USER MOD reduce.3.24.130724 H: found=0, std=0, add=1204, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1204 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 7 THR OG1 : rot -70:sc= -0.667! USER MOD Set 1.2: B 9 THR OG1 : rot 180:sc= 0.0816 USER MOD Set 2.1: B 6 LYS NZ :NH3+ -179:sc= 0.217 (180deg=-0.317) USER MOD Set 2.2: B 12 THR OG1 : rot 150:sc= -0.763 USER MOD Set 3.1: A 13 TYR OH : rot -70:sc= 0.195 USER MOD Set 3.2: A 59 GLN : amide:sc= -2.39! C(o=-0.81!,f=-3.7!) USER MOD Set 3.3: B 68 HIS : no HE2:sc= 1.39 K(o=-0.81,f=-12!) USER MOD Set 4.1: A 12 GLN : amide:sc= -0.172 K(o=0.84,f=0.17) USER MOD Set 4.2: A 68 LYS NZ :NH3+ 159:sc= 1.01 (180deg=0.3) USER MOD Set 5.1: A 6 LYS NZ :NH3+ -143:sc= 1.21 (180deg=0) USER MOD Set 5.2: A 46 GLN : amide:sc= 1.55 K(o=3.2,f=-9.3!) USER MOD Set 5.3: A 53 SER OG : rot 154:sc= 0.428 USER MOD Single : A 1 MET CE :methyl -143:sc= -0.242 (180deg=-1.07) USER MOD Single : A 1 MET N :NH3+ -165:sc= -0.0461 (180deg=-0.312) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -161:sc= 1.17 (180deg=0.469) USER MOD Single : A 16 MET CE :methyl -156:sc= 0 (180deg=-0.183) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.237 USER MOD Single : A 26 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.113) USER MOD Single : A 27 SER OG : rot 95:sc= 1.28 USER MOD Single : A 30 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0865) USER MOD Single : A 32 TYR OH : rot 30:sc= -0.0028 USER MOD Single : A 37 LYS NZ :NH3+ 141:sc= -0.263! (180deg=-0.988!) USER MOD Single : A 38 LYS NZ :NH3+ -163:sc= -0.0606 (180deg=-0.405) USER MOD Single : A 39 SER OG : rot 113:sc= 1.28 USER MOD Single : A 40 LYS NZ :NH3+ -169:sc= 1.09 (180deg=0.749) USER MOD Single : A 44 MET CE :methyl -143:sc= -0.372 (180deg=-1.31!) USER MOD Single : A 45 CYS SG : rot -123:sc= -1.98! USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -159:sc= -1.25 (180deg=-2.24!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HE2:sc= -0.359 K(o=-0.36,f=-6.2!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -161:sc= -0.657 (180deg=-1.58!) USER MOD Single : B 1 MET N :NH3+ 171:sc= 2.07 (180deg=1.72) USER MOD Single : B 2 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : B 11 LYS NZ :NH3+ 172:sc= 1.22 (180deg=1.02) USER MOD Single : B 14 THR OG1 : rot -80:sc= 0.355 USER MOD Single : B 19 SER OG : rot -49:sc= 1.44 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.234 USER MOD Single : B 25 ASN : amide:sc= 1.08 K(o=1.1,f=-1.5!) USER MOD Single : B 27 LYS NZ :NH3+ -112:sc= 0.788 (180deg=-0.497!) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ -147:sc= 0.222 (180deg=0.0133) USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -0.643 X(o=-0.64,f=-1) USER MOD Single : B 41 GLN : amide:sc= -0.788 K(o=-0.79,f=-5!) USER MOD Single : B 48 LYS NZ :NH3+ -114:sc= 0.86 (180deg=-0.0206) USER MOD Single : B 49 GLN : amide:sc= -2.01! C(o=-2!,f=-9!) USER MOD Single : B 55 THR OG1 : rot -71:sc= 1.25 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 30:sc= 0.201 USER MOD Single : B 60 ASN : amide:sc= -0.133 X(o=-0.13,f=-0.52) USER MOD Single : B 62 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : B 63 LYS NZ :NH3+ 166:sc= -0.0237 (180deg=-0.253) USER MOD Single : B 65 SER OG : rot 111:sc= 1.19 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -28.225 -3.057 11.270 1.00 0.00 N ATOM 2 CA MET A 1 -26.946 -2.437 10.853 1.00 0.00 C ATOM 3 C MET A 1 -27.166 -0.970 10.520 1.00 0.00 C ATOM 4 O MET A 1 -28.052 -0.635 9.737 1.00 0.00 O ATOM 5 CB MET A 1 -26.375 -3.157 9.627 1.00 0.00 C ATOM 6 CG MET A 1 -26.059 -4.625 9.866 1.00 0.00 C ATOM 7 SD MET A 1 -25.534 -5.470 8.362 1.00 0.00 S ATOM 8 CE MET A 1 -26.985 -5.249 7.333 1.00 0.00 C ATOM 0 H1 MET A 1 -28.034 -3.968 11.733 1.00 0.00 H new ATOM 0 H2 MET A 1 -28.716 -2.426 11.936 1.00 0.00 H new ATOM 0 H3 MET A 1 -28.824 -3.212 10.434 1.00 0.00 H new ATOM 0 HA MET A 1 -26.237 -2.522 11.676 1.00 0.00 H new ATOM 0 HB2 MET A 1 -27.088 -3.078 8.807 1.00 0.00 H new ATOM 0 HB3 MET A 1 -25.466 -2.647 9.309 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.274 -4.707 10.618 1.00 0.00 H new ATOM 0 HG3 MET A 1 -26.941 -5.122 10.270 1.00 0.00 H new ATOM 0 HE1 MET A 1 -27.145 -6.145 6.733 1.00 0.00 H new ATOM 0 HE2 MET A 1 -27.856 -5.075 7.965 1.00 0.00 H new ATOM 0 HE3 MET A 1 -26.837 -4.393 6.675 1.00 0.00 H new ATOM 20 N ALA A 2 -26.368 -0.095 11.120 1.00 0.00 N ATOM 21 CA ALA A 2 -26.489 1.334 10.868 1.00 0.00 C ATOM 22 C ALA A 2 -25.594 1.753 9.711 1.00 0.00 C ATOM 23 O ALA A 2 -25.935 2.653 8.940 1.00 0.00 O ATOM 24 CB ALA A 2 -26.153 2.128 12.118 1.00 0.00 C ATOM 0 H ALA A 2 -25.634 -0.349 11.781 1.00 0.00 H new ATOM 0 HA ALA A 2 -27.523 1.546 10.595 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -26.249 3.193 11.909 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -26.838 1.852 12.920 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -25.130 1.909 12.424 1.00 0.00 H new ATOM 30 N SER A 3 -24.450 1.096 9.587 1.00 0.00 N ATOM 31 CA SER A 3 -23.545 1.334 8.474 1.00 0.00 C ATOM 32 C SER A 3 -24.031 0.569 7.247 1.00 0.00 C ATOM 33 O SER A 3 -23.381 -0.367 6.777 1.00 0.00 O ATOM 34 CB SER A 3 -22.124 0.908 8.842 1.00 0.00 C ATOM 35 OG SER A 3 -21.726 1.484 10.075 1.00 0.00 O ATOM 0 H SER A 3 -24.126 0.390 10.248 1.00 0.00 H new ATOM 0 HA SER A 3 -23.532 2.400 8.246 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.072 -0.179 8.910 1.00 0.00 H new ATOM 0 HB3 SER A 3 -21.434 1.211 8.055 1.00 0.00 H new ATOM 0 HG SER A 3 -20.814 1.196 10.291 1.00 0.00 H new ATOM 41 N LYS A 4 -25.199 0.961 6.755 1.00 0.00 N ATOM 42 CA LYS A 4 -25.832 0.277 5.637 1.00 0.00 C ATOM 43 C LYS A 4 -25.425 0.914 4.313 1.00 0.00 C ATOM 44 O LYS A 4 -25.629 0.334 3.242 1.00 0.00 O ATOM 45 CB LYS A 4 -27.356 0.295 5.803 1.00 0.00 C ATOM 46 CG LYS A 4 -27.969 1.688 5.774 1.00 0.00 C ATOM 47 CD LYS A 4 -29.396 1.689 6.302 1.00 0.00 C ATOM 48 CE LYS A 4 -29.431 1.461 7.805 1.00 0.00 C ATOM 49 NZ LYS A 4 -30.817 1.438 8.341 1.00 0.00 N ATOM 0 H LYS A 4 -25.729 1.754 7.116 1.00 0.00 H new ATOM 0 HA LYS A 4 -25.495 -0.760 5.628 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -27.804 -0.304 5.010 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -27.613 -0.184 6.748 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -27.360 2.366 6.372 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -27.959 2.068 4.752 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -29.873 2.640 6.065 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -29.972 0.911 5.801 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -28.938 0.517 8.038 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -28.865 2.248 8.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -30.789 1.280 9.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -31.281 2.347 8.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -31.352 0.670 7.887 1.00 0.00 H new ATOM 63 N SER A 5 -24.842 2.103 4.390 1.00 0.00 N ATOM 64 CA SER A 5 -24.353 2.791 3.210 1.00 0.00 C ATOM 65 C SER A 5 -22.936 2.322 2.905 1.00 0.00 C ATOM 66 O SER A 5 -21.955 2.883 3.402 1.00 0.00 O ATOM 67 CB SER A 5 -24.389 4.311 3.428 1.00 0.00 C ATOM 68 OG SER A 5 -24.109 5.028 2.233 1.00 0.00 O ATOM 0 H SER A 5 -24.697 2.610 5.263 1.00 0.00 H new ATOM 0 HA SER A 5 -24.994 2.557 2.360 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.371 4.600 3.802 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.663 4.585 4.193 1.00 0.00 H new ATOM 0 HG SER A 5 -24.143 5.991 2.413 1.00 0.00 H new ATOM 74 N LYS A 6 -22.836 1.254 2.131 1.00 0.00 N ATOM 75 CA LYS A 6 -21.547 0.694 1.771 1.00 0.00 C ATOM 76 C LYS A 6 -21.073 1.258 0.439 1.00 0.00 C ATOM 77 O LYS A 6 -21.516 0.822 -0.625 1.00 0.00 O ATOM 78 CB LYS A 6 -21.618 -0.834 1.711 1.00 0.00 C ATOM 79 CG LYS A 6 -21.872 -1.487 3.061 1.00 0.00 C ATOM 80 CD LYS A 6 -21.814 -3.005 2.969 1.00 0.00 C ATOM 81 CE LYS A 6 -21.945 -3.651 4.340 1.00 0.00 C ATOM 82 NZ LYS A 6 -21.876 -5.136 4.279 1.00 0.00 N ATOM 0 H LYS A 6 -23.636 0.757 1.739 1.00 0.00 H new ATOM 0 HA LYS A 6 -20.827 0.973 2.540 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -22.410 -1.125 1.021 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -20.683 -1.217 1.302 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -21.131 -1.137 3.780 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -22.849 -1.182 3.435 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -22.613 -3.362 2.319 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -20.872 -3.307 2.511 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -21.153 -3.280 4.990 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -22.892 -3.353 4.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -22.534 -5.543 4.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -22.138 -5.457 3.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -20.908 -5.448 4.495 1.00 0.00 H new ATOM 96 N LYS A 7 -20.192 2.246 0.512 1.00 0.00 N ATOM 97 CA LYS A 7 -19.643 2.883 -0.675 1.00 0.00 C ATOM 98 C LYS A 7 -18.750 1.896 -1.417 1.00 0.00 C ATOM 99 O LYS A 7 -17.832 1.323 -0.837 1.00 0.00 O ATOM 100 CB LYS A 7 -18.874 4.144 -0.267 1.00 0.00 C ATOM 101 CG LYS A 7 -19.748 5.145 0.482 1.00 0.00 C ATOM 102 CD LYS A 7 -18.960 6.339 1.005 1.00 0.00 C ATOM 103 CE LYS A 7 -17.913 5.929 2.031 1.00 0.00 C ATOM 104 NZ LYS A 7 -17.361 7.107 2.753 1.00 0.00 N ATOM 0 H LYS A 7 -19.840 2.626 1.391 1.00 0.00 H new ATOM 0 HA LYS A 7 -20.447 3.180 -1.349 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -18.029 3.863 0.362 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -18.464 4.620 -1.158 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -20.538 5.499 -0.181 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -20.235 4.642 1.318 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -18.472 6.844 0.171 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -19.646 7.057 1.455 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -18.357 5.238 2.748 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -17.104 5.396 1.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -16.455 6.851 3.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -17.211 7.887 2.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -18.031 7.408 3.489 1.00 0.00 H new ATOM 118 N ARG A 8 -19.034 1.692 -2.691 1.00 0.00 N ATOM 119 CA ARG A 8 -18.403 0.621 -3.449 1.00 0.00 C ATOM 120 C ARG A 8 -17.091 1.063 -4.088 1.00 0.00 C ATOM 121 O ARG A 8 -17.010 2.116 -4.725 1.00 0.00 O ATOM 122 CB ARG A 8 -19.356 0.110 -4.527 1.00 0.00 C ATOM 123 CG ARG A 8 -20.667 -0.426 -3.977 1.00 0.00 C ATOM 124 CD ARG A 8 -21.608 -0.838 -5.094 1.00 0.00 C ATOM 125 NE ARG A 8 -21.938 0.284 -5.972 1.00 0.00 N ATOM 126 CZ ARG A 8 -22.588 0.156 -7.130 1.00 0.00 C ATOM 127 NH1 ARG A 8 -22.959 -1.038 -7.568 1.00 0.00 N ATOM 128 NH2 ARG A 8 -22.863 1.224 -7.863 1.00 0.00 N ATOM 0 H ARG A 8 -19.698 2.253 -3.225 1.00 0.00 H new ATOM 0 HA ARG A 8 -18.174 -0.181 -2.747 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -19.569 0.920 -5.225 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -18.860 -0.678 -5.094 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -20.470 -1.282 -3.331 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -21.143 0.336 -3.360 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -21.149 -1.634 -5.680 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -22.524 -1.245 -4.665 1.00 0.00 H new ATOM 0 HE ARG A 8 -21.654 1.220 -5.682 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -22.748 -1.871 -7.018 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -23.456 -1.124 -8.455 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -22.578 2.149 -7.543 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -23.360 1.121 -8.748 1.00 0.00 H new ATOM 142 N GLY A 9 -16.071 0.239 -3.914 1.00 0.00 N ATOM 143 CA GLY A 9 -14.794 0.480 -4.541 1.00 0.00 C ATOM 144 C GLY A 9 -14.258 -0.782 -5.184 1.00 0.00 C ATOM 145 O GLY A 9 -14.743 -1.879 -4.899 1.00 0.00 O ATOM 0 H GLY A 9 -16.109 -0.604 -3.341 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -14.896 1.261 -5.294 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -14.084 0.844 -3.799 1.00 0.00 H new ATOM 149 N ILE A 10 -13.279 -0.642 -6.055 1.00 0.00 N ATOM 150 CA ILE A 10 -12.684 -1.791 -6.708 1.00 0.00 C ATOM 151 C ILE A 10 -11.200 -1.869 -6.372 1.00 0.00 C ATOM 152 O ILE A 10 -10.477 -0.875 -6.475 1.00 0.00 O ATOM 153 CB ILE A 10 -12.878 -1.735 -8.239 1.00 0.00 C ATOM 154 CG1 ILE A 10 -14.371 -1.699 -8.582 1.00 0.00 C ATOM 155 CG2 ILE A 10 -12.205 -2.928 -8.903 1.00 0.00 C ATOM 156 CD1 ILE A 10 -14.657 -1.600 -10.063 1.00 0.00 C ATOM 0 H ILE A 10 -12.879 0.256 -6.327 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.187 -2.685 -6.340 1.00 0.00 H new ATOM 0 HB ILE A 10 -12.413 -0.825 -8.618 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -14.846 -2.598 -8.190 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -14.830 -0.850 -8.076 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.351 -2.874 -9.982 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.138 -2.915 -8.680 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.643 -3.851 -8.523 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -15.735 -1.580 -10.225 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -14.213 -0.687 -10.459 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -14.230 -2.462 -10.575 1.00 0.00 H new ATOM 168 N VAL A 11 -10.759 -3.044 -5.951 1.00 0.00 N ATOM 169 CA VAL A 11 -9.367 -3.253 -5.593 1.00 0.00 C ATOM 170 C VAL A 11 -8.517 -3.504 -6.835 1.00 0.00 C ATOM 171 O VAL A 11 -8.768 -4.439 -7.601 1.00 0.00 O ATOM 172 CB VAL A 11 -9.213 -4.424 -4.597 1.00 0.00 C ATOM 173 CG1 VAL A 11 -10.046 -5.623 -5.025 1.00 0.00 C ATOM 174 CG2 VAL A 11 -7.749 -4.811 -4.456 1.00 0.00 C ATOM 0 H VAL A 11 -11.349 -3.870 -5.849 1.00 0.00 H new ATOM 0 HA VAL A 11 -9.015 -2.343 -5.107 1.00 0.00 H new ATOM 0 HB VAL A 11 -9.581 -4.092 -3.626 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -9.917 -6.431 -4.305 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.097 -5.339 -5.068 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -9.721 -5.959 -6.010 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -7.657 -5.637 -3.751 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -7.358 -5.117 -5.427 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -7.180 -3.956 -4.089 1.00 0.00 H new ATOM 184 N GLN A 12 -7.515 -2.657 -7.028 1.00 0.00 N ATOM 185 CA GLN A 12 -6.654 -2.748 -8.196 1.00 0.00 C ATOM 186 C GLN A 12 -5.415 -3.582 -7.897 1.00 0.00 C ATOM 187 O GLN A 12 -4.987 -4.397 -8.716 1.00 0.00 O ATOM 188 CB GLN A 12 -6.244 -1.349 -8.661 1.00 0.00 C ATOM 189 CG GLN A 12 -7.425 -0.454 -8.999 1.00 0.00 C ATOM 190 CD GLN A 12 -8.341 -1.060 -10.047 1.00 0.00 C ATOM 191 OE1 GLN A 12 -7.906 -1.808 -10.922 1.00 0.00 O ATOM 192 NE2 GLN A 12 -9.624 -0.747 -9.956 1.00 0.00 N ATOM 0 H GLN A 12 -7.279 -1.898 -6.389 1.00 0.00 H new ATOM 0 HA GLN A 12 -7.214 -3.239 -8.992 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -5.650 -0.874 -7.880 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -5.603 -1.439 -9.538 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -7.997 -0.258 -8.092 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -7.056 0.507 -9.357 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -9.945 -0.123 -9.216 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -10.291 -1.130 -10.626 1.00 0.00 H new ATOM 201 N TYR A 13 -4.844 -3.385 -6.719 1.00 0.00 N ATOM 202 CA TYR A 13 -3.611 -4.063 -6.358 1.00 0.00 C ATOM 203 C TYR A 13 -3.875 -5.315 -5.540 1.00 0.00 C ATOM 204 O TYR A 13 -4.649 -5.302 -4.586 1.00 0.00 O ATOM 205 CB TYR A 13 -2.678 -3.117 -5.605 1.00 0.00 C ATOM 206 CG TYR A 13 -2.019 -2.103 -6.507 1.00 0.00 C ATOM 207 CD1 TYR A 13 -0.879 -2.437 -7.222 1.00 0.00 C ATOM 208 CD2 TYR A 13 -2.544 -0.825 -6.665 1.00 0.00 C ATOM 209 CE1 TYR A 13 -0.274 -1.529 -8.063 1.00 0.00 C ATOM 210 CE2 TYR A 13 -1.945 0.089 -7.512 1.00 0.00 C ATOM 211 CZ TYR A 13 -0.810 -0.271 -8.209 1.00 0.00 C ATOM 212 OH TYR A 13 -0.211 0.623 -9.064 1.00 0.00 O ATOM 0 H TYR A 13 -5.214 -2.763 -6.000 1.00 0.00 H new ATOM 0 HA TYR A 13 -3.125 -4.372 -7.283 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -3.243 -2.596 -4.832 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.909 -3.700 -5.099 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -0.458 -3.426 -7.118 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -3.432 -0.543 -6.119 1.00 0.00 H new ATOM 0 HE1 TYR A 13 0.618 -1.804 -8.606 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.363 1.078 -7.627 1.00 0.00 H new ATOM 0 HH TYR A 13 0.650 0.906 -8.691 1.00 0.00 H new ATOM 222 N ASP A 14 -3.214 -6.392 -5.930 1.00 0.00 N ATOM 223 CA ASP A 14 -3.373 -7.686 -5.280 1.00 0.00 C ATOM 224 C ASP A 14 -2.538 -7.730 -4.003 1.00 0.00 C ATOM 225 O ASP A 14 -1.335 -7.974 -4.053 1.00 0.00 O ATOM 226 CB ASP A 14 -2.928 -8.787 -6.243 1.00 0.00 C ATOM 227 CG ASP A 14 -3.362 -10.171 -5.815 1.00 0.00 C ATOM 228 OD1 ASP A 14 -4.544 -10.519 -6.042 1.00 0.00 O ATOM 229 OD2 ASP A 14 -2.520 -10.936 -5.299 1.00 0.00 O ATOM 0 H ASP A 14 -2.552 -6.396 -6.706 1.00 0.00 H new ATOM 0 HA ASP A 14 -4.419 -7.840 -5.016 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -3.332 -8.578 -7.234 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -1.842 -8.766 -6.330 1.00 0.00 H new ATOM 234 N PHE A 15 -3.172 -7.470 -2.868 1.00 0.00 N ATOM 235 CA PHE A 15 -2.455 -7.346 -1.605 1.00 0.00 C ATOM 236 C PHE A 15 -2.816 -8.476 -0.650 1.00 0.00 C ATOM 237 O PHE A 15 -3.969 -8.622 -0.244 1.00 0.00 O ATOM 238 CB PHE A 15 -2.740 -5.986 -0.954 1.00 0.00 C ATOM 239 CG PHE A 15 -2.058 -5.789 0.374 1.00 0.00 C ATOM 240 CD1 PHE A 15 -0.699 -5.522 0.437 1.00 0.00 C ATOM 241 CD2 PHE A 15 -2.776 -5.866 1.557 1.00 0.00 C ATOM 242 CE1 PHE A 15 -0.071 -5.338 1.654 1.00 0.00 C ATOM 243 CE2 PHE A 15 -2.153 -5.683 2.777 1.00 0.00 C ATOM 244 CZ PHE A 15 -0.799 -5.418 2.825 1.00 0.00 C ATOM 0 H PHE A 15 -4.181 -7.341 -2.795 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.389 -7.415 -1.820 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -2.424 -5.195 -1.634 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -3.816 -5.878 -0.818 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -0.125 -5.457 -0.475 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -3.836 -6.072 1.525 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.989 -5.132 1.690 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -2.724 -5.747 3.691 1.00 0.00 H new ATOM 0 HZ PHE A 15 -0.310 -5.273 3.777 1.00 0.00 H new ATOM 254 N MET A 16 -1.818 -9.269 -0.294 1.00 0.00 N ATOM 255 CA MET A 16 -2.006 -10.351 0.660 1.00 0.00 C ATOM 256 C MET A 16 -1.745 -9.846 2.074 1.00 0.00 C ATOM 257 O MET A 16 -0.655 -9.351 2.374 1.00 0.00 O ATOM 258 CB MET A 16 -1.068 -11.518 0.345 1.00 0.00 C ATOM 259 CG MET A 16 -1.287 -12.134 -1.029 1.00 0.00 C ATOM 260 SD MET A 16 -2.905 -12.914 -1.197 1.00 0.00 S ATOM 261 CE MET A 16 -2.827 -13.476 -2.896 1.00 0.00 C ATOM 0 H MET A 16 -0.867 -9.183 -0.652 1.00 0.00 H new ATOM 0 HA MET A 16 -3.035 -10.703 0.585 1.00 0.00 H new ATOM 0 HB2 MET A 16 -0.037 -11.172 0.416 1.00 0.00 H new ATOM 0 HB3 MET A 16 -1.198 -12.290 1.103 1.00 0.00 H new ATOM 0 HG2 MET A 16 -1.181 -11.361 -1.790 1.00 0.00 H new ATOM 0 HG3 MET A 16 -0.510 -12.875 -1.218 1.00 0.00 H new ATOM 0 HE1 MET A 16 -3.837 -13.584 -3.290 1.00 0.00 H new ATOM 0 HE2 MET A 16 -2.280 -12.748 -3.495 1.00 0.00 H new ATOM 0 HE3 MET A 16 -2.316 -14.438 -2.938 1.00 0.00 H new ATOM 271 N ALA A 17 -2.745 -9.961 2.932 1.00 0.00 N ATOM 272 CA ALA A 17 -2.625 -9.504 4.306 1.00 0.00 C ATOM 273 C ALA A 17 -2.195 -10.643 5.213 1.00 0.00 C ATOM 274 O ALA A 17 -2.758 -11.737 5.161 1.00 0.00 O ATOM 275 CB ALA A 17 -3.939 -8.922 4.787 1.00 0.00 C ATOM 0 H ALA A 17 -3.651 -10.368 2.700 1.00 0.00 H new ATOM 0 HA ALA A 17 -1.863 -8.726 4.341 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.832 -8.585 5.818 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.216 -8.078 4.156 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.716 -9.685 4.734 1.00 0.00 H new ATOM 281 N GLU A 18 -1.200 -10.383 6.040 1.00 0.00 N ATOM 282 CA GLU A 18 -0.678 -11.394 6.944 1.00 0.00 C ATOM 283 C GLU A 18 -1.361 -11.303 8.302 1.00 0.00 C ATOM 284 O GLU A 18 -1.495 -12.302 9.013 1.00 0.00 O ATOM 285 CB GLU A 18 0.835 -11.238 7.093 1.00 0.00 C ATOM 286 CG GLU A 18 1.599 -11.440 5.792 1.00 0.00 C ATOM 287 CD GLU A 18 1.500 -12.861 5.269 1.00 0.00 C ATOM 288 OE1 GLU A 18 0.435 -13.233 4.732 1.00 0.00 O ATOM 289 OE2 GLU A 18 2.483 -13.618 5.398 1.00 0.00 O ATOM 0 H GLU A 18 -0.735 -9.478 6.105 1.00 0.00 H new ATOM 0 HA GLU A 18 -0.887 -12.377 6.523 1.00 0.00 H new ATOM 0 HB2 GLU A 18 1.053 -10.243 7.482 1.00 0.00 H new ATOM 0 HB3 GLU A 18 1.195 -11.955 7.831 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.214 -10.752 5.039 1.00 0.00 H new ATOM 0 HG3 GLU A 18 2.648 -11.187 5.948 1.00 0.00 H new ATOM 296 N SER A 19 -1.802 -10.104 8.656 1.00 0.00 N ATOM 297 CA SER A 19 -2.501 -9.890 9.910 1.00 0.00 C ATOM 298 C SER A 19 -4.011 -9.891 9.676 1.00 0.00 C ATOM 299 O SER A 19 -4.470 -9.538 8.592 1.00 0.00 O ATOM 300 CB SER A 19 -2.054 -8.571 10.536 1.00 0.00 C ATOM 301 OG SER A 19 -0.643 -8.539 10.690 1.00 0.00 O ATOM 0 H SER A 19 -1.686 -9.264 8.089 1.00 0.00 H new ATOM 0 HA SER A 19 -2.259 -10.700 10.597 1.00 0.00 H new ATOM 0 HB2 SER A 19 -2.375 -7.739 9.910 1.00 0.00 H new ATOM 0 HB3 SER A 19 -2.533 -8.443 11.507 1.00 0.00 H new ATOM 0 HG SER A 19 -0.377 -7.685 11.091 1.00 0.00 H new ATOM 307 N GLN A 20 -4.773 -10.294 10.689 1.00 0.00 N ATOM 308 CA GLN A 20 -6.230 -10.378 10.573 1.00 0.00 C ATOM 309 C GLN A 20 -6.860 -8.991 10.509 1.00 0.00 C ATOM 310 O GLN A 20 -7.940 -8.816 9.942 1.00 0.00 O ATOM 311 CB GLN A 20 -6.823 -11.157 11.747 1.00 0.00 C ATOM 312 CG GLN A 20 -6.396 -12.613 11.793 1.00 0.00 C ATOM 313 CD GLN A 20 -7.090 -13.384 12.897 1.00 0.00 C ATOM 314 OE1 GLN A 20 -6.601 -13.457 14.022 1.00 0.00 O ATOM 315 NE2 GLN A 20 -8.240 -13.959 12.585 1.00 0.00 N ATOM 0 H GLN A 20 -4.408 -10.568 11.601 1.00 0.00 H new ATOM 0 HA GLN A 20 -6.454 -10.905 9.645 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -6.530 -10.672 12.678 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -7.910 -11.108 11.691 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -6.613 -13.083 10.834 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -5.317 -12.668 11.938 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -8.612 -13.875 11.639 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -8.754 -14.486 13.290 1.00 0.00 H new ATOM 324 N ASP A 21 -6.183 -8.012 11.096 1.00 0.00 N ATOM 325 CA ASP A 21 -6.661 -6.632 11.080 1.00 0.00 C ATOM 326 C ASP A 21 -6.485 -6.032 9.691 1.00 0.00 C ATOM 327 O ASP A 21 -7.106 -5.028 9.345 1.00 0.00 O ATOM 328 CB ASP A 21 -5.901 -5.799 12.114 1.00 0.00 C ATOM 329 CG ASP A 21 -6.513 -4.433 12.336 1.00 0.00 C ATOM 330 OD1 ASP A 21 -7.657 -4.364 12.838 1.00 0.00 O ATOM 331 OD2 ASP A 21 -5.849 -3.422 12.037 1.00 0.00 O ATOM 0 H ASP A 21 -5.301 -8.146 11.590 1.00 0.00 H new ATOM 0 HA ASP A 21 -7.721 -6.625 11.334 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.877 -6.339 13.061 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -4.868 -5.680 11.788 1.00 0.00 H new ATOM 336 N GLU A 22 -5.638 -6.670 8.898 1.00 0.00 N ATOM 337 CA GLU A 22 -5.394 -6.255 7.529 1.00 0.00 C ATOM 338 C GLU A 22 -6.287 -7.072 6.602 1.00 0.00 C ATOM 339 O GLU A 22 -6.652 -8.205 6.927 1.00 0.00 O ATOM 340 CB GLU A 22 -3.917 -6.462 7.178 1.00 0.00 C ATOM 341 CG GLU A 22 -2.965 -5.831 8.181 1.00 0.00 C ATOM 342 CD GLU A 22 -1.519 -6.247 7.982 1.00 0.00 C ATOM 343 OE1 GLU A 22 -1.266 -7.423 7.629 1.00 0.00 O ATOM 344 OE2 GLU A 22 -0.622 -5.404 8.205 1.00 0.00 O ATOM 0 H GLU A 22 -5.102 -7.489 9.187 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.626 -5.197 7.411 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.712 -7.531 7.116 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -3.723 -6.043 6.191 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.037 -4.746 8.106 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.278 -6.103 9.189 1.00 0.00 H new ATOM 351 N LEU A 23 -6.653 -6.511 5.466 1.00 0.00 N ATOM 352 CA LEU A 23 -7.542 -7.211 4.552 1.00 0.00 C ATOM 353 C LEU A 23 -6.795 -7.733 3.333 1.00 0.00 C ATOM 354 O LEU A 23 -6.142 -6.972 2.617 1.00 0.00 O ATOM 355 CB LEU A 23 -8.691 -6.305 4.103 1.00 0.00 C ATOM 356 CG LEU A 23 -9.699 -6.966 3.158 1.00 0.00 C ATOM 357 CD1 LEU A 23 -10.352 -8.160 3.836 1.00 0.00 C ATOM 358 CD2 LEU A 23 -10.750 -5.963 2.705 1.00 0.00 C ATOM 0 H LEU A 23 -6.355 -5.586 5.154 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.952 -8.063 5.095 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.221 -5.950 4.987 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.272 -5.428 3.609 1.00 0.00 H new ATOM 0 HG LEU A 23 -9.166 -7.318 2.275 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.066 -8.620 3.153 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.587 -8.888 4.106 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.871 -7.829 4.735 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.456 -6.453 2.035 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.283 -5.577 3.574 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.265 -5.139 2.182 1.00 0.00 H new ATOM 370 N THR A 24 -6.886 -9.036 3.113 1.00 0.00 N ATOM 371 CA THR A 24 -6.346 -9.641 1.910 1.00 0.00 C ATOM 372 C THR A 24 -7.246 -9.316 0.726 1.00 0.00 C ATOM 373 O THR A 24 -8.365 -9.825 0.621 1.00 0.00 O ATOM 374 CB THR A 24 -6.204 -11.167 2.063 1.00 0.00 C ATOM 375 OG1 THR A 24 -5.332 -11.460 3.162 1.00 0.00 O ATOM 376 CG2 THR A 24 -5.648 -11.802 0.795 1.00 0.00 C ATOM 0 H THR A 24 -7.330 -9.693 3.754 1.00 0.00 H new ATOM 0 HA THR A 24 -5.351 -9.230 1.738 1.00 0.00 H new ATOM 0 HB THR A 24 -7.195 -11.582 2.248 1.00 0.00 H new ATOM 0 HG1 THR A 24 -5.244 -12.431 3.259 1.00 0.00 H new ATOM 0 HG21 THR A 24 -5.560 -12.879 0.936 1.00 0.00 H new ATOM 0 HG22 THR A 24 -6.320 -11.599 -0.039 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.665 -11.383 0.579 1.00 0.00 H new ATOM 384 N ILE A 25 -6.758 -8.456 -0.149 1.00 0.00 N ATOM 385 CA ILE A 25 -7.547 -7.971 -1.264 1.00 0.00 C ATOM 386 C ILE A 25 -7.031 -8.532 -2.584 1.00 0.00 C ATOM 387 O ILE A 25 -5.900 -8.266 -2.997 1.00 0.00 O ATOM 388 CB ILE A 25 -7.565 -6.425 -1.304 1.00 0.00 C ATOM 389 CG1 ILE A 25 -6.141 -5.856 -1.316 1.00 0.00 C ATOM 390 CG2 ILE A 25 -8.329 -5.893 -0.108 1.00 0.00 C ATOM 391 CD1 ILE A 25 -6.079 -4.342 -1.361 1.00 0.00 C ATOM 0 H ILE A 25 -5.812 -8.077 -0.107 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.570 -8.320 -1.120 1.00 0.00 H new ATOM 0 HB ILE A 25 -8.061 -6.109 -2.222 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.615 -6.204 -0.427 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -5.609 -6.256 -2.179 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -8.340 -4.803 -0.139 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -9.352 -6.267 -0.134 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.845 -6.225 0.810 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.038 -4.021 -1.367 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -6.574 -3.984 -2.264 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -6.581 -3.931 -0.485 1.00 0.00 H new ATOM 403 N LYS A 26 -7.859 -9.335 -3.230 1.00 0.00 N ATOM 404 CA LYS A 26 -7.488 -9.951 -4.491 1.00 0.00 C ATOM 405 C LYS A 26 -7.787 -8.995 -5.639 1.00 0.00 C ATOM 406 O LYS A 26 -8.892 -8.460 -5.735 1.00 0.00 O ATOM 407 CB LYS A 26 -8.250 -11.266 -4.687 1.00 0.00 C ATOM 408 CG LYS A 26 -7.482 -12.302 -5.491 1.00 0.00 C ATOM 409 CD LYS A 26 -8.328 -13.531 -5.786 1.00 0.00 C ATOM 410 CE LYS A 26 -7.481 -14.690 -6.292 1.00 0.00 C ATOM 411 NZ LYS A 26 -6.591 -14.291 -7.413 1.00 0.00 N ATOM 0 H LYS A 26 -8.794 -9.576 -2.901 1.00 0.00 H new ATOM 0 HA LYS A 26 -6.420 -10.169 -4.477 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.493 -11.684 -3.710 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -9.195 -11.057 -5.188 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.146 -11.858 -6.428 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.589 -12.599 -4.941 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -8.857 -13.834 -4.882 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -9.085 -13.282 -6.530 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -6.877 -15.080 -5.473 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.134 -15.499 -6.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.175 -15.141 -7.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -7.143 -13.774 -8.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.832 -13.679 -7.052 1.00 0.00 H new ATOM 425 N SER A 27 -6.800 -8.782 -6.498 1.00 0.00 N ATOM 426 CA SER A 27 -6.929 -7.842 -7.604 1.00 0.00 C ATOM 427 C SER A 27 -8.105 -8.210 -8.510 1.00 0.00 C ATOM 428 O SER A 27 -8.160 -9.314 -9.057 1.00 0.00 O ATOM 429 CB SER A 27 -5.631 -7.801 -8.413 1.00 0.00 C ATOM 430 OG SER A 27 -5.713 -6.877 -9.486 1.00 0.00 O ATOM 0 H SER A 27 -5.895 -9.251 -6.450 1.00 0.00 H new ATOM 0 HA SER A 27 -7.122 -6.854 -7.187 1.00 0.00 H new ATOM 0 HB2 SER A 27 -4.803 -7.528 -7.759 1.00 0.00 H new ATOM 0 HB3 SER A 27 -5.414 -8.795 -8.804 1.00 0.00 H new ATOM 0 HG SER A 27 -5.340 -6.015 -9.205 1.00 0.00 H new ATOM 436 N GLY A 28 -9.053 -7.288 -8.649 1.00 0.00 N ATOM 437 CA GLY A 28 -10.173 -7.511 -9.542 1.00 0.00 C ATOM 438 C GLY A 28 -11.477 -7.777 -8.815 1.00 0.00 C ATOM 439 O GLY A 28 -12.532 -7.862 -9.445 1.00 0.00 O ATOM 0 H GLY A 28 -9.065 -6.393 -8.160 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -10.295 -6.639 -10.185 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -9.948 -8.357 -10.191 1.00 0.00 H new ATOM 443 N ASP A 29 -11.422 -7.910 -7.496 1.00 0.00 N ATOM 444 CA ASP A 29 -12.630 -8.189 -6.719 1.00 0.00 C ATOM 445 C ASP A 29 -13.357 -6.885 -6.379 1.00 0.00 C ATOM 446 O ASP A 29 -13.031 -5.820 -6.912 1.00 0.00 O ATOM 447 CB ASP A 29 -12.289 -8.954 -5.432 1.00 0.00 C ATOM 448 CG ASP A 29 -13.400 -9.902 -5.007 1.00 0.00 C ATOM 449 OD1 ASP A 29 -14.441 -9.432 -4.504 1.00 0.00 O ATOM 450 OD2 ASP A 29 -13.238 -11.128 -5.183 1.00 0.00 O ATOM 0 H ASP A 29 -10.568 -7.831 -6.945 1.00 0.00 H new ATOM 0 HA ASP A 29 -13.287 -8.813 -7.326 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -11.370 -9.520 -5.582 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -12.097 -8.242 -4.630 1.00 0.00 H new ATOM 455 N LYS A 30 -14.338 -6.977 -5.498 1.00 0.00 N ATOM 456 CA LYS A 30 -15.113 -5.823 -5.068 1.00 0.00 C ATOM 457 C LYS A 30 -14.927 -5.593 -3.575 1.00 0.00 C ATOM 458 O LYS A 30 -14.903 -6.546 -2.791 1.00 0.00 O ATOM 459 CB LYS A 30 -16.599 -6.041 -5.362 1.00 0.00 C ATOM 460 CG LYS A 30 -16.966 -6.027 -6.833 1.00 0.00 C ATOM 461 CD LYS A 30 -16.741 -4.659 -7.449 1.00 0.00 C ATOM 462 CE LYS A 30 -17.407 -4.548 -8.809 1.00 0.00 C ATOM 463 NZ LYS A 30 -16.927 -5.590 -9.755 1.00 0.00 N ATOM 0 H LYS A 30 -14.621 -7.854 -5.060 1.00 0.00 H new ATOM 0 HA LYS A 30 -14.761 -4.950 -5.617 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -16.903 -6.997 -4.936 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -17.173 -5.268 -4.852 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -16.370 -6.769 -7.365 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -18.011 -6.313 -6.951 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -17.136 -3.890 -6.785 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -15.671 -4.475 -7.550 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -18.487 -4.636 -8.691 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -17.211 -3.561 -9.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -17.303 -5.396 -10.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -15.887 -5.579 -9.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -17.254 -6.525 -9.437 1.00 0.00 H new ATOM 477 N VAL A 31 -14.802 -4.334 -3.181 1.00 0.00 N ATOM 478 CA VAL A 31 -14.668 -3.991 -1.775 1.00 0.00 C ATOM 479 C VAL A 31 -15.625 -2.868 -1.397 1.00 0.00 C ATOM 480 O VAL A 31 -15.959 -2.011 -2.220 1.00 0.00 O ATOM 481 CB VAL A 31 -13.225 -3.571 -1.410 1.00 0.00 C ATOM 482 CG1 VAL A 31 -12.262 -4.741 -1.537 1.00 0.00 C ATOM 483 CG2 VAL A 31 -12.765 -2.405 -2.271 1.00 0.00 C ATOM 0 H VAL A 31 -14.791 -3.535 -3.815 1.00 0.00 H new ATOM 0 HA VAL A 31 -14.915 -4.891 -1.212 1.00 0.00 H new ATOM 0 HB VAL A 31 -13.228 -3.249 -0.369 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -11.256 -4.414 -1.274 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -12.571 -5.541 -0.865 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -12.268 -5.107 -2.564 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -11.747 -2.128 -1.995 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -12.790 -2.696 -3.321 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.428 -1.554 -2.115 1.00 0.00 H new ATOM 493 N TYR A 32 -16.090 -2.903 -0.164 1.00 0.00 N ATOM 494 CA TYR A 32 -16.908 -1.834 0.376 1.00 0.00 C ATOM 495 C TYR A 32 -16.063 -0.926 1.251 1.00 0.00 C ATOM 496 O TYR A 32 -15.327 -1.399 2.118 1.00 0.00 O ATOM 497 CB TYR A 32 -18.073 -2.389 1.195 1.00 0.00 C ATOM 498 CG TYR A 32 -19.093 -3.152 0.381 1.00 0.00 C ATOM 499 CD1 TYR A 32 -19.765 -2.547 -0.675 1.00 0.00 C ATOM 500 CD2 TYR A 32 -19.400 -4.473 0.682 1.00 0.00 C ATOM 501 CE1 TYR A 32 -20.711 -3.237 -1.409 1.00 0.00 C ATOM 502 CE2 TYR A 32 -20.342 -5.169 -0.048 1.00 0.00 C ATOM 503 CZ TYR A 32 -20.996 -4.548 -1.090 1.00 0.00 C ATOM 504 OH TYR A 32 -21.933 -5.245 -1.819 1.00 0.00 O ATOM 0 H TYR A 32 -15.914 -3.667 0.488 1.00 0.00 H new ATOM 0 HA TYR A 32 -17.314 -1.266 -0.461 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -17.678 -3.046 1.970 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -18.573 -1.563 1.702 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -19.544 -1.520 -0.926 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -18.893 -4.963 1.500 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -21.224 -2.753 -2.227 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -20.566 -6.197 0.197 1.00 0.00 H new ATOM 0 HH TYR A 32 -21.949 -4.908 -2.739 1.00 0.00 H new ATOM 514 N ILE A 33 -16.164 0.367 1.013 1.00 0.00 N ATOM 515 CA ILE A 33 -15.448 1.344 1.808 1.00 0.00 C ATOM 516 C ILE A 33 -16.224 1.632 3.086 1.00 0.00 C ATOM 517 O ILE A 33 -17.272 2.285 3.058 1.00 0.00 O ATOM 518 CB ILE A 33 -15.226 2.661 1.032 1.00 0.00 C ATOM 519 CG1 ILE A 33 -14.495 2.381 -0.284 1.00 0.00 C ATOM 520 CG2 ILE A 33 -14.438 3.650 1.880 1.00 0.00 C ATOM 521 CD1 ILE A 33 -14.318 3.605 -1.159 1.00 0.00 C ATOM 0 H ILE A 33 -16.739 0.767 0.271 1.00 0.00 H new ATOM 0 HA ILE A 33 -14.470 0.926 2.049 1.00 0.00 H new ATOM 0 HB ILE A 33 -16.197 3.101 0.804 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -13.514 1.960 -0.061 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -15.047 1.624 -0.841 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -14.290 4.573 1.319 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -14.990 3.866 2.795 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -13.469 3.220 2.134 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -13.792 3.326 -2.072 