USER MOD reduce.3.24.130724 H: found=0, std=0, add=1626, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1626 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 76 CYS SG : rot -67:sc= 0.667! USER MOD Set 1.2: A 80 SER OG : rot 157:sc= -1.21! USER MOD Set 1.3: B 76 CYS SG : rot 72:sc= -2.56! USER MOD Set 1.4: B 80 SER OG : rot 151:sc= -0.966! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -171:sc= -0.405 (180deg=-0.678) USER MOD Single : A 3 CYS SG : rot -125:sc= 0.0918 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl -158:sc= -0.0754 (180deg=-1.11) USER MOD Single : A 14 SER OG : rot 178:sc= -0.982 USER MOD Single : A 15 THR OG1 : rot 172:sc= 1.2 USER MOD Single : A 17 HIS : no HD1:sc= -3.5 K(o=-3.5,f=-5.5!) USER MOD Single : A 18 LYS NZ :NH3+ 161:sc= -0.0589 (180deg=-0.508) USER MOD Single : A 19 TYR OH : rot 129:sc= -0.462 USER MOD Single : A 20 SER OG : rot -36:sc= 1.13 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 147:sc= 0.311 (180deg=0.032) USER MOD Single : A 30 ASN : amide:sc= -3.32 K(o=-3.3,f=-7.7!) USER MOD Single : A 31 LYS NZ :NH3+ -156:sc= -0.132 (180deg=-0.918) USER MOD Single : A 32 SER OG : rot 180:sc=-0.00833 USER MOD Single : A 35 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0258) USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.0509 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -160:sc= -0.0109 USER MOD Single : A 56 GLN : amide:sc= -0.227 X(o=-0.23,f=-0.26) USER MOD Single : A 57 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.34) USER MOD Single : A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -3.65! C(o=-3.7!,f=-3.7!) USER MOD Single : A 64 SER OG : rot 180:sc= -0.0945 USER MOD Single : A 65 ASN : amide:sc= -0.15 K(o=-0.15,f=-1.8!) USER MOD Single : A 68 ASN : amide:sc= -0.0575 K(o=-0.058,f=-2.1!) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot 77:sc= 0.468 USER MOD Single : A 84 MET CE :methyl -158:sc= -0.349 (180deg=-1.42) USER MOD Single : A 85 MET CE :methyl 170:sc= -0.0187 (180deg=-0.248) USER MOD Single : A 86 CYS SG : rot 35:sc= -0.0162! USER MOD Single : A 87 ASN : amide:sc= -3.93! C(o=-3.9!,f=-8.1!) USER MOD Single : A 96 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.105) USER MOD Single : A 97 GLN :FLIP amide:sc= -0.0122 F(o=-0.66,f=-0.012) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -170:sc= -0.45 (180deg=-0.709) USER MOD Single : B 3 CYS SG : rot -126:sc= 0.0769 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl -158:sc= -0.0764 (180deg=-1.01) USER MOD Single : B 14 SER OG : rot 175:sc= -0.932 USER MOD Single : B 15 THR OG1 : rot -170:sc= 1.15 USER MOD Single : B 17 HIS : no HD1:sc= -3.43! C(o=-3.4!,f=-5.6!) USER MOD Single : B 18 LYS NZ :NH3+ 162:sc= -0.0469 (180deg=-0.442) USER MOD Single : B 19 TYR OH : rot 130:sc= -0.479 USER MOD Single : B 20 SER OG : rot -22:sc= 0.97 USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 153:sc= 0.327 (180deg=0.0631) USER MOD Single : B 30 ASN : amide:sc= -3.09 K(o=-3.1,f=-7.1!) USER MOD Single : B 31 LYS NZ :NH3+ -159:sc= -0.0651 (180deg=-0.665) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0207) USER MOD Single : B 39 THR OG1 : rot 180:sc= -0.0464 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 THR OG1 : rot -160:sc= 0 USER MOD Single : B 56 GLN : amide:sc= -0.235 X(o=-0.23,f=-0.27) USER MOD Single : B 57 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.273) USER MOD Single : B 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 ASN : amide:sc= -3.53 X(o=-3.5,f=-3.4!) USER MOD Single : B 64 SER OG : rot 180:sc= -0.119 USER MOD Single : B 65 ASN : amide:sc= -0.143 K(o=-0.14,f=-1.8!) USER MOD Single : B 68 ASN : amide:sc= -0.0218 K(o=-0.022,f=-1.9!) USER MOD Single : B 73 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 81 CYS SG : rot 76:sc= 0.504 USER MOD Single : B 84 MET CE :methyl -158:sc= -0.589 (180deg=-1.67) USER MOD Single : B 85 MET CE :methyl 171:sc= -0.0122 (180deg=-0.198) USER MOD Single : B 86 CYS SG : rot 23:sc= -0.0726! USER MOD Single : B 87 ASN : amide:sc= -3.99! C(o=-4!,f=-8.5!) USER MOD Single : B 96 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.103) USER MOD Single : B 97 GLN :FLIP amide:sc= -0.0171 F(o=-0.7,f=-0.017) USER MOD Single : B 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 77.648 -1.279 -20.172 1.00 0.00 N ATOM 2 CA MET A 1 77.628 -0.027 -20.979 1.00 0.00 C ATOM 3 C MET A 1 76.814 1.037 -20.239 1.00 0.00 C ATOM 4 O MET A 1 76.661 2.149 -20.702 1.00 0.00 O ATOM 5 CB MET A 1 76.986 -0.300 -22.343 1.00 0.00 C ATOM 6 CG MET A 1 77.797 -1.357 -23.096 1.00 0.00 C ATOM 7 SD MET A 1 77.044 -1.655 -24.717 1.00 0.00 S ATOM 8 CE MET A 1 78.279 -2.827 -25.330 1.00 0.00 C ATOM 0 H1 MET A 1 78.321 -1.952 -20.592 1.00 0.00 H new ATOM 0 H2 MET A 1 77.940 -1.060 -19.198 1.00 0.00 H new ATOM 0 H3 MET A 1 76.697 -1.701 -20.162 1.00 0.00 H new ATOM 0 HA MET A 1 78.649 0.325 -21.126 1.00 0.00 H new ATOM 0 HB2 MET A 1 75.960 -0.643 -22.210 1.00 0.00 H new ATOM 0 HB3 MET A 1 76.942 0.620 -22.925 1.00 0.00 H new ATOM 0 HG2 MET A 1 78.827 -1.022 -23.218 1.00 0.00 H new ATOM 0 HG3 MET A 1 77.829 -2.283 -22.522 1.00 0.00 H new ATOM 0 HE1 MET A 1 78.008 -3.148 -26.336 1.00 0.00 H new ATOM 0 HE2 MET A 1 79.257 -2.346 -25.354 1.00 0.00 H new ATOM 0 HE3 MET A 1 78.317 -3.694 -24.670 1.00 0.00 H new ATOM 20 N ALA A 2 76.288 0.702 -19.089 1.00 0.00 N ATOM 21 CA ALA A 2 75.482 1.690 -18.312 1.00 0.00 C ATOM 22 C ALA A 2 75.619 1.392 -16.817 1.00 0.00 C ATOM 23 O ALA A 2 76.086 0.341 -16.427 1.00 0.00 O ATOM 24 CB ALA A 2 74.013 1.587 -18.723 1.00 0.00 C ATOM 0 H ALA A 2 76.382 -0.216 -18.654 1.00 0.00 H new ATOM 0 HA ALA A 2 75.844 2.698 -18.517 1.00 0.00 H new ATOM 0 HB1 ALA A 2 73.425 2.308 -18.156 1.00 0.00 H new ATOM 0 HB2 ALA A 2 73.917 1.799 -19.788 1.00 0.00 H new ATOM 0 HB3 ALA A 2 73.648 0.581 -18.519 1.00 0.00 H new ATOM 30 N CYS A 3 75.224 2.311 -15.979 1.00 0.00 N ATOM 31 CA CYS A 3 75.343 2.082 -14.512 1.00 0.00 C ATOM 32 C CYS A 3 76.761 1.600 -14.178 1.00 0.00 C ATOM 33 O CYS A 3 76.944 0.496 -13.707 1.00 0.00 O ATOM 34 CB CYS A 3 74.335 1.019 -14.071 1.00 0.00 C ATOM 35 SG CYS A 3 72.663 1.550 -14.516 1.00 0.00 S ATOM 0 H CYS A 3 74.824 3.210 -16.247 1.00 0.00 H new ATOM 0 HA CYS A 3 75.140 3.016 -13.989 1.00 0.00 H new ATOM 0 HB2 CYS A 3 74.564 0.066 -14.547 1.00 0.00 H new ATOM 0 HB3 CYS A 3 74.404 0.862 -12.995 1.00 0.00 H new ATOM 0 HG CYS A 3 71.906 1.533 -13.459 1.00 0.00 H new ATOM 41 N PRO A 4 77.765 2.415 -14.419 1.00 0.00 N ATOM 42 CA PRO A 4 79.167 2.007 -14.120 1.00 0.00 C ATOM 43 C PRO A 4 79.329 1.562 -12.663 1.00 0.00 C ATOM 44 O PRO A 4 80.349 1.030 -12.271 1.00 0.00 O ATOM 45 CB PRO A 4 79.968 3.289 -14.424 1.00 0.00 C ATOM 46 CG PRO A 4 79.019 4.313 -15.083 1.00 0.00 C ATOM 47 CD PRO A 4 77.576 3.778 -14.992 1.00 0.00 C ATOM 0 HA PRO A 4 79.499 1.148 -14.703 1.00 0.00 H new ATOM 0 HB2 PRO A 4 80.390 3.699 -13.506 1.00 0.00 H new ATOM 0 HB3 PRO A 4 80.804 3.065 -15.087 1.00 0.00 H new ATOM 0 HG2 PRO A 4 79.097 5.278 -14.582 1.00 0.00 H new ATOM 0 HG3 PRO A 4 79.298 4.472 -16.125 1.00 0.00 H new ATOM 0 HD2 PRO A 4 76.953 4.403 -14.352 1.00 0.00 H new ATOM 0 HD3 PRO A 4 77.095 3.743 -15.970 1.00 0.00 H new ATOM 55 N LEU A 5 78.321 1.770 -11.865 1.00 0.00 N ATOM 56 CA LEU A 5 78.401 1.354 -10.442 1.00 0.00 C ATOM 57 C LEU A 5 78.624 -0.156 -10.407 1.00 0.00 C ATOM 58 O LEU A 5 79.371 -0.666 -9.603 1.00 0.00 O ATOM 59 CB LEU A 5 77.089 1.708 -9.727 1.00 0.00 C ATOM 60 CG LEU A 5 77.151 1.285 -8.248 1.00 0.00 C ATOM 61 CD1 LEU A 5 78.211 2.113 -7.499 1.00 0.00 C ATOM 62 CD2 LEU A 5 75.780 1.520 -7.608 1.00 0.00 C ATOM 0 H LEU A 5 77.443 2.212 -12.139 1.00 0.00 H new ATOM 0 HA LEU A 5 79.219 1.868 -9.937 1.00 0.00 H new ATOM 0 HB2 LEU A 5 76.907 2.780 -9.798 1.00 0.00 H new ATOM 0 HB3 LEU A 5 76.254 1.210 -10.219 1.00 0.00 H new ATOM 0 HG LEU A 5 77.421 0.231 -8.187 1.00 0.00 H new ATOM 0 HD11 LEU A 5 78.244 1.803 -6.455 1.00 0.00 H new ATOM 0 HD12 LEU A 5 79.188 1.953 -7.956 1.00 0.00 H new ATOM 0 HD13 LEU A 5 77.953 3.171 -7.556 1.00 0.00 H new ATOM 0 HD21 LEU A 5 75.812 1.224 -6.560 1.00 0.00 H new ATOM 0 HD22 LEU A 5 75.522 2.577 -7.679 1.00 0.00 H new ATOM 0 HD23 LEU A 5 75.029 0.927 -8.130 1.00 0.00 H new ATOM 74 N GLU A 6 77.971 -0.874 -11.281 1.00 0.00 N ATOM 75 CA GLU A 6 78.130 -2.355 -11.306 1.00 0.00 C ATOM 76 C GLU A 6 79.592 -2.721 -11.568 1.00 0.00 C ATOM 77 O GLU A 6 80.149 -3.581 -10.914 1.00 0.00 O ATOM 78 CB GLU A 6 77.283 -2.923 -12.445 1.00 0.00 C ATOM 79 CG GLU A 6 75.800 -2.791 -12.104 1.00 0.00 C ATOM 80 CD GLU A 6 74.964 -3.359 -13.253 1.00 0.00 C ATOM 81 OE1 GLU A 6 74.784 -4.565 -13.290 1.00 0.00 O ATOM 82 OE2 GLU A 6 74.519 -2.577 -14.077 1.00 0.00 O ATOM 0 H GLU A 6 77.332 -0.496 -11.981 1.00 0.00 H new ATOM 0 HA GLU A 6 77.815 -2.764 -10.346 1.00 0.00 H new ATOM 0 HB2 GLU A 6 77.501 -2.392 -13.372 1.00 0.00 H new ATOM 0 HB3 GLU A 6 77.535 -3.970 -12.611 1.00 0.00 H new ATOM 0 HG2 GLU A 6 75.579 -3.325 -11.180 1.00 0.00 H new ATOM 0 HG3 GLU A 6 75.545 -1.744 -11.937 1.00 0.00 H new ATOM 89 N LYS A 7 80.224 -2.082 -12.514 1.00 0.00 N ATOM 90 CA LYS A 7 81.647 -2.411 -12.794 1.00 0.00 C ATOM 91 C LYS A 7 82.477 -1.924 -11.622 1.00 0.00 C ATOM 92 O LYS A 7 83.294 -2.636 -11.080 1.00 0.00 O ATOM 93 CB LYS A 7 82.107 -1.708 -14.074 1.00 0.00 C ATOM 94 CG LYS A 7 81.114 -2.001 -15.197 1.00 0.00 C ATOM 95 CD LYS A 7 81.723 -1.634 -16.559 1.00 0.00 C ATOM 96 CE LYS A 7 81.864 -0.115 -16.686 1.00 0.00 C ATOM 97 NZ LYS A 7 82.148 0.240 -18.107 1.00 0.00 N ATOM 0 H LYS A 7 79.819 -1.352 -13.100 1.00 0.00 H new ATOM 0 HA LYS A 7 81.764 -3.486 -12.928 1.00 0.00 H new ATOM 0 HB2 LYS A 7 82.177 -0.633 -13.907 1.00 0.00 H new ATOM 0 HB3 LYS A 7 83.102 -2.053 -14.354 1.00 0.00 H new ATOM 0 HG2 LYS A 7 80.843 -3.057 -15.185 1.00 0.00 H new ATOM 0 HG3 LYS A 7 80.197 -1.434 -15.037 1.00 0.00 H new ATOM 0 HD2 LYS A 7 82.699 -2.107 -16.668 1.00 0.00 H new ATOM 0 HD3 LYS A 7 81.092 -2.016 -17.362 1.00 0.00 H new ATOM 0 HE2 LYS A 7 80.949 0.375 -16.353 1.00 0.00 H new ATOM 0 HE3 LYS A 7 82.669 0.242 -16.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 82.244 1.272 -18.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 83.032 -0.217 -18.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 81.366 -0.087 -18.710 1.00 0.00 H new ATOM 111 N ALA A 8 82.240 -0.723 -11.202 1.00 0.00 N ATOM 112 CA ALA A 8 82.982 -0.203 -10.032 1.00 0.00 C ATOM 113 C ALA A 8 82.665 -1.128 -8.863 1.00 0.00 C ATOM 114 O ALA A 8 83.520 -1.493 -8.084 1.00 0.00 O ATOM 115 CB ALA A 8 82.562 1.231 -9.726 1.00 0.00 C ATOM 0 H ALA A 8 81.566 -0.079 -11.616 1.00 0.00 H new ATOM 0 HA ALA A 8 84.055 -0.183 -10.225 1.00 0.00 H new ATOM 0 HB1 ALA A 8 83.118 1.597 -8.863 1.00 0.00 H new ATOM 0 HB2 ALA A 8 82.773 1.864 -10.588 1.00 0.00 H new ATOM 0 HB3 ALA A 8 81.494 1.259 -9.508 1.00 0.00 H new ATOM 121 N LEU A 9 81.435 -1.546 -8.761 1.00 0.00 N ATOM 122 CA LEU A 9 81.075 -2.487 -7.676 1.00 0.00 C ATOM 123 C LEU A 9 81.932 -3.726 -7.883 1.00 0.00 C ATOM 124 O LEU A 9 82.459 -4.297 -6.949 1.00 0.00 O ATOM 125 CB LEU A 9 79.580 -2.842 -7.756 1.00 0.00 C ATOM 126 CG LEU A 9 79.189 -3.819 -6.634 1.00 0.00 C ATOM 127 CD1 LEU A 9 79.289 -3.126 -5.266 1.00 0.00 C ATOM 128 CD2 LEU A 9 77.746 -4.280 -6.860 1.00 0.00 C ATOM 0 H LEU A 9 80.670 -1.276 -9.380 1.00 0.00 H new ATOM 0 HA LEU A 9 81.251 -2.050 -6.693 1.00 0.00 H new ATOM 0 HB2 LEU A 9 78.982 -1.934 -7.679 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.359 -3.288 -8.726 1.00 0.00 H new ATOM 0 HG LEU A 9 79.866 -4.673 -6.648 1.00 0.00 H new ATOM 0 HD11 LEU A 9 79.010 -3.829 -4.481 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.312 -2.788 -5.103 1.00 0.00 H new ATOM 0 HD13 LEU A 9 78.616 -2.269 -5.242 1.00 0.00 H new ATOM 0 HD21 LEU A 9 77.458 -4.974 -6.070 1.00 0.00 H new ATOM 0 HD22 LEU A 9 77.081 -3.416 -6.845 1.00 0.00 H new ATOM 0 HD23 LEU A 9 77.671 -4.779 -7.826 1.00 0.00 H new ATOM 140 N ASP A 10 82.108 -4.125 -9.118 1.00 0.00 N ATOM 141 CA ASP A 10 82.973 -5.302 -9.388 1.00 0.00 C ATOM 142 C ASP A 10 84.420 -4.922 -9.073 1.00 0.00 C ATOM 143 O ASP A 10 85.194 -5.735 -8.621 1.00 0.00 O ATOM 144 CB ASP A 10 82.856 -5.739 -10.854 1.00 0.00 C ATOM 145 CG ASP A 10 81.486 -6.371 -11.100 1.00 0.00 C ATOM 146 OD1 ASP A 10 80.893 -6.846 -10.146 1.00 0.00 O ATOM 147 OD2 ASP A 10 81.056 -6.379 -12.242 1.00 0.00 O ATOM 0 H ASP A 10 81.692 -3.688 -9.941 1.00 0.00 H new ATOM 0 HA ASP A 10 82.656 -6.136 -8.762 1.00 0.00 H new ATOM 0 HB2 ASP A 10 82.993 -4.880 -11.511 1.00 0.00 H new ATOM 0 HB3 ASP A 10 83.644 -6.453 -11.094 1.00 0.00 H new ATOM 152 N VAL A 11 84.799 -3.691 -9.311 1.00 0.00 N ATOM 153 CA VAL A 11 86.210 -3.287 -9.018 1.00 0.00 C ATOM 154 C VAL A 11 86.506 -3.486 -7.529 1.00 0.00 C ATOM 155 O VAL A 11 87.562 -3.965 -7.160 1.00 0.00 O ATOM 156 CB VAL A 11 86.418 -1.811 -9.390 1.00 0.00 C ATOM 157 CG1 VAL A 11 87.776 -1.318 -8.869 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.365 -1.662 -10.913 1.00 0.00 C ATOM 0 H VAL A 11 84.202 -2.956 -9.691 1.00 0.00 H new ATOM 0 HA VAL A 11 86.887 -3.905 -9.607 1.00 0.00 H new ATOM 0 HB VAL A 11 85.630 -1.212 -8.934 1.00 0.00 H new ATOM 0 HG11 VAL A 11 87.911 -0.271 -9.139 1.00 0.00 H new ATOM 0 HG12 VAL A 11 87.808 -1.420 -7.784 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.574 -1.913 -9.313 1.00 0.00 H new ATOM 0 HG21 VAL A 11 86.512 -0.616 -11.182 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.151 -2.267 -11.365 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.394 -1.997 -11.278 1.00 0.00 H new ATOM 168 N MET A 12 85.589 -3.140 -6.668 1.00 0.00 N ATOM 169 CA MET A 12 85.840 -3.334 -5.212 1.00 0.00 C ATOM 170 C MET A 12 85.920 -4.835 -4.944 1.00 0.00 C ATOM 171 O MET A 12 86.723 -5.306 -4.169 1.00 0.00 O ATOM 172 CB MET A 12 84.714 -2.704 -4.385 1.00 0.00 C ATOM 173 CG MET A 12 84.689 -1.186 -4.616 1.00 0.00 C ATOM 174 SD MET A 12 83.881 -0.368 -3.217 1.00 0.00 S ATOM 175 CE MET A 12 82.385 -1.380 -3.184 1.00 0.00 C ATOM 0 H MET A 12 84.684 -2.735 -6.907 1.00 0.00 H new ATOM 0 HA MET A 12 86.773 -2.849 -4.925 1.00 0.00 H new ATOM 0 HB2 MET A 12 83.755 -3.140 -4.666 1.00 0.00 H new ATOM 0 HB3 MET A 12 84.863 -2.918 -3.327 1.00 0.00 H new ATOM 0 HG2 MET A 12 85.705 -0.809 -4.732 1.00 0.00 H new ATOM 0 HG3 MET A 12 84.157 -0.958 -5.540 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.588 -0.834 -2.680 1.00 0.00 H new ATOM 0 HE2 MET A 12 82.078 -1.610 -4.204 1.00 0.00 H new ATOM 0 HE3 MET A 12 82.585 -2.308 -2.648 1.00 0.00 H new ATOM 185 N VAL A 13 85.073 -5.588 -5.580 1.00 0.00 N ATOM 186 CA VAL A 13 85.082 -7.060 -5.385 1.00 0.00 C ATOM 187 C VAL A 13 86.274 -7.683 -6.121 1.00 0.00 C ATOM 188 O VAL A 13 86.935 -8.570 -5.617 1.00 0.00 O ATOM 189 CB VAL A 13 83.780 -7.628 -5.945 1.00 0.00 C ATOM 190 CG1 VAL A 13 83.827 -9.156 -5.930 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.614 -7.136 -5.086 1.00 0.00 C ATOM 0 H VAL A 13 84.369 -5.244 -6.232 1.00 0.00 H new ATOM 0 HA VAL A 13 85.170 -7.291 -4.323 1.00 0.00 H new ATOM 0 HB VAL A 13 83.647 -7.293 -6.974 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.894 -9.553 -6.331 1.00 0.00 H new ATOM 0 HG12 VAL A 13 84.661 -9.500 -6.542 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.960 -9.506 -4.906 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.679 -7.536 -5.478 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.751 -7.474 -4.059 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.580 -6.047 -5.108 1.00 0.00 H new ATOM 201 N SER A 14 86.539 -7.235 -7.319 1.00 0.00 N ATOM 202 CA SER A 14 87.667 -7.812 -8.103 1.00 0.00 C ATOM 203 C SER A 14 88.976 -7.614 -7.348 1.00 0.00 C ATOM 204 O SER A 14 89.725 -8.547 -7.135 1.00 0.00 O ATOM 205 CB SER A 14 87.751 -7.108 -9.456 1.00 0.00 C ATOM 206 OG SER A 14 88.220 -5.779 -9.264 1.00 0.00 O ATOM 0 H SER A 14 86.021 -6.492 -7.789 1.00 0.00 H new ATOM 0 HA SER A 14 87.496 -8.878 -8.251 1.00 0.00 H new ATOM 0 HB2 SER A 14 88.423 -7.651 -10.121 1.00 0.00 H new ATOM 0 HB3 SER A 14 86.771 -7.095 -9.934 1.00 0.00 H new ATOM 0 HG SER A 14 88.307 -5.334 -10.133 1.00 0.00 H new ATOM 212 N THR A 15 89.262 -6.415 -6.923 1.00 0.00 N ATOM 213 CA THR A 15 90.527 -6.200 -6.170 1.00 0.00 C ATOM 214 C THR A 15 90.485 -7.055 -4.901 1.00 0.00 C ATOM 215 O THR A 15 91.450 -7.687 -4.519 1.00 0.00 O ATOM 216 CB THR A 15 90.668 -4.708 -5.821 1.00 0.00 C ATOM 217 OG1 THR A 15 92.036 -4.406 -5.597 1.00 0.00 O ATOM 218 CG2 THR A 15 89.853 -4.349 -4.573 1.00 0.00 C ATOM 0 H THR A 15 88.684 -5.586 -7.062 1.00 0.00 H new ATOM 0 HA THR A 15 91.388 -6.492 -6.772 1.00 0.00 H new ATOM 0 HB THR A 15 90.286 -4.122 -6.657 1.00 0.00 H new ATOM 0 HG1 THR A 15 92.145 -3.437 -5.499 1.00 0.00 H new ATOM 0 HG21 THR A 15 89.973 -3.288 -4.352 1.00 0.00 H new ATOM 0 HG22 THR A 15 88.800 -4.565 -4.752 1.00 0.00 H new ATOM 0 HG23 THR A 15 90.206 -4.938 -3.726 1.00 0.00 H new ATOM 226 N PHE A 16 89.349 -7.083 -4.266 1.00 0.00 N ATOM 227 CA PHE A 16 89.181 -7.883 -3.019 1.00 0.00 C ATOM 228 C PHE A 16 89.446 -9.366 -3.309 1.00 0.00 C ATOM 229 O PHE A 16 90.042 -10.066 -2.515 1.00 0.00 O ATOM 230 CB PHE A 16 87.744 -7.714 -2.523 1.00 0.00 C ATOM 231 CG PHE A 16 87.526 -8.510 -1.261 1.00 0.00 C ATOM 232 CD1 PHE A 16 87.134 -9.851 -1.344 1.00 0.00 C ATOM 233 CD2 PHE A 16 87.703 -7.907 -0.011 1.00 0.00 C ATOM 234 CE1 PHE A 16 86.920 -10.591 -0.177 1.00 0.00 C ATOM 235 CE2 PHE A 16 87.488 -8.645 1.156 1.00 0.00 C ATOM 236 CZ PHE A 16 87.097 -9.987 1.075 1.00 0.00 C ATOM 0 H PHE A 16 88.514 -6.577 -4.562 1.00 0.00 H new ATOM 0 HA PHE A 16 89.886 -7.538 -2.263 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.539 -6.660 -2.336 1.00 0.00 H new ATOM 0 HB3 PHE A 16 87.046 -8.043 -3.293 1.00 0.00 H new ATOM 0 HD1 PHE A 16 86.997 -10.314 -2.310 1.00 0.00 H new ATOM 0 HD2 PHE A 16 88.006 -6.872 0.052 1.00 0.00 H new ATOM 0 HE1 PHE A 16 86.619 -11.626 -0.240 1.00 0.00 H new ATOM 0 HE2 PHE A 16 87.624 -8.180 2.121 1.00 0.00 H new ATOM 0 HZ PHE A 16 86.932 -10.557 1.978 1.00 0.00 H new ATOM 246 N HIS A 17 88.993 -9.855 -4.434 1.00 0.00 N ATOM 247 CA HIS A 17 89.209 -11.297 -4.762 1.00 0.00 C ATOM 248 C HIS A 17 90.685 -11.551 -5.045 1.00 0.00 C ATOM 249 O HIS A 17 91.173 -12.650 -4.867 1.00 0.00 O ATOM 250 CB HIS A 17 88.383 -11.690 -5.994 1.00 0.00 C ATOM 251 CG HIS A 17 86.925 -11.748 -5.633 1.00 0.00 C ATOM 252 ND1 HIS A 17 86.491 -11.821 -4.318 1.00 0.00 N ATOM 253 CD2 HIS A 17 85.787 -11.763 -6.405 1.00 0.00 C ATOM 254 CE1 HIS A 17 85.146 -11.876 -4.336 1.00 0.00 C ATOM 255 NE2 HIS A 17 84.671 -11.845 -5.581 1.00 0.00 N ATOM 0 H HIS A 17 88.484 -9.321 -5.138 1.00 0.00 H new ATOM 0 HA HIS A 17 88.892 -11.898 -3.909 1.00 0.00 H new ATOM 0 HB2 HIS A 17 88.540 -10.967 -6.794 1.00 0.00 H new ATOM 0 HB3 HIS A 17 88.713 -12.658 -6.370 1.00 0.00 H new ATOM 0 HD2 HIS A 17 85.764 -11.718 -7.484 1.00 0.00 H new ATOM 0 HE1 HIS A 17 84.529 -11.938 -3.452 1.00 0.00 H new ATOM 0 HE2 HIS A 17 83.693 -11.875 -5.869 1.00 0.00 H new ATOM 264 N LYS A 18 91.417 -10.557 -5.464 1.00 0.00 N ATOM 265 CA LYS A 18 92.856 -10.790 -5.719 1.00 0.00 C ATOM 266 C LYS A 18 93.472 -11.245 -4.404 1.00 0.00 C ATOM 267 O LYS A 18 94.273 -12.157 -4.355 1.00 0.00 O ATOM 268 CB LYS A 18 93.513 -9.488 -6.166 1.00 0.00 C ATOM 269 CG LYS A 18 94.977 -9.752 -6.507 1.00 0.00 C ATOM 270 CD LYS A 18 95.646 -8.443 -6.914 1.00 0.00 C ATOM 271 CE LYS A 18 97.121 -8.700 -7.211 1.00 0.00 C ATOM 272 NZ LYS A 18 97.245 -9.623 -8.374 1.00 0.00 N ATOM 0 H LYS A 18 91.083 -9.609 -5.637 1.00 0.00 H new ATOM 0 HA LYS A 18 93.000 -11.537 -6.499 1.00 0.00 H new ATOM 0 HB2 LYS A 18 92.993 -9.084 -7.035 1.00 0.00 H new ATOM 0 HB3 LYS A 18 93.441 -8.741 -5.376 1.00 0.00 H new ATOM 0 HG2 LYS A 18 95.490 -10.184 -5.648 1.00 0.00 H new ATOM 0 HG3 LYS A 18 95.048 -10.477 -7.318 1.00 0.00 H new ATOM 0 HD2 LYS A 18 95.153 -8.028 -7.793 1.00 0.00 H new ATOM 0 HD3 LYS A 18 95.547 -7.707 -6.116 1.00 0.00 H new ATOM 0 HE2 LYS A 18 97.628 -7.759 -7.425 1.00 0.00 H new ATOM 0 HE3 LYS A 18 97.608 -9.133 -6.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 98.201 -9.548 -8.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 97.076 -10.600 -8.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 96.544 -9.365 -9.098 1.00 0.00 H new ATOM 286 N TYR A 19 93.059 -10.637 -3.324 1.00 0.00 N ATOM 287 CA TYR A 19 93.575 -11.056 -1.996 1.00 0.00 C ATOM 288 C TYR A 19 92.984 -12.427 -1.691 1.00 0.00 C ATOM 289 O TYR A 19 93.638 -13.292 -1.139 1.00 0.00 O ATOM 290 CB TYR A 19 93.140 -10.052 -0.922 1.00 0.00 C ATOM 291 CG TYR A 19 93.876 -8.744 -1.116 1.00 0.00 C ATOM 292 CD1 TYR A 19 95.114 -8.531 -0.495 1.00 0.00 C ATOM 293 CD2 TYR A 19 93.309 -7.739 -1.907 1.00 0.00 C ATOM 294 CE1 TYR A 19 95.785 -7.310 -0.668 1.00 0.00 C ATOM 295 CE2 TYR A 19 93.977 -6.522 -2.083 1.00 0.00 C ATOM 296 CZ TYR A 19 95.216 -6.306 -1.464 1.00 0.00 C ATOM 297 OH TYR A 19 95.875 -5.104 -1.633 1.00 0.00 O ATOM 0 H TYR A 19 92.387 -9.870 -3.308 1.00 0.00 H new ATOM 0 HA TYR A 19 94.664 -11.096 -2.003 1.00 0.00 H new ATOM 0 HB2 TYR A 19 92.064 -9.887 -0.980 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.348 -10.453 0.070 1.00 0.00 H new ATOM 0 HD1 TYR A 19 95.552 -9.306 0.117 1.00 0.00 H new ATOM 0 HD2 TYR A 19 92.353 -7.903 -2.383 1.00 0.00 H new ATOM 0 HE1 TYR A 19 96.738 -7.144 -0.188 1.00 0.00 H new ATOM 0 HE2 TYR A 19 93.538 -5.749 -2.696 1.00 0.00 H new ATOM 0 HH TYR A 19 95.937 -4.896 -2.589 1.00 0.00 H new ATOM 307 N SER A 20 91.740 -12.631 -2.041 1.00 0.00 N ATOM 308 CA SER A 20 91.094 -13.945 -1.771 1.00 0.00 C ATOM 309 C SER A 20 91.337 -14.335 -0.317 1.00 0.00 C ATOM 310 O SER A 20 91.095 -15.455 0.088 1.00 0.00 O ATOM 311 CB SER A 20 91.700 -15.005 -2.686 1.00 0.00 C ATOM 312 OG SER A 20 91.084 -16.257 -2.423 1.00 0.00 O ATOM 0 H SER A 20 91.145 -11.942 -2.502 1.00 0.00 H new ATOM 0 HA SER A 20 90.023 -13.872 -1.958 1.00 0.00 H new ATOM 0 HB2 SER A 20 91.555 -14.727 -3.730 1.00 0.00 H new ATOM 0 HB3 SER A 20 92.775 -15.073 -2.521 1.00 0.00 H new ATOM 0 HG SER A 20 90.895 -16.334 -1.464 1.00 0.00 H new ATOM 318 N GLY A 21 91.822 -13.422 0.472 1.00 0.00 N ATOM 319 CA GLY A 21 92.089 -13.749 1.902 1.00 0.00 C ATOM 320 C GLY A 21 93.316 -14.657 1.989 1.00 0.00 C ATOM 321 O GLY A 21 93.218 -15.826 2.304 1.00 0.00 O ATOM 0 H GLY A 21 92.045 -12.467 0.193 1.00 0.00 H new ATOM 0 HA2 GLY A 21 92.257 -12.835 2.471 1.00 0.00 H new ATOM 0 HA3 GLY A 21 91.223 -14.244 2.342 1.00 0.00 H new ATOM 325 N LYS A 22 94.472 -14.127 1.696 1.00 0.00 N ATOM 326 CA LYS A 22 95.714 -14.946 1.744 1.00 0.00 C ATOM 327 C LYS A 22 95.922 -15.490 3.161 1.00 0.00 C ATOM 328 O LYS A 22 96.317 -16.623 3.347 1.00 0.00 O ATOM 329 CB LYS A 22 96.902 -14.074 1.334 1.00 0.00 C ATOM 330 CG LYS A 22 96.739 -13.674 -0.136 1.00 0.00 C ATOM 331 CD LYS A 22 97.911 -12.797 -0.588 1.00 0.00 C ATOM 332 CE LYS A 22 97.952 -11.501 0.228 1.00 0.00 C ATOM 333 NZ LYS A 22 98.667 -10.454 -0.554 1.00 0.00 N ATOM 0 H LYS A 22 94.609 -13.154 1.423 1.00 0.00 H new ATOM 0 HA LYS A 22 95.628 -15.788 1.057 1.00 0.00 H new ATOM 0 HB2 LYS A 22 96.952 -13.185 1.963 1.00 0.00 H new ATOM 0 HB3 LYS A 22 97.836 -14.618 1.475 1.00 0.00 H new ATOM 0 HG2 LYS A 22 96.685 -14.567 -0.758 1.00 0.00 H new ATOM 0 HG3 LYS A 22 95.801 -13.135 -0.270 1.00 0.00 H new ATOM 0 HD2 LYS A 22 98.848 -13.340 -0.467 1.00 0.00 H new ATOM 0 HD3 LYS A 22 97.812 -12.564 -1.648 1.00 0.00 H new ATOM 0 HE2 LYS A 22 96.939 -11.171 0.460 1.00 0.00 H new ATOM 0 HE3 LYS A 22 98.458 -11.671 1.