2165 CD1 LEU B 34 69.750 4.101 -0.993 1.00 0.00 C ATOM 2166 CD2 LEU B 34 67.790 3.223 -2.307 1.00 0.00 C ATOM 0 H LEU B 34 67.682 8.025 -3.235 1.00 0.00 H new ATOM 0 HA LEU B 34 69.576 6.124 -4.177 1.00 0.00 H new ATOM 0 HB2 LEU B 34 68.970 6.363 -1.799 1.00 0.00 H new ATOM 0 HB3 LEU B 34 67.370 5.728 -2.128 1.00 0.00 H new ATOM 0 HG LEU B 34 69.614 4.035 -3.154 1.00 0.00 H new ATOM 0 HD11 LEU B 34 70.128 3.083 -0.902 1.00 0.00 H new ATOM 0 HD12 LEU B 34 70.586 4.800 -0.996 1.00 0.00 H new ATOM 0 HD13 LEU B 34 69.096 4.322 -0.149 1.00 0.00 H new ATOM 0 HD21 LEU B 34 68.187 2.213 -2.206 1.00 0.00 H new ATOM 0 HD22 LEU B 34 67.123 3.436 -1.471 1.00 0.00 H new ATOM 0 HD23 LEU B 34 67.236 3.304 -3.242 1.00 0.00 H new ATOM 2178 N LYS B 35 66.365 5.471 -4.784 1.00 0.00 N ATOM 2179 CA LYS B 35 65.522 4.621 -5.669 1.00 0.00 C ATOM 2180 C LYS B 35 65.889 4.868 -7.126 1.00 0.00 C ATOM 2181 O LYS B 35 66.111 3.947 -7.886 1.00 0.00 O ATOM 2182 CB LYS B 35 64.041 4.957 -5.455 1.00 0.00 C ATOM 2183 CG LYS B 35 63.162 4.092 -6.366 1.00 0.00 C ATOM 2184 CD LYS B 35 61.694 4.444 -6.133 1.00 0.00 C ATOM 2185 CE LYS B 35 60.817 3.609 -7.068 1.00 0.00 C ATOM 2186 NZ LYS B 35 59.383 3.814 -6.722 1.00 0.00 N ATOM 0 H LYS B 35 65.865 6.152 -4.212 1.00 0.00 H new ATOM 0 HA LYS B 35 65.696 3.573 -5.424 1.00 0.00 H new ATOM 0 HB2 LYS B 35 63.770 4.791 -4.412 1.00 0.00 H new ATOM 0 HB3 LYS B 35 63.866 6.012 -5.665 1.00 0.00 H new ATOM 0 HG2 LYS B 35 63.426 4.258 -7.410 1.00 0.00 H new ATOM 0 HG3 LYS B 35 63.332 3.036 -6.158 1.00 0.00 H new ATOM 0 HD2 LYS B 35 61.423 4.253 -5.095 1.00 0.00 H new ATOM 0 HD3 LYS B 35 61.530 5.506 -6.315 1.00 0.00 H new ATOM 0 HE2 LYS B 35 60.996 3.896 -8.104 1.00 0.00 H new ATOM 0 HE3 LYS B 35 61.076 2.554 -6.980 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 58.788 3.246 -7.358 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 59.218 3.520 -5.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 59.141 4.820 -6.828 1.00 0.00 H new ATOM 2200 N GLU B 36 65.940 6.101 -7.526 1.00 0.00 N ATOM 2201 CA GLU B 36 66.275 6.398 -8.941 1.00 0.00 C ATOM 2202 C GLU B 36 67.736 6.077 -9.224 1.00 0.00 C ATOM 2203 O GLU B 36 68.072 5.484 -10.225 1.00 0.00 O ATOM 2204 CB GLU B 36 65.992 7.874 -9.210 1.00 0.00 C ATOM 2205 CG GLU B 36 66.370 8.221 -10.645 1.00 0.00 C ATOM 2206 CD GLU B 36 65.854 9.623 -10.975 1.00 0.00 C ATOM 2207 OE1 GLU B 36 66.402 10.575 -10.445 1.00 0.00 O ATOM 2208 OE2 GLU B 36 64.917 9.719 -11.749 1.00 0.00 O ATOM 0 H GLU B 36 65.765 6.915 -6.937 1.00 0.00 H new ATOM 0 HA GLU B 36 65.665 5.780 -9.599 1.00 0.00 H new ATOM 0 HB2 GLU B 36 64.937 8.088 -9.041 1.00 0.00 H new ATOM 0 HB3 GLU B 36 66.558 8.494 -8.515 1.00 0.00 H new ATOM 0 HG2 GLU B 36 67.452 8.180 -10.769 1.00 0.00 H new ATOM 0 HG3 GLU B 36 65.943 7.492 -11.333 1.00 0.00 H new ATOM 2215 N LEU B 37 68.606 6.451 -8.348 1.00 0.00 N ATOM 2216 CA LEU B 37 70.040 6.159 -8.561 1.00 0.00 C ATOM 2217 C LEU B 37 70.253 4.664 -8.424 1.00 0.00 C ATOM 2218 O LEU B 37 71.072 4.080 -9.105 1.00 0.00 O ATOM 2219 CB LEU B 37 70.871 6.906 -7.503 1.00 0.00 C ATOM 2220 CG LEU B 37 72.393 6.734 -7.768 1.00 0.00 C ATOM 2221 CD1 LEU B 37 73.142 8.006 -7.353 1.00 0.00 C ATOM 2222 CD2 LEU B 37 72.959 5.562 -6.951 1.00 0.00 C ATOM 0 H LEU B 37 68.387 6.950 -7.486 1.00 0.00 H new ATOM 0 HA LEU B 37 70.351 6.485 -9.553 1.00 0.00 H new ATOM 0 HB2 LEU B 37 70.614 7.965 -7.514 1.00 0.00 H new ATOM 0 HB3 LEU B 37 70.626 6.529 -6.510 1.00 0.00 H new ATOM 0 HG LEU B 37 72.527 6.540 -8.832 1.00 0.00 H new ATOM 0 HD11 LEU B 37 74.208 7.878 -7.541 1.00 0.00 H new ATOM 0 HD12 LEU B 37 72.770 8.852 -7.931 1.00 0.00 H new ATOM 0 HD13 LEU B 37 72.981 8.193 -6.291 1.00 0.00 H new ATOM 0 HD21 LEU B 37 74.025 5.460 -7.152 1.00 0.00 H new ATOM 0 HD22 LEU B 37 72.806 5.752 -5.889 1.00 0.00 H new ATOM 0 HD23 LEU B 37 72.447 4.642 -7.232 1.00 0.00 H new ATOM 2234 N LEU B 38 69.545 4.036 -7.530 1.00 0.00 N ATOM 2235 CA LEU B 38 69.760 2.566 -7.354 1.00 0.00 C ATOM 2236 C LEU B 38 69.233 1.792 -8.567 1.00 0.00 C ATOM 2237 O LEU B 38 69.874 0.883 -9.056 1.00 0.00 O ATOM 2238 CB LEU B 38 69.056 2.085 -6.066 1.00 0.00 C ATOM 2239 CG LEU B 38 69.218 0.565 -5.836 1.00 0.00 C ATOM 2240 CD1 LEU B 38 68.285 -0.246 -6.764 1.00 0.00 C ATOM 2241 CD2 LEU B 38 70.679 0.141 -6.052 1.00 0.00 C ATOM 0 H LEU B 38 68.842 4.460 -6.924 1.00 0.00 H new ATOM 0 HA LEU B 38 70.830 2.378 -7.268 1.00 0.00 H new ATOM 0 HB2 LEU B 38 69.463 2.624 -5.210 1.00 0.00 H new ATOM 0 HB3 LEU B 38 67.995 2.330 -6.122 1.00 0.00 H new ATOM 0 HG LEU B 38 68.937 0.353 -4.804 1.00 0.00 H new ATOM 0 HD11 LEU B 38 68.423 -1.311 -6.578 1.00 0.00 H new ATOM 0 HD12 LEU B 38 67.248 0.026 -6.565 1.00 0.00 H new ATOM 0 HD13 LEU B 38 68.525 -0.025 -7.804 1.00 0.00 H new ATOM 0 HD21 LEU B 38 70.775 -0.932 -5.886 1.00 0.00 H new ATOM 0 HD22 LEU B 38 70.980 0.379 -7.072 1.00 0.00 H new ATOM 0 HD23 LEU B 38 71.320 0.675 -5.351 1.00 0.00 H new ATOM 2253 N THR B 39 68.068 2.123 -9.050 1.00 0.00 N ATOM 2254 CA THR B 39 67.502 1.360 -10.205 1.00 0.00 C ATOM 2255 C THR B 39 68.127 1.779 -11.543 1.00 0.00 C ATOM 2256 O THR B 39 68.124 1.020 -12.492 1.00 0.00 O ATOM 2257 CB THR B 39 65.991 1.589 -10.263 1.00 0.00 C ATOM 2258 OG1 THR B 39 65.450 1.512 -8.952 1.00 0.00 O ATOM 2259 CG2 THR B 39 65.351 0.517 -11.143 1.00 0.00 C ATOM 0 H THR B 39 67.484 2.883 -8.700 1.00 0.00 H new ATOM 0 HA THR B 39 67.731 0.306 -10.050 1.00 0.00 H new ATOM 0 HB THR B 39 65.786 2.574 -10.682 1.00 0.00 H new ATOM 0 HG1 THR B 39 65.506 2.391 -8.523 1.00 0.00 H new ATOM 0 HG21 THR B 39 64.274 0.677 -11.186 1.00 0.00 H new ATOM 0 HG22 THR B 39 65.767 0.575 -12.149 1.00 0.00 H new ATOM 0 HG23 THR B 39 65.555 -0.468 -10.723 1.00 0.00 H new ATOM 2267 N ARG B 40 68.642 2.968 -11.650 1.00 0.00 N ATOM 2268 CA ARG B 40 69.225 3.391 -12.957 1.00 0.00 C ATOM 2269 C ARG B 40 70.508 2.619 -13.248 1.00 0.00 C ATOM 2270 O ARG B 40 70.786 2.275 -14.380 1.00 0.00 O ATOM 2271 CB ARG B 40 69.512 4.901 -12.953 1.00 0.00 C ATOM 2272 CG ARG B 40 68.225 5.682 -13.246 1.00 0.00 C ATOM 2273 CD ARG B 40 68.546 7.175 -13.316 1.00 0.00 C ATOM 2274 NE ARG B 40 67.300 7.938 -13.613 1.00 0.00 N ATOM 2275 CZ ARG B 40 67.284 9.235 -13.478 1.00 0.00 C ATOM 2276 NH1 ARG B 40 68.347 9.856 -13.047 1.00 0.00 N ATOM 2277 NH2 ARG B 40 66.208 9.911 -13.772 1.00 0.00 N ATOM 0 H ARG B 40 68.687 3.660 -10.902 1.00 0.00 H new ATOM 0 HA ARG B 40 68.499 3.171 -13.740 1.00 0.00 H new ATOM 0 HB2 ARG B 40 69.916 5.200 -11.986 1.00 0.00 H new ATOM 0 HB3 ARG B 40 70.269 5.137 -13.701 1.00 0.00 H new ATOM 0 HG2 ARG B 40 67.789 5.347 -14.187 1.00 0.00 H new ATOM 0 HG3 ARG B 40 67.486 5.493 -12.467 1.00 0.00 H new ATOM 0 HD2 ARG B 40 68.974 7.510 -12.371 1.00 0.00 H new ATOM 0 HD3 ARG B 40 69.292 7.362 -14.088 1.00 0.00 H new ATOM 0 HE ARG B 40 66.461 7.446 -13.921 1.00 0.00 H new ATOM 0 HH11 ARG B 40 69.188 9.327 -12.816 1.00 0.00 H new ATOM 0 HH12 ARG B 40 68.337 10.870 -12.941 1.00 0.00 H new ATOM 0 HH21 ARG B 40 65.377 9.425 -14.108 1.00 0.00 H new ATOM 0 HH22 ARG B 40 66.198 10.925 -13.666 1.00 0.00 H new ATOM 2291 N GLU B 41 71.300 2.355 -12.248 1.00 0.00 N ATOM 2292 CA GLU B 41 72.581 1.618 -12.484 1.00 0.00 C ATOM 2293 C GLU B 41 72.412 0.157 -12.130 1.00 0.00 C ATOM 2294 O GLU B 41 73.194 -0.673 -12.546 1.00 0.00 O ATOM 2295 CB GLU B 41 73.690 2.221 -11.620 1.00 0.00 C ATOM 2296 CG GLU B 41 73.884 3.693 -11.989 1.00 0.00 C ATOM 2297 CD GLU B 41 75.003 4.288 -11.132 1.00 0.00 C ATOM 2298 OE1 GLU B 41 74.735 4.624 -9.990 1.00 0.00 O ATOM 2299 OE2 GLU B 41 76.109 4.399 -11.634 1.00 0.00 O ATOM 0 H GLU B 41 71.120 2.615 -11.278 1.00 0.00 H new ATOM 0 HA GLU B 41 72.848 1.705 -13.537 1.00 0.00 H new ATOM 0 HB2 GLU B 41 73.432 2.131 -10.565 1.00 0.00 H new ATOM 0 HB3 GLU B 41 74.620 1.672 -11.769 1.00 0.00 H new ATOM 0 HG2 GLU B 41 74.133 3.785 -13.046 1.00 0.00 H new ATOM 0 HG3 GLU B 41 72.957 4.244 -11.831 1.00 0.00 H new ATOM 2306 N LEU B 42 71.407 -0.178 -11.371 1.00 0.00 N ATOM 2307 CA LEU B 42 71.216 -1.615 -11.005 1.00 0.00 C ATOM 2308 C LEU B 42 69.714 -1.944 -10.961 1.00 0.00 C ATOM 2309 O LEU B 42 69.128 -1.994 -9.897 1.00 0.00 O ATOM 2310 CB LEU B 42 71.819 -1.870 -9.623 1.00 0.00 C ATOM 2311 CG LEU B 42 73.353 -1.769 -9.656 1.00 0.00 C ATOM 2312 CD1 LEU B 42 73.883 -1.846 -8.219 1.00 0.00 C ATOM 2313 CD2 LEU B 42 73.953 -2.918 -10.493 1.00 0.00 C ATOM 0 H LEU B 42 70.716 0.469 -10.991 1.00 0.00 H new ATOM 0 HA LEU B 42 71.707 -2.243 -11.748 1.00 0.00 H new ATOM 0 HB2 LEU B 42 71.420 -1.148 -8.911 1.00 0.00 H new ATOM 0 HB3 LEU B 42 71.525 -2.859 -9.272 1.00 0.00 H new ATOM 0 HG LEU B 42 73.642 -0.823 -10.113 1.00 0.00 H new ATOM 0 HD11 LEU B 42 74.971 -1.776 -8.228 1.00 0.00 H new ATOM 0 HD12 LEU B 42 73.471 -1.023 -7.635 1.00 0.00 H new ATOM 0 HD13 LEU B 42 73.585 -2.794 -7.771 1.00 0.00 H new ATOM 0 HD21 LEU B 42 75.039 -2.830 -10.505 1.00 0.00 H new ATOM 0 HD22 LEU B 42 73.671 -3.874 -10.053 1.00 0.00 H new ATOM 0 HD23 LEU B 42 73.573 -2.862 -11.513 1.00 0.00 H new ATOM 2325 N PRO B 43 69.082 -2.155 -12.092 1.00 0.00 N ATOM 2326 CA PRO B 43 67.621 -2.462 -12.115 1.00 0.00 C ATOM 2327 C PRO B 43 67.278 -3.918 -11.704 1.00 0.00 C ATOM 2328 O PRO B 43 67.121 -4.218 -10.537 1.00 0.00 O ATOM 2329 CB PRO B 43 67.268 -2.177 -13.589 1.00 0.00 C ATOM 2330 CG PRO B 43 68.578 -2.202 -14.403 1.00 0.00 C ATOM 2331 CD PRO B 43 69.759 -2.089 -13.418 1.00 0.00 C ATOM 0 HA PRO B 43 67.055 -1.875 -11.392 1.00 0.00 H new ATOM 0 HB2 PRO B 43 66.570 -2.925 -13.966 1.00 0.00 H new ATOM 0 HB3 PRO B 43 66.778 -1.208 -13.684 1.00 0.00 H new ATOM 0 HG2 PRO B 43 68.650 -3.125 -14.979 1.00 0.00 H new ATOM 0 HG3 PRO B 43 68.598 -1.378 -15.117 1.00 0.00 H new ATOM 0 HD2 PRO B 43 70.475 -2.900 -13.549 1.00 0.00 H new ATOM 0 HD3 PRO B 43 70.307 -1.156 -13.547 1.00 0.00 H new ATOM 2339 N SER B 44 67.125 -4.804 -12.656 1.00 0.00 N ATOM 2340 CA SER B 44 66.752 -6.220 -12.342 1.00 0.00 C ATOM 2341 C SER B 44 67.899 -6.970 -11.658 1.00 0.00 C ATOM 2342 O SER B 44 67.670 -7.801 -10.808 1.00 0.00 O ATOM 2343 CB SER B 44 66.380 -6.941 -13.637 1.00 0.00 C ATOM 2344 OG SER B 44 65.849 -8.223 -13.323 1.00 0.00 O ATOM 0 H SER B 44 67.244 -4.605 -13.649 1.00 0.00 H new ATOM 0 HA SER B 44 65.905 -6.202 -11.656 1.00 0.00 H new ATOM 0 HB2 SER B 44 65.647 -6.357 -14.195 1.00 0.00 H new ATOM 0 HB3 SER B 44 67.258 -7.044 -14.275 1.00 0.00 H new ATOM 0 HG SER B 44 65.607 -8.689 -14.151 1.00 0.00 H new ATOM 2350 N PHE B 45 69.119 -6.704 -12.040 1.00 0.00 N ATOM 2351 CA PHE B 45 70.291 -7.421 -11.434 1.00 0.00 C ATOM 2352 C PHE B 45 70.163 -7.503 -9.909 1.00 0.00 C ATOM 2353 O PHE B 45 70.899 -8.216 -9.255 1.00 0.00 O ATOM 2354 CB PHE B 45 71.556 -6.642 -11.770 1.00 0.00 C ATOM 2355 CG PHE B 45 71.901 -6.824 -13.232 1.00 0.00 C ATOM 2356 CD1 PHE B 45 71.344 -5.974 -14.195 1.00 0.00 C ATOM 2357 CD2 PHE B 45 72.773 -7.847 -13.624 1.00 0.00 C ATOM 2358 CE1 PHE B 45 71.662 -6.144 -15.548 1.00 0.00 C ATOM 2359 CE2 PHE B 45 73.090 -8.018 -14.978 1.00 0.00 C ATOM 2360 CZ PHE B 45 72.535 -7.166 -15.940 1.00 0.00 C ATOM 0 H PHE B 45 69.361 -6.015 -12.752 1.00 0.00 H new ATOM 0 HA PHE B 45 70.327 -8.434 -11.836 1.00 0.00 H new ATOM 0 HB2 PHE B 45 71.411 -5.584 -11.551 1.00 0.00 H new ATOM 0 HB3 PHE B 45 72.382 -6.986 -11.147 1.00 0.00 H new ATOM 0 HD1 PHE B 45 70.669 -5.187 -13.894 1.00 0.00 H new ATOM 0 HD2 PHE B 45 73.202 -8.505 -12.882 1.00 0.00 H new ATOM 0 HE1 PHE B 45 71.234 -5.486 -16.290 1.00 0.00 H new ATOM 0 HE2 PHE B 45 73.763 -8.807 -15.280 1.00 0.00 H new ATOM 0 HZ PHE B 45 72.780 -7.297 -16.984 1.00 0.00 H new ATOM 2370 N LEU B 46 69.228 -6.800 -9.345 1.00 0.00 N ATOM 2371 CA LEU B 46 69.027 -6.844 -7.857 1.00 0.00 C ATOM 2372 C LEU B 46 67.853 -7.754 -7.583 1.00 0.00 C ATOM 2373 O LEU B 46 68.005 -8.907 -7.228 1.00 0.00 O ATOM 2374 CB LEU B 46 68.708 -5.455 -7.317 1.00 0.00 C ATOM 2375 CG LEU B 46 69.868 -4.504 -7.593 1.00 0.00 C ATOM 2376 CD1 LEU B 46 69.435 -3.097 -7.196 1.00 0.00 C ATOM 2377 CD2 LEU B 46 71.111 -4.916 -6.781 1.00 0.00 C ATOM 0 H LEU B 46 68.584 -6.189 -9.847 1.00 0.00 H new ATOM 0 HA LEU B 46 69.935 -7.204 -7.373 1.00 0.00 H new ATOM 0 HB2 LEU B 46 67.798 -5.076 -7.783 1.00 0.00 H new ATOM 0 HB3 LEU B 46 68.519 -5.508 -6.245 1.00 0.00 H new ATOM 0 HG LEU B 46 70.128 -4.539 -8.651 1.00 0.00 H new ATOM 0 HD11 LEU B 46 70.250 -2.399 -7.385 1.00 0.00 H new ATOM 0 HD12 LEU B 46 68.564 -2.805 -7.783 1.00 0.00 H new ATOM 0 HD13 LEU B 46 69.181 -3.080 -6.136 1.00 0.00 H new ATOM 0 HD21 LEU B 46 71.928 -4.226 -6.991 1.00 0.00 H new ATOM 0 HD22 LEU B 46 70.876 -4.887 -5.717 1.00 0.00 H new ATOM 0 HD23 LEU B 46 71.409 -5.927 -7.060 1.00 0.00 H new ATOM 2389 N GLY B 47 66.672 -7.254 -7.796 1.00 0.00 N ATOM 2390 CA GLY B 47 65.475 -8.098 -7.606 1.00 0.00 C ATOM 2391 C GLY B 47 65.454 -9.109 -8.746 1.00 0.00 C ATOM 2392 O GLY B 47 64.419 -9.636 -9.107 1.00 0.00 O ATOM 0 H GLY B 47 66.488 -6.296 -8.094 1.00 0.00 H new ATOM 0 HA2 GLY B 47 65.510 -8.605 -6.642 1.00 0.00 H new ATOM 0 HA3 GLY B 47 64.570 -7.490 -7.613 1.00 0.00 H new ATOM 2396 N LYS B 48 66.602 -9.370 -9.338 1.00 0.00 N ATOM 2397 CA LYS B 48 66.660 -10.327 -10.473 1.00 0.00 C ATOM 2398 C LYS B 48 65.858 -11.579 -10.097 1.00 0.00 C ATOM 2399 O LYS B 48 65.004 -12.036 -10.831 1.00 0.00 O ATOM 2400 CB LYS B 48 68.122 -10.732 -10.730 1.00 0.00 C ATOM 2401 CG LYS B 48 68.218 -11.724 -11.902 1.00 0.00 C ATOM 2402 CD LYS B 48 67.666 -11.094 -13.190 1.00 0.00 C ATOM 2403 CE LYS B 48 68.205 -11.853 -14.407 1.00 0.00 C ATOM 2404 NZ LYS B 48 69.658 -11.564 -14.570 1.00 0.00 N ATOM 0 H LYS B 48 67.497 -8.956 -9.076 1.00 0.00 H new ATOM 0 HA LYS B 48 66.247 -9.864 -11.369 1.00 0.00 H new ATOM 0 HB2 LYS B 48 68.716 -9.845 -10.949 1.00 0.00 H new ATOM 0 HB3 LYS B 48 68.542 -11.183 -9.831 1.00 0.00 H new ATOM 0 HG2 LYS B 48 69.257 -12.019 -12.051 1.00 0.00 H new ATOM 0 HG3 LYS B 48 67.660 -12.630 -11.666 1.00 0.00 H new ATOM 0 HD2 LYS B 48 66.576 -11.124 -13.183 1.00 0.00 H new ATOM 0 HD3 LYS B 48 67.955 -10.045 -13.246 1.00 0.00 H new ATOM 0 HE2 LYS B 48 68.049 -12.924 -14.279 1.00 0.00 H new ATOM 0 HE3 LYS B 48 67.661 -11.556 -15.304 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 69.926 -11.685 -15.568 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 69.853 -10.586 -14.275 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 70.211 -12.220 -13.981 1.00 0.00 H new ATOM 2418 N ARG B 49 66.128 -12.117 -8.937 1.00 0.00 N ATOM 2419 CA ARG B 49 65.396 -13.323 -8.459 1.00 0.00 C ATOM 2420 C ARG B 49 65.639 -13.464 -6.953 1.00 0.00 C ATOM 2421 O ARG B 49 65.056 -14.296 -6.287 1.00 0.00 O ATOM 2422 CB ARG B 49 65.906 -14.566 -9.198 1.00 0.00 C ATOM 2423 CG ARG B 49 65.028 -15.772 -8.852 1.00 0.00 C ATOM 2424 CD ARG B 49 65.422 -16.959 -9.732 1.00 0.00 C ATOM 2425 NE ARG B 49 64.400 -18.051 -9.594 1.00 0.00 N ATOM 2426 CZ ARG B 49 64.110 -18.581 -8.435 1.00 0.00 C ATOM 2427 NH1 ARG B 49 64.832 -18.315 -7.381 1.00 0.00 N ATOM 2428 NH2 ARG B 49 63.119 -19.425 -8.341 1.00 0.00 N ATOM 0 H ARG B 49 66.836 -11.765 -8.292 1.00 0.00 H new ATOM 0 HA ARG B 49 64.328 -13.222 -8.655 1.00 0.00 H new ATOM 0 HB2 ARG B 49 65.893 -14.392 -10.274 1.00 0.00 H new ATOM 0 HB3 ARG B 49 66.941 -14.766 -8.920 1.00 0.00 H new ATOM 0 HG2 ARG B 49 65.146 -16.031 -7.800 1.00 0.00 H new ATOM 0 HG3 ARG B 49 63.977 -15.526 -9.004 1.00 0.00 H new ATOM 0 HD2 ARG B 49 65.494 -16.644 -10.773 1.00 0.00 H new ATOM 0 HD3 ARG B 49 66.405 -17.329 -9.442 1.00 0.00 H new ATOM 0 HE