USER MOD reduce.3.24.130724 H: found=0, std=0, add=1344, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1346 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 42 SER OG : rot 179:sc= 1.08 USER MOD Set 1.2: B 46 LYS NZ :NH3+ -169:sc= 1.21 (180deg=0) USER MOD Set 2.1: A 71 TYR OH : rot -130:sc= 0.8 USER MOD Set 2.2: B 10 LYS NZ :NH3+ 156:sc= 2.16 (180deg=1.15) USER MOD Set 3.1: A 10 LYS NZ :NH3+ -170:sc= 2.75 (180deg=0.769) USER MOD Set 3.2: B 71 TYR OH : rot 0:sc= 0.815 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.11 USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.084) USER MOD Single : A 15 LYS NZ :NH3+ 161:sc= 1.29 (180deg=1.17) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 82:sc= 0.203 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -133:sc= 1.24 (180deg=0.262) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 75:sc= 0.0313 USER MOD Single : A 39 ASN : amide:sc= -0.0816 K(o=-0.082,f=-1.4!) USER MOD Single : A 42 SER OG : rot 70:sc= 1.22 USER MOD Single : A 44 LYS NZ :NH3+ -142:sc= -0.4! (180deg=-1.06) USER MOD Single : A 46 LYS NZ :NH3+ -113:sc= 1.2 (180deg=0.543) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.0661 USER MOD Single : A 50 GLN : amide:sc= -0.258 K(o=-0.26,f=-0.79) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 1.21 K(o=1.2,f=-0.73) USER MOD Single : A 57 LYS NZ :NH3+ 162:sc= 0.171 (180deg=-0.476) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 68:sc= 1.2 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -169:sc= 1.12 (180deg=0.494) USER MOD Single : A 73 SER OG : rot 77:sc= 0.531 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 78:sc= 1.23 USER MOD Single : A 86 SER OG : rot 73:sc= 0.976 USER MOD Single : B 15 LYS NZ :NH3+ 168:sc= 1.26 (180deg=1.24) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot -32:sc= 0.423 USER MOD Single : B 25 LYS NZ :NH3+ -169:sc= -0.0138 (180deg=-0.196) USER MOD Single : B 26 LYS NZ :NH3+ 154:sc= 1.13 (180deg=-0.37) USER MOD Single : B 35 LYS NZ :NH3+ 168:sc=-0.00457 (180deg=-0.132) USER MOD Single : B 37 SER OG : rot 73:sc= 1.24 USER MOD Single : B 39 ASN : amide:sc= 0.247 K(o=0.25,f=-0.52) USER MOD Single : B 44 LYS NZ :NH3+ -164:sc= 1.51 (180deg=1.04) USER MOD Single : B 47 THR OG1 : rot 88:sc= 1.07 USER MOD Single : B 50 GLN : amide:sc= -0.2! X(o=-0.2!,f=-0.33) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= 0.893 K(o=0.89,f=-0.22) USER MOD Single : B 57 LYS NZ :NH3+ -118:sc= -0.915 (180deg=-1.42) USER MOD Single : B 62 TYR OH : rot -16:sc= 0.637 USER MOD Single : B 63 THR OG1 : rot 87:sc= 1.23 USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 69 LYS NZ :NH3+ -104:sc= 1.23 (180deg=-0.739) USER MOD Single : B 73 SER OG : rot 180:sc= 0.00374 USER MOD Single : B 76 SER OG : rot 67:sc= 0.257 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 84 THR OG1 : rot 70:sc= 1.21 USER MOD Single : B 86 SER OG : rot 73:sc= 0.405 USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 6 -20.415 13.902 -7.428 1.00 1.91 N ATOM 78 CA GLN A 6 -19.971 12.535 -7.652 1.00 1.87 C ATOM 79 C GLN A 6 -18.756 12.499 -8.572 1.00 1.83 C ATOM 80 O GLN A 6 -17.805 11.761 -8.325 1.00 1.77 O ATOM 81 CB GLN A 6 -21.110 11.707 -8.248 1.00 1.89 C ATOM 82 CG GLN A 6 -20.829 10.211 -8.280 1.00 1.95 C ATOM 83 CD GLN A 6 -22.026 9.408 -8.740 1.00 1.96 C ATOM 84 OE1 GLN A 6 -22.193 9.146 -9.928 1.00 2.22 O ATOM 85 NE2 GLN A 6 -22.866 9.010 -7.799 1.00 2.13 N ATOM 0 HA GLN A 6 -19.682 12.107 -6.692 1.00 1.87 H new ATOM 0 HB2 GLN A 6 -22.017 11.885 -7.670 1.00 1.89 H new ATOM 0 HB3 GLN A 6 -21.306 12.053 -9.263 1.00 1.89 H new ATOM 0 HG2 GLN A 6 -19.987 10.016 -8.945 1.00 1.95 H new ATOM 0 HG3 GLN A 6 -20.533 9.879 -7.285 1.00 1.95 H new ATOM 0 HE21 GLN A 6 -22.690 9.250 -6.823 1.00 2.13 H new ATOM 0 HE22 GLN A 6 -23.690 8.463 -8.049 1.00 2.13 H new ATOM 94 N THR A 7 -18.782 13.316 -9.617 1.00 1.86 N ATOM 95 CA THR A 7 -17.682 13.371 -10.575 1.00 1.83 C ATOM 96 C THR A 7 -16.434 13.977 -9.941 1.00 1.79 C ATOM 97 O THR A 7 -15.308 13.565 -10.232 1.00 1.71 O ATOM 98 CB THR A 7 -18.073 14.184 -11.820 1.00 1.88 C ATOM 99 OG1 THR A 7 -19.038 15.178 -11.460 1.00 2.15 O ATOM 100 CG2 THR A 7 -18.644 13.282 -12.905 1.00 1.95 C ATOM 0 H THR A 7 -19.553 13.951 -9.824 1.00 1.86 H new ATOM 0 HA THR A 7 -17.463 12.347 -10.877 1.00 1.83 H new ATOM 0 HB THR A 7 -17.177 14.665 -12.213 1.00 1.88 H new ATOM 0 HG1 THR A 7 -19.285 15.697 -12.254 1.00 2.15 H new ATOM 0 HG21 THR A 7 -18.912 13.883 -13.774 1.00 1.95 H new ATOM 0 HG22 THR A 7 -17.898 12.541 -13.192 1.00 1.95 H new ATOM 0 HG23 THR A 7 -19.532 12.775 -12.527 1.00 1.95 H new ATOM 108 N ARG A 8 -16.644 14.943 -9.058 1.00 1.84 N ATOM 109 CA ARG A 8 -15.544 15.617 -8.385 1.00 1.82 C ATOM 110 C ARG A 8 -14.791 14.660 -7.468 1.00 1.75 C ATOM 111 O ARG A 8 -13.564 14.581 -7.514 1.00 1.69 O ATOM 112 CB ARG A 8 -16.071 16.817 -7.586 1.00 1.94 C ATOM 113 CG ARG A 8 -14.991 17.643 -6.889 1.00 2.03 C ATOM 114 CD ARG A 8 -13.867 18.044 -7.835 1.00 2.06 C ATOM 115 NE ARG A 8 -14.369 18.541 -9.119 1.00 2.06 N ATOM 116 CZ ARG A 8 -13.906 18.141 -10.304 1.00 2.08 C ATOM 117 NH1 ARG A 8 -12.929 17.240 -10.371 1.00 2.10 N ATOM 118 NH2 ARG A 8 -14.420 18.642 -11.420 1.00 2.22 N ATOM 0 H ARG A 8 -17.570 15.278 -8.791 1.00 1.84 H new ATOM 0 HA ARG A 8 -14.847 15.973 -9.144 1.00 1.82 H new ATOM 0 HB2 ARG A 8 -16.629 17.468 -8.259 1.00 1.94 H new ATOM 0 HB3 ARG A 8 -16.774 16.456 -6.836 1.00 1.94 H new ATOM 0 HG2 ARG A 8 -15.441 18.540 -6.463 1.00 2.03 H new ATOM 0 HG3 ARG A 8 -14.577 17.069 -6.060 1.00 2.03 H new ATOM 0 HD2 ARG A 8 -13.256 18.814 -7.364 1.00 2.06 H new ATOM 0 HD3 ARG A 8 -13.218 17.185 -8.009 1.00 2.06 H new ATOM 0 HE ARG A 8 -15.117 19.234 -9.106 1.00 2.06 H new ATOM 0 HH11 ARG A 8 -12.532 16.853 -9.515 1.00 2.10 H new ATOM 0 HH12 ARG A 8 -12.577 16.936 -11.279 1.00 2.10 H new ATOM 0 HH21 ARG A 8 -15.169 19.333 -11.371 1.00 2.22 H new ATOM 0 HH22 ARG A 8 -14.066 18.336 -12.327 1.00 2.22 H new ATOM 132 N ASN A 9 -15.530 13.930 -6.642 1.00 1.76 N ATOM 133 CA ASN A 9 -14.922 12.980 -5.716 1.00 1.72 C ATOM 134 C ASN A 9 -14.313 11.800 -6.471 1.00 1.61 C ATOM 135 O ASN A 9 -13.247 11.296 -6.106 1.00 1.56 O ATOM 136 CB ASN A 9 -15.956 12.473 -4.705 1.00 1.78 C ATOM 137 CG ASN A 9 -15.381 11.446 -3.738 1.00 1.75 C ATOM 138 OD1 ASN A 9 -15.398 10.243 -4.004 1.00 1.75 O ATOM 139 ND2 ASN A 9 -14.869 11.915 -2.609 1.00 1.84 N ATOM 0 H ASN A 9 -16.548 13.976 -6.593 1.00 1.76 H new ATOM 0 HA ASN A 9 -14.128 13.498 -5.178 1.00 1.72 H new ATOM 0 HB2 ASN A 9 -16.349 13.318 -4.139 1.00 1.78 H new ATOM 0 HB3 ASN A 9 -16.795 12.030 -5.241 1.00 1.78 H new ATOM 0 HD21 ASN A 9 -14.470 11.273 -1.924 1.00 1.84 H new ATOM 0 HD22 ASN A 9 -14.873 12.918 -2.425 1.00 1.84 H new ATOM 146 N LYS A 10 -14.994 11.381 -7.534 1.00 1.60 N ATOM 147 CA LYS A 10 -14.548 10.262 -8.356 1.00 1.52 C ATOM 148 C LYS A 10 -13.161 10.519 -8.931 1.00 1.47 C ATOM 149 O LYS A 10 -12.283 9.660 -8.861 1.00 1.41 O ATOM 150 CB LYS A 10 -15.546 10.017 -9.496 1.00 1.53 C ATOM 151 CG LYS A 10 -15.148 8.908 -10.464 1.00 1.59 C ATOM 152 CD LYS A 10 -15.669 7.549 -10.021 1.00 1.70 C ATOM 153 CE LYS A 10 -14.847 6.967 -8.878 1.00 2.07 C ATOM 154 NZ LYS A 10 -13.385 7.031 -9.157 1.00 2.48 N ATOM 0 H LYS A 10 -15.866 11.806 -7.848 1.00 1.60 H new ATOM 0 HA LYS A 10 -14.496 9.377 -7.722 1.00 1.52 H new ATOM 0 HB2 LYS A 10 -16.517 9.773 -9.065 1.00 1.53 H new ATOM 0 HB3 LYS A 10 -15.670 10.943 -10.057 1.00 1.53 H new ATOM 0 HG2 LYS A 10 -15.534 9.138 -11.457 1.00 1.59 H new ATOM 0 HG3 LYS A 10 -14.062 8.871 -10.545 1.00 1.59 H new ATOM 0 HD2 LYS A 10 -16.709 7.644 -9.708 1.00 1.70 H new ATOM 0 HD3 LYS A 10 -15.652 6.861 -10.866 1.00 1.70 H new ATOM 0 HE2 LYS A 10 -15.066 7.512 -7.960 1.00 2.07 H new ATOM 0 HE3 LYS A 10 -15.140 5.930 -8.711 1.00 2.07 H new ATOM 0 HZ1 LYS A 10 -12.871 6.478 -8.442 1.00 2.48 H new ATOM 0 HZ2 LYS A 10 -13.194 6.639 -10.101 1.00 2.48 H new ATOM 0 HZ3 LYS A 10 -13.068 8.021 -9.123 1.00 2.48 H new ATOM 168 N GLU A 11 -12.984 11.702 -9.498 1.00 1.52 N ATOM 169 CA GLU A 11 -11.721 12.098 -10.102 1.00 1.50 C ATOM 170 C GLU A 11 -10.644 12.312 -9.037 1.00 1.45 C ATOM 171 O GLU A 11 -9.470 12.006 -9.249 1.00 1.38 O ATOM 172 CB GLU A 11 -11.930 13.390 -10.894 1.00 1.58 C ATOM 173 CG GLU A 11 -10.725 13.816 -11.716 1.00 1.63 C ATOM 174 CD GLU A 11 -10.619 15.322 -11.855 1.00 1.77 C ATOM 175 OE1 GLU A 11 -11.594 15.950 -12.320 1.00 1.96 O ATOM 176 OE2 GLU A 11 -9.566 15.889 -11.488 1.00 1.90 O ATOM 0 H GLU A 11 -13.712 12.415 -9.553 1.00 1.52 H new ATOM 0 HA GLU A 11 -11.385 11.301 -10.766 1.00 1.50 H new ATOM 0 HB2 GLU A 11 -12.783 13.261 -11.560 1.00 1.58 H new ATOM 0 HB3 GLU A 11 -12.185 14.191 -10.201 1.00 1.58 H new ATOM 0 HG2 GLU A 11 -9.817 13.433 -11.250 1.00 1.63 H new ATOM 0 HG3 GLU A 11 -10.788 13.367 -12.707 1.00 1.63 H new ATOM 183 N LEU A 12 -11.063 12.836 -7.893 1.00 1.51 N ATOM 184 CA LEU A 12 -10.154 13.126 -6.791 1.00 1.50 C ATOM 185 C LEU A 12 -9.414 11.879 -6.320 1.00 1.40 C ATOM 186 O LEU A 12 -8.187 11.814 -6.390 1.00 1.33 O ATOM 187 CB LEU A 12 -10.926 13.749 -5.620 1.00 1.62 C ATOM 188 CG LEU A 12 -10.075 14.180 -4.426 1.00 1.65 C ATOM 189 CD1 LEU A 12 -9.119 15.296 -4.817 1.00 1.69 C ATOM 190 CD2 LEU A 12 -10.963 14.620 -3.275 1.00 1.82 C ATOM 0 H LEU A 12 -12.037 13.071 -7.703 1.00 1.51 H new ATOM 0 HA LEU A 12 -9.411 13.834 -7.157 1.00 1.50 H new ATOM 0 HB2 LEU A 12 -11.471 14.618 -5.988 1.00 1.62 H new ATOM 0 HB3 LEU A 12 -11.669 13.030 -5.274 1.00 1.62 H new ATOM 0 HG LEU A 12 -9.483 13.324 -4.102 1.00 1.65 H new ATOM 0 HD11 LEU A 12 -8.524 15.586 -3.951 1.00 1.69 H new ATOM 0 HD12 LEU A 12 -8.458 14.948 -5.611 1.00 1.69 H new ATOM 0 HD13 LEU A 12 -9.688 16.156 -5.170 1.00 1.69 H new ATOM 0 HD21 LEU A 12 -10.342 14.924 -2.432 1.00 1.82 H new ATOM 0 HD22 LEU A 12 -11.581 15.460 -3.592 1.00 1.82 H new ATOM 0 HD23 LEU A 12 -11.604 13.792 -2.973 1.00 1.82 H new ATOM 202 N LEU A 13 -10.165 10.882 -5.868 1.00 1.41 N ATOM 203 CA LEU A 13 -9.568 9.652 -5.361 1.00 1.35 C ATOM 204 C LEU A 13 -8.847 8.881 -6.463 1.00 1.23 C ATOM 205 O LEU A 13 -7.794 8.292 -6.229 1.00 1.18 O ATOM 206 CB LEU A 13 -10.628 8.765 -4.696 1.00 1.43 C ATOM 207 CG LEU A 13 -11.301 9.368 -3.458 1.00 1.43 C ATOM 208 CD1 LEU A 13 -12.234 8.357 -2.813 1.00 1.81 C ATOM 209 CD2 LEU A 13 -10.263 9.850 -2.450 1.00 1.76 C ATOM 0 H LEU A 13 -11.185 10.900 -5.842 1.00 1.41 H new ATOM 0 HA LEU A 13 -8.828 9.935 -4.612 1.00 1.35 H new ATOM 0 HB2 LEU A 13 -11.398 8.533 -5.432 1.00 1.43 H new ATOM 0 HB3 LEU A 13 -10.163 7.821 -4.413 1.00 1.43 H new ATOM 0 HG LEU A 13 -11.887 10.229 -3.780 1.00 1.43 H new ATOM 0 HD11 LEU A 13 -12.703 8.803 -1.936 1.00 1.81 H new ATOM 0 HD12 LEU A 13 -13.004 8.065 -3.527 1.00 1.81 H new ATOM 0 HD13 LEU A 13 -11.665 7.477 -2.513 1.00 1.81 H new ATOM 0 HD21 LEU A 13 -10.768 10.273 -1.582 1.00 1.76 H new ATOM 0 HD22 LEU A 13 -9.643 9.010 -2.136 1.00 1.76 H new ATOM 0 HD23 LEU A 13 -9.634 10.612 -2.911 1.00 1.76 H new ATOM 221 N LEU A 14 -9.406 8.915 -7.663 1.00 1.21 N ATOM 222 CA LEU A 14 -8.827 8.218 -8.808 1.00 1.13 C ATOM 223 C LEU A 14 -7.390 8.667 -9.067 1.00 1.11 C ATOM 224 O LEU A 14 -6.496 7.841 -9.260 1.00 1.04 O ATOM 225 CB LEU A 14 -9.680 8.473 -10.053 1.00 1.16 C ATOM 226 CG LEU A 14 -9.267 7.713 -11.316 1.00 1.09 C ATOM 227 CD1 LEU A 14 -9.444 6.215 -11.117 1.00 1.11 C ATOM 228 CD2 LEU A 14 -10.083 8.195 -12.509 1.00 1.23 C ATOM 0 H LEU A 14 -10.266 9.421 -7.873 1.00 1.21 H new ATOM 0 HA LEU A 14 -8.812 7.152 -8.582 1.00 1.13 H new ATOM 0 HB2 LEU A 14 -10.713 8.216 -9.820 1.00 1.16 H new ATOM 0 HB3 LEU A 14 -9.658 9.541 -10.272 1.00 1.16 H new ATOM 0 HG LEU A 14 -8.213 7.909 -11.514 1.00 1.09 H new ATOM 0 HD11 LEU A 14 -9.146 5.690 -12.024 1.00 1.11 H new ATOM 0 HD12 LEU A 14 -8.823 5.883 -10.285 1.00 1.11 H new ATOM 0 HD13 LEU A 14 -10.490 5.998 -10.899 1.00 1.11 H new ATOM 0 HD21 LEU A 14 -9.781 7.647 -13.402 1.00 1.23 H new ATOM 0 HD22 LEU A 14 -11.142 8.022 -12.319 1.00 1.23 H new ATOM 0 HD23 LEU A 14 -9.911 9.260 -12.661 1.00 1.23 H new ATOM 240 N LYS A 15 -7.171 9.975 -9.063 1.00 1.19 N ATOM 241 CA LYS A 15 -5.847 10.527 -9.313 1.00 1.19 C ATOM 242 C LYS A 15 -4.949 10.454 -8.081 1.00 1.14 C ATOM 243 O LYS A 15 -3.773 10.115 -8.189 1.00 1.09 O ATOM 244 CB LYS A 15 -5.958 11.976 -9.791 1.00 1.32 C ATOM 245 CG LYS A 15 -6.378 12.107 -11.250 1.00 1.56 C ATOM 246 CD LYS A 15 -7.109 13.415 -11.516 1.00 1.68 C ATOM 247 CE LYS A 15 -6.242 14.630 -11.231 1.00 1.70 C ATOM 248 NZ LYS A 15 -6.878 15.882 -11.717 1.00 1.93 N ATOM 0 H LYS A 15 -7.894 10.674 -8.889 1.00 1.19 H new ATOM 0 HA LYS A 15 -5.387 9.919 -10.092 1.00 1.19 H new ATOM 0 HB2 LYS A 15 -6.679 12.502 -9.165 1.00 1.32 H new ATOM 0 HB3 LYS A 15 -4.996 12.470 -9.653 1.00 1.32 H new ATOM 0 HG2 LYS A 15 -5.496 12.048 -11.888 1.00 1.56 H new ATOM 0 HG3 LYS A 15 -7.023 11.270 -11.519 1.00 1.56 H new ATOM 0 HD2 LYS A 15 -7.436 13.441 -12.556 1.00 1.68 H new ATOM 0 HD3 LYS A 15 -8.006 13.459 -10.899 1.00 1.68 H new ATOM 0 HE2 LYS A 15 -6.062 14.705 -10.159 1.00 1.70 H new ATOM 0 HE3 LYS A 15 -5.271 14.505 -11.710 1.00 1.70 H new ATOM 0 HZ1 LYS A 15 -6.445 16.699 -11.241 1.00 1.93 H new ATOM 0 HZ2 LYS A 15 -6.739 15.966 -12.744 1.00 1.93 H new ATOM 0 HZ3 LYS A 15 -7.896 15.859 -11.506 1.00 1.93 H new ATOM 262 N LYS A 16 -5.506 10.768 -6.916 1.00 1.17 N ATOM 263 CA LYS A 16 -4.737 10.756 -5.672 1.00 1.16 C ATOM 264 C LYS A 16 -4.206 9.360 -5.347 1.00 1.04 C ATOM 265 O LYS A 16 -3.035 9.198 -4.998 1.00 1.05 O ATOM 266 CB LYS A 16 -5.592 11.266 -4.507 1.00 1.26 C ATOM 267 CG LYS A 16 -5.833 12.771 -4.520 1.00 1.32 C ATOM 268 CD LYS A 16 -4.537 13.568 -4.453 1.00 1.30 C ATOM 269 CE LYS A 16 -3.692 13.192 -3.243 1.00 1.50 C ATOM 270 NZ LYS A 16 -2.488 14.059 -3.123 1.00 1.62 N ATOM 0 H LYS A 16 -6.485 11.034 -6.805 1.00 1.17 H new ATOM 0 HA LYS A 16 -3.884 11.419 -5.814 1.00 1.16 H new ATOM 0 HB2 LYS A 16 -6.555 10.755 -4.527 1.00 1.26 H new ATOM 0 HB3 LYS A 16 -5.107 10.995 -3.569 1.00 1.26 H new ATOM 0 HG2 LYS A 16 -6.376 13.041 -5.426 1.00 1.32 H new ATOM 0 HG3 LYS A 16 -6.467 13.042 -3.676 1.00 1.32 H new ATOM 0 HD2 LYS A 16 -3.961 13.399 -5.363 1.00 1.30 H new ATOM 0 HD3 LYS A 16 -4.769 14.632 -4.416 1.00 1.30 H new ATOM 0 HE2 LYS A 16 -4.294 13.277 -2.338 1.00 1.50 H new ATOM 0 HE3 LYS A 16 -3.384 12.150 -3.324 1.00 1.50 H new ATOM 0 HZ1 LYS A 16 -1.937 13.774 -2.288 1.00 1.62 H new ATOM 0 HZ2 LYS A 16 -1.902 13.959 -3.976 1.00 1.62 H new ATOM 0 HZ3 LYS A 16 -2.783 15.051 -3.021 1.00 1.62 H new ATOM 284 N ILE A 17 -5.069 8.360 -5.459 1.00 0.96 N ATOM 285 CA ILE A 17 -4.683 6.986 -5.159 1.00 0.88 C ATOM 286 C ILE A 17 -3.724 6.423 -6.216 1.00 0.85 C ATOM 287 O ILE A 17 -2.791 5.687 -5.886 1.00 0.83 O ATOM 288 CB ILE A 17 -5.924 6.073 -5.020 1.00 0.85 C ATOM 289 CG1 ILE A 17 -6.768 6.541 -3.832 1.00 1.01 C ATOM 290 CG2 ILE A 17 -5.513 4.616 -4.839 1.00 0.89 C ATOM 291 CD1 ILE A 17 -8.052 5.762 -3.645 1.00 1.02 C ATOM 0 H ILE A 17 -6.039 8.472 -5.754 1.00 0.96 H new ATOM 0 HA ILE A 17 -4.158 7.004 -4.204 1.00 0.88 H new ATOM 0 HB ILE A 17 -6.515 6.141 -5.934 1.00 0.85 H new ATOM 0 HG12 ILE A 17 -6.172 6.463 -2.923 1.00 1.01 H new ATOM 0 HG13 ILE A 17 -7.011 7.595 -3.965 1.00 1.01 H new ATOM 0 HG21 ILE A 17 -6.404 3.996 -4.744 1.00 0.89 H new ATOM 0 HG22 ILE A 17 -4.935 4.291 -5.704 1.00 0.89 H new ATOM 0 HG23 ILE A 17 -4.905 4.518 -3.939 1.00 0.89 H new ATOM 0 HD11 ILE A 17 -8.593 6.154 -2.784 1.00 1.02 H new ATOM 0 HD12 ILE A 17 -8.670 5.860 -4.537 1.00 1.02 H new ATOM 0 HD13 ILE A 17 -7.819 4.710 -3.479 1.00 1.02 H new ATOM 303 N ASP A 18 -3.943 6.778 -7.476 1.00 0.90 N ATOM 304 CA ASP A 18 -3.081 6.308 -8.565 1.00 0.93 C ATOM 305 C ASP A 18 -1.632 6.742 -8.321 1.00 0.93 C ATOM 306 O ASP A 18 -0.705 5.931 -8.367 1.00 0.93 O ATOM 307 CB ASP A 18 -3.585 6.851 -9.909 1.00 1.04 C ATOM 308 CG ASP A 18 -2.900 6.230 -11.113 1.00 1.20 C ATOM 309 OD1 ASP A 18 -2.197 5.209 -10.960 1.00 1.66 O ATOM 310 OD2 ASP A 18 -3.071 6.766 -12.231 1.00 1.62 O ATOM 0 H ASP A 18 -4.705 7.387 -7.773 1.00 0.90 H new ATOM 0 HA ASP A 18 -3.114 5.219 -8.595 1.00 0.93 H new ATOM 0 HB2 ASP A 18 -4.658 6.676 -9.982 1.00 1.04 H new ATOM 0 HB3 ASP A 18 -3.436 7.930 -9.934 1.00 1.04 H new ATOM 315 N SER A 19 -1.454 8.025 -8.023 1.00 0.99 N ATOM 316 CA SER A 19 -0.132 8.587 -7.761 1.00 1.03 C ATOM 317 C SER A 19 0.483 7.997 -6.496 1.00 0.96 C ATOM 318 O SER A 19 1.704 7.884 -6.387 1.00 0.96 O ATOM 319 CB SER A 19 -0.231 10.105 -7.640 1.00 1.17 C ATOM 320 OG SER A 19 -0.785 10.667 -8.819 1.00 1.28 O ATOM 0 H SER A 19 -2.215 8.701 -7.956 1.00 0.99 H new ATOM 0 HA SER A 19 0.518 8.331 -8.597 1.00 1.03 H new ATOM 0 HB2 SER A 19 -0.849 10.367 -6.781 1.00 1.17 H new ATOM 0 HB3 SER A 19 0.758 10.526 -7.461 1.00 1.17 H new ATOM 0 HG SER A 19 -1.762 10.593 -8.789 1.00 1.28 H new ATOM 326 N LEU A 20 -0.375 7.631 -5.552 1.00 0.92 N ATOM 327 CA LEU A 20 0.061 7.054 -4.287 1.00 0.90 C ATOM 328 C LEU A 20 0.979 5.861 -4.537 1.00 0.84 C ATOM 329 O LEU A 20 2.083 5.794 -4.003 1.00 0.86 O ATOM 330 CB LEU A 20 -1.158 6.619 -3.464 1.00 0.92 C ATOM 331 CG LEU A 20 -0.871 6.208 -2.011 1.00 1.01 C ATOM 332 CD1 LEU A 20 -1.432 7.241 -1.050 1.00 1.37 C ATOM 333 CD2 LEU A 20 -1.446 4.829 -1.728 1.00 1.14 C ATOM 0 H LEU A 20 -1.387 7.725 -5.641 1.00 0.92 H new ATOM 0 HA LEU A 20 0.616 7.808 -3.729 1.00 0.90 H new ATOM 0 HB2 LEU A 20 -1.878 7.438 -3.455 1.00 0.92 H new ATOM 0 HB3 LEU A 20 -1.635 5.781 -3.972 1.00 0.92 H new ATOM 0 HG LEU A 20 0.208 6.161 -1.865 1.00 1.01 H new ATOM 0 HD11 LEU A 20 -1.221 6.937 -0.025 1.00 1.37 H new ATOM 0 HD12 LEU A 20 -0.968 8.208 -1.244 1.00 1.37 H new ATOM 0 HD13 LEU A 20 -2.510 7.321 -1.190 1.00 1.37 H new ATOM 0 HD21 LEU A 20 -1.235 4.552 -0.695 1.00 1.14 H new ATOM 0 HD22 LEU A 20 -2.524 4.845 -1.886 1.00 1.14 H new ATOM 0 HD23 LEU A 20 -0.992 4.100 -2.399 1.00 1.14 H new ATOM 345 N ILE A 21 0.537 4.947 -5.388 1.00 0.80 N ATOM 346 CA ILE A 21 1.328 3.766 -5.705 1.00 0.79 C ATOM 347 C ILE A 21 2.588 4.140 -6.483 1.00 0.81 C ATOM 348 O ILE A 21 3.658 3.584 -6.245 1.00 0.83 O ATOM 349 CB ILE A 21 0.521 2.754 -6.536 1.00 0.81 C ATOM 350 CG1 ILE A 21 -0.905 2.628 -5.996 1.00 1.06 C ATOM 351 CG2 ILE A 21 1.214 1.402 -6.534 1.00 1.04 C ATOM 352 CD1 ILE A 21 -1.924 2.343 -7.073 1.00 1.23 C ATOM 0 H ILE A 21 -0.361 4.999 -5.870 1.00 0.80 H new ATOM 0 HA ILE A 21 1.606 3.311 -4.754 1.00 0.79 H new