USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 949 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 18 GLN :FLIP amide:sc= -6.57! C(o=-18!,f=-18!) USER MOD Set 1.2: B 18 GLN : amide:sc= -5.12! C(o=-18!,f=-18!) USER MOD Set 1.3: C 18 GLN :FLIP amide:sc= -5.82! C(o=-18!,f=-18!) USER MOD Single : A 11 CYS SG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc=-0.00473 K(o=-0.0047,f=-1.6!) USER MOD Single : A 27 THR OG1 : rot 84:sc= 0.103 USER MOD Single : A 29 GLN : amide:sc= -0.149 X(o=-0.15,f=0) USER MOD Single : A 30 GLN : amide:sc= -0.351 K(o=-0.35,f=-3.5!) USER MOD Single : A 31 LYS NZ :NH3+ -116:sc= 0 (180deg=-0.0212) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= -0.969 K(o=-0.97,f=-4.6!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 ASN : amide:sc= -0.0158 K(o=-0.016,f=-1.8!) USER MOD Single : B 27 THR OG1 : rot 180:sc= 0 USER MOD Single : B 29 GLN : amide:sc= -0.0963 X(o=-0.096,f=0) USER MOD Single : B 30 GLN : amide:sc= -0.504 K(o=-0.5,f=-3.4!) USER MOD Single : B 31 LYS NZ :NH3+ -118:sc= 0 (180deg=-0.0169) USER MOD Single : B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 ASN : amide:sc= -0.61 K(o=-0.61,f=-3.9!) USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 CYS SG : rot 180:sc= 0 USER MOD Single : C 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 13 SER OG : rot 180:sc= 0 USER MOD Single : C 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 19 THR OG1 : rot 180:sc= 0 USER MOD Single : C 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 26 ASN : amide:sc= -0.0142 K(o=-0.014,f=-1.6!) USER MOD Single : C 27 THR OG1 : rot 85:sc= 0.00289 USER MOD Single : C 29 GLN : amide:sc= -0.109 X(o=-0.11,f=0) USER MOD Single : C 30 GLN : amide:sc= -0.511 K(o=-0.51,f=-3.5!) USER MOD Single : C 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 121 N GLU A 10 19.533 2.611 -12.959 1.00 0.00 N ATOM 122 CA GLU A 10 18.120 2.182 -13.153 1.00 0.00 C ATOM 123 C GLU A 10 17.225 3.405 -13.374 1.00 0.00 C ATOM 124 O GLU A 10 16.134 3.490 -12.850 1.00 0.00 O ATOM 125 CB GLU A 10 17.744 1.464 -11.856 1.00 0.00 C ATOM 126 CG GLU A 10 18.459 0.114 -11.791 1.00 0.00 C ATOM 127 CD GLU A 10 19.199 -0.009 -10.458 1.00 0.00 C ATOM 128 OE1 GLU A 10 18.534 -0.071 -9.436 1.00 0.00 O ATOM 129 OE2 GLU A 10 20.419 -0.042 -10.480 1.00 0.00 O ATOM 0 HA GLU A 10 17.996 1.538 -14.024 1.00 0.00 H new ATOM 0 HB2 GLU A 10 18.021 2.075 -10.997 1.00 0.00 H new ATOM 0 HB3 GLU A 10 16.665 1.318 -11.809 1.00 0.00 H new ATOM 0 HG2 GLU A 10 17.738 -0.697 -11.895 1.00 0.00 H new ATOM 0 HG3 GLU A 10 19.162 0.023 -12.619 1.00 0.00 H new ATOM 136 N CYS A 11 17.681 4.355 -14.141 1.00 0.00 N ATOM 137 CA CYS A 11 16.856 5.569 -14.385 1.00 0.00 C ATOM 138 C CYS A 11 15.408 5.175 -14.682 1.00 0.00 C ATOM 139 O CYS A 11 14.487 5.928 -14.436 1.00 0.00 O ATOM 140 CB CYS A 11 17.486 6.244 -15.602 1.00 0.00 C ATOM 141 SG CYS A 11 18.774 7.391 -15.057 1.00 0.00 S ATOM 0 H CYS A 11 18.588 4.343 -14.608 1.00 0.00 H new ATOM 0 HA CYS A 11 16.835 6.231 -13.519 1.00 0.00 H new ATOM 0 HB2 CYS A 11 17.911 5.493 -16.268 1.00 0.00 H new ATOM 0 HB3 CYS A 11 16.724 6.779 -16.169 1.00 0.00 H new ATOM 0 HG CYS A 11 19.312 7.964 -16.093 1.00 0.00 H new ATOM 146 N LYS A 12 15.201 4.002 -15.210 1.00 0.00 N ATOM 147 CA LYS A 12 13.813 3.562 -15.524 1.00 0.00 C ATOM 148 C LYS A 12 13.508 2.233 -14.829 1.00 0.00 C ATOM 149 O LYS A 12 12.384 1.780 -14.810 1.00 0.00 O ATOM 150 CB LYS A 12 13.787 3.393 -17.044 1.00 0.00 C ATOM 151 CG LYS A 12 13.917 4.763 -17.710 1.00 0.00 C ATOM 152 CD LYS A 12 15.243 4.840 -18.470 1.00 0.00 C ATOM 153 CE LYS A 12 14.968 5.054 -19.960 1.00 0.00 C ATOM 154 NZ LYS A 12 16.032 5.993 -20.416 1.00 0.00 N ATOM 0 H LYS A 12 15.932 3.329 -15.438 1.00 0.00 H new ATOM 0 HA LYS A 12 13.065 4.276 -15.180 1.00 0.00 H new ATOM 0 HB2 LYS A 12 14.602 2.743 -17.363 1.00 0.00 H new ATOM 0 HB3 LYS A 12 12.858 2.914 -17.352 1.00 0.00 H new ATOM 0 HG2 LYS A 12 13.084 4.927 -18.394 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.871 5.550 -16.958 1.00 0.00 H new ATOM 0 HD2 LYS A 12 15.850 5.657 -18.081 1.00 0.00 H new ATOM 0 HD3 LYS A 12 15.812 3.922 -18.323 1.00 0.00 H new ATOM 0 HE2 LYS A 12 15.010 4.113 -20.509 1.00 0.00 H new ATOM 0 HE3 LYS A 12 13.975 5.473 -20.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.911 6.189 -21.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 15.963 6.882 -19.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 16.966 5.564 -20.255 1.00 0.00 H new ATOM 168 N SER A 13 14.501 1.609 -14.256 1.00 0.00 N ATOM 169 CA SER A 13 14.268 0.306 -13.560 1.00 0.00 C ATOM 170 C SER A 13 13.708 0.543 -12.153 1.00 0.00 C ATOM 171 O SER A 13 12.904 -0.217 -11.651 1.00 0.00 O ATOM 172 CB SER A 13 15.649 -0.347 -13.491 1.00 0.00 C ATOM 173 OG SER A 13 15.844 -1.155 -14.644 1.00 0.00 O ATOM 0 H SER A 13 15.465 1.943 -14.238 1.00 0.00 H new ATOM 0 HA SER A 13 13.543 -0.320 -14.080 1.00 0.00 H new ATOM 0 HB2 SER A 13 16.423 0.418 -13.434 1.00 0.00 H new ATOM 0 HB3 SER A 13 15.733 -0.954 -12.589 1.00 0.00 H new ATOM 0 HG SER A 13 16.729 -1.574 -14.604 1.00 0.00 H new ATOM 179 N ILE A 14 14.121 1.605 -11.527 1.00 0.00 N ATOM 180 CA ILE A 14 13.623 1.929 -10.162 1.00 0.00 C ATOM 181 C ILE A 14 12.224 2.511 -10.271 1.00 0.00 C ATOM 182 O ILE A 14 11.342 2.214 -9.493 1.00 0.00 O ATOM 183 CB ILE A 14 14.587 2.989 -9.643 1.00 0.00 C ATOM 184 CG1 ILE A 14 15.932 2.339 -9.319 1.00 0.00 C ATOM 185 CG2 ILE A 14 14.006 3.644 -8.387 1.00 0.00 C ATOM 186 CD1 ILE A 14 17.026 3.408 -9.342 1.00 0.00 C ATOM 0 H ILE A 14 14.792 2.273 -11.907 1.00 0.00 H new ATOM 0 HA ILE A 14 13.576 1.059 -9.507 1.00 0.00 H new ATOM 0 HB ILE A 14 14.733 3.754 -10.406 1.00 0.00 H new ATOM 0 HG12 ILE A 14 15.893 1.863 -8.339 1.00 0.00 H new ATOM 0 HG13 ILE A 14 16.156 1.557 -10.045 1.00 0.00 H new ATOM 0 HG21 ILE A 14 14.698 4.401 -8.018 1.00 0.00 H new ATOM 0 HG22 ILE A 14 13.051 4.111 -8.629 1.00 0.00 H new ATOM 0 HG23 ILE A 14 13.855 2.886 -7.618 1.00 0.00 H new ATOM 0 HD11 ILE A 14 17.988 2.950 -9.111 1.00 0.00 H new ATOM 0 HD12 ILE A 14 17.069 3.863 -10.331 1.00 0.00 H new ATOM 0 HD13 ILE A 14 16.802 4.174 -8.600 1.00 0.00 H new ATOM 198 N VAL A 15 12.020 3.328 -11.256 1.00 0.00 N ATOM 199 CA VAL A 15 10.685 3.933 -11.461 1.00 0.00 C ATOM 200 C VAL A 15 9.810 2.900 -12.164 1.00 0.00 C ATOM 201 O VAL A 15 8.596 2.967 -12.144 1.00 0.00 O ATOM 202 CB VAL A 15 10.934 5.169 -12.331 1.00 0.00 C ATOM 203 CG1 VAL A 15 9.767 6.146 -12.174 1.00 0.00 C ATOM 204 CG2 VAL A 15 12.226 5.861 -11.877 1.00 0.00 C ATOM 0 H VAL A 15 12.729 3.606 -11.935 1.00 0.00 H new ATOM 0 HA VAL A 15 10.177 4.222 -10.541 1.00 0.00 H new ATOM 0 HB VAL A 15 11.024 4.864 -13.374 1.00 0.00 H new ATOM 0 HG11 VAL A 15 9.943 7.026 -12.793 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.842 5.662 -12.487 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.683 6.448 -11.130 1.00 0.00 H new ATOM 0 HG21 VAL A 15 12.404 6.741 -12.495 1.00 0.00 H new ATOM 0 HG22 VAL A 15 12.130 6.164 -10.834 1.00 0.00 H new ATOM 0 HG23 VAL A 15 13.063 5.171 -11.978 1.00 0.00 H new ATOM 214 N LYS A 16 10.433 1.906 -12.742 1.00 0.00 N ATOM 215 CA LYS A 16 9.666 0.820 -13.396 1.00 0.00 C ATOM 216 C LYS A 16 8.987 0.034 -12.287 1.00 0.00 C ATOM 217 O LYS A 16 7.826 -0.311 -12.363 1.00 0.00 O ATOM 218 CB LYS A 16 10.720 -0.028 -14.120 1.00 0.00 C ATOM 219 CG LYS A 16 10.257 -1.483 -14.215 1.00 0.00 C ATOM 220 CD LYS A 16 10.899 -2.303 -13.093 1.00 0.00 C ATOM 221 CE LYS A 16 11.569 -3.547 -13.683 1.00 0.00 C ATOM 222 NZ LYS A 16 11.367 -4.613 -12.661 1.00 0.00 N ATOM 0 H LYS A 16 11.447 1.805 -12.786 1.00 0.00 H new ATOM 0 HA LYS A 16 8.905 1.159 -14.099 1.00 0.00 H new ATOM 0 HB2 LYS A 16 10.894 0.371 -15.119 1.00 0.00 H new ATOM 0 HB3 LYS A 16 11.669 0.025 -13.586 1.00 0.00 H new ATOM 0 HG2 LYS A 16 9.171 -1.535 -14.141 1.00 0.00 H new ATOM 0 HG3 LYS A 16 10.530 -1.899 -15.185 1.00 0.00 H new ATOM 0 HD2 LYS A 16 11.635 -1.699 -12.563 1.00 0.00 H new ATOM 0 HD3 LYS A 16 10.143 -2.596 -12.365 1.00 0.00 H new ATOM 0 HE2 LYS A 16 11.119 -3.823 -14.636 1.00 0.00 H new ATOM 0 HE3 LYS A 16 12.629 -3.374 -13.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 11.799 -5.499 -12.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 11.812 -4.325 -11.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 10.349 -4.760 -12.510 1.00 0.00 H new ATOM 236 N PHE A 17 9.712 -0.214 -11.229 1.00 0.00 N ATOM 237 CA PHE A 17 9.112 -0.939 -10.079 1.00 0.00 C ATOM 238 C PHE A 17 8.086 -0.015 -9.418 1.00 0.00 C ATOM 239 O PHE A 17 7.074 -0.451 -8.904 1.00 0.00 O ATOM 240 CB PHE A 17 10.289 -1.240 -9.142 1.00 0.00 C ATOM 241 CG PHE A 17 9.815 -1.293 -7.707 1.00 0.00 C ATOM 242 CD1 PHE A 17 8.879 -2.257 -7.310 1.00 0.00 C ATOM 243 CD2 PHE A 17 10.311 -0.375 -6.775 1.00 0.00 C ATOM 244 CE1 PHE A 17 8.439 -2.301 -5.982 1.00 0.00 C ATOM 245 CE2 PHE A 17 9.872 -0.419 -5.448 1.00 0.00 C ATOM 246 CZ PHE A 17 8.936 -1.381 -5.051 1.00 0.00 C ATOM 0 H PHE A 17 10.689 0.054 -11.114 1.00 0.00 H new ATOM 0 HA PHE A 17 8.597 -1.859 -10.355 1.00 0.00 H new ATOM 0 HB2 PHE A 17 10.748 -2.190 -9.416 1.00 0.00 H new ATOM 0 HB3 PHE A 17 11.055 -0.473 -9.251 1.00 0.00 H new ATOM 0 HD1 PHE A 17 8.497 -2.966 -8.029 1.00 0.00 H new ATOM 0 HD2 PHE A 17 11.033 0.368 -7.080 1.00 0.00 H new ATOM 0 HE1 PHE A 17 7.717 -3.044 -5.676 1.00 0.00 H new ATOM 0 HE2 PHE A 17 10.255 0.290 -4.729 1.00 0.00 H new ATOM 0 HZ PHE A 17 8.597 -1.414 -4.026 1.00 0.00 H new ATOM 256 N GLN A 18 8.340 1.266 -9.448 1.00 0.00 N ATOM 257 CA GLN A 18 7.383 2.236 -8.841 1.00 0.00 C ATOM 258 C GLN A 18 5.992 2.037 -9.444 1.00 0.00 C ATOM 259 O GLN A 18 5.001 1.981 -8.744 1.00 0.00 O ATOM 260 CB GLN A 18 7.931 3.623 -9.206 1.00 0.00 C ATOM 261 CG GLN A 18 8.896 4.165 -8.127 1.00 0.00 C ATOM 262 CD GLN A 18 9.380 3.051 -7.188 1.00 0.00 C ATOM 263 OE1 GLN A 18 8.660 2.736 -6.149 1.00 0.00 O flip ATOM 264 NE2 GLN A 18 10.428 2.472 -7.396 1.00 0.00 N flip ATOM 0 H GLN A 18 9.171 1.683 -9.868 1.00 0.00 H new ATOM 0 HA GLN A 18 7.291 2.108 -7.762 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.451 3.568 -10.163 1.00 0.00 H new ATOM 0 HB3 GLN A 18 7.102 4.319 -9.334 1.00 0.00 H new ATOM 0 HG2 GLN A 18 9.754 4.634 -8.608 1.00 0.00 H new ATOM 0 HG3 GLN A 18 8.395 4.939 -7.546 1.00 0.00 H new ATOM 0 HE21 GLN A 18 10.993 2.717 -8.209 1.00 0.00 H new ATOM 0 HE22 GLN A 18 10.742 1.741 -6.758 1.00 0.00 H new ATOM 273 N THR A 19 5.913 1.922 -10.739 1.00 0.00 N ATOM 274 CA THR A 19 4.589 1.718 -11.392 1.00 0.00 C ATOM 275 C THR A 19 3.939 0.447 -10.844 1.00 0.00 C ATOM 276 O THR A 19 2.745 0.392 -10.627 1.00 0.00 O ATOM 277 CB THR A 19 4.903 1.566 -12.880 1.00 0.00 C ATOM 278 OG1 THR A 19 5.414 2.794 -13.382 1.00 0.00 O ATOM 279 CG2 THR A 19 3.630 1.191 -13.638 1.00 0.00 C ATOM 0 H THR A 19 6.709 1.960 -11.376 1.00 0.00 H new ATOM 0 HA THR A 19 3.897 2.540 -11.209 1.00 0.00 H new ATOM 0 HB THR A 19 5.646 0.780 -13.016 1.00 0.00 H new ATOM 0 HG1 THR A 19 5.618 2.698 -14.336 1.00 0.00 H new ATOM 0 HG21 THR A 19 3.857 1.083 -14.699 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.241 0.249 -13.252 1.00 0.00 H new ATOM 0 HG23 THR A 19 2.883 1.973 -13.504 1.00 0.00 H new ATOM 287 N LYS A 20 4.721 -0.568 -10.599 1.00 0.00 N ATOM 288 CA LYS A 20 4.146 -1.824 -10.043 1.00 0.00 C ATOM 289 C LYS A 20 3.606 -1.528 -8.648 1.00 0.00 C ATOM 290 O LYS A 20 2.649 -2.124 -8.193 1.00 0.00 O ATOM 291 CB LYS A 20 5.313 -2.811 -9.978 1.00 0.00 C ATOM 292 CG LYS A 20 5.686 -3.254 -11.395 1.00 0.00 C ATOM 293 CD LYS A 20 4.630 -4.229 -11.921 1.00 0.00 C ATOM 294 CE LYS A 20 4.980 -5.651 -11.476 1.00 0.00 C ATOM 295 NZ LYS A 20 3.741 -6.445 -11.711 1.00 0.00 N ATOM 0 H LYS A 20 5.728 -0.582 -10.759 1.00 0.00 H new ATOM 0 HA LYS A 20 3.330 -2.227 -10.643 1.00 0.00 H new ATOM 0 HB2 LYS A 20 6.171 -2.345 -9.494 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.038 -3.677 -9.375 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.755 -2.387 -12.052 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.666 -3.730 -11.392 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.645 -3.952 -11.546 1.00 0.00 H new ATOM 0 HD3 LYS A 20 4.583 -4.178 -13.009 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.818 -6.049 -12.048 1.00 0.00 H new ATOM 0 HE3 LYS A 20 5.271 -5.675 -10.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 3.903 -7.433 -11.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.962 -6.048 -11.