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -15.295 4.015 -1.414 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -13.739 4.356 -0.622 1.00 0.00 H new ATOM 533 N LEU A 34 -15.720 1.114 4.196 1.00 0.00 N ATOM 534 CA LEU A 34 -16.352 1.316 5.490 1.00 0.00 C ATOM 535 C LEU A 34 -16.022 2.704 6.007 1.00 0.00 C ATOM 536 O LEU A 34 -16.904 3.549 6.150 1.00 0.00 O ATOM 537 CB LEU A 34 -15.875 0.260 6.486 1.00 0.00 C ATOM 538 CG LEU A 34 -16.039 -1.188 6.028 1.00 0.00 C ATOM 539 CD1 LEU A 34 -15.462 -2.135 7.065 1.00 0.00 C ATOM 540 CD2 LEU A 34 -17.504 -1.502 5.773 1.00 0.00 C ATOM 0 H LEU A 34 -14.872 0.548 4.226 1.00 0.00 H new ATOM 0 HA LEU A 34 -17.432 1.221 5.375 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -14.822 0.438 6.703 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -16.420 0.393 7.420 1.00 0.00 H new ATOM 0 HG LEU A 34 -15.493 -1.323 5.094 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -15.585 -3.164 6.727 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -14.402 -1.922 7.202 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -15.984 -2.000 8.012 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -17.603 -2.538 5.447 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -18.073 -1.354 6.691 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -17.888 -0.840 4.997 1.00 0.00 H new ATOM 552 N ASP A 35 -14.744 2.939 6.277 1.00 0.00 N ATOM 553 CA ASP A 35 -14.286 4.256 6.679 1.00 0.00 C ATOM 554 C ASP A 35 -13.084 4.659 5.841 1.00 0.00 C ATOM 555 O ASP A 35 -12.183 3.848 5.608 1.00 0.00 O ATOM 556 CB ASP A 35 -13.926 4.281 8.163 1.00 0.00 C ATOM 557 CG ASP A 35 -13.982 5.680 8.731 1.00 0.00 C ATOM 558 OD1 ASP A 35 -13.249 6.565 8.240 1.00 0.00 O ATOM 559 OD2 ASP A 35 -14.796 5.913 9.650 1.00 0.00 O ATOM 0 H ASP A 35 -14.010 2.233 6.224 1.00 0.00 H new ATOM 0 HA ASP A 35 -15.095 4.968 6.516 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -14.612 3.637 8.714 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.925 3.873 8.301 1.00 0.00 H new ATOM 564 N ASP A 36 -13.080 5.906 5.392 1.00 0.00 N ATOM 565 CA ASP A 36 -12.049 6.404 4.488 1.00 0.00 C ATOM 566 C ASP A 36 -11.557 7.769 4.942 1.00 0.00 C ATOM 567 O ASP A 36 -10.804 8.443 4.232 1.00 0.00 O ATOM 568 CB ASP A 36 -12.602 6.507 3.065 1.00 0.00 C ATOM 569 CG ASP A 36 -13.777 7.461 2.966 1.00 0.00 C ATOM 570 OD1 ASP A 36 -14.884 7.092 3.413 1.00 0.00 O ATOM 571 OD2 ASP A 36 -13.603 8.578 2.437 1.00 0.00 O ATOM 0 H ASP A 36 -13.786 6.599 5.641 1.00 0.00 H new ATOM 0 HA ASP A 36 -11.214 5.704 4.501 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -11.810 6.840 2.394 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.911 5.518 2.726 1.00 0.00 H new ATOM 576 N LYS A 37 -11.979 8.174 6.131 1.00 0.00 N ATOM 577 CA LYS A 37 -11.641 9.492 6.641 1.00 0.00 C ATOM 578 C LYS A 37 -11.050 9.412 8.045 1.00 0.00 C ATOM 579 O LYS A 37 -10.496 10.389 8.548 1.00 0.00 O ATOM 580 CB LYS A 37 -12.864 10.419 6.628 1.00 0.00 C ATOM 581 CG LYS A 37 -14.020 9.971 7.512 1.00 0.00 C ATOM 582 CD LYS A 37 -14.894 8.915 6.853 1.00 0.00 C ATOM 583 CE LYS A 37 -16.131 8.628 7.692 1.00 0.00 C ATOM 584 NZ LYS A 37 -15.787 8.303 9.105 1.00 0.00 N ATOM 0 H LYS A 37 -12.554 7.610 6.758 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.883 9.911 5.979 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -12.550 11.414 6.943 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -13.223 10.507 5.603 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -13.624 9.575 8.447 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -14.633 10.836 7.766 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -15.194 9.253 5.861 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -14.322 7.997 6.717 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -16.792 9.494 7.670 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -16.681 7.796 7.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -16.486 8.738 9.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -15.794 7.271 9.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -14.840 8.673 9.326 1.00 0.00 H new ATOM 598 N LYS A 38 -11.183 8.252 8.681 1.00 0.00 N ATOM 599 CA LYS A 38 -10.586 8.022 9.992 1.00 0.00 C ATOM 600 C LYS A 38 -9.068 8.122 9.880 1.00 0.00 C ATOM 601 O LYS A 38 -8.397 8.715 10.726 1.00 0.00 O ATOM 602 CB LYS A 38 -10.993 6.636 10.514 1.00 0.00 C ATOM 603 CG LYS A 38 -11.185 6.560 12.023 1.00 0.00 C ATOM 604 CD LYS A 38 -9.891 6.794 12.785 1.00 0.00 C ATOM 605 CE LYS A 38 -10.126 6.836 14.287 1.00 0.00 C ATOM 606 NZ LYS A 38 -11.058 7.930 14.670 1.00 0.00 N ATOM 0 H LYS A 38 -11.700 7.455 8.309 1.00 0.00 H new ATOM 0 HA LYS A 38 -10.942 8.776 10.694 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -11.921 6.337 10.027 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -10.232 5.913 10.221 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -11.923 7.301 12.330 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.587 5.582 12.286 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -9.181 6.001 12.549 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -9.441 7.732 12.460 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -10.532 5.880 14.618 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -9.174 6.973 14.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -10.974 8.116 15.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -10.818 8.792 14.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -12.034 7.648 14.449 1.00 0.00 H new ATOM 620 N SER A 39 -8.541 7.548 8.813 1.00 0.00 N ATOM 621 CA SER A 39 -7.121 7.582 8.547 1.00 0.00 C ATOM 622 C SER A 39 -6.871 7.842 7.066 1.00 0.00 C ATOM 623 O SER A 39 -7.749 7.620 6.234 1.00 0.00 O ATOM 624 CB SER A 39 -6.475 6.272 8.996 1.00 0.00 C ATOM 625 OG SER A 39 -7.370 5.181 8.846 1.00 0.00 O ATOM 0 H SER A 39 -9.086 7.048 8.111 1.00 0.00 H new ATOM 0 HA SER A 39 -6.667 8.396 9.113 1.00 0.00 H new ATOM 0 HB2 SER A 39 -5.573 6.089 8.412 1.00 0.00 H new ATOM 0 HB3 SER A 39 -6.168 6.353 10.039 1.00 0.00 H new ATOM 0 HG SER A 39 -7.040 4.582 8.144 1.00 0.00 H new ATOM 631 N LYS A 40 -5.678 8.324 6.744 1.00 0.00 N ATOM 632 CA LYS A 40 -5.353 8.694 5.371 1.00 0.00 C ATOM 633 C LYS A 40 -4.634 7.569 4.628 1.00 0.00 C ATOM 634 O LYS A 40 -4.940 7.295 3.471 1.00 0.00 O ATOM 635 CB LYS A 40 -4.511 9.978 5.341 1.00 0.00 C ATOM 636 CG LYS A 40 -3.543 10.118 6.508 1.00 0.00 C ATOM 637 CD LYS A 40 -2.726 11.394 6.409 1.00 0.00 C ATOM 638 CE LYS A 40 -1.564 11.251 5.437 1.00 0.00 C ATOM 639 NZ LYS A 40 -0.536 10.298 5.937 1.00 0.00 N ATOM 0 H LYS A 40 -4.921 8.468 7.412 1.00 0.00 H new ATOM 0 HA LYS A 40 -6.296 8.876 4.855 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -3.946 10.007 4.409 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -5.181 10.838 5.334 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -4.100 10.114 7.445 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -2.874 9.258 6.531 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -3.370 12.213 6.087 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.344 11.658 7.395 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -1.938 10.908 4.472 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -1.106 12.226 5.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 0.317 10.367 5.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -0.296 10.532 6.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -0.910 9.329 5.893 1.00 0.00 H new ATOM 653 N ASP A 41 -3.691 6.919 5.297 1.00 0.00 N ATOM 654 CA ASP A 41 -2.870 5.892 4.655 1.00 0.00 C ATOM 655 C ASP A 41 -3.628 4.577 4.520 1.00 0.00 C ATOM 656 O ASP A 41 -3.669 3.977 3.446 1.00 0.00 O ATOM 657 CB ASP A 41 -1.581 5.664 5.450 1.00 0.00 C ATOM 658 CG ASP A 41 -0.746 6.921 5.579 1.00 0.00 C ATOM 659 OD1 ASP A 41 -1.076 7.769 6.440 1.00 0.00 O ATOM 660 OD2 ASP A 41 0.232 7.077 4.819 1.00 0.00 O ATOM 0 H ASP A 41 -3.473 7.081 6.280 1.00 0.00 H new ATOM 0 HA ASP A 41 -2.621 6.248 3.656 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -1.832 5.296 6.445 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.990 4.888 4.963 1.00 0.00 H new ATOM 665 N TRP A 42 -4.223 4.130 5.612 1.00 0.00 N ATOM 666 CA TRP A 42 -4.935 2.860 5.625 1.00 0.00 C ATOM 667 C TRP A 42 -6.433 3.093 5.770 1.00 0.00 C ATOM 668 O TRP A 42 -6.864 3.880 6.614 1.00 0.00 O ATOM 669 CB TRP A 42 -4.426 1.972 6.766 1.00 0.00 C ATOM 670 CG TRP A 42 -2.993 1.550 6.615 1.00 0.00 C ATOM 671 CD1 TRP A 42 -1.883 2.328 6.790 1.00 0.00 C ATOM 672 CD2 TRP A 42 -2.515 0.244 6.273 1.00 0.00 C ATOM 673 NE1 TRP A 42 -0.749 1.589 6.574 1.00 0.00 N ATOM 674 CE2 TRP A 42 -1.108 0.307 6.253 1.00 0.00 C ATOM 675 CE3 TRP A 42 -3.137 -0.972 5.976 1.00 0.00 C ATOM 676 CZ2 TRP A 42 -0.317 -0.799 5.954 1.00 0.00 C ATOM 677 CZ3 TRP A 42 -2.352 -2.069 5.678 1.00 0.00 C ATOM 678 CH2 TRP A 42 -0.954 -1.976 5.668 1.00 0.00 C ATOM 0 H TRP A 42 -4.228 4.627 6.503 1.00 0.00 H new ATOM 0 HA TRP A 42 -4.750 2.352 4.679 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -4.539 2.508 7.709 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -5.052 1.082 6.828 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -1.897 3.374 7.059 1.00 0.00 H new ATOM 0 HE1 TRP A 42 0.207 1.937 6.641 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -4.214 -1.053 5.979 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 0.761 -0.731 5.948 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -2.823 -3.013 5.449 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -0.367 -2.851 5.430 1.00 0.00 H new ATOM 689 N TRP A 43 -7.217 2.423 4.940 1.00 0.00 N ATOM 690 CA TRP A 43 -8.667 2.559 4.976 1.00 0.00 C ATOM 691 C TRP A 43 -9.327 1.264 5.417 1.00 0.00 C ATOM 692 O TRP A 43 -8.704 0.202 5.408 1.00 0.00 O ATOM 693 CB TRP A 43 -9.213 2.957 3.602 1.00 0.00 C ATOM 694 CG TRP A 43 -8.907 4.368 3.209 1.00 0.00 C ATOM 695 CD1 TRP A 43 -8.331 5.332 3.982 1.00 0.00 C ATOM 696 CD2 TRP A 43 -9.185 4.979 1.947 1.00 0.00 C ATOM 697 NE1 TRP A 43 -8.222 6.501 3.274 1.00 0.00 N ATOM 698 CE2 TRP A 43 -8.745 6.312 2.023 1.00 0.00 C ATOM 699 CE3 TRP A 43 -9.765 4.526 0.759 1.00 0.00 C ATOM 700 CZ2 TRP A 43 -8.861 7.195 0.954 1.00 0.00 C ATOM 701 CZ3 TRP A 43 -9.881 5.403 -0.301 1.00 0.00 C ATOM 702 CH2 TRP A 43 -9.432 6.725 -0.197 1.00 0.00 C ATOM 0 H TRP A 43 -6.873 1.777 4.230 1.00 0.00 H new ATOM 0 HA TRP A 43 -8.900 3.342 5.697 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.801 2.284 2.850 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -10.294 2.816 3.598 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -8.008 5.195 5.003 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -7.817 7.370 3.623 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -10.116 3.508 0.672 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -8.513 8.215 1.030 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.325 5.064 -1.225 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -9.539 7.388 -1.043 1.00 0.00 H new ATOM 713 N MET A 44 -10.595 1.365 5.788 1.00 0.00 N ATOM 714 CA MET A 44 -11.379 0.204 6.183 1.00 0.00 C ATOM 715 C MET A 44 -12.167 -0.306 4.992 1.00 0.00 C ATOM 716 O MET A 44 -13.095 0.356 4.532 1.00 0.00 O ATOM 717 CB MET A 44 -12.365 0.560 7.296 1.00 0.00 C ATOM 718 CG MET A 44 -11.725 1.134 8.546 1.00 0.00 C ATOM 719 SD MET A 44 -10.872 -0.114 9.531 1.00 0.00 S ATOM 720 CE MET A 44 -12.211 -1.253 9.883 1.00 0.00 C ATOM 0 H MET A 44 -11.106 2.247 5.824 1.00 0.00 H new ATOM 0 HA MET A 44 -10.690 -0.560 6.545 1.00 0.00 H new ATOM 0 HB2 MET A 44 -13.085 1.281 6.909 1.00 0.00 H new ATOM 0 HB3 MET A 44 -12.924 -0.335 7.568 1.00 0.00 H new ATOM 0 HG2 MET A 44 -11.017 1.912 8.261 1.00 0.00 H new ATOM 0 HG3 MET A 44 -12.493 1.610 9.156 1.00 0.00 H new ATOM 0 HE1 MET A 44 -12.099 -1.644 10.894 1.00 0.00 H new ATOM 0 HE2 MET A 44 -13.164 -0.731 9.799 1.00 0.00 H new ATOM 0 HE3 MET A 44 -12.185 -2.077 9.170 1.00 0.00 H new ATOM 730 N CYS A 45 -11.802 -1.467 4.490 1.00 0.00 N ATOM 731 CA CYS A 45 -12.525 -2.052 3.380 1.00 0.00 C ATOM 732 C CYS A 45 -13.068 -3.422 3.756 1.00 0.00 C ATOM 733 O CYS A 45 -12.524 -4.100 4.630 1.00 0.00 O ATOM 734 CB CYS A 45 -11.634 -2.143 2.141 1.00 0.00 C ATOM 735 SG CYS A 45 -11.143 -0.533 1.479 1.00 0.00 S ATOM 0 H CYS A 45 -11.015 -2.021 4.829 1.00 0.00 H new ATOM 0 HA CYS A 45 -13.369 -1.404 3.143 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -10.738 -2.712 2.389 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -12.161 -2.700 1.366 1.00 0.00 H new ATOM 0 HG CYS A 45 -11.512 -0.444 0.236 1.00 0.00 H new ATOM 741 N GLN A 46 -14.158 -3.799 3.117 1.00 0.00 N ATOM 742 CA GLN A 46 -14.776 -5.093 3.337 1.00 0.00 C ATOM 743 C GLN A 46 -14.979 -5.801 2.006 1.00 0.00 C ATOM 744 O GLN A 46 -15.581 -5.241 1.091 1.00 0.00 O ATOM 745 CB GLN A 46 -16.121 -4.914 4.044 1.00 0.00 C ATOM 746 CG GLN A 46 -16.857 -6.219 4.300 1.00 0.00 C ATOM 747 CD GLN A 46 -18.237 -6.007 4.890 1.00 0.00 C ATOM 748 OE1 GLN A 46 -19.223 -5.874 4.163 1.00 0.00 O ATOM 749 NE2 GLN A 46 -18.317 -5.973 6.208 1.00 0.00 N ATOM 0 H GLN A 46 -14.640 -3.218 2.431 1.00 0.00 H new ATOM 0 HA GLN A 46 -14.123 -5.698 3.966 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -15.957 -4.408 4.995 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -16.754 -4.263 3.441 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -16.947 -6.770 3.364 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -16.268 -6.837 4.978 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -17.476 -6.087 6.773 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -19.220 -5.832 6.661 1.00 0.00 H new ATOM 758 N LEU A 47 -14.461 -7.014 1.893 1.00 0.00 N ATOM 759 CA LEU A 47 -14.647 -7.812 0.689 1.00 0.00 C ATOM 760 C LEU A 47 -16.122 -8.137 0.498 1.00 0.00 C ATOM 761 O LEU A 47 -16.763 -8.678 1.397 1.00 0.00 O ATOM 762 CB LEU A 47 -13.826 -9.103 0.767 1.00 0.00 C ATOM 763 CG LEU A 47 -12.318 -8.932 0.594 1.00 0.00 C ATOM 764 CD1 LEU A 47 -11.607 -10.259 0.818 1.00 0.00 C ATOM 765 CD2 LEU A 47 -11.996 -8.375 -0.788 1.00 0.00 C ATOM 0 H LEU A 47 -13.908 -7.468 2.620 1.00 0.00 H new ATOM 0 HA LEU A 47 -14.300 -7.234 -0.167 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -14.013 -9.575 1.732 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -14.187 -9.790 0.001 1.00 0.00 H new ATOM 0 HG LEU A 47 -11.962 -8.220 1.338 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -10.533 -10.122 0.692 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -11.811 -10.615 1.828 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -11.967 -10.991 0.095 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -10.917 -8.260 -0.892 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -12.363 -9.061 -1.551 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -12.477 -7.405 -0.910 1.00 0.00 H new ATOM 777 N VAL A 48 -16.648 -7.800 -0.671 1.00 0.00 N ATOM 778 CA VAL A 48 -18.066 -7.983 -0.968 1.00 0.00 C ATOM 779 C VAL A 48 -18.493 -9.441 -0.818 1.00 0.00 C ATOM 780 O VAL A 48 -19.532 -9.734 -0.225 1.00 0.00 O ATOM 781 CB VAL A 48 -18.396 -7.486 -2.396 1.00 0.00 C ATOM 782 CG1 VAL A 48 -19.825 -7.826 -2.801 1.00 0.00 C ATOM 783 CG2 VAL A 48 -18.173 -5.987 -2.484 1.00 0.00 C ATOM 0 H VAL A 48 -16.110 -7.395 -1.437 1.00 0.00 H new ATOM 0 HA VAL A 48 -18.624 -7.390 -0.243 1.00 0.00 H new ATOM 0 HB VAL A 48 -17.728 -7.998 -3.088 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.014 -7.459 -3.810 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -19.963 -8.907 -2.776 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -20.522 -7.355 -2.107 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -18.407 -5.643 -3.491 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -18.820 -5.480 -1.768 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -17.132 -5.760 -2.256 1.00 0.00 H new ATOM 793 N ASP A 49 -17.681 -10.350 -1.333 1.00 0.00 N ATOM 794 CA ASP A 49 -18.025 -11.766 -1.329 1.00 0.00 C ATOM 795 C ASP A 49 -17.571 -12.446 -0.040 1.00 0.00 C ATOM 796 O ASP A 49 -18.353 -13.135 0.617 1.00 0.00 O ATOM 797 CB ASP A 49 -17.400 -12.461 -2.538 1.00 0.00 C ATOM 798 CG ASP A 49 -17.660 -13.952 -2.558 1.00 0.00 C ATOM 799 OD1 ASP A 49 -18.686 -14.372 -3.133 1.00 0.00 O ATOM 800 OD2 ASP A 49 -16.825 -14.713 -2.022 1.00 0.00 O ATOM 0 H ASP A 49 -16.780 -10.135 -1.759 1.00 0.00 H new ATOM 0 HA ASP A 49 -19.110 -11.848 -1.387 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -17.795 -12.016 -3.451 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -16.324 -12.285 -2.537 1.00 0.00 H new ATOM 805 N SER A 50 -16.312 -12.239 0.326 1.00 0.00 N ATOM 806 CA SER A 50 -15.736 -12.899 1.492 1.00 0.00 C ATOM 807 C SER A 50 -16.324 -12.353 2.793 1.00 0.00 C ATOM 808 O SER A 50 -16.417 -13.066 3.792 1.00 0.00 O ATOM 809 CB SER A 50 -14.218 -12.728 1.490 1.00 0.00 C ATOM 810 OG SER A 50 -13.664 -13.145 0.254 1.00 0.00 O ATOM 0 H SER A 50 -15.670 -11.619 -0.168 1.00 0.00 H new ATOM 0 HA SER A 50 -15.982 -13.959 1.434 1.00 0.00 H new ATOM 0 HB2 SER A 50 -13.965 -11.683 1.672 1.00 0.00 H new ATOM 0 HB3 SER A 50 -13.782 -13.308 2.303 1.00 0.00 H new ATOM 0 HG SER A 50 -12.692 -13.025 0.274 1.00 0.00 H new ATOM 816 N GLY A 51 -16.712 -11.083 2.778 1.00 0.00 N ATOM 817 CA GLY A 51 -17.292 -10.468 3.957 1.00 0.00 C ATOM 818 C GLY A 51 -16.249 -10.070 4.982 1.00 0.00 C ATOM 819 O GLY A 51 -16.588 -9.620 6.076 1.00 0.00 O ATOM 0 H GLY A 51 -16.635 -10.467 1.969 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -17.859 -9.586 3.660 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.998 -11.162 4.414 1.00 0.00 H new ATOM 823 N LYS A 52 -14.981 -10.229 4.634 1.00 0.00 N ATOM 824 CA LYS A 52 -13.896 -9.895 5.542 1.00 0.00 C ATOM 825 C LYS A 52 -13.606 -8.403 5.483 1.00 0.00 C ATOM 826 O LYS A 52 -13.505 -7.830 4.398 1.00 0.00 O ATOM 827 CB LYS A 52 -12.632 -10.685 5.186 1.00 0.00 C ATOM 828 CG LYS A 52 -12.834 -12.193 5.162 1.00 0.00 C ATOM 829 CD LYS A 52 -11.534 -12.936 4.881 1.00 0.00 C ATOM 830 CE LYS A 52 -10.719 -13.185 6.149 1.00 0.00 C ATOM 831 NZ LYS A 52 -10.260 -11.928 6.808 1.00 0.00 N ATOM 0 H LYS A 52 -14.679 -10.588 3.728 1.00 0.00 H new ATOM 0 HA LYS A 52 -14.200 -10.161 6.554 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -12.276 -10.360 4.208 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -11.850 -10.444 5.906 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -13.239 -12.520 6.119 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -13.570 -12.449 4.400 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -11.760 -13.890 4.404 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -10.935 -12.361 4.175 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -11.321 -13.758 6.854 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -9.851 -13.796 5.