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 98.698 -9.571 -0.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 99.637 -10.772 -0.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 98.166 -10.287 -1.450 1.00 0.00 H new ATOM 347 N GLU A 23 95.653 -14.687 4.161 1.00 0.00 N ATOM 348 CA GLU A 23 95.827 -15.142 5.578 1.00 0.00 C ATOM 349 C GLU A 23 94.455 -15.391 6.208 1.00 0.00 C ATOM 350 O GLU A 23 93.517 -14.648 5.999 1.00 0.00 O ATOM 351 CB GLU A 23 96.557 -14.060 6.374 1.00 0.00 C ATOM 352 CG GLU A 23 96.906 -14.588 7.771 1.00 0.00 C ATOM 353 CD GLU A 23 97.972 -15.679 7.654 1.00 0.00 C ATOM 354 OE1 GLU A 23 98.696 -15.671 6.670 1.00 0.00 O ATOM 355 OE2 GLU A 23 98.053 -16.498 8.554 1.00 0.00 O ATOM 0 H GLU A 23 95.318 -13.729 4.057 1.00 0.00 H new ATOM 0 HA GLU A 23 96.408 -16.064 5.592 1.00 0.00 H new ATOM 0 HB2 GLU A 23 97.465 -13.761 5.851 1.00 0.00 H new ATOM 0 HB3 GLU A 23 95.931 -13.172 6.457 1.00 0.00 H new ATOM 0 HG2 GLU A 23 97.271 -13.774 8.398 1.00 0.00 H new ATOM 0 HG3 GLU A 23 96.014 -14.987 8.254 1.00 0.00 H new ATOM 362 N GLY A 24 94.339 -16.430 6.986 1.00 0.00 N ATOM 363 CA GLY A 24 93.033 -16.736 7.643 1.00 0.00 C ATOM 364 C GLY A 24 92.068 -17.349 6.624 1.00 0.00 C ATOM 365 O GLY A 24 92.479 -17.868 5.605 1.00 0.00 O ATOM 0 H GLY A 24 95.093 -17.084 7.197 1.00 0.00 H new ATOM 0 HA2 GLY A 24 93.186 -17.426 8.473 1.00 0.00 H new ATOM 0 HA3 GLY A 24 92.604 -15.825 8.061 1.00 0.00 H new ATOM 369 N ASP A 25 90.786 -17.291 6.886 1.00 0.00 N ATOM 370 CA ASP A 25 89.807 -17.871 5.922 1.00 0.00 C ATOM 371 C ASP A 25 89.964 -17.167 4.584 1.00 0.00 C ATOM 372 O ASP A 25 90.093 -15.961 4.514 1.00 0.00 O ATOM 373 CB ASP A 25 88.383 -17.674 6.450 1.00 0.00 C ATOM 374 CG ASP A 25 88.157 -18.579 7.662 1.00 0.00 C ATOM 375 OD1 ASP A 25 88.884 -19.547 7.796 1.00 0.00 O ATOM 376 OD2 ASP A 25 87.256 -18.293 8.432 1.00 0.00 O ATOM 0 H ASP A 25 90.379 -16.869 7.721 1.00 0.00 H new ATOM 0 HA ASP A 25 89.992 -18.938 5.801 1.00 0.00 H new ATOM 0 HB2 ASP A 25 88.228 -16.631 6.728 1.00 0.00 H new ATOM 0 HB3 ASP A 25 87.659 -17.907 5.669 1.00 0.00 H new ATOM 381 N LYS A 26 89.965 -17.912 3.519 1.00 0.00 N ATOM 382 CA LYS A 26 90.130 -17.284 2.187 1.00 0.00 C ATOM 383 C LYS A 26 88.878 -16.484 1.863 1.00 0.00 C ATOM 384 O LYS A 26 88.876 -15.633 0.995 1.00 0.00 O ATOM 385 CB LYS A 26 90.348 -18.364 1.124 1.00 0.00 C ATOM 386 CG LYS A 26 91.718 -19.016 1.330 1.00 0.00 C ATOM 387 CD LYS A 26 91.944 -20.088 0.262 1.00 0.00 C ATOM 388 CE LYS A 26 93.315 -20.735 0.472 1.00 0.00 C ATOM 389 NZ LYS A 26 93.542 -21.772 -0.574 1.00 0.00 N ATOM 0 H LYS A 26 89.859 -18.926 3.514 1.00 0.00 H new ATOM 0 HA LYS A 26 90.997 -16.624 2.196 1.00 0.00 H new ATOM 0 HB2 LYS A 26 89.562 -19.117 1.189 1.00 0.00 H new ATOM 0 HB3 LYS A 26 90.288 -17.926 0.128 1.00 0.00 H new ATOM 0 HG2 LYS A 26 92.503 -18.262 1.274 1.00 0.00 H new ATOM 0 HG3 LYS A 26 91.774 -19.461 2.323 1.00 0.00 H new ATOM 0 HD2 LYS A 26 91.161 -20.844 0.318 1.00 0.00 H new ATOM 0 HD3 LYS A 26 91.888 -19.644 -0.732 1.00 0.00 H new ATOM 0 HE2 LYS A 26 94.097 -19.978 0.424 1.00 0.00 H new ATOM 0 HE3 LYS A 26 93.368 -21.186 1.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 94.474 -22.211 -0.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 92.802 -22.500 -0.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 93.509 -21.329 -1.515 1.00 0.00 H new ATOM 403 N PHE A 27 87.808 -16.747 2.561 1.00 0.00 N ATOM 404 CA PHE A 27 86.546 -15.997 2.298 1.00 0.00 C ATOM 405 C PHE A 27 86.539 -14.712 3.129 1.00 0.00 C ATOM 406 O PHE A 27 85.643 -13.900 3.019 1.00 0.00 O ATOM 407 CB PHE A 27 85.340 -16.866 2.681 1.00 0.00 C ATOM 408 CG PHE A 27 84.066 -16.114 2.381 1.00 0.00 C ATOM 409 CD1 PHE A 27 83.485 -16.201 1.110 1.00 0.00 C ATOM 410 CD2 PHE A 27 83.470 -15.320 3.369 1.00 0.00 C ATOM 411 CE1 PHE A 27 82.307 -15.498 0.829 1.00 0.00 C ATOM 412 CE2 PHE A 27 82.294 -14.616 3.086 1.00 0.00 C ATOM 413 CZ PHE A 27 81.712 -14.705 1.816 1.00 0.00 C ATOM 0 H PHE A 27 87.752 -17.447 3.301 1.00 0.00 H new ATOM 0 HA PHE A 27 86.485 -15.746 1.239 1.00 0.00 H new ATOM 0 HB2 PHE A 27 85.362 -17.803 2.125 1.00 0.00 H new ATOM 0 HB3 PHE A 27 85.384 -17.122 3.740 1.00 0.00 H new ATOM 0 HD1 PHE A 27 83.945 -16.810 0.346 1.00 0.00 H new ATOM 0 HD2 PHE A 27 83.918 -15.251 4.349 1.00 0.00 H new ATOM 0 HE1 PHE A 27 81.857 -15.568 -0.150 1.00 0.00 H new ATOM 0 HE2 PHE A 27 81.835 -14.004 3.848 1.00 0.00 H new ATOM 0 HZ PHE A 27 80.804 -14.162 1.598 1.00 0.00 H new ATOM 423 N LYS A 28 87.529 -14.529 3.973 1.00 0.00 N ATOM 424 CA LYS A 28 87.575 -13.300 4.832 1.00 0.00 C ATOM 425 C LYS A 28 88.994 -12.715 4.850 1.00 0.00 C ATOM 426 O LYS A 28 89.956 -13.380 4.522 1.00 0.00 O ATOM 427 CB LYS A 28 87.172 -13.689 6.249 1.00 0.00 C ATOM 428 CG LYS A 28 85.837 -14.429 6.200 1.00 0.00 C ATOM 429 CD LYS A 28 85.410 -14.830 7.615 1.00 0.00 C ATOM 430 CE LYS A 28 84.164 -15.730 7.553 1.00 0.00 C ATOM 431 NZ LYS A 28 84.590 -17.157 7.502 1.00 0.00 N ATOM 0 H LYS A 28 88.306 -15.177 4.104 1.00 0.00 H new ATOM 0 HA LYS A 28 86.894 -12.549 4.432 1.00 0.00 H new ATOM 0 HB2 LYS A 28 87.937 -14.322 6.698 1.00 0.00 H new ATOM 0 HB3 LYS A 28 87.087 -12.800 6.874 1.00 0.00 H new ATOM 0 HG2 LYS A 28 85.076 -13.794 5.748 1.00 0.00 H new ATOM 0 HG3 LYS A 28 85.926 -15.316 5.573 1.00 0.00 H new ATOM 0 HD2 LYS A 28 86.224 -15.356 8.114 1.00 0.00 H new ATOM 0 HD3 LYS A 28 85.196 -13.939 8.206 1.00 0.00 H new ATOM 0 HE2 LYS A 28 83.533 -15.558 8.425 1.00 0.00 H new ATOM 0 HE3 LYS A 28 83.567 -15.485 6.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 83.891 -17.746 7.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 84.659 -17.463 6.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 85.517 -17.259 7.962 1.00 0.00 H new ATOM 445 N LEU A 29 89.124 -11.463 5.237 1.00 0.00 N ATOM 446 CA LEU A 29 90.467 -10.798 5.289 1.00 0.00 C ATOM 447 C LEU A 29 90.763 -10.403 6.746 1.00 0.00 C ATOM 448 O LEU A 29 89.873 -10.304 7.563 1.00 0.00 O ATOM 449 CB LEU A 29 90.431 -9.550 4.368 1.00 0.00 C ATOM 450 CG LEU A 29 91.273 -9.768 3.094 1.00 0.00 C ATOM 451 CD1 LEU A 29 90.812 -8.797 1.990 1.00 0.00 C ATOM 452 CD2 LEU A 29 92.744 -9.505 3.422 1.00 0.00 C ATOM 0 H LEU A 29 88.346 -10.869 5.522 1.00 0.00 H new ATOM 0 HA LEU A 29 91.255 -11.468 4.943 1.00 0.00 H new ATOM 0 HB2 LEU A 29 89.400 -9.329 4.092 1.00 0.00 H new ATOM 0 HB3 LEU A 29 90.808 -8.684 4.911 1.00 0.00 H new ATOM 0 HG LEU A 29 91.147 -10.792 2.743 1.00 0.00 H new ATOM 0 HD11 LEU A 29 91.410 -8.956 1.093 1.00 0.00 H new ATOM 0 HD12 LEU A 29 89.761 -8.977 1.762 1.00 0.00 H new ATOM 0 HD13 LEU A 29 90.938 -7.770 2.333 1.00 0.00 H new ATOM 0 HD21 LEU A 29 93.349 -9.656 2.528 1.00 0.00 H new ATOM 0 HD22 LEU A 29 92.861 -8.479 3.770 1.00 0.00 H new ATOM 0 HD23 LEU A 29 93.071 -10.192 4.202 1.00 0.00 H new ATOM 464 N ASN A 30 92.013 -10.198 7.073 1.00 0.00 N ATOM 465 CA ASN A 30 92.389 -9.825 8.469 1.00 0.00 C ATOM 466 C ASN A 30 92.610 -8.315 8.569 1.00 0.00 C ATOM 467 O ASN A 30 93.263 -7.708 7.744 1.00 0.00 O ATOM 468 CB ASN A 30 93.682 -10.547 8.858 1.00 0.00 C ATOM 469 CG ASN A 30 93.408 -12.043 9.017 1.00 0.00 C ATOM 470 OD1 ASN A 30 92.309 -12.440 9.353 1.00 0.00 O ATOM 471 ND2 ASN A 30 94.369 -12.894 8.794 1.00 0.00 N ATOM 0 H ASN A 30 92.797 -10.274 6.425 1.00 0.00 H new ATOM 0 HA ASN A 30 91.583 -10.116 9.142 1.00 0.00 H new ATOM 0 HB2 ASN A 30 94.444 -10.386 8.095 1.00 0.00 H new ATOM 0 HB3 ASN A 30 94.072 -10.138 9.790 1.00 0.00 H new ATOM 0 HD21 ASN A 30 94.200 -13.894 8.901 1.00 0.00 H new ATOM 0 HD22 ASN A 30 95.291 -12.560 8.512 1.00 0.00 H new ATOM 478 N LYS A 31 92.068 -7.713 9.585 1.00 0.00 N ATOM 479 CA LYS A 31 92.221 -6.246 9.784 1.00 0.00 C ATOM 480 C LYS A 31 93.671 -5.835 9.550 1.00 0.00 C ATOM 481 O LYS A 31 93.950 -4.768 9.067 1.00 0.00 O ATOM 482 CB LYS A 31 91.834 -5.903 11.222 1.00 0.00 C ATOM 483 CG LYS A 31 92.727 -6.693 12.185 1.00 0.00 C ATOM 484 CD LYS A 31 92.220 -6.522 13.619 1.00 0.00 C ATOM 485 CE LYS A 31 93.233 -7.123 14.599 1.00 0.00 C ATOM 486 NZ LYS A 31 93.239 -8.606 14.460 1.00 0.00 N ATOM 0 H LYS A 31 91.514 -8.183 10.301 1.00 0.00 H new ATOM 0 HA LYS A 31 91.580 -5.716 9.079 1.00 0.00 H new ATOM 0 HB2 LYS A 31 91.947 -4.833 11.397 1.00 0.00 H new ATOM 0 HB3 LYS A 31 90.786 -6.145 11.397 1.00 0.00 H new ATOM 0 HG2 LYS A 31 92.727 -7.748 11.913 1.00 0.00 H new ATOM 0 HG3 LYS A 31 93.757 -6.344 12.109 1.00 0.00 H new ATOM 0 HD2 LYS A 31 92.070 -5.465 13.838 1.00 0.00 H new ATOM 0 HD3 LYS A 31 91.253 -7.012 13.734 1.00 0.00 H new ATOM 0 HE2 LYS A 31 94.228 -6.724 14.400 1.00 0.00 H new ATOM 0 HE3 LYS A 31 92.976 -6.844 15.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 93.582 -9.036 15.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 92.274 -8.940 14.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 93.865 -8.879 13.676 1.00 0.00 H new ATOM 500 N SER A 32 94.605 -6.663 9.875 1.00 0.00 N ATOM 501 CA SER A 32 96.011 -6.262 9.638 1.00 0.00 C ATOM 502 C SER A 32 96.198 -6.071 8.146 1.00 0.00 C ATOM 503 O SER A 32 96.859 -5.156 7.699 1.00 0.00 O ATOM 504 CB SER A 32 96.974 -7.318 10.140 1.00 0.00 C ATOM 505 OG SER A 32 96.685 -8.561 9.515 1.00 0.00 O ATOM 0 H SER A 32 94.466 -7.585 10.288 1.00 0.00 H new ATOM 0 HA SER A 32 96.220 -5.339 10.179 1.00 0.00 H new ATOM 0 HB2 SER A 32 98.000 -7.021 9.925 1.00 0.00 H new ATOM 0 HB3 SER A 32 96.891 -7.416 11.222 1.00 0.00 H new ATOM 0 HG SER A 32 97.310 -9.243 9.839 1.00 0.00 H new ATOM 511 N GLU A 33 95.586 -6.914 7.366 1.00 0.00 N ATOM 512 CA GLU A 33 95.701 -6.757 5.902 1.00 0.00 C ATOM 513 C GLU A 33 95.085 -5.428 5.543 1.00 0.00 C ATOM 514 O GLU A 33 95.378 -4.862 4.518 1.00 0.00 O ATOM 515 CB GLU A 33 95.011 -7.910 5.175 1.00 0.00 C ATOM 516 CG GLU A 33 95.808 -9.201 5.394 1.00 0.00 C ATOM 517 CD GLU A 33 97.147 -9.107 4.660 1.00 0.00 C ATOM 518 OE1 GLU A 33 97.198 -8.431 3.645 1.00 0.00 O ATOM 519 OE2 GLU A 33 98.100 -9.710 5.129 1.00 0.00 O ATOM 0 H GLU A 33 95.016 -7.699 7.681 1.00 0.00 H new ATOM 0 HA GLU A 33 96.746 -6.779 5.593 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.993 -8.031 5.546 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.938 -7.691 4.110 1.00 0.00 H new ATOM 0 HG2 GLU A 33 95.976 -9.361 6.459 1.00 0.00 H new ATOM 0 HG3 GLU A 33 95.241 -10.057 5.029 1.00 0.00 H new ATOM 526 N LEU A 34 94.259 -4.882 6.391 1.00 0.00 N ATOM 527 CA LEU A 34 93.707 -3.549 6.043 1.00 0.00 C ATOM 528 C LEU A 34 94.900 -2.617 5.912 1.00 0.00 C ATOM 529 O LEU A 34 94.976 -1.816 5.003 1.00 0.00 O ATOM 530 CB LEU A 34 92.763 -3.036 7.150 1.00 0.00 C ATOM 531 CG LEU A 34 92.208 -1.617 6.852 1.00 0.00 C ATOM 532 CD1 LEU A 34 93.249 -0.517 7.190 1.00 0.00 C ATOM 533 CD2 LEU A 34 91.784 -1.503 5.381 1.00 0.00 C ATOM 0 H LEU A 34 93.952 -5.284 7.277 1.00 0.00 H new ATOM 0 HA LEU A 34 93.127 -3.600 5.122 1.00 0.00 H new ATOM 0 HB2 LEU A 34 91.931 -3.731 7.264 1.00 0.00 H new ATOM 0 HB3 LEU A 34 93.298 -3.021 8.100 1.00 0.00 H new ATOM 0 HG LEU A 34 91.336 -1.465 7.488 1.00 0.00 H new ATOM 0 HD11 LEU A 34 92.827 0.463 6.969 1.00 0.00 H new ATOM 0 HD12 LEU A 34 93.506 -0.572 8.248 1.00 0.00 H new ATOM 0 HD13 LEU A 34 94.147 -0.669 6.591 1.00 0.00 H new ATOM 0 HD21 LEU A 34 91.398 -0.502 5.190 1.00 0.00 H new ATOM 0 HD22 LEU A 34 92.645 -1.688 4.739 1.00 0.00 H new ATOM 0 HD23 LEU A 34 91.008 -2.238 5.168 1.00 0.00 H new ATOM 545 N LYS A 35 95.862 -2.738 6.794 1.00 0.00 N ATOM 546 CA LYS A 35 97.055 -1.862 6.669 1.00 0.00 C ATOM 547 C LYS A 35 97.798 -2.194 5.374 1.00 0.00 C ATOM 548 O LYS A 35 98.091 -1.330 4.579 1.00 0.00 O ATOM 549 CB LYS A 35 97.986 -2.086 7.863 1.00 0.00 C ATOM 550 CG LYS A 35 99.191 -1.149 7.762 1.00 0.00 C ATOM 551 CD LYS A 35 100.112 -1.385 8.958 1.00 0.00 C ATOM 552 CE LYS A 35 101.316 -0.446 8.875 1.00 0.00 C ATOM 553 NZ LYS A 35 102.277 -0.956 7.857 1.00 0.00 N ATOM 0 H LYS A 35 95.870 -3.392 7.577 1.00 0.00 H new ATOM 0 HA LYS A 35 96.737 -0.820 6.650 1.00 0.00 H new ATOM 0 HB2 LYS A 35 97.449 -1.904 8.794 1.00 0.00 H new ATOM 0 HB3 LYS A 35 98.321 -3.123 7.886 1.00 0.00 H new ATOM 0 HG2 LYS A 35 99.730 -1.329 6.832 1.00 0.00 H new ATOM 0 HG3 LYS A 35 98.859 -0.111 7.743 1.00 0.00 H new ATOM 0 HD2 LYS A 35 99.568 -1.214 9.887 1.00 0.00 H new ATOM 0 HD3 LYS A 35 100.448 -2.422 8.972 1.00 0.00 H new ATOM 0 HE2 LYS A 35 100.989 0.559 8.610 1.00 0.00 H new ATOM 0 HE3 LYS A 35 101.803 -0.376 9.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 103.147 -0.386 7.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 102.507 -1.949 8.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 101.849 -0.889 6.911 1.00 0.00 H new ATOM 567 N GLU A 36 98.114 -3.441 5.157 1.00 0.00 N ATOM 568 CA GLU A 36 98.850 -3.815 3.915 1.00 0.00 C ATOM 569 C GLU A 36 97.966 -3.606 2.694 1.00 0.00 C ATOM 570 O GLU A 36 98.391 -3.073 1.689 1.00 0.00 O ATOM 571 CB GLU A 36 99.273 -5.284 4.007 1.00 0.00 C ATOM 572 CG GLU A 36 99.883 -5.740 2.679 1.00 0.00 C ATOM 573 CD GLU A 36 100.535 -7.111 2.863 1.00 0.00 C ATOM 574 OE1 GLU A 36 100.580 -7.577 3.990 1.00 0.00 O ATOM 575 OE2 GLU A 36 100.980 -7.670 1.874 1.00 0.00 O ATOM 0 H GLU A 36 97.895 -4.216 5.784 1.00 0.00 H new ATOM 0 HA GLU A 36 99.733 -3.183 3.815 1.00 0.00 H new ATOM 0 HB2 GLU A 36 99.997 -5.412 4.812 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.411 -5.904 4.252 1.00 0.00 H new ATOM 0 HG2 GLU A 36 99.111 -5.792 1.911 1.00 0.00 H new ATOM 0 HG3 GLU A 36 100.623 -5.016 2.339 1.00 0.00 H new ATOM 582 N LEU A 37 96.739 -4.007 2.776 1.00 0.00 N ATOM 583 CA LEU A 37 95.826 -3.822 1.632 1.00 0.00 C ATOM 584 C LEU A 37 95.659 -2.335 1.397 1.00 0.00 C ATOM 585 O LEU A 37 95.572 -1.875 0.276 1.00 0.00 O ATOM 586 CB LEU A 37 94.466 -4.461 1.948 1.00 0.00 C ATOM 587 CG LEU A 37 93.508 -4.335 0.728 1.00 0.00 C ATOM 588 CD1 LEU A 37 92.618 -5.580 0.644 1.00 0.00 C ATOM 589 CD2 LEU A 37 92.603 -3.093 0.858 1.00 0.00 C ATOM 0 H LEU A 37 96.327 -4.458 3.593 1.00 0.00 H new ATOM 0 HA LEU A 37 96.233 -4.297 0.740 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.602 -5.512 2.204 1.00 0.00 H new ATOM 0 HB3 LEU A 37 94.023 -3.976 2.818 1.00 0.00 H new ATOM 0 HG LEU A 37 94.118 -4.238 -0.170 1.00 0.00 H new ATOM 0 HD11 LEU A 37 91.947 -5.491 -0.211 1.00 0.00 H new ATOM 0 HD12 LEU A 37 93.242 -6.466 0.525 1.00 0.00 H new ATOM 0 HD13 LEU A 37 92.031 -5.670 1.558 1.00 0.00 H new ATOM 0 HD21 LEU A 37 91.944 -3.030 -0.008 1.00 0.00 H new ATOM 0 HD22 LEU A 37 92.003 -3.173 1.765 1.00 0.00 H new ATOM 0 HD23 LEU A 37 93.221 -2.196 0.910 1.00 0.00 H new ATOM 601 N LEU A 38 95.582 -1.574 2.453 1.00 0.00 N ATOM 602 CA LEU A 38 95.382 -0.107 2.267 1.00 0.00 C ATOM 603 C LEU A 38 96.540 0.511 1.471 1.00 0.00 C ATOM 604 O LEU A 38 96.329 1.233 0.518 1.00 0.00 O ATOM 605 CB LEU A 38 95.243 0.587 3.627 1.00 0.00 C ATOM 606 CG LEU A 38 95.172 2.110 3.443 1.00 0.00 C ATOM 607 CD1 LEU A 38 94.087 2.465 2.415 1.00 0.00 C ATOM 608 CD2 LEU A 38 94.822 2.753 4.787 1.00 0.00 C ATOM 0 H LEU A 38 95.647 -1.894 3.419 1.00 0.00 H new ATOM 0 HA LEU A 38 94.463 0.040 1.699 1.00 0.00 H new ATOM 0 HB2 LEU A 38 94.345 0.233 4.134 1.00 0.00 H new ATOM 0 HB3 LEU A 38 96.090 0.330 4.263 1.00 0.00 H new ATOM 0 HG LEU A 38 96.134 2.479 3.087 1.00 0.00 H new ATOM 0 HD11 LEU A 38 94.044 3.547 2.291 1.00 0.00 H new ATOM 0 HD12 LEU A 38 94.325 1.999 1.459 1.00 0.00 H new ATOM 0 HD13 LEU A 38 93.121 2.101 2.765 1.00 0.00 H new ATOM 0 HD21 LEU A 38 94.769 3.835 4.670 1.00 0.00 H new ATOM 0 HD22 LEU A 38 93.858 2.377 5.130 1.00 0.00 H new ATOM 0 HD23 LEU A 38 95.590 2.505 5.520 1.00 0.00 H new ATOM 620 N THR A 39 97.761 0.252 1.849 1.00 0.00 N ATOM 621 CA THR A 39 98.905 0.854 1.098 1.00 0.00 C ATOM 622 C THR A 39 99.091 0.157 -0.234 1.00 0.00 C ATOM 623 O THR A 39 99.527 0.745 -1.203 1.00 0.00 O ATOM 624 CB THR A 39 100.193 0.685 1.891 1.00 0.00 C ATOM 625 OG1 THR A 39 100.564 -0.688 1.901 1.00 0.00 O ATOM 626 CG2 THR A 39 99.974 1.158 3.312 1.00 0.00 C ATOM 0 H THR A 39 98.018 -0.343 2.636 1.00 0.00 H new ATOM 0 HA THR A 39 98.684 1.910 0.942 1.00 0.00 H new ATOM 0 HB THR A 39 100.986 1.273 1.430 1.00 0.00 H new ATOM 0 HG1 THR A 39 101.394 -0.799 2.410 1.00 0.00 H new ATOM 0 HG21 THR A 39 100.896 1.038 3.882 1.00 0.00 H new ATOM 0 HG22 THR A 39 99.686 2.209 3.305 1.00 0.00 H new ATOM 0 HG23 THR A 39 99.182 0.568 3.774 1.00 0.00 H new ATOM 634 N ARG A 40 98.798 -1.102 -0.281 1.00 0.00 N ATOM 635 CA ARG A 40 98.990 -1.851 -1.539 1.00 0.00 C ATOM 636 C ARG A 40 97.964 -1.400 -2.566 1.00 0.00 C ATOM 637 O ARG A 40 98.205 -1.451 -3.757 1.00 0.00 O ATOM 638 CB ARG A 40 98.863 -3.359 -1.289 1.00 0.00 C ATOM 639 CG ARG A 40 100.067 -3.879 -0.483 1.00 0.00 C ATOM 640 CD ARG A 40 101.277 -4.088 -1.405 1.00 0.00 C ATOM 641 NE ARG A 40 102.339 -4.826 -0.666 1.00 0.00 N ATOM 642 CZ ARG A 40 103.323 -5.375 -1.325 1.00 0.00 C ATOM 643 NH1 ARG A 40 103.396 -5.239 -2.618 1.00 0.00 N ATOM 644 NH2 ARG A 40 104.233 -6.058 -0.695 1.00 0.00 N ATOM 0 H ARG A 40 98.433 -1.647 0.500 1.00 0.00 H new ATOM 0 HA ARG A 40 99.991 -1.649 -1.921 1.00 0.00 H new ATOM 0 HB2 ARG A 40 97.940 -3.567 -0.748 1.00 0.00 H new ATOM 0 HB3 ARG A 40 98.801 -3.887 -2.241 1.00 0.00 H new ATOM 0 HG2 ARG A 40 100.320 -3.169 0.304 1.00 0.00 H new ATOM 0 HG3 ARG A 40 99.808 -4.818 0.006 1.00 0.00 H new ATOM 0 HD2 ARG A 40 100.980 -4.647 -2.292 1.00 0.00 H new ATOM 0 HD3 ARG A 40 101.658 -3.126 -1.747 1.00 0.00 H new ATOM 0 HE ARG A 40 102.298 -4.902 0.350 1.00 0.00 H new ATOM 0 HH11 ARG A 40 102.684 -4.704 -3.115 1.00 0.00 H new ATOM 0 HH12 ARG A 40 104.165 -5.668 -3.133 1.00 0.00 H new ATOM 0 HH21 ARG A 40 104.179 -6.166 0.318 1.00 0.00 H new ATOM 0 HH22 ARG A 40 105.000 -6.485 -1.214 1.00 0.00 H new ATOM 658 N GLU A 41 96.818 -0.953 -2.124 1.00 0.00 N ATOM 659 CA GLU A 41 95.778 -0.495 -3.093 1.00 0.00 C ATOM 660 C GLU A 41 95.817 1.007 -3.174 1.00 0.00 C ATOM 661 O GLU A 41 95.379 1.589 -4.144 1.00 0.00 O ATOM 662 CB GLU A 41 94.393 -0.945 -2.628 1.00 0.00 C ATOM 663 CG GLU A 41 94.276 -2.463 -2.768 1.00 0.00 C ATOM 664 CD GLU A 41 94.279 -2.848 -4.251 1.00 0.00 C ATOM 665 OE1 GLU A 41 93.391 -2.407 -4.960 1.00 0.00 O ATOM 666 OE2 GLU A 41 95.177 -3.570 -4.652 1.00 0.00 O ATOM 0 H GLU A 41 96.558 -0.885 -1.140 1.00 0.00 H new ATOM 0 HA GLU A 41 95.978 -0.928 -4.073 1.00 0.00 H new ATOM 0 HB2 GLU A 41 94.233 -0.651 -1.591 1.00 0.00 H new ATOM 0 HB3 GLU A 41 93.621 -0.454 -3.221 1.00 0.00 H new ATOM 0 HG2 GLU A 41 95.105 -2.950 -2.255 1.00 0.00 H new ATOM 0 HG3 GLU A 41 93.359 -2.812 -2.294 1.00 0.00 H new ATOM 673 N LEU A 42 96.351 1.654 -2.175 1.00 0.00 N ATOM 674 CA LEU A 42 96.424 3.144 -2.228 1.00 0.00 C ATOM 675 C LEU A 42 97.712 3.624 -1.546 1.00 0.00 C ATOM 676 O LEU A 42 97.665 4.184 -0.469 1.00 0.00 O ATOM 677 CB LEU A 42 95.226 3.781 -1.504 1.00 0.00 C ATOM 678 CG LEU A 42 93.886 3.406 -2.164 1.00 0.00 C ATOM 679 CD1 LEU A 42 92.736 3.821 -1.241 1.00 0.00 C ATOM 680 CD2 LEU A 42 93.728 4.140 -3.503 1.00 0.00 C ATOM 0 H LEU A 42 96.736 1.224 -1.334 1.00 0.00 H new ATOM 0 HA LEU A 42 96.411 3.443 -3.276 1.00 0.00 H new ATOM 0 HB2 LEU A 42 95.219 3.460 -0.462 1.00 0.00 H new ATOM 0 HB3 LEU A 42 95.338 4.865 -1.502 1.00 0.00 H new ATOM 0 HG LEU A 42 93.868 2.330 -2.336 1.00 0.00 H new ATOM 0 HD11 LEU A 42 91.785 3.558 -1.704 1.00 0.00 H new ATOM 0 HD12 LEU A 42 92.831 3.303 -0.286 1.00 0.00 H new ATOM 0 HD13 LEU A 42 92.773 4.898 -1.075 1.00 0.00 H new ATOM 0 HD21 LEU A 42 92.776 3.865 -3.958 1.00 0.00 H new ATOM 0 HD22 LEU A 42 93.752 5.216 -3.333 1.00 0.00 H new ATOM 0 HD23 LEU A 42 94.543 3.860 -4.170 1.00 0.00 H new ATOM 692 N PRO A 43 98.855 3.411 -2.151 1.00 0.00 N ATOM 693 CA PRO A 43 100.142 3.849 -1.537 1.00 0.00 C ATOM 694 C PRO A 43 100.366 5.369 -1.656 1.00 0.00 C ATOM 695 O PRO A 43 100.253 6.100 -0.692 1.00 0.00 O ATOM 696 CB PRO A 43 101.171 3.064 -2.369 1.00 0.00 C ATOM 697 CG PRO A 43 100.478 2.601 -3.666 1.00 0.00 C ATOM 698 CD PRO A 43 98.953 2.724 -3.469 1.00 0.00 C ATOM 0 HA PRO A 43 100.193 3.659 -0.465 1.00 0.00 H new ATOM 0 HB2 PRO A 43 102.033 3.690 -2.600 1.00 0.00 H new ATOM 0 HB3 PRO A 43 101.541 2.206 -1.807 1.00 0.00 H new ATOM 0 HG2 PRO A 43 100.803 3.211 -4.509 1.00 0.00 H new ATOM 0 HG3 PRO A 43 100.750 1.571 -3.895 1.00 0.00 H new ATOM 0 HD2 PRO A 43 98.486 3.304 -4.265 1.00 0.00 H new ATOM 0 HD3 PRO A 43 98.465 1.749 -3.456 1.00 0.00 H new ATOM 706 N SER A 44 100.694 5.842 -2.831 1.00 0.00 N ATOM 707 CA SER A 44 100.937 7.306 -3.011 1.00 0.00 C ATOM 708 C SER A 44 99.606 8.055 -3.131 1.00 0.00 C ATOM 709 O SER A 44 99.557 9.266 -3.067 1.00 0.00 O ATOM 710 CB SER A 44 101.772 7.538 -4.272 1.00 0.00 C ATOM 711 OG SER A 44 101.081 7.021 -5.401 1.00 0.00 O ATOM 0 H SER A 44 100.804 5.278 -3.674 1.00 0.00 H new ATOM 0 HA SER A 44 101.477 7.682 -2.142 1.00 0.00 H new ATOM 0 HB2 SER A 44 101.961 8.603 -4.405 1.00 0.00 H new ATOM 0 HB3 SER A 44 102.743 7.052 -4.173 1.00 0.00 H new ATOM 0 HG SER A 44 101.615 7.171 -6.209 1.00 0.00 H new ATOM 717 N PHE A 45 98.529 7.346 -3.317 1.00 0.00 N ATOM 718 CA PHE A 45 97.197 8.011 -3.446 1.00 0.00 C ATOM 719 C PHE A 45 96.573 8.194 -2.061 1.00 0.00 C ATOM 720 O PHE A 45 95.553 8.834 -1.905 1.00 0.00 O ATOM 721 CB PHE A 45 96.279 7.122 -4.272 1.00 0.00 C ATOM 722 CG PHE A 45 96.839 6.957 -5.671 1.00 0.00 C ATOM 723 CD1 PHE A 45 96.971 8.073 -6.510 1.00 0.00 C ATOM 724 CD2 PHE A 45 97.224 5.690 -6.131 1.00 0.00 C ATOM 725 CE1 PHE A 45 97.487 7.921 -7.803 1.00 0.00 C ATOM 726 CE2 PHE A 45 97.740 5.539 -7.425 1.00 0.00 C ATOM 727 CZ PHE A 45 97.872 6.655 -8.260 1.00 0.00 C ATOM 0 H PHE A 45 98.511 6.329 -3.386 1.00 0.00 H new ATOM 0 HA PHE A 45 97.325 8.982 -3.925 1.00 0.00 H new ATOM 0 HB2 PHE A 45 96.177 6.147 -3.795 1.00 0.00 H new ATOM 0 HB3 PHE A 45 95.282 7.559 -4.320 1.00 0.00 H new ATOM 0 HD1 PHE A 45 96.675 9.050 -6.159 1.00 0.00 H new ATOM 0 HD2 PHE A 45 97.123 4.829 -5.487 1.00 0.00 H new ATOM 0 HE1 PHE A 45 97.588 8.781 -8.448 1.00 0.00 H new ATOM 0 HE2 PHE A 45 98.036 4.562 -7.778 1.00 0.00 H new ATOM 0 HZ PHE A 45 98.271 6.539 -9.257 1.00 0.00 H new ATOM 737 N LEU A 46 97.173 7.619 -1.062 1.00 0.00 N ATOM 738 CA LEU A 46 96.620 7.733 0.325 1.00 0.00 C ATOM 739 C LEU A 46 97.762 7.558 1.313 1.00 0.00 C ATOM 740 O LEU A 46 97.877 8.277 2.285 1.00 0.00 O ATOM 741 CB LEU A 46 95.563 6.640 0.533 1.00 0.00 C ATOM 742 CG LEU A 46 94.817 6.825 1.881 1.00 0.00 C ATOM 743 CD1 LEU A 46 93.364 6.339 1.739 1.00 0.00 C ATOM 744 CD2 LEU A 46 95.503 6.015 2.996 1.00 0.00 C ATOM 0 H LEU A 46 98.029 7.070 -1.140 1.00 0.00 H new ATOM 0 HA LEU A 46 96.155 8.707 0.477 1.00 0.00 H new ATOM 0 HB2 LEU A 46 94.846 6.664 -0.288 1.00 0.00 H new ATOM 0 HB3 LEU A 46 96.041 5.660 0.511 1.00 0.00 H new ATOM 0 HG LEU A 46 94.837 7.883 2.142 1.00 0.00 H new ATOM 0 HD11 LEU A 46 92.842 6.470 2.687 1.00 0.00 H new ATOM 0 HD12 LEU A 46 92.861 6.918 0.965 1.00 0.00 H new ATOM 0 HD13 LEU A 46 93.358 5.284 1.464 1.00 0.00 H new ATOM 0 HD21 LEU A 46 94.965 6.158 3.933 1.00 0.00 H new ATOM 0 HD22 LEU A 46 95.499 4.957 2.733 1.00 0.00 H new ATOM 0 HD23 LEU A 46 96.532 6.355 3.113 1.00 0.00 H new ATOM 756 N GLY A 47 98.641 6.637 1.042 1.00 0.00 N ATOM 757 CA GLY A 47 99.814 6.453 1.935 1.00 0.00 C ATOM 758 C GLY A 47 100.773 7.583 1.600 1.00 0.00 C ATOM 759 O GLY A 47 101.916 7.613 2.008 1.00 0.00 O ATOM 0 H GLY A 47 98.598 6.005 0.242 1.00 0.00 H new ATOM 0 HA2 GLY A 47 99.517 6.491 2.983 1.00 0.00 H new ATOM 0 HA3 GLY A 47 100.282 5.482 1.771 1.00 0.00 H new ATOM 763 N LYS A 48 100.282 8.505 0.821 1.00 0.00 N ATOM 764 CA LYS A 48 101.086 9.659 0.377 1.00 0.00 C ATOM 765 C LYS A 48 101.821 10.284 1.568 1.00 0.00 C ATOM 766 O LYS A 48 102.758 11.041 1.406 1.00 0.00 O ATOM 767 CB LYS A 48 100.135 10.687 -0.231 1.00 0.00 C ATOM 768 CG LYS A 48 100.932 11.782 -0.932 1.00 0.00 C ATOM 769 CD LYS A 48 99.968 12.658 -1.732 1.00 0.00 C ATOM 770 CE LYS A 48 100.732 13.828 -2.352 1.00 0.00 C ATOM 771 NZ LYS A 48 99.777 14.715 -3.078 1.00 0.00 N ATOM 0 H LYS A 48 99.325 8.499 0.467 1.00 0.00 H new ATOM 0 HA LYS A 48 101.827 9.338 -0.355 1.00 0.00 H new ATOM 0 HB2 LYS A 48 99.466 10.201 -0.941 1.00 0.00 H new ATOM 0 HB3 LYS A 48 99.510 11.123 0.549 1.00 0.00 H new ATOM 0 HG2 LYS A 48 101.470 12.384 -0.200 1.00 0.00 H new ATOM 0 HG3 LYS A 48 101.678 11.341 -1.593 1.00 0.00 H new ATOM 0 HD2 LYS A 48 99.489 12.069 -2.514 1.00 0.00 H new ATOM 0 HD3 LYS A 48 99.176 13.031 -1.083 1.00 0.00 H new ATOM 0 HE2 LYS A 48 101.250 14.391 -1.575 1.00 0.00 H new ATOM 0 HE3 LYS A 48 101.494 13.457 -3.