USER MOD reduce.3.24.130724 H: found=0, std=0, add=824, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 823 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 MET CE :methyl 150:sc= -0.0253 (180deg=-0.00527) USER MOD Set 1.2: A 103 HIS : no HD1:sc= -1.18 X(o=-1.2,f=-1.7) USER MOD Set 2.1: A 46 THR OG1 : rot 120:sc= -0.287 USER MOD Set 2.2: A 61 LYS NZ :NH3+ -134:sc= 0.908 (180deg=0) USER MOD Single : A 27 SER OG : rot -48:sc= 0.842 USER MOD Single : A 31 HIS : no HD1:sc= 0.195 K(o=0.2,f=-2.2!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS :FLIP no HD1:sc= -0.254 F(o=-1.2,f=-0.25) USER MOD Single : A 38 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.131) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 100:sc= -0.326 USER MOD Single : A 57 ASN : amide:sc= -0.358 K(o=-0.36,f=-3.6!) USER MOD Single : A 58 SER OG : rot -149:sc= -0.316! USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 15:sc= -5.81! USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 TYR OH : rot 175:sc= 0.824 USER MOD Single : A 78 SER OG : rot 170:sc= -0.522 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= -0.0195 X(o=-0.019,f=-0.013) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 MET CE :methyl -148:sc= -0.168 (180deg=-1.14) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ -131:sc= 2.23 (180deg=-1.31) USER MOD Single : A 112 THR OG1 : rot -72:sc= 1.2 USER MOD Single : A 114 ASN : amide:sc= -0.299 X(o=-0.3,f=-0.74) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -0.181 K(o=-0.18,f=-2.6!) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 159:sc=-0.00308 (180deg=-0.199) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 287 N ALA A 21 4.982 6.870 7.566 1.00 0.00 N ATOM 288 CA ALA A 21 3.678 6.445 8.047 1.00 0.00 C ATOM 289 C ALA A 21 3.856 5.293 9.038 1.00 0.00 C ATOM 290 O ALA A 21 4.926 4.691 9.111 1.00 0.00 O ATOM 291 CB ALA A 21 2.796 6.060 6.857 1.00 0.00 C ATOM 0 HA ALA A 21 3.179 7.258 8.573 1.00 0.00 H new ATOM 0 HB1 ALA A 21 1.818 5.741 7.217 1.00 0.00 H new ATOM 0 HB2 ALA A 21 2.677 6.921 6.199 1.00 0.00 H new ATOM 0 HB3 ALA A 21 3.264 5.244 6.307 1.00 0.00 H new ATOM 297 N ALA A 22 2.790 5.020 9.776 1.00 0.00 N ATOM 298 CA ALA A 22 2.815 3.951 10.760 1.00 0.00 C ATOM 299 C ALA A 22 2.520 2.619 10.067 1.00 0.00 C ATOM 300 O ALA A 22 1.679 2.554 9.171 1.00 0.00 O ATOM 301 CB ALA A 22 1.815 4.261 11.876 1.00 0.00 C ATOM 0 H ALA A 22 1.904 5.521 9.712 1.00 0.00 H new ATOM 0 HA ALA A 22 3.801 3.874 11.218 1.00 0.00 H new ATOM 0 HB1 ALA A 22 1.834 3.459 12.614 1.00 0.00 H new ATOM 0 HB2 ALA A 22 2.085 5.202 12.355 1.00 0.00 H new ATOM 0 HB3 ALA A 22 0.813 4.343 11.454 1.00 0.00 H new ATOM 307 N VAL A 23 3.229 1.590 10.507 1.00 0.00 N ATOM 308 CA VAL A 23 3.053 0.264 9.940 1.00 0.00 C ATOM 309 C VAL A 23 2.097 -0.541 10.822 1.00 0.00 C ATOM 310 O VAL A 23 1.924 -0.231 11.999 1.00 0.00 O ATOM 311 CB VAL A 23 4.414 -0.413 9.761 1.00 0.00 C ATOM 312 CG1 VAL A 23 4.253 -1.920 9.553 1.00 0.00 C ATOM 313 CG2 VAL A 23 5.194 0.220 8.607 1.00 0.00 C ATOM 0 H VAL A 23 3.926 1.648 11.249 1.00 0.00 H new ATOM 0 HA VAL A 23 2.604 0.329 8.949 1.00 0.00 H new ATOM 0 HB VAL A 23 4.987 -0.260 10.676 1.00 0.00 H new ATOM 0 HG11 VAL A 23 5.235 -2.377 9.428 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.757 -2.356 10.420 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.652 -2.102 8.662 1.00 0.00 H new ATOM 0 HG21 VAL A 23 6.157 -0.280 8.502 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.627 0.113 7.682 1.00 0.00 H new ATOM 0 HG23 VAL A 23 5.355 1.278 8.814 1.00 0.00 H new ATOM 323 N ASP A 24 1.500 -1.558 10.218 1.00 0.00 N ATOM 324 CA ASP A 24 0.565 -2.410 10.934 1.00 0.00 C ATOM 325 C ASP A 24 1.337 -3.526 11.640 1.00 0.00 C ATOM 326 O ASP A 24 2.366 -3.983 11.145 1.00 0.00 O ATOM 327 CB ASP A 24 -0.434 -3.060 9.974 1.00 0.00 C ATOM 328 CG ASP A 24 -1.840 -2.457 9.999 1.00 0.00 C ATOM 329 OD1 ASP A 24 -2.476 -2.544 11.071 1.00 0.00 O ATOM 330 OD2 ASP A 24 -2.247 -1.923 8.944 1.00 0.00 O ATOM 0 H ASP A 24 1.645 -1.811 9.241 1.00 0.00 H new ATOM 0 HA ASP A 24 0.026 -1.791 11.651 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.041 -2.986 8.960 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.506 -4.121 10.212 1.00 0.00 H new ATOM 335 N PRO A 25 0.796 -3.944 12.816 1.00 0.00 N ATOM 336 CA PRO A 25 1.423 -4.998 13.595 1.00 0.00 C ATOM 337 C PRO A 25 1.182 -6.368 12.958 1.00 0.00 C ATOM 338 O PRO A 25 1.908 -7.322 13.235 1.00 0.00 O ATOM 339 CB PRO A 25 0.817 -4.874 14.984 1.00 0.00 C ATOM 340 CG PRO A 25 -0.458 -4.064 14.811 1.00 0.00 C ATOM 341 CD PRO A 25 -0.421 -3.426 13.432 1.00 0.00 C ATOM 0 HA PRO A 25 2.508 -4.901 13.638 1.00 0.00 H new ATOM 0 HB2 PRO A 25 0.602 -5.856 15.405 1.00 0.00 H new ATOM 0 HB3 PRO A 25 1.506 -4.378 15.668 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -1.334 -4.705 14.912 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -0.532 -3.299 15.584 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -1.303 -3.691 12.849 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -0.399 -2.338 13.499 1.00 0.00 H new ATOM 349 N ASP A 26 0.160 -6.422 12.117 1.00 0.00 N ATOM 350 CA ASP A 26 -0.186 -7.660 11.438 1.00 0.00 C ATOM 351 C ASP A 26 0.831 -7.928 10.327 1.00 0.00 C ATOM 352 O ASP A 26 0.901 -9.037 9.799 1.00 0.00 O ATOM 353 CB ASP A 26 -1.573 -7.568 10.798 1.00 0.00 C ATOM 354 CG ASP A 26 -2.710 -8.161 11.631 1.00 0.00 C ATOM 355 OD1 ASP A 26 -2.393 -8.750 12.687 1.00 0.00 O ATOM 356 OD2 ASP A 26 -3.872 -8.011 11.194 1.00 0.00 O ATOM 0 H ASP A 26 -0.440 -5.629 11.890 1.00 0.00 H new ATOM 0 HA ASP A 26 -0.182 -8.462 12.176 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -1.796 -6.520 10.600 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -1.546 -8.076 9.834 1.00 0.00 H new ATOM 361 N SER A 27 1.594 -6.894 10.005 1.00 0.00 N ATOM 362 CA SER A 27 2.604 -7.005 8.966 1.00 0.00 C ATOM 363 C SER A 27 3.847 -7.708 9.517 1.00 0.00 C ATOM 364 O SER A 27 4.534 -8.423 8.789 1.00 0.00 O ATOM 365 CB SER A 27 