USER MOD reduce.3.24.130724 H: found=0, std=0, add=700, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 702 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 10 THR OG1 : rot 32:sc= 0.267 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -168:sc= -1.79! (180deg=-2.58!) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 44:sc= 0.592 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -66:sc= 2.12 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 210 THR OG1 : rot 30:sc= 0.153 USER MOD Single : B 213 SER OG : rot 180:sc= 0 USER MOD Single : B 215 THR OG1 : rot 180:sc= 0 USER MOD Single : B 216 THR OG1 : rot 180:sc=-0.00638 USER MOD Single : B 217 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : B 222 SER OG : rot 180:sc= 0 USER MOD Single : B 225 LYS NZ :NH3+ -135:sc= 1.22 (180deg=-0.877) USER MOD Single : B 226 THR OG1 : rot 180:sc= 0 USER MOD Single : B 227 TYR OH : rot 180:sc= -0.0515 USER MOD Single : B 228 THR OG1 : rot 180:sc= 0 USER MOD Single : B 230 THR OG1 : rot 45:sc= 0.64 USER MOD Single : B 233 SER OG : rot 180:sc= 0 USER MOD Single : B 241 THR OG1 : rot -47:sc= 1.14 USER MOD Single : B 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 246 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 137 N THR A 10 -10.097 -10.453 -4.409 1.00 22.41 N ATOM 138 CA THR A 10 -8.883 -10.196 -3.702 1.00 12.24 C ATOM 139 C THR A 10 -7.912 -9.431 -4.619 1.00 64.24 C ATOM 140 O THR A 10 -7.943 -9.595 -5.846 1.00 31.22 O ATOM 141 CB THR A 10 -8.248 -11.546 -3.299 1.00 65.52 C ATOM 142 OG1 THR A 10 -9.244 -12.360 -2.656 1.00 54.55 O ATOM 143 CG2 THR A 10 -7.086 -11.346 -2.335 1.00 21.31 C ATOM 0 HA THR A 10 -9.088 -9.600 -2.813 1.00 12.24 H new ATOM 0 HB THR A 10 -7.873 -12.029 -4.201 1.00 65.52 H new ATOM 0 HG1 THR A 10 -10.124 -12.167 -3.043 1.00 54.55 H new ATOM 0 HG21 THR A 10 -6.661 -12.315 -2.071 1.00 21.31 H new ATOM 0 HG22 THR A 10 -6.321 -10.732 -2.810 1.00 21.31 H new ATOM 0 HG23 THR A 10 -7.443 -10.848 -1.433 1.00 21.31 H new ATOM 151 N CYS A 11 -7.079 -8.608 -4.041 1.00 3.24 N ATOM 152 CA CYS A 11 -6.102 -7.873 -4.790 1.00 44.30 C ATOM 153 C CYS A 11 -4.744 -8.252 -4.252 1.00 3.21 C ATOM 154 O CYS A 11 -4.609 -8.493 -3.051 1.00 20.31 O ATOM 155 CB CYS A 11 -6.305 -6.375 -4.566 1.00 1.11 C ATOM 156 SG CYS A 11 -8.027 -5.770 -4.791 1.00 23.03 S ATOM 0 H CYS A 11 -7.060 -8.430 -3.037 1.00 3.24 H new ATOM 0 HA CYS A 11 -6.191 -8.097 -5.853 1.00 44.30 H new ATOM 0 HB2 CYS A 11 -5.981 -6.129 -3.555 1.00 1.11 H new ATOM 0 HB3 CYS A 11 -5.654 -5.831 -5.251 1.00 1.11 H new ATOM 161 N VAL A 12 -3.744 -8.318 -5.097 1.00 61.34 N ATOM 162 CA VAL A 12 -2.420 -8.645 -4.631 1.00 41.42 C ATOM 163 C VAL A 12 -1.519 -7.410 -4.702 1.00 12.10 C ATOM 164 O VAL A 12 -1.538 -6.668 -5.692 1.00 41.53 O ATOM 165 CB VAL A 12 -1.793 -9.894 -5.356 1.00 14.35 C ATOM 166 CG1 VAL A 12 -2.615 -11.146 -5.087 1.00 24.32 C ATOM 167 CG2 VAL A 12 -1.629 -9.686 -6.859 1.00 51.25 C ATOM 0 H VAL A 12 -3.820 -8.152 -6.100 1.00 61.34 H new ATOM 0 HA VAL A 12 -2.506 -8.947 -3.587 1.00 41.42 H new ATOM 0 HB VAL A 12 -0.794 -10.022 -4.938 1.00 14.35 H new ATOM 0 HG11 VAL A 12 -2.162 -11.995 -5.598 1.00 24.32 H new ATOM 0 HG12 VAL A 12 -2.642 -11.340 -4.015 1.00 24.32 H new ATOM 0 HG13 VAL A 12 -3.631 -11.000 -5.455 1.00 24.32 H new ATOM 0 HG21 VAL A 12 -1.192 -10.580 -7.305 1.00 51.25 H new ATOM 0 HG22 VAL A 12 -2.604 -9.496 -7.308 1.00 51.25 H new ATOM 0 HG23 VAL A 12 -0.974 -8.834 -7.039 1.00 51.25 H new ATOM 177 N SER A 13 -0.772 -7.158 -3.654 1.00 21.12 N ATOM 178 CA SER A 13 0.047 -5.976 -3.601 1.00 63.23 C ATOM 179 C SER A 13 1.514 -6.293 -3.368 1.00 32.23 C ATOM 180 O SER A 13 1.867 -7.219 -2.622 1.00 75.02 O ATOM 181 CB SER A 13 -0.488 -4.994 -2.550 1.00 15.11 C ATOM 182 OG SER A 13 -0.608 -5.605 -1.270 1.00 24.32 O ATOM 0 H SER A 13 -0.716 -7.755 -2.829 1.00 21.12 H new ATOM 0 HA SER A 13 -0.012 -5.500 -4.580 1.00 63.23 H new ATOM 0 HB2 SER A 13 0.179 -4.135 -2.482 1.00 15.11 H new ATOM 0 HB3 SER A 13 -1.461 -4.617 -2.866 1.00 15.11 H new ATOM 0 HG SER A 13 -0.950 -4.950 -0.626 1.00 24.32 H new ATOM 188 N LEU A 14 2.346 -5.543 -4.028 1.00 74.51 N ATOM 189 CA LEU A 14 3.766 -5.661 -3.932 1.00 73.23 C ATOM 190 C LEU A 14 4.361 -4.381 -3.451 1.00 42.03 C ATOM 191 O LEU A 14 4.213 -3.342 -4.089 1.00 30.20 O ATOM 192 CB LEU A 14 4.319 -6.007 -5.286 1.00 31.22 C ATOM 193 CG LEU A 14 4.114 -7.431 -5.721 1.00 1.54 C ATOM 194 CD1 LEU A 14 4.302 -7.560 -7.212 1.00 73.43 C ATOM 195 CD2 LEU A 14 5.122 -8.318 -4.981 1.00 35.25 C ATOM 0 H LEU A 14 2.042 -4.809 -4.668 1.00 74.51 H new ATOM 0 HA LEU A 14 4.017 -6.446 -3.219 1.00 73.23 H new ATOM 0 HB2 LEU A 14 3.862 -5.350 -6.025 1.00 31.22 H new ATOM 0 HB3 LEU A 14 5.388 -5.794 -5.288 1.00 31.22 H new ATOM 0 HG LEU A 14 3.098 -7.744 -5.482 1.00 1.54 H new ATOM 0 HD11 LEU A 14 4.150 -8.598 -7.509 1.00 73.43 H new ATOM 0 HD12 LEU A 14 3.580 -6.926 -7.726 1.00 73.43 H new ATOM 0 HD13 LEU A 14 5.312 -7.250 -7.479 1.00 73.43 H new ATOM 0 HD21 LEU A 14 4.986 -9.356 -5.286 1.00 35.25 H new ATOM 0 HD22 LEU A 14 6.135 -7.998 -5.224 1.00 35.25 H new ATOM 0 HD23 LEU A 14 4.962 -8.232 -3.906 1.00 35.25 H new ATOM 207 N THR A 15 5.021 -4.441 -2.345 1.00 71.34 N ATOM 208 CA THR A 15 5.658 -3.284 -1.819 1.00 33.11 C ATOM 209 C THR A 15 7.120 -3.304 -2.259 1.00 62.25 C ATOM 210 O THR A 15 7.736 -4.368 -2.323 1.00 73.15 O ATOM 211 CB THR A 15 5.556 -3.231 -0.289 1.00 3.21 C ATOM 212 OG1 THR A 15 4.191 -3.486 0.103 1.00 14.12 O ATOM 213 CG2 THR A 15 5.921 -1.843 0.179 1.00 24.25 C ATOM 0 H THR A 15 5.134 -5.286 -1.785 1.00 71.34 H new ATOM 0 HA THR A 15 5.160 -2.393 -2.200 1.00 33.11 H new ATOM 0 HB THR A 15 6.225 -3.973 0.147 1.00 3.21 H new ATOM 0 HG1 THR A 15 4.120 -3.455 1.080 1.00 14.12 H new ATOM 0 HG21 THR A 15 5.851 -1.795 1.266 1.00 24.25 H new ATOM 0 HG22 THR A 15 6.940 -1.611 -0.130 1.00 24.25 H new ATOM 0 HG23 THR A 15 5.235 -1.119 -0.261 1.00 24.25 H new ATOM 221 N THR A 16 7.646 -2.165 -2.586 1.00 42.32 N ATOM 222 CA THR A 16 8.975 -2.053 -3.085 1.00 74.13 C ATOM 223 C THR A 16 9.672 -0.895 -2.374 1.00 43.41 C ATOM 224 O THR A 16 9.010 -0.137 -1.644 1.00 1.30 O ATOM 225 CB THR A 16 8.977 -1.863 -4.640 1.00 52.01 C ATOM 226 OG1 THR A 16 10.318 -1.889 -5.161 1.00 15.32 O ATOM 227 CG2 THR A 16 8.300 -0.551 -5.044 1.00 34.40 C ATOM 0 H THR A 16 7.154 -1.275 -2.511 1.00 42.32 H new ATOM 0 HA THR A 16 9.522 -2.974 -2.882 1.00 74.13 H new ATOM 0 HB THR A 16 8.412 -2.693 -5.064 1.00 52.01 H new ATOM 0 HG1 THR A 16 10.293 -1.770 -6.133 1.00 15.32 H new ATOM 0 HG21 THR A 16 8.319 -0.451 -6.129 1.00 34.40 H new ATOM 0 HG22 THR A 16 7.266 -0.553 -4.698 1.00 34.40 H new ATOM 0 HG23 THR A 16 8.832 0.287 -4.593 1.00 34.40 H new ATOM 235 N GLN A 17 10.997 -0.814 -2.506 1.00 2.55 N ATOM 236 CA GLN A 17 11.793 0.275 -1.920 1.00 72.44 C ATOM 237 C GLN A 17 11.132 1.636 -2.223 1.00 42.10 C ATOM 238 O GLN A 17 10.507 1.810 -3.278 1.00 21.32 O ATOM 239 CB GLN A 17 13.217 0.234 -2.490 1.00 62.32 C ATOM 240 CG GLN A 17 14.174 1.257 -1.899 1.00 35.10 C ATOM 241 CD GLN A 17 15.560 1.170 -2.502 1.00 1.14 C ATOM 242 OE1 GLN A 17 15.728 0.803 -3.664 1.00 63.22 O ATOM 243 NE2 GLN A 17 16.560 1.498 -1.723 1.00 11.02 N ATOM 0 H GLN A 17 11.551 -1.498 -3.021 1.00 2.55 H new ATOM 0 HA GLN A 17 11.840 0.147 -0.839 1.00 72.44 H new ATOM 0 HB2 GLN A 17 13.629 -0.762 -2.329 1.00 62.32 H new ATOM 0 HB3 GLN A 17 13.166 0.387 -3.568 1.00 62.32 H new ATOM 0 HG2 GLN A 17 13.774 2.258 -2.058 1.00 35.10 H new ATOM 0 HG3 GLN A 17 14.240 1.108 -0.821 1.00 35.10 H new ATOM 0 HE21 GLN A 17 16.383 1.798 -0.764 1.00 11.02 H new ATOM 0 HE22 GLN A 17 17.516 1.454 -2.075 1.00 11.02 H new ATOM 252 N ARG A 18 11.257 2.570 -1.309 1.00 61.14 N ATOM 253 CA ARG A 18 10.596 3.859 -1.423 1.00 20.33 C ATOM 254 C ARG A 18 11.167 4.753 -2.525 1.00 54.14 C ATOM 255 O ARG A 18 12.092 5.543 -2.289 1.00 60.41 O ATOM 256 CB ARG A 18 10.594 4.599 -0.085 1.00 42.33 C ATOM 257 CG ARG A 18 9.807 3.906 1.012 1.00 62.20 C ATOM 258 CD ARG A 18 9.950 4.639 2.335 1.00 42.01 C ATOM 259 NE ARG A 18 11.324 4.567 2.864 1.00 11.14 N ATOM 260 CZ ARG A 18 11.781 5.265 3.911 1.00 2.42 C ATOM 261 NH1 ARG A 18 11.012 6.176 4.493 1.00 63.12 N ATOM 262 NH2 ARG A 18 13.013 5.058 4.368 1.00 40.42 N ATOM 0 H ARG A 18 11.818 2.462 -0.464 1.00 61.14 H new ATOM 0 HA ARG A 18 9.570 3.634 -1.712 1.00 20.33 H new ATOM 0 HB2 ARG A 18 11.624 4.726 0.248 1.00 42.33 H new ATOM 0 HB3 ARG A 18 10.183 5.597 -0.236 1.00 42.33 H new ATOM 0 HG2 ARG A 18 8.755 3.856 0.733 1.00 62.20 H new ATOM 0 HG3 ARG A 18 10.157 2.880 1.122 1.00 62.20 H new ATOM 0 HD2 ARG A 18 9.667 5.683 2.203 1.00 42.01 H new ATOM 0 HD3 ARG A 18 9.259 4.212 3.062 1.00 42.01 H new ATOM 0 HE ARG A 18 11.976 3.937 2.397 1.00 11.14 H new ATOM 0 HH11 ARG A 18 10.069 6.346 4.143 1.00 63.12 H new ATOM 0 HH12 ARG A 18 11.364 6.706 5.291 1.00 63.12 H new ATOM 0 HH21 ARG A 18 13.613 4.365 3.920 1.00 40.42 H new ATOM 0 HH22 ARG A 18 13.357 5.592 5.166 1.00 40.42 H new ATOM 276 N LEU A 19 10.652 4.576 -3.721 1.00 21.04 N ATOM 277 CA LEU A 19 10.950 5.439 -4.845 1.00 23.20 C ATOM 278 C LEU A 19 9.740 6.338 -5.080 1.00 32.31 C ATOM 279 O LEU A 19 8.603 5.905 -4.864 1.00 51.14 O ATOM 280 CB LEU A 19 11.297 4.655 -6.149 1.00 41.31 C ATOM 281 CG LEU A 19 12.654 3.902 -6.223 1.00 60.41 C ATOM 282 CD1 LEU A 19 13.825 4.823 -5.929 1.00 15.22 C ATOM 283 CD2 LEU A 19 12.690 2.672 -5.341 1.00 1.02 C ATOM 0 H LEU A 19 10.006 3.819 -3.945 1.00 21.04 H new ATOM 0 HA LEU A 19 11.838 6.021 -4.601 1.00 23.20 H new ATOM 0 HB2 LEU A 19 10.504 3.927 -6.319 1.00 41.31 H new ATOM 0 HB3 LEU A 19 11.264 5.361 -6.979 1.00 41.31 H new ATOM 0 HG LEU A 19 12.752 3.554 -7.251 1.00 60.41 H new ATOM 0 HD11 LEU A 19 14.756 4.259 -5.991 1.00 15.22 H new ATOM 0 HD12 LEU A 19 13.843 5.633 -6.658 1.00 15.22 H new ATOM 0 HD13 LEU A 19 13.718 5.239 -4.927 1.00 15.22 H new