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 3.492 -6.409 -12.720 1.00 0.00 H new ATOM 309 N VAL A 21 4.212 -0.586 -7.982 1.00 0.00 N ATOM 310 CA VAL A 21 3.748 -0.201 -6.623 1.00 0.00 C ATOM 311 C VAL A 21 2.551 0.739 -6.760 1.00 0.00 C ATOM 312 O VAL A 21 1.765 0.903 -5.852 1.00 0.00 O ATOM 313 CB VAL A 21 4.949 0.519 -5.998 1.00 0.00 C ATOM 314 CG1 VAL A 21 4.477 1.590 -5.011 1.00 0.00 C ATOM 315 CG2 VAL A 21 5.822 -0.492 -5.254 1.00 0.00 C ATOM 0 H VAL A 21 5.017 -0.062 -8.326 1.00 0.00 H new ATOM 0 HA VAL A 21 3.429 -1.046 -6.013 1.00 0.00 H new ATOM 0 HB VAL A 21 5.522 0.994 -6.795 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.342 2.091 -4.577 1.00 0.00 H new ATOM 0 HG12 VAL A 21 3.859 2.320 -5.534 1.00 0.00 H new ATOM 0 HG13 VAL A 21 3.893 1.122 -4.218 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.675 0.021 -4.810 1.00 0.00 H new ATOM 0 HG22 VAL A 21 5.237 -0.969 -4.468 1.00 0.00 H new ATOM 0 HG23 VAL A 21 6.177 -1.250 -5.953 1.00 0.00 H new ATOM 325 N GLU A 22 2.412 1.354 -7.901 1.00 0.00 N ATOM 326 CA GLU A 22 1.272 2.282 -8.122 1.00 0.00 C ATOM 327 C GLU A 22 -0.021 1.480 -8.269 1.00 0.00 C ATOM 328 O GLU A 22 -1.021 1.762 -7.636 1.00 0.00 O ATOM 329 CB GLU A 22 1.617 3.009 -9.423 1.00 0.00 C ATOM 330 CG GLU A 22 2.407 4.280 -9.102 1.00 0.00 C ATOM 331 CD GLU A 22 2.392 5.211 -10.315 1.00 0.00 C ATOM 332 OE1 GLU A 22 1.343 5.767 -10.597 1.00 0.00 O ATOM 333 OE2 GLU A 22 3.428 5.353 -10.943 1.00 0.00 O ATOM 0 H GLU A 22 3.045 1.252 -8.695 1.00 0.00 H new ATOM 0 HA GLU A 22 1.121 2.978 -7.297 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.203 2.358 -10.072 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.705 3.261 -9.964 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.971 4.783 -8.239 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.434 4.026 -8.838 1.00 0.00 H new ATOM 340 N GLU A 23 -0.002 0.471 -9.097 1.00 0.00 N ATOM 341 CA GLU A 23 -1.222 -0.362 -9.287 1.00 0.00 C ATOM 342 C GLU A 23 -1.444 -1.254 -8.064 1.00 0.00 C ATOM 343 O GLU A 23 -2.563 -1.527 -7.679 1.00 0.00 O ATOM 344 CB GLU A 23 -0.935 -1.207 -10.528 1.00 0.00 C ATOM 345 CG GLU A 23 -0.361 -0.314 -11.631 1.00 0.00 C ATOM 346 CD GLU A 23 -0.915 -0.753 -12.988 1.00 0.00 C ATOM 347 OE1 GLU A 23 -2.122 -0.692 -13.161 1.00 0.00 O ATOM 348 OE2 GLU A 23 -0.125 -1.143 -13.831 1.00 0.00 O ATOM 0 H GLU A 23 0.807 0.188 -9.650 1.00 0.00 H new ATOM 0 HA GLU A 23 -2.122 0.240 -9.407 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -0.230 -2.002 -10.285 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -1.850 -1.688 -10.874 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.620 0.728 -11.441 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.727 -0.376 -11.634 1.00 0.00 H new ATOM 355 N LEU A 24 -0.387 -1.706 -7.442 1.00 0.00 N ATOM 356 CA LEU A 24 -0.552 -2.573 -6.239 1.00 0.00 C ATOM 357 C LEU A 24 -1.162 -1.760 -5.095 1.00 0.00 C ATOM 358 O LEU A 24 -2.077 -2.201 -4.429 1.00 0.00 O ATOM 359 CB LEU A 24 0.858 -3.040 -5.879 1.00 0.00 C ATOM 360 CG LEU A 24 0.778 -4.414 -5.210 1.00 0.00 C ATOM 361 CD1 LEU A 24 0.157 -5.420 -6.181 1.00 0.00 C ATOM 362 CD2 LEU A 24 2.184 -4.883 -4.831 1.00 0.00 C ATOM 0 H LEU A 24 0.577 -1.514 -7.713 1.00 0.00 H new ATOM 0 HA LEU A 24 -1.216 -3.417 -6.424 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.476 -3.094 -6.775 1.00 0.00 H new ATOM 0 HB3 LEU A 24 1.331 -2.323 -5.208 1.00 0.00 H new ATOM 0 HG LEU A 24 0.163 -4.342 -4.313 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.100 -6.399 -5.704 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.846 -5.091 -6.454 1.00 0.00 H new ATOM 0 HD13 LEU A 24 0.773 -5.488 -7.077 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.125 -5.862 -4.355 1.00 0.00 H new ATOM 0 HD22 LEU A 24 2.799 -4.953 -5.729 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.632 -4.169 -4.139 1.00 0.00 H new ATOM 374 N ILE A 25 -0.671 -0.572 -4.869 1.00 0.00 N ATOM 375 CA ILE A 25 -1.239 0.266 -3.775 1.00 0.00 C ATOM 376 C ILE A 25 -2.725 0.507 -4.056 1.00 0.00 C ATOM 377 O ILE A 25 -3.545 0.472 -3.163 1.00 0.00 O ATOM 378 CB ILE A 25 -0.418 1.572 -3.799 1.00 0.00 C ATOM 379 CG1 ILE A 25 0.481 1.624 -2.559 1.00 0.00 C ATOM 380 CG2 ILE A 25 -1.336 2.802 -3.798 1.00 0.00 C ATOM 381 CD1 ILE A 25 1.163 0.270 -2.356 1.00 0.00 C ATOM 0 H ILE A 25 0.095 -0.147 -5.392 1.00 0.00 H new ATOM 0 HA ILE A 25 -1.179 -0.200 -2.791 1.00 0.00 H new ATOM 0 HB ILE A 25 0.182 1.584 -4.709 1.00 0.00 H new ATOM 0 HG12 ILE A 25 1.232 2.406 -2.675 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -0.111 1.879 -1.680 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -0.730 3.708 -3.815 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -1.978 2.778 -4.679 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.953 2.795 -2.899 1.00 0.00 H new ATOM 0 HD11 ILE A 25 1.801 0.313 -1.473 1.00 0.00 H new ATOM 0 HD12 ILE A 25 0.406 -0.502 -2.220 1.00 0.00 H new ATOM 0 HD13 ILE A 25 1.769 0.033 -3.230 1.00 0.00 H new ATOM 393 N ASN A 26 -3.077 0.739 -5.291 1.00 0.00 N ATOM 394 CA ASN A 26 -4.512 0.963 -5.617 1.00 0.00 C ATOM 395 C ASN A 26 -5.310 -0.286 -5.245 1.00 0.00 C ATOM 396 O ASN A 26 -6.366 -0.213 -4.651 1.00 0.00 O ATOM 397 CB ASN A 26 -4.548 1.197 -7.128 1.00 0.00 C ATOM 398 CG ASN A 26 -5.812 1.978 -7.495 1.00 0.00 C ATOM 399 OD1 ASN A 26 -6.732 2.069 -6.707 1.00 0.00 O ATOM 400 ND2 ASN A 26 -5.897 2.548 -8.666 1.00 0.00 N ATOM 0 H ASN A 26 -2.436 0.783 -6.084 1.00 0.00 H new ATOM 0 HA ASN A 26 -4.944 1.804 -5.075 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -3.663 1.750 -7.442 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -4.532 0.243 -7.655 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.736 3.070 -8.919 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -5.124 2.472 -9.328 1.00 0.00 H new ATOM 407 N THR A 27 -4.795 -1.434 -5.585 1.00 0.00 N ATOM 408 CA THR A 27 -5.497 -2.705 -5.252 1.00 0.00 C ATOM 409 C THR A 27 -5.649 -2.841 -3.735 1.00 0.00 C ATOM 410 O THR A 27 -6.618 -3.384 -3.244 1.00 0.00 O ATOM 411 CB THR A 27 -4.583 -3.802 -5.797 1.00 0.00 C ATOM 412 OG1 THR A 27 -4.674 -3.834 -7.214 1.00 0.00 O ATOM 413 CG2 THR A 27 -5.004 -5.156 -5.225 1.00 0.00 C ATOM 0 H THR A 27 -3.912 -1.547 -6.083 1.00 0.00 H new ATOM 0 HA THR A 27 -6.500 -2.753 -5.677 1.00 0.00 H new ATOM 0 HB THR A 27 -3.554 -3.593 -5.504 1.00 0.00 H new ATOM 0 HG1 THR A 27 -4.072 -3.162 -7.596 1.00 0.00 H new ATOM 0 HG21 THR A 27 -4.350 -5.935 -5.616 1.00 0.00 H new ATOM 0 HG22 THR A 27 -4.929 -5.131 -4.138 1.00 0.00 H new ATOM 0 HG23 THR A 27 -6.034 -5.368 -5.513 1.00 0.00 H new ATOM 421 N LEU A 28 -4.699 -2.348 -2.986 1.00 0.00 N ATOM 422 CA LEU A 28 -4.799 -2.447 -1.501 1.00 0.00 C ATOM 423 C LEU A 28 -5.913 -1.528 -1.007 1.00 0.00 C ATOM 424 O LEU A 28 -6.748 -1.914 -0.213 1.00 0.00 O ATOM 425 CB LEU A 28 -3.443 -1.977 -0.976 1.00 0.00 C ATOM 426 CG LEU A 28 -2.441 -3.128 -1.053 1.00 0.00 C ATOM 427 CD1 LEU A 28 -1.051 -2.574 -1.372 1.00 0.00 C ATOM 428 CD2 LEU A 28 -2.402 -3.858 0.291 1.00 0.00 C ATOM 0 H LEU A 28 -3.862 -1.883 -3.336 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.031 -3.456 -1.161 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.087 -1.131 -1.563 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -3.539 -1.632 0.054 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.744 -3.822 -1.837 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.336 -3.395 -1.427 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.078 -2.052 -2.328 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.747 -1.880 -0.588 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.688 -4.680 0.238 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.098 -3.163 1.074 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.392 -4.252 0.520 1.00 0.00 H new ATOM 440 N GLN A 29 -5.941 -0.319 -1.492 1.00 0.00 N ATOM 441 CA GLN A 29 -7.006 0.626 -1.080 1.00 0.00 C ATOM 442 C GLN A 29 -8.347 0.134 -1.626 1.00 0.00 C ATOM 443 O GLN A 29 -9.403 0.581 -1.223 1.00 0.00 O ATOM 444 CB GLN A 29 -6.606 1.952 -1.724 1.00 0.00 C ATOM 445 CG GLN A 29 -7.164 3.115 -0.902 1.00 0.00 C ATOM 446 CD GLN A 29 -6.264 4.339 -1.072 1.00 0.00 C ATOM 447 OE1 GLN A 29 -6.001 5.053 -0.124 1.00 0.00 O ATOM 448 NE2 GLN A 29 -5.778 4.616 -2.251 1.00 0.00 N ATOM 0 H GLN A 29 -5.266 0.054 -2.160 1.00 0.00 H new ATOM 0 HA GLN A 29 -7.112 0.719 0.001 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.520 2.025 -1.784 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.986 2.001 -2.745 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -8.178 3.349 -1.225 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.221 2.836 0.150 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.998 4.017 -3.047 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.178 5.431 -2.377 1.00 0.00 H new ATOM 457 N GLN A 30 -8.301 -0.802 -2.536 1.00 0.00 N ATOM 458 CA GLN A 30 -9.555 -1.355 -3.118 1.00 0.00 C ATOM 459 C GLN A 30 -10.117 -2.421 -2.179 1.00 0.00 C ATOM 460 O GLN A 30 -11.275 -2.397 -1.812 1.00 0.00 O ATOM 461 CB GLN A 30 -9.124 -1.970 -4.449 1.00 0.00 C ATOM 462 CG GLN A 30 -8.884 -0.852 -5.461 1.00 0.00 C ATOM 463 CD GLN A 30 -9.916 -0.947 -6.587 1.00 0.00 C ATOM 464 OE1 GLN A 30 -10.606 -1.938 -6.712 1.00 0.00 O ATOM 465 NE2 GLN A 30 -10.052 0.051 -7.418 1.00 0.00 N ATOM 0 H GLN A 30 -7.441 -1.209 -2.903 1.00 0.00 H new ATOM 0 HA GLN A 30 -10.334 -0.605 -3.257 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -8.216 -2.558 -4.315 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -9.893 -2.650 -4.815 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -8.956 0.118 -4.970 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -7.877 -0.928 -5.870 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -9.473 0.884 -7.314 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -10.738 -0.002 -8.171 1.00 0.00 H new ATOM 474 N LYS A 31 -9.295 -3.348 -1.773 1.00 0.00 N ATOM 475 CA LYS A 31 -9.774 -4.404 -0.838 1.00 0.00 C ATOM 476 C LYS A 31 -10.060 -3.770 0.523 1.00 0.00 C ATOM 477 O LYS A 31 -10.737 -4.337 1.359 1.00 0.00 O ATOM 478 CB LYS A 31 -8.625 -5.409 -0.737 1.00 0.00 C ATOM 479 CG LYS A 31 -8.948 -6.643 -1.584 1.00 0.00 C ATOM 480 CD LYS A 31 -7.707 -7.534 -1.681 1.00 0.00 C ATOM 481 CE LYS A 31 -7.920 -8.596 -2.764 1.00 0.00 C ATOM 482 NZ LYS A 31 -8.786 -9.627 -2.126 1.00 0.00 N ATOM 0 H LYS A 31 -8.315 -3.420 -2.047 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.690 -4.887 -1.178 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -7.697 -4.952 -1.081 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.472 -5.699 0.303 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -9.773 -7.198 -1.138 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -9.270 -6.340 -2.580 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -6.831 -6.930 -1.917 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -7.515 -8.013 -0.721 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -8.398 -8.170 -3.646 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -6.972 -9.023 -3.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -8.266 -10.525 -2.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -9.054 -9.313 -1.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -9.643 -9.764 -2.699 1.00 0.00 H new ATOM 496 N LEU A 32 -9.555 -2.586 0.741 1.00 0.00 N ATOM 497 CA LEU A 32 -9.798 -1.891 2.032 1.00 0.00 C ATOM 498 C LEU A 32 -11.161 -1.198 1.987 1.00 0.00 C ATOM 499 O LEU A 32 -11.949 -1.295 2.905 1.00 0.00 O ATOM 500 CB LEU A 32 -8.672 -0.863 2.137 1.00 0.00 C ATOM 501 CG LEU A 32 -8.374 -0.572 3.605 1.00 0.00 C ATOM 502 CD1 LEU A 32 -8.097 -1.882 4.342 1.00 0.00 C ATOM 503 CD2 LEU A 32 -7.146 0.334 3.702 1.00 0.00 C ATOM 0 H LEU A 32 -8.981 -2.069 0.074 1.00 0.00 H new ATOM 0 HA LEU A 32 -9.808 -2.568 2.886 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -7.777 -1.239 1.642 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.957 0.056 1.625 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.233 -0.077 4.058 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.884 -1.672 5.390 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.970 -2.531 4.272 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.239 -2.379 3.890 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.930 0.544 4.750 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.289 -0.164 3.248 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.342 1.269 3.177 1.00 0.00 H new ATOM 515 N GLU A 33 -11.448 -0.511 0.913 1.00 0.00 N ATOM 516 CA GLU A 33 -12.769 0.170 0.799 1.00 0.00 C ATOM 517 C GLU A 33 -13.859 -0.886 0.633 1.00 0.00 C ATOM 518 O GLU A 33 -15.027 -0.636 0.857 1.00 0.00 O ATOM 519 CB GLU A 33 -12.662 1.045 -0.452 1.00 0.00 C ATOM 520 CG GLU A 33 -13.994 1.754 -0.700 1.00 0.00 C ATOM 521 CD GLU A 33 -13.799 3.268 -0.582 1.00 0.00 C ATOM 522 OE1 GLU A 33 -13.832 3.764 0.532 1.00 0.00 O ATOM 523 OE2 GLU A 33 -13.621 3.903 -1.608 1.00 0.00 O ATOM 0 H GLU A 33 -10.827 -0.393 0.113 1.00 0.00 H new ATOM 0 HA GLU A 33 -13.019 0.766 1.677 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -11.866 1.779 -0.327 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -12.399 0.433 -1.314 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -14.373 1.502 -1.690 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -14.738 1.416 0.021 1.00 0.00 H new ATOM 530 N ALA A 34 -13.472 -2.078 0.271 1.00 0.00 N ATOM 531 CA ALA A 34 -14.461 -3.176 0.122 1.00 0.00 C ATOM 532 C ALA A 34 -14.562 -3.892 1.462 1.00 0.00 C ATOM 533 O ALA A 34 -15.607 -4.365 1.860 1.00 0.00 O ATOM 534 CB ALA A 34 -13.884 -4.099 -0.952 1.00 0.00 C ATOM 0 H ALA A 34 -12.506 -2.338 0.071 1.00 0.00 H new ATOM 0 HA ALA A 34 -15.457 -2.835 -0.161 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -14.563 -4.936 -1.116 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -13.762 -3.543 -1.882 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -12.915 -4.477 -0.625 1.00 0.00 H new ATOM 540 N VAL A 35 -13.469 -3.940 2.173 1.00 0.00 N ATOM 541 CA VAL A 35 -13.467 -4.585 3.508 1.00 0.00 C ATOM 542 C VAL A 35 -14.373 -3.775 4.435 1.00 0.00 C ATOM 543 O VAL A 35 -15.104 -4.319 5.235 1.00 0.00 O ATOM 544 CB VAL A 35 -12.002 -4.529 3.959 1.00 0.00 C ATOM 545 CG1 VAL A 35 -11.907 -4.312 5.470 1.00 0.00 C ATOM 546 CG2 VAL A 35 -11.306 -5.841 3.592 1.00 0.00 C ATOM 0 H VAL A 35 -12.571 -3.555 1.880 1.00 0.00 H new ATOM 0 HA VAL A 35 -13.837 -5.610 3.508 1.00 0.00 H new ATOM 0 HB