2.976 -5.628 8.411 1.00 0.00 C ATOM 366 OG SER A 27 3.705 -4.850 9.356 1.00 0.00 O ATOM 0 H SER A 27 1.533 -5.976 10.445 1.00 0.00 H new ATOM 0 HA SER A 27 2.191 -7.597 8.149 1.00 0.00 H new ATOM 0 HB2 SER A 27 3.572 -5.751 7.506 1.00 0.00 H new ATOM 0 HB3 SER A 27 2.069 -5.095 8.126 1.00 0.00 H new ATOM 0 HG SER A 27 3.249 -4.877 10.223 1.00 0.00 H new ATOM 372 N GLY A 28 4.097 -7.480 10.798 1.00 0.00 N ATOM 373 CA GLY A 28 5.245 -8.083 11.455 1.00 0.00 C ATOM 374 C GLY A 28 6.482 -7.192 11.325 1.00 0.00 C ATOM 375 O GLY A 28 7.471 -7.390 12.028 1.00 0.00 O ATOM 0 H GLY A 28 3.525 -6.886 11.398 1.00 0.00 H new ATOM 0 HA2 GLY A 28 5.020 -8.248 12.509 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.448 -9.060 11.016 1.00 0.00 H new ATOM 379 N LEU A 29 6.385 -6.228 10.420 1.00 0.00 N ATOM 380 CA LEU A 29 7.484 -5.306 10.189 1.00 0.00 C ATOM 381 C LEU A 29 7.175 -3.971 10.870 1.00 0.00 C ATOM 382 O LEU A 29 7.824 -2.964 10.592 1.00 0.00 O ATOM 383 CB LEU A 29 7.772 -5.180 8.692 1.00 0.00 C ATOM 384 CG LEU A 29 7.690 -6.476 7.882 1.00 0.00 C ATOM 385 CD1 LEU A 29 7.929 -7.696 8.774 1.00 0.00 C ATOM 386 CD2 LEU A 29 6.361 -6.568 7.129 1.00 0.00 C ATOM 0 H LEU A 29 5.563 -6.066 9.839 1.00 0.00 H new ATOM 0 HA LEU A 29 8.402 -5.688 10.636 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.070 -4.464 8.266 1.00 0.00 H new ATOM 0 HB3 LEU A 29 8.770 -4.760 8.568 1.00 0.00 H new ATOM 0 HG LEU A 29 8.484 -6.463 7.135 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.865 -8.604 8.174 1.00 0.00 H new ATOM 0 HD12 LEU A 29 8.919 -7.628 9.226 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.173 -7.726 9.559 1.00 0.00 H new ATOM 0 HD21 LEU A 29 6.328 -7.498 6.561 1.00 0.00 H new ATOM 0 HD22 LEU A 29 5.537 -6.549 7.842 1.00 0.00 H new ATOM 0 HD23 LEU A 29 6.270 -5.723 6.447 1.00 0.00 H new ATOM 398 N GLU A 30 6.183 -4.006 11.748 1.00 0.00 N ATOM 399 CA GLU A 30 5.780 -2.811 12.470 1.00 0.00 C ATOM 400 C GLU A 30 6.948 -2.273 13.298 1.00 0.00 C ATOM 401 O GLU A 30 7.051 -1.068 13.523 1.00 0.00 O ATOM 402 CB GLU A 30 4.563 -3.090 13.354 1.00 0.00 C ATOM 403 CG GLU A 30 4.757 -4.371 14.168 1.00 0.00 C ATOM 404 CD GLU A 30 3.997 -4.299 15.494 1.00 0.00 C ATOM 405 OE1 GLU A 30 3.566 -3.178 15.840 1.00 0.00 O ATOM 406 OE2 GLU A 30 3.866 -5.366 16.131 1.00 0.00 O ATOM 0 H GLU A 30 5.647 -4.843 11.976 1.00 0.00 H new ATOM 0 HA GLU A 30 5.494 -2.050 11.744 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.398 -2.249 14.027 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.672 -3.181 12.733 1.00 0.00 H new ATOM 0 HG2 GLU A 30 4.409 -5.228 13.592 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.818 -4.526 14.361 1.00 0.00 H new ATOM 413 N HIS A 31 7.799 -3.192 13.731 1.00 0.00 N ATOM 414 CA HIS A 31 8.955 -2.824 14.530 1.00 0.00 C ATOM 415 C HIS A 31 10.236 -3.217 13.790 1.00 0.00 C ATOM 416 O HIS A 31 11.321 -3.199 14.368 1.00 0.00 O ATOM 417 CB HIS A 31 8.867 -3.438 15.928 1.00 0.00 C ATOM 418 CG HIS A 31 8.456 -4.891 15.937 1.00 0.00 C ATOM 419 ND1 HIS A 31 8.646 -5.730 14.853 1.00 0.00 N ATOM 420 CD2 HIS A 31 7.863 -5.644 16.908 1.00 0.00 C ATOM 421 CE1 HIS A 31 8.185 -6.932 15.168 1.00 0.00 C ATOM 422 NE2 HIS A 31 7.700 -6.876 16.442 1.00 0.00 N ATOM 0 H HIS A 31 7.711 -4.191 13.543 1.00 0.00 H new ATOM 0 HA HIS A 31 8.975 -1.743 14.672 1.00 0.00 H new ATOM 0 HB2 HIS A 31 9.836 -3.342 16.417 1.00 0.00 H new ATOM 0 HB3 HIS A 31 8.153 -2.866 16.521 1.00 0.00 H new ATOM 0 HD2 HIS A 31 7.575 -5.297 17.889 1.00 0.00 H new ATOM 0 HE1 HIS A 31 8.192 -7.802 14.529 1.00 0.00 H new ATOM 0 HE2 HIS A 31 7.281 -7.653 16.952 1.00 0.00 H new ATOM 430 N SER A 32 10.066 -3.563 12.522 1.00 0.00 N ATOM 431 CA SER A 32 11.195 -3.960 11.697 1.00 0.00 C ATOM 432 C SER A 32 11.307 -3.034 10.484 1.00 0.00 C ATOM 433 O SER A 32 12.345 -2.409 10.270 1.00 0.00 O ATOM 434 CB SER A 32 11.061 -5.415 11.244 1.00 0.00 C ATOM 435 OG SER A 32 12.319 -5.978 10.880 1.00 0.00 O ATOM 0 H SER A 32 9.164 -3.577 12.046 1.00 0.00 H new ATOM 0 HA SER A 32 12.102 -3.876 12.295 1.00 0.00 H new ATOM 0 HB2 SER A 32 10.618 -6.005 12.046 1.00 0.00 H new ATOM 0 HB3 SER A 32 10.380 -5.469 10.395 1.00 0.00 H new ATOM 0 HG SER A 32 12.192 -6.908 10.598 1.00 0.00 H new ATOM 441 N ALA A 33 10.225 -2.975 9.722 1.00 0.00 N ATOM 442 CA ALA A 33 10.189 -2.136 8.537 1.00 0.00 C ATOM 443 C ALA A 33 9.266 -0.942 8.789 1.00 0.00 C ATOM 444 O ALA A 33 8.650 -0.843 9.849 1.00 0.00 O ATOM 445 CB ALA A 33 9.745 -2.971 7.334 1.00 0.00 C ATOM 0 H ALA A 33 9.366 -3.495 9.903 1.00 0.00 H new ATOM 0 HA ALA A 33 11.182 -1.744 8.315 1.00 0.00 H new ATOM 0 HB1 ALA A 33 9.718 -2.342 6.444 1.00 0.00 H new ATOM 0 HB2 ALA A 33 10.449 -3.789 7.179 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.751 -3.378 7.521 1.00 0.00 H new ATOM 451 N HIS A 34 9.200 -0.066 7.798 1.00 0.00 N ATOM 452 CA HIS A 34 8.363 1.117 7.900 1.00 0.00 C ATOM 453 C HIS A 34 7.771 1.447 6.528 1.00 0.00 C ATOM 454 O HIS A 34 8.304 1.028 5.501 1.00 0.00 O ATOM 455 CB HIS A 34 9.144 2.285 8.504 1.00 0.00 C ATOM 456 CG HIS A 34 10.332 2.722 7.680 1.00 0.00 C ATOM 457 ND1 HIS A 34 10.457 2.933 6.339 1.00 0.00 N flip ATOM 458 CD2 HIS A 34 11.572 2.989 8.235 1.00 0.00 C flip ATOM 459 CE1 HIS A 34 11.704 3.311 6.087 1.00 0.00 C flip ATOM 460 NE2 HIS A 34 12.397 3.345 7.262 1.00 0.00 N flip ATOM 0 H HIS A 34 9.713 -0.152 6.920 1.00 0.00 H new ATOM 0 HA HIS A 34 7.533 0.921 8.578 1.00 0.00 H new ATOM 0 HB2 HIS A 34 8.470 3.133 8.629 1.00 0.00 H new ATOM 0 HB3 HIS A 34 9.489 2.002 9.499 1.00 0.00 H new ATOM 0 HD2 HIS A 34 11.824 2.919 9.283 1.00 0.00 H new ATOM 0 HE1 HIS A 34 12.104 3.552 5.113 1.00 0.00 H new ATOM 0 HE2 HIS A 34 13.379 3.600 7.372 1.00 0.00 H new ATOM 468 N VAL A 35 6.678 2.194 6.554 1.00 0.00 N ATOM 469 CA VAL A 35 6.008 2.585 5.326 1.00 0.00 C ATOM 470 C VAL A 35 7.031 3.190 4.362 1.00 0.00 C ATOM 471 O VAL A 35 7.816 4.054 4.748 1.00 0.00 O ATOM 472 CB VAL A 35 4.849 3.533 5.640 1.00 0.00 C ATOM 473 CG1 VAL A 35 4.094 3.918 4.366 1.00 0.00 C ATOM 474 CG2 VAL