ARG B 49 63.919 -18.388 -10.428 1.00 0.00 H new ATOM 0 HH11 ARG B 49 65.633 -17.687 -7.456 1.00 0.00 H new ATOM 0 HH12 ARG B 49 64.596 -18.735 -6.482 1.00 0.00 H new ATOM 0 HH21 ARG B 49 62.576 -19.668 -9.169 1.00 0.00 H new ATOM 0 HH22 ARG B 49 62.888 -19.842 -7.439 1.00 0.00 H new ATOM 2442 N THR B 50 66.495 -12.640 -6.413 1.00 0.00 N ATOM 2443 CA THR B 50 66.785 -12.704 -4.953 1.00 0.00 C ATOM 2444 C THR B 50 65.527 -12.330 -4.169 1.00 0.00 C ATOM 2445 O THR B 50 64.420 -12.624 -4.574 1.00 0.00 O ATOM 2446 CB THR B 50 67.905 -11.720 -4.612 1.00 0.00 C ATOM 2447 OG1 THR B 50 67.447 -10.393 -4.831 1.00 0.00 O ATOM 2448 CG2 THR B 50 69.120 -11.993 -5.498 1.00 0.00 C ATOM 0 H THR B 50 67.008 -11.922 -6.924 1.00 0.00 H new ATOM 0 HA THR B 50 67.095 -13.715 -4.688 1.00 0.00 H new ATOM 0 HB THR B 50 68.189 -11.842 -3.567 1.00 0.00 H new ATOM 0 HG1 THR B 50 67.753 -10.082 -5.709 1.00 0.00 H new ATOM 0 HG21 THR B 50 69.915 -11.290 -5.252 1.00 0.00 H new ATOM 0 HG22 THR B 50 69.471 -13.011 -5.330 1.00 0.00 H new ATOM 0 HG23 THR B 50 68.841 -11.873 -6.545 1.00 0.00 H new ATOM 2456 N ASP B 51 65.687 -11.691 -3.041 1.00 0.00 N ATOM 2457 CA ASP B 51 64.499 -11.305 -2.227 1.00 0.00 C ATOM 2458 C ASP B 51 63.957 -9.958 -2.714 1.00 0.00 C ATOM 2459 O ASP B 51 64.565 -8.922 -2.526 1.00 0.00 O ATOM 2460 CB ASP B 51 64.914 -11.197 -0.757 1.00 0.00 C ATOM 2461 CG ASP B 51 63.674 -11.000 0.116 1.00 0.00 C ATOM 2462 OD1 ASP B 51 62.664 -10.564 -0.412 1.00 0.00 O ATOM 2463 OD2 ASP B 51 63.753 -11.295 1.298 1.00 0.00 O ATOM 0 H ASP B 51 66.589 -11.420 -2.649 1.00 0.00 H new ATOM 0 HA ASP B 51 63.720 -12.060 -2.332 1.00 0.00 H new ATOM 0 HB2 ASP B 51 65.446 -12.098 -0.452 1.00 0.00 H new ATOM 0 HB3 ASP B 51 65.601 -10.361 -0.624 1.00 0.00 H new ATOM 2468 N GLU B 52 62.813 -9.975 -3.341 1.00 0.00 N ATOM 2469 CA GLU B 52 62.205 -8.713 -3.855 1.00 0.00 C ATOM 2470 C GLU B 52 61.802 -7.813 -2.682 1.00 0.00 C ATOM 2471 O GLU B 52 61.843 -6.603 -2.774 1.00 0.00 O ATOM 2472 CB GLU B 52 60.970 -9.053 -4.691 1.00 0.00 C ATOM 2473 CG GLU B 52 60.367 -7.767 -5.264 1.00 0.00 C ATOM 2474 CD GLU B 52 59.180 -8.117 -6.161 1.00 0.00 C ATOM 2475 OE1 GLU B 52 58.980 -9.293 -6.416 1.00 0.00 O ATOM 2476 OE2 GLU B 52 58.492 -7.202 -6.583 1.00 0.00 O ATOM 0 H GLU B 52 62.267 -10.818 -3.521 1.00 0.00 H new ATOM 0 HA GLU B 52 62.932 -8.186 -4.473 1.00 0.00 H new ATOM 0 HB2 GLU B 52 61.242 -9.731 -5.500 1.00 0.00 H new ATOM 0 HB3 GLU B 52 60.233 -9.570 -4.076 1.00 0.00 H new ATOM 0 HG2 GLU B 52 60.044 -7.112 -4.455 1.00 0.00 H new ATOM 0 HG3 GLU B 52 61.119 -7.222 -5.834 1.00 0.00 H new ATOM 2483 N ALA B 53 61.396 -8.394 -1.588 1.00 0.00 N ATOM 2484 CA ALA B 53 60.970 -7.569 -0.420 1.00 0.00 C ATOM 2485 C ALA B 53 62.122 -6.670 0.035 1.00 0.00 C ATOM 2486 O ALA B 53 61.914 -5.531 0.398 1.00 0.00 O ATOM 2487 CB ALA B 53 60.559 -8.489 0.733 1.00 0.00 C ATOM 0 H ALA B 53 61.340 -9.403 -1.451 1.00 0.00 H new ATOM 0 HA ALA B 53 60.124 -6.947 -0.714 1.00 0.00 H new ATOM 0 HB1 ALA B 53 60.248 -7.886 1.586 1.00 0.00 H new ATOM 0 HB2 ALA B 53 59.731 -9.123 0.415 1.00 0.00 H new ATOM 0 HB3 ALA B 53 61.405 -9.114 1.019 1.00 0.00 H new ATOM 2493 N ALA B 54 63.331 -7.158 0.030 1.00 0.00 N ATOM 2494 CA ALA B 54 64.459 -6.294 0.477 1.00 0.00 C ATOM 2495 C ALA B 54 64.539 -5.058 -0.420 1.00 0.00 C ATOM 2496 O ALA B 54 64.862 -3.976 0.020 1.00 0.00 O ATOM 2497 CB ALA B 54 65.777 -7.047 0.411 1.00 0.00 C ATOM 0 H ALA B 54 63.585 -8.103 -0.259 1.00 0.00 H new ATOM 0 HA ALA B 54 64.279 -5.997 1.510 1.00 0.00 H new ATOM 0 HB1 ALA B 54 66.585 -6.395 0.742 1.00 0.00 H new ATOM 0 HB2 ALA B 54 65.729 -7.923 1.058 1.00 0.00 H new ATOM 0 HB3 ALA B 54 65.964 -7.364 -0.615 1.00 0.00 H new ATOM 2503 N PHE B 55 64.229 -5.198 -1.674 1.00 0.00 N ATOM 2504 CA PHE B 55 64.271 -4.010 -2.561 1.00 0.00 C ATOM 2505 C PHE B 55 63.309 -2.998 -1.970 1.00 0.00 C ATOM 2506 O PHE B 55 63.570 -1.814 -1.916 1.00 0.00 O ATOM 2507 CB PHE B 55 63.781 -4.392 -3.952 1.00 0.00 C ATOM 2508 CG PHE B 55 63.824 -3.181 -4.853 1.00 0.00 C ATOM 2509 CD1 PHE B 55 62.740 -2.293 -4.880 1.00 0.00 C ATOM 2510 CD2 PHE B 55 64.940 -2.948 -5.665 1.00 0.00 C ATOM 2511 CE1 PHE B 55 62.773 -1.172 -5.717 1.00 0.00 C ATOM 2512 CE2 PHE B 55 64.972 -1.826 -6.503 1.00 0.00 C ATOM 2513 CZ PHE B 55 63.889 -0.938 -6.530 1.00 0.00 C ATOM 0 H PHE B 55 63.951 -6.073 -2.119 1.00 0.00 H new ATOM 0 HA PHE B 55 65.284 -3.615 -2.638 1.00 0.00 H new ATOM 0 HB2 PHE B 55 64.404 -5.186 -4.363 1.00 0.00 H new ATOM 0 HB3 PHE B 55 62.764 -4.781 -3.897 1.00 0.00 H new ATOM 0 HD1 PHE B 55 61.879 -2.474 -4.254 1.00 0.00 H new ATOM 0 HD2 PHE B 55 65.775 -3.632 -5.645 1.00 0.00 H new ATOM 0 HE1 PHE B 55 61.938 -0.487 -5.736 1.00 0.00 H new ATOM 0 HE2 PHE B 55 65.833 -1.645 -7.129 1.00 0.00 H new ATOM 0 HZ PHE B 55 63.915 -0.074 -7.177 1.00 0.00 H new ATOM 2523 N GLN B 56 62.201 -3.484 -1.503 1.00 0.00 N ATOM 2524 CA GLN B 56 61.203 -2.591 -0.876 1.00 0.00 C ATOM 2525 C GLN B 56 61.757 -2.113 0.462 1.00 0.00 C ATOM 2526 O GLN B 56 61.403 -1.067 0.953 1.00 0.00 O ATOM 2527 CB GLN B 56 59.884 -3.341 -0.670 1.00 0.00 C ATOM 2528 CG GLN B 56 58.859 -2.408 -0.024 1.00 0.00 C ATOM 2529 CD GLN B 56 57.483 -3.076 -0.036 1.00 0.00 C ATOM 2530 OE1 GLN B 56 57.297 -4.098 -0.666 1.00 0.00 O ATOM 2531 NE2 GLN B 56 56.503 -2.537 0.636 1.00 0.00 N ATOM 0 H GLN B 56 61.943 -4.470 -1.530 1.00 0.00 H new ATOM 0 HA GLN B 56 61.009 -1.734 -1.521 1.00 0.00 H new ATOM 0 HB2 GLN B 56 59.508 -3.705 -1.626 1.00 0.00 H new ATOM 0 HB3 GLN B 56 60.045 -4.214 -0.038 1.00 0.00 H new ATOM 0 HG2 GLN B 56 59.155 -2.178 1.000 1.00 0.00 H new ATOM 0 HG3 GLN B 56 58.821 -1.462 -0.565 1.00 0.00 H new ATOM 0 HE21 GLN B 56 56.659 -1.679 1.165 1.00 0.00 H new ATOM 0 HE22 GLN B 56 55.581 -2.974 0.632 1.00 0.00 H new ATOM 2540 N LYS B 57 62.629 -2.883 1.050 1.00 0.00 N ATOM 2541 CA LYS B 57 63.231 -2.486 2.362 1.00 0.00 C ATOM 2542 C LYS B 57 64.161 -1.309 2.144 1.00 0.00 C ATOM 2543 O LYS B 57 64.190 -0.372 2.917 1.00 0.00 O ATOM 2544 CB LYS B 57 64.009 -3.664 2.965 1.00 0.00 C ATOM 2545 CG LYS B 57 64.625 -3.258 4.308 1.00 0.00 C ATOM 2546 CD LYS B 57 64.962 -4.503 5.139 1.00 0.00 C ATOM 2547 CE LYS B 57 66.070 -5.308 4.456 1.00 0.00 C ATOM 2548 NZ LYS B 57 67.254 -4.434 4.229 1.00 0.00 N ATOM 0 H LYS B 57 62.955 -3.776 0.680 1.00 0.00 H new ATOM 0 HA LYS B 57 62.438 -2.203 3.055 1.00 0.00 H new ATOM 0 HB2 LYS B 57 63.343 -4.516 3.104 1.00 0.00 H new ATOM 0 HB3 LYS B 57 64.793 -3.981 2.278 1.00 0.00 H new ATOM 0 HG2 LYS B 57 65.527 -2.670 4.139 1.00 0.00 H new ATOM 0 HG3 LYS B 57 63.930 -2.623 4.857 1.00 0.00 H new ATOM 0 HD2 LYS B 57 65.280 -4.207 6.139 1.00 0.00 H new ATOM 0 HD3 LYS B 57 64.073 -5.122 5.258 1.00 0.00 H new ATOM 0 HE2 LYS B 57 66.348 -6.161 5.075 1.00 0.00 H new ATOM 0 HE3 LYS B 57 65.712 -5.706 3.507 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 68.107 -5.022 4.140 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 67.119 -3.886 3.355 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 67.364 -3.783 5.032 1.00 0.00 H new ATOM 2562 N LEU B 58 64.900 -1.330 1.078 1.00 0.00 N ATOM 2563 CA LEU B 58 65.795 -0.187 0.799 1.00 0.00 C ATOM 2564 C LEU B 58 64.886 0.968 0.474 1.00 0.00 C ATOM 2565 O LEU B 58 65.087 2.082 0.903 1.00 0.00 O ATOM 2566 CB LEU B 58 66.704 -0.495 -0.396 1.00 0.00 C ATOM 2567 CG LEU B 58 67.575 -1.719 -0.094 1.00 0.00 C ATOM 2568 CD1 LEU B 58 68.355 -2.103 -1.355 1.00 0.00 C ATOM 2569 CD2 LEU B 58 68.560 -1.401 1.046 1.00 0.00 C ATOM 0 H LEU B 58 64.922 -2.085 0.392 1.00 0.00 H new ATOM 0 HA LEU B 58 66.443 0.031 1.648 1.00 0.00 H new ATOM 0 HB2 LEU B 58 66.100 -0.679 -1.284 1.00 0.00 H new ATOM 0 HB3 LEU B 58 67.336 0.366 -0.613 1.00 0.00 H new ATOM 0 HG LEU B 58 