USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1668 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 ALA N :NH3+ -171:sc= 0 (180deg=-0.0711) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ -167:sc= -0.219 (180deg=-0.89) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 CYS SG : rot -32:sc= -2.33 USER MOD Single : A 18 LYS NZ :NH3+ -157:sc= -0.239 (180deg=-1.19!) USER MOD Single : A 19 SER OG : rot -54:sc= 0.0183 USER MOD Single : A 21 SER OG : rot 100:sc= 0.676 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.0667 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= -1.76 USER MOD Single : A 40 TYR OH : rot 180:sc= -0.191 USER MOD Single : A 42 LYS NZ :NH3+ 150:sc= 0.633 (180deg=-1.21!) USER MOD Single : A 43 MET CE :methyl -169:sc= -0.126 (180deg=-0.192) USER MOD Single : A 45 MET CE :methyl -178:sc= 0 (180deg=-0.00443) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= -3.78! K(o=-3.8!,f=-0.8) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -113:sc= 0.0531 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -0.0115 X(o=-0.012,f=-0.2) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 149:sc= -1.67! (180deg=-2.42!) USER MOD Single : A 79 ASN : amide:sc= -5.15 K(o=-5.1,f=-3.8!) USER MOD Single : A 80 MET CE :methyl -166:sc= -0.141 (180deg=-0.323) USER MOD Single : A 82 GLN : amide:sc= -0.362 X(o=-0.36,f=0) USER MOD Single : A 84 LYS NZ :NH3+ -148:sc= -0.179 (180deg=-0.847) USER MOD Single : A 86 LYS NZ :NH3+ -153:sc= -0.0418 (180deg=-0.317) USER MOD Single : A 88 ASN : amide:sc= -5.18! C(o=-5.2!,f=-10!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= -0.25 USER MOD Single : A 95 GLN : amide:sc= -0.205 K(o=-0.21,f=-1.9!) USER MOD Single : B 1 ALA N :NH3+ -170:sc= 0 (180deg=-0.0911) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 SER OG : rot 73:sc= 0.356 USER MOD Single : B 6 LYS NZ :NH3+ -163:sc= -0.197 (180deg=-0.92) USER MOD Single : B 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 17 CYS SG : rot -37:sc= -1.45 USER MOD Single : B 18 LYS NZ :NH3+ -142:sc= -0.188 (180deg=-1.18!) USER MOD Single : B 19 SER OG : rot -53:sc= 0.0153 USER MOD Single : B 21 SER OG : rot 125:sc= 0.669 USER MOD Single : B 23 LYS NZ :NH3+ 155:sc= -0.0229 (180deg=-0.138) USER MOD Single : B 24 THR OG1 : rot 180:sc= -0.0587 USER MOD Single : B 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= -0.0214 X(o=-0.021,f=-0.075) USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 34 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 THR OG1 : rot 180:sc= -0.63 USER MOD Single : B 40 TYR OH : rot 180:sc= -0.168 USER MOD Single : B 42 LYS NZ :NH3+ 136:sc= 0.0186 (180deg=-3.2!) USER MOD Single : B 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 45 MET CE :methyl 175:sc= 0 (180deg=-0.0363) USER MOD Single : B 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 GLN : amide:sc= -0.697 X(o=-0.7,f=-0.67) USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 THR OG1 : rot 180:sc= 0.00901 USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 LYS NZ :NH3+ -113:sc= 0.0472 (180deg=0) USER MOD Single : B 74 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : B 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 78 LYS NZ :NH3+ -104:sc= -1.7! (180deg=-2.88!) USER MOD Single : B 79 ASN : amide:sc= -6.77! C(o=-6.8!,f=-5.8!) USER MOD Single : B 80 MET CE :methyl -164:sc= -0.0151 (180deg=-0.212) USER MOD Single : B 82 GLN : amide:sc= -0.268 X(o=-0.27,f=0) USER MOD Single : B 84 LYS NZ :NH3+ -144:sc= -0.237 (180deg=-1.2!) USER MOD Single : B 86 LYS NZ :NH3+ -153:sc= -0.0111 (180deg=-0.27) USER MOD Single : B 88 ASN : amide:sc= -4.85! C(o=-4.8!,f=-9.5!) USER MOD Single : B 89 SER OG : rot 180:sc= 0 USER MOD Single : B 92 SER OG : rot -33:sc= -1.37! USER MOD Single : B 95 GLN : amide:sc= -0.388 K(o=-0.39,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -8.907 12.452 6.161 1.00 5.35 N ATOM 2 CA ALA A 1 -9.853 11.584 6.918 1.00 4.76 C ATOM 3 C ALA A 1 -11.213 11.580 6.218 1.00 4.12 C ATOM 4 O ALA A 1 -11.866 10.560 6.118 1.00 3.94 O ATOM 5 CB ALA A 1 -10.012 12.124 8.341 1.00 4.81 C ATOM 0 H1 ALA A 1 -7.947 12.337 6.545 1.00 5.35 H new ATOM 0 H2 ALA A 1 -8.914 12.180 5.157 1.00 5.35 H new ATOM 0 H3 ALA A 1 -9.199 13.446 6.252 1.00 5.35 H new ATOM 0 HA ALA A 1 -9.462 10.567 6.957 1.00 4.76 H new ATOM 0 HB1 ALA A 1 -10.704 11.490 8.896 1.00 4.81 H new ATOM 0 HB2 ALA A 1 -9.043 12.127 8.840 1.00 4.81 H new ATOM 0 HB3 ALA A 1 -10.403 13.141 8.303 1.00 4.81 H new ATOM 13 N LYS A 2 -11.646 12.712 5.735 1.00 4.22 N ATOM 14 CA LYS A 2 -12.964 12.772 5.043 1.00 4.07 C ATOM 15 C LYS A 2 -12.762 12.557 3.541 1.00 3.66 C ATOM 16 O LYS A 2 -11.790 13.004 2.966 1.00 4.35 O ATOM 17 CB LYS A 2 -13.603 14.141 5.279 1.00 4.82 C ATOM 18 CG LYS A 2 -13.805 14.359 6.781 1.00 5.66 C ATOM 19 CD LYS A 2 -14.373 15.758 7.023 1.00 6.60 C ATOM 20 CE LYS A 2 -14.289 16.094 8.513 1.00 7.50 C ATOM 21 NZ LYS A 2 -12.956 16.686 8.814 1.00 7.90 N ATOM 0 H LYS A 2 -11.144 13.598 5.790 1.00 4.22 H new ATOM 0 HA LYS A 2 -13.616 11.993 5.438 1.00 4.07 H new ATOM 0 HB2 LYS A 2 -12.968 14.926 4.869 1.00 4.82 H new ATOM 0 HB3 LYS A 2 -14.560 14.202 4.760 1.00 4.82 H new ATOM 0 HG2 LYS A 2 -14.484 13.606 7.180 1.00 5.66 H new ATOM 0 HG3 LYS A 2 -12.857 14.244 7.306 1.00 5.66 H new ATOM 0 HD2 LYS A 2 -13.816 16.493 6.442 1.00 6.60 H new ATOM 0 HD3 LYS A 2 -15.409 15.804 6.687 1.00 6.60 H new ATOM 0 HE2 LYS A 2 -15.079 16.794 8.784 1.00 7.50 H new ATOM 0 HE3 LYS A 2 -14.442 15.194 9.109 1.00 7.50 H new ATOM 0 HZ1 LYS A 2 -12.898 16.915 9.827 1.00 7.90 H new ATOM 0 HZ2 LYS A 2 -12.210 16.004 8.570 1.00 7.90 H new ATOM 0 HZ3 LYS A 2 -12.827 17.554 8.255 1.00 7.90 H new ATOM 35 N LYS A 3 -13.672 11.874 2.901 1.00 2.85 N ATOM 36 CA LYS A 3 -13.540 11.627 1.447 1.00 2.88 C ATOM 37 C LYS A 3 -14.794 10.898 0.988 1.00 2.35 C ATOM 38 O LYS A 3 -15.362 11.207 -0.041 1.00 2.83 O ATOM 39 CB LYS A 3 -12.309 10.758 1.179 1.00 3.31 C ATOM 40 CG LYS A 3 -11.319 11.529 0.302 1.00 3.76 C ATOM 41 CD LYS A 3 -10.019 10.732 0.180 1.00 4.46 C ATOM 42 CE LYS A 3 -9.619 10.628 -1.293 1.00 5.18 C ATOM 43 NZ LYS A 3 -8.369 9.827 -1.412 1.00 5.69 N ATOM 0 H LYS A 3 -14.506 11.475 3.332 1.00 2.85 H new ATOM 0 HA LYS A 3 -13.424 12.567 0.908 1.00 2.88 H new ATOM 0 HB2 LYS A 3 -11.836 10.479 2.121 1.00 3.31 H new ATOM 0 HB3 LYS A 3 -12.605 9.833 0.685 1.00 3.31 H new ATOM 0 HG2 LYS A 3 -11.748 11.700 -0.686 1.00 3.76 H new ATOM 0 HG3 LYS A 3 -11.118 12.509 0.736 1.00 3.76 H new ATOM 0 HD2 LYS A 3 -9.227 11.219 0.749 1.00 4.46 H new ATOM 0 HD3 LYS A 3 -10.150 9.736 0.603 1.00 4.46 H new ATOM 0 HE2 LYS A 3 -10.419 10.160 -1.866 1.00 5.18 H new ATOM 0 HE3 LYS A 3 -9.467 11.623 -1.711 1.00 5.18 H new ATOM 0 HZ1 LYS A 3 -8.096 9.756 -2.413 1.00 5.69 H new ATOM 0 HZ2 LYS A 3 -7.607 10.291 -0.878 1.00 5.69 H new ATOM 0 HZ3 LYS A 3 -8.530 8.874 -1.028 1.00 5.69 H new ATOM 57 N LYS A 4 -15.235 9.940 1.766 1.00 1.83 N ATOM 58 CA LYS A 4 -16.463 9.184 1.403 1.00 1.71 C ATOM 59 C LYS A 4 -16.431 8.875 -0.088 1.00 1.52 C ATOM 60 O LYS A 4 -15.749 7.976 -0.541 1.00 2.02 O ATOM 61 CB LYS A 4 -17.692 10.041 1.724 1.00 2.12 C ATOM 62 CG LYS A 4 -18.053 9.882 3.201 1.00 2.54 C ATOM 63 CD LYS A 4 -18.722 11.164 3.703 1.00 3.17 C ATOM 64 CE LYS A 4 -19.117 10.996 5.172 1.00 3.65 C ATOM 65 NZ LYS A 4 -20.539 11.404 5.354 1.00 4.24 N ATOM 0 H LYS A 4 -14.792 9.652 2.639 1.00 1.83 H new ATOM 0 HA LYS A 4 -16.511 8.253 1.968 1.00 1.71 H new ATOM 0 HB2 LYS A 4 -17.487 11.088 1.499 1.00 2.12 H new ATOM 0 HB3 LYS A 4 -18.532 9.739 1.099 1.00 2.12 H new ATOM 0 HG2 LYS A 4 -18.724 9.033 3.333 1.00 2.54 H new ATOM 0 HG3 LYS A 4 -17.157 9.674 3.785 1.00 2.54 H new ATOM 0 HD2 LYS A 4 -18.041 12.008 3.593 1.00 3.17 H new ATOM 0 HD3 LYS A 4 -19.604 11.385 3.102 1.00 3.17 H new ATOM 0 HE2 LYS A 4 -18.983 9.959 5.479 1.00 3.65 H new ATOM 0 HE3 LYS A 4 -18.470 11.602 5.805 1.00 3.65 H new ATOM 0 HZ1 LYS A 4 -20.808 11.290 6.352 1.00 4.24 H new ATOM 0 HZ2 LYS A 4 -20.653 12.400 5.076 1.00 4.24 H new ATOM 0 HZ3 LYS A 4 -21.150 10.807 4.761 1.00 4.24 H new ATOM 79 N SER A 5 -17.161 9.626 -0.847 1.00 1.49 N ATOM 80 CA SER A 5 -17.192 9.414 -2.313 1.00 1.72 C ATOM 81 C SER A 5 -17.474 7.948 -2.624 1.00 1.51 C ATOM 82 O SER A 5 -18.612 7.540 -2.724 1.00 1.76 O ATOM 83 CB SER A 5 -15.855 9.814 -2.913 1.00 2.08 C ATOM 84 OG SER A 5 -15.872 11.203 -3.219 1.00 2.67 O ATOM 0 H SER A 5 -17.747 10.390 -0.511 1.00 1.49 H new ATOM 0 HA SER A 5 -17.983 10.027 -2.745 1.00 1.72 H new ATOM 0 HB2 SER A 5 -15.049 9.594 -2.213 1.00 2.08 H new ATOM 0 HB3 SER A 5 -15.660 9.234 -3.815 1.00 2.08 H new ATOM 0 HG SER A 5 -15.010 11.464 -3.605 1.00 2.67 H new ATOM 90 N LYS A 6 -16.446 7.158 -2.785 1.00 1.38 N ATOM 91 CA LYS A 6 -16.642 5.713 -3.104 1.00 1.30 C ATOM 92 C LYS A 6 -15.966 4.856 -2.037 1.00 1.16 C ATOM 93 O LYS A 6 -15.995 3.642 -2.090 1.00 1.17 O ATOM 94 CB LYS A 6 -16.026 5.427 -4.477 1.00 1.59 C ATOM 95 CG LYS A 6 -14.582 4.925 -4.330 1.00 2.31 C ATOM 96 CD LYS A 6 -13.881 5.002 -5.688 1.00 2.60 C ATOM 97 CE LYS A 6 -12.518 4.314 -5.598 1.00 3.41 C ATOM 98 NZ LYS A 6 -11.950 4.514 -4.235 1.00 3.78 N ATOM 0 H LYS A 6 -15.473 7.453 -2.709 1.00 1.38 H new ATOM 0 HA LYS A 6 -17.705 5.474 -3.122 1.00 1.30 H new ATOM 0 HB2 LYS A 6 -16.624 4.681 -5.001 1.00 1.59 H new ATOM 0 HB3 LYS A 6 -16.042 6.332 -5.084 1.00 1.59 H new ATOM 0 HG2 LYS A 6 -14.047 5.529 -3.597 1.00 2.31 H new ATOM 0 HG3 LYS A 6 -14.577 3.899 -3.962 1.00 2.31 H new ATOM 0 HD2 LYS A 6 -14.492 4.523 -6.453 1.00 2.60 H new ATOM 0 HD3 LYS A 6 -13.756 6.043 -5.986 1.00 2.60 H new ATOM 0 HE2 LYS A 6 -12.621 3.249 -5.808 1.00 3.41 H new ATOM 0 HE3 LYS A 6 -11.842 4.723 -6.349 1.00 3.41 H new ATOM 0 HZ1 LYS A 6 -10.945 4.245 -4.235 1.00 3.78 H new ATOM 0 HZ2 LYS A 6 -12.041 5.514 -3.964 1.00 3.78 H new ATOM 0 HZ3 LYS A 6 -12.467 3.923 -3.553 1.00 3.78 H new ATOM 112 N LEU A 7 -15.337 5.475 -1.083 1.00 1.10 N ATOM 113 CA LEU A 7 -14.639 4.690 -0.026 1.00 1.09 C ATOM 114 C LEU A 7 -15.536 4.514 1.205 1.00 1.01 C ATOM 115 O LEU A 7 -15.914 3.412 1.552 1.00 0.97 O ATOM 116 CB LEU A 7 -13.362 5.427 0.384 1.00 1.23 C ATOM 117 CG LEU A 7 -12.322 5.306 -0.732 1.00 1.37 C ATOM 118 CD1 LEU A 7 -11.630 6.655 -0.934 1.00 2.05 C ATOM 119 CD2 LEU A 7 -11.281 4.252 -0.346 1.00 1.67 C ATOM 0 H LEU A 7 -15.274 6.488 -0.987 1.00 1.10 H new ATOM 0 HA LEU A 7 -14.398 3.705 -0.425 1.00 1.09 H new ATOM 0 HB2 LEU A 7 -13.582 6.477 0.578 1.00 1.23 H new ATOM 0 HB3 LEU A 7 -12.968 5.007 1.310 1.00 1.23 H new ATOM 0 HG LEU A 7 -12.815 5.009 -1.657 1.00 1.37 H new ATOM 0 HD11 LEU A 7 -10.889 6.569 -1.729 1.00 2.05 H new ATOM 0 HD12 LEU A 7 -12.371 7.406 -1.208 1.00 2.05 H new ATOM 0 HD13 LEU A 7 -11.136 6.953 -0.009 1.00 2.05 H new ATOM 0 HD21 LEU A 7 -10.540 4.165 -1.140 1.00 1.67 H new ATOM 0 HD22 LEU A 7 -10.788 4.549 0.580 1.00 1.67 H new ATOM 0 HD23 LEU A 7 -11.773 3.290 -0.202 1.00 1.67 H new ATOM 131 N GLU A 8 -15.834 5.577 1.900 1.00 1.07 N ATOM 132 CA GLU A 8 -16.654 5.427 3.142 1.00 1.16 C ATOM 133 C GLU A 8 -18.148 5.277 2.829 1.00 1.10 C ATOM 134 O GLU A 8 -18.706 4.225 3.021 1.00 1.03 O ATOM 135 CB GLU A 8 -16.446 6.643 4.046 1.00 1.37 C ATOM 136 CG GLU A 8 -16.341 6.184 5.502 1.00 1.46 C ATOM 137 CD GLU A 8 -16.554 7.380 6.431 1.00 1.74 C ATOM 138 OE1 GLU A 8 -17.701 7.719 6.676 1.00 2.33 O ATOM 139 OE2 GLU A 8 -15.567 7.936 6.883 1.00 2.13 O ATOM 0 H GLU A 8 -15.552 6.530 1.670 1.00 1.07 H new ATOM 0 HA GLU A 8 -16.324 4.519 3.647 1.00 1.16 H new ATOM 0 HB2 GLU A 8 -15.540 7.175 3.755 1.00 1.37 H new ATOM 0 HB3 GLU A 8 -17.276 7.340 3.932 1.00 1.37 H new ATOM 0 HG2 GLU A 8 -17.085 5.414 5.706 1.00 1.46 H new ATOM 0 HG3 GLU A 8 -15.363 5.738 5.684 1.00 1.46 H new ATOM 146 N ILE A 9 -18.784 6.310 2.339 1.00 1.18 N ATOM 147 CA ILE A 9 -20.253 6.196 2.033 1.00 1.23 C ATOM 148 C ILE A 9 -20.519 4.773 1.539 1.00 1.11 C ATOM 149 O ILE A 9 -21.482 4.125 1.898 1.00 1.20 O ATOM 150 CB ILE A 9 -20.661 7.220 0.965 1.00 1.31 C ATOM 151 CG1 ILE A 9 -22.187 7.311 0.911 1.00 1.91 C ATOM 152 CG2 ILE A 9 -20.129 6.814 -0.412 1.00 1.86 C ATOM 153 CD1 ILE A 9 -22.657 8.517 1.727 1.00 2.19 C ATOM 0 H ILE A 9 -18.363 7.217 2.138 1.00 1.18 H new ATOM 0 HA ILE A 9 -20.841 6.401 2.927 1.00 1.23 H new ATOM 0 HB ILE A 9 -20.235 8.188 1.230 1.00 1.31 H new ATOM 0 HG12 ILE A 9 -22.520 7.406 -0.123 1.00 1.91 H new ATOM 0 HG13 ILE A 9 -22.630 6.397 1.306 1.00 1.91 H new ATOM 0 HG21 ILE A 9 -20.431 7.555 -1.152 1.00 1.86 H new ATOM 0 HG22 ILE A 9 -19.041 6.757 -0.379 1.00 1.86 H new ATOM 0 HG23 ILE A 9 -20.536 5.841 -0.687 1.00 1.86 H new ATOM 0 HD11 ILE A 9 -23.744 8.581 1.688 1.00 2.19 H new ATOM 0 HD12 ILE A 9 -22.337 8.403 2.763 1.00 2.19 H new ATOM 0 HD13 ILE A 9 -22.225 9.428 1.312 1.00 2.19 H new ATOM 165 N ILE A 10 -19.632 4.304 0.720 1.00 0.96 N ATOM 166 CA ILE A 10 -19.739 2.926 0.160 1.00 0.91 C ATOM 167 C ILE A 10 -19.707 1.915 1.308 1.00 0.82 C ATOM 168 O ILE A 10 -20.623 1.140 1.495 1.00 0.85 O ATOM 169 CB ILE A 10 -18.570 2.675 -0.809 1.00 0.92 C ATOM 170 CG1 ILE A 10 -19.017 3.003 -2.240 1.00 1.11 C ATOM 171 CG2 ILE A 10 -18.109 1.211 -0.742 1.00 0.92 C ATOM 172 CD1 ILE A 10 -19.746 1.805 -2.851 1.00 1.39 C ATOM 0 H ILE A 10 -18.815 4.826 0.404 1.00 0.96 H new ATOM 0 HA ILE A 10 -20.676 2.816 -0.386 1.00 0.91 H new ATOM 0 HB ILE A 10 -17.736 3.315 -0.521 1.00 0.92 H new ATOM 0 HG12 ILE A 10 -19.673 3.873 -2.234 1.00 1.11 H new ATOM 0 HG13 ILE A 10 -18.151 3.261 -2.850 1.00 1.11 H new ATOM 0 HG21 ILE A 10 -17.282 1.058 -1.435 1.00 0.92 H new ATOM 0 HG22 ILE A 10 -17.781 0.979 0.271 1.00 0.92 H new ATOM 0 HG23 ILE A 10 -18.937 0.556 -1.014 1.00 0.92 H new ATOM 0 HD11 ILE A 10 -20.059 2.049 -3.866 1.00 1.39 H new ATOM 0 HD12 ILE A 10 -19.077 0.945 -2.874 1.00 1.39 H new ATOM 0 HD13 ILE A 10 -20.623 1.567 -2.249 1.00 1.39 H new ATOM 184 N GLN A 11 -18.647 1.914 2.067 1.00 0.77 N ATOM 185 CA GLN A 11 -18.534 0.950 3.195 1.00 0.74 C ATOM 186 C GLN A 11 -19.771 1.047 4.091 1.00 0.80 C ATOM 187 O GLN A 11 -20.292 0.052 4.549 1.00 0.78 O ATOM 188 CB GLN A 11 -17.286 1.280 4.016 1.00 0.77 C ATOM 189 CG GLN A 11 -16.456 0.012 4.218 1.00 1.36 C ATOM 190 CD GLN A 11 -15.310 0.303 5.188 1.00 1.62 C ATOM 191 OE1 GLN A 11 -15.230 -0.287 6.248 1.00 2.31 O ATOM 192 NE2 GLN A 11 -14.412 1.194 4.869 1.00 1.94 N ATOM 0 H GLN A 11 -17.851 2.542 1.954 1.00 0.77 H new ATOM 0 HA GLN A 11 -18.459 -0.062 2.797 1.00 0.74 H new ATOM 0 HB2 GLN A 11 -16.692 2.038 3.505 1.00 0.77 H new ATOM 0 HB3 GLN A 11 -17.573 1.697 4.981 1.00 0.77 H new ATOM 0 HG2 GLN A 11 -17.084 -0.788 4.610 1.00 1.36 H new ATOM 0 HG3 GLN A 11 -16.060 -0.332 3.263 1.00 1.36 H new ATOM 0 HE21 GLN A 11 -14.478 1.689 3.980 1.00 1.94 H new ATOM 0 HE22 GLN A 11 -13.643 1.395 5.509 1.00 1.94 H new ATOM 201 N ALA A 12 -20.256 2.235 4.336 1.00 0.90 N ATOM 202 CA ALA A 12 -21.467 2.381 5.192 1.00 0.98 C ATOM 203 C ALA A 12 -22.669 1.741 4.494 1.00 0.94 C ATOM 204 O ALA A 12 -23.517 1.139 5.121 1.00 0.94 O ATOM 205 CB ALA A 12 -21.749 3.865 5.432 1.00 1.11 C ATOM 0 H ALA A 12 -19.866 3.108 3.981 1.00 0.90 H new ATOM 0 HA ALA A 12 -21.295 1.885 6.147 1.00 0.98 H new ATOM 0 HB1 ALA A 12 -22.635 3.970 6.058 1.00 1.11 H new ATOM 0 HB2 ALA A 12 -20.895 4.321 5.932 1.00 1.11 H new ATOM 0 HB3 ALA A 12 -21.919 4.362 4.477 1.00 1.11 H new ATOM 211 N ILE A 13 -22.743 1.866 3.196 1.00 0.90 N ATOM 212 CA ILE A 13 -23.884 1.261 2.458 1.00 0.86 C ATOM 213 C ILE A 13 -23.741 -0.263 2.478 1.00 0.75 C ATOM 214 O ILE A 13 -24.709 -0.993 2.578 1.00 0.72 O ATOM 215 CB ILE A 13 -23.884 1.766 1.014 1.00 0.87 C ATOM 216 CG1 ILE A 13 -24.530 3.153 0.963 1.00 1.03 C ATOM 217 CG2 ILE A 13 -24.680 0.800 0.138 1.00 0.85 C ATOM 218 CD1 ILE A 13 -23.926 3.959 -0.189 1.00 1.06 C ATOM 0 H ILE A 13 -22.063 2.360 2.618 1.00 0.90 H new ATOM 0 HA ILE A 13 -24.824 1.543 2.933 1.00 0.86 H new ATOM 0 HB ILE A 13 -22.859 1.827 0.648 1.00 0.87 H new ATOM 0 HG12 ILE A 13 -25.608 3.059 0.828 1.00 1.03 H new ATOM 0 HG13 ILE A 13 -24.371 3.674 1.907 1.00 1.03 H new ATOM 0 HG21 ILE A 13 -24.681 1.159 -0.891 1.00 0.85 H new ATOM 0 HG22 ILE A 13 -24.222 -0.188 0.177 1.00 0.85 H new ATOM 0 HG23 ILE A 13 -25.706 0.740 0.502 1.00 0.85 H new ATOM 0 HD11 ILE A 13 -24.387 4.946 -0.224 1.00 1.06 H new ATOM 0 HD12 ILE A 13 -22.852 4.065 -0.035 1.00 1.06 H new ATOM 0 HD13 ILE A 13 -24.108 3.440 -1.130 1.00 1.06 H new ATOM 230 N LEU A 14 -22.532 -0.745 2.388 1.00 0.74 N ATOM 231 CA LEU A 14 -22.299 -2.217 2.400 1.00 0.65 C ATOM 232 C LEU A 14 -22.594 -2.779 3.795 1.00 0.67 C ATOM 233 O LEU A 14 -23.215 -3.812 3.942 1.00 0.64 O ATOM 234 CB LEU A 14 -20.833 -2.485 2.052 1.00 0.65 C ATOM 235 CG LEU A 14 -20.743 -3.219 0.711 1.00 0.67 C ATOM 236 CD1 LEU A 14 -19.275 -3.364 0.297 1.00 0.61 C ATOM 237 CD2 LEU A 14 -21.370 -4.609 0.851 1.00 1.04 C ATOM 0 H LEU A 14 -21.689 -0.177 2.306 1.00 0.74 H new ATOM 0 HA LEU A 14 -22.955 -2.697 1.674 1.00 0.65 H new ATOM 0 HB2 LEU A 14 -20.285 -1.544 2.000 1.00 0.65 H new ATOM 0 HB3 LEU A 14 -20.367 -3.082 2.836 1.00 0.65 H new ATOM 0 HG LEU A 14 -21.277 -2.649 -0.049 1.00 0.67 H new ATOM 0 HD11 LEU A 14 -19.216 -3.887 -0.658 1.00 0.61 H new ATOM 0 HD12 LEU A 14 -18.826 -2.376 0.198 1.00 0.61 H new ATOM 0 HD13 LEU A 14 -18.737 -3.933 1.056 1.00 0.61 H new ATOM 0 HD21 LEU A 14 -21.307 -5.134 -0.102 1.00 1.04 H new ATOM 0 HD22 LEU A 14 -20.834 -5.175 1.613 1.00 1.04 H new ATOM 0 HD23 LEU A 14 -22.416 -4.509 1.142 1.00 1.04 H new ATOM 249 N GLU A 15 -22.143 -2.107 4.815 1.00 0.75 N ATOM 250 CA GLU A 15 -22.384 -2.596 6.202 1.00 0.80 C ATOM 251 C GLU A 15 -23.876 -2.548 6.526 1.00 0.83 C ATOM 252 O GLU A 15 -24.403 -3.415 7.191 1.00 0.85 O ATOM 253 CB GLU A 15 -21.619 -1.717 7.199 1.00 0.87 C ATOM 254 CG GLU A 15 -20.115 -1.986 7.091 1.00 0.89 C ATOM 255 CD GLU A 15 -19.451 -1.722 8.443 1.00 1.01 C ATOM 256 OE1 GLU A 15 -19.960 -2.212 9.438 1.00 1.53 O ATOM 257 OE2 GLU A 15 -18.443 -1.034 8.462 1.00 1.43 O ATOM 0 H GLU A 15 -21.616 -1.236 4.749 1.00 0.75 H new ATOM 0 HA GLU A 15 -22.035 -3.626 6.278 1.00 0.80 H new ATOM 0 HB2 GLU A 15 -21.823 -0.665 7.000 1.00 0.87 H new ATOM 0 HB3 GLU A 15 -21.961 -1.922 8.213 1.00 0.87 H new ATOM 0 HG2 GLU A 15 -19.940 -3.017 6.783 1.00 0.89 H new ATOM 0 HG3 GLU A 15 -19.674 -1.346 6.326 1.00 0.89 H new ATOM 264 N ALA A 16 -24.567 -1.549 6.067 1.00 0.85 N ATOM 265 CA ALA A 16 -26.016 -1.475 6.362 1.00 0.88 C ATOM 266 C ALA A 16 -26.711 -2.627 5.657 1.00 0.83 C ATOM 267 O ALA A 16 -27.641 -3.215 6.168 1.00 0.86 O ATOM 268 CB ALA A 16 -26.581 -0.156 5.848 1.00 0.91 C ATOM 0 H ALA A 16 -24.193 -0.785 5.504 1.00 0.85 H new ATOM 0 HA ALA A 16 -26.178 -1.536 7.438 1.00 0.88 H new ATOM 0 HB1 ALA A 16 -27.648 -0.107 6.068 1.00 0.91 H new ATOM 0 HB2 ALA A 16 -26.071 0.674 6.338 1.00 0.91 H new ATOM 0 HB3 ALA A 16 -26.429 -0.090 4.771 1.00 0.91 H new ATOM 274 N CYS A 17 -26.273 -2.947 4.472 1.00 0.76 N ATOM 275 CA CYS A 17 -26.915 -4.043 3.730 1.00 0.72 C ATOM 276 C CYS A 17 -26.443 -5.398 4.269 1.00 0.71 C ATOM 277 O CYS A 17 -27.059 -6.414 4.037 1.00 0.71 O ATOM 278 CB CYS A 17 -26.571 -3.907 2.253 1.00 0.65 C ATOM 279 SG CYS A 17 -24.895 -4.515 1.949 1.00 0.81 S ATOM 0 H CYS A 17 -25.497 -2.491 3.993 1.00 0.76 H new ATOM 0 HA CYS A 17 -27.996 -3.988 3.857 1.00 0.72 H new ATOM 0 HB2 CYS A 17 -27.285 -4.469 1.652 1.00 0.65 H new ATOM 0 HB3 CYS A 17 -26.649 -2.864 1.948 1.00 0.65 H new ATOM 0 HG CYS A 17 -24.154 -4.286 2.993 1.00 0.81 H new ATOM 285 N LYS A 18 -25.350 -5.434 4.980 1.00 0.72 N ATOM 286 CA LYS A 18 -24.859 -6.737 5.519 1.00 0.73 C ATOM 287 C LYS A 18 -25.989 -7.499 6.233 1.00 0.83 C ATOM 288 O LYS A 18 -25.795 -8.606 6.691 1.00 0.87 O ATOM 289 CB LYS A 18 -23.716 -6.491 6.506 1.00 0.78 C ATOM 290 CG LYS A 18 -24.285 -6.206 7.903 1.00 1.34 C ATOM 291 CD LYS A 18 -23.227 -5.513 8.772 1.00 1.96 C ATOM 292 CE LYS A 18 -22.146 -6.519 9.177 1.00 2.36 C ATOM 293 NZ LYS A 18 -22.775 -7.673 9.878 1.00 2.97 N ATOM 0 H LYS A 18 -24.777 -4.623 5.211 1.00 0.72 H new ATOM 0 HA LYS A 18 -24.505 -7.339 4.682 1.00 0.73 H new ATOM 0 HB2 LYS A 18 -23.061 -7.361 6.541 1.00 0.78 H new ATOM 0 HB3 LYS A 18 -23.110 -5.649 6.172 1.00 0.78 H new ATOM 0 HG2 LYS A 18 -25.170 -5.575 7.822 1.00 1.34 H new ATOM 0 HG3 LYS A 18 -24.600 -7.138 8.373 1.00 1.34 H new ATOM 0 HD2 LYS A 18 -22.778 -4.685 8.223 1.00 1.96 H new ATOM 0 HD3 LYS A 18 -23.694 -5.090 9.661 1.00 1.96 H new ATOM 0 HE2 LYS A 18 -21.609 -6.866 8.294 1.00 2.36 H new ATOM 0 HE3 LYS A 18 -21.415 -6.040 9.828 1.00 2.36 H new ATOM 0 HZ1 LYS A 18 -22.067 -8.142 10.479 1.00 2.97 H new ATOM 0 HZ2 LYS A 18 -23.561 -7.334 10.469 1.00 2.97 H new ATOM 0 HZ3 LYS A 18 -23.137 -8.350 9.176 1.00 2.97 H new ATOM 307 N SER A 19 -27.164 -6.929 6.345 1.00 0.88 N ATOM 308 CA SER A 19 -28.266 -7.653 7.041 1.00 0.99 C ATOM 309 C SER A 19 -29.626 -7.141 6.553 1.00 1.05 C ATOM 310 O SER A 19 -30.587 -7.108 7.294 1.00 1.21 O ATOM 311 CB SER A 19 -28.151 -7.421 8.548 1.00 1.07 C ATOM 312 OG SER A 19 -28.816 -8.471 9.238 1.00 1.10 O ATOM 0 H SER A 19 -27.404 -6.004 5.988 1.00 0.88 H new ATOM 0 HA SER A 19 -28.186 -8.718 6.821 1.00 0.99 H new ATOM 0 HB2 SER A 19 -27.102 -7.384 8.843 1.00 1.07 H new ATOM 0 HB3 SER A 19 -28.591 -6.460 8.814 1.00 1.07 H new ATOM 0 HG SER A 19 -29.738 -8.542 8.915 1.00 1.10 H new ATOM 318 N GLY A 20 -29.721 -6.753 5.308 1.00 0.94 N ATOM 319 CA GLY A 20 -31.025 -6.260 4.781 1.00 1.01 C ATOM 320 C GLY A 20 -31.449 -5.017 5.556 1.00 1.07 C ATOM 321 O GLY A 20 -31.876 -5.099 6.691 1.00 1.15 O ATOM 0 H GLY A 20 -28.954 -6.757 4.636 1.00 0.94 H new ATOM 0 HA2 GLY A 20 -30.936 -6.027 3.720 1.00 1.01 H new ATOM 0 HA3 GLY A 20 -31.784 -7.037 4.874 1.00 1.01 H new ATOM 325 N SER A 21 -31.309 -3.860 4.968 1.00 1.06 N ATOM 326 CA SER A 21 -31.676 -2.613 5.689 1.00 1.14 C ATOM 327 C SER A 21 -32.199 -1.562 4.686 1.00 1.14 C ATOM 328 O SER A 21 -31.557 -1.305 3.687 1.00 1.07 O ATOM 329 CB SER A 21 -30.414 -2.080 6.361 1.00 1.14 C ATOM 330 OG SER A 21 -29.806 -3.126 7.108 1.00 1.09 O ATOM 0 H SER A 21 -30.956 -3.727 4.020 1.00 1.06 H new ATOM 0 HA SER A 21 -32.455 -2.815 6.424 1.00 1.14 H new ATOM 0 HB2 SER A 21 -29.720 -1.702 5.611 1.00 1.14 H new ATOM 0 HB3 SER A 21 -30.661 -1.245 7.016 1.00 1.14 H new ATOM 0 HG SER A 21 -29.064 -3.506 6.594 1.00 1.09 H new ATOM 336 N PRO A 22 -33.347 -0.942 4.931 1.00 1.23 N ATOM 337 CA PRO A 22 -33.886 0.096 4.005 1.00 1.26 C ATOM 338 C PRO A 22 -32.858 1.199 3.738 1.00 1.26 C ATOM 339 O PRO A 22 -31.899 1.349 4.466 1.00 1.25 O ATOM 340 CB PRO A 22 -35.091 0.689 4.738 1.00 1.35 C ATOM 341 CG PRO A 22 -35.472 -0.295 5.791 1.00 1.47 C ATOM 342 CD PRO A 22 -34.246 -1.159 6.084 1.00 1.34 C ATOM 0 HA PRO A 22 -34.142 -0.335 3.037 1.00 1.26 H new ATOM 0 HB2 PRO A 22 -34.840 1.653 5.180 1.00 1.35 H new ATOM 0 HB3 PRO A 22 -35.918 0.860 4.049 1.00 1.35 H new ATOM 0 HG2 PRO A 22 -35.802 0.219 6.694 1.00 