VAL A 35 -11.516 -3.694 3.455 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -10.859 -4.276 5.767 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -12.392 -3.372 5.734 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -12.403 -5.133 5.987 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -10.265 -5.802 3.912 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -11.808 -6.671 4.090 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -11.349 -5.986 2.513 1.00 0.00 H new ATOM 556 N ALA A 36 -14.341 -2.475 4.315 1.00 0.00 N ATOM 557 CA ALA A 36 -15.219 -1.635 5.172 1.00 0.00 C ATOM 558 C ALA A 36 -16.670 -1.863 4.757 1.00 0.00 C ATOM 559 O ALA A 36 -17.582 -1.754 5.551 1.00 0.00 O ATOM 560 CB ALA A 36 -14.795 -0.191 4.897 1.00 0.00 C ATOM 0 H ALA A 36 -13.747 -1.962 3.663 1.00 0.00 H new ATOM 0 HA ALA A 36 -15.133 -1.872 6.233 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -15.402 0.487 5.497 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.744 -0.064 5.158 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.936 0.035 3.840 1.00 0.00 H new ATOM 566 N LYS A 37 -16.882 -2.198 3.511 1.00 0.00 N ATOM 567 CA LYS A 37 -18.270 -2.457 3.034 1.00 0.00 C ATOM 568 C LYS A 37 -18.763 -3.783 3.607 1.00 0.00 C ATOM 569 O LYS A 37 -19.921 -3.941 3.934 1.00 0.00 O ATOM 570 CB LYS A 37 -18.160 -2.538 1.511 1.00 0.00 C ATOM 571 CG LYS A 37 -18.257 -1.133 0.914 1.00 0.00 C ATOM 572 CD LYS A 37 -18.297 -1.227 -0.613 1.00 0.00 C ATOM 573 CE LYS A 37 -19.665 -0.756 -1.117 1.00 0.00 C ATOM 574 NZ LYS A 37 -19.388 -0.088 -2.419 1.00 0.00 N ATOM 0 H LYS A 37 -16.154 -2.303 2.805 1.00 0.00 H new ATOM 0 HA LYS A 37 -18.973 -1.684 3.345 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -17.214 -2.999 1.229 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -18.954 -3.169 1.112 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -19.152 -0.632 1.281 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -17.404 -0.533 1.229 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -17.507 -0.614 -1.047 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -18.114 -2.254 -0.930 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.350 -1.595 -1.242 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.130 -0.067 -0.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -20.279 0.262 -2.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -18.739 0.711 -2.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -18.952 -0.769 -3.073 1.00 0.00 H new ATOM 588 N ARG A 38 -17.880 -4.732 3.745 1.00 0.00 N ATOM 589 CA ARG A 38 -18.279 -6.045 4.314 1.00 0.00 C ATOM 590 C ARG A 38 -18.543 -5.881 5.808 1.00 0.00 C ATOM 591 O ARG A 38 -19.495 -6.410 6.347 1.00 0.00 O ATOM 592 CB ARG A 38 -17.085 -6.964 4.064 1.00 0.00 C ATOM 593 CG ARG A 38 -16.790 -7.011 2.564 1.00 0.00 C ATOM 594 CD ARG A 38 -17.431 -8.261 1.955 1.00 0.00 C ATOM 595 NE ARG A 38 -16.368 -9.302 2.009 1.00 0.00 N ATOM 596 CZ ARG A 38 -15.972 -9.885 0.912 1.00 0.00 C ATOM 597 NH1 ARG A 38 -15.841 -9.190 -0.185 1.00 0.00 N ATOM 598 NH2 ARG A 38 -15.707 -11.163 0.911 1.00 0.00 N ATOM 0 H ARG A 38 -16.896 -4.653 3.487 1.00 0.00 H new ATOM 0 HA ARG A 38 -19.187 -6.448 3.866 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -16.212 -6.601 4.607 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -17.298 -7.966 4.436 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -17.179 -6.116 2.078 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -15.713 -7.023 2.395 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -18.313 -8.567 2.518 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -17.755 -8.080 0.930 1.00 0.00 H new ATOM 0 HE ARG A 38 -15.950 -9.559 2.903 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -16.048 -8.191 -0.184 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -15.531 -9.646 -1.043 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -15.810 -11.706 1.768 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -15.397 -11.619 0.053 1.00 0.00 H new ATOM 612 N ILE A 39 -17.717 -5.125 6.476 1.00 0.00 N ATOM 613 CA ILE A 39 -17.931 -4.894 7.930 1.00 0.00 C ATOM 614 C ILE A 39 -19.326 -4.313 8.122 1.00 0.00 C ATOM 615 O ILE A 39 -20.059 -4.701 9.009 1.00 0.00 O ATOM 616 CB ILE A 39 -16.857 -3.885 8.338 1.00 0.00 C ATOM 617 CG1 ILE A 39 -15.506 -4.608 8.468 1.00 0.00 C ATOM 618 CG2 ILE A 39 -17.242 -3.231 9.670 1.00 0.00 C ATOM 619 CD1 ILE A 39 -15.375 -5.263 9.847 1.00 0.00 C ATOM 0 H ILE A 39 -16.903 -4.657 6.077 1.00 0.00 H new ATOM 0 HA ILE A 39 -17.860 -5.802 8.529 1.00 0.00 H new ATOM 0 HB ILE A 39 -16.774 -3.107 7.579 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -15.417 -5.366 7.690 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -14.692 -3.899 8.317 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -16.474 -2.513 9.958 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -18.197 -2.717 9.560 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -17.329 -3.998 10.440 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -14.413 -5.769 9.919 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -15.442 -4.498 10.621 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -16.178 -5.988 9.983 1.00 0.00 H new ATOM 631 N GLU A 40 -19.709 -3.406 7.265 1.00 0.00 N ATOM 632 CA GLU A 40 -21.070 -2.820 7.368 1.00 0.00 C ATOM 633 C GLU A 40 -22.088 -3.923 7.103 1.00 0.00 C ATOM 634 O GLU A 40 -23.135 -3.980 7.716 1.00 0.00 O ATOM 635 CB GLU A 40 -21.132 -1.750 6.278 1.00 0.00 C ATOM 636 CG GLU A 40 -19.992 -0.750 6.482 1.00 0.00 C ATOM 637 CD GLU A 40 -20.547 0.545 7.080 1.00 0.00 C ATOM 638 OE1 GLU A 40 -21.757 0.648 7.203 1.00 0.00 O ATOM 639 OE2 GLU A 40 -19.753 1.412 7.403 1.00 0.00 O ATOM 0 H GLU A 40 -19.137 -3.048 6.500 1.00 0.00 H new ATOM 0 HA GLU A 40 -21.283 -2.392 8.347 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -21.053 -2.212 5.294 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -22.092 -1.235 6.312 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -19.237 -1.174 7.144 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -19.502 -0.543 5.531 1.00 0.00 H new ATOM 646 N ALA A 41 -21.772 -4.818 6.206 1.00 0.00 N ATOM 647 CA ALA A 41 -22.710 -5.936 5.921 1.00 0.00 C ATOM 648 C ALA A 41 -23.022 -6.654 7.232 1.00 0.00 C ATOM 649 O ALA A 41 -24.125 -7.105 7.464 1.00 0.00 O ATOM 650 CB ALA A 41 -21.961 -6.859 4.961 1.00 0.00 C ATOM 0 H ALA A 41 -20.909 -4.822 5.662 1.00 0.00 H new ATOM 0 HA ALA A 41 -23.653 -5.604 5.487 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -22.594 -7.709 4.706 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -21.706 -6.311 4.054 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -21.048 -7.216 5.438 1.00 0.00 H new ATOM 656 N LEU A 42 -22.051 -6.737 8.102 1.00 0.00 N ATOM 657 CA LEU A 42 -22.275 -7.395 9.418 1.00 0.00 C ATOM 658 C LEU A 42 -22.972 -6.410 10.352 1.00 0.00 C ATOM 659 O LEU A 42 -23.750 -6.789 11.197 1.00 0.00 O ATOM 660 CB LEU A 42 -20.876 -7.738 9.952 1.00 0.00 C ATOM 661 CG LEU A 42 -20.272 -8.962 9.236 1.00 0.00 C ATOM 662 CD1 LEU A 42 -21.355 -9.825 8.576 1.00 0.00 C ATOM 663 CD2 LEU A 42 -19.290 -8.481 8.172 1.00 0.00 C ATOM 0 H LEU A 42 -21.109 -6.375 7.955 1.00 0.00 H new ATOM 0 HA LEU A 42 -22.898 -8.286 9.340 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -20.217 -6.879 9.822 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -20.934 -7.936 11.022 1.00 0.00 H new ATOM 0 HG LEU A 42 -19.763 -9.575 9.979 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -20.890 -10.678 8.082 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -22.050 -10.181 9.336 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -21.896 -9.230 7.840 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -18.858 -9.341 7.660 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -19.814 -7.855 7.450 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -18.496 -7.903 8.645 1.00 0.00 H new ATOM 675 N GLU A 43 -22.703 -5.143 10.192 1.00 0.00 N ATOM 676 CA GLU A 43 -23.358 -4.127 11.061 1.00 0.00 C ATOM 677 C GLU A 43 -24.843 -4.052 10.724 1.00 0.00 C ATOM 678 O GLU A 43 -25.645 -3.564 11.492 1.00 0.00 O ATOM 679 CB GLU A 43 -22.659 -2.815 10.720 1.00 0.00 C ATOM 680 CG GLU A 43 -21.174 -2.951 11.036 1.00 0.00 C ATOM 681 CD GLU A 43 -20.703 -1.735 11.836 1.00 0.00 C ATOM 682 OE1 GLU A 43 -21.424 -1.322 12.730 1.00 0.00 O ATOM 683 OE2 GLU A 43 -19.628 -1.237 11.542 1.00 0.00 O ATOM 0 H GLU A 43 -22.058 -4.768 9.497 1.00 0.00 H new ATOM 0 HA GLU A 43 -23.280 -4.361 12.123 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -22.800 -2.576 9.666 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -23.093 -1.996 11.294 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -20.996 -3.864 11.605 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -20.602 -3.034 10.112 1.00 0.00 H new ATOM 690 N ASN A 44 -25.211 -4.550 9.580 1.00 0.00 N ATOM 691 CA ASN A 44 -26.646 -4.529 9.187 1.00 0.00 C ATOM 692 C ASN A 44 -27.394 -5.600 9.978 1.00 0.00 C ATOM 693 O ASN A 44 -28.605 -5.583 10.085 1.00 0.00 O ATOM 694 CB ASN A 44 -26.656 -4.854 7.694 1.00 0.00 C ATOM 695 CG ASN A 44 -26.056 -3.686 6.909 1.00 0.00 C ATOM 696 OD1 ASN A 44 -25.397 -2.835 7.474 1.00 0.00 O ATOM 697 ND2 ASN A 44 -26.260 -3.607 5.623 1.00 0.00 N ATOM 0 H ASN A 44 -24.580 -4.972 8.898 1.00 0.00 H new ATOM 0 HA ASN A 44 -27.128 -3.572 9.388 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -26.085 -5.763 7.506 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -27.676 -5.044 7.360 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -25.866 -2.831 5.091 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -26.813 -4.321 5.150 1.00 0.00 H new ATOM 704 N LYS A 45 -26.671 -6.533 10.536 1.00 0.00 N ATOM 705 CA LYS A 45 -27.318 -7.613 11.329 1.00 0.00 C ATOM 706 C LYS A 45 -26.906 -7.498 12.799 1.00 0.00 C ATOM 707 O LYS A 45 -27.539 -8.056 13.674 1.00 0.00 O ATOM 708 CB LYS A 45 -26.796 -8.914 10.723 1.00 0.00 C ATOM 709 CG LYS A 45 -27.450 -9.138 9.359 1.00 0.00 C ATOM 710 CD LYS A 45 -26.931 -8.096 8.367 1.00 0.00 C ATOM 711 CE LYS A 45 -26.816 -8.730 6.979 1.00 0.00 C ATOM 712 NZ LYS A 45 -28.043 -8.294 6.257 1.00 0.00 N ATOM 0 H LYS A 45 -25.655 -6.592 10.475 1.00 0.00 H new ATOM 0 HA LYS A 45 -28.406 -7.560 11.297 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -25.712 -8.869 10.616 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -27.016 -9.751 11.386 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -27.228 -10.142 8.998 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -28.534 -9.064 9.447 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -27.606 -7.241 8.334 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -25.959 -7.722 8.690 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -25.915 -8.395 6.465 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -26.761 -9.817 7.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -28.038 -8.689 5.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -28.884 -8.633 6.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -28.065 -7.256 6.205 1.00 0.00 H new ATOM 726 N ILE A 46 -25.856 -6.770 13.081 1.00 0.00 N ATOM 727 CA ILE A 46 -25.423 -6.617 14.497 1.00 0.00 C ATOM 728 C ILE A 46 -25.837 -5.236 15.010 1.00 0.00 C ATOM 729 O ILE A 46 -25.781 -4.958 16.191 1.00 0.00 O ATOM 730 CB ILE A 46 -23.892 -6.756 14.485 1.00 0.00 C ATOM 731 CG1 ILE A 46 -23.456 -8.107 13.880 1.00 0.00 C ATOM 732 CG2 ILE A 46 -23.368 -6.671 15.918 1.00 0.00 C ATOM 733 CD1 ILE A 46 -24.543 -9.171 14.073 1.00 0.00 C ATOM 0 H ILE A 46 -25.284 -6.278 12.394 1.00 0.00 H new ATOM 0 HA ILE A 46 -25.878 -7.361 15.151 1.00 0.00 H new ATOM 0 HB ILE A 46 -23.483 -5.951 13.874 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -23.248 -7.983 12.817 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -22.530 -8.438 14.350 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -22.282 -6.769 15.915 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -23.644 -5.709 16.350 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -23.803 -7.474 16.513 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -24.211 -10.114 13.638 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -24.732 -9.309 15.138 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -25.460 -8.847 13.581 1.00 0.00 H new ATOM 886 N GLU B 10 14.804 12.398 -13.414 1.00 0.00 N ATOM 887 CA GLU B 10 13.829 12.678 -12.323 1.00 0.00 C ATOM 888 C GLU B 10 14.498 12.495 -10.959 1.00 0.00 C ATOM 889 O GLU B 10 13.922 11.942 -10.046 1.00 0.00 O ATOM 890 CB GLU B 10 12.721 11.645 -12.511 1.00 0.00 C ATOM 891 CG GLU B 10 11.862 12.025 -13.717 1.00 0.00 C ATOM 892 CD GLU B 10 11.873 10.875 -14.726 1.00 0.00 C ATOM 893 OE1 GLU B 10 11.210 9.883 -14.469 1.00 0.00 O ATOM 894 OE2 GLU B 10 12.546 11.004 -15.735 1.00 0.00 O ATOM 0 HA GLU B 10 13.449 13.699 -12.360 1.00 0.00 H new ATOM 0 HB2 GLU B 10 13.154 10.656 -12.658 1.00 0.00 H new ATOM 0 HB3 GLU B 10 12.103 11.593 -11.614 1.00 0.00 H new ATOM 0 HG2 GLU B 10 10.841 12.236 -13.399 1.00 0.00 H new ATOM 0 HG3 GLU B 10 12.246 12.934 -14.180 1.00 0.00 H new ATOM 901 N CYS B 11 15.711 12.950 -10.814 1.00 0.00 N ATOM 902 CA CYS B 11 16.409 12.795 -9.510 1.00 0.00 C ATOM 903 C CYS B 11 15.460 13.123 -8.357 1.00 0.00 C ATOM 904 O CYS B 11 15.588 12.599 -7.268 1.00 0.00 O ATOM 905 CB CYS B 11 17.571 13.787 -9.554 1.00 0.00 C ATOM 906 SG CYS B 11 19.034 12.971 -10.238 1.00 0.00 S ATOM 0 H CYS B 11 16.248 13.422 -11.542 1.00 0.00 H