ATOM 0 HD21 LEU A 19 13.662 2.186 -5.433 1.00 1.02 H new ATOM 0 HD22 LEU A 19 12.527 2.963 -4.303 1.00 1.02 H new ATOM 0 HD23 LEU A 19 11.907 1.979 -5.651 1.00 1.02 H new ATOM 295 N PRO A 20 9.940 7.591 -5.504 1.00 15.53 N ATOM 296 CA PRO A 20 8.851 8.518 -5.662 1.00 31.44 C ATOM 297 C PRO A 20 8.164 8.447 -7.030 1.00 55.13 C ATOM 298 O PRO A 20 8.810 8.309 -8.084 1.00 2.54 O ATOM 299 CB PRO A 20 9.518 9.892 -5.477 1.00 73.32 C ATOM 300 CG PRO A 20 11.005 9.635 -5.446 1.00 53.14 C ATOM 301 CD PRO A 20 11.215 8.207 -5.854 1.00 42.01 C ATOM 0 HA PRO A 20 8.054 8.301 -4.951 1.00 31.44 H new ATOM 0 HB2 PRO A 20 9.256 10.565 -6.293 1.00 73.32 H new ATOM 0 HB3 PRO A 20 9.185 10.366 -4.553 1.00 73.32 H new ATOM 0 HG2 PRO A 20 11.527 10.310 -6.124 1.00 53.14 H new ATOM 0 HG3 PRO A 20 11.406 9.813 -4.448 1.00 53.14 H new ATOM 0 HD2 PRO A 20 11.432 8.116 -6.918 1.00 42.01 H new ATOM 0 HD3 PRO A 20 12.048 7.750 -5.319 1.00 42.01 H new ATOM 309 N VAL A 21 6.862 8.576 -6.986 1.00 64.34 N ATOM 310 CA VAL A 21 6.009 8.619 -8.153 1.00 52.22 C ATOM 311 C VAL A 21 5.282 9.949 -8.118 1.00 3.25 C ATOM 312 O VAL A 21 5.268 10.606 -7.062 1.00 34.21 O ATOM 313 CB VAL A 21 4.974 7.445 -8.190 1.00 51.25 C ATOM 314 CG1 VAL A 21 5.679 6.096 -8.219 1.00 0.05 C ATOM 315 CG2 VAL A 21 4.009 7.517 -7.013 1.00 52.33 C ATOM 0 H VAL A 21 6.347 8.657 -6.109 1.00 64.34 H new ATOM 0 HA VAL A 21 6.621 8.511 -9.049 1.00 52.22 H new ATOM 0 HB VAL A 21 4.395 7.550 -9.107 1.00 51.25 H new ATOM 0 HG11 VAL A 21 4.937 5.298 -8.244 1.00 0.05 H new ATOM 0 HG12 VAL A 21 6.309 6.034 -9.106 1.00 0.05 H new ATOM 0 HG13 VAL A 21 6.296 5.989 -7.327 1.00 0.05 H new ATOM 0 HG21 VAL A 21 3.304 6.688 -7.069 1.00 52.33 H new ATOM 0 HG22 VAL A 21 4.568 7.455 -6.080 1.00 52.33 H new ATOM 0 HG23 VAL A 21 3.463 8.460 -7.047 1.00 52.33 H new ATOM 325 N SER A 22 4.706 10.360 -9.215 1.00 61.43 N ATOM 326 CA SER A 22 4.054 11.653 -9.284 1.00 1.33 C ATOM 327 C SER A 22 2.825 11.711 -8.363 1.00 55.05 C ATOM 328 O SER A 22 2.693 12.632 -7.529 1.00 51.10 O ATOM 329 CB SER A 22 3.653 11.966 -10.725 1.00 24.33 C ATOM 330 OG SER A 22 3.118 13.286 -10.856 1.00 25.04 O ATOM 0 H SER A 22 4.671 9.821 -10.080 1.00 61.43 H new ATOM 0 HA SER A 22 4.764 12.406 -8.941 1.00 1.33 H new ATOM 0 HB2 SER A 22 4.522 11.861 -11.374 1.00 24.33 H new ATOM 0 HB3 SER A 22 2.913 11.240 -11.062 1.00 24.33 H new ATOM 0 HG SER A 22 2.875 13.449 -11.791 1.00 25.04 H new ATOM 336 N ARG A 23 1.947 10.748 -8.490 1.00 64.05 N ATOM 337 CA ARG A 23 0.715 10.749 -7.728 1.00 4.11 C ATOM 338 C ARG A 23 0.275 9.293 -7.507 1.00 41.45 C ATOM 339 O ARG A 23 0.976 8.382 -7.915 1.00 73.01 O ATOM 340 CB ARG A 23 -0.319 11.548 -8.556 1.00 61.11 C ATOM 341 CG ARG A 23 -1.621 11.893 -7.869 1.00 74.14 C ATOM 342 CD ARG A 23 -2.458 12.768 -8.770 1.00 41.51 C ATOM 343 NE ARG A 23 -3.693 13.223 -8.135 1.00 21.23 N ATOM 344 CZ ARG A 23 -4.296 14.382 -8.428 1.00 54.24 C ATOM 345 NH1 ARG A 23 -3.770 15.199 -9.350 1.00 42.43 N ATOM 346 NH2 ARG A 23 -5.422 14.722 -7.811 1.00 52.12 N ATOM 0 H ARG A 23 2.059 9.949 -9.115 1.00 64.05 H new ATOM 0 HA ARG A 23 0.826 11.210 -6.747 1.00 4.11 H new ATOM 0 HB2 ARG A 23 0.150 12.477 -8.881 1.00 61.11 H new ATOM 0 HB3 ARG A 23 -0.550 10.976 -9.455 1.00 61.11 H new ATOM 0 HG2 ARG A 23 -2.166 10.981 -7.623 1.00 74.14 H new ATOM 0 HG3 ARG A 23 -1.422 12.408 -6.929 1.00 74.14 H new ATOM 0 HD2 ARG A 23 -1.871 13.635 -9.073 1.00 41.51 H new ATOM 0 HD3 ARG A 23 -2.704 12.216 -9.677 1.00 41.51 H new ATOM 0 HE ARG A 23 -4.120 12.624 -7.429 1.00 21.23 H new ATOM 0 HH11 ARG A 23 -2.909 14.939 -9.830 1.00 42.43 H new ATOM 0 HH12 ARG A 23 -4.231 16.081 -9.572 1.00 42.43 H new ATOM 0 HH21 ARG A 23 -5.829 14.100 -7.113 1.00 52.12 H new ATOM 0 HH22 ARG A 23 -5.880 15.605 -8.036 1.00 52.12 H new ATOM 360 N ILE A 24 -0.832 9.070 -6.835 1.00 31.41 N ATOM 361 CA ILE A 24 -1.376 7.730 -6.681 1.00 65.51 C ATOM 362 C ILE A 24 -2.511 7.637 -7.664 1.00 53.35 C ATOM 363 O ILE A 24 -3.406 8.473 -7.650 1.00 34.31 O ATOM 364 CB ILE A 24 -1.955 7.501 -5.256 1.00 34.12 C ATOM 365 CG1 ILE A 24 -0.957 7.941 -4.159 1.00 21.35 C ATOM 366 CG2 ILE A 24 -2.355 6.032 -5.069 1.00 63.42 C ATOM 367 CD1 ILE A 24 0.375 7.239 -4.184 1.00 65.42 C ATOM 0 H ILE A 24 -1.380 9.801 -6.382 1.00 31.41 H new ATOM 0 HA ILE A 24 -0.593 6.989 -6.844 1.00 65.51 H new ATOM 0 HB ILE A 24 -2.846 8.120 -5.156 1.00 34.12 H new ATOM 0 HG12 ILE A 24 -0.786 9.013 -4.255 1.00 21.35 H new ATOM 0 HG13 ILE A 24 -1.418 7.777 -3.185 1.00 21.35 H new ATOM 0 HG21 ILE A 24 -2.758 5.889 -4.066 1.00 63.42 H new ATOM 0 HG22 ILE A 24 -3.112 5.764 -5.806 1.00 63.42 H new ATOM 0 HG23 ILE A 24 -1.479 5.397 -5.202 1.00 63.42 H new ATOM 0 HD11 ILE A 24 1.001 7.618 -3.377 1.00 65.42 H new ATOM 0 HD12 ILE A 24 0.224 6.167 -4.054 1.00 65.42 H new ATOM 0 HD13 ILE A 24 0.865 7.423 -5.140 1.00 65.42 H new ATOM 379 N LYS A 25 -2.477 6.666 -8.524 1.00 11.10 N ATOM 380 CA LYS A 25 -3.487 6.557 -9.521 1.00 65.53 C ATOM 381 C LYS A 25 -3.787 5.122 -9.794 1.00 13.14 C ATOM 382 O LYS A 25 -2.929 4.248 -9.557 1.00 55.21 O ATOM 383 CB LYS A 25 -3.108 7.268 -10.856 1.00 53.44 C ATOM 384 CG LYS A 25 -2.012 6.623 -11.753 1.00 74.33 C ATOM 385 CD LYS A 25 -0.554 7.019 -11.479 1.00 60.41 C ATOM 386 CE LYS A 25 -0.053 6.561 -10.159 1.00 31.31 C ATOM 387 NZ LYS A 25 1.392 6.788 -9.992 1.00 54.35 N ATOM 0 H LYS A 25 -1.761 5.941 -8.553 1.00 11.10 H new ATOM 0 HA LYS A 25 -4.368 7.061 -9.124 1.00 65.53 H new ATOM 0 HB2 LYS A 25 -4.015 7.358 -11.453 1.00 53.44 H new ATOM 0 HB3 LYS A 25 -2.785 8.280 -10.613 1.00 53.44 H new ATOM 0 HG2 LYS A 25 -2.091 5.540 -11.656 1.00 74.33 H new ATOM 0 HG3 LYS A 25 -2.239 6.868 -12.791 1.00 74.33 H new ATOM 0 HD2 LYS A 25 0.080 6.605 -12.263 1.00 60.41 H new ATOM 0 HD3 LYS A 25 -0.464 8.104 -11.536 1.00 60.41 H new ATOM 0 HE2 LYS A 25 -0.593 7.083 -9.369 1.00 31.31 H new ATOM 0 HE3 LYS A 25 -0.266 5.498 -10.042 1.00 31.31 H new ATOM 0 HZ1 LYS A 25 1.729 6.275 -9.153 1.00 54.35 H new ATOM 0 HZ2 LYS A 25 1.897 6.444 -10.834 1.00 54.35 H new ATOM 0 HZ3 LYS A 25 1.572 7.805 -9.872 1.00 54.35 H new ATOM 401 N THR A 26 -4.980 4.876 -10.268 1.00 44.10 N ATOM 402 CA THR A 26 -5.400 3.580 -10.658 1.00 70.11 C ATOM 403 C THR A 26 -5.687 3.506 -12.143 1.00 20.21 C ATOM 404 O THR A 26 -6.336 4.385 -12.715 1.00 12.23 O ATOM 405 CB THR A 26 -6.612 3.101 -9.841 1.00 3.44 C ATOM 406 OG1 THR A 26 -7.518 4.195 -9.619 1.00 34.40 O ATOM 407 CG2 THR A 26 -6.180 2.505 -8.526 1.00 60.03 C ATOM 0 H THR A 26 -5.693 5.595 -10.392 1.00 44.10 H new ATOM 0 HA THR A 26 -4.571 2.905 -10.446 1.00 70.11 H new ATOM 0 HB THR A 26 -7.122 2.324 -10.410 1.00 3.44 H new ATOM 0 HG1 THR A 26 -8.288 3.882 -9.100 1.00 34.40 H new ATOM 0 HG21 THR A 26 -7.058 2.175 -7.970 1.00 60.03 H new ATOM 0 HG22 THR A 26 -5.526 1.653 -8.710 1.00 60.03 H new ATOM 0 HG23 THR A 26 -5.644 3.255 -7.945 1.00 60.03 H new ATOM 415 N TYR A 27 -5.151 2.501 -12.768 1.00 30.01 N ATOM 416 CA TYR A 27 -5.428 2.236 -14.150 1.00 31.13 C ATOM 417 C TYR A 27 -6.228 0.991 -14.238 1.00 62.22 C ATOM 418 O TYR A 27 -5.963 0.031 -13.514 1.00 65.53 O ATOM 419 CB TYR A 27 -4.154 2.108 -14.985 1.00 61.15 C ATOM 420 CG TYR A 27 -3.358 3.373 -15.053 1.00 24.41 C ATOM 421 CD1 TYR A 27 -3.733 4.394 -15.907 1.00 43.43 C ATOM 422 CD2 TYR A 27 -2.245 3.557 -14.263 1.00 41.24 C ATOM 423 CE1 TYR A 27 -3.019 5.565 -15.968 1.00 34.54 C ATOM 424 CE2 TYR A 27 -1.523 4.720 -14.320 1.00 31.44 C ATOM 425 CZ TYR A 27 -1.915 5.723 -15.172 1.00 34.31 C ATOM 426 OH TYR A 27 -1.205 6.897 -15.221 1.00 3.21 O ATOM 0 H TYR A 27 -4.507 1.839 -12.334 1.00 30.01 H new ATOM 0 HA TYR A 27 -5.984 3.080 -14.559 1.00 31.13 H new ATOM 0 HB2 TYR A 27 -3.531 1.318 -14.565 1.00 61.15 H new ATOM 0 HB3 TYR A 27 -4.421 1.801 -15.996 1.00 61.15 H new ATOM 0 HD1 TYR A 27 -4.602 4.268 -16.536 1.00 43.43 H new ATOM 0 HD2 TYR A 27 -1.937 2.772 -13.588 1.00 41.24 H new ATOM 0 HE1 TYR A 27 -3.325 6.355 -16.638 1.00 34.54 H new ATOM 0 HE2 TYR A 27 -0.650 4.847 -13.698 1.00 31.44 H new ATOM 0 HH TYR A 27 -0.452 6.850 -14.596 1.00 3.21 H new ATOM 436 N THR A 28 -7.211 0.992 -15.068 1.00 14.52 N ATOM 437 CA THR A 28 -8.022 -0.151 -15.216 1.00 50.03 C ATOM 438 C THR A 28 -7.801 -0.749 -16.604 1.00 23.25 C ATOM 439 O THR A 28 -7.984 -0.080 -17.627 1.00 25.42 O ATOM 440 CB THR A 28 -9.504 0.202 -14.994 1.00 35.40 C ATOM 441 OG1 THR A 28 -9.617 0.953 -13.767 1.00 60.24 O ATOM 442 CG2 THR A 28 -10.335 -1.070 -14.858 1.00 70.52 C ATOM 0 H THR A 28 -7.470 1.783 -15.658 1.00 14.52 H new ATOM 0 HA THR A 28 -7.746 -0.890 -14.464 1.00 50.03 H new ATOM 0 HB THR A 28 -9.867 0.781 -15.843 1.00 35.40 H new ATOM 0 HG1 THR A 28 -10.556 1.187 -13.612 1.00 60.24 H new ATOM 0 HG21 THR A 28 -11.381 -0.806 -14.701 1.00 70.52 H new ATOM 0 HG22 THR A 28 -10.243 -1.664 -15.767 1.00 70.52 H new ATOM 0 HG23 THR A 28 -9.976 -1.650 -14.008 1.00 70.52 H new ATOM 450 N ILE A 29 -7.388 -1.975 -16.628 1.00 63.30 N ATOM 451 CA ILE A 29 -7.139 -2.674 -17.847 1.00 11.31 C ATOM 452 C ILE A 29 -8.285 -3.593 -18.103 1.00 72.33 C ATOM 453 O ILE A 29 -8.680 -4.352 -17.231 1.00 13.45 O ATOM 454 CB ILE A 29 -5.846 -3.521 -17.767 1.00 62.11 C ATOM 455 CG1 ILE A 29 -4.642 -2.631 -17.484 1.00 63.00 C ATOM 456 CG2 ILE A 29 -5.645 -4.321 -19.057 1.00 40.43 C ATOM 457 CD1 ILE A 29 -3.374 -3.355 -17.268 1.00 51.41 C ATOM 0 H ILE A 29 -7.212 -2.527 -15.789 1.00 63.30 H new ATOM 0 HA ILE A 29 -7.022 -1.941 -18.645 1.00 11.31 H new ATOM 0 HB ILE A 29 -5.946 -4.228 -16.944 1.00 62.11 H new ATOM 0 HG12 ILE A 29 -4.513 -1.942 -18.319 1.00 63.00 H new ATOM 0 HG13 ILE A 29 -4.854 -2.027 -16.602 1.00 63.00 H new ATOM 0 HG21 ILE A 29 -4.731 -4.910 -18.981 1.00 40.43 H new ATOM 0 HG22 ILE A 29 -6.494 -4.987 -19.208 1.00 40.43 H new ATOM 0 HG23 ILE A 29 -5.566 -3.636 -19.901 1.00 40.43 H new ATOM 0 HD11 ILE A 29 -2.575 -2.639 -17.074 1.00 51.41 H new ATOM 0 HD12 ILE