USER MOD reduce.3.24.130724 H: found=0, std=0, add=1436, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 1436 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 70 THR OG1 : rot 60:sc= -1.76 USER MOD Set 1.2: B 72 HIS : no HD1:sc= -5.65! C(o=-12!,f=-18!) USER MOD Set 1.3: B 87 LYS NZ :NH3+ -173:sc= -5.02! (180deg=-5.29!) USER MOD Set 2.1: A 67 THR OG1 : rot 176:sc= -0.581 USER MOD Set 2.2: B 53 THR OG1 : rot 60:sc= -5.06! USER MOD Set 3.1: B 32 TYR OH : rot 180:sc= 0.613 USER MOD Set 3.2: B 41 HIS : no HE2:sc= -18.2! C(o=-18!,f=-29!) USER MOD Set 4.1: B 27 GLN : amide:sc= -0.0911 K(o=-0.091,f=-1.3!) USER MOD Set 4.2: B 49 LYS NZ :NH3+ 175:sc= 0 (180deg=0) USER MOD Set 5.1: A 88 SER OG : rot -123:sc= 0.448 USER MOD Set 5.2: B 88 SER OG : rot -99:sc= -0.558 USER MOD Set 6.1: A 68 HIS :FLIP no HD1:sc= -7.55! C(o=-11!,f=-7.5!) USER MOD Set 6.2: A 70 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 43 LYS NZ :NH3+ 176:sc= 0.139 (180deg=-0.0445) USER MOD Set 7.2: B 67 THR OG1 : rot -151:sc= -0.533 USER MOD Set 8.1: A 13 MET CE :methyl -112:sc= -1.59! (180deg=-2.51) USER MOD Set 8.2: A 21 SER OG : rot 54:sc= -3.7! USER MOD Set 9.1: A 1 MET N :NH3+ -178:sc= -2.79 (180deg=-2.9) USER MOD Set 9.2: A 2 CYS SG : rot 180:sc= -0.0948 USER MOD Single : A 1 MET CE :methyl 151:sc= -0.754 (180deg=-2.16!) USER MOD Single : A 5 LYS NZ :NH3+ -166:sc= -0.0137 (180deg=-0.222) USER MOD Single : A 9 LYS NZ :NH3+ -157:sc= -0.54 (180deg=-2.18!) USER MOD Single : A 10 ASN : amide:sc= -2.09 K(o=-2.1,f=-4.5!) USER MOD Single : A 14 SER OG : rot 180:sc= 0.0101 USER MOD Single : A 17 MET CE :methyl -150:sc= -10.1! (180deg=-11.3!) USER MOD Single : A 18 GLN :FLIP amide:sc= -5.18! C(o=-10!,f=-5.2!) USER MOD Single : A 19 GLN : amide:sc= -5.73! C(o=-5.7!,f=-11!) USER MOD Single : A 24 CYS SG : rot 124:sc= -7.98! USER MOD Single : A 26 THR OG1 : rot 66:sc= 0.0148 USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.115) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.168 K(o=-0.17,f=-2.2!) USER MOD Single : A 36 LYS NZ :NH3+ -157:sc= -5.06! (180deg=-6.79!) USER MOD Single : A 41 HIS : no HE2:sc= -24.5! C(o=-25!,f=-28!) USER MOD Single : A 44 LYS NZ :NH3+ -149:sc= -0.201 (180deg=-1.09) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= -0.709 (180deg=-0.709) USER MOD Single : A 50 TYR OH : rot -140:sc= -1.08 USER MOD Single : A 51 ASN : amide:sc= -2.97! C(o=-3!,f=-4!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HE2:sc= -23.5! C(o=-24!,f=-25!) USER MOD Single : A 56 CYS SG : rot 97:sc= -2.76! USER MOD Single : A 61 ASN : amide:sc= -1.26! C(o=-1.3!,f=-1!) USER MOD Single : A 64 SER OG : rot 100:sc= -0.0905 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HD1:sc= -7.58! C(o=-7.6!,f=-7.4!) USER MOD Single : A 75 TYR OH : rot 39:sc= 1.35 USER MOD Single : A 77 TYR OH : rot 150:sc= -2.02! USER MOD Single : A 80 GLN : amide:sc= -0.0509 K(o=-0.051,f=-1.5) USER MOD Single : A 87 LYS NZ :NH3+ 154:sc= -9.59! (180deg=-12.2!) USER MOD Single : B 1 MET CE :methyl 161:sc= -0.0231 (180deg=-0.404) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 CYS SG : rot 180:sc= 0.285 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 ASN :FLIP amide:sc= -0.0747 F(o=-2.4!,f=-0.075) USER MOD Single : B 13 MET CE :methyl 138:sc= -0.183 (180deg=-0.87) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 17 MET CE :methyl -124:sc= -5.92! (180deg=-10.2!) USER MOD Single : B 18 GLN : amide:sc= -15.3! C(o=-15!,f=-19!) USER MOD Single : B 19 GLN :FLIP amide:sc= -7.34! C(o=-8.1!,f=-7.3!) USER MOD Single : B 21 SER OG : rot -82:sc= -1.86 USER MOD Single : B 24 CYS SG : rot 158:sc= -6.17! USER MOD Single : B 26 THR OG1 : rot 61:sc= -0.409 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 ASN :FLIP amide:sc= -0.137 F(o=-0.69,f=-0.14) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.0783) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 TYR OH : rot 180:sc= -2.63! USER MOD Single : B 51 ASN : amide:sc= -2.02 K(o=-2,f=-4.4!) USER MOD Single : B 55 HIS : no HE2:sc= -14.6! C(o=-15!,f=-16!) USER MOD Single : B 56 CYS SG : rot -87:sc= -1.29 USER MOD Single : B 61 ASN : amide:sc= -2.18 X(o=-2.2,f=-2.7!) USER MOD Single : B 64 SER OG : rot -106:sc= 0.0429 USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 68 HIS :FLIP no HD1:sc= -9.68! C(o=-11!,f=-9.7!) USER MOD Single : B 71 LYS NZ :NH3+ -169:sc= -0.178 (180deg=-0.39) USER MOD Single : B 75 TYR OH : rot 27:sc= 0.137 USER MOD Single : B 77 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -19.735 2.323 10.952 1.00 0.00 N ATOM 2 CA MET A 1 -20.075 0.886 10.777 1.00 0.00 C ATOM 3 C MET A 1 -21.383 0.716 10.011 1.00 0.00 C ATOM 4 O MET A 1 -22.058 -0.306 10.134 1.00 0.00 O ATOM 5 CB MET A 1 -20.185 0.240 12.160 1.00 0.00 C ATOM 6 CG MET A 1 -19.153 0.749 13.153 1.00 0.00 C ATOM 7 SD MET A 1 -18.884 -0.393 14.522 1.00 0.00 S ATOM 8 CE MET A 1 -18.577 -1.919 13.636 1.00 0.00 C ATOM 0 H1 MET A 1 -18.824 2.406 11.446 1.00 0.00 H new ATOM 0 H2 MET A 1 -19.666 2.779 10.020 1.00 0.00 H new ATOM 0 H3 MET A 1 -20.477 2.790 11.512 1.00 0.00 H new ATOM 0 HA MET A 1 -19.290 0.401 10.196 1.00 0.00 H new ATOM 0 HB2 MET A 1 -21.183 0.424 12.559 1.00 0.00 H new ATOM 0 HB3 MET A 1 -20.076 -0.840 12.057 1.00 0.00 H new ATOM 0 HG2 MET A 1 -18.209 0.918 12.635 1.00 0.00 H new ATOM 0 HG3 MET A 1 -19.478 1.712 13.547 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.921 -2.557 14.227 1.00 0.00 H new ATOM 0 HE2 MET A 1 -19.522 -2.434 13.460 1.00 0.00 H new ATOM 0 HE3 MET A 1 -18.102 -1.696 12.681 1.00 0.00 H new ATOM 20 N CYS A 2 -21.735 1.724 9.221 1.00 0.00 N ATOM 21 CA CYS A 2 -22.961 1.684 8.433 1.00 0.00 C ATOM 22 C CYS A 2 -22.700 2.126 6.997 1.00 0.00 C ATOM 23 O CYS A 2 -23.086 1.444 6.048 1.00 0.00 O ATOM 24 CB CYS A 2 -24.028 2.578 9.068 1.00 0.00 C ATOM 25 SG CYS A 2 -23.811 2.842 10.844 1.00 0.00 S ATOM 0 H CYS A 2 -21.189 2.578 9.109 1.00 0.00 H new ATOM 0 HA CYS A 2 -23.320 0.655 8.417 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -24.023 3.545 8.565 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -25.008 2.134 8.895 1.00 0.00 H new ATOM 0 HG CYS A 2 -24.760 3.612 11.288 1.00 0.00 H new ATOM 31 N ASP A 3 -22.044 3.271 6.847 1.00 0.00 N ATOM 32 CA ASP A 3 -21.731 3.803 5.526 1.00 0.00 C ATOM 33 C ASP A 3 -21.078 5.178 5.632 1.00 0.00 C ATOM 34 O ASP A 3 -21.519 6.025 6.407 1.00 0.00 O ATOM 35 CB ASP A 3 -23.001 3.892 4.676 1.00 0.00 C ATOM 36 CG ASP A 3 -24.260 3.905 5.519 1.00 0.00 C ATOM 37 OD1 ASP A 3 -24.322 4.701 6.480 1.00 0.00 O ATOM 38 OD2 ASP A 3 -25.184 3.120 5.220 1.00 0.00 O ATOM 0 H ASP A 3 -21.719 3.848 7.623 1.00 0.00 H new ATOM 0 HA ASP A 3 -21.027 3.124 5.046 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -22.965 4.796 4.067 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -23.035 3.046 3.989 1.00 0.00 H new ATOM 43 N ARG A 4 -20.026 5.393 4.847 1.00 0.00 N ATOM 44 CA ARG A 4 -19.319 6.668 4.856 1.00 0.00 C ATOM 45 C ARG A 4 -18.873 7.028 6.271 1.00 0.00 C ATOM 46 O ARG A 4 -18.680 8.200 6.593 1.00 0.00 O ATOM 47 CB ARG A 4 -20.217 7.773 4.297 1.00 0.00 C ATOM 48 CG ARG A 4 -19.471 8.808 3.470 1.00 0.00 C ATOM 49 CD ARG A 4 -20.427 9.782 2.800 1.00 0.00 C ATOM 50 NE ARG A 4 -20.265 11.143 3.304 1.00 0.00 N ATOM 51 CZ ARG A 4 -21.181 12.098 3.162 1.00 0.00 C ATOM 52 NH1 ARG A 4 -22.323 11.839 2.539 1.00 0.00 N ATOM 53 NH2 ARG A 4 -20.954 13.313 3.643 1.00 0.00 N ATOM 0 H ARG A 4 -19.646 4.703 4.199 1.00 0.00 H new ATOM 0 HA ARG A 4 -18.434 6.573 4.226 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -20.994 7.320 3.681 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -20.718 8.275 5.125 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -18.780 9.357 4.110 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -18.871 8.305 2.711 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -20.259 9.772 1.723 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -21.453 9.454 2.965 1.00 0.00 H new ATOM 0 HE ARG A 4 -19.400 11.375 3.793 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -22.501 10.906 2.167 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -23.023 12.573 2.432 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -20.077 13.516 4.122 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -21.657 14.044 3.534 1.00 0.00 H new ATOM 67 N LYS A 5 -18.717 6.010 7.114 1.00 0.00 N ATOM 68 CA LYS A 5 -18.301 6.216 8.497 1.00 0.00 C ATOM 69 C LYS A 5 -16.795 6.429 8.593 1.00 0.00 C ATOM 70 O LYS A 5 -16.074 5.597 9.144 1.00 0.00 O ATOM 71 CB LYS A 5 -18.707 5.020 9.358 1.00 0.00 C ATOM 72 CG LYS A 5 -18.162 5.084 10.776 1.00 0.00 C ATOM 73 CD LYS A 5 -18.837 6.182 11.582 1.00 0.00 C ATOM 74 CE LYS A 5 -18.171 6.371 12.936 1.00 0.00 C ATOM 75 NZ LYS A 5 -18.019 5.081 13.664 1.00 0.00 N ATOM 0 H LYS A 5 -18.873 5.034 6.862 1.00 0.00 H new ATOM 0 HA LYS A 5 -18.801 7.112 8.865 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -19.795 4.962 9.397 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -18.356 4.104 8.883 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -18.313 4.124 11.269 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -17.087 5.261 10.746 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -18.802 7.118 11.024 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -19.889 5.935 11.724 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -17.191 6.828 12.798 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -18.762 7.061 13.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -17.786 5.270 14.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -18.909 4.546 13.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -17.255 4.525 13.229 1.00 0.00 H new ATOM 89 N ALA A 6 -16.325 7.547 8.055 1.00 0.00 N ATOM 90 CA ALA A 6 -14.907 7.866 8.082 1.00 0.00 C ATOM 91 C ALA A 6 -14.674 9.323 8.458 1.00 0.00 C ATOM 92 O ALA A 6 -15.593 10.019 8.891 1.00 0.00 O ATOM 93 CB ALA A 6 -14.276 7.558 6.734 1.00 0.00 C ATOM 0 H ALA A 6 -16.907 8.247 7.595 1.00 0.00 H new ATOM 0 HA ALA A 6 -14.435 7.247 8.845 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -13.214 7.801 6.766 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -14.400 6.499 6.508 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.761 8.153 5.961 1.00 0.00 H new ATOM 99 N VAL A 7 -13.437 9.776 8.291 1.00 0.00 N ATOM 100 CA VAL A 7 -13.074 11.150 8.611 1.00 0.00 C ATOM 101 C VAL A 7 -12.016 11.671 7.649 1.00 0.00 C ATOM 102 O VAL A 7 -10.854 11.827 8.020 1.00 0.00 O ATOM 103 CB VAL A 7 -12.540 11.268 10.050 1.00 0.00 C ATOM 104 CG1 VAL A 7 -12.028 12.674 10.317 1.00 0.00 C ATOM 105 CG2 VAL A 7 -13.618 10.884 11.052 1.00 0.00 C ATOM 0 H VAL A 7 -12.667 9.210 7.935 1.00 0.00 H new ATOM 0 HA VAL A 7 -13.980 11.749 8.516 1.00 0.00 H new ATOM 0 HB VAL A 7 -11.706 10.576 10.166 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -11.655 12.737 11.339 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -11.222 12.906 9.621 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.840 13.389 10.182 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -13.223 10.973 12.064 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -14.475 11.548 10.937 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -13.930 9.855 10.874 1.00 0.00 H new ATOM 115 N ILE A 8 -12.424 11.932 6.411 1.00 0.00 N ATOM 116 CA ILE A 8 -11.509 12.432 5.392 1.00 0.00 C ATOM 117 C ILE A 8 -10.607 13.530 5.954 1.00 0.00 C ATOM 118 O ILE A 8 -10.902 14.133 6.986 1.00 0.00 O ATOM 119 CB ILE A 8 -12.284 12.954 4.146 1.00 0.00 C ATOM 120 CG1 ILE A 8 -12.415 11.845 3.102 1.00 0.00 C ATOM 121 CG2 ILE A 8 -11.615 14.176 3.520 1.00 0.00 C ATOM 122 CD1 ILE A 8 -13.726 11.096 3.172 1.00 0.00 C ATOM 0 H ILE A 8 -13.384 11.805 6.089 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.881 11.598 5.079 1.00 0.00 H new ATOM 0 HB ILE A 8 -13.274 13.257 4.487 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -12.308 12.279 2.108 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -11.596 11.138 3.231 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -12.192 14.503 2.655 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -11.571 14.982 4.253 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -10.604 13.916 3.205 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -13.746 10.325 2.402 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.828 10.631 4.153 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -14.551 11.790 3.012 1.00 0.00 H new ATOM 134 N LYS A 9 -9.518 13.786 5.243 1.00 0.00 N ATOM 135 CA LYS A 9 -8.561 14.816 5.627 1.00 0.00 C ATOM 136 C LYS A 9 -7.907 15.386 4.379 1.00 0.00 C ATOM 137 O LYS A 9 -7.400 16.508 4.376 1.00 0.00 O ATOM 138 CB LYS A 9 -7.495 14.251 6.567 1.00 0.00 C ATOM 139 CG LYS A 9 -8.055 13.312 7.618 1.00 0.00 C ATOM 140 CD LYS A 9 -8.428 11.972 7.013 1.00 0.00 C ATOM 141 CE LYS A 9 -7.986 10.822 7.901 1.00 0.00 C ATOM 142 NZ LYS A 9 -6.647 11.068 8.503 1.00 0.00 N ATOM 0 H LYS A 9 -9.273 13.288 4.387 1.00 0.00 H new ATOM 0 HA LYS A 9 -9.092 15.607 6.157 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -6.746 13.721 5.978 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.984 15.076 7.063 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.318 13.165 8.408 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.933 13.762 8.081 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -9.507 11.926 6.865 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.967 11.873 6.030 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.719 10.673 8.694 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.958 9.902 7.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.212 10.160 8.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.041 11.557 7.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.752 11.659 9.352 1.00 0.00 H new ATOM 156 N ASN A 10 -7.941 14.593 3.315 1.00 0.00 N ATOM 157 CA ASN A 10 -7.374 14.986 2.035 1.00 0.00 C ATOM 158 C ASN A 10 -8.045 14.194 0.925 1.00 0.00 C ATOM 159 O ASN A 10 -8.719 13.200 1.191 1.00 0.00 O ATOM 160 CB ASN A 10 -5.864 14.742 2.017 1.00 0.00 C ATOM 161 CG ASN A 10 -5.216 15.228 0.736 1.00 0.00 C ATOM 162 OD1 ASN A 10 -5.651 16.215 0.142 1.00 0.00 O ATOM 163 ND2 ASN A 10 -4.170 14.535 0.301 1.00 0.00 N ATOM 0 H ASN A 10 -8.361 13.663 3.317 1.00 0.00 H new ATOM 0 HA ASN A 10 -7.548 16.051 1.880 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -5.407 15.248 2.867 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -5.669 13.676 2.138 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -3.694 14.815 -0.557 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -3.843 13.723 0.825 1.00 0.00 H new ATOM 170 N ALA A 11 -7.867 14.627 -0.316 1.00 0.00 N ATOM 171 CA ALA A 11 -8.471 13.930 -1.441 1.00 0.00 C ATOM 172 C ALA A 11 -8.421 14.760 -2.717 1.00 0.00 C ATOM 173 O ALA A 11 -8.854 15.912 -2.741 1.00 0.00 O ATOM 174 CB ALA A 11 -9.910 13.557 -1.118 1.00 0.00 C ATOM 0 H ALA A 11 -7.316 15.448 -0.567 1.00 0.00 H new ATOM 0 HA ALA A 11 -7.891 13.023 -1.613 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.350 13.036 -1.968 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -9.930 12.906 -0.244 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -10.482 14.461 -0.910 1.00 0.00 H new ATOM 180 N ASP A 12 -7.905 14.154 -3.779 1.00 0.00 N ATOM 181 CA ASP A 12 -7.813 14.816 -5.071 1.00 0.00 C ATOM 182 C ASP A 12 -8.637 14.057 -6.101 1.00 0.00 C ATOM 183 O ASP A 12 -8.353 14.097 -7.297 1.00 0.00 O ATOM 184 CB ASP A 12 -6.355 14.913 -5.524 1.00 0.00 C ATOM 185 CG ASP A 12 -5.651 16.123 -4.945 1.00 0.00 C ATOM 186 OD1 ASP A 12 -5.712 17.201 -5.573 1.00 0.00 O ATOM 187 OD2 ASP A 12 -5.043 15.995 -3.862 1.00 0.00 O ATOM 0 H ASP A 12 -7.543 13.201 -3.769 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.209 15.827 -4.975 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.824 14.009 -5.226 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -6.318 14.960 -6.612 1.00 0.00 H new ATOM 192 N MET A 13 -9.662 13.364 -5.614 1.00 0.00 N ATOM 193 CA MET A 13 -10.544 12.582 -6.470 1.00 0.00 C ATOM 194 C MET A 13 -11.917 13.236 -6.575 1.00 0.00 C ATOM 195 O MET A 13 -12.245 14.141 -5.808 1.00 0.00 O ATOM 196 CB MET A 13 -10.690 11.161 -5.920 1.00 0.00 C ATOM 197 CG MET A 13 -11.659 10.299 -6.712 1.00 0.00 C ATOM 198 SD MET A 13 -11.327 8.535 -6.541 1.00 0.00 S ATOM 199 CE MET A 13 -11.487 8.332 -4.769 1.00 0.00 C ATOM 0 H MET A 13 -9.902 13.329 -4.623 1.00 0.00 H new ATOM 0 HA MET A 13 -10.101 12.540 -7.465 1.00 0.00 H new ATOM 0 HB2 MET A 13 -9.712 10.681 -5.913 1.00 0.00 H new ATOM 0 HB3 MET A 13 -11.026 11.214 -4.885 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.677 10.506 -6.381 1.00 0.00 H new ATOM 0 HG3 MET A 13 -11.605 10.574 -7.765 1.00 0.00 H new ATOM 0 HE1 MET A 13 -10.512 8.101 -4.340 1.00 0.00 H new ATOM 0 HE2 MET A 13 -11.867 9.254 -4.330 1.00 0.00 H new ATOM 0 HE3 MET A 13 -12.179 7.517 -4.557 1.00 0.00 H new ATOM 209 N SER A 14 -12.717 12.771 -7.527 1.00 0.00 N ATOM 210 CA SER A 14 -14.056 13.310 -7.726 1.00 0.00 C ATOM 211 C SER A 14 -14.890 13.171 -6.456 1.00 0.00 C ATOM 212 O SER A 14 -14.971 12.091 -5.871 1.00 0.00 O ATOM 213 CB SER A 14 -14.749 12.598 -8.889 1.00 0.00 C ATOM 214 OG SER A 14 -16.075 12.234 -8.546 1.00 0.00 O ATOM 0 H SER A 14 -12.462 12.023 -8.172 1.00 0.00 H new ATOM 0 HA SER A 14 -13.964 14.370 -7.965 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.762 13.249 -9.763 1.00 0.00 H new ATOM 0 HB3 SER A 14 -14.183 11.708 -9.163 1.00 0.00 H new ATOM 0 HG SER A 14 -16.497 11.782 -9.306 1.00 0.00 H new ATOM 220 N GLU A 15 -15.506 14.270 -6.036 1.00 0.00 N ATOM 221 CA GLU A 15 -16.333 14.272 -4.836 1.00 0.00 C ATOM 222 C GLU A 15 -17.044 12.934 -4.662 1.00 0.00 C ATOM 223 O GLU A 15 -16.765 12.187 -3.723 1.00 0.00 O ATOM 224 CB GLU A 15 -17.359 15.404 -4.905 1.00 0.00 C ATOM 225 CG GLU A 15 -16.826 16.665 -5.566 1.00 0.00 C ATOM 226 CD GLU A 15 -17.910 17.461 -6.266 1.00 0.00 C ATOM 227 OE1 GLU A 15 -18.868 17.884 -5.585 1.00 0.00 O ATOM 228 OE2 GLU A 15 -17.800 17.664 -7.492 1.00 0.00 O ATOM 0 H GLU A 15 -15.448 15.172 -6.509 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.683 14.430 -3.975 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.234 15.057 -5.454 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -17.691 15.645 -3.895 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -16.350 17.292 -4.812 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -16.056 16.394 -6.288 1.00 0.00 H new ATOM 235 N GLU A 16 -17.962 12.636 -5.575 1.00 0.00 N ATOM 236 CA GLU A 16 -18.713 11.388 -5.527 1.00 0.00 C ATOM 237 C GLU A 16 -17.773 10.196 -5.375 1.00 0.00 C ATOM 238 O GLU A 16 -18.117 9.196 -4.743 1.00 0.00 O ATOM 239 CB GLU A 16 -19.555 11.229 -6.794 1.00 0.00 C ATOM 240 CG GLU A 16 -20.705 12.219 -6.888 1.00 0.00 C ATOM 241 CD GLU A 16 -22.033 11.608 -6.485 1.00 0.00 C ATOM 242 OE1 GLU A 16 -22.022 10.572 -5.787 1.00 0.00 O ATOM 243 OE2 GLU A 16 -23.084 12.165 -6.868 1.00 0.00 O ATOM 0 H GLU A 16 -18.204 13.243 -6.358 1.00 0.00 H new ATOM 0 HA GLU A 16 -19.374 11.421 -4.661 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -18.911 11.349 -7.665 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -19.955 10.216 -6.830 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.495 13.077 -6.249 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.776 12.592 -7.910 1.00 0.00 H new ATOM 250 N MET A 17 -16.585 10.311 -5.960 1.00 0.00 N ATOM 251 CA MET A 17 -15.591 9.244 -5.896 1.00 0.00 C ATOM 252 C MET A 17 -14.975 9.147 -4.502 1.00 0.00 C ATOM 253 O MET A 17 -14.636 8.059 -4.039 1.00 0.00 O ATOM 254 CB MET A 17 -14.495 9.480 -6.936 1.00 0.00 C ATOM 255 CG MET A 17 -14.905 9.097 -8.348 1.00 0.00 C ATOM 256 SD MET A 17 -15.258 7.336 -8.512 1.00 0.00 S ATOM 257 CE MET A 17 -13.924 6.635 -7.543 1.00 0.00 C ATOM 0 H MET A 17 -16.286 11.133 -6.485 1.00 0.00 H new ATOM 0 HA MET A 17 -16.094 8.302 -6.113 1.00 0.00 H new ATOM 0 HB2 MET A 17 -14.212 10.533 -6.921 1.00 0.00 H new ATOM 0 HB3 MET A 17 -13.610 8.908 -6.656 1.00 0.00 H new ATOM 0 HG2 MET A 17 -15.787 9.669 -8.634 1.00 0.00 H new ATOM 0 HG3 MET A 17 -14.109 9.371 -9.041 1.00 0.00 H new ATOM 0 HE1 MET A 17 -13.662 5.655 -7.941 1.00 0.00 H new ATOM 0 HE2 MET A 17 -13.055 7.291 -7.592 1.00 0.00 H new ATOM 0 HE3 MET A 17 -14.243 6.532 -6.506 1.00 0.00 H new ATOM 267 N GLN A 18 -14.834 10.290 -3.837 1.00 0.00 N ATOM 268 CA GLN A 18 -14.257 10.323 -2.496 1.00 0.00 C ATOM 269 C GLN A 18 -15.182 9.638 -1.496 1.00 0.00 C ATOM 270 O GLN A 18 -14.727 8.916 -0.609 1.00 0.00 O ATOM 271 CB GLN A 18 -13.988 11.765 -2.058 1.00 0.00 C ATOM 272 CG GLN A 18 -14.211 12.790 -3.156 1.00 0.00 C ATOM 273 CD GLN A 18 -12.997 13.666 -3.393 1.00 0.00 C ATOM 274 OE1 GLN A 18 -11.838 13.040 -3.556 1.00 0.00 O flip ATOM 275 NE2 GLN A 18 -13.100 14.893 -3.429 1.00 0.00 N flip ATOM 0 H GLN A 18 -15.110 11.202 -4.202 1.00 0.00 H new ATOM 0 HA GLN A 18 -13.310 9.784 -2.523 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -14.634 12.005 -1.213 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.960 11.842 -1.705 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -14.469 12.275 -4.081 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -15.062 13.419 -2.893 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -14.011 15.332 -3.299 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -12.274 15.470 -3.589 1.00 0.00 H new ATOM 284 N GLN A 19 -16.481 9.857 -1.656 1.00 0.00 N ATOM 285 CA GLN A 19 -17.469 9.248 -0.776 1.00 0.00 C ATOM 286 C GLN A 19 -17.614 7.774 -1.115 1.00 0.00 C ATOM 287 O GLN A 19 -17.823 6.937 -0.235 1.00 0.00 O ATOM 288 CB GLN A 19 -18.816 9.958 -0.911 1.00 0.00 C ATOM 289 CG GLN A 19 -19.064 10.992 0.174 1.00 