USER MOD reduce.3.24.130724 H: found=0, std=0, add=784, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 787 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 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 73:sc= 0.411 USER MOD Single : A 23 TYR OH : rot 150:sc= 0.785 USER MOD Single : A 24 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0383) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ -132:sc= -0.139 (180deg=-0.687) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.349 USER MOD Single : A 84 SER OG : rot 180:sc= -0.414 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl 152:sc= -0.789 (180deg=-2.37!) USER MOD Single : A 94 GLN : amide:sc= -0.12 X(o=-0.12,f=0) USER MOD Single : A 96 GLN : amide:sc= -0.952 K(o=-0.95,f=-0.021) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.0038) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.0148 USER MOD Single : A 111 TYR OH : rot 180:sc= -0.16 USER MOD Single : A 112 LYS NZ :NH3+ -117:sc= 0 (180deg=-1.46!) USER MOD Single : A 117 ASN : amide:sc= -0.0819 K(o=-0.082,f=-1.7!) USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.715 USER MOD Single : A 128 SER OG : rot -51:sc= 0.00912 USER MOD Single : A 129 SER OG : rot 101:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 LYS NZ :NH3+ 152:sc= -1.21 (180deg=-2.47!) USER MOD Single : A 147 THR OG1 : rot 6:sc= 1.05 USER MOD Single : A 148 ASN : amide:sc= -0.444 K(o=-0.44,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 223 N GLY A 17 2.484 -8.499 -14.851 1.00 0.00 N ATOM 224 CA GLY A 17 3.907 -8.279 -14.666 1.00 0.00 C ATOM 225 C GLY A 17 4.219 -6.877 -14.183 1.00 0.00 C ATOM 226 O GLY A 17 4.799 -6.074 -14.914 1.00 0.00 O ATOM 0 HA2 GLY A 17 4.293 -9.002 -13.947 1.00 0.00 H new ATOM 0 HA3 GLY A 17 4.425 -8.459 -15.608 1.00 0.00 H new ATOM 230 N THR A 18 3.832 -6.579 -12.947 1.00 0.00 N ATOM 231 CA THR A 18 4.071 -5.263 -12.367 1.00 0.00 C ATOM 232 C THR A 18 4.856 -5.371 -11.065 1.00 0.00 C ATOM 233 O THR A 18 4.679 -6.316 -10.296 1.00 0.00 O ATOM 234 CB THR A 18 2.749 -4.519 -12.098 1.00 0.00 C ATOM 235 OG1 THR A 18 2.019 -4.360 -13.318 1.00 0.00 O ATOM 236 CG2 THR A 18 3.013 -3.157 -11.476 1.00 0.00 C ATOM 0 H THR A 18 3.351 -7.232 -12.328 1.00 0.00 H new ATOM 0 HA THR A 18 4.655 -4.698 -13.094 1.00 0.00 H new ATOM 0 HB THR A 18 2.159 -5.112 -11.399 1.00 0.00 H new ATOM 0 HG1 THR A 18 1.179 -3.888 -13.138 1.00 0.00 H new ATOM 0 HG21 THR A 18 2.065 -2.650 -11.295 1.00 0.00 H new ATOM 0 HG22 THR A 18 3.542 -3.285 -10.532 1.00 0.00 H new ATOM 0 HG23 THR A 18 3.621 -2.559 -12.155 1.00 0.00 H new ATOM 244 N THR A 19 5.725 -4.394 -10.821 1.00 0.00 N ATOM 245 CA THR A 19 6.538 -4.379 -9.611 1.00 0.00 C ATOM 246 C THR A 19 6.918 -2.955 -9.223 1.00 0.00 C ATOM 247 O THR A 19 7.171 -2.112 -10.084 1.00 0.00 O ATOM 248 CB THR A 19 7.821 -5.213 -9.786 1.00 0.00 C ATOM 249 OG1 THR A 19 8.813 -4.788 -8.845 1.00 0.00 O ATOM 250 CG2 THR A 19 8.365 -5.078 -11.200 1.00 0.00 C ATOM 0 H THR A 19 5.883 -3.603 -11.445 1.00 0.00 H new ATOM 0 HA THR A 19 5.934 -4.819 -8.818 1.00 0.00 H new ATOM 0 HB THR A 19 7.575 -6.260 -9.607 1.00 0.00 H new ATOM 0 HG1 THR A 19 8.562 -5.089 -7.947 1.00 0.00 H new ATOM 0 HG21 THR A 19 9.271 -5.676 -11.300 1.00 0.00 H new ATOM 0 HG22 THR A 19 7.618 -5.429 -11.912 1.00 0.00 H new ATOM 0 HG23 THR A 19 8.596 -4.032 -11.403 1.00 0.00 H new ATOM 258 N LEU A 20 6.959 -2.693 -7.920 1.00 0.00 N ATOM 259 CA LEU A 20 7.311 -1.370 -7.417 1.00 0.00 C ATOM 260 C LEU A 20 8.722 -1.365 -6.839 1.00 0.00 C ATOM 261 O LEU A 20 9.135 -2.315 -6.175 1.00 0.00 O ATOM 262 CB LEU A 20 6.310 -0.925 -6.350 1.00 0.00 C ATOM 263 CG LEU A 20 6.604 -1.383 -4.921 1.00 0.00 C ATOM 264 CD1 LEU A 20 5.657 -0.710 -3.940 1.00 0.00 C ATOM 265 CD2 LEU A 20 6.499 -2.897 -4.814 1.00 0.00 C ATOM 0 H LEU A 20 6.753 -3.379 -7.194 1.00 0.00 H new ATOM 0 HA LEU A 20 7.277 -0.671 -8.252 1.00 0.00 H new ATOM 0 HB2 LEU A 20 6.261 0.164 -6.358 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.323 -1.291 -6.632 1.00 0.00 H new ATOM 0 HG LEU A 20 7.623 -1.091 -4.668 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.881 -1.048 -2.928 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.782 0.371 -3.997 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.629 -0.970 -4.190 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.711 -3.205 -3.790 1.00 0.00 H new ATOM 0 HD22 LEU A 20 5.492 -3.212 -5.086 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.219 -3.360 -5.489 1.00 0.00 H new ATOM 277 N TRP A 21 9.457 -0.288 -7.096 1.00 0.00 N ATOM 278 CA TRP A 21 10.823 -0.159 -6.599 1.00 0.00 C ATOM 279 C TRP A 21 10.980 1.107 -5.764 1.00 0.00 C ATOM 280 O TRP A 21 10.292 2.103 -5.992 1.00 0.00 O ATOM 281 CB TRP A 21 11.812 -0.142 -7.765 1.00 0.00 C ATOM 282 CG TRP A 21 11.380 -0.990 -8.923 1.00 0.00 C ATOM 283 CD1 TRP A 21 10.865 -2.254 -8.867 1.00 0.00 C ATOM 284 CD2 TRP A 21 11.428 -0.636 -10.310 1.00 0.00 C ATOM 285 NE1 TRP A 21 10.589 -2.706 -10.134 1.00 0.00 N ATOM 286 CE2 TRP A 21 10.925 -1.733 -11.037 1.00 0.00 C ATOM 287 CE3 TRP A 21 11.845 0.501 -11.007 1.00 0.00 C ATOM 288 CZ2 TRP A 21 10.830 -1.723 -12.426 1.00 0.00 C ATOM 289 CZ3 TRP A 21 11.750 0.509 -12.386 1.00 0.00 C ATOM 290 CH2 TRP A 21 11.246 -0.597 -13.083 1.00 0.00 C ATOM 0 H TRP A 21 9.131 0.507 -7.645 1.00 0.00 H new ATOM 0 HA TRP A 21 11.036 -1.019 -5.964 1.00 0.00 H new ATOM 0 HB2 TRP A 21 11.944 0.885 -8.105 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.784 -0.488 -7.413 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.699 -2.815 -7.959 1.00 0.00 H new ATOM 0 HE1 TRP A 21 10.197 -3.619 -10.365 1.00 0.00 H new ATOM 0 HE3 TRP A 21 12.235 1.358 -10.478 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 10.442 -2.574 -12.966 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 12.070 1.382 -12.935 1.00 0.00 H new ATOM 0 HH2 TRP A 21 11.185 -0.560 -14.161 1.00 0.00 H new ATOM 301 N VAL A 22 11.890 1.063 -4.797 1.00 0.00 N ATOM 302 CA VAL A 22 12.138 2.209 -3.929 1.00 0.00 C ATOM 303 C VAL A 22 13.482 2.856 -4.243 1.00 0.00 C ATOM 304 O VAL A 22 14.467 2.167 -4.514 1.00 0.00 O ATOM 305 CB VAL A 22 12.112 1.802 -2.443 1.00 0.00 C ATOM 306 CG1 VAL A 22 13.287 0.893 -2.117 1.00 0.00 C ATOM 307 CG2 VAL A 22 12.121 3.036 -1.554 1.00 0.00 C ATOM 0 H VAL A 22 12.468 0.247 -4.594 1.00 0.00 H new ATOM 0 HA VAL A 22 11.340 2.927 -4.117 1.00 0.00 H new ATOM 0 HB VAL A 22 11.192 1.249 -2.252 1.00 0.00 H new ATOM 0 HG11 VAL A 22 13.252 0.616 -1.063 1.00 0.00 H new ATOM 0 HG12 VAL A 22 13.232 -0.006 -2.730 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.220 1.417 -2.323 1.00 0.00 H new ATOM 0 HG21 VAL A 22 12.102 2.731 -0.508 1.00 0.00 H new ATOM 0 HG22 VAL A 22 13.023 3.617 -1.747 1.00 0.00 H new ATOM 0 HG23 VAL A 22 11.244 3.646 -1.770 1.00 0.00 H new ATOM 317 N TYR A 23 13.517 4.183 -4.206 1.00 0.00 N ATOM 318 CA TYR A 23 14.739 4.924 -4.490 1.00 0.00 C ATOM 319 C TYR A 23 14.983 5.998 -3.434 1.00 0.00 C ATOM 320 O TYR A 23 14.048 6.650 -2.967 1.00 0.00 O ATOM 321 CB TYR A 23 14.663 5.564 -5.876 1.00 0.00 C ATOM 322 CG TYR A 23 13.550 6.579 -6.014 1.00 0.00 C ATOM 323 CD1 TYR A 23 12.227 6.175 -6.138 1.00 0.00 C ATOM 324 CD2 TYR A 23 13.823 7.942 -6.022 1.00 0.00 C ATOM 325 CE1 TYR A 23 11.207 7.099 -6.264 1.00 0.00 C ATOM 326 CE2 TYR A 23 12.810 8.872 -6.146 1.00 0.00 C ATOM 327 CZ TYR A 23 11.504 8.446 -6.268 1.00 0.00 C ATOM 328 OH TYR A 23 10.492 9.369 -6.394 1.00 0.00 O ATOM 0 H TYR A 23 12.712 4.768 -3.982 1.00 0.00 H new ATOM 0 HA TYR A 23 15.572 4.222 -4.467 1.00 0.00 H new ATOM 0 HB2 TYR A 23 15.614 6.048 -6.096 1.00 0.00 H new ATOM 0 HB3 TYR A 23 14.524 4.781 -6.621 1.00 0.00 H new ATOM 0 HD1 TYR A 23 11.991 5.121 -6.136 1.00 0.00 H new ATOM 0 HD2 TYR A 23 14.845 8.279 -5.930 1.00 0.00 H new ATOM 0 HE1 TYR A 23 10.183 6.768 -6.359 1.00 0.00 H new ATOM 0 HE2 TYR A 23 13.039 9.927 -6.147 1.00 0.00 H new ATOM 0 HH TYR A 23 10.740 10.193 -5.924 1.00 0.00 H new ATOM 338 N LYS A 24 16.246 6.178 -3.062 1.00 0.00 N ATOM 339 CA LYS A 24 16.616 7.174 -2.063 1.00 0.00 C ATOM 340 C LYS A 24 17.783 8.026 -2.550 1.00 0.00 C ATOM 341 O LYS A 24 18.857 7.508 -2.854 1.00 0.00 O ATOM 342 CB LYS A 24 16.983 6.491 -0.743 1.00 0.00 C ATOM 343 CG LYS A 24 17.013 7.437 0.444 1.00 0.00 C ATOM 344 CD LYS A 24 17.912 6.915 1.551 1.00 0.00 C ATOM 345 CE LYS A 24 17.939 7.861 2.741 1.00 0.00 C ATOM 346 NZ LYS A 24 16.646 7.858 3.481 1.00 0.00 N ATOM 0 H LYS A 24 17.031 5.647 -3.438 1.00 0.00 H new ATOM 0 HA LYS A 24 15.757 7.826 -1.901 1.00 0.00 H new ATOM 0 HB2 LYS A 24 16.266 5.695 -0.544 1.00 0.00 H new ATOM 0 HB3 LYS A 24 17.961 6.021 -0.847 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.364 8.417 0.121 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.002 7.572 0.828 1.00 0.00 H new ATOM 0 HD2 LYS A 24 17.562 5.934 1.873 1.00 0.00 H new ATOM 0 HD3 LYS A 24 18.924 6.783 1.167 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.745 7.573 3.416 1.00 0.00 H new ATOM 0 HE3 LYS A 24 18.158 8.872 2.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 16.732 8.449 4.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 15.895 8.238 2.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 16.407 6.885 3.758 1.00 0.00 H new ATOM 411 N TYR A 30 13.175 13.549 -7.678 1.00 0.00 N ATOM 412 CA TYR A 30 11.967 13.456 -8.489 1.00 0.00 C ATOM 413 C TYR A 30 12.186 14.081 -9.864 1.00 0.00 C ATOM 414 O TYR A 30 11.550 13.692 -10.843 1.00 0.00 O ATOM 415 CB TYR A 30 10.799 14.146 -7.783 1.00 0.00 C ATOM 416 CG TYR A 30 10.675 13.782 -6.320 1.00 0.00 C ATOM 417 CD1 TYR A 30 10.312 12.498 -5.933 1.00 0.00 C ATOM 418 CD2 TYR A 30 10.920 14.721 -5.326 1.00 0.00 C ATOM 419 CE1 TYR A 30 10.197 12.160 -4.598 1.00 0.00 C ATOM 420 CE2 TYR A 30 10.809 14.392 -3.989 1.00 0.00 C ATOM 421 CZ TYR A 30 10.447 13.111 -3.631 1.00 0.00 C ATOM 422 OH TYR A 30 10.333 12.779 -2.300 1.00 0.00 O ATOM 0 HA TYR A 30 11.729 12.401 -8.623 1.00 0.00 H new ATOM 0 HB2 TYR A 30 10.919 15.226 -7.871 1.00 0.00 H new ATOM 0 HB3 TYR A 30 9.872 13.885 -8.293 1.00 0.00 H new ATOM 0 HD1 TYR A 30 10.116 11.751 -6.688 1.00 0.00 H new ATOM 0 HD2 TYR A 30 11.202 15.726 -5.603 1.00 0.00 H new ATOM 0 HE1 TYR A 30 9.913 11.157 -4.314 1.00 0.00 H new ATOM 0 HE2 TYR A 30 11.005 15.134 -3.229 1.00 0.00 H new ATOM 0 HH TYR A 30 10.544 13.561 -1.749 1.00 0.00 H new ATOM 432 N ALA A 31 13.090 15.053 -9.928 1.00 0.00 N ATOM 433 CA ALA A 31 13.396 15.731 -11.182 1.00 0.00 C ATOM 434 C ALA A 31 13.877 14.742 -12.237 1.00 0.00 C ATOM 435 O ALA A 31 13.595 14.899 -13.424 1.00 0.00 O ATOM 436 CB ALA A 31 14.439 16.814 -10.955 1.00 0.00 C ATOM 0 H ALA A 31 13.623 15.389 -9.126 1.00 0.00 H new ATOM 0 HA ALA A 31 12.481 16.196 -11.549 1.00 0.00 H new ATOM 0 HB1 ALA A 31 14.658 17.312 -11.900 1.00 0.00 H new ATOM 0 HB2 ALA A 31 14.057 17.543 -10.240 1.00 0.00 H new ATOM 0 HB3 ALA A 31 15.351 16.364 -10.562 1.00 0.00 H new ATOM 442 N ASN A 32 14.608 13.722 -11.796 1.00 0.00 N ATOM 443 CA ASN A 32 15.131 12.708 -12.705 1.00 0.00 C ATOM 444 C ASN A 32 15.608 11.482 -11.933 1.00 0.00 C ATOM 445 O ASN A 32 16.805 11.216 -11.819 1.00 0.00 O ATOM 446 CB ASN A 32 16.281 13.281 -13.536 1.00 0.00 C ATOM 447 CG ASN A 32 16.621 12.411 -14.730 1.00 0.00 C ATOM 448 OD1 ASN A 32 15.743 12.028 -15.503 1.00 0.00 O ATOM 449 ND2 ASN A 32 17.901 12.095 -14.887 1.00 0.00 N ATOM 0 H ASN A 32 14.851 13.576 -10.816 1.00 0.00 H new ATOM 0 HA ASN A 32 14.326 12.405 -13.374 1.00 0.00 H new ATOM 0 