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -9.448 -12.135 7.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -9.977 -11.239 6.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -11.034 -11.532 7.378 1.00 0.00 H new ATOM 845 N SER A 53 -13.494 -7.782 6.642 1.00 0.00 N ATOM 846 CA SER A 53 -13.186 -6.365 6.719 1.00 0.00 C ATOM 847 C SER A 53 -11.796 -6.172 7.323 1.00 0.00 C ATOM 848 O SER A 53 -11.353 -6.986 8.140 1.00 0.00 O ATOM 849 CB SER A 53 -14.239 -5.654 7.571 1.00 0.00 C ATOM 850 OG SER A 53 -15.531 -6.195 7.339 1.00 0.00 O ATOM 0 H SER A 53 -13.612 -8.238 7.547 1.00 0.00 H new ATOM 0 HA SER A 53 -13.196 -5.936 5.717 1.00 0.00 H new ATOM 0 HB2 SER A 53 -13.984 -5.751 8.626 1.00 0.00 H new ATOM 0 HB3 SER A 53 -14.240 -4.589 7.340 1.00 0.00 H new ATOM 0 HG SER A 53 -16.091 -6.055 8.131 1.00 0.00 H new ATOM 856 N GLY A 54 -11.105 -5.116 6.916 1.00 0.00 N ATOM 857 CA GLY A 54 -9.782 -4.862 7.446 1.00 0.00 C ATOM 858 C GLY A 54 -9.145 -3.618 6.865 1.00 0.00 C ATOM 859 O GLY A 54 -9.755 -2.921 6.048 1.00 0.00 O ATOM 0 H GLY A 54 -11.435 -4.435 6.232 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -9.843 -4.761 8.530 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -9.143 -5.721 7.242 1.00 0.00 H new ATOM 863 N LEU A 55 -7.917 -3.347 7.288 1.00 0.00 N ATOM 864 CA LEU A 55 -7.172 -2.182 6.829 1.00 0.00 C ATOM 865 C LEU A 55 -6.428 -2.488 5.532 1.00 0.00 C ATOM 866 O LEU A 55 -5.800 -3.541 5.396 1.00 0.00 O ATOM 867 CB LEU A 55 -6.168 -1.716 7.896 1.00 0.00 C ATOM 868 CG LEU A 55 -6.748 -0.919 9.076 1.00 0.00 C ATOM 869 CD1 LEU A 55 -7.495 0.310 8.582 1.00 0.00 C ATOM 870 CD2 LEU A 55 -7.655 -1.787 9.936 1.00 0.00 C ATOM 0 H LEU A 55 -7.411 -3.927 7.957 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.892 -1.384 6.647 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.659 -2.594 8.294 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.411 -1.102 7.408 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.914 -0.589 9.695 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.897 0.858 9.434 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.812 0.952 8.026 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.313 0.001 7.931 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -8.049 -1.195 10.762 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.481 -2.161 9.331 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.085 -2.628 10.332 1.00 0.00 H new ATOM 882 N VAL A 56 -6.522 -1.565 4.582 1.00 0.00 N ATOM 883 CA VAL A 56 -5.798 -1.664 3.318 1.00 0.00 C ATOM 884 C VAL A 56 -5.257 -0.293 2.918 1.00 0.00 C ATOM 885 O VAL A 56 -5.774 0.731 3.364 1.00 0.00 O ATOM 886 CB VAL A 56 -6.692 -2.199 2.175 1.00 0.00 C ATOM 887 CG1 VAL A 56 -7.098 -3.640 2.431 1.00 0.00 C ATOM 888 CG2 VAL A 56 -7.918 -1.320 1.998 1.00 0.00 C ATOM 0 H VAL A 56 -7.100 -0.729 4.665 1.00 0.00 H new ATOM 0 HA VAL A 56 -4.980 -2.368 3.472 1.00 0.00 H new ATOM 0 HB VAL A 56 -6.113 -2.171 1.252 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -7.726 -3.992 1.613 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -6.206 -4.263 2.498 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -7.654 -3.701 3.367 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -8.534 -1.713 1.189 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -8.496 -1.311 2.922 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -7.606 -0.304 1.755 1.00 0.00 H new ATOM 898 N PRO A 57 -4.203 -0.252 2.089 1.00 0.00 N ATOM 899 CA PRO A 57 -3.638 1.007 1.593 1.00 0.00 C ATOM 900 C PRO A 57 -4.635 1.790 0.740 1.00 0.00 C ATOM 901 O PRO A 57 -5.284 1.229 -0.147 1.00 0.00 O ATOM 902 CB PRO A 57 -2.442 0.561 0.745 1.00 0.00 C ATOM 903 CG PRO A 57 -2.147 -0.831 1.190 1.00 0.00 C ATOM 904 CD PRO A 57 -3.467 -1.421 1.583 1.00 0.00 C ATOM 0 HA PRO A 57 -3.367 1.678 2.408 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.679 0.593 -0.318 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.584 1.215 0.900 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -1.683 -1.408 0.390 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.452 -0.834 2.029 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.973 -1.883 0.735 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -3.356 -2.191 2.346 1.00 0.00 H new ATOM 912 N ALA A 58 -4.736 3.087 1.014 1.00 0.00 N ATOM 913 CA ALA A 58 -5.699 3.968 0.352 1.00 0.00 C ATOM 914 C ALA A 58 -5.629 3.888 -1.174 1.00 0.00 C ATOM 915 O ALA A 58 -6.653 3.734 -1.838 1.00 0.00 O ATOM 916 CB ALA A 58 -5.485 5.405 0.804 1.00 0.00 C ATOM 0 H ALA A 58 -4.152 3.560 1.703 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.692 3.627 0.644 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -6.206 6.054 0.307 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.622 5.471 1.883 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -4.474 5.721 0.546 1.00 0.00 H new ATOM 922 N GLN A 59 -4.426 3.982 -1.733 1.00 0.00 N ATOM 923 CA GLN A 59 -4.268 4.011 -3.189 1.00 0.00 C ATOM 924 C GLN A 59 -4.244 2.609 -3.796 1.00 0.00 C ATOM 925 O GLN A 59 -3.759 2.413 -4.910 1.00 0.00 O ATOM 926 CB GLN A 59 -3.013 4.791 -3.597 1.00 0.00 C ATOM 927 CG GLN A 59 -1.789 4.514 -2.740 1.00 0.00 C ATOM 928 CD GLN A 59 -0.532 5.137 -3.314 1.00 0.00 C ATOM 929 OE1 GLN A 59 0.222 4.487 -4.038 1.00 0.00 O ATOM 930 NE2 GLN A 59 -0.316 6.410 -3.029 1.00 0.00 N ATOM 0 H GLN A 59 -3.553 4.039 -1.209 1.00 0.00 H new ATOM 0 HA GLN A 59 -5.142 4.527 -3.587 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -2.775 4.554 -4.634 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -3.235 5.857 -3.556 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.957 4.901 -1.735 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -1.649 3.437 -2.648 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -0.965 6.914 -2.425 1.00 0.00 H new ATOM 0 HE22 GLN A 59 0.499 6.887 -3.414 1.00 0.00 H new ATOM 939 N PHE A 60 -4.773 1.637 -3.067 1.00 0.00 N ATOM 940 CA PHE A 60 -4.945 0.293 -3.605 1.00 0.00 C ATOM 941 C PHE A 60 -6.413 0.066 -3.935 1.00 0.00 C ATOM 942 O PHE A 60 -6.774 -0.885 -4.636 1.00 0.00 O ATOM 943 CB PHE A 60 -4.454 -0.765 -2.608 1.00 0.00 C ATOM 944 CG PHE A 60 -2.956 -0.919 -2.558 1.00 0.00 C ATOM 945 CD1 PHE A 60 -2.118 0.168 -2.744 1.00 0.00 C ATOM 946 CD2 PHE A 60 -2.390 -2.163 -2.331 1.00 0.00 C ATOM 947 CE1 PHE A 60 -0.746 0.018 -2.704 1.00 0.00 C ATOM 948 CE2 PHE A 60 -1.019 -2.321 -2.291 1.00 0.00 C ATOM 949 CZ PHE A 60 -0.195 -1.228 -2.478 1.00 0.00 C ATOM 0 H PHE A 60 -5.090 1.752 -2.104 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.349 0.199 -4.513 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -4.815 -0.505 -1.613 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -4.898 -1.726 -2.867 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -2.543 1.145 -2.922 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -3.030 -3.021 -2.183 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -0.104 0.874 -2.849 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -0.592 -3.297 -2.114 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.878 -1.348 -2.448 1.00 0.00 H new ATOM 959 N ILE A 61 -7.252 0.969 -3.437 1.00 0.00 N ATOM 960 CA ILE A 61 -8.691 0.889 -3.633 1.00 0.00 C ATOM 961 C ILE A 61 -9.178 2.073 -4.466 1.00 0.00 C ATOM 962 O ILE A 61 -8.937 3.229 -4.117 1.00 0.00 O ATOM 963 CB ILE A 61 -9.439 0.877 -2.280 1.00 0.00 C ATOM 964 CG1 ILE A 61 -8.975 -0.304 -1.417 1.00 0.00 C ATOM 965 CG2 ILE A 61 -10.947 0.832 -2.490 1.00 0.00 C ATOM 966 CD1 ILE A 61 -9.170 -1.658 -2.067 1.00 0.00 C ATOM 0 H ILE A 61 -6.952 1.774 -2.888 1.00 0.00 H new ATOM 0 HA ILE A 61 -8.902 -0.042 -4.159 1.00 0.00 H new ATOM 0 HB ILE A 61 -9.201 1.801 -1.754 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -7.919 -0.175 -1.181 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -9.518 -0.285 -0.472 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -11.449 0.824 -1.523 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -11.262 1.709 -3.055 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -11.211 -0.070 -3.043 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -8.817 -2.439 -1.393 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -10.228 -1.811 -2.278 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -8.605 -1.699 -2.998 1.00 0.00 H new ATOM 978 N GLU A 62 -9.853 1.783 -5.568 1.00 0.00 N ATOM 979 CA GLU A 62 -10.375 2.826 -6.438 1.00 0.00 C ATOM 980 C GLU A 62 -11.899 2.763 -6.468 1.00 0.00 C ATOM 981 O GLU A 62 -12.476 1.779 -6.932 1.00 0.00 O ATOM 982 CB GLU A 62 -9.800 2.670 -7.850 1.00 0.00 C ATOM 983 CG GLU A 62 -10.132 3.826 -8.779 1.00 0.00 C ATOM 984 CD GLU A 62 -9.511 3.670 -10.155 1.00 0.00 C ATOM 985 OE1 GLU A 62 -9.670 2.593 -10.765 1.00 0.00 O ATOM 986 OE2 GLU A 62 -8.872 4.627 -10.640 1.00 0.00 O ATOM 0 H GLU A 62 -10.052 0.833 -5.881 1.00 0.00 H new ATOM 0 HA GLU A 62 -10.075 3.799 -6.050 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.717 2.570 -7.782 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -10.178 1.745 -8.286 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -11.214 3.906 -8.881 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.784 4.757 -8.332 1.00 0.00 H new ATOM 993 N PRO A 63 -12.570 3.804 -5.953 1.00 0.00 N ATOM 994 CA PRO A 63 -14.037 3.849 -5.872 1.00 0.00 C ATOM 995 C PRO A 63 -14.702 3.744 -7.241 1.00 0.00 C ATOM 996 O PRO A 63 -14.286 4.398 -8.202 1.00 0.00 O ATOM 997 CB PRO A 63 -14.326 5.218 -5.243 1.00 0.00 C ATOM 998 CG PRO A 63 -13.053 5.621 -4.581 1.00 0.00 C ATOM 999 CD PRO A 63 -11.952 5.022 -5.406 1.00 0.00 C ATOM 0 HA PRO A 63 -14.432 3.011 -5.298 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -14.623 5.944 -6.000 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -15.142 5.156 -4.523 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -12.962 6.706 -4.538 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -13.014 5.257 -3.554 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -11.627 5.699 -6.196 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -11.075 4.792 -4.802 1.00 0.00 H new ATOM 1007 N VAL A 64 -15.743 2.926 -7.324 1.00 0.00 N ATOM 1008 CA VAL A 64 -16.453 2.722 -8.578 1.00 0.00 C ATOM 1009 C VAL A 64 -17.339 3.928 -8.867 1.00 0.00 C ATOM 1010 O VAL A 64 -17.727 4.645 -7.936 1.00 0.00 O ATOM 1011 CB VAL A 64 -17.314 1.436 -8.541 1.00 0.00 C ATOM 1012 CG1 VAL A 64 -18.588 1.653 -7.738 1.00 0.00 C ATOM 1013 CG2 VAL A 64 -17.635 0.951 -9.948 1.00 0.00 C ATOM 0 H VAL A 64 -16.114 2.393 -6.537 1.00 0.00 H new ATOM 0 HA VAL A 64 -15.713 2.607 -9.370 1.00 0.00 H new ATOM 0 HB VAL A 64 -16.731 0.661 -8.043 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -19.173 0.734 -7.729 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -18.331 1.930 -6.716 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -19.174 2.451 -8.194 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -18.241 0.046 -9.892 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -18.187 1.724 -10.482 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -16.708 0.734 -10.479 1.00 0.00 H new ATOM 1023 N ARG A 65 -17.635 4.158 -10.151 1.00 0.00 N ATOM 1024 CA ARG A 65 -18.455 5.285 -10.604 1.00 0.00 C ATOM 1025 C ARG A 65 -17.726 6.625 -10.442 1.00 0.00 C ATOM 1026 O ARG A 65 -17.763 7.464 -11.338 1.00 0.00 O ATOM 1027 CB ARG A 65 -19.798 5.316 -9.868 1.00 0.00 C ATOM 1028 CG ARG A 65 -20.720 6.441 -10.316 1.00 0.00 C ATOM 1029 CD ARG A 65 -21.092 6.301 -11.785 1.00 0.00 C ATOM 1030 NE ARG A 65 -21.895 7.425 -12.267 1.00 0.00 N ATOM 1031 CZ ARG A 65 -22.891 7.308 -13.145 1.00 0.00 C ATOM 1032 NH1 ARG A 65 -23.219 6.115 -13.629 1.00 0.00 N ATOM 1033 NH2 ARG A 65 -23.555 8.383 -13.547 1.00 0.00 N ATOM 0 H ARG A 65 -17.309 3.561 -10.911 1.00 0.00 H new ATOM 0 HA ARG A 65 -18.643 5.137 -11.667 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -20.305 4.363 -10.017 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -19.613 5.415 -8.798 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -21.625 6.436 -9.708 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -20.231 7.401 -10.153 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -20.183 6.225 -12.382 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -21.646 5.374 -11.930 1.00 0.00 H new ATOM 0 HE ARG A 65 -21.679 8.355 -11.909 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -22.708 5.285 -13.329 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -23.982 6.029 -14.301 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -23.304 9.303 -13.184 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -24.317 8.290 -14.219 1.00 0.00 H new ATOM 1047 N ASP A 66 -17.059 6.796 -9.302 1.00 0.00 N ATOM 1048 CA ASP A 66 -16.365 8.036 -8.953 1.00 0.00 C ATOM 1049 C ASP A 66 -15.461 8.533 -10.083 1.00 0.00 C ATOM 1050 O ASP A 66 -15.771 9.529 -10.738 1.00 0.00 O ATOM 1051 CB ASP A 66 -15.551 7.820 -7.674 1.00 0.00 C ATOM 1052 CG ASP A 66 -14.800 9.060 -7.233 1.00 0.00 C ATOM 1053 OD1 ASP A 66 -15.436 9.987 -6.688 1.00 0.00 O ATOM 1054 OD2 ASP A 66 -13.568 9.108 -7.414 1.00 0.00 O ATOM 0 H ASP A 66 -16.984 6.072 -8.588 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.118 8.807 -8.788 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -16.220 7.503 -6.874 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -14.840 7.010 -7.835 1.00 0.00 H new ATOM 1059 N LYS A 67 -14.350 7.841 -10.315 1.00 0.00 N ATOM 1060 CA LYS A 67 -13.428 8.221 -11.384 1.00 0.00 C ATOM 1061 C LYS A 67 -13.098 7.029 -12.272 1.00 0.00 C ATOM 1062 O LYS A 67 -12.177 7.086 -13.084 1.00 0.00 O ATOM 1063 CB LYS A 67 -12.130 8.804 -10.808 1.00 0.00 C ATOM 1064 CG LYS A 67 -12.316 10.117 -10.061 1.00 0.00 C ATOM 1065 CD LYS A 67 -12.988 11.168 -10.933 1.00 0.00 C ATOM 1066 CE LYS A 67 -13.235 12.455 -10.164 1.00 0.00 C ATOM 1067 NZ LYS A 67 -14.058 13.420 -10.943 1.00 0.00 N ATOM 0 H LYS A 67 -14.066 7.019 -9.782 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.924 8.983 -11.985 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -11.685 8.074 -10.132 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -11.421 8.959 -11.622 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -12.917 9.946 -9.168 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -11.347 10.487 -9.727 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -12.362 11.376 -11.801 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -13.935 10.780 -11.308 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -13.738 12.225 -9.225 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -12.280 12.915 -9.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -14.203 14.284 -10.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -13.567 13.660 -11.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -14.980 12.992 -11.163 1.00 0.00 H new ATOM 1081 N LYS A 68 -13.859 5.952 -12.134 1.00 0.00 N ATOM 1082 CA LYS A 68 -13.595 4.750 -12.914 1.00 0.00 C ATOM 1083 C LYS A 68 -14.374 4.741 -14.218 1.00 0.00 C ATOM 1084 O LYS A 68 -14.057 3.971 -15.126 1.00 0.00 O ATOM 1085 CB LYS A 68 -13.911 3.487 -12.119 1.00 0.00 C ATOM 1086 CG LYS A 68 -12.907 3.211 -11.015 1.00 0.00 C ATOM 1087 CD LYS A 68 -12.938 1.759 -10.564 1.00 0.00 C ATOM 1088 CE LYS A 68 -12.526 0.802 -11.680 1.00 0.00 C ATOM 1089 NZ LYS A 68 -11.231 1.185 -12.310 1.00 0.00 N ATOM 0 H LYS A 68 -14.654 5.885 -11.498 1.00 0.00 H new ATOM 0 HA LYS A 68 -12.530 4.761 -13.148 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -14.906 3.579 -11.683 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -13.939 2.635 -12.798 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -11.905 3.460 -11.366 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -13.117 3.859 -10.164 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -12.271 1.630 -9.712 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -13.942 1.507 -10.223 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -12.446 -0.208 -11.277 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -13.305 0.781 -12.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -10.819 0.358 -12.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -11.394 1.941 -13.