0.00 C ATOM 290 CD GLN A 19 -20.099 12.023 -0.230 1.00 0.00 C ATOM 291 OE1 GLN A 19 -20.772 12.610 0.617 1.00 0.00 O ATOM 292 NE2 GLN A 19 -20.232 12.249 -1.531 1.00 0.00 N ATOM 0 H GLN A 19 -16.874 10.451 -2.386 1.00 0.00 H new ATOM 0 HA GLN A 19 -17.133 9.347 0.256 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -18.866 10.445 -1.885 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -19.614 9.216 -0.885 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -19.394 10.488 1.083 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -18.127 11.496 0.411 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -19.653 11.740 -2.199 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -20.913 12.932 -1.863 1.00 0.00 H new ATOM 301 N ASP A 20 -17.477 7.463 -2.399 1.00 0.00 N ATOM 302 CA ASP A 20 -17.571 6.090 -2.861 1.00 0.00 C ATOM 303 C ASP A 20 -16.331 5.315 -2.435 1.00 0.00 C ATOM 304 O ASP A 20 -16.394 4.116 -2.164 1.00 0.00 O ATOM 305 CB ASP A 20 -17.725 6.046 -4.381 1.00 0.00 C ATOM 306 CG ASP A 20 -19.152 5.761 -4.808 1.00 0.00 C ATOM 307 OD1 ASP A 20 -19.569 4.585 -4.740 1.00 0.00 O ATOM 308 OD2 ASP A 20 -19.853 6.713 -5.208 1.00 0.00 O ATOM 0 H ASP A 20 -17.301 8.146 -3.136 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.451 5.629 -2.413 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -17.405 6.998 -4.804 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -17.066 5.279 -4.788 1.00 0.00 H new ATOM 313 N SER A 21 -15.205 6.020 -2.365 1.00 0.00 N ATOM 314 CA SER A 21 -13.947 5.412 -1.956 1.00 0.00 C ATOM 315 C SER A 21 -14.012 5.006 -0.490 1.00 0.00 C ATOM 316 O SER A 21 -13.635 3.893 -0.124 1.00 0.00 O ATOM 317 CB SER A 21 -12.786 6.382 -2.184 1.00 0.00 C ATOM 318 OG SER A 21 -13.221 7.727 -2.101 1.00 0.00 O ATOM 0 H SER A 21 -15.140 7.013 -2.587 1.00 0.00 H new ATOM 0 HA SER A 21 -13.779 4.521 -2.561 1.00 0.00 H new ATOM 0 HB2 SER A 21 -12.007 6.202 -1.443 1.00 0.00 H new ATOM 0 HB3 SER A 21 -12.343 6.200 -3.163 1.00 0.00 H new ATOM 0 HG SER A 21 -13.684 7.869 -1.249 1.00 0.00 H new ATOM 324 N VAL A 22 -14.506 5.916 0.344 1.00 0.00 N ATOM 325 CA VAL A 22 -14.633 5.649 1.769 1.00 0.00 C ATOM 326 C VAL A 22 -15.537 4.447 2.009 1.00 0.00 C ATOM 327 O VAL A 22 -15.217 3.564 2.804 1.00 0.00 O ATOM 328 CB VAL A 22 -15.200 6.863 2.526 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.054 6.669 4.026 1.00 0.00 C ATOM 330 CG2 VAL A 22 -14.511 8.143 2.076 1.00 0.00 C ATOM 0 H VAL A 22 -14.824 6.842 0.057 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.632 5.439 2.146 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.262 6.950 2.295 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.460 7.537 4.546 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.598 5.775 4.332 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -13.999 6.556 4.277 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.925 8.990 2.622 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.442 8.070 2.275 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -14.672 8.286 1.008 1.00 0.00 H new ATOM 340 N GLU A 23 -16.667 4.414 1.306 1.00 0.00 N ATOM 341 CA GLU A 23 -17.611 3.312 1.435 1.00 0.00 C ATOM 342 C GLU A 23 -16.936 1.997 1.062 1.00 0.00 C ATOM 343 O GLU A 23 -17.189 0.960 1.676 1.00 0.00 O ATOM 344 CB GLU A 23 -18.834 3.552 0.547 1.00 0.00 C ATOM 345 CG GLU A 23 -19.579 4.837 0.874 1.00 0.00 C ATOM 346 CD GLU A 23 -20.850 4.999 0.063 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.800 4.219 0.288 1.00 0.00 O ATOM 348 OE2 GLU A 23 -20.895 5.904 -0.796 1.00 0.00 O ATOM 0 H GLU A 23 -16.949 5.137 0.644 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.942 3.254 2.472 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.516 3.581 -0.495 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.518 2.709 0.648 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.826 4.849 1.936 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -18.924 5.689 0.690 1.00 0.00 H new ATOM 355 N CYS A 24 -16.065 2.054 0.059 1.00 0.00 N ATOM 356 CA CYS A 24 -15.337 0.873 -0.389 1.00 0.00 C ATOM 357 C CYS A 24 -14.380 0.402 0.699 1.00 0.00 C ATOM 358 O CYS A 24 -14.250 -0.799 0.957 1.00 0.00 O ATOM 359 CB CYS A 24 -14.563 1.179 -1.673 1.00 0.00 C ATOM 360 SG CYS A 24 -13.372 -0.098 -2.138 1.00 0.00 S ATOM 0 H CYS A 24 -15.847 2.905 -0.458 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.055 0.080 -0.595 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -15.273 1.313 -2.489 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -14.036 2.125 -1.550 1.00 0.00 H new ATOM 0 HG CYS A 24 -13.626 -0.510 -3.344 1.00 0.00 H new ATOM 366 N ALA A 25 -13.736 1.359 1.361 1.00 0.00 N ATOM 367 CA ALA A 25 -12.819 1.044 2.441 1.00 0.00 C ATOM 368 C ALA A 25 -13.618 0.477 3.591 1.00 0.00 C ATOM 369 O ALA A 25 -13.105 -0.256 4.438 1.00 0.00 O ATOM 370 CB ALA A 25 -12.049 2.284 2.873 1.00 0.00 C ATOM 0 H ALA A 25 -13.835 2.355 1.166 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.087 0.310 2.105 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.368 2.025 3.683 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.478 2.671 2.029 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.749 3.046 3.217 1.00 0.00 H new ATOM 376 N THR A 26 -14.899 0.816 3.585 1.00 0.00 N ATOM 377 CA THR A 26 -15.827 0.348 4.590 1.00 0.00 C ATOM 378 C THR A 26 -16.243 -1.080 4.274 1.00 0.00 C ATOM 379 O THR A 26 -16.237 -1.950 5.145 1.00 0.00 O ATOM 380 CB THR A 26 -17.050 1.257 4.630 1.00 0.00 C ATOM 381 OG1 THR A 26 -16.677 2.610 4.440 1.00 0.00 O ATOM 382 CG2 THR A 26 -17.806 1.169 5.929 1.00 0.00 C ATOM 0 H THR A 26 -15.319 1.423 2.881 1.00 0.00 H new ATOM 0 HA THR A 26 -15.343 0.369 5.567 1.00 0.00 H new ATOM 0 HB THR A 26 -17.697 0.912 3.824 1.00 0.00 H new ATOM 0 HG1 THR A 26 -16.322 2.727 3.534 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.665 1.839 5.896 1.00 0.00 H new ATOM 0 HG22 THR A 26 -18.149 0.146 6.082 1.00 0.00 H new ATOM 0 HG23 THR A 26 -17.152 1.459 6.751 1.00 0.00 H new ATOM 390 N GLN A 27 -16.582 -1.318 3.009 1.00 0.00 N ATOM 391 CA GLN A 27 -16.975 -2.647 2.567 1.00 0.00 C ATOM 392 C GLN A 27 -15.967 -3.666 3.072 1.00 0.00 C ATOM 393 O GLN A 27 -16.333 -4.716 3.600 1.00 0.00 O ATOM 394 CB GLN A 27 -17.063 -2.701 1.040 1.00 0.00 C ATOM 395 CG GLN A 27 -18.277 -1.984 0.473 1.00 0.00 C ATOM 396 CD GLN A 27 -19.505 -2.872 0.414 1.00 0.00 C ATOM 397 OE1 GLN A 27 -20.373 -2.810 1.285 1.00 0.00 O ATOM 398 NE2 GLN A 27 -19.584 -3.704 -0.619 1.00 0.00 N ATOM 0 H GLN A 27 -16.591 -0.608 2.277 1.00 0.00 H new ATOM 0 HA GLN A 27 -17.959 -2.880 2.973 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -16.161 -2.259 0.617 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -17.087 -3.744 0.723 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -18.496 -1.109 1.084 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -18.046 -1.623 -0.529 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -18.841 -3.722 -1.318 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -20.388 -4.325 -0.713 1.00 0.00 H new ATOM 407 N ALA A 28 -14.689 -3.331 2.923 1.00 0.00 N ATOM 408 CA ALA A 28 -13.615 -4.201 3.381 1.00 0.00 C ATOM 409 C ALA A 28 -13.458 -4.089 4.892 1.00 0.00 C ATOM 410 O ALA A 28 -13.127 -5.058 5.573 1.00 0.00 O ATOM 411 CB ALA A 28 -12.310 -3.842 2.687 1.00 0.00 C ATOM 0 H ALA A 28 -14.374 -2.464 2.489 1.00 0.00 H new ATOM 0 HA ALA A 28 -13.869 -5.231 3.130 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.517 -4.501 3.040 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.427 -3.959 1.610 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -12.050 -2.808 2.913 1.00 0.00 H new ATOM 417 N LEU A 29 -13.705 -2.891 5.408 1.00 0.00 N ATOM 418 CA LEU A 29 -13.599 -2.637 6.836 1.00 0.00 C ATOM 419 C LEU A 29 -14.621 -3.458 7.616 1.00 0.00 C ATOM 420 O LEU A 29 -14.439 -3.730 8.802 1.00 0.00 O ATOM 421 CB LEU A 29 -13.796 -1.152 7.121 1.00 0.00 C ATOM 422 CG LEU A 29 -12.520 -0.319 7.043 1.00 0.00 C ATOM 423 CD1 LEU A 29 -12.846 1.113 6.672 1.00 0.00 C ATOM 424 CD2 LEU A 29 -11.770 -0.371 8.363 1.00 0.00 C ATOM 0 H LEU A 29 -13.981 -2.079 4.855 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.602 -2.935 7.160 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -14.520 -0.752 6.412 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -14.228 -1.040 8.115 1.00 0.00 H new ATOM 0 HG LEU A 29 -11.879 -0.739 6.267 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -11.925 1.694 6.620 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -13.343 1.133 5.702 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -13.505 1.543 7.426 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.863 0.228 8.290 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -12.403 0.025 9.157 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.505 -1.404 8.591 1.00 0.00 H new ATOM 436 N GLU A 30 -15.701 -3.841 6.942 1.00 0.00 N ATOM 437 CA GLU A 30 -16.759 -4.622 7.569 1.00 0.00 C ATOM 438 C GLU A 30 -16.632 -6.107 7.237 1.00 0.00 C ATOM 439 O GLU A 30 -17.049 -6.962 8.020 1.00 0.00 O ATOM 440 CB GLU A 30 -18.126 -4.101 7.124 1.00 0.00 C ATOM 441 CG GLU A 30 -18.889 -3.391 8.227 1.00 0.00 C ATOM 442 CD GLU A 30 -19.721 -4.343 9.066 1.00 0.00 C ATOM 443 OE1 GLU A 30 -20.507 -5.117 8.481 1.00 0.00 O ATOM 444 OE2 GLU A 30 -19.585 -4.312 10.306 1.00 0.00 O ATOM 0 H GLU A 30 -15.866 -3.622 5.959 1.00 0.00 H new ATOM 0 HA GLU A 30 -16.662 -4.512 8.649 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -17.991 -3.416 6.287 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -18.724 -4.936 6.759 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -18.184 -2.866 8.871 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -19.541 -2.637 7.786 1.00 0.00 H new ATOM 451 N LYS A 31 -16.061 -6.412 6.074 1.00 0.00 N ATOM 452 CA LYS A 31 -15.893 -7.799 5.651 1.00 0.00 C ATOM 453 C LYS A 31 -14.616 -8.400 6.233 1.00 0.00 C ATOM 454 O LYS A 31 -14.525 -9.611 6.434 1.00 0.00 O ATOM 455 CB LYS A 31 -15.865 -7.895 4.125 1.00 0.00 C ATOM 456 CG LYS A 31 -17.179 -7.505 3.466 1.00 0.00 C ATOM 457 CD LYS A 31 -18.349 -8.275 4.059 1.00 0.00 C ATOM 458 CE LYS A 31 -19.680 -7.718 3.582 1.00 0.00 C ATOM 459 NZ LYS A 31 -19.770 -7.694 2.096 1.00 0.00 N ATOM 0 H LYS A 31 -15.709 -5.721 5.411 1.00 0.00 H new ATOM 0 HA LYS A 31 -16.744 -8.367 6.027 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -15.072 -7.252 3.743 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -15.613 -8.916 3.838 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -17.346 -6.435 3.590 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -17.121 -7.697 2.395 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -18.273 -9.326 3.781 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -18.303 -8.229 5.147 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -20.492 -8.323 3.985 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -19.811 -6.708 3.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -20.748 -7.487 1.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -19.137 -6.958 1.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -19.487 -8.620 1.716 1.00 0.00 H new ATOM 473 N TYR A 32 -13.633 -7.547 6.504 1.00 0.00 N ATOM 474 CA TYR A 32 -12.364 -7.999 7.065 1.00 0.00 C ATOM 475 C TYR A 32 -11.783 -6.951 8.009 1.00 0.00 C ATOM 476 O TYR A 32 -12.165 -5.782 7.964 1.00 0.00 O ATOM 477 CB TYR A 32 -11.362 -8.306 5.950 1.00 0.00 C ATOM 478 CG TYR A 32 -11.991 -8.428 4.580 1.00 0.00 C ATOM 479 CD1 TYR A 32 -12.657 -7.355 4.003 1.00 0.00 C ATOM 480 CD2 TYR A 32 -11.916 -9.615 3.864 1.00 0.00 C ATOM 481 CE1 TYR A 32 -13.231 -7.460 2.751 1.00 0.00 C ATOM 482 CE2 TYR A 32 -12.485 -9.729 2.611 1.00 0.00 C ATOM 483 CZ TYR A 32 -13.142 -8.649 2.059 1.00 0.00 C ATOM 484 OH TYR A 32 -13.711 -8.757 0.811 1.00 0.00 O ATOM 0 H TYR A 32 -13.690 -6.541 6.345 1.00 0.00 H new ATOM 0 HA TYR A 32 -12.554 -8.911 7.631 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -10.608 -7.519 5.925 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -10.844 -9.236 6.186 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -12.727 -6.422 4.542 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -11.404 -10.463 4.294 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -13.746 -6.616 2.317 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -12.416 -10.659 2.066 1.00 0.00 H new ATOM 0 HH TYR A 32 -13.558 -9.659 0.459 1.00 0.00 H new ATOM 494 N ASN A 33 -10.859 -7.380 8.862 1.00 0.00 N ATOM 495 CA ASN A 33 -10.225 -6.478 9.818 1.00 0.00 C ATOM 496 C ASN A 33 -8.706 -6.543 9.703 1.00 0.00 C ATOM 497 O ASN A 33 -7.993 -6.450 10.703 1.00 0.00 O ATOM 498 CB ASN A 33 -10.656 -6.828 11.243 1.00 0.00 C ATOM 499 CG ASN A 33 -10.655 -5.620 12.159 1.00 0.00 C ATOM 500 OD1 ASN A 33 -10.563 -4.481 11.704 1.00 0.00 O ATOM 501 ND2 ASN A 33 -10.759 -5.865 13.460 1.00 0.00 N ATOM 0 H ASN A 33 -10.532 -8.345 8.911 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.545 -5.462 9.588 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -11.655 -7.263 11.221 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -9.986 -7.587 11.646 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -10.765 -5.092 14.126 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -10.833 -6.826 13.794 1.00 0.00 H new ATOM 508 N ILE A 34 -8.216 -6.700 8.478 1.00 0.00 N ATOM 509 CA ILE A 34 -6.781 -6.774 8.231 1.00 0.00 C ATOM 510 C ILE A 34 -6.334 -5.657 7.299 1.00 0.00 C ATOM 511 O ILE A 34 -6.458 -5.772 6.079 1.00 0.00 O ATOM 512 CB ILE A 34 -6.384 -8.130 7.618 1.00 0.00 C ATOM 513 CG1 ILE A 34 -7.268 -9.246 8.176 1.00 0.00 C ATOM 514 CG2 ILE A 34 -4.914 -8.423 7.884 1.00 0.00 C ATOM 515 CD1 ILE A 34 -6.996 -9.561 9.629 1.00 0.00 C ATOM 0 H ILE A 34 -8.792 -6.779 7.640 1.00 0.00 H new ATOM 0 HA ILE A 34 -6.285 -6.664 9.195 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.533 -8.082 6.539 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.314 -8.960 8.064 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.119 -10.148 7.583 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.649 -9.385 7.444 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.301 -7.640 7.439 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.738 -8.455 8.959 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.659 -10.361 9.958 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -5.959 -9.877 9.745 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.173 -8.672 10.234 1.00 0.00 H new ATOM 527 N GLU A 35 -5.819 -4.577 7.886 1.00 0.00 N ATOM 528 CA GLU A 35 -5.349 -3.424 7.121 1.00 0.00 C ATOM 529 C GLU A 35 -5.009 -3.815 5.687 1.00 0.00 C ATOM 530 O GLU A 35 -5.740 -3.486 4.754 1.00 0.00 O ATOM 531 CB GLU A 35 -4.126 -2.808 7.799 1.00 0.00 C ATOM 532 CG GLU A 35 -4.171 -2.879 9.316 1.00 0.00 C ATOM 533 CD GLU A 35 -3.594 -4.173 9.857 1.00 0.00 C ATOM 534 OE1 GLU A 35 -2.525 -4.595 9.368 1.00 0.00 O ATOM 535 OE2 GLU A 35 -4.212 -4.763 10.768 1.00 0.00 O ATOM 0 H GLU A 35 -5.717 -4.477 8.896 1.00 0.00 H new ATOM 0 HA GLU A 35 -6.153 -2.688 7.090 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -3.230 -3.318 7.446 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -4.039 -1.765 7.495 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -3.618 -2.037 9.732 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -5.204 -2.778 9.650 1.00 0.00 H new ATOM 542 N LYS A 36 -3.901 -4.527 5.518 1.00 0.00 N ATOM 543 CA LYS A 36 -3.476 -4.967 4.195 1.00 0.00 C ATOM 544 C LYS A 36 -4.644 -5.591 3.439 1.00 0.00 C ATOM 545 O LYS A 36 -4.928 -5.219 2.300 1.00 0.00 O ATOM 546 CB LYS A 36 -2.328 -5.973 4.307 1.00 0.00 C ATOM 547 CG LYS A 36 -1.795 -6.140 5.722 1.00 0.00 C ATOM 548 CD LYS A 36 -2.422 -7.338 6.416 1.00 0.00 C ATOM 549 CE LYS A 36 -1.980 -8.647 5.781 1.00 0.00 C ATOM 550 NZ LYS A 36 -2.372 -8.730 4.347 1.00 0.00 N ATOM 0 H LYS A 36 -3.283 -4.811 6.278 1.00 0.00 H new ATOM 0 HA LYS A 36 -3.126 -4.095 3.642 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.669 -6.941 3.940 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.513 -5.654 3.657 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -0.712 -6.261 5.692 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.999 -5.237 6.298 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.147 -7.333 7.471 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -3.508 -7.259 6.370 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.898 -8.745 5.868 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.420 -9.482 6.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.418 -9.728 4.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.304 -8.288 4.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.668 -8.232 3.765 1.00 0.00 H new ATOM 564 N ASP A 37 -5.323 -6.536 4.082 1.00 0.00 N ATOM 565 CA ASP A 37 -6.465 -7.204 3.471 1.00 0.00 C ATOM 566 C ASP A 37 -7.493 -6.182 3.001 1.00 0.00 C ATOM 567 O ASP A 37 -7.778 -6.074 1.809 1.00 0.00 O ATOM 568 CB ASP A 37 -7.109 -8.173 4.465 1.00 0.00 C ATOM 569 CG ASP A 37 -7.668 -9.407 3.786 1.00 0.00 C ATOM 570 OD1 ASP A 37 -7.027 -9.902 2.834 1.00 0.00 O ATOM 571 OD2 ASP A 37 -8.746 -9.879 4.204 1.00 0.00 O ATOM 0 H ASP A 37 -5.102 -6.856 5.025 1.00 0.00 H new ATOM 0 HA ASP A 37 -6.111 -7.767 2.607 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.369 -8.473 5.207 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -7.909 -7.662 5.001 1.00 0.00 H new ATOM 576 N ILE A 38 -8.041 -5.427 3.948 1.00 0.00 N ATOM 577 CA ILE A 38 -9.032 -4.409 3.631 1.00 0.00 C ATOM 578 C ILE A 38 -8.618 -3.613 2.398 1.00 0.00 C ATOM 579 O ILE A 38 -9.438 -3.330 1.526 1.00 0.00 O ATOM 580 CB ILE A 38 -9.237 -3.437 4.810 1.00 0.00 C ATOM 581 CG1 ILE A 38 -9.433 -4.214 6.114 1.00 0.00 C ATOM 582 CG2 ILE A 38 -10.425 -2.523 4.547 1.00 0.00 C ATOM 583 CD1 ILE A 38 -8.839 -3.528 7.325 1.00 0.00 C ATOM 0 H ILE A 38 -7.815 -5.502 4.940 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.970 -4.928 3.432 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.345 -2.819 4.908 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.500 -4.365 6.280 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -8.983 -5.201 6.010 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.555 -1.844 5.389 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.246 -1.946 3.640 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.326 -3.124 4.423 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -9.017 -4.137 8.212 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -7.766 -3.401 7.181 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -9.306 -2.552 7.456 1.00 0.00 H new ATOM 595 N ALA A 39 -7.338 -3.260 2.334 1.00 0.00 N ATOM 596 CA ALA A 39 -6.812 -2.499 1.207 1.00 0.00 C ATOM 597 C ALA A 39 -6.876 -3.316 -0.078 1.00 0.00 C ATOM 598 O ALA A 39 -7.465 -2.885 -1.070 1.00 0.00 O ATOM 599 CB ALA A 39 -5.384 -2.060 1.488 1.00 0.00 C ATOM 0 H ALA A 39 -6.647 -3.489 3.049 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.431 -1.612 1.075 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.004 -1.493 0.638 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.365 -1.434 2.380 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.758 -2.938 1.647 1.00 0.00 H new ATOM 605 N ALA A 40 -6.271 -4.499 -0.056 1.00 0.00 N ATOM 606 CA ALA A 40 -6.267 -5.372 -1.223 1.00 0.00 C ATOM 607 C ALA A 40 -7.616 -5.330 -1.933 1.00 0.00 C ATOM 608 O ALA A 40 -7.688 -5.113 -3.141 1.00 0.00 O ATOM 609 CB ALA A 40 -5.926 -6.798 -0.815 1.00 0.00 C ATOM 0 H ALA A 40 -5.779 -4.874 0.755 1.00 0.00 H new ATOM 0 HA ALA A 40 -5.505 -5.015 -1.916 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.927 -7.439 -1.697 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -4.939 -6.818 -0.353 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.668 -7.160 -0.103 1.00 0.00 H new ATOM 615 N HIS A 41 -8.682 -5.537 -1.168 1.00 0.00 N ATOM 616 CA HIS A 41 -10.034 -5.521 -1.716 1.00 0.00 C ATOM 617 C HIS A 41 -10.393 -4.134 -2.237 1.00 0.00 C ATOM 618 O HIS A 41 -10.775 -3.975 -3.396 1.00 0.00 O ATOM 619 CB HIS A 41 -11.043 -5.957 -0.651 1.00 0.00 C ATOM 620 CG HIS A 41 -10.423 -6.699 0.491 1.00 0.00 C ATOM 621 ND1 HIS A 41 -10.789 -6.502 1.806 1.00 0.00 N ATOM 622 CD2 HIS A 41 -9.454 -7.642 0.510 1.00 0.00 C ATOM 623 CE1 HIS A 41 -10.070 -7.292 2.584 1.00 0.00 C ATOM 624 NE2 HIS A 41 -9.252 -7.994 1.822 1.00 0.00 N ATOM 0 H HIS A 41 -8.636 -5.718 -0.165 1.00 0.00 H new ATOM 0 HA HIS A 41 -10.071 -6.222 -2.550 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -11.556 -5.076 -0.266 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -11.800 -6.589 -1.116 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -11.503 -5.849 2.128 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -8.935 -8.044 -0.348 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -10.140 -7.353 3.660 1.00 0.00 H new ATOM 633 N ILE A 42 -10.266 -3.132 -1.374 1.00 0.00 N ATOM 634 CA ILE A 42 -10.575 -1.758 -1.750 1.00 0.00 C ATOM 635 C ILE A 42 -9.968 -1.410 -3.104 1.00 0.00 C ATOM 636 O ILE A 42 -10.675 -1.000 -4.026 1.00 0.00 O ATOM 637 CB ILE A 42 -10.057 -0.758 -0.701 1.00 0.00 C ATOM 638 CG1 ILE A 42 -10.688 -1.040 0.664 1.00 0.00 C ATOM 639 CG2 ILE A 42 -10.350 0.667 -1.142 1.00 0.00 C ATOM 640 CD1 ILE A 42 -10.069 -0.243 1.791 1.00 0.00 C ATOM 0 H ILE A 42 -9.952 -3.246 -0.410 1.00 0.00 H new ATOM 0 HA ILE A 42 -11.661 -1.684 -1.809 1.00 0.00 H new ATOM 0 HB ILE A 42 -8.977 -0.876 -0.610 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.754 -0.818 0.615 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -10.593 -2.103 0.887 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -9.978 1.364 -0.391 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -9.856 0.862 -2.094 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.426 0.798 -1.258 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.565 -0.493 2.729 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -9.008 -0.483 1.866 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -10.187 0.822 1.591 1.00 0.00 H new ATOM 652 N LYS A 43 -8.654 -1.575 -3.216 1.00 0.00 N ATOM 653 CA LYS A 43 -7.949 -1.278 -4.458 1.00 0.00 C ATOM 654 C LYS A 43 -8.487 -2.125 -5.607 1.00 0.00 C ATOM 655 O LYS A 43 -9.154 -1.616 -6.508 1.00 0.00 O ATOM 656 CB LYS A 43 -6.447 -1.522 -4.286 1.00 0.00 C ATOM 657 CG LYS A 43 -5.580 -0.587 -5.112 1.00 0.00 C ATOM 658 CD LYS A 43 -4.432 -1.331 -5.775 1.00 0.00 C ATOM 659 CE LYS A 43 -4.882 -2.035 -7.044 1.00 0.00 C ATOM 660 NZ LYS A 43 -4.277 -3.390 -7.171 1.00 0.00 N ATOM 0 H LYS A 43 -8.056 -1.913 -2.462 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.115 -0.228 -4.699 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.187 -1.409 -3.233 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.221 -2.552 -4.562 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -6.190 -0.103 -5.875 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.183 0.202 -4.473 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -3.631 -0.630 -6.011 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -4.021 -2.062 -5.079 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -5.969 -2.121 -7.046 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -4.608 -1.432 -7.