HB2 ASN A 32 16.013 14.279 -13.882 1.00 0.00 H new ATOM 0 HB3 ASN A 32 17.163 13.388 -12.905 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.190 11.513 -15.673 1.00 0.00 H new ATOM 0 HD22 ASN A 32 18.595 12.435 -14.222 1.00 0.00 H new ATOM 456 N PRO A 33 14.652 10.714 -11.389 1.00 0.00 N ATOM 457 CA PRO A 33 14.950 9.503 -10.620 1.00 0.00 C ATOM 458 C PRO A 33 15.490 8.378 -11.497 1.00 0.00 C ATOM 459 O PRO A 33 16.113 7.438 -11.002 1.00 0.00 O ATOM 460 CB PRO A 33 13.592 9.115 -10.029 1.00 0.00 C ATOM 461 CG PRO A 33 12.590 9.702 -10.963 1.00 0.00 C ATOM 462 CD PRO A 33 13.205 10.971 -11.485 1.00 0.00 C ATOM 0 HA PRO A 33 15.723 9.676 -9.871 1.00 0.00 H new ATOM 0 HB2 PRO A 33 13.484 8.032 -9.962 1.00 0.00 H new ATOM 0 HB3 PRO A 33 13.472 9.510 -9.020 1.00 0.00 H new ATOM 0 HG2 PRO A 33 12.365 9.013 -11.777 1.00 0.00 H new ATOM 0 HG3 PRO A 33 11.650 9.906 -10.450 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.900 11.172 -12.512 1.00 0.00 H new ATOM 0 HD3 PRO A 33 12.910 11.835 -10.890 1.00 0.00 H new ATOM 470 N LEU A 34 15.248 8.481 -12.799 1.00 0.00 N ATOM 471 CA LEU A 34 15.711 7.472 -13.744 1.00 0.00 C ATOM 472 C LEU A 34 17.210 7.233 -13.596 1.00 0.00 C ATOM 473 O LEU A 34 17.686 6.105 -13.721 1.00 0.00 O ATOM 474 CB LEU A 34 15.391 7.902 -15.177 1.00 0.00 C ATOM 475 CG LEU A 34 14.354 7.056 -15.917 1.00 0.00 C ATOM 476 CD1 LEU A 34 12.953 7.370 -15.414 1.00 0.00 C ATOM 477 CD2 LEU A 34 14.448 7.289 -17.418 1.00 0.00 C ATOM 0 H LEU A 34 14.734 9.253 -13.224 1.00 0.00 H new ATOM 0 HA LEU A 34 15.190 6.540 -13.525 1.00 0.00 H new ATOM 0 HB2 LEU A 34 15.040 8.934 -15.155 1.00 0.00 H new ATOM 0 HB3 LEU A 34 16.316 7.892 -15.753 1.00 0.00 H new ATOM 0 HG LEU A 34 14.563 6.005 -15.719 1.00 0.00 H new ATOM 0 HD11 LEU A 34 12.228 6.759 -15.952 1.00 0.00 H new ATOM 0 HD12 LEU A 34 12.892 7.152 -14.348 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.734 8.425 -15.582 1.00 0.00 H new ATOM 0 HD21 LEU A 34 13.703 6.679 -17.928 1.00 0.00 H new ATOM 0 HD22 LEU A 34 14.266 8.341 -17.635 1.00 0.00 H new ATOM 0 HD23 LEU A 34 15.443 7.014 -17.767 1.00 0.00 H new ATOM 489 N SER A 35 17.951 8.304 -13.326 1.00 0.00 N ATOM 490 CA SER A 35 19.397 8.211 -13.161 1.00 0.00 C ATOM 491 C SER A 35 19.760 7.134 -12.143 1.00 0.00 C ATOM 492 O SER A 35 20.751 6.422 -12.304 1.00 0.00 O ATOM 493 CB SER A 35 19.968 9.560 -12.720 1.00 0.00 C ATOM 494 OG SER A 35 21.293 9.419 -12.236 1.00 0.00 O ATOM 0 H SER A 35 17.574 9.245 -13.217 1.00 0.00 H new ATOM 0 HA SER A 35 19.831 7.937 -14.123 1.00 0.00 H new ATOM 0 HB2 SER A 35 19.956 10.255 -13.559 1.00 0.00 H new ATOM 0 HB3 SER A 35 19.337 9.989 -11.942 1.00 0.00 H new ATOM 0 HG SER A 35 21.636 10.295 -11.962 1.00 0.00 H new ATOM 500 N ASP A 36 18.952 7.024 -11.095 1.00 0.00 N ATOM 501 CA ASP A 36 19.186 6.034 -10.051 1.00 0.00 C ATOM 502 C ASP A 36 19.205 4.623 -10.632 1.00 0.00 C ATOM 503 O ASP A 36 18.173 4.099 -11.051 1.00 0.00 O ATOM 504 CB ASP A 36 18.109 6.137 -8.970 1.00 0.00 C ATOM 505 CG ASP A 36 18.165 7.455 -8.222 1.00 0.00 C ATOM 506 OD1 ASP A 36 19.081 8.257 -8.499 1.00 0.00 O ATOM 507 OD2 ASP A 36 17.291 7.686 -7.360 1.00 0.00 O ATOM 0 H ASP A 36 18.129 7.608 -10.946 1.00 0.00 H new ATOM 0 HA ASP A 36 20.160 6.237 -9.605 1.00 0.00 H new ATOM 0 HB2 ASP A 36 17.126 6.024 -9.428 1.00 0.00 H new ATOM 0 HB3 ASP A 36 18.228 5.316 -8.263 1.00 0.00 H new ATOM 512 N VAL A 37 20.386 4.015 -10.656 1.00 0.00 N ATOM 513 CA VAL A 37 20.541 2.665 -11.187 1.00 0.00 C ATOM 514 C VAL A 37 20.738 1.653 -10.064 1.00 0.00 C ATOM 515 O VAL A 37 20.470 0.463 -10.232 1.00 0.00 O ATOM 516 CB VAL A 37 21.732 2.577 -12.158 1.00 0.00 C ATOM 517 CG1 VAL A 37 21.566 3.569 -13.299 1.00 0.00 C ATOM 518 CG2 VAL A 37 23.040 2.817 -11.419 1.00 0.00 C ATOM 0 H VAL A 37 21.250 4.435 -10.314 1.00 0.00 H new ATOM 0 HA VAL A 37 19.624 2.430 -11.728 1.00 0.00 H new ATOM 0 HB VAL A 37 21.759 1.573 -12.582 1.00 0.00 H new ATOM 0 HG11 VAL A 37 22.418 3.492 -13.975 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.649 3.346 -13.844 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.512 4.581 -12.897 1.00 0.00 H new ATOM 0 HG21 VAL A 37 23.872 2.751 -12.121 1.00 0.00 H new ATOM 0 HG22 VAL A 37 23.025 3.808 -10.966 1.00 0.00 H new ATOM 0 HG23 VAL A 37 23.162 2.064 -10.641 1.00 0.00 H new ATOM 528 N ASP A 38 21.208 2.133 -8.917 1.00 0.00 N ATOM 529 CA ASP A 38 21.440 1.270 -7.765 1.00 0.00 C ATOM 530 C ASP A 38 20.228 1.262 -6.840 1.00 0.00 C ATOM 531 O ASP A 38 20.348 0.985 -5.646 1.00 0.00 O ATOM 532 CB ASP A 38 22.680 1.731 -6.998 1.00 0.00 C ATOM 533 CG ASP A 38 23.896 1.874 -7.892 1.00 0.00 C ATOM 534 OD1 ASP A 38 24.392 0.841 -8.388 1.00 0.00 O ATOM 535 OD2 ASP A 38 24.350 3.019 -8.097 1.00 0.00 O ATOM 0 H ASP A 38 21.436 3.115 -8.761 1.00 0.00 H new ATOM 0 HA ASP A 38 21.604 0.255 -8.128 1.00 0.00 H new ATOM 0 HB2 ASP A 38 22.472 2.687 -6.518 1.00 0.00 H new ATOM 0 HB3 ASP A 38 22.899 1.017 -6.204 1.00 0.00 H new ATOM 540 N TRP A 39 19.062 1.567 -7.398 1.00 0.00 N ATOM 541 CA TRP A 39 17.827 1.595 -6.622 1.00 0.00 C ATOM 542 C TRP A 39 17.594 0.261 -5.921 1.00 0.00 C ATOM 543 O TRP A 39 18.359 -0.687 -6.100 1.00 0.00 O ATOM 544 CB TRP A 39 16.639 1.925 -7.527 1.00 0.00 C ATOM 545 CG TRP A 39 16.208 0.773 -8.385 1.00 0.00 C ATOM 546 CD1 TRP A 39 15.273 -0.172 -8.077 1.00 0.00 C ATOM 547 CD2 TRP A 39 16.698 0.447 -9.689 1.00 0.00 C ATOM 548 NE1 TRP A 39 15.152 -1.068 -9.113 1.00 0.00 N ATOM 549 CE2 TRP A 39 16.015 -0.709 -10.114 1.00 0.00 C ATOM 550 CE3 TRP A 39 17.646 1.019 -10.541 1.00 0.00 C ATOM 551 CZ2 TRP A 39 16.251 -1.302 -11.351 1.00 0.00 C ATOM 552 CZ3 TRP A 39 17.881 0.430 -11.770 1.00 0.00 C ATOM 553 CH2 TRP A 39 17.185 -0.720 -12.165 1.00 0.00 C ATOM 0 H TRP A 39 18.946 1.798 -8.385 1.00 0.00 H new ATOM 0 HA TRP A 39 17.922 2.371 -5.862 1.00 0.00 H new ATOM 0 HB2 TRP A 39 15.799 2.244 -6.910 1.00 0.00 H new ATOM 0 HB3 TRP A 39 16.902 2.767 -8.167 1.00 0.00 H new ATOM 0 HD1 TRP A 39 14.711 -0.210 -7.156 1.00 0.00 H new ATOM 0 HE1 TRP A 39 14.522 -1.870 -9.133 1.00 0.00 H new ATOM 0 HE3 TRP A 39 18.186 1.906 -10.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 15.717 -2.189 -11.657 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 18.613 0.863 -12.436 1.00 0.00 H new ATOM 0 HH2 TRP A 39 17.390 -1.156 -13.132 1.00 0.00 H new ATOM 564 N SER A 40 16.532 0.194 -5.125 1.00 0.00 N ATOM 565 CA SER A 40 16.199 -1.025 -4.395 1.00 0.00 C ATOM 566 C SER A 40 14.818 -1.536 -4.792 1.00 0.00 C ATOM 567 O SER A 40 13.913 -0.752 -5.081 1.00 0.00 O ATOM 568 CB SER A 40 16.249 -0.770 -2.888 1.00 0.00 C ATOM 569 OG SER A 40 17.256 -1.552 -2.271 1.00 0.00 O ATOM 0 H SER A 40 15.887 0.969 -4.969 1.00 0.00 H new ATOM 0 HA SER A 40 16.935 -1.787 -4.652 1.00 0.00 H new ATOM 0 HB2 SER A 40 16.440 0.287 -2.701 1.00 0.00 H new ATOM 0 HB3 SER A 40 15.281 -1.003 -2.444 1.00 0.00 H new ATOM 0 HG SER A 40 17.268 -1.369 -1.308 1.00 0.00 H new ATOM 575 N ARG A 41 14.663 -2.856 -4.801 1.00 0.00 N ATOM 576 CA ARG A 41 13.392 -3.473 -5.163 1.00 0.00 C ATOM 577 C ARG A 41 12.675 -4.006 -3.926 1.00 0.00 C ATOM 578 O ARG A 41 13.311 -4.455 -2.972 1.00 0.00 O ATOM 579 CB ARG A 41 13.619 -4.609 -6.163 1.00 0.00 C ATOM 580 CG ARG A 41 14.451 -5.752 -5.607 1.00 0.00 C ATOM 581 CD ARG A 41 15.905 -5.644 -6.038 1.00 0.00 C ATOM 582 NE ARG A 41 16.477 -6.947 -6.369 1.00 0.00 N ATOM 583 CZ ARG A 41 16.230 -7.590 -7.506 1.00 0.00 C ATOM 584 NH1 ARG A 41 15.427 -7.053 -8.414 1.00 0.00 N ATOM 585 NH2 ARG A 41 16.787 -8.773 -7.735 1.00 0.00 N ATOM 0 H ARG A 41 15.401 -3.518 -4.562 1.00 0.00 H new ATOM 0 HA ARG A 41 12.765 -2.711 -5.625 1.00 0.00 H new ATOM 0 HB2 ARG A 41 12.653 -4.997 -6.485 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.112 -4.209 -7.049 1.00 0.00 H new ATOM 0 HG2 ARG A 41 14.392 -5.750 -4.519 1.00 0.00 H new ATOM 0 HG3 ARG A 41 14.039 -6.702 -5.947 1.00 0.00 H new ATOM 0 HD2 ARG A 41 15.978 -4.986 -6.904 1.00 0.00 H new ATOM 0 HD3 ARG A 41 16.487 -5.185 -5.238 1.00 0.00 H new ATOM 0 HE ARG A 41 17.099 -7.387 -5.691 1.00 0.00 H new ATOM 0 HH11 ARG A 41 14.997 -6.144 -8.241 1.00 0.00 H new ATOM 0 HH12 ARG A 41 15.239 -7.548 -9.286 1.00 0.00 H new ATOM 0 HH21 ARG A 41 17.405 -9.189 -7.038 1.00 0.00 H new ATOM 0 HH22 ARG A 41 16.597 -9.266 -8.608 1.00 0.00 H new ATOM 599 N LEU A 42 11.348 -3.952 -3.949 1.00 0.00 N ATOM 600 CA LEU A 42 10.543 -4.428 -2.830 1.00 0.00 C ATOM 601 C LEU A 42 9.978 -5.815 -3.117 1.00 0.00 C ATOM 602 O LEU A 42 10.290 -6.781 -2.421 1.00 0.00 O ATOM 603 CB LEU A 42 9.404 -3.449 -2.542 1.00 0.00 C ATOM 604 CG LEU A 42 9.767 -1.965 -2.583 1.00 0.00 C ATOM 605 CD1 LEU A 42 8.586 -1.114 -2.141 1.00 0.00 C ATOM 606 CD2 LEU A 42 10.983 -1.689 -1.709 1.00 0.00 C ATOM 0 H LEU A 42 10.807 -3.583 -4.731 1.00 0.00 H new ATOM 0 HA LEU A 42 11.187 -4.493 -1.953 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.607 -3.627 -3.264 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.998 -3.676 -1.556 1.00 0.00 H new ATOM 0 HG LEU A 42 10.015 -1.699 -3.611 1.00 0.00 H new ATOM 0 HD11 LEU A 42 8.863 -0.060 -2.177 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.741 -1.290 -2.807 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.306 -1.381 -1.122 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.227 -0.628 -1.750 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.763 -1.971 -0.679 1.00 0.00 H new ATOM 0 HD23 LEU A 42 11.831 -2.271 -2.071 1.00 0.00 H new ATOM 618 N ALA A 43 9.144 -5.907 -4.149 1.00 0.00 N ATOM 619 CA ALA A 43 8.539 -7.176 -4.531 1.00 0.00 C ATOM 620 C ALA A 43 7.660 -7.015 -5.767 1.00 0.00 C ATOM 621 O ALA A 43 7.594 -5.936 -6.358 1.00 0.00 O ATOM 622 CB ALA A 43 7.728 -7.743 -3.376 1.00 0.00 C ATOM 0 H ALA A 43 8.873 -5.117 -4.735 1.00 0.00 H new ATOM 0 HA ALA A 43 9.341 -7.873 -4.775 1.00 0.00 H new ATOM 0 HB1 ALA A 43 7.282 -8.691 -3.676 1.00 0.00 H new ATOM 0 HB2 ALA A 43 8.380 -7.904 -2.518 1.00 0.00 H new ATOM 0 HB3 ALA A 43 6.940 -7.040 -3.105 1.00 0.00 H new ATOM 628 N LYS A 44 6.987 -8.094 -6.154 1.00 0.00 N ATOM 629 CA LYS A 44 6.112 -8.073 -7.320 1.00 0.00 C ATOM 630 C LYS A 44 4.695 -7.667 -6.929 1.00 0.00 C ATOM 631 O LYS A 44 4.114 -8.223 -5.997 1.00 0.00 O ATOM 632 CB LYS A 44 6.094 -9.446 -7.994 1.00 0.00 C ATOM 633 CG LYS A 44 5.530 -10.548 -7.114 1.00 0.00 C ATOM 634 CD LYS A 44 5.921 -11.924 -7.624 1.00 0.00 C ATOM 635 CE LYS A 44 7.247 -12.381 -7.035 1.00 0.00 C ATOM 636 NZ LYS A 44 7.712 -13.660 -7.641 1.00 0.00 N ATOM 0 H LYS A 44 7.031 -8.994 -5.677 1.00 0.00 H new ATOM 0 HA LYS A 44 6.501 -7.336 -8.023 1.00 0.00 H new ATOM 0 HB2 LYS A 44 5.504 -9.385 -8.908 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.110 -9.711 -8.287 1.00 0.00 H new ATOM 0 HG2 LYS A 44 5.892 -10.421 -6.094 1.00 0.00 H new ATOM 0 HG3 LYS A 44 4.444 -10.467 -7.079 1.00 0.00 H new ATOM 0 HD2 LYS A 44 5.142 -12.642 -7.369 1.00 0.00 H new ATOM 0 HD3 LYS A 44 5.993 -11.903 -8.711 1.00 0.00 H new ATOM 0 HE2 LYS A 44 8.000 -11.609 -7.194 1.00 0.00 H new ATOM 0 HE3 LYS A 44 7.142 -12.507 -5.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 8.618 -13.938 -7.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 7.005 -14.403 -7.