66.937 -2.548 0.214 1.00 0.00 H new ATOM 0 HD11 LEU B 58 68.977 -2.974 -1.147 1.00 0.00 H new ATOM 0 HD12 LEU B 58 67.656 -2.340 -2.157 1.00 0.00 H new ATOM 0 HD13 LEU B 58 68.988 -1.269 -1.659 1.00 0.00 H new ATOM 0 HD21 LEU B 58 69.174 -2.278 1.252 1.00 0.00 H new ATOM 0 HD22 LEU B 58 69.201 -0.570 0.752 1.00 0.00 H new ATOM 0 HD23 LEU B 58 68.003 -1.129 1.943 1.00 0.00 H new ATOM 2581 N MET B 59 63.849 0.678 -0.252 1.00 0.00 N ATOM 2582 CA MET B 59 62.863 1.727 -0.589 1.00 0.00 C ATOM 2583 C MET B 59 62.147 2.117 0.694 1.00 0.00 C ATOM 2584 O MET B 59 61.855 3.266 0.939 1.00 0.00 O ATOM 2585 CB MET B 59 61.854 1.187 -1.600 1.00 0.00 C ATOM 2586 CG MET B 59 61.000 2.329 -2.152 1.00 0.00 C ATOM 2587 SD MET B 59 59.769 2.815 -0.919 1.00 0.00 S ATOM 2588 CE MET B 59 58.488 1.628 -1.395 1.00 0.00 C ATOM 0 H MET B 59 63.643 -0.248 -0.628 1.00 0.00 H new ATOM 0 HA MET B 59 63.361 2.591 -1.028 1.00 0.00 H new ATOM 0 HB2 MET B 59 62.377 0.687 -2.415 1.00 0.00 H new ATOM 0 HB3 MET B 59 61.216 0.442 -1.126 1.00 0.00 H new ATOM 0 HG2 MET B 59 61.632 3.180 -2.405 1.00 0.00 H new ATOM 0 HG3 MET B 59 60.505 2.015 -3.071 1.00 0.00 H new ATOM 0 HE1 MET B 59 57.778 1.511 -0.576 1.00 0.00 H new ATOM 0 HE2 MET B 59 57.965 1.992 -2.279 1.00 0.00 H new ATOM 0 HE3 MET B 59 58.948 0.665 -1.617 1.00 0.00 H new ATOM 2598 N SER B 60 61.866 1.160 1.521 1.00 0.00 N ATOM 2599 CA SER B 60 61.172 1.480 2.796 1.00 0.00 C ATOM 2600 C SER B 60 62.001 2.508 3.554 1.00 0.00 C ATOM 2601 O SER B 60 61.486 3.275 4.343 1.00 0.00 O ATOM 2602 CB SER B 60 61.017 0.221 3.650 1.00 0.00 C ATOM 2603 OG SER B 60 60.209 0.520 4.780 1.00 0.00 O ATOM 0 H SER B 60 62.084 0.174 1.374 1.00 0.00 H new ATOM 0 HA SER B 60 60.180 1.876 2.580 1.00 0.00 H new ATOM 0 HB2 SER B 60 60.562 -0.577 3.063 1.00 0.00 H new ATOM 0 HB3 SER B 60 61.995 -0.138 3.972 1.00 0.00 H new ATOM 0 HG SER B 60 60.105 -0.284 5.330 1.00 0.00 H new ATOM 2609 N ASN B 61 63.281 2.547 3.312 1.00 0.00 N ATOM 2610 CA ASN B 61 64.123 3.550 4.019 1.00 0.00 C ATOM 2611 C ASN B 61 63.735 4.922 3.492 1.00 0.00 C ATOM 2612 O ASN B 61 63.670 5.890 4.220 1.00 0.00 O ATOM 2613 CB ASN B 61 65.606 3.283 3.758 1.00 0.00 C ATOM 2614 CG ASN B 61 66.452 4.159 4.683 1.00 0.00 C ATOM 2615 OD1 ASN B 61 66.130 5.308 4.914 1.00 0.00 O ATOM 2616 ND2 ASN B 61 67.524 3.658 5.234 1.00 0.00 N ATOM 0 H ASN B 61 63.776 1.935 2.663 1.00 0.00 H new ATOM 0 HA ASN B 61 63.962 3.491 5.095 1.00 0.00 H new ATOM 0 HB2 ASN B 61 65.833 2.231 3.929 1.00 0.00 H new ATOM 0 HB3 ASN B 61 65.847 3.496 2.717 1.00 0.00 H new ATOM 0 HD21 ASN B 61 68.092 4.231 5.859 1.00 0.00 H new ATOM 0 HD22 ASN B 61 67.794 2.694 5.040 1.00 0.00 H new ATOM 2623 N LEU B 62 63.437 5.004 2.229 1.00 0.00 N ATOM 2624 CA LEU B 62 63.009 6.310 1.670 1.00 0.00 C ATOM 2625 C LEU B 62 61.735 6.687 2.410 1.00 0.00 C ATOM 2626 O LEU B 62 61.449 7.842 2.655 1.00 0.00 O ATOM 2627 CB LEU B 62 62.753 6.191 0.163 1.00 0.00 C ATOM 2628 CG LEU B 62 64.091 6.137 -0.584 1.00 0.00 C ATOM 2629 CD1 LEU B 62 65.014 5.085 0.039 1.00 0.00 C ATOM 2630 CD2 LEU B 62 63.837 5.775 -2.048 1.00 0.00 C ATOM 0 H LEU B 62 63.471 4.230 1.565 1.00 0.00 H new ATOM 0 HA LEU B 62 63.778 7.072 1.798 1.00 0.00 H new ATOM 0 HB2 LEU B 62 62.171 5.294 -0.047 1.00 0.00 H new ATOM 0 HB3 LEU B 62 62.165 7.041 -0.184 1.00 0.00 H new ATOM 0 HG LEU B 62 64.570 7.113 -0.514 1.00 0.00 H new ATOM 0 HD11 LEU B 62 65.958 5.062 -0.505 1.00 0.00 H new ATOM 0 HD12 LEU B 62 65.202 5.338 1.082 1.00 0.00 H new ATOM 0 HD13 LEU B 62 64.539 4.106 -0.017 1.00 0.00 H new ATOM 0 HD21 LEU B 62 64.786 5.736 -2.583 1.00 0.00 H new ATOM 0 HD22 LEU B 62 63.349 4.802 -2.103 1.00 0.00 H new ATOM 0 HD23 LEU B 62 63.195 6.529 -2.503 1.00 0.00 H new ATOM 2642 N ASP B 63 60.992 5.688 2.810 1.00 0.00 N ATOM 2643 CA ASP B 63 59.752 5.921 3.593 1.00 0.00 C ATOM 2644 C ASP B 63 60.145 5.938 5.070 1.00 0.00 C ATOM 2645 O ASP B 63 59.342 5.685 5.947 1.00 0.00 O ATOM 2646 CB ASP B 63 58.750 4.793 3.337 1.00 0.00 C ATOM 2647 CG ASP B 63 58.205 4.904 1.910 1.00 0.00 C ATOM 2648 OD1 ASP B 63 58.270 5.988 1.355 1.00 0.00 O ATOM 2649 OD2 ASP B 63 57.730 3.902 1.400 1.00 0.00 O ATOM 0 H ASP B 63 61.199 4.707 2.622 1.00 0.00 H new ATOM 0 HA ASP B 63 59.286 6.863 3.303 1.00 0.00 H new ATOM 0 HB2 ASP B 63 59.232 3.826 3.479 1.00 0.00 H new ATOM 0 HB3 ASP B 63 57.932 4.850 4.055 1.00 0.00 H new ATOM 2654 N SER B 64 61.395 6.223 5.342 1.00 0.00 N ATOM 2655 CA SER B 64 61.877 6.247 6.751 1.00 0.00 C ATOM 2656 C SER B 64 61.008 7.213 7.561 1.00 0.00 C ATOM 2657 O SER B 64 60.180 7.920 7.022 1.00 0.00 O ATOM 2658 CB SER B 64 63.335 6.720 6.786 1.00 0.00 C ATOM 2659 OG SER B 64 63.502 7.794 5.869 1.00 0.00 O ATOM 0 H SER B 64 62.104 6.441 4.641 1.00 0.00 H new ATOM 0 HA SER B 64 61.812 5.246 7.178 1.00 0.00 H new ATOM 0 HB2 SER B 64 63.601 7.042 7.793 1.00 0.00 H new ATOM 0 HB3 SER B 64 64.002 5.898 6.527 1.00 0.00 H new ATOM 0 HG SER B 64 63.853 7.449 5.022 1.00 0.00 H new ATOM 2665 N ASN B 65 61.180 7.237 8.853 1.00 0.00 N ATOM 2666 CA ASN B 65 60.353 8.141 9.699 1.00 0.00 C ATOM 2667 C ASN B 65 60.564 9.600 9.288 1.00 0.00 C ATOM 2668 O ASN B 65 59.628 10.376 9.251 1.00 0.00 O ATOM 2669 CB ASN B 65 60.749 7.964 11.169 1.00 0.00 C ATOM 2670 CG ASN B 65 60.167 6.653 11.702 1.00 0.00 C ATOM 2671 OD1 ASN B 65 60.888 5.813 12.205 1.00 0.00 O ATOM 2672 ND2 ASN B 65 58.882 6.444 11.617 1.00 0.00 N ATOM 0 H ASN B 65 61.859 6.669 9.360 1.00 0.00 H new ATOM 0 HA ASN B 65 59.302 7.886 9.564 1.00 0.00 H new ATOM 0 HB2 ASN B 65 61.835 7.958 11.266 1.00 0.00 H new ATOM 0 HB3 ASN B 65 60.381 8.804 11.759 1.00 0.00 H new ATOM 0 HD21 ASN B 65 58.482 5.576 11.973 1.00 0.00 H new ATOM 0 HD22 ASN B 65 58.277 7.149 11.195 1.00 0.00 H new ATOM 2679 N ARG B 66 61.770 9.998 8.983 1.00 0.00 N ATOM 2680 CA ARG B 66 61.981 11.421 8.588 1.00 0.00 C ATOM 2681 C ARG B 66 63.328 11.586 7.874 1.00 0.00 C ATOM 2682 O ARG B 66 63.598 12.610 7.278 1.00 0.00 O ATOM 2683 CB ARG B 66 61.955 12.290 9.848 1.00 0.00 C ATOM 2684 CG ARG B 66 61.872 13.768 9.459 1.00 0.00 C ATOM 2685 CD ARG B 66 61.741 14.620 10.723 1.00 0.00 C ATOM 2686 NE ARG B 66 61.656 16.059 10.350 1.00 0.00 N ATOM 2687 CZ ARG B 66 61.227 16.933 11.218 1.00 0.00 C ATOM 2688 NH1 ARG B 66 60.866 16.546 12.411 1.00 0.00 N ATOM 2689 NH2 ARG B 66 61.155 18.195 10.893 1.00 0.00 N ATOM 0 H ARG B 66 62.605 9.412 8.989 1.00 0.00 H new ATOM 0 HA ARG B 66 61.190 11.727 7.904 1.00 0.00 H new ATOM 0 HB2 ARG B 66 61.101 12.020 10.469 1.00 0.00 H new ATOM 0 HB3 ARG B 66 62.851 12.111 10.442 1.00 0.00 H new ATOM 0 HG2 ARG B 66 62.762 14.059 8.902 1.00 0.00 H new ATOM 0 HG3 ARG B 66 61.017 13.936 8.804 1.00 0.00 H new ATOM 0 HD2 ARG B 66 60.852 14.326 11.281 1.00 0.00 H new ATOM 0 HD3 ARG B 66 62.598 14.453 11.376 1.00 0.00 H new ATOM 0 HE ARG B 66 61.933 16.361 9.416 1.00 0.00 H new ATOM 0 HH11 ARG B 66 60.919 15.560 12.665 1.00 0.00 H new ATOM 0 HH12 ARG B 66 60.531 17.230 13.089 1.00 0.00 H new ATOM 0 HH21 ARG B 66 61.434 18.498 9.960 1.00 0.00 H new ATOM 0 HH22 ARG B 66 60.819 18.878 11.572 1.00 0.00 H new ATOM 2703 N ASP B 67 64.179 10.598 7.924 1.00 0.00 N ATOM 2704 CA ASP B 67 65.502 10.729 7.246 1.00 0.00 C ATOM 2705 C ASP B 67 65.299 10.785 5.730 1.00 0.00 C ATOM 2706 O ASP B 67 64.617 9.960 5.154 1.00 0.00 O ATOM 2707 CB ASP B 67 66.378 9.527 7.597 1.00 0.00 C ATOM 2708 CG ASP B 67 66.791 9.608 9.068 1.00 0.00 C ATOM 2709 OD1 ASP B 67 66.681 10.681 9.635 1.00 0.00 O ATOM 2710 OD2 ASP B 67 67.215 8.595 9.600 1.00 0.00 O ATOM 0 H ASP B 67 64.018 9.711 8.401 1.00 0.00 H new ATOM 0 HA ASP B 67 65.989 11.645 7.581 1.00 0.00 H new ATOM 0 HB2 ASP B 67 65.834 8.601 7.412 1.00 0.00 H new ATOM 0 HB3 ASP B 67 67.263 9.510 6.960 1.00 0.00 H new ATOM 2715 N ASN B 68 65.885 