ATOM 0 HB ILE A 21 0.465 3.115 -7.563 1.00 0.81 H new ATOM 0 HG12 ILE A 21 -0.937 1.830 -5.254 1.00 1.06 H new ATOM 0 HG13 ILE A 21 -1.176 3.551 -5.483 1.00 1.06 H new ATOM 0 HG21 ILE A 21 0.633 0.694 -7.126 1.00 1.04 H new ATOM 0 HG22 ILE A 21 2.210 1.503 -6.965 1.00 1.04 H new ATOM 0 HG23 ILE A 21 1.297 1.037 -5.510 1.00 1.04 H new ATOM 0 HD11 ILE A 21 -2.915 2.265 -6.625 1.00 1.23 H new ATOM 0 HD12 ILE A 21 -1.918 3.153 -7.803 1.00 1.23 H new ATOM 0 HD13 ILE A 21 -1.676 1.405 -7.570 1.00 1.23 H new ATOM 364 N GLU A 22 2.451 5.091 -7.402 1.00 0.84 N ATOM 365 CA GLU A 22 3.571 5.541 -8.229 1.00 0.90 C ATOM 366 C GLU A 22 4.711 6.101 -7.377 1.00 0.90 C ATOM 367 O GLU A 22 5.883 5.819 -7.631 1.00 0.93 O ATOM 368 CB GLU A 22 3.111 6.603 -9.225 1.00 0.98 C ATOM 369 CG GLU A 22 2.583 6.034 -10.535 1.00 1.29 C ATOM 370 CD GLU A 22 2.599 7.061 -11.648 1.00 1.78 C ATOM 371 OE1 GLU A 22 3.644 7.713 -11.838 1.00 2.22 O ATOM 372 OE2 GLU A 22 1.564 7.243 -12.320 1.00 2.29 O ATOM 0 H GLU A 22 1.571 5.569 -7.595 1.00 0.84 H new ATOM 0 HA GLU A 22 3.942 4.671 -8.771 1.00 0.90 H new ATOM 0 HB2 GLU A 22 2.331 7.207 -8.762 1.00 0.98 H new ATOM 0 HB3 GLU A 22 3.945 7.270 -9.440 1.00 0.98 H new ATOM 0 HG2 GLU A 22 3.187 5.175 -10.826 1.00 1.29 H new ATOM 0 HG3 GLU A 22 1.565 5.673 -10.389 1.00 1.29 H new ATOM 379 N ALA A 23 4.359 6.892 -6.372 1.00 0.89 N ATOM 380 CA ALA A 23 5.346 7.493 -5.487 1.00 0.92 C ATOM 381 C ALA A 23 6.122 6.428 -4.722 1.00 0.88 C ATOM 382 O ALA A 23 7.353 6.452 -4.680 1.00 0.89 O ATOM 383 CB ALA A 23 4.673 8.458 -4.520 1.00 0.94 C ATOM 0 H ALA A 23 3.393 7.133 -6.149 1.00 0.89 H new ATOM 0 HA ALA A 23 6.055 8.048 -6.101 1.00 0.92 H new ATOM 0 HB1 ALA A 23 5.424 8.899 -3.865 1.00 0.94 H new ATOM 0 HB2 ALA A 23 4.173 9.247 -5.082 1.00 0.94 H new ATOM 0 HB3 ALA A 23 3.939 7.919 -3.920 1.00 0.94 H new ATOM 389 N ILE A 24 5.399 5.481 -4.136 1.00 0.86 N ATOM 390 CA ILE A 24 6.018 4.409 -3.369 1.00 0.85 C ATOM 391 C ILE A 24 6.848 3.495 -4.279 1.00 0.83 C ATOM 392 O ILE A 24 7.924 3.030 -3.893 1.00 0.83 O ATOM 393 CB ILE A 24 4.946 3.604 -2.580 1.00 0.87 C ATOM 394 CG1 ILE A 24 4.555 4.368 -1.304 1.00 1.12 C ATOM 395 CG2 ILE A 24 5.439 2.201 -2.238 1.00 1.03 C ATOM 396 CD1 ILE A 24 3.100 4.807 -1.255 1.00 1.05 C ATOM 0 H ILE A 24 4.381 5.435 -4.178 1.00 0.86 H new ATOM 0 HA ILE A 24 6.697 4.856 -2.643 1.00 0.85 H new ATOM 0 HB ILE A 24 4.066 3.494 -3.214 1.00 0.87 H new ATOM 0 HG12 ILE A 24 4.760 3.736 -0.440 1.00 1.12 H new ATOM 0 HG13 ILE A 24 5.191 5.249 -1.213 1.00 1.12 H new ATOM 0 HG21 ILE A 24 4.665 1.667 -1.687 1.00 1.03 H new ATOM 0 HG22 ILE A 24 5.667 1.662 -3.157 1.00 1.03 H new ATOM 0 HG23 ILE A 24 6.338 2.270 -1.625 1.00 1.03 H new ATOM 0 HD11 ILE A 24 2.911 5.338 -0.322 1.00 1.05 H new ATOM 0 HD12 ILE A 24 2.891 5.467 -2.097 1.00 1.05 H new ATOM 0 HD13 ILE A 24 2.454 3.931 -1.311 1.00 1.05 H new ATOM 408 N LYS A 25 6.368 3.275 -5.498 1.00 0.83 N ATOM 409 CA LYS A 25 7.075 2.431 -6.457 1.00 0.84 C ATOM 410 C LYS A 25 8.386 3.090 -6.875 1.00 0.86 C ATOM 411 O LYS A 25 9.373 2.416 -7.159 1.00 0.86 O ATOM 412 CB LYS A 25 6.203 2.157 -7.687 1.00 0.88 C ATOM 413 CG LYS A 25 6.835 1.200 -8.692 1.00 0.96 C ATOM 414 CD LYS A 25 6.964 -0.210 -8.136 1.00 1.13 C ATOM 415 CE LYS A 25 7.850 -1.076 -9.019 1.00 1.39 C ATOM 416 NZ LYS A 25 7.211 -1.384 -10.329 1.00 1.61 N ATOM 0 H LYS A 25 5.494 3.668 -5.846 1.00 0.83 H new ATOM 0 HA LYS A 25 7.297 1.479 -5.976 1.00 0.84 H new ATOM 0 HB2 LYS A 25 5.248 1.745 -7.359 1.00 0.88 H new ATOM 0 HB3 LYS A 25 5.988 3.102 -8.186 1.00 0.88 H new ATOM 0 HG2 LYS A 25 6.232 1.178 -9.600 1.00 0.96 H new ATOM 0 HG3 LYS A 25 7.821 1.570 -8.974 1.00 0.96 H new ATOM 0 HD2 LYS A 25 7.380 -0.169 -7.129 1.00 1.13 H new ATOM 0 HD3 LYS A 25 5.976 -0.662 -8.054 1.00 1.13 H new ATOM 0 HE2 LYS A 25 8.798 -0.566 -9.190 1.00 1.39 H new ATOM 0 HE3 LYS A 25 8.078 -2.007 -8.500 1.00 1.39 H new ATOM 0 HZ1 LYS A 25 7.851 -1.976 -10.897 1.00 1.61 H new ATOM 0 HZ2 LYS A 25 6.319 -1.894 -10.169 1.00 1.61 H new ATOM 0 HZ3 LYS A 25 7.017 -0.498 -10.837 1.00 1.61 H new ATOM 430 N LYS A 26 8.387 4.413 -6.915 1.00 0.87 N ATOM 431 CA LYS A 26 9.582 5.159 -7.270 1.00 0.91 C ATOM 432 C LYS A 26 10.611 5.074 -6.148 1.00 0.90 C ATOM 433 O LYS A 26 11.811 5.002 -6.404 1.00 0.91 O ATOM 434 CB LYS A 26 9.241 6.619 -7.565 1.00 0.97 C ATOM 435 CG LYS A 26 9.125 6.927 -9.051 1.00 1.07 C ATOM 436 CD LYS A 26 10.426 7.482 -9.624 1.00 1.21 C ATOM 437 CE LYS A 26 11.505 6.412 -9.733 1.00 1.35 C ATOM 438 NZ LYS A 26 12.811 6.971 -10.186 1.00 1.42 N ATOM 0 H LYS A 26 7.573 4.992 -6.706 1.00 0.87 H new ATOM 0 HA LYS A 26 10.007 4.717 -8.171 1.00 0.91 H new ATOM 0 HB2 LYS A 26 8.300 6.870 -7.075 1.00 0.97 H new ATOM 0 HB3 LYS A 26 10.008 7.258 -7.128 1.00 0.97 H new ATOM 0 HG2 LYS A 26 8.850 6.020 -9.589 1.00 1.07 H new ATOM 0 HG3 LYS A 26 8.323 7.647 -9.210 1.00 1.07 H new ATOM 0 HD2 LYS A 26 10.236 7.907 -10.610 1.00 1.21 H new ATOM 0 HD3 LYS A 26 10.784 8.294 -8.991 1.00 1.21 H new ATOM 0 HE2 LYS A 26 11.635 5.930 -8.764 1.00 1.35 H new ATOM 0 HE3 LYS A 26 11.180 5.641 -10.432 1.00 1.35 H new ATOM 0 HZ1 LYS A 26 13.201 6.373 -10.942 1.00 1.42 H new ATOM 0 HZ2 LYS A 26 12.669 7.936 -10.546 1.00 1.42 H new ATOM 0 HZ3 LYS A 26 13.475 6.994 -9.386 1.00 1.42 H new ATOM 452 N ILE A 27 10.128 5.075 -4.908 1.00 0.88 N ATOM 453 CA ILE A 27 11.001 4.994 -3.738 1.00 0.89 C ATOM 454 C ILE A 27 11.866 3.730 -3.790 1.00 0.87 C ATOM 455 O ILE A 27 13.081 3.786 -3.579 1.00 0.90 O ATOM 456 CB ILE A 27 10.180 4.998 -2.427 1.00 0.90 C ATOM 457 CG1 ILE A 27 9.505 6.358 -2.219 1.00 0.90 C ATOM 458 CG2 ILE A 27 11.066 4.652 -1.238 1.00 0.93 C ATOM 459 CD1 ILE A 27 8.610 6.416 -0.996 1.00 1.31 C ATOM 0 H ILE A 27 9.134 5.131 -4.686 1.00 0.88 H new ATOM 0 HA ILE A 27 11.646 5.872 -3.753 1.00 0.89 H new ATOM 0 HB ILE A 27 9.403 4.238 -2.507 1.00 0.90 H new ATOM 0 HG12 ILE A 27 10.274 7.125 -2.132 1.00 0.90 H new ATOM 0 HG13 ILE A 27 8.914 6.599 -3.102 1.00 0.90 H new ATOM 0 HG21 ILE A 27 10.470 4.660 -0.325 1.00 0.93 H new ATOM 0 HG22 ILE A 27 11.497 3.661 -1.381 1.00 0.93 H new ATOM 0 HG23 ILE A 27 11.867 5.387 -1.155 1.00 0.93 H new ATOM 0 HD11 ILE A 27 8.168 7.409 -0.915 1.00 1.31 H new ATOM 0 HD12 ILE A 27 7.818 5.673 -1.089 1.00 1.31 H new ATOM 0 HD13 ILE A 27 9.200 6.208 -0.103 1.00 1.31 H new ATOM 471 N ILE A 28 11.236 2.596 -4.093 1.00 0.83 N ATOM 472 CA ILE A 28 11.948 1.319 -4.167 1.00 0.82 C ATOM 473 C ILE A 28 12.992 1.340 -5.288 1.00 0.83 C ATOM 474 O ILE A 28 14.063 0.736 -5.172 1.00 0.84 O ATOM 475 CB ILE A 28 10.975 0.121 -4.351 1.00 0.82 C ATOM 476 CG1 ILE A 28 11.605 -1.175 -3.840 1.00 0.88 C ATOM 477 CG2 ILE A 28 10.545 -0.047 -5.802 1.00 0.88 C ATOM 478 CD1 ILE A 28 11.449 -1.372 -2.348 1.00 1.05 C ATOM 0 H ILE A 28 10.237 2.534 -4.291 1.00 0.83 H new ATOM 0 HA ILE A 28 12.461 1.182 -3.215 1.00 0.82 H new ATOM 0 HB ILE A 28 10.085 0.342 -3.762 1.00 0.82 H new ATOM 0 HG12 ILE A 28 11.153 -2.020 -4.360 1.00 0.88 H new ATOM 0 HG13 ILE A 28 12.666 -1.178 -4.090 1.00 0.88 H new ATOM 0 HG21 ILE A 28 9.866 -0.896 -5.884 1.00 0.88 H new ATOM 0 HG22 ILE A 28 10.038 0.857 -6.138 1.00 0.88 H new ATOM 0 HG23 ILE A 28 11.423 -0.223 -6.424 1.00 0.88 H new ATOM 0 HD11 ILE A 28 11.919 -2.311 -2.054 1.00 1.05 H new ATOM 0 HD12 ILE A 28 11.926 -0.546 -1.820 1.00 1.05 H new ATOM 0 HD13 ILE A 28 10.389 -1.401 -2.094 1.00 1.05 H new ATOM 490 N ALA A 29 12.673 2.047 -6.369 1.00 0.84 N ATOM 491 CA ALA A 29 13.571 2.152 -7.505 1.00 0.87 C ATOM 492 C ALA A 29 14.853 2.876 -7.112 1.00 0.90 C ATOM 493 O ALA A 29 15.947 2.480 -7.515 1.00 0.93 O ATOM 494 CB ALA A 29 12.890 2.870 -8.658 1.00 0.90 C ATOM 0 H ALA A 29 11.795 2.555 -6.478 1.00 0.84 H new ATOM 0 HA ALA A 29 13.831 1.144 -7.829 1.00 0.87 H new ATOM 0 HB1 ALA A 29 13.578 2.939 -9.501 1.00 0.90 H new ATOM 0 HB2 ALA A 29 12.002 2.314 -8.959 1.00 0.90 H new ATOM 0 HB3 ALA A 29 12.601 3.872 -8.342 1.00 0.90 H new ATOM 500 N GLU A 30 14.708 3.929 -6.309 1.00 0.93 N ATOM 501 CA GLU A 30 15.849 4.712 -5.851 1.00 0.99 C ATOM 502 C GLU A 30 16.784 3.861 -5.001 1.00 0.99 C ATOM 503 O GLU A 30 18.001 4.002 -5.087 1.00 1.01 O ATOM 504 CB GLU A 30 15.388 5.921 -5.036 1.00 1.06 C ATOM 505 CG GLU A 30 14.389 6.808 -5.761 1.00 1.10 C ATOM 506 CD GLU A 30 14.966 7.455 -7.004 1.00 1.18 C ATOM 507 OE1 GLU A 30 16.038 8.088 -6.907 1.00 1.46 O ATOM 508 OE2 GLU A 30 14.348 7.340 -8.082 1.00 1.25 O ATOM 0 H GLU A 30 13.807 4.259 -5.962 1.00 0.93 H new ATOM 0 HA GLU A 30 16.384 5.059 -6.735 1.00 0.99 H new ATOM 0 HB2 GLU A 30 14.940 5.571 -4.106 1.00 1.06 H new ATOM 0 HB3 GLU A 30 16.259 6.518 -4.765 1.00 1.06 H new ATOM 0 HG2 GLU A 30 13.518 6.214 -6.038 1.00 1.10 H new ATOM 0 HG3 GLU A 30 14.041 7.586 -5.081 1.00 1.10 H new ATOM 515 N PHE A 31 16.207 2.981 -4.177 1.00 0.97 N ATOM 516 CA PHE A 31 16.996 2.108 -3.307 1.00 1.00 C ATOM 517 C PHE A 31 17.973 1.270 -4.118 1.00 0.97 C ATOM 518 O PHE A 31 19.141 1.128 -3.749 1.00 1.00 O ATOM 519 CB PHE A 31 16.089 1.187 -2.482 1.00 1.02 C ATOM 520 CG PHE A 31 15.340 1.881 -1.378 1.00 1.10 C ATOM 521 CD1 PHE A 31 15.870 2.990 -0.734 1.00 1.79 C ATOM 522 CD2 PHE A 31 14.101 1.412 -0.978 1.00 1.42 C ATOM 523 CE1 PHE A 31 15.179 3.616 0.283 1.00 1.98 C ATOM 524 CE2 PHE A 31 13.404 2.034 0.040 1.00 1.58 C ATOM 525 CZ PHE A 31 13.944 3.138 0.672 1.00 1.54 C ATOM 0 H PHE A 31 15.198 2.855 -4.095 1.00 0.97 H new ATOM 0 HA PHE A 31 17.559 2.748 -2.627 1.00 1.00 H new ATOM 0 HB2 PHE A 31 15.370 0.712 -3.150 1.00 1.02 H new ATOM 0 HB3 PHE A 31 16.696 0.392 -2.049 1.00 1.02 H new ATOM 0 HD1 PHE A 31 16.836 3.368 -1.033 1.00 1.79 H new ATOM 0 HD2 PHE A 31 13.674 0.549 -1.467 1.00 1.42 H new ATOM 0 HE1 PHE A 31 15.604 4.479 0.774 1.00 1.98 H new ATOM 0 HE2 PHE A 31 12.438 1.658 0.342 1.00 1.58 H new ATOM 0 HZ PHE A 31 13.401 3.625 1.468 1.00 1.54 H new ATOM 535 N ASP A 32 17.493 0.725 -5.228 1.00 0.93 N ATOM 536 CA ASP A 32 18.331 -0.094 -6.101 1.00 0.92 C ATOM 537 C ASP A 32 19.464 0.746 -6.697 1.00 0.92 C ATOM 538 O ASP A 32 20.589 0.272 -6.869 1.00 0.93 O ATOM 539 CB ASP A 32 17.484 -0.721 -7.213 1.00 0.94 C ATOM 540 CG ASP A 32 18.308 -1.555 -8.177 1.00 1.15 C ATOM 541 OD1 ASP A 32 18.842 -2.601 -7.759 1.00 1.54 O ATOM 542 OD2 ASP A 32 18.415 -1.171 -9.361 1.00 1.45 O ATOM 0 H ASP A 32 16.530 0.833 -5.547 1.00 0.93 H new ATOM 0 HA ASP A 32 18.773 -0.895 -5.509 1.00 0.92 H new ATOM 0 HB2 ASP A 32 16.711 -1.347 -6.767 1.00 0.94 H new ATOM 0 HB3 ASP A 32 16.975 0.069 -7.766 1.00 0.94 H new ATOM 547 N VAL A 33 19.160 2.011 -6.979 1.00 0.93 N ATOM 548 CA VAL A 33 20.136 2.937 -7.547 1.00 0.95 C ATOM 549 C VAL A 33 21.218 3.279 -6.527 1.00 0.96 C ATOM 550 O VAL A 33 22.410 3.261 -6.843 1.00 0.97 O ATOM 551 CB VAL A 33 19.461 4.240 -8.030 1.00 0.99 C ATOM 552 CG1 VAL A 33 20.473 5.162 -8.690 1.00 1.06 C ATOM 553 CG2 VAL A 33 18.322 3.927 -8.982 1.00 0.98 C ATOM 0 H VAL A 33 18.239 2.420 -6.822 1.00 0.93 H new ATOM 0 HA VAL A 33 20.591 2.439 -8.403 1.00 0.95 H new ATOM 0 HB VAL A 33 19.052 4.754 -7.160 1.00 0.99 H new ATOM 0 HG11 VAL A 33 19.974 6.072 -9.022 1.00 1.06 H new ATOM 0 HG12 VAL A 33 21.254 5.417 -7.974 1.00 1.06 H new ATOM 0 HG13 VAL A 33 20.918 4.659 -9.549 1.00 1.06 H new ATOM 0 HG21 VAL A 33 17.858 4.856 -9.312 1.00 0.98 H new ATOM 0 HG22 VAL A 33 18.708 3.387 -9.847 1.00 0.98 H new ATOM 0 HG23 VAL A 33 17.580 3.312 -8.472 1.00 0.98 H new ATOM 563 N VAL A 34 20.796 3.588 -5.303 1.00 0.98 N ATOM 564 CA VAL A 34 21.730 3.921 -4.230 1.00 1.02 C ATOM 565 C VAL A 34 22.683 2.754 -3.986 1.00 1.02 C ATOM 566 O VAL A 34 23.876 2.946 -3.755 1.00 1.04 O ATOM 567 CB VAL A 34 20.988 4.256 -2.914 1.00 1.07 C ATOM 568 CG1 VAL A 34 21.976 4.579 -1.801 1.00 1.14 C ATOM 569 CG2 VAL A 34 20.028 5.415 -3.118 1.00 1.08 C ATOM 0 H VAL A 34 19.814 3.615 -5.030 1.00 0.98 H new ATOM 0 HA VAL A 34 22.291 4.802 -4.543 1.00 1.02 H new ATOM 0 HB VAL A 34 20.414 3.378 -2.620 1.00 1.07 H new ATOM 0 HG11 VAL A 34 21.431 4.811 -0.886 1.00 1.14 H new ATOM 0 HG12 VAL A 34 22.624 3.720 -1.629 1.00 1.14 H new ATOM 0 HG13 VAL A 34 22.582 5.438 -2.090 1.00 1.14 H new ATOM 0 HG21 VAL A 34 19.517 5.634 -2.180 1.00 1.08 H new ATOM 0 HG22 VAL A 34 20.584 6.295 -3.442 1.00 1.08 H new ATOM 0 HG23 VAL A 34 19.293 5.149 -3.878 1.00 1.08 H new ATOM 579 N LYS A 35 22.141 1.545 -4.071 1.00 1.00 N ATOM 580 CA LYS A 35 22.915 0.328 -3.879 1.00 1.02 C ATOM 581 C LYS A 35 24.028 0.231 -4.923 1.00 1.01 C ATOM 582 O LYS A 35 25.160 -0.137 -4.614 1.00 1.04 O ATOM 583 CB LYS A 35 21.987 -0.884 -3.981 1.00 1.02 C ATOM 584 CG LYS A 35 22.685 -2.230 -3.854 1.00 1.06 C ATOM 585 CD LYS A 35 21.680 -3.363 -3.914 1.00 1.23 C ATOM 586 CE LYS A 35 22.360 -4.717 -4.015 1.00 1.45 C ATOM 587 NZ LYS A 35 21.368 -5.818 -4.105 1.00 1.92 N ATOM 0 H LYS A 35 21.155 1.382 -4.275 1.00 1.00 H new ATOM 0 HA LYS A 35 23.375 0.350 -2.891 1.00 1.02 H new ATOM 0 HB2 LYS A 35 21.227 -0.809 -3.203 1.00 1.02 H new ATOM 0 HB3 LYS A 35 21.468 -0.848 -4.939 1.00 1.02 H new ATOM 0 HG2 LYS A 35 23.416 -2.343 -4.655 1.00 1.06 H new ATOM 0 HG3 LYS A 35 23.234 -2.273 -2.913 1.00 1.06 H new ATOM 0 HD2 LYS A 35 21.051 -3.338 -3.024 1.00 1.23 H new ATOM 0 HD3 LYS A 35 21.024 -3.221 -4.773 1.00 1.23 H new ATOM 0 HE2 LYS A 35 23.007 -4.736 -4.892 1.00 1.45 H new ATOM 0 HE3 LYS A 35 22.998 -4.871 -3.145 1.00 1.45 H new ATOM 0 HZ1 LYS A 35 21.865 -6.729 -4.173 1.00 1.92 H new ATOM 0 HZ2 LYS A 35 20.767 -5.814 -3.256 1.00 1.92 H new ATOM 0 HZ3 LYS A 35 20.776 -5.683 -4.949 1.00 1.92 H new ATOM 601 N GLU A 36 23.690 0.583 -6.158 1.00 0.99 N ATOM 602 CA GLU A 36 24.645 0.545 -7.261 1.00 1.00 C ATOM 603 C GLU A 36 25.720 1.622 -7.092 1.00 0.99 C ATOM 604 O GLU A 36 26.888 1.408 -7.422 1.00 1.01 O ATOM 605 CB GLU A 36 23.905 0.757 -8.588 1.00 1.03 C ATOM 606 CG GLU A 36 24.715 0.379 -9.820 1.00 1.31 C ATOM 607 CD GLU A 36 25.049 -1.096 -9.871 1.00 1.41 C ATOM 608 OE1 GLU A 36 24.121 -1.924 -9.782 1.00 1.71 O ATOM 609 OE2 GLU A 36 26.247 -1.430 -9.996 1.00 1.44 O ATOM 0 H GLU A 36 22.757 0.900 -6.422 1.00 0.99 H new ATOM 0 HA GLU A 36 25.133 -0.430 -7.262 1.00 1.00 H new ATOM 0 HB2 GLU A 36 22.986 0.171 -8.577 1.00 1.03 H new ATOM 0 HB3 GLU A 36 23.614 1.804 -8.666 1.00 1.03 H new ATOM 0 HG2 GLU A 36 24.156 0.652 -10.715 1.00 1.31 H new ATOM 0 HG3 GLU A 36 25.639 0.957 -9.833 1.00 1.31 H new ATOM 616 N SER A 37 25.334 2.770 -6.563 1.00 0.00 N ATOM 617 CA SER A 37 26.226 3.909 -6.367 1.00 0.00 C ATOM 618 C SER A 37 27.266 3.606 -5.313 1.00 0.00 C ATOM 619 O SER A 37 28.467 3.780 -5.544 1.00 0.00 O ATOM 620 CB SER A 37 25.422 5.187 -6.023 1.00 0.00 C ATOM 621 OG SER A 37 24.600 5.636 -7.106 1.00 0.00 O ATOM 0 H SER A 37 24.378 2.944 -6.252 1.00 0.00 H new ATOM 0 HA SER A 37 26.753 4.094 -7.303 1.00 0.00 H new ATOM 0 HB2 SER A 37 24.794 4.992 -5.153 1.00 0.00 H new ATOM 0 HB3 SER A 37 26.114 5.982 -5.745 1.00 0.00 H new ATOM 0 HG SER A 37 23.821 5.048 -7.191 1.00 0.00 H new ATOM 627 N VAL A 38 26.827 3.219 -4.114 1.00 1.03 N ATOM 628 CA VAL A 38 27.729 2.954 -2.991 1.00 1.06 C ATOM 629 C VAL A 38 28.747 1.864 -3.317 1.00 1.07 C ATOM 630 O VAL A 38 29.853 1.860 -2.775 1.00 1.09 O ATOM 631 CB VAL A 38 26.968 2.569 -1.703 1.00 1.10 C ATOM 632 CG1 VAL A 38 26.144 3.743 -1.200 1.00 1.12 C ATOM 633 CG2 VAL A 38 26.085 1.349 -1.920 1.00 1.10 C ATOM 0 H VAL A 38 25.841 3.081 -3.894 1.00 1.03 H new ATOM 0 HA VAL A 38 28.258 3.891 -2.816 1.00 1.06 H new ATOM 0 HB VAL A 38 27.708 2.311 -0.945 1.00 1.10 H new ATOM 0 HG11 VAL A 38 25.615 3.454 -0.292 1.00 1.12 H new ATOM 0 HG12 VAL A 38 26.803 4.584 -0.983 1.00 1.12 H new ATOM 0 HG13 VAL A 38 25.423 4.035 -1.963 1.00 1.12 H new ATOM 0 HG21 VAL A 38 25.565 1.107 -0.993 1.00 1.10 H new ATOM 0 HG22 VAL A 38 25.355 1.562 -2.701 1.00 1.10 H new ATOM 0 HG23 VAL A 38 26.702 0.502 -2.222 1.00 1.10 H new ATOM 643 N ASN A 39 28.372 0.951 -4.205 1.00 1.05 N ATOM 644 CA ASN A 39 29.258 -0.142 -4.600 1.00 1.08 C ATOM 645 C ASN A 39 30.499 0.400 -5.294 1.00 1.07 C ATOM 646 O ASN A 39 31.626 0.127 -4.880 1.00 1.10 O ATOM 647 CB ASN A 39 28.533 -1.115 -5.535 1.00 1.10 C ATOM 648 CG ASN A 39 27.688 -2.131 -4.789 1.00 1.41 C ATOM 649 OD1 ASN A 39 28.010 -2.526 -3.670 1.00 1.68 O ATOM 650 ND2 ASN A 39 26.608 -2.574 -5.413 1.00 1.72 N ATOM 0 H ASN A 39 27.462 0.944 -4.666 1.00 1.05 H new ATOM 0 HA ASN A 39 29.557 -0.674 -3.697 1.00 1.08 H new ATOM 0 HB2 ASN A 39 27.896 -0.550 -6.216 1.00 1.10 H new ATOM 0 HB3 ASN A 39 29.268 -1.639 -6.146 1.00 1.10 H new ATOM 0 HD21 ASN A 39 26.009 -3.268 -4.966 1.00 1.72 H new ATOM 0 HD22 ASN A 39 26.375 -2.221 -6.341 1.00 1.72 H new ATOM 657 N GLU A 40 30.282 1.213 -6.318 1.00 1.06 N ATOM 658 CA GLU A 40 31.383 1.788 -7.081 1.00 1.08 C ATOM 659 C GLU A 40 32.113 2.856 -6.270 1.00 1.06 C ATOM 660 O GLU A 40 33.333 3.012 -6.377 1.00 1.09 O ATOM 661 CB GLU A 40 30.858 2.385 -8.386 1.00 1.11 C ATOM 662 CG GLU A 40 31.479 1.770 -9.628 1.00 1.33 C ATOM 663 CD GLU A 40 32.933 2.160 -9.808 1.00 1.77 C ATOM 664 OE1 GLU A 40 33.200 3.300 -10.245 1.00 2.13 O ATOM 665 OE2 GLU A 40 33.818 1.333 -9.518 1.00 2.31 O ATOM 0 H GLU A 40 29.355 1.490 -6.640 1.00 1.06 H new ATOM 0 HA GLU A 40 32.092 0.993 -7.310 1.00 1.08 H new ATOM 0 HB2 GLU A 40 29.777 2.253 -8.427 1.00 1.11 H new ATOM 0 HB3 GLU A 40 31.049 3.458 -8.388 1.00 1.11 H new ATOM 0 HG2 GLU A 40 31.403 0.684 -9.568 1.00 1.33 H new ATOM 0 HG3 GLU A 40 30.912 2.081 -10.505 1.00 1.33 H new ATOM 672 N LEU A 41 31.358 3.569 -5.447 1.00 1.04 N ATOM 673 CA LEU A 41 31.904 4.630 -4.612 1.00 1.05 C ATOM 674 C LEU A 41 32.926 4.071 -3.630 1.00 1.08 C ATOM 675 O LEU A 41 33.971 4.679 -3.399 1.00 1.12 O ATOM 676 CB LEU A 41 30.776 5.332 -3.852 1.00 1.04 C ATOM 677 CG LEU A 41 31.158 6.653 -3.183 1.00 1.04 C ATOM 678 CD1 LEU A 41 31.470 7.714 -4.228 1.00 1.19 C ATOM 679 CD2 LEU A 41 30.042 7.122 -2.261 1.00 1.07 C ATOM 0 H LEU A 41 30.353 3.430 -5.339 1.00 1.04 H new ATOM 0 HA LEU A 41 32.405 5.353 -5.256 1.00 1.05 H new ATOM 0 HB2 LEU A 41 29.956 5.519 -4.545 1.00 1.04 H new ATOM 0 HB3 LEU A 41 30.399 4.653 -3.087 1.00 1.04 H new ATOM 0 HG LEU A 41 32.055 6.490 -2.586 1.00 1.04 H new ATOM 0 HD11 LEU A 41 31.739 8.646 -3.731 1.00 1.19 H new ATOM 0 HD12 LEU A 41 32.302 7.380 -4.849 1.00 1.19 H new ATOM 0 HD13 LEU A 41 30.593 7.877 -4.854 1.00 1.19 H new ATOM 0 HD21 LEU A 41 30.329 8.063 -1.792 1.00 1.07 H new ATOM 0 HD22 LEU A 41 29.130 7.268 -2.839 1.00 1.07 H new ATOM 0 HD23 LEU A 41 29.867 6.371 -1.490 1.00 1.07 H new ATOM 691 N SER A 42 32.627 2.906 -3.067 1.00 1.07 N ATOM 692 CA SER A 42 33.525 2.266 -2.117 1.00 1.12 C ATOM 693 C SER A 42 34.815 1.823 -2.804 1.00 1.16 C ATOM 694 O SER A 42 35.893 1.884 -2.212 1.00 1.20 O ATOM 695 CB SER A 42 32.840 1.068 -1.459 1.00 1.13 C ATOM 696 OG SER A 42 31.674 1.471 -0.761 1.00 1.47 O ATOM 0 H SER A 42 31.769 2.386 -3.253 1.00 1.07 H new ATOM 0 HA SER A 42 33.778 2.993 -1.346 1.00 1.12 H new ATOM 0 HB2 SER A 42 32.577 0.332 -2.219 1.00 1.13 H new ATOM 0 HB3 SER A 42 33.531 0.582 -0.770 1.00 1.13 H new ATOM 0 HG SER A 42 30.987 1.746 -1.403 1.00 1.47 H new ATOM 702 N GLU A 43 34.699 1.390 -4.055 1.00 1.16 N ATOM 703 CA GLU A 43 35.861 0.946 -4.817 1.00 1.22 C ATOM 704 C GLU A 43 36.803 2.113 -5.097 1.00 1.21 C ATOM 705 O GLU A 43 38.020 1.944 -5.164 1.00 1.25 O ATOM 706 CB GLU A 43 35.420 0.297 -6.130 1.00 1.27 C ATOM 707 CG GLU A 43 34.446 -0.859 -5.946 1.00 1.60 C ATOM 708 CD GLU A 43 34.899 -1.847 -4.890 1.00 1.71 C ATOM 709 OE1 GLU A 43 35.614 -2.811 -5.234 1.00 1.98 O ATOM 710 OE2 GLU A 43 34.547 -1.666 -3.707 1.00 1.94 O ATOM 0 H GLU A 43 33.815 1.337 -4.562 1.00 1.16 H new ATOM 0 HA GLU A 43 36.397 0.207 -4.222 1.00 1.22 H new ATOM 0 HB2 GLU A 43 34.955 1.055 -6.761 1.00 1.27 H new ATOM 0 HB3 GLU A 43 36.301 -0.063 -6.661 1.00 1.27 H new ATOM 0 HG2 GLU A 43 33.468 -0.464 -5.671 1.00 1.60 H new ATOM 0 HG3 GLU A 43 34.324 -1.380 -6.896 1.00 1.60 H new ATOM 717 N LYS A 44 36.235 3.301 -5.238 1.00 1.18 N ATOM 718 CA LYS A 44 37.022 4.497 -5.513 1.00 1.20 C ATOM 719 C LYS A 44 37.600 5.082 -4.227 1.00 1.20 C ATOM 720 O LYS A 44 38.593 5.811 -4.256 1.00 1.25 O ATOM 721 CB LYS A 44 36.163 5.544 -6.227 1.00 1.22 C ATOM 722 CG LYS A 44 35.702 5.114 -7.613 1.00 1.25 C ATOM 723 CD LYS A 44 36.867 5.013 -8.582 1.00 1.46 C ATOM 724 CE LYS A 44 36.422 4.490 -9.938 1.00 1.75 C ATOM 725 NZ LYS A 44 35.953 3.082 -9.858 1.00 2.12 N ATOM 0 H LYS A 44 35.231 3.464 -5.167 1.00 1.18 H new ATOM 0 HA LYS A 44 37.851 4.214 -6.161 1.00 1.20 H new ATOM 0 HB2 LYS A 44 35.288 5.763 -5.614 1.00 1.22 H new ATOM 0 HB3 LYS A 44 36.731 6.470 -6.314 1.00 1.22 H new ATOM 0 HG2 LYS A 44 35.198 4.150 -7.547 1.00 1.25 H new ATOM 0 HG3 LYS A 44 34.973 5.829 -7.993 1.00 1.25 H new ATOM 0 HD2 LYS A 44 37.327 5.994 -8.703 1.00 1.46 H new ATOM 0 HD3 LYS A 44 37.629 4.352 -8.169 1.00 1.46 H new ATOM 0 HE2 LYS A 44 35.620 5.119 -10.325 1.00 1.75 H new ATOM 0 HE3 LYS A 44 37.250 4.558 -10.644 1.00 1.75 H new ATOM 0 HZ1 LYS A 44 36.258 2.566 -10.707 1.00 2.12 H new ATOM 0 HZ2 LYS A 44 36.357 2.629 -9.013 1.00 2.12 H new ATOM 0 HZ3 LYS A 44 34.915 3.065 -9.797 1.00 2.12 H new ATOM 739 N ALA A 45 36.982 4.743 -3.104 1.00 1.17 N ATOM 740 CA ALA A 45 37.421 5.232 -1.800 1.00 1.18 C ATOM 741 C ALA A 45 38.476 4.316 -1.186 1.00 1.18 C ATOM 742 O ALA A 45 39.159 4.686 -0.234 1.00 1.19 O ATOM 743 CB ALA A 45 36.229 5.356 -0.864 1.00 1.21 C ATOM 0 H ALA A 45 36.170 4.127 -3.068 1.00 1.17 H new ATOM 0 HA ALA A 45 37.873 6.213 -1.944 1.00 1.18 H new ATOM 0 HB1 ALA A 45 36.565 5.721 0.106 1.00 1.21 H new ATOM 0 HB2 ALA A 45 35.507 6.056 -1.285 1.00 1.21 H new ATOM 0 HB3 ALA A 45 35.759 4.380 -0.742 1.00 1.21 H new ATOM 749 N LYS A 46 38.617 3.128 -1.758 1.00 1.21 N ATOM 750 CA LYS A 46 39.572 2.138 -1.264 1.00 1.24 C ATOM 751 C LYS A 46 41.016 2.556 -1.526 1.00 1.24 C ATOM 752 O LYS A 46 41.943 2.048 -0.894 1.00 1.27 O ATOM 753 CB LYS A 46 39.311 0.790 -1.939 1.00 1.32 C ATOM 754 CG LYS A 46 39.442 -0.408 -1.010 1.00 1.61 C ATOM 755 CD LYS A 46 38.091 -1.046 -0.718 1.00 2.02 C ATOM 756 CE LYS A 46 37.414 -1.532 -1.990 1.00 2.38 C ATOM 757 NZ LYS A 46 36.167 -2.289 -1.713 1.00 2.75 N ATOM 0 H LYS A 46 38.080 2.823 -2.570 1.00 1.21 H new ATOM 0 HA LYS A 46 39.433 2.058 -0.186 1.00 1.24 H new ATOM 0 HB2 LYS A 46 38.308 0.798 -2.365 1.00 1.32 H new ATOM 0 HB3 LYS A 46 40.008 0.671 -2.768 1.00 1.32 H new ATOM 0 HG2 LYS A 46 40.103 -1.148 -1.461 1.00 1.61 H new ATOM 0 HG3 LYS A 46 39.906 -0.094 -0.075 1.00 1.61 H new ATOM 0 HD2 LYS A 46 38.224 -1.884 -0.033 1.00 2.02 H new ATOM 0 HD3 LYS A 46 37.448 -0.323 -0.216 1.00 2.02 H new ATOM 0 HE2 LYS A 46 37.183 -0.677 -2.625 1.00 2.38 H new ATOM 0 HE3 LYS A 46 38.104 -2.166 -2.547 1.00 2.38 H new ATOM 0 HZ1 LYS A 46 36.298 -3.285 -1.984 1.00 2.75 H new ATOM 0 HZ2 LYS A 46 35.945 -2.232 -0.699 1.00 2.75 H new ATOM 0 HZ3 LYS A 46 35.384 -1.881 -2.262 1.00 2.75 H new ATOM 771 N THR A 47 41.207 3.479 -2.457 1.00 1.23 N ATOM 772 CA THR A 47 42.546 3.934 -2.809 1.00 1.26 C ATOM 773 C THR A 47 42.947 5.206 -2.063 1.00 1.21 C ATOM 774 O THR A 47 43.891 5.894 -2.458 1.00 1.30 O ATOM 775 CB THR A 47 42.646 4.175 -4.323 1.00 1.39 C ATOM 776 OG1 THR A 47 41.386 4.644 -4.832 1.00 1.54 O ATOM 777 CG2 THR A 47 43.040 2.899 -5.041 1.00 1.62 C ATOM 0 H THR A 47 40.455 3.927 -2.981 1.00 1.23 H new ATOM 0 HA THR A 47 43.236 3.144 -2.511 1.00 1.26 H new ATOM 0 HB THR A 47 43.412 4.930 -4.500 1.00 1.39 H new ATOM 0 HG1 THR A 47 41.459 4.797 -5.797 1.00 1.54 H new ATOM 0 HG21 THR A 47 43.106 3.090 -6.112 1.00 1.62 H new ATOM 0 HG22 THR A 47 44.008 2.558 -4.673 1.00 1.62 H new ATOM 0 HG23 THR A 47 42.290 2.130 -4.855 1.00 1.62 H new ATOM 785 N ASP A 48 42.239 5.521 -0.984 1.00 1.15 N ATOM 786 CA ASP A 48 42.539 6.716 -0.200 1.00 1.15 C ATOM 787 C ASP A 48 42.109 6.530 1.252 1.00 1.09 C ATOM 788 O ASP A 48 40.972 6.155 1.518 1.00 1.06 O ATOM 789 CB ASP A 48 41.835 7.935 -0.799 1.00 1.24 C ATOM 790 CG ASP A 48 42.170 9.216 -0.066 1.00 1.32 C ATOM 791 OD1 ASP A 48 43.248 9.789 -0.316 1.00 1.50 O ATOM 792 OD2 ASP A 48 41.346 9.666 0.749 1.00 1.41 O ATOM 0 H ASP A 48 41.457 4.969 -0.632 1.00 1.15 H new ATOM 0 HA ASP A 48 43.616 6.879 -0.226 1.00 1.15 H new ATOM 0 HB2 ASP A 48 42.118 8.035 -1.847 1.00 1.24 H new ATOM 0 HB3 ASP A 48 40.757 7.777 -0.773 1.00 1.24 H new ATOM 797 N PRO A 49 43.020 6.789 2.204 1.00 1.12 N ATOM 798 CA PRO A 49 42.743 6.636 3.640 1.00 1.13 C ATOM 799 C PRO A 49 41.617 7.544 4.134 1.00 1.17 C ATOM 800 O PRO A 49 40.829 7.154 4.997 1.00 1.18 O ATOM 801 CB PRO A 49 44.071 7.012 4.310 1.00 1.22 C ATOM 802 CG PRO A 49 44.823 7.788 3.287 1.00 1.25 C ATOM 803 CD PRO A 49 44.398 7.244 1.954 1.00 1.19 C ATOM 0 HA PRO A 49 42.403 5.627 3.872 1.00 1.13 H new ATOM 0 HB2 PRO A 49 43.904 7.606 5.209 1.00 1.22 H new ATOM 0 HB3 PRO A 49 44.624 6.123 4.614 1.00 1.22 H new ATOM 0 HG2 PRO A 49 44.599 8.852 3.363 1.00 1.25 H new ATOM 0 HG3 PRO A 49 45.898 7.678 3.428 1.00 1.25 H new ATOM 0 HD2 PRO A 49 44.436 8.007 1.176 1.00 1.19 H new ATOM 0 HD3 PRO A 49 45.040 6.425 1.629 1.00 1.19 H new ATOM 811 N GLN A 50 41.543 8.753 3.591 1.00 1.23 N ATOM 812 CA GLN A 50 40.509 9.698 3.987 1.00 1.30 C ATOM 813 C GLN A 50 39.170 9.289 3.389 1.00 1.21 C ATOM 814 O GLN A 50 38.152 9.264 4.079 1.00 1.22 O ATOM 815 CB GLN A 50 40.880 11.115 3.545 1.00 1.43 C ATOM 816 CG GLN A 50 41.408 11.992 4.672 1.00 1.59 C ATOM 817 CD GLN A 50 42.388 11.266 5.577 1.00 1.77 C ATOM 818 OE1 GLN A 50 41.998 10.677 6.587 1.00 2.00 O ATOM 819 NE2 GLN A 50 43.663 11.299 5.224 1.00 1.96 N ATOM 0 H GLN A 50 42.184 9.100 2.878 1.00 1.23 H new ATOM 0 HA GLN A 50 40.425 9.689 5.074 1.00 1.30 H new ATOM 0 HB2 GLN A 50 41.634 11.055 2.760 1.00 1.43 H new ATOM 0 HB3 GLN A 50 40.002 11.591 3.108 1.00 1.43 H new ATOM 0 HG2 GLN A 50 41.896 12.868 4.245 1.00 1.59 H new ATOM 0 HG3 GLN A 50 40.570 12.353 5.268 1.00 1.59 H new ATOM 0 HE21 GLN A 50 43.946 11.798 4.380 1.00 1.96 H new ATOM 0 HE22 GLN A 50 44.363 10.826 5.796 1.00 1.96 H new ATOM 828 N ALA A 51 39.185 8.946 2.105 1.00 1.16 N ATOM 829 CA ALA A 51 37.981 8.525 1.406 1.00 1.11 C ATOM 830 C ALA A 51 37.402 7.267 2.039 1.00 1.02 C ATOM 831 O ALA A 51 36.185 7.120 2.146 1.00 1.00 O ATOM 832 CB ALA A 51 38.271 8.290 -0.067 1.00 1.15 C ATOM 0 H ALA A 51 40.025 8.952 1.526 1.00 1.16 H new ATOM 0 HA ALA A 51 37.244 9.323 1.490 1.00 1.11 H new ATOM 0 HB1 ALA A 51 37.358 7.976 -0.572 1.00 1.15 H new ATOM 0 HB2 ALA A 51 38.636 9.213 -0.518 1.00 1.15 H new ATOM 0 HB3 ALA A 51 39.028 7.512 -0.169 1.00 1.15 H new ATOM 838 N ALA A 52 38.280 6.362 2.458 1.00 1.01 N ATOM 839 CA ALA A 52 37.860 5.126 3.101 1.00 1.01 C ATOM 840 C ALA A 52 37.086 5.435 4.376 1.00 1.04 C ATOM 841 O ALA A 52 36.093 4.777 4.685 1.00 1.05 O ATOM 842 CB ALA A 52 39.065 4.250 3.406 1.00 1.07 C ATOM 0 H ALA A 52 39.290 6.464 2.362 1.00 1.01 H new ATOM 0 HA ALA A 52 37.205 4.582 2.420 1.00 1.01 H new ATOM 0 HB1 ALA A 52 38.733 3.330 3.887 1.00 1.07 H new ATOM 0 HB2 ALA A 52 39.583 4.008 2.478 1.00 1.07 H new ATOM 0 HB3 ALA A 52 39.743 4.783 4.072 1.00 1.07 H new ATOM 848 N GLU A 53 37.538 6.453 5.101 1.00 1.10 N ATOM 849 CA GLU A 53 36.875 6.868 6.331 1.00 1.20 C ATOM 850 C GLU A 53 35.538 7.537 6.001 1.00 1.18 C ATOM 851 O GLU A 53 34.581 7.461 6.772 1.00 1.23 O ATOM 852 CB GLU A 53 37.784 7.807 7.130 1.00 1.32 C ATOM 853 CG GLU A 53 37.133 8.438 8.356 1.00 1.52 C ATOM 854 CD GLU A 53 36.403 7.449 9.242 1.00 1.64 C ATOM 855 OE1 GLU A 53 37.024 6.465 9.689 1.00 1.87 O ATOM 856 OE2 GLU A 53 35.199 7.664 9.497 1.00 1.65 O ATOM 0 H GLU A 53 38.360 7.005 4.858 1.00 1.10 H new ATOM 0 HA GLU A 53 36.675 5.991 6.947 1.00 1.20 H new ATOM 0 HB2 GLU A 53 38.665 7.251 7.450 1.00 1.32 H new ATOM 0 HB3 GLU A 53 38.131 8.602 6.470 1.00 1.32 H new ATOM 0 HG2 GLU A 53 37.901 8.940 8.945 1.00 1.52 H new ATOM 0 HG3 GLU A 53 36.431 9.204 8.028 1.00 1.52 H new ATOM 863 N LYS A 54 35.464 8.178 4.845 1.00 1.14 N ATOM 864 CA LYS A 54 34.228 8.828 4.423 1.00 1.15 C ATOM 865 C LYS A 54 33.125 7.785 4.273 1.00 1.06 C ATOM 866 O LYS A 54 31.987 7.996 4.689 1.00 1.08 O ATOM 867 CB LYS A 54 34.430 9.565 3.102 1.00 1.20 C ATOM 868 CG LYS A 54 35.393 10.736 3.198 1.00 1.43 C ATOM 869 CD LYS A 54 35.579 11.422 1.853 1.00 1.56 C ATOM 870 CE LYS A 54 34.313 12.128 1.408 1.00 1.86 C ATOM 871 NZ LYS A 54 34.486 12.785 0.089 1.00 2.25 N ATOM 0 H LYS A 54 36.237 8.263 4.185 1.00 1.14 H new ATOM 0 HA LYS A 54 33.939 9.555 5.182 1.00 1.15 H new ATOM 0 HB2 LYS A 54 34.800 8.861 2.356 1.00 1.20 H new ATOM 0 HB3 LYS A 54 33.465 9.927 2.747 1.00 1.20 H new ATOM 0 HG2 LYS A 54 35.019 11.456 3.925 1.00 1.43 H new ATOM 0 HG3 LYS A 54 36.358 10.385 3.564 1.00 1.43 H new ATOM 0 HD2 LYS A 54 36.394 12.143 1.921 1.00 1.56 H new ATOM 0 HD3 LYS A 54 35.868 10.684 1.104 1.00 1.56 H new ATOM 0 HE2 LYS A 54 33.496 11.409 1.352 1.00 1.86 H new ATOM 0 HE3 LYS A 54 34.031 12.873 2.152 1.00 1.86 H new ATOM 0 HZ1 LYS A 54 33.600 13.257 -0.182 1.00 2.25 H new ATOM 0 HZ2 LYS A 54 35.249 13.489 0.149 1.00 2.25 H new ATOM 0 HZ3 LYS A 54 34.730 12.070 -0.626 1.00 2.25 H new ATOM 885 N LEU A 55 33.485 6.649 3.693 1.00 0.98 N ATOM 886 CA LEU A 55 32.543 5.554 3.503 1.00 0.95 C ATOM 887 C LEU A 55 32.325 4.825 4.828 1.00 0.98 C ATOM 888 O LEU A 55 31.279 4.220 5.051 1.00 1.00 O ATOM 889 CB LEU A 55 33.064 4.578 2.440 1.00 0.93 C ATOM 890 CG LEU A 55 32.585 4.837 1.006 1.00 1.05 C ATOM 891 CD1 LEU A 55 31.085 4.624 0.897 1.00 1.34 C ATOM 892 CD2 LEU A 55 32.962 6.240 0.549 1.00 1.22 C ATOM 0 H LEU A 55 34.425 6.461 3.345 1.00 0.98 H new ATOM 0 HA LEU A 55 31.592 5.962 3.159 1.00 0.95 H new ATOM 0 HB2 LEU A 55 34.154 4.607 2.450 1.00 0.93 H new ATOM 0 HB3 LEU A 55 32.769 3.568 2.725 1.00 0.93 H new ATOM 0 HG LEU A 55 33.083 4.124 0.350 1.00 1.05 H new ATOM 0 HD11 LEU A 55 30.764 4.812 -0.128 1.00 1.34 H new ATOM 0 HD12 LEU A 55 30.843 3.597 1.170 1.00 1.34 H new ATOM 0 HD13 LEU A 55 30.570 5.310 1.570 1.00 1.34 H new ATOM 0 HD21 LEU A 55 32.611 6.397 -0.471 1.00 1.22 H new ATOM 0 HD22 LEU A 55 32.500 6.974 1.209 1.00 1.22 H new ATOM 0 HD23 LEU A 55 34.046 6.354 0.581 1.00 1.22 H new ATOM 904 N ASN A 56 33.324 4.920 5.705 1.00 1.04 N ATOM 905 CA ASN A 56 33.285 4.280 7.021 1.00 1.14 C ATOM 906 C ASN A 56 32.159 4.870 7.873 1.00 1.19 C ATOM 907 O ASN A 56 31.410 4.145 8.528 1.00 1.25 O ATOM 908 CB ASN A 56 34.634 4.453 7.731 1.00 1.25 C ATOM 909 CG ASN A 56 34.748 3.631 8.997 1.00 1.42 C ATOM 910 OD1 ASN A 56 34.168 2.548 9.105 1.00 1.48 O ATOM 911 ND2 ASN A 56 35.504 4.133 9.960 1.00 1.57 N ATOM 0 H ASN A 56 34.182 5.442 5.524 1.00 1.04 H new ATOM 0 HA ASN A 56 33.092 3.216 6.884 1.00 1.14 H new ATOM 0 HB2 ASN A 56 35.436 4.171 7.049 1.00 1.25 H new ATOM 0 HB3 ASN A 56 34.778 5.506 7.974 1.00 1.25 H new ATOM 0 HD21 ASN A 56 35.625 3.620 10.833 1.00 1.57 H new ATOM 0 HD22 ASN A 56 35.966 5.033 9.829 1.00 1.57 H new ATOM 918 N LYS A 57 32.044 6.193 7.853 1.00 1.20 N ATOM 919 CA LYS A 57 31.005 6.884 8.608 1.00 1.28 C ATOM 920 C LYS A 57 29.671 6.839 7.867 1.00 1.22 C ATOM 921 O LYS A 57 28.614 6.821 8.491 1.00 1.27 O ATOM 922 CB LYS A 57 31.407 8.337 8.896 1.00 1.39 C ATOM 923 CG LYS A 57 31.965 9.086 7.694 1.00 1.52 C ATOM 924 CD LYS A 57 32.158 10.567 7.994 1.00 1.63 C ATOM 925 CE LYS A 57 33.118 10.788 9.158 1.00 1.74 C ATOM 926 NZ LYS A 57 34.467 10.206 8.903 1.00 1.86 N ATOM 0 H LYS A 57 32.658 6.810 7.321 1.00 1.20 H new ATOM 0 HA LYS A 57 30.888 6.366 9.560 1.00 1.28 H new ATOM 0 HB2 LYS A 57 30.536 8.874 9.271 1.00 1.39 H new ATOM 0 HB3 LYS A 57 32.153 8.344 9.691 1.00 1.39 H new ATOM 0 HG2 LYS A 57 32.919 8.646 7.402 1.00 1.52 H new ATOM 0 HG3 LYS A 57 31.288 8.971 6.847 1.00 1.52 H new ATOM 0 HD2 LYS A 57 32.541 11.071 7.106 1.00 1.63 H new ATOM 0 HD3 LYS A 57 31.194 11.019 8.227 1.00 1.63 H new ATOM 0 HE2 LYS A 57 33.217 11.857 9.346 1.00 1.74 H new ATOM 0 HE3 LYS A 57 32.698 10.343 10.060 1.00 1.74 H new ATOM 0 HZ1 LYS A 57 35.157 10.629 9.556 1.00 1.86 H new ATOM 0 HZ2 LYS A 57 34.435 9.177 9.052 1.00 1.86 H new ATOM 0 HZ3 LYS A 57 34.751 10.405 7.923 1.00 1.86 H new ATOM 940 N LEU A 58 29.732 6.830 6.536 1.00 1.12 N ATOM 941 CA LEU A 58 28.529 6.787 5.705 1.00 1.10 C ATOM 942 C LEU A 58 27.736 5.506 5.957 1.00 1.08 C ATOM 943 O LEU A 58 26.540 5.549 6.253 1.00 1.11 O ATOM 944 CB LEU A 58 28.905 6.874 4.220 1.00 1.06 C ATOM 945 CG LEU A 58 28.271 8.032 3.439 1.00 1.22 C ATOM 946 CD1 LEU A 58 26.757 7.937 3.461 1.00 1.35 C ATOM 947 CD2 LEU A 58 28.735 9.373 3.988 1.00 1.39 C ATOM 0 H LEU A 58 30.605 6.852 6.008 1.00 1.12 H new ATOM 0 HA LEU A 58 27.907 7.641 5.971 1.00 1.10 H new ATOM 0 HB2 LEU A 58 29.989 6.959 4.143 1.00 1.06 H new ATOM 0 HB3 LEU A 58 28.624 5.938 3.738 1.00 1.06 H new ATOM 0 HG LEU A 58 28.599 7.957 2.402 1.00 1.22 H new ATOM 0 HD11 LEU A 58 26.332 8.770 2.900 1.00 1.35 H new ATOM 0 HD12 LEU A 58 26.445 6.997 3.007 1.00 1.35 H new ATOM 0 HD13 LEU A 58 26.405 7.976 4.492 1.00 1.35 H new ATOM 0 HD21 LEU A 58 28.272 10.179 3.418 1.00 1.39 H new ATOM 0 HD22 LEU A 58 28.446 9.457 5.036 1.00 1.39 H new ATOM 0 HD23 LEU A 58 29.819 9.445 3.904 1.00 1.39 H new ATOM 959 N ILE A 59 28.414 4.368 5.843 1.00 1.07 N ATOM 960 CA ILE A 59 27.778 3.071 6.055 1.00 1.12 C ATOM 961 C ILE A 59 27.304 2.935 7.498 1.00 1.22 C ATOM 962 O ILE A 59 26.276 2.319 7.765 1.00 1.28 O ATOM 963 CB ILE A 59 28.716 1.895 5.683 1.00 1.15 C ATOM 964 CG1 ILE A 59 27.933 0.581 5.631 1.00 1.28 C ATOM 965 CG2 ILE A 59 29.879 1.778 6.663 1.00 1.26 C ATOM 966 CD1 ILE A 59 26.952 0.492 4.478 1.00 1.39 C ATOM 0 H ILE A 59 29.405 4.317 5.605 1.00 1.07 H new ATOM 0 HA ILE A 59 26.915 3.023 5.392 1.00 1.12 H new ATOM 0 HB ILE A 59 29.129 2.100 4.695 1.00 1.15 H new ATOM 0 HG12 ILE A 59 28.638 -0.247 5.559 1.00 1.28 H new ATOM 0 HG13 ILE A 59 27.389 0.457 6.567 1.00 1.28 H new ATOM 0 HG21 ILE A 59 30.517 0.943 6.373 1.00 1.26 H new ATOM 0 HG22 ILE A 59 30.460 2.700 6.650 1.00 1.26 H new ATOM 0 HG23 ILE A 59 29.492 1.607 7.668 1.00 1.26 H new ATOM 0 HD11 ILE A 59 26.437 -0.468 4.511 1.00 1.39 H new ATOM 0 HD12 ILE A 59 26.222 1.298 4.558 1.00 1.39 H new ATOM 0 HD13 ILE A 59 27.490 0.583 3.535 1.00 1.39 H new ATOM 978 N GLU A 60 28.063 3.519 8.420 1.00 1.27 N ATOM 979 CA GLU A 60 27.718 3.479 9.831 1.00 1.41 C ATOM 980 C GLU A 60 26.405 4.213 10.069 1.00 1.39 C ATOM 981 O GLU A 60 25.563 3.766 10.852 1.00 1.49 O ATOM 982 CB GLU A 60 28.835 4.111 10.655 1.00 1.52 C ATOM 983 CG GLU A 60 28.601 4.054 12.150 1.00 1.73 C ATOM 984 CD GLU A 60 29.579 4.923 12.904 1.00 2.09 C ATOM 985 OE1 GLU A 60 29.341 6.143 13.003 1.00 2.28 O ATOM 986 OE2 GLU A 60 30.601 4.395 13.381 1.00 2.61 O ATOM 0 H GLU A 60 28.923 4.026 8.211 1.00 1.27 H new ATOM 0 HA GLU A 60 27.597 2.441 10.139 1.00 1.41 H new ATOM 0 HB2 GLU A 60 29.773 3.607 10.424 1.00 1.52 H new ATOM 0 HB3 GLU A 60 28.950 5.152 10.354 1.00 1.52 H new ATOM 0 HG2 GLU A 60 27.583 4.376 12.371 1.00 1.73 H new ATOM 0 HG3 GLU A 60 28.691 3.023 12.493 1.00 1.73 H new ATOM 993 N GLY A 61 26.233 5.332 9.373 1.00 1.30 N ATOM 994 CA GLY A 61 25.020 6.115 9.500 1.00 1.30 C ATOM 995 C GLY A 61 23.809 5.364 8.993 1.00 1.26 C ATOM 996 O GLY A 61 22.706 5.538 9.507 1.00 1.27 O ATOM 0 H GLY A 61 26.918 5.712 8.719 1.00 1.30 H new ATOM 0 HA2 GLY A 61 24.869 6.384 10.545 1.00 1.30 H new ATOM 0 HA3 GLY A 61 25.129 7.046 8.944 1.00 1.30 H new ATOM 1000 N TYR A 62 24.018 4.511 7.993 1.00 1.25 N ATOM 1001 CA TYR A 62 22.934 3.719 7.426 1.00 1.31 C ATOM 1002 C TYR A 62 22.440 2.690 8.435 1.00 1.43 C ATOM 1003 O TYR A 62 21.243 2.419 8.522 1.00 1.47 O ATOM 1004 CB TYR A 62 23.389 3.021 6.143 1.00 1.39 C ATOM 1005 CG TYR A 62 23.339 3.913 4.919 1.00 1.59 C ATOM 1006 CD1 TYR A 62 22.173 4.582 4.573 1.00 2.03 C ATOM 1007 CD2 TYR A 62 24.457 4.087 4.111 1.00 2.27 C ATOM 1008 CE1 TYR A 62 22.121 5.398 3.460 1.00 2.60 C ATOM 1009 CE2 TYR A 62 24.412 4.901 2.995 1.00 2.80 C ATOM 1010 CZ TYR A 62 23.243 5.553 2.674 1.00 2.80 C ATOM 1011 OH TYR A 62 23.194 6.361 1.562 1.00 3.54 O ATOM 0 H TYR A 62 24.928 4.352 7.560 1.00 1.25 H new ATOM 0 HA TYR A 62 22.113 4.393 7.182 1.00 1.31 H new ATOM 0 HB2 TYR A 62 24.408 2.659 6.278 1.00 1.39 H new ATOM 0 HB3 TYR A 62 22.760 2.147 5.972 1.00 1.39 H new ATOM 0 HD1 TYR A 62 21.291 4.462 5.185 1.00 2.03 H new ATOM 0 HD2 TYR A 62 25.376 3.577 4.360 1.00 2.27 H new ATOM 0 HE1 TYR A 62 21.206 5.912 3.207 1.00 2.60 H new ATOM 0 HE2 TYR A 62 25.290 5.025 2.378 1.00 2.80 H new ATOM 0 HH TYR A 62 24.069 6.362 1.120 1.00 3.54 H new ATOM 1021 N THR A 63 23.368 2.116 9.193 1.00 1.55 N ATOM 1022 CA THR A 63 23.015 1.131 10.207 1.00 1.74 C ATOM 1023 C THR A 63 22.198 1.776 11.324 1.00 1.68 C ATOM 1024 O THR A 63 21.266 1.178 11.863 1.00 1.81 O ATOM 1025 CB THR A 63 24.270 0.476 10.808 1.00 1.96 C ATOM 1026 OG1 THR A 63 25.450 1.120 10.310 1.00 2.00 O ATOM 1027 CG2 THR A 63 24.321 -1.003 10.468 1.00 2.37 C ATOM 0 H THR A 63 24.366 2.315 9.125 1.00 1.55 H new ATOM 0 HA THR A 63 22.416 0.362 