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 100.296 15.511 -3.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 99.303 14.174 -3.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 99.066 15.079 -2.412 1.00 0.00 H new ATOM 785 N ARG A 49 101.388 9.983 2.765 1.00 0.00 N ATOM 786 CA ARG A 49 102.034 10.561 3.985 1.00 0.00 C ATOM 787 C ARG A 49 101.529 12.003 4.173 1.00 0.00 C ATOM 788 O ARG A 49 102.101 12.783 4.906 1.00 0.00 O ATOM 789 CB ARG A 49 103.581 10.546 3.830 1.00 0.00 C ATOM 790 CG ARG A 49 104.267 10.204 5.169 1.00 0.00 C ATOM 791 CD ARG A 49 104.037 11.331 6.178 1.00 0.00 C ATOM 792 NE ARG A 49 104.885 11.110 7.383 1.00 0.00 N ATOM 793 CZ ARG A 49 105.085 12.086 8.228 1.00 0.00 C ATOM 794 NH1 ARG A 49 104.568 13.264 8.002 1.00 0.00 N ATOM 795 NH2 ARG A 49 105.797 11.881 9.304 1.00 0.00 N ATOM 0 H ARG A 49 100.606 9.355 2.953 1.00 0.00 H new ATOM 0 HA ARG A 49 101.774 9.964 4.859 1.00 0.00 H new ATOM 0 HB2 ARG A 49 103.867 9.815 3.073 1.00 0.00 H new ATOM 0 HB3 ARG A 49 103.924 11.519 3.479 1.00 0.00 H new ATOM 0 HG2 ARG A 49 103.871 9.267 5.561 1.00 0.00 H new ATOM 0 HG3 ARG A 49 105.336 10.057 5.012 1.00 0.00 H new ATOM 0 HD2 ARG A 49 104.277 12.292 5.724 1.00 0.00 H new ATOM 0 HD3 ARG A 49 102.986 11.367 6.463 1.00 0.00 H new ATOM 0 HE ARG A 49 105.309 10.197 7.548 1.00 0.00 H new ATOM 0 HH11 ARG A 49 104.007 13.423 7.165 1.00 0.00 H new ATOM 0 HH12 ARG A 49 104.725 14.025 8.663 1.00 0.00 H new ATOM 0 HH21 ARG A 49 106.196 10.960 9.484 1.00 0.00 H new ATOM 0 HH22 ARG A 49 105.954 12.642 9.964 1.00 0.00 H new ATOM 809 N THR A 50 100.462 12.365 3.509 1.00 0.00 N ATOM 810 CA THR A 50 99.929 13.751 3.660 1.00 0.00 C ATOM 811 C THR A 50 99.327 13.921 5.063 1.00 0.00 C ATOM 812 O THR A 50 99.496 14.941 5.701 1.00 0.00 O ATOM 813 CB THR A 50 98.852 14.001 2.604 1.00 0.00 C ATOM 814 OG1 THR A 50 99.419 13.844 1.309 1.00 0.00 O ATOM 815 CG2 THR A 50 98.312 15.425 2.752 1.00 0.00 C ATOM 0 H THR A 50 99.939 11.764 2.872 1.00 0.00 H new ATOM 0 HA THR A 50 100.739 14.468 3.527 1.00 0.00 H new ATOM 0 HB THR A 50 98.038 13.288 2.737 1.00 0.00 H new ATOM 0 HG1 THR A 50 98.855 14.297 0.648 1.00 0.00 H new ATOM 0 HG21 THR A 50 97.544 15.603 1.999 1.00 0.00 H new ATOM 0 HG22 THR A 50 97.882 15.549 3.746 1.00 0.00 H new ATOM 0 HG23 THR A 50 99.125 16.138 2.617 1.00 0.00 H new ATOM 823 N ASP A 51 98.630 12.916 5.545 1.00 0.00 N ATOM 824 CA ASP A 51 98.008 12.987 6.909 1.00 0.00 C ATOM 825 C ASP A 51 98.311 11.690 7.661 1.00 0.00 C ATOM 826 O ASP A 51 97.611 10.704 7.537 1.00 0.00 O ATOM 827 CB ASP A 51 96.491 13.156 6.780 1.00 0.00 C ATOM 828 CG ASP A 51 96.172 14.566 6.280 1.00 0.00 C ATOM 829 OD1 ASP A 51 97.034 15.424 6.396 1.00 0.00 O ATOM 830 OD2 ASP A 51 95.068 14.768 5.798 1.00 0.00 O ATOM 0 H ASP A 51 98.464 12.042 5.047 1.00 0.00 H new ATOM 0 HA ASP A 51 98.418 13.838 7.453 1.00 0.00 H new ATOM 0 HB2 ASP A 51 96.090 12.415 6.089 1.00 0.00 H new ATOM 0 HB3 ASP A 51 96.013 12.984 7.744 1.00 0.00 H new ATOM 835 N GLU A 52 99.359 11.685 8.433 1.00 0.00 N ATOM 836 CA GLU A 52 99.732 10.460 9.193 1.00 0.00 C ATOM 837 C GLU A 52 98.726 10.188 10.314 1.00 0.00 C ATOM 838 O GLU A 52 98.485 9.055 10.676 1.00 0.00 O ATOM 839 CB GLU A 52 101.126 10.654 9.790 1.00 0.00 C ATOM 840 CG GLU A 52 101.115 11.872 10.716 1.00 0.00 C ATOM 841 CD GLU A 52 102.539 12.160 11.197 1.00 0.00 C ATOM 842 OE1 GLU A 52 103.054 11.368 11.967 1.00 0.00 O ATOM 843 OE2 GLU A 52 103.087 13.169 10.787 1.00 0.00 O ATOM 0 H GLU A 52 99.979 12.483 8.572 1.00 0.00 H new ATOM 0 HA GLU A 52 99.728 9.606 8.515 1.00 0.00 H new ATOM 0 HB2 GLU A 52 101.424 9.764 10.344 1.00 0.00 H new ATOM 0 HB3 GLU A 52 101.858 10.794 8.995 1.00 0.00 H new ATOM 0 HG2 GLU A 52 100.715 12.739 10.190 1.00 0.00 H new ATOM 0 HG3 GLU A 52 100.462 11.688 11.569 1.00 0.00 H new ATOM 850 N ALA A 53 98.152 11.209 10.883 1.00 0.00 N ATOM 851 CA ALA A 53 97.186 10.979 11.993 1.00 0.00 C ATOM 852 C ALA A 53 96.014 10.125 11.501 1.00 0.00 C ATOM 853 O ALA A 53 95.725 9.084 12.047 1.00 0.00 O ATOM 854 CB ALA A 53 96.663 12.325 12.500 1.00 0.00 C ATOM 0 H ALA A 53 98.307 12.185 10.631 1.00 0.00 H new ATOM 0 HA ALA A 53 97.691 10.454 12.804 1.00 0.00 H new ATOM 0 HB1 ALA A 53 95.956 12.158 13.312 1.00 0.00 H new ATOM 0 HB2 ALA A 53 97.497 12.926 12.863 1.00 0.00 H new ATOM 0 HB3 ALA A 53 96.163 12.851 11.687 1.00 0.00 H new ATOM 860 N ALA A 54 95.340 10.558 10.474 1.00 0.00 N ATOM 861 CA ALA A 54 94.178 9.778 9.955 1.00 0.00 C ATOM 862 C ALA A 54 94.629 8.387 9.511 1.00 0.00 C ATOM 863 O ALA A 54 93.961 7.401 9.750 1.00 0.00 O ATOM 864 CB ALA A 54 93.575 10.522 8.774 1.00 0.00 C ATOM 0 H ALA A 54 95.542 11.421 9.969 1.00 0.00 H new ATOM 0 HA ALA A 54 93.435 9.666 10.745 1.00 0.00 H new ATOM 0 HB1 ALA A 54 92.725 9.961 8.386 1.00 0.00 H new ATOM 0 HB2 ALA A 54 93.242 11.508 9.097 1.00 0.00 H new ATOM 0 HB3 ALA A 54 94.325 10.631 7.991 1.00 0.00 H new ATOM 870 N PHE A 55 95.764 8.286 8.890 1.00 0.00 N ATOM 871 CA PHE A 55 96.248 6.946 8.474 1.00 0.00 C ATOM 872 C PHE A 55 96.392 6.113 9.732 1.00 0.00 C ATOM 873 O PHE A 55 96.066 4.944 9.772 1.00 0.00 O ATOM 874 CB PHE A 55 97.611 7.089 7.807 1.00 0.00 C ATOM 875 CG PHE A 55 98.126 5.734 7.372 1.00 0.00 C ATOM 876 CD1 PHE A 55 97.717 5.184 6.152 1.00 0.00 C ATOM 877 CD2 PHE A 55 99.022 5.029 8.191 1.00 0.00 C ATOM 878 CE1 PHE A 55 98.200 3.933 5.749 1.00 0.00 C ATOM 879 CE2 PHE A 55 99.507 3.778 7.786 1.00 0.00 C ATOM 880 CZ PHE A 55 99.096 3.231 6.565 1.00 0.00 C ATOM 0 H PHE A 55 96.375 9.067 8.653 1.00 0.00 H new ATOM 0 HA PHE A 55 95.556 6.480 7.772 1.00 0.00 H new ATOM 0 HB2 PHE A 55 97.534 7.751 6.944 1.00 0.00 H new ATOM 0 HB3 PHE A 55 98.316 7.549 8.499 1.00 0.00 H new ATOM 0 HD1 PHE A 55 97.028 5.725 5.520 1.00 0.00 H new ATOM 0 HD2 PHE A 55 99.338 5.451 9.134 1.00 0.00 H new ATOM 0 HE1 PHE A 55 97.881 3.509 4.808 1.00 0.00 H new ATOM 0 HE2 PHE A 55 100.197 3.236 8.416 1.00 0.00 H new ATOM 0 HZ PHE A 55 99.470 2.267 6.252 1.00 0.00 H new ATOM 890 N GLN A 56 96.873 6.732 10.766 1.00 0.00 N ATOM 891 CA GLN A 56 97.044 6.018 12.055 1.00 0.00 C ATOM 892 C GLN A 56 95.672 5.695 12.629 1.00 0.00 C ATOM 893 O GLN A 56 95.521 4.767 13.388 1.00 0.00 O ATOM 894 CB GLN A 56 97.824 6.905 13.035 1.00 0.00 C ATOM 895 CG GLN A 56 98.058 6.162 14.357 1.00 0.00 C ATOM 896 CD GLN A 56 98.890 4.905 14.106 1.00 0.00 C ATOM 897 OE1 GLN A 56 99.963 4.977 13.542 1.00 0.00 O ATOM 898 NE2 GLN A 56 98.441 3.748 14.506 1.00 0.00 N ATOM 0 H GLN A 56 97.158 7.711 10.774 1.00 0.00 H new ATOM 0 HA GLN A 56 97.599 5.094 11.895 1.00 0.00 H new ATOM 0 HB2 GLN A 56 98.780 7.190 12.596 1.00 0.00 H new ATOM 0 HB3 GLN A 56 97.272 7.826 13.221 1.00 0.00 H new ATOM 0 HG2 GLN A 56 98.571 6.813 15.065 1.00 0.00 H new ATOM 0 HG3 GLN A 56 97.103 5.893 14.807 1.00 0.00 H new ATOM 0 HE21 GLN A 56 97.540 3.687 14.980 1.00 0.00 H new ATOM 0 HE22 GLN A 56 98.991 2.904 14.345 1.00 0.00 H new ATOM 907 N LYS A 57 94.673 6.451 12.275 1.00 0.00 N ATOM 908 CA LYS A 57 93.307 6.160 12.812 1.00 0.00 C ATOM 909 C LYS A 57 92.803 4.884 12.177 1.00 0.00 C ATOM 910 O LYS A 57 92.202 4.044 12.819 1.00 0.00 O ATOM 911 CB LYS A 57 92.325 7.288 12.478 1.00 0.00 C ATOM 912 CG LYS A 57 92.663 8.546 13.274 1.00 0.00 C ATOM 913 CD LYS A 57 91.619 9.627 12.977 1.00 0.00 C ATOM 914 CE LYS A 57 92.141 10.986 13.444 1.00 0.00 C ATOM 915 NZ LYS A 57 92.508 10.903 14.885 1.00 0.00 N ATOM 0 H LYS A 57 94.736 7.250 11.644 1.00 0.00 H new ATOM 0 HA LYS A 57 93.374 6.066 13.896 1.00 0.00 H new ATOM 0 HB2 LYS A 57 92.362 7.505 11.411 1.00 0.00 H new ATOM 0 HB3 LYS A 57 91.307 6.970 12.704 1.00 0.00 H new ATOM 0 HG2 LYS A 57 92.679 8.322 14.341 1.00 0.00 H new ATOM 0 HG3 LYS A 57 93.658 8.902 13.008 1.00 0.00 H new ATOM 0 HD2 LYS A 57 91.405 9.656 11.909 1.00 0.00 H new ATOM 0 HD3 LYS A 57 90.683 9.392 13.484 1.00 0.00 H new ATOM 0 HE2 LYS A 57 93.008 11.278 12.852 1.00 0.00 H new ATOM 0 HE3 LYS A 57 91.380 11.752 13.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 92.552 11.861 15.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 91.792 10.346 15.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 93.436 10.444 14.981 1.00 0.00 H new ATOM 929 N LEU A 58 93.065 4.721 10.918 1.00 0.00 N ATOM 930 CA LEU A 58 92.617 3.485 10.244 1.00 0.00 C ATOM 931 C LEU A 58 93.402 2.361 10.871 1.00 0.00 C ATOM 932 O LEU A 58 92.878 1.315 11.186 1.00 0.00 O ATOM 933 CB LEU A 58 92.911 3.566 8.739 1.00 0.00 C ATOM 934 CG LEU A 58 92.148 4.748 8.115 1.00 0.00 C ATOM 935 CD1 LEU A 58 92.669 4.996 6.697 1.00 0.00 C ATOM 936 CD2 LEU A 58 90.645 4.438 8.043 1.00 0.00 C ATOM 0 H LEU A 58 93.567 5.386 10.330 1.00 0.00 H new ATOM 0 HA LEU A 58 91.544 3.333 10.358 1.00 0.00 H new ATOM 0 HB2 LEU A 58 93.982 3.687 8.576 1.00 0.00 H new ATOM 0 HB3 LEU A 58 92.618 2.636 8.252 1.00 0.00 H new ATOM 0 HG LEU A 58 92.303 5.631 8.735 1.00 0.00 H new ATOM 0 HD11 LEU A 58 92.130 5.833 6.253 1.00 0.00 H new ATOM 0 HD12 LEU A 58 93.733 5.229 6.736 1.00 0.00 H new ATOM 0 HD13 LEU A 58 92.515 4.103 6.091 1.00 0.00 H new ATOM 0 HD21 LEU A 58 90.120 5.284 7.599 1.00 0.00 H new ATOM 0 HD22 LEU A 58 90.485 3.550 7.431 1.00 0.00 H new ATOM 0 HD23 LEU A 58 90.262 4.260 9.048 1.00 0.00 H new ATOM 948 N MET A 59 94.654 2.605 11.105 1.00 0.00 N ATOM 949 CA MET A 59 95.497 1.586 11.773 1.00 0.00 C ATOM 950 C MET A 59 95.085 1.502 13.235 1.00 0.00 C ATOM 951 O MET A 59 95.093 0.449 13.839 1.00 0.00 O ATOM 952 CB MET A 59 96.973 1.971 11.658 1.00 0.00 C ATOM 953 CG MET A 59 97.846 0.814 12.144 1.00 0.00 C ATOM 954 SD MET A 59 99.593 1.272 11.990 1.00 0.00 S ATOM 955 CE MET A 59 100.284 -0.101 12.944 1.00 0.00 C ATOM 0 H MET A 59 95.133 3.472 10.861 1.00 0.00 H new ATOM 0 HA MET A 59 95.360 0.616 11.296 1.00 0.00 H new ATOM 0 HB2 MET A 59 97.216 2.213 10.623 1.00 0.00 H new ATOM 0 HB3 MET A 59 97.173 2.864 12.250 1.00 0.00 H new ATOM 0 HG2 MET A 59 97.611 0.577 13.182 1.00 0.00 H new ATOM 0 HG3 MET A 59 97.641 -0.082 11.558 1.00 0.00 H new ATOM 0 HE1 MET A 59 101.370 -0.012 12.976 1.00 0.00 H new ATOM 0 HE2 MET A 59 99.888 -0.075 13.959 1.00 0.00 H new ATOM 0 HE3 MET A 59 100.011 -1.045 12.473 1.00 0.00 H new ATOM 965 N SER A 60 94.714 2.605 13.816 1.00 0.00 N ATOM 966 CA SER A 60 94.293 2.570 15.243 1.00 0.00 C ATOM 967 C SER A 60 93.187 1.537 15.385 1.00 0.00 C ATOM 968 O SER A 60 93.010 0.939 16.428 1.00 0.00 O ATOM 969 CB SER A 60 93.760 3.937 15.676 1.00 0.00 C ATOM 970 OG SER A 60 93.479 3.911 17.068 1.00 0.00 O ATOM 0 H SER A 60 94.683 3.522 13.371 1.00 0.00 H new ATOM 0 HA SER A 60 95.147 2.314 15.870 1.00 0.00 H new ATOM 0 HB2 SER A 60 94.493 4.713 15.456 1.00 0.00 H new ATOM 0 HB3 SER A 60 92.858 4.183 15.116 1.00 0.00 H new ATOM 0 HG SER A 60 93.139 4.786 17.349 1.00 0.00 H new ATOM 976 N ASN A 61 92.443 1.312 14.339 1.00 0.00 N ATOM 977 CA ASN A 61 91.360 0.301 14.430 1.00 0.00 C ATOM 978 C ASN A 61 92.017 -1.068 14.518 1.00 0.00 C ATOM 979 O ASN A 61 91.617 -1.918 15.288 1.00 0.00 O ATOM 980 CB ASN A 61 90.460 0.390 13.195 1.00 0.00 C ATOM 981 CG ASN A 61 89.223 -0.484 13.400 1.00 0.00 C ATOM 982 OD1 ASN A 61 89.252 -1.427 14.166 1.00 0.00 O ATOM 983 ND2 ASN A 61 88.127 -0.205 12.750 1.00 0.00 N ATOM 0 H ASN A 61 92.537 1.779 13.437 1.00 0.00 H new ATOM 0 HA ASN A 61 90.738 0.475 15.308 1.00 0.00 H new ATOM 0 HB2 ASN A 61 90.163 1.424 13.023 1.00 0.00 H new ATOM 0 HB3 ASN A 61 91.006 0.064 12.310 1.00 0.00 H new ATOM 0 HD21 ASN A 61 87.294 -0.778 12.885 1.00 0.00 H new ATOM 0 HD22 ASN A 61 88.103 0.587 12.107 1.00 0.00 H new ATOM 990 N LEU A 62 93.060 -1.267 13.763 1.00 0.00 N ATOM 991 CA LEU A 62 93.785 -2.563 13.838 1.00 0.00 C ATOM 992 C LEU A 62 94.305 -2.698 15.263 1.00 0.00 C ATOM 993 O LEU A 62 94.255 -3.750 15.867 1.00 0.00 O ATOM 994 CB LEU A 62 94.950 -2.570 12.842 1.00 0.00 C ATOM 995 CG LEU A 62 94.426 -2.806 11.422 1.00 0.00 C ATOM 996 CD1 LEU A 62 93.251 -1.874 11.129 1.00 0.00 C ATOM 997 CD2 LEU A 62 95.551 -2.533 10.422 1.00 0.00 C ATOM 0 H LEU A 62 93.440 -0.591 13.100 1.00 0.00 H new ATOM 0 HA LEU A 62 93.128 -3.396 13.586 1.00 0.00 H new ATOM 0 HB2 LEU A 62 95.484 -1.621 12.888 1.00 0.00 H new ATOM 0 HB3 LEU A 62 95.663 -3.350 13.109 1.00 0.00 H new ATOM 0 HG LEU A 62 94.088 -3.838 11.333 1.00 0.00 H new ATOM 0 HD11 LEU A 62 92.889 -2.053 10.117 1.00 0.00 H new ATOM 0 HD12 LEU A 62 92.448 -2.066 11.841 1.00 0.00 H new ATOM 0 HD13 LEU A 62 93.577 -0.838 11.220 1.00 0.00 H new ATOM 0 HD21 LEU A 62 95.185 -2.699 9.409 1.00 0.00 H new ATOM 0 HD22 LEU A 62 95.885 -1.500 10.523 1.00 0.00 H new ATOM 0 HD23 LEU A 62 96.386 -3.205 10.621 1.00 0.00 H new ATOM 1009 N ASP A 63 94.772 -1.605 15.807 1.00 0.00 N ATOM 1010 CA ASP A 63 95.271 -1.600 17.206 1.00 0.00 C ATOM 1011 C ASP A 63 94.099 -1.257 18.125 1.00 0.00 C ATOM 1012 O ASP A 63 94.274 -0.736 19.207 1.00 0.00 O ATOM 1013 CB ASP A 63 96.373 -0.545 17.360 1.00 0.00 C ATOM 1014 CG ASP A 63 97.624 -1.003 16.606 1.00 0.00 C ATOM 1015 OD1 ASP A 63 97.706 -2.180 16.296 1.00 0.00 O ATOM 1016 OD2 ASP A 63 98.478 -0.169 16.351 1.00 0.00 O ATOM 0 H ASP A 63 94.828 -0.705 15.331 1.00 0.00 H new ATOM 0 HA ASP A 63 95.683 -2.576 17.464 1.00 0.00 H new ATOM 0 HB2 ASP A 63 96.031 0.414 16.971 1.00 0.00 H new ATOM 0 HB3 ASP A 63 96.605 -0.396 18.415 1.00 0.00 H new ATOM 1021 N SER A 64 92.897 -1.522 17.681 1.00 0.00 N ATOM 1022 CA SER A 64 91.707 -1.185 18.509 1.00 0.00 C ATOM 1023 C SER A 64 91.823 -1.852 19.884 1.00 0.00 C ATOM 1024 O SER A 64 92.250 -1.241 20.844 1.00 0.00 O ATOM 1025 CB SER A 64 90.444 -1.690 17.809 1.00 0.00 C ATOM 1026 OG SER A 64 89.384 -1.776 18.751 1.00 0.00 O ATOM 0 H SER A 64 92.691 -1.957 16.782 1.00 0.00 H new ATOM 0 HA SER A 64 91.653 -0.104 18.636 1.00 0.00 H new ATOM 0 HB2 SER A 64 90.170 -1.015 16.998 1.00 0.00 H new ATOM 0 HB3 SER A 64 90.628 -2.667 17.363 1.00 0.00 H new ATOM 0 HG SER A 64 88.574 -2.098 18.303 1.00 0.00 H new ATOM 1032 N ASN A 65 91.453 -3.101 19.988 1.00 0.00 N ATOM 1033 CA ASN A 65 91.546 -3.801 21.302 1.00 0.00 C ATOM 1034 C ASN A 65 91.228 -5.287 21.118 1.00 0.00 C ATOM 1035 O ASN A 65 91.703 -6.130 21.852 1.00 0.00 O ATOM 1036 CB ASN A 65 90.537 -3.189 22.278 1.00 0.00 C ATOM 1037 CG ASN A 65 90.595 -3.940 23.611 1.00 0.00 C ATOM 1038 OD1 ASN A 65 89.706 -4.705 23.928 1.00 0.00 O ATOM 1039 ND2 ASN A 65 91.609 -3.752 24.412 1.00 0.00 N ATOM 0 H ASN A 65 91.091 -3.666 19.220 1.00 0.00 H new ATOM 0 HA ASN A 65 92.556 -3.690 21.697 1.00 0.00 H new ATOM 0 HB2 ASN A 65 90.760 -2.133 22.433 1.00 0.00 H new ATOM 0 HB3 ASN A 65 89.532 -3.245 21.861 1.00 0.00 H new ATOM 0 HD21 ASN A 65 91.654 -4.247 25.303 1.00 0.00 H new ATOM 0 HD22 ASN A 65 92.356 -3.110 24.147 1.00 0.00 H new ATOM 1046 N ARG A 66 90.410 -5.607 20.146 1.00 0.00 N ATOM 1047 CA ARG A 66 90.026 -7.033 19.901 1.00 0.00 C ATOM 1048 C ARG A 66 90.178 -7.360 18.413 1.00 0.00 C ATOM 1049 O ARG A 66 90.209 -6.484 17.571 1.00 0.00 O ATOM 1050 CB ARG A 66 88.569 -7.239 20.319 1.00 0.00 C ATOM 1051 CG ARG A 66 88.438 -7.043 21.832 1.00 0.00 C ATOM 1052 CD ARG A 66 86.982 -7.251 22.248 1.00 0.00 C ATOM 1053 NE ARG A 66 86.803 -6.822 23.663 1.00 0.00 N ATOM 1054 CZ ARG A 66 85.603 -6.626 24.136 1.00 0.00 C ATOM 1055 NH1 ARG A 66 84.560 -6.839 23.378 1.00 0.00 N ATOM 1056 NH2 ARG A 66 85.445 -6.227 25.368 1.00 0.00 N ATOM 0 H ARG A 66 89.988 -4.935 19.505 1.00 0.00 H new ATOM 0 HA ARG A 66 90.674 -7.689 20.482 1.00 0.00 H new ATOM 0 HB2 ARG A 66 87.926 -6.533 19.793 1.00 0.00 H new ATOM 0 HB3 ARG A 66 88.238 -8.240 20.041 1.00 0.00 H new ATOM 0 HG2 ARG A 66 89.082 -7.748 22.358 1.00 0.00 H new ATOM 0 HG3 ARG A 66 88.767 -6.042 22.110 1.00 0.00 H new ATOM 0 HD2 ARG A 66 86.321 -6.678 21.597 1.00 0.00 H new ATOM 0 HD3 ARG A 66 86.707 -8.300 22.137 1.00 0.00 H new ATOM 0 HE ARG A 66 87.617 -6.682 24.261 1.00 0.00 H new ATOM 0 HH11 ARG A 66 84.684 -7.158 22.417 1.00 0.00 H new ATOM 0 HH12 ARG A 66 83.622 -6.686 23.747 1.00 0.00 H new ATOM 0 HH21 ARG A 66 86.260 -6.068 25.961 1.00 0.00 H new ATOM 0 HH22 ARG A 66 84.507 -6.074 25.738 1.00 0.00 H new ATOM 1070 N ASP A 67 90.272 -8.620 18.085 1.00 0.00 N ATOM 1071 CA ASP A 67 90.416 -9.014 16.656 1.00 0.00 C ATOM 1072 C ASP A 67 89.239 -8.440 15.861 1.00 0.00 C ATOM 1073 O ASP A 67 88.198 -8.140 16.411 1.00 0.00 O ATOM 1074 CB ASP A 67 90.414 -10.539 16.552 1.00 0.00 C ATOM 1075 CG ASP A 67 90.700 -10.953 15.109 1.00 0.00 C ATOM 1076 OD1 ASP A 67 89.847 -10.724 14.268 1.00 0.00 O ATOM 1077 OD2 ASP A 67 91.764 -11.498 14.869 1.00 0.00 O ATOM 0 H ASP A 67 90.255 -9.395 18.748 1.00 0.00 H new ATOM 0 HA ASP A 67 91.352 -8.627 16.254 1.00 0.00 H new ATOM 0 HB2 ASP A 67 91.167 -10.960 17.218 1.00 0.00 H new ATOM 0 HB3 ASP A 67 89.449 -10.934 16.870 1.00 0.00 H new ATOM 1082 N ASN A 68 89.399 -8.275 14.574 1.00 0.00 N ATOM 1083 CA ASN A 68 88.298 -7.711 13.748 1.00 0.00 C ATOM 1084 C ASN A 68 88.471 -8.165 12.299 1.00 0.00 C ATOM 1085 O ASN A 68 88.805 -7.388 11.429 1.00 0.00 O ATOM 1086 CB ASN A 68 88.351 -6.183 13.806 1.00 0.00 C ATOM 1087 CG ASN A 68 87.071 -5.606 13.200 1.00 0.00 C ATOM 1088 OD1 ASN A 68 86.119 -6.324 12.963 1.00 0.00 O ATOM 1089 ND2 ASN A 68 87.008 -4.328 12.936 1.00 0.00 N ATOM 0 H ASN A 68 90.249 -8.508 14.060 1.00 0.00 H new ATOM 0 HA ASN A 68 87.339 -8.059 14.131 1.00 0.00 H new ATOM 0 HB2 ASN A 68 88.459 -5.851 14.839 1.00 0.00 H new ATOM 0 HB3 ASN A 68 89.221 -5.818 13.261 1.00 0.00 H new ATOM 0 HD21 ASN A 68 86.160 -3.932 12.531 1.00 0.00 H new ATOM 0 HD22 ASN A 68 87.807 -3.726 13.135 1.00 0.00 H new ATOM 1096 N GLU A 69 88.236 -9.420 12.037 1.00 0.00 N ATOM 1097 CA GLU A 69 88.371 -9.943 10.642 1.00 0.00 C ATOM 1098 C GLU A 69 87.670 -8.972 9.689 1.00 0.00 C ATOM 1099 O GLU A 69 86.832 -8.193 10.099 1.00 0.00 O ATOM 1100 CB GLU A 69 87.701 -11.319 10.563 1.00 0.00 C ATOM 1101 CG GLU A 69 88.095 -12.018 9.262 1.00 0.00 C ATOM 1102 CD GLU A 69 89.578 -12.388 9.309 1.00 0.00 C ATOM 1103 OE1 GLU A 69 90.119 -12.446 10.402 1.00 0.00 O ATOM 1104 OE2 GLU A 69 90.147 -12.610 8.252 1.00 0.00 O ATOM 0 H GLU A 69 87.954 -10.113 12.731 1.00 0.00 H new ATOM 0 HA GLU A 69 89.422 -10.035 10.367 1.00 0.00 H new ATOM 0 HB2 GLU A 69 87.999 -11.927 11.417 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.618 -11.209 10.613 1.00 0.00 H new ATOM 0 HG2 GLU A 69 87.490 -12.914 9.121 1.00 0.00 H new ATOM 0 HG3 GLU A 69 87.899 -11.364 8.412 1.00 0.00 H new ATOM 1111 N VAL A 70 88.023 -8.992 8.431 1.00 0.00 N ATOM 1112 CA VAL A 70 87.402 -8.052 7.453 1.00 0.00 C ATOM 1113 C VAL A 70 86.450 -8.800 6.530 1.00 0.00 C ATOM 1114 O VAL A 70 86.857 -9.564 5.679 1.00 0.00 O ATOM 1115 CB VAL A 70 88.513 -7.425 6.611 1.00 0.00 C ATOM 1116 CG1 VAL A 70 88.015 -6.153 5.937 1.00 0.00 C ATOM 1117 CG2 VAL A 70 89.701 -7.098 7.501 1.00 0.00 C ATOM 0 H VAL A 70 88.720 -9.624 8.037 1.00 0.00 H new ATOM 0 HA VAL A 70 86.845 -7.286 7.993 1.00 0.00 H new ATOM 0 HB VAL A 70 88.815 -8.135 5.841 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.818 -5.719 5.341 1.00 0.00 H new ATOM 0 HG12 VAL A 70 87.171 -6.391 5.290 1.00 0.00 H new ATOM 0 HG13 VAL A 70 87.700 -5.438 6.697 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.493 -6.651 6.901 1.00 0.00 H new ATOM 0 HG22 VAL A 70 89.393 -6.396 8.276 1.00 0.00 H new ATOM 0 HG23 VAL A 70 90.070 -8.012 7.966 1.00 0.00 H new ATOM 1127 N ASP A 71 85.189 -8.531 6.660 1.00 0.00 N ATOM 1128 CA ASP A 71 84.184 -9.155 5.760 1.00 0.00 C ATOM 1129 C ASP A 71 83.925 -8.124 4.671 1.00 0.00 C ATOM 1130 O ASP A 71 84.373 -6.999 4.778 1.00 0.00 O ATOM 1131 CB ASP A 71 82.885 -9.441 6.528 1.00 0.00 C ATOM 1132 CG ASP A 71 81.989 -10.360 5.695 1.00 0.00 C ATOM 1133 OD1 ASP A 71 82.245 -10.488 4.510 1.00 0.00 O ATOM 1134 OD2 ASP A 71 81.061 -10.918 6.258 1.00 0.00 O ATOM 0 H ASP A 71 84.803 -7.897 7.360 1.00 0.00 H new ATOM 0 HA ASP A 71 84.538 -10.103 5.354 1.00 0.00 H new ATOM 0 HB2 ASP A 71 83.112 -9.909 7.486 1.00 0.00 H new ATOM 0 HB3 ASP A 71 82.365 -8.508 6.744 1.00 0.00 H new ATOM 1139 N PHE A 72 83.220 -8.449 3.634 1.00 0.00 N ATOM 1140 CA PHE A 72 82.982 -7.418 2.601 1.00 0.00 C ATOM 1141 C PHE A 72 82.356 -6.209 3.296 1.00 0.00 C ATOM 1142 O PHE A 72 82.661 -5.072 2.995 1.00 0.00 O ATOM 1143 CB PHE A 72 82.039 -7.964 1.531 1.00 0.00 C ATOM 1144 CG PHE A 72 82.062 -7.037 0.353 1.00 0.00 C ATOM 1145 CD1 PHE A 72 83.063 -7.180 -0.608 1.00 0.00 C ATOM 1146 CD2 PHE A 72 81.103 -6.031 0.227 1.00 0.00 C ATOM 1147 CE1 PHE A 72 83.108 -6.319 -1.702 1.00 0.00 C ATOM 1148 CE2 PHE A 72 81.145 -5.165 -0.869 1.00 0.00 C ATOM 1149 CZ PHE A 72 82.149 -5.309 -1.836 1.00 0.00 C ATOM 0 H PHE A 72 82.806 -9.364 3.458 1.00 0.00 H new ATOM 0 HA PHE A 72 83.915 -7.134 2.114 1.00 0.00 H new ATOM 0 HB2 PHE A 72 82.348 -8.965 1.230 1.00 0.00 H new ATOM 0 HB3 PHE A 72 81.027 -8.048 1.926 1.00 0.00 H new ATOM 0 HD1 PHE A 72 83.804 -7.959 -0.504 1.00 0.00 H new ATOM 0 HD2 PHE A 72 80.331 -5.922 0.974 1.00 0.00 H new ATOM 0 HE1 PHE A 72 83.883 -6.431 -2.446 1.00 0.00 H new ATOM 0 HE2 PHE A 72 80.404 -4.386 -0.971 1.00 0.00 H new ATOM 0 HZ PHE A 72 82.183 -4.641 -2.684 1.00 0.00 H new ATOM 1159 N GLN A 73 81.493 -6.458 4.245 1.00 0.00 N ATOM 1160 CA GLN A 73 80.855 -5.342 4.996 1.00 0.00 C ATOM 1161 C GLN A 73 81.910 -4.519 5.744 1.00 0.00 C ATOM 1162 O GLN A 73 81.889 -3.310 5.700 1.00 0.00 O ATOM 1163 CB GLN A 73 79.842 -5.911 5.997 1.00 0.00 C ATOM 1164 CG GLN A 73 79.173 -4.770 6.781 1.00 0.00 C ATOM 1165 CD GLN A 73 78.162 -5.356 7.770 1.00 0.00 C ATOM 1166 OE1 GLN A 73 77.859 -6.531 7.719 1.00 0.00 O ATOM 1167 NE2 GLN A 73 77.635 -4.586 8.686 1.00 0.00 N ATOM 0 H GLN A 73 81.202 -7.392 4.532 1.00 0.00 H new ATOM 0 HA GLN A 73 80.346 -4.690 4.286 1.00 0.00 H new ATOM 0 HB2 GLN A 73 79.086 -6.492 5.470 1.00 0.00 H new ATOM 0 HB3 GLN A 73 80.343 -6.591 6.686 1.00 0.00 H new ATOM 0 HG2 GLN A 73 79.926 -4.190 7.315 1.00 0.00 H new ATOM 0 HG3 GLN A 73 78.673 -4.087 6.095 1.00 0.00 H new ATOM 0 HE21 GLN A 73 77.888 -3.599 8.730 1.00 0.00 H new ATOM 0 HE22 GLN A 73 76.970 -4.972 9.356 1.00 0.00 H new ATOM 1176 N GLU A 74 82.827 -5.141 6.447 1.00 0.00 N ATOM 1177 CA GLU A 74 83.831 -4.329 7.179 1.00 0.00 C ATOM 1178 C GLU A 74 84.758 -3.637 6.192 1.00 0.00 C ATOM 1179 O GLU A 74 85.119 -2.497 6.357 1.00 0.00 O ATOM 1180 CB GLU A 74 