A 29 -3.478 -4.024 -16.413 1.00 51.41 H new ATOM 0 HD13 ILE A 29 -3.132 -3.937 -18.157 1.00 51.41 H new ATOM 469 N THR A 30 -8.805 -3.510 -19.257 1.00 22.12 N ATOM 470 CA THR A 30 -9.862 -4.348 -19.674 1.00 45.42 C ATOM 471 C THR A 30 -9.497 -4.969 -20.989 1.00 14.44 C ATOM 472 O THR A 30 -9.764 -4.398 -22.052 1.00 10.04 O ATOM 473 CB THR A 30 -11.213 -3.588 -19.772 1.00 31.41 C ATOM 474 OG1 THR A 30 -11.078 -2.443 -20.641 1.00 41.24 O ATOM 475 CG2 THR A 30 -11.666 -3.121 -18.398 1.00 33.13 C ATOM 0 H THR A 30 -8.503 -2.840 -19.964 1.00 22.12 H new ATOM 0 HA THR A 30 -10.004 -5.126 -18.924 1.00 45.42 H new ATOM 0 HB THR A 30 -11.957 -4.272 -20.180 1.00 31.41 H new ATOM 0 HG1 THR A 30 -10.575 -2.698 -21.443 1.00 41.24 H new ATOM 0 HG21 THR A 30 -12.614 -2.591 -18.488 1.00 33.13 H new ATOM 0 HG22 THR A 30 -11.793 -3.984 -17.744 1.00 33.13 H new ATOM 0 HG23 THR A 30 -10.916 -2.453 -17.975 1.00 33.13 H new ATOM 483 N GLU A 31 -8.837 -6.094 -20.947 1.00 13.12 N ATOM 484 CA GLU A 31 -8.413 -6.691 -22.165 1.00 20.11 C ATOM 485 C GLU A 31 -8.970 -8.090 -22.246 1.00 13.33 C ATOM 486 O GLU A 31 -8.746 -8.901 -21.368 1.00 52.43 O ATOM 487 CB GLU A 31 -6.849 -6.572 -22.337 1.00 24.34 C ATOM 488 CG GLU A 31 -5.909 -7.609 -21.674 1.00 62.13 C ATOM 489 CD GLU A 31 -5.798 -8.899 -22.501 1.00 45.23 C ATOM 490 OE1 GLU A 31 -5.424 -8.795 -23.694 1.00 65.13 O ATOM 491 OE2 GLU A 31 -6.083 -9.989 -22.002 1.00 14.13 O ATOM 0 H GLU A 31 -8.589 -6.601 -20.097 1.00 13.12 H new ATOM 0 HA GLU A 31 -8.814 -6.155 -23.025 1.00 20.11 H new ATOM 0 HB2 GLU A 31 -6.640 -6.585 -23.407 1.00 24.34 H new ATOM 0 HB3 GLU A 31 -6.557 -5.589 -21.967 1.00 24.34 H new ATOM 0 HG2 GLU A 31 -4.918 -7.172 -21.549 1.00 62.13 H new ATOM 0 HG3 GLU A 31 -6.279 -7.848 -20.677 1.00 62.13 H new ATOM 498 N GLY A 32 -9.781 -8.319 -23.255 1.00 41.14 N ATOM 499 CA GLY A 32 -10.386 -9.610 -23.462 1.00 40.42 C ATOM 500 C GLY A 32 -11.335 -10.009 -22.345 1.00 14.43 C ATOM 501 O GLY A 32 -11.246 -11.120 -21.832 1.00 14.33 O ATOM 0 H GLY A 32 -10.037 -7.618 -23.950 1.00 41.14 H new ATOM 0 HA2 GLY A 32 -10.929 -9.603 -24.407 1.00 40.42 H new ATOM 0 HA3 GLY A 32 -9.602 -10.362 -23.551 1.00 40.42 H new ATOM 505 N SER A 33 -12.234 -9.081 -21.952 1.00 35.02 N ATOM 506 CA SER A 33 -13.264 -9.345 -20.918 1.00 31.21 C ATOM 507 C SER A 33 -12.616 -9.632 -19.541 1.00 14.44 C ATOM 508 O SER A 33 -13.121 -10.417 -18.733 1.00 0.34 O ATOM 509 CB SER A 33 -14.131 -10.518 -21.377 1.00 74.23 C ATOM 510 OG SER A 33 -14.668 -10.243 -22.663 1.00 71.14 O ATOM 0 H SER A 33 -12.269 -8.137 -22.336 1.00 35.02 H new ATOM 0 HA SER A 33 -13.888 -8.460 -20.794 1.00 31.21 H new ATOM 0 HB2 SER A 33 -13.537 -11.431 -21.408 1.00 74.23 H new ATOM 0 HB3 SER A 33 -14.938 -10.687 -20.664 1.00 74.23 H new ATOM 0 HG SER A 33 -15.221 -10.997 -22.955 1.00 71.14 H new ATOM 516 N LEU A 34 -11.543 -8.939 -19.282 1.00 0.33 N ATOM 517 CA LEU A 34 -10.763 -9.078 -18.071 1.00 25.41 C ATOM 518 C LEU A 34 -10.567 -7.685 -17.452 1.00 34.41 C ATOM 519 O LEU A 34 -10.207 -6.766 -18.165 1.00 64.21 O ATOM 520 CB LEU A 34 -9.427 -9.792 -18.487 1.00 21.31 C ATOM 521 CG LEU A 34 -8.238 -9.883 -17.515 1.00 22.04 C ATOM 522 CD1 LEU A 34 -7.504 -8.552 -17.417 1.00 23.33 C ATOM 523 CD2 LEU A 34 -8.688 -10.349 -16.146 1.00 42.41 C ATOM 0 H LEU A 34 -11.171 -8.239 -19.923 1.00 0.33 H new ATOM 0 HA LEU A 34 -11.246 -9.681 -17.302 1.00 25.41 H new ATOM 0 HB2 LEU A 34 -9.686 -10.812 -18.770 1.00 21.31 H new ATOM 0 HB3 LEU A 34 -9.066 -9.293 -19.386 1.00 21.31 H new ATOM 0 HG LEU A 34 -7.543 -10.622 -17.913 1.00 22.04 H new ATOM 0 HD11 LEU A 34 -6.669 -8.647 -16.723 1.00 23.33 H new ATOM 0 HD12 LEU A 34 -7.128 -8.271 -18.401 1.00 23.33 H new ATOM 0 HD13 LEU A 34 -8.189 -7.784 -17.057 1.00 23.33 H new ATOM 0 HD21 LEU A 34 -7.827 -10.404 -15.479 1.00 42.41 H new ATOM 0 HD22 LEU A 34 -9.415 -9.644 -15.742 1.00 42.41 H new ATOM 0 HD23 LEU A 34 -9.146 -11.335 -16.230 1.00 42.41 H new ATOM 535 N ARG A 35 -10.832 -7.509 -16.133 1.00 31.33 N ATOM 536 CA ARG A 35 -10.670 -6.187 -15.523 1.00 40.01 C ATOM 537 C ARG A 35 -9.569 -6.181 -14.485 1.00 1.24 C ATOM 538 O ARG A 35 -9.712 -6.753 -13.430 1.00 1.04 O ATOM 539 CB ARG A 35 -11.964 -5.713 -14.851 1.00 23.02 C ATOM 540 CG ARG A 35 -13.139 -5.494 -15.774 1.00 75.20 C ATOM 541 CD ARG A 35 -14.328 -4.981 -14.997 1.00 52.33 C ATOM 542 NE ARG A 35 -15.455 -4.653 -15.864 1.00 64.33 N ATOM 543 CZ ARG A 35 -16.672 -4.334 -15.436 1.00 14.11 C ATOM 544 NH1 ARG A 35 -16.915 -4.209 -14.138 1.00 45.03 N ATOM 545 NH2 ARG A 35 -17.631 -4.092 -16.304 1.00 3.34 N ATOM 0 H ARG A 35 -11.147 -8.244 -15.500 1.00 31.33 H new ATOM 0 HA ARG A 35 -10.409 -5.510 -16.336 1.00 40.01 H new ATOM 0 HB2 ARG A 35 -12.250 -6.446 -14.097 1.00 23.02 H new ATOM 0 HB3 ARG A 35 -11.759 -4.780 -14.327 1.00 23.02 H new ATOM 0 HG2 ARG A 35 -12.870 -4.781 -16.553 1.00 75.20 H new ATOM 0 HG3 ARG A 35 -13.397 -6.428 -16.273 1.00 75.20 H new ATOM 0 HD2 ARG A 35 -14.637 -5.733 -14.271 1.00 52.33 H new ATOM 0 HD3 ARG A 35 -14.036 -4.095 -14.433 1.00 52.33 H new ATOM 0 HE ARG A 35 -15.297 -4.670 -16.872 1.00 64.33 H new ATOM 0 HH11 ARG A 35 -16.166 -4.358 -13.462 1.00 45.03 H new ATOM 0 HH12 ARG A 35 -17.851 -3.964 -13.816 1.00 45.03 H new ATOM 0 HH21 ARG A 35 -17.440 -4.149 -17.304 1.00 3.34 H new ATOM 0 HH22 ARG A 35 -18.565 -3.847 -15.976 1.00 3.34 H new ATOM 559 N CYS A 36 -8.516 -5.506 -14.780 1.00 30.33 N ATOM 560 CA CYS A 36 -7.397 -5.356 -13.874 1.00 43.45 C ATOM 561 C CYS A 36 -7.286 -3.893 -13.410 1.00 51.13 C ATOM 562 O CYS A 36 -7.463 -2.985 -14.194 1.00 12.32 O ATOM 563 CB CYS A 36 -6.090 -5.799 -14.558 1.00 53.54 C ATOM 564 SG CYS A 36 -5.765 -7.605 -14.737 1.00 2.13 S ATOM 0 H CYS A 36 -8.390 -5.027 -15.672 1.00 30.33 H new ATOM 0 HA CYS A 36 -7.564 -5.990 -13.003 1.00 43.45 H new ATOM 0 HB2 CYS A 36 -6.070 -5.357 -15.554 1.00 53.54 H new ATOM 0 HB3 CYS A 36 -5.260 -5.366 -14.001 1.00 53.54 H new ATOM 569 N VAL A 37 -7.011 -3.688 -12.148 1.00 64.44 N ATOM 570 CA VAL A 37 -6.872 -2.358 -11.561 1.00 13.21 C ATOM 571 C VAL A 37 -5.486 -2.257 -10.951 1.00 33.01 C ATOM 572 O VAL A 37 -5.037 -3.180 -10.256 1.00 43.22 O ATOM 573 CB VAL A 37 -7.933 -2.084 -10.461 1.00 3.13 C ATOM 574 CG1 VAL A 37 -7.836 -0.655 -9.947 1.00 42.41 C ATOM 575 CG2 VAL A 37 -9.330 -2.375 -10.961 1.00 44.03 C ATOM 0 H VAL A 37 -6.873 -4.445 -11.479 1.00 64.44 H new ATOM 0 HA VAL A 37 -7.021 -1.617 -12.347 1.00 13.21 H new ATOM 0 HB VAL A 37 -7.724 -2.759 -9.631 1.00 3.13 H new ATOM 0 HG11 VAL A 37 -8.591 -0.493 -9.178 1.00 42.41 H new ATOM 0 HG12 VAL A 37 -6.846 -0.487 -9.524 1.00 42.41 H new ATOM 0 HG13 VAL A 37 -8.002 0.040 -10.770 1.00 42.41 H new ATOM 0 HG21 VAL A 37 -10.050 -2.173 -10.168 1.00 44.03 H new ATOM 0 HG22 VAL A 37 -9.549 -1.740 -11.819 1.00 44.03 H new ATOM 0 HG23 VAL A 37 -9.400 -3.422 -11.257 1.00 44.03 H new ATOM 585 N ILE A 38 -4.822 -1.167 -11.216 1.00 54.43 N ATOM 586 CA ILE A 38 -3.439 -0.984 -10.829 1.00 44.31 C ATOM 587 C ILE A 38 -3.265 0.256 -9.966 1.00 51.11 C ATOM 588 O ILE A 38 -3.570 1.355 -10.402 1.00 62.33 O ATOM 589 CB ILE A 38 -2.622 -0.774 -12.104 1.00 62.23 C ATOM 590 CG1 ILE A 38 -2.878 -1.926 -13.067 1.00 50.33 C ATOM 591 CG2 ILE A 38 -1.130 -0.672 -11.772 1.00 15.22 C ATOM 592 CD1 ILE A 38 -2.436 -1.646 -14.460 1.00 24.42 C ATOM 0 H ILE A 38 -5.223 -0.370 -11.711 1.00 54.43 H new ATOM 0 HA ILE A 38 -3.115 -1.858 -10.264 1.00 44.31 H new ATOM 0 HB ILE A 38 -2.928 0.159 -12.576 1.00 62.23 H new ATOM 0 HG12 ILE A 38 -2.363 -2.815 -12.703 1.00 50.33 H new ATOM 0 HG13 ILE A 38 -3.944 -2.155 -13.072 1.00 50.33 H new ATOM 0 HG21 ILE A 38 -0.562 -0.523 -12.690 1.00 15.22 H new ATOM 0 HG22 ILE A 38 -0.963 0.171 -11.101 1.00 15.22 H new ATOM 0 HG23 ILE A 38 -0.801 -1.592 -11.288 1.00 15.22 H new ATOM 0 HD11 ILE A 38 -2.649 -2.510 -15.090 1.00 24.42 H new ATOM 0 HD12 ILE A 38 -2.970 -0.776 -14.843 1.00 24.42 H new ATOM 0 HD13 ILE A 38 -1.364 -1.447 -14.469 1.00 24.42 H new ATOM 604 N PHE A 39 -2.781 0.071 -8.766 1.00 2.42 N ATOM 605 CA PHE A 39 -2.462 1.175 -7.868 1.00 45.14 C ATOM 606 C PHE A 39 -0.989 1.409 -7.876 1.00 52.14 C ATOM 607 O PHE A 39 -0.233 0.539 -7.459 1.00 12.45 O ATOM 608 CB PHE A 39 -2.853 0.873 -6.420 1.00 12.10 C ATOM 609 CG PHE A 39 -4.312 0.814 -6.134 1.00 3.30 C ATOM 610 CD1 PHE A 39 -5.100 -0.256 -6.547 1.00 25.45 C ATOM 611 CD2 PHE A 39 -4.897 1.849 -5.435 1.00 53.54 C ATOM 612 CE1 PHE A 39 -6.455 -0.279 -6.260 1.00 73.02 C ATOM 613 CE2 PHE A 39 -6.228 1.843 -5.144 1.00 22.13 C ATOM 614 CZ PHE A 39 -7.023 0.776 -5.554 1.00 64.42 C ATOM 0 H PHE A 39 -2.592 -0.851 -8.372 1.00 2.42 H new ATOM 0 HA PHE A 39 -3.020 2.042 -8.222 1.00 45.14 H new ATOM 0 HB2 PHE A 39 -2.409 -0.081 -6.137 1.00 12.10 H new ATOM 0 HB3 PHE A 39 -2.408 1.634 -5.779 1.00 12.10 H new ATOM 0 HD1 PHE A 39 -4.653 -1.073 -7.094 1.00 25.45 H new ATOM 0 HD2 PHE A 39 -4.288 2.680 -5.112 1.00 53.54 H new ATOM 0 HE1 PHE A 39 -7.066 -1.110 -6.582 1.00 73.02 H new ATOM 0 HE2 PHE A 39 -6.666 2.664 -4.596 1.00 22.13 H new ATOM 0 HZ PHE A 39 -8.078 0.768 -5.324 1.00 64.42 H new ATOM 624 N ILE A 40 -0.558 2.543 -8.348 1.00 63.31 N ATOM 625 CA ILE A 40 0.851 2.843 -8.272 1.00 55.14 C ATOM 626 C ILE A 40 1.016 3.814 -7.137 1.00 52.25 C ATOM 627 O ILE A 40 0.464 4.926 -7.202 1.00 54.24 O ATOM 628 CB ILE A 40 1.373 3.560 -9.534 1.00 3.15 C ATOM 629 CG1 ILE A 40 0.677 3.059 -10.795 1.00 62.21 C ATOM 630 CG2 ILE A 40 2.877 3.402 -9.644 1.00 21.04 C ATOM 631 CD1 ILE A 40 1.234 3.640 -12.091 1.00 60.42 C ATOM 0 H ILE A 40 -1.140 3.261 -8.779 1.00 63.31 H new ATOM 0 HA ILE A 40 1.398 1.908 -8.152 1.00 55.14 H new ATOM 0 HB ILE A 40 1.140 4.620 -9.438 1.00 3.15 H new ATOM 0 HG12 ILE A 40 0.757 1.973 -10.833 1.00 62.21 H new ATOM 0 HG13 ILE A 40 -0.384 3.298 -10.730 1.00 62.21 H new ATOM 0 HG21 ILE A 40 3.232 3.913 -10.539 1.00 21.04 H new ATOM 0 HG22 ILE A 40 3.354 3.836 -8.765 1.00 21.04 H new ATOM 0 HG23 ILE A 40 3.128 2.343 -9.707 1.00 21.04 H new ATOM 0 HD11 ILE A 40 0.684 3.232 -12.939 1.00 60.42 H new ATOM 0 HD12 ILE A 40 1.129 4.725 -12.078 1.00 60.42 H new ATOM 0 HD13 ILE A 40 2.288 3.379 -12.183 1.00 60.42 H new ATOM 643 N THR A 41 1.735 3.446 -6.119 1.00 31.33 N ATOM 644 CA THR A 41 1.935 4.345 -5.037 1.00 13.21 C ATOM 645 C THR A 41 3.411 4.619 -4.895 1.00 40.51 C ATOM 646 O THR A 41 4.224 3.987 -5.556 1.00 1.31 O ATOM 647 CB THR A 41 1.371 3.808 -3.683 1.00 64.24 C ATOM 648 OG1 THR A 41 2.144 2.718 -3.215 1.00 2.12 O ATOM 649 CG2 THR A 41 -0.072 3.348 -3.828 1.00 52.33 C ATOM 0 H THR A 41 2.187 2.537 -6.020 1.00 31.33 H new ATOM 0 HA THR A 41 1.387 5.259 -5.266 1.00 13.21 H new ATOM 0 HB THR A 41 1.418 4.631 -2.970 1.00 64.24 H new ATOM 0 HG1 THR A 41 2.042 1.958 -3.826 1.00 2.12 H new ATOM 0 HG21 THR A 41 -0.435 2.980 -2.868 1.00 52.33 H new ATOM 0 HG22 THR A 41 -0.690 4.185 -4.153 1.00 52.33 H new ATOM 0 HG23 THR A 41 -0.127 2.549 -4.567 1.00 52.33 H new ATOM 657 N LYS A 42 3.748 5.530 -4.033 1.00 74.25 N ATOM 658 CA LYS A 42 5.148 5.882 -3.772 1.00 64.12 C ATOM 659 C LYS A 42 5.847 4.915 -2.799 1.00 20.21 C ATOM 660 O LYS A 42 6.813 5.284 -2.118 1.00 70.24 O ATOM 661 CB LYS A 42 5.275 7.372 -3.338 1.00 43.32 C ATOM 662 CG LYS A 42 4.236 7.879 -2.323 1.00 14.13 C ATOM 663 CD LYS A 42 4.239 7.121 -1.007 1.00 45.10 C ATOM 664 CE LYS A 42 3.197 7.689 -0.065 1.00 51.11 C ATOM 665 NZ LYS A 42 3.103 6.930 1.198 1.00 70.25 N ATOM 0 H LYS A 42 3.075 6.061 -3.481 1.00 74.25 H new ATOM 0 HA LYS A 42 5.686 5.768 -4.713 1.00 64.12 H new ATOM 0 HB2 LYS A 42 6.268 7.521 -2.914 1.00 43.32 H new ATOM 0 HB3 LYS A 42 5.213 7.994 -4.231 1.00 43.32 H new ATOM 0 HG2 LYS A 42 4.423 8.934 -2.123 1.00 14.13 H new ATOM 0 HG3 LYS A 42 3.244 7.810 -2.769 1.00 14.13 H new ATOM 0 HD2 LYS A 42 4.037 6.065 -1.188 1.00 45.10 H new ATOM 0 HD3 LYS A 42 5.225 7.183 -0.547 1.00 45.10 H new ATOM 0 HE2 LYS A 42 3.440 8.728 0.157 1.00 51.11 H new ATOM 0 HE3 LYS A 42 2.226 7.687 -0.559 1.00 51.11 H new ATOM 0 HZ1 LYS A 42 2.377 7.358 1.807 1.00 70.25 H new ATOM 0 HZ2 LYS A 42 2.845 5.944 0.992 1.00 70.25 H new ATOM 0 HZ3 LYS A 42 4.021 6.952 1.686 1.00 70.25 H new ATOM 679 N ARG A 43 5.380 3.675 -2.766 1.00 71.40 N ATOM 680 CA ARG A 43 5.979 2.657 -1.930 1.00 64.01 C ATOM 681 C ARG A 43 5.606 1.262 -2.421 1.00 60.23 C ATOM 682 O ARG A 43 6.398 0.336 -2.344 1.00 73.55 O ATOM 683 CB ARG A 43 5.570 2.832 -0.478 1.00 70.35 C ATOM 684 CG ARG A 43 6.352 1.953 0.469 1.00 24.13 C ATOM 685 CD ARG A 43 5.986 2.234 1.895 1.00 74.44 C ATOM 686 NE ARG A 43 6.237 3.640 2.259 1.00 74.15 N ATOM 687 CZ ARG A 43 6.113 4.156 3.484 1.00 0.32 C ATOM 688 NH1 ARG A 43 5.812 3.368 4.520 1.00 3.12 N ATOM 689 NH2 ARG A 43 6.310 5.460 3.671 1.00 52.32 N ATOM 0 H ARG A 43 4.582 3.353 -3.314 1.00 71.40 H new ATOM 0 HA ARG A 43 7.061 2.769 -1.996 1.00 64.01 H new ATOM 0 HB2 ARG A 43 5.706 3.875 -0.192 1.00 70.35 H new ATOM 0 HB3 ARG A 43 4.508 2.610 -0.377 1.00 70.35 H new ATOM 0 HG2 ARG A 43 6.158 0.905 0.241 1.00 24.13 H new ATOM 0 HG3 ARG A 43 7.420 2.118 0.325 1.00 24.13 H new ATOM 0 HD2 ARG A 43 4.933 2.000 2.053 1.00 74.44 H new ATOM 0 HD3 ARG A 43 6.559 1.581 2.553 1.00 74.44 H new ATOM 0 HE ARG A 43 6.530 4.271 1.513 1.00 74.15 H new ATOM 0 HH11 ARG A 43 5.676 2.367 4.377 1.00 3.12 H new ATOM 0 HH12 ARG A 43 5.718 3.767 5.454 1.00 3.12 H new ATOM 0 HH21 ARG A 43 6.554 6.057 2.881 1.00 52.32 H new ATOM 0 HH22 ARG A 43 6.217 5.861 4.604 1.00 52.32 H new ATOM 703 N GLY A 44 4.414 1.108 -2.932 1.00 40.51 N ATOM 704 CA GLY A 44 4.013 -0.191 -3.406 1.00 51.33 C ATOM 705 C GLY A 44 3.107 -0.127 -4.606 1.00 11.42 C ATOM 706 O GLY A 44 2.606 0.936 -4.971 1.00 73.14 O ATOM 0 H GLY A 44 3.717 1.846 -3.030 1.00 40.51 H new ATOM 0 HA2 GLY A 44 4.902 -0.769 -3.659 1.00 51.33 H new ATOM 0 HA3 GLY A 44 3.505 -0.724 -2.602 1.00 51.33 H new ATOM 710 N LEU A 45 2.913 -1.235 -5.232 1.00 42.04 N ATOM 711 CA LEU A 45 2.014 -1.321 -6.353 1.00 12.44 C ATOM 712 C LEU A 45 1.009 -2.413 -6.109 1.00 12.13 C ATOM 713 O LEU A 45 1.359 -3.500 -5.637 1.00 34.30 O ATOM 714 CB LEU A 45 2.728 -1.521 -7.719 1.00 63.03 C ATOM 715 CG LEU A 45 3.615 -0.366 -8.250 1.00 62.02 C ATOM 716 CD1 LEU A 45 4.909 -0.208 -7.465 1.00 10.01 C ATOM 717 CD2 LEU A 45 3.892 -0.536 -9.731 1.00 22.14 C ATOM 0 H LEU A 45 3.369 -2.114 -4.989 1.00 42.04 H new ATOM 0 HA LEU A 45 1.510 -0.357 -6.428 1.00 12.44 H new ATOM 0 HB2 LEU A 45 3.350 -2.413 -7.644 1.00 63.03 H new ATOM 0 HB3 LEU A 45 1.964 -1.728 -8.469 1.00 63.03 H new ATOM 0 HG LEU A 45 3.051 0.556 -8.105 1.00 62.02 H new ATOM 0 HD11 LEU A 45 5.489 0.615 -7.882 1.00 10.01 H new ATOM 0 HD12 LEU A 45 4.678 0.003 -6.421 1.00 10.01 H new ATOM 0 HD13 LEU A 45 5.488 -1.129 -7.529 1.00 10.01 H new ATOM 0 HD21 LEU A 45 4.516 0.286 -10.081 1.00 22.14 H new ATOM 0 HD22 LEU A 45 4.409 -1.481 -9.898 1.00 22.14 H new ATOM 0 HD23 LEU A 45 2.950 -0.536 -10.280 1.00 22.14 H new ATOM 729 N LYS A 46 -0.226 -2.133 -6.400 1.00 54.35 N ATOM 730 CA LYS A 46 -1.279 -3.084 -6.161 1.00 71.41 C ATOM 731 C LYS A 46 -1.916 -3.462 -7.461 1.00 33.10 C ATOM 732 O LYS A 46 -2.321 -2.595 -8.232 1.00 45.40 O ATOM 733 CB LYS A 46 -2.358 -2.493 -5.264 1.00 75.42 C ATOM 734 CG LYS A 46 -3.384 -3.507 -4.777 1.00 55.13 C ATOM 735 CD LYS A 46 -4.535 -2.850 -4.017 1.00 62.13 C ATOM 736 CE LYS A 46 -4.040 -1.879 -2.954 1.00 72.32 C ATOM 737 NZ LYS A 46 -5.118 -1.453 -2.046 1.00 71.45 N ATOM 0 H LYS A 46 -0.534 -1.249 -6.806 1.00 54.35 H new ATOM 0 HA LYS A 46 -0.839 -3.954 -5.674 1.00 71.41 H new ATOM 0 HB2 LYS A 46 -1.883 -2.029 -4.400 1.00 75.42 H new ATOM 0 HB3 LYS A 46 -2.874 -1.702 -5.807 1.00 75.42 H new ATOM 0 HG2 LYS A 46 -3.782 -4.056 -5.630 1.00 55.13 H new ATOM 0 HG3 LYS A 46 -2.893 -4.235 -4.130 1.00 55.13 H new ATOM 0 HD2 LYS A 46 -5.177 -2.320 -4.720 1.00 62.13 H new ATOM 0 HD3 LYS A 46 -5.145 -3.621 -3.547 1.00 62.13 H new ATOM 0 HE2 LYS A 46 -3.245 -2.350 -2.376 1.00 72.32 H new ATOM 0 HE3 LYS A 46 -3.607 -1.003 -3.437 1.00 72.32 H new ATOM 0 HZ1 LYS A 46 -4.736 -0.793 -1.339 1.00 71.45 H new ATOM 0 HZ2 LYS A 46 -5.866 -0.980 -2.593 1.00 71.45 H new ATOM 0 HZ3 LYS A 46 -5.515 -2.285 -1.564 1.00 71.45 H new ATOM 751 N VAL A 47 -2.003 -4.720 -7.701 1.00 13.23 N ATOM 752 CA VAL A 47 -2.676 -5.218 -8.853 1.00 1.23 C ATOM 753 C VAL A 47 -3.868 -6.041 -8.419 1.00 2.52 C ATOM 754 O VAL A 47 -3.751 -7.065 -7.734 1.00 22.31 O ATOM 755 CB VAL A 47 -1.748 -6.004 -9.822 1.00 23.21 C ATOM 756 CG1 VAL A 47 -0.732 -5.064 -10.446 1.00 4.20 C ATOM 757 CG2 VAL A 47 -1.029 -7.123 -9.095 1.00 73.31 C ATOM 0 H VAL A 47 -1.607 -5.443 -7.100 1.00 13.23 H new ATOM 0 HA VAL A 47 -3.020 -4.361 -9.432 1.00 1.23 H new ATOM 0 HB VAL A 47 -2.367 -6.441 -10.605 1.00 23.21 H new ATOM 0 HG11 VAL A 47 -0.087 -5.623 -11.123 1.00 4.20 H new ATOM 0 HG12 VAL A 47 -1.252 -4.284 -11.002 1.00 4.20 H new ATOM 0 HG13 VAL A 47 -0.127 -4.609 -9.661 1.00 4.20 H new ATOM 0 HG21 VAL A 47 -0.386 -7.657 -9.795 1.00 73.31 H new ATOM 0 HG22 VAL A 47 -0.422 -6.704 -8.292 1.00 73.31 H new ATOM 0 HG23 VAL A 47 -1.761 -7.813 -8.675 1.00 73.31 H new ATOM 767 N CYS A 48 -4.997 -5.574 -8.756 1.00 74.40 N ATOM 768 CA CYS A 48 -6.201 -6.215 -8.383 1.00 2.42 C ATOM 769 C CYS A 48 -6.921 -6.547 -9.638 1.00 1.52 C ATOM 770 O CYS A 48 -7.127 -5.676 -10.453 1.00 41.04 O ATOM 771 CB CYS A 48 -7.019 -5.256 -7.556 1.00 24.44 C ATOM 772 SG CYS A 48 -8.431 -6.021 -6.756 1.00 32.22 S ATOM 0 H CYS A 48 -5.123 -4.724 -9.306 1.00 74.40 H new ATOM 0 HA CYS A 48 -6.017 -7.117 -7.799 1.00 2.42 H new ATOM 0 HB2 CYS A 48 -6.379 -4.808 -6.795 1.00 24.44 H new ATOM 0 HB3 CYS A 48 -7.369 -4.445 -8.195 1.00 24.44 H new ATOM 777 N CYS A 49 -7.287 -7.777 -9.846 1.00 15.45 N ATOM 778 CA CYS A 49 -7.886 -8.075 -11.114 1.00 71.34 C ATOM 779 C CYS A 49 -9.073 -9.041 -10.992 1.00 13.01 C ATOM 780 O CYS A 49 -9.093 -9.916 -10.123 1.00 43.53 O ATOM 781 CB CYS A 49 -6.808 -8.592 -12.067 1.00 21.44 C ATOM 782 SG CYS A 49 -7.286 -8.582 -13.803 1.00 53.05 S ATOM 0 H CYS A 49 -7.190 -8.555 -9.193 1.00 15.45 H new ATOM 0 HA CYS A 49 -8.308 -7.158 -11.525 1.00 71.34 H new ATOM 0 HB2 CYS A 49 -5.911 -7.985 -11.946 1.00 21.44 H new ATOM 0 HB3 CYS A 49 -6.545 -9.610 -11.781 1.00 21.44 H new ATOM 787 N ASP A 50 -10.055 -8.837 -11.861 1.00 14.10 N ATOM 788 CA ASP A 50 -11.285 -9.617 -11.920 1.00 24.25 C ATOM 789 C ASP A 50 -11.600 -9.916 -13.383 1.00 44.31 C ATOM 790 O ASP A 50 -11.880 -9.007 -14.149 1.00 11.54 O ATOM 791 CB ASP A 50 -12.444 -8.792 -11.337 1.00 43.20 C ATOM 792 CG ASP A 50 -13.770 -9.559 -11.214 1.00 51.55 C ATOM 793 OD1 ASP A 50 -13.928 -10.357 -10.273 1.00 71.44 O ATOM 794 OD2 ASP A 50 -14.689 -9.336 -12.031 1.00 52.12 O ATOM 0 H ASP A 50 -10.016 -8.101 -12.566 1.00 14.10 H new ATOM 0 HA ASP A 50 -11.162 -10.539 -11.352 1.00 24.25 H new ATOM 0 HB2 ASP A 50 -12.155 -8.429 -10.351 1.00 43.20 H new ATOM 0 HB3 ASP A 50 -12.602 -7.916 -11.965 1.00 43.20 H new ATOM 799 N PRO A 51 -11.560 -11.179 -13.796 1.00 45.02 N ATOM 800 CA PRO A 51 -11.852 -11.593 -15.195 1.00 60.21 C ATOM 801 C PRO A 51 -13.369 -11.589 -15.494 1.00 13.51 C ATOM 802 O PRO A 51 -13.865 -12.387 -16.304 1.00 23.50 O ATOM 803 CB PRO A 51 -11.311 -13.023 -15.224 1.00 44.23 C ATOM 804 CG PRO A 51 -11.511 -13.505 -13.840 1.00 13.03 C ATOM 805 CD PRO A 51 -11.228 -12.326 -12.953 1.00 73.44 C ATOM 0 HA PRO A 51 -11.413 -10.926 -15.937 1.00 60.21 H new ATOM 0 HB2 PRO A 51 -11.849 -13.640 -15.944 1.00 44.23 H new ATOM 0 HB3 PRO A 51 -10.259 -13.047 -15.508 1.00 44.23 H new ATOM 0 HG2 PRO A 51 -12.528 -13.868 -13.695 1.00 13.03 H new ATOM 0 HG3 PRO A 51 -10.841 -14.335 -13.614 1.00 13.03 H new ATOM 0 HD2 PRO A 51 -11.836 -12.349 -12.048 1.00 73.44 H new ATOM 0 HD3 PRO A 51 -10.185 -12.303 -12.636 1.00 73.44 H new ATOM 1207 N THR B 210 15.128 -3.041 -9.806 1.00 54.11 N ATOM 1208 CA THR