new ATOM 0 HA CYS B 11 16.757 11.774 -9.350 1.00 0.00 H new ATOM 0 HB2 CYS B 11 17.304 14.650 -10.164 1.00 0.00 H new ATOM 0 HB3 CYS B 11 17.784 14.159 -8.552 1.00 0.00 H new ATOM 911 N LYS B 12 14.507 13.983 -8.584 1.00 0.00 N ATOM 912 CA LYS B 12 13.554 14.337 -7.493 1.00 0.00 C ATOM 913 C LYS B 12 12.113 14.062 -7.934 1.00 0.00 C ATOM 914 O LYS B 12 11.193 14.139 -7.149 1.00 0.00 O ATOM 915 CB LYS B 12 13.765 15.832 -7.247 1.00 0.00 C ATOM 916 CG LYS B 12 15.165 16.063 -6.675 1.00 0.00 C ATOM 917 CD LYS B 12 16.024 16.789 -7.711 1.00 0.00 C ATOM 918 CE LYS B 12 16.443 18.155 -7.163 1.00 0.00 C ATOM 919 NZ LYS B 12 17.853 18.328 -7.603 1.00 0.00 N ATOM 0 H LYS B 12 14.346 14.455 -9.474 1.00 0.00 H new ATOM 0 HA LYS B 12 13.726 13.749 -6.592 1.00 0.00 H new ATOM 0 HB2 LYS B 12 13.646 16.385 -8.179 1.00 0.00 H new ATOM 0 HB3 LYS B 12 13.011 16.207 -6.555 1.00 0.00 H new ATOM 0 HG2 LYS B 12 15.103 16.652 -5.760 1.00 0.00 H new ATOM 0 HG3 LYS B 12 15.623 15.110 -6.410 1.00 0.00 H new ATOM 0 HD2 LYS B 12 16.906 16.195 -7.948 1.00 0.00 H new ATOM 0 HD3 LYS B 12 15.465 16.914 -8.639 1.00 0.00 H new ATOM 0 HE2 LYS B 12 15.807 18.949 -7.554 1.00 0.00 H new ATOM 0 HE3 LYS B 12 16.361 18.187 -6.077 1.00 0.00 H new ATOM 0 HZ1 LYS B 12 18.212 19.244 -7.265 1.00 0.00 H new ATOM 0 HZ2 LYS B 12 18.436 17.561 -7.210 1.00 0.00 H new ATOM 0 HZ3 LYS B 12 17.898 18.300 -8.642 1.00 0.00 H new ATOM 933 N SER B 13 11.912 13.740 -9.183 1.00 0.00 N ATOM 934 CA SER B 13 10.527 13.461 -9.670 1.00 0.00 C ATOM 935 C SER B 13 10.121 12.027 -9.315 1.00 0.00 C ATOM 936 O SER B 13 8.976 11.745 -9.014 1.00 0.00 O ATOM 937 CB SER B 13 10.605 13.647 -11.185 1.00 0.00 C ATOM 938 OG SER B 13 10.294 14.996 -11.509 1.00 0.00 O ATOM 0 H SER B 13 12.645 13.658 -9.888 1.00 0.00 H new ATOM 0 HA SER B 13 9.783 14.116 -9.217 1.00 0.00 H new ATOM 0 HB2 SER B 13 11.603 13.396 -11.543 1.00 0.00 H new ATOM 0 HB3 SER B 13 9.909 12.972 -11.682 1.00 0.00 H new ATOM 0 HG SER B 13 10.345 15.119 -12.480 1.00 0.00 H new ATOM 944 N ILE B 14 11.059 11.128 -9.334 1.00 0.00 N ATOM 945 CA ILE B 14 10.762 9.711 -8.988 1.00 0.00 C ATOM 946 C ILE B 14 10.630 9.584 -7.479 1.00 0.00 C ATOM 947 O ILE B 14 9.756 8.915 -6.970 1.00 0.00 O ATOM 948 CB ILE B 14 11.980 8.931 -9.479 1.00 0.00 C ATOM 949 CG1 ILE B 14 11.989 8.908 -11.005 1.00 0.00 C ATOM 950 CG2 ILE B 14 11.930 7.494 -8.947 1.00 0.00 C ATOM 951 CD1 ILE B 14 13.423 8.705 -11.493 1.00 0.00 C ATOM 0 H ILE B 14 12.032 11.315 -9.577 1.00 0.00 H new ATOM 0 HA ILE B 14 9.836 9.347 -9.434 1.00 0.00 H new ATOM 0 HB ILE B 14 12.886 9.416 -9.115 1.00 0.00 H new ATOM 0 HG12 ILE B 14 11.349 8.106 -11.373 1.00 0.00 H new ATOM 0 HG13 ILE B 14 11.587 9.842 -11.398 1.00 0.00 H new ATOM 0 HG21 ILE B 14 12.802 6.944 -9.302 1.00 0.00 H new ATOM 0 HG22 ILE B 14 11.929 7.509 -7.857 1.00 0.00 H new ATOM 0 HG23 ILE B 14 11.023 7.005 -9.304 1.00 0.00 H new ATOM 0 HD11 ILE B 14 13.437 8.687 -12.583 1.00 0.00 H new ATOM 0 HD12 ILE B 14 14.048 9.523 -11.135 1.00 0.00 H new ATOM 0 HD13 ILE B 14 13.807 7.760 -11.110 1.00 0.00 H new ATOM 963 N VAL B 15 11.485 10.247 -6.759 1.00 0.00 N ATOM 964 CA VAL B 15 11.408 10.194 -5.278 1.00 0.00 C ATOM 965 C VAL B 15 10.300 11.135 -4.830 1.00 0.00 C ATOM 966 O VAL B 15 9.783 11.041 -3.735 1.00 0.00 O ATOM 967 CB VAL B 15 12.776 10.654 -4.774 1.00 0.00 C ATOM 968 CG1 VAL B 15 12.994 10.124 -3.357 1.00 0.00 C ATOM 969 CG2 VAL B 15 13.873 10.098 -5.688 1.00 0.00 C ATOM 0 H VAL B 15 12.237 10.826 -7.134 1.00 0.00 H new ATOM 0 HA VAL B 15 11.181 9.201 -4.889 1.00 0.00 H new ATOM 0 HB VAL B 15 12.815 11.743 -4.775 1.00 0.00 H new ATOM 0 HG11 VAL B 15 13.968 10.449 -2.993 1.00 0.00 H new ATOM 0 HG12 VAL B 15 12.214 10.509 -2.700 1.00 0.00 H new ATOM 0 HG13 VAL B 15 12.955 9.035 -3.366 1.00 0.00 H new ATOM 0 HG21 VAL B 15 14.848 10.427 -5.328 1.00 0.00 H new ATOM 0 HG22 VAL B 15 13.833 9.009 -5.684 1.00 0.00 H new ATOM 0 HG23 VAL B 15 13.720 10.463 -6.704 1.00 0.00 H new ATOM 979 N LYS B 16 9.899 12.018 -5.703 1.00 0.00 N ATOM 980 CA LYS B 16 8.787 12.933 -5.368 1.00 0.00 C ATOM 981 C LYS B 16 7.531 12.076 -5.311 1.00 0.00 C ATOM 982 O LYS B 16 6.720 12.186 -4.412 1.00 0.00 O ATOM 983 CB LYS B 16 8.738 13.937 -6.524 1.00 0.00 C ATOM 984 CG LYS B 16 7.306 14.424 -6.738 1.00 0.00 C ATOM 985 CD LYS B 16 6.664 13.633 -7.878 1.00 0.00 C ATOM 986 CE LYS B 16 6.149 14.599 -8.947 1.00 0.00 C ATOM 987 NZ LYS B 16 4.870 14.003 -9.419 1.00 0.00 N ATOM 0 H LYS B 16 10.298 12.141 -6.634 1.00 0.00 H new ATOM 0 HA LYS B 16 8.893 13.462 -4.421 1.00 0.00 H new ATOM 0 HB2 LYS B 16 9.390 14.784 -6.308 1.00 0.00 H new ATOM 0 HB3 LYS B 16 9.112 13.472 -7.436 1.00 0.00 H new ATOM 0 HG2 LYS B 16 6.727 14.298 -5.823 1.00 0.00 H new ATOM 0 HG3 LYS B 16 7.304 15.488 -6.973 1.00 0.00 H new ATOM 0 HD2 LYS B 16 7.391 12.947 -8.313 1.00 0.00 H new ATOM 0 HD3 LYS B 16 5.843 13.026 -7.496 1.00 0.00 H new ATOM 0 HE2 LYS B 16 5.992 15.596 -8.536 1.00 0.00 H new ATOM 0 HE3 LYS B 16 6.863 14.700 -9.764 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 4.455 14.609 -10.155 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 5.052 13.057 -9.812 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 4.208 13.925 -8.621 1.00 0.00 H new ATOM 1001 N PHE B 17 7.397 11.183 -6.257 1.00 0.00 N ATOM 1002 CA PHE B 17 6.226 10.268 -6.247 1.00 0.00 C ATOM 1003 C PHE B 17 6.376 9.327 -5.049 1.00 0.00 C ATOM 1004 O PHE B 17 5.412 8.933 -4.423 1.00 0.00 O ATOM 1005 CB PHE B 17 6.304 9.499 -7.574 1.00 0.00 C ATOM 1006 CG PHE B 17 5.665 8.137 -7.421 1.00 0.00 C ATOM 1007 CD1 PHE B 17 4.317 8.031 -7.061 1.00 0.00 C ATOM 1008 CD2 PHE B 17 6.427 6.982 -7.632 1.00 0.00 C ATOM 1009 CE1 PHE B 17 3.731 6.768 -6.911 1.00 0.00 C ATOM 1010 CE2 PHE B 17 5.842 5.720 -7.484 1.00 0.00 C ATOM 1011 CZ PHE B 17 4.494 5.612 -7.124 1.00 0.00 C ATOM 0 H PHE B 17 8.047 11.051 -7.032 1.00 0.00 H new ATOM 0 HA PHE B 17 5.268 10.779 -6.157 1.00 0.00 H new ATOM 0 HB2 PHE B 17 5.799 10.061 -8.360 1.00 0.00 H new ATOM 0 HB3 PHE B 17 7.345 9.389 -7.880 1.00 0.00 H new ATOM 0 HD1 PHE B 17 3.729 8.922 -6.899 1.00 0.00 H new ATOM 0 HD2 PHE B 17 7.467 7.065 -7.909 1.00 0.00 H new ATOM 0 HE1 PHE B 17 2.691 6.685 -6.631 1.00 0.00 H new ATOM 0 HE2 PHE B 17 6.430 4.829 -7.648 1.00 0.00 H new ATOM 0 HZ PHE B 17 4.042 4.638 -7.010 1.00 0.00 H new ATOM 1021 N GLN B 18 7.595 8.980 -4.721 1.00 0.00 N ATOM 1022 CA GLN B 18 7.830 8.079 -3.554 1.00 0.00 C ATOM 1023 C GLN B 18 7.166 8.657 -2.305 1.00 0.00 C ATOM 1024 O GLN B 18 6.501 7.962 -1.566 1.00 0.00 O ATOM 1025 CB GLN B 18 9.355 8.030 -3.380 1.00 0.00 C ATOM 1026 CG GLN B 18 9.983 6.855 -4.160 1.00 0.00 C ATOM 1027 CD GLN B 18 9.048 6.344 -5.264 1.00 0.00 C ATOM 1028 OE1 GLN B 18 9.124 6.778 -6.393 1.00 0.00 O ATOM 1029 NE2 GLN B 18 8.170 5.423 -4.979 1.00 0.00 N ATOM 0 H GLN B 18 8.437 9.282 -5.211 1.00 0.00 H new ATOM 0 HA GLN B 18 7.410 7.085 -3.710 1.00 0.00 H new ATOM 0 HB2 GLN B 18 9.790 8.968 -3.723 1.00 0.00 H new ATOM 0 HB3 GLN B 18 9.597 7.935 -2.322 1.00 0.00 H new ATOM 0 HG2 GLN B 18 10.927 7.174 -4.601 1.00 0.00 H new ATOM 0 HG3 GLN B 18 10.212 6.042 -3.471 1.00 0.00 H new ATOM 0 HE21 GLN B 18 8.105 5.057 -4.029 1.00 0.00 H new ATOM 0 HE22 GLN B 18 7.548 5.069 -5.706 1.00 0.00 H new ATOM 1038 N THR B 19 7.337 9.927 -2.067 1.00 0.00 N ATOM 1039 CA THR B 19 6.708 10.550 -0.868 1.00 0.00 C ATOM 1040 C THR B 19 5.191 10.386 -0.944 1.00 0.00 C ATOM 1041 O THR B 19 4.533 10.139 0.047 1.00 0.00 O ATOM 1042 CB THR B 19 7.098 12.027 -0.932 1.00 0.00 C ATOM 1043 OG1 THR B 19 8.506 12.148 -0.785 1.00 0.00 O ATOM 1044 CG2 THR B 19 6.398 12.791 0.193 1.00 0.00 C ATOM 0 H THR B 19 7.884 10.561 -2.650 1.00 0.00 H new ATOM 0 HA THR B 19 7.037 10.091 0.065 1.00 0.00 H new ATOM 0 HB THR B 19 6.795 12.443 -1.893 1.00 0.00 H new ATOM 0 HG1 THR B 19 8.759 13.094 -0.827 1.00 0.00 H new ATOM 0 HG21 THR B 19 6.677 13.844 0.146 1.00 0.00 H new ATOM 0 HG22 THR B 19 5.318 12.696 0.080 1.00 0.00 H new ATOM 0 HG23 THR B 19 6.700 12.378 1.156 1.00 0.00 H new ATOM 1052 N LYS B 20 4.631 10.500 -2.118 1.00 0.00 N ATOM 1053 CA LYS B 20 3.160 10.324 -2.252 1.00 0.00 C ATOM 1054 C LYS B 20 2.817 8.878 -1.907 1.00 0.00 C ATOM 1055 O LYS B 20 1.752 8.574 -1.409 1.00 0.00 O ATOM 1056 CB LYS B 20 2.849 10.627 -3.719 1.00 0.00 C ATOM 1057 CG LYS B 20 2.976 12.133 -3.966 1.00 0.00 C ATOM 1058 CD LYS B 20 1.783 12.859 -3.339 1.00 0.00 C ATOM 1059 CE LYS B 20 0.635 12.929 -4.350 1.00 0.00 C ATOM 1060 NZ LYS B 20 -0.548 13.370 -3.558 1.00 0.00 N ATOM 0 H LYS B 20 5.127 10.706 -2.985 1.00 0.00 H new ATOM 0 HA LYS B 20 2.584 10.973 -1.592 1.00 0.00 H new ATOM 0 HB2 LYS B 20 3.535 10.082 -4.368 1.00 0.00 H new ATOM 0 HB3 LYS B 20 1.842 10.291 -3.966 1.00 0.00 H new ATOM 0 HG2 LYS B 20 3.907 12.505 -3.538 1.00 0.00 H new ATOM 0 HG3 LYS B 20 3.015 12.334 -5.037 1.00 0.00 H new ATOM 0 HD2 LYS B 20 1.458 12.336 -2.440 1.00 0.00 H new ATOM 0 HD3 LYS B 20 2.075 13.864 -3.035 1.00 0.00 H new ATOM 0 HE2 LYS B 20 0.858 13.632 -5.152 1.00 0.00 H new ATOM 0 HE3 LYS B 20 0.459 11.959 -4.816 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 -1.377 13.442 -4.182 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 -0.740 12.678 -2.806 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 -0.354 14.299 -3.132 1.00 0.00 H new ATOM 1074 N VAL B 21 3.739 7.988 -2.149 1.00 0.00 N ATOM 1075 CA VAL B 21 3.512 6.555 -1.820 1.00 0.00 C ATOM 1076 C VAL B 21 3.773 6.349 -0.327 1.00 0.00 C ATOM 1077 O VAL B 21 3.307 5.405 0.273 1.00 0.00 O ATOM 1078 CB VAL B 21 4.537 5.797 -2.674 1.00 0.00 C ATOM 1079 CG1 VAL B 21 5.000 4.527 -1.957 1.00 0.00 C ATOM 1080 CG2 VAL B 21 3.898 5.408 -4.007 1.00 0.00 C ATOM 0 H VAL B 21 4.647 8.195 -2.564 1.00 0.00 H new ATOM 0 HA VAL B 21 2.497 6.213 -2.023 1.00 0.00 H new ATOM 0 HB VAL B 21 5.397 6.445 -2.842 1.00 0.00 H new ATOM 0 HG11 VAL B 21 5.726 4.003 -2.578 1.00 0.00 H new ATOM 0 HG12 VAL B 21 5.461 4.794 -1.006 1.00 0.00 H new ATOM 0 HG13 VAL B 21 4.143 3.879 -1.776 1.00 0.00 H new ATOM 0 HG21 VAL B 21 4.625 4.869 -4.615 1.00 0.00 H new ATOM 0 HG22 VAL B 21 3.034 4.770 -3.824 1.00 0.00 H new ATOM 0 HG23 VAL B 21 3.579 6.307 -4.534 1.00 0.00 H new ATOM 1090 N GLU B 22 4.521 7.235 0.266 1.00 0.00 N ATOM 1091 CA GLU B 22 4.825 7.114 1.716 1.00 0.00 C ATOM 1092 C GLU B 22 3.578 7.449 2.538 1.00 0.00 C ATOM 1093 O GLU B 22 3.183 6.711 3.421 1.00 0.00 O ATOM 1094 CB GLU B 22 5.931 8.143 1.958 1.00 0.00 C ATOM 1095 CG GLU B 22 7.297 7.485 1.748 1.00 0.00 C ATOM 1096 CD GLU B 22 8.379 8.323 2.429 1.00 0.00 C ATOM 1097 OE1 GLU B 22 8.547 8.174 3.628 1.00 0.00 O ATOM 1098 OE2 GLU B 22 9.022 9.098 1.741 1.00 0.00 O ATOM 0 H GLU B 22 4.938 8.044 -0.196 1.00 0.00 H new ATOM 0 HA GLU B 22 5.131 6.109 2.006 1.00 0.00 H new ATOM 0 HB2 GLU B 22 5.813 8.986 1.277 1.00 0.00 H new ATOM 0 HB3 GLU B 22 5.858 8.539 2.971 1.00 0.00 H new ATOM 0 HG2 GLU B 22 7.293 6.475 2.158 1.00 0.00 H new ATOM 0 HG3 GLU B 22 7.509 7.395 0.683 1.00 0.00 H new ATOM 1105 N GLU B 23 2.952 8.555 2.246 1.00 0.00 N ATOM 1106 CA GLU B 23 1.726 8.938 3.004 1.00 0.00 C ATOM 1107 C GLU B 23 0.561 8.026 2.613 1.00 0.00 C ATOM 1108 O GLU B 23 -0.271 7.680 3.428 1.00 0.00 O ATOM 1109 CB GLU B 23 1.441 10.385 2.594 1.00 0.00 C ATOM 1110 CG GLU B 23 2.735 11.199 2.653 1.00 0.00 C ATOM 1111 CD GLU B 23 2.447 12.572 3.264 1.00 0.00 C ATOM 1112 OE1 GLU B 23 2.060 12.614 4.421 1.00 0.00 O ATOM 1113 OE2 GLU B 23 2.619 13.557 2.567 1.00 0.00 O ATOM 0 H GLU B 23 3.235 9.210 1.517 1.00 0.00 H new ATOM 0 HA GLU B 23 1.857 8.841 4.082 1.00 0.00 H new ATOM 0 HB2 GLU B 23 1.027 10.413 1.586 1.00 0.00 H new ATOM 0 HB3 GLU B 23 0.694 10.821 3.257 1.00 0.00 H new ATOM 0 HG2 GLU B 23 3.481 10.673 3.249 1.00 0.00 H new ATOM 0 HG3 GLU B 23 3.150 11.315 1.652 1.00 0.00 H new ATOM 1120 N LEU B 24 0.496 7.628 1.371 1.00 0.00 N ATOM 1121 CA LEU B 24 -0.612 6.733 0.937 1.00 0.00 C ATOM 1122 C LEU B 24 -0.487 5.379 1.640 1.00 0.00 C ATOM 1123 O LEU B 24 -1.446 4.852 2.167 1.00 0.00 O ATOM 1124 CB LEU B 24 -0.434 6.576 -0.573 1.00 0.00 C ATOM 1125 CG LEU B 24 -1.799 6.360 -1.227 1.00 0.00 C ATOM 1126 CD1 LEU B 24 -2.683 7.584 -0.982 1.00 0.00 C ATOM 1127 CD2 LEU B 24 -1.617 6.156 -2.731 1.00 0.00 C ATOM 0 H LEU B 24 1.161 7.884 0.641 1.00 0.00 H new ATOM 0 HA LEU B 24 -1.594 7.136 1.184 1.00 0.00 H new ATOM 0 HB2 LEU B 24 0.044 7.464 -0.988 1.00 0.00 H new ATOM 0 HB3 LEU B 24 0.221 5.732 -0.787 1.00 0.00 H new ATOM 0 HG LEU B 24 -2.272 5.478 -0.795 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -3.656 7.429 -1.448 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -2.814 7.730 0.090 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -2.210 8.466 -1.413 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -2.590 6.002 -3.198 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -1.143 7.037 -3.163 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -0.988 5.283 -2.906 1.00 0.00 H new ATOM 1139 N ILE B 25 0.692 4.818 1.661 1.00 0.00 N ATOM 1140 CA ILE B 25 0.877 3.504 2.342 1.00 0.00 C ATOM 1141 C ILE B 25 0.458 3.631 3.812 1.00 0.00 C ATOM 1142 O ILE B 25 -0.179 2.757 4.359 1.00 0.00 O ATOM 1143 CB ILE B 25 2.376 3.180 2.182 1.00 0.00 C ATOM 1144 CG1 ILE B 25 2.531 2.011 1.204 1.00 0.00 C ATOM 1145 CG2 ILE B 25 3.010 2.797 3.525 1.00 0.00 C ATOM 1146 CD1 ILE B 25 1.686 2.268 -0.045 1.00 0.00 C ATOM 0 H ILE B 25 1.533 5.211 1.238 1.00 0.00 H new ATOM 0 HA ILE B 25 0.267 2.705 1.920 1.00 0.00 H new ATOM 0 HB ILE B 25 2.882 4.068 1.805 1.00 0.00 H new ATOM 