11.758 5.076 1.00 0.00 N ATOM 2716 CA ASN B 68 65.725 11.874 3.594 1.00 0.00 C ATOM 2717 C ASN B 68 67.016 12.401 2.960 1.00 0.00 C ATOM 2718 O ASN B 68 66.991 12.936 1.870 1.00 0.00 O ATOM 2719 CB ASN B 68 64.581 12.847 3.289 1.00 0.00 C ATOM 2720 CG ASN B 68 64.992 14.265 3.698 1.00 0.00 C ATOM 2721 OD1 ASN B 68 65.862 14.441 4.528 1.00 0.00 O ATOM 2722 ND2 ASN B 68 64.404 15.289 3.143 1.00 0.00 N ATOM 0 H ASN B 68 66.467 12.477 5.505 1.00 0.00 H new ATOM 0 HA ASN B 68 65.503 10.890 3.181 1.00 0.00 H new ATOM 0 HB2 ASN B 68 64.340 12.819 2.226 1.00 0.00 H new ATOM 0 HB3 ASN B 68 63.682 12.548 3.828 1.00 0.00 H new ATOM 0 HD21 ASN B 68 64.675 16.237 3.406 1.00 0.00 H new ATOM 0 HD22 ASN B 68 63.674 15.142 2.446 1.00 0.00 H new ATOM 2729 N GLU B 69 68.137 12.279 3.632 1.00 0.00 N ATOM 2730 CA GLU B 69 69.429 12.800 3.067 1.00 0.00 C ATOM 2731 C GLU B 69 70.445 11.668 2.919 1.00 0.00 C ATOM 2732 O GLU B 69 70.494 10.742 3.705 1.00 0.00 O ATOM 2733 CB GLU B 69 69.998 13.877 3.994 1.00 0.00 C ATOM 2734 CG GLU B 69 71.290 14.444 3.397 1.00 0.00 C ATOM 2735 CD GLU B 69 71.832 15.546 4.308 1.00 0.00 C ATOM 2736 OE1 GLU B 69 71.120 15.939 5.217 1.00 0.00 O ATOM 2737 OE2 GLU B 69 72.949 15.980 4.079 1.00 0.00 O ATOM 0 H GLU B 69 68.215 11.840 4.550 1.00 0.00 H new ATOM 0 HA GLU B 69 69.232 13.227 2.083 1.00 0.00 H new ATOM 0 HB2 GLU B 69 69.268 14.675 4.130 1.00 0.00 H new ATOM 0 HB3 GLU B 69 70.196 13.455 4.979 1.00 0.00 H new ATOM 0 HG2 GLU B 69 72.030 13.652 3.287 1.00 0.00 H new ATOM 0 HG3 GLU B 69 71.099 14.842 2.401 1.00 0.00 H new ATOM 2744 N VAL B 70 71.258 11.754 1.903 1.00 0.00 N ATOM 2745 CA VAL B 70 72.298 10.713 1.646 1.00 0.00 C ATOM 2746 C VAL B 70 73.674 11.355 1.702 1.00 0.00 C ATOM 2747 O VAL B 70 74.052 12.122 0.840 1.00 0.00 O ATOM 2748 CB VAL B 70 72.101 10.151 0.240 1.00 0.00 C ATOM 2749 CG1 VAL B 70 72.890 8.865 0.093 1.00 0.00 C ATOM 2750 CG2 VAL B 70 70.627 9.865 -0.017 1.00 0.00 C ATOM 0 H VAL B 70 71.246 12.516 1.226 1.00 0.00 H new ATOM 0 HA VAL B 70 72.214 9.924 2.393 1.00 0.00 H new ATOM 0 HB VAL B 70 72.452 10.888 -0.483 1.00 0.00 H new ATOM 0 HG11 VAL B 70 72.749 8.464 -0.911 1.00 0.00 H new ATOM 0 HG12 VAL B 70 73.948 9.067 0.258 1.00 0.00 H new ATOM 0 HG13 VAL B 70 72.541 8.138 0.826 1.00 0.00 H new ATOM 0 HG21 VAL B 70 70.504 9.465 -1.023 1.00 0.00 H new ATOM 0 HG22 VAL B 70 70.266 9.137 0.709 1.00 0.00 H new ATOM 0 HG23 VAL B 70 70.055 10.788 0.079 1.00 0.00 H new ATOM 2760 N ASP B 71 74.443 11.002 2.675 1.00 0.00 N ATOM 2761 CA ASP B 71 75.823 11.534 2.757 1.00 0.00 C ATOM 2762 C ASP B 71 76.696 10.530 2.026 1.00 0.00 C ATOM 2763 O ASP B 71 76.237 9.462 1.671 1.00 0.00 O ATOM 2764 CB ASP B 71 76.257 11.649 4.220 1.00 0.00 C ATOM 2765 CG ASP B 71 75.471 12.774 4.895 1.00 0.00 C ATOM 2766 OD1 ASP B 71 74.957 13.621 4.183 1.00 0.00 O ATOM 2767 OD2 ASP B 71 75.399 12.772 6.113 1.00 0.00 O ATOM 0 H ASP B 71 74.178 10.364 3.425 1.00 0.00 H new ATOM 0 HA ASP B 71 75.900 12.528 2.316 1.00 0.00 H new ATOM 0 HB2 ASP B 71 76.082 10.706 4.738 1.00 0.00 H new ATOM 0 HB3 ASP B 71 77.326 11.851 4.279 1.00 0.00 H new ATOM 2772 N PHE B 72 77.933 10.822 1.791 1.00 0.00 N ATOM 2773 CA PHE B 72 78.766 9.831 1.085 1.00 0.00 C ATOM 2774 C PHE B 72 78.722 8.533 1.888 1.00 0.00 C ATOM 2775 O PHE B 72 78.662 7.448 1.343 1.00 0.00 O ATOM 2776 CB PHE B 72 80.197 10.347 0.986 1.00 0.00 C ATOM 2777 CG PHE B 72 81.028 9.327 0.267 1.00 0.00 C ATOM 2778 CD1 PHE B 72 81.148 9.384 -1.123 1.00 0.00 C ATOM 2779 CD2 PHE B 72 81.672 8.321 0.987 1.00 0.00 C ATOM 2780 CE1 PHE B 72 81.915 8.432 -1.794 1.00 0.00 C ATOM 2781 CE2 PHE B 72 82.441 7.369 0.318 1.00 0.00 C ATOM 2782 CZ PHE B 72 82.563 7.422 -1.075 1.00 0.00 C ATOM 0 H PHE B 72 78.398 11.691 2.053 1.00 0.00 H new ATOM 0 HA PHE B 72 78.395 9.658 0.075 1.00 0.00 H new ATOM 0 HB2 PHE B 72 80.220 11.297 0.452 1.00 0.00 H new ATOM 0 HB3 PHE B 72 80.602 10.531 1.981 1.00 0.00 H new ATOM 0 HD1 PHE B 72 80.648 10.164 -1.678 1.00 0.00 H new ATOM 0 HD2 PHE B 72 81.575 8.279 2.062 1.00 0.00 H new ATOM 0 HE1 PHE B 72 82.009 8.475 -2.869 1.00 0.00 H new ATOM 0 HE2 PHE B 72 82.942 6.591 0.875 1.00 0.00 H new ATOM 0 HZ PHE B 72 83.157 6.684 -1.594 1.00 0.00 H new ATOM 2792 N GLN B 73 78.742 8.645 3.186 1.00 0.00 N ATOM 2793 CA GLN B 73 78.692 7.433 4.044 1.00 0.00 C ATOM 2794 C GLN B 73 77.343 6.715 3.900 1.00 0.00 C ATOM 2795 O GLN B 73 77.295 5.507 3.877 1.00 0.00 O ATOM 2796 CB GLN B 73 78.897 7.829 5.510 1.00 0.00 C ATOM 2797 CG GLN B 73 78.852 6.574 6.391 1.00 0.00 C ATOM 2798 CD GLN B 73 79.278 6.927 7.818 1.00 0.00 C ATOM 2799 OE1 GLN B 73 79.321 8.085 8.183 1.00 0.00 O ATOM 2800 NE2 GLN B 73 79.595 5.969 8.648 1.00 0.00 N ATOM 0 H GLN B 73 78.791 9.530 3.691 1.00 0.00 H new ATOM 0 HA GLN B 73 79.485 6.757 3.726 1.00 0.00 H new ATOM 0 HB2 GLN B 73 79.854 8.336 5.630 1.00 0.00 H new ATOM 0 HB3 GLN B 73 78.123 8.531 5.820 1.00 0.00 H new ATOM 0 HG2 GLN B 73 77.845 6.157 6.395 1.00 0.00 H new ATOM 0 HG3 GLN B 73 79.512 5.808 5.983 1.00 0.00 H new ATOM 0 HE21 GLN B 73 79.559 4.997 8.342 1.00 0.00 H new ATOM 0 HE22 GLN B 73 79.878 6.194 9.602 1.00 0.00 H new ATOM 2809 N GLU B 74 76.237 7.418 3.819 1.00 0.00 N ATOM 2810 CA GLU B 74 74.948 6.691 3.705 1.00 0.00 C ATOM 2811 C GLU B 74 74.850 6.030 2.341 1.00 0.00 C ATOM 2812 O GLU B 74 74.386 4.915 2.218 1.00 0.00 O ATOM 2813 CB GLU B 74 73.784 7.663 3.897 1.00 0.00 C ATOM 2814 CG GLU B 74 73.737 8.116 5.355 1.00 0.00 C ATOM 2815 CD GLU B 74 72.573 9.088 5.551 1.00 0.00 C ATOM 2816 OE1 GLU B 74 71.478 8.625 5.825 1.00 0.00 O ATOM 2817 OE2 GLU B 74 72.797 10.281 5.425 1.00 0.00 O ATOM 0 H GLU B 74 76.177 8.436 3.827 1.00 0.00 H new ATOM 0 HA GLU B 74 74.901 5.924 4.478 1.00 0.00 H new ATOM 0 HB2 GLU B 74 73.903 8.525 3.241 1.00 0.00 H new ATOM 0 HB3 GLU B 74 72.845 7.182 3.624 1.00 0.00 H new ATOM 0 HG2 GLU B 74 73.619 7.254 6.011 1.00 0.00 H new ATOM 0 HG3 GLU B 74 74.676 8.597 5.628 1.00 0.00 H new ATOM 2824 N TYR B 75 75.284 6.694 1.312 1.00 0.00 N ATOM 2825 CA TYR B 75 75.198 6.071 -0.029 1.00 0.00 C ATOM 2826 C TYR B 75 76.013 4.774 -0.019 1.00 0.00 C ATOM 2827 O TYR B 75 75.619 3.772 -0.583 1.00 0.00 O ATOM 2828 CB TYR B 75 75.753 7.025 -1.096 1.00 0.00 C ATOM 2829 CG TYR B 75 75.910 6.297 -2.420 1.00 0.00 C ATOM 2830 CD1 TYR B 75 74.825 5.604 -2.986 1.00 0.00 C ATOM 2831 CD2 TYR B 75 77.148 6.312 -3.080 1.00 0.00 C ATOM 2832 CE1 TYR B 75 74.985 4.936 -4.206 1.00 0.00 C ATOM 2833 CE2 TYR B 75 77.302 5.642 -4.299 1.00 0.00 C ATOM 2834 CZ TYR B 75 76.222 4.955 -4.862 1.00 0.00 C ATOM 2835 OH TYR B 75 76.375 4.294 -6.064 1.00 0.00 O ATOM 0 H TYR B 75 75.690 7.629 1.341 1.00 0.00 H new ATOM 0 HA TYR B 75 74.156 5.857 -0.266 1.00 0.00 H new ATOM 0 HB2 TYR B 75 75.083 7.876 -1.218 1.00 0.00 H new ATOM 0 HB3 TYR B 75 76.716 7.422 -0.774 1.00 0.00 H new ATOM 0 HD1 TYR B 75 73.871 5.587 -2.481 1.00 0.00 H new ATOM 0 HD2 TYR B 75 77.984 6.842 -2.647 1.00 0.00 H new ATOM 0 HE1 TYR B 75 74.152 4.405 -4.642 1.00 0.00 H new ATOM 0 HE2 TYR B 75 78.256 5.656 -4.805 1.00 0.00 H new ATOM 0 HH TYR B 75 77.294 4.408 -6.385 1.00 0.00 H new ATOM 2845 N CYS B 76 77.151 4.793 0.623 1.00 0.00 N ATOM 2846 CA CYS B 76 78.002 3.578 0.682 1.00 0.00 C ATOM 2847 C CYS B 76 77.319 2.538 1.557 1.00 0.00 C ATOM 2848 O CYS B 76 77.331 1.361 1.256 1.00 0.00 O ATOM 2849 CB CYS B 76 79.387 3.931 1.246 1.00 0.00 C ATOM 2850 SG CYS B 76 79.347 3.984 3.058 1.00 0.00 S ATOM 0 H CYS B 76 77.527 5.606 1.111 1.00 0.00 H new ATOM 0 HA CYS B 76 78.136 3.173 -0.321 1.00 0.00 H new ATOM 0 HB2 CYS B 76 80.119 3.194 0.915 1.00 0.00 H new ATOM 0 HB3 CYS B 76 79.709 4.897 0.856 1.00 0.00 H new ATOM 0 HG CYS B 76 78.339 4.706 3.449 1.00 0.00 H new ATOM 2856 N VAL B 77 76.700 2.949 2.635 1.00 