B 210 14.401 -4.201 -9.362 1.00 53.21 C ATOM 1209 C THR B 210 12.915 -4.130 -9.743 1.00 75.12 C ATOM 1210 O THR B 210 12.317 -3.038 -9.809 1.00 63.24 O ATOM 1211 CB THR B 210 14.573 -4.351 -7.825 1.00 23.44 C ATOM 1212 OG1 THR B 210 15.983 -4.416 -7.523 1.00 41.10 O ATOM 1213 CG2 THR B 210 13.896 -5.613 -7.299 1.00 1.20 C ATOM 0 HA THR B 210 14.809 -5.078 -9.864 1.00 53.21 H new ATOM 0 HB THR B 210 14.105 -3.492 -7.343 1.00 23.44 H new ATOM 0 HG1 THR B 210 16.485 -3.908 -8.194 1.00 41.10 H new ATOM 0 HG21 THR B 210 14.040 -5.680 -6.221 1.00 1.20 H new ATOM 0 HG22 THR B 210 12.830 -5.573 -7.521 1.00 1.20 H new ATOM 0 HG23 THR B 210 14.334 -6.488 -7.779 1.00 1.20 H new ATOM 1221 N CYS B 211 12.345 -5.285 -10.008 1.00 3.12 N ATOM 1222 CA CYS B 211 10.960 -5.412 -10.347 1.00 23.13 C ATOM 1223 C CYS B 211 10.309 -6.329 -9.322 1.00 43.43 C ATOM 1224 O CYS B 211 10.994 -7.136 -8.679 1.00 70.32 O ATOM 1225 CB CYS B 211 10.822 -6.055 -11.726 1.00 23.24 C ATOM 1226 SG CYS B 211 11.825 -5.275 -13.051 1.00 2.25 S ATOM 0 H CYS B 211 12.847 -6.173 -9.991 1.00 3.12 H new ATOM 0 HA CYS B 211 10.488 -4.430 -10.355 1.00 23.13 H new ATOM 0 HB2 CYS B 211 11.102 -7.106 -11.650 1.00 23.24 H new ATOM 0 HB3 CYS B 211 9.773 -6.026 -12.020 1.00 23.24 H new ATOM 1231 N VAL B 212 9.025 -6.216 -9.158 1.00 63.33 N ATOM 1232 CA VAL B 212 8.308 -7.053 -8.232 1.00 22.44 C ATOM 1233 C VAL B 212 7.225 -7.849 -8.965 1.00 73.34 C ATOM 1234 O VAL B 212 6.590 -7.345 -9.886 1.00 43.34 O ATOM 1235 CB VAL B 212 7.730 -6.243 -7.019 1.00 20.30 C ATOM 1236 CG1 VAL B 212 8.848 -5.741 -6.125 1.00 44.31 C ATOM 1237 CG2 VAL B 212 6.907 -5.058 -7.491 1.00 55.30 C ATOM 0 H VAL B 212 8.443 -5.545 -9.659 1.00 63.33 H new ATOM 0 HA VAL B 212 9.017 -7.762 -7.804 1.00 22.44 H new ATOM 0 HB VAL B 212 7.089 -6.921 -6.456 1.00 20.30 H new ATOM 0 HG11 VAL B 212 8.424 -5.182 -5.291 1.00 44.31 H new ATOM 0 HG12 VAL B 212 9.416 -6.589 -5.742 1.00 44.31 H new ATOM 0 HG13 VAL B 212 9.508 -5.091 -6.699 1.00 44.31 H new ATOM 0 HG21 VAL B 212 6.520 -4.517 -6.628 1.00 55.30 H new ATOM 0 HG22 VAL B 212 7.534 -4.393 -8.085 1.00 55.30 H new ATOM 0 HG23 VAL B 212 6.075 -5.412 -8.100 1.00 55.30 H new ATOM 1247 N SER B 213 7.037 -9.087 -8.593 1.00 22.35 N ATOM 1248 CA SER B 213 6.085 -9.928 -9.279 1.00 61.12 C ATOM 1249 C SER B 213 5.271 -10.788 -8.313 1.00 41.12 C ATOM 1250 O SER B 213 5.824 -11.333 -7.350 1.00 2.53 O ATOM 1251 CB SER B 213 6.835 -10.822 -10.277 1.00 74.53 C ATOM 1252 OG SER B 213 7.870 -11.578 -9.635 1.00 33.13 O ATOM 0 H SER B 213 7.528 -9.538 -7.821 1.00 22.35 H new ATOM 0 HA SER B 213 5.380 -9.283 -9.803 1.00 61.12 H new ATOM 0 HB2 SER B 213 6.131 -11.502 -10.757 1.00 74.53 H new ATOM 0 HB3 SER B 213 7.269 -10.205 -11.064 1.00 74.53 H new ATOM 0 HG SER B 213 8.326 -12.137 -10.298 1.00 33.13 H new ATOM 1258 N LEU B 214 3.965 -10.875 -8.543 1.00 51.11 N ATOM 1259 CA LEU B 214 3.123 -11.806 -7.803 1.00 42.43 C ATOM 1260 C LEU B 214 2.409 -12.728 -8.730 1.00 32.23 C ATOM 1261 O LEU B 214 1.865 -12.309 -9.765 1.00 51.25 O ATOM 1262 CB LEU B 214 2.119 -11.146 -6.849 1.00 34.11 C ATOM 1263 CG LEU B 214 2.693 -10.509 -5.592 1.00 33.23 C ATOM 1264 CD1 LEU B 214 1.596 -9.907 -4.744 1.00 22.40 C ATOM 1265 CD2 LEU B 214 3.484 -11.521 -4.776 1.00 61.21 C ATOM 0 H LEU B 214 3.468 -10.313 -9.234 1.00 51.11 H new ATOM 0 HA LEU B 214 3.813 -12.365 -7.172 1.00 42.43 H new ATOM 0 HB2 LEU B 214 1.576 -10.380 -7.402 1.00 34.11 H new ATOM 0 HB3 LEU B 214 1.390 -11.898 -6.548 1.00 34.11 H new ATOM 0 HG LEU B 214 3.369 -9.714 -5.906 1.00 33.23 H new ATOM 0 HD11 LEU B 214 2.031 -9.458 -3.851 1.00 22.40 H new ATOM 0 HD12 LEU B 214 1.072 -9.142 -5.317 1.00 22.40 H new ATOM 0 HD13 LEU B 214 0.893 -10.687 -4.452 1.00 22.40 H new ATOM 0 HD21 LEU B 214 3.882 -11.038 -3.884 1.00 61.21 H new ATOM 0 HD22 LEU B 214 2.830 -12.342 -4.482 1.00 61.21 H new ATOM 0 HD23 LEU B 214 4.307 -11.909 -5.376 1.00 61.21 H new ATOM 1277 N THR B 215 2.419 -13.964 -8.382 1.00 11.15 N ATOM 1278 CA THR B 215 1.763 -14.953 -9.142 1.00 33.11 C ATOM 1279 C THR B 215 0.490 -15.320 -8.399 1.00 41.35 C ATOM 1280 O THR B 215 0.496 -15.460 -7.169 1.00 43.54 O ATOM 1281 CB THR B 215 2.665 -16.180 -9.313 1.00 4.50 C ATOM 1282 OG1 THR B 215 3.973 -15.726 -9.692 1.00 71.12 O ATOM 1283 CG2 THR B 215 2.134 -17.041 -10.429 1.00 55.45 C ATOM 0 H THR B 215 2.891 -14.317 -7.549 1.00 11.15 H new ATOM 0 HA THR B 215 1.528 -14.582 -10.140 1.00 33.11 H new ATOM 0 HB THR B 215 2.696 -16.748 -8.383 1.00 4.50 H new ATOM 0 HG1 THR B 215 4.567 -16.497 -9.805 1.00 71.12 H new ATOM 0 HG21 THR B 215 2.775 -17.914 -10.551 1.00 55.45 H new ATOM 0 HG22 THR B 215 1.121 -17.365 -10.188 1.00 55.45 H new ATOM 0 HG23 THR B 215 2.121 -16.468 -11.356 1.00 55.45 H new ATOM 1291 N THR B 216 -0.571 -15.454 -9.109 1.00 31.44 N ATOM 1292 CA THR B 216 -1.839 -15.677 -8.518 1.00 23.12 C ATOM 1293 C THR B 216 -2.604 -16.707 -9.340 1.00 74.15 C ATOM 1294 O THR B 216 -2.194 -17.017 -10.463 1.00 32.40 O ATOM 1295 CB THR B 216 -2.622 -14.326 -8.391 1.00 14.13 C ATOM 1296 OG1 THR B 216 -3.905 -14.526 -7.775 1.00 2.33 O ATOM 1297 CG2 THR B 216 -2.790 -13.638 -9.747 1.00 23.42 C ATOM 0 H THR B 216 -0.583 -15.411 -10.128 1.00 31.44 H new ATOM 0 HA THR B 216 -1.716 -16.073 -7.510 1.00 23.12 H new ATOM 0 HB THR B 216 -2.027 -13.673 -7.753 1.00 14.13 H new ATOM 0 HG1 THR B 216 -4.372 -13.667 -7.706 1.00 2.33 H new ATOM 0 HG21 THR B 216 -3.338 -12.705 -9.616 1.00 23.42 H new ATOM 0 HG22 THR B 216 -1.809 -13.426 -10.172 1.00 23.42 H new ATOM 0 HG23 THR B 216 -3.343 -14.292 -10.421 1.00 23.42 H new ATOM 1305 N GLN B 217 -3.666 -17.273 -8.759 1.00 54.22 N ATOM 1306 CA GLN B 217 -4.505 -18.264 -9.439 1.00 71.24 C ATOM 1307 C GLN B 217 -4.887 -17.779 -10.828 1.00 54.41 C ATOM 1308 O GLN B 217 -5.436 -16.698 -10.976 1.00 54.22 O ATOM 1309 CB GLN B 217 -5.748 -18.587 -8.624 1.00 61.12 C ATOM 1310 CG GLN B 217 -5.461 -19.225 -7.282 1.00 74.04 C ATOM 1311 CD GLN B 217 -6.725 -19.584 -6.535 1.00 65.13 C ATOM 1312 OE1 GLN B 217 -7.760 -19.877 -7.136 1.00 20.35 O ATOM 1313 NE2 GLN B 217 -6.659 -19.562 -5.237 1.00 44.21 N ATOM 0 H GLN B 217 -3.967 -17.058 -7.808 1.00 54.22 H new ATOM 0 HA GLN B 217 -3.924 -19.181 -9.540 1.00 71.24 H new ATOM 0 HB2 GLN B 217 -6.313 -17.669 -8.464 1.00 61.12 H new ATOM 0 HB3 GLN B 217 -6.385 -19.256 -9.203 1.00 61.12 H new ATOM 0 HG2 GLN B 217 -4.862 -20.123 -7.430 1.00 74.04 H new ATOM 0 HG3 GLN B 217 -4.866 -18.541 -6.677 1.00 74.04 H new ATOM 0 HE21 GLN B 217 -5.784 -19.314 -4.775 1.00 44.21 H new ATOM 0 HE22 GLN B 217 -7.482 -19.792 -4.681 1.00 44.21 H new ATOM 1322 N ARG B 218 -4.615 -18.615 -11.807 1.00 34.55 N ATOM 1323 CA ARG B 218 -4.690 -18.291 -13.238 1.00 34.34 C ATOM 1324 C ARG B 218 -5.924 -17.524 -13.695 1.00 11.54 C ATOM 1325 O ARG B 218 -7.067 -18.004 -13.574 1.00 65.33 O ATOM 1326 CB ARG B 218 -4.531 -19.546 -14.089 1.00 65.14 C ATOM 1327 CG ARG B 218 -3.200 -20.236 -13.919 1.00 43.33 C ATOM 1328 CD ARG B 218 -3.059 -21.405 -14.874 1.00 2.15 C ATOM 1329 NE ARG B 218 -4.066 -22.442 -14.655 1.00 33.34 N ATOM 1330 CZ ARG B 218 -4.674 -23.145 -15.626 1.00 14.45 C ATOM 1331 NH1 ARG B 218 -4.433 -22.884 -16.908 1.00 1.20 N ATOM 1332 NH2 ARG B 218 -5.535 -24.093 -15.306 1.00 3.10 N ATOM 0 H ARG B 218 -4.324 -19.577 -11.635 1.00 34.55 H new ATOM 0 HA ARG B 218 -3.857 -17.604 -13.385 1.00 34.34 H new ATOM 0 HB2 ARG B 218 -5.327 -20.247 -13.837 1.00 65.14 H new ATOM 0 HB3 ARG B 218 -4.660 -19.280 -15.138 1.00 65.14 H new ATOM 0 HG2 ARG B 218 -2.394 -19.523 -14.092 1.00 43.33 H new ATOM 0 HG3 ARG B 218 -3.099 -20.588 -12.892 1.00 43.33 H new ATOM 0 HD2 ARG B 218 -3.135 -21.042 -15.899 1.00 2.15 H new ATOM 0 HD3 ARG B 218 -2.066 -21.841 -14.763 1.00 2.15 H new ATOM 0 HE ARG B 218 -4.327 -22.648 -13.691 1.00 33.34 H new ATOM 0 HH11 ARG B 218 -3.780 -22.143 -17.164 1.00 1.20 H new ATOM 0 HH12 ARG B 218 -4.901 -23.425 -17.635 1.00 1.20 H new ATOM 0 HH21 ARG B 218 -5.736 -24.289 -14.326 1.00 3.10 H new ATOM 0 HH22 ARG B 218 -5.999 -24.629 -16.039 1.00 3.10 H new ATOM 1346 N LEU B 219 -5.672 -16.337 -14.221 1.00 32.54 N ATOM 1347 CA LEU B 219 -6.671 -15.533 -14.883 1.00 62.23 C ATOM 1348 C LEU B 219 -6.270 -15.548 -16.342 1.00 4.41 C ATOM 1349 O LEU B 219 -5.178 -15.080 -16.669 1.00 3.52 O ATOM 1350 CB LEU B 219 -6.685 -14.041 -14.413 1.00 51.15 C ATOM 1351 CG LEU B 219 -6.875 -13.724 -12.916 1.00 63.13 C ATOM 1352 CD1 LEU B 219 -8.038 -14.482 -12.305 1.00 73.32 C ATOM 1353 CD2 LEU B 219 -5.589 -13.895 -12.128 1.00 23.22 C ATOM 0 H LEU B 219 -4.749 -15.903 -14.197 1.00 32.54 H new ATOM 0 HA LEU B 219 -7.661 -15.937 -14.669 1.00 62.23 H new ATOM 0 HB2 LEU B 219 -5.744 -13.590 -14.727 1.00 51.15 H new ATOM 0 HB3 LEU B 219 -7.480 -13.533 -14.959 1.00 51.15 H new ATOM 0 HG LEU B 219 -7.138 -12.668 -12.853 1.00 63.13 H new ATOM 0 HD11 LEU B 219 -8.128 -14.222 -11.250 1.00 73.32 H new ATOM 0 HD12 LEU B 219 -8.959 -14.215 -12.824 1.00 73.32 H new ATOM 0 HD13 LEU B 219 -7.865 -15.554 -12.401 1.00 73.32 H new ATOM 0 HD21 LEU B 219 -5.771 -13.661 -11.079 1.00 23.22 H new ATOM 0 HD22 LEU B 219 -5.243 -14.925 -12.215 1.00 23.22 H new ATOM 0 HD23 LEU B 219 -4.828 -13.222 -12.523 1.00 23.22 H new ATOM 1365 N PRO B 220 -7.081 -16.110 -17.240 1.00 71.33 N ATOM 1366 CA PRO B 220 -6.709 -16.180 -18.649 1.00 5.22 C ATOM 1367 C PRO B 220 -6.670 -14.795 -19.289 1.00 15.21 C ATOM 1368 O PRO B 220 -7.556 -13.960 -19.051 1.00 75.21 O ATOM 1369 CB PRO B 220 -7.834 -17.012 -19.281 1.00 75.31 C ATOM 1370 CG PRO B 220 -8.570 -17.633 -18.138 1.00 1.24 C ATOM 1371 CD PRO B 220 -8.391 -16.708 -16.975 1.00 2.03 C ATOM 0 HA PRO B 220 -5.716 -16.607 -18.788 1.00 5.22 H new ATOM 0 HB2 PRO B 220 -8.496 -16.385 -19.878 1.00 75.31 H new ATOM 0 HB3 PRO B 220 -7.430 -17.775 -19.947 1.00 75.31 H new ATOM 0 HG2 PRO B 220 -9.626 -17.758 -18.377 1.00 1.24 H new ATOM 0 HG3 PRO B 220 -8.175 -18.623 -17.912 