9.719 1.00 1.74 H new ATOM 0 HB THR A 63 24.224 0.587 11.891 1.00 1.96 H new ATOM 0 HG1 THR A 63 25.496 2.034 10.660 1.00 2.00 H new ATOM 0 HG21 THR A 63 25.217 -1.446 10.903 1.00 2.37 H new ATOM 0 HG22 THR A 63 23.438 -1.500 10.871 1.00 2.37 H new ATOM 0 HG23 THR A 63 24.344 -1.127 9.385 1.00 2.37 H new ATOM 1035 N TYR A 64 22.545 3.014 11.651 1.00 1.56 N ATOM 1036 CA TYR A 64 21.843 3.759 12.688 1.00 1.61 C ATOM 1037 C TYR A 64 20.755 4.615 12.053 1.00 1.32 C ATOM 1038 O TYR A 64 20.411 5.690 12.559 1.00 1.40 O ATOM 1039 CB TYR A 64 22.818 4.646 13.467 1.00 1.89 C ATOM 1040 CG TYR A 64 23.831 3.872 14.282 1.00 2.36 C ATOM 1041 CD1 TYR A 64 23.430 3.045 15.325 1.00 2.88 C ATOM 1042 CD2 TYR A 64 25.189 3.963 14.005 1.00 2.94 C ATOM 1043 CE1 TYR A 64 24.353 2.335 16.066 1.00 3.56 C ATOM 1044 CE2 TYR A 64 26.117 3.255 14.743 1.00 3.61 C ATOM 1045 CZ TYR A 64 25.693 2.443 15.771 1.00 3.79 C ATOM 1046 OH TYR A 64 26.615 1.739 16.512 1.00 4.61 O ATOM 0 H TYR A 64 23.311 3.525 11.212 1.00 1.56 H new ATOM 0 HA TYR A 64 21.390 3.052 13.383 1.00 1.61 H new ATOM 0 HB2 TYR A 64 23.347 5.291 12.766 1.00 1.89 H new ATOM 0 HB3 TYR A 64 22.250 5.296 14.133 1.00 1.89 H new ATOM 0 HD1 TYR A 64 22.379 2.957 15.559 1.00 2.88 H new ATOM 0 HD2 TYR A 64 25.525 4.598 13.199 1.00 2.94 H new ATOM 0 HE1 TYR A 64 24.025 1.697 16.874 1.00 3.56 H new ATOM 0 HE2 TYR A 64 27.169 3.338 14.515 1.00 3.61 H new ATOM 0 HH TYR A 64 27.516 1.925 16.175 1.00 4.61 H new ATOM 1056 N GLY A 65 20.227 4.129 10.937 1.00 1.16 N ATOM 1057 CA GLY A 65 19.187 4.833 10.222 1.00 1.08 C ATOM 1058 C GLY A 65 17.860 4.791 10.947 1.00 1.03 C ATOM 1059 O GLY A 65 17.017 3.934 10.670 1.00 1.02 O ATOM 0 H GLY A 65 20.508 3.246 10.511 1.00 1.16 H new ATOM 0 HA2 GLY A 65 19.487 5.871 10.079 1.00 1.08 H new ATOM 0 HA3 GLY A 65 19.071 4.395 9.231 1.00 1.08 H new ATOM 1063 N GLU A 66 17.674 5.706 11.888 1.00 1.04 N ATOM 1064 CA GLU A 66 16.441 5.777 12.651 1.00 1.03 C ATOM 1065 C GLU A 66 15.277 6.160 11.746 1.00 0.98 C ATOM 1066 O GLU A 66 14.127 5.792 12.007 1.00 0.98 O ATOM 1067 CB GLU A 66 16.580 6.777 13.801 1.00 1.10 C ATOM 1068 CG GLU A 66 17.179 6.175 15.059 1.00 1.55 C ATOM 1069 CD GLU A 66 16.399 4.969 15.533 1.00 1.48 C ATOM 1070 OE1 GLU A 66 15.301 5.152 16.094 1.00 1.79 O ATOM 1071 OE2 GLU A 66 16.865 3.832 15.323 1.00 1.73 O ATOM 0 H GLU A 66 18.366 6.411 12.140 1.00 1.04 H new ATOM 0 HA GLU A 66 16.239 4.793 13.074 1.00 1.03 H new ATOM 0 HB2 GLU A 66 17.203 7.610 13.474 1.00 1.10 H new ATOM 0 HB3 GLU A 66 15.598 7.187 14.036 1.00 1.10 H new ATOM 0 HG2 GLU A 66 18.212 5.887 14.867 1.00 1.55 H new ATOM 0 HG3 GLU A 66 17.199 6.927 15.848 1.00 1.55 H new ATOM 1078 N GLU A 67 15.574 6.888 10.674 1.00 0.98 N ATOM 1079 CA GLU A 67 14.542 7.285 9.725 1.00 0.98 C ATOM 1080 C GLU A 67 14.178 6.091 8.844 1.00 0.95 C ATOM 1081 O GLU A 67 13.039 5.959 8.404 1.00 0.93 O ATOM 1082 CB GLU A 67 14.971 8.497 8.880 1.00 1.05 C ATOM 1083 CG GLU A 67 16.476 8.703 8.778 1.00 1.33 C ATOM 1084 CD GLU A 67 17.130 7.715 7.844 1.00 1.79 C ATOM 1085 OE1 GLU A 67 17.526 6.629 8.309 1.00 2.46 O ATOM 1086 OE2 GLU A 67 17.237 8.017 6.636 1.00 2.37 O ATOM 0 H GLU A 67 16.513 7.212 10.443 1.00 0.98 H new ATOM 0 HA GLU A 67 13.660 7.598 10.284 1.00 0.98 H new ATOM 0 HB2 GLU A 67 14.565 8.383 7.875 1.00 1.05 H new ATOM 0 HB3 GLU A 67 14.523 9.395 9.305 1.00 1.05 H new ATOM 0 HG2 GLU A 67 16.679 9.716 8.431 1.00 1.33 H new ATOM 0 HG3 GLU A 67 16.921 8.611 9.769 1.00 1.33 H new ATOM 1093 N ARG A 68 15.159 5.222 8.600 1.00 0.97 N ATOM 1094 CA ARG A 68 14.940 4.006 7.823 1.00 0.99 C ATOM 1095 C ARG A 68 13.944 3.122 8.570 1.00 0.96 C ATOM 1096 O ARG A 68 13.101 2.448 7.974 1.00 0.97 O ATOM 1097 CB ARG A 68 16.272 3.270 7.603 1.00 1.06 C ATOM 1098 CG ARG A 68 16.141 1.842 7.079 1.00 1.17 C ATOM 1099 CD ARG A 68 16.188 0.821 8.209 1.00 1.27 C ATOM 1100 NE ARG A 68 16.050 -0.552 7.722 1.00 1.43 N ATOM 1101 CZ ARG A 68 14.880 -1.149 7.473 1.00 1.40 C ATOM 1102 NH1 ARG A 68 13.738 -0.486 7.612 1.00 1.41 N ATOM 1103 NH2 ARG A 68 14.852 -2.409 7.062 1.00 1.70 N ATOM 0 H ARG A 68 16.116 5.340 8.932 1.00 0.97 H new ATOM 0 HA ARG A 68 14.534 4.256 6.843 1.00 0.99 H new ATOM 0 HB2 ARG A 68 16.876 3.845 6.901 1.00 1.06 H new ATOM 0 HB3 ARG A 68 16.817 3.246 8.547 1.00 1.06 H new ATOM 0 HG2 ARG A 68 15.203 1.739 6.534 1.00 1.17 H new ATOM 0 HG3 ARG A 68 16.945 1.639 6.371 1.00 1.17 H new ATOM 0 HD2 ARG A 68 17.131 0.920 8.747 1.00 1.27 H new ATOM 0 HD3 ARG A 68 15.391 1.034 8.921 1.00 1.27 H new ATOM 0 HE ARG A 68 16.902 -1.089 7.562 1.00 1.43 H new ATOM 0 HH11 ARG A 68 13.748 0.489 7.912 1.00 1.41 H new ATOM 0 HH12 ARG A 68 12.851 -0.952 7.419 1.00 1.41 H new ATOM 0 HH21 ARG A 68 15.724 -2.924 6.936 1.00 1.70 H new ATOM 0 HH22 ARG A 68 13.959 -2.864 6.872 1.00 1.70 H new ATOM 1117 N LYS A 69 14.051 3.145 9.889 1.00 0.95 N ATOM 1118 CA LYS A 69 13.167 2.380 10.748 1.00 0.97 C ATOM 1119 C LYS A 69 11.774 2.988 10.706 1.00 0.91 C ATOM 1120 O LYS A 69 10.773 2.276 10.741 1.00 0.92 O ATOM 1121 CB LYS A 69 13.701 2.365 12.179 1.00 1.04 C ATOM 1122 CG LYS A 69 13.138 1.245 13.039 1.00 1.31 C ATOM 1123 CD LYS A 69 13.950 1.061 14.312 1.00 1.43 C ATOM 1124 CE LYS A 69 13.848 2.269 15.226 1.00 1.48 C ATOM 1125 NZ LYS A 69 14.906 2.271 16.266 1.00 1.54 N ATOM 0 H LYS A 69 14.750 3.692 10.391 1.00 0.95 H new ATOM 0 HA LYS A 69 13.119 1.351 10.392 1.00 0.97 H new ATOM 0 HB2 LYS A 69 14.787 2.275 12.149 1.00 1.04 H new ATOM 0 HB3 LYS A 69 13.473 3.321 12.651 1.00 1.04 H new ATOM 0 HG2 LYS A 69 12.102 1.467 13.295 1.00 1.31 H new ATOM 0 HG3 LYS A 69 13.134 0.315 12.471 1.00 1.31 H new ATOM 0 HD2 LYS A 69 13.600 0.174 14.841 1.00 1.43 H new ATOM 0 HD3 LYS A 69 14.995 0.887 14.055 1.00 1.43 H new ATOM 0 HE2 LYS A 69 13.922 3.180 14.632 1.00 1.48 H new ATOM 0 HE3 LYS A 69 12.869 2.279 15.705 1.00 1.48 H new ATOM 0 HZ1 LYS A 69 14.694 3.001 16.976 1.00 1.54 H new ATOM 0 HZ2 LYS A 69 14.941 1.339 16.727 1.00 1.54 H new ATOM 0 HZ3 LYS A 69 15.826 2.474 15.825 1.00 1.54 H new ATOM 1139 N LEU A 70 11.720 4.313 10.613 1.00 0.90 N ATOM 1140 CA LEU A 70 10.452 5.022 10.539 1.00 0.88 C ATOM 1141 C LEU A 70 9.717 4.636 9.263 1.00 0.85 C ATOM 1142 O LEU A 70 8.494 4.552 9.248 1.00 0.85 O ATOM 1143 CB LEU A 70 10.669 6.537 10.586 1.00 0.93 C ATOM 1144 CG LEU A 70 9.391 7.379 10.496 1.00 1.01 C ATOM 1145 CD1 LEU A 70 8.597 7.306 11.790 1.00 1.14 C ATOM 1146 CD2 LEU A 70 9.727 8.822 10.160 1.00 1.15 C ATOM 0 H LEU A 70 12.542 4.916 10.587 1.00 0.90 H new ATOM 0 HA LEU A 70 9.848 4.739 11.401 1.00 0.88 H new ATOM 0 HB2 LEU A 70 11.185 6.786 11.513 1.00 0.93 H new ATOM 0 HB3 LEU A 70 11.330 6.819 9.767 1.00 0.93 H new ATOM 0 HG LEU A 70 8.773 6.970 9.697 1.00 1.01 H new ATOM 0 HD11 LEU A 70 7.696 7.912 11.699 1.00 1.14 H new ATOM 0 HD12 LEU A 70 8.319 6.271 11.989 1.00 1.14 H new ATOM 0 HD13 LEU A 70 9.206 7.683 12.612 1.00 1.14 H new ATOM 0 HD21 LEU A 70 8.808 9.405 10.100 1.00 1.15 H new ATOM 0 HD22 LEU A 70 10.370 9.236 10.937 1.00 1.15 H new ATOM 0 HD23 LEU A 70 10.245 8.861 9.202 1.00 1.15 H new ATOM 1158 N TYR A 71 10.478 4.404 8.194 1.00 0.84 N ATOM 1159 CA TYR A 71 9.896 3.990 6.925 1.00 0.86 C ATOM 1160 C TYR A 71 9.165 2.663 7.108 1.00 0.85 C ATOM 1161 O TYR A 71 8.034 2.489 6.657 1.00 0.85 O ATOM 1162 CB TYR A 71 10.972 3.819 5.844 1.00 0.91 C ATOM 1163 CG TYR A 71 11.742 5.074 5.480 1.00 0.92 C ATOM 1164 CD1 TYR A 71 11.189 6.345 5.603 1.00 0.94 C ATOM 1165 CD2 TYR A 71 13.038 4.970 4.999 1.00 0.99 C ATOM 1166 CE1 TYR A 71 11.914 7.473 5.252 1.00 1.01 C ATOM 1167 CE2 TYR A 71 13.767 6.087 4.652 1.00 1.05 C ATOM 1168 CZ TYR A 71 13.204 7.334 4.779 1.00 1.05 C ATOM 1169 OH TYR A 71 13.932 8.447 4.418 1.00 1.16 O ATOM 0 H TYR A 71 11.494 4.496 8.184 1.00 0.84 H new ATOM 0 HA TYR A 71 9.202 4.767 6.605 1.00 0.86 H new ATOM 0 HB2 TYR A 71 11.682 3.064 6.180 1.00 0.91 H new ATOM 0 HB3 TYR A 71 10.497 3.432 4.943 1.00 0.91 H new ATOM 0 HD1 TYR A 71 10.182 6.454 5.977 1.00 0.94 H new ATOM 0 HD2 TYR A 71 13.486 3.993 4.894 1.00 0.99 H new ATOM 0 HE1 TYR A 71 11.473 8.454 5.348 1.00 1.01 H new ATOM 0 HE2 TYR A 71 14.776 5.983 4.282 1.00 1.05 H new ATOM 0 HH TYR A 71 14.317 8.311 3.527 1.00 1.16 H new ATOM 1179 N ASP A 72 9.829 1.731 7.791 1.00 0.86 N ATOM 1180 CA ASP A 72 9.266 0.404 8.040 1.00 0.90 C ATOM 1181 C ASP A 72 8.002 0.489 8.890 1.00 0.87 C ATOM 1182 O ASP A 72 7.008 -0.178 8.607 1.00 0.87 O ATOM 1183 CB ASP A 72 10.296 -0.494 8.734 1.00 0.98 C ATOM 1184 CG ASP A 72 10.519 -1.805 8.001 1.00 1.21 C ATOM 1185 OD1 ASP A 72 9.679 -2.718 8.128 1.00 1.47 O ATOM 1186 OD2 ASP A 72 11.552 -1.932 7.306 1.00 1.48 O ATOM 0 H ASP A 72 10.760 1.871 8.183 1.00 0.86 H new ATOM 0 HA ASP A 72 9.004 -0.029 7.075 1.00 0.90 H new ATOM 0 HB2 ASP A 72 11.243 0.040 8.812 1.00 0.98 H new ATOM 0 HB3 ASP A 72 9.963 -0.703 9.751 1.00 0.98 H new ATOM 1191 N SER A 73 8.046 1.310 9.933 1.00 0.85 N ATOM 1192 CA SER A 73 6.906 1.486 10.826 1.00 0.85 C ATOM 1193 C SER A 73 5.729 2.140 10.102 1.00 0.81 C ATOM 1194 O SER A 73 4.569 1.910 10.447 1.00 0.80 O ATOM 1195 CB SER A 73 7.316 2.323 12.035 1.00 0.90 C ATOM 1196 OG SER A 73 8.534 1.848 12.589 1.00 0.96 O ATOM 0 H SER A 73 8.863 1.867 10.182 1.00 0.85 H new ATOM 0 HA SER A 73 6.583 0.501 11.164 1.00 0.85 H new ATOM 0 HB2 SER A 73 7.428 3.366 11.739 1.00 0.90 H new ATOM 0 HB3 SER A 73 6.530 2.289 12.790 1.00 0.90 H new ATOM 0 HG SER A 73 9.284 2.141 12.030 1.00 0.96 H new ATOM 1202 N ALA A 74 6.030 2.962 9.101 1.00 0.80 N ATOM 1203 CA ALA A 74 5.002 3.634 8.323 1.00 0.79 C ATOM 1204 C ALA A 74 4.270 2.621 7.454 1.00 0.76 C ATOM 1205 O ALA A 74 3.078 2.762 7.184 1.00 0.75 O ATOM 1206 CB ALA A 74 5.614 4.744 7.481 1.00 0.82 C ATOM 0 H ALA A 74 6.984 3.178 8.811 1.00 0.80 H new ATOM 0 HA ALA A 74 4.280 4.091 9.000 1.00 0.79 H new ATOM 0 HB1 ALA A 74 4.831 5.237 6.905 1.00 0.82 H new ATOM 0 HB2 ALA A 74 6.097 5.471 8.133 1.00 0.82 H new ATOM 0 HB3 ALA A 74 6.353 4.320 6.801 1.00 0.82 H new ATOM 1212 N LEU A 75 4.995 1.586 7.039 1.00 0.77 N ATOM 1213 CA LEU A 75 4.420 0.525 6.228 1.00 0.78 C ATOM 1214 C LEU A 75 3.434 -0.268 7.073 1.00 0.77 C ATOM 1215 O LEU A 75 2.402 -0.719 6.582 1.00 0.77 O ATOM 1216 CB LEU A 75 5.514 -0.403 5.683 1.00 0.83 C ATOM 1217 CG LEU A 75 5.377 -0.786 4.201 1.00 0.92 C ATOM 1218 CD1 LEU A 75 4.089 -1.561 3.953 1.00 1.13 C ATOM 1219 CD2 LEU A 75 5.429 0.455 3.323 1.00 1.15 C ATOM 0 H LEU A 75 5.984 1.462 7.253 1.00 0.77 H new ATOM 0 HA LEU A 75 3.903 0.970 5.377 1.00 0.78 H new ATOM 0 HB2 LEU A 75 6.481 0.079 5.828 1.00 0.83 H new ATOM 0 HB3 LEU A 75 5.521 -1.317 6.278 1.00 0.83 H new ATOM 0 HG LEU A 75 6.215 -1.432 3.941 1.00 0.92 H new ATOM 0 HD11 LEU A 75 4.017 -1.819 2.896 1.00 1.13 H new ATOM 0 HD12 LEU A 75 4.092 -2.473 4.550 1.00 1.13 H new ATOM 0 HD13 LEU A 75 3.234 -0.946 4.235 1.00 1.13 H new ATOM 0 HD21 LEU A 75 5.331 0.165 2.277 1.00 1.15 H new ATOM 0 HD22 LEU A 75 4.613 1.126 3.592 1.00 1.15 H new ATOM 0 HD23 LEU A 75 6.381 0.965 3.470 1.00 1.15 H new ATOM 1231 N SER A 76 3.753 -0.412 8.357 1.00 0.78 N ATOM 1232 CA SER A 76 2.894 -1.127 9.287 1.00 0.80 C ATOM 1233 C SER A 76 1.546 -0.409 9.425 1.00 0.76 C ATOM 1234 O SER A 76 0.512 -1.040 9.669 1.00 0.77 O ATOM 1235 CB SER A 76 3.583 -1.250 10.647 1.00 0.85 C ATOM 1236 OG SER A 76 4.902 -1.758 10.497 1.00 0.88 O ATOM 0 H SER A 76 4.606 -0.039 8.775 1.00 0.78 H new ATOM 0 HA SER A 76 2.709 -2.129 8.900 1.00 0.80 H new ATOM 0 HB2 SER A 76 3.616 -0.275 11.133 1.00 0.85 H new ATOM 0 HB3 SER A 76 3.005 -1.909 11.295 1.00 0.85 H new ATOM 0 HG SER A 76 5.328 -1.828 11.377 1.00 0.88 H new ATOM 1242 N LYS A 77 1.565 0.914 9.251 1.00 0.75 N ATOM 1243 CA LYS A 77 0.348 1.720 9.324 1.00 0.74 C ATOM 1244 C LYS A 77 -0.573 1.344 8.170 1.00 0.71 C ATOM 1245 O LYS A 77 -1.796 1.314 8.312 1.00 0.70 O ATOM 1246 CB LYS A 77 0.680 3.221 9.266 1.00 0.76 C ATOM 1247 CG LYS A 77 1.346 3.759 10.527 1.00 0.90 C ATOM 1248 CD LYS A 77 2.070 5.077 10.263 1.00 0.98 C ATOM 1249 CE LYS A 77 1.150 6.282 10.420 1.00 1.35 C ATOM 1250 NZ LYS A 77 1.916 7.551 10.586 1.00 1.61 N ATOM 0 H LYS A 77 2.412 1.449 9.058 1.00 0.75 H new ATOM 0 HA LYS A 77 -0.150 1.521 10.273 1.00 0.74 H new ATOM 0 HB2 LYS A 77 1.336 3.405 8.415 1.00 0.76 H new ATOM 0 HB3 LYS A 77 -0.239 3.779 9.087 1.00 0.76 H new ATOM 0 HG2 LYS A 77 0.594 3.906 11.302 1.00 0.90 H new ATOM 0 HG3 LYS A 77 2.055 3.023 10.906 1.00 0.90 H new ATOM 0 HD2 LYS A 77 2.910 5.172 10.951 1.00 0.98 H new ATOM 0 HD3 LYS A 77 2.483 5.067 9.254 1.00 0.98 H new ATOM 0 HE2 LYS A 77 0.503 6.361 9.546 1.00 1.35 H new ATOM 0 HE3 LYS A 77 0.502 6.134 11.284 1.00 1.35 H new ATOM 0 HZ1 LYS A 77 1.253 8.346 10.690 1.00 1.61 H new ATOM 0 HZ2 LYS A 77 2.515 7.487 11.434 1.00 1.61 H new ATOM 0 HZ3 LYS A 77 2.515 7.707 9.750 1.00 1.61 H new ATOM 1264 N ILE A 78 0.033 1.052 7.028 1.00 0.71 N ATOM 1265 CA ILE A 78 -0.713 0.651 5.843 1.00 0.71 C ATOM 1266 C ILE A 78 -1.255 -0.763 6.017 1.00 0.70 C ATOM 1267 O ILE A 78 -2.379 -1.052 5.625 1.00 0.69 O ATOM 1268 CB ILE A 78 0.165 0.695 4.579 1.00 0.77 C ATOM 1269 CG1 ILE A 78 0.699 2.112 4.337 1.00 1.04 C ATOM 1270 CG2 ILE A 78 -0.614 0.192 3.369 1.00 0.84 C ATOM 1271 CD1 ILE A 78 -0.363 3.106 3.906 1.00 1.33 C ATOM 0 H ILE A 78 1.044 1.085 6.897 1.00 0.71 H new ATOM 0 HA ILE A 78 -1.535 1.356 5.722 1.00 0.71 H new ATOM 0 HB ILE A 78 1.020 0.036 4.731 1.00 0.77 H new ATOM 0 HG12 ILE A 78 1.170 2.473 5.251 1.00 1.04 H new ATOM 0 HG13 ILE A 78 1.475 2.071 3.573 1.00 1.04 H new ATOM 0 HG21 ILE A 78 0.022 0.230 2.485 1.00 0.84 H new ATOM 0 HG22 ILE A 78 -0.932 -0.836 3.543 1.00 0.84 H new ATOM 0 HG23 ILE A 78 -1.490 0.821 3.213 1.00 0.84 H new ATOM 0 HD11 ILE A 78 0.094 4.084 3.755 1.00 1.33 H new ATOM 0 HD12 ILE A 78 -0.819 2.771 2.974 1.00 1.33 H new ATOM 0 HD13 ILE A 78 -1.128 3.179 4.679 1.00 1.33 H new ATOM 1283 N GLU A 79 -0.441 -1.630 6.609 1.00 0.72 N ATOM 1284 CA GLU A 79 -0.824 -3.019 6.842 1.00 0.74 C ATOM 1285 C GLU A 79 -2.101 -3.093 7.670 1.00 0.73 C ATOM 1286 O GLU A 79 -3.023 -3.844 7.347 1.00 0.74 O ATOM 1287 CB GLU A 79 0.295 -3.774 7.556 1.00 0.79 C ATOM 1288 CG GLU A 79 0.062 -5.275 7.618 1.00 1.00 C ATOM 1289 CD GLU A 79 0.375 -5.858 8.980 1.00 1.32 C ATOM 1290 OE1 GLU A 79 1.552 -6.199 9.229 1.00 1.93 O ATOM 1291 OE2 GLU A 79 -0.554 -5.984 9.807 1.00 1.95 O ATOM 0 H GLU A 79 0.495 -1.394 6.939 1.00 0.72 H new ATOM 0 HA GLU A 79 -1.003 -3.484 5.873 1.00 0.74 H new ATOM 0 HB2 GLU A 79 1.238 -3.580 7.045 1.00 0.79 H new ATOM 0 HB3 GLU A 79 0.396 -3.387 8.570 1.00 0.79 H new ATOM 0 HG2 GLU A 79 -0.977 -5.488 7.366 1.00 1.00 H new ATOM 0 HG3 GLU A 79 0.680 -5.766 6.866 1.00 1.00 H new ATOM 1298 N LYS A 80 -2.151 -2.313 8.739 1.00 0.72 N ATOM 1299 CA LYS A 80 -3.324 -2.284 9.596 1.00 0.73 C ATOM 1300 C LYS A 80 -4.515 -1.711 8.840 1.00 0.72 C ATOM 1301 O LYS A 80 -5.658 -2.104 9.075 1.00 0.75 O ATOM 1302 CB LYS A 80 -3.039 -1.496 10.874 1.00 0.74 C ATOM 1303 CG LYS A 80 -2.329 -2.327 11.931 1.00 0.81 C ATOM 1304 CD LYS A 80 -2.108 -1.539 13.209 1.00 0.96 C ATOM 1305 CE LYS A 80 -1.968 -2.463 14.412 1.00 1.35 C ATOM 1306 NZ LYS A 80 -0.756 -3.327 14.338 1.00 1.71 N ATOM 0 H LYS A 80 -1.395 -1.694 9.032 1.00 0.72 H new ATOM 0 HA LYS A 80 -3.572 -3.304 9.889 1.00 0.73 H new ATOM 0 HB2 LYS A 80 -2.428 -0.626 10.631 1.00 0.74 H new ATOM 0 HB3 LYS A 80 -3.978 -1.122 11.282 1.00 0.74 H new ATOM 0 HG2 LYS A 80 -2.918 -3.218 12.150 1.00 0.81 H new ATOM 0 HG3 LYS A 80 -1.369 -2.667 11.542 1.00 0.81 H new ATOM 0 HD2 LYS A 80 -1.211 -0.928 13.111 1.00 0.96 H new ATOM 0 HD3 LYS A 80 -2.943 -0.857 13.367 1.00 0.96 H new ATOM 0 HE2 LYS A 80 -1.927 -1.864 15.322 1.00 1.35 H new ATOM 0 HE3 LYS A 80 -2.854 -3.093 14.485 1.00 1.35 H new ATOM 0 HZ1 LYS A 80 -0.711 -3.935 15.181 1.00 1.71 H new ATOM 0 HZ2 LYS A 80 -0.804 -3.921 13.485 1.00 1.71 H new ATOM 0 HZ3 LYS A 80 0.094 -2.730 14.296 1.00 1.71 H new ATOM 1320 N LEU A 81 -4.242 -0.794 7.920 1.00 0.69 N ATOM 1321 CA LEU A 81 -5.291 -0.196 7.104 1.00 0.71 C ATOM 1322 C LEU A 81 -5.943 -1.284 6.251 1.00 0.72 C ATOM 1323 O LEU A 81 -7.161 -1.300 6.068 1.00 0.76 O ATOM 1324 CB LEU A 81 -4.712 0.911 6.218 1.00 0.71 C ATOM 1325 CG LEU A 81 -5.515 2.221 6.171 1.00 0.78 C ATOM 1326 CD1 LEU A 81 -6.875 2.006 5.521 1.00 1.00 C ATOM 1327 CD2 LEU A 81 -5.674 2.812 7.564 1.00 0.94 C ATOM 0 H LEU A 81 -3.303 -0.448 7.720 1.00 0.69 H new ATOM 0 HA LEU A 81 -6.045 0.252 7.751 1.00 0.71 H new ATOM 0 HB2 LEU A 81 -3.704 1.138 6.565 1.00 0.71 H new ATOM 0 HB3 LEU A 81 -4.621 0.527 5.202 1.00 0.71 H new ATOM 0 HG LEU A 81 -4.957 2.931 5.561 1.00 0.78 H new ATOM 0 HD11 LEU A 81 -7.422 2.949 5.501 1.00 1.00 H new ATOM 0 HD12 LEU A 81 -6.738 1.644 4.502 1.00 1.00 H new ATOM 0 HD13 LEU A 81 -7.440 1.271 6.094 1.00 1.00 H new ATOM 0 HD21 LEU A 81 -6.246 3.738 7.503 1.00 0.94 H new ATOM 0 HD22 LEU A 81 -6.200 2.102 8.203 1.00 0.94 H new ATOM 0 HD23 LEU A 81 -4.691 3.020 7.986 1.00 0.94 H new ATOM 1339 N ILE A 82 -5.113 -2.210 5.767 1.00 0.72 N ATOM 1340 CA ILE A 82 -5.579 -3.325 4.954 1.00 0.76 C ATOM 1341 C ILE A 82 -6.561 -4.177 5.764 1.00 0.80 C ATOM 1342 O ILE A 82 -7.610 -4.598 5.265 1.00 0.84 O ATOM 1343 CB ILE A 82 -4.398 -4.205 4.462 1.00 0.75 C ATOM 1344 CG1 ILE A 82 -3.346 -3.348 3.733 1.00 0.74 C ATOM 1345 CG2 ILE A 82 -4.901 -5.320 3.554 1.00 0.80 C ATOM 1346 CD1 ILE A 82 -2.143 -4.133 3.225 1.00 0.77 C ATOM 0 H ILE A 82 -4.106 -2.205 5.929 1.00 0.72 H new ATOM 0 HA ILE A 82 -6.080 -2.918 4.076 1.00 0.76 H new ATOM 0 HB ILE A 82 -3.926 -4.658 5.334 1.00 0.75 H new ATOM 0 HG12 ILE A 82 -3.822 -2.849 2.889 1.00 0.74 H new ATOM 0 HG13 ILE A 82 -2.997 -2.568 4.410 1.00 0.74 H new ATOM 0 HG21 ILE A 82 -4.058 -5.925 3.220 1.00 0.80 H new ATOM 0 HG22 ILE A 82 -5.603 -5.947 4.103 1.00 0.80 H new ATOM 0 HG23 ILE A 82 -5.402 -4.886 2.688 1.00 0.80 H new ATOM 0 HD11 ILE A 82 -1.451 -3.455 2.725 1.00 0.77 H new ATOM 0 HD12 ILE A 82 -1.639 -4.611 4.065 1.00 0.77 H new ATOM 0 HD13 ILE A 82 -2.477 -4.895 2.521 1.00 0.77 H new ATOM 1358 N GLU A 83 -6.220 -4.405 7.030 1.00 0.80 N ATOM 1359 CA GLU A 83 -7.068 -5.187 7.925 1.00 0.86 C ATOM 1360 C GLU A 83 -8.330 -4.403 8.292 1.00 0.85 C ATOM 1361 O GLU A 83 -9.385 -4.980 8.572 1.00 0.90 O ATOM 1362 CB GLU A 83 -6.288 -5.583 9.188 1.00 0.90 C ATOM 1363 CG GLU A 83 -7.104 -6.377 10.203 1.00 1.24 C ATOM 1364 CD GLU A 83 -7.385 -7.801 9.763 1.00 1.70 C ATOM 1365 OE1 GLU A 83 -7.853 -8.004 8.627 1.00 2.18 O ATOM 1366 OE2 GLU A 83 -7.139 -8.733 10.561 1.00 2.36 O ATOM 0 H GLU A 83 -5.362 -4.059 7.459 1.00 0.80 H new ATOM 0 HA GLU A 83 -7.372 -6.097 7.408 1.00 0.86 H new ATOM 0 HB2 GLU A 83 -5.420 -6.173 8.895 1.00 0.90 H new ATOM 0 HB3 GLU A 83 -5.912 -4.679 9.668 1.00 0.90 H new ATOM 0 HG2 GLU A 83 -6.570 -6.396 11.153 1.00 1.24 H new ATOM 0 HG3 GLU A 83 -8.050 -5.865 10.379 1.00 1.24 H new ATOM 1373 N THR A 84 -8.224 -3.080 8.289 1.00 0.82 N ATOM 1374 CA THR A 84 -9.359 -2.237 8.607 1.00 0.84 C ATOM 1375 C THR A 84 -10.396 -2.308 7.485 1.00 0.89 C ATOM 1376 O THR A 84 -11.601 -2.270 7.739 1.00 0.92 O ATOM 1377 CB THR A 84 -8.930 -0.773 8.846 1.00 0.83 C ATOM 1378 OG1 THR A 84 -7.848 -0.729 9.787 1.00 0.84 O ATOM 1379 CG2 THR A 84 -10.092 0.047 9.383 1.00 0.85 C ATOM 0 H THR A 84 -7.366 -2.574 8.070 1.00 0.82 H new ATOM 0 HA THR A 84 -9.802 -2.607 9.531 1.00 0.84 H new ATOM 0 HB THR A 84 -8.609 -0.352 7.893 1.00 0.83 H new ATOM 0 HG1 THR A 84 -7.012 -0.968 9.335 1.00 0.84 H new ATOM 0 HG21 THR A 84 -9.768 1.075 9.544 1.00 0.85 H new ATOM 0 HG22 THR A 84 -10.910 0.033 8.663 1.00 0.85 H new ATOM 0 HG23 THR A 84 -10.432 -0.379 10.327 1.00 0.85 H new ATOM 1387 N LEU A 85 -9.915 -2.445 6.251 1.00 0.93 N ATOM 1388 CA LEU A 85 -10.788 -2.544 5.086 1.00 1.01 C ATOM 1389 C LEU A 85 -11.457 -3.914 5.033 1.00 1.08 C ATOM 1390 O LEU A 85 -12.599 -4.046 4.596 1.00 1.17 O ATOM 1391 CB LEU A 85 -9.990 -2.314 3.801 1.00 1.04 C ATOM 1392 CG LEU A 85 -9.475 -0.889 3.598 1.00 1.05 C ATOM 1393 CD1 LEU A 85 -8.371 -0.875 2.554 1.00 1.22 C ATOM 1394 CD2 LEU A 85 -10.612 0.039 3.185 1.00 1.13 C ATOM 0 H LEU A 85 -8.920 -2.490 6.033 1.00 0.93 H new ATOM 0 HA LEU A 85 -11.557 -1.776 5.172 1.00 1.01 H new ATOM 0 HB2 LEU A 85 -9.139 -2.995 3.795 1.00 1.04 H new ATOM 0 HB3 LEU A 85 -10.617 -2.581 2.951 1.00 1.04 H new ATOM 0 HG LEU A 85 -9.067 -0.529 4.543 1.00 1.05 H new ATOM 0 HD11 LEU A 85 -8.012 0.145 2.418 1.00 1.22 H new ATOM 0 HD12 LEU A 85 -7.548 -1.508 2.886 1.00 1.22 H new ATOM 0 HD13 LEU A 85 -8.760 -1.252 1.608 1.00 1.22 H new ATOM 0 HD21 LEU A 85 -10.225 1.048 3.045 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -11.049 -0.314 2.251 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -11.376 0.047 3.963 1.00 1.13 H new ATOM 1406 N SER A 86 -10.731 -4.927 5.482 1.00 1.18 N ATOM 1407 CA SER A 86 -11.229 -6.293 5.490 1.00 1.31 C ATOM 1408 C SER A 86 -12.261 -6.496 6.606 1.00 1.73 C ATOM 1409 O SER A 86 -12.267 -5.755 7.590 1.00 2.31 O ATOM 1410 CB SER A 86 -10.056 -7.255 5.671 1.00 1.71 C ATOM 1411 OG SER A 86 -9.030 -6.990 4.725 1.00 1.97 O ATOM 0 H SER A 86 -9.785 -4.826 5.849 1.00 1.18 H new ATOM 0 HA SER A 86 -11.723 -6.494 4.540 1.00 1.31 H new ATOM 0 HB2 SER A 86 -9.657 -7.162 6.681 1.00 1.71 H new ATOM 0 HB3 SER A 86 -10.403 -8.282 5.559 1.00 1.71 H new ATOM 0 HG SER A 86 -8.566 -6.162 4.969 1.00 1.97 H new ATOM 1914 N LYS B 10 15.362 15.475 1.765 1.00 1.52 N ATOM 1915 CA LYS B 10 14.984 14.715 2.953 1.00 1.44 C ATOM 1916 C LYS B 10 13.646 15.196 3.519 1.00 1.38 C ATOM 1917 O LYS B 10 12.771 14.389 3.835 1.00 1.32 O ATOM 1918 CB LYS B 10 16.079 14.829 4.015 1.00 1.48 C ATOM 1919 CG LYS B 10 16.011 13.753 5.088 1.00 1.54 C ATOM 1920 CD LYS B 10 16.159 12.356 4.501 1.00 1.71 C ATOM 1921 CE LYS B 10 16.326 11.303 5.589 1.00 2.08 C ATOM 1922 NZ LYS B 10 16.286 9.919 5.039 1.00 2.41 N ATOM 0 HA LYS B 10 14.869 13.670 2.665 1.00 1.44 H new ATOM 0 HB2 LYS B 10 17.052 14.780 3.526 1.00 1.48 H new ATOM 0 HB3 LYS B 10 16.010 15.807 4.490 1.00 1.48 H new ATOM 0 HG2 LYS B 10 16.798 13.923 5.823 1.00 1.54 H new ATOM 0 HG3 LYS B 10 15.060 13.826 5.616 1.00 1.54 H new ATOM 0 HD2 LYS B 10 15.283 12.120 3.898 1.00 1.71 H new ATOM 0 HD3 LYS B 10 17.021 12.331 3.835 1.00 1.71 H new ATOM 0 HE2 LYS B 10 17.274 11.461 6.104 1.00 2.08 H new ATOM 0 HE3 LYS B 10 15.537 11.421 6.331 1.00 2.08 H new ATOM 0 HZ1 LYS B 10 16.788 9.275 5.683 1.00 2.41 H new ATOM 0 HZ2 LYS B 10 15.297 9.612 4.943 1.00 2.41 H new ATOM 0 HZ3 LYS B 10 16.745 9.903 4.106 1.00 2.41 H new ATOM 1936 N GLU B 11 13.491 16.511 3.635 1.00 1.42 N ATOM 1937 CA GLU B 11 12.265 17.108 4.153 1.00 1.39 C ATOM 1938 C GLU B 11 11.090 16.789 3.234 1.00 1.36 C ATOM 1939 O GLU B 11 9.981 16.500 3.690 1.00 1.30 O ATOM 1940 CB GLU B 11 12.426 18.627 4.277 1.00 1.47 C ATOM 1941 CG GLU B 11 11.297 19.309 5.034 1.00 1.48 C ATOM 1942 CD GLU B 11 11.061 20.729 4.559 1.00 1.62 C ATOM 1943 OE1 GLU B 11 11.848 21.628 4.921 1.00 1.72 O ATOM 1944 OE2 GLU B 11 10.089 20.958 3.805 1.00 1.90 O ATOM 0 H GLU B 11 14.207 17.189 3.374 1.00 1.42 H new ATOM 0 HA GLU B 11 12.068 16.688 5.140 1.00 1.39 H new ATOM 0 HB2 GLU B 11 13.369 18.842 4.780 1.00 1.47 H new ATOM 0 HB3 GLU B 11 12.492 19.058 3.278 1.00 1.47 H new ATOM 0 HG2 GLU B 11 10.381 18.731 4.914 1.00 1.48 H new ATOM 0 HG3 GLU B 11 11.530 19.318 6.099 1.00 1.48 H new ATOM 1951 N LEU B 12 11.357 16.821 1.933 1.00 1.43 N ATOM 1952 CA LEU B 12 10.338 16.555 0.926 1.00 1.45 C ATOM 1953 C LEU B 12 9.766 15.141 1.058 1.00 1.36 C ATOM 1954 O LEU B 12 8.565 14.975 1.268 1.00 1.32 O ATOM 1955 CB LEU B 12 10.910 16.750 -0.480 1.00 1.57 C ATOM 1956 CG LEU B 12 9.920 16.508 -1.621 1.00 1.73 C ATOM 1957 CD1 LEU B 12 8.890 17.626 -1.692 1.00 1.89 C ATOM 1958 CD2 LEU B 12 10.660 16.377 -2.940 1.00 1.89 C ATOM 0 H LEU B 12 12.279 17.030 1.549 1.00 1.43 H new ATOM 0 HA LEU B 12 9.528 17.266 1.090 1.00 1.45 H new ATOM 0 HB2 LEU B 12 11.294 17.767 -0.562 1.00 1.57 H new ATOM 0 HB3 LEU B 12 11.759 16.078 -0.607 1.00 1.57 H new ATOM 0 HG LEU B 12 9.391 15.576 -1.425 1.00 1.73 H new ATOM 0 HD11 LEU B 12 8.198 17.431 -2.511 1.00 1.89 H new ATOM 0 HD12 LEU B 12 8.338 17.672 -0.753 1.00 1.89 H new ATOM 0 HD13 LEU B 12 9.396 18.576 -1.863 1.00 1.89 H new ATOM 0 HD21 LEU B 12 9.944 16.205 -3.743 1.00 1.89 H new ATOM 0 HD22 LEU B 12 11.215 17.294 -3.139 1.00 1.89 H new ATOM 0 HD23 LEU B 12 11.353 15.538 -2.886 1.00 1.89 H new ATOM 1970 N LEU B 13 10.630 14.128 0.957 1.00 1.35 N ATOM 1971 CA LEU B 13 10.185 12.733 1.034 1.00 1.30 C ATOM 1972 C LEU B 13 9.523 12.416 2.371 1.00 1.18 C ATOM 1973 O LEU B 13 8.567 11.642 2.425 1.00 1.15 O ATOM 1974 CB LEU B 13 11.353 11.764 0.756 1.00 1.35 C ATOM 1975 CG LEU B 13 12.575 11.880 1.680 1.00 1.32 C ATOM 1976 CD1 LEU B 13 12.425 10.997 2.912 1.00 1.48 C ATOM 1977 CD2 LEU B 13 13.841 11.518 0.923 1.00 1.50 C ATOM 0 H LEU B 13 11.634 14.245 0.823 1.00 1.35 H new ATOM 0 HA LEU B 13 9.431 12.594 0.259 1.00 1.30 H new ATOM 0 HB2 LEU B 13 10.973 10.744 0.820 1.00 1.35 H new ATOM 0 HB3 LEU B 13 11.686 11.917 -0.271 1.00 1.35 H new ATOM 0 HG LEU B 13 12.645 12.914 2.017 1.00 1.32 H new ATOM 0 HD11 LEU B 13 13.306 11.102 3.545 1.00 1.48 H new ATOM 0 HD12 LEU B 13 11.539 11.299 3.471 1.00 1.48 H new ATOM 0 HD13 LEU B 13 12.322 9.957 2.604 1.00 1.48 H new ATOM 0 HD21 LEU B 13 14.700 11.604 1.588 1.00 1.50 H new ATOM 0 HD22 LEU B 13 13.766 10.494 0.558 1.00 1.50 H new ATOM 0 HD23 LEU B 13 13.967 12.196 0.079 1.00 1.50 H new ATOM 1989 N LEU B 14 10.008 13.033 3.440 1.00 1.15 N ATOM 1990 CA LEU B 14 9.455 12.795 4.765 1.00 1.07 C ATOM 1991 C LEU B 14 7.996 13.225 4.825 1.00 1.07 C ATOM 1992 O LEU B 14 7.126 12.462 5.253 1.00 1.02 O ATOM 1993 CB LEU B 14 10.264 13.546 5.822 1.00 1.08 C ATOM 1994 CG LEU B 14 10.536 12.768 7.113 1.00 1.04 C ATOM 1995 CD1 LEU B 14 11.503 11.620 6.853 1.00 1.06 C ATOM 1996 CD2 LEU B 14 11.080 13.695 8.190 1.00 1.14 C ATOM 0 H LEU B 14 10.780 13.699 3.416 1.00 1.15 H new ATOM 0 HA LEU B 14 9.511 11.726 4.970 1.00 1.07 H new ATOM 0 HB2 LEU B 14 11.219 13.838 5.385 1.00 1.08 H new ATOM 0 HB3 LEU B 14 9.735 14.465 6.076 1.00 1.08 H new ATOM 0 HG LEU B 14 9.594 12.348 7.466 1.00 1.04 H new ATOM 0 HD11 LEU B 14 11.684 11.079 7.782 1.00 1.06 H new ATOM 0 HD12 LEU B 14 11.073 10.942 6.116 1.00 1.06 H new ATOM 0 HD13 LEU B 14 12.445 12.017 6.475 1.00 1.06 H new ATOM 0 HD21 LEU B 14 11.267 13.125 9.100 1.00 1.14 H new ATOM 0 HD22 LEU B 14 12.011 14.146 7.846 1.00 1.14 H new ATOM 0 HD23 LEU B 14 10.352 14.479 8.397 1.00 1.14 H new ATOM 2008 N LYS B 15 7.730 14.441 4.365 1.00 1.15 N ATOM 2009 CA LYS B 15 6.378 14.982 4.371 1.00 1.18 C ATOM 2010 C LYS B 15 5.476 14.265 3.368 1.00 1.13 C ATOM 2011 O LYS B 15 4.276 14.151 3.587 1.00 1.11 O ATOM 2012 CB LYS B 15 6.408 16.484 4.085 1.00 1.32 C ATOM 2013 CG LYS B 15 6.936 17.292 5.257 1.00 1.46 C ATOM 2014 CD LYS B 15 7.736 18.502 4.802 1.00 1.55 C ATOM 2015 CE LYS B 15 6.849 19.573 4.194 1.00 1.76 C ATOM 2016 NZ LYS B 15 7.373 20.938 4.468 1.00 1.80 N ATOM 0 H LYS B 15 8.434 15.072 3.983 1.00 1.15 H new ATOM 0 HA LYS B 15 5.959 14.817 5.364 1.00 1.18 H new ATOM 0 HB2 LYS B 15 7.031 16.671 3.210 1.00 1.32 H new ATOM 0 HB3 LYS B 15 5.402 16.823 3.839 1.00 1.32 H new ATOM 0 HG2 LYS B 15 6.101 17.621 5.875 1.00 1.46 H new ATOM 0 HG3 LYS B 15 7.564 16.657 5.882 1.00 1.46 H new ATOM 0 HD2 LYS B 15 8.278 18.919 5.651 1.00 1.55 H new ATOM 0 HD3 LYS B 15 8.481 18.190 4.070 1.00 1.55 H new ATOM 0 HE2 LYS B 15 6.778 19.419 3.117 1.00 1.76 H new ATOM 0 HE3 LYS B 15 5.840 19.482 4.596 1.00 1.76 H new ATOM 0 HZ1 LYS B 15 6.868 21.629 3.877 1.00 1.80 H new ATOM 0 HZ2 LYS B 15 7.229 21.170 5.471 1.00 1.80 H new ATOM 0 HZ3 LYS B 15 8.389 20.971 4.247 1.00 1.80 H new ATOM 2030 N LYS B 16 6.052 13.772 2.282 1.00 1.14 N ATOM 2031 CA LYS B 16 5.267 13.072 1.267 1.00 1.14 C ATOM 2032 C LYS B 16 4.803 11.700 1.762 1.00 1.03 C ATOM 2033 O LYS B 16 3.690 11.275 1.462 1.00 1.01 O ATOM 2034 CB LYS B 16 6.064 12.914 -0.033 1.00 1.22 C ATOM 2035 CG LYS B 16 6.360 14.228 -0.752 1.00 1.31 C ATOM 2036 CD LYS B 16 5.094 14.985 -1.130 1.00 1.30 C ATOM 2037 CE LYS B 16 4.279 14.248 -2.184 1.00 1.45 C ATOM 2038 NZ LYS B 16 3.039 14.982 -2.534 1.00 1.65 N ATOM 0 H LYS B 16 7.049 13.840 2.079 1.00 1.14 H new ATOM 0 HA LYS B 16 4.385 13.681 1.068 1.00 1.14 H new ATOM 0 HB2 LYS B 16 7.007 12.415 0.191 1.00 1.22 H new ATOM 0 HB3 LYS B 16 5.511 12.261 -0.708 1.00 1.22 H new ATOM 0 HG2 LYS B 16 6.978 14.857 -0.112 1.00 1.31 H new ATOM 0 HG3 LYS B 16 6.939 14.023 -1.652 1.00 1.31 H new ATOM 0 HD2 LYS B 16 4.483 15.136 -0.240 1.00 1.30 H new ATOM 0 HD3 LYS B 16 5.361 15.973 -1.505 1.00 1.30 H new ATOM 0 HE2 LYS B 16 4.884 14.109 -3.080 1.00 1.45 H new ATOM 0 HE3 LYS B 16 4.022 13.255 -1.816 1.00 1.45 H new ATOM 0 HZ1 LYS B 16 2.511 14.449 -3.254 1.00 1.65 H new ATOM 0 HZ2 LYS B 16 2.450 15.093 -1.684 1.00 1.65 H new ATOM 0 HZ3 LYS B 16 3.285 15.920 -2.909 1.00 1.65 H new ATOM 2052 N ILE B 17 5.647 11.019 2.524 1.00 0.98 N ATOM 2053 CA ILE B 17 5.313 9.694 3.040 1.00 0.92 C ATOM 2054 C ILE B 17 4.342 9.787 4.212 1.00 0.89 C ATOM 2055 O ILE B 17 3.390 9.016 4.291 1.00 0.86 O ATOM 2056 CB ILE B 17 6.586 8.923 3.460 1.00 0.94 C ATOM 2057 CG1 ILE B 17 7.429 8.595 2.224 1.00 1.00 C ATOM 2058 CG2 ILE B 17 6.232 7.649 4.215 1.00 1.00 C ATOM 2059 CD1 ILE B 17 8.746 7.922 2.543 1.00 0.96 C ATOM 0 H ILE B 17 6.568 11.360 2.800 1.00 0.98 H new ATOM 0 HA ILE B 17 4.826 9.144 2.235 1.00 0.92 H new ATOM 0 HB ILE B 17 7.167 9.558 4.130 1.00 0.94 H new ATOM 0 HG12 ILE B 17 6.852 7.948 1.564 1.00 1.00 H new ATOM 0 HG13 ILE B 17 7.626 9.516 1.675 1.00 1.00 H new ATOM 0 HG21 ILE B 17 7.146 7.128 4.498 1.00 1.00 H new ATOM 0 HG22 ILE B 17 5.667 7.903 5.112 1.00 1.00 H new ATOM 0 HG23 ILE B 17 5.629 7.003 3.577 1.00 1.00 H new ATOM 0 HD11 ILE B 17 9.286 7.722 1.617 1.00 0.96 H new ATOM 0 HD12 ILE B 17 9.344 8.576 3.178 1.00 0.96 H new ATOM 0 HD13 ILE B 17 8.558 6.983 3.064 1.00 0.96 H new ATOM 2071 N ASP B 18 4.565 10.729 5.117 1.00 0.94 N ATOM 2072 CA ASP B 18 3.675 10.875 6.266 1.00 0.99 C ATOM 2073 C ASP B 18 2.278 11.297 5.807 1.00 0.96 C ATOM 2074 O ASP B 18 1.271 10.771 6.276 1.00 0.94 O ATOM 2075 CB ASP B 18 4.242 11.879 7.273 1.00 1.14 C ATOM 2076 CG ASP B 18 3.615 11.748 8.654 1.00 1.29 C ATOM 2077 OD1 ASP B 18 3.537 10.610 9.179 1.00 1.88 O ATOM 2078 OD2 ASP B 18 3.214 12.780 9.233 1.00 1.59 O ATOM 0 H ASP B 18 5.338 11.393 5.083 1.00 0.94 H new ATOM 0 HA ASP B 18 3.598 9.909 6.764 1.00 0.99 H new ATOM 0 HB2 ASP B 18 5.320 11.737 7.353 1.00 1.14 H new ATOM 0 HB3 ASP B 18 4.081 12.891 6.900 1.00 1.14 H new ATOM 2083 N SER B 19 2.223 12.228 4.861 1.00 0.98 N ATOM 2084 CA SER B 19 0.956 12.709 4.324 1.00 0.99 C ATOM 2085 C SER B 19 0.246 11.618 3.518 1.00 0.91 C ATOM 2086 O SER B 19 -0.982 11.621 3.399 1.00 0.90 O ATOM 2087 CB SER B 19 1.179 13.958 3.476 1.00 1.10 C ATOM 2088 OG SER B 19 1.487 15.071 4.303 1.00 1.21 O ATOM 0 H SER B 19 3.046 12.667 4.448 1.00 0.98 H new ATOM 0 HA SER B 19 0.309 12.972 5.161 1.00 0.99 H new ATOM 0 HB2 SER B 19 1.992 13.786 2.770 1.00 1.10 H new ATOM 0 HB3 SER B 19 0.286 14.170 2.888 1.00 1.10 H new ATOM 0 HG SER B 19 1.019 14.981 5.160 1.00 1.21 H new ATOM 2094 N LEU B 20 1.032 10.706 2.952 1.00 0.87 N ATOM 2095 CA LEU B 20 0.506 9.591 2.168 1.00 0.84 C ATOM 2096 C LEU B 20 -0.512 8.809 2.989 1.00 0.80 C ATOM 2097 O LEU B 20 -1.620 8.523 2.530 1.00 0.79 O ATOM 2098 CB LEU B 20 1.662 8.669 1.762 1.00 0.86 C ATOM 2099 CG LEU B 20 1.804 8.346 0.265 1.00 0.91 C ATOM 2100 CD1 LEU B 20 1.372 9.532 -0.603 1.00 1.07 C ATOM 2101 CD2 LEU B 20 3.246 7.980 -0.034 1.00 1.35 C ATOM 0 H LEU B 20 2.049 10.718 3.023 1.00 0.87 H new ATOM 0 HA LEU B 20 0.015 9.978 1.275 1.00 0.84 H new ATOM 0 HB2 LEU B 20 2.593 9.124 2.100 1.00 0.86 H new ATOM 0 HB3 LEU B 20 1.552 7.729 2.303 1.00 0.86 H new ATOM 0 HG LEU B 20 1.152 7.505 0.028 1.00 0.91 H new ATOM 0 HD11 LEU B 20 1.484 9.272 -1.656 1.00 1.07 H new ATOM 0 HD12 LEU B 20 0.329 9.772 -0.398 1.00 1.07 H new ATOM 0 HD13 LEU B 20 1.995 10.396 -0.374 1.00 1.07 H new ATOM 0 HD21 LEU B 20 3.351 7.750 -1.094 1.00 1.35 H new ATOM 0 HD22 LEU B 20 3.895 8.818 0.222 1.00 1.35 H new ATOM 0 HD23 LEU B 20 3.530 7.108 0.556 1.00 1.35 H new ATOM 2113 N ILE B 21 -0.128 8.503 4.222 1.00 0.81 N ATOM 2114 CA ILE B 21 -0.982 7.757 5.134 1.00 0.82 C ATOM 2115 C ILE B 21 -2.141 8.620 5.627 1.00 0.81 C ATOM 2116 O ILE B 21 -3.250 8.125 5.816 1.00 0.81 O ATOM 2117 CB ILE B 21 -0.172 7.220 6.334 1.00 0.88 C ATOM 2118 CG1 ILE B 21 1.026 6.402 5.842 1.00 1.19 C ATOM 2119 CG2 ILE B 21 -1.055 6.369 7.238 1.00 1.21 C ATOM 2120 CD1 ILE B 21 2.201 6.413 6.793 1.00 1.38 C ATOM 0 H ILE B 21 0.777 8.763 4.614 1.00 0.81 H new ATOM 0 HA ILE B 21 -1.391 6.909 4.584 1.00 0.82 H new ATOM 0 HB ILE B 21 0.195 8.069 6.910 1.00 0.88 H new ATOM 0 HG12 ILE B 21 0.710 5.371 5.681 1.00 1.19 H new ATOM 0 HG13 ILE B 21 1.348 6.791 4.876 1.00 1.19 H new ATOM 0 HG21 ILE B 21 -0.467 5.999 8.078 1.00 1.21 H new ATOM 0 HG22 ILE B 21 -1.882 6.973 7.612 1.00 1.21 H new ATOM 0 HG23 ILE B 21 -1.449 5.525 6.672 1.00 1.21 H new ATOM 0 HD11 ILE B 21 3.011 5.813 6.378 1.00 1.38 H new ATOM 0 HD12 ILE B 21 2.544 7.438 6.935 1.00 1.38 H new ATOM 0 HD13 ILE B 21 1.896 5.996 7.753 1.00 1.38 H new ATOM 2132 N GLU B 22 -1.880 9.912 5.823 1.00 0.83 N ATOM 2133 CA GLU B 22 -2.909 10.842 6.289 1.00 0.86 C ATOM 2134 C GLU B 22 -4.081 10.877 5.311 1.00 0.83 C ATOM 2135 O GLU B 22 -5.246 10.836 5.710 1.00 0.84 O ATOM 2136 CB GLU B 22 -2.334 12.256 6.449 1.00 0.94 C ATOM 2137 CG GLU B 22 -1.262 12.387 7.522 1.00 1.11 C ATOM 2138 CD GLU B 22 -0.758 13.811 7.664 1.00 1.55 C ATOM 2139 OE1 GLU B 22 -0.132 14.329 6.711 1.00 1.98 O ATOM 2140 OE2 GLU B 22 -0.990 14.428 8.725 1.00 1.95 O ATOM 0 H GLU B 22 -0.967 10.338 5.667 1.00 0.83 H new ATOM 0 HA GLU B 22 -3.261 10.492 7.259 1.00 0.86 H new ATOM 0 HB2 GLU B 22 -1.915 12.574 5.494 1.00 0.94 H new ATOM 0 HB3 GLU B 22 -3.149 12.941 6.683 1.00 0.94 H new ATOM 0 HG2 GLU B 22 -1.665 12.050 8.477 1.00 1.11 H new ATOM 0 HG3 GLU B 22 -0.426 11.731 7.279 1.00 1.11 H new ATOM 2147 N ALA B 23 -3.759 10.950 4.027 1.00 0.82 N ATOM 2148 CA ALA B 23 -4.772 10.982 2.985 1.00 0.83 C ATOM 2149 C ALA B 23 -5.563 9.680 2.949 1.00 0.79 C ATOM 2150 O ALA B 23 -6.791 9.695 2.872 1.00 0.80 O ATOM 2151 CB ALA B 23 -4.135 11.250 1.632 1.00 0.86 C ATOM 0 H ALA B 23 -2.800 10.988 3.682 1.00 0.82 H new ATOM 0 HA ALA B 23 -5.464 11.793 3.214 1.00 0.83 H new ATOM 0 HB1 ALA B 23 -4.908 11.271 0.864 1.00 0.86 H new ATOM 0 HB2 ALA B 23 -3.621 12.211 1.656 1.00 0.86 H new ATOM 0 HB3 ALA B 23 -3.418 10.461 1.405 1.00 0.86 H new ATOM 2157 N ILE B 24 -4.853 8.558 3.026 1.00 0.78 N ATOM 2158 CA ILE B 24 -5.480 7.243 2.998 1.00 0.78 C ATOM 2159 C ILE B 24 -6.404 7.058 4.205 1.00 0.74 C ATOM 2160 O ILE B 24 -7.491 6.485 4.089 1.00 0.74 O ATOM 2161 CB ILE B 24 -4.410 6.128 2.959 1.00 0.83 C ATOM 2162 CG1 ILE B 24 -3.676 6.153 1.615 1.00 0.99 C ATOM 2163 CG2 ILE B 24 -5.028 4.759 3.207 1.00 1.03 C ATOM 2164 CD1 ILE B 24 -2.454 5.257 1.562 1.00 0.89 C ATOM 0 H ILE B 24 -3.837 8.535 3.109 1.00 0.78 H new ATOM 0 HA ILE B 24 -6.081 7.173 2.092 1.00 0.78 H new ATOM 0 HB ILE B 24 -3.693 6.315 3.758 1.00 0.83 H new ATOM 0 HG12 ILE B 24 -4.369 5.852 0.829 1.00 0.99 H new ATOM 0 HG13 ILE B 24 -3.372 7.177 1.398 1.00 0.99 H new ATOM 0 HG21 ILE B 24 -4.250 3.997 3.173 1.00 1.03 H new ATOM 0 HG22 ILE B 24 -5.505 4.747 4.187 1.00 1.03 H new ATOM 0 HG23 ILE B 24 -5.773 4.551 2.439 1.00 1.03 H new ATOM 0 HD11 ILE B 24 -1.991 5.331 0.578 1.00 0.89 H new ATOM 0 HD12 ILE B 24 -1.740 5.570 2.324 1.00 0.89 H new ATOM 0 HD13 ILE B 24 -2.751 4.225 1.746 1.00 0.89 H new ATOM 2176 N LYS B 25 -5.979 7.570 5.355 1.00 0.74 N ATOM 2177 CA LYS B 25 -6.771 7.473 6.577 1.00 0.75 C ATOM 2178 C LYS B 25 -8.098 8.215 6.407 1.00 0.78 C ATOM 2179 O LYS B 25 -9.138 7.774 6.894 1.00 0.80 O ATOM 2180 CB LYS B 25 -5.996 8.052 7.761 1.00 0.79 C ATOM 2181 CG LYS B 25 -6.684 7.867 9.105 1.00 0.88 C ATOM 2182 CD LYS B 25 -6.850 6.395 9.450 1.00 1.17 C ATOM 2183 CE LYS B 25 -7.601 6.210 10.753 1.00 1.48 C ATOM 2184 NZ LYS B 25 -6.899 6.849 11.895 1.00 1.72 N ATOM 0 H LYS B 25 -5.090 8.057 5.467 1.00 0.74 H new ATOM 0 HA LYS B 25 -6.977 6.421 6.774 1.00 0.75 H new ATOM 0 HB2 LYS B 25 -5.012 7.584 7.801 1.00 0.79 H new ATOM 0 HB3 LYS B 25 -5.836 9.117 7.591 1.00 0.79 H new ATOM 0 HG2 LYS B 25 -6.102 8.361 9.883 1.00 0.88 H new ATOM 0 HG3 LYS B 25 -7.661 8.349 9.084 1.00 0.88 H new ATOM 0 HD2 LYS B 25 -7.385 5.890 8.646 1.00 1.17 H new ATOM 0 HD3 LYS B 25 -5.869 5.925 9.524 1.00 1.17 H new ATOM 0 HE2 LYS B 25 -8.601 6.634 10.659 1.00 1.48 H new ATOM 0 HE3 LYS B 25 -7.724 5.146 10.953 1.00 1.48 H new ATOM 0 HZ1 LYS B 25 -7.339 6.545 12.787 1.00 1.72 H new ATOM 0 HZ2 LYS B 25 -5.898 6.566 11.889 1.00 1.72 H new ATOM 0 HZ3 LYS B 25 -6.967 7.883 11.810 1.00 1.72 H new ATOM 2198 N LYS B 26 -8.050 9.341 5.704 1.00 0.80 N ATOM 2199 CA