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -10.575 1.524 -11.577 1.00 0.00 H new ATOM 1103 N HIS A 69 -15.394 5.578 -14.319 1.00 0.00 N ATOM 1104 CA HIS A 69 -16.181 5.637 -15.539 1.00 0.00 C ATOM 1105 C HIS A 69 -16.778 7.022 -15.732 1.00 0.00 C ATOM 1106 O HIS A 69 -17.787 7.375 -15.120 1.00 0.00 O ATOM 1107 CB HIS A 69 -17.283 4.571 -15.531 1.00 0.00 C ATOM 1108 CG HIS A 69 -17.808 4.239 -16.895 1.00 0.00 C ATOM 1109 ND1 HIS A 69 -17.016 4.221 -18.025 1.00 0.00 N ATOM 1110 CD2 HIS A 69 -19.051 3.896 -17.309 1.00 0.00 C ATOM 1111 CE1 HIS A 69 -17.748 3.880 -19.066 1.00 0.00 C ATOM 1112 NE2 HIS A 69 -18.984 3.679 -18.660 1.00 0.00 N ATOM 0 H HIS A 69 -15.693 6.217 -13.582 1.00 0.00 H new ATOM 0 HA HIS A 69 -15.515 5.433 -16.378 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -16.895 3.663 -15.070 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -18.108 4.918 -14.908 1.00 0.00 H new ATOM 0 HD1 HIS A 69 -16.020 4.438 -18.050 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -19.931 3.810 -16.689 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -17.394 3.782 -20.081 1.00 0.00 H new ATOM 1121 N THR A 70 -16.117 7.811 -16.558 1.00 0.00 N ATOM 1122 CA THR A 70 -16.617 9.113 -16.959 1.00 0.00 C ATOM 1123 C THR A 70 -16.891 9.073 -18.461 1.00 0.00 C ATOM 1124 O THR A 70 -17.232 10.068 -19.098 1.00 0.00 O ATOM 1125 CB THR A 70 -15.587 10.213 -16.623 1.00 0.00 C ATOM 1126 OG1 THR A 70 -15.112 10.027 -15.280 1.00 0.00 O ATOM 1127 CG2 THR A 70 -16.192 11.603 -16.752 1.00 0.00 C ATOM 0 H THR A 70 -15.217 7.567 -16.971 1.00 0.00 H new ATOM 0 HA THR A 70 -17.535 9.346 -16.419 1.00 0.00 H new ATOM 0 HB THR A 70 -14.763 10.133 -17.332 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.457 10.723 -15.065 1.00 0.00 H new ATOM 0 HG21 THR A 70 -15.438 12.352 -16.508 1.00 0.00 H new ATOM 0 HG22 THR A 70 -16.538 11.756 -17.774 1.00 0.00 H new ATOM 0 HG23 THR A 70 -17.034 11.699 -16.066 1.00 0.00 H new ATOM 1135 N GLU A 71 -16.753 7.877 -19.001 1.00 0.00 N ATOM 1136 CA GLU A 71 -16.880 7.637 -20.424 1.00 0.00 C ATOM 1137 C GLU A 71 -18.334 7.359 -20.771 1.00 0.00 C ATOM 1138 O GLU A 71 -18.844 7.961 -21.734 1.00 0.00 O ATOM 1139 CB GLU A 71 -16.005 6.448 -20.850 1.00 0.00 C ATOM 1140 CG GLU A 71 -14.542 6.546 -20.419 1.00 0.00 C ATOM 1141 CD GLU A 71 -14.341 6.348 -18.926 1.00 0.00 C ATOM 1142 OE1 GLU A 71 -14.666 5.258 -18.415 1.00 0.00 O ATOM 1143 OE2 GLU A 71 -13.888 7.293 -18.246 1.00 0.00 O ATOM 1144 OXT GLU A 71 -18.970 6.555 -20.059 1.00 0.00 O ATOM 0 H GLU A 71 -16.548 7.038 -18.459 1.00 0.00 H new ATOM 0 HA GLU A 71 -16.544 8.525 -20.959 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -16.431 5.534 -20.436 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -16.045 6.355 -21.935 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -13.960 5.799 -20.959 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -14.151 7.522 -20.705 1.00 0.00 H new TER 1151 GLU A 71 ATOM 1152 N MET B 1 20.923 0.825 -8.395 1.00 0.00 N ATOM 1153 CA MET B 1 19.796 1.037 -9.325 1.00 0.00 C ATOM 1154 C MET B 1 18.844 2.062 -8.783 1.00 0.00 C ATOM 1155 O MET B 1 18.970 2.527 -7.658 1.00 0.00 O ATOM 1156 CB MET B 1 19.012 -0.250 -9.568 1.00 0.00 C ATOM 1157 CG MET B 1 18.470 -0.890 -8.305 1.00 0.00 C ATOM 1158 SD MET B 1 17.866 -2.569 -8.564 1.00 0.00 S ATOM 1159 CE MET B 1 17.089 -2.888 -6.981 1.00 0.00 C ATOM 0 H1 MET B 1 21.486 0.010 -8.711 1.00 0.00 H new ATOM 0 H2 MET B 1 21.523 1.674 -8.378 1.00 0.00 H new ATOM 0 H3 MET B 1 20.555 0.642 -7.440 1.00 0.00 H new ATOM 0 HA MET B 1 20.230 1.380 -10.264 1.00 0.00 H new ATOM 0 HB2 MET B 1 18.181 -0.036 -10.240 1.00 0.00 H new ATOM 0 HB3 MET B 1 19.657 -0.966 -10.078 1.00 0.00 H new ATOM 0 HG2 MET B 1 19.254 -0.905 -7.548 1.00 0.00 H new ATOM 0 HG3 MET B 1 17.660 -0.276 -7.913 1.00 0.00 H new ATOM 0 HE1 MET B 1 16.968 -3.963 -6.845 1.00 0.00 H new ATOM 0 HE2 MET B 1 17.714 -2.489 -6.182 1.00 0.00 H new ATOM 0 HE3 MET B 1 16.112 -2.406 -6.952 1.00 0.00 H new ATOM 1171 N GLN B 2 17.862 2.368 -9.584 1.00 0.00 N ATOM 1172 CA GLN B 2 16.880 3.368 -9.225 1.00 0.00 C ATOM 1173 C GLN B 2 15.495 2.759 -9.168 1.00 0.00 C ATOM 1174 O GLN B 2 15.021 2.174 -10.139 1.00 0.00 O ATOM 1175 CB GLN B 2 16.919 4.524 -10.218 1.00 0.00 C ATOM 1176 CG GLN B 2 18.231 5.288 -10.193 1.00 0.00 C ATOM 1177 CD GLN B 2 18.332 6.326 -11.287 1.00 0.00 C ATOM 1178 OE1 GLN B 2 17.331 6.894 -11.720 1.00 0.00 O ATOM 1179 NE2 GLN B 2 19.549 6.580 -11.743 1.00 0.00 N ATOM 0 H GLN B 2 17.715 1.939 -10.498 1.00 0.00 H new ATOM 0 HA GLN B 2 17.122 3.753 -8.234 1.00 0.00 H new ATOM 0 HB2 GLN B 2 16.750 4.137 -11.223 1.00 0.00 H new ATOM 0 HB3 GLN B 2 16.101 5.211 -9.999 1.00 0.00 H new ATOM 0 HG2 GLN B 2 18.342 5.777 -9.225 1.00 0.00 H new ATOM 0 HG3 GLN B 2 19.057 4.584 -10.291 1.00 0.00 H new ATOM 0 HE21 GLN B 2 20.352 6.085 -11.355 1.00 0.00 H new ATOM 0 HE22 GLN B 2 19.683 7.270 -12.482 1.00 0.00 H new ATOM 1188 N ILE B 3 14.864 2.873 -8.017 1.00 0.00 N ATOM 1189 CA ILE B 3 13.500 2.409 -7.848 1.00 0.00 C ATOM 1190 C ILE B 3 12.600 3.581 -7.512 1.00 0.00 C ATOM 1191 O ILE B 3 12.990 4.487 -6.774 1.00 0.00 O ATOM 1192 CB ILE B 3 13.370 1.325 -6.751 1.00 0.00 C ATOM 1193 CG1 ILE B 3 13.978 1.809 -5.429 1.00 0.00 C ATOM 1194 CG2 ILE B 3 14.031 0.030 -7.206 1.00 0.00 C ATOM 1195 CD1 ILE B 3 13.803 0.834 -4.281 1.00 0.00 C ATOM 0 H ILE B 3 15.276 3.285 -7.180 1.00 0.00 H new ATOM 0 HA ILE B 3 13.196 1.954 -8.791 1.00 0.00 H new ATOM 0 HB ILE B 3 12.310 1.133 -6.583 1.00 0.00 H new ATOM 0 HG12 ILE B 3 15.042 1.995 -5.576 1.00 0.00 H new ATOM 0 HG13 ILE B 3 13.522 2.761 -5.157 1.00 0.00 H new ATOM 0 HG21 ILE B 3 13.932 -0.723 -6.424 1.00 0.00 H new ATOM 0 HG22 ILE B 3 13.547 -0.325 -8.116 1.00 0.00 H new ATOM 0 HG23 ILE B 3 15.088 0.211 -7.404 1.00 0.00 H new ATOM 0 HD11 ILE B 3 14.259 1.246 -3.381 1.00 0.00 H new ATOM 0 HD12 ILE B 3 12.740 0.666 -4.105 1.00 0.00 H new ATOM 0 HD13 ILE B 3 14.284 -0.112 -4.530 1.00 0.00 H new ATOM 1207 N PHE B 4 11.410 3.580 -8.074 1.00 0.00 N ATOM 1208 CA PHE B 4 10.473 4.657 -7.849 1.00 0.00 C ATOM 1209 C PHE B 4 9.620 4.348 -6.634 1.00 0.00 C ATOM 1210 O PHE B 4 8.619 3.640 -6.731 1.00 0.00 O ATOM 1211 CB PHE B 4 9.591 4.870 -9.083 1.00 0.00 C ATOM 1212 CG PHE B 4 10.372 5.167 -10.333 1.00 0.00 C ATOM 1213 CD1 PHE B 4 10.759 6.464 -10.632 1.00 0.00 C ATOM 1214 CD2 PHE B 4 10.718 4.150 -11.209 1.00 0.00 C ATOM 1215 CE1 PHE B 4 11.477 6.741 -11.778 1.00 0.00 C ATOM 1216 CE2 PHE B 4 11.437 4.422 -12.357 1.00 0.00 C ATOM 1217 CZ PHE B 4 11.817 5.720 -12.641 1.00 0.00 C ATOM 0 H PHE B 4 11.069 2.843 -8.691 1.00 0.00 H new ATOM 0 HA PHE B 4 11.029 5.577 -7.667 1.00 0.00 H new ATOM 0 HB2 PHE B 4 8.985 3.978 -9.245 1.00 0.00 H new ATOM 0 HB3 PHE B 4 8.902 5.692 -8.890 1.00 0.00 H new ATOM 0 HD1 PHE B 4 10.496 7.268 -9.960 1.00 0.00 H new ATOM 0 HD2 PHE B 4 10.422 3.134 -10.992 1.00 0.00 H new ATOM 0 HE1 PHE B 4 11.772 7.756 -11.999 1.00 0.00 H new ATOM 0 HE2 PHE B 4 11.702 3.621 -13.032 1.00 0.00 H new ATOM 0 HZ PHE B 4 12.380 5.935 -13.538 1.00 0.00 H new ATOM 1227 N VAL B 5 10.043 4.839 -5.484 1.00 0.00 N ATOM 1228 CA VAL B 5 9.292 4.630 -4.263 1.00 0.00 C ATOM 1229 C VAL B 5 8.253 5.734 -4.104 1.00 0.00 C ATOM 1230 O VAL B 5 8.565 6.894 -3.828 1.00 0.00 O ATOM 1231 CB VAL B 5 10.208 4.516 -3.018 1.00 0.00 C ATOM 1232 CG1 VAL B 5 11.204 5.660 -2.947 1.00 0.00 C ATOM 1233 CG2 VAL B 5 9.383 4.442 -1.738 1.00 0.00 C ATOM 0 H VAL B 5 10.899 5.383 -5.371 1.00 0.00 H new ATOM 0 HA VAL B 5 8.777 3.673 -4.341 1.00 0.00 H new ATOM 0 HB VAL B 5 10.774 3.590 -3.117 1.00 0.00 H new ATOM 0 HG11 VAL B 5 11.828 5.545 -2.061 1.00 0.00 H new ATOM 0 HG12 VAL B 5 11.833 5.651 -3.837 1.00 0.00 H new ATOM 0 HG13 VAL B 5 10.667 6.607 -2.892 1.00 0.00 H new ATOM 0 HG21 VAL B 5 10.050 4.362 -0.879 1.00 0.00 H new ATOM 0 HG22 VAL B 5 8.776 5.342 -1.644 1.00 0.00 H new ATOM 0 HG23 VAL B 5 8.733 3.568 -1.774 1.00 0.00 H new ATOM 1243 N LYS B 6 7.014 5.357 -4.336 1.00 0.00 N ATOM 1244 CA LYS B 6 5.909 6.288 -4.340 1.00 0.00 C ATOM 1245 C LYS B 6 5.185 6.250 -3.005 1.00 0.00 C ATOM 1246 O LYS B 6 4.500 5.273 -2.696 1.00 0.00 O ATOM 1247 CB LYS B 6 4.938 5.917 -5.459 1.00 0.00 C ATOM 1248 CG LYS B 6 3.850 6.943 -5.695 1.00 0.00 C ATOM 1249 CD LYS B 6 2.776 6.394 -6.616 1.00 0.00 C ATOM 1250 CE LYS B 6 1.753 7.461 -6.971 1.00 0.00 C ATOM 1251 NZ LYS B 6 2.367 8.581 -7.734 1.00 0.00 N ATOM 0 H LYS B 6 6.745 4.392 -4.528 1.00 0.00 H new ATOM 0 HA LYS B 6 6.293 7.295 -4.504 1.00 0.00 H new ATOM 0 HB2 LYS B 6 5.500 5.779 -6.383 1.00 0.00 H new ATOM 0 HB3 LYS B 6 4.475 4.959 -5.222 1.00 0.00 H new ATOM 0 HG2 LYS B 6 3.405 7.232 -4.743 1.00 0.00 H new ATOM 0 HG3 LYS B 6 4.283 7.843 -6.131 1.00 0.00 H new ATOM 0 HD2 LYS B 6 3.236 6.011 -7.527 1.00 0.00 H new ATOM 0 HD3 LYS B 6 2.276 5.554 -6.134 1.00 0.00 H new ATOM 0 HE2 LYS B 6 0.952 7.015 -7.561 1.00 0.00 H new ATOM 0 HE3 LYS B 6 1.299 7.848 -6.059 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 1.642 9.297 -7.943 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 3.126 9.012 -7.168 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 2.763 8.218 -8.625 1.00 0.00 H new ATOM 1265 N THR B 7 5.343 7.296 -2.214 1.00 0.00 N ATOM 1266 CA THR B 7 4.655 7.380 -0.938 1.00 0.00 C ATOM 1267 C THR B 7 3.155 7.532 -1.157 1.00 0.00 C ATOM 1268 O THR B 7 2.717 7.999 -2.214 1.00 0.00 O ATOM 1269 CB THR B 7 5.168 8.562 -0.101 1.00 0.00 C ATOM 1270 OG1 THR B 7 5.095 9.761 -0.872 1.00 0.00 O ATOM 1271 CG2 THR B 7 6.599 8.332 0.351 1.00 0.00 C ATOM 0 H THR B 7 5.938 8.095 -2.431 1.00 0.00 H new ATOM 0 HA THR B 7 4.856 6.457 -0.394 1.00 0.00 H new ATOM 0 HB THR B 7 4.540 8.653 0.785 1.00 0.00 H new ATOM 0 HG1 THR B 7 5.764 9.731 -1.587 1.00 0.00 H new ATOM 0 HG21 THR B 7 6.936 9.184 0.941 1.00 0.00 H new ATOM 0 HG22 THR B 7 6.648 7.428 0.958 1.00 0.00 H new ATOM 0 HG23 THR B 7 7.242 8.218 -0.522 1.00 0.00 H new ATOM 1279 N LEU B 8 2.369 7.135 -0.166 1.00 0.00 N ATOM 1280 CA LEU B 8 0.918 7.191 -0.278 1.00 0.00 C ATOM 1281 C LEU B 8 0.430 8.639 -0.374 1.00 0.00 C ATOM 1282 O LEU B 8 -0.647 8.906 -0.909 1.00 0.00 O ATOM 1283 CB LEU B 8 0.272 6.466 0.905 1.00 0.00 C ATOM 1284 CG LEU B 8 -1.223 6.166 0.751 1.00 0.00 C ATOM 1285 CD1 LEU B 8 -1.556 4.821 1.368 1.00 0.00 C ATOM 1286 CD2 LEU B 8 -2.061 7.258 1.400 1.00 0.00 C ATOM 0 H LEU B 8 2.711 6.771 0.723 1.00 0.00 H new ATOM 0 HA LEU B 8 0.620 6.685 -1.196 1.00 0.00 H new ATOM 0 HB2 LEU B 8 0.800 5.526 1.066 1.00 0.00 H new ATOM 0 HB3 LEU B 8 0.414 7.069 1.802 1.00 0.00 H new ATOM 0 HG LEU B 8 -1.457 6.136 -0.313 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -2.621 4.621 1.251 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -0.983 4.040 0.868 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -1.303 4.835 2.428 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -3.119 7.025 1.279 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -1.822 7.318 2.462 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -1.843 8.214 0.925 1.00 0.00 H new ATOM 1298 N THR B 9 1.240 9.570 0.112 1.00 0.00 N ATOM 1299 CA THR B 9 0.901 10.984 0.055 1.00 0.00 C ATOM 1300 C THR B 9 1.070 11.547 -1.359 1.00 0.00 C ATOM 1301 O THR B 9 0.629 12.659 -1.652 1.00 0.00 O ATOM 1302 CB THR B 9 1.756 11.788 1.048 1.00 0.00 C ATOM 1303 OG1 THR B 9 3.066 11.214 1.127 1.00 0.00 O ATOM 1304 CG2 THR B 9 1.112 11.805 2.427 1.00 0.00 C ATOM 0 H THR B 9 2.139 9.370 0.551 1.00 0.00 H new ATOM 0 HA THR B 9 -0.149 11.079 0.333 1.00 0.00 H new ATOM 0 HB THR B 9 1.829 12.816 0.693 1.00 0.00 H new ATOM 0 HG1 THR B 9 3.611 11.728 1.759 1.00 0.00 H new ATOM 0 HG21 THR B 9 1.735 12.380 3.112 1.00 0.00 H new ATOM 0 HG22 THR B 9 0.125 12.264 2.362 1.00 0.00 H new ATOM 0 HG23 THR B 9 1.014 10.784 2.795 1.00 0.00 H new ATOM 1312 N GLY B 10 1.702 10.772 -2.234 1.00 0.00 N ATOM 1313 CA GLY B 10 1.854 11.189 -3.614 1.00 0.00 C ATOM 1314 C GLY B 10 3.254 11.669 -3.930 1.00 0.00 C ATOM 1315 O GLY B 10 3.523 12.146 -5.033 1.00 0.00 O ATOM 0 H GLY B 10 2.111 9.864 -2.012 1.00 0.00 H new ATOM 0 HA2 GLY B 10 1.604 10.356 -4.270 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.144 11.988 -3.828 1.00 0.00 H new ATOM 1319 N LYS B 11 4.151 11.548 -2.966 1.00 0.00 N ATOM 1320 CA LYS B 11 5.531 11.950 -3.166 1.00 0.00 C ATOM 1321 C LYS B 11 6.307 10.797 -3.795 1.00 0.00 C ATOM 1322 O LYS B 11 6.769 9.889 -3.101 1.00 0.00 O ATOM 1323 CB LYS B 11 6.154 12.372 -1.828 1.00 0.00 C ATOM 1324 CG LYS B 11 7.461 13.140 -1.948 1.00 0.00 C ATOM 1325 CD LYS B 11 7.267 14.449 -2.690 1.00 0.00 C ATOM 1326 CE LYS B 11 8.289 15.492 -2.263 1.00 0.00 C ATOM 1327 NZ LYS B 11 9.690 15.030 -2.446 1.00 0.00 N ATOM 0 H LYS B 11 3.948 11.175 -2.039 1.00 0.00 H new ATOM 0 HA LYS B 11 5.572 12.806 -3.840 1.00 0.00 H new ATOM 0 HB2 LYS B 11 5.435 12.987 -1.287 1.00 0.00 H new ATOM 0 HB3 LYS B 11 6.327 11.480 -1.226 1.00 0.00 H new ATOM 0 HG2 LYS B 11 7.860 13.339 -0.954 1.00 0.00 H new ATOM 0 HG3 LYS B 11 8.197 12.529 -2.471 1.00 0.00 H new ATOM 0 HD2 LYS B 11 7.350 14.275 -3.763 1.00 0.00 H new ATOM 0 HD3 LYS B 11 6.262 14.827 -2.505 1.00 0.00 H new ATOM 0 HE2 LYS B 11 8.133 16.404 -2.839 1.00 0.00 H new ATOM 0 HE3 LYS B 11 8.128 15.745 -1.215 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 10.342 15.821 -2.270 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 9.892 14.259 -1.777 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 9.818 14.686 -3.419 1.00 0.00 H new ATOM 1341 N THR B 12 6.384 10.810 -5.117 1.00 0.00 N ATOM 1342 CA THR B 12 7.081 9.775 -5.861 1.00 0.00 C ATOM 1343 C THR B 12 8.550 10.144 -6.020 1.00 0.00 C ATOM 1344 O THR B 12 8.886 11.056 -6.774 1.00 0.00 O ATOM 1345 CB THR B 12 6.454 9.586 -7.256 1.00 0.00 C ATOM 1346 OG1 THR B 12 5.021 9.625 -7.160 1.00 0.00 O ATOM 1347 CG2 THR B 12 6.890 8.264 -7.874 1.00 0.00 C ATOM 0 H THR B 12 5.967 11.535 -5.701 1.00 0.00 H new ATOM 0 HA THR B 12 6.994 8.842 -5.303 1.00 0.00 H new ATOM 0 HB THR B 12 6.798 10.398 -7.896 1.00 0.00 H new ATOM 0 HG1 THR B 12 4.647 9.980 -7.993 1.00 0.00 H new ATOM 0 HG21 THR B 12 6.434 8.154 -8.858 1.00 0.00 H new ATOM 0 HG22 THR B 12 7.975 8.249 -7.973 1.00 0.00 H new ATOM 0 HG23 THR B 12 6.573 7.441 -7.234 1.00 0.00 H new ATOM 1355 N ILE B 13 9.422 9.459 -5.300 1.00 0.00 N ATOM 1356 CA ILE B 13 10.838 9.759 -5.350 1.00 0.00 C ATOM 1357 C ILE B 13 11.628 8.609 -5.968 1.00 0.00 C ATOM 1358 O ILE B 13 11.308 7.437 -5.765 1.00 0.00 O ATOM 1359 CB ILE B 13 11.392 10.076 -3.946 1.00 0.00 C ATOM 1360 CG1 ILE B 13 10.952 9.011 -2.938 1.00 0.00 C ATOM 1361 CG2 ILE B 13 10.943 11.458 -3.499 1.00 0.00 C ATOM 1362 CD1 ILE B 13 11.468 9.245 -1.536 1.00 0.00 C ATOM 0 H ILE B 13 9.172 8.692 -4.675 1.00 0.00 H new ATOM 0 HA ILE B 13 10.956 10.641 -5.980 1.00 0.00 H new ATOM 0 HB ILE B 13 12.481 10.067 -3.995 1.00 0.00 H new ATOM 0 HG12 ILE B 13 9.863 8.976 -2.913 1.00 0.00 H new ATOM 0 HG13 ILE B 13 11.294 8.035 -3.283 1.00 0.00 H new ATOM 0 HG21 ILE B 13 11.342 11.667 -2.506 1.00 0.00 H new ATOM 0 HG22 ILE B 13 11.310 12.205 -4.202 1.00 0.00 H new ATOM 0 HG23 ILE B 13 9.854 11.494 -3.467 1.00 0.00 H new ATOM 0 HD11 ILE B 13 11.114 8.449 -0.880 1.00 0.00 H new ATOM 0 HD12 ILE B 13 12.558 9.249 -1.545 1.00 0.00 H new ATOM 0 HD13 ILE B 13 11.104 10.205 -1.170 1.00 0.00 H new ATOM 1374 N THR B 14 12.649 8.952 -6.740 1.00 0.00 N ATOM 1375 CA THR B 14 13.507 7.955 -7.356 1.00 0.00 C ATOM 1376 C THR B 14 14.692 7.654 -6.443 1.00 0.00 C ATOM 1377 O THR B 14 15.550 8.510 -6.221 1.00 0.00 O ATOM 1378 CB THR B 14 14.014 8.435 -8.726 1.00 0.00 C ATOM 1379 OG1 THR B 14 12.913 8.919 -9.504 1.00 0.00 O ATOM 1380 CG2 THR B 14 14.703 7.307 -9.472 1.00 0.00 C ATOM 0 H THR B 14 12.902 9.917 -6.954 1.00 0.00 H new ATOM 0 HA THR B 14 12.923 7.047 -7.505 1.00 0.00 H new ATOM 0 HB THR B 14 14.734 9.237 -8.565 1.00 0.00 H new ATOM 0 HG1 THR B 14 12.437 8.161 -9.904 1.00 0.00 H new ATOM 0 HG21 THR B 14 15.053 7.670 -10.438 1.00 0.00 H new ATOM 0 HG22 THR B 14 15.552 6.950 -8.889 1.00 0.00 H new ATOM 0 HG23 THR B 14 13.999 6.489 -9.625 1.00 0.00 H new ATOM 1388 N LEU B 15 14.730 6.443 -5.911 1.00 0.00 N ATOM 1389 CA LEU B 15 15.730 6.072 -4.926 1.00 0.00 C ATOM 1390 C LEU B 15 16.848 5.248 -5.567 1.00 0.00 C ATOM 1391 O LEU B 15 16.594 4.230 -6.212 1.00 0.00 O ATOM 1392 CB LEU B 15 15.060 5.280 -3.796 1.00 0.00 C ATOM 1393 CG LEU B 15 15.591 5.551 -2.383 1.00 0.00 C ATOM 1394 CD1 LEU B 15 17.055 5.179 -2.274 1.00 0.00 C ATOM 1395 CD2 LEU B 15 15.389 7.010 -2.003 1.00 0.00 C ATOM 0 H LEU B 15 14.075 5.697 -6.147 1.00 0.00 H new ATOM 0 HA LEU B 15 16.177 6.978 -4.517 1.00 0.00 H new ATOM 0 HB2 LEU B 15 13.992 5.497 -3.810 1.00 0.00 H new ATOM 0 HB3 LEU B 15 15.172 4.217 -4.008 1.00 0.00 H new ATOM 0 HG LEU B 15 15.026 4.929 -1.688 1.00 0.00 H new ATOM 0 HD11 LEU B 15 17.407 5.381 -1.262 1.00 0.00 H new ATOM 0 HD12 LEU B 15 17.179 4.119 -2.497 1.00 0.00 H new ATOM 0 HD13 LEU B 15 17.634 5.769 -2.984 1.00 0.00 H new ATOM 0 HD21 LEU B 15 15.773 7.180 -0.997 1.00 0.00 H new ATOM 0 HD22 LEU B 15 15.923 7.647 -2.708 1.00 0.00 H new ATOM 0 HD23 LEU B 15 14.326 7.250 -2.031 1.00 0.00 H new ATOM 1407 N GLU B 16 18.082 5.703 -5.387 1.00 0.00 N ATOM 1408 CA GLU B 16 19.255 4.982 -5.862 1.00 0.00 C ATOM 1409 C GLU B 16 19.733 4.008 -4.784 1.00 0.00 C ATOM 1410 O GLU B 16 20.221 4.419 -3.728 1.00 0.00 O ATOM 1411 CB GLU B 16 20.361 5.977 -6.240 1.00 0.00 C ATOM 1412 CG GLU B 16 21.701 5.342 -6.591 1.00 0.00 C ATOM 1413 CD GLU B 16 21.636 4.392 -7.771 1.00 0.00 C ATOM 1414 OE1 GLU B 16 21.437 4.858 -8.912 1.00 0.00 O ATOM 1415 OE2 GLU B 16 21.806 3.171 -7.562 1.00 0.00 O ATOM 0 H GLU B 16 18.297 6.578 -4.910 1.00 0.00 H new ATOM 0 HA GLU B 16 18.997 4.408 -6.752 1.00 0.00 H new ATOM 0 HB2 GLU B 16 20.022 6.569 -7.090 1.00 0.00 H new ATOM 0 HB3 GLU B 16 20.509 6.667 -5.409 1.00 0.00 H new ATOM 0 HG2 GLU B 16 22.420 6.131 -6.811 1.00 0.00 H new ATOM 0 HG3 GLU B 16 22.076 4.802 -5.722 1.00 0.00 H new ATOM 1422 N VAL B 17 19.554 2.720 -5.044 1.00 0.00 N ATOM 1423 CA VAL B 17 19.899 1.678 -4.084 1.00 0.00 C ATOM 1424 C VAL B 17 20.446 0.451 -4.798 1.00 0.00 C