84.644 -5.208 8.127 1.00 0.00 C ATOM 1181 CG GLU A 74 83.770 -5.681 9.299 1.00 0.00 C ATOM 1182 CD GLU A 74 82.904 -6.862 8.863 1.00 0.00 C ATOM 1183 OE1 GLU A 74 83.455 -7.935 8.686 1.00 0.00 O ATOM 1184 OE2 GLU A 74 81.704 -6.678 8.728 1.00 0.00 O ATOM 0 H GLU A 74 82.918 -6.153 6.541 1.00 0.00 H new ATOM 0 HA GLU A 74 83.306 -3.576 7.767 1.00 0.00 H new ATOM 0 HB2 GLU A 74 85.037 -6.069 7.587 1.00 0.00 H new ATOM 0 HB3 GLU A 74 85.501 -4.651 8.506 1.00 0.00 H new ATOM 0 HG2 GLU A 74 84.401 -5.973 10.139 1.00 0.00 H new ATOM 0 HG3 GLU A 74 83.137 -4.863 9.644 1.00 0.00 H new ATOM 1191 N TYR A 75 85.150 -4.290 5.152 1.00 0.00 N ATOM 1192 CA TYR A 75 86.040 -3.599 4.197 1.00 0.00 C ATOM 1193 C TYR A 75 85.311 -2.351 3.698 1.00 0.00 C ATOM 1194 O TYR A 75 85.914 -1.335 3.419 1.00 0.00 O ATOM 1195 CB TYR A 75 86.373 -4.523 3.028 1.00 0.00 C ATOM 1196 CG TYR A 75 87.077 -3.740 1.940 1.00 0.00 C ATOM 1197 CD1 TYR A 75 88.378 -3.262 2.148 1.00 0.00 C ATOM 1198 CD2 TYR A 75 86.426 -3.486 0.726 1.00 0.00 C ATOM 1199 CE1 TYR A 75 89.024 -2.532 1.143 1.00 0.00 C ATOM 1200 CE2 TYR A 75 87.074 -2.758 -0.279 1.00 0.00 C ATOM 1201 CZ TYR A 75 88.372 -2.280 -0.070 1.00 0.00 C ATOM 1202 OH TYR A 75 89.011 -1.557 -1.058 1.00 0.00 O ATOM 0 H TYR A 75 84.902 -5.252 4.921 1.00 0.00 H new ATOM 0 HA TYR A 75 86.976 -3.320 4.681 1.00 0.00 H new ATOM 0 HB2 TYR A 75 87.008 -5.341 3.369 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.460 -4.970 2.634 1.00 0.00 H new ATOM 0 HD1 TYR A 75 88.882 -3.457 3.083 1.00 0.00 H new ATOM 0 HD2 TYR A 75 85.423 -3.852 0.565 1.00 0.00 H new ATOM 0 HE1 TYR A 75 90.026 -2.163 1.304 1.00 0.00 H new ATOM 0 HE2 TYR A 75 86.572 -2.565 -1.216 1.00 0.00 H new ATOM 0 HH TYR A 75 88.421 -1.473 -1.836 1.00 0.00 H new ATOM 1212 N CYS A 76 84.010 -2.421 3.585 1.00 0.00 N ATOM 1213 CA CYS A 76 83.248 -1.239 3.105 1.00 0.00 C ATOM 1214 C CYS A 76 83.270 -0.136 4.166 1.00 0.00 C ATOM 1215 O CYS A 76 83.529 1.009 3.853 1.00 0.00 O ATOM 1216 CB CYS A 76 81.799 -1.655 2.774 1.00 0.00 C ATOM 1217 SG CYS A 76 80.704 -1.421 4.204 1.00 0.00 S ATOM 0 H CYS A 76 83.448 -3.243 3.804 1.00 0.00 H new ATOM 0 HA CYS A 76 83.713 -0.850 2.199 1.00 0.00 H new ATOM 0 HB2 CYS A 76 81.433 -1.067 1.932 1.00 0.00 H new ATOM 0 HB3 CYS A 76 81.780 -2.700 2.465 1.00 0.00 H new ATOM 0 HG CYS A 76 81.032 -2.258 5.143 1.00 0.00 H new ATOM 1223 N VAL A 77 83.021 -0.439 5.422 1.00 0.00 N ATOM 1224 CA VAL A 77 83.073 0.670 6.411 1.00 0.00 C ATOM 1225 C VAL A 77 84.491 1.201 6.401 1.00 0.00 C ATOM 1226 O VAL A 77 84.726 2.393 6.376 1.00 0.00 O ATOM 1227 CB VAL A 77 82.666 0.213 7.816 1.00 0.00 C ATOM 1228 CG1 VAL A 77 81.391 -0.614 7.722 1.00 0.00 C ATOM 1229 CG2 VAL A 77 83.757 -0.618 8.483 1.00 0.00 C ATOM 0 H VAL A 77 82.795 -1.365 5.786 1.00 0.00 H new ATOM 0 HA VAL A 77 82.360 1.447 6.136 1.00 0.00 H new ATOM 0 HB VAL A 77 82.504 1.102 8.425 1.00 0.00 H new ATOM 0 HG11 VAL A 77 81.096 -0.942 8.719 1.00 0.00 H new ATOM 0 HG12 VAL A 77 80.595 -0.008 7.289 1.00 0.00 H new ATOM 0 HG13 VAL A 77 81.568 -1.485 7.091 1.00 0.00 H new ATOM 0 HG21 VAL A 77 83.427 -0.921 9.477 1.00 0.00 H new ATOM 0 HG22 VAL A 77 83.958 -1.504 7.881 1.00 0.00 H new ATOM 0 HG23 VAL A 77 84.666 -0.023 8.568 1.00 0.00 H new ATOM 1239 N PHE A 78 85.442 0.316 6.375 1.00 0.00 N ATOM 1240 CA PHE A 78 86.853 0.775 6.310 1.00 0.00 C ATOM 1241 C PHE A 78 87.039 1.588 5.023 1.00 0.00 C ATOM 1242 O PHE A 78 87.699 2.611 5.022 1.00 0.00 O ATOM 1243 CB PHE A 78 87.815 -0.426 6.309 1.00 0.00 C ATOM 1244 CG PHE A 78 88.029 -0.925 7.724 1.00 0.00 C ATOM 1245 CD1 PHE A 78 88.644 -0.091 8.668 1.00 0.00 C ATOM 1246 CD2 PHE A 78 87.619 -2.214 8.098 1.00 0.00 C ATOM 1247 CE1 PHE A 78 88.847 -0.541 9.976 1.00 0.00 C ATOM 1248 CE2 PHE A 78 87.822 -2.663 9.409 1.00 0.00 C ATOM 1249 CZ PHE A 78 88.436 -1.827 10.348 1.00 0.00 C ATOM 0 H PHE A 78 85.307 -0.695 6.396 1.00 0.00 H new ATOM 0 HA PHE A 78 87.076 1.388 7.183 1.00 0.00 H new ATOM 0 HB2 PHE A 78 87.409 -1.226 5.691 1.00 0.00 H new ATOM 0 HB3 PHE A 78 88.769 -0.137 5.869 1.00 0.00 H new ATOM 0 HD1 PHE A 78 88.962 0.901 8.384 1.00 0.00 H new ATOM 0 HD2 PHE A 78 87.146 -2.861 7.374 1.00 0.00 H new ATOM 0 HE1 PHE A 78 89.321 0.104 10.701 1.00 0.00 H new ATOM 0 HE2 PHE A 78 87.505 -3.655 9.695 1.00 0.00 H new ATOM 0 HZ PHE A 78 88.593 -2.173 11.359 1.00 0.00 H new ATOM 1259 N LEU A 79 86.456 1.158 3.923 1.00 0.00 N ATOM 1260 CA LEU A 79 86.611 1.947 2.659 1.00 0.00 C ATOM 1261 C LEU A 79 85.819 3.249 2.782 1.00 0.00 C ATOM 1262 O LEU A 79 86.254 4.304 2.363 1.00 0.00 O ATOM 1263 CB LEU A 79 86.104 1.140 1.454 1.00 0.00 C ATOM 1264 CG LEU A 79 86.265 1.951 0.157 1.00 0.00 C ATOM 1265 CD1 LEU A 79 87.747 2.291 -0.085 1.00 0.00 C ATOM 1266 CD2 LEU A 79 85.732 1.123 -1.019 1.00 0.00 C ATOM 0 H LEU A 79 85.891 0.312 3.848 1.00 0.00 H new ATOM 0 HA LEU A 79 87.667 2.169 2.504 1.00 0.00 H new ATOM 0 HB2 LEU A 79 86.658 0.205 1.376 1.00 0.00 H new ATOM 0 HB3 LEU A 79 85.056 0.879 1.599 1.00 0.00 H new ATOM 0 HG LEU A 79 85.704 2.881 0.246 1.00 0.00 H new ATOM 0 HD11 LEU A 79 87.843 2.865 -1.007 1.00 0.00 H new ATOM 0 HD12 LEU A 79 88.126 2.880 0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 79 88.323 1.369 -0.170 1.00 0.00 H new ATOM 0 HD21 LEU A 79 85.842 1.691 -1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.296 0.193 -1.095 1.00 0.00 H new ATOM 0 HD23 LEU A 79 84.678 0.896 -0.856 1.00 0.00 H new ATOM 1278 N SER A 80 84.657 3.173 3.362 1.00 0.00 N ATOM 1279 CA SER A 80 83.812 4.387 3.534 1.00 0.00 C ATOM 1280 C SER A 80 84.571 5.372 4.401 1.00 0.00 C ATOM 1281 O SER A 80 84.601 6.558 4.147 1.00 0.00 O ATOM 1282 CB SER A 80 82.500 4.011 4.219 1.00 0.00 C ATOM 1283 OG SER A 80 81.793 3.080 3.408 1.00 0.00 O ATOM 0 H SER A 80 84.251 2.312 3.729 1.00 0.00 H new ATOM 0 HA SER A 80 83.588 4.829 2.563 1.00 0.00 H new ATOM 0 HB2 SER A 80 82.700 3.578 5.199 1.00 0.00 H new ATOM 0 HB3 SER A 80 81.894 4.902 4.382 1.00 0.00 H new ATOM 0 HG SER A 80 81.168 2.570 3.964 1.00 0.00 H new ATOM 1289 N CYS A 81 85.222 4.871 5.408 1.00 0.00 N ATOM 1290 CA CYS A 81 86.023 5.753 6.277 1.00 0.00 C ATOM 1291 C CYS A 81 87.074 6.403 5.401 1.00 0.00 C ATOM 1292 O CYS A 81 87.375 7.574 5.524 1.00 0.00 O ATOM 1293 CB CYS A 81 86.697 4.924 7.371 1.00 0.00 C ATOM 1294 SG CYS A 81 85.457 4.410 8.585 1.00 0.00 S ATOM 0 H CYS A 81 85.231 3.884 5.664 1.00 0.00 H new ATOM 0 HA CYS A 81 85.397 6.506 6.756 1.00 0.00 H new ATOM 0 HB2 CYS A 81 87.179 4.049 6.935 1.00 0.00 H new ATOM 0 HB3 CYS A 81 87.478 5.509 7.857 1.00 0.00 H new ATOM 0 HG CYS A 81 84.766 3.418 8.107 1.00 0.00 H new ATOM 1300 N ILE A 82 87.620 5.647 4.490 1.00 0.00 N ATOM 1301 CA ILE A 82 88.640 6.230 3.579 1.00 0.00 C ATOM 1302 C ILE A 82 87.941 7.209 2.637 1.00 0.00 C ATOM 1303 O ILE A 82 88.450 8.264 2.324 1.00 0.00 O ATOM 1304 CB ILE A 82 89.341 5.124 2.779 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.227 4.303 3.729 1.00 0.00 C ATOM 1306 CG2 ILE A 82 90.199 5.753 1.673 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.752 3.058 3.008 1.00 0.00 C ATOM 0 H ILE A 82 87.406 4.661 4.338 1.00 0.00 H new ATOM 0 HA ILE A 82 89.400 6.752 4.160 1.00 0.00 H new ATOM 0 HB ILE A 82 88.598 4.471 2.321 1.00 0.00 H new ATOM 0 HG12 ILE A 82 91.062 4.911 4.078 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.656 4.010 4.610 1.00 0.00 H new ATOM 0 HG21 ILE A 82 90.696 4.966 1.106 1.00 0.00 H new ATOM 0 HG22 ILE A 82 89.563 6.335 1.006 1.00 0.00 H new ATOM 0 HG23 ILE A 82 90.948 6.406 2.121 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.379 2.481 3.688 1.00 0.00 H new ATOM 0 HD12 ILE A 82 89.912 2.445 2.681 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.339 3.360 2.141 1.00 0.00 H new ATOM 1319 N ALA A 83 86.775 6.857 2.177 1.00 0.00 N ATOM 1320 CA ALA A 83 86.037 7.758 1.255 1.00 0.00 C ATOM 1321 C ALA A 83 85.748 9.094 1.943 1.00 0.00 C ATOM 1322 O ALA A 83 85.964 10.145 1.386 1.00 0.00 O ATOM 1323 CB ALA A 83 84.720 7.097 0.851 1.00 0.00 C ATOM 0 H ALA A 83 86.301 5.982 2.401 1.00 0.00 H new ATOM 0 HA ALA A 83 86.646 7.941 0.369 1.00 0.00 H new ATOM 0 HB1 ALA A 83 84.175 7.755 0.174 1.00 0.00 H new ATOM 0 HB2 ALA A 83 84.926 6.151 0.350 1.00 0.00 H new ATOM 0 HB3 ALA A 83 84.118 6.912 1.741 1.00 0.00 H new ATOM 1329 N MET A 84 85.260 9.061 3.151 1.00 0.00 N ATOM 1330 CA MET A 84 84.959 10.338 3.856 1.00 0.00 C ATOM 1331 C MET A 84 86.261 11.077 4.100 1.00 0.00 C ATOM 1332 O MET A 84 86.323 12.289 4.045 1.00 0.00 O ATOM 1333 CB MET A 84 84.264 10.044 5.181 1.00 0.00 C ATOM 1334 CG MET A 84 82.856 9.515 4.903 1.00 0.00 C ATOM 1335 SD MET A 84 82.004 9.206 6.470 1.00 0.00 S ATOM 1336 CE MET A 84 82.982 7.777 7.001 1.00 0.00 C ATOM 0 H MET A 84 85.058 8.211 3.678 1.00 0.00 H new ATOM 0 HA MET A 84 84.297 10.954 3.247 1.00 0.00 H new ATOM 0 HB2 MET A 84 84.835 9.311 5.750 1.00 0.00 H new ATOM 0 HB3 MET A 84 84.213 10.948 5.787 1.00 0.00 H new ATOM 0 HG2 MET A 84 82.296 10.237 4.309 1.00 0.00 H new ATOM 0 HG3 MET A 84 82.910 8.596 4.319 1.00 0.00 H new ATOM 0 HE1 MET A 84 82.410 7.193 7.722 1.00 0.00 H new ATOM 0 HE2 MET A 84 83.218 7.156 6.137 1.00 0.00 H new ATOM 0 HE3 MET A 84 83.907 8.121 7.464 1.00 0.00 H new ATOM 1346 N MET A 85 87.313 10.357 4.343 1.00 0.00 N ATOM 1347 CA MET A 85 88.613 11.025 4.556 1.00 0.00 C ATOM 1348 C MET A 85 88.906 11.822 3.293 1.00 0.00 C ATOM 1349 O MET A 85 89.520 12.867 3.335 1.00 0.00 O ATOM 1350 CB MET A 85 89.703 9.975 4.777 1.00 0.00 C ATOM 1351 CG MET A 85 91.041 10.665 5.031 1.00 0.00 C ATOM 1352 SD MET A 85 92.316 9.405 5.288 1.00 0.00 S ATOM 1353 CE MET A 85 93.745 10.508 5.226 1.00 0.00 C ATOM 0 H MET A 85 87.327 9.339 4.403 1.00 0.00 H new ATOM 0 HA MET A 85 88.587 11.674 5.431 1.00 0.00 H new ATOM 0 HB2 MET A 85 89.444 9.341 5.625 1.00 0.00 H new ATOM 0 HB3 MET A 85 89.778 9.326 3.905 1.00 0.00 H new ATOM 0 HG2 MET A 85 91.304 11.299 4.184 1.00 0.00 H new ATOM 0 HG3 MET A 85 90.970 11.313 5.905 1.00 0.00 H new ATOM 0 HE1 MET A 85 94.637 9.966 5.539 1.00 0.00 H new ATOM 0 HE2 MET A 85 93.880 10.871 4.207 1.00 0.00 H new ATOM 0 HE3 MET A 85 93.581 11.353 5.894 1.00 0.00 H new ATOM 1363 N CYS A 86 88.435 11.345 2.166 1.00 0.00 N ATOM 1364 CA CYS A 86 88.655 12.094 0.899 1.00 0.00 C ATOM 1365 C CYS A 86 87.662 11.609 -0.159 1.00 0.00 C ATOM 1366 O CYS A 86 88.017 10.903 -1.082 1.00 0.00 O ATOM 1367 CB CYS A 86 90.092 11.879 0.400 1.00 0.00 C ATOM 1368 SG CYS A 86 91.214 13.005 1.266 1.00 0.00 S ATOM 0 H CYS A 86 87.911 10.475 2.073 1.00 0.00 H new ATOM 0 HA CYS A 86 88.502 13.158 1.082 1.00 0.00 H new ATOM 0 HB2 CYS A 86 90.395 10.846 0.570 1.00 0.00 H new ATOM 0 HB3 CYS A 86 90.144 12.054 -0.675 1.00 0.00 H new ATOM 0 HG CYS A 86 90.804 13.171 2.488 1.00 0.00 H new ATOM 1374 N ASN A 87 86.422 11.980 -0.032 1.00 0.00 N ATOM 1375 CA ASN A 87 85.412 11.535 -1.035 1.00 0.00 C ATOM 1376 C ASN A 87 85.806 12.041 -2.427 1.00 0.00 C ATOM 1377 O ASN A 87 85.788 11.299 -3.390 1.00 0.00 O ATOM 1378 CB ASN A 87 84.033 12.087 -0.657 1.00 0.00 C ATOM 1379 CG ASN A 87 83.474 11.295 0.528 1.00 0.00 C ATOM 1380 OD1 ASN A 87 83.692 10.105 0.634 1.00 0.00 O ATOM 1381 ND2 ASN A 87 82.762 11.912 1.432 1.00 0.00 N ATOM 0 H ASN A 87 86.062 12.570 0.718 1.00 0.00 H new ATOM 0 HA ASN A 87 85.374 10.446 -1.047 1.00 0.00 H new ATOM 0 HB2 ASN A 87 84.111 13.143 -0.398 1.00 0.00 H new ATOM 0 HB3 ASN A 87 83.355 12.016 -1.508 1.00 0.00 H new ATOM 0 HD21 ASN A 87 82.389 11.395 2.228 1.00 0.00 H new ATOM 0 HD22 ASN A 87 82.579 12.911 1.342 1.00 0.00 H new ATOM 1388 N GLU A 88 86.174 13.294 -2.537 1.00 0.00 N ATOM 1389 CA GLU A 88 86.579 13.851 -3.863 1.00 0.00 C ATOM 1390 C GLU A 88 87.073 15.289 -3.679 1.00 0.00 C ATOM 1391 O GLU A 88 88.250 15.569 -3.773 1.00 0.00 O ATOM 1392 CB GLU A 88 85.373 13.852 -4.812 1.00 0.00 C ATOM 1393 CG GLU A 88 85.800 14.328 -6.206 1.00 0.00 C ATOM 1394 CD GLU A 88 86.804 13.340 -6.805 1.00 0.00 C ATOM 1395 OE1 GLU A 88 86.859 12.218 -6.329 1.00 0.00 O ATOM 1396 OE2 GLU A 88 87.505 13.724 -7.728 1.00 0.00 O ATOM 0 H GLU A 88 86.211 13.956 -1.762 1.00 0.00 H new ATOM 0 HA GLU A 88 87.375 13.237 -4.285 1.00 0.00 H new ATOM 0 HB2 GLU A 88 84.949 12.850 -4.875 1.00 0.00 H new ATOM 0 HB3 GLU A 88 84.592 14.504 -4.420 1.00 0.00 H new ATOM 0 HG2 GLU A 88 84.928 14.413 -6.854 1.00 0.00 H new ATOM 0 HG3 GLU A 88 86.247 15.320 -6.141 1.00 0.00 H new ATOM 1403 N PHE A 89 86.177 16.205 -3.423 1.00 0.00 N ATOM 1404 CA PHE A 89 86.587 17.626 -3.237 1.00 0.00 C ATOM 1405 C PHE A 89 87.243 17.797 -1.863 1.00 0.00 C ATOM 1406 O PHE A 89 86.734 17.336 -0.861 1.00 0.00 O ATOM 1407 CB PHE A 89 85.352 18.527 -3.322 1.00 0.00 C ATOM 1408 CG PHE A 89 84.727 18.408 -4.695 1.00 0.00 C ATOM 1409 CD1 PHE A 89 85.137 19.260 -5.730 1.00 0.00 C ATOM 1410 CD2 PHE A 89 83.739 17.444 -4.937 1.00 0.00 C ATOM 1411 CE1 PHE A 89 84.561 19.148 -7.002 1.00 0.00 C ATOM 1412 CE2 PHE A 89 83.163 17.332 -6.209 1.00 0.00 C ATOM 1413 CZ PHE A 89 83.574 18.184 -7.241 1.00 0.00 C ATOM 0 H PHE A 89 85.176 16.029 -3.335 1.00 0.00 H new ATOM 0 HA PHE A 89 87.298 17.901 -4.016 1.00 0.00 H new ATOM 0 HB2 PHE A 89 84.629 18.243 -2.557 1.00 0.00 H new ATOM 0 HB3 PHE A 89 85.631 19.562 -3.128 1.00 0.00 H new ATOM 0 HD1 PHE A 89 85.898 20.004 -5.546 1.00 0.00 H new ATOM 0 HD2 PHE A 89 83.421 16.786 -4.141 1.00 0.00 H new ATOM 0 HE1 PHE A 89 84.878 19.805 -7.798 1.00 0.00 H new ATOM 0 HE2 PHE A 89 82.402 16.588 -6.394 1.00 0.00 H new ATOM 0 HZ PHE A 89 83.130 18.098 -8.222 1.00 0.00 H new ATOM 1423 N PHE A 90 88.362 18.467 -1.807 1.00 0.00 N ATOM 1424 CA PHE A 90 89.045 18.678 -0.498 1.00 0.00 C ATOM 1425 C PHE A 90 88.387 19.854 0.226 1.00 0.00 C ATOM 1426 O PHE A 90 88.665 20.126 1.377 1.00 0.00 O ATOM 1427 CB PHE A 90 90.525 18.984 -0.737 1.00 0.00 C ATOM 1428 CG PHE A 90 90.660 20.244 -1.559 1.00 0.00 C ATOM 1429 CD1 PHE A 90 90.695 20.166 -2.956 1.00 0.00 C ATOM 1430 CD2 PHE A 90 90.762 21.488 -0.924 1.00 0.00 C ATOM 1431 CE1 PHE A 90 90.830 21.330 -3.719 1.00 0.00 C ATOM 1432 CE2 PHE A 90 90.897 22.654 -1.687 1.00 0.00 C ATOM 1433 CZ PHE A 90 90.932 22.575 -3.085 1.00 0.00 C ATOM 0 H PHE A 90 88.834 18.878 -2.613 1.00 0.00 H new ATOM 0 HA PHE A 90 88.959 17.778 0.112 1.00 0.00 H new ATOM 0 HB2 PHE A 90 91.040 19.104 0.216 1.00 0.00 H new ATOM 0 HB3 PHE A 90 91.000 18.149 -1.253 1.00 0.00 H new ATOM 0 HD1 PHE A 90 90.618 19.206 -3.445 1.00 0.00 H new ATOM 0 HD2 PHE A 90 90.737 21.548 0.154 1.00 0.00 H new ATOM 0 HE1 PHE A 90 90.856 21.269 -4.797 1.00 0.00 H new ATOM 0 HE2 PHE A 90 90.974 23.614 -1.198 1.00 0.00 H new ATOM 0 HZ PHE A 90 91.038 23.474 -3.674 1.00 0.00 H new ATOM 1443 N GLU A 91 87.520 20.560 -0.447 1.00 0.00 N ATOM 1444 CA GLU A 91 86.842 21.723 0.189 1.00 0.00 C ATOM 1445 C GLU A 91 86.033 21.255 1.404 1.00 0.00 C ATOM 1446 O GLU A 91 86.002 21.911 2.428 1.00 0.00 O ATOM 1447 CB GLU A 91 85.909 22.380 -0.833 1.00 0.00 C ATOM 1448 CG GLU A 91 85.225 23.597 -0.204 1.00 0.00 C ATOM 1449 CD GLU A 91 84.311 24.260 -1.236 1.00 0.00 C ATOM 1450 OE1 GLU A 91 84.380 23.877 -2.391 1.00 0.00 O ATOM 1451 OE2 GLU A 91 83.556 25.138 -0.853 1.00 0.00 O ATOM 0 H GLU A 91 87.252 20.380 -1.414 1.00 0.00 H new ATOM 0 HA GLU A 91 87.589 22.444 0.520 1.00 0.00 H new ATOM 0 HB2 GLU A 91 86.475 22.684 -1.713 1.00 0.00 H new ATOM 0 HB3 GLU A 91 85.160 21.663 -1.168 1.00 0.00 H new ATOM 0 HG2 GLU A 91 84.646 23.292 0.667 1.00 0.00 H new ATOM 0 HG3 GLU A 91 85.974 24.308 0.144 1.00 0.00 H new ATOM 1458 N GLY A 92 85.380 20.130 1.302 1.00 0.00 N ATOM 1459 CA GLY A 92 84.573 19.630 2.454 1.00 0.00 C ATOM 1460 C GLY A 92 85.506 19.192 3.582 1.00 0.00 C ATOM 1461 O GLY A 92 86.488 18.512 3.362 1.00 0.00 O ATOM 0 H GLY A 92 85.369 19.536 0.473 1.00 0.00 H new ATOM 0 HA2 GLY A 92 83.901 20.412 2.807 1.00 0.00 H new ATOM 0 HA3 GLY A 92 83.950 18.793 2.138 1.00 0.00 H new ATOM 1465 N PHE A 93 85.201 19.573 4.793 1.00 0.00 N ATOM 1466 CA PHE A 93 86.063 19.177 5.940 1.00 0.00 C ATOM 1467 C PHE A 93 85.817 17.693 6.255 1.00 0.00 C ATOM 1468 O PHE A 93 84.730 17.197 6.036 1.00 0.00 O ATOM 1469 CB PHE A 93 85.699 20.038 7.155 1.00 0.00 C ATOM 1470 CG PHE A 93 86.155 21.458 6.912 1.00 0.00 C ATOM 1471 CD1 PHE A 93 85.396 22.305 6.095 1.00 0.00 C ATOM 1472 CD2 PHE A 93 87.338 21.926 7.498 1.00 0.00 C ATOM 1473 CE1 PHE A 93 85.819 23.619 5.864 1.00 0.00 C ATOM 1474 CE2 PHE A 93 87.761 23.241 7.268 1.00 0.00 C ATOM 1475 CZ PHE A 93 87.002 24.088 6.450 1.00 0.00 C ATOM 0 H PHE A 93 84.390 20.142 5.036 1.00 0.00 H new ATOM 0 HA PHE A 93 87.115 19.326 5.696 1.00 0.00 H new ATOM 0 HB2 PHE A 93 84.622 20.013 7.324 1.00 0.00 H new ATOM 0 HB3 PHE A 93 86.172 19.640 8.053 1.00 0.00 H new ATOM 0 HD1 PHE A 93 84.484 21.944 5.643 1.00 0.00 H new ATOM 0 HD2 PHE A 93 87.924 21.273 8.127 1.00 0.00 H new ATOM 0 HE1 PHE A 93 85.233 24.272 5.234 1.00 0.00 H new ATOM 0 HE2 PHE A 93 88.672 23.602 7.721 1.00 0.00 H new ATOM 0 HZ PHE A 93 87.329 25.102 6.271 1.00 0.00 H new ATOM 1485 N PRO A 94 86.798 16.974 6.760 1.00 0.00 N ATOM 1486 CA PRO A 94 86.592 15.531 7.075 1.00 0.00 C ATOM 1487 C PRO A 94 85.453 15.326 8.082 1.00 0.00 C ATOM 1488 O PRO A 94 85.180 16.175 8.908 1.00 0.00 O ATOM 1489 CB PRO A 94 87.956 15.115 7.662 1.00 0.00 C ATOM 1490 CG PRO A 94 88.810 16.384 7.847 1.00 0.00 C ATOM 1491 CD PRO A 94 88.155 17.523 7.050 1.00 0.00 C ATOM 0 HA PRO A 94 86.298 14.939 6.208 1.00 0.00 H new ATOM 0 HB2 PRO A 94 87.820 14.607 8.616 1.00 0.00 H new ATOM 0 HB3 PRO A 94 88.458 14.413 6.996 1.00 0.00 H new ATOM 0 HG2 PRO A 94 88.876 16.647 8.903 1.00 0.00 H new ATOM 0 HG3 PRO A 94 89.828 16.212 7.497 1.00 0.00 H new ATOM 0 HD2 PRO A 94 88.105 18.446 7.628 1.00 0.00 H new ATOM 0 HD3 PRO A 94 88.706 17.748 6.137 1.00 0.00 H new ATOM 1499 N ASP A 95 84.785 14.204 8.018 1.00 0.00 N ATOM 1500 CA ASP A 95 83.662 13.938 8.968 1.00 0.00 C ATOM 1501 C ASP A 95 83.618 12.447 9.306 1.00 0.00 C ATOM 1502 O ASP A 95 82.859 11.694 8.728 1.00 0.00 O ATOM 1503 CB ASP A 95 82.341 14.343 8.310 1.00 0.00 C ATOM 1504 CG ASP A 95 81.221 14.303 9.351 1.00 0.00 C ATOM 1505 OD1 ASP A 95 81.428 13.700 10.391 1.00 0.00 O ATOM 1506 OD2 ASP A 95 80.175 14.874 9.088 1.00 0.00 O ATOM 0 H ASP A 95 84.969 13.458 7.347 1.00 0.00 H new ATOM 0 HA ASP A 95 83.814 14.513 9.881 1.00 0.00 H new ATOM 0 HB2 ASP A 95 82.424 15.344 7.888 1.00 0.00 H new ATOM 0 HB3 ASP A 95 82.111 13.668 7.486 1.00 0.00 H new ATOM 1511 N LYS A 96 84.418 12.012 10.246 1.00 0.00 N ATOM 1512 CA LYS A 96 84.415 10.567 10.631 1.00 0.00 C ATOM 1513 C LYS A 96 83.517 10.387 11.863 1.00 0.00 C ATOM 1514 O LYS A 96 82.309 10.429 11.757 1.00 0.00 O ATOM 1515 CB LYS A 96 85.848 10.123 10.941 1.00 0.00 C ATOM 1516 CG LYS A 96 85.876 8.604 11.104 1.00 0.00 C ATOM 1517 CD LYS A 96 87.287 8.148 11.494 1.00 0.00 C ATOM 1518 CE LYS A 96 88.232 8.231 10.290 1.00 0.00 C ATOM 1519 NZ LYS A 96 89.440 7.402 10.558 1.00 0.00 N ATOM 0 H LYS A 96 85.074 12.596 10.765 1.00 0.00 H new ATOM 0 HA LYS A 96 84.030 9.956 9.814 1.00 0.00 H new ATOM 0 HB2 LYS A 96 86.518 10.427 10.137 1.00 0.00 H new ATOM 0 HB3 LYS A 96 86.203 10.606 11.852 1.00 0.00 H new ATOM 0 HG2 LYS A 96 85.161 8.298 11.868 1.00 0.00 H new ATOM 0 HG3 LYS A 96 85.573 8.124 10.174 1.00 0.00 H new ATOM 0 HD2 LYS A 96 87.666 8.771 12.304 1.00 0.00 H new ATOM 0 HD3 LYS A 96 87.254 7.125 11.868 1.00 0.00 H new ATOM 0 HE2 LYS A 96 87.727 7.879 9.391 1.00 0.00 H new ATOM 0 HE3 LYS A 96 88.520 9.267 10.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 90.294 7.944 10.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 89.467 7.144 11.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 89.404 6.538 9.980 1.00 0.00 H new ATOM 1533 N GLN A 97 84.089 10.202 13.030 1.00 0.00 N ATOM 1534 CA GLN A 97 83.264 10.044 14.273 1.00 0.00 C ATOM 1535 C GLN A 97 83.379 11.344 15.095 1.00 0.00 C ATOM 1536 O GLN A 97 84.387 11.561 15.739 1.00 0.00 O ATOM 1537 CB GLN A 97 83.819 8.877 15.102 1.00 0.00 C ATOM 1538 CG GLN A 97 83.363 7.549 14.490 1.00 0.00 C ATOM 1539 CD GLN A 97 84.058 6.385 15.199 1.00 0.00 C ATOM 1540 OE1 GLN A 97 85.326 6.478 15.496 1.00 0.00 O flip ATOM 1541 NE2 GLN A 97 83.441 5.377 15.483 1.00 0.00 N flip ATOM 0 H GLN A 97 85.097 10.153 13.176 1.00 0.00 H new ATOM 0 HA GLN A 97 82.224 9.846 14.015 1.00 0.00 H new ATOM 0 HB2 GLN A 97 84.908 8.922 15.128 1.00 0.00 H new ATOM 0 HB3 GLN A 97 83.472 8.952 16.132 1.00 0.00 H new ATOM 0 HG2 GLN A 97 82.281 7.449 14.581 1.00 0.00 H new ATOM 0 HG3 GLN A 97 83.596 7.530 13.425 1.00 0.00 H new ATOM 0 HE21 GLN A 97 82.450 5.303 15.252 1.00 0.00 H new ATOM 0 HE22 GLN A 97 83.914 4.605 15.953 1.00 0.00 H new ATOM 1550 N PRO A 98 82.391 12.224 15.083 1.00 0.00 N ATOM 1551 CA PRO A 98 82.508 13.492 15.860 1.00 0.00 C ATOM 1552 C PRO A 98 82.395 13.264 17.373 1.00 0.00 C ATOM 1553 O PRO A 98 81.322 13.314 17.939 1.00 0.00 O ATOM 1554 CB PRO A 98 81.327 14.322 15.320 1.00 0.00 C ATOM 1555 CG PRO A 98 80.395 13.383 14.530 1.00 0.00 C ATOM 1556 CD PRO A 98 81.121 12.040 14.320 1.00 0.00 C ATOM 0 HA PRO A 98 83.477 13.977 15.739 1.00 0.00 H new ATOM 0 HB2 PRO A 98 80.786 14.791 16.142 1.00 0.00 H new ATOM 0 HB3 PRO A 98 81.690 15.125 14.678 1.00 0.00 H new ATOM 0 HG2 PRO A 98 79.463 13.229 15.073 1.00 0.00 H new ATOM 0 HG3 PRO A 98 80.135 13.827 13.569 1.00 0.00 H new ATOM 0 HD2 PRO A 98 80.538 11.202 14.702 1.00 0.00 H new ATOM 0 HD3 PRO A 98 81.309 11.843 13.265 1.00 0.00 H new ATOM 1564 N ARG A 99 83.503 13.026 18.026 1.00 0.00 N ATOM 1565 CA ARG A 99 83.484 12.805 19.505 1.00 0.00 C ATOM 1566 C ARG A 99 84.001 14.063 20.204 1.00 0.00 C ATOM 1567 O ARG A 99 83.709 14.312 21.358 1.00 0.00 O ATOM 1568 CB ARG A 99 84.384 11.620 19.847 1.00 0.00 C ATOM 1569 CG ARG A 99 83.743 10.327 19.336 1.00 0.00 C ATOM 1570 CD ARG A 99 84.635 9.146 19.710 1.00 0.00 C ATOM 1571 NE ARG A 99 84.630 9.001 21.192 1.00 0.00 N ATOM 1572 CZ ARG A 99 85.146 7.943 21.752 1.00 0.00 C ATOM 1573 NH1 ARG A 99 85.730 7.036 21.019 1.00 0.00 N ATOM 1574 NH2 ARG A 99 85.095 7.805 23.047 1.00 0.00 N ATOM 0 H ARG A 99 84.427 12.975 17.596 1.00 0.00 H new ATOM 0 HA ARG A 99 82.468 12.595 19.838 1.00 0.00 H new ATOM 0 HB2 ARG A 99 85.367 11.754 19.395 1.00 0.00 H new ATOM 0 HB3 ARG A 99 84.534 11.563 20.925 1.00 0.00 H new ATOM 0 HG2 ARG A 99 82.751 10.202 19.771 1.00 0.00 H new ATOM 0 HG3 ARG A 99 83.614 10.373 18.255 1.00 0.00 H new ATOM 0 HD2 ARG A 99 84.272 8.233 19.239 1.00 0.00 H new ATOM 0 HD3 ARG A 99 85.650 9.309 19.349 1.00 0.00 H new ATOM 0 HE ARG A 99 84.221 9.733 21.772 1.00 0.00 H new ATOM 0 HH11 ARG A 99 85.783 7.154 20.007 1.00 0.00 H new ATOM 0 HH12 ARG A 99 86.134 6.208 21.457 1.00 0.00 H new ATOM 0 HH21 ARG A 99 84.652 8.524 23.619 1.00 0.00 H new ATOM 0 HH22 ARG A 99 85.498 6.978 23.488 1.00 0.00 H new ATOM 1588 N LYS A 100 84.761 14.864 19.511 1.00 0.00 N ATOM 1589 CA LYS A 100 85.294 16.109 20.125 1.00 0.00 C ATOM 1590 C LYS A 100 84.118 17.015 20.496 1.00 0.00 C ATOM 1591 O LYS A 100 84.114 17.660 21.527 1.00 0.00 O ATOM 1592 CB LYS A 100 86.216 16.817 19.125 1.00 0.00 C ATOM 1593 CG LYS A 100 86.964 17.954 19.831 1.00 0.00 C ATOM 1594 CD LYS A 100 87.894 18.676 18.840 1.00 0.00 C ATOM 1595 CE LYS A 100 89.121 17.808 18.524 1.00 0.00 C ATOM 1596 NZ LYS A 100 90.174 18.651 17.882 1.00 0.00 N ATOM 0 H LYS A 100 85.036 14.708 18.541 1.00 0.00 H new ATOM 0 HA LYS A 100 85.867 15.873 21.022 1.00 0.00 H new ATOM 0 HB2 LYS A 100 86.927 16.106 18.705 1.00 0.00 H new ATOM 0 HB3 LYS A 100 85.632 17.213 18.294 1.00 0.00 H new ATOM 0 HG2 LYS A 100 86.250 18.662 20.252 1.00 0.00 H new ATOM 0 HG3 LYS A 100 87.546 17.555 20.662 1.00 0.00 H new ATOM 0 HD2 LYS A 100 87.353 18.899 17.921 1.00 0.00 H new ATOM 0 HD3 LYS A 100 88.214 19.629 19.261 1.00 0.00 H new ATOM 0 HE2 LYS A 100 89.507 17.358 19.439 1.00 0.00 H new ATOM 0 HE3 LYS A 100 88.840 16.990 17.