A 35 3.903 2.919 6.674 1.00 0.00 C ATOM 0 H VAL A 35 6.239 2.539 7.407 1.00 0.00 H new ATOM 0 HA VAL A 35 5.573 1.714 4.835 1.00 0.00 H new ATOM 0 HB VAL A 35 5.268 4.443 6.068 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.275 4.592 4.618 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.775 4.416 3.676 1.00 0.00 H new ATOM 0 HG13 VAL A 35 3.693 3.020 3.895 1.00 0.00 H new ATOM 0 HG21 VAL A 35 3.088 3.613 6.879 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.495 1.986 6.285 1.00 0.00 H new ATOM 0 HG23 VAL A 35 4.451 2.720 7.595 1.00 0.00 H new ATOM 484 N LEU A 36 6.988 2.711 3.128 1.00 0.00 N ATOM 485 CA LEU A 36 7.902 3.194 2.106 1.00 0.00 C ATOM 486 C LEU A 36 7.602 4.666 1.814 1.00 0.00 C ATOM 487 O LEU A 36 6.487 5.132 2.041 1.00 0.00 O ATOM 488 CB LEU A 36 7.844 2.297 0.868 1.00 0.00 C ATOM 489 CG LEU A 36 8.559 2.825 -0.377 1.00 0.00 C ATOM 490 CD1 LEU A 36 10.047 3.049 -0.101 1.00 0.00 C ATOM 491 CD2 LEU A 36 8.331 1.900 -1.574 1.00 0.00 C ATOM 0 H LEU A 36 6.335 1.994 2.812 1.00 0.00 H new ATOM 0 HA LEU A 36 8.931 3.142 2.460 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.272 1.328 1.125 1.00 0.00 H new ATOM 0 HB3 LEU A 36 6.797 2.126 0.616 1.00 0.00 H new ATOM 0 HG LEU A 36 8.130 3.794 -0.632 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.532 3.424 -1.002 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.163 3.776 0.703 1.00 0.00 H new ATOM 0 HD13 LEU A 36 10.508 2.106 0.193 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.850 2.298 -2.446 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.717 0.907 -1.345 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.264 1.835 -1.785 1.00 0.00 H new ATOM 503 N GLU A 37 8.616 5.356 1.314 1.00 0.00 N ATOM 504 CA GLU A 37 8.475 6.765 0.988 1.00 0.00 C ATOM 505 C GLU A 37 9.287 7.104 -0.263 1.00 0.00 C ATOM 506 O GLU A 37 10.471 6.780 -0.346 1.00 0.00 O ATOM 507 CB GLU A 37 8.892 7.645 2.168 1.00 0.00 C ATOM 508 CG GLU A 37 7.683 8.014 3.030 1.00 0.00 C ATOM 509 CD GLU A 37 8.101 8.263 4.481 1.00 0.00 C ATOM 510 OE1 GLU A 37 8.828 7.400 5.018 1.00 0.00 O ATOM 511 OE2 GLU A 37 7.683 9.311 5.020 1.00 0.00 O ATOM 0 H GLU A 37 9.539 4.965 1.126 1.00 0.00 H new ATOM 0 HA GLU A 37 7.424 6.967 0.781 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.630 7.120 2.775 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.370 8.552 1.799 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.203 8.906 2.628 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.946 7.212 2.992 1.00 0.00 H new ATOM 518 N LYS A 38 8.619 7.752 -1.206 1.00 0.00 N ATOM 519 CA LYS A 38 9.264 8.139 -2.449 1.00 0.00 C ATOM 520 C LYS A 38 8.685 9.473 -2.926 1.00 0.00 C ATOM 521 O LYS A 38 7.500 9.741 -2.738 1.00 0.00 O ATOM 522 CB LYS A 38 9.153 7.016 -3.483 1.00 0.00 C ATOM 523 CG LYS A 38 10.047 7.295 -4.693 1.00 0.00 C ATOM 524 CD LYS A 38 10.314 6.012 -5.484 1.00 0.00 C ATOM 525 CE LYS A 38 11.201 6.292 -6.698 1.00 0.00 C ATOM 526 NZ LYS A 38 10.462 7.081 -7.709 1.00 0.00 N ATOM 0 H LYS A 38 7.637 8.019 -1.134 1.00 0.00 H new ATOM 0 HA LYS A 38 10.332 8.292 -2.292 1.00 0.00 H new ATOM 0 HB2 LYS A 38 9.437 6.068 -3.027 1.00 0.00 H new ATOM 0 HB3 LYS A 38 8.117 6.916 -3.807 1.00 0.00 H new ATOM 0 HG2 LYS A 38 9.571 8.033 -5.339 1.00 0.00 H new ATOM 0 HG3 LYS A 38 10.992 7.725 -4.360 1.00 0.00 H new ATOM 0 HD2 LYS A 38 10.795 5.276 -4.839 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.369 5.579 -5.812 1.00 0.00 H new ATOM 0 HE2 LYS A 38 12.094 6.834 -6.386 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.536 5.352 -7.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 10.997 7.090 -8.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 9.528 6.652 -7.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 10.341 8.056 -7.368 1.00 0.00 H new ATOM 540 N GLY A 39 9.548 10.273 -3.534 1.00 0.00 N ATOM 541 CA GLY A 39 9.138 11.572 -4.039 1.00 0.00 C ATOM 542 C GLY A 39 8.367 12.355 -2.974 1.00 0.00 C ATOM 543 O GLY A 39 7.281 12.868 -3.240 1.00 0.00 O ATOM 0 H GLY A 39 10.530 10.046 -3.688 1.00 0.00 H new ATOM 0 HA2 GLY A 39 10.016 12.139 -4.349 1.00 0.00 H new ATOM 0 HA3 GLY A 39 8.514 11.442 -4.923 1.00 0.00 H new ATOM 547 N GLY A 40 8.960 12.424 -1.791 1.00 0.00 N ATOM 548 CA GLY A 40 8.343 13.136 -0.685 1.00 0.00 C ATOM 549 C GLY A 40 6.880 12.723 -0.514 1.00 0.00 C ATOM 550 O GLY A 40 6.021 13.562 -0.247 1.00 0.00 O ATOM 0 H GLY A 40 9.861 11.998 -1.574 1.00 0.00 H new ATOM 0 HA2 GLY A 40 8.892 12.932 0.234 1.00 0.00 H new ATOM 0 HA3 GLY A 40 8.403 14.210 -0.861 1.00 0.00 H new ATOM 554 N LYS A 41 6.641 11.429 -0.675 1.00 0.00 N ATOM 555 CA LYS A 41 5.297 10.894 -0.542 1.00 0.00 C ATOM 556 C LYS A 41 5.340 9.627 0.314 1.00 0.00 C ATOM 557 O LYS A 41 6.414 9.098 0.593 1.00 0.00 O ATOM 558 CB LYS A 41 4.665 10.685 -1.920 1.00 0.00 C ATOM 559 CG LYS A 41 3.951 11.952 -2.394 1.00 0.00 C ATOM 560 CD LYS A 41 2.480 11.944 -1.970 1.00 0.00 C ATOM 561 CE LYS A 41 1.591 11.397 -3.088 1.00 0.00 C ATOM 562 NZ LYS A 41 0.325 12.160 -3.164 1.00 0.00 N ATOM 0 H LYS A 41 7.356 10.736 -0.896 1.00 0.00 H new ATOM 0 HA LYS A 41 4.652 11.606 -0.026 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.436 10.407 -2.639 1.00 0.00 H new ATOM 0 HB3 LYS A 41 3.956 9.858 -1.877 1.00 0.00 H new ATOM 0 HG2 LYS A 41 4.448 12.830 -1.981 1.00 0.00 H new ATOM 0 HG3 LYS A 41 4.020 12.028 -3.479 1.00 0.00 H new ATOM 0 HD2 LYS A 41 2.359 11.335 -1.074 1.00 0.00 H new ATOM 0 HD3 LYS A 41 2.166 12.956 -1.713 1.00 0.00 H new ATOM 0 HE2 LYS A 41 2.117 11.457 -4.041 1.00 0.00 H new ATOM 0 HE3 LYS A 41 1.377 10.343 -2.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -0.267 11.776 -3.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -0.183 12.081 -2.