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 7.837 -13.533 -8.666 1.00 0.00 H new ATOM 650 N VAL A 45 4.142 -6.695 -7.648 1.00 0.00 N ATOM 651 CA VAL A 45 2.791 -6.217 -7.377 1.00 0.00 C ATOM 652 C VAL A 45 1.748 -7.126 -8.018 1.00 0.00 C ATOM 653 O VAL A 45 1.531 -7.083 -9.229 1.00 0.00 O ATOM 654 CB VAL A 45 2.591 -4.780 -7.894 1.00 0.00 C ATOM 655 CG1 VAL A 45 1.289 -4.199 -7.364 1.00 0.00 C ATOM 656 CG2 VAL A 45 3.773 -3.905 -7.504 1.00 0.00 C ATOM 0 H VAL A 45 4.609 -6.223 -8.423 1.00 0.00 H new ATOM 0 HA VAL A 45 2.662 -6.227 -6.295 1.00 0.00 H new ATOM 0 HB VAL A 45 2.532 -4.808 -8.982 1.00 0.00 H new ATOM 0 HG11 VAL A 45 1.164 -3.183 -7.739 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.453 -4.814 -7.698 1.00 0.00 H new ATOM 0 HG13 VAL A 45 1.315 -4.182 -6.274 1.00 0.00 H new ATOM 0 HG21 VAL A 45 3.615 -2.893 -7.877 1.00 0.00 H new ATOM 0 HG22 VAL A 45 3.865 -3.881 -6.418 1.00 0.00 H new ATOM 0 HG23 VAL A 45 4.686 -4.313 -7.937 1.00 0.00 H new ATOM 666 N LYS A 46 1.104 -7.948 -7.197 1.00 0.00 N ATOM 667 CA LYS A 46 0.080 -8.867 -7.681 1.00 0.00 C ATOM 668 C LYS A 46 -1.089 -8.104 -8.295 1.00 0.00 C ATOM 669 O LYS A 46 -1.493 -8.375 -9.427 1.00 0.00 O ATOM 670 CB LYS A 46 -0.419 -9.755 -6.539 1.00 0.00 C ATOM 671 CG LYS A 46 0.270 -11.107 -6.474 1.00 0.00 C ATOM 672 CD LYS A 46 -0.197 -12.026 -7.590 1.00 0.00 C ATOM 673 CE LYS A 46 -1.593 -12.565 -7.320 1.00 0.00 C ATOM 674 NZ LYS A 46 -1.650 -13.344 -6.052 1.00 0.00 N ATOM 0 H LYS A 46 1.273 -7.997 -6.192 1.00 0.00 H new ATOM 0 HA LYS A 46 0.526 -9.495 -8.452 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.269 -9.234 -5.593 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.492 -9.909 -6.652 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.349 -10.970 -6.542 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.068 -11.573 -5.510 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.192 -11.484 -8.536 1.00 0.00 H new ATOM 0 HD3 LYS A 46 0.501 -12.857 -7.695 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -2.299 -11.736 -7.269 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.905 -13.199 -8.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.138 -14.247 -6.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -0.684 -13.530 -5.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.168 -12.800 -5.333 1.00 0.00 H new ATOM 688 N ASP A 47 -1.629 -7.152 -7.544 1.00 0.00 N ATOM 689 CA ASP A 47 -2.750 -6.349 -8.015 1.00 0.00 C ATOM 690 C ASP A 47 -2.582 -4.887 -7.609 1.00 0.00 C ATOM 691 O ASP A 47 -1.689 -4.547 -6.832 1.00 0.00 O ATOM 692 CB ASP A 47 -4.066 -6.896 -7.461 1.00 0.00 C ATOM 693 CG ASP A 47 -5.256 -6.536 -8.329 1.00 0.00 C ATOM 694 OD1 ASP A 47 -5.086 -6.460 -9.564 1.00 0.00 O ATOM 695 OD2 ASP A 47 -6.355 -6.330 -7.774 1.00 0.00 O ATOM 0 H ASP A 47 -1.308 -6.917 -6.605 1.00 0.00 H new ATOM 0 HA ASP A 47 -2.771 -6.405 -9.103 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -3.998 -7.980 -7.376 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -4.223 -6.506 -6.455 1.00 0.00 H new ATOM 700 N LEU A 48 -3.444 -4.028 -8.140 1.00 0.00 N ATOM 701 CA LEU A 48 -3.391 -2.602 -7.833 1.00 0.00 C ATOM 702 C LEU A 48 -4.787 -1.992 -7.836 1.00 0.00 C ATOM 703 O LEU A 48 -5.523 -2.099 -8.819 1.00 0.00 O ATOM 704 CB LEU A 48 -2.502 -1.876 -8.845 1.00 0.00 C ATOM 705 CG LEU A 48 -2.151 -0.426 -8.510 1.00 0.00 C ATOM 706 CD1 LEU A 48 -3.332 0.489 -8.798 1.00 0.00 C ATOM 707 CD2 LEU A 48 -1.719 -0.303 -7.057 1.00 0.00 C ATOM 0 H LEU A 48 -4.188 -4.293 -8.785 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.967 -2.485 -6.836 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.574 -2.438 -8.953 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -3.000 -1.894 -9.815 1.00 0.00 H new ATOM 0 HG LEU A 48 -1.318 -0.119 -9.142 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -3.064 1.517 -8.554 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -3.594 0.424 -9.854 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -4.185 0.183 -8.193 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -1.473 0.736 -6.837 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -2.531 -0.629 -6.407 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.843 -0.928 -6.884 1.00 0.00 H new ATOM 719 N THR A 49 -5.149 -1.348 -6.731 1.00 0.00 N ATOM 720 CA THR A 49 -6.458 -0.718 -6.607 1.00 0.00 C ATOM 721 C THR A 49 -6.345 0.800 -6.659 1.00 0.00 C ATOM 722 O THR A 49 -6.149 1.468 -5.643 1.00 0.00 O ATOM 723 CB THR A 49 -7.154 -1.126 -5.293 1.00 0.00 C ATOM 724 OG1 THR A 49 -7.361 -2.541 -5.267 1.00 0.00 O ATOM 725 CG2 THR A 49 -8.489 -0.410 -5.144 1.00 0.00 C ATOM 0 H THR A 49 -4.554 -1.249 -5.909 1.00 0.00 H new ATOM 0 HA THR A 49 -7.057 -1.063 -7.450 1.00 0.00 H new ATOM 0 HB THR A 49 -6.510 -0.839 -4.462 1.00 0.00 H new ATOM 0 HG1 THR A 49 -7.802 -2.792 -4.428 1.00 0.00 H new ATOM 0 HG21 THR A 49 -8.962 -0.713 -4.210 1.00 0.00 H new ATOM 0 HG22 THR A 49 -8.325 0.668 -5.135 1.00 0.00 H new ATOM 0 HG23 THR A 49 -9.137 -0.671 -5.981 1.00 0.00 H new ATOM 733 N PRO A 50 -6.472 1.362 -7.871 1.00 0.00 N ATOM 734 CA PRO A 50 -6.388 2.810 -8.084 1.00 0.00 C ATOM 735 C PRO A 50 -7.589 3.552 -7.507 1.00 0.00 C ATOM 736 O PRO A 50 -8.510 3.922 -8.233 1.00 0.00 O ATOM 737 CB PRO A 50 -6.360 2.943 -9.609 1.00 0.00 C ATOM 738 CG PRO A 50 -7.040 1.714 -10.108 1.00 0.00 C ATOM 739 CD PRO A 50 -6.706 0.627 -9.124 1.00 0.00 C ATOM 0 HA PRO A 50 -5.520 3.245 -7.588 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -6.879 3.844 -9.938 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -5.338 3.009 -9.982 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -8.118 1.864 -10.173 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -6.693 1.455 -11.108 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -7.522 -0.089 -9.024 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -5.824 0.064 -9.431 1.00 0.00 H new ATOM 747 N GLY A 51 -7.572 3.765 -6.195 1.00 0.00 N ATOM 748 CA GLY A 51 -8.666 4.462 -5.543 1.00 0.00 C ATOM 749 C GLY A 51 -8.711 5.934 -5.900 1.00 0.00 C ATOM 750 O GLY A 51 -7.751 6.666 -5.666 1.00 0.00 O ATOM 0 H GLY A 51 -6.821 3.468 -5.572 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -9.610 3.994 -5.824 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -8.567 4.356 -4.463 1.00 0.00 H new ATOM 1139 N SER A 79 -0.356 15.199 1.356 1.00 0.00 N ATOM 1140 CA SER A 79 -0.415 13.821 1.827 1.00 0.00 C ATOM 1141 C SER A 79 -1.836 13.274 1.729 1.00 0.00 C ATOM 1142 O SER A 79 -2.571 13.244 2.716 1.00 0.00 O ATOM 1143 CB SER A 79 0.078 13.732 3.272 1.00 0.00 C ATOM 1144 OG SER A 79 1.478 13.517 3.320 1.00 0.00 O ATOM 0 HA SER A 79 0.233 13.218 1.191 1.00 0.00 H new ATOM 0 HB2 SER A 79 -0.170 14.652 3.802 1.00 0.00 H new ATOM 0 HB3 SER A 79 -0.436 12.919 3.786 1.00 0.00 H new ATOM 0 HG SER A 79 1.769 13.465 4.254 1.00 0.00 H new ATOM 1150 N ALA A 80 -2.216 12.841 0.530 1.00 0.00 N ATOM 1151 CA ALA A 80 -3.547 12.293 0.303 1.00 0.00 C ATOM 1152 C ALA A 80 -3.587 11.462 -0.976 1.00 0.00 C ATOM 1153 O ALA A 80 -2.902 11.771 -1.951 1.00 0.00 O ATOM 1154 CB ALA A 80 -4.575 13.412 0.239 1.00 0.00 C ATOM 0 H ALA A 80 -1.620 12.860 -0.298 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.791 11.638 1.140 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -5.565 12.988 0.069 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.573 13.962 1.180 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -4.325 14.089 -0.578 1.00 0.00 H new ATOM 1160 N GLY A 81 -4.393 10.405 -0.964 1.00 0.00 N ATOM 1161 CA GLY A 81 -4.506 9.546 -2.128 1.00 0.00 C ATOM 1162 C GLY A 81 -3.988 8.145 -1.868 1.00 0.00 C ATOM 1163 O GLY A 81 -3.123 7.651 -2.591 1.00 0.00 O ATOM 0 H GLY A 81 -4.970 10.128 -0.169 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.550 9.492 -2.436 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -3.951 9.987 -2.956 1.00 0.00 H new ATOM 1167 N ASP A 82 -4.517 7.504 -0.832 1.00 0.00 N ATOM 1168 CA ASP A 82 -4.102 6.152 -0.477 1.00 0.00 C ATOM 1169 C ASP A 82 -4.178 5.225 -1.686 1.00 0.00 C ATOM 1170 O ASP A 82 -4.806 5.551 -2.694 1.00 0.00 O ATOM 1171 CB ASP A 82 -4.977 5.607 0.654 1.00 0.00 C ATOM 1172 CG ASP A 82 -6.448 5.909 0.444 1.00 0.00 C ATOM 1173 OD1 ASP A 82 -6.982 5.541 -0.623 1.00 0.00 O ATOM 1174 OD2 ASP A 82 -7.064 6.513 1.347 1.00 0.00 O ATOM 0 H ASP A 82 -5.234 7.899 -0.223 1.00 0.00 H new ATOM 0 HA ASP A 82 -3.067 6.194 -0.138 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -4.838 4.529 0.730 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -4.652 6.038 1.601 1.00 0.00 H new ATOM 1179 N THR A 83 -3.532 4.068 -1.580 1.00 0.00 N ATOM 1180 CA THR A 83 -3.523 3.095 -2.666 1.00 0.00 C ATOM 1181 C THR A 83 -3.274 1.687 -2.139 1.00 0.00 C ATOM 1182 O THR A 83 -2.264 1.428 -1.483 1.00 0.00 O ATOM 1183 CB THR A 83 -2.450 3.435 -3.717 1.00 0.00 C ATOM 1184 OG1 THR A 83 -2.468 4.840 -3.997 1.00 0.00 O ATOM 1185 CG2 THR A 83 -2.684 2.654 -5.002 1.00 0.00 C ATOM 0 H THR A 83 -3.008 3.782 -0.753 1.00 0.00 H new ATOM 0 HA THR A 83 -4.506 3.136 -3.136 1.00 0.00 H new ATOM 0 HB THR A 83 -1.476 3.157 -3.314 1.00 0.00 H new ATOM 0 HG1 THR A 83 -1.782 5.049 -4.665 1.00 0.00 H new ATOM 0 HG21 THR A 83 -1.914 2.911 -5.729 1.00 0.00 H new ATOM 0 HG22 THR A 83 -2.642 1.585 -4.791 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.664 2.906 -5.407 1.00 0.00 H new ATOM 1193 N SER A 84 -4.199 0.777 -2.431 1.00 0.00 N ATOM 1194 CA SER A 84 -4.079 -0.605 -1.984 1.00 0.00 C ATOM 1195 C SER A 84 -3.556 -1.495 -3.107 1.00 0.00 C ATOM 1196 O SER A 84 -3.986 -1.386 -4.255 1.00 0.00 O ATOM 1197 CB SER A 84 -5.434 -1.124 -1.496 1.00 0.00 C ATOM 1198 OG SER A 84 -5.272 -2.063 -0.447 1.00 0.00 O ATOM 0 H SER A 84 -5.039 0.973 -2.975 1.00 0.00 H new ATOM 0 HA SER A 84 -3.367 -0.634 -1.159 1.00 0.00 H new ATOM 0 HB2 SER A 84 -6.044 -0.289 -1.150 1.00 0.00 H new ATOM 0 HB3 SER A 84 -5.969 -1.588 -2.324 1.00 0.00 H new ATOM 0 HG SER A 84 -6.152 -2.378 -0.151 1.00 0.00 H new ATOM 1204 N PHE A 85 -2.622 -2.379 -2.766 1.00 0.00 N ATOM 1205 CA PHE A 85 -2.038 -3.289 -3.744 1.00 0.00 C ATOM 1206 C PHE A 85 -1.662 -4.617 -3.093 1.00 0.00 C ATOM 1207 O PHE A 85 -1.446 -4.691 -1.883 1.00 0.00 O ATOM 1208 CB PHE A 85 -0.804 -2.655 -4.387 1.00 0.00 C ATOM 1209 CG PHE A 85 0.029 -1.854 -3.427 1.00 0.00 C ATOM 1210 CD1 PHE A 85 -0.260 -0.521 -3.184 1.00 0.00 C ATOM 1211 CD2 PHE A 85 1.099 -2.434 -2.767 1.00 0.00 C ATOM 1212 CE1 PHE A 85 0.505 0.218 -2.302 1.00 0.00 C ATOM 1213 CE2 PHE A 85 1.868 -1.701 -1.883 1.00 0.00 C ATOM 1214 CZ PHE A 85 1.570 -0.373 -1.650 1.00 0.00 C ATOM 0 H PHE A 85 -2.254 -2.484 -1.820 1.00 0.00 H new ATOM 0 HA PHE A 85 -2.783 -3.481 -4.516 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.187 -3.441 -4.822 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -1.122 -2.009 -5.206 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -1.092 -0.054 -3.690 1.00 0.00 H new ATOM 0 HD2 PHE A 85 1.336 -3.473 -2.945 1.00 0.00 H new ATOM 0 HE1 PHE A 85 0.271 1.257 -2.122 1.00 0.00 H new ATOM 0 HE2 PHE A 85 2.700 -2.166 -1.375 1.00 0.00 H new ATOM 0 HZ PHE A 85 2.168 0.203 -0.959 1.00 0.00 H new ATOM 1224 N THR A 86 -1.583 -5.666 -3.906 1.00 0.00 N ATOM 1225 CA THR A 86 -1.234 -6.992 -3.412 1.00 0.00 C ATOM 1226 C THR A 86 0.239 -7.298 -3.654 1.00 0.00 C ATOM 1227 O THR A 86 0.808 -6.901 -4.672 1.00 0.00 O ATOM 1228 CB THR A 86 -2.090 -8.084 -4.080 1.00 0.00 C ATOM 1229 OG1 THR A 86 -3.482 -7.784 -3.918 1.00 0.00 O ATOM 1230 CG2 THR A 86 -1.788 -9.450 -3.483 1.00 0.00 C ATOM 0 H THR A 86 -1.756 -5.623 -4.910 1.00 0.00 H new ATOM 0 HA THR A 86 -1.431 -6.992 -2.340 1.00 0.00 H new ATOM 0 HB THR A 86 -1.845 -8.107 -5.142 1.00 0.00 H new ATOM 0 HG1 THR A 86 -4.019 -8.482 -4.347 1.00 0.00 H new ATOM 0 HG21 THR A 86 -2.405 -10.205 -3.971 1.00 0.00 H new ATOM 0 HG22 THR A 86 -0.735 -9.688 -3.634 1.00 0.00 H new ATOM 0 HG23 THR A 86 -2.007 -9.437 -2.415 1.00 0.00 H new ATOM 1238 N LEU A 87 0.853 -8.007 -2.713 1.00 0.00 N ATOM 1239 CA LEU A 87 2.262 -8.369 -2.824 1.00 0.00 C ATOM 1240 C LEU A 87 2.505 -9.780 -2.299 1.00 0.00 C ATOM 1241 O LEU A 87 2.017 -10.149 -1.231 1.00 0.00 O ATOM 1242 CB LEU A 87 3.127 -7.369 -2.054 1.00 0.00 C ATOM 1243 CG LEU A 87 2.976 -5.902 -2.455 1.00 0.00 C ATOM 1244 CD1 LEU A 87 3.706 -5.001 -1.471 1.00 0.00 C ATOM 1245 CD2 LEU A 87 3.495 -5.680 -3.869 1.00 0.00 C ATOM 0 H LEU A 87 0.397 -8.343 -1.864 1.00 0.00 H new ATOM 0 HA LEU A 87 2.537 -8.342 -3.878 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.895 -7.460 -0.993 1.00 0.00 H new ATOM 0 HB3 LEU A 87 4.172 -7.653 -2.178 1.00 0.00 H new ATOM 0 HG LEU A 87 1.917 -5.647 -2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 87 3.587 -3.960 -1.773 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.289 -5.139 -0.473 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.765 -5.257 -1.460 1.00 0.00 H new ATOM 0 HD21 LEU A 87 3.380 -4.630 -4.138 1.00 0.00 H new ATOM 0 HD22 LEU A 87 4.549 -5.953 -3.917 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.928 -6.298 -4.566 1.00 0.00 H new ATOM 1257 N ALA A 88 3.265 -10.565 -3.056 1.00 0.00 N ATOM 1258 CA ALA A 88 3.577 -11.933 -2.666 1.00 0.00 C ATOM 1259 C ALA A 88 5.082 -12.182 -2.691 1.00 0.00 C ATOM 1260 O ALA A 88 5.852 -11.338 -3.147 1.00 0.00 O ATOM 1261 CB ALA A 88 2.863 -12.919 -3.578 1.00 0.00 C ATOM 0 H ALA A 88 3.676 -10.276 -3.944 1.00 0.00 H new ATOM 0 HA ALA A 88 3.227 -12.081 -1.644 1.00 0.00 H new ATOM 0 HB1 ALA A 88 3.106 -13.937 -3.274 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.786 -12.766 -3.507 1.00 0.00 H new ATOM 0 HB3 ALA A 88 3.185 -12.761 -4.607 1.00 0.00 H new ATOM 1267 N TRP A 89 5.493 -13.345 -2.197 1.00 0.00 N ATOM 1268 CA TRP A 89 6.906 -13.704 -2.163 1.00 0.00 C ATOM 1269 C TRP A 89 7.091 -15.204 -2.363 1.00 0.00 C ATOM 1270 O TRP A 89 6.496 -16.012 -1.651 1.00 0.00 O ATOM 1271 CB TRP A 89 7.531 -13.273 -0.834 1.00 0.00 C ATOM 1272 CG TRP A 89 7.863 -11.813 -0.780 1.00 0.00 C ATOM 1273 CD1 TRP A 89 8.999 -11.214 -1.247 1.00 0.00 C ATOM 1274 CD2 TRP A 89 7.054 -10.769 -0.228 1.00 0.00 C ATOM 1275 NE1 TRP A 89 8.944 -9.860 -1.018 1.00 0.00 N ATOM 1276 CE2 TRP A 89 7.760 -9.562 -0.394 1.00 0.00 C ATOM 1277 CE3 TRP A 89 5.800 -10.737 0.389 1.00 0.00 C ATOM 1278 CZ2 TRP A 89 7.255 -8.338 0.036 1.00 0.00 C ATOM 1279 CZ3 TRP A 89 5.300 -9.521 0.816 1.00 0.00 C ATOM 1280 CH2 TRP A 89 6.025 -8.337 0.638 1.00 0.00 C ATOM 0 H TRP A 89 4.868 -14.055 -1.815 1.00 0.00 H new ATOM 0 HA TRP A 89 7.408 -13.183 -2.978 1.00 0.00 H new ATOM 0 HB2 TRP A 89 6.843 -13.512 -0.023 1.00 0.00 H new ATOM 0 HB3 TRP A 89 8.439 -13.851 -0.663 1.00 0.00 H new ATOM 0 HD1 TRP A 89 9.819 -11.729 -1.725 1.00 0.00 H new ATOM 0 HE1 TRP A 89 9.667 -9.186 -1.271 1.00 0.00 H new ATOM 0 HE3 TRP A 89 5.233 -11.645 0.529 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 7.813 -7.423 -0.100 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 4.333 -9.484 1.295 1.00 0.00 H new ATOM 0 HH2 TRP A 89 5.606 -7.403 0.983 1.00 0.00 H new ATOM 1291 N MET A 90 7.920 -15.569 -3.336 1.00 0.00 N ATOM 1292 CA MET A 90 8.185 -16.972 -3.628 1.00 0.00 C ATOM 1293 C MET A 90 9.399 -17.471 -2.849 1.00 0.00 C ATOM 1294 O MET A 90 10.228 -16.691 -2.380 1.00 0.00 O ATOM 1295 CB MET A 90 8.411 -17.170 -5.128 1.00 0.00 C ATOM 1296 CG MET A 90 7.138 -17.492 -5.896 1.00 0.00 C ATOM 1297 SD MET A 90 7.454 -18.449 -7.391 1.00 0.00 S ATOM 1298 CE MET A 90 7.554 -20.106 -6.717 1.00 0.00 C ATOM 0 H MET A 90 8.420 -14.912 -3.935 1.00 0.00 H new ATOM 0 HA MET A 90 7.315 -17.551 -3.320 1.00 0.00 H new ATOM 0 HB2 MET A 90 8.857 -16.266 -5.543 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.129 -17.977 -5.276 1.00 0.00 H new ATOM 0 HG2 MET A 90 6.459 -18.048 -5.250 1.00 0.00 H new ATOM 0 HG3 MET A 90 6.634 -16.563 -6.163 1.00 0.00 H new ATOM 0 HE1 MET A 90 7.252 -20.827 -7.477 1.00 0.00 H new ATOM 0 HE2 MET A 90 8.579 -20.312 -6.409 1.00 0.00 H new ATOM 0 HE3 MET A 90 6.892 -20.189 -5.855 1.00 0.00 H new ATOM 1308 N PRO A 91 9.507 -18.800 -2.707 1.00 0.00 N ATOM 1309 CA PRO A 91 10.617 -19.431 -1.987 1.00 0.00 C ATOM 1310 C PRO A 91 11.940 -19.305 -2.734 1.00 0.00 C ATOM 1311 O PRO A 91 12.065 -19.747 -3.874 1.00 0.00 O ATOM 1312 CB PRO A 91 10.192 -20.899 -1.897 1.00 0.00 C ATOM 1313 CG PRO A 91 9.272 -21.098 -3.051 1.00 0.00 C ATOM 1314 CD PRO A 91 8.556 -19.789 -3.240 1.00 0.00 C ATOM 0 HA PRO A 91 10.792 -18.963 -1.018 1.00 0.00 H new ATOM 0 HB2 PRO A 91 11.053 -21.565 -1.958 1.00 0.00 H new ATOM 0 HB3 PRO A 91 9.692 -21.109 -0.951 1.00 0.00 H new ATOM 0 HG2 PRO A 91 9.826 -21.373 -3.949 1.00 0.00 H new ATOM 0 HG3 PRO A 91 8.566 -21.904 -2.853 1.00 0.00 H new ATOM 0 HD2 PRO A 91 8.329 -19.603 -4.290 1.00 0.00 H new ATOM 0 HD3 PRO A 91 7.609 -19.767 -2.700 1.00 0.00 H new ATOM 1322 N GLY A 92 12.926 -18.696 -2.082 1.00 0.00 N ATOM 1323 CA GLY A 92 14.228 -18.521 -2.700 1.00 0.00 C ATOM 1324 C GLY A 92 14.568 -17.064 -2.936 1.00 0.00 C ATOM 1325 O GLY A 92 15.544 -16.750 -3.616 1.00 0.00 O ATOM 0 H GLY A 92 12.846 -18.321 -1.137 1.00 0.00 H new ATOM 0 HA2 GLY A 92 14.991 -18.970 -2.065 1.00 0.00 H new ATOM 0 HA3 GLY A 92 14.250 -19.054 -3.650 1.00 0.00 H new ATOM 1329 N GLU A 93 13.760 -16.170 -2.373 1.00 0.00 N ATOM 1330 CA GLU A 93 13.979 -14.737 -2.529 1.00 0.00 C ATOM 1331 C GLU A 93 13.650 -13.994 -1.237 1.00 0.00 C ATOM 1332 O GLU A 93 13.265 -14.603 -0.239 1.00 0.00 O ATOM 1333 CB GLU A 93 13.129 -14.190 -3.676 1.00 0.00 C ATOM 1334 CG GLU A 93 13.431 -14.835 -5.019 1.00 0.00 C ATOM 1335 CD GLU A 93 14.789 -14.440 -5.564 1.00 0.00 C ATOM 1336 OE1 GLU A 93 15.102 -13.230 -5.555 1.00 0.00 O ATOM 1337 OE2 GLU A 93 15.540 -15.338 -5.999 1.00 0.00 O ATOM 0 H GLU A 93 12.948 -16.413 -1.805 1.00 0.00 H new ATOM 0 HA GLU A 93 15.032 -14.579 -2.761 1.00 0.00 H new ATOM 0 HB2 GLU A 93 12.075 -14.339 -3.440 1.00 0.00 H new ATOM 0 HB3 GLU A 93 13.289 -13.115 -3.755 1.00 0.00 H new ATOM 0 HG2 GLU A 93 13.387 -15.919 -4.915 1.00 0.00 H new ATOM 0 HG3 GLU A 93 12.660 -14.552 -5.735 1.00 0.00 H new ATOM 1344 N GLN A 94 13.804 -12.674 -1.266 1.00 0.00 N ATOM 1345 CA GLN A 94 13.524 -11.847 -0.099 1.00 0.00 C ATOM 1346 C GLN A 94 12.920 -10.508 -0.511 1.00 0.00 C ATOM 1347 O GLN A 94 12.815 -10.203 -1.698 1.00 0.00 O ATOM 1348 CB GLN A 94 14.803 -11.616 0.708 1.00 0.00 C ATOM 1349 CG GLN A 94 15.408 -12.893 1.266 1.00 0.00 C ATOM 1350 CD GLN A 94 16.743 -12.658 1.946 1.00 0.00 C ATOM 1351 OE1 GLN A 94 16.930 -13.010 3.111 1.00 0.00 O ATOM 1352 NE2 GLN A 94 17.680 -12.060 1.219 1.00 0.00 N ATOM 0 H GLN A 94 14.121 -12.155 -2.085 1.00 0.00 H new ATOM 0 HA GLN A 94 12.801 -12.375 0.523 1.00 0.00 H new ATOM 0 HB2 GLN A 94 15.539 -11.122 0.074 1.00 0.00 H new ATOM 0 HB3 GLN A 94 14.585 -10.937 1.532 1.00 0.00 H new ATOM 0 HG2 GLN A 94 14.714 -13.337 1.980 1.00 0.00 H new ATOM 0 HG3 GLN A 94 15.538 -13.612 0.458 1.00 0.00 H new ATOM 0 HE21 GLN A 94 17.481 -11.785 0.257 1.00 0.00 H new ATOM 0 HE22 GLN A 94 18.598 -11.876 1.623 1.00 0.00 H new ATOM 1361 N GLY A 95 12.524 -9.713 0.478 1.00 0.00 N ATOM 1362 CA GLY A 95 11.935 -8.417 0.197 1.00 0.00 C ATOM 1363 C GLY A 95 11.026 -7.938 1.312 1.00 0.00 C ATOM 1364 O GLY A 95 10.753 -6.744 1.429 1.00 0.00 O ATOM 0 H GLY A 95 12.601 -9.943 1.469 1.00 0.00 H new ATOM 0 HA2 GLY A 95 12.729 -7.687 0.041 1.00 0.00 H new ATOM 0 HA3 GLY A 95 11.367 -8.473 -0.732 1.00 0.00 H new ATOM 1368 N GLN A 96 10.555 -8.874 2.131 1.00 0.00 N ATOM 1369 CA GLN A 96 9.669 -8.541 3.241 1.00 0.00 C ATOM 1370 C GLN A 96 10.307 -7.500 4.154 1.00 0.00 C ATOM 1371 O GLN A 96 9.617 -6.659 4.729 1.00 0.00 O ATOM 1372 CB GLN A 96 9.327 -9.798 4.041 1.00 0.00 C ATOM 1373 CG GLN A 96 8.772 -10.930 3.191 1.00 0.00 C ATOM 1374 CD GLN A 96 8.358 -12.132 4.017 1.00 0.00 C ATOM 1375 OE1 GLN A 96 9.164 -12.698 4.757 1.00 0.00 O ATOM 1376 NE2 GLN A 96 7.097 -12.528 3.894 1.00 0.00 N ATOM 0 H GLN A 96 10.772 -9.867 2.047 1.00 0.00 H new ATOM 0 HA GLN A 96 8.752 -8.121 2.828 1.00 0.00 H new ATOM 0 HB2 GLN A 96 10.223 -10.146 4.554 1.00 0.00 H new ATOM 0 HB3 GLN A 96 8.598 -9.542 4.810 1.00 0.00 H new ATOM 0 HG2 GLN A 96 7.912 -10.568 2.627 1.00 0.00 H new ATOM 0 HG3 GLN A 96 9.524 -11.236 2.464 1.00 0.00 H new ATOM 0 HE21 GLN A 96 6.464 -12.029 3.269 1.00 0.00 H new ATOM 0 HE22 GLN A 96 6.761 -13.332 4.425 1.00 0.00 H new ATOM 1385 N GLN A 97 11.629 -7.563 4.281 1.00 0.00 N ATOM 1386 CA GLN A 97 12.360 -6.625 5.126 1.00 0.00 C ATOM 1387 C GLN A 97 11.996 -5.185 4.781 1.00 0.00 C ATOM 1388 O GLN A 97 11.762 -4.364 5.668 1.00 0.00 O ATOM 1389 CB GLN A 97 13.867 -6.835 4.971 1.00 0.00 C ATOM 1390 CG GLN A 97 14.335 -6.836 3.525 1.00 0.00 C ATOM 1391 CD GLN A 97 15.805 -7.183 3.388 1.00 0.00 C ATOM 1392 OE1 GLN A 97 16.251 -8.236 3.843 1.00 0.00 O ATOM 1393 NE2 GLN A 97 16.566 -6.296 2.759 1.00 0.00 N ATOM 0 H GLN A 97 12.215 -8.253 3.810 1.00 0.00 H new ATOM 0 HA GLN A 97 12.079 -6.813 6.162 1.00 0.00 H new ATOM 0 HB2 GLN A 97 14.393 -6.049 5.514 1.00 0.00 H new ATOM 0 HB3 GLN A 97 14.143 -7.782 5.434 1.00 0.00 H new ATOM 0 HG2 GLN A 97 13.742 -7.552 2.956 1.00 0.00 H new ATOM 0 HG3 GLN A 97 14.155 -5.854 3.088 1.00 0.00 H new ATOM 0 HE21 GLN A 97 16.154 -5.436 2.398 1.00 0.00 H new ATOM 0 HE22 GLN A 97 17.563 -6.475 2.637 1.00 0.00 H new ATOM 1402 N ALA A 98 11.952 -4.884 3.487 1.00 0.00 N ATOM 1403 CA ALA A 98 11.615 -3.543 3.026 1.00 0.00 C ATOM 1404 C ALA A 98 10.261 -3.099 3.568 1.00 0.00 C ATOM 1405 O ALA A 98 10.118 -1.986 4.075 1.00 0.00 O ATOM 1406 CB ALA A 98 11.620 -3.492 1.505 1.00 0.00 C ATOM 0 H ALA A 98 12.146 -5.551 2.740 1.00 0.00 H new ATOM 0 HA ALA A 98 12.371 -2.855 3.405 1.00 0.00 H new ATOM 0 HB1 ALA A 98 11.367 -2.485 1.174 1.00 0.00 H new ATOM 0 HB2 ALA A 98 12.611 -3.757 1.135 1.00 0.00 H new ATOM 0 HB3 ALA A 98 10.886 -4.197 1.115 1.00 0.00 H new ATOM 1412 N LEU A 99 9.269 -3.976 3.457 1.00 0.00 N ATOM 1413 CA LEU A 99 7.925 -3.674 3.936 1.00 0.00 C ATOM 1414 C LEU A 99 7.928 -3.401 5.437 1.00 0.00 C ATOM 1415 O LEU A 99 7.420 -2.378 5.893 1.00 0.00 O ATOM 1416 CB LEU A 99 6.977 -4.833 3.620 1.00 0.00 C ATOM 1417 CG LEU A 99 6.449 -4.896 2.186 1.00 0.00 C ATOM 1418 CD1 LEU A 99 5.718 -3.612 1.830 1.00 0.00 C ATOM 1419 CD2 LEU A 99 7.587 -5.154 1.209 1.00 0.00 C ATOM 0 H LEU A 99 9.370 -4.901 3.040 1.00 0.00 H new ATOM 0 HA LEU A 99 7.578 -2.777 3.423 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.493 -5.768 3.837 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.125 -4.774 4.297 1.00 0.00 H new ATOM 0 HG LEU A 99 5.743 -5.723 2.115 1.00 0.00 H new ATOM 0 HD11 LEU A 99 5.349 -3.675 0.806 1.00 0.00 H new ATOM 0 HD12 LEU A 99 4.878 -3.471 2.510 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.402 -2.768 1.918 1.00 0.00 H new ATOM 0 HD21 LEU A 99 7.193 -5.196 0.194 1.00 0.00 H new ATOM 0 HD22 LEU A 99 8.318 -4.349 1.281 1.00 0.00 H new ATOM 0 HD23 LEU A 99 8.066 -6.102 1.451 1.00 0.00 H new ATOM 1431 N LEU A 100 8.509 -4.323 6.198 1.00 0.00 N ATOM 1432 CA LEU A 100 8.583 -4.181 7.648 1.00 0.00 C ATOM 1433 C LEU A 100 9.158 -2.822 8.034 1.00 0.00 C ATOM 1434 O LEU A 100 8.580 -2.099 8.846 1.00 0.00 O ATOM 1435 CB LEU A 100 9.439 -5.298 8.247 1.00 0.00 C ATOM 1436 CG LEU A 100 9.161 -5.645 9.710 1.00 0.00 C ATOM 1437 CD1 LEU A 100 9.489 -7.105 9.983 1.00 0.00 C