0.00 N ATOM 2857 CA VAL B 77 76.016 1.943 3.479 1.00 0.00 C ATOM 2858 C VAL B 77 74.963 1.271 2.615 1.00 0.00 C ATOM 2859 O VAL B 77 74.795 0.068 2.645 1.00 0.00 O ATOM 2860 CB VAL B 77 75.361 2.635 4.681 1.00 0.00 C ATOM 2861 CG1 VAL B 77 74.448 1.650 5.421 1.00 0.00 C ATOM 2862 CG2 VAL B 77 76.455 3.131 5.640 1.00 0.00 C ATOM 0 H VAL B 77 76.642 3.915 2.956 1.00 0.00 H new ATOM 0 HA VAL B 77 76.722 1.205 3.860 1.00 0.00 H new ATOM 0 HB VAL B 77 74.767 3.478 4.328 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.987 2.150 6.273 1.00 0.00 H new ATOM 0 HG12 VAL B 77 73.670 1.296 4.744 1.00 0.00 H new ATOM 0 HG13 VAL B 77 75.036 0.802 5.773 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.993 3.623 6.496 1.00 0.00 H new ATOM 0 HG22 VAL B 77 77.048 2.284 5.985 1.00 0.00 H new ATOM 0 HG23 VAL B 77 77.101 3.838 5.120 1.00 0.00 H new ATOM 2872 N PHE B 78 74.265 2.032 1.821 1.00 0.00 N ATOM 2873 CA PHE B 78 73.250 1.410 0.942 1.00 0.00 C ATOM 2874 C PHE B 78 73.950 0.600 -0.148 1.00 0.00 C ATOM 2875 O PHE B 78 73.516 -0.472 -0.502 1.00 0.00 O ATOM 2876 CB PHE B 78 72.386 2.484 0.283 1.00 0.00 C ATOM 2877 CG PHE B 78 71.493 3.134 1.320 1.00 0.00 C ATOM 2878 CD1 PHE B 78 70.532 2.373 2.003 1.00 0.00 C ATOM 2879 CD2 PHE B 78 71.632 4.500 1.607 1.00 0.00 C ATOM 2880 CE1 PHE B 78 69.718 2.977 2.968 1.00 0.00 C ATOM 2881 CE2 PHE B 78 70.816 5.102 2.570 1.00 0.00 C ATOM 2882 CZ PHE B 78 69.861 4.340 3.251 1.00 0.00 C ATOM 0 H PHE B 78 74.354 3.045 1.746 1.00 0.00 H new ATOM 0 HA PHE B 78 72.616 0.760 1.545 1.00 0.00 H new ATOM 0 HB2 PHE B 78 73.020 3.236 -0.186 1.00 0.00 H new ATOM 0 HB3 PHE B 78 71.779 2.041 -0.506 1.00 0.00 H new ATOM 0 HD1 PHE B 78 70.421 1.321 1.784 1.00 0.00 H new ATOM 0 HD2 PHE B 78 72.371 5.088 1.083 1.00 0.00 H new ATOM 0 HE1 PHE B 78 68.979 2.391 3.494 1.00 0.00 H new ATOM 0 HE2 PHE B 78 70.923 6.154 2.788 1.00 0.00 H new ATOM 0 HZ PHE B 78 69.233 4.804 3.997 1.00 0.00 H new ATOM 2892 N LEU B 79 75.032 1.098 -0.693 1.00 0.00 N ATOM 2893 CA LEU B 79 75.721 0.326 -1.771 1.00 0.00 C ATOM 2894 C LEU B 79 76.308 -0.957 -1.179 1.00 0.00 C ATOM 2895 O LEU B 79 76.278 -2.006 -1.791 1.00 0.00 O ATOM 2896 CB LEU B 79 76.827 1.178 -2.406 1.00 0.00 C ATOM 2897 CG LEU B 79 77.522 0.406 -3.539 1.00 0.00 C ATOM 2898 CD1 LEU B 79 76.505 0.031 -4.637 1.00 0.00 C ATOM 2899 CD2 LEU B 79 78.619 1.300 -4.135 1.00 0.00 C ATOM 0 H LEU B 79 75.461 1.989 -0.444 1.00 0.00 H new ATOM 0 HA LEU B 79 75.002 0.065 -2.547 1.00 0.00 H new ATOM 0 HB2 LEU B 79 76.402 2.103 -2.796 1.00 0.00 H new ATOM 0 HB3 LEU B 79 77.558 1.458 -1.648 1.00 0.00 H new ATOM 0 HG LEU B 79 77.955 -0.512 -3.143 1.00 0.00 H new ATOM 0 HD11 LEU B 79 77.013 -0.515 -5.432 1.00 0.00 H new ATOM 0 HD12 LEU B 79 75.722 -0.595 -4.209 1.00 0.00 H new ATOM 0 HD13 LEU B 79 76.061 0.938 -5.047 1.00 0.00 H new ATOM 0 HD21 LEU B 79 79.124 0.768 -4.942 1.00 0.00 H new ATOM 0 HD22 LEU B 79 78.171 2.213 -4.527 1.00 0.00 H new ATOM 0 HD23 LEU B 79 79.342 1.554 -3.360 1.00 0.00 H new ATOM 2911 N SER B 80 76.840 -0.878 0.009 1.00 0.00 N ATOM 2912 CA SER B 80 77.428 -2.090 0.645 1.00 0.00 C ATOM 2913 C SER B 80 76.301 -3.047 1.000 1.00 0.00 C ATOM 2914 O SER B 80 76.380 -4.237 0.769 1.00 0.00 O ATOM 2915 CB SER B 80 78.178 -1.698 1.918 1.00 0.00 C ATOM 2916 OG SER B 80 78.848 -2.839 2.435 1.00 0.00 O ATOM 0 H SER B 80 76.893 -0.026 0.567 1.00 0.00 H new ATOM 0 HA SER B 80 78.125 -2.566 -0.045 1.00 0.00 H new ATOM 0 HB2 SER B 80 78.896 -0.906 1.702 1.00 0.00 H new ATOM 0 HB3 SER B 80 77.482 -1.304 2.658 1.00 0.00 H new ATOM 0 HG SER B 80 79.623 -2.552 2.961 1.00 0.00 H new ATOM 2922 N CYS B 81 75.238 -2.525 1.537 1.00 0.00 N ATOM 2923 CA CYS B 81 74.087 -3.389 1.881 1.00 0.00 C ATOM 2924 C CYS B 81 73.607 -4.042 0.599 1.00 0.00 C ATOM 2925 O CYS B 81 73.228 -5.197 0.573 1.00 0.00 O ATOM 2926 CB CYS B 81 72.960 -2.541 2.475 1.00 0.00 C ATOM 2927 SG CYS B 81 73.424 -2.006 4.140 1.00 0.00 S ATOM 0 H CYS B 81 75.119 -1.535 1.752 1.00 0.00 H new ATOM 0 HA CYS B 81 74.379 -4.141 2.614 1.00 0.00 H new ATOM 0 HB2 CYS B 81 72.770 -1.674 1.842 1.00 0.00 H new ATOM 0 HB3 CYS B 81 72.036 -3.118 2.511 1.00 0.00 H new ATOM 0 HG CYS B 81 74.167 -0.942 4.063 1.00 0.00 H new ATOM 2933 N ILE B 82 73.631 -3.306 -0.477 1.00 0.00 N ATOM 2934 CA ILE B 82 73.184 -3.889 -1.771 1.00 0.00 C ATOM 2935 C ILE B 82 74.189 -4.951 -2.214 1.00 0.00 C ATOM 2936 O ILE B 82 73.823 -6.002 -2.702 1.00 0.00 O ATOM 2937 CB ILE B 82 73.083 -2.782 -2.829 1.00 0.00 C ATOM 2938 CG1 ILE B 82 71.883 -1.869 -2.507 1.00 0.00 C ATOM 2939 CG2 ILE B 82 72.902 -3.405 -4.221 1.00 0.00 C ATOM 2940 CD1 ILE B 82 72.048 -0.512 -3.208 1.00 0.00 C ATOM 0 H ILE B 82 73.938 -2.334 -0.516 1.00 0.00 H new ATOM 0 HA ILE B 82 72.203 -4.349 -1.650 1.00 0.00 H new ATOM 0 HB ILE B 82 73.999 -2.192 -2.820 1.00 0.00 H new ATOM 0 HG12 ILE B 82 70.957 -2.344 -2.831 1.00 0.00 H new ATOM 0 HG13 ILE B 82 71.806 -1.723 -1.430 1.00 0.00 H new ATOM 0 HG21 ILE B 82 72.831 -2.614 -4.967 1.00 0.00 H new ATOM 0 HG22 ILE B 82 73.756 -4.042 -4.448 1.00 0.00 H new ATOM 0 HG23 ILE B 82 71.990 -4.002 -4.237 1.00 0.00 H new ATOM 0 HD11 ILE B 82 71.195 0.125 -2.974 1.00 0.00 H new ATOM 0 HD12 ILE B 82 72.964 -0.033 -2.862 1.00 0.00 H new ATOM 0 HD13 ILE B 82 72.102 -0.664 -4.286 1.00 0.00 H new ATOM 2952 N ALA B 83 75.455 -4.692 -2.043 1.00 0.00 N ATOM 2953 CA ALA B 83 76.470 -5.698 -2.449 1.00 0.00 C ATOM 2954 C ALA B 83 76.290 -6.964 -1.612 1.00 0.00 C ATOM 2955 O ALA B 83 76.230 -8.055 -2.132 1.00 0.00 O ATOM 2956 CB ALA B 83 77.873 -5.132 -2.234 1.00 0.00 C ATOM 0 H ALA B 83 75.828 -3.831 -1.642 1.00 0.00 H new ATOM 0 HA ALA B 83 76.341 -5.939 -3.504 1.00 0.00 H new ATOM 0 HB1 ALA B 83 78.614 -5.873 -2.533 1.00 0.00 H new ATOM 0 HB2 ALA B 83 77.998 -4.231 -2.835 1.00 0.00 H new ATOM 0 HB3 ALA B 83 78.009 -4.887 -1.181 1.00 0.00 H new ATOM 2962 N MET B 84 76.188 -6.832 -0.317 1.00 0.00 N ATOM 2963 CA MET B 84 75.997 -8.044 0.529 1.00 0.00 C ATOM 2964 C MET B 84 74.675 -8.695 0.156 1.00 0.00 C ATOM 2965 O MET B 84 74.545 -9.902 0.149 1.00 0.00 O ATOM 2966 CB MET B 84 76.013 -7.671 2.011 1.00 0.00 C ATOM 2967 CG MET B 84 77.432 -7.264 2.410 1.00 0.00 C ATOM 2968 SD MET B 84 77.476 -6.865 4.176 1.00 0.00 S ATOM 2969 CE MET B 84 76.424 -5.397 4.112 1.00 0.00 C ATOM 0 H MET B 84 76.228 -5.946 0.188 1.00 0.00 H new ATOM 0 HA MET B 84 76.813 -8.746 0.354 1.00 0.00 H new ATOM 0 HB2 MET B 84 75.320 -6.851 2.200 1.00 0.00 H new ATOM 0 HB3 MET B 84 75.680 -8.515 2.615 1.00 0.00 H new ATOM 0 HG2 MET B 84 78.128 -8.074 2.192 1.00 0.00 H new ATOM 0 HG3 MET B 84 77.752 -6.402 1.824 1.00 0.00 H new ATOM 0 HE1 MET B 84 76.619 -4.771 4.983 1.00 0.00 H new ATOM 0 HE2 MET B 84 76.641 -4.833 3.205 1.00 0.00 H new ATOM 0 HE3 MET B 84 75.377 -5.700 4.110 1.00 0.00 H new ATOM 2979 N MET B 85 73.697 -7.907 -0.181 1.00 0.00 N ATOM 2980 CA MET B 85 72.401 -8.496 -0.581 1.00 0.00 C ATOM 2981 C MET B 85 72.673 -9.385 -1.791 1.00 0.00 C ATOM 2982 O MET B 85 72.029 -10.397 -1.989 1.00 0.00 O ATOM 2983 CB MET B 85 71.417 -7.387 -0.965 1.00 0.00 C ATOM 2984 CG MET B 85 70.068 -8.003 -1.345 1.00 0.00 C ATOM 2985 SD MET B 85 68.913 -6.690 -1.812 1.00 0.00 S ATOM 2986 CE MET B 85 67.880 -7.684 -2.917 1.00 0.00 C ATOM 0 H MET B 85 73.741 -6.888 -0.196 1.00 0.00 H new ATOM 0 HA MET B 85 71.964 -9.068 0.238 1.00 0.00 H new ATOM 0 HB2 MET B 85 71.290 -6.696 -0.132 1.00 0.00 H new ATOM 0 HB3 MET B 85 71.813 -6.810 -1.801 1.00 0.00 H new ATOM 0 HG2 MET B 85 70.195 -8.701 -2.173 1.00 0.00 H new ATOM 0 HG3 MET B 85 69.667 -8.573 -0.506 1.00 0.00 H new ATOM 0 HE1 MET B 85 67.085 -7.063 -3.328 1.00 0.00 H new ATOM 0 HE2 MET B 85 68.490 -8.077 -3.730 1.00 0.00 H new ATOM 0 HE3 MET B 85 67.442 -8.512 -2.359 1.00 0.00 H