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 91.005 18.064 17.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 89.802 19.060 17.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 90.449 19.417 18.530 1.00 0.00 H new ATOM 1610 N LYS A 101 83.117 17.064 19.652 1.00 0.00 N ATOM 1611 CA LYS A 101 81.920 17.920 19.921 1.00 0.00 C ATOM 1612 C LYS A 101 80.715 17.035 20.256 1.00 0.00 C ATOM 1613 O LYS A 101 79.994 17.376 21.181 1.00 0.00 O ATOM 1614 CB LYS A 101 81.612 18.737 18.668 1.00 0.00 C ATOM 1615 CG LYS A 101 80.512 19.751 18.974 1.00 0.00 C ATOM 1616 CD LYS A 101 80.250 20.596 17.727 1.00 0.00 C ATOM 1617 CE LYS A 101 79.197 21.660 18.038 1.00 0.00 C ATOM 1618 NZ LYS A 101 78.938 22.469 16.813 1.00 0.00 N ATOM 1619 OXT LYS A 101 80.532 16.035 19.583 1.00 0.00 O ATOM 0 H LYS A 101 83.078 16.541 18.777 1.00 0.00 H new ATOM 0 HA LYS A 101 82.122 18.582 20.763 1.00 0.00 H new ATOM 0 HB2 LYS A 101 82.510 19.252 18.328 1.00 0.00 H new ATOM 0 HB3 LYS A 101 81.297 18.077 17.860 1.00 0.00 H new ATOM 0 HG2 LYS A 101 79.600 19.237 19.278 1.00 0.00 H new ATOM 0 HG3 LYS A 101 80.810 20.390 19.805 1.00 0.00 H new ATOM 0 HD2 LYS A 101 81.174 21.071 17.397 1.00 0.00 H new ATOM 0 HD3 LYS A 101 79.908 19.960 16.910 1.00 0.00 H new ATOM 0 HE2 LYS A 101 78.275 21.188 18.377 1.00 0.00 H new ATOM 0 HE3 LYS A 101 79.542 22.304 18.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 78.222 23.194 17.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 79.819 22.930 16.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 78.592 21.848 16.054 1.00 0.00 H new TER 1633 LYS A 101 ATOM 1634 N MET B 1 95.626 5.607 -14.053 1.00 0.00 N ATOM 1635 CA MET B 1 96.156 4.502 -14.901 1.00 0.00 C ATOM 1636 C MET B 1 96.474 3.290 -14.022 1.00 0.00 C ATOM 1637 O MET B 1 96.919 2.266 -14.500 1.00 0.00 O ATOM 1638 CB MET B 1 97.436 4.970 -15.598 1.00 0.00 C ATOM 1639 CG MET B 1 97.121 6.165 -16.500 1.00 0.00 C ATOM 1640 SD MET B 1 98.635 6.715 -17.324 1.00 0.00 S ATOM 1641 CE MET B 1 97.896 8.061 -18.282 1.00 0.00 C ATOM 0 H1 MET B 1 95.253 6.363 -14.662 1.00 0.00 H new ATOM 0 H2 MET B 1 94.864 5.244 -13.446 1.00 0.00 H new ATOM 0 H3 MET B 1 96.391 5.986 -13.459 1.00 0.00 H new ATOM 0 HA MET B 1 95.410 4.225 -15.646 1.00 0.00 H new ATOM 0 HB2 MET B 1 98.185 5.248 -14.857 1.00 0.00 H new ATOM 0 HB3 MET B 1 97.859 4.157 -16.188 1.00 0.00 H new ATOM 0 HG2 MET B 1 96.371 5.887 -17.241 1.00 0.00 H new ATOM 0 HG3 MET B 1 96.699 6.979 -15.910 1.00 0.00 H new ATOM 0 HE1 MET B 1 98.667 8.550 -18.877 1.00 0.00 H new ATOM 0 HE2 MET B 1 97.128 7.658 -18.943 1.00 0.00 H new ATOM 0 HE3 MET B 1 97.447 8.787 -17.604 1.00 0.00 H new ATOM 1653 N ALA B 2 96.253 3.398 -12.738 1.00 0.00 N ATOM 1654 CA ALA B 2 96.545 2.254 -11.823 1.00 0.00 C ATOM 1655 C ALA B 2 95.584 2.297 -10.632 1.00 0.00 C ATOM 1656 O ALA B 2 94.925 3.289 -10.391 1.00 0.00 O ATOM 1657 CB ALA B 2 97.990 2.352 -11.324 1.00 0.00 C ATOM 0 H ALA B 2 95.882 4.231 -12.282 1.00 0.00 H new ATOM 0 HA ALA B 2 96.414 1.315 -12.361 1.00 0.00 H new ATOM 0 HB1 ALA B 2 98.202 1.517 -10.656 1.00 0.00 H new ATOM 0 HB2 ALA B 2 98.671 2.319 -12.174 1.00 0.00 H new ATOM 0 HB3 ALA B 2 98.126 3.290 -10.786 1.00 0.00 H new ATOM 1663 N CYS B 3 95.492 1.227 -9.891 1.00 0.00 N ATOM 1664 CA CYS B 3 94.565 1.203 -8.722 1.00 0.00 C ATOM 1665 C CYS B 3 93.176 1.694 -9.152 1.00 0.00 C ATOM 1666 O CYS B 3 92.704 2.708 -8.679 1.00 0.00 O ATOM 1667 CB CYS B 3 95.106 2.115 -7.618 1.00 0.00 C ATOM 1668 SG CYS B 3 96.767 1.571 -7.147 1.00 0.00 S ATOM 0 H CYS B 3 96.019 0.367 -10.044 1.00 0.00 H new ATOM 0 HA CYS B 3 94.489 0.182 -8.347 1.00 0.00 H new ATOM 0 HB2 CYS B 3 95.135 3.148 -7.966 1.00 0.00 H new ATOM 0 HB3 CYS B 3 94.444 2.089 -6.753 1.00 0.00 H new ATOM 0 HG CYS B 3 96.811 1.373 -5.863 1.00 0.00 H new ATOM 1674 N PRO B 4 92.518 0.988 -10.044 1.00 0.00 N ATOM 1675 CA PRO B 4 91.166 1.410 -10.505 1.00 0.00 C ATOM 1676 C PRO B 4 90.206 1.619 -9.330 1.00 0.00 C ATOM 1677 O PRO B 4 89.117 2.132 -9.486 1.00 0.00 O ATOM 1678 CB PRO B 4 90.729 0.238 -11.404 1.00 0.00 C ATOM 1679 CG PRO B 4 91.943 -0.689 -11.619 1.00 0.00 C ATOM 1680 CD PRO B 4 93.060 -0.266 -10.644 1.00 0.00 C ATOM 0 HA PRO B 4 91.169 2.368 -11.025 1.00 0.00 H new ATOM 0 HB2 PRO B 4 89.910 -0.311 -10.940 1.00 0.00 H new ATOM 0 HB3 PRO B 4 90.362 0.610 -12.360 1.00 0.00 H new ATOM 0 HG2 PRO B 4 91.662 -1.728 -11.445 1.00 0.00 H new ATOM 0 HG3 PRO B 4 92.293 -0.622 -12.649 1.00 0.00 H new ATOM 0 HD2 PRO B 4 93.247 -1.028 -9.888 1.00 0.00 H new ATOM 0 HD3 PRO B 4 94.004 -0.092 -11.161 1.00 0.00 H new ATOM 1688 N LEU B 5 90.611 1.224 -8.156 1.00 0.00 N ATOM 1689 CA LEU B 5 89.736 1.397 -6.968 1.00 0.00 C ATOM 1690 C LEU B 5 89.457 2.888 -6.807 1.00 0.00 C ATOM 1691 O LEU B 5 88.365 3.294 -6.474 1.00 0.00 O ATOM 1692 CB LEU B 5 90.459 0.868 -5.722 1.00 0.00 C ATOM 1693 CG LEU B 5 89.572 1.025 -4.475 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.305 0.159 -4.618 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.371 0.576 -3.242 1.00 0.00 C ATOM 0 H LEU B 5 91.514 0.787 -7.969 1.00 0.00 H new ATOM 0 HA LEU B 5 88.803 0.848 -7.093 1.00 0.00 H new ATOM 0 HB2 LEU B 5 90.716 -0.182 -5.862 1.00 0.00 H new ATOM 0 HB3 LEU B 5 91.394 1.409 -5.580 1.00 0.00 H new ATOM 0 HG LEU B 5 89.273 2.067 -4.365 1.00 0.00 H new ATOM 0 HD11 LEU B 5 87.682 0.276 -3.731 1.00 0.00 H new ATOM 0 HD12 LEU B 5 87.745 0.475 -5.498 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.590 -0.888 -4.726 1.00 0.00 H new ATOM 0 HD21 LEU B 5 89.754 0.682 -2.350 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.664 -0.467 -3.358 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.263 1.194 -3.142 1.00 0.00 H new ATOM 1707 N GLU B 6 90.449 3.703 -7.033 1.00 0.00 N ATOM 1708 CA GLU B 6 90.260 5.171 -6.887 1.00 0.00 C ATOM 1709 C GLU B 6 89.173 5.660 -7.846 1.00 0.00 C ATOM 1710 O GLU B 6 88.312 6.435 -7.474 1.00 0.00 O ATOM 1711 CB GLU B 6 91.565 5.876 -7.245 1.00 0.00 C ATOM 1712 CG GLU B 6 92.618 5.602 -6.173 1.00 0.00 C ATOM 1713 CD GLU B 6 93.916 6.316 -6.549 1.00 0.00 C ATOM 1714 OE1 GLU B 6 94.020 7.498 -6.272 1.00 0.00 O ATOM 1715 OE2 GLU B 6 94.783 5.668 -7.110 1.00 0.00 O ATOM 0 H GLU B 6 91.386 3.413 -7.314 1.00 0.00 H new ATOM 0 HA GLU B 6 89.969 5.391 -5.860 1.00 0.00 H new ATOM 0 HB2 GLU B 6 91.922 5.528 -8.214 1.00 0.00 H new ATOM 0 HB3 GLU B 6 91.396 6.949 -7.334 1.00 0.00 H new ATOM 0 HG2 GLU B 6 92.265 5.951 -5.202 1.00 0.00 H new ATOM 0 HG3 GLU B 6 92.792 4.530 -6.083 1.00 0.00 H new ATOM 1722 N LYS B 7 89.198 5.223 -9.076 1.00 0.00 N ATOM 1723 CA LYS B 7 88.158 5.677 -10.036 1.00 0.00 C ATOM 1724 C LYS B 7 86.845 5.048 -9.623 1.00 0.00 C ATOM 1725 O LYS B 7 85.830 5.702 -9.512 1.00 0.00 O ATOM 1726 CB LYS B 7 88.519 5.238 -11.458 1.00 0.00 C ATOM 1727 CG LYS B 7 89.960 5.643 -11.759 1.00 0.00 C ATOM 1728 CD LYS B 7 90.229 5.560 -13.268 1.00 0.00 C ATOM 1729 CE LYS B 7 90.222 4.098 -13.723 1.00 0.00 C ATOM 1730 NZ LYS B 7 90.780 4.005 -15.104 1.00 0.00 N ATOM 0 H LYS B 7 89.890 4.575 -9.454 1.00 0.00 H new ATOM 0 HA LYS B 7 88.085 6.764 -10.025 1.00 0.00 H new ATOM 0 HB2 LYS B 7 88.404 4.159 -11.558 1.00 0.00 H new ATOM 0 HB3 LYS B 7 87.842 5.699 -12.177 1.00 0.00 H new ATOM 0 HG2 LYS B 7 90.142 6.658 -11.405 1.00 0.00 H new ATOM 0 HG3 LYS B 7 90.649 4.990 -11.223 1.00 0.00 H new ATOM 0 HD2 LYS B 7 89.470 6.122 -13.812 1.00 0.00 H new ATOM 0 HD3 LYS B 7 91.191 6.017 -13.500 1.00 0.00 H new ATOM 0 HE2 LYS B 7 90.813 3.490 -13.038 1.00 0.00 H new ATOM 0 HE3 LYS B 7 89.206 3.704 -13.702 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 90.776 3.012 -15.414 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 90.198 4.573 -15.753 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 91.756 4.365 -15.109 1.00 0.00 H new ATOM 1744 N ALA B 8 86.867 3.783 -9.354 1.00 0.00 N ATOM 1745 CA ALA B 8 85.627 3.118 -8.904 1.00 0.00 C ATOM 1746 C ALA B 8 85.198 3.805 -7.617 1.00 0.00 C ATOM 1747 O ALA B 8 84.038 4.078 -7.393 1.00 0.00 O ATOM 1748 CB ALA B 8 85.868 1.633 -8.666 1.00 0.00 C ATOM 0 H ALA B 8 87.687 3.181 -9.426 1.00 0.00 H new ATOM 0 HA ALA B 8 84.849 3.197 -9.663 1.00 0.00 H new ATOM 0 HB1 ALA B 8 84.942 1.163 -8.335 1.00 0.00 H new ATOM 0 HB2 ALA B 8 86.202 1.166 -9.592 1.00 0.00 H new ATOM 0 HB3 ALA B 8 86.633 1.507 -7.900 1.00 0.00 H new ATOM 1754 N LEU B 9 86.141 4.127 -6.779 1.00 0.00 N ATOM 1755 CA LEU B 9 85.788 4.841 -5.533 1.00 0.00 C ATOM 1756 C LEU B 9 85.130 6.143 -5.966 1.00 0.00 C ATOM 1757 O LEU B 9 84.140 6.571 -5.406 1.00 0.00 O ATOM 1758 CB LEU B 9 87.059 5.123 -4.716 1.00 0.00 C ATOM 1759 CG LEU B 9 86.714 5.866 -3.413 1.00 0.00 C ATOM 1760 CD1 LEU B 9 85.919 4.949 -2.471 1.00 0.00 C ATOM 1761 CD2 LEU B 9 88.017 6.292 -2.724 1.00 0.00 C ATOM 0 H LEU B 9 87.133 3.927 -6.905 1.00 0.00 H new ATOM 0 HA LEU B 9 85.119 4.253 -4.904 1.00 0.00 H new ATOM 0 HB2 LEU B 9 87.563 4.185 -4.483 1.00 0.00 H new ATOM 0 HB3 LEU B 9 87.753 5.720 -5.308 1.00 0.00 H new ATOM 0 HG LEU B 9 86.108 6.741 -3.648 1.00 0.00 H new ATOM 0 HD11 LEU B 9 85.682 5.488 -1.553 1.00 0.00 H new ATOM 0 HD12 LEU B 9 84.995 4.639 -2.959 1.00 0.00 H new ATOM 0 HD13 LEU B 9 86.515 4.069 -2.231 1.00 0.00 H new ATOM 0 HD21 LEU B 9 87.784 6.820 -1.799 1.00 0.00 H new ATOM 0 HD22 LEU B 9 88.614 5.409 -2.497 1.00 0.00 H new ATOM 0 HD23 LEU B 9 88.580 6.951 -3.385 1.00 0.00 H new ATOM 1773 N ASP B 10 85.654 6.759 -6.998 1.00 0.00 N ATOM 1774 CA ASP B 10 85.023 8.010 -7.496 1.00 0.00 C ATOM 1775 C ASP B 10 83.665 7.664 -8.104 1.00 0.00 C ATOM 1776 O ASP B 10 82.734 8.433 -8.027 1.00 0.00 O ATOM 1777 CB ASP B 10 85.910 8.688 -8.550 1.00 0.00 C ATOM 1778 CG ASP B 10 87.154 9.275 -7.879 1.00 0.00 C ATOM 1779 OD1 ASP B 10 87.089 9.547 -6.691 1.00 0.00 O ATOM 1780 OD2 ASP B 10 88.147 9.447 -8.566 1.00 0.00 O ATOM 0 H ASP B 10 86.481 6.450 -7.508 1.00 0.00 H new ATOM 0 HA ASP B 10 84.898 8.704 -6.665 1.00 0.00 H new ATOM 0 HB2 ASP B 10 86.203 7.965 -9.312 1.00 0.00 H new ATOM 0 HB3 ASP B 10 85.352 9.476 -9.056 1.00 0.00 H new ATOM 1785 N VAL B 11 83.542 6.515 -8.720 1.00 0.00 N ATOM 1786 CA VAL B 11 82.227 6.149 -9.333 1.00 0.00 C ATOM 1787 C VAL B 11 81.145 6.110 -8.251 1.00 0.00 C ATOM 1788 O VAL B 11 80.042 6.580 -8.450 1.00 0.00 O ATOM 1789 CB VAL B 11 82.331 4.772 -9.999 1.00 0.00 C ATOM 1790 CG1 VAL B 11 80.944 4.274 -10.415 1.00 0.00 C ATOM 1791 CG2 VAL B 11 83.223 4.873 -11.237 1.00 0.00 C ATOM 0 H VAL B 11 84.284 5.823 -8.825 1.00 0.00 H new ATOM 0 HA VAL B 11 81.964 6.895 -10.083 1.00 0.00 H new ATOM 0 HB VAL B 11 82.761 4.068 -9.286 1.00 0.00 H new ATOM 0 HG11 VAL B 11 81.035 3.295 -10.886 1.00 0.00 H new ATOM 0 HG12 VAL B 11 80.307 4.195 -9.534 1.00 0.00 H new ATOM 0 HG13 VAL B 11 80.502 4.977 -11.121 1.00 0.00 H new ATOM 0 HG21 VAL B 11 83.298 3.895 -11.712 1.00 0.00 H new ATOM 0 HG22 VAL B 11 82.791 5.585 -11.940 1.00 0.00 H new ATOM 0 HG23 VAL B 11 84.217 5.211 -10.943 1.00 0.00 H new ATOM 1801 N MET B 12 81.449 5.567 -7.103 1.00 0.00 N ATOM 1802 CA MET B 12 80.423 5.522 -6.023 1.00 0.00 C ATOM 1803 C MET B 12 80.137 6.958 -5.586 1.00 0.00 C ATOM 1804 O MET B 12 79.016 7.337 -5.326 1.00 0.00 O ATOM 1805 CB MET B 12 80.938 4.696 -4.835 1.00 0.00 C ATOM 1806 CG MET B 12 81.142 3.236 -5.268 1.00 0.00 C ATOM 1807 SD MET B 12 81.088 2.153 -3.817 1.00 0.00 S ATOM 1808 CE MET B 12 82.273 3.059 -2.799 1.00 0.00 C ATOM 0 H MET B 12 82.353 5.157 -6.868 1.00 0.00 H new ATOM 0 HA MET B 12 79.511 5.051 -6.388 1.00 0.00 H new ATOM 0 HB2 MET B 12 81.877 5.112 -4.471 1.00 0.00 H new ATOM 0 HB3 MET B 12 80.227 4.745 -4.010 1.00 0.00 H new ATOM 0 HG2 MET B 12 80.368 2.946 -5.979 1.00 0.00 H new ATOM 0 HG3 MET B 12 82.099 3.129 -5.778 1.00 0.00 H new ATOM 0 HE1 MET B 12 82.687 2.393 -2.042 1.00 0.00 H new ATOM 0 HE2 MET B 12 83.078 3.438 -3.428 1.00 0.00 H new ATOM 0 HE3 MET B 12 81.770 3.894 -2.311 1.00 0.00 H new ATOM 1818 N VAL B 13 81.157 7.758 -5.502 1.00 0.00 N ATOM 1819 CA VAL B 13 80.967 9.175 -5.093 1.00 0.00 C ATOM 1820 C VAL B 13 80.352 9.980 -6.245 1.00 0.00 C ATOM 1821 O VAL B 13 79.478 10.800 -6.047 1.00 0.00 O ATOM 1822 CB VAL B 13 82.330 9.757 -4.728 1.00 0.00 C ATOM 1823 CG1 VAL B 13 82.210 11.266 -4.493 1.00 0.00 C ATOM 1824 CG2 VAL B 13 82.829 9.066 -3.459 1.00 0.00 C ATOM 0 H VAL B 13 82.121 7.491 -5.700 1.00 0.00 H new ATOM 0 HA VAL B 13 80.293 9.226 -4.238 1.00 0.00 H new ATOM 0 HB VAL B 13 83.035 9.591 -5.542 1.00 0.00 H new ATOM 0 HG11 VAL B 13 83.187 11.673 -4.233 1.00 0.00 H new ATOM 0 HG12 VAL B 13 81.846 11.748 -5.401 1.00 0.00 H new ATOM 0 HG13 VAL B 13 81.511 11.453 -3.678 1.00 0.00 H new ATOM 0 HG21 VAL B 13 83.803 9.470 -3.184 1.00 0.00 H new ATOM 0 HG22 VAL B 13 82.122 9.240 -2.648 1.00 0.00 H new ATOM 0 HG23 VAL B 13 82.919 7.995 -3.639 1.00 0.00 H new ATOM 1834 N SER B 14 80.819 9.760 -7.445 1.00 0.00 N ATOM 1835 CA SER B 14 80.288 10.525 -8.609 1.00 0.00 C ATOM 1836 C SER B 14 78.791 10.270 -8.758 1.00 0.00 C ATOM 1837 O SER B 14 78.004 11.192 -8.841 1.00 0.00 O ATOM 1838 CB SER B 14 81.005 10.072 -9.882 1.00 0.00 C ATOM 1839 OG SER B 14 80.579 8.759 -10.217 1.00 0.00 O ATOM 0 H SER B 14 81.547 9.082 -7.669 1.00 0.00 H new ATOM 0 HA SER B 14 80.458 11.589 -8.447 1.00 0.00 H new ATOM 0 HB2 SER B 14 80.786 10.758 -10.700 1.00 0.00 H new ATOM 0 HB3 SER B 14 82.084 10.089 -9.731 1.00 0.00 H new ATOM 0 HG SER B 14 80.973 8.496 -11.075 1.00 0.00 H new ATOM 1845 N THR B 15 78.376 9.036 -8.776 1.00 0.00 N ATOM 1846 CA THR B 15 76.919 8.766 -8.902 1.00 0.00 C ATOM 1847 C THR B 15 76.207 9.389 -7.698 1.00 0.00 C ATOM 1848 O THR B 15 75.156 9.988 -7.809 1.00 0.00 O ATOM 1849 CB THR B 15 76.686 7.246 -8.958 1.00 0.00 C ATOM 1850 OG1 THR B 15 75.438 6.984 -9.580 1.00 0.00 O ATOM 1851 CG2 THR B 15 76.697 6.632 -7.554 1.00 0.00 C ATOM 0 H THR B 15 78.974 8.212 -8.710 1.00 0.00 H new ATOM 0 HA THR B 15 76.521 9.204 -9.817 1.00 0.00 H new ATOM 0 HB THR B 15 77.494 6.795 -9.534 1.00 0.00 H new ATOM 0 HG1 THR B 15 75.210 6.037 -9.470 1.00 0.00 H new ATOM 0 HG21 THR B 15 76.530 5.557 -7.626 1.00 0.00 H new ATOM 0 HG22 THR B 15 77.662 6.819 -7.083 1.00 0.00 H new ATOM 0 HG23 THR B 15 75.907 7.083 -6.954 1.00 0.00 H new ATOM 1859 N PHE B 16 76.801 9.246 -6.549 1.00 0.00 N ATOM 1860 CA PHE B 16 76.213 9.811 -5.302 1.00 0.00 C ATOM 1861 C PHE B 16 76.077 11.334 -5.425 1.00 0.00 C ATOM 1862 O PHE B 16 75.108 11.918 -4.985 1.00 0.00 O ATOM 1863 CB PHE B 16 77.139 9.478 -4.133 1.00 0.00 C ATOM 1864 CG PHE B 16 76.582 10.034 -2.844 1.00 0.00 C ATOM 1865 CD1 PHE B 16 76.880 11.347 -2.464 1.00 0.00 C ATOM 1866 CD2 PHE B 16 75.776 9.234 -2.022 1.00 0.00 C ATOM 1867 CE1 PHE B 16 76.373 11.863 -1.265 1.00 0.00 C ATOM 1868 CE2 PHE B 16 75.271 9.749 -0.822 1.00 0.00 C ATOM 1869 CZ PHE B 16 75.569 11.063 -0.443 1.00 0.00 C ATOM 0 H PHE B 16 77.684 8.753 -6.418 1.00 0.00 H new ATOM 0 HA PHE B 16 75.225 9.382 -5.137 1.00 0.00 H new ATOM 0 HB2 PHE B 16 77.256 8.397 -4.050 1.00 0.00 H new ATOM 0 HB3 PHE B 16 78.130 9.892 -4.317 1.00 0.00 H new ATOM 0 HD1 PHE B 16 77.502 11.963 -3.096 1.00 0.00 H new ATOM 0 HD2 PHE B 16 75.545 8.220 -2.314 1.00 0.00 H new ATOM 0 HE1 PHE B 16 76.602 12.878 -0.974 1.00 0.00 H new ATOM 0 HE2 PHE B 16 74.651 9.132 -0.188 1.00 0.00 H new ATOM 0 HZ PHE B 16 75.179 11.460 0.483 1.00 0.00 H new ATOM 1879 N HIS B 17 77.051 11.980 -6.009 1.00 0.00 N ATOM 1880 CA HIS B 17 76.988 13.463 -6.145 1.00 0.00 C ATOM 1881 C HIS B 17 75.902 13.843 -7.145 1.00 0.00 C ATOM 1882 O HIS B 17 75.345 14.919 -7.080 1.00 0.00 O ATOM 1883 CB HIS B 17 78.337 14.005 -6.631 1.00 0.00 C ATOM 1884 CG HIS B 17 79.342 13.930 -5.517 1.00 0.00 C ATOM 1885 ND1 HIS B 17 78.967 13.764 -4.192 1.00 0.00 N ATOM 1886 CD2 HIS B 17 80.713 14.008 -5.512 1.00 0.00 C ATOM 1887 CE1 HIS B 17 80.090 13.750 -3.451 1.00 0.00 C ATOM 1888 NE2 HIS B 17 81.179 13.894 -4.208 1.00 0.00 N ATOM 0 H HIS B 17 77.887 11.544 -6.398 1.00 0.00 H new ATOM 0 HA HIS B 17 76.756 13.896 -5.172 1.00 0.00 H new ATOM 0 HB2 HIS B 17 78.685 13.428 -7.487 1.00 0.00 H new ATOM 0 HB3 HIS B 17 78.227 15.036 -6.966 1.00 0.00 H new ATOM 0 HD2 HIS B 17 81.333 14.138 -6.387 1.00 0.00 H new ATOM 0 HE1 HIS B 17 80.108 13.636 -2.377 1.00 0.00 H new ATOM 0 HE2 HIS B 17 82.150 13.916 -3.895 1.00 0.00 H new ATOM 1897 N LYS B 18 75.578 12.976 -8.062 1.00 0.00 N ATOM 1898 CA LYS B 18 74.513 13.331 -9.029 1.00 0.00 C ATOM 1899 C LYS B 18 73.247 13.591 -8.223 1.00 0.00 C ATOM 1900 O LYS B 18 72.515 14.528 -8.470 1.00 0.00 O ATOM 1901 CB LYS B 18 74.274 12.164 -9.983 1.00 0.00 C ATOM 1902 CG LYS B 18 73.231 12.562 -11.025 1.00 0.00 C ATOM 1903 CD LYS B 18 72.968 11.380 -11.952 1.00 0.00 C ATOM 1904 CE LYS B 18 71.885 11.763 -12.956 1.00 0.00 C ATOM 1905 NZ LYS B 18 72.378 12.867 -13.825 1.00 0.00 N ATOM 0 H LYS B 18 75.998 12.054 -8.181 1.00 0.00 H new ATOM 0 HA LYS B 18 74.796 14.206 -9.614 1.00 0.00 H new ATOM 0 HB2 LYS B 18 75.206 11.886 -10.474 1.00 0.00 H new ATOM 0 HB3 LYS B 18 73.933 11.290 -9.427 1.00 0.00 H new ATOM 0 HG2 LYS B 18 72.307 12.866 -10.534 1.00 0.00 H new ATOM 0 HG3 LYS B 18 73.583 13.419 -11.600 1.00 0.00 H new ATOM 0 HD2 LYS B 18 73.883 11.101 -12.474 1.00 0.00 H new ATOM 0 HD3 LYS B 18 72.654 10.511 -11.373 1.00 0.00 H new ATOM 0 HE2 LYS B 18 71.617 10.899 -13.565 1.00 0.00 H new ATOM 0 HE3 LYS B 18 70.982 12.075 -12.431 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 71.790 12.924 -14.681 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 72.323 13.767 -13.307 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 73.365 12.682 -14.094 1.00 0.00 H new ATOM 1919 N TYR B 19 73.014 12.785 -7.221 1.00 0.00 N ATOM 1920 CA TYR B 19 71.826 13.002 -6.350 1.00 0.00 C ATOM 1921 C TYR B 19 72.082 14.266 -5.537 1.00 0.00 C ATOM 1922 O TYR B 19 71.194 15.059 -5.298 1.00 0.00 O ATOM 1923 CB TYR B 19 71.643 11.810 -5.405 1.00 0.00 C ATOM 1924 CG TYR B 19 71.205 10.592 -6.192 1.00 0.00 C ATOM 1925 CD1 TYR B 19 69.843 10.338 -6.408 1.00 0.00 C ATOM 1926 CD2 TYR B 19 72.169 9.713 -6.700 1.00 0.00 C ATOM 1927 CE1 TYR B 19 69.447 9.204 -7.134 1.00 0.00 C ATOM 1928 CE2 TYR B 19 71.777 8.580 -7.426 1.00 0.00 C ATOM 1929 CZ TYR B 19 70.414 8.326 -7.646 1.00 0.00 C ATOM 1930 OH TYR B 19 70.024 7.209 -8.362 1.00 0.00 O ATOM 0 H TYR B 19 73.596 11.986 -6.970 1.00 0.00 H new ATOM 0 HA TYR B 19 70.923 13.103 -6.953 1.00 0.00 H new ATOM 0 HB2 TYR B 19 72.577 11.601 -4.884 1.00 0.00 H new ATOM 0 HB3 TYR B 19 70.900 12.049 -4.644 1.00 0.00 H new ATOM 0 HD1 TYR B 19 69.099 11.015 -6.016 1.00 0.00 H new ATOM 0 HD2 TYR B 19 73.218 9.909 -6.532 1.00 0.00 H new ATOM 0 HE1 TYR B 19 68.398 9.007 -7.298 1.00 0.00 H new ATOM 0 HE2 TYR B 19 72.523 7.903 -7.816 1.00 0.00 H new ATOM 0 HH TYR B 19 70.524 7.169 -9.204 1.00 0.00 H new ATOM 1940 N SER B 20 73.302 14.455 -5.100 1.00 0.00 N ATOM 1941 CA SER B 20 73.629 15.663 -4.293 1.00 0.00 C ATOM 1942 C SER B 20 72.600 15.819 -3.180 1.00 0.00 C ATOM 1943 O SER B 20 72.523 16.837 -2.524 1.00 0.00 O ATOM 1944 CB SER B 20 73.598 16.895 -5.195 1.00 0.00 C ATOM 1945 OG SER B 20 73.852 18.057 -4.418 1.00 0.00 O ATOM 0 H SER B 20 74.084 13.822 -5.269 1.00 0.00 H new ATOM 0 HA SER B 20 74.622 15.557 -3.857 1.00 0.00 H new ATOM 0 HB2 SER B 20 74.345 16.801 -5.983 1.00 0.00 H new ATOM 0 HB3 SER B 20 72.627 16.977 -5.684 1.00 0.00 H new ATOM 0 HG SER B 20 73.640 17.875 -3.479 1.00 0.00 H new ATOM 1951 N GLY B 21 71.809 14.811 -2.965 1.00 0.00 N ATOM 1952 CA GLY B 21 70.778 14.895 -1.894 1.00 0.00 C ATOM 1953 C GLY B 21 69.665 15.842 -2.341 1.00 0.00 C ATOM 1954 O GLY B 21 69.508 16.929 -1.820 1.00 0.00 O ATOM 0 H GLY B 21 71.829 13.932 -3.482 1.00 0.00 H new ATOM 0 HA2 GLY B 21 70.369 13.906 -1.688 1.00 0.00 H new ATOM 0 HA3 GLY B 21 71.227 15.254 -0.968 1.00 0.00 H new ATOM 1958 N LYS B 22 68.897 15.438 -3.314 1.00 0.00 N ATOM 1959 CA LYS B 22 67.797 16.309 -3.819 1.00 0.00 C ATOM 1960 C LYS B 22 66.811 16.611 -2.685 1.00 0.00 C ATOM 1961 O LYS B 22 66.329 17.719 -2.551 1.00 0.00 O ATOM 1962 CB LYS B 22 67.080 15.583 -4.959 1.00 0.00 C ATOM 1963 CG LYS B 22 68.053 15.434 -6.131 1.00 0.00 C ATOM 1964 CD LYS B 22 67.376 14.712 -7.300 1.00 0.00 C ATOM 1965 CE LYS B 22 66.958 13.295 -6.887 1.00 0.00 C ATOM 1966 NZ LYS B 22 66.849 12.440 -8.104 1.00 0.00 N ATOM 0 H LYS B 22 68.984 14.537 -3.784 1.00 0.00 H new ATOM 0 HA LYS B 22 68.206 17.251 -4.184 1.00 0.00 H new ATOM 0 HB2 LYS B 22 66.735 14.604 -4.626 1.00 0.00 H new ATOM 0 HB3 LYS B 22 66.198 16.143 -5.269 1.00 0.00 H new ATOM 0 HG2 LYS B 22 68.397 16.417 -6.453 1.00 0.00 H new ATOM 0 HG3 LYS B 22 68.934 14.876 -5.812 1.00 0.00 H new ATOM 0 HD2 LYS B 22 66.501 15.275 -7.625 1.00 0.00 H new ATOM 0 HD3 LYS B 22 68.058 14.663 -8.149 1.00 0.00 H new ATOM 0 HE2 LYS B 22 67.689 12.874 -6.197 1.00 0.00 H new ATOM 0 HE3 LYS B 22 66.003 13.323 -6.362 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 66.566 11.478 -7.828 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 66.136 12.840 -8.747 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 67.769 12.405 -8.587 1.00 0.00 H new ATOM 1980 N GLU B 23 66.514 15.635 -1.863 1.00 0.00 N ATOM 1981 CA GLU B 23 65.563 15.851 -0.725 1.00 0.00 C ATOM 1982 C GLU B 23 66.340 15.907 0.592 1.00 0.00 C ATOM 1983 O GLU B 23 67.272 15.160 0.812 1.00 0.00 O ATOM 1984 CB GLU B 23 64.572 14.690 -0.672 1.00 0.00 C ATOM 1985 CG GLU B 23 63.477 14.978 0.361 1.00 0.00 C ATOM 1986 CD GLU B 23 62.607 16.138 -0.127 1.00 0.00 C ATOM 1987 OE1 GLU B 23 62.548 16.344 -1.327 1.00 0.00 O ATOM 1988 OE2 GLU B 23 62.006 16.795 0.707 1.00 0.00 O ATOM 0 H GLU B 23 66.892 14.690 -1.931 1.00 0.00 H new ATOM 0 HA GLU B 23 65.029 16.790 -0.872 1.00 0.00 H new ATOM 0 HB2 GLU B 23 64.125 14.538 -1.654 1.00 0.00 H new ATOM 0 HB3 GLU B 23 65.093 13.768 -0.413 1.00 0.00 H new ATOM 0 HG2 GLU B 23 62.864 14.090 0.514 1.00 0.00 H new ATOM 0 HG3 GLU B 23 63.926 15.226 1.323 1.00 0.00 H new ATOM 1995 N GLY B 24 65.955 16.791 1.469 1.00 0.00 N ATOM 1996 CA GLY B 24 66.657 16.910 2.783 1.00 0.00 C ATOM 1997 C GLY B 24 67.991 17.633 2.592 1.00 0.00 C ATOM 1998 O GLY B 24 68.191 18.340 1.624 1.00 0.00 O ATOM 0 H GLY B 24 65.180 17.441 1.334 1.00 0.00 H new ATOM 0 HA2 GLY B 24 66.034 17.457 3.491 1.00 0.00 H new ATOM 0 HA3 GLY B 24 66.826 15.920 3.207 1.00 0.00 H new ATOM 2002 N ASP B 25 68.911 17.458 3.504 1.00 0.00 N ATOM 2003 CA ASP B 25 70.230 18.136 3.365 1.00 0.00 C ATOM 2004 C ASP B 25 70.880 17.678 2.068 1.00 0.00 C ATOM 2005 O ASP B 25 70.871 16.510 1.732 1.00 0.00 O ATOM 2006 CB ASP B 25 71.131 17.770 4.549 1.00 0.00 C ATOM 2007 CG ASP B 25 70.612 18.445 5.821 1.00 0.00 C ATOM 2008 OD1 ASP B 25 69.882 19.415 5.699 1.00 0.00 O ATOM 2009 OD2 ASP B 25 70.963 17.986 6.897 1.00 0.00 O ATOM 0 H ASP B 25 68.805 16.877 4.336 1.00 0.00 H new ATOM 0 HA ASP B 25 70.089 19.217 3.350 1.00 0.00 H new ATOM 0 HB2 ASP B 25 71.151 16.688 4.682 1.00 0.00 H new ATOM 0 HB3 ASP B 25 72.155 18.086 4.350 1.00 0.00 H new ATOM 2014 N LYS B 26 71.433 18.594 1.328 1.00 0.00 N ATOM 2015 CA LYS B 26 72.069 18.216 0.042 1.00 0.00 C ATOM 2016 C LYS B 26 73.330 17.417 0.329 1.00 0.00 C ATOM 2017 O LYS B 26 73.853 16.729 -0.526 1.00 0.00 O ATOM 