ATOM 1438 CD2 LEU A 100 9.957 -4.735 10.634 1.00 0.00 C ATOM 0 H LEU A 100 8.935 -5.176 5.835 1.00 0.00 H new ATOM 0 HA LEU A 100 7.571 -4.253 8.047 1.00 0.00 H new ATOM 0 HB2 LEU A 100 9.298 -6.198 7.648 1.00 0.00 H new ATOM 0 HB3 LEU A 100 10.487 -5.014 8.154 1.00 0.00 H new ATOM 0 HG LEU A 100 8.100 -5.490 9.906 1.00 0.00 H new ATOM 0 HD11 LEU A 100 9.285 -7.334 11.029 1.00 0.00 H new ATOM 0 HD12 LEU A 100 8.875 -7.741 9.346 1.00 0.00 H new ATOM 0 HD13 LEU A 100 10.542 -7.287 9.770 1.00 0.00 H new ATOM 0 HD21 LEU A 100 9.747 -4.996 11.671 1.00 0.00 H new ATOM 0 HD22 LEU A 100 11.022 -4.858 10.437 1.00 0.00 H new ATOM 0 HD23 LEU A 100 9.673 -3.698 10.456 1.00 0.00 H new ATOM 1450 N ALA A 101 10.298 -2.479 7.444 1.00 0.00 N ATOM 1451 CA ALA A 101 10.950 -1.205 7.722 1.00 0.00 C ATOM 1452 C ALA A 101 10.098 -0.036 7.237 1.00 0.00 C ATOM 1453 O ALA A 101 10.119 1.045 7.826 1.00 0.00 O ATOM 1454 CB ALA A 101 12.326 -1.163 7.074 1.00 0.00 C ATOM 0 H ALA A 101 10.790 -3.066 6.770 1.00 0.00 H new ATOM 0 HA ALA A 101 11.067 -1.113 8.802 1.00 0.00 H new ATOM 0 HB1 ALA A 101 12.801 -0.206 7.290 1.00 0.00 H new ATOM 0 HB2 ALA A 101 12.940 -1.971 7.472 1.00 0.00 H new ATOM 0 HB3 ALA A 101 12.224 -1.282 5.995 1.00 0.00 H new ATOM 1460 N TRP A 102 9.353 -0.260 6.162 1.00 0.00 N ATOM 1461 CA TRP A 102 8.495 0.776 5.598 1.00 0.00 C ATOM 1462 C TRP A 102 7.416 1.190 6.592 1.00 0.00 C ATOM 1463 O TRP A 102 7.178 2.379 6.808 1.00 0.00 O ATOM 1464 CB TRP A 102 7.850 0.284 4.302 1.00 0.00 C ATOM 1465 CG TRP A 102 7.358 1.394 3.423 1.00 0.00 C ATOM 1466 CD1 TRP A 102 7.612 2.728 3.570 1.00 0.00 C ATOM 1467 CD2 TRP A 102 6.526 1.266 2.265 1.00 0.00 C ATOM 1468 NE1 TRP A 102 6.988 3.438 2.572 1.00 0.00 N ATOM 1469 CE2 TRP A 102 6.316 2.564 1.758 1.00 0.00 C ATOM 1470 CE3 TRP A 102 5.939 0.183 1.607 1.00 0.00 C ATOM 1471 CZ2 TRP A 102 5.543 2.803 0.625 1.00 0.00 C ATOM 1472 CZ3 TRP A 102 5.173 0.422 0.482 1.00 0.00 C ATOM 1473 CH2 TRP A 102 4.981 1.724 0.000 1.00 0.00 C ATOM 0 H TRP A 102 9.325 -1.149 5.663 1.00 0.00 H new ATOM 0 HA TRP A 102 9.114 1.646 5.379 1.00 0.00 H new ATOM 0 HB2 TRP A 102 8.574 -0.314 3.749 1.00 0.00 H new ATOM 0 HB3 TRP A 102 7.015 -0.373 4.547 1.00 0.00 H new ATOM 0 HD1 TRP A 102 8.214 3.161 4.355 1.00 0.00 H new ATOM 0 HE1 TRP A 102 7.020 4.451 2.456 1.00 0.00 H new ATOM 0 HE3 TRP A 102 6.081 -0.824 1.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 5.392 3.806 0.253 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 4.715 -0.408 -0.034 1.00 0.00 H new ATOM 0 HH2 TRP A 102 4.377 1.878 -0.882 1.00 0.00 H new ATOM 1484 N PHE A 103 6.763 0.202 7.196 1.00 0.00 N ATOM 1485 CA PHE A 103 5.708 0.465 8.168 1.00 0.00 C ATOM 1486 C PHE A 103 6.289 1.015 9.467 1.00 0.00 C ATOM 1487 O PHE A 103 5.802 2.008 10.005 1.00 0.00 O ATOM 1488 CB PHE A 103 4.917 -0.814 8.451 1.00 0.00 C ATOM 1489 CG PHE A 103 3.951 -0.682 9.594 1.00 0.00 C ATOM 1490 CD1 PHE A 103 4.353 -0.956 10.892 1.00 0.00 C ATOM 1491 CD2 PHE A 103 2.644 -0.283 9.371 1.00 0.00 C ATOM 1492 CE1 PHE A 103 3.467 -0.835 11.947 1.00 0.00 C ATOM 1493 CE2 PHE A 103 1.754 -0.159 10.422 1.00 0.00 C ATOM 1494 CZ PHE A 103 2.165 -0.436 11.710 1.00 0.00 C ATOM 0 H PHE A 103 6.946 -0.788 7.029 1.00 0.00 H new ATOM 0 HA PHE A 103 5.038 1.213 7.746 1.00 0.00 H new ATOM 0 HB2 PHE A 103 4.368 -1.098 7.553 1.00 0.00 H new ATOM 0 HB3 PHE A 103 5.615 -1.623 8.667 1.00 0.00 H new ATOM 0 HD1 PHE A 103 5.370 -1.267 11.082 1.00 0.00 H new ATOM 0 HD2 PHE A 103 2.316 -0.066 8.365 1.00 0.00 H new ATOM 0 HE1 PHE A 103 3.792 -1.052 12.954 1.00 0.00 H new ATOM 0 HE2 PHE A 103 0.738 0.155 10.235 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.470 -0.341 12.532 1.00 0.00 H new ATOM 1504 N ASN A 104 7.333 0.361 9.966 1.00 0.00 N ATOM 1505 CA ASN A 104 7.980 0.783 11.202 1.00 0.00 C ATOM 1506 C ASN A 104 8.504 2.211 11.082 1.00 0.00 C ATOM 1507 O ASN A 104 8.238 3.053 11.939 1.00 0.00 O ATOM 1508 CB ASN A 104 9.130 -0.165 11.550 1.00 0.00 C ATOM 1509 CG ASN A 104 9.708 0.107 12.925 1.00 0.00 C ATOM 1510 OD1 ASN A 104 9.047 -0.106 13.942 1.00 0.00 O ATOM 1511 ND2 ASN A 104 10.948 0.581 12.962 1.00 0.00 N ATOM 0 H ASN A 104 7.749 -0.464 9.533 1.00 0.00 H new ATOM 0 HA ASN A 104 7.238 0.752 12.000 1.00 0.00 H new ATOM 0 HB2 ASN A 104 8.775 -1.194 11.506 1.00 0.00 H new ATOM 0 HB3 ASN A 104 9.917 -0.067 10.802 1.00 0.00 H new ATOM 0 HD21 ASN A 104 11.390 0.784 13.859 1.00 0.00 H new ATOM 0 HD22 ASN A 104 11.458 0.742 12.094 1.00 0.00 H new ATOM 1518 N GLU A 105 9.246 2.476 10.012 1.00 0.00 N ATOM 1519 CA GLU A 105 9.805 3.803 9.781 1.00 0.00 C ATOM 1520 C GLU A 105 8.707 4.862 9.766 1.00 0.00 C ATOM 1521 O GLU A 105 8.817 5.895 10.425 1.00 0.00 O ATOM 1522 CB GLU A 105 10.575 3.833 8.458 1.00 0.00 C ATOM 1523 CG GLU A 105 11.422 5.080 8.275 1.00 0.00 C ATOM 1524 CD GLU A 105 12.875 4.858 8.644 1.00 0.00 C ATOM 1525 OE1 GLU A 105 13.205 4.957 9.845 1.00 0.00 O ATOM 1526 OE2 GLU A 105 13.685 4.585 7.732 1.00 0.00 O ATOM 0 H GLU A 105 9.474 1.790 9.292 1.00 0.00 H new ATOM 0 HA GLU A 105 10.490 4.027 10.598 1.00 0.00 H new ATOM 0 HB2 GLU A 105 11.219 2.955 8.402 1.00 0.00 H new ATOM 0 HB3 GLU A 105 9.866 3.761 7.633 1.00 0.00 H new ATOM 0 HG2 GLU A 105 11.361 5.407 7.237 1.00 0.00 H new ATOM 0 HG3 GLU A 105 11.014 5.884 8.887 1.00 0.00 H new ATOM 1533 N GLY A 106 7.646 4.596 9.009 1.00 0.00 N ATOM 1534 CA GLY A 106 6.544 5.535 8.922 1.00 0.00 C ATOM 1535 C GLY A 106 6.989 6.915 8.480 1.00 0.00 C ATOM 1536 O GLY A 106 6.323 7.910 8.762 1.00 0.00 O ATOM 0 H GLY A 106 7.531 3.747 8.455 1.00 0.00 H new ATOM 0 HA2 GLY A 106 5.802 5.154 8.221 1.00 0.00 H new ATOM 0 HA3 GLY A 106 6.056 5.608 9.894 1.00 0.00 H new ATOM 1540 N ASP A 107 8.121 6.975 7.787 1.00 0.00 N ATOM 1541 CA ASP A 107 8.656 8.243 7.306 1.00 0.00 C ATOM 1542 C ASP A 107 8.275 8.477 5.848 1.00 0.00 C ATOM 1543 O ASP A 107 7.672 7.615 5.207 1.00 0.00 O ATOM 1544 CB ASP A 107 10.178 8.269 7.459 1.00 0.00 C ATOM 1545 CG ASP A 107 10.720 9.676 7.623 1.00 0.00 C ATOM 1546 OD1 ASP A 107 10.542 10.256 8.716 1.00 0.00 O ATOM 1547 OD2 ASP A 107 11.322 10.196 6.662 1.00 0.00 O ATOM 0 H ASP A 107 8.686 6.160 7.546 1.00 0.00 H new ATOM 0 HA ASP A 107 8.224 9.043 7.908 1.00 0.00 H new ATOM 0 HB2 ASP A 107 10.464 7.670 8.324 1.00 0.00 H new ATOM 0 HB3 ASP A 107 10.636 7.806 6.585 1.00 0.00 H new ATOM 1552 N THR A 108 8.628 9.649 5.329 1.00 0.00 N ATOM 1553 CA THR A 108 8.321 9.997 3.948 1.00 0.00 C ATOM 1554 C THR A 108 9.147 9.164 2.974 1.00 0.00 C ATOM 1555 O THR A 108 10.354 9.367 2.839 1.00 0.00 O ATOM 1556 CB THR A 108 8.578 11.491 3.674 1.00 0.00 C ATOM 1557 OG1 THR A 108 8.264 12.263 4.839 1.00 0.00 O ATOM 1558 CG2 THR A 108 7.744 11.976 2.499 1.00 0.00 C ATOM 0 H THR A 108 9.127 10.373 5.845 1.00 0.00 H new ATOM 0 HA THR A 108 7.263 9.784 3.797 1.00 0.00 H new ATOM 0 HB THR A 108 9.632 11.617 3.428 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.431 13.211 4.658 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.942 13.034 2.324 1.00 0.00 H new ATOM 0 HG22 THR A 108 8.005 11.406 1.608 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.686 11.837 2.722 1.00 0.00 H new ATOM 1566 N ARG A 109 8.490 8.228 2.298 1.00 0.00 N ATOM 1567 CA ARG A 109 9.164 7.365 1.336 1.00 0.00 C ATOM 1568 C ARG A 109 8.654 7.625 -0.079 1.00 0.00 C ATOM 1569 O ARG A 109 7.614 8.252 -0.269 1.00 0.00 O ATOM 1570 CB ARG A 109 8.954 5.895 1.704 1.00 0.00 C ATOM 1571 CG ARG A 109 10.156 5.014 1.403 1.00 0.00 C ATOM 1572 CD ARG A 109 11.340 5.365 2.290 1.00 0.00 C ATOM 1573 NE ARG A 109 11.412 4.510 3.472 1.00 0.00 N ATOM 1574 CZ ARG A 109 12.479 4.433 4.260 1.00 0.00 C ATOM 1575 NH1 ARG A 109 13.557 5.156 3.994 1.00 0.00 N ATOM 1576 NH2 ARG A 109 12.467 3.631 5.316 1.00 0.00 N ATOM 0 H ARG A 109 7.491 8.048 2.399 1.00 0.00 H new ATOM 0 HA ARG A 109 10.230 7.592 1.366 1.00 0.00 H new ATOM 0 HB2 ARG A 109 8.720 5.825 2.766 1.00 0.00 H new ATOM 0 HB3 ARG A 109 8.089 5.513 1.161 1.00 0.00 H new ATOM 0 HG2 ARG A 109 9.888 3.968 1.550 1.00 0.00 H new ATOM 0 HG3 ARG A 109 10.438 5.127 0.356 1.00 0.00 H new ATOM 0 HD2 ARG A 109 12.263 5.270 1.717 1.00 0.00 H new ATOM 0 HD3 ARG A 109 11.264 6.407 2.601 1.00 0.00 H new ATOM 0 HE ARG A 109 10.598 3.941 3.705 1.00 0.00 H new ATOM 0 HH11 ARG A 109 13.569 5.774 3.182 1.00 0.00 H new ATOM 0 HH12 ARG A 109 14.375 5.095 4.601 1.00 0.00 H new ATOM 0 HH21 ARG A 109 11.639 3.073 5.523 1.00 0.00 H new ATOM 0 HH22 ARG A 109 13.286 3.572 5.921 1.00 0.00 H new ATOM 1590 N ALA A 110 9.396 7.136 -1.069 1.00 0.00 N ATOM 1591 CA ALA A 110 9.019 7.314 -2.465 1.00 0.00 C ATOM 1592 C ALA A 110 9.409 6.097 -3.297 1.00 0.00 C ATOM 1593 O ALA A 110 10.540 5.618 -3.222 1.00 0.00 O ATOM 1594 CB ALA A 110 9.665 8.570 -3.029 1.00 0.00 C ATOM 0 H ALA A 110 10.261 6.614 -0.929 1.00 0.00 H new ATOM 0 HA ALA A 110 7.936 7.423 -2.513 1.00 0.00 H new ATOM 0 HB1 ALA A 110 9.375 8.691 -4.073 1.00 0.00 H new ATOM 0 HB2 ALA A 110 9.334 9.437 -2.458 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.749 8.483 -2.961 1.00 0.00 H new ATOM 1600 N TYR A 111 8.464 5.602 -4.089 1.00 0.00 N ATOM 1601 CA TYR A 111 8.708 4.439 -4.934 1.00 0.00 C ATOM 1602 C TYR A 111 8.140 4.653 -6.334 1.00 0.00 C ATOM 1603 O TYR A 111 7.375 5.588 -6.570 1.00 0.00 O ATOM 1604 CB TYR A 111 8.088 3.189 -4.307 1.00 0.00 C ATOM 1605 CG TYR A 111 6.624 3.345 -3.966 1.00 0.00 C ATOM 1606 CD1 TYR A 111 6.227 3.983 -2.797 1.00 0.00 C ATOM 1607 CD2 TYR A 111 5.637 2.855 -4.812 1.00 0.00 C ATOM 1608 CE1 TYR A 111 4.890 4.127 -2.481 1.00 0.00 C ATOM 1609 CE2 TYR A 111 4.298 2.996 -4.505 1.00 0.00 C ATOM 1610 CZ TYR A 111 3.930 3.632 -3.338 1.00 0.00 C ATOM 1611 OH TYR A 111 2.596 3.774 -3.027 1.00 0.00 O ATOM 0 H TYR A 111 7.523 5.988 -4.163 1.00 0.00 H new ATOM 0 HA TYR A 111 9.786 4.301 -5.016 1.00 0.00 H new ATOM 0 HB2 TYR A 111 8.205 2.352 -4.995 1.00 0.00 H new ATOM 0 HB3 TYR A 111 8.638 2.936 -3.401 1.00 0.00 H new ATOM 0 HD1 TYR A 111 6.976 4.373 -2.124 1.00 0.00 H new ATOM 0 HD2 TYR A 111 5.922 2.355 -5.726 1.00 0.00 H new ATOM 0 HE1 TYR A 111 4.598 4.624 -1.568 1.00 0.00 H new ATOM 0 HE2 TYR A 111 3.544 2.611 -5.175 1.00 0.00 H new ATOM 0 HH TYR A 111 2.050 3.372 -3.735 1.00 0.00 H new ATOM 1621 N LYS A 112 8.523 3.781 -7.260 1.00 0.00 N ATOM 1622 CA LYS A 112 8.053 3.871 -8.638 1.00 0.00 C ATOM 1623 C LYS A 112 7.623 2.502 -9.156 1.00 0.00 C ATOM 1624 O LYS A 112 8.408 1.554 -9.156 1.00 0.00 O ATOM 1625 CB LYS A 112 9.150 4.447 -9.536 1.00 0.00 C ATOM 1626 CG LYS A 112 9.861 5.647 -8.935 1.00 0.00 C ATOM 1627 CD LYS A 112 10.565 6.470 -10.000 1.00 0.00 C ATOM 1628 CE LYS A 112 11.875 5.825 -10.426 1.00 0.00 C ATOM 1629 NZ LYS A 112 12.283 6.250 -11.794 1.00 0.00 N ATOM 0 H LYS A 112 9.158 3.003 -7.081 1.00 0.00 H new ATOM 0 HA LYS A 112 7.189 4.536 -8.659 1.00 0.00 H new ATOM 0 HB2 LYS A 112 9.883 3.668 -9.745 1.00 0.00 H new ATOM 0 HB3 LYS A 112 8.711 4.736 -10.491 1.00 0.00 H new ATOM 0 HG2 LYS A 112 9.140 6.272 -8.409 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.588 5.308 -8.197 1.00 0.00 H new ATOM 0 HD2 LYS A 112 9.913 6.580 -10.867 1.00 0.00 H new ATOM 0 HD3 LYS A 112 10.759 7.472 -9.618 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.658 6.089 -9.715 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.772 4.740 -10.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.300 5.423 -12.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.603 6.948 -12.