LYS B 26 -9.242 10.137 5.455 1.00 0.85 C ATOM 2200 C LYS B 26 -10.187 9.396 4.522 1.00 0.83 C ATOM 2201 O LYS B 26 -11.407 9.463 4.683 1.00 0.86 O ATOM 2202 CB LYS B 26 -8.872 11.498 4.860 1.00 0.91 C ATOM 2203 CG LYS B 26 -8.692 12.594 5.902 1.00 1.01 C ATOM 2204 CD LYS B 26 -9.968 13.403 6.102 1.00 1.13 C ATOM 2205 CE LYS B 26 -11.095 12.561 6.682 1.00 1.38 C ATOM 2206 NZ LYS B 26 -12.361 13.329 6.802 1.00 1.39 N ATOM 0 H LYS B 26 -7.196 9.722 5.297 1.00 0.80 H new ATOM 0 HA LYS B 26 -9.746 10.303 6.407 1.00 0.85 H new ATOM 0 HB2 LYS B 26 -7.949 11.396 4.290 1.00 0.91 H new ATOM 0 HB3 LYS B 26 -9.649 11.801 4.158 1.00 0.91 H new ATOM 0 HG2 LYS B 26 -8.393 12.148 6.850 1.00 1.01 H new ATOM 0 HG3 LYS B 26 -7.885 13.259 5.594 1.00 1.01 H new ATOM 0 HD2 LYS B 26 -9.764 14.242 6.767 1.00 1.13 H new ATOM 0 HD3 LYS B 26 -10.284 13.823 5.147 1.00 1.13 H new ATOM 0 HE2 LYS B 26 -11.259 11.689 6.048 1.00 1.38 H new ATOM 0 HE3 LYS B 26 -10.802 12.190 7.664 1.00 1.38 H new ATOM 0 HZ1 LYS B 26 -13.169 12.675 6.767 1.00 1.39 H new ATOM 0 HZ2 LYS B 26 -12.371 13.843 7.706 1.00 1.39 H new ATOM 0 HZ3 LYS B 26 -12.431 14.007 6.017 1.00 1.39 H new ATOM 2220 N ILE B 27 -9.615 8.673 3.564 1.00 0.80 N ATOM 2221 CA ILE B 27 -10.399 7.917 2.594 1.00 0.81 C ATOM 2222 C ILE B 27 -11.363 6.957 3.290 1.00 0.80 C ATOM 2223 O ILE B 27 -12.563 6.962 3.014 1.00 0.82 O ATOM 2224 CB ILE B 27 -9.495 7.113 1.625 1.00 0.81 C ATOM 2225 CG1 ILE B 27 -8.583 8.058 0.834 1.00 0.79 C ATOM 2226 CG2 ILE B 27 -10.342 6.266 0.681 1.00 0.90 C ATOM 2227 CD1 ILE B 27 -7.687 7.346 -0.159 1.00 1.04 C ATOM 0 H ILE B 27 -8.606 8.595 3.439 1.00 0.80 H new ATOM 0 HA ILE B 27 -10.968 8.647 2.019 1.00 0.81 H new ATOM 0 HB ILE B 27 -8.867 6.444 2.213 1.00 0.81 H new ATOM 0 HG12 ILE B 27 -9.199 8.782 0.301 1.00 0.79 H new ATOM 0 HG13 ILE B 27 -7.963 8.620 1.532 1.00 0.79 H new ATOM 0 HG21 ILE B 27 -9.690 5.709 0.008 1.00 0.90 H new ATOM 0 HG22 ILE B 27 -10.946 5.569 1.261 1.00 0.90 H new ATOM 0 HG23 ILE B 27 -10.996 6.915 0.098 1.00 0.90 H new ATOM 0 HD11 ILE B 27 -7.070 8.077 -0.682 1.00 1.04 H new ATOM 0 HD12 ILE B 27 -7.045 6.642 0.370 1.00 1.04 H new ATOM 0 HD13 ILE B 27 -8.300 6.806 -0.881 1.00 1.04 H new ATOM 2239 N ILE B 28 -10.830 6.152 4.202 1.00 0.78 N ATOM 2240 CA ILE B 28 -11.634 5.179 4.934 1.00 0.78 C ATOM 2241 C ILE B 28 -12.643 5.864 5.858 1.00 0.81 C ATOM 2242 O ILE B 28 -13.746 5.353 6.073 1.00 0.84 O ATOM 2243 CB ILE B 28 -10.763 4.178 5.734 1.00 0.77 C ATOM 2244 CG1 ILE B 28 -11.564 2.916 6.036 1.00 0.80 C ATOM 2245 CG2 ILE B 28 -10.248 4.793 7.026 1.00 0.82 C ATOM 2246 CD1 ILE B 28 -10.706 1.723 6.395 1.00 0.97 C ATOM 0 H ILE B 28 -9.841 6.154 4.453 1.00 0.78 H new ATOM 0 HA ILE B 28 -12.184 4.611 4.184 1.00 0.78 H new ATOM 0 HB ILE B 28 -9.899 3.921 5.121 1.00 0.77 H new ATOM 0 HG12 ILE B 28 -12.250 3.120 6.858 1.00 0.80 H new ATOM 0 HG13 ILE B 28 -12.173 2.666 5.167 1.00 0.80 H new ATOM 0 HG21 ILE B 28 -9.641 4.062 7.560 1.00 0.82 H new ATOM 0 HG22 ILE B 28 -9.642 5.669 6.796 1.00 0.82 H new ATOM 0 HG23 ILE B 28 -11.092 5.090 7.649 1.00 0.82 H new ATOM 0 HD11 ILE B 28 -11.345 0.863 6.597 1.00 0.97 H new ATOM 0 HD12 ILE B 28 -10.038 1.492 5.565 1.00 0.97 H new ATOM 0 HD13 ILE B 28 -10.116 1.953 7.282 1.00 0.97 H new ATOM 2258 N ALA B 29 -12.261 7.019 6.399 1.00 0.82 N ATOM 2259 CA ALA B 29 -13.128 7.768 7.299 1.00 0.87 C ATOM 2260 C ALA B 29 -14.389 8.220 6.577 1.00 0.90 C ATOM 2261 O ALA B 29 -15.492 8.150 7.123 1.00 0.93 O ATOM 2262 CB ALA B 29 -12.388 8.964 7.883 1.00 0.90 C ATOM 0 H ALA B 29 -11.355 7.455 6.228 1.00 0.82 H new ATOM 0 HA ALA B 29 -13.420 7.111 8.118 1.00 0.87 H new ATOM 0 HB1 ALA B 29 -13.052 9.511 8.553 1.00 0.90 H new ATOM 0 HB2 ALA B 29 -11.517 8.617 8.439 1.00 0.90 H new ATOM 0 HB3 ALA B 29 -12.065 9.621 7.076 1.00 0.90 H new ATOM 2268 N GLU B 30 -14.214 8.667 5.339 1.00 0.91 N ATOM 2269 CA GLU B 30 -15.330 9.133 4.525 1.00 0.95 C ATOM 2270 C GLU B 30 -16.211 7.960 4.106 1.00 0.95 C ATOM 2271 O GLU B 30 -17.427 8.095 4.005 1.00 0.96 O ATOM 2272 CB GLU B 30 -14.827 9.870 3.279 1.00 1.00 C ATOM 2273 CG GLU B 30 -13.858 11.005 3.576 1.00 1.02 C ATOM 2274 CD GLU B 30 -14.404 12.010 4.574 1.00 1.13 C ATOM 2275 OE1 GLU B 30 -14.248 11.792 5.794 1.00 1.18 O ATOM 2276 OE2 GLU B 30 -14.979 13.030 4.146 1.00 1.38 O ATOM 0 H GLU B 30 -13.307 8.717 4.876 1.00 0.91 H new ATOM 0 HA GLU B 30 -15.918 9.825 5.128 1.00 0.95 H new ATOM 0 HB2 GLU B 30 -14.339 9.153 2.619 1.00 1.00 H new ATOM 0 HB3 GLU B 30 -15.683 10.271 2.737 1.00 1.00 H new ATOM 0 HG2 GLU B 30 -12.927 10.588 3.961 1.00 1.02 H new ATOM 0 HG3 GLU B 30 -13.616 11.520 2.646 1.00 1.02 H new ATOM 2283 N PHE B 31 -15.585 6.806 3.869 1.00 0.96 N ATOM 2284 CA PHE B 31 -16.310 5.607 3.455 1.00 0.99 C ATOM 2285 C PHE B 31 -17.396 5.236 4.457 1.00 0.97 C ATOM 2286 O PHE B 31 -18.526 4.940 4.074 1.00 1.01 O ATOM 2287 CB PHE B 31 -15.352 4.429 3.270 1.00 1.01 C ATOM 2288 CG PHE B 31 -15.024 4.148 1.832 1.00 1.04 C ATOM 2289 CD1 PHE B 31 -13.982 4.808 1.202 1.00 1.68 C ATOM 2290 CD2 PHE B 31 -15.765 3.224 1.110 1.00 1.50 C ATOM 2291 CE1 PHE B 31 -13.683 4.553 -0.123 1.00 1.83 C ATOM 2292 CE2 PHE B 31 -15.470 2.964 -0.215 1.00 1.59 C ATOM 2293 CZ PHE B 31 -14.428 3.629 -0.832 1.00 1.37 C ATOM 0 H PHE B 31 -14.577 6.678 3.957 1.00 0.96 H new ATOM 0 HA PHE B 31 -16.787 5.832 2.501 1.00 0.99 H new ATOM 0 HB2 PHE B 31 -14.429 4.632 3.813 1.00 1.01 H new ATOM 0 HB3 PHE B 31 -15.794 3.538 3.715 1.00 1.01 H new ATOM 0 HD1 PHE B 31 -13.397 5.530 1.752 1.00 1.68 H new ATOM 0 HD2 PHE B 31 -16.581 2.702 1.588 1.00 1.50 H new ATOM 0 HE1 PHE B 31 -12.869 5.075 -0.604 1.00 1.83 H new ATOM 0 HE2 PHE B 31 -16.053 2.242 -0.767 1.00 1.59 H new ATOM 0 HZ PHE B 31 -14.196 3.427 -1.867 1.00 1.37 H new ATOM 2303 N ASP B 32 -17.055 5.260 5.740 1.00 0.94 N ATOM 2304 CA ASP B 32 -18.018 4.929 6.791 1.00 0.93 C ATOM 2305 C ASP B 32 -19.122 5.977 6.849 1.00 0.93 C ATOM 2306 O ASP B 32 -20.302 5.647 6.976 1.00 0.96 O ATOM 2307 CB ASP B 32 -17.314 4.822 8.149 1.00 0.94 C ATOM 2308 CG ASP B 32 -18.283 4.670 9.311 1.00 1.20 C ATOM 2309 OD1 ASP B 32 -18.863 3.574 9.480 1.00 1.64 O ATOM 2310 OD2 ASP B 32 -18.459 5.646 10.073 1.00 1.54 O ATOM 0 H ASP B 32 -16.125 5.504 6.080 1.00 0.94 H new ATOM 0 HA ASP B 32 -18.467 3.964 6.556 1.00 0.93 H new ATOM 0 HB2 ASP B 32 -16.636 3.968 8.134 1.00 0.94 H new ATOM 0 HB3 ASP B 32 -16.703 5.711 8.306 1.00 0.94 H new ATOM 2315 N VAL B 33 -18.726 7.240 6.728 1.00 0.92 N ATOM 2316 CA VAL B 33 -19.671 8.347 6.759 1.00 0.93 C ATOM 2317 C VAL B 33 -20.687 8.206 5.632 1.00 0.94 C ATOM 2318 O VAL B 33 -21.894 8.245 5.866 1.00 0.95 O ATOM 2319 CB VAL B 33 -18.952 9.713 6.638 1.00 0.94 C ATOM 2320 CG1 VAL B 33 -19.947 10.846 6.412 1.00 1.00 C ATOM 2321 CG2 VAL B 33 -18.119 9.987 7.881 1.00 0.92 C ATOM 0 H VAL B 33 -17.753 7.521 6.607 1.00 0.92 H new ATOM 0 HA VAL B 33 -20.183 8.313 7.721 1.00 0.93 H new ATOM 0 HB VAL B 33 -18.292 9.665 5.772 1.00 0.94 H new ATOM 0 HG11 VAL B 33 -19.410 11.791 6.331 1.00 1.00 H new ATOM 0 HG12 VAL B 33 -20.502 10.664 5.492 1.00 1.00 H new ATOM 0 HG13 VAL B 33 -20.641 10.893 7.251 1.00 1.00 H new ATOM 0 HG21 VAL B 33 -17.620 10.951 7.780 1.00 0.92 H new ATOM 0 HG22 VAL B 33 -18.767 10.004 8.757 1.00 0.92 H new ATOM 0 HG23 VAL B 33 -17.372 9.202 7.998 1.00 0.92 H new ATOM 2331 N VAL B 34 -20.190 8.009 4.414 1.00 0.96 N ATOM 2332 CA VAL B 34 -21.055 7.866 3.248 1.00 0.99 C ATOM 2333 C VAL B 34 -21.936 6.619 3.364 1.00 1.00 C ATOM 2334 O VAL B 34 -23.082 6.615 2.916 1.00 1.02 O ATOM 2335 CB VAL B 34 -20.229 7.808 1.939 1.00 1.02 C ATOM 2336 CG1 VAL B 34 -21.130 7.588 0.728 1.00 1.21 C ATOM 2337 CG2 VAL B 34 -19.425 9.083 1.766 1.00 1.13 C ATOM 0 H VAL B 34 -19.193 7.945 4.209 1.00 0.96 H new ATOM 0 HA VAL B 34 -21.698 8.746 3.213 1.00 0.99 H new ATOM 0 HB VAL B 34 -19.545 6.963 2.011 1.00 1.02 H new ATOM 0 HG11 VAL B 34 -20.522 7.552 -0.176 1.00 1.21 H new ATOM 0 HG12 VAL B 34 -21.668 6.647 0.841 1.00 1.21 H new ATOM 0 HG13 VAL B 34 -21.844 8.408 0.652 1.00 1.21 H new ATOM 0 HG21 VAL B 34 -18.850 9.028 0.842 1.00 1.13 H new ATOM 0 HG22 VAL B 34 -20.101 9.937 1.722 1.00 1.13 H new ATOM 0 HG23 VAL B 34 -18.745 9.202 2.610 1.00 1.13 H new ATOM 2347 N LYS B 35 -21.401 5.575 3.989 1.00 1.01 N ATOM 2348 CA LYS B 35 -22.128 4.324 4.175 1.00 1.05 C ATOM 2349 C LYS B 35 -23.407 4.557 4.985 1.00 1.03 C ATOM 2350 O LYS B 35 -24.492 4.126 4.595 1.00 1.05 O ATOM 2351 CB LYS B 35 -21.230 3.298 4.883 1.00 1.08 C ATOM 2352 CG LYS B 35 -21.971 2.094 5.444 1.00 1.13 C ATOM 2353 CD LYS B 35 -21.025 1.119 6.124 1.00 1.32 C ATOM 2354 CE LYS B 35 -21.792 0.044 6.880 1.00 1.51 C ATOM 2355 NZ LYS B 35 -22.762 -0.676 6.009 1.00 1.86 N ATOM 0 H LYS B 35 -20.458 5.571 4.378 1.00 1.01 H new ATOM 0 HA LYS B 35 -22.409 3.936 3.196 1.00 1.05 H new ATOM 0 HB2 LYS B 35 -20.474 2.948 4.180 1.00 1.08 H new ATOM 0 HB3 LYS B 35 -20.702 3.796 5.697 1.00 1.08 H new ATOM 0 HG2 LYS B 35 -22.723 2.430 6.158 1.00 1.13 H new ATOM 0 HG3 LYS B 35 -22.501 1.585 4.639 1.00 1.13 H new ATOM 0 HD2 LYS B 35 -20.381 0.653 5.378 1.00 1.32 H new ATOM 0 HD3 LYS B 35 -20.376 1.659 6.813 1.00 1.32 H new ATOM 0 HE2 LYS B 35 -21.088 -0.671 7.304 1.00 1.51 H new ATOM 0 HE3 LYS B 35 -22.325 0.500 7.714 1.00 1.51 H new ATOM 0 HZ1 LYS B 35 -23.111 -1.522 6.503 1.00 1.86 H new ATOM 0 HZ2 LYS B 35 -23.562 -0.049 5.789 1.00 1.86 H new ATOM 0 HZ3 LYS B 35 -22.291 -0.960 5.126 1.00 1.86 H new ATOM 2369 N GLU B 36 -23.267 5.249 6.104 1.00 1.00 N ATOM 2370 CA GLU B 36 -24.407 5.549 6.964 1.00 1.00 C ATOM 2371 C GLU B 36 -25.291 6.624 6.341 1.00 0.96 C ATOM 2372 O GLU B 36 -26.508 6.635 6.536 1.00 0.97 O ATOM 2373 CB GLU B 36 -23.936 5.997 8.345 1.00 1.01 C ATOM 2374 CG GLU B 36 -24.678 5.328 9.492 1.00 1.15 C ATOM 2375 CD GLU B 36 -24.603 3.816 9.427 1.00 1.29 C ATOM 2376 OE1 GLU B 36 -23.649 3.236 9.989 1.00 1.57 O ATOM 2377 OE2 GLU B 36 -25.507 3.192 8.822 1.00 1.40 O ATOM 0 H GLU B 36 -22.376 5.615 6.441 1.00 1.00 H new ATOM 0 HA GLU B 36 -24.994 4.637 7.071 1.00 1.00 H new ATOM 0 HB2 GLU B 36 -22.871 5.787 8.442 1.00 1.01 H new ATOM 0 HB3 GLU B 36 -24.056 7.077 8.427 1.00 1.01 H new ATOM 0 HG2 GLU B 36 -24.260 5.669 10.439 1.00 1.15 H new ATOM 0 HG3 GLU B 36 -25.723 5.638 9.475 1.00 1.15 H new ATOM 2384 N SER B 37 -24.685 7.524 5.592 1.00 0.00 N ATOM 2385 CA SER B 37 -25.396 8.620 4.941 1.00 0.00 C ATOM 2386 C SER B 37 -26.418 8.095 3.960 1.00 0.00 C ATOM 2387 O SER B 37 -27.567 8.547 3.961 1.00 0.00 O ATOM 2388 CB SER B 37 -24.402 9.595 4.261 1.00 0.00 C ATOM 2389 OG SER B 37 -23.579 10.295 5.200 1.00 0.00 O ATOM 0 H SER B 37 -23.681 7.520 5.414 1.00 0.00 H new ATOM 0 HA SER B 37 -25.935 9.179 5.706 1.00 0.00 H new ATOM 0 HB2 SER B 37 -23.766 9.037 3.573 1.00 0.00 H new ATOM 0 HB3 SER B 37 -24.960 10.317 3.665 1.00 0.00 H new ATOM 0 HG SER B 37 -22.916 9.679 5.577 1.00 0.00 H new ATOM 2395 N VAL B 38 -26.019 7.182 3.079 1.00 0.96 N ATOM 2396 CA VAL B 38 -26.931 6.636 2.076 1.00 1.00 C ATOM 2397 C VAL B 38 -28.048 5.838 2.745 1.00 1.02 C ATOM 2398 O VAL B 38 -29.157 5.748 2.227 1.00 1.04 O ATOM 2399 CB VAL B 38 -26.199 5.754 1.035 1.00 1.05 C ATOM 2400 CG1 VAL B 38 -25.136 6.563 0.300 1.00 1.05 C ATOM 2401 CG2 VAL B 38 -25.580 4.525 1.681 1.00 1.07 C ATOM 0 H VAL B 38 -25.072 6.805 3.038 1.00 0.96 H new ATOM 0 HA VAL B 38 -27.362 7.483 1.543 1.00 1.00 H new ATOM 0 HB VAL B 38 -26.940 5.412 0.313 1.00 1.05 H new ATOM 0 HG11 VAL B 38 -24.632 5.926 -0.427 1.00 1.05 H new ATOM 0 HG12 VAL B 38 -25.607 7.400 -0.215 1.00 1.05 H new ATOM 0 HG13 VAL B 38 -24.407 6.942 1.016 1.00 1.05 H new ATOM 0 HG21 VAL B 38 -25.075 3.930 0.920 1.00 1.07 H new ATOM 0 HG22 VAL B 38 -24.859 4.836 2.437 1.00 1.07 H new ATOM 0 HG23 VAL B 38 -26.362 3.927 2.149 1.00 1.07 H new ATOM 2411 N ASN B 39 -27.742 5.286 3.909 1.00 1.03 N ATOM 2412 CA ASN B 39 -28.700 4.503 4.678 1.00 1.07 C ATOM 2413 C ASN B 39 -29.848 5.394 5.172 1.00 1.05 C ATOM 2414 O ASN B 39 -31.025 5.063 5.011 1.00 1.08 O ATOM 2415 CB ASN B 39 -27.965 3.840 5.848 1.00 1.11 C ATOM 2416 CG ASN B 39 -28.840 2.944 6.700 1.00 1.20 C ATOM 2417 OD1 ASN B 39 -29.869 2.432 6.252 1.00 1.25 O ATOM 2418 ND2 ASN B 39 -28.417 2.731 7.940 1.00 1.25 N ATOM 0 H ASN B 39 -26.825 5.367 4.348 1.00 1.03 H new ATOM 0 HA ASN B 39 -29.140 3.729 4.049 1.00 1.07 H new ATOM 0 HB2 ASN B 39 -27.135 3.252 5.456 1.00 1.11 H new ATOM 0 HB3 ASN B 39 -27.535 4.617 6.480 1.00 1.11 H new ATOM 0 HD21 ASN B 39 -28.949 2.123 8.563 1.00 1.25 H new ATOM 0 HD22 ASN B 39 -27.560 3.175 8.270 1.00 1.25 H new ATOM 2425 N GLU B 40 -29.487 6.542 5.738 1.00 1.02 N ATOM 2426 CA GLU B 40 -30.457 7.505 6.251 1.00 1.02 C ATOM 2427 C GLU B 40 -31.243 8.151 5.114 1.00 0.98 C ATOM 2428 O GLU B 40 -32.471 8.266 5.173 1.00 1.01 O ATOM 2429 CB GLU B 40 -29.724 8.586 7.042 1.00 1.04 C ATOM 2430 CG GLU B 40 -30.017 8.566 8.531 1.00 1.24 C ATOM 2431 CD GLU B 40 -31.428 9.014 8.858 1.00 1.46 C ATOM 2432 OE1 GLU B 40 -31.872 10.051 8.322 1.00 2.04 O ATOM 2433 OE2 GLU B 40 -32.106 8.329 9.649 1.00 1.92 O ATOM 0 H GLU B 40 -28.516 6.831 5.854 1.00 1.02 H new ATOM 0 HA GLU B 40 -31.160 6.978 6.897 1.00 1.02 H new ATOM 0 HB2 GLU B 40 -28.651 8.467 6.892 1.00 1.04 H new ATOM 0 HB3 GLU B 40 -29.996 9.563 6.642 1.00 1.04 H new ATOM 0 HG2 GLU B 40 -29.863 7.557 8.913 1.00 1.24 H new ATOM 0 HG3 GLU B 40 -29.307 9.213 9.045 1.00 1.24 H new ATOM 2440 N LEU B 41 -30.520 8.552 4.076 1.00 0.95 N ATOM 2441 CA LEU B 41 -31.109 9.208 2.911 1.00 0.94 C ATOM 2442 C LEU B 41 -32.122 8.302 2.219 1.00 0.95 C ATOM 2443 O LEU B 41 -33.157 8.765 1.749 1.00 0.97 O ATOM 2444 CB LEU B 41 -30.005 9.612 1.928 1.00 0.92 C ATOM 2445 CG LEU B 41 -30.417 10.618 0.852 1.00 0.97 C ATOM 2446 CD1 LEU B 41 -30.710 11.973 1.476 1.00 1.08 C ATOM 2447 CD2 LEU B 41 -29.330 10.748 -0.200 1.00 1.01 C ATOM 0 H LEU B 41 -29.509 8.433 4.016 1.00 0.95 H new ATOM 0 HA LEU B 41 -31.635 10.100 3.252 1.00 0.94 H new ATOM 0 HB2 LEU B 41 -29.174 10.032 2.495 1.00 0.92 H new ATOM 0 HB3 LEU B 41 -29.633 8.713 1.437 1.00 0.92 H new ATOM 0 HG LEU B 41 -31.324 10.253 0.370 1.00 0.97 H new ATOM 0 HD11 LEU B 41 -31.002 12.677 0.697 1.00 1.08 H new ATOM 0 HD12 LEU B 41 -31.521 11.874 2.197 1.00 1.08 H new ATOM 0 HD13 LEU B 41 -29.818 12.341 1.982 1.00 1.08 H new ATOM 0 HD21 LEU B 41 -29.641 11.468 -0.957 1.00 1.01 H new ATOM 0 HD22 LEU B 41 -28.408 11.091 0.270 1.00 1.01 H new ATOM 0 HD23 LEU B 41 -29.160 9.779 -0.669 1.00 1.01 H new ATOM 2459 N SER B 42 -31.820 7.015 2.174 1.00 0.97 N ATOM 2460 CA SER B 42 -32.695 6.039 1.537 1.00 1.01 C ATOM 2461 C SER B 42 -34.056 5.989 2.225 1.00 1.02 C ATOM 2462 O SER B 42 -35.093 6.024 1.567 1.00 1.03 O ATOM 2463 CB SER B 42 -32.042 4.656 1.573 1.00 1.07 C ATOM 2464 OG SER B 42 -32.655 3.762 0.655 1.00 1.56 O ATOM 0 H SER B 42 -30.970 6.618 2.573 1.00 0.97 H new ATOM 0 HA SER B 42 -32.849 6.342 0.501 1.00 1.01 H new ATOM 0 HB2 SER B 42 -30.982 4.748 1.338 1.00 1.07 H new ATOM 0 HB3 SER B 42 -32.111 4.247 2.581 1.00 1.07 H new ATOM 0 HG SER B 42 -32.202 2.894 0.692 1.00 1.56 H new ATOM 2470 N GLU B 43 -34.042 5.937 3.551 1.00 1.04 N ATOM 2471 CA GLU B 43 -35.274 5.857 4.338 1.00 1.07 C ATOM 2472 C GLU B 43 -36.185 7.056 4.089 1.00 1.05 C ATOM 2473 O GLU B 43 -37.393 6.904 3.918 1.00 1.10 O ATOM 2474 CB GLU B 43 -34.948 5.764 5.830 1.00 1.12 C ATOM 2475 CG GLU B 43 -36.175 5.575 6.718 1.00 1.24 C ATOM 2476 CD GLU B 43 -35.861 5.719 8.191 1.00 1.41 C ATOM 2477 OE1 GLU B 43 -35.261 6.746 8.574 1.00 1.56 O ATOM 2478 OE2 GLU B 43 -36.208 4.807 8.971 1.00 1.92 O ATOM 0 H GLU B 43 -33.189 5.949 4.110 1.00 1.04 H new ATOM 0 HA GLU B 43 -35.802 4.958 4.021 1.00 1.07 H new ATOM 0 HB2 GLU B 43 -34.263 4.932 5.991 1.00 1.12 H new ATOM 0 HB3 GLU B 43 -34.426 6.671 6.136 1.00 1.12 H new ATOM 0 HG2 GLU B 43 -36.935 6.305 6.440 1.00 1.24 H new ATOM 0 HG3 GLU B 43 -36.600 4.588 6.537 1.00 1.24 H new ATOM 2485 N LYS B 44 -35.592 8.243 4.052 1.00 1.00 N ATOM 2486 CA LYS B 44 -36.349 9.474 3.849 1.00 1.00 C ATOM 2487 C LYS B 44 -36.849 9.598 2.410 1.00 0.98 C ATOM 2488 O LYS B 44 -37.960 10.072 2.168 1.00 1.03 O ATOM 2489 CB LYS B 44 -35.491 10.693 4.219 1.00 1.01 C ATOM 2490 CG LYS B 44 -34.899 10.631 5.625 1.00 1.06 C ATOM 2491 CD LYS B 44 -35.970 10.369 6.673 1.00 1.17 C ATOM 2492 CE LYS B 44 -35.421 10.487 8.090 1.00 1.32 C ATOM 2493 NZ LYS B 44 -34.537 9.342 8.442 1.00 1.35 N ATOM 0 H LYS B 44 -34.587 8.380 4.160 1.00 1.00 H new ATOM 0 HA LYS B 44 -37.221 9.438 4.502 1.00 1.00 H new ATOM 0 HB2 LYS B 44 -34.679 10.786 3.498 1.00 1.01 H new ATOM 0 HB3 LYS B 44 -36.100 11.593 4.131 1.00 1.01 H new ATOM 0 HG2 LYS B 44 -34.146 9.844 5.669 1.00 1.06 H new ATOM 0 HG3 LYS B 44 -34.392 11.570 5.849 1.00 1.06 H new ATOM 0 HD2 LYS B 44 -36.788 11.077 6.541 1.00 1.17 H new ATOM 0 HD3 LYS B 44 -36.385 9.372 6.526 1.00 1.17 H new ATOM 0 HE2 LYS B 44 -34.863 11.419 8.187 1.00 1.32 H new ATOM 0 HE3 LYS B 44 -36.249 10.536 8.797 1.00 1.32 H new ATOM 0 HZ1 LYS B 44 -34.404 9.310 9.473 1.00 1.35 H new ATOM 0 HZ2 LYS B 44 -34.974 8.454 8.121 1.00 1.35 H new ATOM 0 HZ3 LYS B 44 -33.614 9.461 7.978 1.00 1.35 H new ATOM 2507 N ALA B 45 -36.031 9.170 1.456 1.00 0.98 N ATOM 2508 CA ALA B 45 -36.389 9.243 0.042 1.00 0.99 C ATOM 2509 C ALA B 45 -37.484 8.246 -0.324 1.00 1.01 C ATOM 2510 O ALA B 45 -38.219 8.457 -1.286 1.00 1.03 O ATOM 2511 CB ALA B 45 -35.158 9.013 -0.823 1.00 1.01 C ATOM 0 H ALA B 45 -35.111 8.767 1.636 1.00 0.98 H new ATOM 0 HA ALA B 45 -36.782 10.242 -0.145 1.00 0.99 H new ATOM 0 HB1 ALA B 45 -35.437 9.070 -1.875 1.00 1.01 H new ATOM 0 HB2 ALA B 45 -34.412 9.776 -0.604 1.00 1.01 H new ATOM 0 HB3 ALA B 45 -34.743 8.028 -0.610 1.00 1.01 H new ATOM 2517 N LYS B 46 -37.598 7.173 0.457 1.00 1.04 N ATOM 2518 CA LYS B 46 -38.600 6.134 0.210 1.00 1.10 C ATOM 2519 C LYS B 46 -40.019 6.685 0.316 1.00 1.12 C ATOM 2520 O LYS B 46 -40.970 6.064 -0.157 1.00 1.18 O ATOM 2521 CB LYS B 46 -38.426 4.970 1.190 1.00 1.18 C ATOM 2522 CG LYS B 46 -37.985 3.673 0.527 1.00 1.46 C ATOM 2523 CD LYS B 46 -36.503 3.425 0.729 1.00 1.98 C ATOM 2524 CE LYS B 46 -36.011 2.231 -0.075 1.00 2.66 C ATOM 2525 NZ LYS B 46 -34.626 1.847 0.302 1.00 3.40 N ATOM 0 H LYS B 46 -37.007 6.999 1.270 1.00 1.04 H new ATOM 0 HA LYS B 46 -38.447 5.774 -0.807 1.00 1.10 H new ATOM 0 HB2 LYS B 46 -37.692 5.249 1.946 1.00 1.18 H new ATOM 0 HB3 LYS B 46 -39.369 4.800 1.709 1.00 1.18 H new ATOM 0 HG2 LYS B 46 -38.554 2.840 0.939 1.00 1.46 H new ATOM 0 HG3 LYS B 