0 HG12 ILE B 25 3.579 1.892 0.928 1.00 0.00 H new ATOM 0 HG13 ILE B 25 2.219 1.082 1.681 1.00 0.00 H new ATOM 0 HG21 ILE B 25 4.067 2.574 3.378 1.00 0.00 H new ATOM 0 HG22 ILE B 25 2.908 3.626 4.225 1.00 0.00 H new ATOM 0 HG23 ILE B 25 2.507 1.918 3.927 1.00 0.00 H new ATOM 0 HD11 ILE B 25 1.799 1.435 -0.738 1.00 0.00 H new ATOM 0 HD12 ILE B 25 0.638 2.365 0.238 1.00 0.00 H new ATOM 0 HD13 ILE B 25 2.018 3.188 -0.526 1.00 0.00 H new ATOM 1158 N ASN B 26 0.803 4.717 4.451 1.00 0.00 N ATOM 1159 CA ASN B 26 0.407 4.889 5.877 1.00 0.00 C ATOM 1160 C ASN B 26 -1.116 4.865 5.985 1.00 0.00 C ATOM 1161 O ASN B 26 -1.684 4.213 6.838 1.00 0.00 O ATOM 1162 CB ASN B 26 0.951 6.259 6.283 1.00 0.00 C ATOM 1163 CG ASN B 26 1.097 6.316 7.805 1.00 0.00 C ATOM 1164 OD1 ASN B 26 0.608 5.453 8.505 1.00 0.00 O ATOM 1165 ND2 ASN B 26 1.752 7.305 8.350 1.00 0.00 N ATOM 0 H ASN B 26 1.338 5.487 4.050 1.00 0.00 H new ATOM 0 HA ASN B 26 0.795 4.098 6.519 1.00 0.00 H new ATOM 0 HB2 ASN B 26 1.916 6.435 5.807 1.00 0.00 H new ATOM 0 HB3 ASN B 26 0.278 7.046 5.941 1.00 0.00 H new ATOM 0 HD21 ASN B 26 1.853 7.353 9.364 1.00 0.00 H new ATOM 0 HD22 ASN B 26 2.163 8.030 7.762 1.00 0.00 H new ATOM 1172 N THR B 27 -1.775 5.569 5.114 1.00 0.00 N ATOM 1173 CA THR B 27 -3.263 5.597 5.140 1.00 0.00 C ATOM 1174 C THR B 27 -3.814 4.187 4.921 1.00 0.00 C ATOM 1175 O THR B 27 -4.841 3.823 5.453 1.00 0.00 O ATOM 1176 CB THR B 27 -3.651 6.512 3.980 1.00 0.00 C ATOM 1177 OG1 THR B 27 -3.449 7.866 4.362 1.00 0.00 O ATOM 1178 CG2 THR B 27 -5.121 6.293 3.620 1.00 0.00 C ATOM 0 H THR B 27 -1.346 6.131 4.379 1.00 0.00 H new ATOM 0 HA THR B 27 -3.661 5.950 6.091 1.00 0.00 H new ATOM 0 HB THR B 27 -3.033 6.282 3.112 1.00 0.00 H new ATOM 0 HG1 THR B 27 -3.695 8.456 3.619 1.00 0.00 H new ATOM 0 HG21 THR B 27 -5.394 6.947 2.792 1.00 0.00 H new ATOM 0 HG22 THR B 27 -5.273 5.254 3.327 1.00 0.00 H new ATOM 0 HG23 THR B 27 -5.745 6.521 4.484 1.00 0.00 H new ATOM 1186 N LEU B 28 -3.137 3.388 4.145 1.00 0.00 N ATOM 1187 CA LEU B 28 -3.623 1.999 3.906 1.00 0.00 C ATOM 1188 C LEU B 28 -3.495 1.194 5.197 1.00 0.00 C ATOM 1189 O LEU B 28 -4.399 0.491 5.601 1.00 0.00 O ATOM 1190 CB LEU B 28 -2.704 1.433 2.825 1.00 0.00 C ATOM 1191 CG LEU B 28 -3.228 1.839 1.448 1.00 0.00 C ATOM 1192 CD1 LEU B 28 -2.053 2.023 0.483 1.00 0.00 C ATOM 1193 CD2 LEU B 28 -4.153 0.743 0.916 1.00 0.00 C ATOM 0 H LEU B 28 -2.271 3.635 3.667 1.00 0.00 H new ATOM 0 HA LEU B 28 -4.668 1.964 3.598 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -1.689 1.805 2.964 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -2.659 0.347 2.903 1.00 0.00 H new ATOM 0 HG LEU B 28 -3.778 2.777 1.532 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -2.430 2.312 -0.498 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -1.390 2.801 0.861 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -1.502 1.086 0.398 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -4.529 1.029 -0.066 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -3.599 -0.192 0.834 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -4.991 0.610 1.600 1.00 0.00 H new ATOM 1205 N GLN B 29 -2.378 1.317 5.853 1.00 0.00 N ATOM 1206 CA GLN B 29 -2.175 0.590 7.131 1.00 0.00 C ATOM 1207 C GLN B 29 -3.087 1.198 8.195 1.00 0.00 C ATOM 1208 O GLN B 29 -3.292 0.639 9.253 1.00 0.00 O ATOM 1209 CB GLN B 29 -0.705 0.828 7.469 1.00 0.00 C ATOM 1210 CG GLN B 29 -0.171 -0.333 8.308 1.00 0.00 C ATOM 1211 CD GLN B 29 1.334 -0.480 8.076 1.00 0.00 C ATOM 1212 OE1 GLN B 29 1.838 -1.579 7.963 1.00 0.00 O ATOM 1213 NE2 GLN B 29 2.077 0.591 7.999 1.00 0.00 N ATOM 0 H GLN B 29 -1.592 1.895 5.555 1.00 0.00 H new ATOM 0 HA GLN B 29 -2.408 -0.473 7.073 1.00 0.00 H new ATOM 0 HB2 GLN B 29 -0.123 0.924 6.553 1.00 0.00 H new ATOM 0 HB3 GLN B 29 -0.595 1.764 8.016 1.00 0.00 H new ATOM 0 HG2 GLN B 29 -0.371 -0.154 9.364 1.00 0.00 H new ATOM 0 HG3 GLN B 29 -0.683 -1.256 8.038 1.00 0.00 H new ATOM 0 HE21 GLN B 29 1.653 1.514 8.094 1.00 0.00 H new ATOM 0 HE22 GLN B 29 3.081 0.505 7.844 1.00 0.00 H new ATOM 1222 N GLN B 30 -3.647 2.343 7.906 1.00 0.00 N ATOM 1223 CA GLN B 30 -4.560 3.001 8.878 1.00 0.00 C ATOM 1224 C GLN B 30 -5.957 2.402 8.742 1.00 0.00 C ATOM 1225 O GLN B 30 -6.556 1.965 9.705 1.00 0.00 O ATOM 1226 CB GLN B 30 -4.561 4.473 8.478 1.00 0.00 C ATOM 1227 CG GLN B 30 -3.241 5.108 8.906 1.00 0.00 C ATOM 1228 CD GLN B 30 -3.509 6.183 9.961 1.00 0.00 C ATOM 1229 OE1 GLN B 30 -4.638 6.585 10.162 1.00 0.00 O ATOM 1230 NE2 GLN B 30 -2.512 6.668 10.648 1.00 0.00 N ATOM 0 H GLN B 30 -3.508 2.851 7.033 1.00 0.00 H new ATOM 0 HA GLN B 30 -4.249 2.867 9.914 1.00 0.00 H new ATOM 0 HB2 GLN B 30 -4.693 4.570 7.400 1.00 0.00 H new ATOM 0 HB3 GLN B 30 -5.397 4.990 8.949 1.00 0.00 H new ATOM 0 HG2 GLN B 30 -2.573 4.347 9.309 1.00 0.00 H new ATOM 0 HG3 GLN B 30 -2.740 5.547 8.043 1.00 0.00 H new ATOM 0 HE21 GLN B 30 -1.564 6.331 10.479 1.00 0.00 H new ATOM 0 HE22 GLN B 30 -2.680 7.385 11.354 1.00 0.00 H new ATOM 1239 N LYS B 31 -6.471 2.357 7.545 1.00 0.00 N ATOM 1240 CA LYS B 31 -7.818 1.763 7.343 1.00 0.00 C ATOM 1241 C LYS B 31 -7.745 0.267 7.637 1.00 0.00 C ATOM 1242 O LYS B 31 -8.740 -0.383 7.887 1.00 0.00 O ATOM 1243 CB LYS B 31 -8.153 2.011 5.872 1.00 0.00 C ATOM 1244 CG LYS B 31 -9.186 3.134 5.765 1.00 0.00 C ATOM 1245 CD LYS B 31 -9.325 3.564 4.305 1.00 0.00 C ATOM 1246 CE LYS B 31 -10.060 4.904 4.236 1.00 0.00 C ATOM 1247 NZ LYS B 31 -11.499 4.563 4.417 1.00 0.00 N ATOM 0 H LYS B 31 -6.017 2.705 6.701 1.00 0.00 H new ATOM 0 HA LYS B 31 -8.576 2.194 7.996 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -7.250 2.279 5.323 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -8.543 1.100 5.418 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -10.148 2.795 6.148 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -8.881 3.983 6.377 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -8.341 3.653 3.846 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -9.872 2.808 3.742 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -9.715 5.584 5.014 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -9.889 5.400 3.280 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -12.030 4.838 3.566 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -11.596 3.539 4.571 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -11.876 5.074 5.241 1.00 0.00 H new ATOM 1261 N LEU B 32 -6.558 -0.278 7.615 1.00 0.00 N ATOM 1262 CA LEU B 32 -6.388 -1.727 7.902 1.00 0.00 C ATOM 1263 C LEU B 32 -6.447 -1.957 9.414 1.00 0.00 C ATOM 1264 O LEU B 32 -7.146 -2.826 9.893 1.00 0.00 O ATOM 1265 CB LEU B 32 -5.005 -2.071 7.350 1.00 0.00 C ATOM 1266 CG LEU B 32 -4.948 -3.553 6.979 1.00 0.00 C ATOM 1267 CD1 LEU B 32 -6.112 -3.899 6.049 1.00 0.00 C ATOM 1268 CD2 LEU B 32 -3.627 -3.843 6.265 1.00 0.00 C ATOM 0 H LEU B 32 -5.695 0.224 7.409 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.165 -2.346 7.454 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -4.791 -1.459 6.474 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -4.240 -1.843 8.093 1.00 0.00 H new ATOM 0 HG LEU B 32 -5.019 -4.155 7.885 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -6.067 -4.956 5.787 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -7.055 -3.690 6.553 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -6.044 -3.298 5.142 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -3.582 -4.899 5.998 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -3.561 -3.237 5.361 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -2.795 -3.600 6.926 1.00 0.00 H new ATOM 1280 N GLU B 33 -5.727 -1.171 10.169 1.00 0.00 N ATOM 1281 CA GLU B 33 -5.756 -1.332 11.650 1.00 0.00 C ATOM 1282 C GLU B 33 -7.127 -0.908 12.178 1.00 0.00 C ATOM 1283 O GLU B 33 -7.524 -1.260 13.272 1.00 0.00 O ATOM 1284 CB GLU B 33 -4.662 -0.400 12.173 1.00 0.00 C ATOM 1285 CG GLU B 33 -4.567 -0.526 13.695 1.00 0.00 C ATOM 1286 CD GLU B 33 -3.186 -1.062 14.077 1.00 0.00 C ATOM 1287 OE1 GLU B 33 -3.041 -2.272 14.143 1.00 0.00 O ATOM 1288 OE2 GLU B 33 -2.298 -0.255 14.296 1.00 0.00 O ATOM 0 H GLU B 33 -5.121 -0.426 9.824 1.00 0.00 H new ATOM 0 HA GLU B 33 -5.589 -2.361 11.967 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -3.705 -0.653 11.716 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -4.885 0.630 11.896 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -4.734 0.445 14.162 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -5.344 -1.196 14.064 1.00 0.00 H new ATOM 1295 N ALA B 34 -7.865 -0.177 11.387 1.00 0.00 N ATOM 1296 CA ALA B 34 -9.225 0.253 11.810 1.00 0.00 C ATOM 1297 C ALA B 34 -10.211 -0.812 11.353 1.00 0.00 C ATOM 1298 O ALA B 34 -11.211 -1.079 11.990 1.00 0.00 O ATOM 1299 CB ALA B 34 -9.477 1.576 11.085 1.00 0.00 C ATOM 0 H ALA B 34 -7.581 0.142 10.461 1.00 0.00 H new ATOM 0 HA ALA B 34 -9.328 0.379 12.888 1.00 0.00 H new ATOM 0 HB1 ALA B 34 -10.465 1.954 11.350 1.00 0.00 H new ATOM 0 HB2 ALA B 34 -8.720 2.302 11.380 1.00 0.00 H new ATOM 0 HB3 ALA B 34 -9.427 1.416 10.008 1.00 0.00 H new ATOM 1305 N VAL B 35 -9.906 -1.442 10.254 1.00 0.00 N ATOM 1306 CA VAL B 35 -10.779 -2.522 9.739 1.00 0.00 C ATOM 1307 C VAL B 35 -10.731 -3.687 10.728 1.00 0.00 C ATOM 1308 O VAL B 35 -11.722 -4.330 10.996 1.00 0.00 O ATOM 1309 CB VAL B 35 -10.157 -2.898 8.389 1.00 0.00 C ATOM 1310 CG1 VAL B 35 -10.285 -4.401 8.136 1.00 0.00 C ATOM 1311 CG2 VAL B 35 -10.869 -2.132 7.273 1.00 0.00 C ATOM 0 H VAL B 35 -9.080 -1.250 9.688 1.00 0.00 H new ATOM 0 HA VAL B 35 -11.825 -2.239 9.623 1.00 0.00 H new ATOM 0 HB VAL B 35 -9.099 -2.636 8.405 1.00 0.00 H new ATOM 0 HG11 VAL B 35 -9.838 -4.647 7.173 1.00 0.00 H new ATOM 0 HG12 VAL B 35 -9.770 -4.948 8.926 1.00 0.00 H new ATOM 0 HG13 VAL B 35 -11.339 -4.680 8.129 1.00 0.00 H new ATOM 0 HG21 VAL B 35 -10.429 -2.397 6.312 1.00 0.00 H new ATOM 0 HG22 VAL B 35 -11.928 -2.392 7.272 1.00 0.00 H new ATOM 0 HG23 VAL B 35 -10.759 -1.060 7.439 1.00 0.00 H new ATOM 1321 N ALA B 36 -9.577 -3.946 11.281 1.00 0.00 N ATOM 1322 CA ALA B 36 -9.458 -5.050 12.267 1.00 0.00 C ATOM 1323 C ALA B 36 -10.222 -4.662 13.531 1.00 0.00 C ATOM 1324 O ALA B 36 -10.734 -5.501 14.244 1.00 0.00 O ATOM 1325 CB ALA B 36 -7.960 -5.172 12.555 1.00 0.00 C ATOM 0 H ALA B 36 -8.713 -3.439 11.090 1.00 0.00 H new ATOM 0 HA ALA B 36 -9.867 -5.993 11.905 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -7.792 -5.970 13.278 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -7.429 -5.402 11.631 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -7.590 -4.231 12.962 1.00 0.00 H new ATOM 1331 N LYS B 37 -10.312 -3.387 13.801 1.00 0.00 N ATOM 1332 CA LYS B 37 -11.059 -2.934 15.008 1.00 0.00 C ATOM 1333 C LYS B 37 -12.559 -3.107 14.766 1.00 0.00 C ATOM 1334 O LYS B 37 -13.312 -3.430 15.664 1.00 0.00 O ATOM 1335 CB LYS B 37 -10.705 -1.454 15.173 1.00 0.00 C ATOM 1336 CG LYS B 37 -9.386 -1.320 15.937 1.00 0.00 C ATOM 1337 CD LYS B 37 -9.087 0.161 16.181 1.00 0.00 C ATOM 1338 CE LYS B 37 -9.298 0.490 17.662 1.00 0.00 C ATOM 1339 NZ LYS B 37 -8.249 1.497 17.987 1.00 0.00 N ATOM 0 H LYS B 37 -9.901 -2.642 13.239 1.00 0.00 H new ATOM 0 HA LYS B 37 -10.801 -3.504 15.901 1.00 0.00 H new ATOM 0 HB2 LYS B 37 -10.620 -0.980 14.195 1.00 0.00 H new ATOM 0 HB3 LYS B 37 -11.501 -0.938 15.709 1.00 0.00 H new ATOM 0 HG2 LYS B 37 -9.448 -1.851 16.887 1.00 0.00 H new ATOM 0 HG3 LYS B 37 -8.576 -1.777 15.369 1.00 0.00 H new ATOM 0 HD2 LYS B 37 -8.061 0.388 15.890 1.00 0.00 H new ATOM 0 HD3 LYS B 37 -9.738 0.780 15.564 1.00 0.00 H new ATOM 0 HE2 LYS B 37 -10.297 0.889 17.839 1.00 0.00 H new ATOM 0 HE3 LYS B 37 -9.196 -0.400 18.282 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 -8.330 1.772 18.987 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 -7.309 1.087 17.815 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 -8.375 2.336 17.386 1.00 0.00 H new ATOM 1353 N ARG B 38 -12.992 -2.910 13.551 1.00 0.00 N ATOM 1354 CA ARG B 38 -14.437 -3.082 13.237 1.00 0.00 C ATOM 1355 C ARG B 38 -14.782 -4.570 13.281 1.00 0.00 C ATOM 1356 O ARG B 38 -15.802 -4.970 13.805 1.00 0.00 O ATOM 1357 CB ARG B 38 -14.607 -2.523 11.825 1.00 0.00 C ATOM 1358 CG ARG B 38 -14.115 -1.075 11.785 1.00 0.00 C ATOM 1359 CD ARG B 38 -15.305 -0.126 11.940 1.00 0.00 C ATOM 1360 NE ARG B 38 -15.737 0.183 10.548 1.00 0.00 N ATOM 1361 CZ ARG B 38 -15.798 1.423 10.145 1.00 0.00 C ATOM 1362 NH1 ARG B 38 -14.884 2.275 10.520 1.00 0.00 N ATOM 1363 NH2 ARG B 38 -16.772 1.808 9.366 1.00 0.00 N ATOM 0 H ARG B 38 -12.406 -2.637 12.762 1.00 0.00 H new ATOM 0 HA ARG B 38 -15.092 -2.573 13.944 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -14.046 -3.128 11.113 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -15.655 -2.570 11.528 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -13.393 -0.903 12.583 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -13.601 -0.880 10.843 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -16.110 -0.592 12.509 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -15.020 0.780 12.475 1.00 0.00 H new ATOM 0 HE ARG B 38 -15.985 -0.574 9.911 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -14.123 1.972 11.127 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -14.931 3.244 10.206 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -17.485 1.140 9.073 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -16.820 2.777 9.051 1.00 0.00 H new ATOM 1377 N ILE B 39 -13.916 -5.392 12.759 1.00 0.00 N ATOM 1378 CA ILE B 39 -14.161 -6.859 12.793 1.00 0.00 C ATOM 1379 