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.661 -3.864 -8.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -3.245 -3.302 -7.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -4.503 -3.952 -6.325 1.00 0.00 H new ATOM 674 N LYS A 44 -8.192 -3.421 -5.567 1.00 0.00 N ATOM 675 CA LYS A 44 -8.646 -4.342 -6.604 1.00 0.00 C ATOM 676 C LYS A 44 -10.016 -3.934 -7.134 1.00 0.00 C ATOM 677 O LYS A 44 -10.180 -3.658 -8.322 1.00 0.00 O ATOM 678 CB LYS A 44 -8.702 -5.771 -6.059 1.00 0.00 C ATOM 679 CG LYS A 44 -8.764 -6.837 -7.142 1.00 0.00 C ATOM 680 CD LYS A 44 -10.145 -6.912 -7.774 1.00 0.00 C ATOM 681 CE LYS A 44 -10.917 -8.128 -7.287 1.00 0.00 C ATOM 682 NZ LYS A 44 -10.171 -9.393 -7.526 1.00 0.00 N ATOM 0 H LYS A 44 -7.641 -3.857 -4.828 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.932 -4.302 -7.427 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.824 -5.948 -5.437 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -9.575 -5.870 -5.414 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -8.023 -6.619 -7.911 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -8.505 -7.806 -6.715 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -10.704 -6.007 -7.537 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.048 -6.952 -8.859 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -11.123 -8.024 -6.222 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -11.880 -8.173 -7.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -10.845 -10.168 -7.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -9.559 -9.283 -8.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -9.586 -9.614 -6.695 1.00 0.00 H new ATOM 696 N GLU A 45 -10.996 -3.901 -6.241 1.00 0.00 N ATOM 697 CA GLU A 45 -12.357 -3.530 -6.610 1.00 0.00 C ATOM 698 C GLU A 45 -12.393 -2.138 -7.231 1.00 0.00 C ATOM 699 O GLU A 45 -13.021 -1.927 -8.269 1.00 0.00 O ATOM 700 CB GLU A 45 -13.269 -3.577 -5.384 1.00 0.00 C ATOM 701 CG GLU A 45 -14.389 -4.597 -5.499 1.00 0.00 C ATOM 702 CD GLU A 45 -14.400 -5.581 -4.347 1.00 0.00 C ATOM 703 OE1 GLU A 45 -13.310 -6.051 -3.957 1.00 0.00 O ATOM 704 OE2 GLU A 45 -15.497 -5.883 -3.833 1.00 0.00 O ATOM 0 H GLU A 45 -10.874 -4.127 -5.254 1.00 0.00 H new ATOM 0 HA GLU A 45 -12.715 -4.247 -7.349 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -12.669 -3.806 -4.503 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -13.703 -2.590 -5.226 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.346 -4.077 -5.538 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.284 -5.142 -6.437 1.00 0.00 H new ATOM 711 N PHE A 46 -11.717 -1.191 -6.590 1.00 0.00 N ATOM 712 CA PHE A 46 -11.674 0.181 -7.080 1.00 0.00 C ATOM 713 C PHE A 46 -11.071 0.238 -8.479 1.00 0.00 C ATOM 714 O PHE A 46 -11.249 1.218 -9.203 1.00 0.00 O ATOM 715 CB PHE A 46 -10.866 1.059 -6.125 1.00 0.00 C ATOM 716 CG PHE A 46 -11.640 2.227 -5.586 1.00 0.00 C ATOM 717 CD1 PHE A 46 -12.633 2.037 -4.638 1.00 0.00 C ATOM 718 CD2 PHE A 46 -11.375 3.513 -6.026 1.00 0.00 C ATOM 719 CE1 PHE A 46 -13.347 3.110 -4.139 1.00 0.00 C ATOM 720 CE2 PHE A 46 -12.086 4.590 -5.531 1.00 0.00 C ATOM 721 CZ PHE A 46 -13.073 4.388 -4.587 1.00 0.00 C ATOM 0 H PHE A 46 -11.192 -1.349 -5.730 1.00 0.00 H new ATOM 0 HA PHE A 46 -12.696 0.557 -7.130 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -10.516 0.450 -5.292 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -9.981 1.428 -6.644 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -12.851 1.040 -4.285 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -10.604 3.676 -6.764 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -14.118 2.950 -3.400 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -11.870 5.588 -5.882 1.00 0.00 H new ATOM 0 HZ PHE A 46 -13.630 5.228 -4.199 1.00 0.00 H new ATOM 731 N ASP A 47 -10.359 -0.818 -8.855 1.00 0.00 N ATOM 732 CA ASP A 47 -9.732 -0.889 -10.170 1.00 0.00 C ATOM 733 C ASP A 47 -10.698 -1.472 -11.195 1.00 0.00 C ATOM 734 O ASP A 47 -10.690 -1.084 -12.363 1.00 0.00 O ATOM 735 CB ASP A 47 -8.460 -1.735 -10.109 1.00 0.00 C ATOM 736 CG ASP A 47 -7.268 -0.949 -9.600 1.00 0.00 C ATOM 737 OD1 ASP A 47 -7.259 -0.594 -8.402 1.00 0.00 O ATOM 738 OD2 ASP A 47 -6.346 -0.684 -10.399 1.00 0.00 O ATOM 0 H ASP A 47 -10.201 -1.637 -8.268 1.00 0.00 H new ATOM 0 HA ASP A 47 -9.468 0.123 -10.477 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -8.629 -2.594 -9.460 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -8.238 -2.124 -11.102 1.00 0.00 H new ATOM 743 N LYS A 48 -11.533 -2.405 -10.746 1.00 0.00 N ATOM 744 CA LYS A 48 -12.510 -3.043 -11.619 1.00 0.00 C ATOM 745 C LYS A 48 -13.888 -2.415 -11.438 1.00 0.00 C ATOM 746 O LYS A 48 -14.878 -2.895 -11.990 1.00 0.00 O ATOM 747 CB LYS A 48 -12.581 -4.545 -11.331 1.00 0.00 C ATOM 748 CG LYS A 48 -11.964 -5.404 -12.421 1.00 0.00 C ATOM 749 CD LYS A 48 -12.690 -5.228 -13.745 1.00 0.00 C ATOM 750 CE LYS A 48 -13.998 -6.003 -13.772 1.00 0.00 C ATOM 751 NZ LYS A 48 -14.556 -6.099 -15.149 1.00 0.00 N ATOM 0 H LYS A 48 -11.551 -2.735 -9.781 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.192 -2.893 -12.651 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.074 -4.750 -10.388 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -13.624 -4.832 -11.201 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.913 -5.140 -12.543 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.997 -6.452 -12.123 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.890 -4.170 -13.914 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.049 -5.565 -14.560 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -13.835 -7.005 -13.375 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.723 -5.516 -13.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.447 -6.634 -15.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.735 -5.143 -15.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -13.875 -6.586 -15.766 1.00 0.00 H new ATOM 765 N LYS A 49 -13.945 -1.342 -10.657 1.00 0.00 N ATOM 766 CA LYS A 49 -15.201 -0.652 -10.399 1.00 0.00 C ATOM 767 C LYS A 49 -15.105 0.824 -10.777 1.00 0.00 C ATOM 768 O LYS A 49 -16.025 1.599 -10.519 1.00 0.00 O ATOM 769 CB LYS A 49 -15.582 -0.788 -8.923 1.00 0.00 C ATOM 770 CG LYS A 49 -17.069 -0.616 -8.658 1.00 0.00 C ATOM 771 CD LYS A 49 -17.327 -0.116 -7.245 1.00 0.00 C ATOM 772 CE LYS A 49 -18.724 0.468 -7.099 1.00 0.00 C ATOM 773 NZ LYS A 49 -19.384 0.681 -8.418 1.00 0.00 N ATOM 0 H LYS A 49 -13.135 -0.932 -10.192 1.00 0.00 H new ATOM 0 HA LYS A 49 -15.973 -1.113 -11.015 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.269 -1.769 -8.565 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.031 -0.047 -8.345 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -17.489 0.087 -9.377 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -17.579 -1.568 -8.808 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -17.201 -0.938 -6.540 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -16.587 0.642 -6.987 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -19.334 -0.201 -6.493 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -18.666 1.417 -6.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -20.333 1.080 -8.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -18.816 1.340 -8.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -19.464 -0.228 -8.917 1.00 0.00 H new ATOM 787 N TYR A 50 -13.988 1.208 -11.390 1.00 0.00 N ATOM 788 CA TYR A 50 -13.783 2.594 -11.797 1.00 0.00 C ATOM 789 C TYR A 50 -12.915 2.686 -13.051 1.00 0.00 C ATOM 790 O TYR A 50 -13.390 3.091 -14.112 1.00 0.00 O ATOM 791 CB TYR A 50 -13.144 3.391 -10.659 1.00 0.00 C ATOM 792 CG TYR A 50 -13.986 3.439 -9.404 1.00 0.00 C ATOM 793 CD1 TYR A 50 -15.048 4.327 -9.289 1.00 0.00 C ATOM 794 CD2 TYR A 50 -13.718 2.594 -8.333 1.00 0.00 C ATOM 795 CE1 TYR A 50 -15.819 4.374 -8.143 1.00 0.00 C ATOM 796 CE2 TYR A 50 -14.485 2.635 -7.184 1.00 0.00 C ATOM 797 CZ TYR A 50 -15.533 3.527 -7.093 1.00 0.00 C ATOM 798 OH TYR A 50 -16.297 3.571 -5.950 1.00 0.00 O ATOM 0 H TYR A 50 -13.215 0.582 -11.615 1.00 0.00 H new ATOM 0 HA TYR A 50 -14.759 3.019 -12.031 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -12.175 2.953 -10.420 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -12.958 4.409 -11.000 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -15.275 4.992 -10.109 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -12.898 1.895 -8.400 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -16.641 5.070 -8.070 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -14.265 1.971 -6.361 1.00 0.00 H new ATOM 0 HH TYR A 50 -15.718 3.476 -5.165 1.00 0.00 H new ATOM 808 N ASN A 51 -11.643 2.314 -12.921 1.00 0.00 N ATOM 809 CA ASN A 51 -10.707 2.363 -14.038 1.00 0.00 C ATOM 810 C ASN A 51 -9.269 2.345 -13.529 1.00 0.00 C ATOM 811 O ASN A 51 -8.794 3.327 -12.959 1.00 0.00 O ATOM 812 CB ASN A 51 -10.944 3.616 -14.885 1.00 0.00 C ATOM 813 CG ASN A 51 -11.834 3.344 -16.082 1.00 0.00 C ATOM 814 OD1 ASN A 51 -11.798 2.260 -16.663 1.00 0.00 O ATOM 815 ND2 ASN A 51 -12.642 4.330 -16.455 1.00 0.00 N ATOM 0 H ASN A 51 -11.238 1.974 -12.049 1.00 0.00 H new ATOM 0 HA ASN A 51 -10.873 1.483 -14.660 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -11.399 4.389 -14.266 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -9.986 4.005 -15.229 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -13.266 4.204 -17.252 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -12.639 5.213 -15.944 1.00 0.00 H new ATOM 822 N PRO A 52 -8.553 1.224 -13.725 1.00 0.00 N ATOM 823 CA PRO A 52 -7.167 1.089 -13.277 1.00 0.00 C ATOM 824 C PRO A 52 -6.329 2.335 -13.584 1.00 0.00 C ATOM 825 O PRO A 52 -6.658 3.090 -14.498 1.00 0.00 O ATOM 826 CB PRO A 52 -6.666 -0.106 -14.079 1.00 0.00 C ATOM 827 CG PRO A 52 -7.875 -0.951 -14.290 1.00 0.00 C ATOM 828 CD PRO A 52 -9.038 0.000 -14.397 1.00 0.00 C ATOM 0 HA PRO A 52 -7.092 0.962 -12.197 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.231 0.208 -15.028 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -5.892 -0.650 -13.538 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -7.778 -1.551 -15.195 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -8.014 -1.645 -13.461 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -9.304 0.192 -15.437 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -9.928 -0.399 -13.909 1.00 0.00 H new ATOM 836 N THR A 53 -5.242 2.558 -12.825 1.00 0.00 N ATOM 837 CA THR A 53 -4.832 1.674 -11.733 1.00 0.00 C ATOM 838 C THR A 53 -4.877 2.415 -10.401 1.00 0.00 C ATOM 839 O THR A 53 -4.383 3.537 -10.289 1.00 0.00 O ATOM 840 CB THR A 53 -3.423 1.130 -11.999 1.00 0.00 C ATOM 841 OG1 THR A 53 -3.475 0.014 -12.868 1.00 0.00 O ATOM 842 CG2 THR A 53 -2.691 0.698 -10.745 1.00 0.00 C ATOM 0 H THR A 53 -4.625 3.360 -12.956 1.00 0.00 H new ATOM 0 HA THR A 53 -5.527 0.836 -11.680 1.00 0.00 H new ATOM 0 HB THR A 53 -2.877 1.961 -12.446 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.567 -0.319 -13.028 1.00 0.00 H new ATOM 0 HG21 THR A 53 -1.702 0.325 -11.011 1.00 0.00 H new ATOM 0 HG22 THR A 53 -2.588 1.549 -10.072 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.255 -0.091 -10.248 1.00 0.00 H new ATOM 850 N TRP A 54 -5.478 1.785 -9.395 1.00 0.00 N ATOM 851 CA TRP A 54 -5.596 2.396 -8.077 1.00 0.00 C ATOM 852 C TRP A 54 -4.525 1.890 -7.116 1.00 0.00 C ATOM 853 O TRP A 54 -3.849 0.893 -7.375 1.00 0.00 O ATOM 854 CB TRP A 54 -6.976 2.117 -7.482 1.00 0.00 C ATOM 855 CG TRP A 54 -8.103 2.618 -8.329 1.00 0.00 C ATOM 856 CD1 TRP A 54 -8.596 2.040 -9.461 1.00 0.00 C ATOM 857 CD2 TRP A 54 -8.880 3.802 -8.110 1.00 0.00 C ATOM 858 NE1 TRP A 54 -9.630 2.792 -9.961 1.00 0.00 N ATOM 859 CE2 TRP A 54 -9.826 3.875 -9.148 1.00 0.00 C ATOM 860 CE3 TRP A 54 -8.869 4.804 -7.138 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -10.751 4.911 -9.241 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -9.788 5.833 -7.233 1.00 0.00 C ATOM 863 CH2 TRP A 54 -10.719 5.879 -8.276 1.00 0.00 C ATOM 0 H TRP A 54 -5.889 0.854 -9.468 1.00 0.00 H new ATOM 0 HA TRP A 54 -5.458 3.469 -8.209 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -7.090 1.043 -7.337 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -7.039 2.580 -6.497 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -8.227 1.125 -9.900 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -10.165 2.578 -10.802 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -8.156 4.776 -6.327 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -11.469 4.949 -10.047 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -9.787 6.615 -6.488 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -11.426 6.694 -8.320 1.00 0.00 H new ATOM 874 N HIS A 55 -4.398 2.591 -5.996 1.00 0.00 N ATOM 875 CA HIS A 55 -3.437 2.247 -4.953 1.00 0.00 C ATOM 876 C HIS A 55 -3.890 2.858 -3.631 1.00 0.00 C ATOM 877 O HIS A 55 -3.864 4.078 -3.463 1.00 0.00 O ATOM 878 CB HIS A 55 -2.038 2.751 -5.318 1.00 0.00 C ATOM 879 CG HIS A 55 -1.851 2.993 -6.783 1.00 0.00 C ATOM 880 ND1 HIS A 55 -0.891 2.349 -7.537 1.00 0.00 N ATOM 881 CD2 HIS A 55 -2.508 3.814 -7.638 1.00 0.00 C ATOM 882 CE1 HIS A 55 -0.966 2.763 -8.789 1.00 0.00 C ATOM 883 NE2 HIS A 55 -1.938 3.650 -8.876 1.00 0.00 N ATOM 0 H HIS A 55 -4.959 3.416 -5.784 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.390 1.162 -4.856 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -1.842 3.677 -4.778 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.300 2.023 -4.981 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -0.227 1.661 -7.183 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -3.327 4.474 -7.392 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -0.338 2.432 -9.603 1.00 0.00 H new ATOM 892 N CYS A 56 -4.336 2.013 -2.706 1.00 0.00 N ATOM 893 CA CYS A 56 -4.826 2.496 -1.420 1.00 0.00 C ATOM 894 C CYS A 56 -4.059 1.900 -0.244 1.00 0.00 C ATOM 895 O CYS A 56 -3.543 0.784 -0.318 1.00 0.00 O ATOM 896 CB CYS A 56 -6.311 2.173 -1.274 1.00 0.00 C ATOM 897 SG CYS A 56 -6.740 0.464 -1.680 1.00 0.00 S ATOM 0 H CYS A 56 -4.368 1.000 -2.821 1.00 0.00 H new ATOM 0 HA CYS A 56 -4.671 3.575 -1.403 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -6.617 2.379 -0.248 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -6.882 2.842 -1.918 1.00 0.00 H new ATOM 0 HG CYS A 56 -6.810 -0.237 -0.587 1.00 0.00 H new ATOM 903 N ILE A 57 -4.013 2.657 0.849 1.00 0.00 N ATOM 904 CA ILE A 57 -3.339 2.223 2.068 1.00 0.00 C ATOM 905 C ILE A 57 -4.262 2.381 3.270 1.00 0.00 C ATOM 906 O ILE A 57 -4.506 3.496 3.732 1.00 0.00 O ATOM 907 CB ILE A 57 -2.049 3.025 2.332 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.127 2.998 1.107 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.334 2.483 3.563 1.00 0.00 C ATOM 910 CD1 ILE A 57 -0.928 1.620 0.513 1.00 0.00 C ATOM 0 H ILE A 57 -4.439 3.582 0.914 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.076 1.175 1.926 1.00 0.00 H new ATOM 0 HB ILE A 57 -2.321 4.064 2.520 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.538 3.656 0.341 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -0.155 3.404 1.388 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.425 3.058 3.738 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -1.989 2.566 4.430 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -1.076 1.436 3.402 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.264 1.688 -0.349 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.486 0.962 1.261 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.891 1.217 0.198 1.00 0.00 H new ATOM 922 N VAL A 58 -4.779 1.266 3.772 1.00 0.00 N ATOM 923 CA VAL A 58 -5.682 1.299 4.916 1.00 0.00 C ATOM 924 C VAL A 58 -4.986 0.853 6.195 1.00 0.00 C ATOM 925 O VAL A 58 -4.430 -0.242 6.263 1.00 0.00 O ATOM 926 CB VAL A 58 -6.918 0.414 4.686 1.00 0.00 C ATOM 927 CG1 VAL A 58 -6.499 -1.000 4.329 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.814 0.419 5.915 1.00 0.00 C ATOM 0 H VAL A 58 -4.590 0.332 3.407 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.999 2.336 5.026 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.486 0.822 3.850 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.386 -1.613 4.170 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.901 -0.983 3.418 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.909 -1.421 5.143 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.684 -0.213 5.734 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.259 0.036 6.771 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.142 1.438 6.122 1.00 0.00 H new ATOM 938 N GLY A 59 -5.029 1.712 7.207 1.00 0.00 N ATOM 939 CA GLY A 59 -4.408 1.401 8.479 1.00 0.00 C ATOM 940 C GLY A 59 -5.133 2.059 9.633 1.00 0.00 C ATOM 941 O GLY A 59 -6.357 1.974 9.734 1.00 0.00 O ATOM 0 H GLY A 59 -5.486 2.623 7.167 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.398 0.321 8.624 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -3.369 1.731 8.467 1.00 0.00 H new ATOM 945 N ARG A 60 -4.382 2.715 10.509 1.00 0.00 N ATOM 946 CA ARG A 60 -4.968 3.382 11.657 1.00 0.00 C ATOM 947 C ARG A 60 -4.031 4.442 12.225 1.00 0.00 C ATOM 948 O ARG A 60 -4.314 5.038 13.264 1.00 0.00 O ATOM 949 CB ARG A 60 -5.302 2.355 12.729 1.00 0.00 C ATOM 950 CG ARG A 60 -4.313 1.202 12.795 1.00 0.00 C ATOM 951 CD ARG A 60 -5.004 -0.101 13.166 1.00 0.00 C ATOM 952 NE ARG A 60 -4.325 -0.793 14.258 1.00 0.00 N ATOM 953 CZ ARG A 60 -4.927 -1.655 15.071 1.00 0.00 C ATOM 954 NH1 ARG A 60 -6.219 -1.917 14.921 1.00 0.00 N ATOM 955 NH2 ARG A 60 -4.243 -2.251 16.038 1.00 0.00 N ATOM 0 H ARG A 60 -3.367 2.797 10.444 1.00 0.00 H new ATOM 0 HA ARG A 60 -5.879 3.883 11.331 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -5.334 2.851 13.699 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -6.299 1.957 12.541 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -3.817 1.091 11.831 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.538 1.427 13.528 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.035 0.105 13.454 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.041 -0.752 12.293 1.00 0.00 H new ATOM 0 HE ARG A 60 -3.333 -0.604 14.405 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.750 -1.457 14.182 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -6.681 -2.579 15.545 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -3.251 -2.049 16.160 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -4.709 -2.912 16.660 1.00 0.00 H new ATOM 969 N ASN A 61 -2.914 4.674 11.543 1.00 0.00 N ATOM 970 CA ASN A 61 -1.943 5.667 11.991 1.00 0.00 C ATOM 971 C ASN A 61 -0.620 5.524 11.246 1.00 0.00 C ATOM 972 O ASN A 61 0.447 5.777 11.804 1.00 0.00 O ATOM 973 CB ASN A 61 -1.709 5.534 13.497 1.00 0.00 C ATOM 974 CG ASN A 61 -0.709 6.547 14.019 1.00 0.00 C ATOM 975 OD1 ASN A 61 -0.954 7.753 13.981 1.00 0.00 O ATOM 976 ND2 ASN A 61 0.427 6.062 14.506 1.00 0.00 N ATOM 0 H ASN A 61 -2.659 4.191 10.682 1.00 0.00 H new ATOM 0 HA ASN A 61 -2.350 6.655 11.774 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.656 5.659 14.021 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -1.352 4.528 13.719 1.00 0.00 H new ATOM 0 HD21 ASN A 61 1.139 6.697 14.868 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.588 5.055 14.518 1.00 0.00 H new ATOM 983 N PHE A 62 -0.695 5.120 9.981 1.00 0.00 N ATOM 984 CA PHE A 62 0.503 4.949 9.166 1.00 0.00 C ATOM 985 C PHE A 62 1.032 6.296 8.682 1.00 0.00 C ATOM 986 O PHE A 62 0.479 7.346 9.010 1.00 0.00 O ATOM 987 CB PHE A 62 0.209 4.041 7.969 1.00 0.00 C ATOM 988 CG PHE A 62 -0.863 4.571 7.061 1.00 0.00 C ATOM 989 CD1 PHE A 62 -0.558 5.482 6.063 1.00 0.00 C ATOM 990 CD2 PHE A 62 -2.177 4.156 7.205 1.00 0.00 C ATOM 991 CE1 PHE A 62 -1.543 5.970 5.226 1.00 0.00 C ATOM 992 CE2 PHE A 62 -3.167 4.640 6.372 1.00 0.00 C ATOM 993 CZ PHE A 62 -2.850 5.548 5.381 1.00 0.00 C ATOM 0 H PHE A 62 -1.569 4.906 9.500 1.00 0.00 H new ATOM 0 HA PHE A 62 1.268 4.482 9.786 1.00 0.00 H new ATOM 0 HB2 PHE A 62 1.125 3.904 7.394 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -0.089 3.058 8.334 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.462 5.815 5.938 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -2.430 3.445 7.978 