1.00 1.24 H new ATOM 0 HD2 PRO B 220 -9.178 -15.956 -16.931 1.00 2.03 H new ATOM 0 HD3 PRO B 220 -8.408 -17.243 -16.025 1.00 2.03 H new ATOM 1379 N VAL B 221 -5.672 -14.572 -20.125 1.00 33.44 N ATOM 1380 CA VAL B 221 -5.506 -13.298 -20.802 1.00 35.40 C ATOM 1381 C VAL B 221 -5.235 -13.532 -22.278 1.00 14.14 C ATOM 1382 O VAL B 221 -4.855 -14.648 -22.678 1.00 41.10 O ATOM 1383 CB VAL B 221 -4.362 -12.423 -20.189 1.00 74.15 C ATOM 1384 CG1 VAL B 221 -4.640 -12.111 -18.727 1.00 33.43 C ATOM 1385 CG2 VAL B 221 -2.996 -13.085 -20.352 1.00 34.32 C ATOM 0 H VAL B 221 -4.958 -15.264 -20.353 1.00 33.44 H new ATOM 0 HA VAL B 221 -6.436 -12.745 -20.669 1.00 35.40 H new ATOM 0 HB VAL B 221 -4.339 -11.484 -20.741 1.00 74.15 H new ATOM 0 HG11 VAL B 221 -3.830 -11.502 -18.325 1.00 33.43 H new ATOM 0 HG12 VAL B 221 -5.580 -11.566 -18.644 1.00 33.43 H new ATOM 0 HG13 VAL B 221 -4.709 -13.041 -18.163 1.00 33.43 H new ATOM 0 HG21 VAL B 221 -2.228 -12.447 -19.914 1.00 34.32 H new ATOM 0 HG22 VAL B 221 -2.997 -14.051 -19.847 1.00 34.32 H new ATOM 0 HG23 VAL B 221 -2.786 -13.230 -21.412 1.00 34.32 H new ATOM 1395 N SER B 222 -5.414 -12.511 -23.078 1.00 51.21 N ATOM 1396 CA SER B 222 -5.226 -12.632 -24.499 1.00 71.43 C ATOM 1397 C SER B 222 -3.737 -12.625 -24.858 1.00 34.44 C ATOM 1398 O SER B 222 -3.290 -13.393 -25.730 1.00 51.41 O ATOM 1399 CB SER B 222 -5.982 -11.507 -25.235 1.00 11.24 C ATOM 1400 OG SER B 222 -5.854 -11.612 -26.657 1.00 10.02 O ATOM 0 H SER B 222 -5.692 -11.581 -22.765 1.00 51.21 H new ATOM 0 HA SER B 222 -5.637 -13.589 -24.822 1.00 71.43 H new ATOM 0 HB2 SER B 222 -7.037 -11.542 -24.963 1.00 11.24 H new ATOM 0 HB3 SER B 222 -5.600 -10.540 -24.908 1.00 11.24 H new ATOM 0 HG SER B 222 -6.348 -10.882 -27.085 1.00 10.02 H new ATOM 1406 N ARG B 223 -2.968 -11.794 -24.190 1.00 43.51 N ATOM 1407 CA ARG B 223 -1.563 -11.672 -24.503 1.00 53.23 C ATOM 1408 C ARG B 223 -0.784 -11.174 -23.309 1.00 11.45 C ATOM 1409 O ARG B 223 -1.275 -10.329 -22.550 1.00 55.02 O ATOM 1410 CB ARG B 223 -1.382 -10.712 -25.695 1.00 10.50 C ATOM 1411 CG ARG B 223 0.059 -10.465 -26.111 1.00 25.44 C ATOM 1412 CD ARG B 223 0.125 -9.555 -27.318 1.00 53.21 C ATOM 1413 NE ARG B 223 1.505 -9.260 -27.723 1.00 43.40 N ATOM 1414 CZ ARG B 223 1.862 -8.858 -28.950 1.00 2.11 C ATOM 1415 NH1 ARG B 223 0.942 -8.709 -29.891 1.00 63.21 N ATOM 1416 NH2 ARG B 223 3.140 -8.602 -29.232 1.00 41.33 N ATOM 0 H ARG B 223 -3.291 -11.195 -23.430 1.00 43.51 H new ATOM 0 HA ARG B 223 -1.178 -12.657 -24.768 1.00 53.23 H new ATOM 0 HB2 ARG B 223 -1.927 -11.112 -26.550 1.00 10.50 H new ATOM 0 HB3 ARG B 223 -1.840 -9.755 -25.444 1.00 10.50 H new ATOM 0 HG2 ARG B 223 0.609 -10.018 -25.283 1.00 25.44 H new ATOM 0 HG3 ARG B 223 0.543 -11.414 -26.340 1.00 25.44 H new ATOM 0 HD2 ARG B 223 -0.403 -10.021 -28.150 1.00 53.21 H new ATOM 0 HD3 ARG B 223 -0.392 -8.622 -27.095 1.00 53.21 H new ATOM 0 HE ARG B 223 2.240 -9.368 -27.024 1.00 43.40 H new ATOM 0 HH11 ARG B 223 -0.038 -8.900 -29.681 1.00 63.21 H new ATOM 0 HH12 ARG B 223 1.213 -8.403 -30.825 1.00 63.21 H new ATOM 0 HH21 ARG B 223 3.853 -8.712 -28.511 1.00 41.33 H new ATOM 0 HH22 ARG B 223 3.404 -8.296 -30.169 1.00 41.33 H new ATOM 1430 N ILE B 224 0.414 -11.717 -23.133 1.00 12.04 N ATOM 1431 CA ILE B 224 1.334 -11.243 -22.112 1.00 31.52 C ATOM 1432 C ILE B 224 1.805 -9.898 -22.595 1.00 23.01 C ATOM 1433 O ILE B 224 2.603 -9.806 -23.527 1.00 21.23 O ATOM 1434 CB ILE B 224 2.580 -12.178 -21.958 1.00 65.40 C ATOM 1435 CG1 ILE B 224 2.180 -13.665 -21.749 1.00 20.12 C ATOM 1436 CG2 ILE B 224 3.485 -11.694 -20.826 1.00 33.42 C ATOM 1437 CD1 ILE B 224 1.339 -13.946 -20.543 1.00 62.32 C ATOM 0 H ILE B 224 0.772 -12.493 -23.691 1.00 12.04 H new ATOM 0 HA ILE B 224 0.835 -11.212 -21.143 1.00 31.52 H new ATOM 0 HB ILE B 224 3.136 -12.126 -22.894 1.00 65.40 H new ATOM 0 HG12 ILE B 224 1.641 -14.005 -22.633 1.00 20.12 H new ATOM 0 HG13 ILE B 224 3.090 -14.261 -21.682 1.00 20.12 H new ATOM 0 HG21 ILE B 224 4.344 -12.359 -20.737 1.00 33.42 H new ATOM 0 HG22 ILE B 224 3.829 -10.683 -21.043 1.00 33.42 H new ATOM 0 HG23 ILE B 224 2.928 -11.695 -19.889 1.00 33.42 H new ATOM 0 HD11 ILE B 224 1.118 -15.012 -20.494 1.00 62.32 H new ATOM 0 HD12 ILE B 224 1.879 -13.645 -19.645 1.00 62.32 H new ATOM 0 HD13 ILE B 224 0.407 -13.385 -20.611 1.00 62.32 H new ATOM 1449 N LYS B 225 1.290 -8.876 -22.019 1.00 22.42 N ATOM 1450 CA LYS B 225 1.549 -7.566 -22.514 1.00 42.35 C ATOM 1451 C LYS B 225 2.157 -6.702 -21.460 1.00 72.55 C ATOM 1452 O LYS B 225 1.997 -6.966 -20.263 1.00 22.21 O ATOM 1453 CB LYS B 225 0.252 -6.953 -23.012 1.00 11.14 C ATOM 1454 CG LYS B 225 -0.792 -6.754 -21.938 1.00 53.14 C ATOM 1455 CD LYS B 225 -2.067 -6.217 -22.526 1.00 54.12 C ATOM 1456 CE LYS B 225 -2.707 -7.228 -23.457 1.00 1.44 C ATOM 1457 NZ LYS B 225 -3.867 -6.679 -24.175 1.00 31.20 N ATOM 0 H LYS B 225 0.683 -8.916 -21.200 1.00 22.42 H new ATOM 0 HA LYS B 225 2.261 -7.637 -23.336 1.00 42.35 H new ATOM 0 HB2 LYS B 225 0.472 -5.990 -23.472 1.00 11.14 H new ATOM 0 HB3 LYS B 225 -0.163 -7.592 -23.792 1.00 11.14 H new ATOM 0 HG2 LYS B 225 -0.989 -7.701 -21.436 1.00 53.14 H new ATOM 0 HG3 LYS B 225 -0.416 -6.064 -21.182 1.00 53.14 H new ATOM 0 HD2 LYS B 225 -2.762 -5.964 -21.725 1.00 54.12 H new ATOM 0 HD3 LYS B 225 -1.860 -5.296 -23.071 1.00 54.12 H new ATOM 0 HE2 LYS B 225 -1.966 -7.571 -24.179 1.00 1.44 H new ATOM 0 HE3 LYS B 225 -3.019 -8.100 -22.882 1.00 1.44 H new ATOM 0 HZ1 LYS B 225 -4.647 -7.366 -24.152 1.00 31.20 H new ATOM 0 HZ2 LYS B 225 -4.171 -5.795 -23.719 1.00 31.20 H new ATOM 0 HZ3 LYS B 225 -3.605 -6.487 -25.163 1.00 31.20 H new ATOM 1471 N THR B 226 2.842 -5.683 -21.894 1.00 0.11 N ATOM 1472 CA THR B 226 3.436 -4.752 -21.003 1.00 31.40 C ATOM 1473 C THR B 226 2.851 -3.368 -21.166 1.00 4.44 C ATOM 1474 O THR B 226 2.664 -2.882 -22.283 1.00 73.12 O ATOM 1475 CB THR B 226 4.973 -4.697 -21.132 1.00 24.42 C ATOM 1476 OG1 THR B 226 5.357 -4.580 -22.510 1.00 30.42 O ATOM 1477 CG2 THR B 226 5.630 -5.906 -20.499 1.00 34.52 C ATOM 0 H THR B 226 3.000 -5.481 -22.881 1.00 0.11 H new ATOM 0 HA THR B 226 3.203 -5.113 -20.001 1.00 31.40 H new ATOM 0 HB THR B 226 5.319 -3.814 -20.594 1.00 24.42 H new ATOM 0 HG1 THR B 226 6.334 -4.545 -22.575 1.00 30.42 H new ATOM 0 HG21 THR B 226 6.712 -5.832 -20.610 1.00 34.52 H new ATOM 0 HG22 THR B 226 5.375 -5.946 -19.440 1.00 34.52 H new ATOM 0 HG23 THR B 226 5.276 -6.812 -20.991 1.00 34.52 H new ATOM 1485 N TYR B 227 2.527 -2.767 -20.066 1.00 54.42 N ATOM 1486 CA TYR B 227 2.092 -1.394 -20.037 1.00 15.34 C ATOM 1487 C TYR B 227 3.166 -0.576 -19.412 1.00 40.31 C ATOM 1488 O TYR B 227 3.660 -0.922 -18.349 1.00 71.20 O ATOM 1489 CB TYR B 227 0.801 -1.221 -19.234 1.00 71.12 C ATOM 1490 CG TYR B 227 -0.428 -1.765 -19.886 1.00 61.01 C ATOM 1491 CD1 TYR B 227 -0.763 -3.092 -19.779 1.00 42.34 C ATOM 1492 CD2 TYR B 227 -1.265 -0.930 -20.610 1.00 42.53 C ATOM 1493 CE1 TYR B 227 -1.898 -3.579 -20.372 1.00 31.12 C ATOM 1494 CE2 TYR B 227 -2.404 -1.412 -21.203 1.00 71.12 C ATOM 1495 CZ TYR B 227 -2.714 -2.739 -21.082 1.00 35.52 C ATOM 1496 OH TYR B 227 -3.852 -3.236 -21.668 1.00 30.31 O ATOM 0 H TYR B 227 2.555 -3.214 -19.150 1.00 54.42 H new ATOM 0 HA TYR B 227 1.893 -1.073 -21.059 1.00 15.34 H new ATOM 0 HB2 TYR B 227 0.925 -1.707 -18.266 1.00 71.12 H new ATOM 0 HB3 TYR B 227 0.651 -0.159 -19.041 1.00 71.12 H new ATOM 0 HD1 TYR B 227 -0.124 -3.760 -19.221 1.00 42.34 H new ATOM 0 HD2 TYR B 227 -1.016 0.116 -20.709 1.00 42.53 H new ATOM 0 HE1 TYR B 227 -2.149 -4.625 -20.280 1.00 31.12 H new ATOM 0 HE2 TYR B 227 -3.050 -0.750 -21.760 1.00 71.12 H new ATOM 0 HH TYR B 227 -4.323 -2.513 -22.134 1.00 30.31 H new ATOM 1506 N THR B 228 3.569 0.465 -20.064 1.00 3.10 N ATOM 1507 CA THR B 228 4.537 1.329 -19.506 1.00 43.23 C ATOM 1508 C THR B 228 3.874 2.644 -19.133 1.00 34.20 C ATOM 1509 O THR B 228 3.318 3.350 -19.984 1.00 42.14 O ATOM 1510 CB THR B 228 5.714 1.555 -20.469 1.00 12.53 C ATOM 1511 OG1 THR B 228 6.234 0.263 -20.857 1.00 51.21 O ATOM 1512 CG2 THR B 228 6.824 2.340 -19.773 1.00 13.41 C ATOM 0 H THR B 228 3.236 0.733 -20.990 1.00 3.10 H new ATOM 0 HA THR B 228 4.949 0.866 -18.609 1.00 43.23 H new ATOM 0 HB THR B 228 5.371 2.117 -21.338 1.00 12.53 H new ATOM 0 HG1 THR B 228 6.986 0.385 -21.474 1.00 51.21 H new ATOM 0 HG21 THR B 228 7.651 2.493 -20.466 1.00 13.41 H new ATOM 0 HG22 THR B 228 6.438 3.307 -19.450 1.00 13.41 H new ATOM 0 HG23 THR B 228 7.176 1.781 -18.906 1.00 13.41 H new ATOM 1520 N ILE B 229 3.941 2.953 -17.880 1.00 40.23 N ATOM 1521 CA ILE B 229 3.323 4.118 -17.320 1.00 52.14 C ATOM 1522 C ILE B 229 4.394 5.146 -17.041 1.00 40.43 C ATOM 1523 O ILE B 229 5.417 4.837 -16.430 1.00 21.43 O ATOM 1524 CB ILE B 229 2.585 3.744 -16.005 1.00 14.54 C ATOM 1525 CG1 ILE B 229 1.510 2.681 -16.307 1.00 3.45 C ATOM 1526 CG2 ILE B 229 1.957 4.985 -15.370 1.00 22.14 C ATOM 1527 CD1 ILE B 229 0.865 2.046 -15.120 1.00 73.41 C ATOM 0 H ILE B 229 4.441 2.388 -17.194 1.00 40.23 H new ATOM 0 HA ILE B 229 2.595 4.527 -18.021 1.00 52.14 H new ATOM 0 HB ILE B 229 3.302 3.333 -15.295 1.00 14.54 H new ATOM 0 HG12 ILE B 229 0.732 3.143 -16.915 1.00 3.45 H new ATOM 0 HG13 ILE B 229 1.964 1.896 -16.912 1.00 3.45 H new ATOM 0 HG21 ILE B 229 1.445 4.703 -14.450 1.00 22.14 H new ATOM 0 HG22 ILE B 229 2.737 5.712 -15.143 1.00 22.14 H new ATOM 0 HG23 ILE B 229 1.241 5.426 -16.064 1.00 22.14 H new ATOM 0 HD11 ILE B 229 0.127 1.316 -15.454 1.00 73.41 H new ATOM 0 HD12 ILE B 229 1.624 1.546 -14.518 1.00 73.41 H new ATOM 0 HD13 ILE B 229 0.373 2.812 -14.520 1.00 73.41 H new ATOM 1539 N THR B 230 4.172 6.335 -17.505 1.00 45.24 N ATOM 1540 CA THR B 230 5.115 7.410 -17.345 1.00 34.21 C ATOM 1541 C THR B 230 4.439 8.628 -16.733 1.00 63.42 C ATOM 1542 O THR B 230 3.868 9.440 -17.454 1.00 4.54 O ATOM 1543 CB THR B 230 5.757 7.794 -18.712 1.00 51.14 C ATOM 1544 OG1 THR B 230 4.719 