C ILE B 39 -14.357 -7.273 14.245 1.00 0.00 C ATOM 1380 O ILE B 39 -15.250 -8.023 14.577 1.00 0.00 O ATOM 1381 CB ILE B 39 -12.891 -7.488 12.216 1.00 0.00 C ATOM 1382 CG1 ILE B 39 -12.903 -7.351 10.686 1.00 0.00 C ATOM 1383 CG2 ILE B 39 -12.816 -8.965 12.615 1.00 0.00 C ATOM 1384 CD1 ILE B 39 -13.760 -8.453 10.056 1.00 0.00 C ATOM 0 H ILE B 39 -13.046 -5.109 12.309 1.00 0.00 H new ATOM 0 HA ILE B 39 -15.042 -7.167 12.230 1.00 0.00 H new ATOM 0 HB ILE B 39 -12.016 -6.973 12.614 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -13.294 -6.373 10.406 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -11.885 -7.409 10.302 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -11.910 -9.408 12.202 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -12.797 -9.048 13.702 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -13.687 -9.492 12.226 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -13.757 -8.341 8.972 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -13.351 -9.428 10.321 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -14.782 -8.375 10.426 1.00 0.00 H new ATOM 1396 N GLU B 40 -13.535 -6.757 15.115 1.00 0.00 N ATOM 1397 CA GLU B 40 -13.678 -7.082 16.557 1.00 0.00 C ATOM 1398 C GLU B 40 -15.017 -6.537 17.045 1.00 0.00 C ATOM 1399 O GLU B 40 -15.689 -7.138 17.859 1.00 0.00 O ATOM 1400 CB GLU B 40 -12.515 -6.365 17.247 1.00 0.00 C ATOM 1401 CG GLU B 40 -11.193 -6.814 16.621 1.00 0.00 C ATOM 1402 CD GLU B 40 -10.497 -7.807 17.554 1.00 0.00 C ATOM 1403 OE1 GLU B 40 -10.982 -7.994 18.658 1.00 0.00 O ATOM 1404 OE2 GLU B 40 -9.490 -8.365 17.148 1.00 0.00 O ATOM 0 H GLU B 40 -12.769 -6.123 14.887 1.00 0.00 H new ATOM 0 HA GLU B 40 -13.656 -8.152 16.762 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -12.629 -5.286 17.147 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -12.518 -6.588 18.314 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -11.376 -7.277 15.651 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -10.550 -5.951 16.446 1.00 0.00 H new ATOM 1411 N ALA B 41 -15.419 -5.406 16.528 1.00 0.00 N ATOM 1412 CA ALA B 41 -16.727 -4.830 16.937 1.00 0.00 C ATOM 1413 C ALA B 41 -17.816 -5.866 16.678 1.00 0.00 C ATOM 1414 O ALA B 41 -18.758 -6.002 17.434 1.00 0.00 O ATOM 1415 CB ALA B 41 -16.924 -3.601 16.048 1.00 0.00 C ATOM 0 H ALA B 41 -14.898 -4.860 15.842 1.00 0.00 H new ATOM 0 HA ALA B 41 -16.765 -4.559 17.992 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -17.872 -3.122 16.294 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -16.108 -2.897 16.214 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -16.932 -3.906 15.002 1.00 0.00 H new ATOM 1421 N LEU B 42 -17.675 -6.615 15.619 1.00 0.00 N ATOM 1422 CA LEU B 42 -18.677 -7.668 15.310 1.00 0.00 C ATOM 1423 C LEU B 42 -18.398 -8.888 16.187 1.00 0.00 C ATOM 1424 O LEU B 42 -19.295 -9.605 16.569 1.00 0.00 O ATOM 1425 CB LEU B 42 -18.469 -8.010 13.824 1.00 0.00 C ATOM 1426 CG LEU B 42 -19.048 -6.920 12.897 1.00 0.00 C ATOM 1427 CD1 LEU B 42 -20.136 -6.098 13.603 1.00 0.00 C ATOM 1428 CD2 LEU B 42 -17.919 -5.988 12.451 1.00 0.00 C ATOM 0 H LEU B 42 -16.906 -6.541 14.954 1.00 0.00 H new ATOM 0 HA LEU B 42 -19.701 -7.346 15.500 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -17.404 -8.129 13.624 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -18.943 -8.966 13.601 1.00 0.00 H new ATOM 0 HG LEU B 42 -19.501 -7.411 12.036 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -20.520 -5.340 12.920 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -20.949 -6.757 13.909 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -19.712 -5.612 14.482 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -18.322 -5.216 11.796 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -17.465 -5.521 13.325 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -17.164 -6.562 11.914 1.00 0.00 H new ATOM 1440 N GLU B 43 -17.157 -9.115 16.522 1.00 0.00 N ATOM 1441 CA GLU B 43 -16.814 -10.277 17.392 1.00 0.00 C ATOM 1442 C GLU B 43 -17.355 -10.037 18.797 1.00 0.00 C ATOM 1443 O GLU B 43 -17.494 -10.946 19.589 1.00 0.00 O ATOM 1444 CB GLU B 43 -15.289 -10.319 17.402 1.00 0.00 C ATOM 1445 CG GLU B 43 -14.789 -10.526 15.978 1.00 0.00 C ATOM 1446 CD GLU B 43 -13.716 -11.615 15.964 1.00 0.00 C ATOM 1447 OE1 GLU B 43 -13.916 -12.625 16.618 1.00 0.00 O ATOM 1448 OE2 GLU B 43 -12.710 -11.420 15.300 1.00 0.00 O ATOM 0 H GLU B 43 -16.364 -8.544 16.230 1.00 0.00 H new ATOM 0 HA GLU B 43 -17.242 -11.214 17.036 1.00 0.00 H new ATOM 0 HB2 GLU B 43 -14.890 -9.391 17.810 1.00 0.00 H new ATOM 0 HB3 GLU B 43 -14.939 -11.126 18.045 1.00 0.00 H new ATOM 0 HG2 GLU B 43 -15.617 -10.809 15.329 1.00 0.00 H new ATOM 0 HG3 GLU B 43 -14.381 -9.594 15.586 1.00 0.00 H new ATOM 1455 N ASN B 44 -17.671 -8.813 19.101 1.00 0.00 N ATOM 1456 CA ASN B 44 -18.221 -8.496 20.448 1.00 0.00 C ATOM 1457 C ASN B 44 -19.665 -8.987 20.525 1.00 0.00 C ATOM 1458 O ASN B 44 -20.218 -9.171 21.591 1.00 0.00 O ATOM 1459 CB ASN B 44 -18.167 -6.973 20.554 1.00 0.00 C ATOM 1460 CG ASN B 44 -16.718 -6.519 20.744 1.00 0.00 C ATOM 1461 OD1 ASN B 44 -15.796 -7.246 20.433 1.00 0.00 O ATOM 1462 ND2 ASN B 44 -16.478 -5.337 21.245 1.00 0.00 N ATOM 0 H ASN B 44 -17.573 -8.014 18.474 1.00 0.00 H new ATOM 0 HA ASN B 44 -17.665 -8.972 21.255 1.00 0.00 H new ATOM 0 HB2 ASN B 44 -18.584 -6.521 19.654 1.00 0.00 H new ATOM 0 HB3 ASN B 44 -18.777 -6.636 21.392 1.00 0.00 H new ATOM 0 HD21 ASN B 44 -15.516 -5.024 21.375 1.00 0.00 H new ATOM 0 HD22 ASN B 44 -17.253 -4.727 21.506 1.00 0.00 H new ATOM 1469 N LYS B 45 -20.274 -9.199 19.390 1.00 0.00 N ATOM 1470 CA LYS B 45 -21.681 -9.680 19.371 1.00 0.00 C ATOM 1471 C LYS B 45 -21.739 -11.093 18.786 1.00 0.00 C ATOM 1472 O LYS B 45 -22.712 -11.803 18.951 1.00 0.00 O ATOM 1473 CB LYS B 45 -22.422 -8.689 18.471 1.00 0.00 C ATOM 1474 CG LYS B 45 -22.569 -7.348 19.196 1.00 0.00 C ATOM 1475 CD LYS B 45 -21.193 -6.698 19.363 1.00 0.00 C ATOM 1476 CE LYS B 45 -21.320 -5.182 19.192 1.00 0.00 C ATOM 1477 NZ LYS B 45 -21.457 -4.646 20.575 1.00 0.00 N ATOM 0 H LYS B 45 -19.853 -9.058 18.471 1.00 0.00 H new ATOM 0 HA LYS B 45 -22.122 -9.730 20.367 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -21.876 -8.551 17.538 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -23.404 -9.083 18.211 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -23.227 -6.688 18.631 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -23.031 -7.500 20.172 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -20.786 -6.931 20.347 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -20.497 -7.101 18.627 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -20.444 -4.767 18.693 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -22.186 -4.925 18.582 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -21.549 -3.611 20.539 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -22.303 -5.053 21.023 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -20.615 -4.899 21.131 1.00 0.00 H new ATOM 1491 N ILE B 46 -20.700 -11.514 18.110 1.00 0.00 N ATOM 1492 CA ILE B 46 -20.698 -12.886 17.526 1.00 0.00 C ATOM 1493 C ILE B 46 -19.849 -13.816 18.394 1.00 0.00 C ATOM 1494 O ILE B 46 -19.883 -15.022 18.249 1.00 0.00 O ATOM 1495 CB ILE B 46 -20.079 -12.741 16.125 1.00 0.00 C ATOM 1496 CG1 ILE B 46 -20.893 -11.765 15.252 1.00 0.00 C ATOM 1497 CG2 ILE B 46 -20.058 -14.105 15.440 1.00 0.00 C ATOM 1498 CD1 ILE B 46 -22.356 -11.712 15.711 1.00 0.00 C ATOM 0 H ILE B 46 -19.856 -10.967 17.939 1.00 0.00 H new ATOM 0 HA ILE B 46 -21.700 -13.312 17.475 1.00 0.00 H new ATOM 0 HB ILE B 46 -19.068 -12.350 16.240 1.00 0.00 H new ATOM 0 HG12 ILE B 46 -20.454 -10.769 15.307 1.00 0.00 H new ATOM 0 HG13 ILE B 46 -20.846 -12.077 14.209 1.00 0.00 H new ATOM 0 HG21 ILE B 46 -19.620 -14.007 14.447 1.00 0.00 H new ATOM 0 HG22 ILE B 46 -19.463 -14.800 16.032 1.00 0.00 H new ATOM 0 HG23 ILE B 46 -21.076 -14.483 15.352 1.00 0.00 H new ATOM 0 HD11 ILE B 46 -22.910 -11.017 15.080 1.00 0.00 H new ATOM 0 HD12 ILE B 46 -22.798 -12.705 15.632 1.00 0.00 H new ATOM 0 HD13 ILE B 46 -22.400 -11.376 16.747 1.00 0.00 H new ATOM 1641 N CYS C 9 22.494 11.009 -7.000 1.00 0.00 N ATOM 1642 CA CYS C 9 21.032 11.174 -6.766 1.00 0.00 C ATOM 1643 C CYS C 9 20.487 9.959 -6.008 1.00 0.00 C ATOM 1644 O CYS C 9 19.591 9.280 -6.468 1.00 0.00 O ATOM 1645 CB CYS C 9 20.415 11.248 -8.163 1.00 0.00 C ATOM 1646 SG CYS C 9 20.360 12.972 -8.712 1.00 0.00 S ATOM 0 HA CYS C 9 20.802 12.058 -6.171 1.00 0.00 H new ATOM 0 HB2 CYS C 9 21.001 10.652 -8.862 1.00 0.00 H new ATOM 0 HB3 CYS C 9 19.409 10.828 -8.150 1.00 0.00 H new ATOM 1651 N GLU C 10 21.024 9.675 -4.851 1.00 0.00 N ATOM 1652 CA GLU C 10 20.540 8.500 -4.073 1.00 0.00 C ATOM 1653 C GLU C 10 20.363 7.294 -4.999 1.00 0.00 C ATOM 1654 O GLU C 10 19.390 6.572 -4.917 1.00 0.00 O ATOM 1655 CB GLU C 10 19.195 8.935 -3.492 1.00 0.00 C ATOM 1656 CG GLU C 10 19.425 9.920 -2.343 1.00 0.00 C ATOM 1657 CD GLU C 10 18.641 11.207 -2.609 1.00 0.00 C ATOM 1658 OE1 GLU C 10 17.433 11.187 -2.441 1.00 0.00 O ATOM 1659 OE2 GLU C 10 19.262 12.191 -2.976 1.00 0.00 O ATOM 0 H GLU C 10 21.776 10.206 -4.412 1.00 0.00 H new ATOM 0 HA GLU C 10 21.241 8.202 -3.293 1.00 0.00 H new ATOM 0 HB2 GLU C 10 18.586 9.401 -4.267 1.00 0.00 H new ATOM 0 HB3 GLU C 10 18.644 8.065 -3.134 1.00 0.00 H new ATOM 0 HG2 GLU C 10 19.106 9.476 -1.400 1.00 0.00 H new ATOM 0 HG3 GLU C 10 20.488 10.142 -2.248 1.00 0.00 H new ATOM 1666 N CYS C 11 21.294 7.072 -5.885 1.00 0.00 N ATOM 1667 CA CYS C 11 21.174 5.917 -6.817 1.00 0.00 C ATOM 1668 C CYS C 11 20.716 4.669 -6.063 1.00 0.00 C ATOM 1669 O CYS C 11 20.086 3.792 -6.621 1.00 0.00 O ATOM 1670 CB CYS C 11 22.577 5.714 -7.387 1.00 0.00 C ATOM 1671 SG CYS C 11 22.761 6.696 -8.897 1.00 0.00 S ATOM 0 H CYS C 11 22.132 7.641 -6.004 1.00 0.00 H new ATOM 0 HA CYS C 11 20.439 6.100 -7.601 1.00 0.00 H new ATOM 0 HB2 CYS C 11 23.326 6.011 -6.653 1.00 0.00 H new ATOM 0 HB3 CYS C 11 22.744 4.659 -7.604 1.00 0.00 H new ATOM 0 HG CYS C 11 23.955 6.526 -9.382 1.00 0.00 H new ATOM 1676 N LYS C 12 21.028 4.579 -4.801 1.00 0.00 N ATOM 1677 CA LYS C 12 20.611 3.384 -4.016 1.00 0.00 C ATOM 1678 C LYS C 12 19.818 3.814 -2.780 1.00 0.00 C ATOM 1679 O LYS C 12 19.266 2.998 -2.075 1.00 0.00 O ATOM 1680 CB LYS C 12 21.917 2.702 -3.608 1.00 0.00 C ATOM 1681 CG LYS C 12 22.624 2.164 -4.854 1.00 0.00 C ATOM 1682 CD LYS C 12 23.879 2.995 -5.127 1.00 0.00 C ATOM 1683 CE LYS C 12 25.124 2.123 -4.941 1.00 0.00 C ATOM 1684 NZ LYS C 12 26.057 2.550 -6.019 1.00 0.00 N ATOM 0 H LYS C 12 21.553 5.280 -4.279 1.00 0.00 H new ATOM 0 HA LYS C 12 19.967 2.717 -4.589 1.00 0.00 H new ATOM 0 HB2 LYS C 12 22.562 3.410 -3.088 1.00 0.00 H new ATOM 0 HB3 LYS C 12 21.712 1.888 -2.913 1.00 0.00 H new ATOM 0 HG2 LYS C 12 22.892 1.117 -4.710 1.00 0.00 H new ATOM 0 HG3 LYS C 12 21.953 2.206 -5.712 1.00 0.00 H new ATOM 0 HD2 LYS C 12 23.850 3.393 -6.141 1.00 0.00 H new ATOM 0 HD3 LYS C 12 23.916 3.849 -4.450 1.00 0.00 H new ATOM 0 HE2 LYS C 12 25.566 2.270 -3.955 1.00 0.00 H new ATOM 0 HE3 LYS C 12 24.881 1.064 -5.026 1.00 0.00 H new ATOM 0 HZ1 LYS C 12 26.935 1.997 -5.957 1.00 0.00 H new ATOM 0 HZ2 LYS C 12 25.612 2.392 -6.946 1.00 0.00 H new ATOM 0 HZ3 LYS C 12 26.276 3.561 -5.908 1.00 0.00 H new ATOM 1698 N SER C 13 19.760 5.091 -2.513 1.00 0.00 N ATOM 1699 CA SER C 13 19.002 5.575 -1.319 1.00 0.00 C ATOM 1700 C SER C 13 17.507 5.677 -1.644 1.00 0.00 C ATOM 1701 O SER C 13 16.656 5.449 -0.807 1.00 0.00 O ATOM 1702 CB SER C 13 19.591 6.954 -1.022 1.00 0.00 C ATOM 1703 OG SER C 13 20.673 6.814 -0.113 1.00 0.00 O ATOM 0 H SER C 13 20.204 5.822 -3.069 1.00 0.00 H new ATOM 0 HA SER C 13 19.088 4.902 -0.466 1.00 0.00 H new ATOM 0 HB2 SER C 13 19.934 7.423 -1.945 1.00 0.00 H new ATOM 0 HB3 SER C 13 18.827 7.606 -0.599 1.00 0.00 H new ATOM 0 HG SER C 13 21.055 7.696 0.079 1.00 0.00 H new ATOM 1709 N ILE C 14 17.192 6.003 -2.865 1.00 0.00 N ATOM 1710 CA ILE C 14 15.766 6.110 -3.282 1.00 0.00 C ATOM 1711 C ILE C 14 15.220 4.711 -3.513 1.00 0.00 C ATOM 1712 O ILE C 14 14.097 4.398 -3.182 1.00 0.00 O ATOM 1713 CB ILE C 14 15.804 6.882 -4.601 1.00 0.00 C ATOM 1714 CG1 ILE C 14 16.164 8.341 -4.325 1.00 0.00 C ATOM 1715 CG2 ILE C 14 14.435 6.812 -5.288 1.00 0.00 C ATOM 1716 CD1 ILE C 14 16.742 8.967 -5.595 1.00 0.00 C ATOM 0 H ILE C 14 17.869 6.202 -3.601 1.00 0.00 H new ATOM 0 HA ILE C 14 15.137 6.602 -2.540 1.00 0.00 H new ATOM 0 HB ILE C 14 16.554 6.438 -5.255 1.00 0.00 H new ATOM 0 HG12 ILE C 14 15.280 8.892 -4.004 1.00 0.00 H new ATOM 0 HG13 ILE C 14 16.889 8.402 -3.513 1.00 0.00 H new ATOM 0 HG21 ILE C 14 14.470 7.364 -6.227 1.00 0.00 H new ATOM 0 HG22 ILE C 14 14.181 5.771 -5.489 1.00 0.00 H new ATOM 0 HG23 ILE C 14 13.679 7.251 -4.637 1.00 0.00 H new ATOM 0 HD11 ILE C 14 17.000 10.008 -5.402 1.00 0.00 H new ATOM 0 HD12 ILE C 14 17.636 8.421 -5.895 1.00 0.00 H new ATOM 0 HD13 ILE C 14 16.002 8.919 -6.394 1.00 0.00 H new ATOM 1728 N VAL C 15 16.033 3.859 -4.058 1.00 0.00 N ATOM 1729 CA VAL C 15 15.598 2.463 -4.298 1.00 0.00 C ATOM 1730 C VAL C 15 15.756 1.694 -2.992 1.00 0.00 C ATOM 1731 O VAL C 15 15.160 0.656 -2.784 1.00 0.00 O ATOM 1732 CB VAL C 15 16.527 1.931 -5.390 1.00 0.00 C ATOM 1733 CG1 VAL C 15 15.902 0.686 -6.022 1.00 0.00 C ATOM 1734 CG2 VAL C 15 16.709 3.001 -6.474 1.00 0.00 C ATOM 0 H VAL C 15 16.987 4.071 -4.350 1.00 0.00 H new ATOM 0 HA VAL C 15 14.559 2.370 -4.613 1.00 0.00 H new ATOM 0 HB VAL C 15 17.494 1.682 -4.953 1.00 0.00 H new ATOM 0 HG11 VAL C 15 16.561 