ATOM 1425 O VAL B 17 20.137 0.213 -5.964 1.00 0.00 O ATOM 1426 CB VAL B 17 18.685 1.285 -3.189 1.00 0.00 C ATOM 1427 CG1 VAL B 17 17.415 1.986 -3.634 1.00 0.00 C ATOM 1428 CG2 VAL B 17 18.427 -0.208 -3.168 1.00 0.00 C ATOM 0 H VAL B 17 19.168 2.369 -5.920 1.00 0.00 H new ATOM 0 HA VAL B 17 20.672 2.084 -3.432 1.00 0.00 H new ATOM 0 HB VAL B 17 18.954 1.605 -2.182 1.00 0.00 H new ATOM 0 HG11 VAL B 17 16.589 1.688 -2.988 1.00 0.00 H new ATOM 0 HG12 VAL B 17 17.554 3.065 -3.571 1.00 0.00 H new ATOM 0 HG13 VAL B 17 17.188 1.709 -4.663 1.00 0.00 H new ATOM 0 HG21 VAL B 17 17.570 -0.420 -2.528 1.00 0.00 H new ATOM 0 HG22 VAL B 17 18.219 -0.556 -4.180 1.00 0.00 H new ATOM 0 HG23 VAL B 17 19.306 -0.724 -2.780 1.00 0.00 H new ATOM 1438 N GLU B 18 21.243 -0.331 -4.089 1.00 0.00 N ATOM 1439 CA GLU B 18 21.847 -1.524 -4.668 1.00 0.00 C ATOM 1440 C GLU B 18 20.846 -2.674 -4.696 1.00 0.00 C ATOM 1441 O GLU B 18 20.015 -2.808 -3.800 1.00 0.00 O ATOM 1442 CB GLU B 18 23.107 -1.955 -3.904 1.00 0.00 C ATOM 1443 CG GLU B 18 24.349 -1.136 -4.226 1.00 0.00 C ATOM 1444 CD GLU B 18 24.349 0.234 -3.584 1.00 0.00 C ATOM 1445 OE1 GLU B 18 23.754 1.166 -4.160 1.00 0.00 O ATOM 1446 OE2 GLU B 18 24.967 0.393 -2.507 1.00 0.00 O ATOM 0 H GLU B 18 21.488 -0.163 -3.113 1.00 0.00 H new ATOM 0 HA GLU B 18 22.138 -1.273 -5.688 1.00 0.00 H new ATOM 0 HB2 GLU B 18 22.909 -1.887 -2.834 1.00 0.00 H new ATOM 0 HB3 GLU B 18 23.310 -3.003 -4.125 1.00 0.00 H new ATOM 0 HG2 GLU B 18 25.232 -1.684 -3.896 1.00 0.00 H new ATOM 0 HG3 GLU B 18 24.430 -1.022 -5.307 1.00 0.00 H new ATOM 1453 N SER B 19 20.937 -3.505 -5.725 1.00 0.00 N ATOM 1454 CA SER B 19 20.049 -4.653 -5.875 1.00 0.00 C ATOM 1455 C SER B 19 20.154 -5.615 -4.686 1.00 0.00 C ATOM 1456 O SER B 19 19.221 -6.370 -4.402 1.00 0.00 O ATOM 1457 CB SER B 19 20.375 -5.386 -7.177 1.00 0.00 C ATOM 1458 OG SER B 19 20.287 -4.504 -8.287 1.00 0.00 O ATOM 0 H SER B 19 21.622 -3.405 -6.474 1.00 0.00 H new ATOM 0 HA SER B 19 19.024 -4.284 -5.906 1.00 0.00 H new ATOM 0 HB2 SER B 19 21.378 -5.808 -7.121 1.00 0.00 H new ATOM 0 HB3 SER B 19 19.686 -6.219 -7.313 1.00 0.00 H new ATOM 0 HG SER B 19 19.437 -4.017 -8.251 1.00 0.00 H new ATOM 1464 N SER B 20 21.283 -5.574 -3.989 1.00 0.00 N ATOM 1465 CA SER B 20 21.515 -6.453 -2.854 1.00 0.00 C ATOM 1466 C SER B 20 21.355 -5.710 -1.526 1.00 0.00 C ATOM 1467 O SER B 20 21.696 -6.237 -0.468 1.00 0.00 O ATOM 1468 CB SER B 20 22.914 -7.060 -2.963 1.00 0.00 C ATOM 1469 OG SER B 20 23.056 -7.785 -4.176 1.00 0.00 O ATOM 0 H SER B 20 22.054 -4.938 -4.193 1.00 0.00 H new ATOM 0 HA SER B 20 20.769 -7.247 -2.872 1.00 0.00 H new ATOM 0 HB2 SER B 20 23.663 -6.269 -2.917 1.00 0.00 H new ATOM 0 HB3 SER B 20 23.096 -7.721 -2.116 1.00 0.00 H new ATOM 0 HG SER B 20 23.958 -8.164 -4.227 1.00 0.00 H new ATOM 1475 N ASP B 21 20.821 -4.492 -1.583 1.00 0.00 N ATOM 1476 CA ASP B 21 20.571 -3.713 -0.372 1.00 0.00 C ATOM 1477 C ASP B 21 19.358 -4.251 0.365 1.00 0.00 C ATOM 1478 O ASP B 21 18.407 -4.732 -0.256 1.00 0.00 O ATOM 1479 CB ASP B 21 20.324 -2.238 -0.694 1.00 0.00 C ATOM 1480 CG ASP B 21 21.561 -1.374 -0.569 1.00 0.00 C ATOM 1481 OD1 ASP B 21 22.328 -1.563 0.396 1.00 0.00 O ATOM 1482 OD2 ASP B 21 21.744 -0.467 -1.408 1.00 0.00 O ATOM 0 H ASP B 21 20.554 -4.025 -2.450 1.00 0.00 H new ATOM 0 HA ASP B 21 21.461 -3.799 0.252 1.00 0.00 H new ATOM 0 HB2 ASP B 21 19.935 -2.157 -1.709 1.00 0.00 H new ATOM 0 HB3 ASP B 21 19.553 -1.853 -0.026 1.00 0.00 H new ATOM 1487 N THR B 22 19.395 -4.165 1.682 1.00 0.00 N ATOM 1488 CA THR B 22 18.263 -4.549 2.502 1.00 0.00 C ATOM 1489 C THR B 22 17.207 -3.454 2.481 1.00 0.00 C ATOM 1490 O THR B 22 17.526 -2.284 2.261 1.00 0.00 O ATOM 1491 CB THR B 22 18.697 -4.788 3.956 1.00 0.00 C ATOM 1492 OG1 THR B 22 19.418 -3.645 4.434 1.00 0.00 O ATOM 1493 CG2 THR B 22 19.565 -6.030 4.074 1.00 0.00 C ATOM 0 H THR B 22 20.202 -3.830 2.208 1.00 0.00 H new ATOM 0 HA THR B 22 17.852 -5.472 2.093 1.00 0.00 H new ATOM 0 HB THR B 22 17.803 -4.941 4.561 1.00 0.00 H new ATOM 0 HG1 THR B 22 19.693 -3.797 5.362 1.00 0.00 H new ATOM 0 HG21 THR B 22 19.856 -6.173 5.115 1.00 0.00 H new ATOM 0 HG22 THR B 22 19.004 -6.900 3.732 1.00 0.00 H new ATOM 0 HG23 THR B 22 20.458 -5.910 3.461 1.00 0.00 H new ATOM 1501 N ILE B 23 15.954 -3.830 2.712 1.00 0.00 N ATOM 1502 CA ILE B 23 14.876 -2.857 2.816 1.00 0.00 C ATOM 1503 C ILE B 23 15.154 -1.915 3.982 1.00 0.00 C ATOM 1504 O ILE B 23 14.793 -0.739 3.949 1.00 0.00 O ATOM 1505 CB ILE B 23 13.503 -3.545 2.996 1.00 0.00 C ATOM 1506 CG1 ILE B 23 13.241 -4.511 1.833 1.00 0.00 C ATOM 1507 CG2 ILE B 23 12.385 -2.514 3.095 1.00 0.00 C ATOM 1508 CD1 ILE B 23 13.298 -3.862 0.465 1.00 0.00 C ATOM 0 H ILE B 23 15.661 -4.800 2.830 1.00 0.00 H new ATOM 0 HA ILE B 23 14.836 -2.289 1.887 1.00 0.00 H new ATOM 0 HB ILE B 23 13.522 -4.111 3.927 1.00 0.00 H new ATOM 0 HG12 ILE B 23 13.974 -5.317 1.872 1.00 0.00 H new ATOM 0 HG13 ILE B 23 12.260 -4.966 1.967 1.00 0.00 H new ATOM 0 HG21 ILE B 23 11.430 -3.024 3.221 1.00 0.00 H new ATOM 0 HG22 ILE B 23 12.565 -1.863 3.951 1.00 0.00 H new ATOM 0 HG23 ILE B 23 12.360 -1.916 2.184 1.00 0.00 H new ATOM 0 HD11 ILE B 23 13.102 -4.612 -0.302 1.00 0.00 H new ATOM 0 HD12 ILE B 23 12.546 -3.075 0.404 1.00 0.00 H new ATOM 0 HD13 ILE B 23 14.287 -3.432 0.307 1.00 0.00 H new ATOM 1520 N ASP B 24 15.831 -2.446 4.996 1.00 0.00 N ATOM 1521 CA ASP B 24 16.309 -1.652 6.121 1.00 0.00 C ATOM 1522 C ASP B 24 17.191 -0.508 5.634 1.00 0.00 C ATOM 1523 O ASP B 24 16.975 0.653 5.987 1.00 0.00 O ATOM 1524 CB ASP B 24 17.104 -2.532 7.090 1.00 0.00 C ATOM 1525 CG ASP B 24 17.825 -1.726 8.151 1.00 0.00 C ATOM 1526 OD1 ASP B 24 17.179 -1.330 9.140 1.00 0.00 O ATOM 1527 OD2 ASP B 24 19.042 -1.492 8.000 1.00 0.00 O ATOM 0 H ASP B 24 16.063 -3.437 5.060 1.00 0.00 H new ATOM 0 HA ASP B 24 15.443 -1.237 6.637 1.00 0.00 H new ATOM 0 HB2 ASP B 24 16.428 -3.238 7.572 1.00 0.00 H new ATOM 0 HB3 ASP B 24 17.831 -3.119 6.529 1.00 0.00 H new ATOM 1532 N ASN B 25 18.177 -0.839 4.807 1.00 0.00 N ATOM 1533 CA ASN B 25 19.085 0.170 4.283 1.00 0.00 C ATOM 1534 C ASN B 25 18.354 1.089 3.313 1.00 0.00 C ATOM 1535 O ASN B 25 18.656 2.277 3.232 1.00 0.00 O ATOM 1536 CB ASN B 25 20.297 -0.472 3.602 1.00 0.00 C ATOM 1537 CG ASN B 25 21.404 0.534 3.336 1.00 0.00 C ATOM 1538 OD1 ASN B 25 21.517 1.547 4.022 1.00 0.00 O ATOM 1539 ND2 ASN B 25 22.236 0.261 2.348 1.00 0.00 N ATOM 0 H ASN B 25 18.365 -1.789 4.488 1.00 0.00 H new ATOM 0 HA ASN B 25 19.449 0.763 5.122 1.00 0.00 H new ATOM 0 HB2 ASN B 25 20.682 -1.275 4.230 1.00 0.00 H new ATOM 0 HB3 ASN B 25 19.985 -0.925 2.661 1.00 0.00 H new ATOM 0 HD21 ASN B 25 23.002 0.900 2.135 1.00 0.00 H new ATOM 0 HD22 ASN B 25 22.113 -0.589 1.798 1.00 0.00 H new ATOM 1546 N VAL B 26 17.380 0.544 2.589 1.00 0.00 N ATOM 1547 CA VAL B 26 16.545 1.347 1.710 1.00 0.00 C ATOM 1548 C VAL B 26 15.816 2.424 2.509 1.00 0.00 C ATOM 1549 O VAL B 26 15.769 3.587 2.104 1.00 0.00 O ATOM 1550 CB VAL B 26 15.522 0.475 0.949 1.00 0.00 C ATOM 1551 CG1 VAL B 26 14.550 1.337 0.168 1.00 0.00 C ATOM 1552 CG2 VAL B 26 16.231 -0.491 0.014 1.00 0.00 C ATOM 0 H VAL B 26 17.152 -0.450 2.596 1.00 0.00 H new ATOM 0 HA VAL B 26 17.198 1.821 0.977 1.00 0.00 H new ATOM 0 HB VAL B 26 14.959 -0.099 1.685 1.00 0.00 H new ATOM 0 HG11 VAL B 26 13.840 0.699 -0.359 1.00 0.00 H new ATOM 0 HG12 VAL B 26 14.011 1.990 0.854 1.00 0.00 H new ATOM 0 HG13 VAL B 26 15.099 1.942 -0.553 1.00 0.00 H new ATOM 0 HG21 VAL B 26 15.493 -1.096 -0.512 1.00 0.00 H new ATOM 0 HG22 VAL B 26 16.822 0.071 -0.709 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.887 -1.141 0.592 1.00 0.00 H new ATOM 1562 N LYS B 27 15.272 2.040 3.660 1.00 0.00 N ATOM 1563 CA LYS B 27 14.592 2.986 4.534 1.00 0.00 C ATOM 1564 C LYS B 27 15.561 4.046 5.044 1.00 0.00 C ATOM 1565 O LYS B 27 15.191 5.207 5.195 1.00 0.00 O ATOM 1566 CB LYS B 27 13.941 2.261 5.710 1.00 0.00 C ATOM 1567 CG LYS B 27 12.831 1.308 5.304 1.00 0.00 C ATOM 1568 CD LYS B 27 12.208 0.642 6.516 1.00 0.00 C ATOM 1569 CE LYS B 27 11.111 -0.327 6.121 1.00 0.00 C ATOM 1570 NZ LYS B 27 10.440 -0.910 7.312 1.00 0.00 N ATOM 0 H LYS B 27 15.290 1.081 4.008 1.00 0.00 H new ATOM 0 HA LYS B 27 13.813 3.480 3.953 1.00 0.00 H new ATOM 0 HB2 LYS B 27 14.706 1.703 6.250 1.00 0.00 H new ATOM 0 HB3 LYS B 27 13.537 3.000 6.402 1.00 0.00 H new ATOM 0 HG2 LYS B 27 12.065 1.852 4.751 1.00 0.00 H new ATOM 0 HG3 LYS B 27 13.229 0.547 4.632 1.00 0.00 H new ATOM 0 HD2 LYS B 27 12.978 0.111 7.076 1.00 0.00 H new ATOM 0 HD3 LYS B 27 11.799 1.404 7.180 1.00 0.00 H new ATOM 0 HE2 LYS B 27 10.375 0.188 5.504 1.00 0.00 H new ATOM 0 HE3 LYS B 27 11.533 -1.127 5.513 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 10.664 -1.924 7.375 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 10.775 -0.427 8.170 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 9.411 -0.788 7.225 1.00 0.00 H new ATOM 1584 N SER B 28 16.800 3.643 5.300 1.00 0.00 N ATOM 1585 CA SER B 28 17.841 4.580 5.703 1.00 0.00 C ATOM 1586 C SER B 28 18.090 5.604 4.599 1.00 0.00 C ATOM 1587 O SER B 28 18.254 6.797 4.865 1.00 0.00 O ATOM 1588 CB SER B 28 19.130 3.832 6.036 1.00 0.00 C ATOM 1589 OG SER B 28 20.194 4.724 6.336 1.00 0.00 O ATOM 0 H SER B 28 17.108 2.673 5.236 1.00 0.00 H new ATOM 0 HA SER B 28 17.506 5.108 6.596 1.00 0.00 H new ATOM 0 HB2 SER B 28 18.958 3.172 6.886 1.00 0.00 H new ATOM 0 HB3 SER B 28 19.412 3.200 5.194 1.00 0.00 H new ATOM 0 HG SER B 28 21.002 4.211 6.546 1.00 0.00 H new ATOM 1595 N LYS B 29 18.097 5.130 3.357 1.00 0.00 N ATOM 1596 CA LYS B 29 18.292 6.000 2.204 1.00 0.00 C ATOM 1597 C LYS B 29 17.145 7.002 2.093 1.00 0.00 C ATOM 1598 O LYS B 29 17.362 8.177 1.796 1.00 0.00 O ATOM 1599 CB LYS B 29 18.382 5.174 0.919 1.00 0.00 C ATOM 1600 CG LYS B 29 19.441 4.083 0.954 1.00 0.00 C ATOM 1601 CD LYS B 29 19.253 3.085 -0.182 1.00 0.00 C ATOM 1602 CE LYS B 29 20.227 1.919 -0.079 1.00 0.00 C ATOM 1603 NZ LYS B 29 21.635 2.326 -0.336 1.00 0.00 N ATOM 0 H LYS B 29 17.969 4.145 3.124 1.00 0.00 H new ATOM 0 HA LYS B 29 19.227 6.544 2.341 1.00 0.00 H new ATOM 0 HB2 LYS B 29 17.412 4.717 0.725 1.00 0.00 H new ATOM 0 HB3 LYS B 29 18.592 5.843 0.084 1.00 0.00 H new ATOM 0 HG2 LYS B 29 20.431 4.533 0.884 1.00 0.00 H new ATOM 0 HG3 LYS B 29 19.395 3.561 1.910 1.00 0.00 H new ATOM 0 HD2 LYS B 29 18.231 2.707 -0.168 1.00 0.00 H new ATOM 0 HD3 LYS B 29 19.392 3.591 -1.137 1.00 0.00 H new ATOM 0 HE2 LYS B 29 20.156 1.478 0.915 1.00 0.00 H new ATOM 0 HE3 LYS B 29 19.940 1.146 -0.792 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 22.144 1.545 -0.797 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 21.647 3.161 -0.956 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 22.099 2.557 0.565 1.00 0.00 H new ATOM 1617 N ILE B 30 15.925 6.533 2.333 1.00 0.00 N ATOM 1618 CA ILE B 30 14.750 7.396 2.281 1.00 0.00 C ATOM 1619 C ILE B 30 14.734 8.346 3.478 1.00 0.00 C ATOM 1620 O ILE B 30 14.293 9.493 3.374 1.00 0.00 O ATOM 1621 CB ILE B 30 13.442 6.573 2.255 1.00 0.00 C ATOM 1622 CG1 ILE B 30 13.460 5.579 1.089 1.00 0.00 C ATOM 1623 CG2 ILE B 30 12.233 7.497 2.144 1.00 0.00 C ATOM 1624 CD1 ILE B 30 12.254 4.664 1.049 1.00 0.00 C ATOM 0 H ILE B 30 15.724 5.560 2.565 1.00 0.00 H new ATOM 0 HA ILE B 30 14.809 7.974 1.359 1.00 0.00 H new ATOM 0 HB ILE B 30 13.367 6.014 3.188 1.00 0.00 H new ATOM 0 HG12 ILE B 30 13.516 6.133 0.152 1.00 0.00 H new ATOM 0 HG13 ILE B 30 14.363 4.972 1.155 1.00 0.00 H new ATOM 0 HG21 ILE B 30 11.320 6.901 2.127 1.00 0.00 H new ATOM 0 HG22 ILE B 30 12.210 8.171 3.000 1.00 0.00 H new ATOM 0 HG23 ILE B 30 12.303 8.079 1.225 1.00 0.00 H new ATOM 0 HD11 ILE B 30 12.337 3.989 0.197 1.00 0.00 H new ATOM 0 HD12 ILE B 30 12.208 4.082 1.970 1.00 0.00 H new ATOM 0 HD13 ILE B 30 11.347 5.261 0.951 1.00 0.00 H new ATOM 1636 N GLN B 31 15.232 7.864 4.610 1.00 0.00 N ATOM 1637 CA GLN B 31 15.340 8.676 5.813 1.00 0.00 C ATOM 1638 C GLN B 31 16.367 9.793 5.606 1.00 0.00 C ATOM 1639 O GLN B 31 16.285 10.849 6.226 1.00 0.00 O ATOM 1640 CB GLN B 31 15.709 7.792 7.012 1.00 0.00 C ATOM 1641 CG GLN B 31 15.778 8.536 8.334 1.00 0.00 C ATOM 1642 CD GLN B 31 16.036 7.609 9.507 1.00 0.00 C ATOM 1643 OE1 GLN B 31 16.678 6.569 9.363 1.00 0.00 O ATOM 1644 NE2 GLN B 31 15.532 7.972 10.676 1.00 0.00 N ATOM 0 H GLN B 31 15.569 6.908 4.719 1.00 0.00 H new ATOM 0 HA GLN B 31 14.377 9.142 6.021 1.00 0.00 H new ATOM 0 HB2 GLN B 31 14.976 6.990 7.097 1.00 0.00 H new ATOM 0 HB3 GLN B 31 16.674 7.323 6.821 1.00 0.00 H new ATOM 0 HG2 GLN B 31 16.569 9.285 8.285 1.00 0.00 H new ATOM 0 HG3 GLN B 31 14.842 9.071 8.496 1.00 0.00 H new ATOM 0 HE21 GLN B 31 15.005 8.842 10.756 1.00 0.00 H new ATOM 0 HE22 GLN B 31 15.671 7.382 11.496 1.00 0.00 H new ATOM 1653 N ASP B 32 17.322 9.551 4.716 1.00 0.00 N ATOM 1654 CA ASP B 32 18.278 10.580 4.317 1.00 0.00 C ATOM 1655 C ASP B 32 17.647 11.516 3.291 1.00 0.00 C ATOM 1656 O ASP B 32 17.799 12.734 3.364 1.00 0.00 O ATOM 1657 CB ASP B 32 19.538 9.939 3.721 1.00 0.00 C ATOM 1658 CG ASP B 32 20.506 10.961 3.146 1.00 0.00 C ATOM 1659 OD1 ASP B 32 21.332 11.501 3.914 1.00 0.00 O ATOM 1660 OD2 ASP B 32 20.450 11.224 1.924 1.00 0.00 O ATOM 0 H ASP B 32 17.456 8.651 4.256 1.00 0.00 H new ATOM 0 HA ASP B 32 18.556 11.152 5.202 1.00 0.00 H new ATOM 0 HB2 ASP B 32 20.045 9.360 4.493 1.00 0.00 H new ATOM 0 HB3 ASP B 32 19.248 9.240 2.937 1.00 0.00 H new ATOM 1665 N LYS B 33 16.927 10.926 2.345 1.00 0.00 N ATOM 1666 CA LYS B 33 16.304 11.664 1.264 1.00 0.00 C ATOM 1667 C LYS B 33 15.210 12.597 1.779 1.00 0.00 C ATOM 1668 O LYS B 33 15.342 13.821 1.723 1.00 0.00 O ATOM 1669 CB LYS B 33 15.714 10.670 0.266 1.00 0.00 C ATOM 1670 CG LYS B 33 15.204 11.304 -1.012 1.00 0.00 C ATOM 1671 CD LYS B 33 16.345 11.724 -1.925 1.00 0.00 C ATOM 1672 CE LYS B 33 17.160 10.522 -2.377 1.00 0.00 C ATOM 1673 NZ LYS B 33 18.287 10.909 -3.263 1.00 0.00 N ATOM 0 H LYS B 33 16.761 9.920 2.310 1.00 0.00 H new ATOM 0 HA LYS B 33 17.061 12.282 0.781 1.00 0.00 H new ATOM 0 HB2 LYS B 33 16.474 9.931 0.014 1.00 0.00 H new ATOM 0 HB3 LYS B 33 14.895 10.134 0.745 1.00 0.00 H new ATOM 0 HG2 LYS B 33 14.559 10.599 -1.536 1.00 0.00 H new ATOM 0 HG3 LYS B 33 14.594 12.174 -0.769 1.00 0.00 H new ATOM 0 HD2 LYS B 33 15.945 12.243 -2.796 1.00 0.00 H new ATOM 0 HD3 LYS B 33 16.991 12.429 -1.402 1.00 0.00 H new ATOM 0 HE2 LYS B 33 17.550 10.000 -1.503 1.00 0.00 H new ATOM 0 HE3 LYS B 33 16.511 9.822 -2.903 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 18.814 10.058 -3.546 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 17.915 11.384 -4.110 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 18.922 11.556 -2.754 1.00 0.00 H new ATOM 1687 N GLU B 34 14.137 12.010 2.291 1.00 0.00 N ATOM 1688 CA GLU B 34 12.972 12.776 2.715 1.00 0.00 C ATOM 1689 C GLU B 34 12.935 12.924 4.232 1.00 0.00 C ATOM 1690 O GLU B 34 12.453 13.927 4.756 1.00 0.00 O ATOM 1691 CB GLU B 34 11.692 12.095 2.229 1.00 0.00 C ATOM 1692 CG GLU B 34 11.662 11.840 0.729 1.00 0.00 C ATOM 1693 CD GLU B 34 11.644 13.114 -0.094 1.00 0.00 C ATOM 1694 OE1 GLU B 34 12.727 13.682 -0.354 1.00 0.00 O ATOM 1695 OE2 GLU B 34 10.545 13.550 -0.487 1.00 0.00 O ATOM 0 H GLU B 34 14.049 11.002 2.423 1.00 0.00 H new ATOM 0 HA GLU B 34 13.042 13.771 2.275 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.576 11.146 2.752 1.00 0.00 H new ATOM 0 HB3 GLU B 34 10.837 12.714 2.500 1.00 0.00 H new ATOM 0 HG2 GLU B 34 12.533 11.248 0.450 1.00 0.00 H new ATOM 0 HG3 GLU B 34 10.781 11.246 0.486 1.00 0.00 H new ATOM 1702 N GLY B 35 13.447 11.921 4.931 1.00 0.00 N ATOM 1703 CA GLY B 35 13.451 11.957 6.382 1.00 0.00 C ATOM 1704 C GLY B 35 12.209 11.324 6.979 1.00 0.00 C ATOM 1705 O GLY B 35 11.391 12.005 7.595 1.00 0.00 O ATOM 0 H GLY B 35 13.860 11.083 4.521 1.00 0.00 H new ATOM 0 HA2 GLY B 35 14.335 11.438 6.753 1.00 0.00 H new ATOM 0 HA3 GLY B 35 13.525 12.992 6.717 1.00 0.00 H new ATOM 1709 N ILE B 36 12.058 10.023 6.781 1.00 0.00 N ATOM 1710 CA ILE B 36 10.907 9.298 7.302 1.00 0.00 C ATOM 1711 C ILE B 36 11.368 8.141 8.185 1.00 0.00 C ATOM 1712 O ILE B 36 12.292 7.413 7.817 1.00 0.00 O ATOM 1713 CB ILE B 36 10.034 8.746 6.151 1.00 0.00 C ATOM 1714 CG1 ILE B 36 9.748 9.845 5.121 1.00 0.00 C ATOM 1715 CG2 ILE B 36 8.730 8.181 6.696 1.00 0.00 C ATOM 1716 CD1 ILE B 36 8.987 9.360 3.905 1.00 0.00 C ATOM 0 H ILE B 36 12.720 9.446 6.262 1.00 0.00 H new ATOM 0 HA ILE B 36 10.312 9.994 7.893 1.00 0.00 H new ATOM 0 HB ILE B 36 10.582 7.942 5.659 1.00 0.00 H new ATOM 0 HG12 ILE B 36 9.178 10.641 5.601 1.00 0.00 H new ATOM 0 HG13 ILE B 36 10.693 10.281 4.797 1.00 0.00 H new ATOM 0 HG21 ILE B 36 8.128 7.797 5.873 1.00 0.00 H new ATOM 0 HG22 ILE B 36 8.947 7.373 7.394 1.00 0.00 H new ATOM 0 HG23 ILE B 36 8.180 8.968 7.212 1.00 0.00 H new ATOM 0 HD11 ILE B 36 8.822 10.194 3.222 1.00 0.00 H new ATOM 0 HD12 ILE B 36 9.564 8.586 3.400 1.00 0.00 H new ATOM 0 HD13 ILE B 36 8.026 8.951 4.217 1.00 0.00 H new ATOM 1728 N PRO B 37 10.762 7.979 9.376 1.00 0.00 N ATOM 1729 CA PRO B 37 11.061 6.860 10.279 1.00 0.00 C ATOM 1730 C PRO B 37 10.878 5.496 9.607 1.00 0.00 C ATOM 1731 O PRO B 37 9.814 5.194 9.061 1.00 0.00 O ATOM 1732 CB PRO B 37 10.058 7.030 11.430 1.00 0.00 C ATOM 1733 CG PRO B 37 9.053 8.022 10.947 1.00 0.00 C ATOM 1734 CD PRO B 37 9.768 8.891 9.956 1.00 0.00 C ATOM 0 HA PRO B 37 12.101 6.879 10.603 1.00 0.00 H new ATOM 0 HB2 PRO B 37 9.583 6.081 11.679 1.00 0.00 H new ATOM 0 HB3 PRO B 37 10.555 7.384 12.333 1.00 0.00 H new ATOM 0 HG2 PRO B 37 8.203 7.521 10.484 1.00 0.00 H new ATOM 0 HG3 PRO B 37 8.662 8.615 11.774 1.00 0.00 H new ATOM 0 HD2 PRO B 37 9.089 9.283 9.199 1.00 0.00 H new ATOM 0 HD3 PRO B 37 10.239 9.749 10.437 1.00 0.00 H new ATOM 1742 N PRO B 38 11.932 4.663 9.628 1.00 