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.231 6.677 -11.757 1.00 0.00 H new ATOM 1643 N ILE A 113 6.374 2.408 -9.599 1.00 0.00 N ATOM 1644 CA ILE A 113 5.842 1.156 -10.123 1.00 0.00 C ATOM 1645 C ILE A 113 5.921 1.120 -11.646 1.00 0.00 C ATOM 1646 O ILE A 113 5.492 2.056 -12.322 1.00 0.00 O ATOM 1647 CB ILE A 113 4.380 0.941 -9.690 1.00 0.00 C ATOM 1648 CG1 ILE A 113 4.188 1.368 -8.234 1.00 0.00 C ATOM 1649 CG2 ILE A 113 3.980 -0.515 -9.879 1.00 0.00 C ATOM 1650 CD1 ILE A 113 2.778 1.162 -7.724 1.00 0.00 C ATOM 0 H ILE A 113 5.712 3.184 -9.606 1.00 0.00 H new ATOM 0 HA ILE A 113 6.456 0.355 -9.711 1.00 0.00 H new ATOM 0 HB ILE A 113 3.736 1.558 -10.317 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.879 0.806 -7.605 1.00 0.00 H new ATOM 0 HG13 ILE A 113 4.451 2.421 -8.135 1.00 0.00 H new ATOM 0 HG21 ILE A 113 2.944 -0.651 -9.569 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.083 -0.787 -10.929 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.626 -1.151 -9.275 1.00 0.00 H new ATOM 0 HD11 ILE A 113 2.716 1.486 -6.685 1.00 0.00 H new ATOM 0 HD12 ILE A 113 2.084 1.745 -8.329 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.518 0.106 -7.790 1.00 0.00 H new ATOM 1662 N ARG A 114 6.469 0.033 -12.179 1.00 0.00 N ATOM 1663 CA ARG A 114 6.603 -0.125 -13.622 1.00 0.00 C ATOM 1664 C ARG A 114 5.339 -0.734 -14.222 1.00 0.00 C ATOM 1665 O ARG A 114 4.796 -1.706 -13.697 1.00 0.00 O ATOM 1666 CB ARG A 114 7.811 -1.006 -13.949 1.00 0.00 C ATOM 1667 CG ARG A 114 7.586 -2.480 -13.657 1.00 0.00 C ATOM 1668 CD ARG A 114 7.219 -3.248 -14.917 1.00 0.00 C ATOM 1669 NE ARG A 114 7.601 -4.656 -14.831 1.00 0.00 N ATOM 1670 CZ ARG A 114 8.851 -5.087 -14.961 1.00 0.00 C ATOM 1671 NH1 ARG A 114 9.833 -4.225 -15.180 1.00 0.00 N ATOM 1672 NH2 ARG A 114 9.118 -6.384 -14.870 1.00 0.00 N ATOM 0 H ARG A 114 6.827 -0.751 -11.634 1.00 0.00 H new ATOM 0 HA ARG A 114 6.752 0.863 -14.059 1.00 0.00 H new ATOM 0 HB2 ARG A 114 8.062 -0.887 -15.003 1.00 0.00 H new ATOM 0 HB3 ARG A 114 8.670 -0.658 -13.376 1.00 0.00 H new ATOM 0 HG2 ARG A 114 8.488 -2.907 -13.219 1.00 0.00 H new ATOM 0 HG3 ARG A 114 6.791 -2.589 -12.919 1.00 0.00 H new ATOM 0 HD2 ARG A 114 6.145 -3.174 -15.087 1.00 0.00 H new ATOM 0 HD3 ARG A 114 7.710 -2.791 -15.776 1.00 0.00 H new ATOM 0 HE ARG A 114 6.868 -5.345 -14.662 1.00 0.00 H new ATOM 0 HH11 ARG A 114 9.630 -3.228 -15.249 1.00 0.00 H new ATOM 0 HH12 ARG A 114 10.792 -4.559 -15.279 1.00 0.00 H new ATOM 0 HH21 ARG A 114 8.364 -7.049 -14.700 1.00 0.00 H new ATOM 0 HH22 ARG A 114 10.077 -6.715 -14.970 1.00 0.00 H new ATOM 1686 N PHE A 115 4.875 -0.154 -15.324 1.00 0.00 N ATOM 1687 CA PHE A 115 3.674 -0.638 -15.994 1.00 0.00 C ATOM 1688 C PHE A 115 4.034 -1.526 -17.181 1.00 0.00 C ATOM 1689 O PHE A 115 5.148 -1.487 -17.703 1.00 0.00 O ATOM 1690 CB PHE A 115 2.817 0.540 -16.466 1.00 0.00 C ATOM 1691 CG PHE A 115 1.768 0.951 -15.474 1.00 0.00 C ATOM 1692 CD1 PHE A 115 2.125 1.506 -14.256 1.00 0.00 C ATOM 1693 CD2 PHE A 115 0.422 0.785 -15.761 1.00 0.00 C ATOM 1694 CE1 PHE A 115 1.159 1.885 -13.341 1.00 0.00 C ATOM 1695 CE2 PHE A 115 -0.548 1.162 -14.851 1.00 0.00 C ATOM 1696 CZ PHE A 115 -0.178 1.714 -13.640 1.00 0.00 C ATOM 0 H PHE A 115 5.312 0.651 -15.772 1.00 0.00 H new ATOM 0 HA PHE A 115 3.103 -1.230 -15.279 1.00 0.00 H new ATOM 0 HB2 PHE A 115 3.465 1.392 -16.671 1.00 0.00 H new ATOM 0 HB3 PHE A 115 2.333 0.274 -17.406 1.00 0.00 H new ATOM 0 HD1 PHE A 115 3.169 1.644 -14.018 1.00 0.00 H new ATOM 0 HD2 PHE A 115 0.127 0.356 -16.707 1.00 0.00 H new ATOM 0 HE1 PHE A 115 1.450 2.314 -12.394 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -1.593 1.025 -15.086 1.00 0.00 H new ATOM 0 HZ PHE A 115 -0.934 2.011 -12.928 1.00 0.00 H new ATOM 1706 N PRO A 116 3.069 -2.348 -17.619 1.00 0.00 N ATOM 1707 CA PRO A 116 3.259 -3.262 -18.749 1.00 0.00 C ATOM 1708 C PRO A 116 3.370 -2.525 -20.079 1.00 0.00 C ATOM 1709 O PRO A 116 4.020 -2.998 -21.009 1.00 0.00 O ATOM 1710 CB PRO A 116 1.997 -4.128 -18.721 1.00 0.00 C ATOM 1711 CG PRO A 116 0.971 -3.282 -18.050 1.00 0.00 C ATOM 1712 CD PRO A 116 1.716 -2.448 -17.045 1.00 0.00 C ATOM 0 HA PRO A 116 4.185 -3.831 -18.662 1.00 0.00 H new ATOM 0 HB2 PRO A 116 1.685 -4.405 -19.728 1.00 0.00 H new ATOM 0 HB3 PRO A 116 2.165 -5.055 -18.173 1.00 0.00 H new ATOM 0 HG2 PRO A 116 0.452 -2.652 -18.772 1.00 0.00 H new ATOM 0 HG3 PRO A 116 0.215 -3.898 -17.563 1.00 0.00 H new ATOM 0 HD2 PRO A 116 1.259 -1.466 -16.920 1.00 0.00 H new ATOM 0 HD3 PRO A 116 1.730 -2.920 -16.063 1.00 0.00 H new ATOM 1720 N ASN A 117 2.731 -1.363 -20.160 1.00 0.00 N ATOM 1721 CA ASN A 117 2.758 -0.560 -21.378 1.00 0.00 C ATOM 1722 C ASN A 117 4.093 0.165 -21.522 1.00 0.00 C ATOM 1723 O ASN A 117 4.350 0.821 -22.531 1.00 0.00 O ATOM 1724 CB ASN A 117 1.612 0.455 -21.370 1.00 0.00 C ATOM 1725 CG ASN A 117 0.273 -0.183 -21.684 1.00 0.00 C ATOM 1726 OD1 ASN A 117 0.209 -1.252 -22.292 1.00 0.00 O ATOM 1727 ND2 ASN A 117 -0.805 0.472 -21.270 1.00 0.00 N ATOM 0 H ASN A 117 2.189 -0.956 -19.398 1.00 0.00 H new ATOM 0 HA ASN A 117 2.635 -1.231 -22.229 1.00 0.00 H new ATOM 0 HB2 ASN A 117 1.562 0.935 -20.393 1.00 0.00 H new ATOM 0 HB3 ASN A 117 1.818 1.238 -22.100 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -1.734 0.092 -21.452 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -0.704 1.355 -20.770 1.00 0.00 H new ATOM 1734 N GLY A 118 4.940 0.041 -20.505 1.00 0.00 N ATOM 1735 CA GLY A 118 6.238 0.689 -20.538 1.00 0.00 C ATOM 1736 C GLY A 118 6.272 1.963 -19.718 1.00 0.00 C ATOM 1737 O GLY A 118 7.344 2.487 -19.414 1.00 0.00 O ATOM 0 H GLY A 118 4.751 -0.496 -19.659 1.00 0.00 H new ATOM 0 HA2 GLY A 118 6.994 -0.001 -20.163 1.00 0.00 H new ATOM 0 HA3 GLY A 118 6.500 0.919 -21.571 1.00 0.00 H new ATOM 1741 N THR A 119 5.094 2.464 -19.356 1.00 0.00 N ATOM 1742 CA THR A 119 4.993 3.685 -18.568 1.00 0.00 C ATOM 1743 C THR A 119 5.512 3.470 -17.151 1.00 0.00 C ATOM 1744 O THR A 119 5.995 2.389 -16.813 1.00 0.00 O ATOM 1745 CB THR A 119 3.539 4.190 -18.499 1.00 0.00 C ATOM 1746 OG1 THR A 119 2.770 3.350 -17.630 1.00 0.00 O ATOM 1747 CG2 THR A 119 2.907 4.210 -19.883 1.00 0.00 C ATOM 0 H THR A 119 4.197 2.042 -19.597 1.00 0.00 H new ATOM 0 HA THR A 119 5.607 4.435 -19.067 1.00 0.00 H new ATOM 0 HB THR A 119 3.549 5.207 -18.107 1.00 0.00 H new ATOM 0 HG1 THR A 119 1.847 3.678 -17.590 1.00 0.00 H new ATOM 0 HG21 THR A 119 1.881 4.570 -19.809 1.00 0.00 H new ATOM 0 HG22 THR A 119 3.478 4.872 -20.534 1.00 0.00 H new ATOM 0 HG23 THR A 119 2.909 3.202 -20.299 1.00 0.00 H new ATOM 1755 N VAL A 120 5.410 4.506 -16.325 1.00 0.00 N ATOM 1756 CA VAL A 120 5.869 4.431 -14.943 1.00 0.00 C ATOM 1757 C VAL A 120 5.064 5.363 -14.045 1.00 0.00 C ATOM 1758 O VAL A 120 4.718 6.477 -14.440 1.00 0.00 O ATOM 1759 CB VAL A 120 7.363 4.786 -14.826 1.00 0.00 C ATOM 1760 CG1 VAL A 120 7.673 5.345 -13.447 1.00 0.00 C ATOM 1761 CG2 VAL A 120 8.224 3.567 -15.122 1.00 0.00 C ATOM 0 H VAL A 120 5.013 5.408 -16.589 1.00 0.00 H new ATOM 0 HA VAL A 120 5.722 3.401 -14.617 1.00 0.00 H new ATOM 0 HB VAL A 120 7.595 5.555 -15.563 1.00 0.00 H new ATOM 0 HG11 VAL A 120 8.733 5.590 -13.384 1.00 0.00 H new ATOM 0 HG12 VAL A 120 7.082 6.245 -13.278 1.00 0.00 H new ATOM 0 HG13 VAL A 120 7.426 4.601 -12.689 1.00 0.00 H new ATOM 0 HG21 VAL A 120 9.277 3.835 -15.035 1.00 0.00 H new ATOM 0 HG22 VAL A 120 7.991 2.775 -14.410 1.00 0.00 H new ATOM 0 HG23 VAL A 120 8.022 3.216 -16.134 1.00 0.00 H new ATOM 1771 N ASP A 121 4.770 4.903 -12.834 1.00 0.00 N ATOM 1772 CA ASP A 121 4.007 5.696 -11.878 1.00 0.00 C ATOM 1773 C ASP A 121 4.760 5.826 -10.557 1.00 0.00 C ATOM 1774 O ASP A 121 4.972 4.839 -9.852 1.00 0.00 O ATOM 1775 CB ASP A 121 2.635 5.066 -11.638 1.00 0.00 C ATOM 1776 CG ASP A 121 1.538 6.103 -11.494 1.00 0.00 C ATOM 1777 OD1 ASP A 121 1.868 7.295 -11.323 1.00 0.00 O ATOM 1778 OD2 ASP A 121 0.350 5.721 -11.551 1.00 0.00 O ATOM 0 H ASP A 121 5.049 3.984 -12.491 1.00 0.00 H new ATOM 0 HA ASP A 121 3.870 6.693 -12.298 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.395 4.400 -12.467 1.00 0.00 H new ATOM 0 HB3 ASP A 121 2.672 4.454 -10.737 1.00 0.00 H new ATOM 1783 N VAL A 122 5.160 7.050 -10.227 1.00 0.00 N ATOM 1784 CA VAL A 122 5.887 7.309 -8.991 1.00 0.00 C ATOM 1785 C VAL A 122 4.945 7.769 -7.885 1.00 0.00 C ATOM 1786 O VAL A 122 4.041 8.571 -8.118 1.00 0.00 O ATOM 1787 CB VAL A 122 6.980 8.375 -9.196 1.00 0.00 C ATOM 1788 CG1 VAL A 122 7.858 8.486 -7.958 1.00 0.00 C ATOM 1789 CG2 VAL A 122 7.816 8.051 -10.425 1.00 0.00 C ATOM 0 H VAL A 122 4.992 7.878 -10.799 1.00 0.00 H new ATOM 0 HA VAL A 122 6.356 6.370 -8.697 1.00 0.00 H new ATOM 0 HB VAL A 122 6.497 9.339 -9.357 1.00 0.00 H new ATOM 0 HG11 VAL A 122 8.624 9.244 -8.122 1.00 0.00 H new ATOM 0 HG12 VAL A 122 7.246 8.768 -7.102 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.334 7.525 -7.762 1.00 0.00 H new ATOM 0 HG21 VAL A 122 8.583 8.814 -10.555 1.00 0.00 H new ATOM 0 HG22 VAL A 122 8.290 7.078 -10.296 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.174 8.028 -11.306 1.00 0.00 H new ATOM 1799 N PHE A 123 5.164 7.256 -6.678 1.00 0.00 N ATOM 1800 CA PHE A 123 4.334 7.614 -5.534 1.00 0.00 C ATOM 1801 C PHE A 123 5.196 7.944 -4.319 1.00 0.00 C ATOM 1802 O PHE A 123 6.343 7.506 -4.220 1.00 0.00 O ATOM 1803 CB PHE A 123 3.373 6.472 -5.197 1.00 0.00 C ATOM 1804 CG PHE A 123 2.232 6.344 -6.165 1.00 0.00 C ATOM 1805 CD1 PHE A 123 1.518 7.461 -6.567 1.00 0.00 C ATOM 1806 CD2 PHE A 123 1.872 5.106 -6.672 1.00 0.00 C ATOM 1807 CE1 PHE A 123 0.467 7.348 -7.457 1.00 0.00 C ATOM 1808 CE2 PHE A 123 0.823 4.985 -7.564 1.00 0.00 C ATOM 1809 CZ PHE A 123 0.119 6.108 -7.955 1.00 0.00 C ATOM 0 H PHE A 123 5.909 6.592 -6.468 1.00 0.00 H new ATOM 0 HA PHE A 123 3.756 8.499 -5.799 1.00 0.00 H new ATOM 0 HB2 PHE A 123 3.928 5.534 -5.176 1.00 0.00 H new ATOM 0 HB3 PHE A 123 2.973 6.628 -4.195 1.00 0.00 H new ATOM 0 HD1 PHE A 123 1.786 8.433 -6.180 1.00 0.00 H new ATOM 0 HD2 PHE A 123 2.417 4.225 -6.367 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -0.081 8.227 -7.762 1.00 0.00 H new ATOM 0 HE2 PHE A 123 0.554 4.015 -7.955 1.00 0.00 H new ATOM 0 HZ PHE A 123 -0.703 6.016 -8.650 1.00 0.00 H new ATOM 1819 N ARG A 124 4.636 8.719 -3.395 1.00 0.00 N ATOM 1820 CA ARG A 124 5.352 9.108 -2.187 1.00 0.00 C ATOM 1821 C ARG A 124 4.433 9.063 -0.970 1.00 0.00 C ATOM 1822 O ARG A 124 3.210 9.021 -1.105 1.00 0.00 O ATOM 1823 CB ARG A 124 5.936 10.514 -2.347 1.00 0.00 C ATOM 1824 CG ARG A 124 6.638 10.735 -3.676 1.00 0.00 C ATOM 1825 CD ARG A 124 7.092 12.177 -3.833 1.00 0.00 C ATOM 1826 NE ARG A 124 5.973 13.114 -3.761 1.00 0.00 N ATOM 1827 CZ ARG A 124 6.119 14.434 -3.773 1.00 0.00 C ATOM 1828 NH1 ARG A 124 7.329 14.971 -3.856 1.00 0.00 N ATOM 1829 NH2 ARG A 124 5.053 15.221 -3.704 1.00 0.00 N ATOM 0 H ARG A 124 3.688 9.090 -3.461 1.00 0.00 H new ATOM 0 HA ARG A 124 6.165 8.398 -2.032 1.00 0.00 H new ATOM 0 HB2 ARG A 124 5.134 11.245 -2.244 1.00 0.00 H new ATOM 0 HB3 ARG A 124 6.642 10.699 -1.538 1.00 0.00 H new ATOM 0 HG2 ARG A 124 7.500 10.071 -3.748 1.00 0.00 H new ATOM 0 HG3 ARG A 124 5.965 10.473 -4.492 1.00 0.00 H new ATOM 0 HD2 ARG A 124 7.816 12.416 -3.054 1.00 0.00 H new ATOM 0 HD3 ARG A 124 7.602 12.294 -4.789 1.00 0.00 H new ATOM 0 HE ARG A 124 5.029 12.734 -3.698 1.00 0.00 H new ATOM 0 HH11 ARG A 124 8.151 14.370 -3.911 1.00 0.00 H new ATOM 0 HH12 ARG A 124 7.437 15.985 -3.865 1.00 0.00 H new ATOM 0 HH21 ARG A 124 4.121 14.812 -3.642 1.00 0.00 H new ATOM 0 HH22 ARG A 124 5.166 16.235 -3.713 1.00 0.00 H new ATOM 1843 N GLY