1.47 H new ATOM 0 HG3 PRO A 22 -36.304 -0.913 5.454 1.00 1.47 H new ATOM 0 HD2 PRO A 22 -33.769 -0.864 7.019 1.00 1.34 H new ATOM 0 HD3 PRO A 22 -34.517 -2.210 6.182 1.00 1.34 H new ATOM 350 N LYS A 23 -33.052 1.980 2.709 1.00 1.27 N ATOM 351 CA LYS A 23 -32.082 3.075 2.418 1.00 1.28 C ATOM 352 C LYS A 23 -32.030 4.031 3.618 1.00 1.33 C ATOM 353 O LYS A 23 -31.019 4.649 3.885 1.00 1.35 O ATOM 354 CB LYS A 23 -32.534 3.839 1.162 1.00 1.31 C ATOM 355 CG LYS A 23 -31.470 4.870 0.750 1.00 1.27 C ATOM 356 CD LYS A 23 -32.032 6.282 0.938 1.00 1.83 C ATOM 357 CE LYS A 23 -33.162 6.522 -0.064 1.00 1.76 C ATOM 358 NZ LYS A 23 -34.390 6.944 0.667 1.00 2.13 N ATOM 0 H LYS A 23 -33.836 1.908 2.060 1.00 1.27 H new ATOM 0 HA LYS A 23 -31.091 2.656 2.244 1.00 1.28 H new ATOM 0 HB2 LYS A 23 -32.706 3.139 0.345 1.00 1.31 H new ATOM 0 HB3 LYS A 23 -33.481 4.342 1.356 1.00 1.31 H new ATOM 0 HG2 LYS A 23 -30.570 4.741 1.352 1.00 1.27 H new ATOM 0 HG3 LYS A 23 -31.182 4.716 -0.290 1.00 1.27 H new ATOM 0 HD2 LYS A 23 -32.403 6.404 1.956 1.00 1.83 H new ATOM 0 HD3 LYS A 23 -31.243 7.020 0.795 1.00 1.83 H new ATOM 0 HE2 LYS A 23 -32.870 7.290 -0.781 1.00 1.76 H new ATOM 0 HE3 LYS A 23 -33.358 5.613 -0.632 1.00 1.76 H new ATOM 0 HZ1 LYS A 23 -35.160 7.108 -0.013 1.00 2.13 H new ATOM 0 HZ2 LYS A 23 -34.671 6.197 1.334 1.00 2.13 H new ATOM 0 HZ3 LYS A 23 -34.198 7.822 1.190 1.00 2.13 H new ATOM 372 N THR A 24 -33.115 4.160 4.344 1.00 1.35 N ATOM 373 CA THR A 24 -33.142 5.076 5.528 1.00 1.41 C ATOM 374 C THR A 24 -32.216 4.582 6.652 1.00 1.43 C ATOM 375 O THR A 24 -31.498 5.355 7.255 1.00 1.48 O ATOM 376 CB THR A 24 -34.572 5.157 6.065 1.00 1.40 C ATOM 377 OG1 THR A 24 -35.004 3.860 6.452 1.00 1.42 O ATOM 378 CG2 THR A 24 -35.501 5.702 4.978 1.00 1.42 C ATOM 0 H THR A 24 -33.989 3.666 4.165 1.00 1.35 H new ATOM 0 HA THR A 24 -32.792 6.056 5.204 1.00 1.41 H new ATOM 0 HB THR A 24 -34.598 5.823 6.927 1.00 1.40 H new ATOM 0 HG1 THR A 24 -35.920 3.910 6.798 1.00 1.42 H new ATOM 0 HG21 THR A 24 -36.519 5.758 5.364 1.00 1.42 H new ATOM 0 HG22 THR A 24 -35.170 6.697 4.682 1.00 1.42 H new ATOM 0 HG23 THR A 24 -35.477 5.039 4.113 1.00 1.42 H new ATOM 386 N ARG A 25 -32.237 3.308 6.954 1.00 1.40 N ATOM 387 CA ARG A 25 -31.373 2.777 8.056 1.00 1.43 C ATOM 388 C ARG A 25 -29.900 3.007 7.714 1.00 1.44 C ATOM 389 O ARG A 25 -29.015 2.750 8.505 1.00 1.47 O ATOM 390 CB ARG A 25 -31.631 1.271 8.199 1.00 1.39 C ATOM 391 CG ARG A 25 -32.205 0.945 9.583 1.00 1.72 C ATOM 392 CD ARG A 25 -31.076 0.962 10.612 1.00 1.56 C ATOM 393 NE ARG A 25 -31.621 0.624 11.957 1.00 2.13 N ATOM 394 CZ ARG A 25 -30.826 0.171 12.888 1.00 2.45 C ATOM 395 NH1 ARG A 25 -29.554 0.011 12.641 1.00 2.53 N ATOM 396 NH2 ARG A 25 -31.303 -0.123 14.066 1.00 3.15 N ATOM 0 H ARG A 25 -32.815 2.611 6.485 1.00 1.40 H new ATOM 0 HA ARG A 25 -31.608 3.290 8.989 1.00 1.43 H new ATOM 0 HB2 ARG A 25 -32.325 0.942 7.426 1.00 1.39 H new ATOM 0 HB3 ARG A 25 -30.701 0.722 8.048 1.00 1.39 H new ATOM 0 HG2 ARG A 25 -32.970 1.673 9.853 1.00 1.72 H new ATOM 0 HG3 ARG A 25 -32.686 -0.033 9.569 1.00 1.72 H new ATOM 0 HD2 ARG A 25 -30.303 0.246 10.331 1.00 1.56 H new ATOM 0 HD3 ARG A 25 -30.606 1.945 10.635 1.00 1.56 H new ATOM 0 HE ARG A 25 -32.615 0.747 12.150 1.00 2.13 H new ATOM 0 HH11 ARG A 25 -29.181 0.240 11.720 1.00 2.53 H new ATOM 0 HH12 ARG A 25 -28.934 -0.343 13.369 1.00 2.53 H new ATOM 0 HH21 ARG A 25 -32.297 0.001 14.259 1.00 3.15 H new ATOM 0 HH22 ARG A 25 -30.682 -0.477 14.794 1.00 3.15 H new ATOM 410 N ILE A 26 -29.647 3.494 6.541 1.00 1.41 N ATOM 411 CA ILE A 26 -28.248 3.750 6.138 1.00 1.41 C ATOM 412 C ILE A 26 -27.861 5.155 6.612 1.00 1.49 C ATOM 413 O ILE A 26 -26.700 5.503 6.698 1.00 1.50 O ATOM 414 CB ILE A 26 -28.133 3.559 4.622 1.00 1.34 C ATOM 415 CG1 ILE A 26 -28.723 2.181 4.289 1.00 1.28 C ATOM 416 CG2 ILE A 26 -26.666 3.620 4.192 1.00 1.34 C ATOM 417 CD1 ILE A 26 -28.064 1.592 3.040 1.00 0.96 C ATOM 0 H ILE A 26 -30.352 3.727 5.841 1.00 1.41 H new ATOM 0 HA ILE A 26 -27.549 3.051 6.598 1.00 1.41 H new ATOM 0 HB ILE A 26 -28.670 4.347 4.094 1.00 1.34 H new ATOM 0 HG12 ILE A 26 -28.580 1.506 5.133 1.00 1.28 H new ATOM 0 HG13 ILE A 26 -29.798 2.270 4.130 1.00 1.28 H new ATOM 0 HG21 ILE A 26 -26.597 3.483 3.113 1.00 1.34 H new ATOM 0 HG22 ILE A 26 -26.248 4.590 4.462 1.00 1.34 H new ATOM 0 HG23 ILE A 26 -26.106 2.831 4.694 1.00 1.34 H new ATOM 0 HD11 ILE A 26 -28.499 0.616 2.825 1.00 0.96 H new ATOM 0 HD12 ILE A 26 -28.230 2.258 2.193 1.00 0.96 H new ATOM 0 HD13 ILE A 26 -26.993 1.482 3.211 1.00 0.96 H new ATOM 429 N MET A 27 -28.842 5.956 6.957 1.00 1.55 N ATOM 430 CA MET A 27 -28.560 7.330 7.467 1.00 1.64 C ATOM 431 C MET A 27 -27.844 7.216 8.810 1.00 1.70 C ATOM 432 O MET A 27 -26.873 7.900 9.067 1.00 1.74 O ATOM 433 CB MET A 27 -29.874 8.102 7.608 1.00 1.72 C ATOM 434 CG MET A 27 -29.586 9.578 7.855 1.00 2.02 C ATOM 435 SD MET A 27 -31.097 10.392 8.433 1.00 2.29 S ATOM 436 CE MET A 27 -31.640 11.031 6.828 1.00 1.90 C ATOM 0 H MET A 27 -29.831 5.712 6.906 1.00 1.55 H new ATOM 0 HA MET A 27 -27.921 7.873 6.770 1.00 1.64 H new ATOM 0 HB2 MET A 27 -30.473 7.986 6.705 1.00 1.72 H new ATOM 0 HB3 MET A 27 -30.459 7.694 8.432 1.00 1.72 H new ATOM 0 HG2 MET A 27 -28.794 9.687 8.596 1.00 2.02 H new ATOM 0 HG3 MET A 27 -29.232 10.050 6.938 1.00 2.02 H new ATOM 0 HE1 MET A 27 -32.574 11.579 6.952 1.00 1.90 H new ATOM 0 HE2 MET A 27 -30.878 11.699 6.426 1.00 1.90 H new ATOM 0 HE3 MET A 27 -31.795 10.200 6.139 1.00 1.90 H new ATOM 446 N TYR A 28 -28.296 6.336 9.659 1.00 1.72 N ATOM 447 CA TYR A 28 -27.619 6.158 10.971 1.00 1.80 C ATOM 448 C TYR A 28 -26.179 5.718 10.701 1.00 1.78 C ATOM 449 O TYR A 28 -25.358 5.629 11.592 1.00 2.09 O ATOM 450 CB TYR A 28 -28.340 5.075 11.772 1.00 1.82 C ATOM 451 CG TYR A 28 -27.966 5.194 13.229 1.00 2.02 C ATOM 452 CD1 TYR A 28 -28.524 6.210 14.013 1.00 2.25 C ATOM 453 CD2 TYR A 28 -27.061 4.289 13.795 1.00 2.64 C ATOM 454 CE1 TYR A 28 -28.178 6.321 15.364 1.00 2.48 C ATOM 455 CE2 TYR A 28 -26.714 4.400 15.148 1.00 3.00 C ATOM 456 CZ TYR A 28 -27.272 5.416 15.932 1.00 2.69 C ATOM 457 OH TYR A 28 -26.931 5.525 17.265 1.00 3.10 O ATOM 0 H TYR A 28 -29.104 5.734 9.500 1.00 1.72 H new ATOM 0 HA TYR A 28 -27.634 7.089 11.538 1.00 1.80 H new ATOM 0 HB2 TYR A 28 -29.419 5.177 11.653 1.00 1.82 H new ATOM 0 HB3 TYR A 28 -28.070 4.088 11.396 1.00 1.82 H new ATOM 0 HD1 TYR A 28 -29.222 6.908 13.575 1.00 2.25 H new ATOM 0 HD2 TYR A 28 -26.630 3.505 13.189 1.00 2.64 H new ATOM 0 HE1 TYR A 28 -28.609 7.105 15.969 1.00 2.48 H new ATOM 0 HE2 TYR A 28 -26.016 3.702 15.586 1.00 3.00 H new ATOM 0 HH TYR A 28 -26.293 4.819 17.498 1.00 3.10 H new ATOM 467 N GLY A 29 -25.878 5.465 9.459 1.00 1.51 N ATOM 468 CA GLY A 29 -24.498 5.049 9.078 1.00 1.48 C ATOM 469 C GLY A 29 -23.725 6.282 8.608 1.00 1.54 C ATOM 470 O GLY A 29 -22.511 6.322 8.639 1.00 1.61 O ATOM 0 H GLY A 29 -26.536 5.529 8.682 1.00 1.51 H new ATOM 0 HA2 GLY A 29 -23.994 4.589 9.928 1.00 1.48 H new ATOM 0 HA3 GLY A 29 -24.534 4.301 8.286 1.00 1.48 H new ATOM 474 N ALA A 30 -24.431 7.286 8.168 1.00 1.57 N ATOM 475 CA ALA A 30 -23.762 8.526 7.685 1.00 1.67 C ATOM 476 C ALA A 30 -24.804 9.409 7.002 1.00 1.71 C ATOM 477 O ALA A 30 -25.839 8.936 6.578 1.00 1.72 O ATOM 478 CB ALA A 30 -22.668 8.163 6.679 1.00 1.66 C ATOM 0 H ALA A 30 -25.450 7.301 8.122 1.00 1.57 H new ATOM 0 HA ALA A 30 -23.313 9.055 8.526 1.00 1.67 H new ATOM 0 HB1 ALA A 30 -22.181 9.072 6.328 1.00 1.66 H new ATOM 0 HB2 ALA A 30 -21.931 7.519 7.159 1.00 1.66 H new ATOM 0 HB3 ALA A 30 -23.112 7.639 5.832 1.00 1.66 H new ATOM 484 N ASN A 31 -24.542 10.683 6.881 1.00 1.82 N ATOM 485 CA ASN A 31 -25.525 11.576 6.208 1.00 1.87 C ATOM 486 C ASN A 31 -25.960 10.908 4.902 1.00 1.82 C ATOM 487 O ASN A 31 -25.146 10.622 4.049 1.00 2.17 O ATOM 488 CB ASN A 31 -24.862 12.923 5.903 1.00 2.00 C ATOM 489 CG ASN A 31 -25.832 14.063 6.222 1.00 2.22 C ATOM 490 OD1 ASN A 31 -26.640 14.437 5.395 1.00 2.79 O ATOM 491 ND2 ASN A 31 -25.785 14.636 7.393 1.00 2.38 N ATOM 0 H ASN A 31 -23.695 11.140 7.217 1.00 1.82 H new ATOM 0 HA ASN A 31 -26.390 11.744 6.850 1.00 1.87 H new ATOM 0 HB2 ASN A 31 -23.952 13.032 6.493 1.00 2.00 H new ATOM 0 HB3 ASN A 31 -24.569 12.965 4.854 1.00 2.00 H new ATOM 0 HD21 ASN A 31 -26.426 15.398 7.614 1.00 2.38 H new ATOM 0 HD22 ASN A 31 -25.107 14.322 8.087 1.00 2.38 H new ATOM 498 N LEU A 32 -27.226 10.625 4.741 1.00 1.81 N ATOM 499 CA LEU A 32 -27.657 9.942 3.490 1.00 1.70 C ATOM 500 C LEU A 32 -27.657 10.918 2.326 1.00 1.72 C ATOM 501 O LEU A 32 -28.516 11.759 2.178 1.00 1.84 O ATOM 502 CB LEU A 32 -29.067 9.370 3.653 1.00 1.75 C ATOM 503 CG LEU A 32 -29.148 7.908 3.157 1.00 1.74 C ATOM 504 CD1 LEU A 32 -28.682 7.761 1.706 1.00 1.67 C ATOM 505 CD2 LEU A 32 -28.301 7.003 4.038 1.00 1.69 C ATOM 0 H LEU A 32 -27.967 10.833 5.410 1.00 1.81 H new ATOM 0 HA LEU A 32 -26.954 9.133 3.289 1.00 1.70 H new ATOM 0 HB2 LEU A 32 -29.360 9.416 4.702 1.00 1.75 H new ATOM 0 HB3 LEU A 32 -29.776 9.983 3.097 1.00 1.75 H new ATOM 0 HG LEU A 32 -30.197 7.616 3.212 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -28.757 6.716 1.404 1.00 1.67 H new ATOM 0 HD12 LEU A 32 -29.310 8.373 1.058 1.00 1.67 H new ATOM 0 HD13 LEU A 32 -27.646 8.089 1.622 1.00 1.67 H new ATOM 0 HD21 LEU A 32 -28.368 5.977 3.676 1.00 1.69 H new ATOM 0 HD22 LEU A 32 -27.262 7.332 4.006 1.00 1.69 H new ATOM 0 HD23 LEU A 32 -28.665 7.050 5.064 1.00 1.69 H new ATOM 517 N SER A 33 -26.704 10.741 1.473 1.00 1.63 N ATOM 518 CA SER A 33 -26.587 11.550 0.241 1.00 1.66 C ATOM 519 C SER A 33 -27.781 11.203 -0.658 1.00 1.68 C ATOM 520 O SER A 33 -27.769 11.475 -1.826 1.00 1.69 O ATOM 521 CB SER A 33 -25.263 11.236 -0.462 1.00 1.58 C ATOM 522 OG SER A 33 -24.603 12.454 -0.783 1.00 1.75 O ATOM 0 H SER A 33 -25.971 10.040 1.583 1.00 1.63 H new ATOM 0 HA SER A 33 -26.595 12.615 0.471 1.00 1.66 H new ATOM 0 HB2 SER A 33 -24.631 10.625 0.183 1.00 1.58 H new ATOM 0 HB3 SER A 33 -25.447 10.658 -1.368 1.00 1.58 H new ATOM 0 HG SER A 33 -23.754 12.258 -1.232 1.00 1.75 H new ATOM 528 N TYR A 34 -28.754 10.499 -0.108 1.00 1.70 N ATOM 529 CA TYR A 34 -29.936 9.980 -0.885 1.00 1.73 C ATOM 530 C TYR A 34 -30.177 10.742 -2.179 1.00 1.77 C ATOM 531 O TYR A 34 -30.364 10.131 -3.213 1.00 1.71 O ATOM 532 CB TYR A 34 -31.198 10.107 -0.026 1.00 1.92 C ATOM 533 CG TYR A 34 -31.744 11.517 -0.099 1.00 1.73 C ATOM 534 CD1 TYR A 34 -32.604 11.882 -1.143 1.00 2.49 C ATOM 535 CD2 TYR A 34 -31.396 12.455 0.880 1.00 1.94 C ATOM 536 CE1 TYR A 34 -33.112 13.185 -1.208 1.00 3.01 C ATOM 537 CE2 TYR A 34 -31.906 13.759 0.814 1.00 2.57 C ATOM 538 CZ TYR A 34 -32.762 14.124 -0.231 1.00 2.95 C ATOM 539 OH TYR A 34 -33.263 15.408 -0.295 1.00 3.85 O ATOM 0 H TYR A 34 -28.776 10.256 0.882 1.00 1.70 H new ATOM 0 HA TYR A 34 -29.715 8.943 -1.137 1.00 1.73 H new ATOM 0 HB2 TYR A 34 -31.953 9.399 -0.370 1.00 1.92 H new ATOM 0 HB3 TYR A 34 -30.969 9.852 1.009 1.00 1.92 H new ATOM 0 HD1 TYR A 34 -32.875 11.158 -1.898 1.00 2.49 H new ATOM 0 HD2 TYR A 34 -30.735 12.174 1.686 1.00 1.94 H new ATOM 0 HE1 TYR A 34 -33.775 13.466 -2.013 1.00 3.01 H new ATOM 0 HE2 TYR A 34 -31.638 14.482 1.570 1.00 2.57 H new ATOM 0 HH TYR A 34 -32.921 15.930 0.461 1.00 3.85 H new ATOM 549 N ALA A 35 -30.156 12.035 -2.180 1.00 1.88 N ATOM 550 CA ALA A 35 -30.362 12.724 -3.475 1.00 1.95 C ATOM 551 C ALA A 35 -29.327 12.151 -4.442 1.00 1.82 C ATOM 552 O ALA A 35 -29.620 11.781 -5.561 1.00 1.78 O ATOM 553 CB ALA A 35 -30.144 14.230 -3.305 1.00 2.11 C ATOM 0 H ALA A 35 -30.010 12.633 -1.367 1.00 1.88 H new ATOM 0 HA ALA A 35 -31.375 12.572 -3.847 1.00 1.95 H new ATOM 0 HB1 ALA A 35 -30.297 14.730 -4.261 1.00 2.11 H new ATOM 0 HB2 ALA A 35 -30.852 14.620 -2.574 1.00 2.11 H new ATOM 0 HB3 ALA A 35 -29.127 14.414 -2.958 1.00 2.11 H new ATOM 559 N LEU A 36 -28.117 12.054 -3.974 1.00 1.76 N ATOM 560 CA LEU A 36 -27.007 11.482 -4.787 1.00 1.66 C ATOM 561 C LEU A 36 -26.771 9.998 -4.437 1.00 1.48 C ATOM 562 O LEU A 36 -26.636 9.160 -5.305 1.00 1.40 O ATOM 563 CB LEU A 36 -25.728 12.274 -4.515 1.00 1.73 C ATOM 564 CG LEU A 36 -25.228 12.901 -5.817 1.00 1.83 C ATOM 565 CD1 LEU A 36 -24.008 13.776 -5.527 1.00 2.23 C ATOM 566 CD2 LEU A 36 -24.840 11.794 -6.800 1.00 2.42 C ATOM 0 H LEU A 36 -27.843 12.354 -3.039 1.00 1.76 H new ATOM 0 HA LEU A 36 -27.278 11.548 -5.841 1.00 1.66 H new ATOM 0 HB2 LEU A 36 -25.920 13.051 -3.775 1.00 1.73 H new ATOM 0 HB3 LEU A 36 -24.964 11.618 -4.098 1.00 1.73 H new ATOM 0 HG LEU A 36 -26.018 13.513 -6.252 1.00 1.83 H new ATOM 0 HD11 LEU A 36 -23.652 14.223 -6.455 1.00 2.23 H new ATOM 0 HD12 LEU A 36 -24.284 14.565 -4.827 1.00 2.23 H new ATOM 0 HD13 LEU A 36 -23.217 13.165 -5.092 1.00 2.23 H new ATOM 0 HD21 LEU A 36 -24.484 12.240 -7.728 1.00 2.42 H new ATOM 0 HD22 LEU A 36 -24.050 11.182 -6.365 1.00 2.42 H new ATOM 0 HD23 LEU A 36 -25.710 11.171 -7.008 1.00 2.42 H new ATOM 578 N THR A 37 -26.666 9.685 -3.163 1.00 1.43 N ATOM 579 CA THR A 37 -26.371 8.272 -2.746 1.00 1.30 C ATOM 580 C THR A 37 -27.193 7.279 -3.559 1.00 1.23 C ATOM 581 O THR A 37 -26.697 6.239 -3.928 1.00 1.15 O ATOM 582 CB THR A 37 -26.652 8.066 -1.253 1.00 1.36 C ATOM 583 OG1 THR A 37 -25.532 8.506 -0.498 1.00 1.49 O ATOM 584 CG2 THR A 37 -26.894 6.578 -0.976 1.00 1.33 C ATOM 0 H THR A 37 -26.772 10.347 -2.394 1.00 1.43 H new ATOM 0 HA THR A 37 -25.312 8.094 -2.934 1.00 1.30 H new ATOM 0 HB THR A 37 -27.535 8.638 -0.969 1.00 1.36 H new ATOM 0 HG1 THR A 37 -25.710 8.377 0.457 1.00 1.49 H new ATOM 0 HG21 THR A 37 -27.094 6.433 0.086 1.00 1.33 H new ATOM 0 HG22 THR A 37 -27.750 6.234 -1.556 1.00 1.33 H new ATOM 0 HG23 THR A 37 -26.010 6.007 -1.260 1.00 1.33 H new ATOM 592 N GLY A 38 -28.434 7.573 -3.834 1.00 1.26 N ATOM 593 CA GLY A 38 -29.248 6.610 -4.640 1.00 1.21 C ATOM 594 C GLY A 38 -28.386 6.130 -5.812 1.00 1.17 C ATOM 595 O GLY A 38 -28.530 5.033 -6.311 1.00 1.12 O ATOM 0 H GLY A 38 -28.917 8.423 -3.543 1.00 1.26 H new ATOM 0 HA2 GLY A 38 -29.560 5.766 -4.025 1.00 1.21 H new ATOM 0 HA3 GLY A 38 -30.156 7.090 -5.006 1.00 1.21 H new ATOM 599 N ARG A 39 -27.471 6.963 -6.222 1.00 1.22 N ATOM 600 CA ARG A 39 -26.541 6.613 -7.336 1.00 1.23 C ATOM 601 C ARG A 39 -25.547 5.553 -6.851 1.00 1.13 C ATOM 602 O ARG A 39 -25.140 4.678 -7.590 1.00 1.10 O ATOM 603 CB ARG A 39 -25.776 7.879 -7.746 1.00 1.33 C ATOM 604 CG ARG A 39 -24.846 7.592 -8.934 1.00 1.36 C ATOM 605 CD ARG A 39 -23.504 8.305 -8.721 1.00 1.39 C ATOM 606 NE ARG A 39 -23.728 9.777 -8.670 1.00 1.58 N ATOM 607 CZ ARG A 39 -23.873 10.453 -9.776 1.00 2.13 C ATOM 608 NH1 ARG A 39 -23.821 9.838 -10.926 1.00 2.75 N ATOM 609 NH2 ARG A 39 -24.069 11.741 -9.733 1.00 2.58 N ATOM 0 H ARG A 39 -27.324 7.891 -5.825 1.00 1.22 H new ATOM 0 HA ARG A 39 -27.101 6.221 -8.185 1.00 1.23 H new ATOM 0 HB2 ARG A 39 -26.482 8.666 -8.012 1.00 1.33 H new ATOM 0 HB3 ARG A 39 -25.193 8.246 -6.902 1.00 1.33 H new ATOM 0 HG2 ARG A 39 -24.687 6.518 -9.033 1.00 1.36 H new ATOM 0 HG3 ARG A 39 -25.307 7.933 -9.861 1.00 1.36 H new ATOM 0 HD2 ARG A 39 -23.042 7.964 -7.795 1.00 1.39 H new ATOM 0 HD3 ARG A 39 -22.816 8.059 -9.530 1.00 1.39 H new ATOM 0 HE ARG A 39 -23.768 10.256 -7.770 1.00 1.58 H new ATOM 0 HH11 ARG A 39 -23.667 8.830 -10.959 1.00 2.75 H new ATOM 0 HH12 ARG A 39 -23.934 10.365 -11.792 1.00 2.75 H new ATOM 0 HH21 ARG A 39 -24.109 12.221 -8.834 1.00 2.58 H new ATOM 0 HH22 ARG A 39 -24.182 12.269 -10.598 1.00 2.58 H new ATOM 623 N TYR A 40 -25.160 5.627 -5.609 1.00 1.10 N ATOM 624 CA TYR A 40 -24.197 4.631 -5.068 1.00 1.01 C ATOM 625 C TYR A 40 -24.925 3.321 -4.788 1.00 0.91 C ATOM 626 O TYR A 40 -24.450 2.255 -5.117 1.00 0.85 O ATOM 627 CB TYR A 40 -23.556 5.175 -3.788 1.00 1.04 C ATOM 628 CG TYR A 40 -22.313 5.945 -4.168 1.00 1.24 C ATOM 629 CD1 TYR A 40 -21.150 5.257 -4.529 1.00 1.92 C ATOM 630 CD2 TYR A 40 -22.328 7.345 -4.176 1.00 1.74 C ATOM 631 CE1 TYR A 40 -20.002 5.969 -4.899 1.00 2.17 C ATOM 632 CE2 TYR A 40 -21.180 8.057 -4.543 1.00 2.01 C ATOM 633 CZ TYR A 40 -20.017 7.367 -4.906 1.00 1.89 C ATOM 634 OH TYR A 40 -18.886 8.069 -5.270 1.00 2.27 O ATOM 0 H TYR A 40 -25.470 6.336 -4.944 1.00 1.10 H new ATOM 0 HA TYR A 40 -23.410 4.446 -5.799 1.00 1.01 H new ATOM 0 HB2 TYR A 40 -24.256 5.822 -3.259 1.00 1.04 H new ATOM 0 HB3 TYR A 40 -23.304 4.357 -3.113 1.00 1.04 H new ATOM 0 HD1 TYR A 40 -21.137 4.177 -4.522 1.00 1.92 H new ATOM 0 HD2 TYR A 40 -23.226 7.876 -3.899 1.00 1.74 H new ATOM 0 HE1 TYR A 40 -19.104 5.438 -5.179 1.00 2.17 H new ATOM 0 HE2 TYR A 40 -21.191 9.137 -4.546 1.00 2.01 H new ATOM 0 HH TYR A 40 -19.068 9.031 -5.221 1.00 2.27 H new ATOM 644 N ILE A 41 -26.081 3.388 -4.198 1.00 0.89 N ATOM 645 CA ILE A 41 -26.838 2.142 -3.915 1.00 0.80 C ATOM 646 C ILE A 41 -27.180 1.447 -5.231 1.00 0.77 C ATOM 647 O ILE A 41 -26.880 0.293 -5.429 1.00 0.70 O ATOM 648 CB ILE A 41 -28.125 2.488 -3.168 1.00 0.82 C ATOM 649 CG1 ILE A 41 -27.775 2.958 -1.754 1.00 0.92 C ATOM 650 CG2 ILE A 41 -29.016 1.249 -3.087 1.00 0.77 C ATOM 651 CD1 ILE A 41 -29.003 3.602 -1.110 1.00 0.95 C ATOM 0 H ILE A 41 -26.535 4.251 -3.899 1.00 0.89 H new ATOM 0 HA ILE A 41 -26.231 1.477 -3.301 1.00 0.80 H new ATOM 0 HB ILE A 41 -28.655 3.280 -3.697 1.00 0.82 H new ATOM 0 HG12 ILE A 41 -27.437 2.114 -1.153 1.00 0.92 H new ATOM 0 HG13 ILE A 41 -26.953 3.673 -1.790 1.00 0.92 H new ATOM 0 HG21 ILE A 41 -29.934 1.495 -2.554 1.00 0.77 H new ATOM 0 HG22 ILE A 41 -29.260 0.910 -4.094 1.00 0.77 H new ATOM 0 HG23 ILE A 41 -28.490 0.456 -2.555 1.00 0.77 H new ATOM 0 HD11 ILE A 41 -28.753 3.936 -0.103 1.00 0.95 H new ATOM 0 HD12 ILE A 41 -29.321 4.456 -1.707 1.00 0.95 H new ATOM 0 HD13 ILE A 41 -29.812 2.873 -1.060 1.00 0.95 H new ATOM 663 N LYS A 42 -27.799 2.151 -6.133 1.00 0.85 N ATOM 664 CA LYS A 42 -28.167 1.540 -7.441 1.00 0.86 C ATOM 665 C LYS A 42 -26.916 0.990 -8.142 1.00 0.85 C ATOM 666 O LYS A 42 -26.948 -0.063 -8.746 1.00 0.82 O ATOM 667 CB LYS A 42 -28.821 2.609 -8.322 1.00 0.98 C ATOM 668 CG LYS A 42 -29.821 1.961 -9.288 1.00 1.09 C ATOM 669 CD LYS A 42 -29.092 1.004 -10.237 1.00 1.05 C ATOM 670 CE LYS A 42 -29.859 0.913 -11.556 1.00 1.07 C ATOM 671 NZ LYS A 42 -29.573 -0.399 -12.203 1.00 1.81 N ATOM 0 H LYS A 42 -28.068 3.129 -6.022 1.00 0.85 H new ATOM 0 HA LYS A 42 -28.863 0.718 -7.273 1.00 0.86 H new ATOM 0 HB2 LYS A 42 -29.331 3.343 -7.698 1.00 0.98 H new ATOM 0 HB3 LYS A 42 -28.056 3.145 -8.884 1.00 0.98 H new ATOM 0 HG2 LYS A 42 -30.582 1.419 -8.726 1.00 1.09 H new ATOM 0 HG3 LYS A 42 -30.336 2.732 -9.861 1.00 1.09 H new ATOM 0 HD2 LYS A 42 -28.077 1.357 -10.418 1.00 1.05 H new ATOM 0 HD3 LYS A 42 -29.010 0.017 -9.783 1.00 1.05 H new ATOM 0 HE2 LYS A 42 -30.929 1.017 -11.376 1.00 1.07 H new ATOM 0 HE3 LYS A 42 -29.566 1.729 -12.217 1.00 1.07 H new ATOM 0 HZ1 LYS A 42 -30.396 -0.695 -12.766 1.00 1.81 H new ATOM 0 HZ2 LYS A 42 -28.744 -0.306 -12.824 1.00 1.81 H new ATOM 0 HZ3 LYS A 42 -29.379 -1.112 -11.471 1.00 1.81 H new ATOM 685 N MET A 43 -25.818 1.690 -8.073 1.00 0.90 N ATOM 686 CA MET A 43 -24.579 1.192 -8.750 1.00 0.93 C ATOM 687 C MET A 43 -24.139 -0.117 -8.110 1.00 0.80 C ATOM 688 O MET A 43 -23.840 -1.083 -8.781 1.00 0.79 O ATOM 689 CB MET A 43 -23.443 2.214 -8.638 1.00 1.02 C ATOM 690 CG MET A 43 -22.336 1.844 -9.633 1.00 1.13 C ATOM 691 SD MET A 43 -22.408 2.957 -11.059 1.00 2.14 S ATOM 692 CE MET A 43 -20.650 2.904 -11.483 1.00 2.36 C ATOM 0 H MET A 43 -25.721 2.579 -7.582 1.00 0.90 H new ATOM 0 HA MET A 43 -24.805 1.036 -9.805 1.00 0.93 H new ATOM 0 HB2 MET A 43 -23.817 3.216 -8.847 1.00 1.02 H new ATOM 0 HB3 MET A 43 -23.047 2.227 -7.622 1.00 1.02 H new ATOM 0 HG2 MET A 43 -21.361 1.916 -9.151 1.00 1.13 H new ATOM 0 HG3 MET A 43 -22.456 0.811 -9.959 1.00 1.13 H new ATOM 0 HE1 MET A 43 -20.430 3.676 -12.221 1.00 2.36 H new ATOM 0 HE2 MET A 43 -20.054 3.078 -10.587 1.00 2.36 H new ATOM 0 HE3 MET A 43 -20.405 1.926 -11.897 1.00 2.36 H new ATOM 702 N LEU A 44 -24.095 -0.156 -6.810 1.00 0.73 N ATOM 703 CA LEU A 44 -23.668 -1.399 -6.119 1.00 0.61 C ATOM 704 C LEU A 44 -24.637 -2.526 -6.485 1.00 0.57 C ATOM 705 O LEU A 44 -24.290 -3.688 -6.473 1.00 0.54 O ATOM 706 CB LEU A 44 -23.675 -1.154 -4.606 1.00 0.57 C ATOM 707 CG LEU A 44 -22.682 -0.025 -4.271 1.00 0.69 C ATOM 708 CD1 LEU A 44 -23.032 0.619 -2.923 1.00 1.14 C ATOM 709 CD2 LEU A 44 -21.259 -0.583 -4.190 1.00 0.67 C ATOM 0 H LEU A 44 -24.337 0.621 -6.196 1.00 0.73 H new ATOM 0 HA LEU A 44 -22.661 -1.683 -6.427 1.00 0.61 H new ATOM 0 HB2 LEU A 44 -24.677 -0.883 -4.274 1.00 0.57 H new ATOM 0 HB3 LEU A 44 -23.399 -2.066 -4.077 1.00 0.57 H new ATOM 0 HG LEU A 44 -22.745 0.724 -5.060 1.00 0.69 H new ATOM 0 HD11 LEU A 44 -22.319 1.414 -2.704 1.00 1.14 H new ATOM 0 HD12 LEU A 44 -24.038 1.036 -2.969 1.00 1.14 H new ATOM 0 HD13 LEU A 44 -22.987 -0.135 -2.137 1.00 1.14 H new ATOM 0 HD21 LEU A 44 -20.565 0.223 -3.953 1.00 0.67 H new ATOM 0 HD22 LEU A 44 -21.211 -1.344 -3.412 1.00 0.67 H new ATOM 0 HD23 LEU A 44 -20.987 -1.026 -5.148 1.00 0.67 H new ATOM 721 N MET A 45 -25.843 -2.184 -6.840 1.00 0.60 N ATOM 722 CA MET A 45 -26.831 -3.227 -7.240 1.00 0.58 C ATOM 723 C MET A 45 -26.591 -3.555 -8.711 1.00 0.62 C ATOM 724 O MET A 45 -26.515 -4.698 -9.116 1.00 0.59 O ATOM 725 CB MET A 45 -28.254 -2.680 -7.087 1.00 0.64 C ATOM 726 CG MET A 45 -28.470 -2.158 -5.669 1.00 1.07 C ATOM 727 SD MET A 45 -29.234 -3.454 -4.665 1.00 1.19 S ATOM 728 CE MET A 45 -30.911 -2.777 -4.660 1.00 1.04 C ATOM 0 H MET A 45 -26.189 -1.225 -6.871 1.00 0.60 H new ATOM 0 HA MET A 45 -26.716 -4.112 -6.614 1.00 0.58 H new ATOM 0 HB2 MET A 45 -28.422 -1.879 -7.807 1.00 0.64 H new ATOM 0 HB3 MET A 45 -28.978 -3.464 -7.308 1.00 0.64 H new ATOM 0 HG2 MET A 45 -27.518 -1.856 -5.231 1.00 1.07 H new ATOM 0 HG3 MET A 45 -29.107 -1.274 -5.688 1.00 1.07 H new ATOM 0 HE1 MET A 45 -31.558 -3.412 -4.055 1.00 1.04 H new ATOM 0 HE2 MET A 45 -30.896 -1.771 -4.241 1.00 1.04 H new ATOM 0 HE3 MET A 45 -31.291 -2.739 -5.681 1.00 1.04 H new ATOM 738 N ASP A 46 -26.453 -2.531 -9.497 1.00 0.69 N ATOM 739 CA ASP A 46 -26.193 -2.715 -10.949 1.00 0.76 C ATOM 740 C ASP A 46 -24.875 -3.471 -11.131 1.00 0.75 C ATOM 741 O ASP A 46 -24.682 -4.183 -12.096 1.00 0.81 O ATOM 742 CB ASP A 46 -26.095 -1.350 -11.624 1.00 0.85 C ATOM 743 CG ASP A 46 -26.738 -1.417 -13.011 1.00 1.03 C ATOM 744 OD1 ASP A 46 -26.519 -2.401 -13.698 1.00 1.71 O ATOM 745 OD2 ASP A 46 -27.438 -0.481 -13.363 1.00 1.26 O ATOM 0 H ASP A 46 -26.510 -1.559 -9.192 1.00 0.69 H new ATOM 0 HA ASP A 46 -27.007 -3.283 -11.399 1.00 0.76 H new ATOM 0 HB2 ASP A 46 -26.595 -0.596 -11.016 1.00 0.85 H new ATOM 0 HB3 ASP A 46 -25.051 -1.050 -11.710 1.00 0.85 H new ATOM 750 N LEU A 47 -23.961 -3.307 -10.212 1.00 0.69 N ATOM 751 CA LEU A 47 -22.646 -3.999 -10.329 1.00 0.70 C ATOM 752 C LEU A 47 -22.696 -5.352 -9.610 1.00 0.62 C ATOM 753 O LEU A 47 -21.779 -6.142 -9.711 1.00 0.63 O ATOM 754 CB LEU A 47 -21.552 -3.114 -9.725 1.00 0.72 C ATOM 755 CG LEU A 47 -20.949 -2.219 -10.820 1.00 0.84 C ATOM 756 CD1 LEU A 47 -22.060 -1.483 -11.574 1.00 0.89 C ATOM 757 CD2 LEU A 47 -20.019 -1.183 -10.183 1.00 0.89 C ATOM 0 H LEU A 47 -24.070 -2.722 -9.384 1.00 0.69 H new ATOM 0 HA LEU A 47 -22.422 -4.177 -11.381 1.00 0.70 H new ATOM 0 HB2 LEU A 47 -21.967 -2.499 -8.927 1.00 0.72 H new ATOM 0 HB3 LEU A 47 -20.774 -3.734 -9.279 1.00 0.72 H new ATOM 0 HG LEU A 47 -20.392 -2.847 -11.515 1.00 0.84 H new ATOM 0 HD11 LEU A 47 -21.620 -0.853 -12.347 1.00 0.89 H new ATOM 0 HD12 LEU A 47 -22.729 -2.209 -12.036 1.00 0.89 H new ATOM 0 HD13 LEU A 47 -22.623 -0.863 -10.877 1.00 0.89 H new ATOM 0 HD21 LEU A 47 -19.593 -0.550 -10.961 1.00 0.89 H new ATOM 0 HD22 LEU A 47 -20.585 -0.568 -9.484 1.00 0.89 H new ATOM 0 HD23 LEU A 47 -19.217 -1.693 -9.650 1.00 0.89 H new ATOM 769 N GLU A 48 -23.759 -5.619 -8.894 1.00 0.55 N ATOM 770 CA GLU A 48 -23.891 -6.924 -8.167 1.00 0.50 C ATOM 771 C GLU A 48 -23.110 -6.873 -6.845 1.00 0.44 C ATOM 772 O GLU A 48 -22.045 -7.439 -6.716 1.00 0.46 O ATOM 773 CB GLU A 48 -23.373 -8.072 -9.047 1.00 0.56 C ATOM 774 CG GLU A 48 -24.153 -9.348 -8.727 1.00 1.22 C ATOM 775 CD GLU A 48 -25.516 -9.301 -9.419 1.00 1.27 C ATOM 776 OE1 GLU A 48 -25.538 -9.192 -10.634 1.00 1.79 O ATOM 777 OE2 GLU A 48 -26.515 -9.373 -8.723 1.00 1.73 O ATOM 0 H GLU A 48 -24.549 -4.985 -8.780 1.00 0.55 H new ATOM 0 HA GLU A 48 -24.943 -7.100 -7.945 1.00 0.50 H new ATOM 0 HB2 GLU A 48 -23.487 -7.817 -10.101 1.00 0.56 H new ATOM 0 HB3 GLU A 48 -22.309 -8.229 -8.870 1.00 0.56 H new ATOM 0 HG2 GLU A 48 -23.594 -10.222 -9.061 1.00 1.22 H new ATOM 0 HG3 GLU A 48 -24.284 -9.446 -7.649 1.00 1.22 H new ATOM 784 N ILE A 49 -23.650 -6.204 -5.860 1.00 0.40 N ATOM 785 CA ILE A 49 -22.975 -6.104 -4.530 1.00 0.37 C ATOM 786 C ILE A 49 -24.073 -5.951 -3.466 1.00 0.37 C ATOM 787 O ILE A 49 -23.872 -6.218 -2.296 1.00 0.40 O ATOM 788 CB ILE A 49 -22.039 -4.870 -4.513 1.00 0.39 C ATOM 789 CG1 ILE A 49 -20.759 -5.131 -5.329 1.00 0.44 C ATOM 790 CG2 ILE A 49 -21.626 -4.524 -3.080 1.00 0.37 C ATOM 791 CD1 ILE A 49 -20.880 -4.480 -6.710 1.00 0.82 C ATOM 0 H ILE A 49 -24.543 -5.715 -5.921 1.00 0.40 H new ATOM 0 HA ILE A 49 -22.374 -6.991 -4.331 1.00 0.37 H new ATOM 0 HB ILE A 49 -22.594 -4.043 -4.955 1.00 0.39 H new ATOM 0 HG12 ILE A 49 -19.893 -4.729 -4.802 1.00 0.44 H new ATOM 0 HG13 ILE A 49 -20.598 -6.204 -5.436 1.00 0.44 H new ATOM 0 HG21 ILE A 49 -20.969 -3.654 -3.091 1.00 0.37 H new ATOM 0 HG22 ILE A 49 -22.514 -4.300 -2.489 1.00 0.37 H new ATOM 0 HG23 ILE A 49 -21.100 -5.371 -2.638 1.00 0.37 H new ATOM 0 HD11 ILE A 49 -19.971 -4.668 -7.282 1.00 0.82 H new ATOM 0 HD12 ILE A 49 -21.735 -4.902 -7.238 1.00 0.82 H new ATOM 0 HD13 ILE A 49 -21.020 -3.405 -6.595 1.00 0.82 H new ATOM 803 N ILE A 50 -25.248 -5.544 -3.883 1.00 0.43 N ATOM 804 CA ILE A 50 -26.377 -5.375 -2.920 1.00 0.48 C ATOM 805 C ILE A 50 -27.632 -5.997 -3.516 1.00 0.43 C ATOM 806 O ILE A 50 -27.932 -5.817 -4.680 1.00 0.49 O ATOM 807 CB ILE A 50 -26.612 -3.878 -2.671 1.00 0.56 C ATOM 808 CG1 ILE A 50 -25.382 -3.296 -1.985 1.00 0.62 C ATOM 809 CG2 ILE A 50 -27.837 -3.645 -1.768 1.00 0.67 C ATOM 810 CD1 ILE A 50 -25.606 -1.812 -1.713 1.00 0.74 C ATOM 0 H ILE A 50 -25.472 -5.321 -4.853 1.00 0.43 H new ATOM 0 HA ILE A 50 -26.138 -5.864 -1.976 1.00 0.48 H new ATOM 0 HB ILE A 50 -26.793 -3.393 -3.631 1.00 0.56 H new ATOM 0 HG12 ILE A 50 -25.190 -3.823 -1.050 1.00 0.62 H new ATOM 0 HG13 ILE A 50 -24.503 -3.433 -2.614 1.00 0.62 H new ATOM 0 HG21 ILE A 50 -27.975 -2.575 -1.611 1.00 0.67 H new ATOM 0 HG22 ILE A 50 -28.725 -4.060 -2.245 1.00 0.67 H new ATOM 0 HG23 ILE A 50 -27.679 -4.135 -0.807 1.00 0.67 H new ATOM 0 HD11 ILE A 50 -24.726 -1.395 -1.222 1.00 0.74 H new ATOM 0 HD12 ILE A 50 -25.777 -1.291 -2.655 1.00 0.74 H new ATOM 0 HD13 ILE A 50 -26.475 -1.688 -1.067 1.00 0.74 H new ATOM 822 N ARG A 51 -28.367 -6.727 -2.720 1.00 0.58 N ATOM 823 CA ARG A 51 -29.613 -7.367 -3.230 1.00 0.56 C ATOM 824 C ARG A 51 -30.836 -6.591 -2.755 1.00 0.53 C ATOM 825 O ARG A 51 -30.776 -5.788 -1.845 1.00 0.53 O ATOM 826 CB ARG A 51 -29.717 -8.803 -2.700 1.00 0.60 C ATOM 827 CG ARG A 51 -29.935 -9.816 -3.832 1.00 0.83 C ATOM 828 CD ARG A 51 -29.158 -11.083 -3.508 1.00 0.87 C ATOM 829 NE ARG A 51 -29.664 -12.202 -4.348 1.00 1.02 N ATOM 830 CZ ARG A 51 -29.447 -12.203 -5.634 1.00 1.06 C ATOM 831 NH1 ARG A 51 -28.775 -11.228 -6.185 1.00 1.47 N ATOM 832 NH2 ARG A 51 -29.899 -13.179 -6.369 1.00 1.39 N ATOM 0 H ARG A 51 -28.158 -6.907 -1.738 1.00 0.58 H new ATOM 0 HA ARG A 51 -29.576 -7.370 -4.319 1.00 0.56 H new ATOM 0 HB2 ARG A 51 -28.807 -9.056 -2.156 1.00 0.60 H new ATOM 0 HB3 ARG A 51 -30.541 -8.869 -1.990 1.00 0.60 H new ATOM 0 HG2 ARG A 51 -30.996 -10.040 -3.939 1.00 0.83 H new ATOM 0 HG3 ARG A 51 -29.600 -9.399 -4.782 1.00 0.83 H new ATOM 0 HD2 ARG A 51 -28.095 -10.928 -3.692 1.00 0.87 H new ATOM 0 HD3 ARG A 51 -29.266 -11.329 -2.452 1.00 0.87 H new ATOM 0 HE ARG A 51 -30.181 -12.969 -3.918 1.00 1.02 H new ATOM 0 HH11 ARG A 51 -28.419 -10.465 -5.609 1.00 1.47 H new ATOM 0 HH12 ARG A 51 -28.606 -11.230 -7.191 1.00 1.47 H new ATOM 0 HH21 ARG A 51 -30.422 -13.942 -5.939 1.00 1.39 H new ATOM 0 HH22 ARG A 51 -29.730 -13.181 -7.375 1.00 1.39 H new ATOM 846 N GLN A 52 -31.949 -6.861 -3.364 1.00 0.59 N ATOM 847 CA GLN A 52 -33.224 -6.192 -2.975 1.00 0.59 C ATOM 848 C GLN A 52 -34.053 -7.177 -2.158 1.00 0.56 C ATOM 849 O GLN A 52 -34.534 -8.162 -2.681 1.00 0.58 O ATOM 850 CB GLN A 52 -33.993 -5.804 -4.241 1.00 0.68 C ATOM 851 CG GLN A 52 -34.695 -4.462 -4.029 1.00 1.47 C ATOM 852 CD GLN A 52 -35.598 -4.169 -5.229 1.00 1.71 C ATOM 853 OE1 GLN A 52 -35.126 -3.769 -6.275 1.00 2.42 O ATOM 854 NE2 GLN A 52 -36.886 -4.354 -5.124 1.00 1.84 N ATOM 0 H GLN A 52 -32.036 -7.529 -4.130 1.00 0.59 H new ATOM 0 HA GLN A 52 -33.021 -5.297 -2.388 1.00 0.59 H new ATOM 0 HB2 GLN A 52 -33.309 -5.738 -5.087 1.00 0.68 H new ATOM 0 HB3 GLN A 52 -34.726 -6.574 -4.483 1.00 0.68 H new ATOM 0 HG2 GLN A 52 -35.285 -4.488 -3.113 1.00 1.47 H new ATOM 0 HG3 GLN A 52 -33.958 -3.668 -3.911 1.00 1.47 H new ATOM 0 HE21 GLN A 52 -37.283 -4.690 -4.247 1.00 1.84 H new ATOM 0 HE22 GLN A 52 -37.495 -4.163 -5.919 1.00 1.84 H new ATOM 863 N GLU A 53 -34.243 -6.917 -0.890 1.00 0.67 N ATOM 864 CA GLU A 53 -35.062 -7.835 -0.055 1.00 0.78 C ATOM 865 C GLU A 53 -36.361 -7.132 0.310 1.00 0.77 C ATOM 866 O GLU A 53 -36.400 -6.283 1.172 1.00 0.87 O ATOM 867 CB GLU A 53 -34.293 -8.176 1.221 1.00 1.04 C ATOM 868 CG GLU A 53 -34.122 -9.691 1.339 1.00 0.85 C ATOM 869 CD GLU A 53 -33.554 -10.032 2.718 1.00 1.59 C ATOM 870 OE1 GLU A 53 -33.357 -9.115 3.498 1.00 2.30 O ATOM 871 OE2 GLU A 53 -33.327 -11.203 2.972 1.00 2.25 O ATOM 0 H GLU A 53 -33.864 -6.107 -0.400 1.00 0.67 H new ATOM 0 HA GLU A 53 -35.276 -8.752 -0.604 1.00 0.78 H new ATOM 0 HB2 GLU A 53 -33.317 -7.691 1.208 1.00 1.04 H new ATOM 0 HB3 GLU A 53 -34.827 -7.793 2.091 1.00 1.04 H new ATOM 0 HG2 GLU A 53 -35.081 -10.189 1.195 1.00 0.85 H new ATOM 0 HG3 GLU A 53 -33.454 -10.055 0.558 1.00 0.85 H new ATOM 878 N GLY A 54 -37.427 -7.475 -0.342 1.00 0.73 N ATOM 879 CA GLY A 54 -38.722 -6.819 -0.034 1.00 0.75 C ATOM 880 C GLY A 54 -38.571 -5.301 -0.159 1.00 0.83 C ATOM 881 O GLY A 54 -39.124 -4.554 0.622 1.00 1.15 O ATOM 0 H GLY A 54 -37.460 -8.182 -1.076 1.00 0.73 H new ATOM 0 HA2 GLY A 54 -39.493 -7.175 -0.717 1.00 0.75 H new ATOM 0 HA3 GLY A 54 -39.043 -7.081 0.974 1.00 0.75 H new ATOM 885 N LYS A 55 -37.799 -4.846 -1.120 1.00 0.86 N ATOM 886 CA LYS A 55 -37.570 -3.376 -1.297 1.00 1.03 C ATOM 887 C LYS A 55 -36.496 -2.923 -0.308 1.00 1.02 C ATOM 888 O LYS A 55 -36.241 -1.747 -0.137 1.00 1.27 O ATOM 889 CB LYS A 55 -38.867 -2.602 -1.037 1.00 1.21 C ATOM 890 CG LYS A 55 -38.912 -1.356 -1.922 1.00 1.38 C ATOM 891 CD LYS A 55 -39.864 -0.329 -1.305 1.00 1.67 C ATOM 892 CE LYS A 55 -40.569 0.451 -2.416 1.00 1.89 C ATOM 893 NZ LYS A 55 -41.745 -0.327 -2.900 1.00 2.27 N ATOM 0 H LYS A 55 -37.314 -5.437 -1.795 1.00 0.86 H new ATOM 0 HA LYS A 55 -37.246 -3.179 -2.319 1.00 1.03 H new ATOM 0 HB2 LYS A 55 -39.728 -3.237 -1.244 1.00 1.21 H new ATOM 0 HB3 LYS A 55 -38.926 -2.316 0.013 1.00 1.21 H new ATOM 0 HG2 LYS A 55 -37.914 -0.930 -2.020 1.00 1.38 H new ATOM 0 HG3 LYS A 55 -39.246 -1.621 -2.925 1.00 1.38 H new ATOM 0 HD2 LYS A 55 -40.599 -0.832 -0.677 1.00 1.67 H new ATOM 0 HD3 LYS A 55 -39.310 0.355 -0.662 1.00 1.67 H new ATOM 0 HE2 LYS A 55 -40.891 1.424 -2.044 1.00 1.89 H new ATOM 0 HE3 LYS A 55 -39.879 0.637 -3.239 1.00 1.89 H new ATOM 0 HZ1 LYS A 55 -42.225 0.203 -3.655 1.00 2.27 H new ATOM 0 HZ2 LYS A 55 -41.426 -1.245 -3.270 1.00 2.27 H new ATOM 0 HZ3 LYS A 55 -42.406 -0.482 -2.113 1.00 2.27 H new ATOM 907 N GLN A 56 -35.890 -3.865 0.357 1.00 0.87 N ATOM 908 CA GLN A 56 -34.851 -3.534 1.365 1.00 0.97 C ATOM 909 C GLN A 56 -33.473 -3.787 0.749 1.00 0.89 C ATOM 910 O GLN A 56 -33.357 -4.496 -0.226 1.00 0.86 O ATOM 911 CB GLN A 56 -35.073 -4.440 2.578 1.00 1.04 C ATOM 912 CG GLN A 56 -34.479 -3.825 3.846 1.00 1.44 C ATOM 913 CD GLN A 56 -35.116 -4.489 5.068 1.00 1.38 C ATOM 914 OE1 GLN A 56 -36.247 -4.199 5.410 1.00 1.49 O ATOM 915 NE2 GLN A 56 -34.438 -5.374 5.745 1.00 2.04 N ATOM 0 H GLN A 56 -36.074 -4.862 0.242 1.00 0.87 H new ATOM 0 HA GLN A 56 -34.910 -2.490 1.672 1.00 0.97 H new ATOM 0 HB2 GLN A 56 -36.141 -4.608 2.718 1.00 1.04 H new ATOM 0 HB3 GLN A 56 -34.618 -5.414 2.396 1.00 1.04 H new ATOM 0 HG2 GLN A 56 -33.398 -3.966 3.862 1.00 1.44 H new ATOM 0 HG3 GLN A 56 -34.661 -2.750 3.864 1.00 1.44 H new ATOM 0 HE21 GLN A 56 -33.490 -5.618 5.459 1.00 2.04 H new ATOM 0 HE22 GLN A 56 -34.856 -5.822 6.560 1.00 2.04 H new ATOM 924 N TYR A 57 -32.435 -3.194 1.288 1.00 0.87 N ATOM 925 CA TYR A 57 -31.081 -3.385 0.695 1.00 0.80 C ATOM 926 C TYR A 57 -30.257 -4.354 1.533 1.00 0.79 C ATOM 927 O TYR A 57 -29.996 -4.121 2.695 1.00 0.95 O ATOM 928 CB TYR A 57 -30.370 -2.040 0.647 1.00 0.81 C ATOM 929 CG TYR A 57 -31.235 -1.052 -0.096 1.00 0.85 C ATOM 930 CD1 TYR A 57 -32.235 -0.351 0.584 1.00 1.34 C ATOM 931 CD2 TYR A 57 -31.047 -0.850 -1.469 1.00 1.49 C ATOM 932 CE1 TYR A 57 -33.047 0.556 -0.106 1.00 1.35 C ATOM 933 CE2 TYR A 57 -31.859 0.059 -2.159 1.00 1.56 C ATOM 934 CZ TYR A 57 -32.859 0.762 -1.477 1.00 0.98 C ATOM 935 OH TYR A 57 -33.660 1.656 -2.157 1.00 1.06 O ATOM 0 H TYR A 57 -32.470 -2.590 2.109 1.00 0.87 H new ATOM 0 HA TYR A 57 -31.190 -3.796 -0.309 1.00 0.80 H new ATOM 0 HB2 TYR A 57 -30.173 -1.682 1.658 1.00 0.81 H new ATOM 0 HB3 TYR A 57 -29.405 -2.142 0.151 1.00 0.81 H new ATOM 0 HD1 TYR A 57 -32.381 -0.509 1.642 1.00 1.34 H new ATOM 0 HD2 TYR A 57 -30.277 -1.394 -1.995 1.00 1.49 H new ATOM 0 HE1 TYR A 57 -33.819 1.097 0.420 1.00 1.35 H new ATOM 0 HE2 TYR A 57 -31.714 0.218 -3.217 1.00 1.56 H new ATOM 0 HH TYR A 57 -33.396 1.680 -3.100 1.00 1.06 H new ATOM 945 N MET A 58 -29.861 -5.444 0.932 1.00 0.66 N ATOM 946 CA MET A 58 -29.058 -6.466 1.650 1.00 0.67 C ATOM 947 C MET A 58 -27.805 -6.773 0.833 1.00 0.57 C ATOM 948 O MET A 58 -27.617 -6.242 -0.239 1.00 0.51 O ATOM 949 CB MET A 58 -29.898 -7.720 1.929 1.00 0.73 C ATOM 950 CG MET A 58 -29.528 -8.860 0.983 1.00 0.90 C ATOM 951 SD MET A 58 -30.780 -10.162 1.101 1.00 1.22 S ATOM 952 CE MET A 58 -29.698 -11.456 1.758 1.00 1.60 C ATOM 0 H MET A 58 -30.065 -5.669 -0.042 1.00 0.66 H new ATOM 0 HA MET A 58 -28.747 -6.083 2.622 1.00 0.67 H new ATOM 0 HB2 MET A 58 -29.748 -8.038 2.961 1.00 0.73 H new ATOM 0 HB3 MET A 58 -30.956 -7.483 1.819 1.00 0.73 H new ATOM 0 HG2 MET A 58 -29.464 -8.492 -0.041 1.00 0.90 H new ATOM 0 HG3 MET A 58 -28.547 -9.258 1.241 1.00 0.90 H new ATOM 0 HE1 MET A 58 -30.274 -12.369 1.911 1.00 1.60 H new ATOM 0 HE2 MET A 58 -28.892 -11.650 1.051 1.00 1.60 H new ATOM 0 HE3 MET A 58 -29.276 -11.130 2.709 1.00 1.60 H new ATOM 962 N LEU A 59 -26.918 -7.560 1.360 1.00 0.59 N ATOM 963 CA LEU A 59 -25.636 -7.813 0.637 1.00 0.52 C ATOM 964 C LEU A 59 -25.706 -9.094 -0.201 1.00 0.46 C ATOM 965 O LEU A 59 -26.291 -10.083 0.190 1.00 0.53 O ATOM 966 CB LEU A 59 -24.494 -7.937 1.667 1.00 0.63 C ATOM 967 CG LEU A 59 -24.530 -9.295 2.402 1.00 0.71 C ATOM 968 CD1 LEU A 59 -23.383 -9.344 3.410 1.00 1.03 C ATOM 969 CD2 LEU A 59 -25.856 -9.465 3.154 1.00 1.16 C ATOM 0 H LEU A 59 -27.018 -8.040 2.255 1.00 0.59 H new ATOM 0 HA LEU A 59 -25.453 -6.978 -0.039 1.00 0.52 H new ATOM 0 HB2 LEU A 59 -23.535 -7.822 1.162 1.00 0.63 H new ATOM 0 HB3 LEU A 59 -24.570 -7.128 2.394 1.00 0.63 H new ATOM 0 HG LEU A 59 -24.432 -10.096 1.669 1.00 0.71 H new ATOM 0 HD11 LEU A 59 -23.400 -10.299 3.934 1.00 1.03 H new ATOM 0 HD12 LEU A 59 -22.433 -9.234 2.886 1.00 1.03 H new ATOM 0 HD13 LEU A 59 -23.496 -8.533 4.130 1.00 1.03 H new ATOM 0 HD21 LEU A 59 -25.863 -10.427 3.666 1.00 1.16 H new ATOM 0 HD22 LEU A 59 -25.965 -8.664 3.885 1.00 1.16 H new ATOM 0 HD23 LEU A 59 -26.684 -9.424 2.446 1.00 1.16 H new ATOM 981 N THR A 60 -25.116 -9.065 -1.373 1.00 0.39 N ATOM 982 CA THR A 60 -25.150 -10.265 -2.262 1.00 0.41 C ATOM 983 C THR A 60 -23.844 -11.044 -2.084 1.00 0.46 C ATOM 984 O THR A 60 -22.888 -10.538 -1.530 1.00 0.43 O ATOM 985 CB THR A 60 -25.248 -9.840 -3.736 1.00 0.40 C ATOM 986 OG1 THR A 60 -23.976 -9.384 -4.173 1.00 1.12 O ATOM 987 CG2 THR A 60 -26.275 -8.718 -3.917 1.00 1.04 C ATOM 0 H THR A 60 -24.613 -8.262 -1.750 1.00 0.39 H new ATOM 0 HA THR A 60 -26.015 -10.873 -1.998 1.00 0.41 H new ATOM 0 HB THR A 60 -25.568 -10.699 -4.325 1.00 0.40 H new ATOM 0 HG1 THR A 60 -24.031 -9.113 -5.113 1.00 1.12 H new ATOM 0 HG21 THR A 60 -26.324 -8.436 -4.969 1.00 1.04 H new ATOM 0 HG22 THR A 60 -27.255 -9.065 -3.588 1.00 1.04 H new ATOM 0 HG23 THR A 60 -25.978 -7.853 -3.323 1.00 1.04 H new ATOM 995 N LYS A 61 -23.793 -12.266 -2.553 1.00 0.54 N ATOM 996 CA LYS A 61 -22.539 -13.070 -2.417 1.00 0.61 C ATOM 997 C LYS A 61 -21.344 -12.187 -2.789 1.00 0.57 C ATOM 998 O LYS A 61 -20.325 -12.164 -2.129 1.00 0.56 O ATOM 999 CB LYS A 61 -22.582 -14.260 -3.380 1.00 0.70 C ATOM 1000 CG LYS A 61 -23.829 -15.109 -3.118 1.00 1.39 C ATOM 1001 CD LYS A 61 -24.408 -15.600 -4.449 1.00 0.99 C ATOM 1002 CE LYS A 61 -23.301 -16.240 -5.294 1.00 1.84 C ATOM 1003 NZ LYS A 61 -23.841 -17.436 -6.001 1.00 2.26 N ATOM 0 H LYS A 61 -24.564 -12.741 -3.023 1.00 0.54 H new ATOM 0 HA LYS A 61 -22.447 -13.429 -1.392 1.00 0.61 H new ATOM 0 HB2 LYS A 61 -22.586 -13.903 -4.410 1.00 0.70 H new ATOM 0 HB3 LYS A 61 -21.686 -14.869 -3.257 1.00 0.70 H new ATOM 0 HG2 LYS A 61 -23.575 -15.959 -2.485 1.00 1.39 H new ATOM 0 HG3 LYS A 61 -24.574 -14.522 -2.581 1.00 1.39 H new ATOM 0 HD2 LYS A 61 -25.202 -16.324 -4.265 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -24.855 -14.767 -4.991 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -22.919 -15.519 -6.017 1.00 1.84 H new ATOM 0 HE3 LYS A 61 -22.464 -16.528 -4.658 1.00 1.84 H new ATOM 0 HZ1 LYS A 61 -23.089 -17.869 -6.574 1.00 2.26 H new ATOM 0 HZ2 LYS A 61 -24.186 -18.126 -5.303 1.00 2.26 H new ATOM 0 HZ3 LYS A 61 -24.626 -17.148 -6.620 1.00 2.26 H new ATOM 1017 N LYS A 62 -21.480 -11.469 -3.860 1.00 0.57 N ATOM 1018 CA LYS A 62 -20.386 -10.573 -4.323 1.00 0.56 C ATOM 1019 C LYS A 62 -20.123 -9.480 -3.280 1.00 0.50 C ATOM 1020 O LYS A 62 -19.007 -9.025 -3.116 1.00 0.58 O ATOM 1021 CB LYS A 62 -20.789 -9.933 -5.652 1.00 0.59 C ATOM 1022 CG LYS A 62 -20.906 -11.016 -6.726 1.00 0.78 C ATOM 1023 CD LYS A 62 -19.561 -11.183 -7.437 1.00 1.25 C ATOM 1024 CE LYS A 62 -19.669 -12.297 -8.480 1.00 1.29 C ATOM 1025 NZ LYS A 62 -19.027 -11.855 -9.751 1.00 2.14 N ATOM 0 H LYS A 62 -22.315 -11.462 -4.446 1.00 0.57 H new ATOM 0 HA LYS A 62 -19.475 -11.156 -4.458 1.00 0.56 H new ATOM 0 HB2 LYS A 62 -21.739 -9.410 -5.543 1.00 0.59 H new ATOM 0 HB3 LYS A 62 -20.049 -9.190 -5.949 1.00 0.59 H new ATOM 0 HG2 LYS A 62 -21.209 -11.960 -6.273 1.00 0.78 H new ATOM 0 HG3 LYS A 62 -21.678 -10.746 -7.446 1.00 0.78 H new ATOM 0 HD2 LYS A 62 -19.273 -10.248 -7.917 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -18.782 -11.423 -6.713 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -19.186 -13.202 -8.112 1.00 1.29 H new ATOM 0 HE3 LYS A 62 -20.716 -12.544 -8.656 1.00 1.29 H new ATOM 0 HZ1 LYS A 62 -19.101 -12.613 -10.459 1.00 2.14 H new ATOM 0 HZ2 LYS A 62 -19.507 -11.003 -10.104 1.00 2.14 H new ATOM 0 HZ3 LYS A 62 -18.024 -11.640 -9.577 1.00 2.14 H new ATOM 1039 N GLY A 63 -21.141 -9.039 -2.587 1.00 0.43 N ATOM 1040 CA GLY A 63 -20.937 -7.959 -1.579 1.00 0.38 C ATOM 1041 C GLY A 63 -20.189 -8.486 -0.350 1.00 0.40 C ATOM 1042 O GLY A 63 -19.304 -7.832 0.166 1.00 0.39 O ATOM 0 H GLY A 63 -22.099 -9.378 -2.675 1.00 0.43 H new ATOM 0 HA2 GLY A 63 -20.374 -7.140 -2.028 1.00 0.38 H new ATOM 0 HA3 GLY A 63 -21.902 -7.554 -1.275 1.00 0.38 H new ATOM 1046 N GLU A 64 -20.520 -9.653 0.125 1.00 0.46 N ATOM 1047 CA GLU A 64 -19.798 -10.192 1.320 1.00 0.51 C ATOM 1048 C GLU A 64 -18.333 -10.454 0.960 1.00 0.51 C ATOM 1049 O GLU A 64 -17.424 -10.042 1.654 1.00 0.50 O ATOM 1050 CB GLU A 64 -20.444 -11.492 1.799 1.00 0.60 C ATOM 1051 CG GLU A 64 -21.655 -11.799 0.934 1.00 0.65 C ATOM 1052 CD GLU A 64 -22.329 -13.081 1.426 1.00 0.80 C ATOM 1053 OE1 GLU A 64 -21.799 -13.693 2.339 1.00 1.25 O ATOM 1054 OE2 GLU A 64 -23.364 -13.429 0.882 1.00 1.40 O ATOM 0 H GLU A 64 -21.251 -10.255 -0.254 1.00 0.46 H new ATOM 0 HA GLU A 64 -19.856 -9.456 2.122 1.00 0.51 H new ATOM 0 HB2 GLU A 64 -19.726 -12.310 1.743 1.00 0.60 H new ATOM 0 HB3 GLU A 64 -20.742 -11.400 2.843 1.00 0.60 H new ATOM 0 HG2 GLU A 64 -22.360 -10.969 0.971 1.00 0.65 H new ATOM 0 HG3 GLU A 64 -21.351 -11.913 -0.107 1.00 0.65 H new ATOM 1061 N GLU A 65 -18.107 -11.145 -0.123 1.00 0.55 N ATOM 1062 CA GLU A 65 -16.709 -11.449 -0.538 1.00 0.58 C ATOM 1063 C GLU A 65 -15.936 -10.143 -0.715 1.00 0.52 C ATOM 1064 O GLU A 65 -14.771 -10.049 -0.382 1.00 0.53 O ATOM 1065 CB GLU A 65 -16.724 -12.214 -1.864 1.00 0.64 C ATOM 1066 CG GLU A 65 -17.242 -13.634 -1.629 1.00 0.72 C ATOM 1067 CD GLU A 65 -17.213 -14.412 -2.945 1.00 1.15 C ATOM 1068 OE1 GLU A 65 -17.383 -13.791 -3.982 1.00 1.82 O ATOM 1069 OE2 GLU A 65 -17.022 -15.616 -2.895 1.00 1.69 O ATOM 0 H GLU A 65 -18.832 -11.513 -0.739 1.00 0.55 H new ATOM 0 HA GLU A 65 -16.228 -12.058 0.228 1.00 0.58 H new ATOM 0 HB2 GLU A 65 -17.358 -11.699 -2.586 1.00 0.64 H new ATOM 0 HB3 GLU A 65 -15.720 -12.247 -2.288 1.00 0.64 H new ATOM 0 HG2 GLU A 65 -16.628 -14.138 -0.883 1.00 0.72 H new ATOM 0 HG3 GLU A 65 -18.258 -13.601 -1.236 1.00 0.72 H new ATOM 1076 N LEU A 66 -16.575 -9.132 -1.235 1.00 0.50 N ATOM 1077 CA LEU A 66 -15.872 -7.835 -1.429 1.00 0.48 C ATOM 1078 C LEU A 66 -15.645 -7.171 -0.069 1.00 0.44 C ATOM 1079 O LEU A 66 -14.608 -6.589 0.180 1.00 0.45 O ATOM 1080 CB LEU A 66 -16.722 -6.924 -2.325 1.00 0.46 C ATOM 1081 CG LEU A 66 -16.106 -5.523 -2.397 1.00 0.62 C ATOM 1082 CD1 LEU A 66 -14.667 -5.615 -2.899 1.00 0.77 C ATOM 1083 CD2 LEU A 66 -16.920 -4.671 -3.365 1.00 1.54 C ATOM 0 H LEU A 66 -17.550 -9.148 -1.533 1.00 0.50 H new ATOM 0 HA LEU A 66 -14.908 -8.006 -1.907 1.00 0.48 H new ATOM 0 HB2 LEU A 66 -16.792 -7.350 -3.326 1.00 0.46 H new ATOM 0 HB3 LEU A 66 -17.737 -6.862 -1.933 1.00 0.46 H new ATOM 0 HG LEU A 66 -16.113 -5.073 -1.404 1.00 0.62 H new ATOM 0 HD11 LEU A 66 -14.234 -4.616 -2.948 1.00 0.77 H new ATOM 0 HD12 LEU A 66 -14.082 -6.231 -2.216 1.00 0.77 H new ATOM 0 HD13 LEU A 66 -14.656 -6.064 -3.892 1.00 0.77 H new ATOM 0 HD21 LEU A 66 -16.488 -3.672 -3.422 1.00 1.54 H new ATOM 0 HD22 LEU A 66 -16.906 -5.130 -4.354 1.00 1.54 H new ATOM 0 HD23 LEU A 66 -17.949 -4.602 -3.012 1.00 1.54 H new ATOM 1095 N LEU A 67 -16.600 -7.255 0.819 1.00 0.43 N ATOM 1096 CA LEU A 67 -16.426 -6.631 2.160 1.00 0.43 C ATOM 1097 C LEU A 67 -15.132 -7.140 2.794 1.00 0.46 C ATOM 1098 O LEU A 67 -14.345 -6.378 3.322 1.00 0.48 O ATOM 1099 CB LEU A 67 -17.611 -6.999 3.055 1.00 0.46 C ATOM 1100 CG LEU A 67 -17.678 -6.030 4.237 1.00 0.61 C ATOM 1101 CD1 LEU A 67 -18.568 -4.840 3.873 1.00 0.89 C ATOM 1102 CD2 LEU A 67 -18.266 -6.750 5.453 1.00 1.39 C ATOM 0 H LEU A 67 -17.491 -7.729 0.672 1.00 0.43 H new ATOM 0 HA LEU A 67 -16.377 -5.548 2.051 1.00 0.43 H new ATOM 0 HB2 LEU A 67 -18.538 -6.957 2.484 1.00 0.46 H new ATOM 0 HB3 LEU A 67 -17.504 -8.022 3.415 1.00 0.46 H new ATOM 0 HG LEU A 67 -16.675 -5.675 4.472 1.00 0.61 H new ATOM 0 HD11 LEU A 67 -18.615 -4.150 4.715 1.00 0.89 H new ATOM 0 HD12 LEU A 67 -18.152 -4.326 3.006 1.00 0.89 H new ATOM 0 HD13 LEU A 67 -19.571 -5.195 3.638 1.00 0.89 H new ATOM 0 HD21 LEU A 67 -18.314 -6.061 6.296 1.00 1.39 H new ATOM 0 HD22 LEU A 67 -19.269 -7.104 5.216 1.00 1.39 H new ATOM 0 HD23 LEU A 67 -17.634 -7.599 5.714 1.00 1.39 H new ATOM 1114 N GLU A 68 -14.901 -8.424 2.742 1.00 0.50 N ATOM 1115 CA GLU A 68 -13.655 -8.978 3.338 1.00 0.55 C ATOM 1116 C GLU A 68 -12.453 -8.478 2.539 1.00 0.52 C ATOM 1117 O GLU A 68 -11.447 -8.081 3.092 1.00 0.52 O ATOM 1118 CB GLU A 68 -13.700 -10.506 3.290 1.00 0.62 C ATOM 1119 CG GLU A 68 -14.127 -11.049 4.656 1.00 1.34 C ATOM 1120 CD GLU A 68 -14.299 -12.566 4.572 1.00 1.80 C ATOM 1121 OE1 GLU A 68 -14.877 -13.023 3.599 1.00 2.26 O ATOM 1122 OE2 GLU A 68 -13.850 -13.245 5.481 1.00 2.26 O ATOM 0 H GLU A 68 -15.521 -9.111 2.313 1.00 0.50 H new ATOM 0 HA GLU A 68 -13.568 -8.653 4.375 1.00 0.55 H new ATOM 0 HB2 GLU A 68 -14.399 -10.836 2.521 1.00 0.62 H new ATOM 0 HB3 GLU A 68 -12.720 -10.901 3.020 1.00 0.62 H new ATOM 0 HG2 GLU A 68 -13.379 -10.798 5.408 1.00 1.34 H new ATOM 0 HG3 GLU A 68 -15.062 -10.583 4.968 1.00 1.34 H new ATOM 1129 N ASP A 69 -12.556 -8.481 1.238 1.00 0.51 N ATOM 1130 CA ASP A 69 -11.424 -7.993 0.406 1.00 0.51 C ATOM 1131 C ASP A 69 -11.103 -6.550 0.797 1.00 0.46 C ATOM 1132 O ASP A 69 -9.961 -6.194 1.011 1.00 0.48 O ATOM 1133 CB ASP A 69 -11.809 -8.049 -1.073 1.00 0.53 C ATOM 1134 CG ASP A 69 -11.956 -9.507 -1.510 1.00 0.62 C ATOM 1135 OD1 ASP A 69 -11.686 -10.378 -0.700 1.00 1.34 O ATOM 1136 OD2 ASP A 69 -12.337 -9.729 -2.648 1.00 1.13 O ATOM 0 H ASP A 69 -13.374 -8.800 0.718 1.00 0.51 H new ATOM 0 HA ASP A 69 -10.550 -8.623 0.571 1.00 0.51 H new ATOM 0 HB2 ASP A 69 -12.744 -7.514 -1.236 1.00 0.53 H new ATOM 0 HB3 ASP A 69 -11.049 -7.553 -1.676 1.00 0.53 H new ATOM 1141 N ILE A 70 -12.103 -5.713 0.898 1.00 0.43 N ATOM 1142 CA ILE A 70 -11.851 -4.295 1.281 1.00 0.43 C ATOM 1143 C ILE A 70 -11.122 -4.253 2.625 1.00 0.42 C ATOM 1144 O ILE A 70 -10.219 -3.466 2.830 1.00 0.43 O ATOM 1145 CB ILE A 70 -13.184 -3.553 1.401 1.00 0.48 C ATOM 1146 CG1 ILE A 70 -13.645 -3.108 0.011 1.00 0.89 C ATOM 1147 CG2 ILE A 70 -13.006 -2.324 2.295 1.00 0.78 C ATOM 1148 CD1 ILE A 70 -15.096 -2.630 0.079 1.00 1.29 C ATOM 0 H ILE A 70 -13.081 -5.951 0.732 1.00 0.43 H new ATOM 0 HA ILE A 70 -11.237 -3.816 0.518 1.00 0.43 H new ATOM 0 HB ILE A 70 -13.931 -4.216 1.839 1.00 0.48 H new ATOM 0 HG12 ILE A 70 -13.004 -2.306 -0.356 1.00 0.89 H new ATOM 0 HG13 ILE A 70 -13.557 -3.934 -0.694 1.00 0.89 H new ATOM 0 HG21 ILE A 70 -13.956 -1.796 2.380 1.00 0.78 H new ATOM 0 HG22 ILE A 70 -12.676 -2.639 3.285 1.00 0.78 H new ATOM 0 HG23 ILE A 70 -12.260 -1.661 1.857 1.00 0.78 H new ATOM 0 HD11 ILE A 70 -15.422 -2.314 -0.912 1.00 1.29 H new ATOM 0 HD12 ILE A 70 -15.731 -3.444 0.427 1.00 1.29 H new ATOM 0 HD13 ILE A 70 -15.171 -1.791 0.770 1.00 1.29 H new ATOM 1160 N ARG A 71 -11.504 -5.099 3.539 1.00 0.43 N ATOM 1161 CA ARG A 71 -10.833 -5.118 4.868 1.00 0.47 C ATOM 1162 C ARG A 71 -9.333 -5.372 4.687 1.00 0.48 C ATOM 1163 O ARG A 71 -8.505 -4.716 5.287 1.00 0.51 O ATOM 1164 CB ARG A 71 -11.441 -6.234 5.720 1.00 0.51 C ATOM 1165 CG ARG A 71 -11.885 -5.665 7.070 1.00 0.81 C ATOM 1166 CD ARG A 71 -12.545 -6.769 7.898 1.00 1.02 C ATOM 1167 NE ARG A 71 -13.914 -6.340 8.297 1.00 1.58 N ATOM 1168 CZ ARG A 71 -14.733 -7.196 8.845 1.00 2.24 C ATOM 1169 NH1 ARG A 71 -14.353 -8.428 9.044 1.00 2.68 N ATOM 1170 NH2 ARG A 71 -15.933 -6.819 9.194 1.00 3.04 N ATOM 0 H ARG A 71 -12.254 -5.780 3.423 1.00 0.43 H new ATOM 0 HA ARG A 71 -10.976 -4.157 5.362 1.00 0.47 H new ATOM 0 HB2 ARG A 71 -12.292 -6.677 5.203 1.00 0.51 H new ATOM 0 HB3 ARG A 71 -10.711 -7.029 5.871 1.00 0.51 H new ATOM 0 HG2 ARG A 71 -11.027 -5.258 7.605 1.00 0.81 H new ATOM 0 HG3 ARG A 71 -12.584 -4.843 6.918 1.00 0.81 H new ATOM 0 HD2 ARG A 71 -12.596 -7.691 7.319 1.00 1.02 H new ATOM 0 HD3 ARG A 71 -11.946 -6.981 8.784 1.00 1.02 H new ATOM 0 HE ARG A 71 -14.212 -5.377 8.142 1.00 1.58 H new ATOM 0 HH11 ARG A 71 -13.415 -8.723 8.771 1.00 2.68 H new ATOM 0 HH12 ARG A 71 -14.993 -9.096 9.472 1.00 2.68 H new ATOM 0 HH21 ARG A 71 -16.230 -5.856 9.038 1.00 3.04 H new ATOM 0 HH22 ARG A 71 -16.573 -7.488 9.622 1.00 3.04 H new ATOM 1184 N LYS A 72 -8.982 -6.330 3.872 1.00 0.49 N ATOM 1185 CA LYS A 72 -7.540 -6.647 3.655 1.00 0.52 C ATOM 1186 C LYS A 72 -6.806 -5.429 3.075 1.00 0.49 C ATOM 1187 O LYS A 72 -5.893 -4.900 3.678 1.00 0.50 O ATOM 1188 CB LYS A 72 -7.427 -7.825 2.688 1.00 0.57 C ATOM 1189 CG LYS A 72 -7.553 -9.136 3.467 1.00 0.69 C ATOM 1190 CD LYS A 72 -7.788 -10.292 2.493 1.00 0.93 C ATOM 1191 CE LYS A 72 -9.248 -10.736 2.573 1.00 1.44 C ATOM 1192 NZ LYS A 72 -9.540 -11.687 1.463 1.00 1.87 N ATOM 0 H LYS A 72 -9.635 -6.910 3.345 1.00 0.49 H new ATOM 0 HA LYS A 72 -7.083 -6.906 4.610 1.00 0.52 H new ATOM 0 HB2 LYS A 72 -8.208 -7.763 1.930 1.00 0.57 H new ATOM 0 HB3 LYS A 72 -6.471 -7.790 2.165 1.00 0.57 H new ATOM 0 HG2 LYS A 72 -6.648 -9.314 4.047 1.00 0.69 H new ATOM 0 HG3 LYS A 72 -8.378 -9.071 4.176 1.00 0.69 H new ATOM 0 HD2 LYS A 72 -7.547 -9.980 1.477 1.00 0.93 H new ATOM 0 HD3 LYS A 72 -7.129 -11.126 2.736 1.00 0.93 H new ATOM 0 HE2 LYS A 72 -9.442 -11.212 3.534 1.00 1.44 H new ATOM 0 HE3 LYS A 72 -9.907 -9.870 2.507 1.00 1.44 H new ATOM 0 HZ1 LYS A 72 -10.209 -11.249 0.798 1.00 1.87 H new ATOM 0 HZ2 LYS A 72 -8.658 -11.920 0.964 1.00 1.87 H new ATOM 0 HZ3 LYS A 72 -9.958 -12.557 1.852 1.00 1.87 H new ATOM 1206 N PHE A 73 -7.196 -4.989 1.907 1.00 0.48 N ATOM 1207 CA PHE A 73 -6.527 -3.810 1.268 1.00 0.47 C ATOM 1208 C PHE A 73 -6.268 -2.715 2.307 1.00 0.46 C ATOM 1209 O PHE A 73 -5.150 -2.287 2.510 1.00 0.46 O ATOM 1210 CB PHE A 73 -7.445 -3.268 0.171 1.00 0.45 C ATOM 1211 CG PHE A 73 -7.667 -1.787 0.369 1.00 0.46 C ATOM 1212 CD1 PHE A 73 -6.639 -0.882 0.091 1.00 1.35 C ATOM 1213 CD2 PHE A 73 -8.904 -1.319 0.831 1.00 1.20 C ATOM 1214 CE1 PHE A 73 -6.843 0.491 0.274 1.00 1.34 C ATOM 1215 CE2 PHE A 73 -9.110 0.052 1.015 1.00 1.27 C ATOM 1216 CZ PHE A 73 -8.079 0.959 0.736 1.00 0.58 C ATOM 0 H PHE A 73 -7.955 -5.397 1.362 1.00 0.48 H new ATOM 0 HA PHE A 73 -5.571 -4.118 0.845 1.00 0.47 H new ATOM 0 HB2 PHE A 73 -7.002 -3.450 -0.808 1.00 0.45 H new ATOM 0 HB3 PHE A 73 -8.400 -3.793 0.192 1.00 0.45 H new ATOM 0 HD1 PHE A 73 -5.685 -1.242 -0.266 1.00 1.35 H new ATOM 0 HD2 PHE A 73 -9.699 -2.018 1.045 1.00 1.20 H new ATOM 0 HE1 PHE A 73 -6.047 1.189 0.059 1.00 1.34 H new ATOM 0 HE2 PHE A 73 -10.064 0.412 1.372 1.00 1.27 H new ATOM 0 HZ PHE A 73 -8.238 2.018 0.877 1.00 0.58 H new ATOM 1226 N ASN A 74 -7.296 -2.258 2.957 1.00 0.47 N ATOM 1227 CA ASN A 74 -7.111 -1.187 3.974 1.00 0.48 C ATOM 1228 C ASN A 74 -6.164 -1.690 5.057 1.00 0.50 C ATOM 1229 O ASN A 74 -5.384 -0.942 5.610 1.00 0.52 O ATOM 1230 CB ASN A 74 -8.461 -0.825 4.596 1.00 0.48 C ATOM 1231 CG ASN A 74 -8.241 -0.252 5.997 1.00 0.67 C ATOM 1232 OD1 ASN A 74 -8.305 -0.969 6.976 1.00 1.58 O ATOM 1233 ND2 ASN A 74 -7.982 1.020 6.135 1.00 1.06 N ATOM 0 H ASN A 74 -8.256 -2.578 2.830 1.00 0.47 H new ATOM 0 HA ASN A 74 -6.690 -0.300 3.500 1.00 0.48 H new ATOM 0 HB2 ASN A 74 -8.978 -0.097 3.971 1.00 0.48 H new ATOM 0 HB3 ASN A 74 -9.097 -1.708 4.649 1.00 0.48 H new ATOM 0 HD21 ASN A 74 -7.833 1.412 7.065 1.00 1.06 H new ATOM 0 HD22 ASN A 74 -7.928 1.622 5.313 1.00 1.06 H new ATOM 1240 N GLU A 75 -6.224 -2.951 5.364 1.00 0.51 N ATOM 1241 CA GLU A 75 -5.322 -3.490 6.414 1.00 0.55 C ATOM 1242 C GLU A 75 -3.902 -3.583 5.856 1.00 0.55 C ATOM 1243 O GLU A 75 -2.946 -3.319 6.558 1.00 0.65 O ATOM 1244 CB GLU A 75 -5.813 -4.872 6.867 1.00 0.59 C ATOM 1245 CG GLU A 75 -4.623 -5.770 7.230 1.00 0.87 C ATOM 1246 CD GLU A 75 -5.116 -6.975 8.028 1.00 1.22 C ATOM 1247 OE1 GLU A 75 -5.555 -6.778 9.147 1.00 1.79 O ATOM 1248 OE2 GLU A 75 -5.039 -8.075 7.507 1.00 1.77 O ATOM 0 H GLU A 75 -6.855 -3.629 4.937 1.00 0.51 H new ATOM 0 HA GLU A 75 -5.324 -2.825 7.278 1.00 0.55 H new ATOM 0 HB2 GLU A 75 -6.473 -4.766 7.728 1.00 0.59 H new ATOM 0 HB3 GLU A 75 -6.398 -5.336 6.072 1.00 0.59 H new ATOM 0 HG2 GLU A 75 -4.116 -6.103 6.324 1.00 0.87 H new ATOM 0 HG3 GLU A 75 -3.895 -5.207 7.814 1.00 0.87 H new ATOM 1255 N MET A 76 -3.734 -3.946 4.609 1.00 0.52 N ATOM 1256 CA MET A 76 -2.361 -4.036 4.052 1.00 0.51 C ATOM 1257 C MET A 76 -1.925 -2.646 3.599 1.00 0.51 C ATOM 1258 O MET A 76 -0.782 -2.262 3.749 1.00 0.52 O ATOM 1259 CB MET A 76 -2.364 -4.986 2.852 1.00 0.50 C ATOM 1260 CG MET A 76 -2.820 -6.376 3.304 1.00 0.52 C ATOM 1261 SD MET A 76 -1.607 -7.613 2.785 1.00 0.55 S ATOM 1262 CE MET A 76 -2.232 -8.980 3.794 1.00 0.65 C ATOM 0 H MET A 76 -4.486 -4.181 3.961 1.00 0.52 H new ATOM 0 HA MET A 76 -1.673 -4.413 4.809 1.00 0.51 H new ATOM 0 HB2 MET A 76 -3.030 -4.607 2.076 1.00 0.50 H new ATOM 0 HB3 MET A 76 -1.366 -5.042 2.416 1.00 0.50 H new ATOM 0 HG2 MET A 76 -2.935 -6.397 4.388 1.00 0.52 H new ATOM 0 HG3 MET A 76 -3.795 -6.607 2.876 1.00 0.52 H new ATOM 0 HE1 MET A 76 -1.618 -9.865 3.627 1.00 0.65 H new ATOM 0 HE2 MET A 76 -2.191 -8.703 4.847 1.00 0.65 H new ATOM 0 HE3 MET A 76 -3.263 -9.196 3.515 1.00 0.65 H new ATOM 1272 N ARG A 77 -2.833 -1.880 3.051 1.00 0.50 N ATOM 1273 CA ARG A 77 -2.477 -0.509 2.599 1.00 0.50 C ATOM 1274 C ARG A 77 -1.931 0.292 3.781 1.00 0.51 C ATOM 1275 O ARG A 77 -0.904 0.935 3.690 1.00 0.52 O ATOM 1276 CB ARG A 77 -3.721 0.186 2.045 1.00 0.49 C ATOM 1277 CG ARG A 77 -3.354 1.596 1.576 1.00 0.52 C ATOM 1278 CD ARG A 77 -3.917 2.624 2.559 1.00 0.54 C ATOM 1279 NE ARG A 77 -3.386 3.975 2.222 1.00 0.85 N ATOM 1280 CZ ARG A 77 -3.470 4.945 3.090 1.00 1.35 C ATOM 1281 NH1 ARG A 77 -4.021 4.734 4.254 1.00 1.85 N ATOM 1282 NH2 ARG A 77 -3.001 6.127 2.796 1.00 1.84 N ATOM 0 H ARG A 77 -3.805 -2.148 2.898 1.00 0.50 H new ATOM 0 HA ARG A 77 -1.718 -0.571 1.819 1.00 0.50 H new ATOM 0 HB2 ARG A 77 -4.132 -0.389 1.215 1.00 0.49 H new ATOM 0 HB3 ARG A 77 -4.494 0.236 2.812 1.00 0.49 H new ATOM 0 HG2 ARG A 77 -2.271 1.698 1.508 1.00 0.52 H new ATOM 0 HG3 ARG A 77 -3.754 1.774 0.578 1.00 0.52 H new ATOM 0 HD2 ARG A 77 -5.006 2.628 2.514 1.00 0.54 H new ATOM 0 HD3 ARG A 77 -3.641 2.357 3.579 1.00 0.54 H new ATOM 0 HE ARG A 77 -2.957 4.141 1.312 1.00 0.85 H new ATOM 0 HH11 ARG A 77 -4.386 3.810 4.485 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -4.086 5.493 4.932 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -2.569 6.293 1.887 1.00 1.84 H new ATOM 0 HH22 ARG A 77 -3.067 6.885 3.475 1.00 1.84 H new ATOM 1296 N LYS A 78 -2.606 0.243 4.897 1.00 0.51 N ATOM 1297 CA LYS A 78 -2.120 0.983 6.093 1.00 0.52 C ATOM 1298 C LYS A 78 -0.787 0.372 6.518 1.00 0.53 C ATOM 1299 O LYS A 78 0.104 1.053 6.987 1.00 0.55 O ATOM 1300 CB LYS A 78 -3.146 0.863 7.226 1.00 0.52 C ATOM 1301 CG LYS A 78 -2.439 0.942 8.581 1.00 0.90 C ATOM 1302 CD LYS A 78 -3.453 1.294 9.673 1.00 1.04 C ATOM 1303 CE LYS A 78 -4.674 0.378 9.560 1.00 1.45 C ATOM 1304 NZ LYS A 78 -4.225 -1.028 9.361 1.00 2.15 N ATOM 0 H LYS A 78 -3.473 -0.278 5.031 1.00 0.51 H new ATOM 0 HA LYS A 78 -1.987 2.040 5.862 1.00 0.52 H new ATOM 0 HB2 LYS A 78 -3.885 1.660 7.145 1.00 0.52 H new ATOM 0 HB3 LYS A 78 -3.685 -0.081 7.142 1.00 0.52 H new ATOM 0 HG2 LYS A 78 -1.961 -0.011 8.809 1.00 0.90 H new ATOM 0 HG3 LYS A 78 -1.651 1.694 8.547 1.00 0.90 H new ATOM 0 HD2 LYS A 78 -2.995 1.186 10.656 1.00 1.04 H new ATOM 0 HD3 LYS A 78 -3.758 2.336 9.577 1.00 1.04 H new ATOM 0 HE2 LYS A 78 -5.282 0.452 10.462 1.00 1.45 H new ATOM 0 HE3 LYS A 78 -5.301 0.692 8.726 1.00 1.45 H new ATOM 0 HZ1 LYS A 78 -4.916 -1.677 9.789 1.00 2.15 H new ATOM 0 HZ2 LYS A 78 -4.147 -1.227 8.343 1.00 2.15 H new ATOM 0 HZ3 LYS A 78 -3.298 -1.163 9.812 1.00 2.15 H new ATOM 1318 N ASN A 79 -0.642 -0.911 6.338 1.00 0.52 N ATOM 1319 CA ASN A 79 0.643 -1.570 6.711 1.00 0.53 C ATOM 1320 C ASN A 79 1.762 -0.958 5.874 1.00 0.54 C ATOM 1321 O ASN A 79 2.811 -0.602 6.376 1.00 0.54 O ATOM 1322 CB ASN A 79 0.573 -3.070 6.428 1.00 0.54 C ATOM 1323 CG ASN A 79 1.368 -3.827 7.493 1.00 0.60 C ATOM 1324 OD1 ASN A 79 1.028 -4.940 7.846 1.00 1.17 O ATOM 1325 ND2 ASN A 79 2.422 -3.269 8.022 1.00 1.14 N ATOM 0 H ASN A 79 -1.354 -1.531 5.951 1.00 0.52 H new ATOM 0 HA ASN A 79 0.831 -1.420 7.774 1.00 0.53 H new ATOM 0 HB2 ASN A 79 -0.465 -3.403 6.428 1.00 0.54 H new ATOM 0 HB3 ASN A 79 0.976 -3.283 5.438 1.00 0.54 H new ATOM 0 HD21 ASN A 79 2.961 -3.766 8.731 1.00 1.14 H new ATOM 0 HD22 ASN A 79 2.708 -2.336 7.726 1.00 1.14 H new ATOM 1332 N MET A 80 1.542 -0.833 4.595 1.00 0.56 N ATOM 1333 CA MET A 80 2.582 -0.245 3.711 1.00 0.58 C ATOM 1334 C MET A 80 2.998 1.123 4.257 1.00 0.57 C ATOM 1335 O MET A 80 4.160 1.360 4.520 1.00 0.56 O ATOM 1336 CB MET A 80 2.022 -0.102 2.290 1.00 0.60 C ATOM 1337 CG MET A 80 2.847 0.917 1.498 1.00 0.64 C ATOM 1338 SD MET A 80 2.162 2.573 1.751 1.00 1.38 S ATOM 1339 CE MET A 80 3.463 3.492 0.892 1.00 1.16 C ATOM 0 H MET A 80 0.682 -1.115 4.124 1.00 0.56 H new ATOM 0 HA MET A 80 3.456 -0.896 3.683 1.00 0.58 H new ATOM 0 HB2 MET A 80 2.041 -1.068 1.785 1.00 0.60 H new ATOM 0 HB3 MET A 80 0.980 0.216 2.332 1.00 0.60 H new ATOM 0 HG2 MET A 80 3.888 0.889 1.821 1.00 0.64 H new ATOM 0 HG3 MET A 80 2.836 0.665 0.438 1.00 0.64 H new ATOM 0 HE1 MET A 80 3.380 4.552 1.133 1.00 1.16 H new ATOM 0 HE2 MET A 80 4.439 3.123 1.209 1.00 1.16 H new ATOM 0 HE3 MET A 80 3.355 3.355 -0.184 1.00 1.16 H new ATOM 1349 N ASP A 81 2.072 2.027 4.442 1.00 0.58 N ATOM 1350 CA ASP A 81 2.436 3.369 4.985 1.00 0.58 C ATOM 1351 C ASP A 81 3.083 3.210 6.357 1.00 0.56 C ATOM 1352 O ASP A 81 4.066 3.851 6.672 1.00 0.56 O ATOM 1353 CB ASP A 81 1.170 4.213 5.123 1.00 0.59 C ATOM 1354 CG ASP A 81 1.379 5.568 4.445 1.00 0.61 C ATOM 1355 OD1 ASP A 81 1.861 5.579 3.324 1.00 1.22 O ATOM 1356 OD2 ASP A 81 1.054 6.571 5.058 1.00 1.12 O ATOM 0 H ASP A 81 1.081 1.894 4.241 1.00 0.58 H new ATOM 0 HA ASP A 81 3.137 3.857 4.308 1.00 0.58 H new ATOM 0 HB2 ASP A 81 0.325 3.695 4.670 1.00 0.59 H new ATOM 0 HB3 ASP A 81 0.929 4.356 6.176 1.00 0.59 H new ATOM 1361 N GLN A 82 2.551 2.343 7.168 1.00 0.56 N ATOM 1362 CA GLN A 82 3.134 2.110 8.505 1.00 0.54 C ATOM 1363 C GLN A 82 4.553 1.583 8.295 1.00 0.53 C ATOM 1364 O GLN A 82 5.520 2.090 8.836 1.00 0.55 O ATOM 1365 CB GLN A 82 2.259 1.065 9.188 1.00 0.55 C ATOM 1366 CG GLN A 82 2.698 0.858 10.627 1.00 1.12 C ATOM 1367 CD GLN A 82 1.860 1.745 11.550 1.00 0.77 C ATOM 1368 OE1 GLN A 82 0.995 1.263 12.254 1.00 1.13 O ATOM 1369 NE2 GLN A 82 2.079 3.031 11.576 1.00 1.43 N ATOM 0 H GLN A 82 1.727 1.781 6.954 1.00 0.56 H new ATOM 0 HA GLN A 82 3.175 3.010 9.118 1.00 0.54 H new ATOM 0 HB2 GLN A 82 1.217 1.383 9.162 1.00 0.55 H new ATOM 0 HB3 GLN A 82 2.318 0.122 8.645 1.00 0.55 H new ATOM 0 HG2 GLN A 82 2.581 -0.189 10.907 1.00 1.12 H new ATOM 0 HG3 GLN A 82 3.755 1.100 10.734 1.00 1.12 H new ATOM 0 HE21 GLN A 82 2.805 3.437 10.985 1.00 1.43 H new ATOM 0 HE22 GLN A 82 1.524 3.631 12.187 1.00 1.43 H new ATOM 1378 N LEU A 83 4.666 0.582 7.475 1.00 0.51 N ATOM 1379 CA LEU A 83 6.005 0.015 7.171 1.00 0.51 C ATOM 1380 C LEU A 83 6.836 1.126 6.524 1.00 0.52 C ATOM 1381 O LEU A 83 7.985 1.335 6.859 1.00 0.53 O ATOM 1382 CB LEU A 83 5.869 -1.168 6.208 1.00 0.49 C ATOM 1383 CG LEU A 83 5.275 -2.370 6.953 1.00 0.47 C ATOM 1384 CD1 LEU A 83 4.523 -3.265 5.967 1.00 0.52 C ATOM 1385 CD2 LEU A 83 6.396 -3.180 7.616 1.00 0.48 C ATOM 0 H LEU A 83 3.885 0.129 6.999 1.00 0.51 H new ATOM 0 HA LEU A 83 6.486 -0.345 8.081 1.00 0.51 H new ATOM 0 HB2 LEU A 83 5.230 -0.895 5.368 1.00 0.49 H new ATOM 0 HB3 LEU A 83 6.844 -1.428 5.795 1.00 0.49 H new ATOM 0 HG LEU A 83 4.588 -2.009 7.718 1.00 0.47 H new ATOM 0 HD11 LEU A 83 4.102 -4.118 6.498 1.00 0.52 H new ATOM 0 HD12 LEU A 83 3.719 -2.696 5.499 1.00 0.52 H new ATOM 0 HD13 LEU A 83 5.211 -3.619 5.199 1.00 0.52 H new ATOM 0 HD21 LEU A 83 5.966 -4.032 8.143 1.00 0.48 H new ATOM 0 HD22 LEU A 83 7.088 -3.537 6.853 1.00 0.48 H new ATOM 0 HD23 LEU A 83 6.932 -2.548 8.324 1.00 0.48 H new ATOM 1397 N LYS A 84 6.246 1.854 5.613 1.00 0.53 N ATOM 1398 CA LYS A 84 6.976 2.971 4.953 1.00 0.56 C ATOM 1399 C LYS A 84 7.597 3.868 6.027 1.00 0.56 C ATOM 1400 O LYS A 84 8.727 4.301 5.916 1.00 0.57 O ATOM 1401 CB LYS A 84 5.995 3.798 4.120 1.00 0.57 C ATOM 1402 CG LYS A 84 6.775 4.759 3.217 1.00 0.58 C ATOM 1403 CD LYS A 84 5.795 5.602 2.396 1.00 0.75 C ATOM 1404 CE LYS A 84 6.377 7.003 2.189 1.00 0.77 C ATOM 1405 NZ LYS A 84 6.475 7.700 3.501 1.00 1.42 N ATOM 0 H LYS A 84 5.285 1.721 5.298 1.00 0.53 H new ATOM 0 HA LYS A 84 7.756 2.567 4.308 1.00 0.56 H new ATOM 0 HB2 LYS A 84 5.370 3.140 3.516 1.00 0.57 H new ATOM 0 HB3 LYS A 84 5.328 4.358 4.775 1.00 0.57 H new ATOM 0 HG2 LYS A 84 7.410 5.407 3.821 1.00 0.58 H new ATOM 0 HG3 LYS A 84 7.432 4.197 2.553 1.00 0.58 H new ATOM 0 HD2 LYS A 84 5.609 5.128 1.432 1.00 0.75 H new ATOM 0 HD3 LYS A 84 4.836 5.667 2.910 1.00 0.75 H new ATOM 0 HE2 LYS A 84 7.362 6.934 1.727 1.00 0.77 H new ATOM 0 HE3 LYS A 84 5.745 7.574 1.508 1.00 0.77 H new ATOM 0 HZ1 LYS A 84 6.334 8.721 3.363 1.00 1.42 H new ATOM 0 HZ2 LYS A 84 5.744 7.334 4.144 1.00 1.42 H new ATOM 0 HZ3 LYS A 84 7.415 7.533 3.914 1.00 1.42 H new ATOM 1419 N GLU A 85 6.855 4.158 7.062 1.00 0.55 N ATOM 1420 CA GLU A 85 7.382 5.033 8.146 1.00 0.55 C ATOM 1421 C GLU A 85 8.554 4.350 8.851 1.00 0.57 C ATOM 1422 O GLU A 85 9.520 4.982 9.224 1.00 0.57 O ATOM 1423 CB GLU A 85 6.277 5.300 9.169 1.00 0.55 C ATOM 1424 CG GLU A 85 6.909 5.669 10.513 1.00 0.56 C ATOM 1425 CD GLU A 85 5.882 6.406 11.376 1.00 0.56 C ATOM 1426 OE1 GLU A 85 4.739 5.980 11.394 1.00 1.12 O ATOM 1427 OE2 GLU A 85 6.257 7.382 12.004 1.00 1.18 O ATOM 0 H GLU A 85 5.902 3.824 7.203 1.00 0.55 H new ATOM 0 HA GLU A 85 7.720 5.972 7.707 1.00 0.55 H new ATOM 0 HB2 GLU A 85 5.633 6.109 8.823 1.00 0.55 H new ATOM 0 HB3 GLU A 85 5.648 4.417 9.280 1.00 0.55 H new ATOM 0 HG2 GLU A 85 7.251 4.770 11.025 1.00 0.56 H new ATOM 0 HG3 GLU A 85 7.785 6.298 10.354 1.00 0.56 H new ATOM 1434 N LYS A 86 8.485 3.064 9.031 1.00 0.58 N ATOM 1435 CA LYS A 86 9.609 2.357 9.706 1.00 0.61 C ATOM 1436 C LYS A 86 10.866 2.531 8.858 1.00 0.62 C ATOM 1437 O LYS A 86 11.953 2.747 9.365 1.00 0.63 O ATOM 1438 CB LYS A 86 9.278 0.869 9.836 1.00 0.62 C ATOM 1439 CG LYS A 86 9.355 0.459 11.308 1.00 0.65 C ATOM 1440 CD LYS A 86 9.090 -1.042 11.436 1.00 0.83 C ATOM 1441 CE LYS A 86 7.784 -1.264 12.203 1.00 1.01 C ATOM 1442 NZ LYS A 86 7.954 -0.812 13.613 1.00 1.24 N ATOM 0 H LYS A 86 7.705 2.473 8.743 1.00 0.58 H new ATOM 0 HA LYS A 86 9.768 2.771 10.702 1.00 0.61 H new ATOM 0 HB2 LYS A 86 8.281 0.671 9.444 1.00 0.62 H new ATOM 0 HB3 LYS A 86 9.976 0.277 9.245 1.00 0.62 H new ATOM 0 HG2 LYS A 86 10.338 0.701 11.713 1.00 0.65 H new ATOM 0 HG3 LYS A 86 8.624 1.019 11.891 1.00 0.65 H new ATOM 0 HD2 LYS A 86 9.026 -1.497 10.447 1.00 0.83 H new ATOM 0 HD3 LYS A 86 9.917 -1.525 11.956 1.00 0.83 H new ATOM 0 HE2 LYS A 86 6.973 -0.712 11.728 1.00 1.01 H new ATOM 0 HE3 LYS A 86 7.510 -2.319 12.178 1.00 1.01 H new ATOM 0 HZ1 LYS A 86 7.305 -1.343 14.228 1.00 1.24 H new ATOM 0 HZ2 LYS A 86 8.934 -0.982 13.916 1.00 1.24 H new ATOM 0 HZ3 LYS A 86 7.742 0.204 13.680 1.00 1.24 H new ATOM 1456 N ILE A 87 10.719 2.450 7.567 1.00 0.64 N ATOM 1457 CA ILE A 87 11.888 2.618 6.668 1.00 0.67 C ATOM 1458 C ILE A 87 12.444 4.027 6.823 1.00 0.65 C ATOM 1459 O ILE A 87 13.636 4.218 6.959 1.00 0.63 O ATOM 1460 CB ILE A 87 11.450 2.407 5.219 1.00 0.71 C ATOM 1461 CG1 ILE A 87 11.298 0.911 4.942 1.00 0.79 C ATOM 1462 CG2 ILE A 87 12.498 2.999 4.274 1.00 0.80 C ATOM 1463 CD1 ILE A 87 10.040 0.675 4.106 1.00 0.84 C ATOM 0 H ILE A 87 9.833 2.273 7.094 1.00 0.64 H new ATOM 0 HA ILE A 87 12.655 1.889 6.928 1.00 0.67 H new ATOM 0 HB ILE A 87 10.494 2.904 5.055 1.00 0.71 H new ATOM 0 HG12 ILE A 87 12.175 0.537 4.413 1.00 0.79 H new ATOM 0 HG13 ILE A 87 11.233 0.361 5.881 1.00 0.79 H new ATOM 0 HG21 ILE A 87 12.184 2.847 3.241 1.00 0.80 H new ATOM 0 HG22 ILE A 87 12.602 4.066 4.469 1.00 0.80 H new ATOM 0 HG23 ILE A 87 13.456 2.505 4.438 1.00 0.80 H new ATOM 0 HD11 ILE A 87 9.930 -0.391 3.907 1.00 0.84 H new ATOM 0 HD12 ILE A 87 9.168 1.034 4.652 1.00 0.84 H new ATOM 0 HD13 ILE A 87 10.124 1.213 3.162 1.00 0.84 H new ATOM 1475 N ASN A 88 11.601 5.024 6.806 1.00 0.66 N ATOM 1476 CA ASN A 88 12.102 6.411 6.954 1.00 0.65 C ATOM 1477 C ASN A 88 12.832 6.563 8.286 1.00 0.62 C ATOM 1478 O ASN A 88 13.767 7.322 8.403 1.00 0.62 O ATOM 1479 CB ASN A 88 10.922 7.392 6.902 1.00 0.69 C ATOM 1480 CG ASN A 88 10.447 7.718 8.320 1.00 1.66 C ATOM 1481 OD1 ASN A 88 9.395 7.278 8.739 1.00 2.38 O ATOM 1482 ND2 ASN A 88 11.176 8.490 9.081 1.00 2.46 N ATOM 0 H ASN A 88 10.591 4.934 6.696 1.00 0.66 H new ATOM 0 HA ASN A 88 12.794 6.628 6.140 1.00 0.65 H new ATOM 0 HB2 ASN A 88 11.222 8.307 6.391 1.00 0.69 H new ATOM 0 HB3 ASN A 88 10.104 6.959 6.326 1.00 0.69 H new ATOM 0 HD21 ASN A 88 10.861 8.721 10.023 1.00 2.46 H new ATOM 0 HD22 ASN A 88 12.060 8.861 8.733 1.00 2.46 H new ATOM 1489 N SER A 89 12.399 5.864 9.298 1.00 0.61 N ATOM 1490 CA SER A 89 13.058 5.989 10.628 1.00 0.61 C ATOM 1491 C SER A 89 14.484 5.424 10.604 1.00 0.63 C ATOM 1492 O SER A 89 15.404 6.037 11.107 1.00 0.71 O ATOM 1493 CB SER A 89 12.235 5.225 11.666 1.00 0.62 C ATOM 1494 OG SER A 89 12.172 5.983 12.867 1.00 1.29 O ATOM 0 H SER A 89 11.616 5.211 9.261 1.00 0.61 H new ATOM 0 HA SER A 89 13.115 7.047 10.883 1.00 0.61 H new ATOM 0 HB2 SER A 89 11.230 5.040 11.286 1.00 0.62 H new ATOM 0 HB3 SER A 89 12.686 4.252 11.860 1.00 0.62 H new ATOM 0 HG SER A 89 11.644 5.496 13.534 1.00 1.29 H new ATOM 1500 N VAL A 90 14.683 4.257 10.047 1.00 0.58 N ATOM 1501 CA VAL A 90 16.052 3.658 10.020 1.00 0.60 C ATOM 1502 C VAL A 90 16.892 4.300 8.921 1.00 0.59 C ATOM 1503 O VAL A 90 18.039 4.649 9.120 1.00 0.63 O ATOM 1504 CB VAL A 90 15.936 2.159 9.755 1.00 0.61 C ATOM 1505 CG1 VAL A 90 17.252 1.465 10.116 1.00 0.52 C ATOM 1506 CG2 VAL A 90 14.805 1.578 10.606 1.00 0.81 C ATOM 0 H VAL A 90 13.956 3.692 9.609 1.00 0.58 H new ATOM 0 HA VAL A 90 16.536 3.834 10.981 1.00 0.60 H new ATOM 0 HB VAL A 90 15.721 1.996 8.699 1.00 0.61 H new ATOM 0 HG11 VAL A 90 17.164 0.396 9.925 1.00 0.52 H new ATOM 0 HG12 VAL A 90 18.059 1.877 9.509 1.00 0.52 H new ATOM 0 HG13 VAL A 90 17.472 1.628 11.171 1.00 0.52 H new ATOM 0 HG21 VAL A 90 14.721 0.508 10.418 1.00 0.81 H new ATOM 0 HG22 VAL A 90 15.021 1.745 11.661 1.00 0.81 H new ATOM 0 HG23 VAL A 90 13.866 2.067 10.346 1.00 0.81 H new ATOM 1516 N LEU A 91 16.321 4.466 7.764 1.00 0.57 N ATOM 1517 CA LEU A 91 17.065 5.092 6.649 1.00 0.61 C ATOM 1518 C LEU A 91 17.112 6.585 6.911 1.00 0.67 C ATOM 1519 O LEU A 91 17.874 7.311 6.307 1.00 0.70 O ATOM 1520 CB LEU A 91 16.321 4.828 5.336 1.00 0.62 C ATOM 1521 CG LEU A 91 17.237 5.130 4.147 1.00 0.72 C ATOM 1522 CD1 LEU A 91 18.123 3.919 3.851 1.00 0.91 C ATOM 1523 CD2 LEU A 91 16.383 5.445 2.917 1.00 0.97 C ATOM 0 H LEU A 91 15.363 4.192 7.545 1.00 0.57 H new ATOM 0 HA LEU A 91 18.073 4.683 6.576 1.00 0.61 H new ATOM 0 HB2 LEU A 91 15.991 3.790 5.297 1.00 0.62 H new ATOM 0 HB3 LEU A 91 15.427 5.449 5.284 1.00 0.62 H new ATOM 0 HG LEU A 91 17.868 5.986 4.388 1.00 0.72 H new ATOM 0 HD11 LEU A 91 18.772 4.141 3.004 1.00 0.91 H new ATOM 0 HD12 LEU A 91 18.733 3.692 4.725 1.00 0.91 H new ATOM 0 HD13 LEU A 91 17.497 3.059 3.612 1.00 0.91 H new ATOM 0 HD21 LEU A 91 17.033 5.661 2.069 1.00 0.97 H new ATOM 0 HD22 LEU A 91 15.752 4.587 2.683 1.00 0.97 H new ATOM 0 HD23 LEU A 91 15.755 6.312 3.122 1.00 0.97 H new ATOM 1535 N SER A 92 16.317 7.033 7.849 1.00 0.71 N ATOM 1536 CA SER A 92 16.292 8.486 8.210 1.00 0.81 C ATOM 1537 C SER A 92 15.925 9.340 6.984 1.00 0.88 C ATOM 1538 O SER A 92 15.364 10.406 7.116 1.00 1.04 O ATOM 1539 CB SER A 92 17.674 8.905 8.718 1.00 0.85 C ATOM 1540 OG SER A 92 17.575 9.289 10.083 1.00 0.94 O ATOM 0 H SER A 92 15.677 6.449 8.387 1.00 0.71 H new ATOM 0 HA SER A 92 15.543 8.642 8.987 1.00 0.81 H new ATOM 0 HB2 SER A 92 18.379 8.081 8.610 1.00 0.85 H new ATOM 0 HB3 SER A 92 18.058 9.733 8.122 1.00 0.85 H new ATOM 0 HG SER A 92 18.458 9.557 10.412 1.00 0.94 H new ATOM 1546 N ILE A 93 16.280 8.886 5.808 1.00 0.85 N ATOM 1547 CA ILE A 93 16.019 9.663 4.550 1.00 0.92 C ATOM 1548 C ILE A 93 16.814 10.969 4.586 1.00 1.05 C ATOM 1549 O ILE A 93 17.588 11.273 3.700 1.00 1.13 O ATOM 1550 CB ILE A 93 14.536 10.000 4.409 1.00 1.02 C ATOM 1551 CG1 ILE A 93 13.704 8.749 4.708 1.00 1.07 C ATOM 1552 CG2 ILE A 93 14.278 10.501 2.985 1.00 1.16 C ATOM 1553 CD1 ILE A 93 12.458 8.693 3.814 1.00 1.65 C ATOM 0 H ILE A 93 16.749 7.992 5.661 1.00 0.85 H new ATOM 0 HA ILE A 93 16.325 9.049 3.703 1.00 0.92 H new ATOM 0 HB ILE A 93 14.251 10.780 5.115 1.00 1.02 H new ATOM 0 HG12 ILE A 93 14.311 7.857 4.549 1.00 1.07 H new ATOM 0 HG13 ILE A 93 13.405 8.748 5.756 1.00 1.07 H new ATOM 0 HG21 ILE A 93 13.222 10.745 2.871 1.00 1.16 H new ATOM 0 HG22 ILE A 93 14.879 11.391 2.798 1.00 1.16 H new ATOM 0 HG23 ILE A 93 14.550 9.724 2.271 1.00 1.16 H new ATOM 0 HD11 ILE A 93 11.884 7.796 4.046 1.00 1.65 H new ATOM 0 HD12 ILE A 93 11.842 9.574 3.993 1.00 1.65 H new ATOM 0 HD13 ILE A 93 12.762 8.669 2.767 1.00 1.65 H new ATOM 1565 N ARG A 94 16.623 11.730 5.618 1.00 1.20 N ATOM 1566 CA ARG A 94 17.343 13.020 5.774 1.00 1.42 C ATOM 1567 C ARG A 94 17.314 13.392 7.258 1.00 1.49 C ATOM 1568 O ARG A 94 16.480 14.159 7.690 1.00 1.74 O ATOM 1569 CB ARG A 94 16.637 14.103 4.955 1.00 1.79 C ATOM 1570 CG ARG A 94 15.185 14.226 5.424 1.00 2.10 C ATOM 1571 CD ARG A 94 14.249 14.180 4.218 1.00 2.55 C ATOM 1572 NE ARG A 94 14.529 15.338 3.322 1.00 3.16 N ATOM 