8.097 -19.667 1.00 2.04 O ATOM 1545 CG2 THR B 230 6.624 6.668 -19.255 1.00 23.35 C ATOM 0 H THR B 230 3.325 6.595 -18.011 1.00 45.24 H new ATOM 0 HA THR B 230 5.902 7.067 -16.674 1.00 34.21 H new ATOM 0 HB THR B 230 6.389 8.668 -18.553 1.00 51.14 H new ATOM 0 HG1 THR B 230 4.045 8.671 -19.247 1.00 2.04 H new ATOM 0 HG21 THR B 230 7.056 6.969 -20.209 1.00 23.35 H new ATOM 0 HG22 THR B 230 7.424 6.451 -18.547 1.00 23.35 H new ATOM 0 HG23 THR B 230 6.014 5.776 -19.398 1.00 23.35 H new ATOM 1553 N GLU B 231 4.472 8.748 -15.425 1.00 61.21 N ATOM 1554 CA GLU B 231 3.788 9.841 -14.779 1.00 4.44 C ATOM 1555 C GLU B 231 4.709 10.699 -13.928 1.00 14.32 C ATOM 1556 O GLU B 231 5.400 10.202 -13.080 1.00 41.33 O ATOM 1557 CB GLU B 231 2.494 9.347 -14.062 1.00 13.11 C ATOM 1558 CG GLU B 231 2.628 8.236 -13.002 1.00 13.11 C ATOM 1559 CD GLU B 231 3.024 8.704 -11.614 1.00 63.22 C ATOM 1560 OE1 GLU B 231 2.121 9.149 -10.855 1.00 65.11 O ATOM 1561 OE2 GLU B 231 4.168 8.578 -11.233 1.00 43.31 O ATOM 0 H GLU B 231 4.959 8.110 -14.796 1.00 61.21 H new ATOM 0 HA GLU B 231 3.449 10.530 -15.552 1.00 4.44 H new ATOM 0 HB2 GLU B 231 2.028 10.209 -13.584 1.00 13.11 H new ATOM 0 HB3 GLU B 231 1.803 8.995 -14.828 1.00 13.11 H new ATOM 0 HG2 GLU B 231 1.677 7.708 -12.931 1.00 13.11 H new ATOM 0 HG3 GLU B 231 3.368 7.514 -13.348 1.00 13.11 H new ATOM 1568 N GLY B 232 4.744 11.995 -14.237 1.00 73.10 N ATOM 1569 CA GLY B 232 5.562 12.963 -13.505 1.00 61.42 C ATOM 1570 C GLY B 232 7.019 12.534 -13.322 1.00 50.30 C ATOM 1571 O GLY B 232 7.539 12.571 -12.205 1.00 52.24 O ATOM 0 H GLY B 232 4.206 12.404 -15.001 1.00 73.10 H new ATOM 0 HA2 GLY B 232 5.538 13.916 -14.033 1.00 61.42 H new ATOM 0 HA3 GLY B 232 5.117 13.131 -12.524 1.00 61.42 H new ATOM 1575 N SER B 233 7.655 12.132 -14.424 1.00 34.44 N ATOM 1576 CA SER B 233 9.049 11.674 -14.435 1.00 75.21 C ATOM 1577 C SER B 233 9.191 10.320 -13.729 1.00 21.00 C ATOM 1578 O SER B 233 9.781 10.211 -12.650 1.00 12.22 O ATOM 1579 CB SER B 233 10.002 12.727 -13.841 1.00 33.50 C ATOM 1580 OG SER B 233 9.914 13.959 -14.556 1.00 62.24 O ATOM 0 H SER B 233 7.214 12.114 -15.344 1.00 34.44 H new ATOM 0 HA SER B 233 9.340 11.536 -15.476 1.00 75.21 H new ATOM 0 HB2 SER B 233 9.757 12.893 -12.792 1.00 33.50 H new ATOM 0 HB3 SER B 233 11.026 12.356 -13.874 1.00 33.50 H new ATOM 0 HG SER B 233 10.527 14.612 -14.159 1.00 62.24 H new ATOM 1586 N LEU B 234 8.614 9.308 -14.336 1.00 53.14 N ATOM 1587 CA LEU B 234 8.569 7.978 -13.762 1.00 51.53 C ATOM 1588 C LEU B 234 8.301 6.952 -14.880 1.00 42.33 C ATOM 1589 O LEU B 234 7.620 7.281 -15.845 1.00 0.13 O ATOM 1590 CB LEU B 234 7.456 8.016 -12.648 1.00 23.32 C ATOM 1591 CG LEU B 234 6.991 6.742 -11.930 1.00 44.12 C ATOM 1592 CD1 LEU B 234 6.116 5.881 -12.824 1.00 74.12 C ATOM 1593 CD2 LEU B 234 8.167 5.956 -11.393 1.00 52.22 C ATOM 0 H LEU B 234 8.160 9.382 -15.246 1.00 53.14 H new ATOM 0 HA LEU B 234 9.509 7.672 -13.303 1.00 51.53 H new ATOM 0 HB2 LEU B 234 7.804 8.704 -11.877 1.00 23.32 H new ATOM 0 HB3 LEU B 234 6.571 8.465 -13.100 1.00 23.32 H new ATOM 0 HG LEU B 234 6.381 7.052 -11.081 1.00 44.12 H new ATOM 0 HD11 LEU B 234 5.807 4.988 -12.280 1.00 74.12 H new ATOM 0 HD12 LEU B 234 5.234 6.447 -13.124 1.00 74.12 H new ATOM 0 HD13 LEU B 234 6.678 5.589 -13.711 1.00 74.12 H new ATOM 0 HD21 LEU B 234 7.806 5.059 -10.890 1.00 52.22 H new ATOM 0 HD22 LEU B 234 8.821 5.671 -12.217 1.00 52.22 H new ATOM 0 HD23 LEU B 234 8.723 6.571 -10.685 1.00 52.22 H new ATOM 1605 N ARG B 235 8.892 5.750 -14.794 1.00 65.11 N ATOM 1606 CA ARG B 235 8.587 4.680 -15.743 1.00 71.13 C ATOM 1607 C ARG B 235 8.214 3.395 -15.021 1.00 71.42 C ATOM 1608 O ARG B 235 9.048 2.766 -14.411 1.00 33.24 O ATOM 1609 CB ARG B 235 9.766 4.365 -16.677 1.00 3.35 C ATOM 1610 CG ARG B 235 10.094 5.388 -17.745 1.00 70.24 C ATOM 1611 CD ARG B 235 11.232 4.859 -18.597 1.00 21.41 C ATOM 1612 NE ARG B 235 11.512 5.666 -19.793 1.00 74.30 N ATOM 1613 CZ ARG B 235 12.257 5.227 -20.823 1.00 74.25 C ATOM 1614 NH1 ARG B 235 12.774 3.991 -20.795 1.00 51.32 N ATOM 1615 NH2 ARG B 235 12.464 6.009 -21.881 1.00 64.33 N ATOM 0 H ARG B 235 9.578 5.501 -14.081 1.00 65.11 H new ATOM 0 HA ARG B 235 7.748 5.046 -16.336 1.00 71.13 H new ATOM 0 HB2 ARG B 235 10.655 4.221 -16.063 1.00 3.35 H new ATOM 0 HB3 ARG B 235 9.562 3.415 -17.170 1.00 3.35 H new ATOM 0 HG2 ARG B 235 9.218 5.581 -18.364 1.00 70.24 H new ATOM 0 HG3 ARG B 235 10.375 6.336 -17.286 1.00 70.24 H new ATOM 0 HD2 ARG B 235 12.134 4.807 -17.987 1.00 21.41 H new ATOM 0 HD3 ARG B 235 10.997 3.840 -18.906 1.00 21.41 H new ATOM 0 HE ARG B 235 11.121 6.607 -19.844 1.00 74.30 H new ATOM 0 HH11 ARG B 235 12.602 3.384 -19.993 1.00 51.32 H new ATOM 0 HH12 ARG B 235 13.339 3.657 -21.576 1.00 51.32 H new ATOM 0 HH21 ARG B 235 12.057 6.944 -21.912 1.00 64.33 H new ATOM 0 HH22 ARG B 235 13.030 5.673 -22.661 1.00 64.33 H new ATOM 1629 N CYS B 236 6.990 3.010 -15.127 1.00 55.12 N ATOM 1630 CA CYS B 236 6.507 1.752 -14.577 1.00 53.35 C ATOM 1631 C CYS B 236 6.148 0.812 -15.732 1.00 74.14 C ATOM 1632 O CYS B 236 5.662 1.265 -16.745 1.00 30.52 O ATOM 1633 CB CYS B 236 5.272 1.984 -13.684 1.00 0.51 C ATOM 1634 SG CYS B 236 5.522 2.698 -12.003 1.00 62.52 S ATOM 0 H CYS B 236 6.271 3.555 -15.602 1.00 55.12 H new ATOM 0 HA CYS B 236 7.289 1.306 -13.963 1.00 53.35 H new ATOM 0 HB2 CYS B 236 4.591 2.641 -14.225 1.00 0.51 H new ATOM 0 HB3 CYS B 236 4.765 1.027 -13.565 1.00 0.51 H new ATOM 1639 N VAL B 237 6.406 -0.477 -15.585 1.00 22.41 N ATOM 1640 CA VAL B 237 6.121 -1.461 -16.625 1.00 42.12 C ATOM 1641 C VAL B 237 5.364 -2.607 -15.988 1.00 22.21 C ATOM 1642 O VAL B 237 5.749 -3.089 -14.922 1.00 54.32 O ATOM 1643 CB VAL B 237 7.411 -2.031 -17.287 1.00 13.11 C ATOM 1644 CG1 VAL B 237 7.078 -2.928 -18.471 1.00 73.34 C ATOM 1645 CG2 VAL B 237 8.369 -0.934 -17.693 1.00 24.24 C ATOM 0 H VAL B 237 6.819 -0.875 -14.742 1.00 22.41 H new ATOM 0 HA VAL B 237 5.544 -0.966 -17.406 1.00 42.12 H new ATOM 0 HB VAL B 237 7.912 -2.640 -16.534 1.00 13.11 H new ATOM 0 HG11 VAL B 237 8.000 -3.309 -18.910 1.00 73.34 H new ATOM 0 HG12 VAL B 237 6.465 -3.763 -18.133 1.00 73.34 H new ATOM 0 HG13 VAL B 237 6.530 -2.355 -19.219 1.00 73.34 H new ATOM 0 HG21 VAL B 237 9.255 -1.375 -18.150 1.00 24.24 H new ATOM 0 HG22 VAL B 237 7.882 -0.272 -18.409 1.00 24.24 H new ATOM 0 HG23 VAL B 237 8.662 -0.362 -16.812 1.00 24.24 H new ATOM 1655 N ILE B 238 4.302 -3.023 -16.617 1.00 53.31 N ATOM 1656 CA ILE B 238 3.446 -4.053 -16.077 1.00 43.31 C ATOM 1657 C ILE B 238 3.286 -5.180 -17.067 1.00 31.42 C ATOM 1658 O ILE B 238 2.875 -4.951 -18.189 1.00 14.34 O ATOM 1659 CB ILE B 238 2.057 -3.468 -15.803 1.00 70.42 C ATOM 1660 CG1 ILE B 238 2.182 -2.229 -14.927 1.00 23.44 C ATOM 1661 CG2 ILE B 238 1.138 -4.516 -15.154 1.00 73.42 C ATOM 1662 CD1 ILE B 238 0.892 -1.542 -14.695 1.00 24.43 C ATOM 0 H ILE B 238 4.000 -2.660 -17.521 1.00 53.31 H new ATOM 0 HA ILE B 238 3.899 -4.428 -15.159 1.00 43.31 H new ATOM 0 HB ILE B 238 1.604 -3.179 -16.751 1.00 70.42 H new ATOM 0 HG12 ILE B 238 2.612 -2.514 -13.967 1.00 23.44 H new ATOM 0 HG13 ILE B 238 2.878 -1.532 -15.393 1.00 23.44 H new ATOM 0 HG21 ILE B 238 0.158 -4.076 -14.969 1.00 73.42 H new ATOM 0 HG22 ILE B 238 1.032 -5.371 -15.822 1.00 73.42 H new ATOM 0 HG23 ILE B 238 1.572 -4.845 -14.210 1.00 73.42 H new ATOM 0 HD11 ILE B 238 1.053 -0.668 -14.064 1.00 24.43 H new ATOM 0 HD12 ILE B 238 0.471 -1.227 -15.650 1.00 24.43 H new ATOM 0 HD13 ILE B 238 0.200 -2.224 -14.201 1.00 24.43 H new ATOM 1674 N PHE B 239 3.616 -6.370 -16.647 1.00 10.52 N ATOM 1675 CA PHE B 239 3.440 -7.571 -17.441 1.00 3.10 C ATOM 1676 C PHE B 239 2.174 -8.263 -17.021 1.00 24.03 C ATOM 1677 O PHE B 239 2.067 -8.703 -15.864 1.00 43.41 O ATOM 1678 CB PHE B 239 4.590 -8.561 -17.218 1.00 23.13 C ATOM 1679 CG PHE B 239 5.938 -8.140 -17.722 1.00 44.24 C ATOM 1680 CD1 PHE B 239 6.653 -7.105 -17.127 1.00 44.13 C ATOM 1681 CD2 PHE B 239 6.489 -8.793 -18.804 1.00 34.21 C ATOM 1682 CE1 PHE B 239 7.896 -6.736 -17.615 1.00 73.33 C ATOM 1683 CE2 PHE B 239 7.718 -8.440 -19.296 1.00 23.41 C ATOM 1684 CZ PHE B 239 8.432 -7.407 -18.704 1.00 23.53 C ATOM 0 H PHE B 239 4.023 -6.543 -15.728 1.00 10.52 H new ATOM 0 HA PHE B 239 3.409 -7.271 -18.489 1.00 3.10 H new ATOM 0 HB2 PHE B 239 4.671 -8.756 -16.149 1.00 23.13 H new ATOM 0 HB3 PHE B 239 4.326 -9.505 -17.695 1.00 23.13 H new ATOM 0 HD1 PHE B 239 6.235 -6.585 -16.278 1.00 44.13 H new ATOM 0 HD2 PHE B 239 5.942 -9.598 -19.272 1.00 34.21 H new ATOM 0 HE1 PHE B 239 8.445 -5.930 -17.150 1.00 73.33 H new ATOM 0 HE2 PHE B 239 8.131 -8.965 -20.144 1.00 23.41 H new ATOM 0 HZ PHE B 239 9.401 -7.127 -19.090 1.00 23.53 H new ATOM 1694 N ILE B 240 1.224 -8.362 -17.909 1.00 13.21 N ATOM 1695 CA ILE B 240 0.022 -9.098 -17.597 1.00 20.34 C ATOM 1696 C ILE B 240 0.238 -10.505 -18.066 1.00 25.13 C ATOM 1697 O ILE B 240 0.469 -10.725 -19.252 1.00 5.14 O ATOM 1698 CB ILE B 240 -1.238 -8.559 -18.326 1.00 1.11 C ATOM 1699 CG1 ILE B 240 -1.336 -7.047 -18.194 1.00 23.21 C ATOM 1700 CG2 ILE B 240 -2.489 -9.232 -17.778 1.00 63.34 C ATOM 1701 CD1 ILE B 240 -2.663 -6.457 -18.643 1.00 2.22 C ATOM 0 H ILE B 240 1.253 -7.951 -18.842 1.00 13.21 H new ATOM 0 HA ILE B 240 -0.155 -9.010 -16.525 1.00 20.34 H new ATOM 0 HB ILE B 240 -1.152 -8.796 -19.386 1.00 1.11 H new ATOM 0 HG12 ILE B 240 -1.166 -6.775 -17.152 1.00 23.21 H new ATOM 0 HG13 ILE B 240 -0.535 -6.592 -18.777 1.00 23.21 H new ATOM 0 HG21 ILE B 240 -3.367 -8.846 -18.297 1.00 63.34 H new ATOM 0 HG22 ILE B 240 -2.420 -10.309 -17.933 1.00 63.34 H new ATOM 0 HG23 ILE B 240 -2.577 -9.024 -16.712 1.00 63.34 H new ATOM 0 HD11 ILE B 240 -2.643 -5.375 -18.513 1.00 2.22 H new ATOM 0 HD12 ILE B 240 -2.829 -6.693 -19.694 1.00 2.22 H new ATOM 0 HD13 ILE B 240 -3.470 -6.879 -18.044 1.00 2.22 H new ATOM 1713 N THR B 241 0.205 -11.447 -17.173 1.00 34.24 N ATOM 1714 CA THR B 241 0.392 -12.788 -17.571 1.00 45.43 C ATOM 1715 C THR B 241 -0.807 -13.606 -17.159 1.00 62.05 C ATOM 1716 O THR B 241 -1.533 -13.228 -16.247 1.00 30.24 O ATOM 1717 CB THR B 241 1.685 -13.426 -16.979 1.00 10.50 C ATOM 1718 OG1 THR B 241 1.585 -13.538 -15.558 1.00 33.21 O ATOM 1719 CG2 THR B 241 2.927 -12.607 -17.306 1.00 5.54 C ATOM 0 H THR B 241 0.051 -11.303 -16.175 1.00 34.24 H new ATOM 0 HA THR B 241 0.505 -12.787 -18.655 1.00 45.43 H new ATOM 0 HB THR B 241 1.781 -14.412 -17.433 1.00 10.50 H new ATOM 0 HG1 THR B 241 1.254 -12.694 -15.186 1.00 33.21 H new ATOM 0 HG21 THR B 241 3.804 -13.088 -16.874 1.00 5.54 H new ATOM 0 HG22 THR B 241 3.045 -12.541 -18.388 1.00 5.54 H new ATOM 0 HG23 THR B 241 2.822 -11.605 -16.891 1.00 5.54 H new ATOM 1727 N LYS B 242 -0.997 -14.729 -17.803 1.00 22.34 N ATOM 1728 CA LYS B 242 -2.106 -15.629 -17.469 1.00 34.35 C ATOM 1729 C LYS B 242 -1.953 -16.341 -16.097 1.00 55.42 C ATOM 1730 O LYS B 242 -2.785 -17.154 -15.708 1.00 73.13 O ATOM 1731 CB LYS B 242 -2.438 -16.595 -18.637 1.00 12.33 C ATOM 1732 CG LYS B 242 -1.244 -17.236 -19.361 1.00 21.40 C ATOM 1733 CD LYS B 242 -0.390 -18.102 -18.468 1.00 53.33 C ATOM 1734 CE LYS B 242 0.759 -18.716 -19.256 1.00 5.52 C ATOM 1735 NZ LYS B 242 1.636 -19.547 -18.413 1.00 65.12 N ATOM 0 H LYS B 242 -0.404 -15.056 -18.566 1.00 22.34 H new ATOM 0 HA LYS B 242 -2.980 -14.991 -17.336 1.00 34.35 H new ATOM 0 HB2 LYS B 242 -3.070 -17.394 -18.249 1.00 12.33 H new ATOM 0 HB3 LYS B 242 -3.029 -16.050 -19.372 1.00 12.33 H new ATOM 0 HG2 LYS B 242 -1.614 -17.838 -20.191 1.00 21.40 H new ATOM 0 HG3 LYS B 242 -0.624 -16.448 -19.790 1.00 21.40 H new ATOM 0 HD2 LYS B 242 0.004 -17.507 -17.644 1.00 53.33 H new ATOM 0 HD3 LYS B 242 -0.999 -18.892 -18.028 1.00 53.33 H new ATOM 0 HE2 LYS B 242 0.357 -19.323 -20.067 1.00 5.52 H new ATOM 0 HE3 LYS B 242 1.347 -17.921 -19.715 1.00 5.52 H new ATOM 0 HZ1 LYS B 242 2.403 -19.943 -18.994 1.00 65.12 H new ATOM 0 HZ2 LYS B 242 2.043 -18.964 -17.654 1.00 65.12 H new ATOM 0 HZ3 LYS B 242 1.083 -20.322 -17.995 1.00 65.12 H new ATOM 1749 N ARG B 243 -0.888 -16.015 -15.372 1.00 23.53 N ATOM 1750 CA ARG B 243 -0.680 -16.530 -14.024 1.00 72.11 C ATOM 1751 C ARG B 243 -0.484 -15.414 -13.017 1.00 51.22 C ATOM 1752 O ARG B 243 -0.186 -15.664 -11.864 1.00 61.23 O ATOM 1753 CB ARG B 243 0.500 -17.499 -13.934 1.00 64.42 C ATOM 1754 CG ARG B 243 0.276 -18.847 -14.575 1.00 35.04 C ATOM 1755 CD ARG B 243 1.449 -19.756 -14.305 1.00 14.34 C ATOM 1756 NE ARG B 243 1.190 -21.136 -14.717 1.00 44.33 N ATOM 1757 CZ ARG B 243 1.432 -22.207 -13.938 1.00 63.35 C ATOM 1758 NH1 ARG B 243 1.866 -22.036 -12.679 1.00 3.32 N ATOM 1759 NH2 ARG B 243 1.219 -23.440 -14.402 1.00 54.50 N ATOM 0 H ARG B 243 -0.150 -15.391 -15.699 1.00 23.53 H new ATOM 0 HA ARG B 243 -1.591 -17.078 -13.782 1.00 72.11 H new ATOM 0 HB2 ARG B 243 1.368 -17.033 -14.400 1.00 64.42 H new ATOM 0 HB3 ARG B 243 0.745 -17.651 -12.883 1.00 64.42 H new ATOM 0 HG2 ARG B 243 -0.638 -19.295 -14.185 1.00 35.04 H new ATOM 0 HG3 ARG B 243 0.139 -18.728 -15.650 1.00 35.04 H new ATOM 0 HD2 ARG B 243 2.326 -19.380 -14.833 1.00 14.34 H new ATOM 0 HD3 ARG B 243 1.684 -19.735 -13.241 1.00 14.34 H new ATOM 0 HE ARG B 243 0.804 -21.296 -15.648 1.00 44.33 H new ATOM 0 HH11 ARG B 243 2.012 -21.095 -12.313 1.00 3.32 H new ATOM 0 HH12 ARG B 243 2.050 -22.847 -12.088 1.00 3.32 H new ATOM 0 HH21 ARG B 243 0.871 -23.575 -15.351 1.00 54.50 H new ATOM 0 HH22 ARG B 243 1.404 -24.248 -13.807 1.00 54.50 H new ATOM 1773 N GLY B 244 -0.655 -14.197 -13.428 1.00 4.44 N ATOM 1774 CA GLY B 244 -0.451 -13.121 -12.506 1.00 34.05 C ATOM 1775 C GLY B 244 0.142 -11.930 -13.160 1.00 71.11 C ATOM 1776 O GLY B 244 0.016 -11.757 -14.372 1.00 72.14 O ATOM 0 H GLY B 244 -0.929 -13.925 -14.372 1.00 4.44 H new ATOM 0 HA2 GLY B 244 -1.404 -12.848 -12.052 1.00 34.05 H new ATOM 0 HA3 GLY B 244 0.202 -13.454 -11.700 1.00 34.05 H new ATOM 1780 N LEU B 245 0.817 -11.116 -12.402 1.00 2.51 N ATOM 1781 CA LEU B 245 1.336 -9.867 -12.956 1.00 15.21 C ATOM 1782 C LEU B 245 2.727 -9.528 -12.434 1.00 71.54 C ATOM 1783 O LEU B 245 3.070 -9.829 -11.280 1.00 54.12 O ATOM 1784 CB LEU B 245 0.385 -8.641 -12.720 1.00 21.23 C ATOM 1785 CG LEU B 245 -1.026 -8.641 -13.381 1.00 63.53 C ATOM 1786 CD1 LEU B 245 -2.019 -9.541 -12.650 1.00 75.12 C ATOM 1787 CD2 LEU B 245 -1.569 -7.229 -13.513 1.00 2.32 C ATOM 0 H LEU B 245 1.026 -11.275 -11.416 1.00 2.51 H new ATOM 0 HA LEU B 245 1.395 -10.050 -14.029 1.00 15.21 H new ATOM 0 HB2 LEU B 245 0.244 -8.536 -11.644 1.00 21.23 H new ATOM 0 HB3 LEU B 245 0.908 -7.748 -13.062 1.00 21.23 H new ATOM 0 HG LEU B 245 -0.900 -9.058 -14.380 1.00 63.53 H new ATOM 0 HD11 LEU B 245 -2.985 -9.502 -13.154 1.00 75.12 H new ATOM 0 HD12 LEU B 245 -1.650 -10.567 -12.652 1.00 75.12 H new ATOM 0 HD13 LEU B 245 -2.132 -9.198 -11.622 1.00 75.12 H new ATOM 0 HD21 LEU B 245 -2.555 -7.260 -13.977 1.00 2.32 H new ATOM 0 HD22 LEU B 245 -1.648 -6.776 -12.525 1.00 2.32 H new ATOM 0 HD23 LEU B 245 -0.895 -6.636 -14.132 1.00 2.32 H new ATOM 1799 N LYS B 246 3.525 -8.910 -13.293 1.00 0.30 N ATOM 1800 CA LYS B 246 4.839 -8.425 -12.912 1.00 62.42 C ATOM 1801 C LYS B 246 4.826 -6.925 -13.035 1.00 41.13 C ATOM 1802 O LYS B 246 4.574 -6.404 -14.116 1.00 73.14 O ATOM 1803 CB LYS B 246 5.948 -8.928 -13.843 1.00 64.40 C ATOM 1804 CG LYS B 246 7.339 -8.531 -13.355 1.00 51.24 C ATOM 1805 CD LYS B 246 8.437 -8.678 -14.404 1.00 4.34 C ATOM 1806 CE LYS B 246 8.450 -10.036 -15.082 1.00 33.34 C ATOM 1807 NZ LYS B 246 9.674 -10.226 -15.902 1.00 51.22 N ATOM 0 H LYS B 246 3.280 -8.733 -14.267 1.00 0.30 H new ATOM 0 HA LYS B 246 5.041 -8.780 -11.901 1.00 62.42 H new ATOM 0 HB2 LYS B 246 5.889 -10.014 -13.921 1.00 64.40 H new ATOM 0 HB3 LYS B 246 5.789 -8.527 -14.844 1.00 64.40 H new ATOM 0 HG2 LYS B 246 7.311 -7.495 -13.018 1.00 51.24 H new ATOM 0 HG3 LYS B 246 7.596 -9.141 -12.489 1.00 51.24 H new ATOM 0 HD2 LYS B 246 8.311 -7.904 -15.161 1.00 4.34 H new ATOM 0 HD3 LYS B 246 9.405 -8.507 -13.932 1.00 4.34 H new ATOM 0 HE2 LYS B 246 8.391 -10.821 -14.328 1.00 33.34 H new ATOM 0 HE3 LYS B 246 7.568 -10.136 -15.715 1.00 33.34 H new ATOM 0 HZ1 LYS B 246 9.649 -11.164 -16.350 1.00 51.22 H new ATOM 0 HZ2 LYS B 246 9.717 -9.492 -16.637 1.00 51.22 H new ATOM 0 HZ3 LYS B 246 10.514 -10.155 -15.293 1.00 51.22 H new ATOM 1821 N VAL B 247 5.094 -6.244 -11.980 1.00 70.14 N ATOM 1822 CA VAL B 247 5.169 -4.804 -12.036 1.00 72.14 C ATOM 1823 C VAL B 247 6.578 -4.347 -11.724 1.00 70.51 C ATOM 1824 O VAL B 247 7.188 -4.746 -10.734 1.00 25.00 O ATOM 1825 CB VAL B 247 4.127 -4.100 -11.128 1.00 31.32 C ATOM 1826 CG1 VAL B 247 2.717 -4.426 -11.580 1.00 64.24 C ATOM 1827 CG2 VAL B 247 4.309 -4.486 -9.681 1.00 43.14 C ATOM 0 H VAL B 247 5.267 -6.648 -11.060 1.00 70.14 H new ATOM 0 HA VAL B 247 4.915 -4.507 -13.054 1.00 72.14 H new ATOM 0 HB VAL B 247 4.287 -3.025 -11.216 1.00 31.32 H new ATOM 0 HG11 VAL B 247 2.001 -3.923 -10.930 1.00 64.24 H new ATOM 0 HG12 VAL B 247 2.576 -4.087 -12.606 1.00 64.24 H new ATOM 0 HG13 VAL B 247 2.558 -5.503 -11.529 1.00 64.24 H new ATOM 0 HG21 VAL B 247 3.563 -3.975 -9.072 1.00 43.14 H new ATOM 0 HG22 VAL B 247 4.189 -5.564 -9.574 1.00 43.14 H new ATOM 0 HG23 VAL B 247 5.307 -4.198 -9.350 1.00 43.14 H new ATOM 1837 N CYS B 248 7.105 -3.566 -12.571 1.00 31.14 N ATOM 1838 CA CYS B 248 8.430 -3.094 -12.405 1.00 71.42 C ATOM 1839 C CYS B 248 8.390 -1.615 -12.556 1.00 34.20 C ATOM 1840 O CYS B 248 7.572 -1.120 -13.312 1.00 22.52 O ATOM 1841 CB CYS B 248 9.309 -3.704 -13.477 1.00 2.24 C ATOM 1842 SG CYS B 248 11.070 -3.409 -13.229 1.00 62.40 S ATOM 0 H CYS B 248 6.634 -3.227 -13.410 1.00 31.14 H new ATOM 0 HA CYS B 248 8.832 -3.366 -11.429 1.00 71.42 H new ATOM 0 HB2 CYS B 248 9.131 -4.779 -13.511 1.00 2.24 H new ATOM 0 HB3 CYS B 248 9.016 -3.302 -14.447 1.00 2.24 H new ATOM 1847 N CYS B 249 9.211 -0.884 -11.849 1.00 71.43 N ATOM 1848 CA CYS B 249 9.145 0.536 -12.016 1.00 71.10 C ATOM 1849 C CYS B 249 10.484 1.215 -11.719 1.00 51.40 C ATOM 1850 O CYS B 249 11.272 0.745 -10.881 1.00 74.21 O ATOM 1851 CB CYS B 249 7.993 1.123 -11.190 1.00 40.23 C ATOM 1852 SG CYS B 249 7.530 2.792 -11.685 1.00 73.21 S ATOM 0 H CYS B 249 9.901 -1.230 -11.183 1.00 71.43 H new ATOM 0 HA CYS B 249 8.935 0.741 -13.066 1.00 71.10 H new ATOM 0 HB2 CYS B 249 7.124 0.472 -11.280 1.00 40.23 H new ATOM 0 HB3 CYS B 249 8.278 1.131 -10.138 1.00 40.23 H new ATOM 1857 N ASP B 250 10.728 2.289 -12.440 1.00 1.25 N ATOM 1858 CA ASP B 250 11.937 3.085 -12.376 1.00 22.31 C ATOM 1859 C ASP B 250 11.563 4.563 -12.468 1.00 52.33 C ATOM 1860 O ASP B 250 11.043 4.996 -13.476 1.00 34.15 O ATOM 1861 CB ASP B 250 12.825 2.729 -13.570 1.00 71.41 C ATOM 1862 CG ASP B 250 14.131 3.508 -13.628 1.00 24.40 C ATOM 1863 OD1 ASP B 250 15.114 3.112 -12.976 1.00 41.31 O ATOM 1864 OD2 ASP B 250 14.193 4.510 -14.367 1.00 41.33 O ATOM 0 H ASP B 250 10.057 2.648 -13.119 1.00 1.25 H new ATOM 0 HA ASP B 250 12.464 2.889 -11.442 1.00 22.31 H new ATOM 0 HB2 ASP B 250 13.051 1.663 -13.536 1.00 71.41 H new ATOM 0 HB3 ASP B 250 12.267 2.907 -14.489 1.00 71.41 H new ATOM 1869 N PRO B 251 11.814 5.352 -11.430 1.00 4.41 N ATOM 1870 CA PRO B 251 11.489 6.808 -11.401 1.00 65.34 C ATOM 1871 C PRO B 251 12.502 7.649 -12.215 1.00 32.43 C ATOM 1872 O PRO B 251 12.852 8.775 -11.837 1.00 44.42 O ATOM 1873 CB PRO B 251 11.613 7.121 -9.912 1.00 21.20 C ATOM 1874 CG PRO B 251 12.669 6.199 -9.450 1.00 64.44 C ATOM 1875 CD PRO B 251 12.437 4.915 -10.186 1.00 55.33 C ATOM 0 HA PRO B 251 10.518 7.040 -11.839 1.00 65.34 H new ATOM 0 HB2 PRO B 251 11.888 8.162 -9.743 1.00 21.20 H new ATOM 0 HB3 PRO B 251 10.673 6.950 -9.387 1.00 21.20 H new ATOM 0 HG2 PRO B 251 13.660 6.600 -9.664 1.00 64.44 H new ATOM 0 HG3 PRO B 251 12.613 6.048 -8.372 1.00 64.44 H new ATOM 0 HD2 PRO B 251 13.370 4.381 -10.369 1.00 55.33 H new ATOM 0 HD3 PRO B 251 11.789 4.241 -9.626 1.00 55.33 H new