2018 CB LYS B 26 72.421 19.475 -0.756 1.00 0.00 C ATOM 2019 CG LYS B 26 71.135 20.157 -1.225 1.00 0.00 C ATOM 2020 CD LYS B 26 71.481 21.399 -2.049 1.00 0.00 C ATOM 2021 CE LYS B 26 70.187 22.071 -2.512 1.00 0.00 C ATOM 2022 NZ LYS B 26 70.510 23.247 -3.368 1.00 0.00 N ATOM 0 H LYS B 26 71.472 19.587 1.559 1.00 0.00 H new ATOM 0 HA LYS B 26 71.377 17.611 -0.544 1.00 0.00 H new ATOM 0 HB2 LYS B 26 73.004 20.159 -0.139 1.00 0.00 H new ATOM 0 HB3 LYS B 26 73.040 19.213 -1.614 1.00 0.00 H new ATOM 0 HG2 LYS B 26 70.542 19.465 -1.824 1.00 0.00 H new ATOM 0 HG3 LYS B 26 70.526 20.437 -0.365 1.00 0.00 H new ATOM 0 HD2 LYS B 26 72.072 22.093 -1.452 1.00 0.00 H new ATOM 0 HD3 LYS B 26 72.089 21.121 -2.910 1.00 0.00 H new ATOM 0 HE2 LYS B 26 69.576 21.361 -3.069 1.00 0.00 H new ATOM 0 HE3 LYS B 26 69.601 22.387 -1.649 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 69.628 23.701 -3.681 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 71.076 23.928 -2.823 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 71.052 22.933 -4.199 1.00 0.00 H new ATOM 2036 N PHE B 27 73.822 17.497 1.532 1.00 0.00 N ATOM 2037 CA PHE B 27 75.054 16.736 1.886 1.00 0.00 C ATOM 2038 C PHE B 27 74.662 15.330 2.348 1.00 0.00 C ATOM 2039 O PHE B 27 75.507 14.501 2.619 1.00 0.00 O ATOM 2040 CB PHE B 27 75.799 17.462 3.010 1.00 0.00 C ATOM 2041 CG PHE B 27 77.059 16.703 3.353 1.00 0.00 C ATOM 2042 CD1 PHE B 27 78.245 16.969 2.656 1.00 0.00 C ATOM 2043 CD2 PHE B 27 77.041 15.723 4.353 1.00 0.00 C ATOM 2044 CE1 PHE B 27 79.411 16.258 2.962 1.00 0.00 C ATOM 2045 CE2 PHE B 27 78.208 15.010 4.657 1.00 0.00 C ATOM 2046 CZ PHE B 27 79.392 15.277 3.961 1.00 0.00 C ATOM 0 H PHE B 27 73.425 18.056 2.287 1.00 0.00 H new ATOM 0 HA PHE B 27 75.705 16.664 1.015 1.00 0.00 H new ATOM 0 HB2 PHE B 27 76.047 18.477 2.700 1.00 0.00 H new ATOM 0 HB3 PHE B 27 75.161 17.544 3.890 1.00 0.00 H new ATOM 0 HD1 PHE B 27 78.259 17.723 1.883 1.00 0.00 H new ATOM 0 HD2 PHE B 27 76.127 15.517 4.890 1.00 0.00 H new ATOM 0 HE1 PHE B 27 80.326 16.466 2.427 1.00 0.00 H new ATOM 0 HE2 PHE B 27 78.194 14.254 5.428 1.00 0.00 H new ATOM 0 HZ PHE B 27 80.291 14.726 4.194 1.00 0.00 H new ATOM 2056 N LYS B 28 73.380 15.059 2.457 1.00 0.00 N ATOM 2057 CA LYS B 28 72.924 13.706 2.923 1.00 0.00 C ATOM 2058 C LYS B 28 71.766 13.205 2.050 1.00 0.00 C ATOM 2059 O LYS B 28 71.114 13.969 1.367 1.00 0.00 O ATOM 2060 CB LYS B 28 72.447 13.828 4.365 1.00 0.00 C ATOM 2061 CG LYS B 28 73.543 14.488 5.197 1.00 0.00 C ATOM 2062 CD LYS B 28 73.075 14.617 6.647 1.00 0.00 C ATOM 2063 CE LYS B 28 74.103 15.421 7.458 1.00 0.00 C ATOM 2064 NZ LYS B 28 73.778 16.875 7.377 1.00 0.00 N ATOM 0 H LYS B 28 72.630 15.716 2.243 1.00 0.00 H new ATOM 0 HA LYS B 28 73.750 12.999 2.850 1.00 0.00 H new ATOM 0 HB2 LYS B 28 71.532 14.419 4.410 1.00 0.00 H new ATOM 0 HB3 LYS B 28 72.210 12.843 4.768 1.00 0.00 H new ATOM 0 HG2 LYS B 28 74.457 13.895 5.150 1.00 0.00 H new ATOM 0 HG3 LYS B 28 73.780 15.472 4.791 1.00 0.00 H new ATOM 0 HD2 LYS B 28 72.104 15.111 6.682 1.00 0.00 H new ATOM 0 HD3 LYS B 28 72.946 13.628 7.086 1.00 0.00 H new ATOM 0 HE2 LYS B 28 74.097 15.094 8.498 1.00 0.00 H new ATOM 0 HE3 LYS B 28 75.107 15.240 7.073 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 74.134 17.358 8.226 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 74.226 17.284 6.532 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 72.747 16.997 7.316 1.00 0.00 H new ATOM 2078 N LEU B 29 71.508 11.915 2.076 1.00 0.00 N ATOM 2079 CA LEU B 29 70.393 11.324 1.261 1.00 0.00 C ATOM 2080 C LEU B 29 69.362 10.703 2.215 1.00 0.00 C ATOM 2081 O LEU B 29 69.652 10.419 3.358 1.00 0.00 O ATOM 2082 CB LEU B 29 70.992 10.255 0.311 1.00 0.00 C ATOM 2083 CG LEU B 29 70.979 10.742 -1.151 1.00 0.00 C ATOM 2084 CD1 LEU B 29 71.996 9.932 -1.972 1.00 0.00 C ATOM 2085 CD2 LEU B 29 69.574 10.545 -1.738 1.00 0.00 C ATOM 0 H LEU B 29 72.029 11.239 2.634 1.00 0.00 H new ATOM 0 HA LEU B 29 69.895 12.086 0.661 1.00 0.00 H new ATOM 0 HB2 LEU B 29 72.014 10.028 0.613 1.00 0.00 H new ATOM 0 HB3 LEU B 29 70.422 9.330 0.394 1.00 0.00 H new ATOM 0 HG LEU B 29 71.246 11.798 -1.186 1.00 0.00 H new ATOM 0 HD11 LEU B 29 71.986 10.277 -3.006 1.00 0.00 H new ATOM 0 HD12 LEU B 29 72.993 10.069 -1.553 1.00 0.00 H new ATOM 0 HD13 LEU B 29 71.731 8.875 -1.940 1.00 0.00 H new ATOM 0 HD21 LEU B 29 69.560 10.888 -2.772 1.00 0.00 H new ATOM 0 HD22 LEU B 29 69.310 9.488 -1.703 1.00 0.00 H new ATOM 0 HD23 LEU B 29 68.853 11.119 -1.156 1.00 0.00 H new ATOM 2097 N ASN B 30 68.153 10.517 1.752 1.00 0.00 N ATOM 2098 CA ASN B 30 67.082 9.934 2.614 1.00 0.00 C ATOM 2099 C ASN B 30 66.916 8.446 2.311 1.00 0.00 C ATOM 2100 O ASN B 30 66.859 8.025 1.174 1.00 0.00 O ATOM 2101 CB ASN B 30 65.755 10.647 2.337 1.00 0.00 C ATOM 2102 CG ASN B 30 65.817 12.076 2.875 1.00 0.00 C ATOM 2103 OD1 ASN B 30 66.506 12.347 3.838 1.00 0.00 O ATOM 2104 ND2 ASN B 30 65.113 13.007 2.290 1.00 0.00 N ATOM 0 H ASN B 30 67.859 10.747 0.803 1.00 0.00 H new ATOM 0 HA ASN B 30 67.364 10.063 3.659 1.00 0.00 H new ATOM 0 HB2 ASN B 30 65.554 10.660 1.266 1.00 0.00 H new ATOM 0 HB3 ASN B 30 64.935 10.106 2.808 1.00 0.00 H new ATOM 0 HD21 ASN B 30 65.141 13.964 2.641 1.00 0.00 H new ATOM 0 HD22 ASN B 30 64.535 12.777 1.481 1.00 0.00 H new ATOM 2111 N LYS B 31 66.833 7.653 3.336 1.00 0.00 N ATOM 2112 CA LYS B 31 66.664 6.187 3.160 1.00 0.00 C ATOM 2113 C LYS B 31 65.610 5.902 2.094 1.00 0.00 C ATOM 2114 O LYS B 31 65.708 4.955 1.359 1.00 0.00 O ATOM 2115 CB LYS B 31 66.209 5.580 4.487 1.00 0.00 C ATOM 2116 CG LYS B 31 64.913 6.262 4.938 1.00 0.00 C ATOM 2117 CD LYS B 31 64.543 5.785 6.344 1.00 0.00 C ATOM 2118 CE LYS B 31 63.133 6.263 6.697 1.00 0.00 C ATOM 2119 NZ LYS B 31 63.119 7.752 6.780 1.00 0.00 N ATOM 0 H LYS B 31 66.876 7.963 4.307 1.00 0.00 H new ATOM 0 HA LYS B 31 67.613 5.750 2.848 1.00 0.00 H new ATOM 0 HB2 LYS B 31 66.049 4.508 4.374 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.983 5.708 5.243 1.00 0.00 H new ATOM 0 HG2 LYS B 31 65.039 7.345 4.932 1.00 0.00 H new ATOM 0 HG3 LYS B 31 64.107 6.031 4.241 1.00 0.00 H new ATOM 0 HD2 LYS B 31 64.592 4.697 6.394 1.00 0.00 H new ATOM 0 HD3 LYS B 31 65.260 6.170 7.069 1.00 0.00 H new ATOM 0 HE2 LYS B 31 62.423 5.923 5.943 1.00 0.00 H new ATOM 0 HE3 LYS B 31 62.819 5.832 7.648 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 62.304 8.060 7.347 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 63.997 8.083 7.228 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 63.046 8.152 5.823 1.00 0.00 H new ATOM 2133 N SER B 32 64.604 6.706 1.984 1.00 0.00 N ATOM 2134 CA SER B 32 63.594 6.426 0.937 1.00 0.00 C ATOM 2135 C SER B 32 64.285 6.502 -0.407 1.00 0.00 C ATOM 2136 O SER B 32 64.034 5.713 -1.296 1.00 0.00 O ATOM 2137 CB SER B 32 62.456 7.428 0.975 1.00 0.00 C ATOM 2138 OG SER B 32 62.979 8.748 0.911 1.00 0.00 O ATOM 0 H SER B 32 64.435 7.531 2.560 1.00 0.00 H new ATOM 0 HA SER B 32 63.168 5.438 1.109 1.00 0.00 H new ATOM 0 HB2 SER B 32 61.777 7.254 0.140 1.00 0.00 H new ATOM 0 HB3 SER B 32 61.876 7.300 1.889 1.00 0.00 H new ATOM 0 HG SER B 32 62.242 9.393 0.934 1.00 0.00 H new ATOM 2144 N GLU B 33 65.177 7.435 -0.559 1.00 0.00 N ATOM 2145 CA GLU B 33 65.903 7.535 -1.840 1.00 0.00 C ATOM 2146 C GLU B 33 66.676 6.254 -2.019 1.00 0.00 C ATOM 2147 O GLU B 33 67.024 5.888 -3.115 1.00 0.00 O ATOM 2148 CB GLU B 33 66.827 8.749 -1.860 1.00 0.00 C ATOM 2149 CG GLU B 33 65.978 10.023 -1.888 1.00 0.00 C ATOM 2150 CD GLU B 33 65.272 10.137 -3.242 1.00 0.00 C ATOM 2151 OE1 GLU B 33 65.824 9.656 -4.219 1.00 0.00 O ATOM 2152 OE2 GLU B 33 64.189 10.699 -3.278 1.00 0.00 O ATOM 0 H GLU B 33 65.431 8.127 0.146 1.00 0.00 H new ATOM 0 HA GLU B 33 65.202 7.672 -2.663 1.00 0.00 H new ATOM 0 HB2 GLU B 33 67.472 8.746 -0.981 1.00 0.00 H new ATOM 0 HB3 GLU B 33 67.478 8.712 -2.733 1.00 0.00 H new ATOM 0 HG2 GLU B 33 65.243 10.001 -1.083 1.00 0.00 H new ATOM 0 HG3 GLU B 33 66.608 10.896 -1.720 1.00 0.00 H new ATOM 2159 N LEU B 34 66.926 5.531 -0.965 1.00 0.00 N ATOM 2160 CA LEU B 34 67.642 4.246 -1.173 1.00 0.00 C ATOM 2161 C LEU B 34 66.768 3.415 -2.097 1.00 0.00 C ATOM 2162 O LEU B 34 67.244 2.781 -3.014 1.00 0.00 O ATOM 2163 CB LEU B 34 67.849 3.502 0.164 1.00 0.00 C ATOM 2164 CG LEU B 34 68.524 2.119 -0.026 1.00 0.00 C ATOM 2165 CD1 LEU B 34 67.504 1.047 -0.508 1.00 0.00 C ATOM 2166 CD2 LEU B 34 69.689 2.224 -1.022 1.00 0.00 C ATOM 0 H LEU B 34 66.677 5.762 -0.003 1.00 0.00 H new ATOM 0 HA LEU B 34 68.630 4.421 -1.599 1.00 0.00 H new ATOM 0 HB2 LEU B 34 68.462 4.114 0.826 1.00 0.00 H new ATOM 0 HB3 LEU B 34 66.885 3.368 0.655 1.00 0.00 H new ATOM 0 HG LEU B 34 68.910 1.804 0.944 1.00 0.00 H new ATOM 0 HD11 LEU B 34 68.012 0.090 -0.631 1.00 0.00 H new ATOM 0 HD12 LEU B 34 66.709 0.944 0.230 1.00 0.00 H new ATOM 0 HD13 LEU B 34 67.076 1.355 -1.462 1.00 0.00 H new ATOM 0 HD21 LEU B 34 70.152 1.245 -1.144 1.00 0.00 H new ATOM 0 HD22 LEU B 34 69.314 2.571 -1.985 1.00 0.00 H new ATOM 0 HD23 LEU B 34 70.428 2.931 -0.644 1.00 0.00 H new ATOM 2178 N LYS B 35 65.474 3.438 -1.894 1.00 0.00 N ATOM 2179 CA LYS B 35 64.600 2.659 -2.807 1.00 0.00 C ATOM 2180 C LYS B 35 64.680 3.251 -4.217 1.00 0.00 C ATOM 2181 O LYS B 35 64.921 2.554 -5.179 1.00 0.00 O ATOM 2182 CB LYS B 35 63.153 2.723 -2.313 1.00 0.00 C ATOM 2183 CG LYS B 35 62.248 1.894 -3.231 1.00 0.00 C ATOM 2184 CD LYS B 35 60.808 1.973 -2.728 1.00 0.00 C ATOM 2185 CE LYS B 35 59.909 1.105 -3.610 1.00 0.00 C ATOM 2186 NZ LYS B 35 59.644 1.805 -4.900 1.00 0.00 N ATOM 0 H LYS B 35 64.999 3.952 -1.152 1.00 0.00 H new ATOM 0 HA LYS B 35 64.932 1.621 -2.825 1.00 0.00 H new ATOM 0 HB2 LYS B 35 63.092 2.346 -1.292 1.00 0.00 H new ATOM 0 HB3 LYS B 35 62.813 3.758 -2.292 1.00 0.00 H new ATOM 0 HG2 LYS B 35 62.309 2.267 -4.253 1.00 0.00 H new ATOM 0 HG3 LYS B 35 62.582 0.857 -3.250 1.00 0.00 H new ATOM 0 HD2 LYS B 35 60.754 1.635 -1.693 1.00 0.00 H new ATOM 0 HD3 LYS B 35 60.462 3.007 -2.745 1.00 0.00 H new ATOM 0 HE2 LYS B 35 60.387 0.144 -3.798 1.00 0.00 H new ATOM 0 HE3 LYS B 35 58.970 0.899 -3.097 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 58.953 1.261 -5.455 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 59.264 2.754 -4.708 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 60.530 1.889 -5.438 1.00 0.00 H new ATOM 2200 N GLU B 36 64.476 4.533 -4.348 1.00 0.00 N ATOM 2201 CA GLU B 36 64.535 5.158 -5.702 1.00 0.00 C ATOM 2202 C GLU B 36 65.955 5.110 -6.246 1.00 0.00 C ATOM 2203 O GLU B 36 66.184 4.782 -7.394 1.00 0.00 O ATOM 2204 CB GLU B 36 64.064 6.613 -5.607 1.00 0.00 C ATOM 2205 CG GLU B 36 64.252 7.311 -6.956 1.00 0.00 C ATOM 2206 CD GLU B 36 63.550 8.669 -6.930 1.00 0.00 C ATOM 2207 OE1 GLU B 36 62.870 8.942 -5.956 1.00 0.00 O ATOM 2208 OE2 GLU B 36 63.705 9.411 -7.886 1.00 0.00 O ATOM 0 H GLU B 36 64.272 5.173 -3.581 1.00 0.00 H new ATOM 0 HA GLU B 36 63.885 4.605 -6.380 1.00 0.00 H new ATOM 0 HB2 GLU B 36 63.015 6.646 -5.314 1.00 0.00 H new ATOM 0 HB3 GLU B 36 64.627 7.137 -4.835 1.00 0.00 H new ATOM 0 HG2 GLU B 36 65.314 7.443 -7.164 1.00 0.00 H new ATOM 0 HG3 GLU B 36 63.844 6.694 -7.757 1.00 0.00 H new ATOM 2215 N LEU B 37 66.912 5.427 -5.433 1.00 0.00 N ATOM 2216 CA LEU B 37 68.313 5.392 -5.894 1.00 0.00 C ATOM 2217 C LEU B 37 68.655 3.959 -6.250 1.00 0.00 C ATOM 2218 O LEU B 37 69.376 3.692 -7.189 1.00 0.00 O ATOM 2219 CB LEU B 37 69.241 5.881 -4.771 1.00 0.00 C ATOM 2220 CG LEU B 37 70.719 5.908 -5.255 1.00 0.00 C ATOM 2221 CD1 LEU B 37 71.453 7.095 -4.624 1.00 0.00 C ATOM 2222 CD2 LEU B 37 71.452 4.617 -4.849 1.00 0.00 C ATOM 0 H LEU B 37 66.781 5.711 -4.462 1.00 0.00 H new ATOM 0 HA LEU B 37 68.442 6.040 -6.761 1.00 0.00 H new ATOM 0 HB2 LEU B 37 68.939 6.878 -4.451 1.00 0.00 H new ATOM 0 HB3 LEU B 37 69.148 5.226 -3.904 1.00 0.00 H new ATOM 0 HG LEU B 37 70.713 5.997 -6.341 1.00 0.00 H new ATOM 0 HD11 LEU B 37 72.487 7.107 -4.967 1.00 0.00 H new ATOM 0 HD12 LEU B 37 70.962 8.023 -4.916 1.00 0.00 H new ATOM 0 HD13 LEU B 37 71.432 7.000 -3.538 1.00 0.00 H new ATOM 0 HD21 LEU B 37 72.484 4.659 -5.198 1.00 0.00 H new ATOM 0 HD22 LEU B 37 71.440 4.518 -3.764 1.00 0.00 H new ATOM 0 HD23 LEU B 37 70.952 3.758 -5.297 1.00 0.00 H new ATOM 2234 N LEU B 38 68.169 3.029 -5.479 1.00 0.00 N ATOM 2235 CA LEU B 38 68.511 1.605 -5.769 1.00 0.00 C ATOM 2236 C LEU B 38 68.027 1.195 -7.168 1.00 0.00 C ATOM 2237 O LEU B 38 68.769 0.632 -7.947 1.00 0.00 O ATOM 2238 CB LEU B 38 67.906 0.686 -4.704 1.00 0.00 C ATOM 2239 CG LEU B 38 68.143 -0.786 -5.072 1.00 0.00 C ATOM 2240 CD1 LEU B 38 69.632 -1.024 -5.367 1.00 0.00 C ATOM 2241 CD2 LEU B 38 67.711 -1.668 -3.895 1.00 0.00 C ATOM 0 H LEU B 38 67.561 3.185 -4.675 1.00 0.00 H new ATOM 0 HA LEU B 38 69.596 1.505 -5.745 1.00 0.00 H new ATOM 0 HB2 LEU B 38 68.352 0.901 -3.733 1.00 0.00 H new ATOM 0 HB3 LEU B 38 66.837 0.878 -4.614 1.00 0.00 H new ATOM 0 HG LEU B 38 67.562 -1.035 -5.960 1.00 0.00 H new ATOM 0 HD11 LEU B 38 69.789 -2.071 -5.627 1.00 0.00 H new ATOM 0 HD12 LEU B 38 69.943 -0.393 -6.199 1.00 0.00 H new ATOM 0 HD13 LEU B 38 70.222 -0.777 -4.484 1.00 0.00 H new ATOM 0 HD21 LEU B 38 67.875 -2.716 -4.146 1.00 0.00 H new ATOM 0 HD22 LEU B 38 68.297 -1.410 -3.013 1.00 0.00 H new ATOM 0 HD23 LEU B 38 66.653 -1.506 -3.688 1.00 0.00 H new ATOM 2253 N THR B 39 66.790 1.452 -7.494 1.00 0.00 N ATOM 2254 CA THR B 39 66.282 1.048 -8.841 1.00 0.00 C ATOM 2255 C THR B 39 66.830 1.975 -9.911 1.00 0.00 C ATOM 2256 O THR B 39 67.038 1.585 -11.043 1.00 0.00 O ATOM 2257 CB THR B 39 64.761 1.149 -8.868 1.00 0.00 C ATOM 2258 OG1 THR B 39 64.378 2.517 -8.834 1.00 0.00 O ATOM 2259 CG2 THR B 39 64.188 0.438 -7.658 1.00 0.00 C ATOM 0 H THR B 39 66.112 1.920 -6.893 1.00 0.00 H new ATOM 0 HA THR B 39 66.603 0.024 -9.034 1.00 0.00 H new ATOM 0 HB THR B 39 64.381 0.686 -9.779 1.00 0.00 H new ATOM 0 HG1 THR B 39 63.400 2.584 -8.853 1.00 0.00 H new ATOM 0 HG21 THR B 39 63.100 0.509 -7.675 1.00 0.00 H new ATOM 0 HG22 THR B 39 64.483 -0.611 -7.679 1.00 0.00 H new ATOM 0 HG23 THR B 39 64.568 0.904 -6.749 1.00 0.00 H new ATOM 2267 N ARG B 40 67.037 3.207 -9.570 1.00 0.00 N ATOM 2268 CA ARG B 40 67.540 4.168 -10.570 1.00 0.00 C ATOM 2269 C ARG B 40 68.983 3.841 -10.914 1.00 0.00 C ATOM 2270 O ARG B 40 69.440 4.106 -12.008 1.00 0.00 O ATOM 2271 CB ARG B 40 67.439 5.603 -10.041 1.00 0.00 C ATOM 2272 CG ARG B 40 65.969 6.048 -9.956 1.00 0.00 C ATOM 2273 CD ARG B 40 65.452 6.473 -11.341 1.00 0.00 C ATOM 2274 NE ARG B 40 64.119 7.123 -11.198 1.00 0.00 N ATOM 2275 CZ ARG B 40 63.636 7.836 -12.178 1.00 0.00 C ATOM 2276 NH1 ARG B 40 64.308 7.961 -13.290 1.00 0.00 N ATOM 2277 NH2 ARG B 40 62.476 8.417 -12.047 1.00 0.00 N ATOM 0 H ARG B 40 66.878 3.590 -8.638 1.00 0.00 H new ATOM 0 HA ARG B 40 66.928 4.090 -11.468 1.00 0.00 H new ATOM 0 HB2 ARG B 40 67.901 5.666 -9.056 1.00 0.00 H new ATOM 0 HB3 ARG B 40 67.991 6.277 -10.696 1.00 0.00 H new ATOM 0 HG2 ARG B 40 65.358 5.233 -9.568 1.00 0.00 H new ATOM 0 HG3 ARG B 40 65.874 6.878 -9.256 1.00 0.00 H new ATOM 0 HD2 ARG B 40 66.156 7.162 -11.808 1.00 0.00 H new ATOM 0 HD3 ARG B 40 65.376 5.604 -11.995 1.00 0.00 H new ATOM 0 HE ARG B 40 63.585 7.011 -10.336 1.00 0.00 H new ATOM 0 HH11 ARG B 40 65.212 7.501 -13.394 1.00 0.00 H new ATOM 0 HH12 ARG B 40 63.929 8.519 -14.055 1.00 0.00 H new ATOM 0 HH21 ARG B 40 61.949 8.313 -11.180 1.00 0.00 H new ATOM 0 HH22 ARG B 40 62.096 8.975 -12.812 1.00 0.00 H new ATOM 2291 N GLU B 41 69.711 3.263 -9.994 1.00 0.00 N ATOM 2292 CA GLU B 41 71.132 2.919 -10.288 1.00 0.00 C ATOM 2293 C GLU B 41 71.218 1.458 -10.634 1.00 0.00 C ATOM 2294 O GLU B 41 72.144 1.032 -11.291 1.00 0.00 O ATOM 2295 CB GLU B 41 72.004 3.208 -9.066 1.00 0.00 C ATOM 2296 CG GLU B 41 72.097 4.718 -8.856 1.00 0.00 C ATOM 2297 CD GLU B 41 72.902 5.351 -9.995 1.00 0.00 C ATOM 2298 OE1 GLU B 41 74.058 4.987 -10.151 1.00 0.00 O ATOM 2299 OE2 GLU B 41 72.347 6.182 -10.697 1.00 0.00 O ATOM 0 H GLU B 41 69.386 3.016 -9.059 1.00 0.00 H new ATOM 0 HA GLU B 41 71.487 3.521 -11.124 1.00 0.00 H new ATOM 0 HB2 GLU B 41 71.580 2.732 -8.182 1.00 0.00 H new ATOM 0 HB3 GLU B 41 72.999 2.787 -9.208 1.00 0.00 H new ATOM 0 HG2 GLU B 41 71.098 5.152 -8.820 1.00 0.00 H new ATOM 0 HG3 GLU B 41 72.573 4.933 -7.899 1.00 0.00 H new ATOM 2306 N LEU B 42 70.257 0.677 -10.225 1.00 0.00 N ATOM 2307 CA LEU B 42 70.305 -0.774 -10.571 1.00 0.00 C ATOM 2308 C LEU B 42 68.880 -1.295 -10.816 1.00 0.00 C ATOM 2309 O LEU B 42 68.352 -2.039 -10.013 1.00 0.00 O ATOM 2310 CB LEU B 42 70.922 -1.583 -9.424 1.00 0.00 C ATOM 2311 CG LEU B 42 72.386 -1.185 -9.156 1.00 0.00 C ATOM 2312 CD1 LEU B 42 72.840 -1.824 -7.838 1.00 0.00 C ATOM 2313 CD2 LEU B 42 73.298 -1.682 -10.295 1.00 0.00 C ATOM 0 H LEU B 42 69.451 0.973 -9.674 1.00 0.00 H new ATOM 0 HA LEU B 42 70.914 -0.889 -11.468 1.00 0.00 H new ATOM 0 HB2 LEU B 42 70.334 -1.433 -8.518 1.00 0.00 H new ATOM 0 HB3 LEU B 42 70.874 -2.645 -9.663 1.00 0.00 H new ATOM 0 HG LEU B 42 72.454 -0.099 -9.098 1.00 0.00 H new ATOM 0 HD11 LEU B 42 73.876 -1.549 -7.638 1.00 0.00 H new ATOM 0 HD12 LEU B 42 72.207 -1.469 -7.025 1.00 0.00 H new ATOM 0 HD13 LEU B 42 72.761 -2.909 -7.913 1.00 0.00 H new ATOM 0 HD21 LEU B 42 74.328 -1.392 -10.089 1.00 0.00 H new ATOM 0 HD22 LEU B 42 73.234 -2.768 -10.365 1.00 0.00 H new ATOM 0 HD23 LEU B 42 72.978 -1.238 -11.238 1.00 0.00 H new ATOM 2325 N PRO B 43 68.251 -0.913 -11.899 1.00 0.00 N ATOM 2326 CA PRO B 43 66.863 -1.381 -12.186 1.00 0.00 C ATOM 2327 C PRO B 43 66.815 -2.841 -12.673 1.00 0.00 C ATOM 2328 O PRO B 43 66.408 -3.731 -11.953 1.00 0.00 O ATOM 2329 CB PRO B 43 66.426 -0.404 -13.289 1.00 0.00 C ATOM 2330 CG PRO B 43 67.699 0.205 -13.904 1.00 0.00 C ATOM 2331 CD PRO B 43 68.854 0.007 -12.904 1.00 0.00 C ATOM 0 HA PRO B 43 66.220 -1.382 -11.306 1.00 0.00 H new ATOM 0 HB2 PRO B 43 65.843 -0.922 -14.051 1.00 0.00 H new ATOM 0 HB3 PRO B 43 65.788 0.378 -12.877 1.00 0.00 H new ATOM 0 HG2 PRO B 43 67.931 -0.277 -14.854 1.00 0.00 H new ATOM 0 HG3 PRO B 43 67.552 1.265 -14.111 1.00 0.00 H new ATOM 0 HD2 PRO B 43 69.733 -0.429 -13.379 1.00 0.00 H new ATOM 0 HD3 PRO B 43 69.169 0.949 -12.455 1.00 0.00 H new ATOM 2339 N SER B 44 67.218 -3.087 -13.891 1.00 0.00 N ATOM 2340 CA SER B 44 67.186 -4.482 -14.424 1.00 0.00 C ATOM 2341 C SER B 44 68.397 -5.269 -13.916 1.00 0.00 C ATOM 2342 O SER B 44 68.463 -6.473 -14.049 1.00 0.00 O ATOM 2343 CB SER B 44 67.200 -4.447 -15.952 1.00 0.00 C ATOM 2344 OG SER B 44 68.381 -3.796 -16.398 1.00 0.00 O ATOM 0 H SER B 44 67.568 -2.383 -14.541 1.00 0.00 H new ATOM 0 HA SER B 44 66.276 -4.973 -14.079 1.00 0.00 H new ATOM 0 HB2 SER B 44 67.158 -5.461 -16.350 1.00 0.00 H new ATOM 0 HB3 SER B 44 66.320 -3.922 -16.323 1.00 0.00 H new ATOM 0 HG SER B 44 68.392 -3.774 -17.378 1.00 0.00 H new ATOM 2350 N PHE B 45 69.358 -4.600 -13.349 1.00 0.00 N ATOM 2351 CA PHE B 45 70.571 -5.307 -12.836 1.00 0.00 C ATOM 2352 C PHE B 45 70.332 -5.760 -11.396 1.00 0.00 C ATOM 2353 O PHE B 45 71.131 -6.465 -10.811 1.00 0.00 O ATOM 2354 CB PHE B 45 71.743 -4.337 -12.843 1.00 0.00 C ATOM 2355 CG PHE B 45 72.053 -3.911 -14.264 1.00 0.00 C ATOM 2356 CD1 PHE B 45 72.460 -4.860 -15.214 1.00 0.00 C ATOM 2357 CD2 PHE B 45 71.930 -2.564 -14.635 1.00 0.00 C ATOM 2358 CE1 PHE B 45 72.742 -4.461 -16.527 1.00 0.00 C ATOM 2359 CE2 PHE B 45 72.212 -2.168 -15.948 1.00 0.00 C ATOM 2360 CZ PHE B 45 72.618 -3.116 -16.894 1.00 0.00 C ATOM 0 H PHE B 45 69.360 -3.589 -13.216 1.00 0.00 H new ATOM 0 HA PHE B 45 70.781 -6.171 -13.467 1.00 0.00 H new ATOM 0 HB2 PHE B 45 71.506 -3.463 -12.236 1.00 0.00 H new ATOM 0 HB3 PHE B 45 72.619 -4.808 -12.396 1.00 0.00 H new ATOM 0 HD1 PHE B 45 72.556 -5.898 -14.933 1.00 0.00 H new ATOM 0 HD2 PHE B 45 71.617 -1.831 -13.906 1.00 0.00 H new ATOM 0 HE1 PHE B 45 73.056 -5.192 -17.257 1.00 0.00 H new ATOM 0 HE2 PHE B 45 72.116 -1.130 -16.231 1.00 0.00 H new ATOM 0 HZ PHE B 45 72.836 -2.810 -17.907 1.00 0.00 H new ATOM 2370 N LEU B 46 69.247 -5.340 -10.818 1.00 0.00 N ATOM 2371 CA LEU B 46 68.946 -5.718 -9.400 1.00 0.00 C ATOM 2372 C LEU B 46 67.440 -5.651 -9.196 1.00 0.00 C ATOM 2373 O LEU B 46 66.841 -6.519 -8.591 1.00 0.00 O ATOM 2374 CB LEU B 46 69.655 -4.736 -8.457 1.00 0.00 C ATOM 2375 CG LEU B 46 69.533 -5.181 -6.976 1.00 0.00 C ATOM 2376 CD1 LEU B 46 70.782 -4.729 -6.202 1.00 0.00 C ATOM 2377 CD2 LEU B 46 68.294 -4.547 -6.316 1.00 0.00 C ATOM 0 H LEU B 46 68.547 -4.747 -11.263 1.00 0.00 H new ATOM 0 HA LEU B 46 69.299 -6.727 -9.186 1.00 0.00 H new ATOM 0 HB2 LEU B 46 70.708 -4.663 -8.730 1.00 0.00 H new ATOM 0 HB3 LEU B 46 69.225 -3.741 -8.576 1.00 0.00 H new ATOM 0 HG LEU B 46 69.438 -6.267 -6.951 1.00 0.00 H new ATOM 0 HD11 LEU B 46 70.698 -5.041 -5.161 1.00 0.00 H new ATOM 0 HD12 LEU B 46 71.669 -5.182 -6.646 1.00 0.00 H new ATOM 0 HD13 LEU B 46 70.866 -3.643 -6.250 1.00 0.00 H new ATOM 0 HD21 LEU B 46 68.228 -4.873 -5.278 1.00 0.00 H new ATOM 0 HD22 LEU B 46 68.379 -3.461 -6.351 1.00 0.00 H new ATOM 0 HD23 LEU B 46 67.397 -4.858 -6.852 1.00 0.00 H new ATOM 2389 N GLY B 47 66.816 -4.650 -9.744 1.00 0.00 N ATOM 2390 CA GLY B 47 65.337 -4.548 -9.637 1.00 0.00 C ATOM 2391 C GLY B 47 64.779 -5.551 -10.633 1.00 0.00 C ATOM 2392 O GLY B 47 63.602 -5.593 -10.931 1.00 0.00 O ATOM 0 H GLY B 47 67.267 -3.896 -10.263 1.00 0.00 H new ATOM 0 HA2 GLY B 47 65.002 -4.774 -8.625 1.00 0.00 H new ATOM 0 HA3 GLY B 47 64.997 -3.538 -9.867 1.00 0.00 H new ATOM 2396 N LYS B 48 65.664 -6.349 -11.159 1.00 0.00 N ATOM 2397 CA LYS B 48 65.297 -7.369 -12.160 1.00 0.00 C ATOM 2398 C LYS B 48 64.062 -8.150 -11.699 1.00 0.00 C ATOM 2399 O LYS B 48 63.413 -8.820 -12.479 1.00 0.00 O ATOM 2400 CB LYS B 48 66.479 -8.324 -12.310 1.00 0.00 C ATOM 2401 CG LYS B 48 66.253 -9.254 -13.496 1.00 0.00 C ATOM 2402 CD LYS B 48 67.550 -10.009 -13.787 1.00 0.00 C ATOM 2403 CE LYS B 48 67.312 -11.030 -14.901 1.00 0.00 C ATOM 2404 NZ LYS B 48 68.546 -11.843 -15.105 1.00 0.00 N ATOM 0 H LYS B 48 66.656 -6.330 -10.924 1.00 0.00 H new ATOM 0 HA LYS B 48 65.063 -6.890 -13.111 1.00 0.00 H new ATOM 0 HB2 LYS B 48 67.399 -7.757 -12.453 1.00 0.00 H new ATOM 0 HB3 LYS B 48 66.603 -8.908 -11.398 1.00 0.00 H new ATOM 0 HG2 LYS B 48 65.449 -9.956 -13.276 1.00 0.00 H new ATOM 0 HG3 LYS B 48 65.946 -8.681 -14.371 1.00 0.00 H new ATOM 0 HD2 LYS B 48 68.331 -9.309 -14.083 1.00 0.00 H new ATOM 0 HD3 LYS B 48 67.899 -10.514 -12.886 1.00 0.00 H new ATOM 0 HE2 LYS B 48 66.476 -11.679 -14.641 1.00 0.00 H new ATOM 0 HE3 LYS B 48 67.044 -10.519 -15.826 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 68.383 -12.537 -15.862 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 69.333 -11.218 -15.371 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 68.783 -12.342 -14.224 1.00 0.00 H new ATOM 2418 N ARG B 49 63.744 -8.080 -10.432 1.00 0.00 N ATOM 2419 CA ARG B 49 62.563 -8.826 -9.897 1.00 0.00 C ATOM 2420 C ARG B 49 62.952 -10.302 -9.716 1.00 0.00 C ATOM 2421 O ARG B 49 62.110 -11.165 -9.573 1.00 0.00 O ATOM 2422 CB ARG B 49 61.362 -8.692 -10.873 1.00 0.00 C ATOM 2423 CG ARG B 49 60.038 -8.543 -10.098 1.00 0.00 C ATOM 2424 CD ARG B 49 59.716 -9.845 -9.360 1.00 0.00 C ATOM 2425 NE ARG B 49 58.330 -9.784 -8.809 1.00 0.00 N ATOM 2426 CZ ARG B 49 57.744 -10.877 -8.394 1.00 0.00 C ATOM 2427 NH1 ARG B 49 58.363 -12.022 -8.488 1.00 0.00 N ATOM 2428 NH2 ARG B 49 56.538 -10.828 -7.889 1.00 0.00 N ATOM 0 H ARG B 49 64.255 -7.534 -9.739 1.00 0.00 H new ATOM 0 HA ARG B 49 62.264 -8.410 -8.935 1.00 0.00 H new ATOM 0 HB2 ARG B 49 61.509 -7.827 -11.520 