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -1.292 6.680 4.452 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -4.187 4.309 6.496 1.00 0.00 H new ATOM 0 HZ PHE A 62 -3.622 5.928 4.728 1.00 0.00 H new ATOM 1003 N GLY A 63 2.106 6.257 7.899 1.00 0.00 N ATOM 1004 CA GLY A 63 2.696 7.479 7.380 1.00 0.00 C ATOM 1005 C GLY A 63 2.856 7.442 5.873 1.00 0.00 C ATOM 1006 O GLY A 63 3.957 7.232 5.363 1.00 0.00 O ATOM 0 H GLY A 63 2.579 5.400 7.614 1.00 0.00 H new ATOM 0 HA2 GLY A 63 2.071 8.328 7.657 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.670 7.636 7.843 1.00 0.00 H new ATOM 1010 N SER A 64 1.754 7.639 5.162 1.00 0.00 N ATOM 1011 CA SER A 64 1.767 7.622 3.703 1.00 0.00 C ATOM 1012 C SER A 64 2.493 8.839 3.140 1.00 0.00 C ATOM 1013 O SER A 64 2.530 9.898 3.766 1.00 0.00 O ATOM 1014 CB SER A 64 0.336 7.571 3.160 1.00 0.00 C ATOM 1015 OG SER A 64 -0.398 8.720 3.547 1.00 0.00 O ATOM 0 H SER A 64 0.836 7.813 5.572 1.00 0.00 H new ATOM 0 HA SER A 64 2.305 6.729 3.385 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.359 7.499 2.073 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.164 6.675 3.528 1.00 0.00 H new ATOM 0 HG SER A 64 -0.423 9.358 2.803 1.00 0.00 H new ATOM 1021 N TYR A 65 3.067 8.675 1.953 1.00 0.00 N ATOM 1022 CA TYR A 65 3.792 9.754 1.293 1.00 0.00 C ATOM 1023 C TYR A 65 4.005 9.433 -0.182 1.00 0.00 C ATOM 1024 O TYR A 65 5.136 9.404 -0.668 1.00 0.00 O ATOM 1025 CB TYR A 65 5.140 9.992 1.977 1.00 0.00 C ATOM 1026 CG TYR A 65 5.686 11.386 1.764 1.00 0.00 C ATOM 1027 CD1 TYR A 65 5.212 12.461 2.507 1.00 0.00 C ATOM 1028 CD2 TYR A 65 6.674 11.630 0.817 1.00 0.00 C ATOM 1029 CE1 TYR A 65 5.706 13.737 2.314 1.00 0.00 C ATOM 1030 CE2 TYR A 65 7.175 12.904 0.619 1.00 0.00 C ATOM 1031 CZ TYR A 65 6.687 13.952 1.370 1.00 0.00 C ATOM 1032 OH TYR A 65 7.183 15.221 1.175 1.00 0.00 O ATOM 0 H TYR A 65 3.044 7.802 1.427 1.00 0.00 H new ATOM 0 HA TYR A 65 3.194 10.662 1.370 1.00 0.00 H new ATOM 0 HB2 TYR A 65 5.033 9.812 3.047 1.00 0.00 H new ATOM 0 HB3 TYR A 65 5.862 9.266 1.602 1.00 0.00 H new ATOM 0 HD1 TYR A 65 4.444 12.296 3.248 1.00 0.00 H new ATOM 0 HD2 TYR A 65 7.057 10.811 0.226 1.00 0.00 H new ATOM 0 HE1 TYR A 65 5.326 14.561 2.899 1.00 0.00 H new ATOM 0 HE2 TYR A 65 7.944 13.077 -0.120 1.00 0.00 H new ATOM 0 HH TYR A 65 7.869 15.200 0.475 1.00 0.00 H new ATOM 1042 N VAL A 66 2.907 9.188 -0.889 1.00 0.00 N ATOM 1043 CA VAL A 66 2.967 8.866 -2.308 1.00 0.00 C ATOM 1044 C VAL A 66 3.113 10.128 -3.150 1.00 0.00 C ATOM 1045 O VAL A 66 3.506 11.180 -2.646 1.00 0.00 O ATOM 1046 CB VAL A 66 1.707 8.104 -2.764 1.00 0.00 C ATOM 1047 CG1 VAL A 66 1.733 6.671 -2.253 1.00 0.00 C ATOM 1048 CG2 VAL A 66 0.451 8.822 -2.296 1.00 0.00 C ATOM 0 H VAL A 66 1.964 9.207 -0.501 1.00 0.00 H new ATOM 0 HA VAL A 66 3.841 8.231 -2.452 1.00 0.00 H new ATOM 0 HB VAL A 66 1.697 8.075 -3.854 1.00 0.00 H new ATOM 0 HG11 VAL A 66 0.835 6.150 -2.585 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.614 6.161 -2.643 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.768 6.674 -1.164 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.429 8.270 -2.627 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.452 8.885 -1.208 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.428 9.827 -2.717 1.00 0.00 H new ATOM 1058 N THR A 67 2.793 10.015 -4.435 1.00 0.00 N ATOM 1059 CA THR A 67 2.891 11.148 -5.347 1.00 0.00 C ATOM 1060 C THR A 67 1.980 10.963 -6.558 1.00 0.00 C ATOM 1061 O THR A 67 2.352 10.305 -7.530 1.00 0.00 O ATOM 1062 CB THR A 67 4.337 11.329 -5.811 1.00 0.00 C ATOM 1063 OG1 THR A 67 5.242 10.961 -4.785 1.00 0.00 O ATOM 1064 CG2 THR A 67 4.662 12.748 -6.224 1.00 0.00 C ATOM 0 H THR A 67 2.464 9.152 -4.867 1.00 0.00 H new ATOM 0 HA THR A 67 2.569 12.040 -4.809 1.00 0.00 H new ATOM 0 HB THR A 67 4.443 10.683 -6.682 1.00 0.00 H new ATOM 0 HG1 THR A 67 6.161 11.027 -5.120 1.00 0.00 H new ATOM 0 HG21 THR A 67 5.703 12.805 -6.542 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.014 13.044 -7.049 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.503 13.418 -5.379 1.00 0.00 H new ATOM 1072 N HIS A 68 0.790 11.552 -6.495 1.00 0.00 N ATOM 1073 CA HIS A 68 -0.169 11.455 -7.590 1.00 0.00 C ATOM 1074 C HIS A 68 -1.404 12.305 -7.307 1.00 0.00 C ATOM 1075 O HIS A 68 -1.406 13.514 -7.545 1.00 0.00 O ATOM 1076 CB HIS A 68 -0.575 9.998 -7.818 1.00 0.00 C ATOM 1077 CG HIS A 68 -1.651 9.832 -8.845 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -2.999 9.910 -8.736 1.00 0.00 N flip ATOM 1079 CD2 HIS A 68 -1.392 9.547 -10.170 1.00 0.00 C flip ATOM 1080 CE1 HIS A 68 -3.523 9.676 -9.984 1.00 0.00 C flip ATOM 1081 NE2 HIS A 68 -2.534 9.460 -10.830 1.00 0.00 N flip ATOM 0 H HIS A 68 0.467 12.101 -5.698 1.00 0.00 H new ATOM 0 HA HIS A 68 0.310 11.833 -8.493 1.00 0.00 H new ATOM 0 HB2 HIS A 68 0.302 9.429 -8.127 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -0.916 9.572 -6.874 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.410 9.416 -10.600 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -4.574 9.670 -10.232 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -2.634 9.260 -11.825 1.00 0.00 H new ATOM 1090 N GLU A 69 -2.454 11.667 -6.800 1.00 0.00 N ATOM 1091 CA GLU A 69 -3.695 12.367 -6.488 1.00 0.00 C ATOM 1092 C GLU A 69 -4.074 13.333 -7.608 1.00 0.00 C ATOM 1093 O GLU A 69 -3.915 14.546 -7.474 1.00 0.00 O ATOM 1094 CB GLU A 69 -3.560 13.130 -5.169 1.00 0.00 C ATOM 1095 CG GLU A 69 -2.499 12.561 -4.244 1.00 0.00 C ATOM 1096 CD GLU A 69 -1.961 13.590 -3.270 1.00 0.00 C ATOM 1097 OE1 GLU A 69 -1.775 14.755 -3.680 1.00 0.00 O ATOM 1098 OE2 GLU A 69 -1.724 13.232 -2.098 1.00 0.00 O ATOM 0 H GLU A 69 -2.470 10.668 -6.597 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.485 11.622 -6.391 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -3.322 14.172 -5.384 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.521 13.122 -4.654 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -2.919 11.724 -3.687 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -1.677 12.166 -4.840 1.00 0.00 H new ATOM 1105 N THR A 70 -4.574 12.786 -8.710 1.00 0.00 N ATOM 1106 CA THR A 70 -4.975 13.599 -9.852 1.00 0.00 C ATOM 1107 C THR A 70 -6.490 13.768 -9.897 1.00 0.00 C ATOM 1108 O THR A 70 -6.996 14.833 -10.253 1.00 0.00 O ATOM 1109 CB THR A 70 -4.483 12.966 -11.156 1.00 0.00 C ATOM 1110 OG1 THR A 70 -3.131 12.561 -11.037 1.00 0.00 O ATOM 1111 CG2 THR A 70 -4.583 13.896 -12.345 1.00 0.00 C ATOM 0 H THR A 70 -4.711 11.783 -8.837 1.00 0.00 H new ATOM 0 HA THR A 70 -4.521 14.583 -9.740 1.00 0.00 H new ATOM 0 HB THR A 70 -5.136 12.111 -11.329 1.00 0.00 H new ATOM 0 HG1 THR A 70 -2.835 12.157 -11.880 1.00 0.00 H new ATOM 0 HG21 THR A 70 -4.219 13.387 -13.237 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.623 14.187 -12.493 1.00 0.00 H new ATOM 0 HG23 THR A 70 -3.980 14.785 -12.163 1.00 0.00 H new ATOM 1119 N LYS A 71 -7.212 12.712 -9.534 1.00 0.00 N ATOM 1120 CA LYS A 71 -8.670 12.745 -9.535 1.00 0.00 C ATOM 1121 C LYS A 71 -9.246 11.427 -9.023 1.00 0.00 C ATOM 1122 O LYS A 71 -10.442 11.169 -9.154 1.00 0.00 O ATOM 1123 CB LYS A 71 -9.192 13.030 -10.943 1.00 0.00 C ATOM 1124 CG LYS A 71 -8.766 11.992 -11.968 1.00 0.00 C ATOM 1125 CD LYS A 71 -9.465 12.203 -13.303 1.00 0.00 C ATOM 1126 CE LYS A 71 -8.938 13.438 -14.016 1.00 0.00 C ATOM 1127 NZ LYS A 71 -8.568 13.149 -15.429 1.00 0.00 N ATOM 0 H LYS A 71 -6.811 11.823 -9.235 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.991 13.544 -8.867 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -10.281 13.077 -10.916 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -8.838 14.011 -11.262 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -7.686 12.042 -12.110 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -8.992 10.994 -11.592 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -9.319 11.327 -13.934 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -10.538 12.304 -13.141 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -9.695 14.222 -13.992 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -8.067 13.820 -13.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.213 14.017 -15.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.827 12.420 -15.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.405 12.808 -15.944 1.00 0.00 H new ATOM 1141 N HIS A 72 -8.385 10.598 -8.441 1.00 0.00 N ATOM 1142 CA HIS A 72 -8.807 9.306 -7.911 1.00 0.00 C ATOM 1143 C HIS A 72 -8.170 9.044 -6.550 1.00 0.00 C ATOM 1144 O HIS A 72 -8.023 7.894 -6.133 1.00 0.00 O ATOM 1145 CB HIS A 72 -8.437 8.185 -8.884 1.00 0.00 C ATOM 1146 CG HIS A 72 -8.808 8.485 -10.303 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -10.114 8.537 -10.745 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -8.037 8.756 -11.383 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -10.130 8.826 -12.033 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -8.883 8.965 -12.445 1.00 0.00 N ATOM 0 H HIS A 72 -7.392 10.798 -8.324 1.00 0.00 H new ATOM 0 HA HIS A 72 -9.890 9.328 -7.789 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -7.364 8.004 -8.827 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -8.933 7.265 -8.573 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -6.958 8.800 -11.405 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -11.013 8.931 -12.646 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -8.595 9.191 -13.397 1.00 0.00 H new ATOM 1159 N PHE A 73 -7.793 10.116 -5.864 1.00 0.00 N ATOM 1160 CA PHE A 73 -7.172 10.003 -4.550 1.00 0.00 C ATOM 1161 C PHE A 73 -8.151 10.401 -3.451 1.00 0.00 C ATOM 1162 O PHE A 73 -9.218 10.950 -3.726 1.00 0.00 O ATOM 1163 CB PHE A 73 -5.923 10.883 -4.477 1.00 0.00 C ATOM 1164 CG PHE A 73 -5.422 11.092 -3.078 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -5.955 12.090 -2.278 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -4.418 10.289 -2.561 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -5.498 12.282 -0.989 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -3.956 10.477 -1.273 1.00 0.00 C ATOM 1169 CZ PHE A 73 -4.496 11.476 -0.486 1.00 0.00 C ATOM 0 H PHE A 73 -7.906 11.074 -6.196 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.886 8.962 -4.399 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.132 10.429 -5.074 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -6.144 11.852 -4.925 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -6.737 12.725 -2.667 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -3.992 9.507 -3.172 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -5.924 13.062 -0.375 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -3.174 9.844 -0.882 1.00 0.00 H new ATOM 0 HZ PHE A 73 -4.135 11.626 0.521 1.00 0.00 H new ATOM 1179 N ILE A 74 -7.782 10.122 -2.205 1.00 0.00 N ATOM 1180 CA ILE A 74 -8.630 10.451 -1.068 1.00 0.00 C ATOM 1181 C ILE A 74 -8.080 9.845 0.223 1.00 0.00 C ATOM 1182 O ILE A 74 -7.943 8.627 0.339 1.00 0.00 O ATOM 1183 CB ILE A 74 -10.079 9.963 -1.286 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -11.043 10.750 -0.382 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -10.176 8.460 -1.042 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -12.393 10.091 -0.170 1.00 0.00 C ATOM 0 H ILE A 74 -6.902 9.669 -1.959 1.00 0.00 H new ATOM 0 HA ILE A 74 -8.635 11.537 -0.978 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.368 10.146 -2.321 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.570 10.898 0.589 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -11.200 11.738 -0.814 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -11.203 8.131 -1.200 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.517 7.936 -1.734 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.877 8.238 -0.018 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -13.005 10.717 0.479 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -12.892 9.967 -1.131 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -12.252 9.115 0.294 1.00 0.00 H new ATOM 1198 N TYR A 75 -7.766 10.702 1.189 1.00 0.00 N ATOM 1199 CA TYR A 75 -7.233 10.250 2.468 1.00 0.00 C ATOM 1200 C TYR A 75 -8.187 10.598 3.606 1.00 0.00 C ATOM 1201 O TYR A 75 -8.373 11.769 3.940 1.00 0.00 O ATOM 1202 CB TYR A 75 -5.862 10.876 2.725 1.00 0.00 C ATOM 1203 CG TYR A 75 -5.078 10.201 3.829 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -5.197 8.834 4.060 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -4.219 10.930 4.641 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -4.482 8.217 5.067 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -3.500 10.318 5.649 1.00 0.00 C ATOM 1208 CZ TYR A 75 -3.634 8.962 5.859 1.00 0.00 C ATOM 1209 OH TYR A 75 -2.918 8.349 6.862 1.00 0.00 O ATOM 0 H TYR A 75 -7.872 11.713 1.110 1.00 0.00 H new ATOM 0 HA TYR A 75 -7.125 9.166 2.426 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -5.279 10.841 1.805 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -5.995 11.928 2.978 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -5.859 8.246 3.442 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.111 11.993 4.482 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -4.586 7.155 5.234 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -2.835 10.900 6.270 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.608 7.472 6.554 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.792 9.572 4.194 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.736 9.760 5.293 1.00 0.00 C ATOM 1221 C PHE A 76 -9.412 8.837 6.463 1.00 0.00 C ATOM 1222 O PHE A 76 -8.503 8.011 6.385 1.00 0.00 O ATOM 1223 CB PHE A 76 -11.162 9.494 4.815 1.00 0.00 C ATOM 1224 CG PHE A 76 -11.300 8.225 4.023 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -10.681 8.093 2.792 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -12.046 7.164 4.511 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -10.803 6.927 2.060 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -12.171 5.995 3.785 1.00 0.00 C ATOM 1229 CZ PHE A 76 -11.550 5.876 2.558 1.00 0.00 C ATOM 0 H PHE A 76 -8.646 8.598 3.928 1.00 0.00 H new ATOM 0 HA PHE A 76 -9.651 10.792 5.632 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.824 9.447 5.680 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.495 10.333 4.204 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.096 8.911 2.399 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -12.535 7.252 5.470 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.315 6.837 1.100 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.754 5.175 4.177 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.648 4.964 1.988 1.00 0.00 H new ATOM 1239 N TYR A 77 -10.171 8.983 7.545 1.00 0.00 N ATOM 1240 CA TYR A 77 -9.979 8.161 8.734 1.00 0.00 C ATOM 1241 C TYR A 77 -11.320 7.678 9.280 1.00 0.00 C ATOM 1242 O TYR A 77 -12.055 8.441 9.907 1.00 0.00 O ATOM 1243 CB TYR A 77 -9.235 8.950 9.814 1.00 0.00 C ATOM 1244 CG TYR A 77 -9.206 8.258 11.158 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -10.278 8.363 12.036 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -8.109 7.500 11.548 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -10.257 7.732 13.266 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -8.081 6.866 12.776 1.00 0.00 C ATOM 1249 CZ TYR A 77 -9.157 6.984 13.630 1.00 0.00 C ATOM 1250 OH TYR A 77 -9.132 6.354 14.853 1.00 0.00 O ATOM 0 H TYR A 77 -10.926 9.664 7.622 1.00 0.00 H new ATOM 0 HA TYR A 77 -9.383 7.293 8.452 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -8.211 9.126 9.483 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -9.706 9.927 9.928 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -11.141 8.947 11.753 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -7.265 7.405 10.881 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -11.097 7.824 13.938 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -7.220 6.281 13.065 1.00 0.00 H new ATOM 0 HH TYR A 77 -8.590 5.540 14.790 1.00 0.00 H new ATOM 1260 N LEU A 78 -11.632 6.409 9.039 1.00 0.00 N ATOM 1261 CA LEU A 78 -12.887 5.831 9.508 1.00 0.00 C ATOM 1262 C LEU A 78 -12.971 5.874 11.031 1.00 0.00 C ATOM 1263 O LEU A 78 -12.036 6.308 11.702 1.00 0.00 O ATOM 1264 CB LEU A 78 -13.030 4.388 9.019 1.00 0.00 C ATOM 1265 CG LEU A 78 -13.283 4.212 7.515 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -14.761 4.381 7.200 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -12.444 5.189 6.700 1.00 0.00 C ATOM 0 H LEU A 78 -11.035 5.762 8.523 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.703 6.426 9.098 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -12.122 3.844 9.281 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.850 3.920 9.563 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.984 3.201 7.238 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.922 4.253 6.130 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -15.337 3.634 7.745 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -15.085 5.378 7.499 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.643 5.042 5.638 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.701 6.211 6.980 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -11.387 5.014 6.898 1.00 0.00 H new ATOM 1279 N GLY A 79 -14.097 5.416 11.570 1.00 0.00 N ATOM 1280 CA GLY A 79 -14.281 5.409 13.009 1.00 0.00 C ATOM 1281 C GLY A 79 -12.980 5.202 13.758 1.00 0.00 C ATOM 1282 O GLY A 79 -12.726 5.857 14.769 1.00 0.00 O ATOM 0 H GLY A 79 -14.885 5.050 11.035 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -14.729 6.353 13.320 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.982 4.619 13.279 1.00 0.00 H new ATOM 1286 N GLN A 80 -12.156 4.288 13.261 1.00 0.00 N ATOM 1287 CA GLN A 80 -10.873 3.993 13.888 1.00 0.00 C ATOM 1288 C GLN A 80 -9.887 3.432 12.868 1.00 0.00 C ATOM 1289 O GLN A 80 -9.171 2.471 13.145 1.00 0.00 O ATOM 1290 CB GLN A 80 -11.061 2.998 15.035 1.00 0.00 C ATOM 1291 CG GLN A 80 -11.975 1.834 14.688 1.00 0.00 C ATOM 1292 CD GLN A 80 -13.236 1.812 15.529 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -13.799 2.858 15.851 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -13.686 0.616 15.889 1.00 0.00 N ATOM 0 H GLN A 80 -12.353 3.738 12.425 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.467 4.923 14.286 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -10.087 2.608 15.330 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -11.469 3.524 15.898 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -12.247 1.892 13.634 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -11.434 0.898 14.827 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -13.187 -0.225 15.599 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -14.531 0.538 16.455 1.00 0.00 H new ATOM 1303 N VAL A 81 -9.860 4.039 11.685 1.00 0.00 N ATOM 1304 CA VAL A 81 -8.966 3.598 10.621 1.00 0.00 C ATOM 1305 C VAL A 81 -8.649 4.741 9.660 1.00 0.00 C ATOM 1306 O VAL A 81 -9.304 5.783 9.681 1.00 0.00 O ATOM 1307 CB VAL A 81 -9.579 2.422 9.832 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -8.778 2.132 8.573 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -9.668 1.183 10.710 1.00 0.00 C ATOM 0 H VAL A 81 -10.447 4.837 11.440 1.00 0.00 H new ATOM 0 HA VAL A 81 -8.042 3.265 11.094 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.587 2.705 9.529 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -9.232 1.299 8.037 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -8.772 3.015 7.934 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.754 1.874 8.844 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -10.102 0.363 10.139 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.670 0.903 11.046 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -10.296 1.395 11.576 1.00 0.00 H new ATOM 1319 N ALA A 82 -7.642 4.534 8.817 1.00 0.00 N ATOM 1320 CA ALA A 82 -7.236 5.540 7.844 1.00 0.00 C ATOM 1321 C ALA A 82 -7.012 4.906 6.476 1.00 0.00 C ATOM 1322 O ALA A 82 -6.106 4.091 6.300 1.00 0.00 O ATOM 1323 CB ALA A 82 -5.975 6.249 8.311 1.00 0.00 C ATOM 0 H ALA A 82 -7.091 3.676 8.789 1.00 0.00 H new ATOM 0 HA ALA A 82 -8.037 6.274 7.755 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.684 6.997 7.574 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -6.165 6.736 9.267 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -5.171 5.522 8.427 1.00 0.00 H new ATOM 1329 N ILE A 83 -7.844 5.278 5.512 1.00 0.00 N ATOM 1330 CA ILE A 83 -7.737 4.737 4.164 1.00 0.00 C ATOM 1331 C ILE A 83 -7.148 5.759 3.199 1.00 0.00 C ATOM 1332 O ILE A 83 -7.704 6.840 3.003 1.00 0.00 O ATOM 1333 CB ILE A 83 -9.104 4.272 3.626 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -10.095 4.060 4.776 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.942 2.992 2.821 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.752 2.880 5.659 1.00 0.00 C ATOM 0 H ILE A 83 -8.600 5.951 5.638 1.00 0.00 H new ATOM 0 HA ILE A 83 -7.070 3.877 4.230 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.502 5.049 2.973 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -10.129 4.962 5.386 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -11.093 3.916 4.363 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.914 2.673 2.446 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.271 3.173 1.982 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.525 2.212 3.458 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.495 2.790 6.451 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.746 1.968 5.062 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.767 3.031 6.101 1.00 0.00 H new ATOM 1348 N LEU A 84 -6.020 5.403 2.594 1.00 0.00 N ATOM 1349 CA LEU A 84 -5.348 6.276 1.639 1.00 0.00 C ATOM 1350 C LEU A 84 -5.568 5.774 0.218 1.00 0.00 