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 0.534 13.160 -3.358 1.00 0.00 H new ATOM 576 N VAL A 42 4.157 9.177 0.707 1.00 0.00 N ATOM 577 CA VAL A 42 4.046 7.982 1.525 1.00 0.00 C ATOM 578 C VAL A 42 3.184 6.948 0.797 1.00 0.00 C ATOM 579 O VAL A 42 2.146 7.288 0.231 1.00 0.00 O ATOM 580 CB VAL A 42 3.503 8.344 2.909 1.00 0.00 C ATOM 581 CG1 VAL A 42 3.038 7.094 3.660 1.00 0.00 C ATOM 582 CG2 VAL A 42 4.544 9.117 3.722 1.00 0.00 C ATOM 0 H VAL A 42 3.268 9.619 0.474 1.00 0.00 H new ATOM 0 HA VAL A 42 5.027 7.535 1.682 1.00 0.00 H new ATOM 0 HB VAL A 42 2.638 8.992 2.770 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.657 7.379 4.640 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.248 6.602 3.093 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.878 6.410 3.782 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.132 9.362 4.701 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.437 8.504 3.847 1.00 0.00 H new ATOM 0 HG23 VAL A 42 4.805 10.036 3.198 1.00 0.00 H new ATOM 592 N PHE A 43 3.647 5.707 0.835 1.00 0.00 N ATOM 593 CA PHE A 43 2.931 4.622 0.185 1.00 0.00 C ATOM 594 C PHE A 43 1.806 4.095 1.078 1.00 0.00 C ATOM 595 O PHE A 43 1.730 2.896 1.344 1.00 0.00 O ATOM 596 CB PHE A 43 3.943 3.500 -0.056 1.00 0.00 C ATOM 597 CG PHE A 43 4.913 3.773 -1.208 1.00 0.00 C ATOM 598 CD1 PHE A 43 5.633 4.926 -1.232 1.00 0.00 C ATOM 599 CD2 PHE A 43 5.053 2.862 -2.208 1.00 0.00 C ATOM 600 CE1 PHE A 43 6.533 5.179 -2.301 1.00 0.00 C ATOM 601 CE2 PHE A 43 5.953 3.115 -3.277 1.00 0.00 C ATOM 602 CZ PHE A 43 6.674 4.268 -3.301 1.00 0.00 C ATOM 0 H PHE A 43 4.508 5.429 1.305 1.00 0.00 H new ATOM 0 HA PHE A 43 2.485 4.975 -0.745 1.00 0.00 H new ATOM 0 HB2 PHE A 43 4.516 3.339 0.857 1.00 0.00 H new ATOM 0 HB3 PHE A 43 3.403 2.576 -0.261 1.00 0.00 H new ATOM 0 HD1 PHE A 43 5.521 5.650 -0.438 1.00 0.00 H new ATOM 0 HD2 PHE A 43 4.480 1.947 -2.189 1.00 0.00 H new ATOM 0 HE1 PHE A 43 7.105 6.095 -2.320 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.065 2.392 -4.071 1.00 0.00 H new ATOM 0 HZ PHE A 43 7.358 4.460 -4.114 1.00 0.00 H new ATOM 612 N SER A 44 0.961 5.016 1.517 1.00 0.00 N ATOM 613 CA SER A 44 -0.156 4.660 2.374 1.00 0.00 C ATOM 614 C SER A 44 -1.450 5.265 1.827 1.00 0.00 C ATOM 615 O SER A 44 -1.737 6.439 2.059 1.00 0.00 O ATOM 616 CB SER A 44 0.082 5.126 3.812 1.00 0.00 C ATOM 617 OG SER A 44 -0.991 4.761 4.676 1.00 0.00 O ATOM 0 H SER A 44 1.028 6.009 1.295 1.00 0.00 H new ATOM 0 HA SER A 44 -0.246 3.574 2.383 1.00 0.00 H new ATOM 0 HB2 SER A 44 1.011 4.693 4.184 1.00 0.00 H new ATOM 0 HB3 SER A 44 0.207 6.209 3.826 1.00 0.00 H new ATOM 0 HG SER A 44 -0.801 5.075 5.585 1.00 0.00 H new ATOM 623 N ALA A 45 -2.196 4.438 1.110 1.00 0.00 N ATOM 624 CA ALA A 45 -3.453 4.877 0.528 1.00 0.00 C ATOM 625 C ALA A 45 -4.592 4.011 1.069 1.00 0.00 C ATOM 626 O ALA A 45 -4.529 2.784 1.002 1.00 0.00 O ATOM 627 CB ALA A 45 -3.355 4.824 -0.998 1.00 0.00 C ATOM 0 H ALA A 45 -1.954 3.466 0.919 1.00 0.00 H new ATOM 0 HA ALA A 45 -3.664 5.910 0.806 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -4.298 5.153 -1.435 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -2.551 5.479 -1.334 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -3.146 3.802 -1.314 1.00 0.00 H new ATOM 633 N THR A 46 -5.606 4.683 1.595 1.00 0.00 N ATOM 634 CA THR A 46 -6.757 3.989 2.147 1.00 0.00 C ATOM 635 C THR A 46 -7.906 3.974 1.137 1.00 0.00 C ATOM 636 O THR A 46 -8.576 4.986 0.938 1.00 0.00 O ATOM 637 CB THR A 46 -7.122 4.661 3.473 1.00 0.00 C ATOM 638 OG1 THR A 46 -6.011 4.382 4.321 1.00 0.00 O ATOM 639 CG2 THR A 46 -8.303 3.981 4.168 1.00 0.00 C ATOM 0 H THR A 46 -5.654 5.700 1.650 1.00 0.00 H new ATOM 0 HA THR A 46 -6.529 2.942 2.348 1.00 0.00 H new ATOM 0 HB THR A 46 -7.361 5.710 3.295 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.604 5.224 4.614 1.00 0.00 H new ATOM 0 HG21 THR A 46 -8.521 4.497 5.103 1.00 0.00 H new ATOM 0 HG22 THR A 46 -9.178 4.020 3.520 1.00 0.00 H new ATOM 0 HG23 THR A 46 -8.053 2.941 4.377 1.00 0.00 H new ATOM 647 N LEU A 47 -8.098 2.814 0.526 1.00 0.00 N ATOM 648 CA LEU A 47 -9.155 2.653 -0.458 1.00 0.00 C ATOM 649 C LEU A 47 -10.476 2.367 0.259 1.00 0.00 C ATOM 650 O LEU A 47 -10.480 1.881 1.389 1.00 0.00 O ATOM 651 CB LEU A 47 -8.771 1.588 -1.487 1.00 0.00 C ATOM 652 CG LEU A 47 -8.241 2.108 -2.825 1.00 0.00 C ATOM 653 CD1 LEU A 47 -7.415 3.382 -2.630 1.00 0.00 C ATOM 654 CD2 LEU A 47 -7.454 1.023 -3.563 1.00 0.00 C ATOM 0 H LEU A 47 -7.540 1.977 0.693 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.292 3.575 -1.023 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.013 0.941 -1.045 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -9.646 0.967 -1.682 1.00 0.00 H new ATOM 0 HG LEU A 47 -9.094 2.369 -3.451 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -7.050 3.731 -3.596 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -8.038 4.154 -2.177 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -6.568 3.170 -1.977 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -7.089 1.419 -4.510 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -6.609 0.707 -2.952 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -8.103 0.168 -3.753 1.00 0.00 H new ATOM 666 N GLY A 48 -11.565 2.681 -0.427 1.00 0.00 N ATOM 667 CA GLY A 48 -12.889 2.464 0.131 1.00 0.00 C ATOM 668 C GLY A 48 -13.939 2.355 -0.976 1.00 0.00 C ATOM 669 O GLY A 48 -14.238 3.339 -1.652 1.00 0.00 O ATOM 0 H GLY A 48 -11.558 3.084 -1.364 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -12.890 1.553 0.730 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -13.145 3.286 0.800 1.00 0.00 H new ATOM 673 N LEU A 49 -14.470 1.151 -1.128 1.00 0.00 N ATOM 674 CA LEU A 49 -15.481 0.901 -2.142 1.00 0.00 C ATOM 675 C LEU A 49 -16.769 0.427 -1.466 1.00 0.00 C ATOM 676 O LEU A 49 -16.725 -0.355 -0.517 1.00 0.00 O ATOM 677 CB LEU A 49 -14.950 -0.068 -3.200 1.00 0.00 C ATOM 678 CG LEU A 49 -15.820 -0.243 -4.447 1.00 0.00 C ATOM 679 CD1 LEU A 49 -16.973 -1.212 -4.179 1.00 0.00 C ATOM 680 CD2 LEU A 49 -16.316 1.110 -4.963 1.00 0.00 C ATOM 0 H LEU A 49 -14.219 0.338 -0.566 1.00 0.00 H new ATOM 0 HA LEU A 49 -15.720 1.821 -2.676 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -13.964 0.273 -3.514 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -14.816 -1.045 -2.735 1.00 0.00 H new ATOM 0 HG LEU A 49 -15.206 -0.683 -5.233 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -17.576 -1.319 -5.081 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -16.572 -2.185 -3.893 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -17.594 -0.824 -3.371 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -16.932 0.958 -5.849 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -16.908 1.600 -4.190 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -15.462 1.737 -5.218 1.00 0.00 H new ATOM 692 N VAL A 50 -17.886 0.921 -1.980 1.00 0.00 N ATOM 693 CA VAL A 50 -19.184 0.558 -1.438 1.00 0.00 C ATOM 694 C VAL A 50 -20.202 0.475 -2.576 1.00 0.00 C ATOM 695 O VAL A 50 -20.255 1.358 -3.432 1.00 0.00 O ATOM 696 CB VAL A 50 -19.589 1.547 -0.343 1.00 0.00 C ATOM 697 CG1 VAL A 50 -18.691 2.786 -0.364 1.00 0.00 C ATOM 698 CG2 VAL A 50 -21.063 1.936 -0.475 1.00 0.00 C ATOM 0 H VAL A 50 -17.919 1.570 -2.766 1.00 0.00 H new ATOM 0 HA VAL A 50 -19.141 -0.425 -0.969 1.00 0.00 H new ATOM 0 HB VAL A 50 -19.457 1.054 0.620 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -19.000 3.473 0.424 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -17.656 2.488 -0.200 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -18.777 3.281 -1.331 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -21.326 2.640 0.315 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -21.231 2.401 -1.446 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -21.684 1.044 -0.388 1.00 0.00 H new ATOM 708 N ASP A 51 -20.986 -0.593 -2.551 1.00 0.00 N ATOM 709 CA ASP A 51 -22.000 -0.802 -3.570 1.00 0.00 C ATOM 710 C ASP A 51 -23.299 -0.119 -3.139 1.00 0.00 C ATOM 711 O ASP A 51 -23.696 -0.210 -1.978 1.00 0.00 O ATOM 712 CB ASP A 51 -22.290 -2.292 -3.761 1.00 0.00 C ATOM 713 CG ASP A 51 -22.136 -2.802 -5.195 1.00 0.00 C ATOM 714 OD1 ASP A 51 -22.855 -2.269 -6.067 1.00 0.00 O ATOM 715 OD2 ASP A 51 -21.302 -3.714 -5.387 1.00 0.00 O ATOM 0 H ASP A 51 -20.939 -1.323 -1.840 1.00 0.00 H new ATOM 0 HA ASP A 51 -21.629 -0.384 -4.506 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -21.623 -2.862 -3.115 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -23.307 -2.495 -3.427 1.00 0.00 H new ATOM 720 N ILE A 52 -23.925 0.549 -4.096 1.00 0.00 N ATOM 721 CA ILE A 52 -25.171 1.247 -3.830 1.00 0.00 C ATOM 722 C ILE A 52 -26.346 0.300 -4.086 1.00 0.00 C ATOM 723 O ILE A 52 -27.374 0.387 -3.416 1.00 0.00 O ATOM 724 CB ILE A 52 -25.241 2.545 -4.637 1.00 0.00 C ATOM 725 CG1 ILE A 52 -26.569 3.267 -4.400 1.00 0.00 C ATOM 726 CG2 ILE A 52 -24.989 2.282 -6.123 1.00 0.00 C ATOM 727 CD1 ILE A 52 -26.344 4.759 -4.143 1.00 0.00 C ATOM 0 H ILE A 52 -23.592 0.622 -5.058 1.00 0.00 H new ATOM 0 HA ILE A 52 -25.224 1.546 -2.783 1.00 0.00 H new ATOM 0 HB ILE A 52 -24.448 3.207 -4.288 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -27.217 3.137 -5.267 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -27.083 2.821 -3.548 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -25.045 3.221 -6.673 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -23.999 1.844 -6.252 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -25.743 1.593 -6.504 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -27.304 5.249 -3.978 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -25.715 4.886 -3.262 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -25.852 5.207 -5.007 1.00 0.00 H new ATOM 739 N VAL A 53 -26.153 -0.582 -5.055 1.00 0.00 N ATOM 740 CA VAL A 53 -27.184 -1.544 -5.408 1.00 0.00 C ATOM 741 C VAL A 53 -27.098 -2.744 -4.463 1.00 0.00 C ATOM 742 O VAL A 53 -28.048 -3.037 -3.738 1.00 0.00 O ATOM 743 CB VAL A 53 -27.055 -1.932 -6.882 1.00 0.00 C ATOM 744 CG1 VAL A 53 -27.700 -3.294 -7.148 1.00 0.00 C ATOM 745 CG2 VAL A 53 -27.654 -0.854 -7.787 1.00 0.00 C ATOM 0 H VAL A 53 -25.298 -0.651 -5.607 1.00 0.00 H new ATOM 0 HA VAL A 53 -28.175 -1.105 -5.288 1.00 0.00 H new ATOM 0 HB VAL A 53 -25.994 -2.013 -7.116 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -27.595 -3.547 -8.203 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -27.208 -4.054 -6.542 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -28.758 -3.252 -6.889 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -27.549 -1.155 -8.829 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -28.710 -0.726 -7.551 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -27.130 0.088 -7.627 1.00 0.00 H new ATOM 755 N LYS A 54 -25.952 -3.407 -4.502 1.00 0.00 N ATOM 756 CA LYS A 54 -25.730 -4.570 -3.659 1.00 0.00 C ATOM 757 C LYS A 54 -25.787 -4.147 -2.190 1.00 0.00 C ATOM 758 O LYS A 54 -25.895 -4.990 -1.301 1.00 0.00 O ATOM 759 CB LYS A 54 -24.428 -5.272 -4.046 1.00 0.00 C ATOM 760 CG LYS A 54 -24.579 -6.011 -5.377 1.00 0.00 C ATOM 761 CD LYS A 54 -24.803 -7.508 -5.151 1.00 0.00 C ATOM 762 CE LYS A 54 -24.099 -8.337 -6.228 1.00 0.00 C ATOM 763 NZ LYS A 54 -24.988 -9.413 -6.717 1.00 0.00 N ATOM 0 H LYS A 54 -25.167 -3.161 -5.104 1.00 0.00 H new ATOM 0 HA LYS A 54 -26.519 -5.307 -3.811 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -23.624 -4.540 -4.122 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -24.144 -5.977 -3.265 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -25.417 -5.594 -5.935 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -23.686 -5.861 -5.984 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -24.429 -7.791 -4.167 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -25.871 -7.725 -5.160 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -23.807 -7.693 -7.058 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -23.184 -8.769 -5.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -24.495 -9.966 -7.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -25.246 -10.037 -5.