new ATOM 2996 N CYS B 86 73.643 -9.024 -2.596 1.00 0.00 N ATOM 2997 CA CYS B 86 73.966 -9.871 -3.778 1.00 0.00 C ATOM 2998 C CYS B 86 75.260 -9.389 -4.428 1.00 0.00 C ATOM 2999 O CYS B 86 75.251 -8.755 -5.465 1.00 0.00 O ATOM 3000 CB CYS B 86 72.824 -9.809 -4.792 1.00 0.00 C ATOM 3001 SG CYS B 86 73.299 -10.709 -6.289 1.00 0.00 S ATOM 0 H CYS B 86 74.217 -8.188 -2.485 1.00 0.00 H new ATOM 0 HA CYS B 86 74.095 -10.902 -3.448 1.00 0.00 H new ATOM 0 HB2 CYS B 86 71.920 -10.243 -4.365 1.00 0.00 H new ATOM 0 HB3 CYS B 86 72.595 -8.771 -5.035 1.00 0.00 H new ATOM 0 HG CYS B 86 74.402 -10.210 -6.764 1.00 0.00 H new ATOM 3007 N ASN B 87 76.373 -9.690 -3.826 1.00 0.00 N ATOM 3008 CA ASN B 87 77.673 -9.255 -4.406 1.00 0.00 C ATOM 3009 C ASN B 87 77.949 -10.042 -5.688 1.00 0.00 C ATOM 3010 O ASN B 87 78.392 -9.494 -6.675 1.00 0.00 O ATOM 3011 CB ASN B 87 78.791 -9.529 -3.397 1.00 0.00 C ATOM 3012 CG ASN B 87 78.903 -11.038 -3.169 1.00 0.00 C ATOM 3013 OD1 ASN B 87 77.913 -11.740 -3.186 1.00 0.00 O ATOM 3014 ND2 ASN B 87 80.076 -11.571 -2.961 1.00 0.00 N ATOM 0 H ASN B 87 76.440 -10.219 -2.956 1.00 0.00 H new ATOM 0 HA ASN B 87 77.633 -8.190 -4.634 1.00 0.00 H new ATOM 0 HB2 ASN B 87 79.737 -9.134 -3.768 1.00 0.00 H new ATOM 0 HB3 ASN B 87 78.580 -9.021 -2.456 1.00 0.00 H new ATOM 0 HD21 ASN B 87 80.160 -12.577 -2.813 1.00 0.00 H new ATOM 0 HD22 ASN B 87 80.909 -10.982 -2.947 1.00 0.00 H new ATOM 3021 N GLU B 88 77.679 -11.323 -5.678 1.00 0.00 N ATOM 3022 CA GLU B 88 77.921 -12.153 -6.894 1.00 0.00 C ATOM 3023 C GLU B 88 77.428 -13.583 -6.642 1.00 0.00 C ATOM 3024 O GLU B 88 76.607 -14.107 -7.370 1.00 0.00 O ATOM 3025 CB GLU B 88 79.425 -12.185 -7.205 1.00 0.00 C ATOM 3026 CG GLU B 88 79.682 -13.019 -8.463 1.00 0.00 C ATOM 3027 CD GLU B 88 81.177 -13.007 -8.783 1.00 0.00 C ATOM 3028 OE1 GLU B 88 81.889 -12.233 -8.163 1.00 0.00 O ATOM 3029 OE2 GLU B 88 81.584 -13.769 -9.644 1.00 0.00 O ATOM 0 H GLU B 88 77.301 -11.830 -4.878 1.00 0.00 H new ATOM 0 HA GLU B 88 77.383 -11.722 -7.738 1.00 0.00 H new ATOM 0 HB2 GLU B 88 79.797 -11.170 -7.349 1.00 0.00 H new ATOM 0 HB3 GLU B 88 79.970 -12.607 -6.361 1.00 0.00 H new ATOM 0 HG2 GLU B 88 79.340 -14.043 -8.310 1.00 0.00 H new ATOM 0 HG3 GLU B 88 79.116 -12.615 -9.302 1.00 0.00 H new ATOM 3036 N PHE B 89 77.938 -14.223 -5.623 1.00 0.00 N ATOM 3037 CA PHE B 89 77.523 -15.625 -5.323 1.00 0.00 C ATOM 3038 C PHE B 89 76.066 -15.658 -4.854 1.00 0.00 C ATOM 3039 O PHE B 89 75.606 -14.781 -4.150 1.00 0.00 O ATOM 3040 CB PHE B 89 78.427 -16.192 -4.228 1.00 0.00 C ATOM 3041 CG PHE B 89 79.819 -16.383 -4.781 1.00 0.00 C ATOM 3042 CD1 PHE B 89 80.174 -17.594 -5.387 1.00 0.00 C ATOM 3043 CD2 PHE B 89 80.753 -15.344 -4.692 1.00 0.00 C ATOM 3044 CE1 PHE B 89 81.464 -17.766 -5.904 1.00 0.00 C ATOM 3045 CE2 PHE B 89 82.043 -15.515 -5.209 1.00 0.00 C ATOM 3046 CZ PHE B 89 82.398 -16.727 -5.815 1.00 0.00 C ATOM 0 H PHE B 89 78.628 -13.832 -4.982 1.00 0.00 H new ATOM 0 HA PHE B 89 77.614 -16.227 -6.227 1.00 0.00 H new ATOM 0 HB2 PHE B 89 78.452 -15.515 -3.374 1.00 0.00 H new ATOM 0 HB3 PHE B 89 78.032 -17.143 -3.870 1.00 0.00 H new ATOM 0 HD1 PHE B 89 79.453 -18.395 -5.456 1.00 0.00 H new ATOM 0 HD2 PHE B 89 80.478 -14.410 -4.224 1.00 0.00 H new ATOM 0 HE1 PHE B 89 81.738 -18.700 -6.371 1.00 0.00 H new ATOM 0 HE2 PHE B 89 82.763 -14.713 -5.141 1.00 0.00 H new ATOM 0 HZ PHE B 89 83.393 -16.860 -6.214 1.00 0.00 H new ATOM 3056 N PHE B 90 75.337 -16.669 -5.250 1.00 0.00 N ATOM 3057 CA PHE B 90 73.903 -16.777 -4.845 1.00 0.00 C ATOM 3058 C PHE B 90 73.806 -17.499 -3.498 1.00 0.00 C ATOM 3059 O PHE B 90 72.749 -17.591 -2.905 1.00 0.00 O ATOM 3060 CB PHE B 90 73.153 -17.581 -5.906 1.00 0.00 C ATOM 3061 CG PHE B 90 73.414 -16.966 -7.258 1.00 0.00 C ATOM 3062 CD1 PHE B 90 74.529 -17.372 -8.000 1.00 0.00 C ATOM 3063 CD2 PHE B 90 72.552 -15.987 -7.765 1.00 0.00 C ATOM 3064 CE1 PHE B 90 74.783 -16.800 -9.250 1.00 0.00 C ATOM 3065 CE2 PHE B 90 72.806 -15.415 -9.017 1.00 0.00 C ATOM 3066 CZ PHE B 90 73.921 -15.820 -9.760 1.00 0.00 C ATOM 0 H PHE B 90 75.675 -17.429 -5.840 1.00 0.00 H new ATOM 0 HA PHE B 90 73.467 -15.782 -4.753 1.00 0.00 H new ATOM 0 HB2 PHE B 90 73.482 -18.620 -5.894 1.00 0.00 H new ATOM 0 HB3 PHE B 90 72.084 -17.583 -5.692 1.00 0.00 H new ATOM 0 HD1 PHE B 90 75.193 -18.127 -7.607 1.00 0.00 H new ATOM 0 HD2 PHE B 90 71.692 -15.673 -7.191 1.00 0.00 H new ATOM 0 HE1 PHE B 90 75.643 -17.113 -9.823 1.00 0.00 H new ATOM 0 HE2 PHE B 90 72.141 -14.660 -9.410 1.00 0.00 H new ATOM 0 HZ PHE B 90 74.117 -15.378 -10.726 1.00 0.00 H new ATOM 3076 N GLU B 91 74.902 -18.012 -3.013 1.00 0.00 N ATOM 3077 CA GLU B 91 74.881 -18.732 -1.706 1.00 0.00 C ATOM 3078 C GLU B 91 74.405 -17.781 -0.604 1.00 0.00 C ATOM 3079 O GLU B 91 74.690 -16.600 -0.623 1.00 0.00 O ATOM 3080 CB GLU B 91 76.292 -19.237 -1.377 1.00 0.00 C ATOM 3081 CG GLU B 91 76.271 -20.057 -0.080 1.00 0.00 C ATOM 3082 CD GLU B 91 75.421 -21.314 -0.278 1.00 0.00 C ATOM 3083 OE1 GLU B 91 75.224 -21.699 -1.419 1.00 0.00 O ATOM 3084 OE2 GLU B 91 74.988 -21.875 0.716 1.00 0.00 O ATOM 0 H GLU B 91 75.815 -17.964 -3.466 1.00 0.00 H new ATOM 0 HA GLU B 91 74.199 -19.580 -1.770 1.00 0.00 H new ATOM 0 HB2 GLU B 91 76.668 -19.849 -2.197 1.00 0.00 H new ATOM 0 HB3 GLU B 91 76.973 -18.393 -1.271 1.00 0.00 H new ATOM 0 HG2 GLU B 91 77.287 -20.334 0.203 1.00 0.00 H new ATOM 0 HG3 GLU B 91 75.866 -19.457 0.735 1.00 0.00 H new ATOM 3091 N GLY B 92 73.677 -18.288 0.359 1.00 0.00 N ATOM 3092 CA GLY B 92 73.184 -17.413 1.462 1.00 0.00 C ATOM 3093 C GLY B 92 74.348 -16.583 2.007 1.00 0.00 C ATOM 3094 O GLY B 92 75.452 -17.066 2.157 1.00 0.00 O ATOM 0 H GLY B 92 73.404 -19.268 0.428 1.00 0.00 H new ATOM 0 HA2 GLY B 92 72.394 -16.757 1.096 1.00 0.00 H new ATOM 0 HA3 GLY B 92 72.751 -18.020 2.257 1.00 0.00 H new ATOM 3098 N PHE B 93 74.109 -15.332 2.292 1.00 0.00 N ATOM 3099 CA PHE B 93 75.199 -14.457 2.815 1.00 0.00 C ATOM 3100 C PHE B 93 75.256 -14.572 4.350 1.00 0.00 C ATOM 3101 O PHE B 93 74.239 -14.786 4.979 1.00 0.00 O ATOM 3102 CB PHE B 93 74.889 -13.016 2.414 1.00 0.00 C ATOM 3103 CG PHE B 93 74.478 -13.001 0.962 1.00 0.00 C ATOM 3104 CD1 PHE B 93 73.153 -13.286 0.608 1.00 0.00 C ATOM 3105 CD2 PHE B 93 75.422 -12.717 -0.031 1.00 0.00 C ATOM 3106 CE1 PHE B 93 72.774 -13.288 -0.738 1.00 0.00 C ATOM 3107 CE2 PHE B 93 75.042 -12.716 -1.378 1.00 0.00 C ATOM 3108 CZ PHE B 93 73.717 -13.003 -1.731 1.00 0.00 C ATOM 0 H PHE B 93 73.203 -14.876 2.185 1.00 0.00 H new ATOM 0 HA PHE B 93 76.162 -14.760 2.403 1.00 0.00 H new ATOM 0 HB2 PHE B 93 74.091 -12.613 3.038 1.00 0.00 H new ATOM 0 HB3 PHE B 93 75.764 -12.384 2.567 1.00 0.00 H new ATOM 0 HD1 PHE B 93 72.424 -13.504 1.375 1.00 0.00 H new ATOM 0 HD2 PHE B 93 76.444 -12.499 0.242 1.00 0.00 H new ATOM 0 HE1 PHE B 93 71.753 -13.510 -1.011 1.00 0.00 H new ATOM 0 HE2 PHE B 93 75.770 -12.494 -2.145 1.00 0.00 H new ATOM 0 HZ PHE B 93 73.423 -13.004 -2.770 1.00 0.00 H new ATOM 3118 N PRO B 94 76.417 -14.433 4.967 1.00 0.00 N ATOM 3119 CA PRO B 94 76.499 -14.534 6.454 1.00 0.00 C ATOM 3120 C PRO B 94 75.731 -13.394 7.147 1.00 0.00 C ATOM 3121 O PRO B 94 76.203 -12.794 8.092 1.00 0.00 O ATOM 3122 CB PRO B 94 78.019 -14.449 6.713 1.00 0.00 C ATOM 3123 CG PRO B 94 78.701 -13.985 5.412 1.00 0.00 C ATOM 3124 CD PRO B 94 77.706 -14.174 4.256 1.00 0.00 C ATOM 0 HA PRO B 94 76.046 -15.442 6.852 1.00 0.00 H new ATOM 0 HB2 PRO B 94 78.229 -13.750 7.523 1.00 0.00 H new ATOM 0 HB3 PRO B 94 78.407 -15.420 7.021 1.00 0.00 H new ATOM 0 HG2 PRO B 94 78.999 -12.939 5.491 1.00 0.00 H new ATOM 0 HG3 PRO B 94 79.608 -14.562 5.231 1.00 0.00 H new ATOM 0 HD2 PRO B 94 77.648 -13.288 3.623 1.00 0.00 H new ATOM 0 HD3 PRO B 94 77.987 -15.007 3.612 1.00 0.00 H new ATOM 3132 N ASP B 95 