46 -38.207 3.714 -0.539 1.00 1.46 H new ATOM 0 HD2 LYS B 46 -35.944 4.314 0.438 1.00 1.98 H new ATOM 0 HD3 LYS B 46 -36.304 3.256 1.787 1.00 1.98 H new ATOM 0 HE2 LYS B 46 -36.679 1.385 0.084 1.00 2.66 H new ATOM 0 HE3 LYS B 46 -36.046 2.469 -1.138 1.00 2.66 H new ATOM 0 HZ1 LYS B 46 -34.257 1.159 -0.385 1.00 3.40 H new ATOM 0 HZ2 LYS B 46 -34.020 2.692 0.305 1.00 3.40 H new ATOM 0 HZ3 LYS B 46 -34.630 1.421 1.251 1.00 3.40 H new ATOM 2539 N THR B 47 -40.159 7.845 0.942 1.00 1.10 N ATOM 2540 CA THR B 47 -41.459 8.480 1.093 1.00 1.16 C ATOM 2541 C THR B 47 -41.938 9.060 -0.240 1.00 1.17 C ATOM 2542 O THR B 47 -43.139 9.195 -0.481 1.00 1.27 O ATOM 2543 CB THR B 47 -41.395 9.609 2.142 1.00 1.24 C ATOM 2544 OG1 THR B 47 -40.452 9.266 3.164 1.00 1.54 O ATOM 2545 CG2 THR B 47 -42.758 9.846 2.772 1.00 1.41 C ATOM 0 H THR B 47 -39.385 8.366 1.354 1.00 1.10 H new ATOM 0 HA THR B 47 -42.163 7.717 1.426 1.00 1.16 H new ATOM 0 HB THR B 47 -41.081 10.524 1.640 1.00 1.24 H new ATOM 0 HG1 THR B 47 -39.558 9.565 2.897 1.00 1.54 H new ATOM 0 HG21 THR B 47 -42.684 10.647 3.508 1.00 1.41 H new ATOM 0 HG22 THR B 47 -43.472 10.128 1.999 1.00 1.41 H new ATOM 0 HG23 THR B 47 -43.096 8.933 3.262 1.00 1.41 H new ATOM 2553 N ASP B 48 -40.994 9.356 -1.119 1.00 1.14 N ATOM 2554 CA ASP B 48 -41.314 9.943 -2.412 1.00 1.18 C ATOM 2555 C ASP B 48 -40.914 9.011 -3.556 1.00 1.14 C ATOM 2556 O ASP B 48 -39.775 8.566 -3.619 1.00 1.10 O ATOM 2557 CB ASP B 48 -40.592 11.281 -2.549 1.00 1.23 C ATOM 2558 CG ASP B 48 -41.006 12.044 -3.781 1.00 1.28 C ATOM 2559 OD1 ASP B 48 -40.372 11.861 -4.838 1.00 1.43 O ATOM 2560 OD2 ASP B 48 -41.960 12.841 -3.693 1.00 1.39 O ATOM 0 H ASP B 48 -39.999 9.199 -0.961 1.00 1.14 H new ATOM 0 HA ASP B 48 -42.392 10.097 -2.469 1.00 1.18 H new ATOM 0 HB2 ASP B 48 -40.792 11.889 -1.666 1.00 1.23 H new ATOM 0 HB3 ASP B 48 -39.516 11.107 -2.579 1.00 1.23 H new ATOM 2565 N PRO B 49 -41.840 8.725 -4.492 1.00 1.20 N ATOM 2566 CA PRO B 49 -41.574 7.830 -5.629 1.00 1.22 C ATOM 2567 C PRO B 49 -40.472 8.351 -6.548 1.00 1.24 C ATOM 2568 O PRO B 49 -39.727 7.575 -7.139 1.00 1.24 O ATOM 2569 CB PRO B 49 -42.915 7.771 -6.374 1.00 1.33 C ATOM 2570 CG PRO B 49 -43.660 8.980 -5.930 1.00 1.36 C ATOM 2571 CD PRO B 49 -43.212 9.253 -4.521 1.00 1.29 C ATOM 0 HA PRO B 49 -41.219 6.856 -5.293 1.00 1.22 H new ATOM 0 HB2 PRO B 49 -42.766 7.774 -7.454 1.00 1.33 H new ATOM 0 HB3 PRO B 49 -43.461 6.860 -6.130 1.00 1.33 H new ATOM 0 HG2 PRO B 49 -43.446 9.830 -6.578 1.00 1.36 H new ATOM 0 HG3 PRO B 49 -44.736 8.811 -5.971 1.00 1.36 H new ATOM 0 HD2 PRO B 49 -43.238 10.318 -4.290 1.00 1.29 H new ATOM 0 HD3 PRO B 49 -43.850 8.753 -3.792 1.00 1.29 H new ATOM 2579 N GLN B 50 -40.361 9.665 -6.655 1.00 1.28 N ATOM 2580 CA GLN B 50 -39.354 10.272 -7.507 1.00 1.33 C ATOM 2581 C GLN B 50 -37.997 10.237 -6.820 1.00 1.22 C ATOM 2582 O GLN B 50 -36.986 9.895 -7.432 1.00 1.22 O ATOM 2583 CB GLN B 50 -39.751 11.706 -7.857 1.00 1.45 C ATOM 2584 CG GLN B 50 -41.127 11.809 -8.496 1.00 1.58 C ATOM 2585 CD GLN B 50 -41.939 12.978 -7.972 1.00 1.65 C ATOM 2586 OE1 GLN B 50 -42.697 13.605 -8.710 1.00 1.81 O ATOM 2587 NE2 GLN B 50 -41.814 13.261 -6.687 1.00 1.66 N ATOM 0 H GLN B 50 -40.956 10.331 -6.162 1.00 1.28 H new ATOM 0 HA GLN B 50 -39.284 9.703 -8.434 1.00 1.33 H new ATOM 0 HB2 GLN B 50 -39.732 12.312 -6.951 1.00 1.45 H new ATOM 0 HB3 GLN B 50 -39.010 12.125 -8.537 1.00 1.45 H new ATOM 0 HG2 GLN B 50 -41.013 11.908 -9.576 1.00 1.58 H new ATOM 0 HG3 GLN B 50 -41.675 10.884 -8.316 1.00 1.58 H new ATOM 0 HE21 GLN B 50 -41.175 12.719 -6.105 1.00 1.66 H new ATOM 0 HE22 GLN B 50 -42.357 14.021 -6.277 1.00 1.66 H new ATOM 2596 N ALA B 51 -37.985 10.577 -5.537 1.00 1.15 N ATOM 2597 CA ALA B 51 -36.756 10.569 -4.757 1.00 1.08 C ATOM 2598 C ALA B 51 -36.239 9.145 -4.609 1.00 1.00 C ATOM 2599 O ALA B 51 -35.037 8.892 -4.725 1.00 0.98 O ATOM 2600 CB ALA B 51 -36.985 11.207 -3.395 1.00 1.09 C ATOM 0 H ALA B 51 -38.814 10.862 -5.015 1.00 1.15 H new ATOM 0 HA ALA B 51 -36.003 11.156 -5.282 1.00 1.08 H new ATOM 0 HB1 ALA B 51 -36.056 11.192 -2.825 1.00 1.09 H new ATOM 0 HB2 ALA B 51 -37.314 12.238 -3.527 1.00 1.09 H new ATOM 0 HB3 ALA B 51 -37.750 10.648 -2.856 1.00 1.09 H new ATOM 2606 N ALA B 52 -37.163 8.219 -4.382 1.00 0.99 N ATOM 2607 CA ALA B 52 -36.823 6.814 -4.238 1.00 0.98 C ATOM 2608 C ALA B 52 -36.232 6.273 -5.531 1.00 1.02 C ATOM 2609 O ALA B 52 -35.400 5.373 -5.510 1.00 1.03 O ATOM 2610 CB ALA B 52 -38.044 6.001 -3.836 1.00 1.03 C ATOM 0 H ALA B 52 -38.159 8.421 -4.294 1.00 0.99 H new ATOM 0 HA ALA B 52 -36.076 6.725 -3.449 1.00 0.98 H new ATOM 0 HB1 ALA B 52 -37.765 4.952 -3.734 1.00 1.03 H new ATOM 0 HB2 ALA B 52 -38.429 6.368 -2.885 1.00 1.03 H new ATOM 0 HB3 ALA B 52 -38.814 6.099 -4.601 1.00 1.03 H new ATOM 2616 N GLU B 53 -36.663 6.837 -6.656 1.00 1.09 N ATOM 2617 CA GLU B 53 -36.174 6.418 -7.961 1.00 1.18 C ATOM 2618 C GLU B 53 -34.741 6.893 -8.158 1.00 1.17 C ATOM 2619 O GLU B 53 -33.927 6.223 -8.802 1.00 1.23 O ATOM 2620 CB GLU B 53 -37.076 6.972 -9.066 1.00 1.28 C ATOM 2621 CG GLU B 53 -36.753 6.426 -10.447 1.00 1.45 C ATOM 2622 CD GLU B 53 -36.747 4.912 -10.492 1.00 1.51 C ATOM 2623 OE1 GLU B 53 -37.837 4.310 -10.436 1.00 1.66 O ATOM 2624 OE2 GLU B 53 -35.652 4.318 -10.599 1.00 1.58 O ATOM 0 H GLU B 53 -37.353 7.588 -6.687 1.00 1.09 H new ATOM 0 HA GLU B 53 -36.192 5.329 -8.012 1.00 1.18 H new ATOM 0 HB2 GLU B 53 -38.114 6.740 -8.827 1.00 1.28 H new ATOM 0 HB3 GLU B 53 -36.988 8.058 -9.084 1.00 1.28 H new ATOM 0 HG2 GLU B 53 -37.484 6.803 -11.162 1.00 1.45 H new ATOM 0 HG3 GLU B 53 -35.778 6.798 -10.761 1.00 1.45 H new ATOM 2631 N LYS B 54 -34.436 8.057 -7.595 1.00 1.13 N ATOM 2632 CA LYS B 54 -33.098 8.624 -7.686 1.00 1.14 C ATOM 2633 C LYS B 54 -32.136 7.803 -6.846 1.00 1.05 C ATOM 2634 O LYS B 54 -31.033 7.497 -7.280 1.00 1.09 O ATOM 2635 CB LYS B 54 -33.085 10.082 -7.224 1.00 1.16 C ATOM 2636 CG LYS B 54 -33.793 11.024 -8.177 1.00 1.32 C ATOM 2637 CD LYS B 54 -33.645 12.465 -7.727 1.00 1.48 C ATOM 2638 CE LYS B 54 -34.310 13.419 -8.706 1.00 1.68 C ATOM 2639 NZ LYS B 54 -34.041 14.841 -8.374 1.00 2.09 N ATOM 0 H LYS B 54 -35.100 8.626 -7.070 1.00 1.13 H new ATOM 0 HA LYS B 54 -32.783 8.598 -8.729 1.00 1.14 H new ATOM 0 HB2 LYS B 54 -33.556 10.148 -6.243 1.00 1.16 H new ATOM 0 HB3 LYS B 54 -32.052 10.408 -7.104 1.00 1.16 H new ATOM 0 HG2 LYS B 54 -33.382 10.909 -9.180 1.00 1.32 H new ATOM 0 HG3 LYS B 54 -34.850 10.764 -8.233 1.00 1.32 H new ATOM 0 HD2 LYS B 54 -34.088 12.587 -6.739 1.00 1.48 H new ATOM 0 HD3 LYS B 54 -32.588 12.713 -7.635 1.00 1.48 H new ATOM 0 HE2 LYS B 54 -33.953 13.209 -9.714 1.00 1.68 H new ATOM 0 HE3 LYS B 54 -35.386 13.245 -8.706 1.00 1.68 H new ATOM 0 HZ1 LYS B 54 -34.514 15.455 -9.068 1.00 2.09 H new ATOM 0 HZ2 LYS B 54 -34.404 15.050 -7.422 1.00 2.09 H new ATOM 0 HZ3 LYS B 54 -33.016 15.015 -8.399 1.00 2.09 H new ATOM 2653 N LEU B 55 -32.575 7.439 -5.645 1.00 0.98 N ATOM 2654 CA LEU B 55 -31.763 6.632 -4.742 1.00 0.95 C ATOM 2655 C LEU B 55 -31.596 5.224 -5.300 1.00 0.99 C ATOM 2656 O LEU B 55 -30.575 4.572 -5.090 1.00 0.99 O ATOM 2657 CB LEU B 55 -32.397 6.578 -3.349 1.00 0.94 C ATOM 2658 CG LEU B 55 -31.862 7.606 -2.345 1.00 1.02 C ATOM 2659 CD1 LEU B 55 -30.391 7.354 -2.060 1.00 1.13 C ATOM 2660 CD2 LEU B 55 -32.065 9.021 -2.866 1.00 1.09 C ATOM 0 H LEU B 55 -33.491 7.691 -5.274 1.00 0.98 H new ATOM 0 HA LEU B 55 -30.780 7.095 -4.655 1.00 0.95 H new ATOM 0 HB2 LEU B 55 -33.473 6.721 -3.452 1.00 0.94 H new ATOM 0 HB3 LEU B 55 -32.246 5.580 -2.938 1.00 0.94 H new ATOM 0 HG LEU B 55 -32.420 7.498 -1.415 1.00 1.02 H new ATOM 0 HD11 LEU B 55 -30.027 8.092 -1.346 1.00 1.13 H new ATOM 0 HD12 LEU B 55 -30.267 6.354 -1.643 1.00 1.13 H new ATOM 0 HD13 LEU B 55 -29.822 7.434 -2.986 1.00 1.13 H new ATOM 0 HD21 LEU B 55 -31.679 9.735 -2.139 1.00 1.09 H new ATOM 0 HD22 LEU B 55 -31.534 9.141 -3.810 1.00 1.09 H new ATOM 0 HD23 LEU B 55 -33.128 9.202 -3.023 1.00 1.09 H new ATOM 2672 N ASN B 56 -32.611 4.775 -6.026 1.00 1.06 N ATOM 2673 CA ASN B 56 -32.622 3.451 -6.642 1.00 1.16 C ATOM 2674 C ASN B 56 -31.426 3.269 -7.575 1.00 1.20 C ATOM 2675 O ASN B 56 -30.674 2.300 -7.463 1.00 1.26 O ATOM 2676 CB ASN B 56 -33.937 3.261 -7.414 1.00 1.26 C ATOM 2677 CG ASN B 56 -34.033 1.929 -8.137 1.00 1.44 C ATOM 2678 OD1 ASN B 56 -33.554 0.906 -7.645 1.00 1.49 O ATOM 2679 ND2 ASN B 56 -34.661 1.930 -9.307 1.00 1.58 N ATOM 0 H ASN B 56 -33.454 5.320 -6.206 1.00 1.06 H new ATOM 0 HA ASN B 56 -32.548 2.698 -5.858 1.00 1.16 H new ATOM 0 HB2 ASN B 56 -34.772 3.348 -6.719 1.00 1.26 H new ATOM 0 HB3 ASN B 56 -34.041 4.067 -8.140 1.00 1.26 H new ATOM 0 HD21 ASN B 56 -34.761 1.062 -9.833 1.00 1.58 H new ATOM 0 HD22 ASN B 56 -35.044 2.799 -9.680 1.00 1.58 H new ATOM 2686 N LYS B 57 -31.245 4.221 -8.476 1.00 1.21 N ATOM 2687 CA LYS B 57 -30.142 4.172 -9.428 1.00 1.29 C ATOM 2688 C LYS B 57 -28.829 4.588 -8.770 1.00 1.21 C ATOM 2689 O LYS B 57 -27.762 4.122 -9.158 1.00 1.26 O ATOM 2690 CB LYS B 57 -30.433 5.049 -10.649 1.00 1.39 C ATOM 2691 CG LYS B 57 -31.046 6.404 -10.317 1.00 1.52 C ATOM 2692 CD LYS B 57 -31.394 7.187 -11.573 1.00 1.62 C ATOM 2693 CE LYS B 57 -32.414 6.454 -12.434 1.00 1.73 C ATOM 2694 NZ LYS B 57 -33.722 6.295 -11.745 1.00 1.81 N ATOM 0 H LYS B 57 -31.847 5.039 -8.570 1.00 1.21 H new ATOM 0 HA LYS B 57 -30.040 3.140 -9.765 1.00 1.29 H new ATOM 0 HB2 LYS B 57 -29.504 5.208 -11.197 1.00 1.39 H new ATOM 0 HB3 LYS B 57 -31.108 4.512 -11.315 1.00 1.39 H new ATOM 0 HG2 LYS B 57 -31.945 6.260 -9.717 1.00 1.52 H new ATOM 0 HG3 LYS B 57 -30.348 6.981 -9.711 1.00 1.52 H new ATOM 0 HD2 LYS B 57 -31.789 8.164 -11.294 1.00 1.62 H new ATOM 0 HD3 LYS B 57 -30.488 7.363 -12.154 1.00 1.62 H new ATOM 0 HE2 LYS B 57 -32.560 7.001 -13.365 1.00 1.73 H new ATOM 0 HE3 LYS B 57 -32.024 5.472 -12.699 1.00 1.73 H new ATOM 0 HZ1 LYS B 57 -33.930 5.283 -11.623 1.00 1.81 H new ATOM 0 HZ2 LYS B 57 -33.682 6.755 -10.813 1.00 1.81 H new ATOM 0 HZ3 LYS B 57 -34.471 6.736 -12.316 1.00 1.81 H new ATOM 2708 N LEU B 58 -28.919 5.472 -7.782 1.00 1.12 N ATOM 2709 CA LEU B 58 -27.741 5.956 -7.067 1.00 1.09 C ATOM 2710 C LEU B 58 -26.989 4.799 -6.413 1.00 1.08 C ATOM 2711 O LEU B 58 -25.778 4.657 -6.584 1.00 1.11 O ATOM 2712 CB LEU B 58 -28.150 6.980 -6.000 1.00 1.06 C ATOM 2713 CG LEU B 58 -27.523 8.373 -6.138 1.00 1.21 C ATOM 2714 CD1 LEU B 58 -26.022 8.313 -5.900 1.00 1.37 C ATOM 2715 CD2 LEU B 58 -27.823 8.955 -7.513 1.00 1.40 C ATOM 0 H LEU B 58 -29.800 5.870 -7.456 1.00 1.12 H new ATOM 0 HA LEU B 58 -27.080 6.436 -7.789 1.00 1.09 H new ATOM 0 HB2 LEU B 58 -29.235 7.086 -6.022 1.00 1.06 H new ATOM 0 HB3 LEU B 58 -27.889 6.580 -5.020 1.00 1.06 H new ATOM 0 HG LEU B 58 -27.962 9.024 -5.382 1.00 1.21 H new ATOM 0 HD11 LEU B 58 -25.597 9.312 -6.003 1.00 1.37 H new ATOM 0 HD12 LEU B 58 -25.828 7.937 -4.895 1.00 1.37 H new ATOM 0 HD13 LEU B 58 -25.564 7.647 -6.631 1.00 1.37 H new ATOM 0 HD21 LEU B 58 -27.372 9.944 -7.596 1.00 1.40 H new ATOM 0 HD22 LEU B 58 -27.411 8.302 -8.282 1.00 1.40 H new ATOM 0 HD23 LEU B 58 -28.902 9.036 -7.646 1.00 1.40 H new ATOM 2727 N ILE B 59 -27.715 3.967 -5.676 1.00 1.08 N ATOM 2728 CA ILE B 59 -27.118 2.825 -5.000 1.00 1.15 C ATOM 2729 C ILE B 59 -26.647 1.783 -6.017 1.00 1.25 C ATOM 2730 O ILE B 59 -25.640 1.105 -5.808 1.00 1.32 O ATOM 2731 CB ILE B 59 -28.091 2.193 -3.967 1.00 1.20 C ATOM 2732 CG1 ILE B 59 -27.317 1.358 -2.949 1.00 1.33 C ATOM 2733 CG2 ILE B 59 -29.154 1.337 -4.645 1.00 1.22 C ATOM 2734 CD1 ILE B 59 -26.342 2.161 -2.117 1.00 1.37 C ATOM 0 H ILE B 59 -28.720 4.063 -5.532 1.00 1.08 H new ATOM 0 HA ILE B 59 -26.250 3.186 -4.447 1.00 1.15 H new ATOM 0 HB ILE B 59 -28.598 3.009 -3.451 1.00 1.20 H new ATOM 0 HG12 ILE B 59 -28.026 0.863 -2.285 1.00 1.33 H new ATOM 0 HG13 ILE B 59 -26.772 0.574 -3.475 1.00 1.33 H new ATOM 0 HG21 ILE B 59 -29.815 0.912 -3.890 1.00 1.22 H new ATOM 0 HG22 ILE B 59 -29.735 1.954 -5.331 1.00 1.22 H new ATOM 0 HG23 ILE B 59 -28.673 0.532 -5.200 1.00 1.22 H new ATOM 0 HD11 ILE B 59 -25.830 1.500 -1.417 1.00 1.37 H new ATOM 0 HD12 ILE B 59 -25.610 2.635 -2.771 1.00 1.37 H new ATOM 0 HD13 ILE B 59 -26.883 2.928 -1.562 1.00 1.37 H new ATOM 2746 N GLU B 60 -27.380 1.669 -7.122 1.00 1.29 N ATOM 2747 CA GLU B 60 -27.047 0.720 -8.178 1.00 1.44 C ATOM 2748 C GLU B 60 -25.680 1.045 -8.785 1.00 1.40 C ATOM 2749 O GLU B 60 -24.855 0.154 -8.999 1.00 1.51 O ATOM 2750 CB GLU B 60 -28.126 0.736 -9.263 1.00 1.54 C ATOM 2751 CG GLU B 60 -27.903 -0.292 -10.357 1.00 1.75 C ATOM 2752 CD GLU B 60 -28.917 -0.179 -11.474 1.00 1.96 C ATOM 2753 OE1 GLU B 60 -28.812 0.771 -12.287 1.00 2.17 O ATOM 2754 OE2 GLU B 60 -29.814 -1.045 -11.555 1.00 2.28 O ATOM 0 H GLU B 60 -28.213 2.227 -7.309 1.00 1.29 H new ATOM 0 HA GLU B 60 -27.001 -0.278 -7.742 1.00 1.44 H new ATOM 0 HB2 GLU B 60 -29.097 0.558 -8.801 1.00 1.54 H new ATOM 0 HB3 GLU B 60 -28.164 1.729 -9.711 1.00 1.54 H new ATOM 0 HG2 GLU B 60 -26.901 -0.170 -10.767 1.00 1.75 H new ATOM 0 HG3 GLU B 60 -27.951 -1.292 -9.927 1.00 1.75 H new ATOM 2761 N GLY B 61 -25.444 2.332 -9.030 1.00 1.29 N ATOM 2762 CA GLY B 61 -24.183 2.771 -9.602 1.00 1.28 C ATOM 2763 C GLY B 61 -23.018 2.472 -8.684 1.00 1.21 C ATOM 2764 O GLY B 61 -21.943 2.091 -9.139 1.00 1.23 O ATOM 0 H GLY B 61 -26.109 3.082 -8.841 1.00 1.29 H new ATOM 0 HA2 GLY B 61 -24.027 2.277 -10.561 1.00 1.28 H new ATOM 0 HA3 GLY B 61 -24.226 3.842 -9.799 1.00 1.28 H new ATOM 2768 N TYR B 62 -23.243 2.631 -7.383 1.00 1.19 N ATOM 2769 CA TYR B 62 -22.209 2.356 -6.390 1.00 1.23 C ATOM 2770 C TYR B 62 -21.935 0.853 -6.331 1.00 1.35 C ATOM 2771 O TYR B 62 -20.810 0.419 -6.090 1.00 1.37 O ATOM 2772 CB TYR B 62 -22.643 2.864 -5.011 1.00 1.28 C ATOM 2773 CG TYR B 62 -21.611 2.656 -3.926 1.00 1.60 C ATOM 2774 CD1 TYR B 62 -20.551 3.542 -3.771 1.00 2.11 C ATOM 2775 CD2 TYR B 62 -21.696 1.574 -3.061 1.00 2.25 C ATOM 2776 CE1 TYR B 62 -19.602 3.354 -2.782 1.00 2.72 C ATOM 2777 CE2 TYR B 62 -20.754 1.380 -2.071 1.00 2.90 C ATOM 2778 CZ TYR B 62 -19.709 2.273 -1.934 1.00 2.96 C ATOM 2779 OH TYR B 62 -18.763 2.076 -0.950 1.00 3.75 O ATOM 0 H TYR B 62 -24.130 2.948 -6.992 1.00 1.19 H new ATOM 0 HA TYR B 62 -21.296 2.876 -6.680 1.00 1.23 H new ATOM 0 HB2 TYR B 62 -22.871 3.928 -5.082 1.00 1.28 H new ATOM 0 HB3 TYR B 62 -23.565 2.359 -4.723 1.00 1.28 H new ATOM 0 HD1 TYR B 62 -20.467 4.391 -4.433 1.00 2.11 H new ATOM 0 HD2 TYR B 62 -22.511 0.873 -3.164 1.00 2.25 H new ATOM 0 HE1 TYR B 62 -18.783 4.050 -2.675 1.00 2.72 H new ATOM 0 HE2 TYR B 62 -20.834 0.533 -1.406 1.00 2.90 H new ATOM 0 HH TYR B 62 -17.971 2.619 -1.145 1.00 3.75 H new ATOM 2789 N THR B 63 -22.982 0.071 -6.564 1.00 1.51 N ATOM 2790 CA THR B 63 -22.884 -1.379 -6.542 1.00 1.71 C ATOM 2791 C THR B 63 -22.049 -1.895 -7.716 1.00 1.67 C ATOM 2792 O THR B 63 -21.144 -2.710 -7.538 1.00 1.80 O ATOM 2793 CB THR B 63 -24.284 -2.018 -6.593 1.00 1.94 C ATOM 2794 OG1 THR B 63 -25.091 -1.499 -5.531 1.00 2.00 O ATOM 2795 CG2 THR B 63 -24.212 -3.531 -6.479 1.00 2.31 C ATOM 0 H THR B 63 -23.916 0.423 -6.772 1.00 1.51 H new ATOM 0 HA THR B 63 -22.392 -1.659 -5.611 1.00 1.71 H new ATOM 0 HB THR B 63 -24.729 -1.770 -7.557 1.00 1.94 H new ATOM 0 HG1 THR B 63 -25.533 -0.676 -5.828 1.00 2.00 H new ATOM 0 HG21 THR B 63 -25.219 -3.947 -6.519 1.00 2.31 H new ATOM 0 HG22 THR B 63 -23.621 -3.930 -7.304 1.00 2.31 H new ATOM 0 HG23 THR B 63 -23.744 -3.803 -5.533 1.00 2.31 H new ATOM 2803 N TYR B 64 -22.334 -1.392 -8.913 1.00 1.57 N ATOM 2804 CA TYR B 64 -21.615 -1.812 -10.112 1.00 1.63 C ATOM 2805 C TYR B 64 -20.458 -0.860 -10.404 1.00 1.37 C ATOM 2806 O TYR B 64 -20.093 -0.646 -11.560 1.00 1.46 O ATOM 2807 CB TYR B 64 -22.571 -1.871 -11.313 1.00 1.90 C ATOM 2808 CG TYR B 64 -23.691 -2.877 -11.154 1.00 2.42 C ATOM 2809 CD1 TYR B 64 -23.486 -4.228 -11.412 1.00 2.81 C ATOM 2810 CD2 TYR B 64 -24.956 -2.475 -10.744 1.00 3.10 C ATOM 2811 CE1 TYR B 64 -24.511 -5.145 -11.263 1.00 3.50 C ATOM 2812 CE2 TYR B 64 -25.982 -3.385 -10.592 1.00 3.76 C ATOM 2813 CZ TYR B 64 -25.756 -4.715 -10.851 1.00 3.84 C ATOM 2814 OH TYR B 64 -26.783 -5.620 -10.703 1.00 4.62 O ATOM 0 H TYR B 64 -23.058 -0.693 -9.079 1.00 1.57 H new ATOM 0 HA TYR B 64 -21.208 -2.808 -9.939 1.00 1.63 H new ATOM 0 HB2 TYR B 64 -23.003 -0.883 -11.471 1.00 1.90 H new ATOM 0 HB3 TYR B 64 -22.000 -2.116 -12.208 1.00 1.90 H new ATOM 0 HD1 TYR B 64 -22.512 -4.566 -11.733 1.00 2.81 H new ATOM 0 HD2 TYR B 64 -25.140 -1.430 -10.540 1.00 3.10 H new ATOM 0 HE1 TYR B 64 -24.338 -6.191 -11.468 1.00 3.50 H new ATOM 0 HE2 TYR B 64 -26.958 -3.053 -10.271 1.00 3.76 H new ATOM 0 HH TYR B 64 -27.591 -5.152 -10.406 1.00 4.62 H new ATOM 2824 N GLY B 65 -19.886 -0.294 -9.350 1.00 1.20 N ATOM 2825 CA GLY B 65 -18.786 0.632 -9.510 1.00 1.11 C ATOM 2826 C GLY B 65 -17.481 -0.061 -9.843 1.00 1.04 C ATOM 2827 O GLY B 65 -16.797 -0.575 -8.958 1.00 1.03 O ATOM 0 H GLY B 65 -20.167 -0.461 -8.384 1.00 1.20 H new ATOM 0 HA2 GLY B 65 -19.027 1.343 -10.301 1.00 1.11 H new ATOM 0 HA3 GLY B 65 -18.664 1.206 -8.592 1.00 1.11 H new ATOM 2831 N GLU B 66 -17.136 -0.081 -11.122 1.00 1.04 N ATOM 2832 CA GLU B 66 -15.895 -0.700 -11.568 1.00 1.02 C ATOM 2833 C GLU B 66 -14.705 0.093 -11.043 1.00 0.98 C ATOM 2834 O GLU B 66 -13.621 -0.451 -10.822 1.00 0.95 O ATOM 2835 CB GLU B 66 -15.856 -0.786 -13.089 1.00 1.10 C ATOM 2836 CG GLU B 66 -16.773 -1.858 -13.653 1.00 1.36 C ATOM 2837 CD GLU B 66 -16.247 -3.256 -13.412 1.00 1.66 C ATOM 2838 OE1 GLU B 66 -15.336 -3.682 -14.150 1.00 2.08 O ATOM 2839 OE2 GLU B 66 -16.734 -3.933 -12.481 1.00 2.08 O ATOM 0 H GLU B 66 -17.698 0.324 -11.870 1.00 1.04 H new ATOM 0 HA GLU B 66 -15.844 -1.714 -11.172 1.00 1.02 H new ATOM 0 HB2 GLU B 66 -16.137 0.180 -13.508 1.00 1.10 H new ATOM 0 HB3 GLU B 66 -14.834 -0.987 -13.409 1.00 1.10 H new ATOM 0 HG2 GLU B 66 -17.760 -1.762 -13.201 1.00 1.36 H new ATOM 0 HG3 GLU B 66 -16.896 -1.699 -14.724 1.00 1.36 H new ATOM 2846 N GLU B 67 -14.927 1.386 -10.833 1.00 1.00 N ATOM 2847 CA GLU B 67 -13.904 2.271 -10.292 1.00 1.01 C ATOM 2848 C GLU B 67 -13.550 1.848 -8.867 1.00 0.97 C ATOM 2849 O GLU B 67 -12.415 2.001 -8.420 1.00 0.95 O ATOM 2850 CB GLU B 67 -14.410 3.710 -10.293 1.00 1.10 C ATOM 2851 CG GLU B 67 -14.595 4.286 -11.685 1.00 1.53 C ATOM 2852 CD GLU B 67 -13.363 5.015 -12.177 1.00 1.81 C ATOM 2853 OE1 GLU B 67 -12.870 5.894 -11.448 1.00 2.44 O ATOM 2854 OE2 GLU B 67 -12.898 4.715 -13.296 1.00 2.28 O ATOM 0 H GLU B 67 -15.815 1.847 -11.032 1.00 1.00 H new