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -25.849 -8.994 -7.123 1.00 0.00 H new ATOM 777 N GLY A 55 -25.712 -2.840 -1.980 1.00 0.00 N ATOM 778 CA GLY A 55 -25.754 -2.295 -0.633 1.00 0.00 C ATOM 779 C GLY A 55 -24.657 -2.908 0.240 1.00 0.00 C ATOM 780 O GLY A 55 -24.857 -3.123 1.435 1.00 0.00 O ATOM 0 H GLY A 55 -25.622 -2.143 -2.720 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -25.632 -1.213 -0.671 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -26.730 -2.490 -0.188 1.00 0.00 H new ATOM 784 N THR A 56 -23.521 -3.170 -0.389 1.00 0.00 N ATOM 785 CA THR A 56 -22.392 -3.754 0.315 1.00 0.00 C ATOM 786 C THR A 56 -21.222 -2.769 0.354 1.00 0.00 C ATOM 787 O THR A 56 -20.737 -2.334 -0.689 1.00 0.00 O ATOM 788 CB THR A 56 -22.047 -5.082 -0.361 1.00 0.00 C ATOM 789 OG1 THR A 56 -22.027 -4.768 -1.751 1.00 0.00 O ATOM 790 CG2 THR A 56 -23.167 -6.115 -0.228 1.00 0.00 C ATOM 0 H THR A 56 -23.358 -2.988 -1.379 1.00 0.00 H new ATOM 0 HA THR A 56 -22.639 -3.959 1.357 1.00 0.00 H new ATOM 0 HB THR A 56 -21.131 -5.483 0.072 1.00 0.00 H new ATOM 0 HG1 THR A 56 -21.100 -4.646 -2.046 1.00 0.00 H new ATOM 0 HG21 THR A 56 -22.871 -7.039 -0.725 1.00 0.00 H new ATOM 0 HG22 THR A 56 -23.355 -6.315 0.827 1.00 0.00 H new ATOM 0 HG23 THR A 56 -24.075 -5.729 -0.691 1.00 0.00 H new ATOM 798 N ASN A 57 -20.801 -2.447 1.569 1.00 0.00 N ATOM 799 CA ASN A 57 -19.697 -1.522 1.757 1.00 0.00 C ATOM 800 C ASN A 57 -18.392 -2.311 1.885 1.00 0.00 C ATOM 801 O ASN A 57 -18.375 -3.400 2.456 1.00 0.00 O ATOM 802 CB ASN A 57 -19.879 -0.699 3.035 1.00 0.00 C ATOM 803 CG ASN A 57 -21.158 0.138 2.971 1.00 0.00 C ATOM 804 OD1 ASN A 57 -22.153 -0.247 2.380 1.00 0.00 O ATOM 805 ND2 ASN A 57 -21.075 1.301 3.610 1.00 0.00 N ATOM 0 H ASN A 57 -21.205 -2.810 2.432 1.00 0.00 H new ATOM 0 HA ASN A 57 -19.668 -0.852 0.898 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -19.918 -1.364 3.898 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -19.019 -0.045 3.176 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -21.876 1.933 3.625 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -20.211 1.561 4.085 1.00 0.00 H new ATOM 812 N SER A 58 -17.332 -1.731 1.343 1.00 0.00 N ATOM 813 CA SER A 58 -16.026 -2.366 1.389 1.00 0.00 C ATOM 814 C SER A 58 -14.950 -1.329 1.720 1.00 0.00 C ATOM 815 O SER A 58 -15.175 -0.129 1.574 1.00 0.00 O ATOM 816 CB SER A 58 -15.704 -3.060 0.064 1.00 0.00 C ATOM 817 OG SER A 58 -14.332 -3.435 -0.023 1.00 0.00 O ATOM 0 H SER A 58 -17.351 -0.828 0.869 1.00 0.00 H new ATOM 0 HA SER A 58 -16.043 -3.125 2.171 1.00 0.00 H new ATOM 0 HB2 SER A 58 -16.329 -3.946 -0.042 1.00 0.00 H new ATOM 0 HB3 SER A 58 -15.951 -2.395 -0.763 1.00 0.00 H new ATOM 0 HG SER A 58 -14.042 -3.400 -0.958 1.00 0.00 H new ATOM 823 N TYR A 59 -13.805 -1.831 2.158 1.00 0.00 N ATOM 824 CA TYR A 59 -12.694 -0.963 2.511 1.00 0.00 C ATOM 825 C TYR A 59 -11.356 -1.678 2.315 1.00 0.00 C ATOM 826 O TYR A 59 -11.105 -2.713 2.930 1.00 0.00 O ATOM 827 CB TYR A 59 -12.871 -0.634 3.994 1.00 0.00 C ATOM 828 CG TYR A 59 -12.453 -1.765 4.936 1.00 0.00 C ATOM 829 CD1 TYR A 59 -11.133 -1.891 5.320 1.00 0.00 C ATOM 830 CD2 TYR A 59 -13.395 -2.658 5.403 1.00 0.00 C ATOM 831 CE1 TYR A 59 -10.739 -2.955 6.206 1.00 0.00 C ATOM 832 CE2 TYR A 59 -13.001 -3.723 6.290 1.00 0.00 C ATOM 833 CZ TYR A 59 -11.693 -3.819 6.648 1.00 0.00 C ATOM 834 OH TYR A 59 -11.321 -4.824 7.485 1.00 0.00 O ATOM 0 H TYR A 59 -13.622 -2.827 2.277 1.00 0.00 H new ATOM 0 HA TYR A 59 -12.688 -0.072 1.883 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -12.288 0.256 4.230 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -13.917 -0.389 4.179 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -10.396 -1.191 4.956 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -14.428 -2.559 5.104 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.709 -3.065 6.513 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -13.728 -4.429 6.662 1.00 0.00 H new ATOM 0 HH TYR A 59 -12.106 -5.362 7.720 1.00 0.00 H new ATOM 844 N TYR A 60 -10.532 -1.098 1.455 1.00 0.00 N ATOM 845 CA TYR A 60 -9.226 -1.667 1.170 1.00 0.00 C ATOM 846 C TYR A 60 -8.107 -0.749 1.668 1.00 0.00 C ATOM 847 O TYR A 60 -8.286 0.465 1.749 1.00 0.00 O ATOM 848 CB TYR A 60 -9.137 -1.778 -0.353 1.00 0.00 C ATOM 849 CG TYR A 60 -8.048 -2.733 -0.846 1.00 0.00 C ATOM 850 CD1 TYR A 60 -8.331 -4.072 -1.019 1.00 0.00 C ATOM 851 CD2 TYR A 60 -6.781 -2.254 -1.116 1.00 0.00 C ATOM 852 CE1 TYR A 60 -7.305 -4.971 -1.482 1.00 0.00 C ATOM 853 CE2 TYR A 60 -5.756 -3.153 -1.579 1.00 0.00 C ATOM 854 CZ TYR A 60 -6.068 -4.467 -1.739 1.00 0.00 C ATOM 855 OH TYR A 60 -5.100 -5.315 -2.177 1.00 0.00 O ATOM 0 H TYR A 60 -10.744 -0.240 0.946 1.00 0.00 H new ATOM 0 HA TYR A 60 -9.111 -2.630 1.667 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.100 -2.111 -0.739 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -8.952 -0.787 -0.769 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -9.322 -4.446 -0.807 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -6.559 -1.206 -0.980 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -7.513 -6.021 -1.622 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.761 -2.792 -1.794 1.00 0.00 H new ATOM 0 HH TYR A 60 -5.510 -6.155 -2.472 1.00 0.00 H new ATOM 865 N LYS A 61 -6.979 -1.365 1.990 1.00 0.00 N ATOM 866 CA LYS A 61 -5.832 -0.618 2.478 1.00 0.00 C ATOM 867 C LYS A 61 -4.565 -1.130 1.790 1.00 0.00 C ATOM 868 O LYS A 61 -4.317 -2.335 1.755 1.00 0.00 O ATOM 869 CB LYS A 61 -5.767 -0.674 4.006 1.00 0.00 C ATOM 870 CG LYS A 61 -6.153 0.673 4.620 1.00 0.00 C ATOM 871 CD LYS A 61 -4.927 1.574 4.780 1.00 0.00 C ATOM 872 CE LYS A 61 -4.766 2.027 6.233 1.00 0.00 C ATOM 873 NZ LYS A 61 -5.570 3.243 6.489 1.00 0.00 N ATOM 0 H LYS A 61 -6.835 -2.373 1.923 1.00 0.00 H new ATOM 0 HA LYS A 61 -5.929 0.438 2.224 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -6.437 -1.451 4.374 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -4.760 -0.946 4.321 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -6.891 1.166 3.988 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.621 0.513 5.592 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -4.033 1.038 4.461 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -5.024 2.445 4.132 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -5.079 1.229 6.906 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -3.715 2.228 6.