0.304 -6.801 1.00 0.00 H new ATOM 0 HG12 VAL C 15 15.762 -0.079 -5.258 1.00 0.00 H new ATOM 0 HG13 VAL C 15 14.937 0.945 -6.458 1.00 0.00 H new ATOM 0 HG21 VAL C 15 17.371 2.622 -7.252 1.00 0.00 H new ATOM 0 HG22 VAL C 15 15.740 3.246 -6.910 1.00 0.00 H new ATOM 0 HG23 VAL C 15 17.145 3.897 -6.032 1.00 0.00 H new ATOM 1744 N LYS C 16 16.526 2.241 -2.088 1.00 0.00 N ATOM 1745 CA LYS C 16 16.695 1.596 -0.764 1.00 0.00 C ATOM 1746 C LYS C 16 15.371 1.756 -0.032 1.00 0.00 C ATOM 1747 O LYS C 16 14.865 0.839 0.584 1.00 0.00 O ATOM 1748 CB LYS C 16 17.819 2.381 -0.077 1.00 0.00 C ATOM 1749 CG LYS C 16 17.637 2.351 1.441 1.00 0.00 C ATOM 1750 CD LYS C 16 16.872 3.598 1.890 1.00 0.00 C ATOM 1751 CE LYS C 16 17.732 4.403 2.867 1.00 0.00 C ATOM 1752 NZ LYS C 16 16.800 4.811 3.955 1.00 0.00 N ATOM 0 H LYS C 16 17.045 3.110 -2.216 1.00 0.00 H new ATOM 0 HA LYS C 16 16.948 0.536 -0.800 1.00 0.00 H new ATOM 0 HB2 LYS C 16 18.786 1.953 -0.343 1.00 0.00 H new ATOM 0 HB3 LYS C 16 17.819 3.412 -0.430 1.00 0.00 H new ATOM 0 HG2 LYS C 16 17.094 1.453 1.735 1.00 0.00 H new ATOM 0 HG3 LYS C 16 18.609 2.311 1.933 1.00 0.00 H new ATOM 0 HD2 LYS C 16 16.615 4.211 1.026 1.00 0.00 H new ATOM 0 HD3 LYS C 16 15.935 3.310 2.366 1.00 0.00 H new ATOM 0 HE2 LYS C 16 18.554 3.803 3.256 1.00 0.00 H new ATOM 0 HE3 LYS C 16 18.175 5.272 2.380 1.00 0.00 H new ATOM 0 HZ1 LYS C 16 17.317 5.368 4.665 1.00 0.00 H new ATOM 0 HZ2 LYS C 16 16.031 5.387 3.556 1.00 0.00 H new ATOM 0 HZ3 LYS C 16 16.399 3.963 4.405 1.00 0.00 H new ATOM 1766 N PHE C 17 14.785 2.918 -0.142 1.00 0.00 N ATOM 1767 CA PHE C 17 13.464 3.139 0.500 1.00 0.00 C ATOM 1768 C PHE C 17 12.428 2.299 -0.253 1.00 0.00 C ATOM 1769 O PHE C 17 11.477 1.801 0.316 1.00 0.00 O ATOM 1770 CB PHE C 17 13.186 4.641 0.344 1.00 0.00 C ATOM 1771 CG PHE C 17 11.695 4.888 0.269 1.00 0.00 C ATOM 1772 CD1 PHE C 17 10.870 4.525 1.340 1.00 0.00 C ATOM 1773 CD2 PHE C 17 11.138 5.469 -0.877 1.00 0.00 C ATOM 1774 CE1 PHE C 17 9.488 4.743 1.265 1.00 0.00 C ATOM 1775 CE2 PHE C 17 9.758 5.689 -0.951 1.00 0.00 C ATOM 1776 CZ PHE C 17 8.933 5.325 0.119 1.00 0.00 C ATOM 0 H PHE C 17 15.165 3.719 -0.647 1.00 0.00 H new ATOM 0 HA PHE C 17 13.431 2.851 1.551 1.00 0.00 H new ATOM 0 HB2 PHE C 17 13.611 5.187 1.186 1.00 0.00 H new ATOM 0 HB3 PHE C 17 13.671 5.017 -0.557 1.00 0.00 H new ATOM 0 HD1 PHE C 17 11.299 4.077 2.224 1.00 0.00 H new ATOM 0 HD2 PHE C 17 11.774 5.747 -1.704 1.00 0.00 H new ATOM 0 HE1 PHE C 17 8.851 4.462 2.091 1.00 0.00 H new ATOM 0 HE2 PHE C 17 9.330 6.140 -1.834 1.00 0.00 H new ATOM 0 HZ PHE C 17 7.868 5.493 0.061 1.00 0.00 H new ATOM 1786 N GLN C 18 12.623 2.134 -1.536 1.00 0.00 N ATOM 1787 CA GLN C 18 11.668 1.317 -2.342 1.00 0.00 C ATOM 1788 C GLN C 18 11.531 -0.083 -1.739 1.00 0.00 C ATOM 1789 O GLN C 18 10.443 -0.605 -1.598 1.00 0.00 O ATOM 1790 CB GLN C 18 12.290 1.243 -3.744 1.00 0.00 C ATOM 1791 CG GLN C 18 11.793 2.389 -4.655 1.00 0.00 C ATOM 1792 CD GLN C 18 11.165 3.531 -3.843 1.00 0.00 C ATOM 1793 OE1 GLN C 18 9.900 3.475 -3.534 1.00 0.00 O flip ATOM 1794 NE2 GLN C 18 11.828 4.485 -3.494 1.00 0.00 N flip ATOM 0 H GLN C 18 13.403 2.530 -2.060 1.00 0.00 H new ATOM 0 HA GLN C 18 10.669 1.752 -2.364 1.00 0.00 H new ATOM 0 HB2 GLN C 18 13.376 1.289 -3.662 1.00 0.00 H new ATOM 0 HB3 GLN C 18 12.045 0.284 -4.200 1.00 0.00 H new ATOM 0 HG2 GLN C 18 12.627 2.775 -5.241 1.00 0.00 H new ATOM 0 HG3 GLN C 18 11.060 2.000 -5.362 1.00 0.00 H new ATOM 0 HE21 GLN C 18 12.818 4.533 -3.734 1.00 0.00 H new ATOM 0 HE22 GLN C 18 11.395 5.239 -2.961 1.00 0.00 H new ATOM 1803 N THR C 19 12.626 -0.690 -1.376 1.00 0.00 N ATOM 1804 CA THR C 19 12.554 -2.051 -0.772 1.00 0.00 C ATOM 1805 C THR C 19 11.728 -1.998 0.512 1.00 0.00 C ATOM 1806 O THR C 19 10.938 -2.877 0.793 1.00 0.00 O ATOM 1807 CB THR C 19 14.003 -2.432 -0.466 1.00 0.00 C ATOM 1808 OG1 THR C 19 14.721 -2.574 -1.683 1.00 0.00 O ATOM 1809 CG2 THR C 19 14.033 -3.752 0.305 1.00 0.00 C ATOM 0 H THR C 19 13.566 -0.305 -1.471 1.00 0.00 H new ATOM 0 HA THR C 19 12.081 -2.777 -1.433 1.00 0.00 H new ATOM 0 HB THR C 19 14.465 -1.651 0.138 1.00 0.00 H new ATOM 0 HG1 THR C 19 15.650 -2.816 -1.488 1.00 0.00 H new ATOM 0 HG21 THR C 19 15.066 -4.023 0.523 1.00 0.00 H new ATOM 0 HG22 THR C 19 13.483 -3.640 1.239 1.00 0.00 H new ATOM 0 HG23 THR C 19 13.572 -4.535 -0.296 1.00 0.00 H new ATOM 1817 N LYS C 20 11.888 -0.958 1.285 1.00 0.00 N ATOM 1818 CA LYS C 20 11.092 -0.837 2.536 1.00 0.00 C ATOM 1819 C LYS C 20 9.615 -0.753 2.161 1.00 0.00 C ATOM 1820 O LYS C 20 8.744 -1.192 2.885 1.00 0.00 O ATOM 1821 CB LYS C 20 11.563 0.464 3.189 1.00 0.00 C ATOM 1822 CG LYS C 20 12.935 0.247 3.834 1.00 0.00 C ATOM 1823 CD LYS C 20 12.779 -0.613 5.090 1.00 0.00 C ATOM 1824 CE LYS C 20 12.520 0.290 6.299 1.00 0.00 C ATOM 1825 NZ LYS C 20 12.110 -0.632 7.400 1.00 0.00 N ATOM 0 H LYS C 20 12.534 -0.190 1.104 1.00 0.00 H new ATOM 0 HA LYS C 20 11.220 -1.682 3.213 1.00 0.00 H new ATOM 0 HB2 LYS C 20 11.622 1.257 2.443 1.00 0.00 H new ATOM 0 HB3 LYS C 20 10.843 0.787 3.941 1.00 0.00 H new ATOM 0 HG2 LYS C 20 13.607 -0.240 3.128 1.00 0.00 H new ATOM 0 HG3 LYS C 20 13.384 1.207 4.091 1.00 0.00 H new ATOM 0 HD2 LYS C 20 11.954 -1.314 4.963 1.00 0.00 H new ATOM 0 HD3 LYS C 20 13.679 -1.206 5.252 1.00 0.00 H new ATOM 0 HE2 LYS C 20 13.414 0.852 6.569 1.00 0.00 H new ATOM 0 HE3 LYS C 20 11.738 1.019 6.085 1.00 0.00 H new ATOM 0 HZ1 LYS C 20 11.917 -0.081 8.260 1.00 0.00 H new ATOM 0 HZ2 LYS C 20 11.252 -1.148 7.119 1.00 0.00 H new ATOM 0 HZ3 LYS C 20 12.876 -1.310 7.588 1.00 0.00 H new ATOM 1839 N VAL C 21 9.342 -0.204 1.010 1.00 0.00 N ATOM 1840 CA VAL C 21 7.937 -0.092 0.535 1.00 0.00 C ATOM 1841 C VAL C 21 7.504 -1.433 -0.065 1.00 0.00 C ATOM 1842 O VAL C 21 6.332 -1.737 -0.161 1.00 0.00 O ATOM 1843 CB VAL C 21 7.987 1.008 -0.535 1.00 0.00 C ATOM 1844 CG1 VAL C 21 6.964 0.732 -1.639 1.00 0.00 C ATOM 1845 CG2 VAL C 21 7.675 2.359 0.108 1.00 0.00 C ATOM 0 H VAL C 21 10.041 0.176 0.372 1.00 0.00 H new ATOM 0 HA VAL C 21 7.225 0.148 1.324 1.00 0.00 H new ATOM 0 HB VAL C 21 8.985 1.022 -0.972 1.00 0.00 H new ATOM 0 HG11 VAL C 21 7.015 1.522 -2.388 1.00 0.00 H new ATOM 0 HG12 VAL C 21 7.185 -0.227 -2.108 1.00 0.00 H new ATOM 0 HG13 VAL C 21 5.963 0.704 -1.209 1.00 0.00 H new ATOM 0 HG21 VAL C 21 7.710 3.140 -0.651 1.00 0.00 H new ATOM 0 HG22 VAL C 21 6.680 2.329 0.552 1.00 0.00 H new ATOM 0 HG23 VAL C 21 8.412 2.572 0.882 1.00 0.00 H new ATOM 1855 N GLU C 22 8.451 -2.232 -0.470 1.00 0.00 N ATOM 1856 CA GLU C 22 8.116 -3.556 -1.063 1.00 0.00 C ATOM 1857 C GLU C 22 7.623 -4.502 0.033 1.00 0.00 C ATOM 1858 O GLU C 22 6.591 -5.136 -0.089 1.00 0.00 O ATOM 1859 CB GLU C 22 9.433 -4.056 -1.663 1.00 0.00 C ATOM 1860 CG GLU C 22 9.542 -3.595 -3.118 1.00 0.00 C ATOM 1861 CD GLU C 22 10.640 -4.392 -3.826 1.00 0.00 C ATOM 1862 OE1 GLU C 22 10.397 -5.546 -4.139 1.00 0.00 O ATOM 1863 OE2 GLU C 22 11.703 -3.836 -4.041 1.00 0.00 O ATOM 0 H GLU C 22 9.448 -2.023 -0.415 1.00 0.00 H new ATOM 0 HA GLU C 22 7.326 -3.498 -1.812 1.00 0.00 H new ATOM 0 HB2 GLU C 22 10.275 -3.674 -1.086 1.00 0.00 H new ATOM 0 HB3 GLU C 22 9.478 -5.144 -1.611 1.00 0.00 H new ATOM 0 HG2 GLU C 22 8.589 -3.737 -3.628 1.00 0.00 H new ATOM 0 HG3 GLU C 22 9.769 -2.530 -3.157 1.00 0.00 H new ATOM 1870 N GLU C 23 8.354 -4.593 1.109 1.00 0.00 N ATOM 1871 CA GLU C 23 7.934 -5.489 2.222 1.00 0.00 C ATOM 1872 C GLU C 23 6.715 -4.903 2.936 1.00 0.00 C ATOM 1873 O GLU C 23 5.839 -5.618 3.380 1.00 0.00 O ATOM 1874 CB GLU C 23 9.135 -5.538 3.167 1.00 0.00 C ATOM 1875 CG GLU C 23 10.411 -5.802 2.365 1.00 0.00 C ATOM 1876 CD GLU C 23 11.289 -6.800 3.123 1.00 0.00 C ATOM 1877 OE1 GLU C 23 10.780 -7.846 3.493 1.00 0.00 O ATOM 1878 OE2 GLU C 23 12.454 -6.501 3.322 1.00 0.00 O ATOM 0 H GLU C 23 9.225 -4.085 1.266 1.00 0.00 H new ATOM 0 HA GLU C 23 7.652 -6.482 1.870 1.00 0.00 H new ATOM 0 HB2 GLU C 23 9.223 -4.596 3.709 1.00 0.00 H new ATOM 0 HB3 GLU C 23 8.993 -6.322 3.911 1.00 0.00 H new ATOM 0 HG2 GLU C 23 10.160 -6.196 1.380 1.00 0.00 H new ATOM 0 HG3 GLU C 23 10.954 -4.870 2.207 1.00 0.00 H new ATOM 1885 N LEU C 24 6.653 -3.604 3.049 1.00 0.00 N ATOM 1886 CA LEU C 24 5.489 -2.975 3.731 1.00 0.00 C ATOM 1887 C LEU C 24 4.218 -3.222 2.916 1.00 0.00 C ATOM 1888 O LEU C 24 3.192 -3.596 3.446 1.00 0.00 O ATOM 1889 CB LEU C 24 5.821 -1.484 3.788 1.00 0.00 C ATOM 1890 CG LEU C 24 5.180 -0.865 5.030 1.00 0.00 C ATOM 1891 CD1 LEU C 24 5.698 -1.579 6.280 1.00 0.00 C ATOM 1892 CD2 LEU C 24 5.546 0.619 5.108 1.00 0.00 C ATOM 0 H LEU C 24 7.357 -2.954 2.699 1.00 0.00 H new ATOM 0 HA LEU C 24 5.313 -3.383 4.726 1.00 0.00 H new ATOM 0 HB2 LEU C 24 6.901 -1.342 3.815 1.00 0.00 H new ATOM 0 HB3 LEU C 24 5.456 -0.985 2.890 1.00 0.00 H new ATOM 0 HG LEU C 24 4.097 -0.971 4.970 1.00 0.00 H new ATOM 0 HD11 LEU C 24 5.241 -1.138 7.166 1.00 0.00 H new ATOM 0 HD12 LEU C 24 5.441 -2.637 6.227 1.00 0.00 H new ATOM 0 HD13 LEU C 24 6.781 -1.471 6.338 1.00 0.00 H new ATOM 0 HD21 LEU C 24 5.089 1.060 5.994 1.00 0.00 H new ATOM 0 HD22 LEU C 24 6.629 0.724 5.168 1.00 0.00 H new ATOM 0 HD23 LEU C 24 5.181 1.131 4.218 1.00 0.00 H new ATOM 1904 N ILE C 25 4.282 -3.027 1.626 1.00 0.00 N ATOM 1905 CA ILE C 25 3.080 -3.265 0.779 1.00 0.00 C ATOM 1906 C ILE C 25 2.624 -4.722 0.937 1.00 0.00 C ATOM 1907 O ILE C 25 1.447 -5.006 1.013 1.00 0.00 O ATOM 1908 CB ILE C 25 3.542 -2.948 -0.658 1.00 0.00 C ATOM 1909 CG1 ILE C 25 2.911 -1.626 -1.108 1.00 0.00 C ATOM 1910 CG2 ILE C 25 3.126 -4.056 -1.636 1.00 0.00 C ATOM 1911 CD1 ILE C 25 3.040 -0.585 0.008 1.00 0.00 C ATOM 0 H ILE C 25 5.113 -2.714 1.124 1.00 0.00 H new ATOM 0 HA ILE C 25 2.225 -2.648 1.054 1.00 0.00 H new ATOM 0 HB ILE C 25 4.630 -2.877 -0.659 1.00 0.00 H new ATOM 0 HG12 ILE C 25 3.403 -1.267 -2.012 1.00 0.00 H new ATOM 0 HG13 ILE C 25 1.861 -1.779 -1.356 1.00 0.00 H new ATOM 0 HG21 ILE C 25 3.467 -3.802 -2.640 1.00 0.00 H new ATOM 0 HG22 ILE C 25 3.575 -5.000 -1.328 1.00 0.00 H new ATOM 0 HG23 ILE C 25 2.040 -4.153 -1.635 1.00 0.00 H new ATOM 0 HD11 ILE C 25 2.590 0.353 -0.316 1.00 0.00 H new ATOM 0 HD12 ILE C 25 2.528 -0.944 0.901 1.00 0.00 H new ATOM 0 HD13 ILE C 25 4.094 -0.423 0.234 1.00 0.00 H new ATOM 1923 N ASN C 26 3.548 -5.645 1.000 1.00 0.00 N ATOM 1924 CA ASN C 26 3.152 -7.072 1.169 1.00 0.00 C ATOM 1925 C ASN C 26 2.403 -7.234 2.490 1.00 0.00 C ATOM 1926 O ASN C 26 1.376 -7.879 2.564 1.00 0.00 O ATOM 1927 CB ASN C 26 4.468 -7.854 1.193 1.00 0.00 C ATOM 1928 CG ASN C 26 4.210 -9.306 0.784 1.00 0.00 C ATOM 1929 OD1 ASN C 26 3.080 -9.754 0.767 1.00 0.00 O ATOM 1930 ND2 ASN C 26 5.218 -10.064 0.449 1.00 0.00 N ATOM 0 H ASN C 26 4.552 -5.473 0.942 1.00 0.00 H new ATOM 0 HA ASN C 26 2.495 -7.425 0.374 1.00 0.00 H new ATOM 0 HB2 ASN C 26 5.187 -7.396 0.513 1.00 0.00 H new ATOM 0 HB3 ASN C 26 4.905 -7.819 2.191 1.00 0.00 H new ATOM 0 HD21 ASN C 26 5.058 -11.033 0.173 1.00 0.00 H new ATOM 0 HD22 ASN C 26 6.166 -9.688 0.463 1.00 0.00 H new ATOM 1937 N THR C 27 2.913 -6.642 3.530 1.00 0.00 N ATOM 1938 CA THR C 27 2.242 -6.739 4.857 1.00 0.00 C ATOM 1939 C THR C 27 0.838 -6.138 4.782 1.00 0.00 C ATOM 1940 O THR C 27 -0.079 -6.603 5.425 1.00 0.00 O ATOM 1941 CB THR C 27 3.125 -5.921 5.797 1.00 0.00 C ATOM 1942 OG1 THR C 27 4.301 -6.660 6.100 1.00 0.00 O ATOM 1943 CG2 THR C 27 2.363 -5.621 7.087 1.00 0.00 C ATOM 0 H THR C 27 3.771 -6.091 3.520 1.00 0.00 H new ATOM 0 HA THR C 27 2.128 -7.770 5.193 1.00 0.00 H new ATOM 0 HB THR C 27 3.398 -4.983 5.314 1.00 0.00 H new ATOM 0 HG1 THR C 27 4.968 -6.517 5.396 1.00 0.00 H new ATOM 0 HG21 THR C 27 2.995 -5.037 7.756 1.00 0.00 H new ATOM 0 HG22 THR C 27 1.461 -5.054 6.854 1.00 0.00 H new ATOM 0 HG23 THR C 27 2.088 -6.557 7.573 1.00 0.00 H new ATOM 1951 N LEU C 28 0.659 -5.111 3.996 1.00 0.00 N ATOM 1952 CA LEU C 28 -0.694 -4.495 3.880 1.00 0.00 C ATOM 1953 C LEU C 28 -1.634 -5.472 3.181 1.00 0.00 C ATOM 1954 O LEU C 28 -2.754 -5.685 3.599 1.00 0.00 O ATOM 1955 CB LEU C 28 -0.490 -3.241 3.031 1.00 0.00 C ATOM 1956 CG LEU C 28 -0.016 -2.095 3.925 1.00 0.00 C ATOM 1957 CD1 LEU C 28 0.902 -1.168 3.126 1.00 0.00 C ATOM 1958 CD2 LEU C 28 -1.228 -1.306 4.422 1.00 0.00 C ATOM 0 H LEU C 28 1.387 -4.674 3.432 1.00 0.00 H new ATOM 0 HA LEU C 28 -1.133 -4.254 4.848 1.00 0.00 H new ATOM 0 HB2 LEU C 28 0.244 -3.434 2.248 1.00 0.00 H new ATOM 0 HB3 LEU C 28 -1.422 -2.969 2.535 1.00 0.00 H new ATOM 0 HG LEU C 28 0.531 -2.500 4.776 1.00 0.00 H new ATOM 0 HD11 LEU C 28 1.239 -0.351 3.764 1.00 0.00 H new ATOM 0 HD12 LEU C 28 1.765 -1.730 2.769 1.00 0.00 H new ATOM 0 HD13 LEU C 28 0.357 -0.761 2.274 1.00 0.00 H new ATOM 0 HD21 LEU C 28 -0.893 -0.488 5.060 1.00 0.00 H new ATOM 0 HD22 LEU C 28 -1.773 -0.901 3.569 1.00 0.00 H new ATOM 0 HD23 LEU C 28 -1.883 -1.965 4.992 1.00 0.00 H new ATOM 1970 N GLN C 29 -1.171 -6.082 2.127 1.00 0.00 N ATOM 1971 CA GLN C 29 -2.011 -7.066 1.401 1.00 0.00 C ATOM 1972 C GLN C 29 -2.170 -8.317 2.267 1.00 0.00 C ATOM 1973 O GLN C 29 -3.004 -9.164 2.017 1.00 0.00 O ATOM 1974 CB GLN C 29 -1.219 -7.376 0.134 1.00 0.00 C ATOM 1975 CG GLN C 29 -2.176 -7.765 -0.996 1.00 0.00 C ATOM 1976 CD GLN C 29 -1.559 -7.373 -2.340 1.00 0.00 C ATOM 1977 OE1 GLN C 29 -2.245 -6.890 -3.218 1.00 0.00 O ATOM 1978 NE2 GLN C 29 -0.284 -7.564 -2.538 1.00 0.00 N ATOM 0 H GLN C 29 -0.240 -5.938 1.737 1.00 0.00 H new ATOM 0 HA GLN C 29 -3.012 -6.701 1.171 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -0.630 -6.507 -0.159 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -0.517 -8.188 0.323 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -2.370 -8.837 -0.971 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -3.135 -7.265 -0.864 1.00 0.00 H new ATOM 0 HE21 GLN C 29 0.292 -7.970 -1.800 1.00 0.00 H new ATOM 0 HE22 GLN C 29 0.137 -7.308 -3.431 1.00 0.00 H new ATOM 1987 N GLN C 30 -1.372 -8.424 3.298 1.00 0.00 N ATOM 1988 CA GLN C 30 -1.466 -9.600 4.204 1.00 0.00 C ATOM 1989 C GLN C 30 -2.588 -9.368 5.215 1.00 0.00 C ATOM 1990 O GLN C 30 -3.465 -10.192 5.392 1.00 0.00 O ATOM 1991 CB GLN C 30 -0.108 -9.668 4.905 1.00 0.00 C ATOM 1992 CG GLN C 30 0.942 -10.197 3.929 1.00 0.00 C ATOM 1993 CD GLN C 30 1.473 -11.541 4.429 1.00 0.00 C ATOM 1994 OE1 GLN C 30 1.237 -11.917 5.560 1.00 0.00 O ATOM 1995 NE2 GLN C 30 2.186 -12.287 3.630 1.00 0.00 N ATOM 0 H GLN C 30 -0.657 -7.742 3.550 1.00 0.00 H new ATOM 0 HA GLN C 30 -1.690 -10.527 3.677 1.00 0.00 H new ATOM 0 HB2 GLN C 30 0.178 -8.679 5.263 1.00 0.00 H new ATOM 0 HB3 GLN C 30 -0.169 -10.318 5.778 1.00 0.00 H new ATOM 0 HG2 GLN C 30 0.506 -10.313 2.937 1.00 0.00 H new ATOM 0 HG3 GLN C 30 1.760 -9.483 3.836 1.00 0.00 H new ATOM 0 HE21 GLN C 30 2.385 -11.972 2.680 1.00 0.00 H new ATOM 0 HE22 GLN C 30 2.545 -13.185 3.955 1.00 0.00 H new ATOM 2004 N LYS C 31 -2.578 -8.235 5.863 1.00 0.00 N ATOM 2005 CA LYS C 31 -3.657 -7.930 6.843 1.00 0.00 C ATOM 2006 C LYS C 31 -4.969 -7.741 6.087 1.00 0.00 C ATOM 2007 O LYS C 31 -6.044 -7.839 6.641 1.00 0.00 O ATOM 2008 CB LYS C 31 -3.228 -6.627 7.519 1.00 0.00 C ATOM 2009 CG LYS C 31 -2.660 -6.932 8.907 1.00 0.00 C ATOM 2010 CD LYS C 31 -2.095 -5.649 9.522 1.00 0.00 C ATOM 2011 CE LYS C 31 -1.275 -5.997 10.768 1.00 0.00 C ATOM 2012 NZ LYS C 31 -2.276 -6.136 11.862 1.00 0.00 N ATOM 0 H LYS C 31 -1.870 -7.509 5.756 1.00 0.00 H new ATOM 0 HA LYS C 31 -3.807 -8.724 7.575 1.00 0.00 H new ATOM 0 HB2 LYS C 31 -2.478 -6.120 6.912 1.00 0.00 H new ATOM 0 HB3 LYS C 31 -4.080 -5.952 7.604 1.00 0.00 H new ATOM 0 HG2 LYS C 31 -3.440 -7.342 9.548 1.00 0.00 H new ATOM 0 HG3 LYS C 31 -1.878 -7.687 8.833 1.00 0.00 H new ATOM 0 HD2 LYS C 31 -1.470 -5.130 8.796 1.00 0.00 H new ATOM 0 HD3 LYS C 31 -2.907 -4.971 9.786 1.00 0.00 H new ATOM 0 HE2 LYS C 31 -0.715 -6.921 10.626 1.00 0.00 H new ATOM 0 HE3 LYS C 31 -0.549 -5.216 10.994 1.00 0.00 H new ATOM 0 HZ1 LYS C 31 -1.789 -6.374 12.750 1.00 0.00 H new ATOM 0 HZ2 LYS C 31 -2.789 -5.239 11.979 1.00 0.00 H new ATOM 0 HZ3 LYS C 31 -2.949 -6.892 11.623 1.00 0.00 H new ATOM 2026 N LEU C 32 -4.877 -7.479 4.811 1.00 0.00 N ATOM 2027 CA LEU C 32 -6.102 -7.293 3.990 1.00 0.00 C ATOM 2028 C LEU C 32 -6.699 -8.661 3.656 1.00 0.00 C ATOM 2029 O LEU C 32 -7.883 -8.889 3.810 1.00 0.00 O ATOM 2030 CB LEU C 32 -5.614 -6.592 2.723 1.00 0.00 C ATOM 2031 CG LEU C 32 -6.758 -5.798 2.092 1.00 0.00 C ATOM 2032 CD1 LEU C 32 -7.378 -4.868 3.139 1.00 0.00 C ATOM 2033 CD2 LEU C 32 -6.210 -4.965 0.932 1.00 0.00 C ATOM 0 H LEU C 32 -3.998 -7.386 4.301 1.00 0.00 H new ATOM 0 HA LEU C 32 -6.875 -6.717 4.498 1.00 0.00 H new ATOM 0 HB2 LEU C 32 -4.786 -5.925 2.962 1.00 0.00 H new ATOM 0 HB3 LEU C 32 -5.236 -7.328 2.013 1.00 0.00 H new ATOM 0 HG LEU C 32 -7.520 -6.485 1.725 1.00 0.00 H new ATOM 0 HD11 LEU C 32 -8.193 -4.303 2.687 1.00 0.00 H new ATOM 0 HD12 LEU C 32 -7.764 -5.460 3.969 1.00 0.00 H new ATOM 0 HD13 LEU C 32 -6.619 -4.178 3.508 1.00 0.00 H new ATOM 0 HD21 LEU C 32 -7.021 -4.396 0.477 1.00 0.00 H new ATOM 0 HD22 LEU C 32 -5.450 -4.279 1.304 1.00 0.00 H new ATOM 0 HD23 LEU C 32 -5.768 -5.626 0.186 1.00 0.00 H new ATOM 2045 N GLU C 33 -5.882 -9.578 3.213 1.00 0.00 N ATOM 2046 CA GLU C 33 -6.397 -10.937 2.884 1.00 0.00 C ATOM 2047 C GLU C 33 -6.817 -11.646 4.171 1.00 0.00 C ATOM 2048 O GLU C 33 -7.581 -12.591 4.154 1.00 0.00 O ATOM 2049 CB GLU C 33 -5.220 -11.659 2.227 1.00 0.00 C ATOM 2050 CG GLU C 33 -5.623 -13.099 1.905 1.00 0.00 C ATOM 2051 CD GLU C 33 -5.470 -13.350 0.404 1.00 0.00 C ATOM 2052 OE1 GLU C 33 -6.392 -13.028 -0.327 1.00 0.00 O ATOM 2053 OE2 GLU C 33 -4.434 -13.860 0.011 1.00 0.00 O ATOM 0 H GLU C 33 -4.882 -9.445 3.065 1.00 0.00 H new ATOM 0 HA GLU C 33 -7.267 -10.912 2.228 1.00 0.00 H new ATOM 0 HB2 GLU C 33 -4.924 -11.140 1.315 1.00 0.00 H new ATOM 0 HB3 GLU C 33 -4.357 -11.651 2.893 1.00 0.00 H new ATOM 0 HG2 GLU C 33 -5.000 -13.796 2.466 1.00 0.00 H new ATOM 0 HG3 GLU C 33 -6.654 -13.276 2.211 1.00 0.00 H new ATOM 2060 N ALA C 34 -6.343 -11.172 5.290 1.00 0.00 N ATOM 2061 CA ALA C 34 -6.731 -11.786 6.587 1.00 0.00 C ATOM 2062 C ALA C 34 -7.974 -11.065 7.087 1.00 0.00 C ATOM 2063 O ALA C 34 -8.830 -11.635 7.733 1.00 0.00 O ATOM 2064 CB ALA C 34 -5.547 -11.547 7.523 1.00 0.00 C ATOM 0 H ALA C 34 -5.701 -10.382 5.360 1.00 0.00 H new ATOM 0 HA ALA C 34 -6.954 -12.851 6.517 1.00 0.00 H new ATOM 0 HB1 ALA C 34 -5.765 -11.975 8.501 1.00 0.00 H new ATOM 0 HB2 ALA C 34 -4.656 -12.019 7.110 1.00 0.00 H new ATOM 0 HB3 ALA C 34 -5.375 -10.476 7.626 1.00 0.00 H new ATOM 2070 N VAL C 35 -8.082 -9.810 6.752 1.00 0.00 N ATOM 2071 CA VAL C 35 -9.272 -9.029 7.159 1.00 0.00 C ATOM 2072 C VAL C 35 -10.491 -9.612 6.444 1.00 0.00 C ATOM 2073 O VAL C 35 -11.568 -9.697 6.995 1.00 0.00 O ATOM 2074 CB VAL C 35 -8.971 -7.598 6.692 1.00 0.00 C ATOM 2075 CG1 VAL C 35 -10.252 -6.906 6.222 1.00 0.00 C ATOM 2076 CG2 VAL C 35 -8.364 -6.805 7.851 1.00 0.00 C ATOM 0 H VAL C 35 -7.390 -9.293 6.210 1.00 0.00 H new ATOM 0 HA VAL C 35 -9.479 -9.053 8.229 1.00 0.00 H new ATOM 0 HB VAL C 35 -8.269 -7.640 5.860 1.00 0.00 H new ATOM 0 HG11 VAL C 35 -10.019 -5.893 5.895 1.00 0.00 H new ATOM 0 HG12 VAL C 35 -10.684 -7.465 5.392 1.00 0.00 H new ATOM 0 HG13 VAL C 35 -10.967 -6.866 7.044 1.00 0.00 H new ATOM 0 HG21 VAL C 35 -8.149 -5.788 7.523 1.00 0.00 H new ATOM 0 HG22 VAL C 35 -9.069 -6.777 8.681 1.00 0.00 H new ATOM 0 HG23 VAL C 35 -7.440 -7.284 8.176 1.00 0.00 H new ATOM 2086 N ALA C 36 -10.314 -10.033 5.218 1.00 0.00 N ATOM 2087 CA ALA C 36 -11.449 -10.635 4.470 1.00 0.00 C ATOM 2088 C ALA C 36 -11.783 -11.987 5.096 1.00 0.00 C ATOM 2089 O ALA C 36 -12.909 -12.441 5.066 1.00 0.00 O ATOM 2090 CB ALA C 36 -10.942 -10.811 3.036 1.00 0.00 C ATOM 0 H ALA C 36 -9.433 -9.984 4.707 1.00 0.00 H new ATOM 0 HA ALA C 36 -12.350 -10.022 4.494 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -11.729 -11.252 2.424 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -10.665 -9.840 2.626 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -10.071 -11.467 3.036 1.00 0.00 H new ATOM 2096 N LYS C 37 -10.802 -12.624 5.680 1.00 0.00 N ATOM 2097 CA LYS C 37 -11.053 -13.939 6.330 1.00 0.00 C ATOM 2098 C LYS C 37 -11.824 -13.722 7.633 1.00 0.00 C ATOM 2099 O LYS C 37 -12.651 -14.522 8.021 1.00 0.00 O ATOM 2100 CB LYS C 37 -9.665 -14.519 6.609 1.00 0.00 C ATOM 2101 CG LYS C 37 -9.143 -15.228 5.357 1.00 0.00 C ATOM 2102 CD LYS C 37 -7.807 -15.905 5.673 1.00 0.00 C ATOM 2103 CE LYS C 37 -8.007 -17.421 5.746 1.00 0.00 C ATOM 2104 NZ LYS C 37 -6.763 -18.003 5.168 1.00 0.00 N ATOM 0 H LYS C 37 -9.840 -12.289 5.734 1.00 0.00 H new ATOM 0 HA LYS C 37 -11.647 -14.610 5.710 1.00 0.00 H new ATOM 0 HB2 LYS C 37 -8.979 -13.723 6.901 1.00 0.00 H new ATOM 0 HB3 LYS C 37 -9.714 -15.220 7.442 1.00 0.00 H new ATOM 0 HG2 LYS C 37 -9.867 -15.969 5.017 1.00 0.00 H new ATOM 0 HG3 LYS C 37 -9.016 -14.511 4.546 1.00 0.00 H new ATOM 0 HD2 LYS C 37 -7.073 -15.661 4.905 1.00 0.00 H new ATOM 0 HD3 LYS C 37 -7.414 -15.533 6.619 1.00 0.00 H new ATOM 0 HE2 LYS C 37 -8.156 -17.750 6.774 1.00 0.00 H new ATOM 0 HE3 LYS C 37 -8.887 -17.731 5.182 1.00 0.00 H new ATOM 0 HZ1 LYS C 37 -6.825 -19.041 5.184 1.00 0.00 H new ATOM 0 HZ2 LYS C 37 -6.651 -17.678 4.187 1.00 0.00 H new ATOM 0 HZ3 LYS C 37 -5.943 -17.697 5.730 1.00 0.00 H new ATOM 2118 N ARG C 38 -11.568 -12.631 8.301 1.00 0.00 N ATOM 2119 CA ARG C 38 -12.292 -12.341 9.567 1.00 0.00 C ATOM 2120 C ARG C 38 -13.729 -11.943 9.237 1.00 0.00 C ATOM 2121 O ARG C 38 -14.666 -12.339 9.900 1.00 0.00 O ATOM 2122 CB ARG C 38 -11.535 -11.174 10.201 1.00 0.00 C ATOM 2123 CG ARG C 38 -10.065 -11.559 10.386 1.00 0.00 C ATOM 2124 CD ARG C 38 -9.839 -12.040 11.821 1.00 0.00 C ATOM 2125 NE ARG C 38 -9.454 -10.816 12.576 1.00 0.00 N ATOM 2126 CZ ARG C 38 -8.345 -10.794 13.267 1.00 0.00 C ATOM 2127 NH1 ARG C 38 -7.278 -11.388 12.810 1.00 0.00 N ATOM 2128 NH2 ARG C 38 -8.305 -10.172 14.414 1.00 0.00 N ATOM 0 H ARG C 38 -10.886 -11.926 8.022 1.00 0.00 H new ATOM 0 HA ARG C 38 -12.334 -13.197 10.241 1.00 0.00 H new ATOM 0 HB2 ARG C 38 -11.613 -10.289 9.569 1.00 0.00 H new ATOM 0 HB3 ARG C 38 -11.979 -10.919 11.163 1.00 0.00 H new ATOM 0 HG2 ARG C 38 -9.792 -12.344 9.681 1.00 0.00 H new ATOM 0 HG3 ARG C 38 -9.424 -10.703 10.173 1.00 0.00 H new ATOM 0 HD2 ARG C 38 -10.741 -12.492 12.233 1.00 0.00 H new ATOM 0 HD3 ARG C 38 -9.055 -12.796 11.866 1.00 0.00 H new ATOM 0 HE ARG C 38 -10.057 -9.993 12.554 1.00 0.00 H new ATOM 0 HH11 ARG C 38 -7.308 -11.871 11.912 1.00 0.00 H new ATOM 0 HH12 ARG C 38 -6.413 -11.370 13.351 1.00 0.00 H new ATOM 0 HH21 ARG C 38 -9.139 -9.704 14.770 1.00 0.00 H new ATOM 0 HH22 ARG C 38 -7.440 -10.154 14.954 1.00 0.00 H new ATOM 2142 N ILE C 39 -13.903 -11.178 8.196 1.00 0.00 N ATOM 2143 CA ILE C 39 -15.274 -10.771 7.793 1.00 0.00 C ATOM 2144 C ILE C 39 -16.094 -12.030 7.527 1.00 0.00 C ATOM 2145 O ILE C 39 -17.240 -12.132 7.915 1.00 0.00 O ATOM 2146 CB ILE C 39 -15.083 -9.958 6.512 1.00 0.00 C ATOM 2147 CG1 ILE C 39 -14.610 -8.540 6.872 1.00 0.00 C ATOM 2148 CG2 ILE C 39 -16.402 -9.896 5.732 1.00 0.00 C ATOM 2149 CD1 ILE C 39 -15.802 -7.656 7.252 1.00 0.00 C ATOM 0 H ILE C 39 -13.152 -10.817 7.607 1.00 0.00 H new ATOM 0 HA ILE C 39 -15.797 -10.189 8.552 1.00 0.00 H new ATOM 0 HB ILE C 39 -14.330 -10.437 5.886 1.00 0.00 H new ATOM 0 HG12 ILE C 39 -13.905 -8.585 7.702 1.00 0.00 H new ATOM 0 HG13 ILE C 39 -14.080 -8.102 6.026 1.00 0.00 H new ATOM 0 HG21 ILE C 39 -16.259 -9.315 4.821 1.00 0.00 H new ATOM 0 HG22 ILE C 39 -16.719 -10.906 5.473 1.00 0.00 H new ATOM 0 HG23 ILE C 39 -17.167 -9.422 6.348 1.00 0.00 H new ATOM 0 HD11 ILE C 39 -15.448 -6.656 7.504 1.00 0.00 H new ATOM 0 HD12 ILE C 39 -16.493 -7.595 6.411 1.00 0.00 H new ATOM 0 HD13 ILE C 39 -16.315 -8.087 8.112 1.00 0.00 H new ATOM 2161 N GLU C 40 -15.498 -13.001 6.891 1.00 0.00 N ATOM 2162 CA GLU C 40 -16.226 -14.270 6.627 1.00 0.00 C ATOM 2163 C GLU C 40 -16.496 -14.955 7.962 1.00 0.00 C ATOM 2164 O GLU C 40 -17.527 -15.566 8.164 1.00 0.00 O ATOM 2165 CB GLU C 40 -15.287 -15.113 5.764 1.00 0.00 C ATOM 2166 CG GLU C 40 -14.893 -14.325 4.513 1.00 0.00 C ATOM 2167 CD GLU C 40 -15.621 -14.899 3.296 1.00 0.00 C ATOM 2168 OE1 GLU C 40 -16.126 -16.005 3.398 1.00 0.00 O ATOM 2169 OE2 GLU C 40 -15.660 -14.222 2.280 1.00 0.00 O ATOM 0 H GLU C 40 -14.539 -12.969 6.544 1.00 0.00 H new ATOM 0 HA GLU C 40 -17.181 -14.118 6.124 1.00 0.00 H new ATOM 0 HB2 GLU C 40 -14.397 -15.381 6.333 1.00 0.00 H new ATOM 0 HB3 GLU C 40 -15.776 -16.045 5.480 1.00 0.00 H new ATOM 0 HG2 GLU C 40 -15.147 -13.272 4.639 1.00 0.00 H new ATOM 0 HG3 GLU C 40 -13.815 -14.377 4.363 1.00 0.00 H new ATOM 2176 N ALA C 41 -15.583 -14.831 8.888 1.00 0.00 N ATOM 2177 CA ALA C 41 -15.802 -15.449 10.223 1.00 0.00 C ATOM 2178 C ALA C 41 -17.118 -14.923 10.787 1.00 0.00 C ATOM 2179 O ALA C 41 -17.857 -15.628 11.445 1.00 0.00 O ATOM 2180 CB ALA C 41 -14.620 -14.991 11.080 1.00 0.00 C ATOM 0 H ALA C 41 -14.701 -14.331 8.777 1.00 0.00 H new ATOM 0 HA ALA C 41 -15.860 -16.537 10.190 1.00 0.00 H new ATOM 0 HB1 ALA C 41 -14.714 -15.409 12.082 1.00 0.00 H new ATOM 0 HB2 ALA C 41 -13.689 -15.334 10.629 1.00 0.00 H new ATOM 0 HB3 ALA C 41 -14.614 -13.903 11.140 1.00 0.00 H new ATOM 2186 N LEU C 42 -17.427 -13.686 10.504 1.00 0.00 N ATOM 2187 CA LEU C 42 -18.707 -13.107 10.990 1.00 0.00 C ATOM 2188 C LEU C 42 -19.835 -13.558 10.066 1.00 0.00 C ATOM 2189 O LEU C 42 -20.955 -13.745 10.486 1.00 0.00 O ATOM 2190 CB LEU C 42 -18.528 -11.583 10.910 1.00 0.00 C ATOM 2191 CG LEU C 42 -17.624 -11.047 12.040 1.00 0.00 C ATOM 2192 CD1 LEU C 42 -17.579 -12.014 13.230 1.00 0.00 C ATOM 2193 CD2 LEU C 42 -16.212 -10.848 11.495 1.00 0.00 C ATOM 0 H LEU C 42 -16.845 -13.052 9.956 1.00 0.00 H new ATOM 0 HA LEU C 42 -18.953 -13.423 12.004 1.00 0.00 H new ATOM 0 HB2 LEU C 42 -18.097 -11.319 9.944 1.00 0.00 H new ATOM 0 HB3 LEU C 42 -19.503 -11.100 10.966 1.00 0.00 H new ATOM 0 HG LEU C 42 -18.036 -10.100 12.390 1.00 0.00 H new ATOM 0 HD11 LEU C 42 -16.933 -11.605 14.007 1.00 0.00 H new ATOM 0 HD12 LEU C 42 -18.585 -12.149 13.628 1.00 0.00 H new ATOM 0 HD13 LEU C 42 -17.187 -12.977 12.902 1.00 0.00 H new ATOM 0 HD21 LEU C 42 -15.566 -10.469 12.287 1.00 0.00 H new ATOM 0 HD22 LEU C 42 -15.824 -11.800 11.134 1.00 0.00 H new ATOM 0 HD23 LEU C 42 -16.237 -10.132 10.674 1.00 0.00 H new ATOM 2205 N GLU C 43 -19.541 -13.745 8.807 1.00 0.00 N ATOM 2206 CA GLU C 43 -20.592 -14.198 7.852 1.00 0.00 C ATOM 2207 C GLU C 43 -20.996 -15.630 8.180 1.00 0.00 C ATOM 2208 O GLU C 43 -22.038 -16.105 7.777 1.00 0.00 O ATOM 2209 CB GLU C 43 -19.933 -14.126 6.479 1.00 0.00 C ATOM 2210 CG GLU C 43 -19.520 -12.685 6.203 1.00 0.00 C ATOM 2211 CD GLU C 43 -19.974 -12.279 4.798 1.00 0.00 C ATOM 2212 OE1 GLU C 43 -21.097 -12.598 4.446 1.00 0.00 O ATOM 2213 OE2 GLU C 43 -19.190 -11.658 4.099 1.00 0.00 O ATOM 0 H GLU C 43 -18.617 -13.603 8.399 1.00 0.00 H new ATOM 0 HA GLU C 43 -21.495 -13.589 7.898 1.00 0.00 H new ATOM 0 HB2 GLU C 43 -19.062 -14.781 6.444 1.00 0.00 H new ATOM 0 HB3 GLU C 43 -20.624 -14.474 5.711 1.00 0.00 H new ATOM 0 HG2 GLU C 43 -19.963 -12.021 6.945 1.00 0.00 H new ATOM 0 HG3 GLU C 43 -18.438 -12.583 6.290 1.00 0.00 H new