1.00 0.00 H new ATOM 0 HB3 ARG B 49 61.313 -9.569 -11.519 1.00 0.00 H new ATOM 0 HG2 ARG B 49 60.114 -7.721 -9.386 1.00 0.00 H new ATOM 0 HG3 ARG B 49 59.230 -8.296 -10.786 1.00 0.00 H new ATOM 0 HD2 ARG B 49 59.810 -10.692 -10.040 1.00 0.00 H new ATOM 0 HD3 ARG B 49 60.431 -10.003 -8.553 1.00 0.00 H new ATOM 0 HE ARG B 49 57.840 -8.891 -8.756 1.00 0.00 H new ATOM 0 HH11 ARG B 49 59.302 -12.063 -8.884 1.00 0.00 H new ATOM 0 HH12 ARG B 49 57.908 -12.876 -8.165 1.00 0.00 H new ATOM 0 HH21 ARG B 49 56.051 -9.935 -7.818 1.00 0.00 H new ATOM 0 HH22 ARG B 49 56.085 -11.683 -7.567 1.00 0.00 H new ATOM 2442 N THR B 50 64.225 -10.602 -9.726 1.00 0.00 N ATOM 2443 CA THR B 50 64.651 -12.021 -9.547 1.00 0.00 C ATOM 2444 C THR B 50 64.378 -12.460 -8.101 1.00 0.00 C ATOM 2445 O THR B 50 63.928 -13.563 -7.852 1.00 0.00 O ATOM 2446 CB THR B 50 66.142 -12.153 -9.854 1.00 0.00 C ATOM 2447 OG1 THR B 50 66.378 -11.732 -11.189 1.00 0.00 O ATOM 2448 CG2 THR B 50 66.575 -13.618 -9.693 1.00 0.00 C ATOM 0 H THR B 50 64.983 -9.931 -9.849 1.00 0.00 H new ATOM 0 HA THR B 50 64.087 -12.657 -10.230 1.00 0.00 H new ATOM 0 HB THR B 50 66.715 -11.533 -9.165 1.00 0.00 H new ATOM 0 HG1 THR B 50 67.232 -12.097 -11.501 1.00 0.00 H new ATOM 0 HG21 THR B 50 67.639 -13.709 -9.913 1.00 0.00 H new ATOM 0 HG22 THR B 50 66.387 -13.943 -8.670 1.00 0.00 H new ATOM 0 HG23 THR B 50 66.007 -14.243 -10.382 1.00 0.00 H new ATOM 2456 N ASP B 51 64.643 -11.595 -7.145 1.00 0.00 N ATOM 2457 CA ASP B 51 64.399 -11.934 -5.702 1.00 0.00 C ATOM 2458 C ASP B 51 63.668 -10.769 -5.035 1.00 0.00 C ATOM 2459 O ASP B 51 64.272 -9.817 -4.579 1.00 0.00 O ATOM 2460 CB ASP B 51 65.733 -12.170 -4.986 1.00 0.00 C ATOM 2461 CG ASP B 51 66.353 -13.478 -5.474 1.00 0.00 C ATOM 2462 OD1 ASP B 51 65.621 -14.292 -6.011 1.00 0.00 O ATOM 2463 OD2 ASP B 51 67.548 -13.652 -5.293 1.00 0.00 O ATOM 0 H ASP B 51 65.021 -10.661 -7.305 1.00 0.00 H new ATOM 0 HA ASP B 51 63.796 -12.840 -5.640 1.00 0.00 H new ATOM 0 HB2 ASP B 51 66.412 -11.340 -5.179 1.00 0.00 H new ATOM 0 HB3 ASP B 51 65.576 -12.210 -3.908 1.00 0.00 H new ATOM 2468 N GLU B 52 62.370 -10.836 -4.986 1.00 0.00 N ATOM 2469 CA GLU B 52 61.581 -9.740 -4.364 1.00 0.00 C ATOM 2470 C GLU B 52 61.784 -9.717 -2.846 1.00 0.00 C ATOM 2471 O GLU B 52 61.736 -8.673 -2.225 1.00 0.00 O ATOM 2472 CB GLU B 52 60.101 -9.957 -4.676 1.00 0.00 C ATOM 2473 CG GLU B 52 59.659 -11.321 -4.139 1.00 0.00 C ATOM 2474 CD GLU B 52 58.223 -11.599 -4.581 1.00 0.00 C ATOM 2475 OE1 GLU B 52 57.333 -10.917 -4.102 1.00 0.00 O ATOM 2476 OE2 GLU B 52 58.036 -12.491 -5.394 1.00 0.00 O ATOM 0 H GLU B 52 61.816 -11.610 -5.353 1.00 0.00 H new ATOM 0 HA GLU B 52 61.918 -8.786 -4.771 1.00 0.00 H new ATOM 0 HB2 GLU B 52 59.503 -9.166 -4.224 1.00 0.00 H new ATOM 0 HB3 GLU B 52 59.934 -9.907 -5.752 1.00 0.00 H new ATOM 0 HG2 GLU B 52 60.323 -12.102 -4.509 1.00 0.00 H new ATOM 0 HG3 GLU B 52 59.726 -11.335 -3.051 1.00 0.00 H new ATOM 2483 N ALA B 53 61.991 -10.851 -2.236 1.00 0.00 N ATOM 2484 CA ALA B 53 62.168 -10.864 -0.756 1.00 0.00 C ATOM 2485 C ALA B 53 63.376 -10.009 -0.363 1.00 0.00 C ATOM 2486 O ALA B 53 63.262 -9.094 0.423 1.00 0.00 O ATOM 2487 CB ALA B 53 62.386 -12.306 -0.281 1.00 0.00 C ATOM 0 H ALA B 53 62.045 -11.762 -2.693 1.00 0.00 H new ATOM 0 HA ALA B 53 61.274 -10.453 -0.287 1.00 0.00 H new ATOM 0 HB1 ALA B 53 62.516 -12.317 0.801 1.00 0.00 H new ATOM 0 HB2 ALA B 53 61.521 -12.912 -0.549 1.00 0.00 H new ATOM 0 HB3 ALA B 53 63.277 -12.715 -0.757 1.00 0.00 H new ATOM 2493 N ALA B 54 64.526 -10.298 -0.900 1.00 0.00 N ATOM 2494 CA ALA B 54 65.743 -9.504 -0.546 1.00 0.00 C ATOM 2495 C ALA B 54 65.545 -8.033 -0.917 1.00 0.00 C ATOM 2496 O ALA B 54 65.920 -7.143 -0.182 1.00 0.00 O ATOM 2497 CB ALA B 54 66.938 -10.068 -1.302 1.00 0.00 C ATOM 0 H ALA B 54 64.681 -11.051 -1.571 1.00 0.00 H new ATOM 0 HA ALA B 54 65.917 -9.570 0.528 1.00 0.00 H new ATOM 0 HB1 ALA B 54 67.831 -9.495 -1.051 1.00 0.00 H new ATOM 0 HB2 ALA B 54 67.085 -11.111 -1.023 1.00 0.00 H new ATOM 0 HB3 ALA B 54 66.754 -10.002 -2.374 1.00 0.00 H new ATOM 2503 N PHE B 55 64.940 -7.764 -2.033 1.00 0.00 N ATOM 2504 CA PHE B 55 64.699 -6.348 -2.409 1.00 0.00 C ATOM 2505 C PHE B 55 63.841 -5.736 -1.322 1.00 0.00 C ATOM 2506 O PHE B 55 64.032 -4.613 -0.902 1.00 0.00 O ATOM 2507 CB PHE B 55 63.953 -6.299 -3.736 1.00 0.00 C ATOM 2508 CG PHE B 55 63.693 -4.863 -4.142 1.00 0.00 C ATOM 2509 CD1 PHE B 55 64.674 -4.134 -4.830 1.00 0.00 C ATOM 2510 CD2 PHE B 55 62.467 -4.260 -3.834 1.00 0.00 C ATOM 2511 CE1 PHE B 55 64.427 -2.807 -5.208 1.00 0.00 C ATOM 2512 CE2 PHE B 55 62.220 -2.934 -4.213 1.00 0.00 C ATOM 2513 CZ PHE B 55 63.200 -2.207 -4.899 1.00 0.00 C ATOM 0 H PHE B 55 64.603 -8.458 -2.700 1.00 0.00 H new ATOM 0 HA PHE B 55 65.638 -5.805 -2.514 1.00 0.00 H new ATOM 0 HB2 PHE B 55 64.536 -6.802 -4.507 1.00 0.00 H new ATOM 0 HB3 PHE B 55 63.008 -6.836 -3.650 1.00 0.00 H new ATOM 0 HD1 PHE B 55 65.621 -4.596 -5.069 1.00 0.00 H new ATOM 0 HD2 PHE B 55 61.710 -4.818 -3.303 1.00 0.00 H new ATOM 0 HE1 PHE B 55 65.183 -2.247 -5.738 1.00 0.00 H new ATOM 0 HE2 PHE B 55 61.273 -2.472 -3.976 1.00 0.00 H new ATOM 0 HZ PHE B 55 63.010 -1.184 -5.190 1.00 0.00 H new ATOM 2523 N GLN B 56 62.898 -6.497 -0.854 1.00 0.00 N ATOM 2524 CA GLN B 56 62.005 -6.006 0.221 1.00 0.00 C ATOM 2525 C GLN B 56 62.813 -5.860 1.503 1.00 0.00 C ATOM 2526 O GLN B 56 62.476 -5.081 2.362 1.00 0.00 O ATOM 2527 CB GLN B 56 60.861 -7.008 0.436 1.00 0.00 C ATOM 2528 CG GLN B 56 59.898 -6.497 1.512 1.00 0.00 C ATOM 2529 CD GLN B 56 59.288 -5.167 1.071 1.00 0.00 C ATOM 2530 OE1 GLN B 56 58.722 -5.073 0.001 1.00 0.00 O ATOM 2531 NE2 GLN B 56 59.385 -4.130 1.852 1.00 0.00 N ATOM 0 H GLN B 56 62.707 -7.447 -1.174 1.00 0.00 H new ATOM 0 HA GLN B 56 61.582 -5.041 -0.058 1.00 0.00 H new ATOM 0 HB2 GLN B 56 60.323 -7.161 -0.499 1.00 0.00 H new ATOM 0 HB3 GLN B 56 61.267 -7.975 0.732 1.00 0.00 H new ATOM 0 HG2 GLN B 56 59.110 -7.230 1.685 1.00 0.00 H new ATOM 0 HG3 GLN B 56 60.428 -6.369 2.456 1.00 0.00 H new ATOM 0 HE21 GLN B 56 59.861 -4.211 2.751 1.00 0.00 H new ATOM 0 HE22 GLN B 56 58.985 -3.237 1.565 1.00 0.00 H new ATOM 2540 N LYS B 57 63.876 -6.600 1.638 1.00 0.00 N ATOM 2541 CA LYS B 57 64.698 -6.480 2.883 1.00 0.00 C ATOM 2542 C LYS B 57 65.405 -5.144 2.866 1.00 0.00 C ATOM 2543 O LYS B 57 65.507 -4.461 3.867 1.00 0.00 O ATOM 2544 CB LYS B 57 65.756 -7.584 2.966 1.00 0.00 C ATOM 2545 CG LYS B 57 65.091 -8.938 3.198 1.00 0.00 C ATOM 2546 CD LYS B 57 66.171 -10.013 3.356 1.00 0.00 C ATOM 2547 CE LYS B 57 65.541 -11.395 3.183 1.00 0.00 C ATOM 2548 NZ LYS B 57 64.460 -11.576 4.193 1.00 0.00 N ATOM 0 H LYS B 57 64.212 -7.276 0.952 1.00 0.00 H new ATOM 0 HA LYS B 57 64.034 -6.570 3.743 1.00 0.00 H new ATOM 0 HB2 LYS B 57 66.338 -7.610 2.044 1.00 0.00 H new ATOM 0 HB3 LYS B 57 66.453 -7.370 3.777 1.00 0.00 H new ATOM 0 HG2 LYS B 57 64.466 -8.901 4.090 1.00 0.00 H new ATOM 0 HG3 LYS B 57 64.438 -9.183 2.361 1.00 0.00 H new ATOM 0 HD2 LYS B 57 66.958 -9.865 2.617 1.00 0.00 H new ATOM 0 HD3 LYS B 57 66.637 -9.934 4.338 1.00 0.00 H new ATOM 0 HE2 LYS B 57 65.135 -11.498 2.177 1.00 0.00 H new ATOM 0 HE3 LYS B 57 66.299 -12.170 3.302 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 64.181 -12.577 4.227 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 64.806 -11.280 5.128 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 63.638 -10.997 3.929 1.00 0.00 H new ATOM 2562 N LEU B 58 65.880 -4.755 1.724 1.00 0.00 N ATOM 2563 CA LEU B 58 66.564 -3.450 1.630 1.00 0.00 C ATOM 2564 C LEU B 58 65.509 -2.409 1.906 1.00 0.00 C ATOM 2565 O LEU B 58 65.718 -1.464 2.634 1.00 0.00 O ATOM 2566 CB LEU B 58 67.141 -3.265 0.221 1.00 0.00 C ATOM 2567 CG LEU B 58 68.192 -4.349 -0.061 1.00 0.00 C ATOM 2568 CD1 LEU B 58 68.563 -4.321 -1.547 1.00 0.00 C ATOM 2569 CD2 LEU B 58 69.452 -4.106 0.790 1.00 0.00 C ATOM 0 H LEU B 58 65.823 -5.285 0.854 1.00 0.00 H new ATOM 0 HA LEU B 58 67.391 -3.374 2.336 1.00 0.00 H new ATOM 0 HB2 LEU B 58 66.342 -3.320 -0.518 1.00 0.00 H new ATOM 0 HB3 LEU B 58 67.592 -2.277 0.130 1.00 0.00 H new ATOM 0 HG LEU B 58 67.776 -5.323 0.197 1.00 0.00 H new ATOM 0 HD11 LEU B 58 69.309 -5.089 -1.750 1.00 0.00 H new ATOM 0 HD12 LEU B 58 67.673 -4.511 -2.148 1.00 0.00 H new ATOM 0 HD13 LEU B 58 68.971 -3.343 -1.802 1.00 0.00 H new ATOM 0 HD21 LEU B 58 70.188 -4.882 0.580 1.00 0.00 H new ATOM 0 HD22 LEU B 58 69.873 -3.131 0.546 1.00 0.00 H new ATOM 0 HD23 LEU B 58 69.188 -4.133 1.847 1.00 0.00 H new ATOM 2581 N MET B 59 64.349 -2.619 1.361 1.00 0.00 N ATOM 2582 CA MET B 59 63.228 -1.682 1.614 1.00 0.00 C ATOM 2583 C MET B 59 62.757 -1.869 3.051 1.00 0.00 C ATOM 2584 O MET B 59 62.363 -0.935 3.716 1.00 0.00 O ATOM 2585 CB MET B 59 62.078 -1.957 0.642 1.00 0.00 C ATOM 2586 CG MET B 59 61.008 -0.869 0.775 1.00 0.00 C ATOM 2587 SD MET B 59 59.689 -1.178 -0.428 1.00 0.00 S ATOM 2588 CE MET B 59 58.503 0.038 0.205 1.00 0.00 C ATOM 0 H MET B 59 64.128 -3.404 0.748 1.00 0.00 H new ATOM 0 HA MET B 59 63.562 -0.656 1.463 1.00 0.00 H new ATOM 0 HB2 MET B 59 62.454 -1.985 -0.381 1.00 0.00 H new ATOM 0 HB3 MET B 59 61.642 -2.934 0.849 1.00 0.00 H new ATOM 0 HG2 MET B 59 60.601 -0.865 1.786 1.00 0.00 H new ATOM 0 HG3 MET B 59 61.448 0.113 0.605 1.00 0.00 H new ATOM 0 HE1 MET B 59 57.599 0.015 -0.403 1.00 0.00 H new ATOM 0 HE2 MET B 59 58.252 -0.202 1.238 1.00 0.00 H new ATOM 0 HE3 MET B 59 58.944 1.034 0.161 1.00 0.00 H new ATOM 2598 N SER B 60 62.801 -3.073 3.541 1.00 0.00 N ATOM 2599 CA SER B 60 62.357 -3.306 4.945 1.00 0.00 C ATOM 2600 C SER B 60 63.146 -2.379 5.851 1.00 0.00 C ATOM 2601 O SER B 60 62.687 -1.979 6.902 1.00 0.00 O ATOM 2602 CB SER B 60 62.624 -4.756 5.353 1.00 0.00 C ATOM 2603 OG SER B 60 62.070 -4.993 6.639 1.00 0.00 O ATOM 0 H SER B 60 63.121 -3.901 3.038 1.00 0.00 H new ATOM 0 HA SER B 60 61.288 -3.111 5.029 1.00 0.00 H new ATOM 0 HB2 SER B 60 62.185 -5.437 4.624 1.00 0.00 H new ATOM 0 HB3 SER B 60 63.696 -4.951 5.365 1.00 0.00 H new ATOM 0 HG SER B 60 62.239 -5.922 6.902 1.00 0.00 H new ATOM 2609 N ASN B 61 64.331 -2.021 5.448 1.00 0.00 N ATOM 2610 CA ASN B 61 65.134 -1.104 6.293 1.00 0.00 C ATOM 2611 C ASN B 61 64.469 0.262 6.240 1.00 0.00 C ATOM 2612 O ASN B 61 64.342 0.948 7.234 1.00 0.00 O ATOM 2613 CB ASN B 61 66.562 -1.015 5.754 1.00 0.00 C ATOM 2614 CG ASN B 61 67.441 -0.284 6.768 1.00 0.00 C ATOM 2615 OD1 ASN B 61 66.955 0.512 7.546 1.00 0.00 O ATOM 2616 ND2 ASN B 61 68.724 -0.529 6.803 1.00 0.00 N ATOM 0 H ASN B 61 64.773 -2.321 4.579 1.00 0.00 H new ATOM 0 HA ASN B 61 65.182 -1.467 7.320 1.00 0.00 H new ATOM 0 HB2 ASN B 61 66.956 -2.014 5.568 1.00 0.00 H new ATOM 0 HB3 ASN B 61 66.571 -0.487 4.801 1.00 0.00 H new ATOM 0 HD21 ASN B 61 69.316 -0.052 7.483 1.00 0.00 H new ATOM 0 HD22 ASN B 61 69.134 -1.197 6.150 1.00 0.00 H new ATOM 2623 N LEU B 62 64.006 0.641 5.083 1.00 0.00 N ATOM 2624 CA LEU B 62 63.303 1.944 4.964 1.00 0.00 C ATOM 2625 C LEU B 62 62.078 1.866 5.861 1.00 0.00 C ATOM 2626 O LEU B 62 61.733 2.796 6.564 1.00 0.00 O ATOM 2627 CB LEU B 62 62.888 2.191 3.509 1.00 0.00 C ATOM 2628 CG LEU B 62 64.104 2.629 2.685 1.00 0.00 C ATOM 2629 CD1 LEU B 62 65.289 1.697 2.938 1.00 0.00 C ATOM 2630 CD2 LEU B 62 63.742 2.600 1.198 1.00 0.00 C ATOM 0 H LEU B 62 64.084 0.106 4.218 1.00 0.00 H new ATOM 0 HA LEU B 62 63.951 2.768 5.264 1.00 0.00 H new ATOM 0 HB2 LEU B 62 62.459 1.283 3.085 1.00 0.00 H new ATOM 0 HB3 LEU B 62 62.115 2.958 3.468 1.00 0.00 H new ATOM 0 HG LEU B 62 64.385 3.639 2.982 1.00 0.00 H new ATOM 0 HD11 LEU B 62 66.142 2.024 2.344 1.00 0.00 H new ATOM 0 HD12 LEU B 62 65.552 1.722 3.996 1.00 0.00 H new ATOM 0 HD13 LEU B 62 65.019 0.680 2.655 1.00 0.00 H new ATOM 0 HD21 LEU B 62 64.604 2.911 0.608 1.00 0.00 H new ATOM 0 HD22 LEU B 62 63.453 1.588 0.914 1.00 0.00 H new ATOM 0 HD23 LEU B 62 62.911 3.280 1.013 1.00 0.00 H new ATOM 2642 N ASP B 63 61.439 0.726 5.856 1.00 0.00 N ATOM 2643 CA ASP B 63 60.247 0.510 6.717 1.00 0.00 C ATOM 2644 C ASP B 63 60.729 -0.055 8.052 1.00 0.00 C ATOM 2645 O ASP B 63 60.010 -0.746 8.745 1.00 0.00 O ATOM 2646 CB ASP B 63 59.298 -0.490 6.054 1.00 0.00 C ATOM 2647 CG ASP B 63 58.656 0.153 4.824 1.00 0.00 C ATOM 2648 OD1 ASP B 63 58.698 1.368 4.724 1.00 0.00 O ATOM 2649 OD2 ASP B 63 58.133 -0.581 4.000 1.00 0.00 O ATOM 0 H ASP B 63 61.700 -0.075 5.281 1.00 0.00 H new ATOM 0 HA ASP B 63 59.715 1.450 6.866 1.00 0.00 H new ATOM 0 HB2 ASP B 63 59.844 -1.388 5.765 1.00 0.00 H new ATOM 0 HB3 ASP B 63 58.527 -0.799 6.760 1.00 0.00 H new ATOM 2654 N SER B 64 61.959 0.220 8.402 1.00 0.00 N ATOM 2655 CA SER B 64 62.511 -0.317 9.677 1.00 0.00 C ATOM 2656 C SER B 64 61.617 0.107 10.848 1.00 0.00 C ATOM 2657 O SER B 64 60.762 -0.636 11.286 1.00 0.00 O ATOM 2658 CB SER B 64 63.917 0.245 9.896 1.00 0.00 C ATOM 2659 OG SER B 64 64.282 0.077 11.260 1.00 0.00 O ATOM 0 H SER B 64 62.604 0.794 7.858 1.00 0.00 H new ATOM 0 HA SER B 64 62.549 -1.405 9.622 1.00 0.00 H new ATOM 0 HB2 SER B 64 64.631 -0.267 9.251 1.00 0.00 H new ATOM 0 HB3 SER B 64 63.945 1.301 9.627 1.00 0.00 H new ATOM 0 HG SER B 64 65.183 0.434 11.404 1.00 0.00 H new ATOM 2665 N ASN B 65 61.805 1.296 11.359 1.00 0.00 N ATOM 2666 CA ASN B 65 60.965 1.765 12.500 1.00 0.00 C ATOM 2667 C ASN B 65 61.258 3.242 12.779 1.00 0.00 C ATOM 2668 O ASN B 65 60.415 3.972 13.262 1.00 0.00 O ATOM 2669 CB ASN B 65 61.292 0.942 13.748 1.00 0.00 C ATOM 2670 CG ASN B 65 60.470 1.456 14.931 1.00 0.00 C ATOM 2671 OD1 ASN B 65 60.995 2.110 15.810 1.00 0.00 O ATOM 2672 ND2 ASN B 65 59.194 1.188 14.994 1.00 0.00 N ATOM 0 H ASN B 65 62.505 1.963 11.035 1.00 0.00 H new ATOM 0 HA ASN B 65 59.912 1.643 12.246 1.00 0.00 H new ATOM 0 HB2 ASN B 65 61.073 -0.111 13.570 1.00 0.00 H new ATOM 0 HB3 ASN B 65 62.356 1.012 13.974 1.00 0.00 H new ATOM 0 HD21 ASN B 65 58.640 1.528 15.780 1.00 0.00 H new ATOM 0 HD22 ASN B 65 58.751 0.639 14.257 1.00 0.00 H new ATOM 2679 N ARG B 66 62.461 3.679 12.495 1.00 0.00 N ATOM 2680 CA ARG B 66 62.843 5.104 12.755 1.00 0.00 C ATOM 2681 C ARG B 66 63.526 5.690 11.516 1.00 0.00 C ATOM 2682 O ARG B 66 64.012 4.975 10.662 1.00 0.00 O ATOM 2683 CB ARG B 66 63.815 5.156 13.935 1.00 0.00 C ATOM 2684 CG ARG B 66 63.102 4.689 15.205 1.00 0.00 C ATOM 2685 CD ARG B 66 64.072 4.740 16.384 1.00 0.00 C ATOM 2686 NE ARG B 66 63.450 4.075 17.563 1.00 0.00 N ATOM 2687 CZ ARG B 66 64.185 3.734 18.585 1.00 0.00 C ATOM 2688 NH1 ARG B 66 65.459 4.020 18.602 1.00 0.00 N ATOM 2689 NH2 ARG B 66 63.643 3.120 19.599 1.00 0.00 N ATOM 0 H ARG B 66 63.201 3.105 12.091 1.00 0.00 H new ATOM 0 HA ARG B 66 61.948 5.683 12.984 1.00 0.00 H new ATOM 0 HB2 ARG B 66 64.679 4.522 13.736 1.00 0.00 H new ATOM 0 HB3 ARG B 66 64.189 6.171 14.068 1.00 0.00 H new ATOM 0 HG2 ARG B 66 62.238 5.323 15.404 1.00 0.00 H new ATOM 0 HG3 ARG B 66 62.728 3.674 15.072 1.00 0.00 H new ATOM 0 HD2 ARG B 66 65.006 4.243 16.123 1.00 0.00 H new ATOM 0 HD3 ARG B 66 64.317 5.775 16.623 1.00 0.00 H new ATOM 0 HE ARG B 66 62.448 3.886 17.571 1.00 0.00 H new ATOM 0 HH11 ARG B 66 65.882 4.511 17.815 1.00 0.00 H new ATOM 0 HH12 ARG B 66 66.031 3.752 19.403 1.00 0.00 H new ATOM 0 HH21 ARG B 66 62.646 2.907 19.592 1.00 0.00 H new ATOM 0 HH22 ARG B 66 64.216 2.853 20.399 1.00 0.00 H new ATOM 2703 N ASP B 67 63.570 6.991 11.417 1.00 0.00 N ATOM 2704 CA ASP B 67 64.225 7.628 10.244 1.00 0.00 C ATOM 2705 C ASP B 67 65.668 7.130 10.146 1.00 0.00 C ATOM 2706 O ASP B 67 66.244 6.677 11.116 1.00 0.00 O ATOM 2707 CB ASP B 67 64.214 9.146 10.425 1.00 0.00 C ATOM 2708 CG ASP B 67 64.749 9.815 9.158 1.00 0.00 C ATOM 2709 OD1 ASP B 67 65.933 9.687 8.901 1.00 0.00 O ATOM 2710 OD2 ASP B 67 63.964 10.440 8.465 1.00 0.00 O ATOM 0 H ASP B 67 63.179 7.640 12.100 1.00 0.00 H new ATOM 0 HA ASP B 67 63.688 7.369 9.331 1.00 0.00 H new ATOM 0 HB2 ASP B 67 63.201 9.491 10.631 1.00 0.00 H new ATOM 0 HB3 ASP B 67 64.826 9.425 11.283 1.00 0.00 H new ATOM 2715 N ASN B 68 66.256 7.202 8.982 1.00 0.00 N ATOM 2716 CA ASN B 68 67.655 6.726 8.820 1.00 0.00 C ATOM 2717 C ASN B 68 68.291 7.426 7.621 1.00 0.00 C ATOM 2718 O ASN B 68 68.537 6.825 6.595 1.00 0.00 O ATOM 2719 CB ASN B 68 67.653 5.215 8.588 1.00 0.00 C ATOM 2720 CG ASN B 68 69.079 4.679 8.692 1.00 0.00 C ATOM 2721 OD1 ASN B 68 69.974 5.375 9.129 1.00 0.00 O ATOM 2722 ND2 ASN B 68 69.329 3.461 8.303 1.00 0.00 N ATOM 0 H ASN B 68 65.824 7.572 8.135 1.00 0.00 H new ATOM 0 HA ASN B 68 68.227 6.954 9.720 1.00 0.00 H new ATOM 0 HB2 ASN B 68 67.015 4.725 9.323 1.00 0.00 H new ATOM 0 HB3 ASN B 68 67.239 4.988 7.605 1.00 0.00 H new ATOM 0 HD21 ASN B 68 70.277 3.090 8.365 1.00 0.00 H new ATOM 0 HD22 ASN B 68 68.576 2.878 7.936 1.00 0.00 H new ATOM 2729 N GLU B 69 68.569 8.691 7.754 1.00 0.00 N ATOM 2730 CA GLU B 69 69.206 9.453 6.634 1.00 0.00 C ATOM 2731 C GLU B 69 70.366 8.622 6.078 1.00 0.00 C ATOM 2732 O GLU B 69 70.879 7.742 6.742 1.00 0.00 O ATOM 2733 CB GLU B 69 69.739 10.782 7.179 1.00 0.00 C ATOM 2734 CG GLU B 69 70.099 11.715 6.021 1.00 0.00 C ATOM 2735 CD GLU B 69 68.823 12.156 5.301 1.00 0.00 C ATOM 2736 OE1 GLU B 69 67.764 12.052 5.898 1.00 0.00 O ATOM 2737 OE2 GLU B 69 68.928 12.591 4.166 1.00 0.00 O ATOM 0 H GLU B 69 68.383 9.238 8.595 1.00 0.00 H new ATOM 0 HA GLU B 69 68.481 9.649 5.844 1.00 0.00 H new ATOM 0 HB2 GLU B 69 68.988 11.251 7.815 1.00 0.00 H new ATOM 0 HB3 GLU B 69 70.617 10.604 7.800 1.00 0.00 H new ATOM 0 HG2 GLU B 69 70.636 12.586 6.396 1.00 0.00 H new ATOM 0 HG3 GLU B 69 70.764 11.206 5.324 1.00 0.00 H new ATOM 2744 N VAL B 70 70.766 8.874 4.858 1.00 0.00 N ATOM 2745 CA VAL B 70 71.873 8.083 4.244 1.00 0.00 C ATOM 2746 C VAL B 70 73.137 8.923 4.149 1.00 0.00 C ATOM 2747 O VAL B 70 73.235 9.845 3.363 1.00 0.00 O ATOM 2748 CB VAL B 70 71.452 7.670 2.833 1.00 0.00 C ATOM 2749 CG1 VAL B 70 72.296 6.497 2.346 1.00 0.00 C ATOM 2750 CG2 VAL B 70 69.986 7.266 2.836 1.00 0.00 C ATOM 0 H VAL B 70 70.371 9.598 4.258 1.00 0.00 H new ATOM 0 HA VAL B 70 72.073 7.208 4.862 1.00 0.00 H new ATOM 0 HB VAL B 70 71.602 8.517 2.163 1.00 0.00 H new ATOM 0 HG11 VAL B 70 71.983 6.216 1.340 1.00 0.00 H new ATOM 0 HG12 VAL B 70 73.347 6.786 2.331 1.00 0.00 H new ATOM 0 HG13 VAL B 70 72.162 5.649 3.018 1.00 0.00 H new ATOM 0 HG21 VAL B 70 69.688 6.972 1.830 1.00 0.00 H new ATOM 0 HG22 VAL B 70 69.841 6.427 3.517 1.00 0.00 H new ATOM 0 HG23 VAL B 70 69.377 8.109 3.163 1.00 0.00 H new ATOM 2760 N ASP B 71 74.124 8.566 4.906 1.00 0.00 N ATOM 2761 CA ASP B 71 75.425 9.279 4.837 1.00 0.00 C ATOM 2762 C ASP B 71 76.295 8.438 3.919 1.00 0.00 C ATOM 2763 O ASP B 71 75.923 7.337 3.564 1.00 0.00 O ATOM 2764 CB ASP B 71 76.062 9.359 6.230 1.00 0.00 C ATOM 2765 CG ASP B 71 77.225 10.353 6.205 1.00 0.00 C ATOM 2766 OD1 ASP B 71 77.662 10.696 5.120 1.00 0.00 O ATOM 2767 OD2 ASP B 71 77.658 10.755 7.273 1.00 0.00 O ATOM 0 H ASP B 71 74.088 7.801 5.580 1.00 0.00 H new ATOM 0 HA ASP B 71 75.308 10.300 4.473 1.00 0.00 H new ATOM 0 HB2 ASP B 71 75.319 9.671 6.964 1.00 0.00 H new ATOM 0 HB3 ASP B 71 76.418 8.375 6.536 1.00 0.00 H new ATOM 2772 N PHE B 72 77.439 8.901 3.520 1.00 0.00 N ATOM 2773 CA PHE B 72 78.261 8.053 2.632 1.00 0.00 C ATOM 2774 C PHE B 72 78.458 6.707 3.335 1.00 0.00 C ATOM 2775 O PHE B 72 78.437 5.659 2.721 1.00 0.00 O ATOM 2776 CB PHE B 72 79.612 8.719 2.375 1.00 0.00 C ATOM 2777 CG PHE B 72 80.290 8.006 1.242 1.00 0.00 C ATOM 2778 CD1 PHE B 72 79.991 8.368 -0.073 1.00 0.00 C ATOM 2779 CD2 PHE B 72 81.201 6.980 1.499 1.00 0.00 C ATOM 2780 CE1 PHE B 72 80.605 7.709 -1.135 1.00 0.00 C ATOM 2781 CE2 PHE B 72 81.818 6.318 0.434 1.00 0.00 C ATOM 2782 CZ PHE B 72 81.521 6.683 -0.885 1.00 0.00 C ATOM 0 H PHE B 72 77.833 9.810 3.764 1.00 0.00 H new ATOM 0 HA PHE B 72 77.769 7.912 1.670 1.00 0.00 H new ATOM 0 HB2 PHE B 72 79.474 9.772 2.131 1.00 0.00 H new ATOM 0 HB3 PHE B 72 80.230 8.678 3.272 1.00 0.00 H new ATOM 0 HD1 PHE B 72 79.283 9.160 -0.267 1.00 0.00 H new ATOM 0 HD2 PHE B 72 81.428 6.699 2.517 1.00 0.00 H new ATOM 0 HE1 PHE B 72 80.374 7.991 -2.152 1.00 0.00 H new ATOM 0 HE2 PHE B 72 82.524 5.524 0.628 1.00 0.00 H new ATOM 0 HZ PHE B 72 81.999 6.173 -1.708 1.00 0.00 H new ATOM 2792 N GLN B 73 78.633 6.741 4.631 1.00 0.00 N ATOM 2793 CA GLN B 73 78.814 5.479 5.402 1.00 0.00 C ATOM 2794 C GLN B 73 77.564 4.595 5.287 1.00 0.00 C ATOM 2795 O GLN B 73 77.670 3.412 5.059 1.00 0.00 O ATOM 2796 CB GLN B 73 79.066 5.810 6.879 1.00 0.00 C ATOM 2797 CG GLN B 73 79.257 4.517 7.688 1.00 0.00 C ATOM 2798 CD GLN B 73 79.510 4.872 9.152 1.00 0.00 C ATOM 2799 OE1 GLN B 73 79.720 6.022 9.483 1.00 0.00 O ATOM 2800 NE2 GLN B 73 79.486 3.930 10.051 1.00 0.00 N ATOM 0 H GLN B 73 78.658 7.594 5.189 1.00 0.00 H new ATOM 0 HA GLN B 73 79.668 4.940 4.992 1.00 0.00 H new ATOM 0 HB2 GLN B 73 79.951 6.440 6.972 1.00 0.00 H new ATOM 0 HB3 GLN B 73 78.227 6.378 7.280 1.00 0.00 H new ATOM 0 HG2 GLN B 73 78.372 3.886 7.602 1.00 0.00 H new ATOM 0 HG3 GLN B 73 80.096 3.946 7.290 1.00 0.00 H new ATOM 0 HE21 GLN B 73 79.310 2.964 9.773 1.00 0.00 H new ATOM 0 HE22 GLN B 73 79.643 4.158 11.033 1.00 0.00 H new ATOM 2809 N GLU B 74 76.379 5.133 5.455 1.00 0.00 N ATOM 2810 CA GLU B 74 75.177 4.263 5.358 1.00 0.00 C ATOM 2811 C GLU B 74 74.988 3.804 3.918 1.00 0.00 C ATOM 2812 O GLU B 74 74.650 2.675 3.653 1.00 0.00 O ATOM 2813 CB GLU B 74 73.933 5.018 5.830 1.00 0.00 C ATOM 2814 CG GLU B 74 73.983 5.235 7.350 1.00 0.00 C ATOM 2815 CD GLU B 74 74.885 6.424 7.678 1.00 0.00 C ATOM 2816 OE1 GLU B 74 74.473 7.538 7.407 1.00 0.00 O ATOM 2817 OE2 GLU B 74 75.965 6.200 8.200 1.00 0.00 O ATOM 0 H GLU B 74 76.199 6.118 5.651 1.00 0.00 H new ATOM 0 HA GLU B 74 75.321 3.393 5.998 1.00 0.00 H new ATOM 0 HB2 GLU B 74 73.868 5.980 5.321 1.00 0.00 H new ATOM 0 HB3 GLU B 74 73.037 4.457 5.566 1.00 0.00 H new ATOM 0 HG2 GLU B 74 72.978 5.413 7.734 1.00 0.00 H new ATOM 0 HG3 GLU B 74 74.357 4.337 7.842 1.00 0.00 H new ATOM 2824 N TYR B 75 75.208 4.649 2.970 1.00 0.00 N ATOM 2825 CA TYR B 75 75.031 4.185 1.577 1.00 0.00 C ATOM 2826 C TYR B 75 75.976 3.000 1.354 1.00 0.00 C ATOM 2827 O TYR B 75 75.677 2.085 0.614 1.00 0.00 O ATOM 2828 CB TYR B 75 75.362 5.312 0.601 1.00 0.00 C ATOM 2829 CG TYR B 75 75.418 4.766 -0.811 1.00 0.00 C ATOM 2830 CD1 TYR B 75 74.245 4.330 -1.441 1.00 0.00 C ATOM 2831 CD2 TYR B 75 76.643 4.691 -1.487 1.00 0.00 C ATOM 2832 CE1 TYR B 75 74.297 3.820 -2.743 1.00 0.00 C ATOM 2833 CE2 TYR B 75 76.695 4.182 -2.789 1.00 0.00 C ATOM 2834 CZ TYR B 75 75.522 3.746 -3.417 1.00 0.00 C ATOM 2835 OH TYR B 75 75.572 3.238 -4.698 1.00 0.00 O ATOM 0 H TYR B 75 75.496 5.620 3.089 1.00 0.00 H new ATOM 0 HA TYR B 75 73.998 3.883 1.406 1.00 0.00 H new ATOM 0 HB2 TYR B 75 74.609 6.097 0.668 1.00 0.00 H new ATOM 0 HB3 TYR B 75 76.318 5.765 0.864 1.00 0.00 H new ATOM 0 HD1 TYR B 75 73.300 4.388 -0.921 1.00 0.00 H new ATOM 0 HD2 TYR B 75 77.548 5.026 -1.002 1.00 0.00 H new ATOM 0 HE1 TYR B 75 73.393 3.484 -3.228 1.00 0.00 H new ATOM 0 HE2 TYR B 75 77.640 4.125 -3.310 1.00 0.00 H new ATOM 0 HH TYR B 75 76.497 3.258 -5.022 1.00 0.00 H new ATOM 2845 N CYS B 76 77.115 3.014 1.996 1.00 0.00 N ATOM 2846 CA CYS B 76 78.077 1.892 1.826 1.00 0.00 C ATOM 2847 C CYS B 76 77.524 0.627 2.486 1.00 0.00 C ATOM 2848 O CYS B 76 77.535 -0.431 1.889 1.00 0.00 O ATOM 2849 CB CYS B 76 79.439 2.281 2.440 1.00 0.00 C ATOM 2850 SG CYS B 76 79.553 1.744 4.171 1.00 0.00 S ATOM 0 H CYS B 76 77.418 3.754 2.629 1.00 0.00 H new ATOM 0 HA CYS B 76 78.219 1.690 0.764 1.00 0.00 H new ATOM 0 HB2 CYS B 76 80.245 1.828 1.862 1.00 0.00 H new ATOM 0 HB3 CYS B 76 