C ATOM 1351 O LEU A 84 -4.811 4.941 -0.280 1.00 0.00 O ATOM 1352 CB LEU A 84 -3.851 6.343 1.949 1.00 0.00 C ATOM 1353 CG LEU A 84 -2.961 6.727 0.767 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -2.606 8.203 0.830 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -1.701 5.874 0.751 1.00 0.00 C ATOM 0 H LEU A 84 -5.550 4.511 2.749 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.770 7.277 1.724 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.694 7.064 2.751 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.530 5.372 2.325 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.511 6.544 -0.156 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.972 8.461 -0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.518 8.798 0.796 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -2.073 8.410 1.758 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.079 6.160 -0.097 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.146 6.027 1.677 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.974 4.823 0.662 1.00 0.00 H new ATOM 1367 N LEU A 85 -6.615 6.274 -0.426 1.00 0.00 N ATOM 1368 CA LEU A 85 -6.942 5.862 -1.786 1.00 0.00 C ATOM 1369 C LEU A 85 -6.375 6.828 -2.820 1.00 0.00 C ATOM 1370 O LEU A 85 -6.605 8.036 -2.753 1.00 0.00 O ATOM 1371 CB LEU A 85 -8.457 5.755 -1.956 1.00 0.00 C ATOM 1372 CG LEU A 85 -8.954 4.391 -2.435 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -8.986 3.405 -1.279 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -10.329 4.517 -3.072 1.00 0.00 C ATOM 0 H LEU A 85 -7.252 6.965 -0.029 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.486 4.886 -1.951 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.933 5.985 -1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.783 6.515 -2.666 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.263 4.015 -3.189 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.342 2.438 -1.635 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.983 3.293 -0.868 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.657 3.775 -0.503 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.666 3.536 -3.407 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -11.034 4.913 -2.341 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -10.274 5.193 -3.926 1.00 0.00 H new ATOM 1386 N PHE A 86 -5.638 6.280 -3.779 1.00 0.00 N ATOM 1387 CA PHE A 86 -5.039 7.079 -4.842 1.00 0.00 C ATOM 1388 C PHE A 86 -4.727 6.212 -6.060 1.00 0.00 C ATOM 1389 O PHE A 86 -4.350 5.049 -5.923 1.00 0.00 O ATOM 1390 CB PHE A 86 -3.762 7.756 -4.340 1.00 0.00 C ATOM 1391 CG PHE A 86 -2.614 6.805 -4.165 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -1.795 6.487 -5.234 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -2.359 6.227 -2.931 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -0.740 5.610 -5.078 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -1.304 5.349 -2.770 1.00 0.00 C ATOM 1396 CZ PHE A 86 -0.494 5.040 -3.845 1.00 0.00 C ATOM 0 H PHE A 86 -5.440 5.281 -3.842 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.755 7.846 -5.138 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.473 8.537 -5.043 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -3.968 8.244 -3.388 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -1.983 6.930 -6.201 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -2.991 6.465 -2.088 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.108 5.370 -5.920 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -1.113 4.905 -1.804 1.00 0.00 H new ATOM 0 HZ PHE A 86 0.331 4.354 -3.721 1.00 0.00 H new ATOM 1406 N LYS A 87 -4.885 6.785 -7.251 1.00 0.00 N ATOM 1407 CA LYS A 87 -4.620 6.061 -8.490 1.00 0.00 C ATOM 1408 C LYS A 87 -3.308 6.520 -9.114 1.00 0.00 C ATOM 1409 O LYS A 87 -2.542 7.263 -8.502 1.00 0.00 O ATOM 1410 CB LYS A 87 -5.765 6.276 -9.483 1.00 0.00 C ATOM 1411 CG LYS A 87 -6.591 5.034 -9.751 1.00 0.00 C ATOM 1412 CD LYS A 87 -7.785 5.355 -10.633 1.00 0.00 C ATOM 1413 CE LYS A 87 -7.373 5.605 -12.078 1.00 0.00 C ATOM 1414 NZ LYS A 87 -5.894 5.607 -12.251 1.00 0.00 N ATOM 0 H LYS A 87 -5.195 7.748 -7.383 1.00 0.00 H new ATOM 0 HA LYS A 87 -4.543 5.000 -8.253 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -6.420 7.060 -9.102 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.352 6.635 -10.426 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.971 4.278 -10.233 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -6.935 4.611 -8.807 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -8.496 4.530 -10.596 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -8.297 6.235 -10.244 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.810 4.837 -12.716 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -7.777 6.562 -12.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -5.658 5.340 -13.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -5.523 6.558 -12.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -5.467 4.924 -11.593 1.00 0.00 H new ATOM 1428 N SER A 88 -3.064 6.078 -10.342 1.00 0.00 N ATOM 1429 CA SER A 88 -1.853 6.445 -11.064 1.00 0.00 C ATOM 1430 C SER A 88 -2.154 6.584 -12.546 1.00 0.00 C ATOM 1431 O SER A 88 -1.256 6.573 -13.388 1.00 0.00 O ATOM 1432 CB SER A 88 -0.760 5.403 -10.845 1.00 0.00 C ATOM 1433 OG SER A 88 0.386 5.984 -10.247 1.00 0.00 O ATOM 0 H SER A 88 -3.692 5.463 -10.860 1.00 0.00 H new ATOM 0 HA SER A 88 -1.498 7.402 -10.682 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.139 4.602 -10.210 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.487 4.952 -11.799 1.00 0.00 H new ATOM 0 HG SER A 88 1.168 5.823 -10.815 1.00 0.00 H new ATOM 1439 N GLY A 89 -3.434 6.714 -12.846 1.00 0.00 N ATOM 1440 CA GLY A 89 -3.874 6.856 -14.220 1.00 0.00 C ATOM 1441 C GLY A 89 -3.332 5.761 -15.120 1.00 0.00 C ATOM 1442 O GLY A 89 -3.495 5.872 -16.353 1.00 0.00 O ATOM 1443 OXT GLY A 89 -2.744 4.795 -14.590 1.00 0.00 O ATOM 0 H GLY A 89 -4.186 6.724 -12.156 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.963 6.842 -14.252 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -3.556 7.826 -14.602 1.00 0.00 H new TER 1447 GLY A 89 ATOM 1448 N MET B 1 25.667 -5.127 11.699 1.00 0.00 N ATOM 1449 CA MET B 1 24.553 -4.422 11.011 1.00 0.00 C ATOM 1450 C MET B 1 24.811 -4.313 9.512 1.00 0.00 C ATOM 1451 O MET B 1 25.638 -3.514 9.070 1.00 0.00 O ATOM 1452 CB MET B 1 24.406 -3.027 11.624 1.00 0.00 C ATOM 1453 CG MET B 1 22.986 -2.487 11.567 1.00 0.00 C ATOM 1454 SD MET B 1 22.871 -0.776 12.124 1.00 0.00 S ATOM 1455 CE MET B 1 21.119 -0.652 12.474 1.00 0.00 C ATOM 0 H1 MET B 1 25.464 -5.186 12.717 1.00 0.00 H new ATOM 0 H2 MET B 1 25.764 -6.086 11.309 1.00 0.00 H new ATOM 0 H3 MET B 1 26.553 -4.602 11.553 1.00 0.00 H new ATOM 0 HA MET B 1 23.633 -4.991 11.145 1.00 0.00 H new ATOM 0 HB2 MET B 1 24.733 -3.059 12.663 1.00 0.00 H new ATOM 0 HB3 MET B 1 25.070 -2.338 11.102 1.00 0.00 H new ATOM 0 HG2 MET B 1 22.615 -2.558 10.544 1.00 0.00 H new ATOM 0 HG3 MET B 1 22.339 -3.110 12.184 1.00 0.00 H new ATOM 0 HE1 MET B 1 20.938 0.200 13.129 1.00 0.00 H new ATOM 0 HE2 MET B 1 20.570 -0.516 11.542 1.00 0.00 H new ATOM 0 HE3 MET B 1 20.780 -1.565 12.964 1.00 0.00 H new ATOM 1467 N CYS B 2 24.098 -5.120 8.733 1.00 0.00 N ATOM 1468 CA CYS B 2 24.250 -5.112 7.282 1.00 0.00 C ATOM 1469 C CYS B 2 23.757 -3.794 6.694 1.00 0.00 C ATOM 1470 O CYS B 2 23.630 -3.654 5.478 1.00 0.00 O ATOM 1471 CB CYS B 2 23.480 -6.280 6.661 1.00 0.00 C ATOM 1472 SG CYS B 2 22.452 -7.194 7.835 1.00 0.00 S ATOM 0 H CYS B 2 23.410 -5.787 9.082 1.00 0.00 H new ATOM 0 HA CYS B 2 25.310 -5.221 7.051 1.00 0.00 H new ATOM 0 HB2 CYS B 2 22.847 -5.899 5.860 1.00 0.00 H new ATOM 0 HB3 CYS B 2 24.191 -6.968 6.205 1.00 0.00 H new ATOM 0 HG CYS B 2 21.840 -8.159 7.216 1.00 0.00 H new ATOM 1478 N ASP B 3 23.481 -2.830 7.566 1.00 0.00 N ATOM 1479 CA ASP B 3 23.000 -1.523 7.134 1.00 0.00 C ATOM 1480 C ASP B 3 21.663 -1.649 6.413 1.00 0.00 C ATOM 1481 O ASP B 3 21.157 -0.680 5.846 1.00 0.00 O ATOM 1482 CB ASP B 3 24.028 -0.858 6.215 1.00 0.00 C ATOM 1483 CG ASP B 3 23.860 0.647 6.156 1.00 0.00 C ATOM 1484 OD1 ASP B 3 22.787 1.109 5.714 1.00 0.00 O ATOM 1485 OD2 ASP B 3 24.802 1.366 6.550 1.00 0.00 O ATOM 0 H ASP B 3 23.582 -2.929 8.576 1.00 0.00 H new ATOM 0 HA ASP B 3 22.859 -0.903 8.019 1.00 0.00 H new ATOM 0 HB2 ASP B 3 25.032 -1.096 6.566 1.00 0.00 H new ATOM 0 HB3 ASP B 3 23.935 -1.271 5.211 1.00 0.00 H new ATOM 1490 N ARG B 4 21.094 -2.851 6.437 1.00 0.00 N ATOM 1491 CA ARG B 4 19.813 -3.105 5.786 1.00 0.00 C ATOM 1492 C ARG B 4 18.753 -3.497 6.810 1.00 0.00 C ATOM 1493 O ARG B 4 18.264 -4.626 6.812 1.00 0.00 O ATOM 1494 CB ARG B 4 19.960 -4.211 4.739 1.00 0.00 C ATOM 1495 CG ARG B 4 20.213 -3.688 3.334 1.00 0.00 C ATOM 1496 CD ARG B 4 21.665 -3.280 3.145 1.00 0.00 C ATOM 1497 NE ARG B 4 22.381 -4.199 2.264 1.00 0.00 N ATOM 1498 CZ ARG B 4 23.654 -4.042 1.916 1.00 0.00 C ATOM 1499 NH1 ARG B 4 24.346 -3.008 2.375 1.00 0.00 N ATOM 1500 NH2 ARG B 4 24.236 -4.919 1.109 1.00 0.00 N ATOM 0 H ARG B 4 21.500 -3.664 6.900 1.00 0.00 H new ATOM 0 HA ARG B 4 19.495 -2.187 5.292 1.00 0.00 H new ATOM 0 HB2 ARG B 4 20.782 -4.866 5.027 1.00 0.00 H new ATOM 0 HB3 ARG B 4 19.055 -4.818 4.734 1.00 0.00 H new ATOM 0 HG2 ARG B 4 19.952 -4.456 2.606 1.00 0.00 H new ATOM 0 HG3 ARG B 4 19.565 -2.833 3.141 1.00 0.00 H new ATOM 0 HD2 ARG B 4 21.708 -2.273 2.730 1.00 0.00 H new ATOM 0 HD3 ARG B 4 22.161 -3.247 4.115 1.00 0.00 H new ATOM 0 HE ARG B 4 21.876 -5.005 1.896 1.00 0.00 H new ATOM 0 HH11 ARG B 4 23.901 -2.332 2.996 1.00 0.00 H new ATOM 0 HH12 ARG B 4 25.323 -2.889 2.107 1.00 0.00 H new ATOM 0 HH21 ARG B 4 23.706 -5.715 0.754 1.00 0.00 H new ATOM 0 HH22 ARG B 4 25.213 -4.797 0.843 1.00 0.00 H new ATOM 1514 N LYS B 5 18.404 -2.555 7.680 1.00 0.00 N ATOM 1515 CA LYS B 5 17.403 -2.797 8.712 1.00 0.00 C ATOM 1516 C LYS B 5 15.992 -2.674 8.145 1.00 0.00 C ATOM 1517 O LYS B 5 15.601 -1.612 7.663 1.00 0.00 O ATOM 1518 CB LYS B 5 17.587 -1.813 9.868 1.00 0.00 C ATOM 1519 CG LYS B 5 17.930 -2.481 11.189 1.00 0.00 C ATOM 1520 CD LYS B 5 16.722 -2.551 12.107 1.00 0.00 C ATOM 1521 CE LYS B 5 16.935 -1.728 13.368 1.00 0.00 C ATOM 1522 NZ LYS B 5 15.766 -0.854 13.668 1.00 0.00 N ATOM 0 H LYS B 5 18.801 -1.615 7.691 1.00 0.00 H new ATOM 0 HA LYS B 5 17.538 -3.814 9.082 1.00 0.00 H new ATOM 0 HB2 LYS B 5 18.378 -1.108 9.611 1.00 0.00 H new ATOM 0 HB3 LYS B 5 16.671 -1.234 9.990 1.00 0.00 H new ATOM 0 HG2 LYS B 5 18.305 -3.487 11.003 1.00 0.00 H new ATOM 0 HG3 LYS B 5 18.730 -1.928 11.681 1.00 0.00 H new ATOM 0 HD2 LYS B 5 15.840 -2.188 11.579 1.00 0.00 H new ATOM 0 HD3 LYS B 5 16.528 -3.589 12.377 1.00 0.00 H new ATOM 0 HE2 LYS B 5 17.114 -2.396 14.211 1.00 0.00 H new ATOM 0 HE3 LYS B 5 17.828 -1.113 13.253 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 15.952 -0.310 14.535 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 15.610 -0.199 12.875 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 14.919 -1.442 13.803 1.00 0.00 H new ATOM 1536 N ALA B 6 15.235 -3.767 8.208 1.00 0.00 N ATOM 1537 CA ALA B 6 13.866 -3.786 7.702 1.00 0.00 C ATOM 1538 C ALA B 6 13.380 -5.215 7.486 1.00 0.00 C ATOM 1539 O ALA B 6 14.005 -6.170 7.945 1.00 0.00 O ATOM 1540 CB ALA B 6 13.770 -2.998 6.406 1.00 0.00 C ATOM 0 H ALA B 6 15.548 -4.653 8.606 1.00 0.00 H new ATOM 0 HA ALA B 6 13.225 -3.318 8.449 1.00 0.00 H new ATOM 0 HB1 ALA B 6 12.743 -3.021 6.041 1.00 0.00 H new ATOM 0 HB2 ALA B 6 14.068 -1.965 6.585 1.00 0.00 H new ATOM 0 HB3 ALA B 6 14.430 -3.442 5.661 1.00 0.00 H new ATOM 1546 N VAL B 7 12.260 -5.351 6.783 1.00 0.00 N ATOM 1547 CA VAL B 7 11.687 -6.661 6.504 1.00 0.00 C ATOM 1548 C VAL B 7 10.796 -6.621 5.267 1.00 0.00 C ATOM 1549 O VAL B 7 9.571 -6.679 5.373 1.00 0.00 O ATOM 1550 CB VAL B 7 10.860 -7.179 7.697 1.00 0.00 C ATOM 1551 CG1 VAL B 7 10.422 -8.615 7.462 1.00 0.00 C ATOM 1552 CG2 VAL B 7 11.655 -7.058 8.988 1.00 0.00 C ATOM 0 H VAL B 7 11.732 -4.569 6.396 1.00 0.00 H new ATOM 0 HA VAL B 7 12.523 -7.338 6.327 1.00 0.00 H new ATOM 0 HB VAL B 7 9.965 -6.564 7.790 1.00 0.00 H new ATOM 0 HG11 VAL B 7 9.840 -8.962 8.315 1.00 0.00 H new ATOM 0 HG12 VAL B 7 9.811 -8.666 6.561 1.00 0.00 H new ATOM 0 HG13 VAL B 7 11.301 -9.248 7.341 1.00 0.00 H new ATOM 0 HG21 VAL B 7 11.056 -7.428 9.820 1.00 0.00 H new ATOM 0 HG22 VAL B 7 12.569 -7.646 8.909 1.00 0.00 H new ATOM 0 HG23 VAL B 7 11.910 -6.013 9.161 1.00 0.00 H new ATOM 1562 N ILE B 8 11.416 -6.524 4.094 1.00 0.00 N ATOM 1563 CA ILE B 8 10.668 -6.480 2.844 1.00 0.00 C ATOM 1564 C ILE B 8 9.605 -7.576 2.817 1.00 0.00 C ATOM 1565 O ILE B 8 9.785 -8.650 3.392 1.00 0.00 O ATOM 1566 CB ILE B 8 11.608 -6.605 1.612 1.00 0.00 C ATOM 1567 CG1 ILE B 8 12.065 -5.218 1.162 1.00 0.00 C ATOM 1568 CG2 ILE B 8 10.938 -7.334 0.450 1.00 0.00 C ATOM 1569 CD1 ILE B 8 13.388 -4.790 1.759 1.00 0.00 C ATOM 0 H ILE B 8 12.429 -6.475 3.984 1.00 0.00 H new ATOM 0 HA ILE B 8 10.174 -5.510 2.788 1.00 0.00 H new ATOM 0 HB ILE B 8 12.471 -7.197 1.917 1.00 0.00 H new ATOM 0 HG12 ILE B 8 12.146 -5.207 0.075 1.00 0.00 H new ATOM 0 HG13 ILE B 8 11.302 -4.488 1.432 1.00 0.00 H new ATOM 0 HG21 ILE B 8 11.632 -7.398 -0.388 1.00 0.00 H new ATOM 0 HG22 ILE B 8 10.656 -8.339 0.765 1.00 0.00 H new ATOM 0 HG23 ILE B 8 10.047 -6.787 0.142 1.00 0.00 H new ATOM 0 HD11 ILE B 8 13.647 -3.796 1.394 1.00 0.00 H new ATOM 0 HD12 ILE B 8 13.307 -4.768 2.846 1.00 0.00 H new ATOM 0 HD13 ILE B 8 14.164 -5.497 1.468 1.00 0.00 H new ATOM 1581 N LYS B 9 8.502 -7.290 2.141 1.00 0.00 N ATOM 1582 CA LYS B 9 7.405 -8.239 2.025 1.00 0.00 C ATOM 1583 C LYS B 9 6.597 -7.962 0.764 1.00 0.00 C ATOM 1584 O LYS B 9 5.642 -8.673 0.454 1.00 0.00 O ATOM 1585 CB LYS B 9 6.500 -8.160 3.257 1.00 0.00 C ATOM 1586 CG LYS B 9 7.223 -7.718 4.520 1.00 0.00 C ATOM 1587 CD LYS B 9 7.158 -8.782 5.602 1.00 0.00 C ATOM 1588 CE LYS B 9 7.248 -8.171 6.991 1.00 0.00 C ATOM 1589 NZ LYS B 9 6.612 -9.038 8.022 1.00 0.00 N ATOM 0 H LYS B 9 8.343 -6.404 1.662 1.00 0.00 H new ATOM 0 HA LYS B 9 7.822 -9.244 1.961 1.00 0.00 H new ATOM 0 HB2 LYS B 9 5.685 -7.466 3.054 1.00 0.00 H new ATOM 0 HB3 LYS B 9 6.050 -9.138 3.430 1.00 0.00 H new ATOM 0 HG2 LYS B 9 8.265 -7.499 4.286 1.00 0.00 H new ATOM 0 HG3 LYS B 9 6.779 -6.794 4.890 1.00 0.00 H new ATOM 0 HD2 LYS B 9 6.227 -9.341 5.509 1.00 0.00 H new ATOM 0 HD3 LYS B 9 7.972 -9.494 5.463 1.00 0.00 H new ATOM 0 HE2 LYS B 9 8.295 -8.008 7.249 1.00 0.00 H new ATOM 0 HE3 LYS B 9 6.765 -7.194 6.990 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 6.695 -8.586 8.955 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 5.607 -9.173 7.790 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 7.090 -9.962 8.041 1.00 0.00 H new ATOM 1603 N ASN B 10 6.992 -6.919 0.040 1.00 0.00 N ATOM 1604 CA ASN B 10 6.307 -6.541 -1.191 1.00 0.00 C ATOM 1605 C ASN B 10 7.162 -5.589 -2.021 1.00 0.00 C ATOM 1606 O ASN B 10 6.847 -4.406 -2.143 1.00 0.00 O ATOM 1607 CB ASN B 10 4.966 -5.883 -0.869 1.00 0.00 C ATOM 1608 CG ASN B 10 3.982 -5.985 -2.018 1.00 0.00 C ATOM 1609 OD1 ASN B 10 4.496 -6.242 -3.216 1.00 0.00 O flip ATOM 1610 ND2 ASN B 10 2.775 -5.834 -1.832 1.00 0.00 N flip ATOM 0 H ASN B 10 7.782 -6.321 0.284 1.00 0.00 H new ATOM 0 HA ASN B 10 6.133 -7.447 -1.772 1.00 0.00 H new ATOM 0 HB2 ASN B 10 4.537 -6.353 0.016 1.00 0.00 H new ATOM 0 HB3 ASN B 10 5.129 -4.833 -0.625 1.00 0.00 H new ATOM 0 HD21 ASN B 10 2.424 -5.638 -0.895 1.00 0.00 H new ATOM 0 HD22 ASN B 10 2.125 -5.905 -2.615 1.00 0.00 H new ATOM 1617 N ALA B 11 8.245 -6.111 -2.590 1.00 0.00 N ATOM 1618 CA ALA B 11 9.141 -5.299 -3.405 1.00 0.00 C ATOM 1619 C ALA B 11 9.064 -5.688 -4.878 1.00 0.00 C ATOM 1620 O ALA B 11 8.735 -6.824 -5.220 1.00 0.00 O ATOM 1621 CB ALA B 11 10.571 -5.425 -2.903 1.00 0.00 C ATOM 0 H ALA B 11 8.522 -7.089 -2.502 1.00 0.00 H new ATOM 0 HA ALA B 11 8.821 -4.261 -3.316 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.229 -4.814 -3.521 1.00 0.00 H new ATOM 0 HB2 ALA B 11 10.625 -5.085 -1.869 1.00 0.00 H new ATOM 0 HB3 ALA B 11 10.886 -6.467 -2.959 1.00 0.00 H new ATOM 1627 N ASP B 12 9.380 -4.729 -5.743 1.00 0.00 N ATOM 1628 CA ASP B 12 9.361 -4.948 -7.183 1.00 0.00 C ATOM 1629 C ASP B 12 10.400 -4.062 -7.859 1.00 0.00 C ATOM 1630 O ASP B 12 10.240 -3.662 -9.013 1.00 0.00 O ATOM 1631 CB ASP B 12 7.973 -4.656 -7.754 1.00 0.00 C ATOM 1632 CG ASP B 12 7.750 -5.317 -9.100 1.00 0.00 C ATOM 1633 OD1 ASP B 12 7.432 -6.524 -9.122 1.00 0.00 O ATOM 1634 OD2 ASP B 12 7.894 -4.628 -10.131 1.00 0.00 O ATOM 0 H ASP B 12 9.654 -3.786 -5.467 1.00 0.00 H new ATOM 0 HA ASP B 12 9.602 -5.993 -7.377 1.00 0.00 H new ATOM 0 HB2 ASP B 12 7.214 -5.002 -7.052 1.00 0.00 H new ATOM 0 HB3 ASP B 12 7.845 -3.578 -7.856 1.00 0.00 H new ATOM 1639 N MET B 13 11.460 -3.758 -7.123 1.00 0.00 N ATOM 1640 CA MET B 13 12.536 -2.914 -7.626 1.00 0.00 C ATOM 1641 C MET B 13 13.867 -3.657 -7.584 1.00 0.00 C ATOM 1642 O MET B 13 13.964 -4.744 -7.014 1.00 0.00 O ATOM 1643 CB MET B 13 12.618 -1.631 -6.794 1.00 0.00 C ATOM 1644 CG MET B 13 13.969 -0.938 -6.855 1.00 0.00 C ATOM 1645 SD MET B 13 13.854 0.830 -6.525 1.00 0.00 S ATOM 1646 CE MET B 13 13.204 0.817 -4.856 1.00 0.00 C ATOM 0 H MET B 13 11.599 -4.086 -6.167 1.00 0.00 H new ATOM 0 HA MET B 13 12.323 -2.655 -8.663 1.00 0.00 H new ATOM 0 HB2 MET B 13 11.850 -0.938 -7.138 1.00 0.00 H new ATOM 0 HB3 MET B 13 12.390 -1.869 -5.755 1.00 0.00 H new ATOM 0 HG2 MET B 13 14.642 -1.396 -6.130 1.00 0.00 H new ATOM 0 HG3 MET B 13 14.409 -1.092 -7.840 1.00 0.00 H new ATOM 0 HE1 MET B 13 13.716 1.573 -4.260 1.00 0.00 H new ATOM 0 HE2 MET B 13 12.136 1.035 -4.880 1.00 0.00 H new ATOM 0 HE3 MET B 13 13.364 -0.165 -4.411 1.00 0.00 H new ATOM 1656 N SER B 14 14.892 -3.065 -8.190 1.00 0.00 N ATOM 1657 CA SER B 14 16.217 -3.674 -8.214 1.00 0.00 C ATOM 1658 C SER B 14 16.716 -3.936 -6.797 1.00 0.00 C ATOM 1659 O SER B 14 16.505 -3.126 -5.896 1.00 0.00 O ATOM 1660 CB SER B 14 17.203 -2.769 -8.954 1.00 0.00 C ATOM 1661 OG SER B 14 18.143 -3.535 -9.689 1.00 0.00 O ATOM 0 H SER B 14 14.831 -2.167 -8.670 1.00 0.00 H new ATOM 0 HA SER B 14 16.145 -4.626 -8.739 1.00 0.00 H new ATOM 0 HB2 SER B 14 16.659 -2.108 -9.629 1.00 0.00 H new ATOM 0 HB3 SER B 14 17.726 -2.134 -8.239 1.00 0.00 H new ATOM 0 HG SER B 14 18.762 -2.934 -10.155 1.00 0.00 H new ATOM 1667 N GLU B 15 17.378 -5.074 -6.608 1.00 0.00 N ATOM 1668 CA GLU B 15 17.906 -5.443 -5.299 1.00 0.00 C ATOM 1669 C GLU B 15 18.627 -4.269 -4.645 1.00 0.00 C ATOM 1670 O GLU B 15 18.215 -3.781 -3.592 1.00 0.00 O ATOM 1671 CB GLU B 15 18.856 -6.635 -5.428 1.00 0.00 C ATOM 1672 CG GLU B 15 18.148 -7.950 -5.706 1.00 0.00 C ATOM 1673 CD GLU B 15 18.127 -8.301 -7.181 1.00 0.00 C ATOM 1674 OE1 GLU B 15 18.396 -7.404 -8.008 1.00 0.00 O ATOM 1675 OE2 GLU B 15 17.842 -9.471 -7.508 1.00 0.00 O ATOM 0 H GLU B 15 17.561 -5.756 -7.344 1.00 0.00 H new ATOM 0 HA GLU B 15 17.065 -5.723 -4.664 1.00 0.00 H new ATOM 0 HB2 GLU B 15 19.566 -6.438 -6.231 1.00 0.00 H new ATOM 0 HB3 GLU B 15 19.433 -6.730 -4.508 1.00 0.00 H new ATOM 0 HG2 GLU B 15 18.643 -8.749 -5.153 1.00 0.00 H new ATOM 0 HG3 GLU B 15 17.125 -7.893 -5.335 1.00 0.00 H new ATOM 1682 N GLU B 16 19.708 -3.818 -5.270 1.00 0.00 N ATOM 1683 CA GLU B 16 20.482 -2.701 -4.743 1.00 0.00 C ATOM 1684 C GLU B 16 19.585 -1.501 -4.457 1.00 0.00 C ATOM 1685 O GLU B 16 19.876 -0.693 -3.576 1.00 0.00 O ATOM 1686 CB GLU B 16 21.579 -2.304 -5.731 1.00 0.00 C ATOM 1687 CG GLU B 16 21.220 -2.593 -7.178 1.00 0.00 C ATOM 1688 CD GLU B 16 21.135 -1.336 -8.020 1.00 0.00 C ATOM 1689 OE1 GLU B 16 20.474 -0.372 -7.580 1.00 0.00 O ATOM 1690 OE2 GLU B 16 21.728 -1.315 -9.119 1.00 0.00 O ATOM 0 H GLU B 16 20.068 -4.208 -6.141 1.00 0.00 H new ATOM 0 HA GLU B 16 20.940 -3.021 -3.807 1.00 0.00 H new ATOM 0 HB2 GLU B 16 21.788 -1.240 -5.622 1.00 0.00 H new ATOM 0 HB3 GLU B 16 22.496 -2.837 -5.478 1.00 0.00 H new ATOM 0 HG2 GLU B 16 21.965 -3.263 -7.606 1.00 0.00 H new ATOM 0 HG3 GLU B 16 20.264 -3.115 -7.214 1.00 0.00 H new ATOM 1697 N MET B 17 18.495 -1.389 -5.208 1.00 0.00 N ATOM 1698 CA MET B 17 17.560 -0.285 -5.033 1.00 0.00 C ATOM 1699 C MET B 17 16.634 -0.534 -3.846 1.00 0.00 C ATOM 1700 O MET B 17 16.268 0.397 -3.127 1.00 0.00 O ATOM 1701 CB MET B 17 16.734 -0.077 -6.304 1.00 0.00 C ATOM 1702 CG MET B 17 17.442 0.753 -7.363 1.00 0.00 C ATOM 1703 SD MET B 17 18.167 2.262 -6.694 1.00 0.00 S ATOM 1704 CE MET B 17 16.722 3.043 -5.979 1.00 0.00 C ATOM 0 H MET B 17 18.238 -2.048 -5.943 1.00 0.00 H new ATOM 0 HA MET B 17 18.140 0.616 -4.834 1.00 0.00 H new ATOM 0 HB2 MET B 17 16.481 -1.050 -6.726 1.00 0.00 H new ATOM 0 HB3 MET B 17 15.795 0.410 -6.041 1.00 0.00 H new ATOM 0 HG2 MET B 17 18.225 0.153 -7.826 1.00 0.00 H new ATOM 0 HG3 MET B 17 16.733 1.013 -8.149 1.00 0.00 H new ATOM 0 HE1 MET B 17 16.603 4.042 -6.398 1.00 0.00 H new ATOM 0 HE2 MET B 17 15.837 2.447 -6.204 1.00 0.00 H new ATOM 0 HE3 MET B 17 16.845 3.116 -4.898 1.00 0.00 H new ATOM 1714 N GLN B 18 16.262 -1.794 -3.638 1.00 0.00 N ATOM 1715 CA GLN B 18 15.385 -2.154 -2.530 1.00 0.00 C ATOM 1716 C GLN B 18 16.127 -2.030 -1.207 1.00 0.00 C ATOM 1717 O GLN B 18 15.552 -1.630 -0.194 1.00 0.00 O ATOM 1718 CB GLN B 18 14.855 -3.579 -2.702 1.00 0.00 C ATOM 1719 CG GLN B 18 15.668 -4.418 -3.669 1.00 0.00 C ATOM 1720 CD GLN B 18 14.803 -5.151 -4.676 1.00 0.00 C ATOM 1721 OE1 GLN B 18 15.286 -6.001 -5.424 1.00 0.00 O ATOM 1722 NE2 GLN B 18 13.517 -4.824 -4.698 1.00 0.00 N ATOM 0 H GLN B 18 16.553 -2.579 -4.220 1.00 0.00 H new ATOM 0 HA GLN B 18 14.539 -1.467 -2.527 1.00 0.00 H new ATOM 0 HB2 GLN B 18 14.841 -4.072 -1.730 1.00 0.00 H new ATOM 0 HB3 GLN B 18 13.824 -3.534 -3.052 1.00 0.00 H new ATOM 0 HG2 GLN B 18 16.371 -3.776 -4.199 1.00 0.00 H new ATOM 0 HG3 GLN B 18 16.259 -5.142 -3.108 1.00 0.00 H new ATOM 0 HE21 GLN B 18 13.161 -4.113 -4.059 1.00 0.00 H new ATOM 0 HE22 GLN B 18 12.885 -5.283 -5.354 1.00 0.00 H new ATOM 1731 N GLN B 19 17.414 -2.361 -1.226 1.00 0.00 N ATOM 1732 CA GLN B 19 18.242 -2.272 -0.035 1.00 0.00 C ATOM 1733 C GLN B 19 18.575 -0.817 0.248 1.00 0.00 C ATOM 1734 O GLN B 19 18.627 -0.387 1.402 1.00 0.00 O ATOM 1735 CB GLN B 19 19.527 -3.082 -0.210 1.00 0.00 C ATOM 1736 CG GLN B 19 19.287 -4.573 -0.375 1.00 0.00 C ATOM 1737 CD GLN B 19 19.243 -5.306 0.952 1.00 0.00 C ATOM 1738 OE1 GLN B 19 18.238 -5.000 1.764 1.00 0.00 O flip ATOM 1739 NE2 GLN B 19 20.102 -6.138 1.244 1.00 0.00 N flip ATOM 0 H GLN B 19 17.904 -2.694 -2.056 1.00 0.00 H new ATOM 0 HA GLN B 19 17.689 -2.686 0.809 1.00 0.00 H new ATOM 0 HB2 GLN B 19 20.065 -2.710 -1.082 1.00 0.00 H new ATOM 0 HB3 GLN B 19 20.170 -2.919 0.655 1.00 0.00 H new ATOM 0 HG2 GLN B 19 18.347 -4.730 -0.904 1.00 0.00 H new ATOM 0 HG3 GLN B 19 20.076 -4.998 -0.995 1.00 0.00 H new ATOM 0 HE21 GLN B 19 20.857 -6.342 0.590 1.00 0.00 H new ATOM 0 HE22 GLN B 19 20.058 -6.623 2.140 1.00 0.00 H new ATOM 1748 N ASP B 20 18.780 -0.057 -0.822 1.00 0.00 N ATOM 1749 CA ASP B 20 19.089 1.355 -0.699 1.00 0.00 C ATOM 1750 C ASP B 20 17.858 2.108 -0.221 1.00 0.00 C ATOM 1751 O ASP B 20 17.961 3.127 0.464 1.00 0.00 O ATOM 1752 CB ASP B 20 19.573 1.918 -2.037 1.00 0.00 C ATOM 1753 CG ASP B 20 21.086 1.980 -2.120 1.00 0.00 C ATOM 1754 OD1 ASP B 20 21.753 1.439 -1.214 1.00 0.00 O ATOM 1755 OD2 ASP B 20 21.603 2.568 -3.093 1.00 0.00 O ATOM 0 H ASP B 20 18.737 -0.399 -1.782 1.00 0.00 H new ATOM 0 HA ASP B 20 19.889 1.480 0.031 1.00 0.00 H new ATOM 0 HB2 ASP B 20 19.192 1.299 -2.849 1.00 0.00 H new ATOM 0 HB3 ASP B 20 19.162 2.918 -2.178 1.00 0.00 H new ATOM 1760 N SER B 21 16.688 1.582 -0.573 1.00 0.00 N ATOM 1761 CA SER B 21 15.430 2.185 -0.167 1.00 0.00 C ATOM 1762 C SER B 21 15.240 2.026 1.334 1.00 0.00 C ATOM 1763 O SER B 21 14.945 2.991 2.040 1.00 0.00 O ATOM 1764 CB SER B 21 14.261 1.544 -0.916 1.00 0.00 C ATOM 1765 OG SER B 21 13.331 0.968 -0.016 1.00 0.00 O ATOM 0 H SER B 21 16.589 0.739 -1.139 1.00 0.00 H new ATOM 0 HA SER B 21 15.457 3.247 -0.413 1.00 0.00 H new ATOM 0 HB2 SER B 21 13.762 2.295 -1.528 1.00 0.00 H new ATOM 0 HB3 SER B 21 14.636 0.778 -1.595 1.00 0.00 H new ATOM 0 HG SER B 21 13.645 0.080 0.255 1.00 0.00 H new ATOM 1771 N VAL B 22 15.429 0.801 1.817 1.00 0.00 N ATOM 1772 CA VAL B 22 15.296 0.523 3.238 1.00 0.00 C ATOM 1773 C VAL B 22 16.190 1.458 4.041 1.00 0.00 C ATOM 1774 O VAL B 22 15.763 2.036 5.040 1.00 0.00 O ATOM 1775 CB VAL B 22 15.664 -0.936 3.566 1.00 0.00 C ATOM 1776 CG1 VAL B 22 15.652 -1.159 5.069 1.00 0.00 C ATOM 1777 CG2 VAL B 22 14.714 -1.899 2.870 1.00 0.00 C ATOM 0 H VAL B 22 15.673 -0.009 1.247 1.00 0.00 H new ATOM 0 HA VAL B 22 14.252 0.685 3.507 1.00 0.00 H new ATOM 0 HB VAL B 22 16.671 -1.130 3.198 1.00 0.00 H new ATOM 0 HG11 VAL B 22 15.914 -2.195 5.285 1.00 0.00 H new ATOM 0 HG12 VAL B 22 16.376 -0.495 5.541 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.657 -0.947 5.460 1.00 0.00 H new ATOM 0 HG21 VAL B 22 14.991 -2.924 3.115 1.00 0.00 H new ATOM 0 HG22 VAL B 22 13.694 -1.709 3.204 1.00 0.00 H new ATOM 0 HG23 VAL B 22 14.775 -1.754 1.791 1.00 0.00 H new ATOM 1787 N GLU B 23 17.431 1.615 3.586 1.00 0.00 N ATOM 1788 CA GLU B 23 18.377 2.498 4.256 1.00 0.00 C ATOM 1789 C GLU B 23 17.823 3.917 4.295 1.00 0.00 C ATOM 1790 O GLU B 23 17.954 4.620 5.297 1.00 0.00 O ATOM 1791 CB GLU B 23 19.732 2.478 3.545 1.00 0.00 C ATOM 1792 CG GLU B 23 20.356 1.093 3.457 1.00 0.00 C ATOM 1793 CD GLU B 23 21.686 1.099 2.730 1.00 0.00 C ATOM 1794 OE1 GLU B 23 22.212 2.201 2.463 1.00 0.00 O ATOM 1795 OE2 GLU B 23 22.203 0.004 2.428 1.00 0.00 O ATOM 0 H GLU B 23 17.802 1.144 2.761 1.00 0.00 H new ATOM 0 HA GLU B 23 18.522 2.143 5.277 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.610 2.876 2.538 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.418 3.143 4.070 1.00 0.00 H new ATOM 0 HG2 GLU B 23 20.498 0.698 4.463 1.00 0.00 H new ATOM 0 HG3 GLU B 23 19.669 0.421 2.944 1.00 0.00 H new ATOM 1802 N CYS B 24 17.188 4.326 3.199 1.00 0.00 N ATOM 1803 CA CYS B 24 16.596 5.655 3.115 1.00 0.00 C ATOM 1804 C CYS B 24 15.455 5.780 4.115 1.00 0.00 C ATOM 1805 O CYS B 24 15.264 6.831 4.733 1.00 0.00 O ATOM 1806 CB CYS B 24 16.086 5.931 1.699 1.00 0.00 C ATOM 1807 SG CYS B 24 15.702 7.668 1.380 1.00 0.00 S ATOM 0 H CYS B 24 17.071 3.757 2.360 1.00 0.00 H new ATOM 0 HA CYS B 24 17.363 6.391 3.354 1.00 0.00 H new ATOM 0 HB2 CYS B 24 16.837 5.598 0.982 1.00 0.00 H new ATOM 0 HB3 CYS B 24 15.191 5.334 1.524 1.00 0.00 H new ATOM 0 HG CYS B 24 15.736 7.892 0.100 1.00 0.00 H new ATOM 1813 N ALA B 25 14.719 4.688 4.298 1.00 0.00 N ATOM 1814 CA ALA B 25 13.627 4.669 5.250 1.00 0.00 C ATOM 1815 C ALA B 25 14.214 4.739 6.641 1.00 0.00 C ATOM 1816 O ALA B 25 13.616 5.283 7.570 1.00 0.00 O ATOM 1817 CB ALA B 25 12.784 3.412 5.079 1.00 0.00 C ATOM 0 H ALA B 25 14.863 3.810 3.799 1.00 0.00 H new ATOM 0 HA ALA B 25 12.971 5.523 5.082 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.970 3.418 5.804 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.372 3.385 4.070 1.00 0.00 H new ATOM 0 HB3 ALA B 25 13.406 2.532 5.240 1.00 0.00 H new ATOM 1823 N THR B 26 15.421 4.199 6.752 1.00 0.00 N ATOM 1824 CA THR B 26 16.158 4.194 7.998 1.00 0.00 C ATOM 1825 C THR B 26 16.640 5.601 8.318 1.00 0.00 C ATOM 1826 O THR B 26 16.639 6.023 9.473 1.00 0.00 O ATOM 1827 CB THR B 26 17.348 3.247 7.889 1.00 0.00 C ATOM 1828 OG1 THR B 26 17.008 2.098 7.132 1.00 0.00 O ATOM 1829 CG2 THR B 26 17.857 2.778 9.229 1.00 0.00 C ATOM 0 H THR B 26 15.912 3.753 5.977 1.00 0.00 H new ATOM 0 HA THR B 26 15.504 3.852 8.800 1.00 0.00 H new ATOM 0 HB THR B 26 18.133 3.823 7.399 1.00 0.00 H new ATOM 0 HG1 THR B 26 16.753 2.368 6.225 1.00 0.00 H new ATOM 0 HG21 THR B 26 18.704 2.107 9.082 1.00 0.00 H new ATOM 0 HG22 THR B 26 18.173 3.638 9.819 1.00 0.00 H new ATOM 0 HG23 THR B 26 17.062 2.249 9.755 1.00 0.00 H new ATOM 1837 N GLN B 27 17.039 6.328 7.279 1.00 0.00 N ATOM 1838 CA GLN B 27 17.507 7.695 7.441 1.00 0.00 C ATOM 1839 C GLN B 27 16.397 8.550 8.033 1.00 0.00 C ATOM 1840 O GLN B 27 16.627 9.360 8.932 1.00 0.00 O ATOM 1841 CB GLN B 27 17.956 8.272 6.097 1.00 0.00 C ATOM 1842 CG GLN B 27 19.120 7.522 5.470 1.00 0.00 C ATOM 1843 CD GLN B 27 19.887 8.365 4.470 1.00 0.00 C ATOM 1844 OE1 GLN B 27 19.993 9.582 4.620 1.00 0.00 O ATOM 1845 NE2 GLN B 27 20.425 7.721 3.440 1.00 0.00 N ATOM 0 H GLN B 27 17.047 5.991 6.316 1.00 0.00 H new ATOM 0 HA GLN B 27 18.361 7.696 8.118 1.00 0.00 H new ATOM 0 HB2 GLN B 27 17.113 8.260 5.406 1.00 0.00 H new ATOM 0 HB3 GLN B 27 18.240 9.315 6.236 1.00 0.00 H new ATOM 0 HG2 GLN B 27 19.799 7.190 6.256 1.00 0.00 H new ATOM 0 HG3 GLN B 27 18.745 6.627 4.973 1.00 0.00 H new ATOM 0 HE21 GLN B 27 20.312 6.711 3.355 1.00 0.00 H new ATOM 0 HE22 GLN B 27 20.951 8.237 2.734 1.00 0.00 H new ATOM 1854 N ALA B 28 15.186 8.349 7.526 1.00 0.00 N ATOM 1855 CA ALA B 28 14.026 9.085 8.007 1.00 0.00 C ATOM 1856 C ALA B 28 13.605 8.582 9.385 1.00 0.00 C ATOM 1857 O ALA B 28 13.021 9.321 10.177 1.00 0.00 O ATOM 1858 CB ALA B 28 12.874 8.960 7.021 1.00 0.00 C ATOM 0 H ALA B 28 14.983 7.682 6.782 1.00 0.00 H new ATOM 0 HA ALA B 28 14.297 10.137 8.094 1.00 0.00 H new ATOM 0 HB1 ALA B 28 12.014 9.516 7.394 1.00 0.00 H new ATOM 0 HB2 ALA B 28 13.176 9.365 6.055 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.606 7.910 6.906 1.00 0.00 H new ATOM 1864 N LEU B 29 13.910 7.317 9.660 1.00 0.00 N ATOM 1865 CA LEU B 29 13.571 6.707 10.941 1.00 0.00 C ATOM 1866 C LEU B 29 14.472 7.238 12.051 1.00 0.00 C ATOM 1867 O LEU B 29 13.999 7.645 13.112 1.00 0.00 O ATOM 1868 CB LEU B 29 13.703 5.188 10.857 1.00 0.00 C ATOM 1869 CG LEU B 29 12.543 4.483 10.160 1.00 0.00 C ATOM 1870 CD1 LEU B 29 13.064 3.368 9.277 1.00 0.00 C ATOM 1871 CD2 LEU B 29 11.553 3.940 11.178 1.00 0.00 C ATOM 0 H LEU B 29 14.392 6.694 9.012 1.00 0.00 H new ATOM 0 HA LEU B 29 12.538 6.966 11.174 1.00 0.00 H new ATOM 0 HB2 LEU B 29 14.626 4.946 10.330 1.00 0.00 H new ATOM 0 HB3 LEU B 29 13.798 4.789 11.867 1.00 0.00 H new ATOM 0 HG LEU B 29 12.022 5.209 9.535 1.00 0.00 H new ATOM 0 HD11 LEU B 29 12.227 2.872 8.785 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.734 3.783 8.524 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.607 2.645 9.886 1.00 0.00 H new ATOM 0 HD21 LEU B 29 10.734 3.441 10.659 1.00 0.00 H new ATOM 0 HD22 LEU B 29 12.057 3.227 11.831 1.00 0.00 H new ATOM 0 HD23 LEU B 29 11.157 4.762 11.775 1.00 0.00 H new ATOM 1883 N GLU B 30 15.775 7.226 11.792 1.00 0.00 N ATOM 1884 CA GLU B 30 16.759 7.698 12.758 1.00 0.00 C ATOM 1885 C GLU B 30 16.693 9.215 12.910 1.00 0.00 C ATOM 1886 O GLU B 30 17.047 9.759 13.957 1.00 0.00 O ATOM 1887 CB GLU B 30 18.164 7.272 12.325 1.00 0.00 C ATOM 1888 CG GLU B 30 18.827 6.294 13.281 1.00 0.00 C ATOM 1889 CD GLU B 30 20.341 6.334 13.199 1.00 0.00 C ATOM 1890 OE1 GLU B 30 20.902 7.448 13.137 1.00 0.00 O ATOM 1891 OE2 GLU B 30 20.964 5.251 13.194 1.00 0.00 O ATOM 0 H GLU B 30 16.176 6.892 10.915 1.00 0.00 H new ATOM 0 HA GLU B 30 16.531 7.250 13.725 1.00 0.00 H new ATOM 0 HB2 GLU B 30 18.108 6.818 11.336 1.00 0.00 H new ATOM 0 HB3 GLU B 30 18.791 8.159 12.234 1.00 0.00 H new ATOM 0 HG2 GLU B 30 18.516 6.521 14.301 1.00 0.00 H new ATOM 0 HG3 GLU B 30 18.481 5.284 13.060 1.00 0.00 H new ATOM 1898 N LYS B 31 16.238 9.894 11.861 1.00 0.00 N ATOM 1899 CA LYS B 31 16.128 11.348 11.885 1.00 0.00 C ATOM 1900 C LYS B 31 14.789 11.785 12.475 1.00 0.00 C ATOM 1901 O LYS B 31 14.688 12.847 13.090 1.00 0.00 O ATOM 1902 CB LYS B 31 16.291 11.918 10.474 1.00 0.00 C ATOM 1903 CG LYS B 31 17.731 12.254 10.118 1.00 0.00 C ATOM 1904 CD LYS B 31 18.060 11.862 8.687 1.00 0.00 C ATOM 1905 CE LYS B 31 18.904 12.923 7.999 1.00 0.00 C ATOM 1906 NZ LYS B 31 20.335 12.850 8.406 1.00 0.00 N ATOM 0 H LYS B 31 15.940 9.462 10.986 1.00 0.00 H new ATOM 0 HA LYS B 31 16.925 11.736 12.519 1.00 0.00 H new ATOM 0 HB2 LYS B 31 15.905 11.197 9.753 1.00 0.00 H new ATOM 0 HB3 LYS B 31 15.683 12.818 10.382 1.00 0.00 H new ATOM 0 HG2 LYS B 31 17.899 13.323 10.251 1.00 0.00 H new ATOM 0 HG3 LYS B 31 18.405 11.738 10.801 1.00 0.00 H new ATOM 0 HD2 LYS B 31 18.594 10.912 8.682 1.00 0.00 H new ATOM 0 HD3 LYS B 31 17.136 11.712 8.128 1.00 0.00 H new ATOM 0 HE2 LYS B 31 18.828 12.802 6.918 1.00 0.00 H new ATOM 0 HE3 LYS B 31 18.509 13.911 8.238 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 20.874 13.591 7.914 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 20.411 12.991 9.434 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 20.720 11.917 8.155 1.00 0.00 H new ATOM 1920 N TYR B 32 13.765 10.958 12.287 1.00 0.00 N ATOM 1921 CA TYR B 32 12.435 11.258 12.804 1.00 0.00 C ATOM 1922 C TYR B 32 11.677 9.977 13.140 1.00 0.00 C ATOM 1923 O TYR B 32 12.053 8.888 12.706 1.00 0.00 O ATOM 1924 CB TYR B 32 11.636 12.079 11.789 1.00 0.00 C ATOM 1925 CG TYR B 32 12.476 12.667 10.679 1.00 0.00 C ATOM 1926 CD1 TYR B 32 12.730 11.947 9.518 1.00 0.00 C ATOM 1927 CD2 TYR B 32 13.009 13.945 10.788 1.00 0.00 C ATOM 1928 CE1 TYR B 32 13.493 12.483 8.499 1.00 0.00 C ATOM 1929 CE2 TYR B 32 13.773 14.488 9.772 1.00 0.00 C ATOM 1930 CZ TYR B 32 14.012 13.752 8.630 1.00 0.00 C ATOM 1931 OH TYR B 32 14.770 14.289 7.616 1.00 0.00 O ATOM 0 H TYR B 32 13.831 10.075 11.780 1.00 0.00 H new ATOM 0 HA TYR B 32 12.557 11.841 13.717 1.00 0.00 H new ATOM 0 HB2 TYR B 32 10.865 11.446 11.351 1.00 0.00 H new ATOM 0 HB3 TYR B 32 11.125 12.888 12.312 1.00 0.00 H new ATOM 0 HD1 TYR B 32 12.324 10.952 9.411 1.00 0.00 H new ATOM 0 HD2 TYR B 32 12.824 14.524 11.681 1.00 0.00 H new ATOM 0 HE1 TYR B 32 13.682 11.910 7.603 1.00 0.00 H new ATOM 0 HE2 TYR B 32 14.181 15.483 9.872 1.00 0.00 H new ATOM 0 HH TYR B 32 15.059 15.191 7.866 1.00 0.00 H new ATOM 1941 N ASN B 33 10.606 10.117 13.915 1.00 0.00 N ATOM 1942 CA ASN B 33 9.790 8.974 14.308 1.00 0.00 C ATOM 1943 C ASN B 33 8.325 9.212 13.962 1.00 0.00 C ATOM 1944 O ASN B 33 7.426 8.674 14.606 1.00 0.00 O ATOM 1945 CB ASN B 33 9.937 8.702 15.807 1.00 0.00 C ATOM 1946 CG ASN B 33 10.746 7.451 16.091 1.00 0.00 C ATOM 1947 OD1 ASN B 33 11.698 7.149 15.217 1.00 0.00 O flip ATOM 1948 ND2 ASN B 33 10.518 6.763 17.087 1.00 0.00 N flip ATOM 0 H ASN B 33 10.283 11.012 14.283 1.00 0.00 H new ATOM 0 HA ASN B 33 10.140 8.102 13.756 1.00 0.00 H new ATOM 0 HB2 ASN B 33 10.416 9.557 16.283 1.00 0.00 H new ATOM 0 HB3 ASN B 33 8.948 8.601 16.254 1.00 0.00 H new ATOM 0 HD21 ASN B 33 9.776 7.032 17.734 1.00 0.00 H new ATOM 0 HD22 ASN B 33 11.071 5.925 17.265 1.00 0.00 H new ATOM 1955 N ILE B 34 8.098 10.022 12.934 1.00 0.00 N ATOM 1956 CA ILE B 34 6.747 10.338 12.487 1.00 0.00 C ATOM 1957 C ILE B 34 6.448 9.667 11.152 1.00 0.00 C ATOM 1958 O ILE B 34 6.956 10.088 10.114 1.00 0.00 O ATOM 1959 CB ILE B 34 6.547 11.858 12.340 1.00 0.00 C ATOM 1960 CG1 ILE B 34 7.237 12.599 13.484 1.00 0.00 C ATOM 1961 CG2 ILE B 34 5.066 12.199 12.295 1.00 0.00 C ATOM 1962 CD1 ILE B 34 6.739 12.189 14.848 1.00 0.00 C ATOM 0 H ILE B 34 8.836 10.473 12.393 1.00 0.00 H new ATOM 0 HA ILE B 34 6.061 9.962 13.246 1.00 0.00 H new ATOM 0 HB ILE B 34 6.999 12.178 11.401 1.00 0.00 H new ATOM 0 HG12 ILE B 34 8.311 12.420 13.428 1.00 0.00 H new ATOM 0 HG13 ILE B 34 7.086 13.671 13.357 1.00 0.00 H new ATOM 0 HG21 ILE B 34 4.944 13.277 12.191 1.00 0.00 H new ATOM 0 HG22 ILE B 34 4.603 11.698 11.445 1.00 0.00 H new ATOM 0 HG23 ILE B 34 4.588 11.867 13.217 1.00 0.00 H new ATOM 0 HD11 ILE B 34 7.271 12.753 15.614 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.671 12.394 14.922 1.00 0.00 H new ATOM 0 HD13 ILE B 34 6.915 11.123 14.994 1.00 0.00 H new ATOM 1974 N GLU B 35 5.626 8.621 11.187 1.00 0.00 N ATOM 1975 CA GLU B 35 5.269 7.888 9.975 1.00 0.00 C ATOM 1976 C GLU B 35 5.294 8.805 8.756 1.00 0.00 C ATOM 1977 O GLU B 35 6.181 8.701 7.910 1.00 0.00 O ATOM 1978 CB GLU B 35 3.883 7.260 10.126 1.00 0.00 C ATOM 1979 CG GLU B 35 3.738 6.391 11.366 1.00 0.00 C ATOM 1980 CD GLU B 35 4.933 5.487 11.591 1.00 0.00 C ATOM 1981 OE1 GLU B 35 5.991 5.995 12.019 1.00 0.00 O ATOM 1982 OE2 GLU B 35 4.813 4.269 11.339 1.00 0.00 O ATOM 0 H GLU B 35 5.195 8.262 12.039 1.00 0.00 H new ATOM 0 HA GLU B 35 6.006 7.098 9.827 1.00 0.00 H new ATOM 0 HB2 GLU B 35 3.136 8.053 10.159 1.00 0.00 H new ATOM 0 HB3 GLU B 35 3.669 6.657 9.243 1.00 0.00 H new ATOM 0 HG2 GLU B 35 3.602 7.030 12.238 1.00 0.00 H new ATOM 0 HG3 GLU B 35 2.839 5.782 11.274 1.00 0.00 H new ATOM 1989 N LYS B 36 4.325 9.709 8.674 1.00 0.00 N ATOM 1990 CA LYS B 36 4.256 10.643 7.558 1.00 0.00 C ATOM 1991 C LYS B 36 5.623 11.266 7.294 1.00 0.00 C ATOM 1992 O LYS B 36 6.086 11.313 6.155 1.00 0.00 O ATOM 1993 CB LYS B 36 3.228 11.739 7.839 1.00 0.00 C ATOM 1994 CG LYS B 36 2.198 11.354 8.888 1.00 0.00 C ATOM 1995 CD LYS B 36 1.904 12.513 9.826 1.00 0.00 C ATOM 1996 CE LYS B 36 0.554 12.352 10.505 1.00 0.00 C ATOM 1997 NZ LYS B 36 0.677 11.691 11.833 1.00 0.00 N ATOM 0 H LYS B 36 3.580 9.815 9.363 1.00 0.00 H new ATOM 0 HA LYS B 36 3.946 10.090 6.671 1.00 0.00 H new ATOM 0 HB2 LYS B 36 3.749 12.639 8.167 1.00 0.00 H new ATOM 0 HB3 LYS B 36 2.713 11.989 6.911 1.00 0.00 H new ATOM 0 HG2 LYS B 36 1.277 11.038 8.398 1.00 0.00 H new ATOM 0 HG3 LYS B 36 2.562 10.502 9.462 1.00 0.00 H new ATOM 0 HD2 LYS B 36 2.687 12.578 10.582 1.00 0.00 H new ATOM 0 HD3 LYS B 36 1.922 13.448 9.267 1.00 0.00 H new ATOM 0 HE2 LYS B 36 0.090 13.331 10.628 1.00 0.00 H new ATOM 0 HE3 LYS B 36 -0.106 11.765 9.867 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -0.265 11.600 12.264 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 1.096 10.747 11.713 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 1.286 12.264 12.451 1.00 0.00 H new ATOM 2011 N ASP B 37 6.267 11.741 8.358 1.00 0.00 N ATOM 2012 CA ASP B 37 7.584 12.356 8.241 1.00 0.00 C ATOM 2013 C ASP B 37 8.559 11.411 7.547 1.00 0.00 C ATOM 2014 O ASP B 37 9.090 11.725 6.482 1.00 0.00 O ATOM 2015 CB ASP B 37 8.119 12.738 9.623 1.00 0.00 C ATOM 2016 CG ASP B 37 9.396 13.551 9.542 1.00 0.00 C ATOM 2017 OD1 ASP B 37 10.327 13.126 8.824 1.00 0.00 O ATOM 2018 OD2 ASP B 37 9.466 14.612 10.196 1.00 0.00 O ATOM 0 H ASP B 37 5.898 11.711 9.308 1.00 0.00 H new ATOM 0 HA ASP B 37 7.486 13.259 7.639 1.00 0.00 H new ATOM 0 HB2 ASP B 37 7.361 13.309 10.158 1.00 0.00 H new ATOM 0 HB3 ASP B 37 8.303 11.833 10.202 1.00 0.00 H new ATOM 2023 N ILE B 38 8.783 10.249 8.151 1.00 0.00 N ATOM 2024 CA ILE B 38 9.685 9.257 7.584 1.00 0.00 C ATOM 2025 C ILE B 38 9.379 9.039 6.109 1.00 0.00 C ATOM 2026 O ILE B 38 10.275 9.071 5.265 1.00 0.00 O ATOM 2027 CB ILE B 38 9.582 7.909 8.325 1.00 0.00 C ATOM 2028 CG1 ILE B 38 9.441 8.137 9.830 1.00 0.00 C ATOM 2029 CG2 ILE B 38 10.798 7.045 8.027 1.00 0.00 C ATOM 2030 CD1 ILE B 38 8.767 6.991 10.554 1.00 0.00 C ATOM 0 H ILE B 38 8.352 9.972 9.033 1.00 0.00 H new ATOM 0 HA ILE B 38 10.699 9.641 7.697 1.00 0.00 H new ATOM 0 HB ILE B 38 8.693 7.386 7.971 1.00 0.00 H new ATOM 0 HG12 ILE B 38 10.430 8.296 10.260 1.00 0.00 H new ATOM 0 HG13 ILE B 38 8.869 9.050 9.999 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.710 6.097 8.558 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.857 6.857 6.955 1.00 0.00 H new ATOM 0 HG23 ILE B 38 11.700 7.561 8.354 1.00 0.00 H new ATOM 0 HD11 ILE B 38 8.701 7.221 11.617 1.00 0.00 H new ATOM 0 HD12 ILE B 38 7.765 6.845 10.151 1.00 0.00 H new ATOM 0 HD13 ILE B 38 9.350 6.080 10.416 1.00 0.00 H new ATOM 2042 N ALA B 39 8.102 8.828 5.802 1.00 0.00 N ATOM 2043 CA ALA B 39 7.673 8.615 4.428 1.00 0.00 C ATOM 2044 C ALA B 39 8.097 9.786 3.551 1.00 0.00 C ATOM 2045 O ALA B 39 8.454 9.607 2.386 1.00 0.00 O ATOM 2046 CB ALA B 39 6.166 8.421 4.366 1.00 0.00 C ATOM 0 H ALA B 39 7.348 8.800 6.488 1.00 0.00 H new ATOM 0 HA ALA B 39 8.152 7.711 4.052 1.00 0.00 H new ATOM 0 HB1 ALA B 39 5.862 8.263 3.331 1.00 0.00 H new ATOM 0 HB2 ALA B 39 5.886 7.553 4.963 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.669 9.308 4.759 1.00 0.00 H new ATOM 2052 N ALA B 40 8.067 10.986 4.123 1.00 0.00 N ATOM 2053 CA ALA B 40 8.460 12.187 3.401 1.00 0.00 C ATOM 2054 C ALA B 40 9.969 12.213 3.200 1.00 0.00 C ATOM 2055 O ALA B 40 10.458 12.158 2.071 1.00 0.00 O ATOM 2056 CB ALA B 40 8.003 13.431 4.149 1.00 0.00 C ATOM 0 H ALA B 40 7.774 11.150 5.086 1.00 0.00 H new ATOM 0 HA ALA B 40 7.979 12.176 2.423 1.00 0.00 H new ATOM 0 HB1 ALA B 40 8.305 14.320 3.595 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.918 13.417 4.249 1.00 0.00 H new ATOM 0 HB3 ALA B 40 8.458 13.448 5.139 1.00 0.00 H new ATOM 2062 N HIS B 41 10.700 12.280 4.307 1.00 0.00 N ATOM 2063 CA HIS B 41 12.156 12.294 4.262 1.00 0.00 C ATOM 2064 C HIS B 41 12.656 11.369 3.158 1.00 0.00 C ATOM 2065 O HIS B 41 13.396 11.787 2.268 1.00 0.00 O ATOM 2066 CB HIS B 41 12.721 11.860 5.622 1.00 0.00 C ATOM 2067 CG HIS B 41 14.124 11.330 5.572 1.00 0.00 C ATOM 2068 ND1 HIS B 41 15.139 11.814 6.371 1.00 0.00 N ATOM 2069 CD2 HIS B 41 14.678 10.345 4.823 1.00 0.00 C ATOM 2070 CE1 HIS B 41 16.254 11.153 6.114 1.00 0.00 C ATOM 2071 NE2 HIS B 41 16.001 10.256 5.180 1.00 0.00 N ATOM 0 H HIS B 41 10.307 12.325 5.247 1.00 0.00 H new ATOM 0 HA HIS B 41 12.498 13.306 4.045 1.00 0.00 H new ATOM 0 HB2 HIS B 41 12.692 12.711 6.302 1.00 0.00 H new ATOM 0 HB3 HIS B 41 12.071 11.093 6.043 1.00 0.00 H new ATOM 0 HD1 HIS B 41 15.044 12.565 7.054 1.00 0.00 H new ATOM 0 HD2 HIS B 41 14.173 9.742 4.083 1.00 0.00 H new ATOM 0 HE1 HIS B 41 17.210 11.319 6.588 1.00 0.00 H new ATOM 2080 N ILE B 42 12.243 10.109 3.230 1.00 0.00 N ATOM 2081 CA ILE B 42 12.642 9.111 2.247 1.00 0.00 C ATOM 2082 C ILE B 42 12.268 9.545 0.835 1.00 0.00 C ATOM 2083 O ILE B 42 13.139 9.827 0.018 1.00 0.00 O ATOM 2084 CB ILE B 42 11.994 7.745 2.542 1.00 0.00 C ATOM 2085 CG1 ILE B 42 12.331 7.295 3.965 1.00 0.00 C ATOM 2086 CG2 ILE B 42 12.454 6.707 1.530 1.00 0.00 C ATOM 2087 CD1 ILE B 42 11.188 6.593 4.666 1.00 0.00 C ATOM 0 H ILE B 42 11.629 9.754 3.963 1.00 0.00 H new ATOM 0 HA ILE B 42 13.726 9.015 2.316 1.00 0.00 H new ATOM 0 HB ILE B 42 10.912 7.848 2.458 1.00 0.00 H new ATOM 0 HG12 ILE B 42 13.191 6.626 3.931 1.00 0.00 H new ATOM 0 HG13 ILE B 42 12.626 8.165 4.552 1.00 0.00 H new ATOM 0 HG21 ILE B 42 11.986 5.748 1.754 1.00 0.00 H new ATOM 0 HG22 ILE B 42 12.168 7.025 0.527 1.00 0.00 H new ATOM 0 HG23 ILE B 42 13.538 6.603 1.583 1.00 0.00 H new ATOM 0 HD11 ILE B 42 11.500 6.303 5.669 1.00 0.00 H new ATOM 0 HD12 ILE B 42 10.333 7.266 4.732 1.00 0.00 H new ATOM 0 HD13 ILE B 42 10.907 5.704 4.102 1.00 0.00 H new ATOM 2099 N LYS B 43 10.972 9.590 0.552 1.00 0.00 N ATOM 2100 CA LYS B 43 10.496 9.987 -0.769 1.00 0.00 C ATOM 2101 C LYS B 43 11.333 11.129 -1.335 1.00 0.00 C ATOM 2102 O LYS B 43 11.759 11.087 -2.489 1.00 0.00 O ATOM 2103 CB LYS B 43 9.026 10.405 -0.705 1.00 0.00 C ATOM 2104 CG LYS B 43 8.495 10.951 -2.021 1.00 0.00 C ATOM 2105 CD LYS B 43 8.952 12.382 -2.258 1.00 0.00 C ATOM 2106 CE LYS B 43 7.778 13.347 -2.274 1.00 0.00 C ATOM 2107 NZ LYS B 43 7.831 14.269 -3.443 1.00 0.00 N ATOM 0 H LYS B 43 10.234 9.358 1.216 1.00 0.00 H new ATOM 0 HA LYS B 43 10.595 9.126 -1.430 1.00 0.00 H new ATOM 0 HB2 LYS B 43 8.424 9.546 -0.408 1.00 0.00 H new ATOM 0 HB3 LYS B 43 8.905 11.163 0.069 1.00 0.00 H new ATOM 0 HG2 LYS B 43 8.835 10.319 -2.841 1.00 0.00 H new ATOM 0 HG3 LYS B 43 7.406 10.912 -2.019 1.00 0.00 H new ATOM 0 HD2 LYS B 43 9.654 12.675 -1.477 1.00 0.00 H new ATOM 0 HD3 LYS B 43 9.486 12.442 -3.206 1.00 0.00 H new ATOM 0 HE2 LYS B 43 6.845 12.783 -2.299 1.00 0.00 H new ATOM 0 HE3 LYS B 43 7.774 13.929 -1.353 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 7.013 14.910 -3.417 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 8.709 14.826 -3.407 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 7.808 13.715 -4.323 