74.548 -13.099 6.676 1.00 0.00 N ATOM 3133 CA ASP B 95 73.735 -12.010 7.292 1.00 0.00 C ATOM 3134 C ASP B 95 74.480 -10.678 7.168 1.00 0.00 C ATOM 3135 O ASP B 95 75.682 -10.611 7.321 1.00 0.00 O ATOM 3136 CB ASP B 95 73.478 -12.323 8.769 1.00 0.00 C ATOM 3137 CG ASP B 95 73.087 -13.795 8.915 1.00 0.00 C ATOM 3138 OD1 ASP B 95 72.417 -14.300 8.028 1.00 0.00 O ATOM 3139 OD2 ASP B 95 73.463 -14.392 9.909 1.00 0.00 O ATOM 0 H ASP B 95 74.107 -13.569 5.885 1.00 0.00 H new ATOM 0 HA ASP B 95 72.780 -11.939 6.772 1.00 0.00 H new ATOM 0 HB2 ASP B 95 74.371 -12.112 9.358 1.00 0.00 H new ATOM 0 HB3 ASP B 95 72.684 -11.684 9.155 1.00 0.00 H new ATOM 3144 N LYS B 96 73.771 -9.617 6.884 1.00 0.00 N ATOM 3145 CA LYS B 96 74.437 -8.292 6.742 1.00 0.00 C ATOM 3146 C LYS B 96 75.022 -7.865 8.089 1.00 0.00 C ATOM 3147 O LYS B 96 76.105 -7.320 8.158 1.00 0.00 O ATOM 3148 CB LYS B 96 73.412 -7.240 6.294 1.00 0.00 C ATOM 3149 CG LYS B 96 73.004 -7.466 4.829 1.00 0.00 C ATOM 3150 CD LYS B 96 71.982 -8.606 4.720 1.00 0.00 C ATOM 3151 CE LYS B 96 71.346 -8.583 3.328 1.00 0.00 C ATOM 3152 NZ LYS B 96 70.372 -7.458 3.244 1.00 0.00 N ATOM 0 H LYS B 96 72.761 -9.612 6.745 1.00 0.00 H new ATOM 0 HA LYS B 96 75.231 -8.373 6.000 1.00 0.00 H new ATOM 0 HB2 LYS B 96 72.531 -7.289 6.934 1.00 0.00 H new ATOM 0 HB3 LYS B 96 73.834 -6.242 6.409 1.00 0.00 H new ATOM 0 HG2 LYS B 96 72.579 -6.550 4.419 1.00 0.00 H new ATOM 0 HG3 LYS B 96 73.885 -7.703 4.233 1.00 0.00 H new ATOM 0 HD2 LYS B 96 72.470 -9.565 4.894 1.00 0.00 H new ATOM 0 HD3 LYS B 96 71.214 -8.496 5.485 1.00 0.00 H new ATOM 0 HE2 LYS B 96 72.117 -8.468 2.566 1.00 0.00 H new ATOM 0 HE3 LYS B 96 70.842 -9.529 3.131 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 69.708 -7.631 2.462 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 69.844 -7.389 4.137 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 70.883 -6.568 3.074 1.00 0.00 H new ATOM 3166 N GLN B 97 74.316 -8.105 9.163 1.00 0.00 N ATOM 3167 CA GLN B 97 74.839 -7.707 10.502 1.00 0.00 C ATOM 3168 C GLN B 97 75.766 -8.816 11.031 1.00 0.00 C ATOM 3169 O GLN B 97 75.555 -9.976 10.737 1.00 0.00 O ATOM 3170 CB GLN B 97 73.666 -7.522 11.469 1.00 0.00 C ATOM 3171 CG GLN B 97 72.793 -6.360 10.993 1.00 0.00 C ATOM 3172 CD GLN B 97 71.725 -6.059 12.045 1.00 0.00 C ATOM 3173 OE1 GLN B 97 71.860 -5.132 12.819 1.00 0.00 O ATOM 3174 NE2 GLN B 97 70.661 -6.811 12.111 1.00 0.00 N ATOM 0 H GLN B 97 73.402 -8.558 9.170 1.00 0.00 H new ATOM 0 HA GLN B 97 75.394 -6.772 10.418 1.00 0.00 H new ATOM 0 HB2 GLN B 97 73.076 -8.437 11.521 1.00 0.00 H new ATOM 0 HB3 GLN B 97 74.037 -7.324 12.475 1.00 0.00 H new ATOM 0 HG2 GLN B 97 73.408 -5.477 10.821 1.00 0.00 H new ATOM 0 HG3 GLN B 97 72.322 -6.611 10.043 1.00 0.00 H new ATOM 0 HE21 GLN B 97 70.546 -7.590 11.462 1.00 0.00 H new ATOM 0 HE22 GLN B 97 69.944 -6.620 12.811 1.00 0.00 H new ATOM 3183 N PRO B 98 76.782 -8.491 11.807 1.00 0.00 N ATOM 3184 CA PRO B 98 77.694 -9.547 12.342 1.00 0.00 C ATOM 3185 C PRO B 98 77.010 -10.407 13.421 1.00 0.00 C ATOM 3186 O PRO B 98 77.423 -10.433 14.563 1.00 0.00 O ATOM 3187 CB PRO B 98 78.839 -8.702 12.932 1.00 0.00 C ATOM 3188 CG PRO B 98 78.292 -7.286 13.166 1.00 0.00 C ATOM 3189 CD PRO B 98 77.107 -7.086 12.209 1.00 0.00 C ATOM 0 HA PRO B 98 78.016 -10.268 11.591 1.00 0.00 H new ATOM 0 HB2 PRO B 98 79.194 -9.136 13.867 1.00 0.00 H new ATOM 0 HB3 PRO B 98 79.689 -8.677 12.250 1.00 0.00 H new ATOM 0 HG2 PRO B 98 77.974 -7.164 14.201 1.00 0.00 H new ATOM 0 HG3 PRO B 98 79.065 -6.541 12.980 1.00 0.00 H new ATOM 0 HD2 PRO B 98 76.265 -6.598 12.700 1.00 0.00 H new ATOM 0 HD3 PRO B 98 77.376 -6.469 11.351 1.00 0.00 H new ATOM 3197 N ARG B 99 75.961 -11.112 13.075 1.00 0.00 N ATOM 3198 CA ARG B 99 75.268 -11.958 14.095 1.00 0.00 C ATOM 3199 C ARG B 99 75.880 -13.360 14.115 1.00 0.00 C ATOM 3200 O ARG B 99 76.690 -13.682 14.963 1.00 0.00 O ATOM 3201 CB ARG B 99 73.781 -12.059 13.747 1.00 0.00 C ATOM 3202 CG ARG B 99 73.040 -12.775 14.878 1.00 0.00 C ATOM 3203 CD ARG B 99 71.554 -12.875 14.527 1.00 0.00 C ATOM 3204 NE ARG B 99 70.782 -13.350 15.722 1.00 0.00 N ATOM 3205 CZ ARG B 99 71.061 -14.479 16.317 1.00 0.00 C ATOM 3206 NH1 ARG B 99 71.896 -15.323 15.778 1.00 0.00 N ATOM 3207 NH2 ARG B 99 70.459 -14.786 17.431 1.00 0.00 N ATOM 0 H ARG B 99 75.557 -11.139 12.139 1.00 0.00 H new ATOM 0 HA ARG B 99 75.387 -11.501 15.078 1.00 0.00 H new ATOM 0 HB2 ARG B 99 73.363 -11.063 13.597 1.00 0.00 H new ATOM 0 HB3 ARG B 99 73.652 -12.603 12.811 1.00 0.00 H new ATOM 0 HG2 ARG B 99 73.457 -13.771 15.028 1.00 0.00 H new ATOM 0 HG3 ARG B 99 73.168 -12.231 15.814 1.00 0.00 H new ATOM 0 HD2 ARG B 99 71.181 -11.903 14.204 1.00 0.00 H new ATOM 0 HD3 ARG B 99 71.413 -13.564 13.694 1.00 0.00 H new ATOM 0 HE ARG B 99 70.019 -12.776 16.080 1.00 0.00 H new ATOM 0 HH11 ARG B 99 72.337 -15.104 14.885 1.00 0.00 H new ATOM 0 HH12 ARG B 99 72.108 -16.202 16.250 1.00 0.00 H new ATOM 0 HH21 ARG B 99 69.774 -14.146 17.834 1.00 0.00 H new ATOM 0 HH22 ARG B 99 70.673 -15.666 17.900 1.00 0.00 H new ATOM 3221 N LYS B 100 75.502 -14.199 13.190 1.00 0.00 N ATOM 3222 CA LYS B 100 76.065 -15.581 13.160 1.00 0.00 C ATOM 3223 C LYS B 100 77.538 -15.543 12.752 1.00 0.00 C ATOM 3224 O LYS B 100 77.947 -14.744 11.932 1.00 0.00 O ATOM 3225 CB LYS B 100 75.282 -16.438 12.166 1.00 0.00 C ATOM 3226 CG LYS B 100 73.812 -16.506 12.590 1.00 0.00 C ATOM 3227 CD LYS B 100 73.020 -17.364 11.593 1.00 0.00 C ATOM 3228 CE LYS B 100 73.401 -18.844 11.732 1.00 0.00 C ATOM 3229 NZ LYS B 100 72.328 -19.689 11.137 1.00 0.00 N ATOM 0 H LYS B 100 74.828 -13.989 12.454 1.00 0.00 H new ATOM 0 HA LYS B 100 75.983 -16.014 14.157 1.00 0.00 H new ATOM 0 HB2 LYS B 100 75.363 -16.016 11.164 1.00 0.00 H new ATOM 0 HB3 LYS B 100 75.705 -17.442 12.124 1.00 0.00 H new ATOM 0 HG2 LYS B 100 73.732 -16.930 13.591 1.00 0.00 H new ATOM 0 HG3 LYS B 100 73.390 -15.502 12.634 1.00 0.00 H new ATOM 0 HD2 LYS B 100 71.951 -17.240 11.767 1.00 0.00 H new ATOM 0 HD3 LYS B 100 73.218 -17.026 10.576 1.00 0.00 H new ATOM 0 HE2 LYS B 100 74.350 -19.035 11.231 1.00 0.00 H new ATOM 0 HE3 LYS B 100 73.539 -19.098 12.783 1.00 0.00 H new ATOM 0 HZ1 LYS B 100 72.585 -20.693 11.230 1.00 0.00 H new ATOM 0 HZ2 LYS B 100 71.432 -19.513 11.634 1.00 0.00 H new ATOM 0 HZ3 LYS B 100 72.218 -19.452 10.130 1.00 0.00 H new ATOM 3243 N LYS B 101 78.336 -16.416 13.310 1.00 0.00 N ATOM 3244 CA LYS B 101 79.789 -16.459 12.960 1.00 0.00 C ATOM 3245 C LYS B 101 80.034 -17.604 11.975 1.00 0.00 C ATOM 3246 O LYS B 101 79.082 -18.298 11.658 1.00 0.00 O ATOM 3247 CB LYS B 101 80.606 -16.698 14.232 1.00 0.00 C ATOM 3248 CG LYS B 101 80.485 -15.480 15.151 1.00 0.00 C ATOM 3249 CD LYS B 101 81.301 -15.714 16.425 1.00 0.00 C ATOM 3250 CE LYS B 101 81.176 -14.494 17.340 1.00 0.00 C ATOM 3251 NZ LYS B 101 82.033 -14.686 18.544 1.00 0.00 N ATOM 3252 OXT LYS B 101 81.168 -17.768 11.556 1.00 0.00 O ATOM 0 H LYS B 101 78.041 -17.107 13.999 1.00 0.00 H new ATOM 0 HA LYS B 101 80.089 -15.515 12.506 1.00 0.00 H new ATOM 0 HB2 LYS B 101 80.248 -17.591 14.745 1.00 0.00 H new ATOM 0 HB3 LYS B 101 81.651 -16.873 13.978 1.00 0.00 H new ATOM 0 HG2 LYS B 101 80.842 -14.587 14.637 1.00 0.00 H new ATOM 0 HG3 LYS B 101 79.439 -15.305 15.404 1.00 0.00 H new ATOM 0 HD2 LYS B 101 80.945 -16.606 16.940 1.00 0.00 H new ATOM 0 HD3 LYS B 101 82.347 -15.888 16.173 1.00 0.00 H new ATOM 0 HE2 LYS B 101 81.478 -13.593 16.806 1.00 0.00 H new ATOM 0 HE3 LYS B 101 80.137 -14.355 17.638 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 81.948 -13.857 19.166 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 81.725 -15.537 19.057 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 83.024 -14.798 18.250 1.00 0.00 H new TER 3266 LYS B 101