0.00 N ATOM 1743 CA PRO B 38 11.933 3.333 8.995 1.00 0.00 C ATOM 1744 C PRO B 38 10.799 2.419 9.467 1.00 0.00 C ATOM 1745 O PRO B 38 10.169 1.740 8.655 1.00 0.00 O ATOM 1746 CB PRO B 38 13.290 2.751 9.396 1.00 0.00 C ATOM 1747 CG PRO B 38 14.146 3.942 9.653 1.00 0.00 C ATOM 1748 CD PRO B 38 13.232 4.969 10.252 1.00 0.00 C ATOM 0 HA PRO B 38 11.776 3.413 7.919 1.00 0.00 H new ATOM 0 HB2 PRO B 38 13.206 2.124 10.283 1.00 0.00 H new ATOM 0 HB3 PRO B 38 13.704 2.128 8.603 1.00 0.00 H new ATOM 0 HG2 PRO B 38 14.963 3.699 10.333 1.00 0.00 H new ATOM 0 HG3 PRO B 38 14.597 4.308 8.731 1.00 0.00 H new ATOM 0 HD2 PRO B 38 13.188 4.885 11.338 1.00 0.00 H new ATOM 0 HD3 PRO B 38 13.560 5.983 10.024 1.00 0.00 H new ATOM 1756 N ASP B 39 10.533 2.405 10.770 1.00 0.00 N ATOM 1757 CA ASP B 39 9.469 1.565 11.329 1.00 0.00 C ATOM 1758 C ASP B 39 8.115 1.953 10.743 1.00 0.00 C ATOM 1759 O ASP B 39 7.268 1.101 10.467 1.00 0.00 O ATOM 1760 CB ASP B 39 9.438 1.702 12.854 1.00 0.00 C ATOM 1761 CG ASP B 39 8.277 0.965 13.494 1.00 0.00 C ATOM 1762 OD1 ASP B 39 7.170 1.539 13.558 1.00 0.00 O ATOM 1763 OD2 ASP B 39 8.473 -0.179 13.954 1.00 0.00 O ATOM 0 H ASP B 39 11.036 2.963 11.460 1.00 0.00 H new ATOM 0 HA ASP B 39 9.675 0.527 11.068 1.00 0.00 H new ATOM 0 HB2 ASP B 39 10.373 1.322 13.266 1.00 0.00 H new ATOM 0 HB3 ASP B 39 9.379 2.758 13.117 1.00 0.00 H new ATOM 1768 N GLN B 40 7.944 3.248 10.529 1.00 0.00 N ATOM 1769 CA GLN B 40 6.698 3.804 10.015 1.00 0.00 C ATOM 1770 C GLN B 40 6.509 3.467 8.535 1.00 0.00 C ATOM 1771 O GLN B 40 5.394 3.499 8.017 1.00 0.00 O ATOM 1772 CB GLN B 40 6.720 5.320 10.217 1.00 0.00 C ATOM 1773 CG GLN B 40 5.470 6.040 9.748 1.00 0.00 C ATOM 1774 CD GLN B 40 5.611 7.543 9.863 1.00 0.00 C ATOM 1775 OE1 GLN B 40 5.275 8.131 10.889 1.00 0.00 O ATOM 1776 NE2 GLN B 40 6.123 8.170 8.817 1.00 0.00 N ATOM 0 H GLN B 40 8.666 3.946 10.707 1.00 0.00 H new ATOM 0 HA GLN B 40 5.860 3.366 10.558 1.00 0.00 H new ATOM 0 HB2 GLN B 40 6.868 5.530 11.276 1.00 0.00 H new ATOM 0 HB3 GLN B 40 7.580 5.731 9.688 1.00 0.00 H new ATOM 0 HG2 GLN B 40 5.264 5.772 8.712 1.00 0.00 H new ATOM 0 HG3 GLN B 40 4.616 5.709 10.339 1.00 0.00 H new ATOM 0 HE21 GLN B 40 6.388 7.642 7.986 1.00 0.00 H new ATOM 0 HE22 GLN B 40 6.253 9.181 8.842 1.00 0.00 H new ATOM 1785 N GLN B 41 7.601 3.127 7.868 1.00 0.00 N ATOM 1786 CA GLN B 41 7.585 2.895 6.431 1.00 0.00 C ATOM 1787 C GLN B 41 7.290 1.436 6.091 1.00 0.00 C ATOM 1788 O GLN B 41 8.035 0.537 6.480 1.00 0.00 O ATOM 1789 CB GLN B 41 8.931 3.293 5.824 1.00 0.00 C ATOM 1790 CG GLN B 41 9.176 4.789 5.787 1.00 0.00 C ATOM 1791 CD GLN B 41 10.533 5.133 5.212 1.00 0.00 C ATOM 1792 OE1 GLN B 41 10.685 5.290 4.006 1.00 0.00 O ATOM 1793 NE2 GLN B 41 11.529 5.263 6.072 1.00 0.00 N ATOM 0 H GLN B 41 8.516 3.005 8.302 1.00 0.00 H new ATOM 0 HA GLN B 41 6.787 3.508 6.011 1.00 0.00 H new ATOM 0 HB2 GLN B 41 9.729 2.819 6.395 1.00 0.00 H new ATOM 0 HB3 GLN B 41 8.990 2.901 4.809 1.00 0.00 H new ATOM 0 HG2 GLN B 41 8.399 5.268 5.191 1.00 0.00 H new ATOM 0 HG3 GLN B 41 9.098 5.193 6.796 1.00 0.00 H new ATOM 0 HE21 GLN B 41 11.363 5.124 7.069 1.00 0.00 H new ATOM 0 HE22 GLN B 41 12.463 5.502 5.738 1.00 0.00 H new ATOM 1802 N ARG B 42 6.201 1.210 5.367 1.00 0.00 N ATOM 1803 CA ARG B 42 5.895 -0.110 4.833 1.00 0.00 C ATOM 1804 C ARG B 42 5.933 -0.079 3.310 1.00 0.00 C ATOM 1805 O ARG B 42 5.060 0.511 2.669 1.00 0.00 O ATOM 1806 CB ARG B 42 4.525 -0.599 5.305 1.00 0.00 C ATOM 1807 CG ARG B 42 4.497 -1.083 6.745 1.00 0.00 C ATOM 1808 CD ARG B 42 3.137 -1.662 7.087 1.00 0.00 C ATOM 1809 NE ARG B 42 3.106 -2.307 8.398 1.00 0.00 N ATOM 1810 CZ ARG B 42 2.220 -3.249 8.732 1.00 0.00 C ATOM 1811 NH1 ARG B 42 1.383 -3.729 7.818 1.00 0.00 N ATOM 1812 NH2 ARG B 42 2.198 -3.738 9.962 1.00 0.00 N ATOM 0 H ARG B 42 5.513 1.927 5.136 1.00 0.00 H new ATOM 0 HA ARG B 42 6.650 -0.803 5.203 1.00 0.00 H new ATOM 0 HB2 ARG B 42 3.804 0.211 5.192 1.00 0.00 H new ATOM 0 HB3 ARG B 42 4.198 -1.410 4.655 1.00 0.00 H new ATOM 0 HG2 ARG B 42 5.268 -1.838 6.896 1.00 0.00 H new ATOM 0 HG3 ARG B 42 4.726 -0.256 7.417 1.00 0.00 H new ATOM 0 HD2 ARG B 42 2.392 -0.866 7.062 1.00 0.00 H new ATOM 0 HD3 ARG B 42 2.854 -2.387 6.324 1.00 0.00 H new ATOM 0 HE ARG B 42 3.796 -2.023 9.093 1.00 0.00 H new ATOM 0 HH11 ARG B 42 1.417 -3.378 6.861 1.00 0.00 H new ATOM 0 HH12 ARG B 42 0.707 -4.448 8.074 1.00 0.00 H new ATOM 0 HH21 ARG B 42 2.859 -3.395 10.659 1.00 0.00 H new ATOM 0 HH22 ARG B 42 1.520 -4.457 10.213 1.00 0.00 H new ATOM 1826 N LEU B 43 6.955 -0.696 2.738 1.00 0.00 N ATOM 1827 CA LEU B 43 7.100 -0.744 1.292 1.00 0.00 C ATOM 1828 C LEU B 43 6.330 -1.931 0.735 1.00 0.00 C ATOM 1829 O LEU B 43 6.519 -3.064 1.176 1.00 0.00 O ATOM 1830 CB LEU B 43 8.576 -0.843 0.879 1.00 0.00 C ATOM 1831 CG LEU B 43 9.455 0.371 1.212 1.00 0.00 C ATOM 1832 CD1 LEU B 43 9.831 0.393 2.687 1.00 0.00 C ATOM 1833 CD2 LEU B 43 10.705 0.373 0.344 1.00 0.00 C ATOM 0 H LEU B 43 7.696 -1.171 3.253 1.00 0.00 H new ATOM 0 HA LEU B 43 6.695 0.182 0.883 1.00 0.00 H new ATOM 0 HB2 LEU B 43 9.008 -1.721 1.359 1.00 0.00 H new ATOM 0 HB3 LEU B 43 8.620 -1.014 -0.197 1.00 0.00 H new ATOM 0 HG LEU B 43 8.879 1.272 1.001 1.00 0.00 H new ATOM 0 HD11 LEU B 43 10.453 1.264 2.891 1.00 0.00 H new ATOM 0 HD12 LEU B 43 8.926 0.444 3.292 1.00 0.00 H new ATOM 0 HD13 LEU B 43 10.383 -0.513 2.935 1.00 0.00 H new ATOM 0 HD21 LEU B 43 11.318 1.239 0.591 1.00 0.00 H new ATOM 0 HD22 LEU B 43 11.275 -0.538 0.525 1.00 0.00 H new ATOM 0 HD23 LEU B 43 10.418 0.419 -0.707 1.00 0.00 H new ATOM 1845 N ILE B 44 5.445 -1.666 -0.213 1.00 0.00 N ATOM 1846 CA ILE B 44 4.650 -2.713 -0.829 1.00 0.00 C ATOM 1847 C ILE B 44 4.928 -2.786 -2.326 1.00 0.00 C ATOM 1848 O ILE B 44 4.722 -1.811 -3.055 1.00 0.00 O ATOM 1849 CB ILE B 44 3.143 -2.477 -0.604 1.00 0.00 C ATOM 1850 CG1 ILE B 44 2.843 -2.327 0.889 1.00 0.00 C ATOM 1851 CG2 ILE B 44 2.335 -3.623 -1.195 1.00 0.00 C ATOM 1852 CD1 ILE B 44 1.400 -1.979 1.185 1.00 0.00 C ATOM 0 H ILE B 44 5.260 -0.730 -0.573 1.00 0.00 H new ATOM 0 HA ILE B 44 4.932 -3.655 -0.359 1.00 0.00 H new ATOM 0 HB ILE B 44 2.857 -1.554 -1.108 1.00 0.00 H new ATOM 0 HG12 ILE B 44 3.095 -3.258 1.397 1.00 0.00 H new ATOM 0 HG13 ILE B 44 3.487 -1.552 1.305 1.00 0.00 H new ATOM 0 HG21 ILE B 44 1.273 -3.443 -1.029 1.00 0.00 H new ATOM 0 HG22 ILE B 44 2.528 -3.690 -2.266 1.00 0.00 H new ATOM 0 HG23 ILE B 44 2.624 -4.558 -0.715 1.00 0.00 H new ATOM 0 HD11 ILE B 44 1.261 -1.889 2.262 1.00 0.00 H new ATOM 0 HD12 ILE B 44 1.148 -1.033 0.706 1.00 0.00 H new ATOM 0 HD13 ILE B 44 0.750 -2.765 0.800 1.00 0.00 H new ATOM 1864 N PHE B 45 5.406 -3.934 -2.776 1.00 0.00 N ATOM 1865 CA PHE B 45 5.681 -4.147 -4.187 1.00 0.00 C ATOM 1866 C PHE B 45 4.825 -5.287 -4.724 1.00 0.00 C ATOM 1867 O PHE B 45 4.944 -6.425 -4.269 1.00 0.00 O ATOM 1868 CB PHE B 45 7.165 -4.454 -4.403 1.00 0.00 C ATOM 1869 CG PHE B 45 7.523 -4.704 -5.842 1.00 0.00 C ATOM 1870 CD1 PHE B 45 7.571 -3.660 -6.751 1.00 0.00 C ATOM 1871 CD2 PHE B 45 7.806 -5.987 -6.285 1.00 0.00 C ATOM 1872 CE1 PHE B 45 7.895 -3.890 -8.074 1.00 0.00 C ATOM 1873 CE2 PHE B 45 8.130 -6.222 -7.606 1.00 0.00 C ATOM 1874 CZ PHE B 45 8.175 -5.172 -8.502 1.00 0.00 C ATOM 0 H PHE B 45 5.613 -4.736 -2.181 1.00 0.00 H new ATOM 0 HA PHE B 45 5.433 -3.235 -4.730 1.00 0.00 H new ATOM 0 HB2 PHE B 45 7.759 -3.620 -4.029 1.00 0.00 H new ATOM 0 HB3 PHE B 45 7.437 -5.329 -3.812 1.00 0.00 H new ATOM 0 HD1 PHE B 45 7.353 -2.655 -6.422 1.00 0.00 H new ATOM 0 HD2 PHE B 45 7.773 -6.812 -5.589 1.00 0.00 H new ATOM 0 HE1 PHE B 45 7.929 -3.067 -8.773 1.00 0.00 H new ATOM 0 HE2 PHE B 45 8.348 -7.226 -7.939 1.00 0.00 H new ATOM 0 HZ PHE B 45 8.429 -5.354 -9.536 1.00 0.00 H new ATOM 1884 N ALA B 46 3.947 -4.962 -5.675 1.00 0.00 N ATOM 1885 CA ALA B 46 3.062 -5.946 -6.309 1.00 0.00 C ATOM 1886 C ALA B 46 2.132 -6.615 -5.296 1.00 0.00 C ATOM 1887 O ALA B 46 1.579 -7.685 -5.554 1.00 0.00 O ATOM 1888 CB ALA B 46 3.880 -6.992 -7.058 1.00 0.00 C ATOM 0 H ALA B 46 3.828 -4.012 -6.028 1.00 0.00 H new ATOM 0 HA ALA B 46 2.434 -5.411 -7.021 1.00 0.00 H new ATOM 0 HB1 ALA B 46 3.209 -7.714 -7.523 1.00 0.00 H new ATOM 0 HB2 ALA B 46 4.477 -6.504 -7.828 1.00 0.00 H new ATOM 0 HB3 ALA B 46 4.540 -7.507 -6.359 1.00 0.00 H new ATOM 1894 N GLY B 47 1.951 -5.967 -4.152 1.00 0.00 N ATOM 1895 CA GLY B 47 1.089 -6.510 -3.120 1.00 0.00 C ATOM 1896 C GLY B 47 1.868 -7.244 -2.046 1.00 0.00 C ATOM 1897 O GLY B 47 1.293 -7.736 -1.073 1.00 0.00 O ATOM 0 H GLY B 47 2.386 -5.074 -3.920 1.00 0.00 H new ATOM 0 HA2 GLY B 47 0.519 -5.701 -2.663 1.00 0.00 H new ATOM 0 HA3 GLY B 47 0.369 -7.191 -3.573 1.00 0.00 H new ATOM 1901 N LYS B 48 3.180 -7.319 -2.225 1.00 0.00 N ATOM 1902 CA LYS B 48 4.048 -7.972 -1.260 1.00 0.00 C ATOM 1903 C LYS B 48 4.669 -6.945 -0.326 1.00 0.00 C ATOM 1904 O LYS B 48 5.387 -6.044 -0.766 1.00 0.00 O ATOM 1905 CB LYS B 48 5.145 -8.756 -1.981 1.00 0.00 C ATOM 1906 CG LYS B 48 4.604 -9.821 -2.922 1.00 0.00 C ATOM 1907 CD LYS B 48 5.717 -10.534 -3.675 1.00 0.00 C ATOM 1908 CE LYS B 48 6.539 -9.572 -4.524 1.00 0.00 C ATOM 1909 NZ LYS B 48 7.447 -10.300 -5.451 1.00 0.00 N ATOM 0 H LYS B 48 3.666 -6.933 -3.034 1.00 0.00 H new ATOM 0 HA LYS B 48 3.449 -8.665 -0.669 1.00 0.00 H new ATOM 0 HB2 LYS B 48 5.766 -8.062 -2.548 1.00 0.00 H new ATOM 0 HB3 LYS B 48 5.790 -9.229 -1.241 1.00 0.00 H new ATOM 0 HG2 LYS B 48 4.027 -10.549 -2.352 1.00 0.00 H new ATOM 0 HG3 LYS B 48 3.920 -9.361 -3.635 1.00 0.00 H new ATOM 0 HD2 LYS B 48 6.371 -11.039 -2.963 1.00 0.00 H new ATOM 0 HD3 LYS B 48 5.286 -11.305 -4.314 1.00 0.00 H new ATOM 0 HE2 LYS B 48 5.871 -8.930 -5.098 1.00 0.00 H new ATOM 0 HE3 LYS B 48 7.126 -8.922 -3.874 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 8.435 -10.118 -5.183 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 7.255 -11.321 -5.395 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 7.286 -9.971 -6.424 1.00 0.00 H new ATOM 1923 N GLN B 49 4.368 -7.072 0.956 1.00 0.00 N ATOM 1924 CA GLN B 49 4.924 -6.187 1.966 1.00 0.00 C ATOM 1925 C GLN B 49 6.363 -6.595 2.280 1.00 0.00 C ATOM 1926 O GLN B 49 6.640 -7.760 2.567 1.00 0.00 O ATOM 1927 CB GLN B 49 4.047 -6.223 3.220 1.00 0.00 C ATOM 1928 CG GLN B 49 4.527 -5.323 4.342 1.00 0.00 C ATOM 1929 CD GLN B 49 3.477 -5.138 5.420 1.00 0.00 C ATOM 1930 OE1 GLN B 49 2.673 -4.206 5.362 1.00 0.00 O ATOM 1931 NE2 GLN B 49 3.458 -6.034 6.395 1.00 0.00 N ATOM 0 H GLN B 49 3.737 -7.785 1.323 1.00 0.00 H new ATOM 0 HA GLN B 49 4.940 -5.164 1.591 1.00 0.00 H new ATOM 0 HB2 GLN B 49 3.032 -5.935 2.948 1.00 0.00 H new ATOM 0 HB3 GLN B 49 4.000 -7.248 3.587 1.00 0.00 H new ATOM 0 HG2 GLN B 49 5.428 -5.747 4.785 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.800 -4.350 3.933 1.00 0.00 H new ATOM 0 HE21 GLN B 49 4.142 -6.791 6.406 1.00 0.00 H new ATOM 0 HE22 GLN B 49 2.759 -5.968 7.135 1.00 0.00 H new ATOM 1940 N LEU B 50 7.271 -5.632 2.206 1.00 0.00 N ATOM 1941 CA LEU B 50 8.697 -5.910 2.332 1.00 0.00 C ATOM 1942 C LEU B 50 9.170 -5.817 3.784 1.00 0.00 C ATOM 1943 O LEU B 50 8.884 -4.841 4.482 1.00 0.00 O ATOM 1944 CB LEU B 50 9.497 -4.931 1.466 1.00 0.00 C ATOM 1945 CG LEU B 50 8.987 -4.752 0.030 1.00 0.00 C ATOM 1946 CD1 LEU B 50 9.858 -3.765 -0.730 1.00 0.00 C ATOM 1947 CD2 LEU B 50 8.934 -6.086 -0.697 1.00 0.00 C ATOM 0 H LEU B 50 7.046 -4.648 2.059 1.00 0.00 H new ATOM 0 HA LEU B 50 8.865 -6.931 1.991 1.00 0.00 H new ATOM 0 HB2 LEU B 50 9.499 -3.958 1.956 1.00 0.00 H new ATOM 0 HB3 LEU B 50 10.532 -5.270 1.426 1.00 0.00 H new ATOM 0 HG LEU B 50 7.975 -4.351 0.079 1.00 0.00 H new ATOM 0 HD11 LEU B 50 9.479 -3.653 -1.746 1.00 0.00 H new ATOM 0 HD12 LEU B 50 9.838 -2.799 -0.226 1.00 0.00 H new ATOM 0 HD13 LEU B 50 10.883 -4.135 -0.764 1.00 0.00 H new ATOM 0 HD21 LEU B 50 8.569 -5.933 -1.713 1.00 0.00 H new ATOM 0 HD22 LEU B 50 9.933 -6.521 -0.732 1.00 0.00 H new ATOM 0 HD23 LEU B 50 8.262 -6.762 -0.168 1.00 0.00 H new ATOM 1959 N GLU B 51 9.889 -6.844 4.227 1.00 0.00 N ATOM 1960 CA GLU B 51 10.488 -6.865 5.558 1.00 0.00 C ATOM 1961 C GLU B 51 11.822 -6.120 5.558 1.00 0.00 C ATOM 1962 O GLU B 51 12.536 -6.110 4.555 1.00 0.00 O ATOM 1963 CB GLU B 51 10.694 -8.317 6.013 1.00 0.00 C ATOM 1964 CG GLU B 51 11.308 -8.468 7.399 1.00 0.00 C ATOM 1965 CD GLU B 51 10.477 -7.821 8.484 1.00 0.00 C ATOM 1966 OE1 GLU B 51 10.667 -6.614 8.740 1.00 0.00 O ATOM 1967 OE2 GLU B 51 9.635 -8.512 9.087 1.00 0.00 O ATOM 0 H GLU B 51 10.073 -7.682 3.676 1.00 0.00 H new ATOM 0 HA GLU B 51 9.814 -6.364 6.253 1.00 0.00 H new ATOM 0 HB2 GLU B 51 9.731 -8.828 5.999 1.00 0.00 H new ATOM 0 HB3 GLU B 51 11.334 -8.823 5.290 1.00 0.00 H new ATOM 0 HG2 GLU B 51 11.429 -9.528 7.624 1.00 0.00 H new ATOM 0 HG3 GLU B 51 12.305 -8.026 7.400 1.00 0.00 H new ATOM 1974 N ASP B 52 12.156 -5.526 6.698 1.00 0.00 N ATOM 1975 CA ASP B 52 13.379 -4.734 6.851 1.00 0.00 C ATOM 1976 C ASP B 52 14.627 -5.575 6.599 1.00 0.00 C ATOM 1977 O ASP B 52 15.551 -5.145 5.907 1.00 0.00 O ATOM 1978 CB ASP B 52 13.465 -4.137 8.264 1.00 0.00 C ATOM 1979 CG ASP B 52 12.577 -2.924 8.464 1.00 0.00 C ATOM 1980 OD1 ASP B 52 11.362 -3.091 8.697 1.00 0.00 O ATOM 1981 OD2 ASP B 52 13.091 -1.788 8.402 1.00 0.00 O ATOM 0 H ASP B 52 11.589 -5.578 7.544 1.00 0.00 H new ATOM 0 HA ASP B 52 13.335 -3.934 6.112 1.00 0.00 H new ATOM 0 HB2 ASP B 52 13.190 -4.902 8.990 1.00 0.00 H new ATOM 0 HB3 ASP B 52 14.499 -3.859 8.470 1.00 0.00 H new ATOM 1986 N GLY B 53 14.636 -6.782 7.151 1.00 0.00 N ATOM 1987 CA GLY B 53 15.831 -7.609 7.128 1.00 0.00 C ATOM 1988 C GLY B 53 16.075 -8.305 5.805 1.00 0.00 C ATOM 1989 O GLY B 53 17.062 -9.025 5.657 1.00 0.00 O ATOM 0 H GLY B 53 13.834 -7.206 7.617 1.00 0.00 H new ATOM 0 HA2 GLY B 53 16.695 -6.988 7.364 1.00 0.00 H new ATOM 0 HA3 GLY B 53 15.755 -8.361 7.913 1.00 0.00 H new ATOM 1993 N ARG B 54 15.192 -8.101 4.843 1.00 0.00 N ATOM 1994 CA ARG B 54 15.355 -8.716 3.537 1.00 0.00 C ATOM 1995 C ARG B 54 15.797 -7.678 2.517 1.00 0.00 C ATOM 1996 O ARG B 54 15.626 -6.482 2.732 1.00 0.00 O ATOM 1997 CB ARG B 54 14.060 -9.391 3.085 1.00 0.00 C ATOM 1998 CG ARG B 54 13.641 -10.553 3.968 1.00 0.00 C ATOM 1999 CD ARG B 54 12.492 -11.328 3.349 1.00 0.00 C ATOM 2000 NE ARG B 54 12.021 -12.404 4.214 1.00 0.00 N ATOM 2001 CZ ARG B 54 11.595 -13.586 3.772 1.00 0.00 C ATOM 2002 NH1 ARG B 54 11.595 -13.853 2.468 1.00 0.00 N ATOM 2003 NH2 ARG B 54 11.162 -14.495 4.633 1.00 0.00 N ATOM 0 H ARG B 54 14.360 -7.519 4.940 1.00 0.00 H new ATOM 0 HA ARG B 54 16.126 -9.482 3.615 1.00 0.00 H new ATOM 0 HB2 ARG B 54 13.260 -8.651 3.069 1.00 0.00 H new ATOM 0 HB3 ARG B 54 14.184 -9.748 2.063 1.00 0.00 H new ATOM 0 HG2 ARG B 54 14.490 -11.219 4.124 1.00 0.00 H new ATOM 0 HG3 ARG B 54 13.345 -10.180 4.948 1.00 0.00 H new ATOM 0 HD2 ARG B 54 11.668 -10.646 3.139 1.00 0.00 H new ATOM 0 HD3 ARG B 54 12.811 -11.746 2.394 1.00 0.00 H new ATOM 0 HE ARG B 54 12.018 -12.241 5.221 1.00 0.00 H new ATOM 0 HH11 ARG B 54 11.922 -13.151 1.804 1.00 0.00 H new ATOM 0 HH12 ARG B 54 11.268 -14.759 2.133 1.00 0.00 H new ATOM 0 HH21 ARG B 54 11.155 -14.289 5.632 1.00 0.00 H new ATOM 0 HH22 ARG B 54 10.835 -15.401 4.297 1.00 0.00 H new ATOM 2017 N THR B 55 16.374 -8.141 1.421 1.00 0.00 N ATOM 2018 CA THR B 55 16.875 -7.253 0.384 1.00 0.00 C ATOM 2019 C THR B 55 15.866 -7.114 -0.752 1.00 0.00 C ATOM 2020 O THR B 55 14.807 -7.748 -0.737 1.00 0.00 O ATOM 2021 CB THR B 55 18.206 -7.773 -0.201 1.00 0.00 C ATOM 2022 OG1 THR B 55 17.988 -9.007 -0.903 1.00 0.00 O ATOM 2023 CG2 THR B 55 19.236 -7.989 0.896 1.00 0.00 C ATOM 0 H THR B 55 16.508 -9.133 1.225 1.00 0.00 H new ATOM 0 HA THR B 55 17.038 -6.281 0.850 1.00 0.00 H new ATOM 0 HB THR B 55 18.586 -7.021 -0.893 1.00 0.00 H new ATOM 0 HG1 THR B 55 17.794 -9.720 -0.259 1.00 0.00 H new ATOM 0 HG21 THR B 55 20.164 -8.355 0.457 1.00 0.00 H new ATOM 0 HG22 THR B 55 19.425 -7.046 1.409 1.00 0.00 H new ATOM 0 HG23 THR B 55 18.859 -8.721 1.610 1.00 0.00 H new ATOM 2031 N LEU B 56 16.205 -6.293 -1.744 1.00 0.00 N ATOM 2032 CA LEU B 56 15.396 -6.180 -2.955 1.00 0.00 C ATOM 2033 C LEU B 56 15.364 -7.516 -3.694 1.00 0.00 C ATOM 2034 O LEU B 56 14.407 -7.826 -4.404 1.00 0.00 O ATOM 2035 CB LEU B 56 15.944 -5.095 -3.898 1.00 0.00 C ATOM 2036 CG LEU B 56 15.652 -3.636 -3.517 1.00 0.00 C ATOM 2037 CD1 LEU B 56 14.170 -3.430 -3.243 1.00 0.00 C ATOM 2038 CD2 LEU B 56 16.487 -3.199 -2.325 1.00 0.00 C ATOM 0 H LEU B 56 17.033 -5.697 -1.733 1.00 0.00 H new ATOM 0 HA LEU B 56 14.387 -5.900 -2.651 1.00 0.00 H new ATOM 0 HB2 LEU B 56 17.025 -5.219 -3.967 1.00 0.00 H new ATOM 0 HB3 LEU B 56 15.539 -5.274 -4.894 1.00 0.00 H new ATOM 0 HG LEU B 56 15.930 -3.012 -4.366 1.00 0.00 H new ATOM 0 HD11 LEU B 56 13.991 -2.389 -2.975 1.00 0.00 H new ATOM 0 HD12 LEU B 56 13.597 -3.679 -4.136 1.00 0.00 H new ATOM 0 HD13 LEU B 56 13.859 -4.074 -2.421 1.00 0.00 H new ATOM 0 HD21 LEU B 56 16.257 -2.162 -2.080 1.00 0.00 H new ATOM 0 HD22 LEU B 56 16.258 -3.833 -1.468 1.00 0.00 H new ATOM 0 HD23 LEU B 56 17.545 -3.288 -2.570 1.00 0.00 H new ATOM 2050 N SER B 57 16.413 -8.307 -3.514 1.00 0.00 N ATOM 2051 CA SER B 57 16.540 -9.581 -4.202 1.00 0.00 C ATOM 2052 C SER B 57 15.656 -10.645 -3.554 1.00 0.00 C ATOM 2053 O SER B 57 15.140 -11.530 -4.239 1.00 0.00 O ATOM 2054 CB SER B 57 18.003 -10.033 -4.201 1.00 0.00 C ATOM 2055 OG SER B 57 18.176 -11.235 -4.936 1.00 0.00 O ATOM 0 H SER B 57 17.192 -8.086 -2.893 1.00 0.00 H new ATOM 0 HA SER B 57 16.208 -9.449 -5.232 1.00 0.00 H new ATOM 0 HB2 SER B 57 18.627 -9.250 -4.630 1.00 0.00 H new ATOM 0 HB3 SER B 57 18.339 -10.181 -3.175 1.00 0.00 H new ATOM 0 HG SER B 57 19.120 -11.496 -4.918 1.00 0.00 H new ATOM 2061 N ASP B 58 15.459 -10.537 -2.242 1.00 0.00 N ATOM 2062 CA ASP B 58 14.668 -11.521 -1.496 1.00 0.00 C