ATOM 0 HA GLU B 67 -13.012 2.205 -10.915 1.00 1.01 H new ATOM 0 HB2 GLU B 67 -15.361 3.753 -9.761 1.00 1.10 H new ATOM 0 HB3 GLU B 67 -13.708 4.334 -9.741 1.00 1.10 H new ATOM 0 HG2 GLU B 67 -14.839 3.481 -12.379 1.00 1.53 H new ATOM 0 HG3 GLU B 67 -15.442 4.972 -11.682 1.00 1.53 H new ATOM 2861 N ARG B 68 -14.540 1.302 -8.168 1.00 0.98 N ATOM 2862 CA ARG B 68 -14.356 0.829 -6.807 1.00 0.99 C ATOM 2863 C ARG B 68 -13.457 -0.401 -6.836 1.00 0.95 C ATOM 2864 O ARG B 68 -12.605 -0.592 -5.963 1.00 0.95 O ATOM 2865 CB ARG B 68 -15.717 0.480 -6.197 1.00 1.04 C ATOM 2866 CG ARG B 68 -15.721 0.361 -4.684 1.00 1.10 C ATOM 2867 CD ARG B 68 -16.938 -0.419 -4.209 1.00 1.41 C ATOM 2868 NE ARG B 68 -17.306 -0.105 -2.830 1.00 1.59 N ATOM 2869 CZ ARG B 68 -17.225 -0.965 -1.818 1.00 1.88 C ATOM 2870 NH1 ARG B 68 -16.659 -2.158 -1.989 1.00 2.30 N ATOM 2871 NH2 ARG B 68 -17.683 -0.615 -0.625 1.00 2.17 N ATOM 0 H ARG B 68 -15.486 1.177 -8.529 1.00 0.98 H new ATOM 0 HA ARG B 68 -13.891 1.604 -6.198 1.00 0.99 H new ATOM 0 HB2 ARG B 68 -16.438 1.243 -6.490 1.00 1.04 H new ATOM 0 HB3 ARG B 68 -16.060 -0.463 -6.623 1.00 1.04 H new ATOM 0 HG2 ARG B 68 -14.811 -0.138 -4.351 1.00 1.10 H new ATOM 0 HG3 ARG B 68 -15.722 1.355 -4.236 1.00 1.10 H new ATOM 0 HD2 ARG B 68 -17.782 -0.202 -4.864 1.00 1.41 H new ATOM 0 HD3 ARG B 68 -16.735 -1.487 -4.293 1.00 1.41 H new ATOM 0 HE ARG B 68 -17.647 0.835 -2.630 1.00 1.59 H new ATOM 0 HH11 ARG B 68 -16.284 -2.418 -2.901 1.00 2.30 H new ATOM 0 HH12 ARG B 68 -16.601 -2.812 -1.208 1.00 2.30 H new ATOM 0 HH21 ARG B 68 -18.094 0.308 -0.487 1.00 2.17 H new ATOM 0 HH22 ARG B 68 -17.624 -1.269 0.156 1.00 2.17 H new ATOM 2885 N LYS B 69 -13.650 -1.221 -7.868 1.00 0.94 N ATOM 2886 CA LYS B 69 -12.853 -2.424 -8.054 1.00 0.94 C ATOM 2887 C LYS B 69 -11.410 -2.027 -8.338 1.00 0.89 C ATOM 2888 O LYS B 69 -10.470 -2.676 -7.876 1.00 0.88 O ATOM 2889 CB LYS B 69 -13.411 -3.263 -9.214 1.00 1.00 C ATOM 2890 CG LYS B 69 -12.594 -4.509 -9.522 1.00 1.28 C ATOM 2891 CD LYS B 69 -13.206 -5.310 -10.661 1.00 1.46 C ATOM 2892 CE LYS B 69 -12.897 -4.697 -12.020 1.00 1.55 C ATOM 2893 NZ LYS B 69 -13.610 -5.399 -13.120 1.00 1.70 N ATOM 0 H LYS B 69 -14.356 -1.070 -8.589 1.00 0.94 H new ATOM 0 HA LYS B 69 -12.894 -3.027 -7.147 1.00 0.94 H new ATOM 0 HB2 LYS B 69 -14.433 -3.560 -8.976 1.00 1.00 H new ATOM 0 HB3 LYS B 69 -13.459 -2.642 -10.108 1.00 1.00 H new ATOM 0 HG2 LYS B 69 -11.576 -4.222 -9.784 1.00 1.28 H new ATOM 0 HG3 LYS B 69 -12.530 -5.133 -8.630 1.00 1.28 H new ATOM 0 HD2 LYS B 69 -12.828 -6.332 -10.630 1.00 1.46 H new ATOM 0 HD3 LYS B 69 -14.286 -5.366 -10.526 1.00 1.46 H new ATOM 0 HE2 LYS B 69 -13.181 -3.645 -12.017 1.00 1.55 H new ATOM 0 HE3 LYS B 69 -11.823 -4.737 -12.200 1.00 1.55 H new ATOM 0 HZ1 LYS B 69 -12.942 -6.008 -13.634 1.00 1.70 H new ATOM 0 HZ2 LYS B 69 -14.374 -5.982 -12.722 1.00 1.70 H new ATOM 0 HZ3 LYS B 69 -14.014 -4.699 -13.774 1.00 1.70 H new ATOM 2907 N LEU B 70 -11.257 -0.933 -9.080 1.00 0.89 N ATOM 2908 CA LEU B 70 -9.945 -0.409 -9.431 1.00 0.87 C ATOM 2909 C LEU B 70 -9.175 -0.022 -8.172 1.00 0.83 C ATOM 2910 O LEU B 70 -7.952 -0.164 -8.113 1.00 0.82 O ATOM 2911 CB LEU B 70 -10.089 0.802 -10.356 1.00 0.91 C ATOM 2912 CG LEU B 70 -8.797 1.266 -11.036 1.00 0.96 C ATOM 2913 CD1 LEU B 70 -8.253 0.176 -11.952 1.00 1.04 C ATOM 2914 CD2 LEU B 70 -9.043 2.546 -11.824 1.00 1.04 C ATOM 0 H LEU B 70 -12.036 -0.389 -9.452 1.00 0.89 H new ATOM 0 HA LEU B 70 -9.388 -1.186 -9.955 1.00 0.87 H new ATOM 0 HB2 LEU B 70 -10.821 0.563 -11.128 1.00 0.91 H new ATOM 0 HB3 LEU B 70 -10.494 1.633 -9.779 1.00 0.91 H new ATOM 0 HG LEU B 70 -8.055 1.469 -10.264 1.00 0.96 H new ATOM 0 HD11 LEU B 70 -7.335 0.524 -12.426 1.00 1.04 H new ATOM 0 HD12 LEU B 70 -8.042 -0.719 -11.367 1.00 1.04 H new ATOM 0 HD13 LEU B 70 -8.992 -0.057 -12.719 1.00 1.04 H new ATOM 0 HD21 LEU B 70 -8.116 2.863 -12.301 1.00 1.04 H new ATOM 0 HD22 LEU B 70 -9.800 2.364 -12.587 1.00 1.04 H new ATOM 0 HD23 LEU B 70 -9.389 3.328 -11.149 1.00 1.04 H new ATOM 2926 N TYR B 71 -9.897 0.464 -7.163 1.00 0.84 N ATOM 2927 CA TYR B 71 -9.282 0.847 -5.895 1.00 0.84 C ATOM 2928 C TYR B 71 -8.761 -0.392 -5.178 1.00 0.83 C ATOM 2929 O TYR B 71 -7.704 -0.357 -4.554 1.00 0.82 O ATOM 2930 CB TYR B 71 -10.273 1.596 -4.996 1.00 0.91 C ATOM 2931 CG TYR B 71 -10.701 2.947 -5.534 1.00 0.92 C ATOM 2932 CD1 TYR B 71 -9.825 3.747 -6.262 1.00 0.93 C ATOM 2933 CD2 TYR B 71 -11.988 3.421 -5.308 1.00 1.01 C ATOM 2934 CE1 TYR B 71 -10.224 4.976 -6.749 1.00 1.00 C ATOM 2935 CE2 TYR B 71 -12.389 4.647 -5.793 1.00 1.09 C ATOM 2936 CZ TYR B 71 -11.506 5.418 -6.510 1.00 1.07 C ATOM 2937 OH TYR B 71 -11.906 6.640 -6.991 1.00 1.19 O ATOM 0 H TYR B 71 -10.907 0.601 -7.200 1.00 0.84 H new ATOM 0 HA TYR B 71 -8.452 1.519 -6.111 1.00 0.84 H new ATOM 0 HB2 TYR B 71 -11.159 0.976 -4.855 1.00 0.91 H new ATOM 0 HB3 TYR B 71 -9.822 1.735 -4.014 1.00 0.91 H new ATOM 0 HD1 TYR B 71 -8.819 3.402 -6.449 1.00 0.93 H new ATOM 0 HD2 TYR B 71 -12.685 2.819 -4.743 1.00 1.01 H new ATOM 0 HE1 TYR B 71 -9.535 5.587 -7.314 1.00 1.00 H new ATOM 0 HE2 TYR B 71 -13.393 5.000 -5.610 1.00 1.09 H new ATOM 0 HH TYR B 71 -11.164 7.060 -7.474 1.00 1.19 H new ATOM 2947 N ASP B 72 -9.509 -1.489 -5.283 1.00 0.86 N ATOM 2948 CA ASP B 72 -9.106 -2.752 -4.662 1.00 0.88 C ATOM 2949 C ASP B 72 -7.822 -3.257 -5.316 1.00 0.85 C ATOM 2950 O ASP B 72 -6.930 -3.775 -4.648 1.00 0.85 O ATOM 2951 CB ASP B 72 -10.218 -3.802 -4.790 1.00 0.95 C ATOM 2952 CG ASP B 72 -9.874 -5.107 -4.091 1.00 1.07 C ATOM 2953 OD1 ASP B 72 -9.938 -5.153 -2.846 1.00 1.31 O ATOM 2954 OD2 ASP B 72 -9.551 -6.098 -4.783 1.00 1.32 O ATOM 0 H ASP B 72 -10.393 -1.530 -5.789 1.00 0.86 H new ATOM 0 HA ASP B 72 -8.926 -2.579 -3.601 1.00 0.88 H new ATOM 0 HB2 ASP B 72 -11.141 -3.402 -4.370 1.00 0.95 H new ATOM 0 HB3 ASP B 72 -10.407 -3.998 -5.845 1.00 0.95 H new ATOM 2959 N SER B 73 -7.732 -3.073 -6.631 1.00 0.84 N ATOM 2960 CA SER B 73 -6.560 -3.486 -7.391 1.00 0.83 C ATOM 2961 C SER B 73 -5.354 -2.637 -6.995 1.00 0.79 C ATOM 2962 O SER B 73 -4.219 -3.115 -6.967 1.00 0.78 O ATOM 2963 CB SER B 73 -6.834 -3.351 -8.889 1.00 0.86 C ATOM 2964 OG SER B 73 -8.145 -3.791 -9.206 1.00 0.91 O ATOM 0 H SER B 73 -8.463 -2.637 -7.193 1.00 0.84 H new ATOM 0 HA SER B 73 -6.342 -4.530 -7.167 1.00 0.83 H new ATOM 0 HB2 SER B 73 -6.712 -2.311 -9.193 1.00 0.86 H new ATOM 0 HB3 SER B 73 -6.105 -3.935 -9.450 1.00 0.86 H new ATOM 0 HG SER B 73 -8.299 -3.694 -10.169 1.00 0.91 H new ATOM 2970 N ALA B 74 -5.620 -1.377 -6.668 1.00 0.79 N ATOM 2971 CA ALA B 74 -4.582 -0.448 -6.259 1.00 0.78 C ATOM 2972 C ALA B 74 -3.945 -0.911 -4.957 1.00 0.74 C ATOM 2973 O ALA B 74 -2.724 -0.868 -4.796 1.00 0.72 O ATOM 2974 CB ALA B 74 -5.157 0.951 -6.104 1.00 0.81 C ATOM 0 H ALA B 74 -6.558 -0.976 -6.680 1.00 0.79 H new ATOM 0 HA ALA B 74 -3.812 -0.421 -7.030 1.00 0.78 H new ATOM 0 HB1 ALA B 74 -4.367 1.637 -5.797 1.00 0.81 H new ATOM 0 HB2 ALA B 74 -5.574 1.280 -7.056 1.00 0.81 H new ATOM 0 HB3 ALA B 74 -5.942 0.940 -5.348 1.00 0.81 H new ATOM 2980 N LEU B 75 -4.785 -1.379 -4.041 1.00 0.76 N ATOM 2981 CA LEU B 75 -4.326 -1.870 -2.747 1.00 0.76 C ATOM 2982 C LEU B 75 -3.462 -3.114 -2.939 1.00 0.73 C ATOM 2983 O LEU B 75 -2.498 -3.327 -2.207 1.00 0.71 O ATOM 2984 CB LEU B 75 -5.529 -2.178 -1.844 1.00 0.81 C ATOM 2985 CG LEU B 75 -5.268 -2.143 -0.329 1.00 0.89 C ATOM 2986 CD1 LEU B 75 -4.716 -3.476 0.158 1.00 1.13 C ATOM 2987 CD2 LEU B 75 -4.322 -1.007 0.035 1.00 1.14 C ATOM 0 H LEU B 75 -5.795 -1.429 -4.172 1.00 0.76 H new ATOM 0 HA LEU B 75 -3.723 -1.101 -2.265 1.00 0.76 H new ATOM 0 HB2 LEU B 75 -6.320 -1.464 -2.072 1.00 0.81 H new ATOM 0 HB3 LEU B 75 -5.908 -3.167 -2.104 1.00 0.81 H new ATOM 0 HG LEU B 75 -6.221 -1.965 0.170 1.00 0.89 H new ATOM 0 HD11 LEU B 75 -4.540 -3.426 1.232 1.00 1.13 H new ATOM 0 HD12 LEU B 75 -5.435 -4.267 -0.055 1.00 1.13 H new ATOM 0 HD13 LEU B 75 -3.778 -3.690 -0.354 1.00 1.13 H new ATOM 0 HD21 LEU B 75 -4.154 -1.004 1.112 1.00 1.14 H new ATOM 0 HD22 LEU B 75 -3.372 -1.146 -0.480 1.00 1.14 H new ATOM 0 HD23 LEU B 75 -4.762 -0.056 -0.266 1.00 1.14 H new ATOM 2999 N SER B 76 -3.799 -3.919 -3.946 1.00 0.75 N ATOM 3000 CA SER B 76 -3.047 -5.134 -4.238 1.00 0.75 C ATOM 3001 C SER B 76 -1.611 -4.799 -4.634 1.00 0.72 C ATOM 3002 O SER B 76 -0.681 -5.527 -4.288 1.00 0.72 O ATOM 3003 CB SER B 76 -3.741 -5.929 -5.345 1.00 0.81 C ATOM 3004 OG SER B 76 -5.079 -6.236 -4.986 1.00 0.91 O ATOM 0 H SER B 76 -4.587 -3.750 -4.571 1.00 0.75 H new ATOM 0 HA SER B 76 -3.014 -5.747 -3.337 1.00 0.75 H new ATOM 0 HB2 SER B 76 -3.732 -5.354 -6.271 1.00 0.81 H new ATOM 0 HB3 SER B 76 -3.191 -6.850 -5.536 1.00 0.81 H new ATOM 0 HG SER B 76 -5.605 -5.410 -4.945 1.00 0.91 H new ATOM 3010 N LYS B 77 -1.432 -3.686 -5.340 1.00 0.72 N ATOM 3011 CA LYS B 77 -0.102 -3.255 -5.761 1.00 0.71 C ATOM 3012 C LYS B 77 0.744 -2.914 -4.540 1.00 0.67 C ATOM 3013 O LYS B 77 1.951 -3.161 -4.512 1.00 0.66 O ATOM 3014 CB LYS B 77 -0.197 -2.044 -6.693 1.00 0.75 C ATOM 3015 CG LYS B 77 -0.798 -2.359 -8.060 1.00 0.93 C ATOM 3016 CD LYS B 77 -0.956 -1.106 -8.911 1.00 1.09 C ATOM 3017 CE LYS B 77 0.380 -0.624 -9.452 1.00 1.34 C ATOM 3018 NZ LYS B 77 0.506 -0.871 -10.911 1.00 1.68 N ATOM 0 H LYS B 77 -2.189 -3.068 -5.632 1.00 0.72 H new ATOM 0 HA LYS B 77 0.372 -4.071 -6.306 1.00 0.71 H new ATOM 0 HB2 LYS B 77 -0.800 -1.274 -6.211 1.00 0.75 H new ATOM 0 HB3 LYS B 77 0.800 -1.627 -6.833 1.00 0.75 H new ATOM 0 HG2 LYS B 77 -0.161 -3.074 -8.581 1.00 0.93 H new ATOM 0 HG3 LYS B 77 -1.770 -2.834 -7.929 1.00 0.93 H new ATOM 0 HD2 LYS B 77 -1.632 -1.312 -9.741 1.00 1.09 H new ATOM 0 HD3 LYS B 77 -1.414 -0.316 -8.315 1.00 1.09 H new ATOM 0 HE2 LYS B 77 0.489 0.442 -9.253 1.00 1.34 H new ATOM 0 HE3 LYS B 77 1.189 -1.131 -8.926 1.00 1.34 H new ATOM 0 HZ1 LYS B 77 1.430 -0.529 -11.243 1.00 1.68 H new ATOM 0 HZ2 LYS B 77 0.427 -1.891 -11.099 1.00 1.68 H new ATOM 0 HZ3 LYS B 77 -0.251 -0.367 -11.415 1.00 1.68 H new ATOM 3032 N ILE B 78 0.092 -2.354 -3.528 1.00 0.66 N ATOM 3033 CA ILE B 78 0.759 -1.992 -2.287 1.00 0.64 C ATOM 3034 C ILE B 78 1.205 -3.254 -1.551 1.00 0.63 C ATOM 3035 O ILE B 78 2.329 -3.331 -1.054 1.00 0.64 O ATOM 3036 CB ILE B 78 -0.165 -1.153 -1.375 1.00 0.67 C ATOM 3037 CG1 ILE B 78 -0.455 0.213 -2.015 1.00 0.90 C ATOM 3038 CG2 ILE B 78 0.448 -0.979 0.009 1.00 0.79 C ATOM 3039 CD1 ILE B 78 0.733 1.154 -2.032 1.00 1.15 C ATOM 0 H ILE B 78 -0.905 -2.140 -3.545 1.00 0.66 H new ATOM 0 HA ILE B 78 1.630 -1.386 -2.536 1.00 0.64 H new ATOM 0 HB ILE B 78 -1.108 -1.688 -1.261 1.00 0.67 H new ATOM 0 HG12 ILE B 78 -0.796 0.057 -3.038 1.00 0.90 H new ATOM 0 HG13 ILE B 78 -1.274 0.689 -1.475 1.00 0.90 H new ATOM 0 HG21 ILE B 78 -0.221 -0.385 0.631 1.00 0.79 H new ATOM 0 HG22 ILE B 78 0.597 -1.957 0.467 1.00 0.79 H new ATOM 0 HG23 ILE B 78 1.408 -0.470 -0.080 1.00 0.79 H new ATOM 0 HD11 ILE B 78 0.445 2.095 -2.500 1.00 1.15 H new ATOM 0 HD12 ILE B 78 1.062 1.343 -1.010 1.00 1.15 H new ATOM 0 HD13 ILE B 78 1.547 0.702 -2.598 1.00 1.15 H new ATOM 3051 N GLU B 79 0.325 -4.253 -1.520 1.00 0.65 N ATOM 3052 CA GLU B 79 0.621 -5.520 -0.858 1.00 0.67 C ATOM 3053 C GLU B 79 1.835 -6.188 -1.501 1.00 0.67 C ATOM 3054 O GLU B 79 2.682 -6.756 -0.813 1.00 0.70 O ATOM 3055 CB GLU B 79 -0.585 -6.461 -0.927 1.00 0.71 C ATOM 3056 CG GLU B 79 -0.441 -7.695 -0.042 1.00 0.77 C ATOM 3057 CD GLU B 79 -1.413 -8.804 -0.394 1.00 1.10 C ATOM 3058 OE1 GLU B 79 -2.582 -8.746 0.044 1.00 1.59 O ATOM 3059 OE2 GLU B 79 -1.013 -9.741 -1.117 1.00 1.74 O ATOM 0 H GLU B 79 -0.600 -4.208 -1.947 1.00 0.65 H new ATOM 0 HA GLU B 79 0.844 -5.311 0.188 1.00 0.67 H new ATOM 0 HB2 GLU B 79 -1.481 -5.914 -0.632 1.00 0.71 H new ATOM 0 HB3 GLU B 79 -0.730 -6.778 -1.960 1.00 0.71 H new ATOM 0 HG2 GLU B 79 0.577 -8.075 -0.124 1.00 0.77 H new ATOM 0 HG3 GLU B 79 -0.591 -7.407 0.998 1.00 0.77 H new ATOM 3066 N LYS B 80 1.914 -6.104 -2.826 1.00 0.67 N ATOM 3067 CA LYS B 80 3.026 -6.685 -3.572 1.00 0.69 C ATOM 3068 C LYS B 80 4.331 -5.980 -3.217 1.00 0.68 C ATOM 3069 O LYS B 80 5.405 -6.592 -3.214 1.00 0.72 O ATOM 3070 CB LYS B 80 2.753 -6.603 -5.076 1.00 0.72 C ATOM 3071 CG LYS B 80 1.526 -7.392 -5.493 1.00 0.79 C ATOM 3072 CD LYS B 80 1.333 -7.394 -7.000 1.00 1.18 C ATOM 3073 CE LYS B 80 0.111 -8.209 -7.391 1.00 1.78 C ATOM 3074 NZ LYS B 80 0.173 -8.682 -8.799 1.00 2.05 N ATOM 0 H LYS B 80 1.218 -5.637 -3.407 1.00 0.67 H new ATOM 0 HA LYS B 80 3.123 -7.735 -3.298 1.00 0.69 H new ATOM 0 HB2 LYS B 80 2.623 -5.559 -5.361 1.00 0.72 H new ATOM 0 HB3 LYS B 80 3.621 -6.976 -5.619 1.00 0.72 H new ATOM 0 HG2 LYS B 80 1.618 -8.419 -5.138 1.00 0.79 H new ATOM 0 HG3 LYS B 80 0.643 -6.968 -5.015 1.00 0.79 H new ATOM 0 HD2 LYS B 80 1.221 -6.370 -7.357 1.00 1.18 H new ATOM 0 HD3 LYS B 80 2.219 -7.806 -7.483 1.00 1.18 H new ATOM 0 HE2 LYS B 80 0.022 -9.068 -6.726 1.00 1.78 H new ATOM 0 HE3 LYS B 80 -0.785 -7.604 -7.253 1.00 1.78 H new ATOM 0 HZ1 LYS B 80 -0.682 -9.232 -9.018 1.00 2.05 H new ATOM 0 HZ2 LYS B 80 0.231 -7.863 -9.438 1.00 2.05 H new ATOM 0 HZ3 LYS B 80 1.013 -9.281 -8.927 1.00 2.05 H new ATOM 3088 N LEU B 81 4.235 -4.693 -2.899 1.00 0.65 N ATOM 3089 CA LEU B 81 5.401 -3.911 -2.514 1.00 0.67 C ATOM 3090 C LEU B 81 5.897 -4.385 -1.157 1.00 0.68 C ATOM 3091 O LEU B 81 7.098 -4.434 -0.905 1.00 0.72 O ATOM 3092 CB LEU B 81 5.069 -2.414 -2.464 1.00 0.67 C ATOM 3093 CG LEU B 81 5.940 -1.511 -3.347 1.00 0.78 C ATOM 3094 CD1 LEU B 81 7.412 -1.627 -2.972 1.00 1.02 C ATOM 3095 CD2 LEU B 81 5.739 -1.845 -4.816 1.00 0.97 C ATOM 0 H LEU B 81 3.359 -4.170 -2.901 1.00 0.65 H new ATOM 0 HA LEU B 81 6.182 -4.054 -3.261 1.00 0.67 H new ATOM 0 HB2 LEU B 81 4.027 -2.281 -2.756 1.00 0.67 H new ATOM 0 HB3 LEU B 81 5.156 -2.075 -1.432 1.00 0.67 H new ATOM 0 HG LEU B 81 5.630 -0.480 -3.178 1.00 0.78 H new ATOM 0 HD11 LEU B 81 8.004 -0.976 -3.615 1.00 1.02 H new ATOM 0 HD12 LEU B 81 7.547 -1.330 -1.932 1.00 1.02 H new ATOM 0 HD13 LEU B 81 7.740 -2.659 -3.100 1.00 1.02 H new ATOM 0 HD21 LEU B 81 6.365 -1.194 -5.426 1.00 0.97 H new ATOM 0 HD22 LEU B 81 6.015 -2.884 -4.994 1.00 0.97 H new ATOM 0 HD23 LEU B 81 4.693 -1.696 -5.083 1.00 0.97 H new ATOM 3107 N ILE B 82 4.955 -4.760 -0.294 1.00 0.68 N ATOM 3108 CA ILE B 82 5.283 -5.253 1.039 1.00 0.72 C ATOM 3109 C ILE B 82 6.113 -6.536 0.936 1.00 0.77 C ATOM 3110 O ILE B 82 7.059 -6.747 1.699 1.00 0.81 O ATOM 3111 CB ILE B 82 4.007 -5.517 1.879 1.00 0.72 C ATOM 3112 CG1 ILE B 82 3.077 -4.295 1.838 1.00 0.70 C ATOM 3113 CG2 ILE B 82 4.374 -5.868 3.316 1.00 0.78 C ATOM 3114 CD1 ILE B 82 1.787 -4.457 2.627 1.00 0.72 C ATOM 0 H ILE B 82 3.956 -4.731 -0.496 1.00 0.68 H new ATOM 0 HA ILE B 82 5.865 -4.482 1.544 1.00 0.72 H new ATOM 0 HB ILE B 82 3.478 -6.366 1.447 1.00 0.72 H new ATOM 0 HG12 ILE B 82 3.617 -3.430 2.223 1.00 0.70 H new ATOM 0 HG13 ILE B 82 2.828 -4.079 0.799 1.00 0.70 H new ATOM 0 HG21 ILE B 82 3.465 -6.050 3.890 1.00 0.78 H new ATOM 0 HG22 ILE B 82 4.994 -6.765 3.325 1.00 0.78 H new ATOM 0 HG23 ILE B 82 4.926 -5.041 3.763 1.00 0.78 H new ATOM 0 HD11 ILE B 82 1.192 -3.548 2.543 1.00 0.72 H new ATOM 0 HD12 ILE B 82 1.221 -5.299 2.229 1.00 0.72 H new ATOM 0 HD13 ILE B 82 2.022 -4.641 3.675 1.00 0.72 H new ATOM 3126 N GLU B 83 5.757 -7.384 -0.028 1.00 0.78 N ATOM 3127 CA GLU B 83 6.479 -8.629 -0.256 1.00 0.85 C ATOM 3128 C GLU B 83 7.853 -8.319 -0.857 1.00 0.87 C ATOM 3129 O GLU B 83 8.852 -8.939 -0.503 1.00 0.94 O ATOM 3130 CB GLU B 83 5.680 -9.551 -1.184 1.00 0.88 C ATOM 3131 CG GLU B 83 6.304 -10.932 -1.350 1.00 1.11 C ATOM 3132 CD GLU B 83 5.778 -11.950 -0.354 1.00 1.73 C ATOM 3133 OE1 GLU B 83 4.654 -12.459 -0.551 1.00 2.25 O ATOM 3134 OE2 GLU B 83 6.493 -12.272 0.614 1.00 2.41 O ATOM 0 H GLU B 83 4.973 -7.229 -0.662 1.00 0.78 H new ATOM 0 HA GLU B 83 6.614 -9.144 0.695 1.00 0.85 H new ATOM 0 HB2 GLU B 83 4.669 -9.662 -0.791 1.00 0.88 H new ATOM 0 HB3 GLU B 83 5.592 -9.080 -2.163 1.00 0.88 H new ATOM 0 HG2 GLU B 83 6.113 -11.291 -2.361 1.00 1.11 H new ATOM 0 HG3 GLU B 83 7.385 -10.851 -1.240 1.00 1.11 H new ATOM 3141 N THR B 84 7.893 -7.322 -1.737 1.00 0.83 N ATOM 3142 CA THR B 84 9.134 -6.906 -2.383 1.00 0.87 C ATOM 3143 C THR B 84 10.114 -6.329 -1.358 1.00 0.91 C ATOM 3144 O THR B 84 11.331 -6.448 -1.506 1.00 0.98 O ATOM 3145 CB THR B 84 8.863 -5.860 -3.484 1.00 0.84 C ATOM 3146 OG1 THR B 84 7.868 -6.354 -4.395 1.00 0.84 O ATOM 3147 CG2 THR B 84 10.138 -5.525 -4.246 1.00 0.87 C ATOM 0 H THR B 84 7.074 -6.784 -2.020 1.00 0.83 H new ATOM 0 HA THR B 84 9.577 -7.790 -2.841 1.00 0.87 H new ATOM 0 HB THR B 84 8.499 -4.950 -3.006 1.00 0.84 H new ATOM 0 HG1 THR B 84 6.997 -6.379 -3.946 1.00 0.84 H new ATOM 0 HG21 THR B 84 9.918 -4.785 -5.016 1.00 0.87 H new ATOM 0 HG22 THR B 84 10.879 -5.121 -3.556 1.00 0.87 H new ATOM 0 HG23 THR B 84 10.531 -6.428 -4.712 1.00 0.87 H new ATOM 3155 N LEU B 85 9.569 -5.710 -0.314 1.00 0.90 N ATOM 3156 CA LEU B 85 10.383 -5.132 0.749 1.00 0.98 C ATOM 3157 C LEU B 85 11.021 -6.238 1.587 1.00 1.07 C ATOM 3158 O LEU B 85 11.977 -6.011 2.331 1.00 1.22 O ATOM 3159 CB LEU B 85 9.528 -4.222 1.635 1.00 0.97 C ATOM 3160 CG LEU B 85 9.262 -2.825 1.066 1.00 0.91 C ATOM 3161 CD1 LEU B 85 8.031 -2.210 1.716 1.00 1.03 C ATOM 3162 CD2 LEU B 85 10.472 -1.928 1.272 1.00 1.01 C ATOM 0 H LEU B 85 8.564 -5.596 -0.182 1.00 0.90 H new ATOM 0 HA LEU B 85 11.175 -4.535 0.297 1.00 0.98 H new ATOM 0 HB2 LEU B 85 8.571 -4.712 1.816 1.00 0.97 H new ATOM 0 HB3 LEU B 85 10.020 -4.116 2.602 1.00 0.97 H new ATOM 0 HG LEU B 85 9.078 -2.919 -0.004 1.00 0.91 H new ATOM 0 HD11 LEU B 85 7.857 -1.218 1.300 1.00 1.03 H new ATOM 0 HD12 LEU B 85 7.164 -2.842 1.523 1.00 1.03 H new ATOM 0 HD13 LEU B 85 8.189 -2.130 2.791 1.00 1.03 H new ATOM 0 HD21 LEU B 85 10.266 -0.939 0.862 1.00 1.01 H new ATOM 0 HD22 LEU B 85 10.684 -1.842 2.338 1.00 1.01 H new ATOM 0 HD23 LEU B 85 11.335 -2.359 0.764 1.00 1.01 H new ATOM 3174 N SER B 86 10.485 -7.437 1.444 1.00 1.08 N ATOM 3175 CA SER B 86 10.977 -8.592 2.163 1.00 1.20 C ATOM 3176 C SER B 86 11.985 -9.350 1.298 1.00 1.59 C ATOM 3177 O SER B 86 11.954 -9.247 0.069 1.00 2.11 O ATOM 3178 CB SER B 86 9.799 -9.483 2.553 1.00 1.48 C ATOM 3179 OG SER B 86 8.754 -8.711 3.138 1.00 1.78 O ATOM 0 H SER B 86 9.698 -7.634 0.826 1.00 1.08 H new ATOM 0 HA SER B 86 11.487 -8.276 3.073 1.00 1.20 H new ATOM 0 HB2 SER B 86 9.423 -10.004 1.672 1.00 1.48 H new ATOM 0 HB3 SER B 86 10.131 -10.246 3.257 1.00 1.48 H new ATOM 0 HG SER B 86 8.307 -8.185 2.442 1.00 1.78 H new