1573 CZ ARG A 94 14.184 16.542 3.687 1.00 3.74 C ATOM 1574 NH1 ARG A 94 13.603 16.734 4.839 1.00 3.85 N ATOM 1575 NH2 ARG A 94 14.423 17.554 2.899 1.00 4.56 N ATOM 0 H ARG A 94 15.982 11.508 6.380 1.00 1.20 H new ATOM 0 HA ARG A 94 18.371 12.932 5.423 1.00 1.42 H new ATOM 0 HB2 ARG A 94 17.151 15.057 5.072 1.00 1.79 H new ATOM 0 HB3 ARG A 94 16.669 13.852 3.895 1.00 1.79 H new ATOM 0 HG2 ARG A 94 14.946 13.416 6.113 1.00 2.10 H new ATOM 0 HG3 ARG A 94 15.046 15.160 5.969 1.00 2.10 H new ATOM 0 HD2 ARG A 94 14.386 13.245 3.674 1.00 2.55 H new ATOM 0 HD3 ARG A 94 13.211 14.207 4.550 1.00 2.55 H new ATOM 0 HE ARG A 94 14.990 15.189 2.424 1.00 3.16 H new ATOM 0 HH11 ARG A 94 13.418 15.942 5.455 1.00 3.85 H new ATOM 0 HH12 ARG A 94 13.334 17.676 5.124 1.00 3.85 H new ATOM 0 HH21 ARG A 94 14.879 17.403 1.999 1.00 4.56 H new ATOM 0 HH22 ARG A 94 14.154 18.496 3.183 1.00 4.56 H new ATOM 1589 N GLN A 95 18.205 12.832 8.039 1.00 1.46 N ATOM 1590 CA GLN A 95 18.234 13.119 9.508 1.00 1.61 C ATOM 1591 C GLN A 95 17.225 12.214 10.218 1.00 2.21 C ATOM 1592 O GLN A 95 16.198 11.926 9.625 1.00 2.75 O ATOM 1593 CB GLN A 95 17.879 14.584 9.785 1.00 1.83 C ATOM 1594 CG GLN A 95 18.602 15.054 11.048 1.00 2.35 C ATOM 1595 CD GLN A 95 20.064 15.349 10.718 1.00 2.88 C ATOM 1596 OE1 GLN A 95 20.381 15.742 9.612 1.00 3.43 O ATOM 1597 NE2 GLN A 95 20.975 15.173 11.634 1.00 3.20 N ATOM 1598 OXT GLN A 95 17.497 11.823 11.341 1.00 2.78 O ATOM 0 H GLN A 95 18.922 12.181 7.718 1.00 1.46 H new ATOM 0 HA GLN A 95 19.241 12.928 9.880 1.00 1.61 H new ATOM 0 HB2 GLN A 95 18.166 15.205 8.937 1.00 1.83 H new ATOM 0 HB3 GLN A 95 16.801 14.691 9.909 1.00 1.83 H new ATOM 0 HG2 GLN A 95 18.120 15.948 11.444 1.00 2.35 H new ATOM 0 HG3 GLN A 95 18.540 14.289 11.822 1.00 2.35 H new ATOM 0 HE21 GLN A 95 20.708 14.843 12.562 1.00 3.20 H new ATOM 0 HE22 GLN A 95 21.954 15.365 11.423 1.00 3.20 H new TER 1607 GLN A 95 ATOM 1608 N ALA B 1 8.750 -0.073 -14.139 1.00 5.31 N ATOM 1609 CA ALA B 1 9.700 -1.138 -13.712 1.00 4.73 C ATOM 1610 C ALA B 1 11.068 -0.516 -13.425 1.00 4.10 C ATOM 1611 O ALA B 1 11.747 -0.890 -12.489 1.00 3.94 O ATOM 1612 CB ALA B 1 9.836 -2.177 -14.827 1.00 4.76 C ATOM 0 H1 ALA B 1 7.785 -0.460 -14.170 1.00 5.31 H new ATOM 0 H2 ALA B 1 8.785 0.715 -13.461 1.00 5.31 H new ATOM 0 H3 ALA B 1 9.016 0.271 -15.084 1.00 5.31 H new ATOM 0 HA ALA B 1 9.324 -1.620 -12.810 1.00 4.73 H new ATOM 0 HB1 ALA B 1 10.531 -2.957 -14.515 1.00 4.76 H new ATOM 0 HB2 ALA B 1 8.862 -2.620 -15.032 1.00 4.76 H new ATOM 0 HB3 ALA B 1 10.212 -1.695 -15.729 1.00 4.76 H new ATOM 1620 N LYS B 2 11.478 0.432 -14.222 1.00 4.19 N ATOM 1621 CA LYS B 2 12.802 1.078 -13.995 1.00 4.06 C ATOM 1622 C LYS B 2 12.617 2.332 -13.136 1.00 3.61 C ATOM 1623 O LYS B 2 11.648 3.052 -13.273 1.00 4.29 O ATOM 1624 CB LYS B 2 13.416 1.469 -15.341 1.00 4.79 C ATOM 1625 CG LYS B 2 13.601 0.219 -16.202 1.00 5.69 C ATOM 1626 CD LYS B 2 14.144 0.620 -17.576 1.00 6.62 C ATOM 1627 CE LYS B 2 14.043 -0.570 -18.533 1.00 7.56 C ATOM 1628 NZ LYS B 2 12.698 -0.578 -19.176 1.00 7.96 N ATOM 0 H LYS B 2 10.953 0.788 -15.021 1.00 4.19 H new ATOM 0 HA LYS B 2 13.464 0.380 -13.482 1.00 4.06 H new ATOM 0 HB2 LYS B 2 12.771 2.183 -15.853 1.00 4.79 H new ATOM 0 HB3 LYS B 2 14.376 1.961 -15.185 1.00 4.79 H new ATOM 0 HG2 LYS B 2 14.289 -0.472 -15.715 1.00 5.69 H new ATOM 0 HG3 LYS B 2 12.650 -0.303 -16.313 1.00 5.69 H new ATOM 0 HD2 LYS B 2 13.579 1.465 -17.969 1.00 6.62 H new ATOM 0 HD3 LYS B 2 15.181 0.943 -17.489 1.00 6.62 H new ATOM 0 HE2 LYS B 2 14.821 -0.506 -19.294 1.00 7.56 H new ATOM 0 HE3 LYS B 2 14.204 -1.501 -17.990 1.00 7.56 H new ATOM 0 HZ1 LYS B 2 12.629 -1.387 -19.826 1.00 7.96 H new ATOM 0 HZ2 LYS B 2 11.964 -0.659 -18.444 1.00 7.96 H new ATOM 0 HZ3 LYS B 2 12.562 0.306 -19.707 1.00 7.96 H new ATOM 1642 N LYS B 3 13.538 2.597 -12.250 1.00 2.84 N ATOM 1643 CA LYS B 3 13.422 3.793 -11.384 1.00 2.84 C ATOM 1644 C LYS B 3 14.693 3.886 -10.551 1.00 2.25 C ATOM 1645 O LYS B 3 15.259 4.947 -10.381 1.00 2.75 O ATOM 1646 CB LYS B 3 12.208 3.648 -10.464 1.00 3.27 C ATOM 1647 CG LYS B 3 11.207 4.767 -10.756 1.00 3.74 C ATOM 1648 CD LYS B 3 9.919 4.517 -9.969 1.00 4.47 C ATOM 1649 CE LYS B 3 9.523 5.789 -9.218 1.00 5.15 C ATOM 1650 NZ LYS B 3 8.285 5.534 -8.428 1.00 5.62 N ATOM 0 H LYS B 3 14.370 2.029 -12.092 1.00 2.84 H new ATOM 0 HA LYS B 3 13.294 4.692 -11.987 1.00 2.84 H new ATOM 0 HB2 LYS B 3 11.738 2.677 -10.616 1.00 3.27 H new ATOM 0 HB3 LYS B 3 12.522 3.690 -9.421 1.00 3.27 H new ATOM 0 HG2 LYS B 3 11.633 5.732 -10.480 1.00 3.74 H new ATOM 0 HG3 LYS B 3 10.991 4.807 -11.824 1.00 3.74 H new ATOM 0 HD2 LYS B 3 9.119 4.218 -10.646 1.00 4.47 H new ATOM 0 HD3 LYS B 3 10.064 3.697 -9.265 1.00 4.47 H new ATOM 0 HE2 LYS B 3 10.332 6.100 -8.557 1.00 5.15 H new ATOM 0 HE3 LYS B 3 9.356 6.603 -9.923 1.00 5.15 H new ATOM 0 HZ1 LYS B 3 8.015 6.399 -7.917 1.00 5.62 H new ATOM 0 HZ2 LYS B 3 7.515 5.256 -9.069 1.00 5.62 H new ATOM 0 HZ3 LYS B 3 8.460 4.769 -7.746 1.00 5.62 H new ATOM 1664 N LYS B 4 15.149 2.765 -10.047 1.00 1.66 N ATOM 1665 CA LYS B 4 16.392 2.759 -9.231 1.00 1.45 C ATOM 1666 C LYS B 4 16.378 3.956 -8.291 1.00 1.21 C ATOM 1667 O LYS B 4 15.704 3.967 -7.280 1.00 1.74 O ATOM 1668 CB LYS B 4 17.603 2.849 -10.164 1.00 1.77 C ATOM 1669 CG LYS B 4 17.948 1.456 -10.693 1.00 2.27 C ATOM 1670 CD LYS B 4 18.591 1.578 -12.076 1.00 2.87 C ATOM 1671 CE LYS B 4 18.968 0.187 -12.591 1.00 3.35 C ATOM 1672 NZ LYS B 4 20.384 0.195 -13.055 1.00 3.94 N ATOM 0 H LYS B 4 14.708 1.853 -10.169 1.00 1.66 H new ATOM 0 HA LYS B 4 16.451 1.841 -8.647 1.00 1.45 H new ATOM 0 HB2 LYS B 4 17.386 3.521 -10.994 1.00 1.77 H new ATOM 0 HB3 LYS B 4 18.456 3.268 -9.630 1.00 1.77 H new ATOM 0 HG2 LYS B 4 18.630 0.954 -10.007 1.00 2.27 H new ATOM 0 HG3 LYS B 4 17.047 0.845 -10.752 1.00 2.27 H new ATOM 0 HD2 LYS B 4 17.900 2.058 -12.769 1.00 2.87 H new ATOM 0 HD3 LYS B 4 19.478 2.209 -12.022 1.00 2.87 H new ATOM 0 HE2 LYS B 4 18.837 -0.553 -11.801 1.00 3.35 H new ATOM 0 HE3 LYS B 4 18.308 -0.101 -13.409 1.00 3.35 H new ATOM 0 HZ1 LYS B 4 20.640 -0.750 -13.405 1.00 3.94 H new ATOM 0 HZ2 LYS B 4 20.494 0.889 -13.821 1.00 3.94 H new ATOM 0 HZ3 LYS B 4 21.007 0.451 -12.263 1.00 3.94 H new ATOM 1686 N SER B 5 17.114 4.966 -8.631 1.00 1.06 N ATOM 1687 CA SER B 5 17.162 6.183 -7.787 1.00 1.29 C ATOM 1688 C SER B 5 17.463 5.806 -6.339 1.00 1.14 C ATOM 1689 O SER B 5 18.605 5.679 -5.953 1.00 1.52 O ATOM 1690 CB SER B 5 15.825 6.902 -7.858 1.00 1.71 C ATOM 1691 OG SER B 5 15.716 7.575 -9.105 1.00 2.58 O ATOM 0 H SER B 5 17.693 5.002 -9.470 1.00 1.06 H new ATOM 0 HA SER B 5 17.951 6.840 -8.154 1.00 1.29 H new ATOM 0 HB2 SER B 5 15.009 6.188 -7.745 1.00 1.71 H new ATOM 0 HB3 SER B 5 15.739 7.616 -7.039 1.00 1.71 H new ATOM 0 HG SER B 5 15.564 6.920 -9.818 1.00 2.58 H new ATOM 1697 N LYS B 6 16.444 5.637 -5.539 1.00 1.03 N ATOM 1698 CA LYS B 6 16.654 5.280 -4.107 1.00 1.04 C ATOM 1699 C LYS B 6 15.977 3.946 -3.809 1.00 0.96 C ATOM 1700 O LYS B 6 16.014 3.452 -2.700 1.00 1.02 O ATOM 1701 CB LYS B 6 16.044 6.382 -3.235 1.00 1.37 C ATOM 1702 CG LYS B 6 14.602 6.027 -2.843 1.00 2.21 C ATOM 1703 CD LYS B 6 13.904 7.278 -2.304 1.00 2.52 C ATOM 1704 CE LYS B 6 12.556 6.886 -1.696 1.00 3.33 C ATOM 1705 NZ LYS B 6 11.977 5.748 -2.465 1.00 3.75 N ATOM 0 H LYS B 6 15.468 5.732 -5.819 1.00 1.03 H new ATOM 0 HA LYS B 6 17.719 5.189 -3.895 1.00 1.04 H new ATOM 0 HB2 LYS B 6 16.647 6.518 -2.337 1.00 1.37 H new ATOM 0 HB3 LYS B 6 16.057 7.329 -3.775 1.00 1.37 H new ATOM 0 HG2 LYS B 6 14.063 5.639 -3.707 1.00 2.21 H new ATOM 0 HG3 LYS B 6 14.601 5.241 -2.087 1.00 2.21 H new ATOM 0 HD2 LYS B 6 14.528 7.760 -1.552 1.00 2.52 H new ATOM 0 HD3 LYS B 6 13.757 8.000 -3.107 1.00 2.52 H new ATOM 0 HE2 LYS B 6 12.684 6.605 -0.651 1.00 3.33 H new ATOM 0 HE3 LYS B 6 11.875 7.737 -1.716 1.00 3.33 H new ATOM 0 HZ1 LYS B 6 10.962 5.666 -2.253 1.00 3.75 H new ATOM 0 HZ2 LYS B 6 12.105 5.916 -3.483 1.00 3.75 H new ATOM 0 HZ3 LYS B 6 12.459 4.867 -2.196 1.00 3.75 H new ATOM 1719 N LEU B 7 15.338 3.375 -4.787 1.00 0.91 N ATOM 1720 CA LEU B 7 14.632 2.084 -4.557 1.00 0.98 C ATOM 1721 C LEU B 7 15.516 0.895 -4.950 1.00 0.86 C ATOM 1722 O LEU B 7 15.883 0.085 -4.119 1.00 0.86 O ATOM 1723 CB LEU B 7 13.353 2.054 -5.395 1.00 1.15 C ATOM 1724 CG LEU B 7 12.305 2.969 -4.760 1.00 1.40 C ATOM 1725 CD1 LEU B 7 11.572 3.743 -5.856 1.00 2.06 C ATOM 1726 CD2 LEU B 7 11.299 2.122 -3.976 1.00 1.70 C ATOM 0 H LEU B 7 15.273 3.744 -5.736 1.00 0.91 H new ATOM 0 HA LEU B 7 14.395 2.005 -3.496 1.00 0.98 H new ATOM 0 HB2 LEU B 7 13.565 2.379 -6.414 1.00 1.15 H new ATOM 0 HB3 LEU B 7 12.971 1.035 -5.458 1.00 1.15 H new ATOM 0 HG LEU B 7 12.796 3.671 -4.086 1.00 1.40 H new ATOM 0 HD11 LEU B 7 10.825 4.395 -5.403 1.00 2.06 H new ATOM 0 HD12 LEU B 7 12.287 4.345 -6.417 1.00 2.06 H new ATOM 0 HD13 LEU B 7 11.081 3.042 -6.530 1.00 2.06 H new ATOM 0 HD21 LEU B 7 10.551 2.772 -3.523 1.00 1.70 H new ATOM 0 HD22 LEU B 7 10.809 1.421 -4.652 1.00 1.70 H new ATOM 0 HD23 LEU B 7 11.820 1.569 -3.195 1.00 1.70 H new ATOM 1738 N GLU B 8 15.823 0.748 -6.211 1.00 0.85 N ATOM 1739 CA GLU B 8 16.633 -0.438 -6.623 1.00 0.91 C ATOM 1740 C GLU B 8 18.129 -0.225 -6.369 1.00 0.79 C ATOM 1741 O GLU B 8 18.693 -0.857 -5.512 1.00 0.74 O ATOM 1742 CB GLU B 8 16.404 -0.727 -8.108 1.00 1.08 C ATOM 1743 CG GLU B 8 16.301 -2.237 -8.323 1.00 1.20 C ATOM 1744 CD GLU B 8 16.490 -2.556 -9.806 1.00 1.47 C ATOM 1745 OE1 GLU B 8 17.630 -2.628 -10.236 1.00 2.06 O ATOM 1746 OE2 GLU B 8 15.492 -2.723 -10.488 1.00 1.97 O ATOM 0 H GLU B 8 15.555 1.384 -6.962 1.00 0.85 H new ATOM 0 HA GLU B 8 16.309 -1.286 -6.020 1.00 0.91 H new ATOM 0 HB2 GLU B 8 15.492 -0.237 -8.448 1.00 1.08 H new ATOM 0 HB3 GLU B 8 17.224 -0.320 -8.699 1.00 1.08 H new ATOM 0 HG2 GLU B 8 17.057 -2.752 -7.730 1.00 1.20 H new ATOM 0 HG3 GLU B 8 15.330 -2.598 -7.984 1.00 1.20 H new ATOM 1753 N ILE B 9 18.762 0.664 -7.092 1.00 0.80 N ATOM 1754 CA ILE B 9 20.233 0.883 -6.869 1.00 0.81 C ATOM 1755 C ILE B 9 20.508 0.692 -5.376 1.00 0.71 C ATOM 1756 O ILE B 9 21.457 0.053 -4.964 1.00 0.82 O ATOM 1757 CB ILE B 9 20.640 2.293 -7.322 1.00 0.85 C ATOM 1758 CG1 ILE B 9 22.164 2.364 -7.443 1.00 1.52 C ATOM 1759 CG2 ILE B 9 20.163 3.353 -6.325 1.00 1.50 C ATOM 1760 CD1 ILE B 9 22.568 2.197 -8.910 1.00 1.88 C ATOM 0 H ILE B 9 18.337 1.242 -7.817 1.00 0.80 H new ATOM 0 HA ILE B 9 20.818 0.173 -7.453 1.00 0.81 H new ATOM 0 HB ILE B 9 20.173 2.493 -8.287 1.00 0.85 H new ATOM 0 HG12 ILE B 9 22.526 3.319 -7.062 1.00 1.52 H new ATOM 0 HG13 ILE B 9 22.624 1.584 -6.837 1.00 1.52 H new ATOM 0 HG21 ILE B 9 20.465 4.341 -6.672 1.00 1.50 H new ATOM 0 HG22 ILE B 9 19.077 3.314 -6.244 1.00 1.50 H new ATOM 0 HG23 ILE B 9 20.607 3.160 -5.348 1.00 1.50 H new ATOM 0 HD11 ILE B 9 23.653 2.248 -8.997 1.00 1.88 H new ATOM 0 HD12 ILE B 9 22.219 1.231 -9.276 1.00 1.88 H new ATOM 0 HD13 ILE B 9 22.119 2.993 -9.504 1.00 1.88 H new ATOM 1772 N ILE B 10 19.645 1.244 -4.586 1.00 0.59 N ATOM 1773 CA ILE B 10 19.764 1.130 -3.103 1.00 0.59 C ATOM 1774 C ILE B 10 19.722 -0.347 -2.719 1.00 0.51 C ATOM 1775 O ILE B 10 20.623 -0.865 -2.088 1.00 0.54 O ATOM 1776 CB ILE B 10 18.599 1.886 -2.436 1.00 0.67 C ATOM 1777 CG1 ILE B 10 19.054 3.303 -2.056 1.00 0.85 C ATOM 1778 CG2 ILE B 10 18.125 1.151 -1.171 1.00 0.74 C ATOM 1779 CD1 ILE B 10 19.753 3.279 -0.697 1.00 1.31 C ATOM 0 H ILE B 10 18.841 1.784 -4.906 1.00 0.59 H new ATOM 0 HA ILE B 10 20.704 1.566 -2.766 1.00 0.59 H new ATOM 0 HB ILE B 10 17.772 1.937 -3.144 1.00 0.67 H new ATOM 0 HG12 ILE B 10 19.731 3.693 -2.816 1.00 0.85 H new ATOM 0 HG13 ILE B 10 18.195 3.973 -2.021 1.00 0.85 H new ATOM 0 HG21 ILE B 10 17.302 1.703 -0.717 1.00 0.74 H new ATOM 0 HG22 ILE B 10 17.787 0.149 -1.437 1.00 0.74 H new ATOM 0 HG23 ILE B 10 18.949 1.079 -0.461 1.00 0.74 H new ATOM 0 HD11 ILE B 10 20.073 4.287 -0.434 1.00 1.31 H new ATOM 0 HD12 ILE B 10 19.063 2.908 0.061 1.00 1.31 H new ATOM 0 HD13 ILE B 10 20.623 2.624 -0.747 1.00 1.31 H new ATOM 1791 N GLN B 11 18.674 -1.029 -3.091 1.00 0.50 N ATOM 1792 CA GLN B 11 18.564 -2.469 -2.744 1.00 0.50 C ATOM 1793 C GLN B 11 19.791 -3.219 -3.265 1.00 0.52 C ATOM 1794 O GLN B 11 20.299 -4.111 -2.619 1.00 0.52 O ATOM 1795 CB GLN B 11 17.302 -3.055 -3.380 1.00 0.55 C ATOM 1796 CG GLN B 11 16.498 -3.807 -2.318 1.00 1.24 C ATOM 1797 CD GLN B 11 15.345 -4.559 -2.986 1.00 1.53 C ATOM 1798 OE1 GLN B 11 15.288 -5.771 -2.938 1.00 2.22 O ATOM 1799 NE2 GLN B 11 14.419 -3.886 -3.611 1.00 1.91 N ATOM 0 H GLN B 11 17.890 -0.649 -3.621 1.00 0.50 H new ATOM 0 HA GLN B 11 18.508 -2.574 -1.661 1.00 0.50 H new ATOM 0 HB2 GLN B 11 16.697 -2.259 -3.813 1.00 0.55 H new ATOM 0 HB3 GLN B 11 17.571 -3.729 -4.193 1.00 0.55 H new ATOM 0 HG2 GLN B 11 17.143 -4.507 -1.787 1.00 1.24 H new ATOM 0 HG3 GLN B 11 16.109 -3.107 -1.578 1.00 1.24 H new ATOM 0 HE21 GLN B 11 14.468 -2.868 -3.651 1.00 1.91 H new ATOM 0 HE22 GLN B 11 13.646 -4.378 -4.060 1.00 1.91 H new ATOM 1808 N ALA B 12 20.288 -2.854 -4.418 1.00 0.57 N ATOM 1809 CA ALA B 12 21.496 -3.537 -4.958 1.00 0.62 C ATOM 1810 C ALA B 12 22.706 -3.220 -4.077 1.00 0.57 C ATOM 1811 O ALA B 12 23.529 -4.069 -3.805 1.00 0.57 O ATOM 1812 CB ALA B 12 21.762 -3.052 -6.384 1.00 0.71 C ATOM 0 H ALA B 12 19.908 -2.113 -5.007 1.00 0.57 H new ATOM 0 HA ALA B 12 21.328 -4.614 -4.965 1.00 0.62 H new ATOM 0 HB1 ALA B 12 22.646 -3.552 -6.779 1.00 0.71 H new ATOM 0 HB2 ALA B 12 20.903 -3.283 -7.013 1.00 0.71 H new ATOM 0 HB3 ALA B 12 21.927 -1.975 -6.377 1.00 0.71 H new ATOM 1818 N ILE B 13 22.812 -1.998 -3.626 1.00 0.55 N ATOM 1819 CA ILE B 13 23.962 -1.619 -2.759 1.00 0.51 C ATOM 1820 C ILE B 13 23.809 -2.287 -1.392 1.00 0.44 C ATOM 1821 O ILE B 13 24.760 -2.778 -0.814 1.00 0.45 O ATOM 1822 CB ILE B 13 23.983 -0.100 -2.590 1.00 0.52 C ATOM 1823 CG1 ILE B 13 24.574 0.540 -3.850 1.00 0.65 C ATOM 1824 CG2 ILE B 13 24.838 0.273 -1.379 1.00 0.52 C ATOM 1825 CD1 ILE B 13 23.971 1.931 -4.049 1.00 0.84 C ATOM 0 H ILE B 13 22.151 -1.247 -3.822 1.00 0.55 H new ATOM 0 HA ILE B 13 24.895 -1.948 -3.218 1.00 0.51 H new ATOM 0 HB ILE B 13 22.967 0.262 -2.436 1.00 0.52 H new ATOM 0 HG12 ILE B 13 25.658 0.612 -3.760 1.00 0.65 H new ATOM 0 HG13 ILE B 13 24.367 -0.085 -4.719 1.00 0.65 H new ATOM 0 HG21 ILE B 13 24.850 1.357 -1.262 1.00 0.52 H new ATOM 0 HG22 ILE B 13 24.418 -0.184 -0.483 1.00 0.52 H new ATOM 0 HG23 ILE B 13 25.856 -0.087 -1.527 1.00 0.52 H new ATOM 0 HD11 ILE B 13 24.392 2.385 -4.946 1.00 0.84 H new ATOM 0 HD12 ILE B 13 22.890 1.847 -4.159 1.00 0.84 H new ATOM 0 HD13 ILE B 13 24.200 2.554 -3.185 1.00 0.84 H new ATOM 1837 N LEU B 14 22.615 -2.302 -0.874 1.00 0.45 N ATOM 1838 CA LEU B 14 22.374 -2.923 0.457 1.00 0.41 C ATOM 1839 C LEU B 14 22.635 -4.430 0.395 1.00 0.42 C ATOM 1840 O LEU B 14 23.234 -5.004 1.281 1.00 0.41 O ATOM 1841 CB LEU B 14 20.915 -2.689 0.851 1.00 0.45 C ATOM 1842 CG LEU B 14 20.848 -2.032 2.229 1.00 0.57 C ATOM 1843 CD1 LEU B 14 19.383 -1.801 2.610 1.00 0.54 C ATOM 1844 CD2 LEU B 14 21.503 -2.949 3.263 1.00 1.01 C ATOM 0 H LEU B 14 21.787 -1.907 -1.320 1.00 0.45 H new ATOM 0 HA LEU B 14 23.046 -2.475 1.189 1.00 0.41 H new ATOM 0 HB2 LEU B 14 20.427 -2.054 0.112 1.00 0.45 H new ATOM 0 HB3 LEU B 14 20.376 -3.636 0.863 1.00 0.45 H new ATOM 0 HG LEU B 14 21.374 -1.078 2.204 1.00 0.57 H new ATOM 0 HD11 LEU B 14 19.332 -1.332 3.593 1.00 0.54 H new ATOM 0 HD12 LEU B 14 18.914 -1.150 1.873 1.00 0.54 H new ATOM 0 HD13 LEU B 14 18.859 -2.756 2.636 1.00 0.54 H new ATOM 0 HD21 LEU B 14 21.456 -2.481 4.246 1.00 1.01 H new ATOM 0 HD22 LEU B 14 20.976 -3.903 3.289 1.00 1.01 H new ATOM 0 HD23 LEU B 14 22.545 -3.118 2.991 1.00 1.01 H new ATOM 1856 N GLU B 15 22.178 -5.076 -0.637 1.00 0.47 N ATOM 1857 CA GLU B 15 22.391 -6.545 -0.744 1.00 0.52 C ATOM 1858 C GLU B 15 23.866 -6.858 -0.992 1.00 0.53 C ATOM 1859 O GLU B 15 24.387 -7.845 -0.519 1.00 0.60 O ATOM 1860 CB GLU B 15 21.552 -7.115 -1.889 1.00 0.59 C ATOM 1861 CG GLU B 15 20.478 -8.039 -1.317 1.00 0.80 C ATOM 1862 CD GLU B 15 19.752 -8.752 -2.459 1.00 0.73 C ATOM 1863 OE1 GLU B 15 18.837 -8.164 -3.013 1.00 1.29 O ATOM 1864 OE2 GLU B 15 20.123 -9.875 -2.760 1.00 1.28 O ATOM 0 H GLU B 15 21.667 -4.652 -1.411 1.00 0.47 H new ATOM 0 HA GLU B 15 22.084 -7.004 0.196 1.00 0.52 H new ATOM 0 HB2 GLU B 15 21.089 -6.306 -2.453 1.00 0.59 H new ATOM 0 HB3 GLU B 15 22.188 -7.664 -2.583 1.00 0.59 H new ATOM 0 HG2 GLU B 15 20.932 -8.771 -0.649 1.00 0.80 H new ATOM 0 HG3 GLU B 15 19.767 -7.463 -0.724 1.00 0.80 H new ATOM 1871 N ALA B 16 24.550 -6.036 -1.730 1.00 0.49 N ATOM 1872 CA ALA B 16 25.978 -6.321 -1.992 1.00 0.52 C ATOM 1873 C ALA B 16 26.743 -6.221 -0.684 1.00 0.50 C ATOM 1874 O ALA B 16 27.668 -6.967 -0.435 1.00 0.54 O ATOM 1875 CB ALA B 16 26.536 -5.301 -2.982 1.00 0.53 C ATOM 0 H ALA B 16 24.184 -5.186 -2.159 1.00 0.49 H new ATOM 0 HA ALA B 16 26.082 -7.321 -2.413 1.00 0.52 H new ATOM 0 HB1 ALA B 16 27.588 -5.515 -3.171 1.00 0.53 H new ATOM 0 HB2 ALA B 16 25.980 -5.360 -3.917 1.00 0.53 H new ATOM 0 HB3 ALA B 16 26.440 -4.299 -2.565 1.00 0.53 H new ATOM 1881 N CYS B 17 26.375 -5.296 0.155 1.00 0.46 N ATOM 1882 CA CYS B 17 27.099 -5.149 1.431 1.00 0.46 C ATOM 1883 C CYS B 17 26.672 -6.246 2.411 1.00 0.47 C ATOM 1884 O CYS B 17 27.316 -6.473 3.415 1.00 0.49 O ATOM 1885 CB CYS B 17 26.800 -3.778 2.024 1.00 0.42 C ATOM 1886 SG CYS B 17 25.137 -3.766 2.735 1.00 0.42 S ATOM 0 H CYS B 17 25.607 -4.641 0.008 1.00 0.46 H new ATOM 0 HA CYS B 17 28.170 -5.242 1.250 1.00 0.46 H new ATOM 0 HB2 CYS B 17 27.535 -3.536 2.791 1.00 0.42 H new ATOM 0 HB3 CYS B 17 26.881 -3.013 1.252 1.00 0.42 H new ATOM 0 HG CYS B 17 24.343 -4.480 1.994 1.00 0.42 H new ATOM 1892 N LYS B 18 25.592 -6.925 2.133 1.00 0.49 N ATOM 1893 CA LYS B 18 25.128 -8.002 3.055 1.00 0.51 C ATOM 1894 C LYS B 18 26.271 -8.975 3.382 1.00 0.55 C ATOM 1895 O LYS B 18 26.096 -9.895 4.157 1.00 0.58 O ATOM 1896 CB LYS B 18 23.967 -8.767 2.412 1.00 0.56 C ATOM 1897 CG LYS B 18 24.507 -9.936 1.575 1.00 1.18 C ATOM 1898 CD LYS B 18 23.434 -10.424 0.593 1.00 1.89 C ATOM 1899 CE LYS B 18 22.347 -11.195 1.346 1.00 2.29 C ATOM 1900 NZ LYS B 18 22.966 -12.324 2.096 1.00 2.90 N ATOM 0 H LYS B 18 25.011 -6.781 1.307 1.00 0.49 H new ATOM 0 HA LYS B 18 24.793 -7.540 3.984 1.00 0.51 H new ATOM 0 HB2 LYS B 18 23.296 -9.142 3.185 1.00 0.56 H new ATOM 0 HB3 LYS B 18 23.384 -8.096 1.781 1.00 0.56 H new ATOM 0 HG2 LYS B 18 25.395 -9.621 1.027 1.00 1.18 H new ATOM 0 HG3 LYS B 18 24.809 -10.753 2.230 1.00 1.18 H new ATOM 0 HD2 LYS B 18 22.994 -9.574 0.071 1.00 1.89 H new ATOM 0 HD3 LYS B 18 23.887 -11.064 -0.165 1.00 1.89 H new ATOM 0 HE2 LYS B 18 21.825 -10.530 2.034 1.00 2.29 H new ATOM 0 HE3 LYS B 18 21.604 -11.575 0.645 1.00 2.29 H new ATOM 0 HZ1 LYS B 18 22.338 -13.152 2.057 1.00 2.90 H new ATOM 0 HZ2 LYS B 18 23.883 -12.564 1.667 1.00 2.90 H new ATOM 0 HZ3 LYS B 18 23.110 -12.045 3.087 1.00 2.90 H new ATOM 1914 N SER B 19 27.434 -8.805 2.804 1.00 0.57 N ATOM 1915 CA SER B 19 28.543 -9.757 3.110 1.00 0.63 C ATOM 1916 C SER B 19 29.908 -9.105 2.855 1.00 0.66 C ATOM 1917 O SER B 19 30.868 -9.773 2.523 1.00 0.84 O ATOM 1918 CB SER B 19 28.403 -10.996 2.225 1.00 0.70 C ATOM 1919 OG SER B 19 29.047 -12.097 2.853 1.00 0.93 O ATOM 0 H SER B 19 27.661 -8.061 2.144 1.00 0.57 H new ATOM 0 HA SER B 19 28.481 -10.036 4.162 1.00 0.63 H new ATOM 0 HB2 SER B 19 27.350 -11.222 2.060 1.00 0.70 H new ATOM 0 HB3 SER B 19 28.846 -10.810 1.247 1.00 0.70 H new ATOM 0 HG SER B 19 29.968 -11.851 3.080 1.00 0.93 H new ATOM 1925 N GLY B 20 30.012 -7.816 3.023 1.00 0.65 N ATOM 1926 CA GLY B 20 31.325 -7.140 2.807 1.00 0.66 C ATOM 1927 C GLY B 20 31.781 -7.322 1.361 1.00 0.70 C ATOM 1928 O GLY B 20 32.228 -8.381 0.967 1.00 0.77 O ATOM 0 H GLY B 20 29.247 -7.201 3.300 1.00 0.65 H new ATOM 0 HA2 GLY B 20 31.238 -6.078 3.037 1.00 0.66 H new ATOM 0 HA3 GLY B 20 32.071 -7.553 3.486 1.00 0.66 H new ATOM 1932 N SER B 21 31.651 -6.302 0.563 1.00 0.67 N ATOM 1933 CA SER B 21 32.052 -6.412 -0.865 1.00 0.74 C ATOM 1934 C SER B 21 32.472 -5.018 -1.373 1.00 0.72 C ATOM 1935 O SER B 21 31.752 -4.063 -1.172 1.00 0.63 O ATOM 1936 CB SER B 21 30.851 -6.902 -1.672 1.00 0.74 C ATOM 1937 OG SER B 21 29.925 -7.527 -0.793 1.00 0.72 O ATOM 0 H SER B 21 31.282 -5.392 0.840 1.00 0.67 H new ATOM 0 HA SER B 21 32.883 -7.109 -0.974 1.00 0.74 H new ATOM 0 HB2 SER B 21 30.377 -6.066 -2.186 1.00 0.74 H new ATOM 0 HB3 SER B 21 31.175 -7.605 -2.439 1.00 0.74 H new ATOM 0 HG SER B 21 29.046 -7.106 -0.891 1.00 0.72 H new ATOM 1943 N PRO B 22 33.620 -4.880 -2.019 1.00 0.82 N ATOM 1944 CA PRO B 22 34.074 -3.556 -2.539 1.00 0.83 C ATOM 1945 C PRO B 22 32.998 -2.872 -3.386 1.00 0.81 C ATOM 1946 O PRO B 22 32.034 -3.489 -3.792 1.00 0.80 O ATOM 1947 CB PRO B 22 35.285 -3.877 -3.416 1.00 0.93 C ATOM 1948 CG PRO B 22 35.767 -5.225 -2.994 1.00 1.08 C ATOM 1949 CD PRO B 22 34.602 -5.944 -2.317 1.00 0.95 C ATOM 0 HA PRO B 22 34.300 -2.873 -1.720 1.00 0.83 H new ATOM 0 HB2 PRO B 22 35.011 -3.875 -4.471 1.00 0.93 H new ATOM 0 HB3 PRO B 22 36.066 -3.128 -3.288 1.00 0.93 H new ATOM 0 HG2 PRO B 22 36.118 -5.793 -3.856 1.00 1.08 H new ATOM 0 HG3 PRO B 22 36.610 -5.133 -2.309 1.00 1.08 H new ATOM 0 HD2 PRO B 22 34.174 -6.705 -2.970 1.00 0.95 H new ATOM 0 HD3 PRO B 22 34.925 -6.450 -1.407 1.00 0.95 H new ATOM 1957 N LYS B 23 33.159 -1.606 -3.667 1.00 0.80 N ATOM 1958 CA LYS B 23 32.149 -0.897 -4.501 1.00 0.80 C ATOM 1959 C LYS B 23 32.093 -1.567 -5.879 1.00 0.79 C ATOM 1960 O LYS B 23 31.081 -1.547 -6.549 1.00 0.79 O ATOM 1961 CB LYS B 23 32.552 0.580 -4.652 1.00 0.82 C ATOM 1962 CG LYS B 23 31.414 1.386 -5.308 1.00 0.78 C ATOM 1963 CD LYS B 23 31.887 1.921 -6.662 1.00 1.42 C ATOM 1964 CE LYS B 23 33.016 2.932 -6.450 1.00 1.27 C ATOM 1965 NZ LYS B 23 34.248 2.454 -7.140 1.00 1.83 N ATOM 0 H LYS B 23 33.945 -1.035 -3.355 1.00 0.80 H new ATOM 0 HA LYS B 23 31.169 -0.948 -4.027 1.00 0.80 H new ATOM 0 HB2 LYS B 23 32.787 1.001 -3.674 1.00 0.82 H new ATOM 0 HB3 LYS B 23 33.455 0.656 -5.257 1.00 0.82 H new ATOM 0 HG2 LYS B 23 30.535 0.755 -5.441 1.00 0.78 H new ATOM 0 HG3 LYS B 23 31.118 2.212 -4.661 1.00 0.78 H new ATOM 0 HD2 LYS B 23 32.234 1.099 -7.288 1.00 1.42 H new ATOM 0 HD3 LYS B 23 31.057 2.393 -7.188 1.00 1.42 H new ATOM 0 HE2 LYS B 23 32.723 3.907 -6.840 1.00 1.27 H new ATOM 0 HE3 LYS B 23 33.209 3.059 -5.385 1.00 1.27 H new ATOM 0 HZ1 LYS B 23 34.855 3.267 -7.368 1.00 1.83 H new ATOM 0 HZ2 LYS B 23 34.764 1.801 -6.517 1.00 1.83 H new ATOM 0 HZ3 LYS B 23 33.985 1.961 -8.017 1.00 1.83 H new ATOM 1979 N THR B 24 33.177 -2.172 -6.300 1.00 0.79 N ATOM 1980 CA THR B 24 33.200 -2.862 -7.626 1.00 0.79 C ATOM 1981 C THR B 24 32.310 -4.115 -7.608 1.00 0.82 C ATOM 1982 O THR B 24 31.592 -4.387 -8.549 1.00 0.84 O ATOM 1983 CB THR B 24 34.636 -3.268 -7.960 1.00 0.78 C ATOM 1984 OG1 THR B 24 35.120 -4.157 -6.964 1.00 0.85 O ATOM 1985 CG2 THR B 24 35.523 -2.023 -8.010 1.00 0.82 C ATOM 0 H THR