ATOM 2063 C ASP B 58 13.215 -11.527 -1.954 1.00 0.00 C ATOM 2064 O ASP B 58 12.523 -12.539 -1.850 1.00 0.00 O ATOM 2065 CB ASP B 58 14.727 -11.247 0.009 1.00 0.00 C ATOM 2066 CG ASP B 58 16.071 -11.583 0.616 1.00 0.00 C ATOM 2067 OD1 ASP B 58 16.288 -12.756 0.972 1.00 0.00 O ATOM 2068 OD2 ASP B 58 16.912 -10.671 0.749 1.00 0.00 O ATOM 0 H ASP B 58 15.835 -9.780 -1.671 1.00 0.00 H new ATOM 0 HA ASP B 58 15.103 -12.500 -1.697 1.00 0.00 H new ATOM 0 HB2 ASP B 58 14.505 -10.196 0.191 1.00 0.00 H new ATOM 0 HB3 ASP B 58 13.952 -11.828 0.510 1.00 0.00 H new ATOM 2073 N TYR B 59 12.754 -10.392 -2.454 1.00 0.00 N ATOM 2074 CA TYR B 59 11.392 -10.286 -2.955 1.00 0.00 C ATOM 2075 C TYR B 59 11.380 -10.212 -4.472 1.00 0.00 C ATOM 2076 O TYR B 59 10.320 -10.055 -5.081 1.00 0.00 O ATOM 2077 CB TYR B 59 10.695 -9.063 -2.362 1.00 0.00 C ATOM 2078 CG TYR B 59 10.433 -9.181 -0.881 1.00 0.00 C ATOM 2079 CD1 TYR B 59 9.297 -9.826 -0.410 1.00 0.00 C ATOM 2080 CD2 TYR B 59 11.317 -8.646 0.047 1.00 0.00 C ATOM 2081 CE1 TYR B 59 9.049 -9.935 0.944 1.00 0.00 C ATOM 2082 CE2 TYR B 59 11.076 -8.752 1.401 1.00 0.00 C ATOM 2083 CZ TYR B 59 9.942 -9.396 1.844 1.00 0.00 C ATOM 2084 OH TYR B 59 9.705 -9.503 3.193 1.00 0.00 O ATOM 0 H TYR B 59 13.300 -9.533 -2.524 1.00 0.00 H new ATOM 0 HA TYR B 59 10.849 -11.180 -2.648 1.00 0.00 H new ATOM 0 HB2 TYR B 59 11.308 -8.180 -2.546 1.00 0.00 H new ATOM 0 HB3 TYR B 59 9.748 -8.907 -2.879 1.00 0.00 H new ATOM 0 HD1 TYR B 59 8.596 -10.249 -1.114 1.00 0.00 H new ATOM 0 HD2 TYR B 59 12.207 -8.139 -0.297 1.00 0.00 H new ATOM 0 HE1 TYR B 59 8.161 -10.439 1.295 1.00 0.00 H new ATOM 0 HE2 TYR B 59 11.773 -8.332 2.111 1.00 0.00 H new ATOM 0 HH TYR B 59 9.202 -10.324 3.373 1.00 0.00 H new ATOM 2094 N ASN B 60 12.565 -10.343 -5.068 1.00 0.00 N ATOM 2095 CA ASN B 60 12.723 -10.304 -6.521 1.00 0.00 C ATOM 2096 C ASN B 60 12.149 -9.008 -7.098 1.00 0.00 C ATOM 2097 O ASN B 60 11.118 -9.002 -7.772 1.00 0.00 O ATOM 2098 CB ASN B 60 12.065 -11.534 -7.156 1.00 0.00 C ATOM 2099 CG ASN B 60 12.195 -11.573 -8.666 1.00 0.00 C ATOM 2100 OD1 ASN B 60 13.175 -11.088 -9.239 1.00 0.00 O ATOM 2101 ND2 ASN B 60 11.198 -12.147 -9.318 1.00 0.00 N ATOM 0 H ASN B 60 13.439 -10.479 -4.559 1.00 0.00 H new ATOM 0 HA ASN B 60 13.787 -10.325 -6.757 1.00 0.00 H new ATOM 0 HB2 ASN B 60 12.514 -12.434 -6.737 1.00 0.00 H new ATOM 0 HB3 ASN B 60 11.008 -11.550 -6.889 1.00 0.00 H new ATOM 0 HD21 ASN B 60 11.219 -12.202 -10.336 1.00 0.00 H new ATOM 0 HD22 ASN B 60 10.408 -12.535 -8.803 1.00 0.00 H new ATOM 2108 N ILE B 61 12.806 -7.903 -6.787 1.00 0.00 N ATOM 2109 CA ILE B 61 12.384 -6.600 -7.272 1.00 0.00 C ATOM 2110 C ILE B 61 13.400 -6.052 -8.266 1.00 0.00 C ATOM 2111 O ILE B 61 14.538 -5.749 -7.898 1.00 0.00 O ATOM 2112 CB ILE B 61 12.208 -5.604 -6.105 1.00 0.00 C ATOM 2113 CG1 ILE B 61 11.222 -6.168 -5.079 1.00 0.00 C ATOM 2114 CG2 ILE B 61 11.735 -4.247 -6.619 1.00 0.00 C ATOM 2115 CD1 ILE B 61 11.061 -5.306 -3.847 1.00 0.00 C ATOM 0 H ILE B 61 13.638 -7.883 -6.198 1.00 0.00 H new ATOM 0 HA ILE B 61 11.422 -6.723 -7.770 1.00 0.00 H new ATOM 0 HB ILE B 61 13.174 -5.461 -5.620 1.00 0.00 H new ATOM 0 HG12 ILE B 61 10.249 -6.291 -5.554 1.00 0.00 H new ATOM 0 HG13 ILE B 61 11.556 -7.160 -4.775 1.00 0.00 H new ATOM 0 HG21 ILE B 61 11.618 -3.561 -5.780 1.00 0.00 H new ATOM 0 HG22 ILE B 61 12.471 -3.845 -7.316 1.00 0.00 H new ATOM 0 HG23 ILE B 61 10.779 -4.364 -7.128 1.00 0.00 H new ATOM 0 HD11 ILE B 61 10.347 -5.772 -3.168 1.00 0.00 H new ATOM 0 HD12 ILE B 61 12.024 -5.203 -3.347 1.00 0.00 H new ATOM 0 HD13 ILE B 61 10.696 -4.321 -4.137 1.00 0.00 H new ATOM 2127 N GLN B 62 12.996 -5.948 -9.525 1.00 0.00 N ATOM 2128 CA GLN B 62 13.879 -5.438 -10.566 1.00 0.00 C ATOM 2129 C GLN B 62 13.961 -3.913 -10.505 1.00 0.00 C ATOM 2130 O GLN B 62 13.086 -3.252 -9.936 1.00 0.00 O ATOM 2131 CB GLN B 62 13.405 -5.895 -11.949 1.00 0.00 C ATOM 2132 CG GLN B 62 12.060 -5.319 -12.364 1.00 0.00 C ATOM 2133 CD GLN B 62 11.568 -5.872 -13.689 1.00 0.00 C ATOM 2134 OE1 GLN B 62 12.357 -6.243 -14.556 1.00 0.00 O ATOM 2135 NE2 GLN B 62 10.260 -5.927 -13.855 1.00 0.00 N ATOM 0 H GLN B 62 12.065 -6.209 -9.850 1.00 0.00 H new ATOM 0 HA GLN B 62 14.876 -5.842 -10.394 1.00 0.00 H new ATOM 0 HB2 GLN B 62 14.153 -5.613 -12.690 1.00 0.00 H new ATOM 0 HB3 GLN B 62 13.341 -6.983 -11.959 1.00 0.00 H new ATOM 0 HG2 GLN B 62 11.323 -5.534 -11.590 1.00 0.00 H new ATOM 0 HG3 GLN B 62 12.141 -4.234 -12.435 1.00 0.00 H new ATOM 0 HE21 GLN B 62 9.638 -5.610 -13.112 1.00 0.00 H new ATOM 0 HE22 GLN B 62 9.871 -6.287 -14.727 1.00 0.00 H new ATOM 2144 N LYS B 63 15.015 -3.363 -11.090 1.00 0.00 N ATOM 2145 CA LYS B 63 15.246 -1.925 -11.068 1.00 0.00 C ATOM 2146 C LYS B 63 14.211 -1.179 -11.900 1.00 0.00 C ATOM 2147 O LYS B 63 13.537 -1.769 -12.747 1.00 0.00 O ATOM 2148 CB LYS B 63 16.649 -1.599 -11.586 1.00 0.00 C ATOM 2149 CG LYS B 63 16.877 -1.986 -13.040 1.00 0.00 C ATOM 2150 CD LYS B 63 18.264 -1.584 -13.510 1.00 0.00 C ATOM 2151 CE LYS B 63 19.356 -2.353 -12.780 1.00 0.00 C ATOM 2152 NZ LYS B 63 19.260 -3.819 -13.014 1.00 0.00 N ATOM 0 H LYS B 63 15.728 -3.894 -11.589 1.00 0.00 H new ATOM 0 HA LYS B 63 15.156 -1.598 -10.032 1.00 0.00 H new ATOM 0 HB2 LYS B 63 16.828 -0.530 -11.473 1.00 0.00 H new ATOM 0 HB3 LYS B 63 17.383 -2.112 -10.965 1.00 0.00 H new ATOM 0 HG2 LYS B 63 16.750 -3.062 -13.156 1.00 0.00 H new ATOM 0 HG3 LYS B 63 16.126 -1.507 -13.668 1.00 0.00 H new ATOM 0 HD2 LYS B 63 18.350 -1.762 -14.582 1.00 0.00 H new ATOM 0 HD3 LYS B 63 18.405 -0.515 -13.352 1.00 0.00 H new ATOM 0 HE2 LYS B 63 20.332 -1.997 -13.110 1.00 0.00 H new ATOM 0 HE3 LYS B 63 19.288 -2.152 -11.711 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 20.140 -4.278 -12.705 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 18.460 -4.205 -12.474 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 19.113 -4.000 -14.028 1.00 0.00 H new ATOM 2166 N GLU B 64 14.098 0.122 -11.640 1.00 0.00 N ATOM 2167 CA GLU B 64 13.194 1.000 -12.376 1.00 0.00 C ATOM 2168 C GLU B 64 11.746 0.540 -12.252 1.00 0.00 C ATOM 2169 O GLU B 64 10.936 0.721 -13.162 1.00 0.00 O ATOM 2170 CB GLU B 64 13.631 1.098 -13.839 1.00 0.00 C ATOM 2171 CG GLU B 64 14.977 1.789 -14.003 1.00 0.00 C ATOM 2172 CD GLU B 64 15.496 1.753 -15.422 1.00 0.00 C ATOM 2173 OE1 GLU B 64 14.950 2.481 -16.279 1.00 0.00 O ATOM 2174 OE2 GLU B 64 16.463 1.014 -15.684 1.00 0.00 O ATOM 0 H GLU B 64 14.632 0.597 -10.912 1.00 0.00 H new ATOM 0 HA GLU B 64 13.247 1.996 -11.936 1.00 0.00 H new ATOM 0 HB2 GLU B 64 13.687 0.096 -14.266 1.00 0.00 H new ATOM 0 HB3 GLU B 64 12.875 1.644 -14.404 1.00 0.00 H new ATOM 0 HG2 GLU B 64 14.887 2.827 -13.682 1.00 0.00 H new ATOM 0 HG3 GLU B 64 15.705 1.314 -13.345 1.00 0.00 H new ATOM 2181 N SER B 65 11.428 -0.038 -11.104 1.00 0.00 N ATOM 2182 CA SER B 65 10.062 -0.434 -10.797 1.00 0.00 C ATOM 2183 C SER B 65 9.433 0.573 -9.843 1.00 0.00 C ATOM 2184 O SER B 65 10.139 1.385 -9.237 1.00 0.00 O ATOM 2185 CB SER B 65 10.044 -1.829 -10.181 1.00 0.00 C ATOM 2186 OG SER B 65 10.644 -2.772 -11.052 1.00 0.00 O ATOM 0 H SER B 65 12.101 -0.244 -10.366 1.00 0.00 H new ATOM 0 HA SER B 65 9.483 -0.455 -11.720 1.00 0.00 H new ATOM 0 HB2 SER B 65 10.575 -1.818 -9.229 1.00 0.00 H new ATOM 0 HB3 SER B 65 9.016 -2.125 -9.970 1.00 0.00 H new ATOM 0 HG SER B 65 11.496 -3.073 -10.672 1.00 0.00 H new ATOM 2192 N THR B 66 8.118 0.520 -9.707 1.00 0.00 N ATOM 2193 CA THR B 66 7.402 1.445 -8.847 1.00 0.00 C ATOM 2194 C THR B 66 6.907 0.742 -7.583 1.00 0.00 C ATOM 2195 O THR B 66 6.011 -0.106 -7.634 1.00 0.00 O ATOM 2196 CB THR B 66 6.207 2.075 -9.587 1.00 0.00 C ATOM 2197 OG1 THR B 66 6.646 2.590 -10.852 1.00 0.00 O ATOM 2198 CG2 THR B 66 5.584 3.201 -8.768 1.00 0.00 C ATOM 0 H THR B 66 7.523 -0.158 -10.184 1.00 0.00 H new ATOM 0 HA THR B 66 8.098 2.235 -8.565 1.00 0.00 H new ATOM 0 HB THR B 66 5.452 1.304 -9.739 1.00 0.00 H new ATOM 0 HG1 THR B 66 5.886 2.989 -11.324 1.00 0.00 H new ATOM 0 HG21 THR B 66 4.743 3.627 -9.315 1.00 0.00 H new ATOM 0 HG22 THR B 66 5.234 2.806 -7.814 1.00 0.00 H new ATOM 0 HG23 THR B 66 6.329 3.976 -8.588 1.00 0.00 H new ATOM 2206 N LEU B 67 7.506 1.086 -6.456 1.00 0.00 N ATOM 2207 CA LEU B 67 7.105 0.529 -5.176 1.00 0.00 C ATOM 2208 C LEU B 67 6.232 1.528 -4.435 1.00 0.00 C ATOM 2209 O LEU B 67 6.503 2.724 -4.451 1.00 0.00 O ATOM 2210 CB LEU B 67 8.324 0.168 -4.318 1.00 0.00 C ATOM 2211 CG LEU B 67 9.162 -1.019 -4.808 1.00 0.00 C ATOM 2212 CD1 LEU B 67 9.991 -0.652 -6.030 1.00 0.00 C ATOM 2213 CD2 LEU B 67 10.060 -1.522 -3.694 1.00 0.00 C ATOM 0 H LEU B 67 8.276 1.752 -6.402 1.00 0.00 H new ATOM 0 HA LEU B 67 6.542 -0.385 -5.364 1.00 0.00 H new ATOM 0 HB2 LEU B 67 8.971 1.043 -4.255 1.00 0.00 H new ATOM 0 HB3 LEU B 67 7.980 -0.048 -3.306 1.00 0.00 H new ATOM 0 HG LEU B 67 8.476 -1.814 -5.100 1.00 0.00 H new ATOM 0 HD11 LEU B 67 10.572 -1.517 -6.349 1.00 0.00 H new ATOM 0 HD12 LEU B 67 9.329 -0.341 -6.838 1.00 0.00 H new ATOM 0 HD13 LEU B 67 10.667 0.166 -5.779 1.00 0.00 H new ATOM 0 HD21 LEU B 67 10.650 -2.365 -4.055 1.00 0.00 H new ATOM 0 HD22 LEU B 67 10.728 -0.722 -3.376 1.00 0.00 H new ATOM 0 HD23 LEU B 67 9.449 -1.842 -2.850 1.00 0.00 H new ATOM 2225 N HIS B 68 5.182 1.045 -3.799 1.00 0.00 N ATOM 2226 CA HIS B 68 4.275 1.918 -3.069 1.00 0.00 C ATOM 2227 C HIS B 68 4.654 1.946 -1.597 1.00 0.00 C ATOM 2228 O HIS B 68 4.736 0.904 -0.948 1.00 0.00 O ATOM 2229 CB HIS B 68 2.821 1.460 -3.238 1.00 0.00 C ATOM 2230 CG HIS B 68 2.353 1.464 -4.662 1.00 0.00 C ATOM 2231 ND1 HIS B 68 1.539 2.442 -5.189 1.00 0.00 N ATOM 2232 CD2 HIS B 68 2.598 0.598 -5.676 1.00 0.00 C ATOM 2233 CE1 HIS B 68 1.305 2.179 -6.461 1.00 0.00 C ATOM 2234 NE2 HIS B 68 1.938 1.067 -6.783 1.00 0.00 N ATOM 0 H HIS B 68 4.934 0.056 -3.771 1.00 0.00 H new ATOM 0 HA HIS B 68 4.361 2.925 -3.477 1.00 0.00 H new ATOM 0 HB2 HIS B 68 2.716 0.454 -2.833 1.00 0.00 H new ATOM 0 HB3 HIS B 68 2.173 2.110 -2.649 1.00 0.00 H new ATOM 0 HD1 HIS B 68 1.174 3.245 -4.676 1.00 0.00 H new ATOM 0 HD2 HIS B 68 3.201 -0.296 -5.622 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.697 2.774 -7.127 1.00 0.00 H new ATOM 2243 N LEU B 69 4.901 3.138 -1.081 1.00 0.00 N ATOM 2244 CA LEU B 69 5.316 3.297 0.299 1.00 0.00 C ATOM 2245 C LEU B 69 4.148 3.780 1.151 1.00 0.00 C ATOM 2246 O LEU B 69 3.784 4.959 1.128 1.00 0.00 O ATOM 2247 CB LEU B 69 6.496 4.272 0.389 1.00 0.00 C ATOM 2248 CG LEU B 69 7.058 4.500 1.795 1.00 0.00 C ATOM 2249 CD1 LEU B 69 7.432 3.179 2.445 1.00 0.00 C ATOM 2250 CD2 LEU B 69 8.265 5.424 1.740 1.00 0.00 C ATOM 0 H LEU B 69 4.820 4.012 -1.601 1.00 0.00 H new ATOM 0 HA LEU B 69 5.641 2.330 0.682 1.00 0.00 H new ATOM 0 HB2 LEU B 69 7.299 3.903 -0.249 1.00 0.00 H new ATOM 0 HB3 LEU B 69 6.182 5.233 -0.018 1.00 0.00 H new ATOM 0 HG LEU B 69 6.285 4.973 2.400 1.00 0.00 H new ATOM 0 HD11 LEU B 69 7.829 3.364 3.443 1.00 0.00 H new ATOM 0 HD12 LEU B 69 6.548 2.546 2.518 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.188 2.677 1.841 1.00 0.00 H new ATOM 0 HD21 LEU B 69 8.653 5.576 2.747 1.00 0.00 H new ATOM 0 HD22 LEU B 69 9.039 4.975 1.117 1.00 0.00 H new ATOM 0 HD23 LEU B 69 7.969 6.384 1.316 1.00 0.00 H new ATOM 2262 N VAL B 70 3.553 2.855 1.881 1.00 0.00 N ATOM 2263 CA VAL B 70 2.434 3.164 2.753 1.00 0.00 C ATOM 2264 C VAL B 70 2.930 3.325 4.181 1.00 0.00 C ATOM 2265 O VAL B 70 3.631 2.459 4.704 1.00 0.00 O ATOM 2266 CB VAL B 70 1.356 2.062 2.692 1.00 0.00 C ATOM 2267 CG1 VAL B 70 0.153 2.437 3.544 1.00 0.00 C ATOM 2268 CG2 VAL B 70 0.935 1.816 1.251 1.00 0.00 C ATOM 0 H VAL B 70 3.829 1.873 1.887 1.00 0.00 H new ATOM 0 HA VAL B 70 1.982 4.096 2.413 1.00 0.00 H new ATOM 0 HB VAL B 70 1.781 1.142 3.092 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -0.595 1.646 3.486 1.00 0.00 H new ATOM 0 HG12 VAL B 70 0.467 2.565 4.580 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -0.276 3.369 3.177 1.00 0.00 H new ATOM 0 HG21 VAL B 70 0.174 1.036 1.222 1.00 0.00 H new ATOM 0 HG22 VAL B 70 0.529 2.735 0.829 1.00 0.00 H new ATOM 0 HG23 VAL B 70 1.800 1.500 0.668 1.00 0.00 H new ATOM 2278 N LEU B 71 2.592 4.443 4.796 1.00 0.00 N ATOM 2279 CA LEU B 71 3.071 4.742 6.132 1.00 0.00 C ATOM 2280 C LEU B 71 2.126 4.168 7.178 1.00 0.00 C ATOM 2281 O LEU B 71 0.935 3.992 6.925 1.00 0.00 O ATOM 2282 CB LEU B 71 3.222 6.261 6.335 1.00 0.00 C ATOM 2283 CG LEU B 71 4.336 6.943 5.528 1.00 0.00 C ATOM 2284 CD1 LEU B 71 5.649 6.190 5.678 1.00 0.00 C ATOM 2285 CD2 LEU B 71 3.953 7.078 4.058 1.00 0.00 C ATOM 0 H LEU B 71 1.988 5.159 4.392 1.00 0.00 H new ATOM 0 HA LEU B 71 4.051 4.279 6.249 1.00 0.00 H new ATOM 0 HB2 LEU B 71 2.275 6.737 6.082 1.00 0.00 H new ATOM 0 HB3 LEU B 71 3.401 6.450 7.394 1.00 0.00 H new ATOM 0 HG LEU B 71 4.470 7.948 5.929 1.00 0.00 H new ATOM 0 HD11 LEU B 71 6.424 6.691 5.098 1.00 0.00 H new ATOM 0 HD12 LEU B 71 5.939 6.169 6.729 1.00 0.00 H new ATOM 0 HD13 LEU B 71 5.527 5.169 5.315 1.00 0.00 H new ATOM 0 HD21 LEU B 71 4.763 7.565 3.514 1.00 0.00 H new ATOM 0 HD22 LEU B 71 3.776 6.089 3.636 1.00 0.00 H new ATOM 0 HD23 LEU B 71 3.047 7.677 3.972 1.00 0.00 H new ATOM 2297 N ARG B 72 2.669 3.848 8.343 1.00 0.00 N ATOM 2298 CA ARG B 72 1.857 3.400 9.465 1.00 0.00 C ATOM 2299 C ARG B 72 1.063 4.567 10.028 1.00 0.00 C ATOM 2300 O ARG B 72 1.249 5.714 9.620 1.00 0.00 O ATOM 2301 CB ARG B 72 2.728 2.816 10.582 1.00 0.00 C ATOM 2302 CG ARG B 72 3.543 1.600 10.183 1.00 0.00 C ATOM 2303 CD ARG B 72 4.267 1.015 11.387 1.00 0.00 C ATOM 2304 NE ARG B 72 3.334 0.471 12.372 1.00 0.00 N ATOM 2305 CZ ARG B 72 3.676 0.092 13.604 1.00 0.00 C ATOM 2306 NH1 ARG B 72 4.914 0.268 14.050 1.00 0.00 N ATOM 2307 NH2 ARG B 72 2.766 -0.449 14.402 1.00 0.00 N ATOM 0 H ARG B 72 3.670 3.890 8.536 1.00 0.00 H new ATOM 0 HA ARG B 72 1.184 2.625 9.098 1.00 0.00 H new ATOM 0 HB2 ARG B 72 3.408 3.591 10.937 1.00 0.00 H new ATOM 0 HB3 ARG B 72 2.086 2.547 11.421 1.00 0.00 H new ATOM 0 HG2 ARG B 72 2.889 0.846 9.745 1.00 0.00 H new ATOM 0 HG3 ARG B 72 4.267 1.878 9.417 1.00 0.00 H new ATOM 0 HD2 ARG B 72 4.945 0.228 11.056 1.00 0.00 H new ATOM 0 HD3 ARG B 72 4.878 1.787 11.854 1.00 0.00 H new ATOM 0 HE ARG B 72 2.356 0.375 12.099 1.00 0.00 H new ATOM 0 HH11 ARG B 72 5.617 0.698 13.448 1.00 0.00 H new ATOM 0 HH12 ARG B 72 5.163 -0.026 14.994 1.00 0.00 H new ATOM 0 HH21 ARG B 72 1.809 -0.574 14.073 1.00 0.00 H new ATOM 0 HH22 ARG B 72 3.023 -0.740 15.345 1.00 0.00 H new ATOM 2321 N LEU B 73 0.219 4.281 11.006 1.00 0.00 N ATOM 2322 CA LEU B 73 -0.528 5.326 11.691 1.00 0.00 C ATOM 2323 C LEU B 73 0.337 5.938 12.788 1.00 0.00 C ATOM 2324 O LEU B 73 -0.160 6.531 13.743 1.00 0.00 O ATOM 2325 CB LEU B 73 -1.822 4.756 12.275 1.00 0.00 C ATOM 2326 CG LEU B 73 -2.765 4.127 11.246 1.00 0.00 C ATOM 2327 CD1 LEU B 73 -4.001 3.569 11.928 1.00 0.00 C ATOM 2328 CD2 LEU B 73 -3.154 5.144 10.181 1.00 0.00 C ATOM 0 H LEU B 73 0.034 3.337 11.344 1.00 0.00 H new ATOM 0 HA LEU B 73 -0.793 6.106 10.977 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -1.567 4.004 13.022 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -2.353 5.554 12.794 1.00 0.00 H new ATOM 0 HG LEU B 73 -2.241 3.305 10.758 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -4.660 3.126 11.181 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -3.706 2.807 12.649 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -4.526 4.373 12.444 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -3.824 4.677 9.459 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -3.658 5.988 10.651 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -2.258 5.496 9.669 1.00 0.00 H new ATOM 2340 N ARG B 74 1.644 5.782 12.618 1.00 0.00 N ATOM 2341 CA ARG B 74 2.633 6.319 13.539 1.00 0.00 C ATOM 2342 C ARG B 74 2.714 7.835 13.389 1.00 0.00 C ATOM 2343 O ARG B 74 2.949 8.558 14.354 1.00 0.00 O ATOM 2344 CB ARG B 74 3.991 5.674 13.238 1.00 0.00 C ATOM 2345 CG ARG B 74 5.129 6.112 14.148 1.00 0.00 C ATOM 2346 CD ARG B 74 4.867 5.749 15.598 1.00 0.00 C ATOM 2347 NE ARG B 74 6.099 5.729 16.379 1.00 0.00 N ATOM 2348 CZ ARG B 74 6.464 6.684 17.232 1.00 0.00 C ATOM 2349 NH1 ARG B 74 5.700 7.755 17.397 1.00 0.00 N ATOM 2350 NH2 ARG B 74 7.593 6.568 17.917 1.00 0.00 N ATOM 0 H ARG B 74 2.049 5.275 11.831 1.00 0.00 H new ATOM 0 HA ARG B 74 2.347 6.093 14.566 1.00 0.00 H new ATOM 0 HB2 ARG B 74 3.885 4.591 13.309 1.00 0.00 H new ATOM 0 HB3 ARG B 74 4.263 5.901 12.207 1.00 0.00 H new ATOM 0 HG2 ARG B 74 6.057 5.645 13.819 1.00 0.00 H new ATOM 0 HG3 ARG B 74 5.267 7.190 14.063 1.00 0.00 H new ATOM 0 HD2 ARG B 74 4.172 6.467 16.033 1.00 0.00 H new ATOM 0 HD3 ARG B 74 4.388 4.771 15.648 1.00 0.00 H new ATOM 0 HE ARG B 74 6.722 4.930 16.264 1.00 0.00 H new ATOM 0 HH11 ARG B 74 4.832 7.848 16.870 1.00 0.00 H new ATOM 0 HH12 ARG B 74 5.981 8.486 18.051 1.00 0.00 H new ATOM 0 HH21 ARG B 74 8.184 5.746 17.791 1.00 0.00 H new ATOM 0 HH22 ARG B 74 7.871 7.301 18.570 1.00 0.00 H new ATOM 2364 N GLY B 75 2.493 8.304 12.170 1.00 0.00 N ATOM 2365 CA GLY B 75 2.539 9.726 11.900 1.00 0.00 C ATOM 2366 C GLY B 75 1.157 10.338 11.854 1.00 0.00 C ATOM 2367 O GLY B 75 0.901 11.259 11.077 1.00 0.00 O ATOM 0 H GLY B 75 2.282 7.722 11.359 1.00 0.00 H new ATOM 0 HA2 GLY B 75 3.130 10.222 12.670 1.00 0.00 H new ATOM 0 HA3 GLY B 75 3.044 9.899 10.950 1.00 0.00 H new ATOM 2371 N GLY B 76 0.262 9.824 12.684 1.00 0.00 N ATOM 2372 CA GLY B 76 -1.090 10.338 12.740 1.00 0.00 C ATOM 2373 C GLY B 76 -1.772 9.959 14.034 1.00 0.00 C ATOM 2374 O GLY B 76 -1.062 9.776 15.049 1.00 0.00 O ATOM 2375 OXT GLY B 76 -3.013 9.839 14.046 1.00 0.00 O ATOM 0 H GLY B 76 0.451 9.053 13.325 1.00 0.00 H new ATOM 0 HA2 GLY B 76 -1.072 11.423 12.641 1.00 0.00 H new ATOM 0 HA3 GLY B 76 -1.663 9.950 11.898 1.00 0.00 H new TER 2379 GLY B 76