1.00 0.00 H new ATOM 2121 N LYS B 44 11.558 12.153 -0.517 1.00 0.00 N ATOM 2122 CA LYS B 44 12.335 13.312 -0.939 1.00 0.00 C ATOM 2123 C LYS B 44 13.767 12.924 -1.297 1.00 0.00 C ATOM 2124 O LYS B 44 14.254 13.241 -2.383 1.00 0.00 O ATOM 2125 CB LYS B 44 12.344 14.371 0.164 1.00 0.00 C ATOM 2126 CG LYS B 44 11.776 15.712 -0.274 1.00 0.00 C ATOM 2127 CD LYS B 44 12.417 16.863 0.485 1.00 0.00 C ATOM 2128 CE LYS B 44 13.411 17.617 -0.384 1.00 0.00 C ATOM 2129 NZ LYS B 44 12.732 18.413 -1.443 1.00 0.00 N ATOM 0 H LYS B 44 11.213 12.203 0.442 1.00 0.00 H new ATOM 0 HA LYS B 44 11.862 13.722 -1.831 1.00 0.00 H new ATOM 0 HB2 LYS B 44 11.770 14.003 1.014 1.00 0.00 H new ATOM 0 HB3 LYS B 44 13.368 14.515 0.509 1.00 0.00 H new ATOM 0 HG2 LYS B 44 11.938 15.845 -1.344 1.00 0.00 H new ATOM 0 HG3 LYS B 44 10.698 15.723 -0.111 1.00 0.00 H new ATOM 0 HD2 LYS B 44 11.643 17.547 0.832 1.00 0.00 H new ATOM 0 HD3 LYS B 44 12.924 16.479 1.370 1.00 0.00 H new ATOM 0 HE2 LYS B 44 14.009 18.280 0.241 1.00 0.00 H new ATOM 0 HE3 LYS B 44 14.098 16.909 -0.847 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 13.397 19.111 -1.833 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 12.411 17.779 -2.202 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 11.913 18.906 -1.035 1.00 0.00 H new ATOM 2143 N GLU B 45 14.438 12.244 -0.379 1.00 0.00 N ATOM 2144 CA GLU B 45 15.817 11.826 -0.602 1.00 0.00 C ATOM 2145 C GLU B 45 15.923 10.898 -1.808 1.00 0.00 C ATOM 2146 O GLU B 45 16.913 10.926 -2.535 1.00 0.00 O ATOM 2147 CB GLU B 45 16.375 11.136 0.644 1.00 0.00 C ATOM 2148 CG GLU B 45 17.672 10.383 0.394 1.00 0.00 C ATOM 2149 CD GLU B 45 18.873 11.062 1.025 1.00 0.00 C ATOM 2150 OE1 GLU B 45 18.692 11.765 2.042 1.00 0.00 O ATOM 2151 OE2 GLU B 45 19.994 10.891 0.501 1.00 0.00 O ATOM 0 H GLU B 45 14.053 11.970 0.525 1.00 0.00 H new ATOM 0 HA GLU B 45 16.408 12.719 -0.806 1.00 0.00 H new ATOM 0 HB2 GLU B 45 16.543 11.884 1.419 1.00 0.00 H new ATOM 0 HB3 GLU B 45 15.629 10.440 1.029 1.00 0.00 H new ATOM 0 HG2 GLU B 45 17.582 9.371 0.789 1.00 0.00 H new ATOM 0 HG3 GLU B 45 17.834 10.292 -0.680 1.00 0.00 H new ATOM 2158 N PHE B 46 14.898 10.080 -2.018 1.00 0.00 N ATOM 2159 CA PHE B 46 14.881 9.149 -3.138 1.00 0.00 C ATOM 2160 C PHE B 46 14.800 9.902 -4.460 1.00 0.00 C ATOM 2161 O PHE B 46 15.572 9.641 -5.383 1.00 0.00 O ATOM 2162 CB PHE B 46 13.700 8.186 -3.013 1.00 0.00 C ATOM 2163 CG PHE B 46 14.114 6.763 -2.772 1.00 0.00 C ATOM 2164 CD1 PHE B 46 14.363 6.309 -1.486 1.00 0.00 C ATOM 2165 CD2 PHE B 46 14.258 5.881 -3.829 1.00 0.00 C ATOM 2166 CE1 PHE B 46 14.748 5.003 -1.261 1.00 0.00 C ATOM 2167 CE2 PHE B 46 14.642 4.571 -3.611 1.00 0.00 C ATOM 2168 CZ PHE B 46 14.888 4.132 -2.325 1.00 0.00 C ATOM 0 H PHE B 46 14.068 10.043 -1.426 1.00 0.00 H new ATOM 0 HA PHE B 46 15.808 8.576 -3.119 1.00 0.00 H new ATOM 0 HB2 PHE B 46 13.059 8.514 -2.195 1.00 0.00 H new ATOM 0 HB3 PHE B 46 13.104 8.234 -3.924 1.00 0.00 H new ATOM 0 HD1 PHE B 46 14.254 6.985 -0.651 1.00 0.00 H new ATOM 0 HD2 PHE B 46 14.068 6.220 -4.837 1.00 0.00 H new ATOM 0 HE1 PHE B 46 14.940 4.662 -0.254 1.00 0.00 H new ATOM 0 HE2 PHE B 46 14.749 3.893 -4.444 1.00 0.00 H new ATOM 0 HZ PHE B 46 15.189 3.110 -2.151 1.00 0.00 H new ATOM 2178 N ASP B 47 13.865 10.840 -4.543 1.00 0.00 N ATOM 2179 CA ASP B 47 13.688 11.633 -5.751 1.00 0.00 C ATOM 2180 C ASP B 47 14.992 12.325 -6.133 1.00 0.00 C ATOM 2181 O ASP B 47 15.319 12.447 -7.314 1.00 0.00 O ATOM 2182 CB ASP B 47 12.573 12.667 -5.550 1.00 0.00 C ATOM 2183 CG ASP B 47 13.101 14.080 -5.378 1.00 0.00 C ATOM 2184 OD1 ASP B 47 13.718 14.360 -4.329 1.00 0.00 O ATOM 2185 OD2 ASP B 47 12.895 14.906 -6.292 1.00 0.00 O ATOM 0 H ASP B 47 13.218 11.070 -3.788 1.00 0.00 H new ATOM 0 HA ASP B 47 13.402 10.966 -6.564 1.00 0.00 H new ATOM 0 HB2 ASP B 47 11.899 12.638 -6.406 1.00 0.00 H new ATOM 0 HB3 ASP B 47 11.986 12.395 -4.673 1.00 0.00 H new ATOM 2190 N LYS B 48 15.733 12.779 -5.126 1.00 0.00 N ATOM 2191 CA LYS B 48 16.999 13.462 -5.362 1.00 0.00 C ATOM 2192 C LYS B 48 18.169 12.479 -5.372 1.00 0.00 C ATOM 2193 O LYS B 48 19.238 12.782 -5.903 1.00 0.00 O ATOM 2194 CB LYS B 48 17.228 14.540 -4.300 1.00 0.00 C ATOM 2195 CG LYS B 48 16.593 15.877 -4.646 1.00 0.00 C ATOM 2196 CD LYS B 48 17.580 16.795 -5.349 1.00 0.00 C ATOM 2197 CE LYS B 48 18.126 16.160 -6.616 1.00 0.00 C ATOM 2198 NZ LYS B 48 19.013 17.092 -7.365 1.00 0.00 N ATOM 0 H LYS B 48 15.479 12.686 -4.143 1.00 0.00 H new ATOM 0 HA LYS B 48 16.945 13.933 -6.344 1.00 0.00 H new ATOM 0 HB2 LYS B 48 16.827 14.192 -3.348 1.00 0.00 H new ATOM 0 HB3 LYS B 48 18.300 14.681 -4.162 1.00 0.00 H new ATOM 0 HG2 LYS B 48 15.726 15.715 -5.286 1.00 0.00 H new ATOM 0 HG3 LYS B 48 16.233 16.357 -3.736 1.00 0.00 H new ATOM 0 HD2 LYS B 48 17.090 17.737 -5.595 1.00 0.00 H new ATOM 0 HD3 LYS B 48 18.403 17.030 -4.675 1.00 0.00 H new ATOM 0 HE2 LYS B 48 18.681 15.257 -6.360 1.00 0.00 H new ATOM 0 HE3 LYS B 48 17.298 15.854 -7.255 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 19.365 16.622 -8.223 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 18.477 17.942 -7.632 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 19.817 17.364 -6.764 1.00 0.00 H new ATOM 2212 N LYS B 49 17.965 11.306 -4.780 1.00 0.00 N ATOM 2213 CA LYS B 49 19.012 10.291 -4.723 1.00 0.00 C ATOM 2214 C LYS B 49 18.972 9.389 -5.951 1.00 0.00 C ATOM 2215 O LYS B 49 19.907 8.630 -6.206 1.00 0.00 O ATOM 2216 CB LYS B 49 18.866 9.445 -3.458 1.00 0.00 C ATOM 2217 CG LYS B 49 20.034 8.503 -3.220 1.00 0.00 C ATOM 2218 CD LYS B 49 20.691 8.760 -1.874 1.00 0.00 C ATOM 2219 CE LYS B 49 21.074 7.461 -1.187 1.00 0.00 C ATOM 2220 NZ LYS B 49 21.668 7.698 0.158 1.00 0.00 N ATOM 0 H LYS B 49 17.088 11.035 -4.335 1.00 0.00 H new ATOM 0 HA LYS B 49 19.973 10.806 -4.703 1.00 0.00 H new ATOM 0 HB2 LYS B 49 18.762 10.107 -2.598 1.00 0.00 H new ATOM 0 HB3 LYS B 49 17.947 8.862 -3.524 1.00 0.00 H new ATOM 0 HG2 LYS B 49 19.686 7.471 -3.265 1.00 0.00 H new ATOM 0 HG3 LYS B 49 20.770 8.626 -4.015 1.00 0.00 H new ATOM 0 HD2 LYS B 49 21.580 9.376 -2.013 1.00 0.00 H new ATOM 0 HD3 LYS B 49 20.010 9.323 -1.236 1.00 0.00 H new ATOM 0 HE2 LYS B 49 20.192 6.829 -1.088 1.00 0.00 H new ATOM 0 HE3 LYS B 49 21.787 6.918 -1.808 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 21.838 6.786 0.628 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 22.569 8.207 0.055 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 21.013 8.267 0.732 1.00 0.00 H new ATOM 2234 N TYR B 50 17.881 9.470 -6.704 1.00 0.00 N ATOM 2235 CA TYR B 50 17.723 8.652 -7.899 1.00 0.00 C ATOM 2236 C TYR B 50 17.027 9.424 -9.014 1.00 0.00 C ATOM 2237 O TYR B 50 17.629 9.723 -10.045 1.00 0.00 O ATOM 2238 CB TYR B 50 16.928 7.389 -7.570 1.00 0.00 C ATOM 2239 CG TYR B 50 17.398 6.682 -6.318 1.00 0.00 C ATOM 2240 CD1 TYR B 50 18.432 5.755 -6.368 1.00 0.00 C ATOM 2241 CD2 TYR B 50 16.806 6.940 -5.088 1.00 0.00 C ATOM 2242 CE1 TYR B 50 18.862 5.106 -5.226 1.00 0.00 C ATOM 2243 CE2 TYR B 50 17.232 6.295 -3.942 1.00 0.00 C ATOM 2244 CZ TYR B 50 18.259 5.378 -4.017 1.00 0.00 C ATOM 2245 OH TYR B 50 18.686 4.733 -2.879 1.00 0.00 O ATOM 0 H TYR B 50 17.096 10.091 -6.509 1.00 0.00 H new ATOM 0 HA TYR B 50 18.718 8.375 -8.248 1.00 0.00 H new ATOM 0 HB2 TYR B 50 15.877 7.652 -7.455 1.00 0.00 H new ATOM 0 HB3 TYR B 50 16.994 6.700 -8.412 1.00 0.00 H new ATOM 0 HD1 TYR B 50 18.907 5.538 -7.314 1.00 0.00 H new ATOM 0 HD2 TYR B 50 16.000 7.656 -5.026 1.00 0.00 H new ATOM 0 HE1 TYR B 50 19.667 4.389 -5.281 1.00 0.00 H new ATOM 0 HE2 TYR B 50 16.763 6.508 -2.993 1.00 0.00 H new ATOM 0 HH TYR B 50 18.158 5.039 -2.112 1.00 0.00 H new ATOM 2255 N ASN B 51 15.750 9.736 -8.800 1.00 0.00 N ATOM 2256 CA ASN B 51 14.957 10.463 -9.781 1.00 0.00 C ATOM 2257 C ASN B 51 13.473 10.252 -9.505 1.00 0.00 C ATOM 2258 O ASN B 51 12.979 9.127 -9.565 1.00 0.00 O ATOM 2259 CB ASN B 51 15.295 10.000 -11.200 1.00 0.00 C ATOM 2260 CG ASN B 51 14.493 10.736 -12.255 1.00 0.00 C ATOM 2261 OD1 ASN B 51 13.278 10.889 -12.133 1.00 0.00 O ATOM 2262 ND2 ASN B 51 15.172 11.197 -13.300 1.00 0.00 N ATOM 0 H ASN B 51 15.243 9.493 -7.949 1.00 0.00 H new ATOM 0 HA ASN B 51 15.192 11.524 -9.699 1.00 0.00 H new ATOM 0 HB2 ASN B 51 16.358 10.151 -11.385 1.00 0.00 H new ATOM 0 HB3 ASN B 51 15.106 8.930 -11.285 1.00 0.00 H new ATOM 0 HD21 ASN B 51 14.686 11.701 -14.042 1.00 0.00 H new ATOM 0 HD22 ASN B 51 16.179 11.047 -13.360 1.00 0.00 H new ATOM 2269 N PRO B 52 12.738 11.329 -9.188 1.00 0.00 N ATOM 2270 CA PRO B 52 11.308 11.244 -8.894 1.00 0.00 C ATOM 2271 C PRO B 52 10.522 10.536 -10.003 1.00 0.00 C ATOM 2272 O PRO B 52 11.062 10.292 -11.083 1.00 0.00 O ATOM 2273 CB PRO B 52 10.869 12.709 -8.769 1.00 0.00 C ATOM 2274 CG PRO B 52 11.991 13.514 -9.332 1.00 0.00 C ATOM 2275 CD PRO B 52 13.232 12.710 -9.087 1.00 0.00 C ATOM 0 HA PRO B 52 11.117 10.657 -7.996 1.00 0.00 H new ATOM 0 HB2 PRO B 52 9.944 12.889 -9.317 1.00 0.00 H new ATOM 0 HB3 PRO B 52 10.680 12.974 -7.729 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.846 13.696 -10.397 1.00 0.00 H new ATOM 0 HG3 PRO B 52 12.054 14.489 -8.848 1.00 0.00 H new ATOM 0 HD2 PRO B 52 14.005 12.920 -9.826 1.00 0.00 H new ATOM 0 HD3 PRO B 52 13.663 12.917 -8.108 1.00 0.00 H new ATOM 2283 N THR B 53 9.248 10.199 -9.744 1.00 0.00 N ATOM 2284 CA THR B 53 8.597 10.483 -8.466 1.00 0.00 C ATOM 2285 C THR B 53 8.356 9.199 -7.686 1.00 0.00 C ATOM 2286 O THR B 53 7.703 8.277 -8.173 1.00 0.00 O ATOM 2287 CB THR B 53 7.277 11.216 -8.692 1.00 0.00 C ATOM 2288 OG1 THR B 53 6.789 11.759 -7.478 1.00 0.00 O ATOM 2289 CG2 THR B 53 6.197 10.329 -9.265 1.00 0.00 C ATOM 0 H THR B 53 8.646 9.723 -10.416 1.00 0.00 H new ATOM 0 HA THR B 53 9.259 11.122 -7.882 1.00 0.00 H new ATOM 0 HB THR B 53 7.501 12.003 -9.412 1.00 0.00 H new ATOM 0 HG1 THR B 53 7.444 12.391 -7.116 1.00 0.00 H new ATOM 0 HG21 THR B 53 5.284 10.909 -9.402 1.00 0.00 H new ATOM 0 HG22 THR B 53 6.523 9.933 -10.227 1.00 0.00 H new ATOM 0 HG23 THR B 53 6.003 9.504 -8.580 1.00 0.00 H new ATOM 2297 N TRP B 54 8.900 9.146 -6.477 1.00 0.00 N ATOM 2298 CA TRP B 54 8.759 7.972 -5.630 1.00 0.00 C ATOM 2299 C TRP B 54 7.556 8.087 -4.704 1.00 0.00 C ATOM 2300 O TRP B 54 7.480 8.995 -3.875 1.00 0.00 O ATOM 2301 CB TRP B 54 10.025 7.769 -4.799 1.00 0.00 C ATOM 2302 CG TRP B 54 11.266 7.649 -5.627 1.00 0.00 C ATOM 2303 CD1 TRP B 54 11.929 8.659 -6.258 1.00 0.00 C ATOM 2304 CD2 TRP B 54 11.990 6.450 -5.913 1.00 0.00 C ATOM 2305 NE1 TRP B 54 13.022 8.160 -6.923 1.00 0.00 N ATOM 2306 CE2 TRP B 54 13.084 6.805 -6.724 1.00 0.00 C ATOM 2307 CE3 TRP B 54 11.819 5.110 -5.562 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 14.002 5.867 -7.187 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 12.730 4.181 -6.022 1.00 0.00 C ATOM 2310 CH2 TRP B 54 13.810 4.561 -6.827 1.00 0.00 C ATOM 0 H TRP B 54 9.443 9.903 -6.062 1.00 0.00 H new ATOM 0 HA TRP B 54 8.604 7.113 -6.283 1.00 0.00 H new ATOM 0 HB2 TRP B 54 10.136 8.606 -4.110 1.00 0.00 H new ATOM 0 HB3 TRP B 54 9.913 6.870 -4.193 1.00 0.00 H new ATOM 0 HD1 TRP B 54 11.638 9.699 -6.238 1.00 0.00 H new ATOM 0 HE1 TRP B 54 13.681 8.709 -7.475 1.00 0.00 H new ATOM 0 HE3 TRP B 54 10.989 4.806 -4.942 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 14.836 6.159 -7.808 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 12.607 3.142 -5.756 1.00 0.00 H new ATOM 0 HH2 TRP B 54 14.505 3.809 -7.171 1.00 0.00 H new ATOM 2321 N HIS B 55 6.636 7.140 -4.827 1.00 0.00 N ATOM 2322 CA HIS B 55 5.456 7.104 -3.979 1.00 0.00 C ATOM 2323 C HIS B 55 5.693 6.084 -2.881 1.00 0.00 C ATOM 2324 O HIS B 55 5.685 4.879 -3.131 1.00 0.00 O ATOM 2325 CB HIS B 55 4.206 6.735 -4.786 1.00 0.00 C ATOM 2326 CG HIS B 55 4.186 7.295 -6.175 1.00 0.00 C ATOM 2327 ND1 HIS B 55 3.034 7.393 -6.929 1.00 0.00 N ATOM 2328 CD2 HIS B 55 5.181 7.785 -6.952 1.00 0.00 C ATOM 2329 CE1 HIS B 55 3.323 7.914 -8.108 1.00 0.00 C ATOM 2330 NE2 HIS B 55 4.619 8.162 -8.146 1.00 0.00 N ATOM 0 H HIS B 55 6.686 6.384 -5.510 1.00 0.00 H new ATOM 0 HA HIS B 55 5.286 8.091 -3.550 1.00 0.00 H new ATOM 0 HB2 HIS B 55 4.131 5.649 -4.843 1.00 0.00 H new ATOM 0 HB3 HIS B 55 3.324 7.088 -4.251 1.00 0.00 H new ATOM 0 HD1 HIS B 55 2.104 7.107 -6.623 1.00 0.00 H new ATOM 0 HD2 HIS B 55 6.224 7.864 -6.682 1.00 0.00 H new ATOM 0 HE1 HIS B 55 2.619 8.105 -8.905 1.00 0.00 H new ATOM 2339 N CYS B 56 5.950 6.564 -1.672 1.00 0.00 N ATOM 2340 CA CYS B 56 6.238 5.671 -0.564 1.00 0.00 C ATOM 2341 C CYS B 56 5.414 6.001 0.667 1.00 0.00 C ATOM 2342 O CYS B 56 4.820 7.073 0.775 1.00 0.00 O ATOM 2343 CB CYS B 56 7.725 5.736 -0.217 1.00 0.00 C ATOM 2344 SG CYS B 56 8.071 6.339 1.453 1.00 0.00 S ATOM 0 H CYS B 56 5.965 7.556 -1.437 1.00 0.00 H new ATOM 0 HA CYS B 56 5.971 4.663 -0.881 1.00 0.00 H new ATOM 0 HB2 CYS B 56 8.156 4.741 -0.329 1.00 0.00 H new ATOM 0 HB3 CYS B 56 8.226 6.384 -0.936 1.00 0.00 H new ATOM 0 HG CYS B 56 8.133 7.637 1.441 1.00 0.00 H new ATOM 2350 N ILE B 57 5.399 5.057 1.596 1.00 0.00 N ATOM 2351 CA ILE B 57 4.667 5.214 2.841 1.00 0.00 C ATOM 2352 C ILE B 57 5.393 4.513 3.981 1.00 0.00 C ATOM 2353 O ILE B 57 6.300 3.714 3.747 1.00 0.00 O ATOM 2354 CB ILE B 57 3.242 4.665 2.712 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.500 5.455 1.635 1.00 0.00 C ATOM 2356 CG2 ILE B 57 2.517 4.740 4.049 1.00 0.00 C ATOM 2357 CD1 ILE B 57 1.043 5.094 1.516 1.00 0.00 C ATOM 0 H ILE B 57 5.890 4.167 1.508 1.00 0.00 H new ATOM 0 HA ILE B 57 4.608 6.280 3.062 1.00 0.00 H new ATOM 0 HB ILE B 57 3.278 3.615 2.420 1.00 0.00 H new ATOM 0 HG12 ILE B 57 2.585 6.519 1.854 1.00 0.00 H new ATOM 0 HG13 ILE B 57 2.986 5.288 0.674 1.00 0.00 H new ATOM 0 HG21 ILE B 57 1.507 4.346 3.938 1.00 0.00 H new ATOM 0 HG22 ILE B 57 3.057 4.150 4.789 1.00 0.00 H new ATOM 0 HG23 ILE B 57 2.467 5.778 4.378 1.00 0.00 H new ATOM 0 HD11 ILE B 57 0.582 5.695 0.732 1.00 0.00 H new ATOM 0 HD12 ILE B 57 0.949 4.037 1.266 1.00 0.00 H new ATOM 0 HD13 ILE B 57 0.541 5.288 2.464 1.00 0.00 H new ATOM 2369 N VAL B 58 5.007 4.819 5.214 1.00 0.00 N ATOM 2370 CA VAL B 58 5.647 4.214 6.374 1.00 0.00 C ATOM 2371 C VAL B 58 4.720 4.204 7.585 1.00 0.00 C ATOM 2372 O VAL B 58 4.250 5.249 8.031 1.00 0.00 O ATOM 2373 CB VAL B 58 6.955 4.947 6.734 1.00 0.00 C ATOM 2374 CG1 VAL B 58 6.753 6.451 6.682 1.00 0.00 C ATOM 2375 CG2 VAL B 58 7.466 4.519 8.104 1.00 0.00 C ATOM 0 H VAL B 58 4.260 5.477 5.435 1.00 0.00 H new ATOM 0 HA VAL B 58 5.879 3.184 6.105 1.00 0.00 H new ATOM 0 HB VAL B 58 7.709 4.673 5.996 1.00 0.00 H new ATOM 0 HG11 VAL B 58 7.686 6.953 6.939 1.00 0.00 H new ATOM 0 HG12 VAL B 58 6.449 6.743 5.677 1.00 0.00 H new ATOM 0 HG13 VAL B 58 5.979 6.739 7.393 1.00 0.00 H new ATOM 0 HG21 VAL B 58 8.389 5.052 8.331 1.00 0.00 H new ATOM 0 HG22 VAL B 58 6.717 4.752 8.861 1.00 0.00 H new ATOM 0 HG23 VAL B 58 7.658 3.446 8.102 1.00 0.00 H new ATOM 2385 N GLY B 59 4.472 3.010 8.114 1.00 0.00 N ATOM 2386 CA GLY B 59 3.613 2.871 9.272 1.00 0.00 C ATOM 2387 C GLY B 59 4.013 1.696 10.138 1.00 0.00 C ATOM 2388 O GLY B 59 5.027 1.046 9.879 1.00 0.00 O ATOM 0 H GLY B 59 4.853 2.133 7.758 1.00 0.00 H new ATOM 0 HA2 GLY B 59 3.651 3.786 9.863 1.00 0.00 H new ATOM 0 HA3 GLY B 59 2.581 2.745 8.945 1.00 0.00 H new ATOM 2392 N ARG B 60 3.226 1.421 11.170 1.00 0.00 N ATOM 2393 CA ARG B 60 3.518 0.317 12.070 1.00 0.00 C ATOM 2394 C ARG B 60 2.236 -0.326 12.589 1.00 0.00 C ATOM 2395 O ARG B 60 2.170 -0.756 13.740 1.00 0.00 O ATOM 2396 CB ARG B 60 4.366 0.808 13.238 1.00 0.00 C ATOM 2397 CG ARG B 60 3.928 2.158 13.784 1.00 0.00 C ATOM 2398 CD ARG B 60 4.804 2.602 14.945 1.00 0.00 C ATOM 2399 NE ARG B 60 4.218 2.258 16.238 1.00 0.00 N ATOM 2400 CZ ARG B 60 4.198 3.083 17.281 1.00 0.00 C ATOM 2401 NH1 ARG B 60 4.725 4.296 17.181 1.00 0.00 N ATOM 2402 NH2 ARG B 60 3.652 2.695 18.426 1.00 0.00 N ATOM 0 H ARG B 60 2.383 1.946 11.403 1.00 0.00 H new ATOM 0 HA ARG B 60 4.073 -0.438 11.513 1.00 0.00 H new ATOM 0 HB2 ARG B 60 4.326 0.071 14.040 1.00 0.00 H new ATOM 0 HB3 ARG B 60 5.406 0.875 12.918 1.00 0.00 H new ATOM 0 HG2 ARG B 60 3.970 2.903 12.990 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.890 2.099 14.112 1.00 0.00 H new ATOM 0 HD2 ARG B 60 5.786 2.136 14.857 1.00 0.00 H new ATOM 0 HD3 ARG B 60 4.957 3.680 14.892 1.00 0.00 H new ATOM 0 HE ARG B 60 3.801 1.334 16.347 1.00 0.00 H new ATOM 0 HH11 ARG B 60 5.147 4.598 16.303 1.00 0.00 H new ATOM 0 HH12 ARG B 60 4.708 4.927 17.982 1.00 0.00 H new ATOM 0 HH21 ARG B 60 3.247 1.763 18.508 1.00 0.00 H new ATOM 0 HH22 ARG B 60 3.638 3.329 19.225 1.00 0.00 H new ATOM 2416 N ASN B 61 1.223 -0.393 11.735 1.00 0.00 N ATOM 2417 CA ASN B 61 -0.050 -0.990 12.113 1.00 0.00 C ATOM 2418 C ASN B 61 -1.127 -0.688 11.078 1.00 0.00 C ATOM 2419 O ASN B 61 -2.316 -0.658 11.394 1.00 0.00 O ATOM 2420 CB ASN B 61 -0.489 -0.486 13.490 1.00 0.00 C ATOM 2421 CG ASN B 61 -1.188 -1.559 14.300 1.00 0.00 C ATOM 2422 OD1 ASN B 61 -1.215 -1.507 15.530 1.00 0.00 O ATOM 2423 ND2 ASN B 61 -1.756 -2.542 13.613 1.00 0.00 N ATOM 0 H ASN B 61 1.258 -0.042 10.778 1.00 0.00 H new ATOM 0 HA ASN B 61 0.087 -2.070 12.158 1.00 0.00 H new ATOM 0 HB2 ASN B 61 0.383 -0.130 14.039 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -1.158 0.366 13.366 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -2.239 -3.294 14.104 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -1.709 -2.545 12.594 1.00 0.00 H new ATOM 2430 N PHE B 62 -0.701 -0.467 9.840 1.00 0.00 N ATOM 2431 CA PHE B 62 -1.626 -0.172 8.757 1.00 0.00 C ATOM 2432 C PHE B 62 -1.673 -1.320 7.753 1.00 0.00 C ATOM 2433 O PHE B 62 -1.184 -2.416 8.024 1.00 0.00 O ATOM 2434 CB PHE B 62 -1.208 1.119 8.053 1.00 0.00 C ATOM 2435 CG PHE B 62 0.005 0.958 7.181 1.00 0.00 C ATOM 2436 CD1 PHE B 62 1.046 0.124 7.560 1.00 0.00 C ATOM 2437 CD2 PHE B 62 0.101 1.638 5.981 1.00 0.00 C ATOM 2438 CE1 PHE B 62 2.158 -0.026 6.755 1.00 0.00 C ATOM 2439 CE2 PHE B 62 1.210 1.493 5.171 1.00 0.00 C ATOM 2440 CZ PHE B 62 2.241 0.659 5.558 1.00 0.00 C ATOM 0 H PHE B 62 0.280 -0.487 9.563 1.00 0.00 H new ATOM 0 HA PHE B 62 -2.622 -0.046 9.181 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -2.038 1.478 7.445 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -1.008 1.885 8.803 1.00 0.00 H new ATOM 0 HD1 PHE B 62 0.986 -0.414 8.495 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -0.702 2.291 5.673 1.00 0.00 H new ATOM 0 HE1 PHE B 62 2.962 -0.678 7.061 1.00 0.00 H new ATOM 0 HE2 PHE B 62 1.271 2.031 4.236 1.00 0.00 H new ATOM 0 HZ PHE B 62 3.109 0.543 4.927 1.00 0.00 H new ATOM 2450 N GLY B 63 -2.262 -1.055 6.592 1.00 0.00 N ATOM 2451 CA GLY B 63 -2.364 -2.066 5.555 1.00 0.00 C ATOM 2452 C GLY B 63 -2.239 -1.467 4.170 1.00 0.00 C ATOM 2453 O GLY B 63 -3.236 -1.273 3.476 1.00 0.00 O ATOM 0 H GLY B 63 -2.673 -0.153 6.350 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -1.584 -2.814 5.699 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.320 -2.581 5.643 1.00 0.00 H new ATOM 2457 N SER B 64 -1.009 -1.162 3.776 1.00 0.00 N ATOM 2458 CA SER B 64 -0.755 -0.566 2.472 1.00 0.00 C ATOM 2459 C SER B 64 -0.987 -1.567 1.344 1.00 0.00 C ATOM 2460 O SER B 64 -0.499 -2.695 1.387 1.00 0.00 O ATOM 2461 CB SER B 64 0.672 -0.022 2.402 1.00 0.00 C ATOM 2462 OG SER B 64 1.600 -1.057 2.127 1.00 0.00 O ATOM 0 H SER B 64 -0.174 -1.317 4.340 1.00 0.00 H new ATOM 0 HA SER B 64 -1.459 0.257 2.344 1.00 0.00 H new ATOM 0 HB2 SER B 64 0.735 0.743 1.628 1.00 0.00 H new ATOM 0 HB3 SER B 64 0.928 0.459 3.346 1.00 0.00 H new ATOM 0 HG SER B 64 2.099 -1.274 2.942 1.00 0.00 H new ATOM 2468 N TYR B 65 -1.732 -1.132 0.333 1.00 0.00 N ATOM 2469 CA TYR B 65 -2.032 -1.970 -0.821 1.00 0.00 C ATOM 2470 C TYR B 65 -2.085 -1.125 -2.089 1.00 0.00 C ATOM 2471 O TYR B 65 -3.162 -0.810 -2.596 1.00 0.00 O ATOM 2472 CB TYR B 65 -3.362 -2.699 -0.621 1.00 0.00 C ATOM 2473 CG TYR B 65 -3.644 -3.750 -1.673 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -3.144 -5.041 -1.543 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -4.411 -3.453 -2.792 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -3.401 -6.005 -2.499 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -4.671 -4.412 -3.753 1.00 0.00 C ATOM 2478 CZ TYR B 65 -4.164 -5.686 -3.602 1.00 0.00 C ATOM 2479 OH TYR B 65 -4.422 -6.643 -4.557 1.00 0.00 O ATOM 0 H TYR B 65 -2.141 -0.198 0.290 1.00 0.00 H new ATOM 0 HA TYR B 65 -1.239 -2.711 -0.924 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -3.363 -3.171 0.361 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -4.171 -1.968 -0.624 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -2.545 -5.294 -0.681 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -4.811 -2.457 -2.913 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -3.006 -7.003 -2.383 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -5.268 -4.165 -4.618 1.00 0.00 H new ATOM 0 HH TYR B 65 -4.974 -6.255 -5.268 1.00 0.00 H new ATOM 2489 N VAL B 66 -0.912 -0.752 -2.590 1.00 0.00 N ATOM 2490 CA VAL B 66 -0.820 0.064 -3.794 1.00 0.00 C ATOM 2491 C VAL B 66 -0.263 -0.739 -4.964 1.00 0.00 C ATOM 2492 O VAL B 66 0.257 -1.840 -4.784 1.00 0.00 O ATOM 2493 CB VAL B 66 0.069 1.301 -3.566 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -0.541 2.210 -2.511 1.00 0.00 C ATOM 2495 CG2 VAL B 66 1.477 0.881 -3.170 1.00 0.00 C ATOM 0 H VAL B 66 -0.012 -1.002 -2.180 1.00 0.00 H new ATOM 0 HA VAL B 66 -1.832 0.390 -4.032 1.00 0.00 H new ATOM 0 HB VAL B 66 0.131 1.859 -4.500 1.00 0.00 H new ATOM 0 HG11 VAL B 66 0.101 3.078 -2.364 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -1.527 2.539 -2.840 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.635 1.665 -1.572 1.00 0.00 H new ATOM 0 HG21 VAL B 66 2.091 1.768 -3.013 1.00 0.00 H new ATOM 0 HG22 VAL B 66 1.438 0.299 -2.249 1.00 0.00 H new ATOM 0 HG23 VAL B 66 1.913 0.274 -3.964 