B 24 34.052 -2.217 -5.778 1.00 0.79 H new ATOM 0 HA THR B 24 32.818 -2.175 -8.381 1.00 0.79 H new ATOM 0 HB THR B 24 34.656 -3.764 -8.930 1.00 0.78 H new ATOM 0 HG1 THR B 24 36.040 -4.419 -7.178 1.00 0.85 H new ATOM 0 HG21 THR B 24 36.546 -2.314 -8.248 1.00 0.82 H new ATOM 0 HG22 THR B 24 35.152 -1.342 -8.776 1.00 0.82 H new ATOM 0 HG23 THR B 24 35.504 -1.524 -7.041 1.00 0.82 H new ATOM 1993 N ARG B 25 32.355 -4.885 -6.548 1.00 0.84 N ATOM 1994 CA ARG B 25 31.517 -6.124 -6.474 1.00 0.89 C ATOM 1995 C ARG B 25 30.045 -5.735 -6.586 1.00 0.90 C ATOM 1996 O ARG B 25 29.173 -6.556 -6.787 1.00 0.96 O ATOM 1997 CB ARG B 25 31.771 -6.803 -5.119 1.00 0.90 C ATOM 1998 CG ARG B 25 32.269 -8.241 -5.314 1.00 1.33 C ATOM 1999 CD ARG B 25 31.090 -9.139 -5.687 1.00 1.07 C ATOM 2000 NE ARG B 25 31.601 -10.456 -6.165 1.00 1.67 N ATOM 2001 CZ ARG B 25 30.779 -11.455 -6.328 1.00 2.00 C ATOM 2002 NH1 ARG B 25 29.507 -11.302 -6.076 1.00 2.14 N ATOM 2003 NH2 ARG B 25 31.228 -12.608 -6.743 1.00 2.74 N ATOM 0 H ARG B 25 32.937 -4.709 -5.729 1.00 0.84 H new ATOM 0 HA ARG B 25 31.772 -6.807 -7.284 1.00 0.89 H new ATOM 0 HB2 ARG B 25 32.508 -6.232 -4.554 1.00 0.90 H new ATOM 0 HB3 ARG B 25 30.853 -6.808 -4.532 1.00 0.90 H new ATOM 0 HG2 ARG B 25 33.027 -8.272 -6.097 1.00 1.33 H new ATOM 0 HG3 ARG B 25 32.740 -8.602 -4.400 1.00 1.33 H new ATOM 0 HD2 ARG B 25 30.439 -9.281 -4.824 1.00 1.07 H new ATOM 0 HD3 ARG B 25 30.490 -8.666 -6.464 1.00 1.07 H new ATOM 0 HE ARG B 25 32.594 -10.575 -6.365 1.00 1.67 H new ATOM 0 HH11 ARG B 25 29.156 -10.401 -5.752 1.00 2.14 H new ATOM 0 HH12 ARG B 25 28.864 -12.084 -6.204 1.00 2.14 H new ATOM 0 HH21 ARG B 25 32.222 -12.727 -6.940 1.00 2.74 H new ATOM 0 HH22 ARG B 25 30.585 -13.390 -6.871 1.00 2.74 H new ATOM 2017 N ILE B 26 29.789 -4.474 -6.470 1.00 0.86 N ATOM 2018 CA ILE B 26 28.397 -3.990 -6.581 1.00 0.89 C ATOM 2019 C ILE B 26 28.076 -3.783 -8.060 1.00 0.93 C ATOM 2020 O ILE B 26 26.934 -3.834 -8.473 1.00 0.96 O ATOM 2021 CB ILE B 26 28.241 -2.703 -5.774 1.00 0.86 C ATOM 2022 CG1 ILE B 26 28.815 -2.958 -4.376 1.00 0.92 C ATOM 2023 CG2 ILE B 26 26.758 -2.334 -5.674 1.00 0.90 C ATOM 2024 CD1 ILE B 26 28.198 -2.001 -3.351 1.00 0.62 C ATOM 0 H ILE B 26 30.488 -3.751 -6.302 1.00 0.86 H new ATOM 0 HA ILE B 26 27.694 -4.717 -6.174 1.00 0.89 H new ATOM 0 HB ILE B 26 28.768 -1.879 -6.255 1.00 0.86 H new ATOM 0 HG12 ILE B 26 28.620 -3.989 -4.081 1.00 0.92 H new ATOM 0 HG13 ILE B 26 29.897 -2.830 -4.394 1.00 0.92 H new ATOM 0 HG21 ILE B 26 26.650 -1.415 -5.098 1.00 0.90 H new ATOM 0 HG22 ILE B 26 26.352 -2.185 -6.674 1.00 0.90 H new ATOM 0 HG23 ILE B 26 26.215 -3.139 -5.179 1.00 0.90 H new ATOM 0 HD11 ILE B 26 28.621 -2.201 -2.366 1.00 0.62 H new ATOM 0 HD12 ILE B 26 28.415 -0.972 -3.637 1.00 0.62 H new ATOM 0 HD13 ILE B 26 27.118 -2.148 -3.319 1.00 0.62 H new ATOM 2036 N MET B 27 29.082 -3.556 -8.867 1.00 0.94 N ATOM 2037 CA MET B 27 28.834 -3.356 -10.323 1.00 0.99 C ATOM 2038 C MET B 27 28.042 -4.555 -10.846 1.00 1.06 C ATOM 2039 O MET B 27 27.079 -4.410 -11.575 1.00 1.10 O ATOM 2040 CB MET B 27 30.168 -3.241 -11.072 1.00 0.98 C ATOM 2041 CG MET B 27 30.820 -1.875 -10.805 1.00 1.55 C ATOM 2042 SD MET B 27 32.446 -1.830 -11.597 1.00 1.89 S ATOM 2043 CE MET B 27 31.922 -1.038 -13.137 1.00 1.25 C ATOM 0 H MET B 27 30.059 -3.501 -8.580 1.00 0.94 H new ATOM 0 HA MET B 27 28.270 -2.437 -10.483 1.00 0.99 H new ATOM 0 HB2 MET B 27 30.839 -4.039 -10.755 1.00 0.98 H new ATOM 0 HB3 MET B 27 30.003 -3.369 -12.142 1.00 0.98 H new ATOM 0 HG2 MET B 27 30.190 -1.075 -11.194 1.00 1.55 H new ATOM 0 HG3 MET B 27 30.920 -1.709 -9.732 1.00 1.55 H new ATOM 0 HE1 MET B 27 32.784 -0.909 -13.791 1.00 1.25 H new ATOM 0 HE2 MET B 27 31.180 -1.663 -13.634 1.00 1.25 H new ATOM 0 HE3 MET B 27 31.486 -0.064 -12.915 1.00 1.25 H new ATOM 2053 N TYR B 28 28.422 -5.740 -10.453 1.00 1.07 N ATOM 2054 CA TYR B 28 27.679 -6.956 -10.893 1.00 1.14 C ATOM 2055 C TYR B 28 26.241 -6.852 -10.382 1.00 1.09 C ATOM 2056 O TYR B 28 25.402 -7.685 -10.662 1.00 1.20 O ATOM 2057 CB TYR B 28 28.345 -8.194 -10.290 1.00 1.17 C ATOM 2058 CG TYR B 28 27.923 -9.429 -11.052 1.00 1.43 C ATOM 2059 CD1 TYR B 28 28.443 -9.678 -12.327 1.00 1.71 C ATOM 2060 CD2 TYR B 28 27.017 -10.330 -10.477 1.00 2.20 C ATOM 2061 CE1 TYR B 28 28.058 -10.827 -13.029 1.00 1.98 C ATOM 2062 CE2 TYR B 28 26.631 -11.478 -11.179 1.00 2.58 C ATOM 2063 CZ TYR B 28 27.151 -11.727 -12.455 1.00 2.21 C ATOM 2064 OH TYR B 28 26.772 -12.860 -13.145 1.00 2.65 O ATOM 0 H TYR B 28 29.219 -5.919 -9.843 1.00 1.07 H new ATOM 0 HA TYR B 28 27.686 -7.035 -11.980 1.00 1.14 H new ATOM 0 HB2 TYR B 28 29.429 -8.088 -10.325 1.00 1.17 H new ATOM 0 HB3 TYR B 28 28.068 -8.292 -9.240 1.00 1.17 H new ATOM 0 HD1 TYR B 28 29.142 -8.984 -12.770 1.00 1.71 H new ATOM 0 HD2 TYR B 28 26.617 -10.139 -9.492 1.00 2.20 H new ATOM 0 HE1 TYR B 28 28.460 -11.019 -14.013 1.00 1.98 H new ATOM 0 HE2 TYR B 28 25.932 -12.172 -10.736 1.00 2.58 H new ATOM 0 HH TYR B 28 26.139 -13.376 -12.604 1.00 2.65 H new ATOM 2074 N GLY B 29 25.962 -5.821 -9.634 1.00 1.05 N ATOM 2075 CA GLY B 29 24.589 -5.628 -9.091 1.00 1.02 C ATOM 2076 C GLY B 29 23.797 -4.693 -10.009 1.00 1.05 C ATOM 2077 O GLY B 29 22.593 -4.801 -10.127 1.00 1.10 O ATOM 0 H GLY B 29 26.633 -5.098 -9.374 1.00 1.05 H new ATOM 0 HA2 GLY B 29 24.081 -6.589 -9.010 1.00 1.02 H new ATOM 0 HA3 GLY B 29 24.641 -5.209 -8.086 1.00 1.02 H new ATOM 2081 N ALA B 30 24.461 -3.772 -10.658 1.00 1.06 N ATOM 2082 CA ALA B 30 23.735 -2.834 -11.562 1.00 1.10 C ATOM 2083 C ALA B 30 24.735 -2.048 -12.419 1.00 1.16 C ATOM 2084 O ALA B 30 25.931 -2.238 -12.324 1.00 1.24 O ATOM 2085 CB ALA B 30 22.904 -1.859 -10.721 1.00 1.13 C ATOM 0 H ALA B 30 25.469 -3.630 -10.601 1.00 1.06 H new ATOM 0 HA ALA B 30 23.079 -3.406 -12.218 1.00 1.10 H new ATOM 0 HB1 ALA B 30 22.372 -1.172 -11.380 1.00 1.13 H new ATOM 0 HB2 ALA B 30 22.185 -2.417 -10.122 1.00 1.13 H new ATOM 0 HB3 ALA B 30 23.563 -1.293 -10.063 1.00 1.13 H new ATOM 2091 N ASN B 31 24.251 -1.159 -13.253 1.00 1.19 N ATOM 2092 CA ASN B 31 25.168 -0.353 -14.117 1.00 1.26 C ATOM 2093 C ASN B 31 25.994 0.594 -13.243 1.00 1.28 C ATOM 2094 O ASN B 31 26.704 1.450 -13.728 1.00 1.73 O ATOM 2095 CB ASN B 31 24.346 0.464 -15.113 1.00 1.34 C ATOM 2096 CG ASN B 31 25.217 0.818 -16.318 1.00 1.68 C ATOM 2097 OD1 ASN B 31 25.744 1.909 -16.402 1.00 2.40 O ATOM 2098 ND2 ASN B 31 25.393 -0.066 -17.260 1.00 1.85 N ATOM 0 H ASN B 31 23.258 -0.957 -13.372 1.00 1.19 H new ATOM 0 HA ASN B 31 25.835 -1.023 -14.659 1.00 1.26 H new ATOM 0 HB2 ASN B 31 23.474 -0.105 -15.435 1.00 1.34 H new ATOM 0 HB3 ASN B 31 23.976 1.373 -14.638 1.00 1.34 H new ATOM 0 HD21 ASN B 31 25.974 0.158 -18.068 1.00 1.85 H new ATOM 0 HD22 ASN B 31 24.950 -0.982 -17.189 1.00 1.85 H new ATOM 2105 N LEU B 32 25.929 0.405 -11.959 1.00 1.11 N ATOM 2106 CA LEU B 32 26.720 1.225 -11.004 1.00 1.05 C ATOM 2107 C LEU B 32 26.898 2.666 -11.437 1.00 1.03 C ATOM 2108 O LEU B 32 27.786 3.030 -12.183 1.00 1.08 O ATOM 2109 CB LEU B 32 28.079 0.576 -10.786 1.00 1.08 C ATOM 2110 CG LEU B 32 28.295 0.270 -9.291 1.00 1.11 C ATOM 2111 CD1 LEU B 32 28.333 1.567 -8.483 1.00 1.07 C ATOM 2112 CD2 LEU B 32 27.162 -0.611 -8.756 1.00 1.16 C ATOM 0 H LEU B 32 25.343 -0.304 -11.518 1.00 1.11 H new ATOM 0 HA LEU B 32 26.153 1.257 -10.074 1.00 1.05 H new ATOM 0 HB2 LEU B 32 28.147 -0.345 -11.366 1.00 1.08 H new ATOM 0 HB3 LEU B 32 28.867 1.238 -11.146 1.00 1.08 H new ATOM 0 HG LEU B 32 29.245 -0.254 -9.189 1.00 1.11 H new ATOM 0 HD11 LEU B 32 28.486 1.335 -7.429 1.00 1.07 H new ATOM 0 HD12 LEU B 32 29.151 2.194 -8.839 1.00 1.07 H new ATOM 0 HD13 LEU B 32 27.389 2.099 -8.604 1.00 1.07 H new ATOM 0 HD21 LEU B 32 27.330 -0.818 -7.699 1.00 1.16 H new ATOM 0 HD22 LEU B 32 26.210 -0.094 -8.878 1.00 1.16 H new ATOM 0 HD23 LEU B 32 27.138 -1.549 -9.310 1.00 1.16 H new ATOM 2124 N SER B 33 26.093 3.484 -10.864 1.00 0.99 N ATOM 2125 CA SER B 33 26.169 4.942 -11.058 1.00 1.01 C ATOM 2126 C SER B 33 27.484 5.415 -10.420 1.00 0.96 C ATOM 2127 O SER B 33 27.625 6.561 -10.103 1.00 0.96 O ATOM 2128 CB SER B 33 24.967 5.618 -10.396 1.00 0.99 C ATOM 2129 OG SER B 33 24.602 6.767 -11.148 1.00 1.33 O ATOM 0 H SER B 33 25.346 3.189 -10.236 1.00 0.99 H new ATOM 0 HA SER B 33 26.149 5.201 -12.116 1.00 1.01 H new ATOM 0 HB2 SER B 33 24.129 4.923 -10.342 1.00 0.99 H new ATOM 0 HB3 SER B 33 25.213 5.902 -9.373 1.00 0.99 H new ATOM 0 HG SER B 33 23.831 7.202 -10.727 1.00 1.33 H new ATOM 2135 N TYR B 34 28.383 4.485 -10.125 1.00 0.95 N ATOM 2136 CA TYR B 34 29.660 4.778 -9.378 1.00 0.94 C ATOM 2137 C TYR B 34 30.024 6.265 -9.383 1.00 0.96 C ATOM 2138 O TYR B 34 30.340 6.819 -8.349 1.00 0.89 O ATOM 2139 CB TYR B 34 30.810 4.020 -10.045 1.00 1.10 C ATOM 2140 CG TYR B 34 31.382 4.825 -11.190 1.00 1.01 C ATOM 2141 CD1 TYR B 34 32.374 5.783 -10.945 1.00 1.81 C ATOM 2142 CD2 TYR B 34 30.925 4.609 -12.495 1.00 1.77 C ATOM 2143 CE1 TYR B 34 32.908 6.526 -12.006 1.00 2.56 C ATOM 2144 CE2 TYR B 34 31.458 5.352 -13.555 1.00 2.53 C ATOM 2145 CZ TYR B 34 32.449 6.310 -13.310 1.00 2.75 C ATOM 2146 OH TYR B 34 32.975 7.041 -14.356 1.00 3.76 O ATOM 0 H TYR B 34 28.275 3.504 -10.382 1.00 0.95 H new ATOM 0 HA TYR B 34 29.503 4.467 -8.345 1.00 0.94 H new ATOM 0 HB2 TYR B 34 31.590 3.814 -9.313 1.00 1.10 H new ATOM 0 HB3 TYR B 34 30.454 3.057 -10.412 1.00 1.10 H new ATOM 0 HD1 TYR B 34 32.727 5.949 -9.938 1.00 1.81 H new ATOM 0 HD2 TYR B 34 30.161 3.869 -12.684 1.00 1.77 H new ATOM 0 HE1 TYR B 34 33.673 7.265 -11.818 1.00 2.56 H new ATOM 0 HE2 TYR B 34 31.105 5.186 -14.562 1.00 2.53 H new ATOM 0 HH TYR B 34 32.548 6.767 -15.194 1.00 3.76 H new ATOM 2156 N ALA B 35 29.968 6.940 -10.489 1.00 1.07 N ATOM 2157 CA ALA B 35 30.294 8.389 -10.442 1.00 1.15 C ATOM 2158 C ALA B 35 29.306 9.053 -9.479 1.00 1.05 C ATOM 2159 O ALA B 35 29.663 9.863 -8.647 1.00 1.03 O ATOM 2160 CB ALA B 35 30.148 9.001 -11.837 1.00 1.30 C ATOM 0 H ALA B 35 29.717 6.566 -11.404 1.00 1.07 H new ATOM 0 HA ALA B 35 31.320 8.540 -10.106 1.00 1.15 H new ATOM 0 HB1 ALA B 35 30.388 10.063 -11.795 1.00 1.30 H new ATOM 0 HB2 ALA B 35 30.829 8.502 -12.526 1.00 1.30 H new ATOM 0 HB3 ALA B 35 29.123 8.874 -12.184 1.00 1.30 H new ATOM 2166 N LEU B 36 28.062 8.683 -9.594 1.00 1.02 N ATOM 2167 CA LEU B 36 26.998 9.237 -8.707 1.00 0.96 C ATOM 2168 C LEU B 36 26.728 8.295 -7.519 1.00 0.83 C ATOM 2169 O LEU B 36 26.610 8.727 -6.389 1.00 0.79 O ATOM 2170 CB LEU B 36 25.707 9.403 -9.515 1.00 1.03 C ATOM 2171 CG LEU B 36 25.253 10.863 -9.474 1.00 1.16 C ATOM 2172 CD1 LEU B 36 24.030 11.040 -10.377 1.00 1.74 C ATOM 2173 CD2 LEU B 36 24.882 11.244 -8.040 1.00 1.99 C ATOM 0 H LEU B 36 27.730 8.005 -10.280 1.00 1.02 H new ATOM 0 HA LEU B 36 27.333 10.200 -8.321 1.00 0.96 H new ATOM 0 HB2 LEU B 36 25.871 9.093 -10.547 1.00 1.03 H new ATOM 0 HB3 LEU B 36 24.927 8.759 -9.108 1.00 1.03 H new ATOM 0 HG LEU B 36 26.063 11.504 -9.823 1.00 1.16 H new ATOM 0 HD11 LEU B 36 23.705 12.080 -10.349 1.00 1.74 H new ATOM 0 HD12 LEU B 36 24.291 10.768 -11.400 1.00 1.74 H new ATOM 0 HD13 LEU B 36 23.222 10.398 -10.026 1.00 1.74 H new ATOM 0 HD21 LEU B 36 24.559 12.285 -8.012 1.00 1.99 H new ATOM 0 HD22 LEU B 36 24.072 10.603 -7.691 1.00 1.99 H new ATOM 0 HD23 LEU B 36 25.750 11.116 -7.393 1.00 1.99 H new ATOM 2185 N THR B 37 26.579 7.016 -7.781 1.00 0.80 N ATOM 2186 CA THR B 37 26.256 6.043 -6.686 1.00 0.71 C ATOM 2187 C THR B 37 27.080 6.336 -5.438 1.00 0.66 C ATOM 2188 O THR B 37 26.595 6.186 -4.338 1.00 0.61 O ATOM 2189 CB THR B 37 26.510 4.603 -7.140 1.00 0.80 C ATOM 2190 OG1 THR B 37 25.386 4.133 -7.869 1.00 0.93 O ATOM 2191 CG2 THR B 37 26.728 3.710 -5.912 1.00 0.81 C ATOM 0 H THR B 37 26.668 6.603 -8.709 1.00 0.80 H new ATOM 0 HA THR B 37 25.198 6.157 -6.448 1.00 0.71 H new ATOM 0 HB THR B 37 27.396 4.573 -7.774 1.00 0.80 H new ATOM 0 HG1 THR B 37 25.548 3.212 -8.162 1.00 0.93 H new ATOM 0 HG21 THR B 37 26.909 2.685 -6.235 1.00 0.81 H new ATOM 0 HG22 THR B 37 27.589 4.070 -5.349 1.00 0.81 H new ATOM 0 HG23 THR B 37 25.841 3.740 -5.279 1.00 0.81 H new ATOM 2199 N GLY B 38 28.311 6.739 -5.582 1.00 0.69 N ATOM 2200 CA GLY B 38 29.126 7.041 -4.365 1.00 0.68 C ATOM 2201 C GLY B 38 28.261 7.874 -3.415 1.00 0.65 C ATOM 2202 O GLY B 38 28.415 7.847 -2.210 1.00 0.64 O ATOM 0 H GLY B 38 28.786 6.872 -6.475 1.00 0.69 H new ATOM 0 HA2 GLY B 38 29.445 6.118 -3.881 1.00 0.68 H new ATOM 0 HA3 GLY B 38 30.029 7.587 -4.636 1.00 0.68 H new ATOM 2206 N ARG B 39 27.333 8.596 -3.980 1.00 0.67 N ATOM 2207 CA ARG B 39 26.400 9.436 -3.176 1.00 0.69 C ATOM 2208 C ARG B 39 25.430 8.527 -2.414 1.00 0.64 C ATOM 2209 O ARG B 39 25.001 8.835 -1.319 1.00 0.64 O ATOM 2210 CB ARG B 39 25.610 10.334 -4.134 1.00 0.76 C ATOM 2211 CG ARG B 39 24.703 11.294 -3.351 1.00 0.80 C ATOM 2212 CD ARG B 39 23.369 11.459 -4.090 1.00 0.82 C ATOM 2213 NE ARG B 39 23.615 12.064 -5.430 1.00 1.17 N ATOM 2214 CZ ARG B 39 23.780 13.354 -5.543 1.00 1.79 C ATOM 2215 NH1 ARG B 39 23.727 14.114 -4.484 1.00 2.44 N ATOM 2216 NH2 ARG B 39 23.996 13.884 -6.716 1.00 2.34 N ATOM 0 H ARG B 39 27.179 8.640 -4.987 1.00 0.67 H new ATOM 0 HA ARG B 39 26.958 10.045 -2.464 1.00 0.69 H new ATOM 0 HB2 ARG B 39 26.299 10.904 -4.758 1.00 0.76 H new ATOM 0 HB3 ARG B 39 25.007 9.720 -4.803 1.00 0.76 H new ATOM 0 HG2 ARG B 39 24.529 10.908 -2.347 1.00 0.80 H new ATOM 0 HG3 ARG B 39 25.191 12.262 -3.240 1.00 0.80 H new ATOM 0 HD2 ARG B 39 22.880 10.491 -4.200 1.00 0.82 H new ATOM 0 HD3 ARG B 39 22.696 12.092 -3.511 1.00 0.82 H new ATOM 0 HE ARG B 39 23.654 11.470 -6.258 1.00 1.17 H new ATOM 0 HH11 ARG B 39 23.557 13.700 -3.567 1.00 2.44 H new ATOM 0 HH12 ARG B 39 23.856 15.122 -4.573 1.00 2.44 H new ATOM 0 HH21 ARG B 39 24.036 13.290 -7.544 1.00 2.34 H new ATOM 0 HH22 ARG B 39 24.125 14.892 -6.804 1.00 2.34 H new ATOM 2230 N TYR B 40 25.085 7.410 -2.989 1.00 0.60 N ATOM 2231 CA TYR B 40 24.146 6.477 -2.307 1.00 0.56 C ATOM 2232 C TYR B 40 24.907 5.651 -1.271 1.00 0.48 C ATOM 2233 O TYR B 40 24.456 5.465 -0.160 1.00 0.47 O ATOM 2234 CB TYR B 40 23.477 5.571 -3.346 1.00 0.58 C ATOM 2235 CG TYR B 40 22.238 6.268 -3.859 1.00 0.81 C ATOM 2236 CD1 TYR B 40 21.068 6.266 -3.091 1.00 1.61 C ATOM 2237 CD2 TYR B 40 22.262 6.929 -5.093 1.00 1.51 C ATOM 2238 CE1 TYR B 40 19.923 6.925 -3.556 1.00 1.88 C ATOM 2239 CE2 TYR B 40 21.116 7.586 -5.559 1.00 1.79 C ATOM 2240 CZ TYR B 40 19.947 7.584 -4.790 1.00 1.59 C ATOM 2241 OH TYR B 40 18.819 8.233 -5.248 1.00 2.01 O ATOM 0 H TYR B 40 25.413 7.102 -3.904 1.00 0.60 H new ATOM 0 HA TYR B 40 23.370 7.044 -1.793 1.00 0.56 H new ATOM 0 HB2 TYR B 40 24.163 5.364 -4.167 1.00 0.58 H new ATOM 0 HB3 TYR B 40 23.215 4.611 -2.900 1.00 0.58 H new ATOM 0 HD1 TYR B 40 21.048 5.756 -2.139 1.00 1.61 H new ATOM 0 HD2 TYR B 40 23.165 6.932 -5.686 1.00 1.51 H new ATOM 0 HE1 TYR B 40 19.021 6.924 -2.962 1.00 1.88 H new ATOM 0 HE2 TYR B 40 21.135 8.094 -6.512 1.00 1.79 H new ATOM 0 HH TYR B 40 19.006 8.639 -6.120 1.00 2.01 H new ATOM 2251 N ILE B 41 26.066 5.166 -1.619 1.00 0.44 N ATOM 2252 CA ILE B 41 26.862 4.365 -0.649 1.00 0.40 C ATOM 2253 C ILE B 41 27.255 5.250 0.535 1.00 0.41 C ATOM 2254 O ILE B 41 27.015 4.924 1.679 1.00 0.41 O ATOM 2255 CB ILE B 41 28.124 3.849 -1.336 1.00 0.41 C ATOM 2256 CG1 ILE B 41 27.744 2.806 -2.387 1.00 0.53 C ATOM 2257 CG2 ILE B 41 29.044 3.211 -0.295 1.00 0.47 C ATOM 2258 CD1 ILE B 41 28.936 2.555 -3.312 1.00 0.54 C ATOM 0 H ILE B 41 26.497 5.290 -2.535 1.00 0.44 H new ATOM 0 HA ILE B 41 26.268 3.522 -0.295 1.00 0.40 H new ATOM 0 HB ILE B 41 28.640 4.679 -1.819 1.00 0.41 H new ATOM 0 HG12 ILE B 41 27.445 1.877 -1.901 1.00 0.53 H new ATOM 0 HG13 ILE B 41 26.888 3.153 -2.966 1.00 0.53 H new ATOM 0 HG21 ILE B 41 29.946 2.842 -0.784 1.00 0.47 H new ATOM 0 HG22 ILE B 41 29.316 3.954 0.455 1.00 0.47 H new ATOM 0 HG23 ILE B 41 28.527 2.381 0.187 1.00 0.47 H new ATOM 0 HD11 ILE B 41 28.665 1.811 -4.061 1.00 0.54 H new ATOM 0 HD12 ILE B 41 29.214 3.485 -3.808 1.00 0.54 H new ATOM 0 HD13 ILE B 41 29.780 2.190 -2.727 1.00 0.54 H new ATOM 2270 N LYS B 42 27.857 6.374 0.257 1.00 0.46 N ATOM 2271 CA LYS B 42 28.266 7.295 1.351 1.00 0.50 C ATOM 2272 C LYS B 42 27.029 7.682 2.164 1.00 0.51 C ATOM 2273 O LYS B 42 26.992 7.529 3.368 1.00 0.53 O ATOM 2274 CB LYS B 42 28.903 8.549 0.744 1.00 0.59 C ATOM 2275 CG LYS B 42 29.855 9.192 1.756 1.00 0.89 C ATOM 2276 CD LYS B 42 29.073 9.640 2.993 1.00 0.61 C ATOM 2277 CE LYS B 42 29.840 10.755 3.706 1.00 0.65 C ATOM 2278 NZ LYS B 42 29.608 10.658 5.174 1.00 1.61 N ATOM 0 H LYS B 42 28.083 6.694 -0.685 1.00 0.46 H new ATOM 0 HA LYS B 42 28.990 6.805 2.002 1.00 0.50 H new ATOM 0 HB2 LYS B 42 29.446 8.288 -0.164 1.00 0.59 H new ATOM 0 HB3 LYS B 42 28.127 9.260 0.459 1.00 0.59 H new ATOM 0 HG2 LYS B 42 30.630 8.481 2.042 1.00 0.89 H new ATOM 0 HG3 LYS B 42 30.358 10.047 1.303 1.00 0.89 H new ATOM 0 HD2 LYS B 42 28.084 9.993 2.703 1.00 0.61 H new ATOM 0 HD3 LYS B 42 28.925 8.797 3.668 1.00 0.61 H new ATOM 0 HE2 LYS B 42 30.905 10.674 3.489 1.00 0.65 H new ATOM 0 HE3 LYS B 42 29.513 11.728 3.339 1.00 0.65 H new ATOM 0 HZ1 LYS B 42 30.509 10.787 5.677 1.00 1.61 H new ATOM 0 HZ2 LYS B 42 28.937 11.396 5.469 1.00 1.61 H new ATOM 0 HZ3 LYS B 42 29.215 9.722 5.402 1.00 1.61 H new ATOM 2292 N MET B 43 26.014 8.177 1.509 1.00 0.55 N ATOM 2293 CA MET B 43 24.771 8.573 2.232 1.00 0.60 C ATOM 2294 C MET B 43 24.274 7.400 3.080 1.00 0.50 C ATOM 2295 O MET B 43 24.009 7.537 4.256 1.00 0.52 O ATOM 2296 CB MET B 43 23.705 8.970 1.211 1.00 0.68 C ATOM 2297 CG MET B 43 22.391 9.251 1.934 1.00 0.78 C ATOM 2298 SD MET B 43 21.213 9.995 0.779 1.00 1.39 S ATOM 2299 CE MET B 43 20.600 11.295 1.879 1.00 2.16 C ATOM 0 H MET B 43 25.992 8.325 0.500 1.00 0.55 H new ATOM 0 HA MET B 43 24.978 9.419 2.888 1.00 0.60 H new ATOM 0 HB2 MET B 43 24.025 9.854 0.659 1.00 0.68 H new ATOM 0 HB3 MET B 43 23.568 8.171 0.482 1.00 0.68 H new ATOM 0 HG2 MET B 43 21.983 8.326 2.341 1.00 0.78 H new ATOM 0 HG3 MET B 43 22.563 9.921 2.776 1.00 0.78 H new ATOM 0 HE1 MET B 43 19.847 11.887 1.358 1.00 2.16 H new ATOM 0 HE2 MET B 43 20.156 10.842 2.766 1.00 2.16 H new ATOM 0 HE3 MET B 43 21.427 11.940 2.176 1.00 2.16 H new ATOM 2309 N LEU B 44 24.144 6.248 2.489 1.00 0.43 N ATOM 2310 CA LEU B 44 23.659 5.062 3.251 1.00 0.35 C ATOM 2311 C LEU B 44 24.549 4.853 4.483 1.00 0.32 C ATOM 2312 O LEU B 44 24.074 4.557 5.564 1.00 0.35 O ATOM 2313 CB LEU B 44 23.754 3.832 2.349 1.00 0.33 C ATOM 2314 CG LEU B 44 22.607 3.836 1.321 1.00 0.49 C ATOM 2315 CD1 LEU B 44 22.925 2.886 0.153 1.00 0.90 C ATOM 2316 CD2 LEU B 44 21.304 3.373 1.984 1.00 0.68 C ATOM 0 H LEU B 44 24.353 6.074 1.506 1.00 0.43 H new ATOM 0 HA LEU B 44 22.628 5.217 3.569 1.00 0.35 H new ATOM 0 HB2 LEU B 44 24.714 3.824 1.833 1.00 0.33 H new ATOM 0 HB3 LEU B 44 23.708 2.925 2.952 1.00 0.33 H new ATOM 0 HG LEU B 44 22.495 4.853 0.945 1.00 0.49 H new ATOM 0 HD11 LEU B 44 22.103 2.902 -0.563 1.00 0.90 H new ATOM 0 HD12 LEU B 44 23.842 3.209 -0.340 1.00 0.90 H new ATOM 0 HD13 LEU B 44 23.055 1.873 0.533 1.00 0.90 H new ATOM 0 HD21 LEU B 44 20.499 3.379 1.249 1.00 0.68 H new ATOM 0 HD22 LEU B 44 21.432 2.363 2.373 1.00 0.68 H new ATOM 0 HD23 LEU B 44 21.053 4.047 2.803 1.00 0.68 H new ATOM 2328 N MET B 45 25.834 5.023 4.334 1.00 0.40 N ATOM 2329 CA MET B 45 26.749 4.860 5.500 1.00 0.42 C ATOM 2330 C MET B 45 26.590 6.087 6.393 1.00 0.44 C ATOM 2331 O MET B 45 26.508 6.003 7.603 1.00 0.43 O ATOM 2332 CB MET B 45 28.194 4.781 5.002 1.00 0.52 C ATOM 2333 CG MET B 45 28.965 3.759 5.833 1.00 1.13 C ATOM 2334 SD MET B 45 30.742 4.054 5.658 1.00 0.80 S ATOM 2335 CE MET B 45 30.992 3.080 4.154 1.00 0.83 C ATOM 0 H MET B 45 26.290 5.268 3.455 1.00 0.40 H new ATOM 0 HA MET B 45 26.510 3.950 6.051 1.00 0.42 H new ATOM 0 HB2 MET B 45 28.212 4.497 3.950 1.00 0.52 H new ATOM 0 HB3 MET B 45 28.669 5.759 5.077 1.00 0.52 H new ATOM 0 HG2 MET B 45 28.675 3.834 6.881 1.00 1.13 H new ATOM 0 HG3 MET B 45 28.719 2.749 5.505 1.00 1.13 H new ATOM 0 HE1 MET B 45 32.020 3.196 3.812 1.00 0.83 H new ATOM 0 HE2 MET B 45 30.796 2.029 4.365 1.00 0.83 H new ATOM 0 HE3 MET B 45 30.310 3.428 3.378 1.00 0.83 H new ATOM 2345 N ASP B 46 26.521 7.225 5.772 1.00 0.48 N ATOM 2346 CA ASP B 46 26.338 8.490 6.530 1.00 0.53 C ATOM 2347 C ASP B 46 25.025 8.410 7.311 1.00 0.51 C ATOM 2348 O ASP B 46 24.838 9.086 8.305 1.00 0.55 O ATOM 2349 CB ASP B 46 26.283 9.672 5.565 1.00 0.59 C ATOM 2350 CG ASP B 46 26.819 10.926 6.261 1.00 0.71 C ATOM 2351 OD1 ASP B 46 26.577 11.069 7.449 1.00 1.30 O ATOM 2352 OD2 ASP B 46 27.461 11.720 5.595 1.00 1.26 O ATOM 0 H ASP B 46 26.584 7.336 4.760 1.00 0.48 H new ATOM 0 HA ASP B 46 27.174 8.630 7.215 1.00 0.53 H new ATOM 0 HB2 ASP B 46 26.874 9.456 4.675 1.00 0.59 H new ATOM 0 HB3 ASP B 46 25.258 9.837 5.234 1.00 0.59 H new ATOM 2357 N LEU B 47 24.112 7.588 6.860 1.00 0.48 N ATOM 2358 CA LEU B 47 22.802 7.461 7.563 1.00 0.50 C ATOM 2359 C LEU B 47 22.830 6.246 8.492 1.00 0.46 C ATOM 2360 O LEU B 47 21.908 6.015 9.247 1.00 0.50 O ATOM 2361 CB LEU B 47 21.681 7.304 6.533 1.00 0.51 C ATOM 2362 CG LEU B 47 21.021 8.663 6.278 1.00 0.59 C ATOM 2363 CD1 LEU B 47 22.087 9.707 5.933 1.00 0.59 C ATOM 2364 CD2 LEU B 47 20.041 8.539 5.110 1.00 0.62 C ATOM 0 H LEU B 47 24.218 6.999 6.034 1.00 0.48 H new ATOM 0 HA LEU B 47 22.621 8.358 8.156 1.00 0.50 H new ATOM 0 HB2 LEU B 47 22.083 6.903 5.602 1.00 0.51 H new ATOM 0 HB3 LEU B 47 20.940 6.591 6.894 1.00 0.51 H new ATOM 0 HG LEU B 47 20.490 8.976 7.177 1.00 0.59 H new ATOM 0 HD11 LEU B 47 21.609 10.670 5.753 1.00 0.59 H new ATOM 0 HD12 LEU B 47 22.788 9.799 6.763 1.00 0.59 H new ATOM 0 HD13 LEU B 47 22.624 9.396 5.037 1.00 0.59 H new ATOM 0 HD21 LEU B 47 19.570 9.505 4.926 1.00 0.62 H new ATOM 0 HD22 LEU B 47 20.578 8.222 4.216 1.00 0.62 H new ATOM 0 HD23 LEU B 47 19.276 7.802 5.354 1.00 0.62 H new ATOM 2376 N GLU B 48 23.886 5.474 8.433 1.00 0.42 N ATOM 2377 CA GLU B 48 24.007 4.264 9.303 1.00 0.42 C ATOM 2378 C GLU B 48 23.248 3.086 8.676 1.00 0.39 C ATOM 2379 O GLU B 48 22.268 2.603 9.205 1.00 0.47 O ATOM 2380 CB GLU B 48 23.464 4.558 10.709 1.00 0.47 C ATOM 2381 CG GLU B 48 24.228 3.713 11.731 1.00 1.16 C ATOM 2382 CD GLU B 48 25.625 4.301 11.937 1.00 1.19 C ATOM 2383 OE1 GLU B 48 25.709 5.447 12.345 1.00 1.69 O ATOM 2384 OE2 GLU B 48 26.586 3.595 11.683 1.00 1.72 O ATOM 0 H GLU B 48 24.679 5.633 7.811 1.00 0.42 H new ATOM 0 HA GLU B 48 25.061 3.999 9.388 1.00 0.42 H new ATOM 0 HB2 GLU B 48 23.574 5.617 10.940 1.00 0.47 H new ATOM 0 HB3 GLU B 48 22.399 4.331 10.755 1.00 0.47 H new ATOM 0 HG2 GLU B 48 23.688 3.691 12.677 1.00 1.16 H new ATOM 0 HG3 GLU B 48 24.303 2.683 11.383 1.00 1.16 H new ATOM 2391 N ILE B 49 23.715 2.610 7.554 1.00 0.32 N ATOM 2392 CA ILE B 49 23.057 1.452 6.885 1.00 0.30 C ATOM 2393 C ILE B 49 24.154 0.596 6.271 1.00 0.30 C ATOM 2394 O ILE B 49 24.067 -0.619 6.231 1.00 0.31 O ATOM 2395 CB ILE B 49 22.110 1.950 5.784 1.00 0.29 C ATOM 2396 CG1 ILE B 