79.573 3.361 2.382 1.00 0.00 H new ATOM 0 HG CYS B 76 79.683 0.451 4.217 1.00 0.00 H new ATOM 2856 N VAL B 77 77.025 0.697 3.702 1.00 0.00 N ATOM 2857 CA VAL B 77 76.485 -0.558 4.289 1.00 0.00 C ATOM 2858 C VAL B 77 75.337 -0.998 3.404 1.00 0.00 C ATOM 2859 O VAL B 77 75.215 -2.153 3.044 1.00 0.00 O ATOM 2860 CB VAL B 77 76.021 -0.369 5.736 1.00 0.00 C ATOM 2861 CG1 VAL B 77 77.091 0.390 6.505 1.00 0.00 C ATOM 2862 CG2 VAL B 77 74.705 0.397 5.812 1.00 0.00 C ATOM 0 H VAL B 77 76.972 1.532 4.285 1.00 0.00 H new ATOM 0 HA VAL B 77 77.267 -1.317 4.327 1.00 0.00 H new ATOM 0 HB VAL B 77 75.860 -1.354 6.173 1.00 0.00 H new ATOM 0 HG11 VAL B 77 76.768 0.529 7.537 1.00 0.00 H new ATOM 0 HG12 VAL B 77 78.022 -0.177 6.489 1.00 0.00 H new ATOM 0 HG13 VAL B 77 77.251 1.363 6.041 1.00 0.00 H new ATOM 0 HG21 VAL B 77 74.410 0.510 6.855 1.00 0.00 H new ATOM 0 HG22 VAL B 77 74.831 1.382 5.361 1.00 0.00 H new ATOM 0 HG23 VAL B 77 73.933 -0.152 5.274 1.00 0.00 H new ATOM 2872 N PHE B 78 74.517 -0.068 3.010 1.00 0.00 N ATOM 2873 CA PHE B 78 73.403 -0.428 2.097 1.00 0.00 C ATOM 2874 C PHE B 78 73.998 -1.002 0.804 1.00 0.00 C ATOM 2875 O PHE B 78 73.497 -1.968 0.262 1.00 0.00 O ATOM 2876 CB PHE B 78 72.547 0.812 1.774 1.00 0.00 C ATOM 2877 CG PHE B 78 71.556 1.067 2.892 1.00 0.00 C ATOM 2878 CD1 PHE B 78 70.562 0.118 3.171 1.00 0.00 C ATOM 2879 CD2 PHE B 78 71.626 2.246 3.648 1.00 0.00 C ATOM 2880 CE1 PHE B 78 69.643 0.348 4.200 1.00 0.00 C ATOM 2881 CE2 PHE B 78 70.707 2.473 4.678 1.00 0.00 C ATOM 2882 CZ PHE B 78 69.716 1.525 4.954 1.00 0.00 C ATOM 0 H PHE B 78 74.569 0.915 3.277 1.00 0.00 H new ATOM 0 HA PHE B 78 72.763 -1.168 2.577 1.00 0.00 H new ATOM 0 HB2 PHE B 78 73.190 1.682 1.642 1.00 0.00 H new ATOM 0 HB3 PHE B 78 72.016 0.662 0.834 1.00 0.00 H new ATOM 0 HD1 PHE B 78 70.506 -0.791 2.591 1.00 0.00 H new ATOM 0 HD2 PHE B 78 72.390 2.979 3.435 1.00 0.00 H new ATOM 0 HE1 PHE B 78 68.877 -0.383 4.413 1.00 0.00 H new ATOM 0 HE2 PHE B 78 70.763 3.381 5.260 1.00 0.00 H new ATOM 0 HZ PHE B 78 69.007 1.701 5.749 1.00 0.00 H new ATOM 2892 N LEU B 79 75.070 -0.428 0.306 1.00 0.00 N ATOM 2893 CA LEU B 79 75.676 -0.978 -0.945 1.00 0.00 C ATOM 2894 C LEU B 79 76.333 -2.324 -0.631 1.00 0.00 C ATOM 2895 O LEU B 79 76.260 -3.263 -1.397 1.00 0.00 O ATOM 2896 CB LEU B 79 76.722 -0.001 -1.500 1.00 0.00 C ATOM 2897 CG LEU B 79 77.350 -0.559 -2.790 1.00 0.00 C ATOM 2898 CD1 LEU B 79 76.264 -0.756 -3.866 1.00 0.00 C ATOM 2899 CD2 LEU B 79 78.403 0.435 -3.299 1.00 0.00 C ATOM 0 H LEU B 79 75.543 0.383 0.705 1.00 0.00 H new ATOM 0 HA LEU B 79 74.898 -1.116 -1.696 1.00 0.00 H new ATOM 0 HB2 LEU B 79 76.256 0.963 -1.703 1.00 0.00 H new ATOM 0 HB3 LEU B 79 77.499 0.171 -0.755 1.00 0.00 H new ATOM 0 HG LEU B 79 77.816 -1.522 -2.581 1.00 0.00 H new ATOM 0 HD11 LEU B 79 76.719 -1.151 -4.774 1.00 0.00 H new ATOM 0 HD12 LEU B 79 75.514 -1.458 -3.501 1.00 0.00 H new ATOM 0 HD13 LEU B 79 75.790 0.201 -4.084 1.00 0.00 H new ATOM 0 HD21 LEU B 79 78.855 0.050 -4.213 1.00 0.00 H new ATOM 0 HD22 LEU B 79 77.928 1.394 -3.505 1.00 0.00 H new ATOM 0 HD23 LEU B 79 79.175 0.568 -2.541 1.00 0.00 H new ATOM 2911 N SER B 80 76.974 -2.412 0.499 1.00 0.00 N ATOM 2912 CA SER B 80 77.645 -3.683 0.893 1.00 0.00 C ATOM 2913 C SER B 80 76.581 -4.758 1.010 1.00 0.00 C ATOM 2914 O SER B 80 76.757 -5.882 0.581 1.00 0.00 O ATOM 2915 CB SER B 80 78.346 -3.510 2.240 1.00 0.00 C ATOM 2916 OG SER B 80 79.326 -2.486 2.134 1.00 0.00 O ATOM 0 H SER B 80 77.063 -1.652 1.173 1.00 0.00 H new ATOM 0 HA SER B 80 78.390 -3.960 0.147 1.00 0.00 H new ATOM 0 HB2 SER B 80 77.619 -3.254 3.011 1.00 0.00 H new ATOM 0 HB3 SER B 80 78.814 -4.447 2.542 1.00 0.00 H new ATOM 0 HG SER B 80 79.444 -2.054 3.006 1.00 0.00 H new ATOM 2922 N CYS B 81 75.458 -4.403 1.558 1.00 0.00 N ATOM 2923 CA CYS B 81 74.356 -5.378 1.668 1.00 0.00 C ATOM 2924 C CYS B 81 74.001 -5.804 0.259 1.00 0.00 C ATOM 2925 O CYS B 81 73.735 -6.958 -0.013 1.00 0.00 O ATOM 2926 CB CYS B 81 73.144 -4.726 2.333 1.00 0.00 C ATOM 2927 SG CYS B 81 73.490 -4.472 4.090 1.00 0.00 S ATOM 0 H CYS B 81 75.259 -3.476 1.934 1.00 0.00 H new ATOM 0 HA CYS B 81 74.654 -6.234 2.273 1.00 0.00 H new ATOM 0 HB2 CYS B 81 72.920 -3.773 1.853 1.00 0.00 H new ATOM 0 HB3 CYS B 81 72.264 -5.358 2.212 1.00 0.00 H new ATOM 0 HG CYS B 81 74.295 -3.461 4.232 1.00 0.00 H new ATOM 2933 N ILE B 82 74.020 -4.870 -0.653 1.00 0.00 N ATOM 2934 CA ILE B 82 73.701 -5.232 -2.060 1.00 0.00 C ATOM 2935 C ILE B 82 74.850 -6.070 -2.615 1.00 0.00 C ATOM 2936 O ILE B 82 74.650 -7.032 -3.329 1.00 0.00 O ATOM 2937 CB ILE B 82 73.509 -3.967 -2.909 1.00 0.00 C ATOM 2938 CG1 ILE B 82 72.217 -3.271 -2.466 1.00 0.00 C ATOM 2939 CG2 ILE B 82 73.417 -4.350 -4.397 1.00 0.00 C ATOM 2940 CD1 ILE B 82 72.097 -1.902 -3.141 1.00 0.00 C ATOM 0 H ILE B 82 74.239 -3.888 -0.487 1.00 0.00 H new ATOM 0 HA ILE B 82 72.773 -5.803 -2.092 1.00 0.00 H new ATOM 0 HB ILE B 82 74.355 -3.294 -2.773 1.00 0.00 H new ATOM 0 HG12 ILE B 82 71.356 -3.888 -2.723 1.00 0.00 H new ATOM 0 HG13 ILE B 82 72.212 -3.152 -1.382 1.00 0.00 H new ATOM 0 HG21 ILE B 82 73.281 -3.450 -4.997 1.00 0.00 H new ATOM 0 HG22 ILE B 82 74.335 -4.853 -4.701 1.00 0.00 H new ATOM 0 HG23 ILE B 82 72.570 -5.019 -4.549 1.00 0.00 H new ATOM 0 HD11 ILE B 82 71.176 -1.417 -2.819 1.00 0.00 H new ATOM 0 HD12 ILE B 82 72.950 -1.283 -2.862 1.00 0.00 H new ATOM 0 HD13 ILE B 82 72.080 -2.030 -4.223 1.00 0.00 H new ATOM 2952 N ALA B 83 76.058 -5.711 -2.284 1.00 0.00 N ATOM 2953 CA ALA B 83 77.230 -6.478 -2.780 1.00 0.00 C ATOM 2954 C ALA B 83 77.151 -7.926 -2.290 1.00 0.00 C ATOM 2955 O ALA B 83 77.320 -8.853 -3.050 1.00 0.00 O ATOM 2956 CB ALA B 83 78.505 -5.842 -2.246 1.00 0.00 C ATOM 0 H ALA B 83 76.284 -4.915 -1.688 1.00 0.00 H new ATOM 0 HA ALA B 83 77.233 -6.465 -3.870 1.00 0.00 H new ATOM 0 HB1 ALA B 83 79.369 -6.400 -2.607 1.00 0.00 H new ATOM 0 HB2 ALA B 83 78.570 -4.810 -2.592 1.00 0.00 H new ATOM 0 HB3 ALA B 83 78.491 -5.859 -1.156 1.00 0.00 H new ATOM 2962 N MET B 84 76.892 -8.128 -1.028 1.00 0.00 N ATOM 2963 CA MET B 84 76.801 -9.522 -0.507 1.00 0.00 C ATOM 2964 C MET B 84 75.620 -10.217 -1.155 1.00 0.00 C ATOM 2965 O MET B 84 75.660 -11.398 -1.441 1.00 0.00 O ATOM 2966 CB MET B 84 76.640 -9.506 1.011 1.00 0.00 C ATOM 2967 CG MET B 84 77.947 -9.045 1.650 1.00 0.00 C ATOM 2968 SD MET B 84 77.760 -9.025 3.450 1.00 0.00 S ATOM 2969 CE MET B 84 76.607 -7.636 3.556 1.00 0.00 C ATOM 0 H MET B 84 76.740 -7.393 -0.337 1.00 0.00 H new ATOM 0 HA MET B 84 77.716 -10.063 -0.749 1.00 0.00 H new ATOM 0 HB2 MET B 84 75.827 -8.838 1.295 1.00 0.00 H new ATOM 0 HB3 MET B 84 76.376 -10.500 1.371 1.00 0.00 H new ATOM 0 HG2 MET B 84 78.760 -9.713 1.365 1.00 0.00 H new ATOM 0 HG3 MET B 84 78.210 -8.051 1.289 1.00 0.00 H new ATOM 0 HE1 MET B 84 76.653 -7.200 4.554 1.00 0.00 H new ATOM 0 HE2 MET B 84 76.877 -6.882 2.817 1.00 0.00 H new ATOM 0 HE3 MET B 84 75.594 -7.988 3.361 1.00 0.00 H new ATOM 2979 N MET B 85 74.579 -9.491 -1.420 1.00 0.00 N ATOM 2980 CA MET B 85 73.416 -10.113 -2.083 1.00 0.00 C ATOM 2981 C MET B 85 73.915 -10.668 -3.411 1.00 0.00 C ATOM 2982 O MET B 85 73.439 -11.675 -3.893 1.00 0.00 O ATOM 2983 CB MET B 85 72.332 -9.057 -2.322 1.00 0.00 C ATOM 2984 CG MET B 85 71.121 -9.702 -2.994 1.00 0.00 C ATOM 2985 SD MET B 85 69.848 -8.445 -3.262 1.00 0.00 S ATOM 2986 CE MET B 85 68.761 -9.446 -4.303 1.00 0.00 C ATOM 0 H MET B 85 74.485 -8.498 -1.207 1.00 0.00 H new ATOM 0 HA MET B 85 72.984 -10.904 -1.470 1.00 0.00 H new ATOM 0 HB2 MET B 85 72.036 -8.605 -1.375 1.00 0.00 H new ATOM 0 HB3 MET B 85 72.724 -8.256 -2.949 1.00 0.00 H new ATOM 0 HG2 MET B 85 71.413 -10.149 -3.944 1.00 0.00 H new ATOM 0 HG3 MET B 85 70.729 -10.506 -2.370 1.00 0.00 H new ATOM 0 HE1 MET B 85 67.820 -8.918 -4.460 1.00 0.00 H new ATOM 0 HE2 MET B 85 69.242 -9.625 -5.265 1.00 0.00 H new ATOM 0 HE3 MET B 85 68.564 -10.399 -3.813 1.00 0.00 H new ATOM 2996 N CYS B 86 74.906 -10.030 -3.990 1.00 0.00 N ATOM 2997 CA CYS B 86 75.465 -10.539 -5.272 1.00 0.00 C ATOM 2998 C CYS B 86 76.852 -9.939 -5.499 1.00 0.00 C ATOM 2999 O CYS B 86 77.037 -9.067 -6.325 1.00 0.00 O ATOM 3000 CB CYS B 86 74.538 -10.165 -6.436 1.00 0.00 C ATOM 3001 SG CYS B 86 73.182 -11.360 -6.542 1.00 0.00 S ATOM 0 H CYS B 86 75.346 -9.184 -3.628 1.00 0.00 H new ATOM 0 HA CYS B 86 75.545 -11.625 -5.221 1.00 0.00 H new ATOM 0 HB2 CYS B 86 74.140 -9.161 -6.289 1.00 0.00 H new ATOM 0 HB3 CYS B 86 75.099 -10.152 -7.371 1.00 0.00 H new ATOM 0 HG CYS B 86 73.012 -11.928 -5.385 1.00 0.00 H new ATOM 3007 N ASN B 87 77.828 -10.397 -4.772 1.00 0.00 N ATOM 3008 CA ASN B 87 79.201 -9.848 -4.949 1.00 0.00 C ATOM 3009 C ASN B 87 79.671 -10.087 -6.388 1.00 0.00 C ATOM 3010 O ASN B 87 80.182 -9.193 -7.033 1.00 0.00 O ATOM 3011 CB ASN B 87 80.153 -10.537 -3.965 1.00 0.00 C ATOM 3012 CG ASN B 87 79.928 -9.973 -2.557 1.00 0.00 C ATOM 3013 OD1 ASN B 87 79.630 -8.806 -2.399 1.00 0.00 O ATOM 3014 ND2 ASN B 87 80.053 -10.759 -1.522 1.00 0.00 N ATOM 0 H ASN B 87 77.737 -11.126 -4.064 1.00 0.00 H new ATOM 0 HA ASN B 87 79.195 -8.776 -4.753 1.00 0.00 H new ATOM 0 HB2 ASN B 87 79.981 -11.613 -3.969 1.00 0.00 H new ATOM 0 HB3 ASN B 87 81.187 -10.378 -4.271 1.00 0.00 H new ATOM 0 HD21 ASN B 87 79.900 -10.393 -0.582 1.00 0.00 H new ATOM 0 HD22 ASN B 87 80.303 -11.739 -1.653 1.00 0.00 H new ATOM 3021 N GLU B 88 79.489 -11.279 -6.898 1.00 0.00 N ATOM 3022 CA GLU B 88 79.915 -11.574 -8.300 1.00 0.00 C ATOM 3023 C GLU B 88 79.473 -12.992 -8.670 1.00 0.00 C ATOM 3024 O GLU B 88 78.553 -13.187 -9.439 1.00 0.00 O ATOM 3025 CB GLU B 88 81.443 -11.481 -8.405 1.00 0.00 C ATOM 3026 CG GLU B 88 81.885 -11.684 -9.860 1.00 0.00 C ATOM 3027 CD GLU B 88 81.333 -10.554 -10.735 1.00 0.00 C ATOM 3028 OE1 GLU B 88 80.967 -9.528 -10.186 1.00 0.00 O ATOM 3029 OE2 GLU B 88 81.292 -10.735 -11.940 1.00 0.00 O ATOM 0 H GLU B 88 79.063 -12.062 -6.403 1.00 0.00 H new ATOM 0 HA GLU B 88 79.459 -10.852 -8.978 1.00 0.00 H new ATOM 0 HB2 GLU B 88 81.781 -10.509 -8.046 1.00 0.00 H new ATOM 0 HB3 GLU B 88 81.906 -12.235 -7.768 1.00 0.00 H new ATOM 0 HG2 GLU B 88 82.973 -11.703 -9.919 1.00 0.00 H new ATOM 0 HG3 GLU B 88 81.529 -12.647 -10.227 1.00 0.00 H new ATOM 3036 N PHE B 89 80.126 -13.985 -8.126 1.00 0.00 N ATOM 3037 CA PHE B 89 79.749 -15.390 -8.446 1.00 0.00 C ATOM 3038 C PHE B 89 78.451 -15.759 -7.721 1.00 0.00 C ATOM 3039 O PHE B 89 78.294 -15.507 -6.543 1.00 0.00 O ATOM 3040 CB PHE B 89 80.868 -16.333 -7.997 1.00 0.00 C ATOM 3041 CG PHE B 89 82.140 -16.010 -8.748 1.00 0.00 C ATOM 3042 CD1 PHE B 89 82.416 -16.644 -9.967 1.00 0.00 C ATOM 3043 CD2 PHE B 89 83.046 -15.079 -8.224 1.00 0.00 C ATOM 3044 CE1 PHE B 89 83.596 -16.346 -10.660 1.00 0.00 C ATOM 3045 CE2 PHE B 89 84.227 -14.783 -8.917 1.00 0.00 C ATOM 3046 CZ PHE B 89 84.501 -15.416 -10.135 1.00 0.00 C ATOM 0 H PHE B 89 80.904 -13.882 -7.474 1.00 0.00 H new ATOM 0 HA PHE B 89 79.599 -15.485 -9.521 1.00 0.00 H new ATOM 0 HB2 PHE B 89 81.032 -16.233 -6.924 1.00 0.00 H new ATOM 0 HB3 PHE B 89 80.579 -17.368 -8.180 1.00 0.00 H new ATOM 0 HD1 PHE B 89 81.719 -17.362 -10.372 1.00 0.00 H new ATOM 0 HD2 PHE B 89 82.834 -14.589 -7.285 1.00 0.00 H new ATOM 0 HE1 PHE B 89 83.808 -16.834 -11.600 1.00 0.00 H new ATOM 0 HE2 PHE B 89 84.926 -14.066 -8.512 1.00 0.00 H new ATOM 0 HZ PHE B 89 85.411 -15.187 -10.670 1.00 0.00 H new ATOM 3056 N PHE B 90 77.524 -16.366 -8.412 1.00 0.00 N ATOM 3057 CA PHE B 90 76.242 -16.761 -7.760 1.00 0.00 C ATOM 3058 C PHE B 90 76.448 -18.076 -7.007 1.00 0.00 C ATOM 3059 O PHE B 90 75.592 -18.522 -6.269 1.00 0.00 O ATOM 3060 CB PHE B 90 75.155 -16.940 -8.824 1.00 0.00 C ATOM 3061 CG PHE B 90 75.562 -18.028 -9.791 1.00 0.00 C ATOM 3062 CD1 PHE B 90 76.298 -17.707 -10.938 1.00 0.00 C ATOM 3063 CD2 PHE B 90 75.198 -19.358 -9.544 1.00 0.00 C ATOM 3064 CE1 PHE B 90 76.672 -18.714 -11.836 1.00 0.00 C ATOM 3065 CE2 PHE B 90 75.572 -20.366 -10.442 1.00 0.00 C ATOM 3066 CZ PHE B 90 76.309 -20.043 -11.589 1.00 0.00 C ATOM 0 H PHE B 90 77.599 -16.606 -9.401 1.00 0.00 H new ATOM 0 HA PHE B 90 75.931 -15.984 -7.062 1.00 0.00 H new ATOM 0 HB2 PHE B 90 74.208 -17.197 -8.350 1.00 0.00 H new ATOM 0 HB3 PHE B 90 74.999 -16.004 -9.360 1.00 0.00 H new ATOM 0 HD1 PHE B 90 76.577 -16.682 -11.130 1.00 0.00 H new ATOM 0 HD2 PHE B 90 74.629 -19.606 -8.661 1.00 0.00 H new ATOM 0 HE1 PHE B 90 77.241 -18.465 -12.720 1.00 0.00 H new ATOM 0 HE2 PHE B 90 75.292 -21.391 -10.250 1.00 0.00 H new ATOM 0 HZ PHE B 90 76.597 -20.819 -12.282 1.00 0.00 H new ATOM 3076 N GLU B 91 77.575 -18.704 -7.200 1.00 0.00 N ATOM 3077 CA GLU B 91 77.844 -19.994 -6.506 1.00 0.00 C ATOM 3078 C GLU B 91 77.815 -19.783 -4.988 1.00 0.00 C ATOM 3079 O GLU B 91 77.309 -20.604 -4.250 1.00 0.00 O ATOM 3080 CB GLU B 91 79.223 -20.509 -6.923 1.00 0.00 C ATOM 3081 CG GLU B 91 79.503 -21.850 -6.240 1.00 0.00 C ATOM 3082 CD GLU B 91 80.859 -22.386 -6.703 1.00 0.00 C ATOM 3083 OE1 GLU B 91 81.420 -21.810 -7.618 1.00 0.00 O ATOM 3084 OE2 GLU B 91 81.313 -23.361 -6.129 1.00 0.00 O ATOM 0 H GLU B 91 78.324 -18.378 -7.811 1.00 0.00 H new ATOM 0 HA GLU B 91 77.079 -20.721 -6.780 1.00 0.00 H new ATOM 0 HB2 GLU B 91 79.266 -20.626 -8.006 1.00 0.00 H new ATOM 0 HB3 GLU B 91 79.990 -19.784 -6.650 1.00 0.00 H new ATOM 0 HG2 GLU B 91 79.500 -21.726 -5.157 1.00 0.00 H new ATOM 0 HG3 GLU B 91 78.716 -22.564 -6.482 1.00 0.00 H new ATOM 3091 N GLY B 92 78.358 -18.693 -4.515 1.00 0.00 N ATOM 3092 CA GLY B 92 78.363 -18.443 -3.046 1.00 0.00 C ATOM 3093 C GLY B 92 76.939 -18.156 -2.567 1.00 0.00 C ATOM 3094 O GLY B 92 76.211 -17.396 -3.174 1.00 0.00 O ATOM 0 H GLY B 92 78.797 -17.967 -5.081 1.00 0.00 H new ATOM 0 HA2 GLY B 92 78.766 -19.309 -2.521 1.00 0.00 H new ATOM 0 HA3 GLY B 92 79.012 -17.599 -2.813 1.00 0.00 H new ATOM 3098 N PHE B 93 76.540 -18.756 -1.478 1.00 0.00 N ATOM 3099 CA PHE B 93 75.168 -18.519 -0.950 1.00 0.00 C ATOM 3100 C PHE B 93 75.127 -17.125 -0.305 1.00 0.00 C ATOM 3101 O PHE B 93 76.133 -16.655 0.189 1.00 0.00 O ATOM 3102 CB PHE B 93 74.852 -19.592 0.095 1.00 0.00 C ATOM 3103 CG PHE B 93 74.670 -20.921 -0.601 1.00 0.00 C ATOM 3104 CD1 PHE B 93 75.792 -21.653 -1.004 1.00 0.00 C ATOM 3105 CD2 PHE B 93 73.384 -21.417 -0.847 1.00 0.00 C ATOM 3106 CE1 PHE B 93 75.630 -22.882 -1.655 1.00 0.00 C ATOM 3107 CE2 PHE B 93 73.220 -22.647 -1.496 1.00 0.00 C ATOM 3108 CZ PHE B 93 74.343 -23.379 -1.900 1.00 0.00 C ATOM 0 H PHE B 93 77.108 -19.402 -0.930 1.00 0.00 H new ATOM 0 HA PHE B 93 74.431 -18.569 -1.751 1.00 0.00 H new ATOM 0 HB2 PHE B 93 75.660 -19.657 0.824 1.00 0.00 H new ATOM 0 HB3 PHE B 93 73.948 -19.328 0.644 1.00 0.00 H new ATOM 0 HD1 PHE B 93 76.784 -21.270 -0.813 1.00 0.00 H new ATOM 0 HD2 PHE B 93 72.518 -20.851 -0.536 1.00 0.00 H new ATOM 0 HE1 PHE B 93 76.496 -23.446 -1.968 1.00 0.00 H new ATOM 0 HE2 PHE B 93 72.228 -23.031 -1.685 1.00 0.00 H new ATOM 0 HZ PHE B 93 74.217 -24.328 -2.401 1.00 0.00 H new ATOM 3118 N PRO B 94 73.996 -16.451 -0.302 1.00 0.00 N ATOM 3119 CA PRO B 94 73.933 -15.094 0.307 1.00 0.00 C ATOM 3120 C PRO B 94 74.300 -15.123 1.797 1.00 0.00 C ATOM 3121 O PRO B 94 74.112 -16.113 2.474 1.00 0.00 O ATOM 3122 CB PRO B 94 72.462 -14.690 0.080 1.00 0.00 C ATOM 3123 CG PRO B 94 71.694 -15.934 -0.402 1.00 0.00 C ATOM 3124 CD PRO B 94 72.722 -16.972 -0.882 1.00 0.00 C ATOM 0 HA PRO B 94 74.641 -14.390 -0.130 1.00 0.00 H new ATOM 0 HB2 PRO B 94 72.026 -14.307 1.002 1.00 0.00 H new ATOM 0 HB3 PRO B 94 72.396 -13.892 -0.659 1.00 0.00 H new ATOM 0 HG2 PRO B 94 71.088 -16.344 0.406 1.00 0.00 H new ATOM 0 HG3 PRO B 94 71.012 -15.671 -1.211 1.00 0.00 H new ATOM 0 HD2 PRO B 94 72.489 -17.973 -0.519 1.00 0.00 H new ATOM 0 HD3 PRO B 94 72.764 -17.030 -1.970 1.00 0.00 H new ATOM 3132 N ASP B 95 74.831 -14.045 2.310 1.00 0.00 N ATOM 3133 CA ASP B 95 75.218 -14.015 3.751 1.00 0.00 C ATOM 3134 C ASP B 95 74.996 -12.609 4.308 1.00 0.00 C ATOM 3135 O ASP B 95 75.912 -11.814 4.386 1.00 0.00 O ATOM 3136 CB ASP B 95 76.698 -14.386 3.877 1.00 0.00 C ATOM 3137 CG ASP B 95 77.059 -14.572 5.352 1.00 0.00 C ATOM 3138 OD1 ASP B 95 76.285 -14.137 6.190 1.00 0.00 O ATOM 3139 OD2 ASP B 95 78.104 -15.147 5.619 1.00 0.00 O ATOM 0 H ASP B 95 75.013 -13.184 1.794 1.00 0.00 H new ATOM 0 HA ASP B 95 74.611 -14.725 4.312 1.00 0.00 H new ATOM 0 HB2 ASP B 95 76.901 -15.303 3.324 1.00 0.00 H new ATOM 0 HB3 ASP B 95 77.318 -13.605 3.437 1.00 0.00 H new ATOM 3144 N LYS B 96 73.790 -12.292 4.707 1.00 0.00 N ATOM 3145 CA LYS B 96 73.515 -10.935 5.269 1.00 0.00 C ATOM 3146 C LYS B 96 73.569 -11.018 6.802 1.00 0.00 C ATOM 3147 O LYS B 96 74.634 -11.108 7.375 1.00 0.00 O ATOM 3148 CB LYS B 96 72.134 -10.467 4.808 1.00 0.00 C ATOM 3149 CG LYS B 96 71.952 -8.998 5.188 1.00 0.00 C ATOM 3150 CD LYS B 96 70.540 -8.533 4.815 1.00 0.00 C ATOM 3151 CE LYS B 96 70.413 -8.362 3.296 1.00 0.00 C ATOM 3152 NZ LYS B 96 69.206 -7.541 2.993 1.00 0.00 N ATOM 0 H LYS B 96 72.983 -12.915 4.668 1.00 0.00 H new ATOM 0 HA LYS B 96 74.260 -10.220 4.920 1.00 0.00 H new ATOM 0 HB2 LYS B 96 72.035 -10.592 3.730 1.00 0.00 H new ATOM 0 HB3 LYS B 96 71.357 -11.075 5.272 1.00 0.00 H new ATOM 0 HG2 LYS B 96 72.117 -8.867 6.258 1.00 0.00 H new ATOM 0 HG3 LYS B 96 72.693 -8.386 4.674 1.00 0.00 H new ATOM 0 HD2 LYS B 96 69.807 -9.259 5.167 1.00 0.00 H new ATOM 0 HD3 LYS B 96 70.319 -7.589 5.313 1.00 0.00 H new ATOM 0 HE2 LYS B 96 71.305 -7.879 2.897 1.00 0.00 H new ATOM 0 HE3 LYS B 96 70.335 -9.336 2.814 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 68.658 -7.996 2.235 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 68.617 -7.462 3.846 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 69.500 -6.592 2.686 1.00 0.00 H new ATOM 3166 N GLN B 97 72.435 -11.006 7.470 1.00 0.00 N ATOM 3167 CA GLN B 97 72.427 -11.113 8.966 1.00 0.00 C ATOM 3168 C GLN B 97 71.939 -12.528 9.350 1.00 0.00 C ATOM 3169 O GLN B 97 70.754 -12.793 9.290 1.00 0.00 O ATOM 3170 CB GLN B 97 71.456 -10.077 9.551 1.00 0.00 C ATOM 3171 CG GLN B 97 72.103 -8.689 9.516 1.00 0.00 C ATOM 3172 CD GLN B 97 71.072 -7.627 9.912 1.00 0.00 C ATOM 3173 OE1 GLN B 97 69.855 -7.708 9.447 1.00 0.00 O flip ATOM 3174 NE2 GLN B 97 71.379 -6.714 10.649 1.00 0.00 N flip ATOM 0 H GLN B 97 71.513 -10.926 7.041 1.00 0.00 H new ATOM 0 HA GLN B 97 73.428 -10.933 9.357 1.00 0.00 H new ATOM 0 HB2 GLN B 97 70.527 -10.071 8.980 1.00 0.00 H new ATOM 0 HB3 GLN B 97 71.198 -10.343 10.576 1.00 0.00 H new ATOM 0 HG2 GLN B 97 72.953 -8.656 10.198 1.00 0.00 H new ATOM 0 HG3 GLN B 97 72.487 -8.482 8.517 1.00 0.00 H new ATOM 0 HE21 GLN B 97 72.330 -6.650 11.013 1.00 0.00 H new ATOM 0 HE22 GLN B 97 70.686 -6.010 10.905 1.00 0.00 H new ATOM 3183 N PRO B 98 72.815 -13.449 9.731 1.00 0.00 N ATOM 3184 CA PRO B 98 72.356 -14.822 10.088 1.00 0.00 C ATOM 3185 C PRO B 98 71.588 -14.856 11.418 1.00 0.00 C ATOM 3186 O PRO B 98 72.161 -15.057 12.469 1.00 0.00 O ATOM 3187 CB PRO B 98 73.680 -15.608 10.184 1.00 0.00 C ATOM 3188 CG PRO B 98 74.848 -14.603 10.149 1.00 0.00 C ATOM 3189 CD PRO B 98 74.286 -13.206 9.829 1.00 0.00 C ATOM 0 HA PRO B 98 71.654 -15.232 9.362 1.00 0.00 H new ATOM 0 HB2 PRO B 98 73.709 -16.191 11.105 1.00 0.00 H new ATOM 0 HB3 PRO B 98 73.762 -16.314 9.357 1.00 0.00 H new ATOM 0 HG2 PRO B 98 75.366 -14.592 11.108 1.00 0.00 H new ATOM 0 HG3 PRO B 98 75.578 -14.898 9.396 1.00 0.00 H new ATOM 0 HD2 PRO B 98 74.525 -12.486 10.612 1.00 0.00 H new ATOM 0 HD3 PRO B 98 74.693 -12.811 8.898 1.00 0.00 H new ATOM 3197 N ARG B 99 70.291 -14.673 11.375 1.00 0.00 N ATOM 3198 CA ARG B 99 69.477 -14.710 12.629 1.00 0.00 C ATOM 3199 C ARG B 99 68.729 -16.043 12.697 1.00 0.00 C ATOM 3200 O ARG B 99 68.369 -16.515 13.758 1.00 0.00 O ATOM 3201 CB ARG B 99 68.477 -13.555 12.614 1.00 0.00 C ATOM 3202 CG ARG B 99 69.229 -12.232 12.766 1.00 0.00 C ATOM 3203 CD ARG B 99 68.223 -11.087 12.784 1.00 0.00 C ATOM 3204 NE ARG B 99 67.402 -11.193 14.024 1.00 0.00 N ATOM 3205 CZ ARG B 99 66.607 -10.223 14.370 1.00 0.00 C ATOM 3206 NH1 ARG B 99 66.493 -9.171 13.606 1.00 0.00 N ATOM 3207 NH2 ARG B 99 65.918 -10.307 15.476 1.00 0.00 N ATOM 0 H ARG B 99 69.760 -14.499 10.522 1.00 0.00 H new ATOM 0 HA ARG B 99 70.126 -14.612 13.499 1.00 0.00 H new ATOM 0 HB2 ARG B 99 67.912 -13.560 11.682 1.00 0.00 H new ATOM 0 HB3 ARG B 99 67.757 -13.672 13.424 1.00 0.00 H new ATOM 0 HG2 ARG B 99 69.813 -12.235 13.687 1.00 0.00 H new ATOM 0 HG3 ARG B 99 69.932 -12.102 11.943 1.00 0.00 H new ATOM 0 HD2 ARG B 99 68.741 -10.128 12.754 1.00 0.00 H new ATOM 0 HD3 ARG B 99 67.584 -11.132 11.902 1.00 0.00 H new ATOM 0 HE ARG B 99 67.464 -12.030 14.604 1.00 0.00 H new ATOM 0 HH11 ARG B 99 67.027 -9.110 12.739 1.00 0.00 H new ATOM 0 HH12 ARG B 99 65.870 -8.410 13.876 1.00 0.00 H new ATOM 0 HH21 ARG B 99 66.003 -11.133 16.068 1.00 0.00 H new ATOM 0 HH22 ARG B 99 65.295 -9.547 15.748 1.00 0.00 H new ATOM 3221 N LYS B 100 68.498 -16.656 11.568 1.00 0.00 N ATOM 3222 CA LYS B 100 67.786 -17.964 11.557 1.00 0.00 C ATOM 3223 C LYS B 100 68.607 -18.985 12.355 1.00 0.00 C ATOM 3224 O LYS B 100 68.070 -19.801 13.078 1.00 0.00 O ATOM 3225 CB LYS B 100 67.612 -18.438 10.108 1.00 0.00 C ATOM 3226 CG LYS B 100 66.653 -19.632 10.061 1.00 0.00 C ATOM 3227 CD LYS B 100 66.485 -20.109 8.609 1.00 0.00 C ATOM 3228 CE LYS B 100 65.564 -19.156 7.831 1.00 0.00 C ATOM 3229 NZ LYS B 100 65.098 -19.828 6.583 1.00 0.00 N ATOM 0 H LYS B 100 68.773 -16.305 10.650 1.00 0.00 H new ATOM 0 HA LYS B 100 66.802 -17.859 12.013 1.00 0.00 H new ATOM 0 HB2 LYS B 100 67.224 -17.625 9.494 1.00 0.00 H new ATOM 0 HB3 LYS B 100 68.578 -18.720 9.690 1.00 0.00 H new ATOM 0 HG2 LYS B 100 67.038 -20.444 10.678 1.00 0.00 H new ATOM 0 HG3 LYS B 100 65.685 -19.349 10.475 1.00 0.00 H new ATOM 0 HD2 LYS B 100 67.459 -20.161 8.122 1.00 0.00 H new ATOM 0 HD3 LYS B 100 66.069 -21.116 8.597 1.00 0.00 H new ATOM 0 HE2 LYS B 100 64.710 -18.875 8.447 1.00 0.00 H new ATOM 0 HE3 LYS B 100 66.097 -18.237 7.586 1.00 0.00 H new ATOM 0 HZ1 LYS B 100 64.474 -19.185 6.055 1.00 0.00 H new ATOM 0 HZ2 LYS B 100 65.919 -20.075 5.995 1.00 0.00 H new ATOM 0 HZ3 LYS B 100 64.575 -20.693 6.829 1.00 0.00 H new ATOM 3243 N LYS B 101 69.912 -18.941 12.221 1.00 0.00 N ATOM 3244 CA LYS B 101 70.799 -19.901 12.955 1.00 0.00 C ATOM 3245 C LYS B 101 71.574 -19.156 14.045 1.00 0.00 C ATOM 3246 O LYS B 101 71.682 -19.690 15.138 1.00 0.00 O ATOM 3247 CB LYS B 101 71.784 -20.517 11.960 1.00 0.00 C ATOM 3248 CG LYS B 101 72.593 -21.616 12.647 1.00 0.00 C ATOM 3249 CD LYS B 101 73.567 -22.222 11.637 1.00 0.00 C ATOM 3250 CE LYS B 101 74.280 -23.423 12.261 1.00 0.00 C ATOM 3251 NZ LYS B 101 75.230 -24.001 11.268 1.00 0.00 N ATOM 3252 OXT LYS B 101 72.048 -18.066 13.770 1.00 0.00 O ATOM 0 H LYS B 101 70.406 -18.274 11.628 1.00 0.00 H new ATOM 0 HA LYS B 101 70.196 -20.683 13.417 1.00 0.00 H new ATOM 0 HB2 LYS B 101 71.244 -20.929 11.107 1.00 0.00 H new ATOM 0 HB3 LYS B 101 72.453 -19.748 11.573 1.00 0.00 H new ATOM 0 HG2 LYS B 101 73.139 -21.206 13.497 1.00 0.00 H new ATOM 0 HG3 LYS B 101 71.927 -22.386 13.037 1.00 0.00 H new ATOM 0 HD2 LYS B 101 73.030 -22.532 10.741 1.00 0.00 H new ATOM 0 HD3 LYS B 101 74.297 -21.474 11.328 1.00 0.00 H new ATOM 0 HE2 LYS B 101 74.816 -23.116 13.159 1.00 0.00 H new ATOM 0 HE3 LYS B 101 73.552 -24.175 12.566 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 75.717 -24.818 11.688 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 74.706 -24.307 10.424 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 75.931 -23.281 10.998 1.00 0.00 H new TER 3266 LYS B 101