1.00 0.00 H new ATOM 2505 N THR B 67 -0.378 -0.179 -6.164 1.00 0.00 N ATOM 2506 CA THR B 67 0.111 -0.841 -7.367 1.00 0.00 C ATOM 2507 C THR B 67 1.293 -0.082 -7.963 1.00 0.00 C ATOM 2508 O THR B 67 1.261 1.143 -8.077 1.00 0.00 O ATOM 2509 CB THR B 67 -1.010 -0.952 -8.401 1.00 0.00 C ATOM 2510 OG1 THR B 67 -2.161 -1.550 -7.832 1.00 0.00 O ATOM 2511 CG2 THR B 67 -0.624 -1.764 -9.619 1.00 0.00 C ATOM 0 H THR B 67 -0.806 0.732 -6.329 1.00 0.00 H new ATOM 0 HA THR B 67 0.446 -1.841 -7.092 1.00 0.00 H new ATOM 0 HB THR B 67 -1.213 0.071 -8.717 1.00 0.00 H new ATOM 0 HG1 THR B 67 -2.661 -2.024 -8.528 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.465 -1.803 -10.312 1.00 0.00 H new ATOM 0 HG22 THR B 67 0.230 -1.299 -10.111 1.00 0.00 H new ATOM 0 HG23 THR B 67 -0.359 -2.776 -9.313 1.00 0.00 H new ATOM 2519 N HIS B 68 2.332 -0.818 -8.343 1.00 0.00 N ATOM 2520 CA HIS B 68 3.522 -0.211 -8.929 1.00 0.00 C ATOM 2521 C HIS B 68 3.367 -0.061 -10.438 1.00 0.00 C ATOM 2522 O HIS B 68 2.364 -0.482 -11.014 1.00 0.00 O ATOM 2523 CB HIS B 68 4.759 -1.053 -8.612 1.00 0.00 C ATOM 2524 CG HIS B 68 4.778 -2.378 -9.308 1.00 0.00 C ATOM 2525 ND1 HIS B 68 5.729 -3.341 -9.354 1.00 0.00 N flip ATOM 2526 CD2 HIS B 68 3.729 -2.841 -10.075 1.00 0.00 C flip ATOM 2527 CE1 HIS B 68 5.241 -4.357 -10.138 1.00 0.00 C flip ATOM 2528 NE2 HIS B 68 4.034 -4.032 -10.560 1.00 0.00 N flip ATOM 0 H HIS B 68 2.375 -1.833 -8.256 1.00 0.00 H new ATOM 0 HA HIS B 68 3.646 0.781 -8.494 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.651 -0.492 -8.892 1.00 0.00 H new ATOM 0 HB3 HIS B 68 4.810 -1.217 -7.536 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.804 -2.313 -10.251 1.00 0.00 H new ATOM 0 HE1 HIS B 68 5.761 -5.274 -10.372 1.00 0.00 H new ATOM 0 HE2 HIS B 68 3.438 -4.603 -11.159 1.00 0.00 H new ATOM 2537 N GLU B 69 4.363 0.545 -11.072 1.00 0.00 N ATOM 2538 CA GLU B 69 4.336 0.754 -12.513 1.00 0.00 C ATOM 2539 C GLU B 69 5.732 1.065 -13.042 1.00 0.00 C ATOM 2540 O GLU B 69 5.952 2.101 -13.667 1.00 0.00 O ATOM 2541 CB GLU B 69 3.378 1.892 -12.866 1.00 0.00 C ATOM 2542 CG GLU B 69 3.234 2.930 -11.765 1.00 0.00 C ATOM 2543 CD GLU B 69 1.836 3.512 -11.688 1.00 0.00 C ATOM 2544 OE1 GLU B 69 1.526 4.418 -12.490 1.00 0.00 O ATOM 2545 OE2 GLU B 69 1.051 3.061 -10.828 1.00 0.00 O ATOM 0 H GLU B 69 5.200 0.900 -10.610 1.00 0.00 H new ATOM 0 HA GLU B 69 3.985 -0.165 -12.983 1.00 0.00 H new ATOM 0 HB2 GLU B 69 3.729 2.383 -13.773 1.00 0.00 H new ATOM 0 HB3 GLU B 69 2.397 1.473 -13.090 1.00 0.00 H new ATOM 0 HG2 GLU B 69 3.487 2.475 -10.807 1.00 0.00 H new ATOM 0 HG3 GLU B 69 3.949 3.735 -11.934 1.00 0.00 H new ATOM 2552 N THR B 70 6.670 0.160 -12.784 1.00 0.00 N ATOM 2553 CA THR B 70 8.045 0.339 -13.233 1.00 0.00 C ATOM 2554 C THR B 70 8.968 -0.696 -12.592 1.00 0.00 C ATOM 2555 O THR B 70 8.924 -1.877 -12.935 1.00 0.00 O ATOM 2556 CB THR B 70 8.528 1.752 -12.902 1.00 0.00 C ATOM 2557 OG1 THR B 70 9.923 1.869 -13.120 1.00 0.00 O ATOM 2558 CG2 THR B 70 8.251 2.160 -11.471 1.00 0.00 C ATOM 0 H THR B 70 6.503 -0.703 -12.267 1.00 0.00 H new ATOM 0 HA THR B 70 8.072 0.198 -14.313 1.00 0.00 H new ATOM 0 HB THR B 70 7.968 2.411 -13.565 1.00 0.00 H new ATOM 0 HG1 THR B 70 10.125 1.677 -14.060 1.00 0.00 H new ATOM 0 HG21 THR B 70 8.619 3.172 -11.304 1.00 0.00 H new ATOM 0 HG22 THR B 70 7.177 2.129 -11.285 1.00 0.00 H new ATOM 0 HG23 THR B 70 8.757 1.473 -10.792 1.00 0.00 H new ATOM 2566 N LYS B 71 9.801 -0.243 -11.661 1.00 0.00 N ATOM 2567 CA LYS B 71 10.733 -1.128 -10.974 1.00 0.00 C ATOM 2568 C LYS B 71 11.261 -0.470 -9.705 1.00 0.00 C ATOM 2569 O LYS B 71 12.380 -0.741 -9.270 1.00 0.00 O ATOM 2570 CB LYS B 71 11.898 -1.492 -11.896 1.00 0.00 C ATOM 2571 CG LYS B 71 12.116 -0.496 -13.022 1.00 0.00 C ATOM 2572 CD LYS B 71 13.342 0.367 -12.772 1.00 0.00 C ATOM 2573 CE LYS B 71 13.559 1.367 -13.896 1.00 0.00 C ATOM 2574 NZ LYS B 71 13.025 0.868 -15.193 1.00 0.00 N ATOM 0 H LYS B 71 9.849 0.732 -11.365 1.00 0.00 H new ATOM 0 HA LYS B 71 10.200 -2.039 -10.700 1.00 0.00 H new ATOM 0 HB2 LYS B 71 12.810 -1.564 -11.304 1.00 0.00 H new ATOM 0 HB3 LYS B 71 11.717 -2.478 -12.324 1.00 0.00 H new ATOM 0 HG2 LYS B 71 12.232 -1.031 -13.965 1.00 0.00 H new ATOM 0 HG3 LYS B 71 11.236 0.140 -13.122 1.00 0.00 H new ATOM 0 HD2 LYS B 71 13.227 0.899 -11.828 1.00 0.00 H new ATOM 0 HD3 LYS B 71 14.222 -0.269 -12.675 1.00 0.00 H new ATOM 0 HE2 LYS B 71 13.074 2.310 -13.642 1.00 0.00 H new ATOM 0 HE3 LYS B 71 14.624 1.574 -13.997 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 13.353 1.485 -15.964 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 13.363 -0.102 -15.358 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 11.985 0.872 -15.165 1.00 0.00 H new ATOM 2588 N HIS B 72 10.447 0.401 -9.119 1.00 0.00 N ATOM 2589 CA HIS B 72 10.828 1.103 -7.901 1.00 0.00 C ATOM 2590 C HIS B 72 9.748 0.969 -6.833 1.00 0.00 C ATOM 2591 O HIS B 72 9.427 1.933 -6.137 1.00 0.00 O ATOM 2592 CB HIS B 72 11.081 2.580 -8.207 1.00 0.00 C ATOM 2593 CG HIS B 72 11.776 2.811 -9.511 1.00 0.00 C ATOM 2594 ND1 HIS B 72 11.233 3.566 -10.531 1.00 0.00 N ATOM 2595 CD2 HIS B 72 12.978 2.383 -9.963 1.00 0.00 C ATOM 2596 CE1 HIS B 72 12.071 3.591 -11.552 1.00 0.00 C ATOM 2597 NE2 HIS B 72 13.138 2.881 -11.233 1.00 0.00 N ATOM 0 H HIS B 72 9.518 0.637 -9.469 1.00 0.00 H new ATOM 0 HA HIS B 72 11.744 0.652 -7.519 1.00 0.00 H new ATOM 0 HB2 HIS B 72 10.128 3.109 -8.214 1.00 0.00 H new ATOM 0 HB3 HIS B 72 11.679 3.011 -7.405 1.00 0.00 H new ATOM 0 HD2 HIS B 72 13.681 1.765 -9.425 1.00 0.00 H new ATOM 0 HE1 HIS B 72 11.911 4.105 -12.488 1.00 0.00 H new ATOM 0 HE2 HIS B 72 13.949 2.727 -11.832 1.00 0.00 H new ATOM 2606 N PHE B 73 9.195 -0.232 -6.707 1.00 0.00 N ATOM 2607 CA PHE B 73 8.156 -0.497 -5.721 1.00 0.00 C ATOM 2608 C PHE B 73 8.631 -1.541 -4.718 1.00 0.00 C ATOM 2609 O PHE B 73 8.350 -2.729 -4.865 1.00 0.00 O ATOM 2610 CB PHE B 73 6.877 -0.977 -6.411 1.00 0.00 C ATOM 2611 CG PHE B 73 5.901 -1.629 -5.475 1.00 0.00 C ATOM 2612 CD1 PHE B 73 5.427 -0.949 -4.364 1.00 0.00 C ATOM 2613 CD2 PHE B 73 5.462 -2.923 -5.703 1.00 0.00 C ATOM 2614 CE1 PHE B 73 4.532 -1.547 -3.499 1.00 0.00 C ATOM 2615 CE2 PHE B 73 4.567 -3.526 -4.841 1.00 0.00 C ATOM 2616 CZ PHE B 73 4.100 -2.838 -3.737 1.00 0.00 C ATOM 0 H PHE B 73 9.450 -1.039 -7.277 1.00 0.00 H new ATOM 0 HA PHE B 73 7.941 0.430 -5.189 1.00 0.00 H new ATOM 0 HB2 PHE B 73 6.393 -0.128 -6.894 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.141 -1.683 -7.198 1.00 0.00 H new ATOM 0 HD1 PHE B 73 5.761 0.060 -4.173 1.00 0.00 H new ATOM 0 HD2 PHE B 73 5.823 -3.466 -6.564 1.00 0.00 H new ATOM 0 HE1 PHE B 73 4.170 -1.006 -2.637 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.232 -4.535 -5.030 1.00 0.00 H new ATOM 0 HZ PHE B 73 3.400 -3.308 -3.062 1.00 0.00 H new ATOM 2626 N ILE B 74 9.364 -1.091 -3.706 1.00 0.00 N ATOM 2627 CA ILE B 74 9.893 -1.992 -2.691 1.00 0.00 C ATOM 2628 C ILE B 74 9.219 -1.785 -1.339 1.00 0.00 C ATOM 2629 O ILE B 74 9.441 -0.775 -0.670 1.00 0.00 O ATOM 2630 CB ILE B 74 11.409 -1.798 -2.519 1.00 0.00 C ATOM 2631 CG1 ILE B 74 11.963 -2.870 -1.553 1.00 0.00 C ATOM 2632 CG2 ILE B 74 11.695 -0.370 -2.055 1.00 0.00 C ATOM 2633 CD1 ILE B 74 12.862 -2.357 -0.439 1.00 0.00 C ATOM 0 H ILE B 74 9.605 -0.110 -3.567 1.00 0.00 H new ATOM 0 HA ILE B 74 9.685 -3.004 -3.038 1.00 0.00 H new ATOM 0 HB ILE B 74 11.922 -1.932 -3.471 1.00 0.00 H new ATOM 0 HG12 ILE B 74 11.121 -3.395 -1.102 1.00 0.00 H new ATOM 0 HG13 ILE B 74 12.521 -3.603 -2.136 1.00 0.00 H new ATOM 0 HG21 ILE B 74 12.770 -0.235 -1.934 1.00 0.00 H new ATOM 0 HG22 ILE B 74 11.322 0.335 -2.798 1.00 0.00 H new ATOM 0 HG23 ILE B 74 11.197 -0.190 -1.102 1.00 0.00 H new ATOM 0 HD11 ILE B 74 13.192 -3.194 0.177 1.00 0.00 H new ATOM 0 HD12 ILE B 74 13.730 -1.860 -0.872 1.00 0.00 H new ATOM 0 HD13 ILE B 74 12.309 -1.649 0.178 1.00 0.00 H new ATOM 2645 N TYR B 75 8.408 -2.757 -0.936 1.00 0.00 N ATOM 2646 CA TYR B 75 7.714 -2.696 0.344 1.00 0.00 C ATOM 2647 C TYR B 75 8.452 -3.530 1.387 1.00 0.00 C ATOM 2648 O TYR B 75 8.724 -4.710 1.174 1.00 0.00 O ATOM 2649 CB TYR B 75 6.275 -3.192 0.198 1.00 0.00 C ATOM 2650 CG TYR B 75 5.467 -3.080 1.471 1.00 0.00 C ATOM 2651 CD1 TYR B 75 5.557 -1.952 2.276 1.00 0.00 C ATOM 2652 CD2 TYR B 75 4.619 -4.106 1.869 1.00 0.00 C ATOM 2653 CE1 TYR B 75 4.822 -1.846 3.441 1.00 0.00 C ATOM 2654 CE2 TYR B 75 3.880 -4.008 3.032 1.00 0.00 C ATOM 2655 CZ TYR B 75 3.985 -2.877 3.815 1.00 0.00 C ATOM 2656 OH TYR B 75 3.251 -2.775 4.974 1.00 0.00 O ATOM 0 H TYR B 75 8.215 -3.598 -1.479 1.00 0.00 H new ATOM 0 HA TYR B 75 7.693 -1.657 0.674 1.00 0.00 H new ATOM 0 HB2 TYR B 75 5.780 -2.622 -0.588 1.00 0.00 H new ATOM 0 HB3 TYR B 75 6.289 -4.233 -0.124 1.00 0.00 H new ATOM 0 HD1 TYR B 75 6.213 -1.144 1.986 1.00 0.00 H new ATOM 0 HD2 TYR B 75 4.536 -4.994 1.260 1.00 0.00 H new ATOM 0 HE1 TYR B 75 4.902 -0.961 4.055 1.00 0.00 H new ATOM 0 HE2 TYR B 75 3.223 -4.813 3.327 1.00 0.00 H new ATOM 0 HH TYR B 75 3.082 -1.830 5.172 1.00 0.00 H new ATOM 2666 N PHE B 76 8.777 -2.905 2.514 1.00 0.00 N ATOM 2667 CA PHE B 76 9.489 -3.586 3.589 1.00 0.00 C ATOM 2668 C PHE B 76 8.992 -3.123 4.952 1.00 0.00 C ATOM 2669 O PHE B 76 8.240 -2.156 5.055 1.00 0.00 O ATOM 2670 CB PHE B 76 10.992 -3.321 3.475 1.00 0.00 C ATOM 2671 CG PHE B 76 11.327 -1.879 3.219 1.00 0.00 C ATOM 2672 CD1 PHE B 76 11.026 -1.291 2.002 1.00 0.00 C ATOM 2673 CD2 PHE B 76 11.946 -1.112 4.194 1.00 0.00 C ATOM 2674 CE1 PHE B 76 11.333 0.034 1.760 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.255 0.215 3.959 1.00 0.00 C ATOM 2676 CZ PHE B 76 11.948 0.788 2.740 1.00 0.00 C ATOM 0 H PHE B 76 8.558 -1.927 2.706 1.00 0.00 H new ATOM 0 HA PHE B 76 9.299 -4.655 3.495 1.00 0.00 H new ATOM 0 HB2 PHE B 76 11.481 -3.642 4.395 1.00 0.00 H new ATOM 0 HB3 PHE B 76 11.400 -3.930 2.668 1.00 0.00 H new ATOM 0 HD1 PHE B 76 10.545 -1.876 1.232 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.190 -1.556 5.148 1.00 0.00 H new ATOM 0 HE1 PHE B 76 11.092 0.479 0.806 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.736 0.803 4.727 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.189 1.824 2.554 1.00 0.00 H new ATOM 2686 N TYR B 77 9.425 -3.818 5.997 1.00 0.00 N ATOM 2687 CA TYR B 77 9.034 -3.473 7.357 1.00 0.00 C ATOM 2688 C TYR B 77 10.250 -3.451 8.276 1.00 0.00 C ATOM 2689 O TYR B 77 10.904 -4.472 8.482 1.00 0.00 O ATOM 2690 CB TYR B 77 7.996 -4.465 7.885 1.00 0.00 C ATOM 2691 CG TYR B 77 7.536 -4.167 9.294 1.00 0.00 C ATOM 2692 CD1 TYR B 77 8.243 -4.640 10.392 1.00 0.00 C ATOM 2693 CD2 TYR B 77 6.393 -3.411 9.525 1.00 0.00 C ATOM 2694 CE1 TYR B 77 7.824 -4.368 11.681 1.00 0.00 C ATOM 2695 CE2 TYR B 77 5.969 -3.135 10.811 1.00 0.00 C ATOM 2696 CZ TYR B 77 6.687 -3.616 11.884 1.00 0.00 C ATOM 2697 OH TYR B 77 6.267 -3.343 13.166 1.00 0.00 O ATOM 0 H TYR B 77 10.047 -4.624 5.928 1.00 0.00 H new ATOM 0 HA TYR B 77 8.591 -2.477 7.341 1.00 0.00 H new ATOM 0 HB2 TYR B 77 7.132 -4.461 7.221 1.00 0.00 H new ATOM 0 HB3 TYR B 77 8.417 -5.470 7.854 1.00 0.00 H new ATOM 0 HD1 TYR B 77 9.134 -5.230 10.236 1.00 0.00 H new ATOM 0 HD2 TYR B 77 5.827 -3.033 8.686 1.00 0.00 H new ATOM 0 HE1 TYR B 77 8.385 -4.743 12.525 1.00 0.00 H new ATOM 0 HE2 TYR B 77 5.079 -2.545 10.974 1.00 0.00 H new ATOM 0 HH TYR B 77 5.451 -2.801 13.135 1.00 0.00 H new ATOM 2707 N LEU B 78 10.545 -2.279 8.825 1.00 0.00 N ATOM 2708 CA LEU B 78 11.683 -2.117 9.721 1.00 0.00 C ATOM 2709 C LEU B 78 11.437 -2.843 11.042 1.00 0.00 C ATOM 2710 O LEU B 78 10.317 -3.265 11.329 1.00 0.00 O ATOM 2711 CB LEU B 78 11.938 -0.627 9.983 1.00 0.00 C ATOM 2712 CG LEU B 78 12.641 0.151 8.858 1.00 0.00 C ATOM 2713 CD1 LEU B 78 14.149 0.100 9.036 1.00 0.00 C ATOM 2714 CD2 LEU B 78 12.250 -0.374 7.479 1.00 0.00 C ATOM 0 H LEU B 78 10.011 -1.425 8.665 1.00 0.00 H new ATOM 0 HA LEU B 78 12.561 -2.553 9.244 1.00 0.00 H new ATOM 0 HB2 LEU B 78 10.981 -0.146 10.185 1.00 0.00 H new ATOM 0 HB3 LEU B 78 12.538 -0.536 10.889 1.00 0.00 H new ATOM 0 HG LEU B 78 12.313 1.188 8.922 1.00 0.00 H new ATOM 0 HD11 LEU B 78 14.629 0.656 8.231 1.00 0.00 H new ATOM 0 HD12 LEU B 78 14.417 0.545 9.994 1.00 0.00 H new ATOM 0 HD13 LEU B 78 14.483 -0.937 9.011 1.00 0.00 H new ATOM 0 HD21 LEU B 78 12.767 0.201 6.711 1.00 0.00 H new ATOM 0 HD22 LEU B 78 12.530 -1.424 7.397 1.00 0.00 H new ATOM 0 HD23 LEU B 78 11.173 -0.274 7.344 1.00 0.00 H new ATOM 2726 N GLY B 79 12.492 -2.985 11.837 1.00 0.00 N ATOM 2727 CA GLY B 79 12.377 -3.663 13.118 1.00 0.00 C ATOM 2728 C GLY B 79 10.997 -3.536 13.732 1.00 0.00 C ATOM 2729 O GLY B 79 10.423 -4.522 14.193 1.00 0.00 O ATOM 0 H GLY B 79 13.427 -2.642 11.618 1.00 0.00 H new ATOM 0 HA2 GLY B 79 12.615 -4.719 12.987 1.00 0.00 H new ATOM 0 HA3 GLY B 79 13.115 -3.253 13.808 1.00 0.00 H new ATOM 2733 N GLN B 80 10.461 -2.320 13.741 1.00 0.00 N ATOM 2734 CA GLN B 80 9.141 -2.070 14.306 1.00 0.00 C ATOM 2735 C GLN B 80 8.390 -1.020 13.495 1.00 0.00 C ATOM 2736 O GLN B 80 7.538 -0.305 14.023 1.00 0.00 O ATOM 2737 CB GLN B 80 9.265 -1.615 15.761 1.00 0.00 C ATOM 2738 CG GLN B 80 8.295 -2.310 16.701 1.00 0.00 C ATOM 2739 CD GLN B 80 8.249 -1.663 18.073 1.00 0.00 C ATOM 2740 OE1 GLN B 80 9.246 -1.120 18.548 1.00 0.00 O ATOM 2741 NE2 GLN B 80 7.090 -1.721 18.716 1.00 0.00 N ATOM 0 H GLN B 80 10.921 -1.492 13.363 1.00 0.00 H new ATOM 0 HA GLN B 80 8.576 -3.001 14.270 1.00 0.00 H new ATOM 0 HB2 GLN B 80 10.283 -1.797 16.104 1.00 0.00 H new ATOM 0 HB3 GLN B 80 9.099 -0.539 15.812 1.00 0.00 H new ATOM 0 HG2 GLN B 80 7.297 -2.296 16.263 1.00 0.00 H new ATOM 0 HG3 GLN B 80 8.583 -3.356 16.806 1.00 0.00 H new ATOM 0 HE21 GLN B 80 6.289 -2.182 18.283 1.00 0.00 H new ATOM 0 HE22 GLN B 80 7.000 -1.305 19.643 1.00 0.00 H new ATOM 2750 N VAL B 81 8.715 -0.931 12.211 1.00 0.00 N ATOM 2751 CA VAL B 81 8.076 0.032 11.324 1.00 0.00 C ATOM 2752 C VAL B 81 7.924 -0.540 9.920 1.00 0.00 C ATOM 2753 O VAL B 81 8.458 -1.603 9.614 1.00 0.00 O ATOM 2754 CB VAL B 81 8.879 1.344 11.250 1.00 0.00 C ATOM 2755 CG1 VAL B 81 8.130 2.382 10.429 1.00 0.00 C ATOM 2756 CG2 VAL B 81 9.174 1.868 12.647 1.00 0.00 C ATOM 0 H VAL B 81 9.419 -1.516 11.760 1.00 0.00 H new ATOM 0 HA VAL B 81 7.090 0.243 11.737 1.00 0.00 H new ATOM 0 HB VAL B 81 9.829 1.141 10.756 1.00 0.00 H new ATOM 0 HG11 VAL B 81 8.712 3.302 10.388 1.00 0.00 H new ATOM 0 HG12 VAL B 81 7.976 2.004 9.418 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.164 2.584 10.892 1.00 0.00 H new ATOM 0 HG21 VAL B 81 9.742 2.796 12.575 1.00 0.00 H new ATOM 0 HG22 VAL B 81 8.237 2.056 13.170 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.755 1.128 13.198 1.00 0.00 H new ATOM 2766 N ALA B 82 7.192 0.169 9.068 1.00 0.00 N ATOM 2767 CA ALA B 82 6.977 -0.275 7.698 1.00 0.00 C ATOM 2768 C ALA B 82 7.225 0.862 6.713 1.00 0.00 C ATOM 2769 O ALA B 82 6.949 2.023 7.012 1.00 0.00 O ATOM 2770 CB ALA B 82 5.570 -0.828 7.536 1.00 0.00 C ATOM 0 H ALA B 82 6.739 1.052 9.302 1.00 0.00 H new ATOM 0 HA ALA B 82 7.689 -1.071 7.480 1.00 0.00 H new ATOM 0 HB1 ALA B 82 5.424 -1.156 6.507 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.432 -1.674 8.209 1.00 0.00 H new ATOM 0 HB3 ALA B 82 4.844 -0.051 7.776 1.00 0.00 H new ATOM 2776 N ILE B 83 7.753 0.522 5.543 1.00 0.00 N ATOM 2777 CA ILE B 83 8.044 1.517 4.516 1.00 0.00 C ATOM 2778 C ILE B 83 7.759 0.969 3.123 1.00 0.00 C ATOM 2779 O ILE B 83 8.512 0.146 2.604 1.00 0.00 O ATOM 2780 CB ILE B 83 9.515 1.976 4.569 1.00 0.00 C ATOM 2781 CG1 ILE B 83 10.147 1.617 5.919 1.00 0.00 C ATOM 2782 CG2 ILE B 83 9.615 3.472 4.301 1.00 0.00 C ATOM 2783 CD1 ILE B 83 9.694 2.497 7.064 1.00 0.00 C ATOM 0 H ILE B 83 7.989 -0.435 5.281 1.00 0.00 H new ATOM 0 HA ILE B 83 7.394 2.369 4.718 1.00 0.00 H new ATOM 0 HB ILE B 83 10.069 1.452 3.790 1.00 0.00 H new ATOM 0 HG12 ILE B 83 9.910 0.580 6.155 1.00 0.00 H new ATOM 0 HG13 ILE B 83 11.231 1.683 5.830 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.660 3.780 4.342 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.210 3.693 3.313 1.00 0.00 H new ATOM 0 HG23 ILE B 83 9.047 4.016 5.056 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.186 2.179 7.984 1.00 0.00 H new ATOM 0 HD12 ILE B 83 9.956 3.534 6.852 1.00 0.00 H new ATOM 0 HD13 ILE B 83 8.614 2.413 7.182 1.00 0.00 H new ATOM 2795 N LEU B 84 6.672 1.434 2.517 1.00 0.00 N ATOM 2796 CA LEU B 84 6.296 0.991 1.181 1.00 0.00 C ATOM 2797 C LEU B 84 6.763 1.999 0.129 1.00 0.00 C ATOM 2798 O LEU B 84 6.240 3.110 0.044 1.00 0.00 O ATOM 2799 CB LEU B 84 4.775 0.771 1.103 1.00 0.00 C ATOM 2800 CG LEU B 84 3.986 1.806 0.294 1.00 0.00 C ATOM 2801 CD1 LEU B 84 3.923 1.400 -1.170 1.00 0.00 C ATOM 2802 CD2 LEU B 84 2.586 1.975 0.864 1.00 0.00 C ATOM 0 H LEU B 84 6.037 2.117 2.930 1.00 0.00 H new ATOM 0 HA LEU B 84 6.789 0.041 0.974 1.00 0.00 H new ATOM 0 HB2 LEU B 84 4.592 -0.213 0.672 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.378 0.753 2.118 1.00 0.00 H new ATOM 0 HG LEU B 84 4.501 2.764 0.363 1.00 0.00 H new ATOM 0 HD11 LEU B 84 3.359 2.146 -1.730 1.00 0.00 H new ATOM 0 HD12 LEU B 84 4.934 1.331 -1.572 1.00 0.00 H new ATOM 0 HD13 LEU B 84 3.431 0.431 -1.258 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.041 2.714 0.277 1.00 0.00 H new ATOM 0 HD22 LEU B 84 2.060 1.021 0.826 1.00 0.00 H new ATOM 0 HD23 LEU B 84 2.653 2.311 1.899 1.00 0.00 H new ATOM 2814 N LEU B 85 7.754 1.606 -0.665 1.00 0.00 N ATOM 2815 CA LEU B 85 8.292 2.478 -1.705 1.00 0.00 C ATOM 2816 C LEU B 85 7.854 2.011 -3.085 1.00 0.00 C ATOM 2817 O LEU B 85 8.068 0.860 -3.460 1.00 0.00 O ATOM 2818 CB LEU B 85 9.818 2.516 -1.632 1.00 0.00 C ATOM 2819 CG LEU B 85 10.403 3.841 -1.149 1.00 0.00 C ATOM 2820 CD1 LEU B 85 10.078 4.055 0.317 1.00 0.00 C ATOM 2821 CD2 LEU B 85 11.906 3.879 -1.381 1.00 0.00 C ATOM 0 H LEU B 85 8.201 0.691 -0.609 1.00 0.00 H new ATOM 0 HA LEU B 85 7.902 3.482 -1.537 1.00 0.00 H new ATOM 0 HB2 LEU B 85 10.156 1.722 -0.966 1.00 0.00 H new ATOM 0 HB3 LEU B 85 10.221 2.296 -2.621 1.00 0.00 H new ATOM 0 HG LEU B 85 9.952 4.651 -1.723 1.00 0.00 H new ATOM 0 HD11 LEU B 85 10.501 5.003 0.649 1.00 0.00 H new ATOM 0 HD12 LEU B 85 8.996 4.073 0.451 1.00 0.00 H new ATOM 0 HD13 LEU B 85 10.503 3.242 0.906 1.00 0.00 H new ATOM 0 HD21 LEU B 85 12.304 4.831 -1.030 1.00 0.00 H new ATOM 0 HD22 LEU B 85 12.379 3.064 -0.834 1.00 0.00 H new ATOM 0 HD23 LEU B 85 12.113 3.769 -2.446 1.00 0.00 H new ATOM 2833 N PHE B 86 7.240 2.916 -3.837 1.00 0.00 N ATOM 2834 CA PHE B 86 6.773 2.595 -5.181 1.00 0.00 C ATOM 2835 C PHE B 86 6.758 3.834 -6.076 1.00 0.00 C ATOM 2836 O PHE B 86 6.055 4.806 -5.799 1.00 0.00 O ATOM 2837 CB PHE B 86 5.380 1.952 -5.122 1.00 0.00 C ATOM 2838 CG PHE B 86 4.242 2.929 -5.227 1.00 0.00 C ATOM 2839 CD1 PHE B 86 3.868 3.442 -6.458 1.00 0.00 C ATOM 2840 CD2 PHE B 86 3.546 3.329 -4.098 1.00 0.00 C ATOM 2841 CE1 PHE B 86 2.821 4.337 -6.562 1.00 0.00 C ATOM 2842 CE2 PHE B 86 2.498 4.224 -4.196 1.00 0.00 C ATOM 2843 CZ PHE B 86 2.134 4.729 -5.429 1.00 0.00 C ATOM 0 H PHE B 86 7.054 3.874 -3.541 1.00 0.00 H new ATOM 0 HA PHE B 86 7.470 1.880 -5.618 1.00 0.00 H new ATOM 0 HB2 PHE B 86 5.294 1.224 -5.929 1.00 0.00 H new ATOM 0 HB3 PHE B 86 5.286 1.402 -4.186 1.00 0.00 H new ATOM 0 HD1 PHE B 86 4.401 3.139 -7.347 1.00 0.00 H new ATOM 0 HD2 PHE B 86 3.825 2.937 -3.131 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.540 4.730 -7.528 1.00 0.00 H new ATOM 0 HE2 PHE B 86 1.963 4.529 -3.308 1.00 0.00 H new ATOM 0 HZ PHE B 86 1.315 5.428 -5.507 1.00 0.00 H new ATOM 2853 N LYS B 87 7.538 3.784 -7.153 1.00 0.00 N ATOM 2854 CA LYS B 87 7.622 4.893 -8.098 1.00 0.00 C ATOM 2855 C LYS B 87 6.700 4.658 -9.291 1.00 0.00 C ATOM 2856 O LYS B 87 6.237 3.541 -9.521 1.00 0.00 O ATOM 2857 CB LYS B 87 9.063 5.066 -8.581 1.00 0.00 C ATOM 2858 CG LYS B 87 9.603 6.469 -8.385 1.00 0.00 C ATOM 2859 CD LYS B 87 11.042 6.576 -8.856 1.00 0.00 C ATOM 2860 CE LYS B 87 11.139 7.259 -10.211 1.00 0.00 C ATOM 2861 NZ LYS B 87 10.088 6.783 -11.153 1.00 0.00 N ATOM 0 H LYS B 87 8.123 2.984 -7.393 1.00 0.00 H new ATOM 0 HA LYS B 87 7.304 5.802 -7.587 1.00 0.00 H new ATOM 0 HB2 LYS B 87 9.703 4.362 -8.049 1.00 0.00 H new ATOM 0 HB3 LYS B 87 9.116 4.809 -9.639 1.00 0.00 H new ATOM 0 HG2 LYS B 87 8.985 7.179 -8.934 1.00 0.00 H new ATOM 0 HG3 LYS B 87 9.542 6.741 -7.331 1.00 0.00 H new ATOM 0 HD2 LYS B 87 11.624 7.135 -8.124 1.00 0.00 H new ATOM 0 HD3 LYS B 87 11.480 5.580 -8.918 1.00 0.00 H new ATOM 0 HE2 LYS B 87 11.047 8.337 -10.081 1.00 0.00 H new ATOM 0 HE3 LYS B 87 12.123 7.072 -10.641 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 10.261 7.183 -12.097 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 10.114 5.745 -11.207 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 9.154 7.088 -10.814 1.00 0.00 H new ATOM 2875 N SER B 88 6.440 5.719 -10.048 1.00 0.00 N ATOM 2876 CA SER B 88 5.576 5.630 -11.218 1.00 0.00 C ATOM 2877 C SER B 88 6.337 6.011 -12.476 1.00 0.00 C ATOM 2878 O SER B 88 5.748 6.339 -13.506 1.00 0.00 O ATOM 2879 CB SER B 88 4.361 6.537 -11.049 1.00 0.00 C ATOM 2880 OG SER B 88 3.171 5.779 -10.918 1.00 0.00 O ATOM 0 H SER B 88 6.816 6.651 -9.871 1.00 0.00 H new ATOM 0 HA SER B 88 5.237 4.599 -11.315 1.00 0.00 H new ATOM 0 HB2 SER B 88 4.493 7.167 -10.169 1.00 0.00 H new ATOM 0 HB3 SER B 88 4.279 7.203 -11.908 1.00 0.00 H new ATOM 0 HG SER B 88 2.710 5.742 -11.782 1.00 0.00 H new ATOM 2886 N GLY B 89 7.653 5.962 -12.375 1.00 0.00 N ATOM 2887 CA GLY B 89 8.504 6.302 -13.501 1.00 0.00 C ATOM 2888 C GLY B 89 8.313 7.735 -13.960 1.00 0.00 C ATOM 2889 O GLY B 89 7.986 8.591 -13.111 1.00 0.00 O ATOM 2890 OXT GLY B 89 8.490 8.000 -15.167 1.00 0.00 O ATOM 0 H GLY B 89 8.154 5.691 -11.529 1.00 0.00 H new ATOM 0 HA2 GLY B 89 9.547 6.148 -13.224 1.00 0.00 H new ATOM 0 HA3 GLY B 89 8.292 5.627 -14.330 1.00 0.00 H new TER 2894 GLY B 89