A 125 5.030 9.071 0.217 1.00 0.00 N ATOM 1844 CA GLY A 125 4.249 9.030 1.440 1.00 0.00 C ATOM 1845 C GLY A 125 4.655 7.887 2.349 1.00 0.00 C ATOM 1846 O GLY A 125 5.727 7.303 2.182 1.00 0.00 O ATOM 0 H GLY A 125 6.040 9.105 0.354 1.00 0.00 H new ATOM 0 HA2 GLY A 125 4.365 9.973 1.974 1.00 0.00 H new ATOM 0 HA3 GLY A 125 3.193 8.933 1.190 1.00 0.00 H new ATOM 1850 N TRP A 126 3.801 7.567 3.314 1.00 0.00 N ATOM 1851 CA TRP A 126 4.078 6.488 4.253 1.00 0.00 C ATOM 1852 C TRP A 126 2.978 5.434 4.212 1.00 0.00 C ATOM 1853 O TRP A 126 1.901 5.667 3.661 1.00 0.00 O ATOM 1854 CB TRP A 126 4.217 7.041 5.672 1.00 0.00 C ATOM 1855 CG TRP A 126 2.929 7.560 6.236 1.00 0.00 C ATOM 1856 CD1 TRP A 126 2.191 8.609 5.765 1.00 0.00 C ATOM 1857 CD2 TRP A 126 2.228 7.055 7.379 1.00 0.00 C ATOM 1858 NE1 TRP A 126 1.074 8.786 6.546 1.00 0.00 N ATOM 1859 CE2 TRP A 126 1.074 7.845 7.541 1.00 0.00 C ATOM 1860 CE3 TRP A 126 2.463 6.012 8.278 1.00 0.00 C ATOM 1861 CZ2 TRP A 126 0.158 7.623 8.567 1.00 0.00 C ATOM 1862 CZ3 TRP A 126 1.555 5.793 9.296 1.00 0.00 C ATOM 1863 CH2 TRP A 126 0.414 6.595 9.434 1.00 0.00 C ATOM 0 H TRP A 126 2.910 8.040 3.466 1.00 0.00 H new ATOM 0 HA TRP A 126 5.017 6.018 3.960 1.00 0.00 H new ATOM 0 HB2 TRP A 126 4.601 6.256 6.324 1.00 0.00 H new ATOM 0 HB3 TRP A 126 4.954 7.844 5.671 1.00 0.00 H new ATOM 0 HD1 TRP A 126 2.448 9.211 4.906 1.00 0.00 H new ATOM 0 HE1 TRP A 126 0.361 9.502 6.407 1.00 0.00 H new ATOM 0 HE3 TRP A 126 3.339 5.388 8.179 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 -0.722 8.240 8.674 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 1.727 4.990 9.997 1.00 0.00 H new ATOM 0 HH2 TRP A 126 -0.277 6.398 10.240 1.00 0.00 H new ATOM 1874 N VAL A 127 3.253 4.273 4.797 1.00 0.00 N ATOM 1875 CA VAL A 127 2.285 3.182 4.828 1.00 0.00 C ATOM 1876 C VAL A 127 1.787 2.930 6.246 1.00 0.00 C ATOM 1877 O VAL A 127 2.434 3.314 7.220 1.00 0.00 O ATOM 1878 CB VAL A 127 2.887 1.880 4.267 1.00 0.00 C ATOM 1879 CG1 VAL A 127 2.954 1.934 2.749 1.00 0.00 C ATOM 1880 CG2 VAL A 127 4.266 1.633 4.861 1.00 0.00 C ATOM 0 H VAL A 127 4.139 4.063 5.257 1.00 0.00 H new ATOM 0 HA VAL A 127 1.447 3.485 4.200 1.00 0.00 H new ATOM 0 HB VAL A 127 2.240 1.049 4.549 1.00 0.00 H new ATOM 0 HG11 VAL A 127 3.382 1.006 2.370 1.00 0.00 H new ATOM 0 HG12 VAL A 127 1.950 2.062 2.345 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.578 2.773 2.442 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.677 0.709 4.454 1.00 0.00 H new ATOM 0 HG22 VAL A 127 4.924 2.465 4.610 1.00 0.00 H new ATOM 0 HG23 VAL A 127 4.185 1.548 5.945 1.00 0.00 H new ATOM 1890 N SER A 128 0.632 2.280 6.356 1.00 0.00 N ATOM 1891 CA SER A 128 0.045 1.978 7.655 1.00 0.00 C ATOM 1892 C SER A 128 -0.713 0.654 7.614 1.00 0.00 C ATOM 1893 O SER A 128 -1.523 0.363 8.494 1.00 0.00 O ATOM 1894 CB SER A 128 -0.896 3.104 8.087 1.00 0.00 C ATOM 1895 OG SER A 128 -1.017 3.155 9.498 1.00 0.00 O ATOM 0 H SER A 128 0.085 1.953 5.560 1.00 0.00 H new ATOM 0 HA SER A 128 0.854 1.891 8.381 1.00 0.00 H new ATOM 0 HB2 SER A 128 -0.521 4.058 7.716 1.00 0.00 H new ATOM 0 HB3 SER A 128 -1.879 2.953 7.640 1.00 0.00 H new ATOM 0 HG SER A 128 -1.242 2.264 9.839 1.00 0.00 H new ATOM 1901 N SER A 129 -0.442 -0.144 6.586 1.00 0.00 N ATOM 1902 CA SER A 129 -1.100 -1.435 6.428 1.00 0.00 C ATOM 1903 C SER A 129 -0.088 -2.522 6.079 1.00 0.00 C ATOM 1904 O SER A 129 0.018 -2.940 4.925 1.00 0.00 O ATOM 1905 CB SER A 129 -2.173 -1.355 5.340 1.00 0.00 C ATOM 1906 OG SER A 129 -3.024 -0.241 5.546 1.00 0.00 O ATOM 0 H SER A 129 0.228 0.081 5.851 1.00 0.00 H new ATOM 0 HA SER A 129 -1.572 -1.692 7.376 1.00 0.00 H new ATOM 0 HB2 SER A 129 -1.699 -1.279 4.362 1.00 0.00 H new ATOM 0 HB3 SER A 129 -2.763 -2.272 5.338 1.00 0.00 H new ATOM 0 HG SER A 129 -2.764 0.485 4.942 1.00 0.00 H new ATOM 1912 N ILE A 130 0.655 -2.974 7.084 1.00 0.00 N ATOM 1913 CA ILE A 130 1.658 -4.013 6.885 1.00 0.00 C ATOM 1914 C ILE A 130 1.749 -4.930 8.100 1.00 0.00 C ATOM 1915 O ILE A 130 2.118 -4.497 9.191 1.00 0.00 O ATOM 1916 CB ILE A 130 3.047 -3.407 6.608 1.00 0.00 C ATOM 1917 CG1 ILE A 130 3.012 -2.556 5.337 1.00 0.00 C ATOM 1918 CG2 ILE A 130 4.090 -4.509 6.486 1.00 0.00 C ATOM 1919 CD1 ILE A 130 4.300 -1.807 5.075 1.00 0.00 C ATOM 0 H ILE A 130 0.581 -2.637 8.044 1.00 0.00 H new ATOM 0 HA ILE A 130 1.344 -4.594 6.018 1.00 0.00 H new ATOM 0 HB ILE A 130 3.321 -2.765 7.445 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.796 -3.200 4.484 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.194 -1.840 5.411 1.00 0.00 H new ATOM 0 HG21 ILE A 130 5.066 -4.066 6.290 1.00 0.00 H new ATOM 0 HG22 ILE A 130 4.129 -5.077 7.415 1.00 0.00 H new ATOM 0 HG23 ILE A 130 3.822 -5.174 5.665 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.203 -1.225 4.158 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.508 -1.137 5.910 1.00 0.00 H new ATOM 0 HD13 ILE A 130 5.119 -2.518 4.968 1.00 0.00 H new ATOM 1931 N GLY A 131 1.412 -6.200 7.901 1.00 0.00 N ATOM 1932 CA GLY A 131 1.463 -7.159 8.989 1.00 0.00 C ATOM 1933 C GLY A 131 2.321 -8.365 8.659 1.00 0.00 C ATOM 1934 O GLY A 131 3.416 -8.226 8.112 1.00 0.00 O ATOM 0 H GLY A 131 1.105 -6.582 7.007 1.00 0.00 H new ATOM 0 HA2 GLY A 131 1.855 -6.671 9.881 1.00 0.00 H new ATOM 0 HA3 GLY A 131 0.452 -7.490 9.225 1.00 0.00 H new ATOM 1938 N LYS A 132 1.825 -9.552 8.993 1.00 0.00 N ATOM 1939 CA LYS A 132 2.553 -10.788 8.729 1.00 0.00 C ATOM 1940 C LYS A 132 2.129 -11.395 7.395 1.00 0.00 C ATOM 1941 O LYS A 132 0.947 -11.400 7.054 1.00 0.00 O ATOM 1942 CB LYS A 132 2.318 -11.794 9.858 1.00 0.00 C ATOM 1943 CG LYS A 132 3.040 -11.440 11.147 1.00 0.00 C ATOM 1944 CD LYS A 132 2.296 -10.371 11.928 1.00 0.00 C ATOM 1945 CE LYS A 132 2.736 -10.335 13.383 1.00 0.00 C ATOM 1946 NZ LYS A 132 1.749 -9.627 14.244 1.00 0.00 N ATOM 0 H LYS A 132 0.921 -9.684 9.447 1.00 0.00 H new ATOM 0 HA LYS A 132 3.616 -10.551 8.678 1.00 0.00 H new ATOM 0 HB2 LYS A 132 1.248 -11.861 10.057 1.00 0.00 H new ATOM 0 HB3 LYS A 132 2.643 -12.781 9.528 1.00 0.00 H new ATOM 0 HG2 LYS A 132 3.147 -12.333 11.762 1.00 0.00 H new ATOM 0 HG3 LYS A 132 4.046 -11.090 10.917 1.00 0.00 H new ATOM 0 HD2 LYS A 132 2.470 -9.397 11.470 1.00 0.00 H new ATOM 0 HD3 LYS A 132 1.224 -10.561 11.876 1.00 0.00 H new ATOM 0 HE2 LYS A 132 2.870 -11.354 13.747 1.00 0.00 H new ATOM 0 HE3 LYS A 132 3.704 -9.840 13.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 2.086 -9.624 15.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 1.639 -8.647 13.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 0.832 -10.114 14.193 1.00 0.00 H new ATOM 1960 N ALA A 133 3.100 -11.908 6.647 1.00 0.00 N ATOM 1961 CA ALA A 133 2.827 -12.521 5.354 1.00 0.00 C ATOM 1962 C ALA A 133 2.238 -13.917 5.522 1.00 0.00 C ATOM 1963 O ALA A 133 2.697 -14.699 6.355 1.00 0.00 O ATOM 1964 CB ALA A 133 4.096 -12.578 4.518 1.00 0.00 C ATOM 0 H ALA A 133 4.084 -11.911 6.915 1.00 0.00 H new ATOM 0 HA ALA A 133 2.092 -11.905 4.836 1.00 0.00 H new ATOM 0 HB1 ALA A 133 3.877 -13.038 3.555 1.00 0.00 H new ATOM 0 HB2 ALA A 133 4.473 -11.568 4.360 1.00 0.00 H new ATOM 0 HB3 ALA A 133 4.849 -13.169 5.039 1.00 0.00 H new ATOM 1970 N VAL A 134 1.219 -14.225 4.726 1.00 0.00 N ATOM 1971 CA VAL A 134 0.568 -15.528 4.787 1.00 0.00 C ATOM 1972 C VAL A 134 1.302 -16.550 3.928 1.00 0.00 C ATOM 1973 O VAL A 134 1.674 -16.268 2.788 1.00 0.00 O ATOM 1974 CB VAL A 134 -0.899 -15.444 4.325 1.00 0.00 C ATOM 1975 CG1 VAL A 134 -1.584 -16.795 4.473 1.00 0.00 C ATOM 1976 CG2 VAL A 134 -1.644 -14.372 5.106 1.00 0.00 C ATOM 0 H VAL A 134 0.827 -13.590 4.031 1.00 0.00 H new ATOM 0 HA VAL A 134 0.596 -15.847 5.829 1.00 0.00 H new ATOM 0 HB VAL A 134 -0.914 -15.169 3.270 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -2.619 -16.716 4.142 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -1.064 -17.535 3.865 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -1.560 -17.103 5.518 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -2.679 -14.327 4.766 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -1.621 -14.614 6.169 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -1.167 -13.406 4.944 1.00 0.00 H new ATOM 1986 N THR A 135 1.509 -17.741 4.481 1.00 0.00 N ATOM 1987 CA THR A 135 2.200 -18.807 3.767 1.00 0.00 C ATOM 1988 C THR A 135 1.235 -19.915 3.364 1.00 0.00 C ATOM 1989 O THR A 135 0.493 -20.438 4.197 1.00 0.00 O ATOM 1990 CB THR A 135 3.332 -19.412 4.617 1.00 0.00 C ATOM 1991 OG1 THR A 135 4.070 -18.369 5.265 1.00 0.00 O ATOM 1992 CG2 THR A 135 4.272 -20.243 3.756 1.00 0.00 C ATOM 0 H THR A 135 1.207 -17.992 5.423 1.00 0.00 H new ATOM 0 HA THR A 135 2.629 -18.359 2.871 1.00 0.00 H new ATOM 0 HB THR A 135 2.883 -20.061 5.369 1.00 0.00 H new ATOM 0 HG1 THR A 135 4.787 -18.762 5.805 1.00 0.00 H new ATOM 0 HG21 THR A 135 5.063 -20.660 4.379 1.00 0.00 H new ATOM 0 HG22 THR A 135 3.715 -21.054 3.287 1.00 0.00 H new ATOM 0 HG23 THR A 135 4.712 -19.612 2.984 1.00 0.00 H new ATOM 2000 N ALA A 136 1.249 -20.270 2.083 1.00 0.00 N ATOM 2001 CA ALA A 136 0.376 -21.320 1.572 1.00 0.00 C ATOM 2002 C ALA A 136 0.961 -21.958 0.316 1.00 0.00 C ATOM 2003 O ALA A 136 1.359 -21.261 -0.619 1.00 0.00 O ATOM 2004 CB ALA A 136 -1.009 -20.760 1.285 1.00 0.00 C ATOM 0 H ALA A 136 1.855 -19.846 1.381 1.00 0.00 H new ATOM 0 HA ALA A 136 0.293 -22.093 2.336 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -1.651 -21.554 0.904 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -1.436 -20.357 2.203 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.934 -19.966 0.542 1.00 0.00 H new ATOM 2010 N LYS A 137 1.012 -23.285 0.301 1.00 0.00 N ATOM 2011 CA LYS A 137 1.548 -24.017 -0.840 1.00 0.00 C ATOM 2012 C LYS A 137 2.954 -23.535 -1.184 1.00 0.00 C ATOM 2013 O LYS A 137 3.252 -23.238 -2.340 1.00 0.00 O ATOM 2014 CB LYS A 137 0.630 -23.854 -2.054 1.00 0.00 C ATOM 2015 CG LYS A 137 -0.709 -24.554 -1.902 1.00 0.00 C ATOM 2016 CD LYS A 137 -1.740 -23.650 -1.249 1.00 0.00 C ATOM 2017 CE LYS A 137 -3.158 -24.092 -1.578 1.00 0.00 C ATOM 2018 NZ LYS A 137 -4.153 -23.021 -1.295 1.00 0.00 N ATOM 0 H LYS A 137 0.688 -23.876 1.067 1.00 0.00 H new ATOM 0 HA LYS A 137 1.600 -25.072 -0.571 1.00 0.00 H new ATOM 0 HB2 LYS A 137 0.458 -22.792 -2.229 1.00 0.00 H new ATOM 0 HB3 LYS A 137 1.136 -24.244 -2.937 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -1.069 -24.870 -2.881 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -0.583 -25.456 -1.303 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -1.598 -23.655 -0.168 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -1.591 -22.624 -1.585 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -3.216 -24.373 -2.630 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -3.405 -24.980 -0.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -5.107 -23.362 -1.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -4.116 -22.770 -0.