49 20.827 2.528 6.401 1.00 0.35 C ATOM 2397 CG2 ILE B 49 21.742 0.788 4.856 1.00 0.29 C ATOM 2398 CD1 ILE B 49 20.950 4.047 6.514 1.00 0.51 C ATOM 0 H ILE B 49 24.533 2.978 7.068 1.00 0.32 H new ATOM 0 HA ILE B 49 22.473 0.876 7.603 1.00 0.30 H new ATOM 0 HB ILE B 49 22.617 2.731 5.217 1.00 0.29 H new ATOM 0 HG12 ILE B 49 19.966 2.268 5.785 1.00 0.35 H new ATOM 0 HG13 ILE B 49 20.657 2.093 7.386 1.00 0.35 H new ATOM 0 HG21 ILE B 49 21.070 1.144 4.076 1.00 0.29 H new ATOM 0 HG22 ILE B 49 22.647 0.386 4.400 1.00 0.29 H new ATOM 0 HG23 ILE B 49 21.247 0.005 5.431 1.00 0.29 H new ATOM 0 HD11 ILE B 49 20.039 4.454 6.952 1.00 0.51 H new ATOM 0 HD12 ILE B 49 21.800 4.297 7.148 1.00 0.51 H new ATOM 0 HD13 ILE B 49 21.099 4.475 5.523 1.00 0.51 H new ATOM 2410 N ILE B 50 25.200 1.229 5.816 1.00 0.30 N ATOM 2411 CA ILE B 50 26.337 0.480 5.217 1.00 0.31 C ATOM 2412 C ILE B 50 27.482 0.424 6.234 1.00 0.36 C ATOM 2413 O ILE B 50 27.445 1.104 7.240 1.00 0.57 O ATOM 2414 CB ILE B 50 26.771 1.187 3.943 1.00 0.31 C ATOM 2415 CG1 ILE B 50 25.681 0.991 2.881 1.00 0.35 C ATOM 2416 CG2 ILE B 50 28.088 0.604 3.450 1.00 0.36 C ATOM 2417 CD1 ILE B 50 25.945 -0.274 2.060 1.00 0.70 C ATOM 0 H ILE B 50 25.315 2.242 5.834 1.00 0.30 H new ATOM 0 HA ILE B 50 26.044 -0.540 4.967 1.00 0.31 H new ATOM 0 HB ILE B 50 26.913 2.250 4.137 1.00 0.31 H new ATOM 0 HG12 ILE B 50 24.706 0.921 3.363 1.00 0.35 H new ATOM 0 HG13 ILE B 50 25.649 1.858 2.221 1.00 0.35 H new ATOM 0 HG21 ILE B 50 28.393 1.115 2.537 1.00 0.36 H new ATOM 0 HG22 ILE B 50 28.854 0.738 4.214 1.00 0.36 H new ATOM 0 HG23 ILE B 50 27.961 -0.459 3.246 1.00 0.36 H new ATOM 0 HD11 ILE B 50 25.160 -0.393 1.313 1.00 0.70 H new ATOM 0 HD12 ILE B 50 26.911 -0.189 1.561 1.00 0.70 H new ATOM 0 HD13 ILE B 50 25.953 -1.141 2.720 1.00 0.70 H new ATOM 2429 N ARG B 51 28.484 -0.393 6.004 1.00 0.42 N ATOM 2430 CA ARG B 51 29.603 -0.489 7.003 1.00 0.44 C ATOM 2431 C ARG B 51 30.934 -0.482 6.273 1.00 0.44 C ATOM 2432 O ARG B 51 31.030 -0.930 5.164 1.00 0.54 O ATOM 2433 CB ARG B 51 29.504 -1.820 7.748 1.00 0.52 C ATOM 2434 CG ARG B 51 29.491 -1.633 9.271 1.00 0.75 C ATOM 2435 CD ARG B 51 30.892 -1.311 9.792 1.00 0.89 C ATOM 2436 NE ARG B 51 30.890 -1.372 11.285 1.00 0.89 N ATOM 2437 CZ ARG B 51 30.267 -0.457 11.981 1.00 0.95 C ATOM 2438 NH1 ARG B 51 29.633 0.511 11.377 1.00 1.50 N ATOM 2439 NH2 ARG B 51 30.277 -0.512 13.287 1.00 1.24 N ATOM 0 H ARG B 51 28.577 -0.990 5.182 1.00 0.42 H new ATOM 0 HA ARG B 51 29.532 0.352 7.693 1.00 0.44 H new ATOM 0 HB2 ARG B 51 28.597 -2.340 7.440 1.00 0.52 H new ATOM 0 HB3 ARG B 51 30.346 -2.454 7.469 1.00 0.52 H new ATOM 0 HG2 ARG B 51 28.806 -0.828 9.537 1.00 0.75 H new ATOM 0 HG3 ARG B 51 29.120 -2.539 9.750 1.00 0.75 H new ATOM 0 HD2 ARG B 51 31.614 -2.021 9.389 1.00 0.89 H new ATOM 0 HD3 ARG B 51 31.198 -0.320 9.458 1.00 0.89 H new ATOM 0 HE ARG B 51 31.377 -2.130 11.763 1.00 0.89 H new ATOM 0 HH11 ARG B 51 29.622 0.556 10.358 1.00 1.50 H new ATOM 0 HH12 ARG B 51 29.148 1.223 11.924 1.00 1.50 H new ATOM 0 HH21 ARG B 51 30.770 -1.268 13.762 1.00 1.24 H new ATOM 0 HH22 ARG B 51 29.791 0.201 13.831 1.00 1.24 H new ATOM 2453 N GLN B 52 31.962 -0.006 6.906 1.00 0.44 N ATOM 2454 CA GLN B 52 33.307 0.000 6.257 1.00 0.48 C ATOM 2455 C GLN B 52 34.122 -1.155 6.826 1.00 0.53 C ATOM 2456 O GLN B 52 34.534 -1.124 7.968 1.00 0.65 O ATOM 2457 CB GLN B 52 34.018 1.324 6.548 1.00 0.61 C ATOM 2458 CG GLN B 52 34.761 1.785 5.292 1.00 1.46 C ATOM 2459 CD GLN B 52 35.708 2.931 5.647 1.00 1.70 C ATOM 2460 OE1 GLN B 52 35.272 4.025 5.945 1.00 2.42 O ATOM 2461 NE2 GLN B 52 36.997 2.726 5.626 1.00 1.80 N ATOM 0 H GLN B 52 31.935 0.382 7.849 1.00 0.44 H new ATOM 0 HA GLN B 52 33.200 -0.111 5.178 1.00 0.48 H new ATOM 0 HB2 GLN B 52 33.294 2.079 6.854 1.00 0.61 H new ATOM 0 HB3 GLN B 52 34.718 1.200 7.374 1.00 0.61 H new ATOM 0 HG2 GLN B 52 35.323 0.955 4.865 1.00 1.46 H new ATOM 0 HG3 GLN B 52 34.048 2.111 4.535 1.00 1.46 H new ATOM 0 HE21 GLN B 52 37.363 1.808 5.376 1.00 1.80 H new ATOM 0 HE22 GLN B 52 37.638 3.484 5.860 1.00 1.80 H new ATOM 2470 N GLU B 53 34.354 -2.176 6.040 1.00 0.57 N ATOM 2471 CA GLU B 53 35.135 -3.337 6.530 1.00 0.74 C ATOM 2472 C GLU B 53 36.353 -3.543 5.638 1.00 0.75 C ATOM 2473 O GLU B 53 36.262 -4.074 4.556 1.00 0.76 O ATOM 2474 CB GLU B 53 34.246 -4.572 6.462 1.00 0.90 C ATOM 2475 CG GLU B 53 34.829 -5.683 7.334 1.00 1.02 C ATOM 2476 CD GLU B 53 34.172 -7.014 6.969 1.00 1.37 C ATOM 2477 OE1 GLU B 53 33.913 -7.223 5.796 1.00 2.11 O ATOM 2478 OE2 GLU B 53 33.938 -7.803 7.870 1.00 1.95 O ATOM 0 H GLU B 53 34.031 -2.249 5.075 1.00 0.57 H new ATOM 0 HA GLU B 53 35.467 -3.163 7.554 1.00 0.74 H new ATOM 0 HB2 GLU B 53 33.239 -4.325 6.798 1.00 0.90 H new ATOM 0 HB3 GLU B 53 34.162 -4.914 5.430 1.00 0.90 H new ATOM 0 HG2 GLU B 53 35.908 -5.746 7.189 1.00 1.02 H new ATOM 0 HG3 GLU B 53 34.661 -5.459 8.387 1.00 1.02 H new ATOM 2485 N GLY B 54 37.489 -3.120 6.098 1.00 0.80 N ATOM 2486 CA GLY B 54 38.731 -3.281 5.296 1.00 0.85 C ATOM 2487 C GLY B 54 38.602 -2.522 3.971 1.00 0.74 C ATOM 2488 O GLY B 54 39.153 -2.922 2.965 1.00 0.88 O ATOM 0 H GLY B 54 37.615 -2.665 7.002 1.00 0.80 H new ATOM 0 HA2 GLY B 54 39.587 -2.906 5.857 1.00 0.85 H new ATOM 0 HA3 GLY B 54 38.914 -4.338 5.103 1.00 0.85 H new ATOM 2492 N LYS B 55 37.857 -1.444 3.968 1.00 0.78 N ATOM 2493 CA LYS B 55 37.648 -0.639 2.721 1.00 0.78 C ATOM 2494 C LYS B 55 36.496 -1.233 1.898 1.00 0.69 C ATOM 2495 O LYS B 55 36.112 -0.694 0.879 1.00 0.70 O ATOM 2496 CB LYS B 55 38.930 -0.592 1.880 1.00 0.91 C ATOM 2497 CG LYS B 55 39.019 0.762 1.171 1.00 1.13 C ATOM 2498 CD LYS B 55 40.088 0.703 0.078 1.00 1.34 C ATOM 2499 CE LYS B 55 40.659 2.103 -0.158 1.00 1.60 C ATOM 2500 NZ LYS B 55 41.821 2.326 0.749 1.00 2.11 N ATOM 0 H LYS B 55 37.376 -1.081 4.791 1.00 0.78 H new ATOM 0 HA LYS B 55 37.391 0.380 3.009 1.00 0.78 H new ATOM 0 HB2 LYS B 55 39.802 -0.740 2.517 1.00 0.91 H new ATOM 0 HB3 LYS B 55 38.929 -1.400 1.148 1.00 0.91 H new ATOM 0 HG2 LYS B 55 38.054 1.019 0.735 1.00 1.13 H new ATOM 0 HG3 LYS B 55 39.263 1.544 1.890 1.00 1.13 H new ATOM 0 HD2 LYS B 55 40.885 0.019 0.371 1.00 1.34 H new ATOM 0 HD3 LYS B 55 39.658 0.314 -0.845 1.00 1.34 H new ATOM 0 HE2 LYS B 55 40.970 2.210 -1.197 1.00 1.60 H new ATOM 0 HE3 LYS B 55 39.892 2.856 0.025 1.00 1.60 H new ATOM 0 HZ1 LYS B 55 42.209 3.277 0.589 1.00 2.11 H new ATOM 0 HZ2 LYS B 55 41.511 2.241 1.738 1.00 2.11 H new ATOM 0 HZ3 LYS B 55 42.555 1.615 0.554 1.00 2.11 H new ATOM 2514 N GLN B 56 35.926 -2.320 2.351 1.00 0.70 N ATOM 2515 CA GLN B 56 34.777 -2.926 1.609 1.00 0.70 C ATOM 2516 C GLN B 56 33.509 -2.464 2.301 1.00 0.60 C ATOM 2517 O GLN B 56 33.567 -1.934 3.394 1.00 0.60 O ATOM 2518 CB GLN B 56 34.828 -4.457 1.640 1.00 0.85 C ATOM 2519 CG GLN B 56 36.273 -4.938 1.544 1.00 1.17 C ATOM 2520 CD GLN B 56 36.308 -6.278 0.808 1.00 1.15 C ATOM 2521 OE1 GLN B 56 37.152 -6.499 -0.038 1.00 1.54 O ATOM 2522 NE2 GLN B 56 35.418 -7.189 1.096 1.00 1.66 N ATOM 0 H GLN B 56 36.204 -2.813 3.199 1.00 0.70 H new ATOM 0 HA GLN B 56 34.814 -2.615 0.565 1.00 0.70 H new ATOM 0 HB2 GLN B 56 34.375 -4.825 2.561 1.00 0.85 H new ATOM 0 HB3 GLN B 56 34.246 -4.864 0.814 1.00 0.85 H new ATOM 0 HG2 GLN B 56 36.879 -4.203 1.015 1.00 1.17 H new ATOM 0 HG3 GLN B 56 36.700 -5.046 2.541 1.00 1.17 H new ATOM 0 HE21 GLN B 56 34.710 -7.003 1.806 1.00 1.66 H new ATOM 0 HE22 GLN B 56 35.431 -8.086 0.611 1.00 1.66 H new ATOM 2531 N TYR B 57 32.368 -2.620 1.680 1.00 0.56 N ATOM 2532 CA TYR B 57 31.124 -2.135 2.329 1.00 0.48 C ATOM 2533 C TYR B 57 30.324 -3.291 2.926 1.00 0.47 C ATOM 2534 O TYR B 57 29.983 -4.242 2.256 1.00 0.53 O ATOM 2535 CB TYR B 57 30.287 -1.390 1.311 1.00 0.46 C ATOM 2536 CG TYR B 57 31.172 -0.395 0.587 1.00 0.49 C ATOM 2537 CD1 TYR B 57 32.093 -0.829 -0.374 1.00 1.27 C ATOM 2538 CD2 TYR B 57 31.085 0.969 0.898 1.00 1.18 C ATOM 2539 CE1 TYR B 57 32.922 0.096 -1.022 1.00 1.30 C ATOM 2540 CE2 TYR B 57 31.913 1.893 0.249 1.00 1.18 C ATOM 2541 CZ TYR B 57 32.831 1.456 -0.711 1.00 0.57 C ATOM 2542 OH TYR B 57 33.648 2.367 -1.349 1.00 0.63 O ATOM 0 H TYR B 57 32.249 -3.056 0.766 1.00 0.56 H new ATOM 0 HA TYR B 57 31.395 -1.464 3.144 1.00 0.48 H new ATOM 0 HB2 TYR B 57 29.845 -2.089 0.601 1.00 0.46 H new ATOM 0 HB3 TYR B 57 29.463 -0.874 1.804 1.00 0.46 H new ATOM 0 HD1 TYR B 57 32.165 -1.879 -0.616 1.00 1.27 H new ATOM 0 HD2 TYR B 57 30.377 1.308 1.640 1.00 1.18 H new ATOM 0 HE1 TYR B 57 33.632 -0.242 -1.762 1.00 1.30 H new ATOM 0 HE2 TYR B 57 31.843 2.943 0.490 1.00 1.18 H new ATOM 0 HH TYR B 57 33.455 3.268 -1.017 1.00 0.63 H new ATOM 2552 N MET B 58 30.036 -3.196 4.198 1.00 0.44 N ATOM 2553 CA MET B 58 29.264 -4.254 4.909 1.00 0.45 C ATOM 2554 C MET B 58 27.906 -3.697 5.317 1.00 0.42 C ATOM 2555 O MET B 58 27.638 -2.519 5.186 1.00 0.40 O ATOM 2556 CB MET B 58 30.015 -4.718 6.165 1.00 0.50 C ATOM 2557 CG MET B 58 30.162 -6.238 6.153 1.00 1.04 C ATOM 2558 SD MET B 58 31.172 -6.752 7.566 1.00 1.10 S ATOM 2559 CE MET B 58 29.824 -6.908 8.764 1.00 1.52 C ATOM 0 H MET B 58 30.311 -2.409 4.786 1.00 0.44 H new ATOM 0 HA MET B 58 29.137 -5.105 4.239 1.00 0.45 H new ATOM 0 HB2 MET B 58 30.998 -4.249 6.205 1.00 0.50 H new ATOM 0 HB3 MET B 58 29.476 -4.403 7.058 1.00 0.50 H new ATOM 0 HG2 MET B 58 29.181 -6.710 6.202 1.00 1.04 H new ATOM 0 HG3 MET B 58 30.626 -6.563 5.222 1.00 1.04 H new ATOM 0 HE1 MET B 58 30.227 -7.222 9.727 1.00 1.52 H new ATOM 0 HE2 MET B 58 29.324 -5.946 8.876 1.00 1.52 H new ATOM 0 HE3 MET B 58 29.108 -7.650 8.411 1.00 1.52 H new ATOM 2569 N LEU B 59 27.064 -4.542 5.820 1.00 0.44 N ATOM 2570 CA LEU B 59 25.719 -4.086 6.258 1.00 0.43 C ATOM 2571 C LEU B 59 25.756 -3.895 7.778 1.00 0.41 C ATOM 2572 O LEU B 59 26.318 -4.701 8.492 1.00 0.47 O ATOM 2573 CB LEU B 59 24.648 -5.129 5.876 1.00 0.51 C ATOM 2574 CG LEU B 59 24.739 -6.392 6.753 1.00 0.77 C ATOM 2575 CD1 LEU B 59 23.641 -7.370 6.336 1.00 1.05 C ATOM 2576 CD2 LEU B 59 26.101 -7.067 6.569 1.00 1.25 C ATOM 0 H LEU B 59 27.247 -5.537 5.949 1.00 0.44 H new ATOM 0 HA LEU B 59 25.462 -3.148 5.766 1.00 0.43 H new ATOM 0 HB2 LEU B 59 23.657 -4.686 5.978 1.00 0.51 H new ATOM 0 HB3 LEU B 59 24.767 -5.405 4.828 1.00 0.51 H new ATOM 0 HG LEU B 59 24.617 -6.109 7.798 1.00 0.77 H new ATOM 0 HD11 LEU B 59 23.699 -8.267 6.953 1.00 1.05 H new ATOM 0 HD12 LEU B 59 22.666 -6.901 6.469 1.00 1.05 H new ATOM 0 HD13 LEU B 59 23.774 -7.641 5.289 1.00 1.05 H new ATOM 0 HD21 LEU B 59 26.153 -7.958 7.194 1.00 1.25 H new ATOM 0 HD22 LEU B 59 26.229 -7.349 5.524 1.00 1.25 H new ATOM 0 HD23 LEU B 59 26.892 -6.375 6.858 1.00 1.25 H new ATOM 2588 N THR B 60 25.198 -2.824 8.279 1.00 0.38 N ATOM 2589 CA THR B 60 25.249 -2.591 9.753 1.00 0.41 C ATOM 2590 C THR B 60 23.952 -3.092 10.385 1.00 0.44 C ATOM 2591 O THR B 60 22.977 -3.333 9.700 1.00 0.43 O ATOM 2592 CB THR B 60 25.369 -1.091 10.057 1.00 0.40 C ATOM 2593 OG1 THR B 60 24.072 -0.513 10.065 1.00 1.04 O ATOM 2594 CG2 THR B 60 26.224 -0.390 9.003 1.00 1.01 C ATOM 0 H THR B 60 24.714 -2.107 7.738 1.00 0.38 H new ATOM 0 HA THR B 60 26.113 -3.120 10.156 1.00 0.41 H new ATOM 0 HB THR B 60 25.845 -0.968 11.030 1.00 0.40 H new ATOM 0 HG1 THR B 60 24.142 0.445 10.260 1.00 1.04 H new ATOM 0 HG21 THR B 60 26.295 0.672 9.239 1.00 1.01 H new ATOM 0 HG22 THR B 60 27.222 -0.827 8.995 1.00 1.01 H new ATOM 0 HG23 THR B 60 25.766 -0.514 8.022 1.00 1.01 H new ATOM 2602 N LYS B 61 23.932 -3.244 11.685 1.00 0.51 N ATOM 2603 CA LYS B 61 22.693 -3.718 12.369 1.00 0.54 C ATOM 2604 C LYS B 61 21.494 -2.975 11.771 1.00 0.51 C ATOM 2605 O LYS B 61 20.470 -3.547 11.457 1.00 0.50 O ATOM 2606 CB LYS B 61 22.804 -3.408 13.864 1.00 0.61 C ATOM 2607 CG LYS B 61 24.285 -3.298 14.240 1.00 1.28 C ATOM 2608 CD LYS B 61 24.449 -3.372 15.760 1.00 1.04 C ATOM 2609 CE LYS B 61 23.421 -2.466 16.439 1.00 1.73 C ATOM 2610 NZ LYS B 61 23.820 -2.244 17.858 1.00 2.19 N ATOM 0 H LYS B 61 24.723 -3.060 12.303 1.00 0.51 H new ATOM 0 HA LYS B 61 22.565 -4.792 12.232 1.00 0.54 H new ATOM 0 HB2 LYS B 61 22.286 -2.477 14.095 1.00 0.61 H new ATOM 0 HB3 LYS B 61 22.324 -4.193 14.448 1.00 0.61 H new ATOM 0 HG2 LYS B 61 24.849 -4.101 13.766 1.00 1.28 H new ATOM 0 HG3 LYS B 61 24.694 -2.359 13.868 1.00 1.28 H new ATOM 0 HD2 LYS B 61 24.321 -4.400 16.099 1.00 1.04 H new ATOM 0 HD3 LYS B 61 25.457 -3.067 16.041 1.00 1.04 H new ATOM 0 HE2 LYS B 61 23.357 -1.513 15.914 1.00 1.73 H new ATOM 0 HE3 LYS B 61 22.432 -2.922 16.395 1.00 1.73 H new ATOM 0 HZ1 LYS B 61 23.123 -1.628 18.322 1.00 2.19 H new ATOM 0 HZ2 LYS B 61 23.860 -3.157 18.354 1.00 2.19 H new ATOM 0 HZ3 LYS B 61 24.756 -1.792 17.889 1.00 2.19 H new ATOM 2624 N LYS B 62 21.635 -1.693 11.614 1.00 0.51 N ATOM 2625 CA LYS B 62 20.542 -0.865 11.032 1.00 0.49 C ATOM 2626 C LYS B 62 20.281 -1.285 9.579 1.00 0.45 C ATOM 2627 O LYS B 62 19.168 -1.227 9.096 1.00 0.53 O ATOM 2628 CB LYS B 62 20.954 0.606 11.064 1.00 0.54 C ATOM 2629 CG LYS B 62 21.102 1.064 12.515 1.00 0.75 C ATOM 2630 CD LYS B 62 19.797 1.716 12.981 1.00 1.16 C ATOM 2631 CE LYS B 62 19.930 2.130 14.446 1.00 1.17 C ATOM 2632 NZ LYS B 62 19.324 3.478 14.638 1.00 2.08 N ATOM 0 H LYS B 62 22.475 -1.173 11.868 1.00 0.51 H new ATOM 0 HA LYS B 62 19.633 -1.010 11.616 1.00 0.49 H new ATOM 0 HB2 LYS B 62 21.895 0.743 10.531 1.00 0.54 H new ATOM 0 HB3 LYS B 62 20.207 1.215 10.554 1.00 0.54 H new ATOM 0 HG2 LYS B 62 21.344 0.214 13.153 1.00 0.75 H new ATOM 0 HG3 LYS B 62 21.926 1.772 12.602 1.00 0.75 H new ATOM 0 HD2 LYS B 62 19.573 2.587 12.365 1.00 1.16 H new ATOM 0 HD3 LYS B 62 18.967 1.019 12.863 1.00 1.16 H new ATOM 0 HE2 LYS B 62 19.434 1.402 15.087 1.00 1.17 H new ATOM 0 HE3 LYS B 62 20.980 2.147 14.736 1.00 1.17 H new ATOM 0 HZ1 LYS B 62 19.414 3.760 15.635 1.00 2.08 H new ATOM 0 HZ2 LYS B 62 19.816 4.169 14.037 1.00 2.08 H new ATOM 0 HZ3 LYS B 62 18.318 3.447 14.377 1.00 2.08 H new ATOM 2646 N GLY B 63 21.307 -1.682 8.875 1.00 0.41 N ATOM 2647 CA GLY B 63 21.128 -2.078 7.446 1.00 0.39 C ATOM 2648 C GLY B 63 20.383 -3.410 7.336 1.00 0.38 C ATOM 2649 O GLY B 63 19.504 -3.568 6.512 1.00 0.39 O ATOM 0 H GLY B 63 22.262 -1.750 9.227 1.00 0.41 H new ATOM 0 HA2 GLY B 63 20.574 -1.303 6.917 1.00 0.39 H new ATOM 0 HA3 GLY B 63 22.102 -2.161 6.963 1.00 0.39 H new ATOM 2653 N GLU B 64 20.712 -4.367 8.157 1.00 0.40 N ATOM 2654 CA GLU B 64 19.994 -5.678 8.081 1.00 0.43 C ATOM 2655 C GLU B 64 18.533 -5.482 8.494 1.00 0.43 C ATOM 2656 O GLU B 64 17.618 -5.930 7.829 1.00 0.42 O ATOM 2657 CB GLU B 64 20.657 -6.704 9.000 1.00 0.52 C ATOM 2658 CG GLU B 64 21.852 -6.064 9.686 1.00 0.63 C ATOM 2659 CD GLU B 64 22.532 -7.086 10.600 1.00 0.88 C ATOM 2660 OE1 GLU B 64 21.996 -8.173 10.743 1.00 1.51 O ATOM 2661 OE2 GLU B 64 23.577 -6.764 11.142 1.00 1.45 O ATOM 0 H GLU B 64 21.438 -4.304 8.871 1.00 0.40 H new ATOM 0 HA GLU B 64 20.039 -6.048 7.057 1.00 0.43 H new ATOM 0 HB2 GLU B 64 19.943 -7.059 9.743 1.00 0.52 H new ATOM 0 HB3 GLU B 64 20.976 -7.573 8.424 1.00 0.52 H new ATOM 0 HG2 GLU B 64 22.560 -5.701 8.941 1.00 0.63 H new ATOM 0 HG3 GLU B 64 21.530 -5.200 10.267 1.00 0.63 H new ATOM 2668 N GLU B 65 18.315 -4.815 9.596 1.00 0.46 N ATOM 2669 CA GLU B 65 16.921 -4.585 10.070 1.00 0.49 C ATOM 2670 C GLU B 65 16.134 -3.838 8.994 1.00 0.45 C ATOM 2671 O GLU B 65 14.961 -4.078 8.790 1.00 0.48 O ATOM 2672 CB GLU B 65 16.948 -3.750 11.351 1.00 0.54 C ATOM 2673 CG GLU B 65 17.554 -4.575 12.487 1.00 0.62 C ATOM 2674 CD GLU B 65 17.532 -3.759 13.781 1.00 1.07 C ATOM 2675 OE1 GLU B 65 17.692 -2.552 13.698 1.00 1.68 O ATOM 2676 OE2 GLU B 65 17.357 -4.354 14.831 1.00 1.66 O ATOM 0 H GLU B 65 19.044 -4.419 10.189 1.00 0.46 H new ATOM 0 HA GLU B 65 16.444 -5.544 10.271 1.00 0.49 H new ATOM 0 HB2 GLU B 65 17.533 -2.843 11.194 1.00 0.54 H new ATOM 0 HB3 GLU B 65 15.938 -3.436 11.614 1.00 0.54 H new ATOM 0 HG2 GLU B 65 16.992 -5.500 12.619 1.00 0.62 H new ATOM 0 HG3 GLU B 65 18.578 -4.856 12.240 1.00 0.62 H new ATOM 2683 N LEU B 66 16.771 -2.936 8.301 1.00 0.44 N ATOM 2684 CA LEU B 66 16.056 -2.177 7.240 1.00 0.45 C ATOM 2685 C LEU B 66 15.816 -3.096 6.038 1.00 0.43 C ATOM 2686 O LEU B 66 14.784 -3.041 5.399 1.00 0.45 O ATOM 2687 CB LEU B 66 16.908 -0.969 6.820 1.00 0.46 C ATOM 2688 CG LEU B 66 16.297 -0.279 5.594 1.00 0.64 C ATOM 2689 CD1 LEU B 66 14.838 0.087 5.874 1.00 0.72 C ATOM 2690 CD2 LEU B 66 17.085 0.996 5.292 1.00 1.57 C ATOM 0 H LEU B 66 17.754 -2.692 8.424 1.00 0.44 H new ATOM 0 HA LEU B 66 15.096 -1.823 7.617 1.00 0.45 H new ATOM 0 HB2 LEU B 66 16.977 -0.261 7.646 1.00 0.46 H new ATOM 0 HB3 LEU B 66 17.923 -1.294 6.593 1.00 0.46 H new ATOM 0 HG LEU B 66 16.340 -0.956 4.741 1.00 0.64 H new ATOM 0 HD11 LEU B 66 14.411 0.577 4.999 1.00 0.72 H new ATOM 0 HD12 LEU B 66 14.272 -0.818 6.096 1.00 0.72 H new ATOM 0 HD13 LEU B 66 14.790 0.763 6.727 1.00 0.72 H new ATOM 0 HD21 LEU B 66 16.656 1.491 4.421 1.00 1.57 H new ATOM 0 HD22 LEU B 66 17.037 1.665 6.151 1.00 1.57 H new ATOM 0 HD23 LEU B 66 18.125 0.741 5.088 1.00 1.57 H new ATOM 2702 N LEU B 67 16.754 -3.952 5.733 1.00 0.42 N ATOM 2703 CA LEU B 67 16.571 -4.882 4.583 1.00 0.43 C ATOM 2704 C LEU B 67 15.283 -5.684 4.774 1.00 0.45 C ATOM 2705 O LEU B 67 14.499 -5.849 3.858 1.00 0.48 O ATOM 2706 CB LEU B 67 17.761 -5.841 4.505 1.00 0.45 C ATOM 2707 CG LEU B 67 17.816 -6.474 3.113 1.00 0.51 C ATOM 2708 CD1 LEU B 67 18.708 -5.630 2.202 1.00 0.90 C ATOM 2709 CD2 LEU B 67 18.391 -7.889 3.219 1.00 1.26 C ATOM 0 H LEU B 67 17.639 -4.047 6.231 1.00 0.42 H new ATOM 0 HA LEU B 67 16.507 -4.306 3.660 1.00 0.43 H new ATOM 0 HB2 LEU B 67 18.688 -5.305 4.709 1.00 0.45 H new ATOM 0 HB3 LEU B 67 17.667 -6.616 5.265 1.00 0.45 H new ATOM 0 HG LEU B 67 16.810 -6.519 2.695 1.00 0.51 H new ATOM 0 HD11 LEU B 67 18.747 -6.082 1.211 1.00 0.90 H new ATOM 0 HD12 LEU B 67 18.300 -4.622 2.126 1.00 0.90 H new ATOM 0 HD13 LEU B 67 19.714 -5.584 2.619 1.00 0.90 H new ATOM 0 HD21 LEU B 67 18.431 -8.341 2.228 1.00 1.26 H new ATOM 0 HD22 LEU B 67 19.397 -7.843 3.637 1.00 1.26 H new ATOM 0 HD23 LEU B 67 17.756 -8.492 3.868 1.00 1.26 H new ATOM 2721 N GLU B 68 15.053 -6.182 5.960 1.00 0.44 N ATOM 2722 CA GLU B 68 13.813 -6.968 6.206 1.00 0.48 C ATOM 2723 C GLU B 68 12.607 -6.032 6.134 1.00 0.46 C ATOM 2724 O GLU B 68 11.600 -6.344 5.529 1.00 0.47 O ATOM 2725 CB GLU B 68 13.881 -7.611 7.591 1.00 0.52 C ATOM 2726 CG GLU B 68 14.322 -9.071 7.456 1.00 1.26 C ATOM 2727 CD GLU B 68 14.528 -9.673 8.848 1.00 1.77 C ATOM 2728 OE1 GLU B 68 15.121 -9.007 9.679 1.00 2.23 O ATOM 2729 OE2 GLU B 68 14.089 -10.793 9.057 1.00 2.25 O ATOM 0 H GLU B 68 15.670 -6.078 6.766 1.00 0.44 H new ATOM 0 HA GLU B 68 13.717 -7.750 5.453 1.00 0.48 H new ATOM 0 HB2 GLU B 68 14.582 -7.065 8.223 1.00 0.52 H new ATOM 0 HB3 GLU B 68 12.906 -7.558 8.076 1.00 0.52 H new ATOM 0 HG2 GLU B 68 13.570 -9.640 6.910 1.00 1.26 H new ATOM 0 HG3 GLU B 68 15.246 -9.131 6.882 1.00 1.26 H new ATOM 2736 N ASP B 69 12.706 -4.880 6.739 1.00 0.44 N ATOM 2737 CA ASP B 69 11.570 -3.921 6.694 1.00 0.45 C ATOM 2738 C ASP B 69 11.236 -3.618 5.233 1.00 0.45 C ATOM 2739 O ASP B 69 10.094 -3.670 4.823 1.00 0.46 O ATOM 2740 CB ASP B 69 11.961 -2.629 7.412 1.00 0.46 C ATOM 2741 CG ASP B 69 12.148 -2.910 8.904 1.00 0.51 C ATOM 2742 OD1 ASP B 69 11.890 -4.030 9.312 1.00 1.25 O ATOM 2743 OD2 ASP B 69 12.546 -2.001 9.613 1.00 1.12 O ATOM 0 H ASP B 69 13.523 -4.563 7.261 1.00 0.44 H new ATOM 0 HA ASP B 69 10.700 -4.354 7.189 1.00 0.45 H new ATOM 0 HB2 ASP B 69 12.882 -2.230 6.988 1.00 0.46 H new ATOM 0 HB3 ASP B 69 11.190 -1.873 7.268 1.00 0.46 H new ATOM 2748 N ILE B 70 12.229 -3.307 4.441 1.00 0.45 N ATOM 2749 CA ILE B 70 11.970 -3.009 3.004 1.00 0.49 C ATOM 2750 C ILE B 70 11.248 -4.198 2.368 1.00 0.48 C ATOM 2751 O ILE B 70 10.352 -4.040 1.561 1.00 0.50 O ATOM 2752 CB ILE B 70 13.299 -2.774 2.281 1.00 0.56 C ATOM 2753 CG1 ILE B 70 13.727 -1.317 2.463 1.00 0.90 C ATOM 2754 CG2 ILE B 70 13.136 -3.070 0.788 1.00 0.85 C ATOM 2755 CD1 ILE B 70 15.185 -1.157 2.032 1.00 1.29 C ATOM 0 H ILE B 70 13.206 -3.247 4.728 1.00 0.45 H new ATOM 0 HA ILE B 70 11.352 -2.115 2.921 1.00 0.49 H new ATOM 0 HB ILE B 70 14.057 -3.435 2.700 1.00 0.56 H new ATOM 0 HG12 ILE B 70 13.088 -0.662 1.871 1.00 0.90 H new ATOM 0 HG13 ILE B 70 13.610 -1.020 3.505 1.00 0.90 H new ATOM 0 HG21 ILE B 70 14.084 -2.901 0.278 1.00 0.85 H new ATOM 0 HG22 ILE B 70 12.832 -4.108 0.654 1.00 0.85 H new ATOM 0 HG23 ILE B 70 12.376 -2.412 0.367 1.00 0.85 H new ATOM 0 HD11 ILE B 70 15.491 -0.119 2.161 1.00 1.29 H new ATOM 0 HD12 ILE B 70 15.818 -1.801 2.643 1.00 1.29 H new ATOM 0 HD13 ILE B 70 15.287 -1.437 0.984 1.00 1.29 H new ATOM 2767 N ARG B 71 11.626 -5.389 2.735 1.00 0.47 N ATOM 2768 CA ARG B 71 10.958 -6.589 2.165 1.00 0.50 C ATOM 2769 C ARG B 71 9.457 -6.535 2.470 1.00 0.50 C ATOM 2770 O ARG B 71 8.632 -6.713 1.599 1.00 0.54 O ATOM 2771 CB ARG B 71 11.565 -7.849 2.786 1.00 0.52 C ATOM 2772 CG ARG B 71 11.992 -8.813 1.676 1.00 0.82 C ATOM 2773 CD ARG B 71 12.651 -10.047 2.296 1.00 1.02 C ATOM 2774 NE ARG B 71 14.005 -10.238 1.704 1.00 1.57 N ATOM 2775 CZ ARG B 71 14.815 -11.133 2.200 1.00 2.17 C ATOM 2776 NH1 ARG B 71 14.440 -11.860 3.217 1.00 2.58 N ATOM 2777 NH2 ARG B 71 16.001 -11.301 1.680 1.00 2.98 N ATOM 0 H ARG B 71 12.369 -5.583 3.406 1.00 0.47 H new ATOM 0 HA ARG B 71 11.104 -6.610 1.085 1.00 0.50 H new ATOM 0 HB2 ARG B 71 12.424 -7.585 3.403 1.00 0.52 H new ATOM 0 HB3 ARG B 71 10.838 -8.331 3.440 1.00 0.52 H new ATOM 0 HG2 ARG B 71 11.126 -9.109 1.084 1.00 0.82 H new ATOM 0 HG3 ARG B 71 12.688 -8.318 0.998 1.00 0.82 H new ATOM 0 HD2 ARG B 71 12.729 -9.927 3.377 1.00 1.02 H new ATOM 0 HD3 ARG B 71 12.036 -10.929 2.117 1.00 1.02 H new ATOM 0 HE ARG B 71 14.299 -9.669 0.910 1.00 1.57 H new ATOM 0 HH11 ARG B 71 13.514 -11.729 3.624 1.00 2.58 H new ATOM 0 HH12 ARG B 71 15.073 -12.560 3.605 1.00 2.58 H new ATOM 0 HH21 ARG B 71 16.295 -10.733 0.886 1.00 2.98 H new ATOM 0 HH22 ARG B 71 16.634 -12.001 2.068 1.00 2.98 H new ATOM 2791 N LYS B 72 9.103 -6.300 3.705 1.00 0.48 N ATOM 2792 CA LYS B 72 7.659 -6.249 4.083 1.00 0.49 C ATOM 2793 C LYS B 72 6.921 -5.186 3.261 1.00 0.48 C ATOM 2794 O LYS B 72 6.044 -5.499 2.485 1.00 0.51 O ATOM 2795 CB LYS B 72 7.539 -5.918 5.572 1.00 0.49 C ATOM 2796 CG LYS B 72 7.679 -7.204 6.390 1.00 0.65 C ATOM 2797 CD LYS B 72 7.952 -6.856 7.856 1.00 0.91 C ATOM 2798 CE LYS B 72 9.428 -7.101 8.171 1.00 1.46 C ATOM 2799 NZ LYS B 72 9.744 -6.554 9.522 1.00 1.81 N ATOM 0 H LYS B 72 9.755 -6.140 4.473 1.00 0.48 H new ATOM 0 HA LYS B 72 7.208 -7.220 3.879 1.00 0.49 H new ATOM 0 HB2 LYS B 72 8.310 -5.204 5.861 1.00 0.49 H new ATOM 0 HB3 LYS B 72 6.577 -5.447 5.775 1.00 0.49 H new ATOM 0 HG2 LYS B 72 6.768 -7.798 6.311 1.00 0.65 H new ATOM 0 HG3 LYS B 72 8.492 -7.812 5.993 1.00 0.65 H new ATOM 0 HD2 LYS B 72 7.696 -5.814 8.047 1.00 0.91 H new ATOM 0 HD3 LYS B 72 7.324 -7.463 8.508 1.00 0.91 H new ATOM 0 HE2 LYS B 72 9.646 -8.169 8.139 1.00 1.46 H new ATOM 0 HE3 LYS B 72 10.056 -6.625 7.418 1.00 1.46 H new ATOM 0 HZ1 LYS B 72 10.392 -5.746 9.427 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 8.866 -6.241 9.984 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 10.194 -7.293 10.099 1.00 1.81 H new ATOM 2813 N PHE B 73 7.260 -3.935 3.435 1.00 0.47 N ATOM 2814 CA PHE B 73 6.572 -2.846 2.671 1.00 0.48 C ATOM 2815 C PHE B 73 6.309 -3.304 1.234 1.00 0.51 C ATOM 2816 O PHE B 73 5.197 -3.262 0.748 1.00 0.52 O ATOM 2817 CB PHE B 73 7.471 -1.611 2.655 1.00 0.48 C ATOM 2818 CG PHE B 73 7.677 -1.146 1.232 1.00 0.52 C ATOM 2819 CD1 PHE B 73 6.633 -0.519 0.543 1.00 1.37 C ATOM 2820 CD2 PHE B 73 8.912 -1.342 0.603 1.00 1.25 C ATOM 2821 CE1 PHE B 73 6.824 -0.089 -0.776 1.00 1.40 C ATOM 2822 CE2 PHE B 73 9.104 -0.913 -0.715 1.00 1.29 C ATOM 2823 CZ PHE B 73 8.059 -0.286 -1.405 1.00 0.67 C ATOM 0 H PHE B 73 7.987 -3.617 4.076 1.00 0.47 H new ATOM 0 HA PHE B 73 5.621 -2.609 3.148 1.00 0.48 H new ATOM 0 HB2 PHE B 73 7.020 -0.814 3.246 1.00 0.48 H new ATOM 0 HB3 PHE B 73 8.432 -1.843 3.114 1.00 0.48 H new ATOM 0 HD1 PHE B 73 5.680 -0.367 1.028 1.00 1.37 H new ATOM 0 HD2 PHE B 73 9.718 -1.825 1.136 1.00 1.25 H new ATOM 0 HE1 PHE B 73 6.018 0.395 -1.308 1.00 1.40 H new ATOM 0 HE2 PHE B 73 10.057 -1.065 -1.200 1.00 1.29 H new ATOM 0 HZ PHE B 73 8.206 0.046 -2.422 1.00 0.67 H new ATOM 2833 N ASN B 74 7.328 -3.743 0.560 1.00 0.52 N ATOM 2834 CA ASN B 74 7.148 -4.208 -0.843 1.00 0.55 C ATOM 2835 C ASN B 74 6.236 -5.438 -0.873 1.00 0.57 C ATOM 2836 O ASN B 74 5.460 -5.615 -1.790 1.00 0.60 O ATOM 2837 CB ASN B 74 8.509 -4.561 -1.447 1.00 0.57 C ATOM 2838 CG ASN B 74 8.315 -5.555 -2.593 1.00 0.79 C ATOM 2839 OD1 ASN B 74 8.420 -6.750 -2.400 1.00 1.73 O ATOM 2840 ND2 ASN B 74 8.036 -5.109 -3.787 1.00 0.99 N ATOM 0 H ASN B 74 8.281 -3.801 0.918 1.00 0.52 H new ATOM 0 HA ASN B 74 6.689 -3.410 -1.427 1.00 0.55 H new ATOM 0 HB2 ASN B 74 9.002 -3.660 -1.812 1.00 0.57 H new ATOM 0 HB3 ASN B 74 9.157 -4.991 -0.684 1.00 0.57 H new ATOM 0 HD21 ASN B 74 7.906 -5.764 -4.558 1.00 0.99 H new ATOM 0 HD22 ASN B 74 7.948 -4.106 -3.949 1.00 0.99 H new ATOM 2847 N GLU B 75 6.322 -6.299 0.107 1.00 0.55 N ATOM 2848 CA GLU B 75 5.456 -7.509 0.093 1.00 0.59 C ATOM 2849 C GLU B 75 4.040 -7.139 0.540 1.00 0.57 C ATOM 2850 O GLU B 75 3.089 -7.831 0.238 1.00 0.68 O ATOM 2851 CB GLU B 75 6.066 -8.605 0.989 1.00 0.62 C ATOM 2852 CG GLU B 75 5.406 -8.633 2.373 1.00 1.10 C ATOM 2853 CD GLU B 75 4.084 -9.403 2.311 1.00 1.46 C ATOM 2854 OE1 GLU B 75 3.740 -9.872 1.238 1.00 1.88 O ATOM 2855 OE2 GLU B 75 3.441 -9.516 3.341 1.00 2.12 O ATOM 0 H GLU B 75 6.948 -6.216 0.908 1.00 0.55 H new ATOM 0 HA GLU B 75 5.396 -7.904 -0.921 1.00 0.59 H new ATOM 0 HB2 GLU B 75 5.948 -9.576 0.509 1.00 0.62 H new ATOM 0 HB3 GLU B 75 7.137 -8.432 1.099 1.00 0.62 H new ATOM 0 HG2 GLU B 75 6.075 -9.102 3.094 1.00 1.10 H new ATOM 0 HG3 GLU B 75 5.227 -7.615 2.720 1.00 1.10 H new ATOM 2862 N MET B 76 3.874 -6.033 1.226 1.00 0.53 N ATOM 2863 CA MET B 76 2.515 -5.609 1.648 1.00 0.51 C ATOM 2864 C MET B 76 2.017 -4.602 0.619 1.00 0.52 C ATOM 2865 O MET B 76 0.856 -4.568 0.263 1.00 0.53 O ATOM 2866 CB MET B 76 2.596 -4.936 3.020 1.00 0.48 C ATOM 2867 CG MET B 76 3.000 -5.970 4.073 1.00 0.48 C ATOM 2868 SD MET B 76 1.693 -6.106 5.318 1.00 0.51 S ATOM 2869 CE MET B 76 2.418 -7.467 6.263 1.00 0.60 C ATOM 0 H MET B 76 4.629 -5.408 1.509 1.00 0.53 H new ATOM 0 HA MET B 76 1.842 -6.464 1.714 1.00 0.51 H new ATOM 0 HB2 MET B 76 3.322 -4.123 2.996 1.00 0.48 H new ATOM 0 HB3 MET B 76 1.633 -4.496 3.278 1.00 0.48 H new ATOM 0 HG2 MET B 76 3.170 -6.938 3.601 1.00 0.48 H new ATOM 0 HG3 MET B 76 3.938 -5.677 4.545 1.00 0.48 H new ATOM 0 HE1 MET B 76 1.763 -7.720 7.097 1.00 0.60 H new ATOM 0 HE2 MET B 76 2.535 -8.337 5.617 1.00 0.60 H new ATOM 0 HE3 MET B 76 3.393 -7.165 6.646 1.00 0.60 H new ATOM 2879 N ARG B 77 2.911 -3.774 0.146 1.00 0.52 N ATOM 2880 CA ARG B 77 2.536 -2.746 -0.861 1.00 0.54 C ATOM 2881 C ARG B 77 1.945 -3.413 -2.105 1.00 0.57 C ATOM 2882 O ARG B 77 0.927 -2.996 -2.619 1.00 0.57 O ATOM 2883 CB ARG B 77 3.773 -1.940 -1.254 1.00 0.54 C ATOM 2884 CG ARG B 77 3.384 -0.876 -2.280 1.00 0.57 C ATOM 2885 CD ARG B 77 3.985 -1.235 -3.639 1.00 0.62 C ATOM 2886 NE ARG B 77 3.428 -0.332 -4.682 1.00 0.86 N ATOM 2887 CZ ARG B 77 3.469 -0.683 -5.938 1.00 1.32 C ATOM 2888 NH1 ARG B 77 3.999 -1.825 -6.280 1.00 1.81 N ATOM 2889 NH2 ARG B 77 2.978 0.110 -6.852 1.00 1.80 N ATOM 0 H ARG B 77 3.894 -3.769 0.419 1.00 0.52 H new ATOM 0 HA ARG B 77 1.788 -2.083 -0.426 1.00 0.54 H new ATOM 0 HB2 ARG B 77 4.208 -1.469 -0.373 1.00 0.54 H new ATOM 0 HB3 ARG B 77 4.533 -2.601 -1.670 1.00 0.54 H new ATOM 0 HG2 ARG B 77 2.299 -0.809 -2.357 1.00 0.57 H new ATOM 0 HG3 ARG B 77 3.742 0.102 -1.959 1.00 0.57 H new ATOM 0 HD2 ARG B 77 5.070 -1.142 -3.604 1.00 0.62 H new ATOM 0 HD3 ARG B 77 3.762 -2.273 -3.885 1.00 0.62 H new ATOM 0 HE ARG B 77 3.014 0.561 -4.415 1.00 0.86 H new ATOM 0 HH11 ARG B 77 4.382 -2.444 -5.565 1.00 1.81 H new ATOM 0 HH12 ARG B 77 4.031 -2.099 -7.262 1.00 1.81 H new ATOM 0 HH21 ARG B 77 2.563 1.002 -6.584 1.00 1.80 H new ATOM 0 HH22 ARG B 77 3.009 -0.163 -7.834 1.00 1.80 H new ATOM 2903 N LYS B 78 2.563 -4.462 -2.584 1.00 0.58 N ATOM 2904 CA LYS B 78 2.016 -5.159 -3.774 1.00 0.61 C ATOM 2905 C LYS B 78 0.711 -5.824 -3.365 1.00 0.60 C ATOM 2906 O LYS B 78 -0.195 -5.988 -4.159 1.00 0.62 O ATOM 2907 CB LYS B 78 3.013 -6.217 -4.270 1.00 0.63 C ATOM 2908 CG LYS B 78 2.248 -7.420 -4.840 1.00 1.17 C ATOM 2909 CD LYS B 78 3.166 -8.299 -5.685 1.00 1.22 C ATOM 2910 CE LYS B 78 4.525 -8.479 -4.999 1.00 1.57 C ATOM 2911 NZ LYS B 78 4.316 -8.837 -3.567 1.00 2.26 N ATOM 0 H LYS B 78 3.420 -4.861 -2.200 1.00 0.58 H new ATOM 0 HA LYS B 78 1.843 -4.449 -4.583 1.00 0.61 H new ATOM 0 HB2 LYS B 78 3.661 -5.790 -5.035 1.00 0.63 H new ATOM 0 HB3 LYS B 78 3.656 -6.538 -3.450 1.00 0.63 H new ATOM 0 HG2 LYS B 78 1.826 -8.007 -4.024 1.00 1.17 H new ATOM 0 HG3 LYS B 78 1.413 -7.070 -5.447 1.00 1.17 H new ATOM 0 HD2 LYS B 78 2.701 -9.272 -5.844 1.00 1.22 H new ATOM 0 HD3 LYS B 78 3.306 -7.849 -6.668 1.00 1.22 H new ATOM 0 HE2 LYS B 78 5.097 -9.260 -5.500 1.00 1.57 H new ATOM 0 HE3 LYS B 78 5.107 -7.560 -5.074 1.00 1.57 H new ATOM 0 HZ1 LYS B 78 4.507 -8.007 -2.970 1.00 2.26 H new ATOM 0 HZ2 LYS B 78 3.333 -9.145 -3.426 1.00 2.26 H new ATOM 0 HZ3 LYS B 78 4.962 -9.609 -3.304 1.00 2.26 H new ATOM 2925 N ASN B 79 0.601 -6.200 -2.122 1.00 0.58 N ATOM 2926 CA ASN B 79 -0.656 -6.843 -1.664 1.00 0.58 C ATOM 2927 C ASN B 79 -1.784 -5.834 -1.810 1.00 0.57 C ATOM 2928 O ASN B 79 -2.816 -6.113 -2.389 1.00 0.57 O ATOM 2929 CB ASN B 79 -0.530 -7.265 -0.203 1.00 0.57 C ATOM 2930 CG ASN B 79 -1.273 -8.585 0.010 1.00 0.62 C ATOM 2931 OD1 ASN B 79 -0.895 -9.381 0.847 1.00 1.18 O ATOM 2932 ND2 ASN B 79 -2.323 -8.854 -0.717 1.00 1.16 N ATOM 0 H ASN B 79 1.323 -6.090 -1.410 1.00 0.58 H new ATOM 0 HA ASN B 79 -0.859 -7.731 -2.263 1.00 0.58 H new ATOM 0 HB2 ASN B 79 0.520 -7.379 0.065 1.00 0.57 H new ATOM 0 HB3 ASN B 79 -0.943 -6.493 0.447 1.00 0.57 H new ATOM 0 HD21 ASN B 79 -2.825 -9.731 -0.582 1.00 1.16 H new ATOM 0 HD22 ASN B 79 -2.641 -8.187 -1.420 1.00 1.16 H new ATOM 2939 N MET B 80 -1.587 -4.650 -1.301 1.00 0.57 N ATOM 2940 CA MET B 80 -2.637 -3.613 -1.423 1.00 0.57 C ATOM 2941 C MET B 80 -3.017 -3.492 -2.898 1.00 0.58 C ATOM 2942 O MET B 80 -4.175 -3.571 -3.252 1.00 0.57 O ATOM 2943 CB MET B 80 -2.103 -2.276 -0.885 1.00 0.60 C ATOM 2944 CG MET B 80 -2.856 -1.104 -1.524 1.00 0.69 C ATOM 2945 SD MET B 80 -2.067 -0.652 -3.087 1.00 1.27 S ATOM 2946 CE MET B 80 -3.294 0.569 -3.613 1.00 1.05 C ATOM 0 H MET B 80 -0.743 -4.360 -0.807 1.00 0.57 H new ATOM 0 HA MET B 80 -3.518 -3.884 -0.842 1.00 0.57 H new ATOM 0 HB2 MET B 80 -2.216 -2.242 0.199 1.00 0.60 H new ATOM 0 HB3 MET B 80 -1.037 -2.191 -1.097 1.00 0.60 H new ATOM 0 HG2 MET B 80 -3.897 -1.379 -1.697 1.00 0.69 H new ATOM 0 HG3 MET B 80 -2.860 -0.250 -0.847 1.00 0.69 H new ATOM 0 HE1 MET B 80 -3.169 0.776 -4.676 1.00 1.05 H new ATOM 0 HE2 MET B 80 -4.296 0.178 -3.435 1.00 1.05 H new ATOM 0 HE3 MET B 80 -3.158 1.489 -3.045 1.00 1.05 H new ATOM 2956 N ASP B 81 -2.058 -3.315 -3.772 1.00 0.60 N ATOM 2957 CA ASP B 81 -2.379 -3.211 -5.223 1.00 0.62 C ATOM 2958 C ASP B 81 -3.048 -4.499 -5.704 1.00 0.63 C ATOM 2959 O ASP B 81 -4.027 -4.466 -6.425 1.00 0.64 O ATOM 2960 CB ASP B 81 -1.084 -2.979 -6.003 1.00 0.65 C ATOM 2961 CG ASP B 81 -1.359 -2.052 -7.189 1.00 0.67 C ATOM 2962 OD1 ASP B 81 -1.919 -0.990 -6.968 1.00 1.23 O ATOM 2963 OD2 ASP B 81 -1.005 -2.418 -8.297 1.00 1.19 O ATOM 0 H ASP B 81 -1.068 -3.238 -3.541 1.00 0.60 H new ATOM 0 HA ASP B 81 -3.063 -2.378 -5.387 1.00 0.62 H new ATOM 0 HB2 ASP B 81 -0.329 -2.539 -5.352 1.00 0.65 H new ATOM 0 HB3 ASP B 81 -0.685 -3.930 -6.356 1.00 0.65 H new ATOM 2968 N GLN B 82 -2.555 -5.638 -5.290 1.00 0.64 N ATOM 2969 CA GLN B 82 -3.199 -6.916 -5.706 1.00 0.66 C ATOM 2970 C GLN B 82 -4.619 -6.906 -5.152 1.00 0.63 C ATOM 2971 O GLN B 82 -5.590 -7.143 -5.845 1.00 0.65 O ATOM 2972 CB GLN B 82 -2.427 -8.095 -5.106 1.00 0.68 C ATOM 2973 CG GLN B 82 -1.015 -8.149 -5.686 1.00 1.09 C ATOM 2974 CD GLN B 82 -0.945 -9.245 -6.751 1.00 0.83 C ATOM 2975 OE1 GLN B 82 -0.220 -10.208 -6.601 1.00 1.28 O ATOM 2976 NE2 GLN B 82 -1.675 -9.140 -7.828 1.00 1.41 N ATOM 0 H GLN B 82 -1.739 -5.737 -4.686 1.00 0.64 H new ATOM 0 HA GLN B 82 -3.204 -7.015 -6.791 1.00 0.66 H new ATOM 0 HB2 GLN B 82 -2.379 -7.994 -4.022 1.00 0.68 H new ATOM 0 HB3 GLN B 82 -2.951 -9.027 -5.317 1.00 0.68 H new ATOM 0 HG2 GLN B 82 -0.752 -7.185 -6.122 1.00 1.09 H new ATOM 0 HG3 GLN B 82 -0.292 -8.349 -4.895 1.00 1.09 H new ATOM 0 HE21 GLN B 82 -2.284 -8.332 -7.955 1.00 1.41 H new ATOM 0 HE22 GLN B 82 -1.636 -9.866 -8.543 1.00 1.41 H new ATOM 2985 N LEU B 83 -4.724 -6.607 -3.891 1.00 0.59 N ATOM 2986 CA LEU B 83 -6.059 -6.545 -3.244 1.00 0.56 C ATOM 2987 C LEU B 83 -6.868 -5.455 -3.945 1.00 0.55 C ATOM 2988 O LEU B 83 -8.017 -5.643 -4.293 1.00 0.56 O ATOM 2989 CB LEU B 83 -5.893 -6.212 -1.760 1.00 0.53 C ATOM 2990 CG LEU B 83 -5.216 -7.390 -1.046 1.00 0.53 C ATOM 2991 CD1 LEU B 83 -4.479 -6.884 0.194 1.00 0.55 C ATOM 2992 CD2 LEU B 83 -6.269 -8.425 -0.624 1.00 0.56 C ATOM 0 H LEU B 83 -3.936 -6.401 -3.276 1.00 0.59 H new ATOM 0 HA LEU B 83 -6.574 -7.502 -3.325 1.00 0.56 H new ATOM 0 HB2 LEU B 83 -5.294 -5.309 -1.643 1.00 0.53 H new ATOM 0 HB3 LEU B 83 -6.865 -6.010 -1.310 1.00 0.53 H new ATOM 0 HG LEU B 83 -4.507 -7.857 -1.729 1.00 0.53 H new ATOM 0 HD11 LEU B 83 -3.999 -7.722 0.699 1.00 0.55 H new ATOM 0 HD12 LEU B 83 -3.722 -6.158 -0.103 1.00 0.55 H new ATOM 0 HD13 LEU B 83 -5.189 -6.410 0.872 1.00 0.55 H new ATOM 0 HD21 LEU B 83 -5.779 -9.257 -0.118 1.00 0.56 H new ATOM 0 HD22 LEU B 83 -6.985 -7.960 0.053 1.00 0.56 H new ATOM 0 HD23 LEU B 83 -6.791 -8.794 -1.507 1.00 0.56 H new ATOM 3004 N LYS B 84 -6.264 -4.320 -4.176 1.00 0.55 N ATOM 3005 CA LYS B 84 -6.980 -3.220 -4.878 1.00 0.55 C ATOM 3006 C LYS B 84 -7.609 -3.773 -6.159 1.00 0.58 C ATOM 3007 O LYS B 84 -8.732 -3.458 -6.505 1.00 0.58 O ATOM 3008 CB LYS B 84 -5.986 -2.116 -5.241 1.00 0.56 C ATOM 3009 CG LYS B 84 -6.749 -0.899 -5.770 1.00 0.57 C ATOM 3010 CD LYS B 84 -5.760 0.202 -6.159 1.00 0.80 C ATOM 3011 CE LYS B 84 -6.349 1.034 -7.300 1.00 0.80 C ATOM 3012 NZ LYS B 84 -6.528 0.171 -8.502 1.00 1.40 N ATOM 0 H LYS B 84 -5.303 -4.108 -3.907 1.00 0.55 H new ATOM 0 HA LYS B 84 -7.755 -2.813 -4.229 1.00 0.55 H new ATOM 0 HB2 LYS B 84 -5.398 -1.838 -4.366 1.00 0.56 H new ATOM 0 HB3 LYS B 84 -5.285 -2.476 -5.995 1.00 0.56 H new ATOM 0 HG2 LYS B 84 -7.351 -1.182 -6.634 1.00 0.57 H new ATOM 0 HG3 LYS B 84 -7.437 -0.531 -5.009 1.00 0.57 H new ATOM 0 HD2 LYS B 84 -5.552 0.839 -5.300 1.00 0.80 H new ATOM 0 HD3 LYS B 84 -4.812 -0.238 -6.467 1.00 0.80 H new ATOM 0 HE2 LYS B 84 -7.306 1.459 -6.998 1.00 0.80 H new ATOM 0 HE3 LYS B 84 -5.689 1.869 -7.534 1.00 0.80 H new ATOM 0 HZ1 LYS B 84 -6.328 0.724 -9.360 1.00 1.40 H new ATOM 0 HZ2 LYS B 84 -5.874 -0.636 -8.450 1.00 1.40 H new ATOM 0 HZ3 LYS B 84 -7.507 -0.178 -8.536 1.00 1.40 H new ATOM 3026 N GLU B 85 -6.882 -4.594 -6.868 1.00 0.60 N ATOM 3027 CA GLU B 85 -7.414 -5.172 -8.133 1.00 0.63 C ATOM 3028 C GLU B 85 -8.583 -6.113 -7.832 1.00 0.63 C ATOM 3029 O GLU B 85 -9.541 -6.183 -8.575 1.00 0.64 O ATOM 3030 CB GLU B 85 -6.307 -5.961 -8.835 1.00 0.66 C ATOM 3031 CG GLU B 85 -6.934 -7.018 -9.748 1.00 0.69 C ATOM 3032 CD GLU B 85 -5.910 -7.459 -10.796 1.00 0.73 C ATOM 3033 OE1 GLU B 85 -4.762 -7.654 -10.428 1.00 1.28 O ATOM 3034 OE2 GLU B 85 -6.290 -7.595 -11.946 1.00 1.21 O ATOM 0 H GLU B 85 -5.937 -4.890 -6.623 1.00 0.60 H new ATOM 0 HA GLU B 85 -7.760 -4.361 -8.774 1.00 0.63 H new ATOM 0 HB2 GLU B 85 -5.679 -5.287 -9.418 1.00 0.66 H new ATOM 0 HB3 GLU B 85 -5.662 -6.439 -8.097 1.00 0.66 H new ATOM 0 HG2 GLU B 85 -7.260 -7.875 -9.159 1.00 0.69 H new ATOM 0 HG3 GLU B 85 -7.819 -6.612 -10.237 1.00 0.69 H new ATOM 3041 N LYS B 86 -8.520 -6.828 -6.749 1.00 0.63 N ATOM 3042 CA LYS B 86 -9.639 -7.751 -6.406 1.00 0.63 C ATOM 3043 C LYS B 86 -10.899 -6.920 -6.179 1.00 0.61 C ATOM 3044 O LYS B 86 -11.997 -7.310 -6.532 1.00 0.62 O ATOM 3045 CB LYS B 86 -9.295 -8.525 -5.132 1.00 0.64 C ATOM 3046 CG LYS B 86 -9.367 -10.029 -5.411 1.00 0.70 C ATOM 3047 CD LYS B 86 -9.083 -10.802 -4.122 1.00 0.89 C ATOM 3048 CE LYS B 86 -7.777 -11.585 -4.272 1.00 1.09 C ATOM 3049 NZ LYS B 86 -7.960 -12.666 -5.282 1.00 0.99 N ATOM 0 H LYS B 86 -7.745 -6.816 -6.085 1.00 0.63 H new ATOM 0 HA LYS B 86 -9.801 -8.461 -7.217 1.00 0.63 H new ATOM 0 HB2 LYS B 86 -8.296 -8.256 -4.789 1.00 0.64 H new ATOM 0 HB3 LYS B 86 -9.988 -8.259 -4.334 1.00 0.64 H new ATOM 0 HG2 LYS B 86 -10.353 -10.291 -5.795 1.00 0.70 H new ATOM 0 HG3 LYS B 86 -8.643 -10.302 -6.178 1.00 0.70 H new ATOM 0 HD2 LYS B 86 -9.011 -10.113 -3.281 1.00 0.89 H new ATOM 0 HD3 LYS B 86 -9.905 -11.484 -3.906 1.00 0.89 H new ATOM 0 HE2 LYS B 86 -6.973 -10.917 -4.580 1.00 1.09 H new ATOM 0 HE3 LYS B 86 -7.485 -12.014 -3.313 1.00 1.09 H new ATOM 0 HZ1 LYS B 86 -7.304 -13.447 -5.077 1.00 0.99 H new ATOM 0 HZ2 LYS B 86 -8.939 -13.016 -5.242 1.00 0.99 H new ATOM 0 HZ3 LYS B 86 -7.765 -12.290 -6.232 1.00 0.99 H new ATOM 3063 N ILE B 87 -10.740 -5.767 -5.590 1.00 0.59 N ATOM 3064 CA ILE B 87 -11.908 -4.888 -5.332 1.00 0.57 C ATOM 3065 C ILE B 87 -12.504 -4.424 -6.658 1.00 0.57 C ATOM 3066 O ILE B 87 -13.699 -4.502 -6.866 1.00 0.55 O ATOM 3067 CB ILE B 87 -11.452 -3.670 -4.525 1.00 0.59 C ATOM 3068 CG1 ILE B 87 -11.283 -4.061 -3.053 1.00 0.65 C ATOM 3069 CG2 ILE B 87 -12.494 -2.556 -4.638 1.00 0.68 C ATOM 3070 CD1 ILE B 87 -9.995 -3.446 -2.500 1.00 0.70 C ATOM 0 H ILE B 87 -9.843 -5.396 -5.275 1.00 0.59 H new ATOM 0 HA ILE B 87 -12.663 -5.440 -4.772 1.00 0.57 H new ATOM 0 HB ILE B 87 -10.499 -3.316 -4.919 1.00 0.59 H new ATOM 0 HG12 ILE B 87 -12.140 -3.716 -2.474 1.00 0.65 H new ATOM 0 HG13 ILE B 87 -11.250 -5.146 -2.957 1.00 0.65 H new ATOM 0 HG21 ILE B 87 -12.166 -1.691 -4.062 1.00 0.68 H new ATOM 0 HG22 ILE B 87 -12.611 -2.272 -5.684 1.00 0.68 H new ATOM 0 HG23 ILE B 87 -13.449 -2.910 -4.249 1.00 0.68 H new ATOM 0 HD11 ILE B 87 -9.878 -3.726 -1.453 1.00 0.70 H new ATOM 0 HD12 ILE B 87 -9.142 -3.813 -3.071 1.00 0.70 H new ATOM 0 HD13 ILE B 87 -10.046 -2.360 -2.581 1.00 0.70 H new ATOM 3082 N ASN B 88 -11.694 -3.952 -7.564 1.00 0.60 N ATOM 3083 CA ASN B 88 -12.244 -3.502 -8.870 1.00 0.63 C ATOM 3084 C ASN B 88 -12.933 -4.673 -9.567 1.00 0.63 C ATOM 3085 O ASN B 88 -13.856 -4.493 -10.328 1.00 0.64 O ATOM 3086 CB ASN B 88 -11.118 -2.979 -9.768 1.00 0.70 C ATOM 3087 CG ASN B 88 -10.553 -4.126 -10.608 1.00 1.78 C ATOM 3088 OD1 ASN B 88 -9.477 -4.619 -10.341 1.00 2.47 O ATOM 3089 ND2 ASN B 88 -11.238 -4.571 -11.627 1.00 2.62 N ATOM 0 H ASN B 88 -10.684 -3.859 -7.457 1.00 0.60 H new ATOM 0 HA ASN B 88 -12.962 -2.702 -8.690 1.00 0.63 H new ATOM 0 HB2 ASN B 88 -11.496 -2.190 -10.419 1.00 0.70 H new ATOM 0 HB3 ASN B 88 -10.329 -2.539 -9.159 1.00 0.70 H new ATOM 0 HD21 ASN B 88 -10.868 -5.332 -12.197 1.00 2.62 H new ATOM 0 HD22 ASN B 88 -12.143 -4.158 -11.853 1.00 2.62 H new ATOM 3096 N SER B 89 -12.476 -5.870 -9.328 1.00 0.64 N ATOM 3097 CA SER B 89 -13.091 -7.048 -9.996 1.00 0.68 C ATOM 3098 C SER B 89 -14.519 -7.289 -9.494 1.00 0.67 C ATOM 3099 O SER B 89 -15.435 -7.452 -10.275 1.00 0.74 O ATOM 3100 CB SER B 89 -12.244 -8.289 -9.712 1.00 0.70 C ATOM 3101 OG SER B 89 -12.148 -9.073 -10.894 1.00 1.23 O ATOM 0 H SER B 89 -11.702 -6.083 -8.698 1.00 0.64 H new ATOM 0 HA SER B 89 -13.131 -6.851 -11.067 1.00 0.68 H new ATOM 0 HB2 SER B 89 -11.250 -7.995 -9.375 1.00 0.70 H new ATOM 0 HB3 SER B 89 -12.693 -8.874 -8.909 1.00 0.70 H new ATOM 0 HG SER B 89 -11.604 -9.868 -10.716 1.00 1.23 H new ATOM 3107 N VAL B 90 -14.724 -7.327 -8.203 1.00 0.63 N ATOM 3108 CA VAL B 90 -16.096 -7.572 -7.668 1.00 0.64 C ATOM 3109 C VAL B 90 -16.923 -6.293 -7.727 1.00 0.57 C ATOM 3110 O VAL B 90 -18.070 -6.293 -8.125 1.00 0.59 O ATOM 3111 CB VAL B 90 -15.992 -8.036 -6.217 1.00 0.66 C ATOM 3112 CG1 VAL B 90 -17.315 -8.673 -5.781 1.00 0.66 C ATOM 3113 CG2 VAL B 90 -14.865 -9.065 -6.091 1.00 0.89 C ATOM 0 H VAL B 90 -14.000 -7.199 -7.496 1.00 0.63 H new ATOM 0 HA VAL B 90 -16.582 -8.337 -8.273 1.00 0.64 H new ATOM 0 HB VAL B 90 -15.778 -7.179 -5.579 1.00 0.66 H new ATOM 0 HG11 VAL B 90 -17.236 -9.003 -4.745 1.00 0.66 H new ATOM 0 HG12 VAL B 90 -18.118 -7.941 -5.869 1.00 0.66 H new ATOM 0 HG13 VAL B 90 -17.534 -9.530 -6.419 1.00 0.66 H new ATOM 0 HG21 VAL B 90 -14.790 -9.397 -5.056 1.00 0.89 H new ATOM 0 HG22 VAL B 90 -15.080 -9.920 -6.732 1.00 0.89 H new ATOM 0 HG23 VAL B 90 -13.922 -8.611 -6.396 1.00 0.89 H new ATOM 3123 N LEU B 91 -16.339 -5.199 -7.329 1.00 0.51 N ATOM 3124 CA LEU B 91 -17.069 -3.912 -7.354 1.00 0.49 C ATOM 3125 C LEU B 91 -17.161 -3.440 -8.793 1.00 0.57 C ATOM 3126 O LEU B 91 -17.922 -2.559 -9.109 1.00 0.61 O ATOM 3127 CB LEU B 91 -16.293 -2.877 -6.533 1.00 0.47 C ATOM 3128 CG LEU B 91 -17.188 -1.674 -6.225 1.00 0.59 C ATOM 3129 CD1 LEU B 91 -17.974 -1.938 -4.943 1.00 0.91 C ATOM 3130 CD2 LEU B 91 -16.320 -0.428 -6.042 1.00 0.84 C ATOM 0 H LEU B 91 -15.380 -5.145 -6.986 1.00 0.51 H new ATOM 0 HA LEU B 91 -18.067 -4.036 -6.934 1.00 0.49 H new ATOM 0 HB2 LEU B 91 -15.942 -3.327 -5.604 1.00 0.47 H new ATOM 0 HB3 LEU B 91 -15.410 -2.552 -7.083 1.00 0.47 H new ATOM 0 HG LEU B 91 -17.882 -1.517 -7.051 1.00 0.59 H new ATOM 0 HD11 LEU B 91 -18.611 -1.081 -4.724 1.00 0.91 H new ATOM 0 HD12 LEU B 91 -18.592 -2.826 -5.072 1.00 0.91 H new ATOM 0 HD13 LEU B 91 -17.281 -2.095 -4.117 1.00 0.91 H new ATOM 0 HD21 LEU B 91 -16.956 0.430 -5.823 1.00 0.84 H new ATOM 0 HD22 LEU B 91 -15.626 -0.586 -5.216 1.00 0.84 H new ATOM 0 HD23 LEU B 91 -15.758 -0.238 -6.957 1.00 0.84 H new ATOM 3142 N SER B 92 -16.421 -4.062 -9.672 1.00 0.63 N ATOM 3143 CA SER B 92 -16.463 -3.685 -11.125 1.00 0.76 C ATOM 3144 C SER B 92 -16.141 -2.189 -11.317 1.00 0.83 C ATOM 3145 O SER B 92 -15.622 -1.792 -12.339 1.00 1.11 O ATOM 3146 CB SER B 92 -17.858 -3.973 -11.684 1.00 0.72 C ATOM 3147 OG SER B 92 -17.803 -5.134 -12.503 1.00 0.89 O ATOM 0 H SER B 92 -15.781 -4.824 -9.448 1.00 0.63 H new ATOM 0 HA SER B 92 -15.714 -4.274 -11.655 1.00 0.76 H new ATOM 0 HB2 SER B 92 -18.566 -4.122 -10.869 1.00 0.72 H new ATOM 0 HB3 SER B 92 -18.214 -3.121 -12.264 1.00 0.72 H new ATOM 0 HG SER B 92 -16.931 -5.180 -12.947 1.00 0.89 H new ATOM 3153 N ILE B 93 -16.495 -1.365 -10.361 1.00 0.74 N ATOM 3154 CA ILE B 93 -16.274 0.116 -10.467 1.00 0.82 C ATOM 3155 C ILE B 93 -17.186 0.695 -11.552 1.00 1.03 C ATOM 3156 O ILE B 93 -17.941 1.618 -11.320 1.00 1.11 O ATOM 3157 CB ILE B 93 -14.814 0.427 -10.808 1.00 0.92 C ATOM 3158 CG1 ILE B 93 -13.902 -0.401 -9.896 1.00 0.87 C ATOM 3159 CG2 ILE B 93 -14.565 1.923 -10.607 1.00 1.13 C ATOM 3160 CD1 ILE B 93 -12.616 0.369 -9.570 1.00 1.43 C ATOM 0 H ILE B 93 -16.938 -1.662 -9.491 1.00 0.74 H new ATOM 0 HA ILE B 93 -16.510 0.569 -9.504 1.00 0.82 H new ATOM 0 HB ILE B 93 -14.600 0.171 -11.846 1.00 0.92 H new ATOM 0 HG12 ILE B 93 -14.428 -0.647 -8.974 1.00 0.87 H new ATOM 0 HG13 ILE B 93 -13.653 -1.344 -10.382 1.00 0.87 H new ATOM 0 HG21 ILE B 93 -13.527 2.155 -10.847 1.00 1.13 H new ATOM 0 HG22 ILE B 93 -15.225 2.493 -11.261 1.00 1.13 H new ATOM 0 HG23 ILE B 93 -14.765 2.189 -9.569 1.00 1.13 H new ATOM 0 HD11 ILE B 93 -11.983 -0.237 -8.922 1.00 1.43 H new ATOM 0 HD12 ILE B 93 -12.081 0.592 -10.493 1.00 1.43 H new ATOM 0 HD13 ILE B 93 -12.868 1.300 -9.063 1.00 1.43 H new ATOM 3172 N ARG B 94 -17.110 0.161 -12.732 1.00 1.25 N ATOM 3173 CA ARG B 94 -17.954 0.667 -13.853 1.00 1.52 C ATOM 3174 C ARG B 94 -18.270 -0.482 -14.812 1.00 1.60 C ATOM 3175 O ARG B 94 -19.040 -0.340 -15.739 1.00 1.76 O ATOM 3176 CB ARG B 94 -17.194 1.758 -14.609 1.00 1.97 C ATOM 3177 CG ARG B 94 -15.855 1.206 -15.112 1.00 2.23 C ATOM 3178 CD ARG B 94 -14.718 1.974 -14.449 1.00 2.52 C ATOM 3179 NE ARG B 94 -14.754 3.395 -14.898 1.00 3.12 N ATOM 3180 CZ ARG B 94 -14.400 3.704 -16.117 1.00 3.73 C ATOM 3181 NH1 ARG B 94 -13.989 2.772 -16.934 1.00 3.88 N ATOM 3182 NH2 ARG B 94 -14.454 4.945 -16.519 1.00 4.55 N ATOM 0 H ARG B 94 -16.493 -0.614 -12.976 1.00 1.25 H new ATOM 0 HA ARG B 94 -18.882 1.076 -13.452 1.00 1.52 H new ATOM 0 HB2 ARG B 94 -17.790 2.113 -15.450 1.00 1.97 H new ATOM 0 HB3 ARG B 94 -17.023 2.614 -13.956 1.00 1.97 H new ATOM 0 HG2 ARG B 94 -15.776 0.144 -14.881 1.00 2.23 H new ATOM 0 HG3 ARG B 94 -15.792 1.302 -16.196 1.00 2.23 H new ATOM 0 HD2 ARG B 94 -14.812 1.921 -13.364 1.00 2.52 H new ATOM 0 HD3 ARG B 94 -13.760 1.523 -14.708 1.00 2.52 H new ATOM 0 HE ARG B 94 -15.055 4.126 -14.254 1.00 3.12 H new ATOM 0 HH11 ARG B 94 -13.944 1.802 -16.621 1.00 3.88 H new ATOM 0 HH12 ARG B 94 -13.713 3.014 -17.886 1.00 3.88 H new ATOM 0 HH21 ARG B 94 -14.773 5.674 -15.881 1.00 4.55 H new ATOM 0 HH22 ARG B 94 -14.177 5.185 -17.471 1.00 4.55 H new ATOM 3196 N GLN B 95 -17.696 -1.628 -14.576 1.00 1.55 N ATOM 3197 CA GLN B 95 -17.984 -2.798 -15.458 1.00 1.73 C ATOM 3198 C GLN B 95 -17.364 -4.059 -14.857 1.00 2.40 C ATOM 3199 O GLN B 95 -16.418 -3.925 -14.100 1.00 2.92 O ATOM 3200 CB GLN B 95 -17.414 -2.553 -16.859 1.00 1.94 C ATOM 3201 CG GLN B 95 -18.171 -3.415 -17.877 1.00 2.44 C ATOM 3202 CD GLN B 95 -19.585 -2.863 -18.075 1.00 2.98 C ATOM 3203 OE1 GLN B 95 -19.807 -1.674 -17.964 1.00 3.53 O ATOM 3204 NE2 GLN B 95 -20.560 -3.684 -18.364 1.00 3.31 N ATOM 3205 OXT GLN B 95 -17.847 -5.137 -15.164 1.00 3.00 O ATOM 0 H GLN B 95 -17.042 -1.807 -13.814 1.00 1.55 H new ATOM 0 HA GLN B 95 -19.063 -2.930 -15.535 1.00 1.73 H new ATOM 0 HB2 GLN B 95 -17.504 -1.499 -17.121 1.00 1.94 H new ATOM 0 HB3 GLN B 95 -16.352 -2.797 -16.879 1.00 1.94 H new ATOM 0 HG2 GLN B 95 -17.638 -3.424 -18.828 1.00 2.44 H new ATOM 0 HG3 GLN B 95 -18.219 -4.447 -17.529 1.00 2.44 H new ATOM 0 HE21 GLN B 95 -20.375 -4.683 -18.458 1.00 3.31 H new ATOM 0 HE22 GLN B 95 -21.506 -3.326 -18.496 1.00 3.31 H new TER 3214 GLN B 95