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -3.932 -22.182 -1.868 1.00 0.00 H new ATOM 2032 N GLU A 138 3.814 -23.461 -0.173 1.00 0.00 N ATOM 2033 CA GLU A 138 5.187 -23.016 -0.371 1.00 0.00 C ATOM 2034 C GLU A 138 5.226 -21.659 -1.069 1.00 0.00 C ATOM 2035 O GLU A 138 6.185 -21.334 -1.768 1.00 0.00 O ATOM 2036 CB GLU A 138 5.968 -24.045 -1.191 1.00 0.00 C ATOM 2037 CG GLU A 138 5.745 -25.478 -0.740 1.00 0.00 C ATOM 2038 CD GLU A 138 6.868 -26.405 -1.164 1.00 0.00 C ATOM 2039 OE1 GLU A 138 7.996 -26.244 -0.652 1.00 0.00 O ATOM 2040 OE2 GLU A 138 6.619 -27.292 -2.007 1.00 0.00 O ATOM 0 H GLU A 138 3.584 -23.703 0.791 1.00 0.00 H new ATOM 0 HA GLU A 138 5.652 -22.914 0.610 1.00 0.00 H new ATOM 0 HB2 GLU A 138 5.683 -23.954 -2.239 1.00 0.00 H new ATOM 0 HB3 GLU A 138 7.032 -23.815 -1.129 1.00 0.00 H new ATOM 0 HG2 GLU A 138 5.649 -25.502 0.345 1.00 0.00 H new ATOM 0 HG3 GLU A 138 4.804 -25.842 -1.151 1.00 0.00 H new ATOM 2047 N VAL A 139 4.173 -20.871 -0.873 1.00 0.00 N ATOM 2048 CA VAL A 139 4.084 -19.550 -1.483 1.00 0.00 C ATOM 2049 C VAL A 139 3.599 -18.512 -0.477 1.00 0.00 C ATOM 2050 O VAL A 139 2.628 -18.741 0.246 1.00 0.00 O ATOM 2051 CB VAL A 139 3.137 -19.554 -2.697 1.00 0.00 C ATOM 2052 CG1 VAL A 139 3.109 -18.184 -3.357 1.00 0.00 C ATOM 2053 CG2 VAL A 139 3.553 -20.626 -3.693 1.00 0.00 C ATOM 0 H VAL A 139 3.370 -21.125 -0.297 1.00 0.00 H new ATOM 0 HA VAL A 139 5.088 -19.288 -1.817 1.00 0.00 H new ATOM 0 HB VAL A 139 2.130 -19.784 -2.350 1.00 0.00 H new ATOM 0 HG11 VAL A 139 2.434 -18.206 -4.213 1.00 0.00 H new ATOM 0 HG12 VAL A 139 2.760 -17.441 -2.639 1.00 0.00 H new ATOM 0 HG13 VAL A 139 4.112 -17.921 -3.692 1.00 0.00 H new ATOM 0 HG21 VAL A 139 2.873 -20.615 -4.545 1.00 0.00 H new ATOM 0 HG22 VAL A 139 4.568 -20.429 -4.037 1.00 0.00 H new ATOM 0 HG23 VAL A 139 3.516 -21.603 -3.212 1.00 0.00 H new ATOM 2063 N ILE A 140 4.279 -17.371 -0.437 1.00 0.00 N ATOM 2064 CA ILE A 140 3.916 -16.298 0.480 1.00 0.00 C ATOM 2065 C ILE A 140 3.050 -15.253 -0.214 1.00 0.00 C ATOM 2066 O ILE A 140 3.334 -14.843 -1.341 1.00 0.00 O ATOM 2067 CB ILE A 140 5.163 -15.610 1.064 1.00 0.00 C ATOM 2068 CG1 ILE A 140 6.128 -16.653 1.632 1.00 0.00 C ATOM 2069 CG2 ILE A 140 4.763 -14.610 2.139 1.00 0.00 C ATOM 2070 CD1 ILE A 140 7.399 -16.056 2.196 1.00 0.00 C ATOM 0 H ILE A 140 5.084 -17.166 -1.029 1.00 0.00 H new ATOM 0 HA ILE A 140 3.350 -16.754 1.292 1.00 0.00 H new ATOM 0 HB ILE A 140 5.670 -15.070 0.264 1.00 0.00 H new ATOM 0 HG12 ILE A 140 5.622 -17.216 2.416 1.00 0.00 H new ATOM 0 HG13 ILE A 140 6.387 -17.363 0.846 1.00 0.00 H new ATOM 0 HG21 ILE A 140 5.656 -14.132 2.542 1.00 0.00 H new ATOM 0 HG22 ILE A 140 4.110 -13.852 1.706 1.00 0.00 H new ATOM 0 HG23 ILE A 140 4.236 -15.128 2.940 1.00 0.00 H new ATOM 0 HD11 ILE A 140 8.036 -16.853 2.581 1.00 0.00 H new ATOM 0 HD12 ILE A 140 7.928 -15.517 1.410 1.00 0.00 H new ATOM 0 HD13 ILE A 140 7.150 -15.368 3.004 1.00 0.00 H new ATOM 2082 N THR A 141 1.993 -14.819 0.467 1.00 0.00 N ATOM 2083 CA THR A 141 1.086 -13.821 -0.084 1.00 0.00 C ATOM 2084 C THR A 141 0.670 -12.810 0.979 1.00 0.00 C ATOM 2085 O THR A 141 0.519 -13.155 2.151 1.00 0.00 O ATOM 2086 CB THR A 141 -0.177 -14.474 -0.676 1.00 0.00 C ATOM 2087 OG1 THR A 141 -0.573 -15.591 0.127 1.00 0.00 O ATOM 2088 CG2 THR A 141 0.070 -14.932 -2.106 1.00 0.00 C ATOM 0 H THR A 141 1.745 -15.144 1.401 1.00 0.00 H new ATOM 0 HA THR A 141 1.627 -13.308 -0.879 1.00 0.00 H new ATOM 0 HB THR A 141 -0.975 -13.731 -0.682 1.00 0.00 H new ATOM 0 HG1 THR A 141 -1.378 -16.000 -0.255 1.00 0.00 H new ATOM 0 HG21 THR A 141 -0.836 -15.390 -2.503 1.00 0.00 H new ATOM 0 HG22 THR A 141 0.342 -14.074 -2.721 1.00 0.00 H new ATOM 0 HG23 THR A 141 0.881 -15.660 -2.120 1.00 0.00 H new ATOM 2096 N ARG A 142 0.487 -11.562 0.563 1.00 0.00 N ATOM 2097 CA ARG A 142 0.089 -10.501 1.480 1.00 0.00 C ATOM 2098 C ARG A 142 -0.467 -9.301 0.717 1.00 0.00 C ATOM 2099 O ARG A 142 -0.250 -9.164 -0.487 1.00 0.00 O ATOM 2100 CB ARG A 142 1.279 -10.066 2.338 1.00 0.00 C ATOM 2101 CG ARG A 142 0.884 -9.255 3.561 1.00 0.00 C ATOM 2102 CD ARG A 142 -0.079 -10.024 4.452 1.00 0.00 C ATOM 2103 NE ARG A 142 -0.310 -9.344 5.724 1.00 0.00 N ATOM 2104 CZ ARG A 142 -1.352 -9.587 6.510 1.00 0.00 C ATOM 2105 NH1 ARG A 142 -2.255 -10.492 6.157 1.00 0.00 N ATOM 2106 NH2 ARG A 142 -1.492 -8.928 7.653 1.00 0.00 N ATOM 0 H ARG A 142 0.608 -11.260 -0.404 1.00 0.00 H new ATOM 0 HA ARG A 142 -0.695 -10.892 2.129 1.00 0.00 H new ATOM 0 HB2 ARG A 142 1.826 -10.952 2.661 1.00 0.00 H new ATOM 0 HB3 ARG A 142 1.961 -9.476 1.726 1.00 0.00 H new ATOM 0 HG2 ARG A 142 1.777 -8.993 4.129 1.00 0.00 H new ATOM 0 HG3 ARG A 142 0.421 -8.320 3.245 1.00 0.00 H new ATOM 0 HD2 ARG A 142 -1.028 -10.153 3.933 1.00 0.00 H new ATOM 0 HD3 ARG A 142 0.319 -11.021 4.641 1.00 0.00 H new ATOM 0 HE ARG A 142 0.367 -8.643 6.025 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -2.150 -11.003 5.280 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -3.055 -10.677 6.762 1.00 0.00 H new ATOM 0 HH21 ARG A 142 -0.798 -8.233 7.929 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -2.293 -9.116 8.255 1.00 0.00 H new ATOM 2120 N THR A 143 -1.185 -8.436 1.426 1.00 0.00 N ATOM 2121 CA THR A 143 -1.773 -7.250 0.817 1.00 0.00 C ATOM 2122 C THR A 143 -1.288 -5.980 1.506 1.00 0.00 C ATOM 2123 O THR A 143 -1.519 -5.781 2.698 1.00 0.00 O ATOM 2124 CB THR A 143 -3.311 -7.295 0.871 1.00 0.00 C ATOM 2125 OG1 THR A 143 -3.855 -6.068 0.369 1.00 0.00 O ATOM 2126 CG2 THR A 143 -3.796 -7.525 2.294 1.00 0.00 C ATOM 0 H THR A 143 -1.373 -8.535 2.424 1.00 0.00 H new ATOM 0 HA THR A 143 -1.454 -7.239 -0.225 1.00 0.00 H new ATOM 0 HB THR A 143 -3.650 -8.124 0.250 1.00 0.00 H new ATOM 0 HG1 THR A 143 -4.834 -6.105 0.405 1.00 0.00 H new ATOM 0 HG21 THR A 143 -4.886 -7.553 2.307 1.00 0.00 H new ATOM 0 HG22 THR A 143 -3.404 -8.473 2.663 1.00 0.00 H new ATOM 0 HG23 THR A 143 -3.446 -6.714 2.933 1.00 0.00 H new ATOM 2134 N VAL A 144 -0.614 -5.121 0.748 1.00 0.00 N ATOM 2135 CA VAL A 144 -0.097 -3.868 1.285 1.00 0.00 C ATOM 2136 C VAL A 144 -0.949 -2.685 0.836 1.00 0.00 C ATOM 2137 O VAL A 144 -1.375 -2.615 -0.316 1.00 0.00 O ATOM 2138 CB VAL A 144 1.362 -3.631 0.853 1.00 0.00 C ATOM 2139 CG1 VAL A 144 1.852 -2.277 1.348 1.00 0.00 C ATOM 2140 CG2 VAL A 144 2.257 -4.750 1.361 1.00 0.00 C ATOM 0 H VAL A 144 -0.413 -5.270 -0.241 1.00 0.00 H new ATOM 0 HA VAL A 144 -0.137 -3.949 2.371 1.00 0.00 H new ATOM 0 HB VAL A 144 1.405 -3.630 -0.236 1.00 0.00 H new ATOM 0 HG11 VAL A 144 2.885 -2.127 1.034 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.227 -1.488 0.929 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.796 -2.245 2.436 1.00 0.00 H new ATOM 0 HG21 VAL A 144 3.284 -4.566 1.046 1.00 0.00 H new ATOM 0 HG22 VAL A 144 2.212 -4.786 2.449 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.917 -5.702 0.952 1.00 0.00 H new ATOM 2150 N LYS A 145 -1.191 -1.756 1.755 1.00 0.00 N ATOM 2151 CA LYS A 145 -1.990 -0.574 1.454 1.00 0.00 C ATOM 2152 C LYS A 145 -1.323 0.686 1.996 1.00 0.00 C ATOM 2153 O LYS A 145 -0.977 0.759 3.175 1.00 0.00 O ATOM 2154 CB LYS A 145 -3.393 -0.716 2.050 1.00 0.00 C ATOM 2155 CG LYS A 145 -4.108 0.610 2.246 1.00 0.00 C ATOM 2156 CD LYS A 145 -4.185 1.399 0.950 1.00 0.00 C ATOM 2157 CE LYS A 145 -5.623 1.732 0.585 1.00 0.00 C ATOM 2158 NZ LYS A 145 -6.252 2.643 1.581 1.00 0.00 N ATOM 0 H LYS A 145 -0.845 -1.799 2.714 1.00 0.00 H new ATOM 0 HA LYS A 145 -2.068 -0.486 0.370 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -3.993 -1.350 1.397 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -3.321 -1.226 3.011 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -5.115 0.429 2.623 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -3.586 1.198 3.001 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -3.611 2.320 1.049 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -3.728 0.824 0.145 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -5.649 2.198 -0.400 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -6.203 0.812 0.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -6.988 3.211 1.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -6.679 2.081 2.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -5.528 3.274 1.980 1.00 0.00 H new ATOM 2172 N VAL A 146 -1.144 1.676 1.127 1.00 0.00 N ATOM 2173 CA VAL A 146 -0.519 2.934 1.518 1.00 0.00 C ATOM 2174 C VAL A 146 -1.568 3.971 1.906 1.00 0.00 C ATOM 2175 O VAL A 146 -2.390 4.377 1.085 1.00 0.00 O ATOM 2176 CB VAL A 146 0.355 3.503 0.385 1.00 0.00 C ATOM 2177 CG1 VAL A 146 0.970 4.831 0.801 1.00 0.00 C ATOM 2178 CG2 VAL A 146 1.434 2.506 -0.008 1.00 0.00 C ATOM 0 H VAL A 146 -1.423 1.631 0.147 1.00 0.00 H new ATOM 0 HA VAL A 146 0.112 2.719 2.380 1.00 0.00 H new ATOM 0 HB VAL A 146 -0.278 3.679 -0.485 1.00 0.00 H new ATOM 0 HG11 VAL A 146 1.584 5.218 -0.012 1.00 0.00 H new ATOM 0 HG12 VAL A 146 0.177 5.544 1.028 1.00 0.00 H new ATOM 0 HG13 VAL A 146 1.590 4.684 1.686 1.00 0.00 H new ATOM 0 HG21 VAL A 146 2.042 2.925 -0.810 1.00 0.00 H new ATOM 0 HG22 VAL A 146 2.066 2.295 0.855 1.00 0.00 H new ATOM 0 HG23 VAL A 146 0.968 1.582 -0.351 1.00 0.00 H new ATOM 2188 N THR A 147 -1.533 4.395 3.166 1.00 0.00 N ATOM 2189 CA THR A 147 -2.481 5.385 3.664 1.00 0.00 C ATOM 2190 C THR A 147 -1.763 6.643 4.139 1.00 0.00 C ATOM 2191 O THR A 147 -0.985 6.603 5.091 1.00 0.00 O ATOM 2192 CB THR A 147 -3.324 4.821 4.823 1.00 0.00 C ATOM 2193 OG1 THR A 147 -2.522 4.710 6.004 1.00 0.00 O ATOM 2194 CG2 THR A 147 -3.895 3.458 4.463 1.00 0.00 C ATOM 0 H THR A 147 -0.860 4.069 3.859 1.00 0.00 H new ATOM 0 HA THR A 147 -3.140 5.638 2.834 1.00 0.00 H new ATOM 0 HB THR A 147 -4.151 5.507 5.009 1.00 0.00 H new ATOM 0 HG1 THR A 147 -1.643 5.112 5.841 1.00 0.00 H new ATOM 0 HG21 THR A 147 -4.487 3.080 5.297 1.00 0.00 H new ATOM 0 HG22 THR A 147 -4.529 3.550 3.581 1.00 0.00 H new ATOM 0 HG23 THR A 147 -3.080 2.766 4.253 1.00 0.00 H new ATOM 2202 N ASN A 148 -2.029 7.759 3.468 1.00 0.00 N ATOM 2203 CA ASN A 148 -1.408 9.031 3.823 1.00 0.00 C ATOM 2204 C ASN A 148 -2.132 9.681 4.998 1.00 0.00 C ATOM 2205 O ASN A 148 -3.158 9.183 5.463 1.00 0.00 O ATOM 2206 CB ASN A 148 -1.412 9.976 2.620 1.00 0.00 C ATOM 2207 CG ASN A 148 -1.173 9.249 1.311 1.00 0.00 C ATOM 2208 OD1 ASN A 148 -1.905 9.439 0.340 1.00 0.00 O ATOM 2209 ND2 ASN A 148 -0.144 8.410 1.280 1.00 0.00 N ATOM 0 H ASN A 148 -2.670 7.809 2.676 1.00 0.00 H new ATOM 0 HA ASN A 148 -0.378 8.834 4.119 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -2.369 10.496 2.574 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -0.642 10.736 2.756 1.00 0.00 H new ATOM 0 HD21 ASN A 148 0.066 7.892 0.427 1.00 0.00 H new ATOM 0 HD22 ASN A 148 0.436 8.284 2.109 1.00 0.00 H new ATOM 2216 N VAL A 149 -1.590 10.797 5.475 1.00 0.00 N ATOM 2217 CA VAL A 149 -2.184 11.518 6.595 1.00 0.00 C ATOM 2218 C VAL A 149 -2.998 12.712 6.111 1.00 0.00 C ATOM 2219 O VAL A 149 -2.527 13.510 5.303 1.00 0.00 O ATOM 2220 CB VAL A 149 -1.108 12.009 7.581 1.00 0.00 C ATOM 2221 CG1 VAL A 149 -0.160 12.981 6.896 1.00 0.00 C ATOM 2222 CG2 VAL A 149 -1.755 12.651 8.799 1.00 0.00 C ATOM 0 H VAL A 149 -0.740 11.222 5.103 1.00 0.00 H new ATOM 0 HA VAL A 149 -2.843 10.817 7.108 1.00 0.00 H new ATOM 0 HB VAL A 149 -0.528 11.149 7.917 1.00 0.00 H new ATOM 0 HG11 VAL A 149 0.593 13.317 7.608 1.00 0.00 H new ATOM 0 HG12 VAL A 149 0.329 12.483 6.059 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -0.722 13.840 6.530 1.00 0.00 H new ATOM 0 HG21 VAL A 149 -0.980 12.992 9.485 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -2.360 13.501 8.484 1.00 0.00 H new ATOM 0 HG23 VAL A 149 -2.389 11.921 9.302 1.00 0.00 H new ATOM 2232 N GLY A 150 -4.224 12.828 6.611 1.00 0.00 N ATOM 2233 CA GLY A 150 -5.085 13.929 6.219 1.00 0.00 C ATOM 2234 C GLY A 150 -6.544 13.664 6.529 1.00 0.00 C ATOM 2235 O GLY A 150 -6.936 13.600 7.695 1.00 0.00 O ATOM 0 H GLY A 150 -4.637 12.179 7.281 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -4.767 14.836 6.733 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -4.971 14.112 5.150 1.00 0.00 H new