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -4.995 3.936 7.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -5.874 3.655 5.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -6.407 2.993 7.054 1.00 0.00 H new ATOM 887 N LEU A 62 -3.797 -0.190 1.259 1.00 0.00 N ATOM 888 CA LEU A 62 -2.562 -0.531 0.573 1.00 0.00 C ATOM 889 C LEU A 62 -1.396 0.205 1.236 1.00 0.00 C ATOM 890 O LEU A 62 -1.414 1.430 1.347 1.00 0.00 O ATOM 891 CB LEU A 62 -2.689 -0.258 -0.927 1.00 0.00 C ATOM 892 CG LEU A 62 -1.676 -0.969 -1.826 1.00 0.00 C ATOM 893 CD1 LEU A 62 -2.035 -2.447 -1.995 1.00 0.00 C ATOM 894 CD2 LEU A 62 -1.541 -0.255 -3.172 1.00 0.00 C ATOM 0 H LEU A 62 -4.006 0.808 1.290 1.00 0.00 H new ATOM 0 HA LEU A 62 -2.358 -1.598 0.663 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -3.691 -0.545 -1.245 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.598 0.816 -1.090 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.701 -0.928 -1.340 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.299 -2.929 -2.638 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.039 -2.934 -1.020 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.023 -2.532 -2.447 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.815 -0.781 -3.792 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -2.507 -0.243 -3.676 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.205 0.769 -3.009 1.00 0.00 H new ATOM 906 N GLN A 63 -0.411 -0.573 1.659 1.00 0.00 N ATOM 907 CA GLN A 63 0.761 -0.010 2.308 1.00 0.00 C ATOM 908 C GLN A 63 2.019 -0.770 1.883 1.00 0.00 C ATOM 909 O GLN A 63 2.058 -1.998 1.945 1.00 0.00 O ATOM 910 CB GLN A 63 0.603 -0.020 3.830 1.00 0.00 C ATOM 911 CG GLN A 63 -0.344 1.090 4.289 1.00 0.00 C ATOM 912 CD GLN A 63 -0.689 0.938 5.772 1.00 0.00 C ATOM 913 OE1 GLN A 63 -1.718 0.399 6.145 1.00 0.00 O ATOM 914 NE2 GLN A 63 0.227 1.440 6.595 1.00 0.00 N ATOM 0 H GLN A 63 -0.400 -1.589 1.565 1.00 0.00 H new ATOM 0 HA GLN A 63 0.863 1.028 1.993 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.219 -0.988 4.153 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.577 0.110 4.301 1.00 0.00 H new ATOM 0 HG2 GLN A 63 0.119 2.062 4.117 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.257 1.063 3.695 1.00 0.00 H new ATOM 0 HE21 GLN A 63 1.067 1.878 6.217 1.00 0.00 H new ATOM 0 HE22 GLN A 63 0.090 1.387 7.604 1.00 0.00 H new ATOM 923 N LEU A 64 3.017 -0.008 1.459 1.00 0.00 N ATOM 924 CA LEU A 64 4.274 -0.594 1.024 1.00 0.00 C ATOM 925 C LEU A 64 5.315 -0.441 2.135 1.00 0.00 C ATOM 926 O LEU A 64 5.846 0.648 2.347 1.00 0.00 O ATOM 927 CB LEU A 64 4.709 0.007 -0.314 1.00 0.00 C ATOM 928 CG LEU A 64 6.079 -0.435 -0.833 1.00 0.00 C ATOM 929 CD1 LEU A 64 6.459 -1.809 -0.277 1.00 0.00 C ATOM 930 CD2 LEU A 64 6.123 -0.402 -2.362 1.00 0.00 C ATOM 0 H LEU A 64 2.981 1.010 1.407 1.00 0.00 H new ATOM 0 HA LEU A 64 4.155 -1.662 0.844 1.00 0.00 H new ATOM 0 HB2 LEU A 64 3.959 -0.245 -1.064 1.00 0.00 H new ATOM 0 HB3 LEU A 64 4.711 1.093 -0.219 1.00 0.00 H new ATOM 0 HG LEU A 64 6.825 0.274 -0.475 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.437 -2.099 -0.661 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.496 -1.764 0.811 1.00 0.00 H new ATOM 0 HD13 LEU A 64 5.715 -2.544 -0.584 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.107 -0.721 -2.705 1.00 0.00 H new ATOM 0 HD22 LEU A 64 5.364 -1.074 -2.762 1.00 0.00 H new ATOM 0 HD23 LEU A 64 5.929 0.613 -2.710 1.00 0.00 H new ATOM 942 N LEU A 65 5.575 -1.548 2.814 1.00 0.00 N ATOM 943 CA LEU A 65 6.543 -1.551 3.898 1.00 0.00 C ATOM 944 C LEU A 65 7.956 -1.607 3.313 1.00 0.00 C ATOM 945 O LEU A 65 8.224 -2.387 2.401 1.00 0.00 O ATOM 946 CB LEU A 65 6.241 -2.682 4.883 1.00 0.00 C ATOM 947 CG LEU A 65 4.819 -2.717 5.448 1.00 0.00 C ATOM 948 CD1 LEU A 65 4.670 -3.828 6.489 1.00 0.00 C ATOM 949 CD2 LEU A 65 4.416 -1.351 6.006 1.00 0.00 C ATOM 0 H LEU A 65 5.132 -2.449 2.635 1.00 0.00 H new ATOM 0 HA LEU A 65 6.472 -0.629 4.475 1.00 0.00 H new ATOM 0 HB2 LEU A 65 6.437 -3.632 4.386 1.00 0.00 H new ATOM 0 HB3 LEU A 65 6.940 -2.608 5.716 1.00 0.00 H new ATOM 0 HG LEU A 65 4.133 -2.946 4.632 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.650 -3.831 6.875 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.886 -4.791 6.027 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.367 -3.655 7.309 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.401 -1.404 6.401 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.102 -1.067 6.804 1.00 0.00 H new ATOM 0 HD23 LEU A 65 4.457 -0.607 5.211 1.00 0.00 H new ATOM 961 N GLU A 66 8.823 -0.769 3.863 1.00 0.00 N ATOM 962 CA GLU A 66 10.201 -0.712 3.408 1.00 0.00 C ATOM 963 C GLU A 66 11.157 -0.968 4.575 1.00 0.00 C ATOM 964 O GLU A 66 10.912 -0.516 5.693 1.00 0.00 O ATOM 965 CB GLU A 66 10.503 0.629 2.737 1.00 0.00 C ATOM 966 CG GLU A 66 12.008 0.899 2.702 1.00 0.00 C ATOM 967 CD GLU A 66 12.323 2.146 1.873 1.00 0.00 C ATOM 968 OE1 GLU A 66 12.086 3.253 2.401 1.00 0.00 O ATOM 969 OE2 GLU A 66 12.794 1.963 0.730 1.00 0.00 O ATOM 0 H GLU A 66 8.597 -0.124 4.620 1.00 0.00 H new ATOM 0 HA GLU A 66 10.349 -1.495 2.664 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.106 0.629 1.722 1.00 0.00 H new ATOM 0 HB3 GLU A 66 9.999 1.431 3.276 1.00 0.00 H new ATOM 0 HG2 GLU A 66 12.381 1.030 3.718 1.00 0.00 H new ATOM 0 HG3 GLU A 66 12.526 0.037 2.280 1.00 0.00 H new ATOM 976 N ASP A 67 12.225 -1.693 4.276 1.00 0.00 N ATOM 977 CA ASP A 67 13.218 -2.014 5.286 1.00 0.00 C ATOM 978 C ASP A 67 13.804 -0.718 5.850 1.00 0.00 C ATOM 979 O ASP A 67 13.863 0.294 5.155 1.00 0.00 O ATOM 980 CB ASP A 67 14.366 -2.832 4.690 1.00 0.00 C ATOM 981 CG ASP A 67 15.673 -2.785 5.483 1.00 0.00 C ATOM 982 OD1 ASP A 67 15.784 -3.579 6.442 1.00 0.00 O ATOM 983 OD2 ASP A 67 16.532 -1.956 5.112 1.00 0.00 O ATOM 0 H ASP A 67 12.424 -2.067 3.348 1.00 0.00 H new ATOM 0 HA ASP A 67 12.728 -2.596 6.067 1.00 0.00 H new ATOM 0 HB2 ASP A 67 14.047 -3.871 4.606 1.00 0.00 H new ATOM 0 HB3 ASP A 67 14.559 -2.475 3.678 1.00 0.00 H new ATOM 988 N ASP A 68 14.222 -0.792 7.105 1.00 0.00 N ATOM 989 CA ASP A 68 14.801 0.362 7.770 1.00 0.00 C ATOM 990 C ASP A 68 15.633 1.161 6.764 1.00 0.00 C ATOM 991 O ASP A 68 15.479 2.376 6.653 1.00 0.00 O ATOM 992 CB ASP A 68 15.725 -0.066 8.913 1.00 0.00 C ATOM 993 CG ASP A 68 15.026 -0.756 10.085 1.00 0.00 C ATOM 994 OD1 ASP A 68 13.892 -0.333 10.399 1.00 0.00 O ATOM 995 OD2 ASP A 68 15.640 -1.692 10.642 1.00 0.00 O ATOM 0 H ASP A 68 14.171 -1.634 7.679 1.00 0.00 H new ATOM 0 HA ASP A 68 13.986 0.964 8.171 1.00 0.00 H new ATOM 0 HB2 ASP A 68 16.483 -0.740 8.514 1.00 0.00 H new ATOM 0 HB3 ASP A 68 16.246 0.815 9.288 1.00 0.00 H new ATOM 1051 N ARG A 72 14.892 -5.023 2.110 1.00 0.00 N ATOM 1052 CA ARG A 72 13.751 -5.892 2.343 1.00 0.00 C ATOM 1053 C ARG A 72 12.456 -5.077 2.350 1.00 0.00 C ATOM 1054 O ARG A 72 12.398 -4.003 2.947 1.00 0.00 O ATOM 1055 CB ARG A 72 13.886 -6.634 3.674 1.00 0.00 C ATOM 1056 CG ARG A 72 14.519 -8.013 3.471 1.00 0.00 C ATOM 1057 CD ARG A 72 14.640 -8.761 4.800 1.00 0.00 C ATOM 1058 NE ARG A 72 15.996 -9.338 4.934 1.00 0.00 N ATOM 1059 CZ ARG A 72 16.443 -9.958 6.034 1.00 0.00 C ATOM 1060 NH1 ARG A 72 15.644 -10.086 7.103 1.00 0.00 N ATOM 1061 NH2 ARG A 72 17.689 -10.450 6.067 1.00 0.00 N ATOM 0 HA ARG A 72 13.720 -6.623 1.535 1.00 0.00 H new ATOM 0 HB2 ARG A 72 14.496 -6.048 4.361 1.00 0.00 H new ATOM 0 HB3 ARG A 72 12.904 -6.745 4.134 1.00 0.00 H new ATOM 0 HG2 ARG A 72 13.915 -8.596 2.775 1.00 0.00 H new ATOM 0 HG3 ARG A 72 15.505 -7.902 3.021 1.00 0.00 H new ATOM 0 HD2 ARG A 72 14.441 -8.081 5.629 1.00 0.00 H new ATOM 0 HD3 ARG A 72 13.892 -9.553 4.851 1.00 0.00 H new ATOM 0 HE ARG A 72 16.630 -9.259 4.139 1.00 0.00 H new ATOM 0 HH11 ARG A 72 14.696 -9.711 7.079 1.00 0.00 H new ATOM 0 HH12 ARG A 72 15.984 -10.558 7.941 1.00 0.00 H new ATOM 0 HH21 ARG A 72 18.298 -10.352 5.254 1.00 0.00 H new ATOM 0 HH22 ARG A 72 18.029 -10.922 6.905 1.00 0.00 H new ATOM 1075 N TYR A 73 11.449 -5.618 1.680 1.00 0.00 N ATOM 1076 CA TYR A 73 10.159 -4.955 1.603 1.00 0.00 C ATOM 1077 C TYR A 73 9.018 -5.973 1.601 1.00 0.00 C ATOM 1078 O TYR A 73 9.232 -7.151 1.316 1.00 0.00 O ATOM 1079 CB TYR A 73 10.154 -4.198 0.273 1.00 0.00 C ATOM 1080 CG TYR A 73 11.180 -3.065 0.197 1.00 0.00 C ATOM 1081 CD1 TYR A 73 12.525 -3.358 0.095 1.00 0.00 C ATOM 1082 CD2 TYR A 73 10.760 -1.751 0.231 1.00 0.00 C ATOM 1083 CE1 TYR A 73 13.490 -2.292 0.023 1.00 0.00 C ATOM 1084 CE2 TYR A 73 11.726 -0.685 0.160 1.00 0.00 C ATOM 1085 CZ TYR A 73 13.043 -1.008 0.059 1.00 0.00 C ATOM 1086 OH TYR A 73 13.955 -0.002 -0.008 1.00 0.00 O ATOM 0 H TYR A 73 11.501 -6.509 1.185 1.00 0.00 H new ATOM 0 HA TYR A 73 10.014 -4.297 2.460 1.00 0.00 H new ATOM 0 HB2 TYR A 73 10.347 -4.903 -0.535 1.00 0.00 H new ATOM 0 HB3 TYR A 73 9.159 -3.785 0.106 1.00 0.00 H new ATOM 0 HD1 TYR A 73 12.853 -4.387 0.069 1.00 0.00 H new ATOM 0 HD2 TYR A 73 9.708 -1.522 0.311 1.00 0.00 H new ATOM 0 HE1 TYR A 73 14.545 -2.507 -0.058 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.411 0.348 0.186 1.00 0.00 H new ATOM 0 HH TYR A 73 13.489 0.859 -0.053 1.00 0.00 H new ATOM 1096 N TRP A 74 7.829 -5.483 1.921 1.00 0.00 N ATOM 1097 CA TRP A 74 6.654 -6.336 1.960 1.00 0.00 C ATOM 1098 C TRP A 74 5.500 -5.583 1.294 1.00 0.00 C ATOM 1099 O TRP A 74 5.558 -4.364 1.140 1.00 0.00 O ATOM 1100 CB TRP A 74 6.337 -6.769 3.393 1.00 0.00 C ATOM 1101 CG TRP A 74 7.336 -7.769 3.977 1.00 0.00 C ATOM 1102 CD1 TRP A 74 7.254 -9.107 3.987 1.00 0.00 C ATOM 1103 CD2 TRP A 74 8.580 -7.456 4.639 1.00 0.00 C ATOM 1104 NE1 TRP A 74 8.349 -9.676 4.604 1.00 0.00 N ATOM 1105 CE2 TRP A 74 9.181 -8.640 5.014 1.00 0.00 C ATOM 1106 CE3 TRP A 74 9.177 -6.213 4.913 1.00 0.00 C ATOM 1107 CZ2 TRP A 74 10.409 -8.698 5.683 1.00 0.00 C ATOM 1108 CZ3 TRP A 74 10.404 -6.288 5.582 1.00 0.00 C ATOM 1109 CH2 TRP A 74 11.022 -7.472 5.966 1.00 0.00 C ATOM 0 H TRP A 74 7.655 -4.506 2.156 1.00 0.00 H new ATOM 0 HA TRP A 74 6.831 -7.260 1.409 1.00 0.00 H new ATOM 0 HB2 TRP A 74 6.309 -5.885 4.031 1.00 0.00 H new ATOM 0 HB3 TRP A 74 5.341 -7.211 3.416 1.00 0.00 H new ATOM 0 HD1 TRP A 74 6.434 -9.669 3.565 1.00 0.00 H new ATOM 0 HE1 TRP A 74 8.517 -10.673 4.735 1.00 0.00 H new ATOM 0 HE3 TRP A 74 8.724 -5.274 4.630 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 10.859 -9.638 5.966 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 10.906 -5.361 5.816 1.00 0.00 H new ATOM 0 HH2 TRP A 74 11.971 -7.446 6.481 1.00 0.00 H new ATOM 1120 N ILE A 75 4.480 -6.340 0.918 1.00 0.00 N ATOM 1121 CA ILE A 75 3.315 -5.759 0.272 1.00 0.00 C ATOM 1122 C ILE A 75 2.068 -6.074 1.100 1.00 0.00 C ATOM 1123 O ILE A 75 1.562 -7.195 1.064 1.00 0.00 O ATOM 1124 CB ILE A 75 3.222 -6.223 -1.182 1.00 0.00 C ATOM 1125 CG1 ILE A 75 4.276 -5.531 -2.048 1.00 0.00 C ATOM 1126 CG2 ILE A 75 1.808 -6.024 -1.732 1.00 0.00 C ATOM 1127 CD1 ILE A 75 3.823 -4.124 -2.444 1.00 0.00 C ATOM 0 H ILE A 75 4.436 -7.351 1.048 1.00 0.00 H new ATOM 0 HA ILE A 75 3.404 -4.673 0.230 1.00 0.00 H new ATOM 0 HB ILE A 75 3.432 -7.292 -1.213 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.219 -5.474 -1.504 1.00 0.00 H new ATOM 0 HG13 ILE A 75 4.461 -6.123 -2.944 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.769 -6.362 -2.768 1.00 0.00 H new ATOM 0 HG22 ILE A 75 1.101 -6.601 -1.136 1.00 0.00 H new ATOM 0 HG23 ILE A 75 1.545 -4.967 -1.685 1.00 0.00 H new ATOM 0 HD11 ILE A 75 4.591 -3.654 -3.059 1.00 0.00 H new ATOM 0 HD12 ILE A 75 2.893 -4.187 -3.009 1.00 0.00 H new ATOM 0 HD13 ILE A 75 3.662 -3.527 -1.546 1.00 0.00 H new ATOM 1139 N PHE A 76 1.609 -5.066 1.827 1.00 0.00 N ATOM 1140 CA PHE A 76 0.430 -5.222 2.663 1.00 0.00 C ATOM 1141 C PHE A 76 -0.840 -4.859 1.892 1.00 0.00 C ATOM 1142 O PHE A 76 -0.885 -3.837 1.209 1.00 0.00 O ATOM 1143 CB PHE A 76 0.589 -4.262 3.843 1.00 0.00 C ATOM 1144 CG PHE A 76 -0.546 -4.342 4.867 1.00 0.00 C ATOM 1145 CD1 PHE A 76 -0.623 -5.402 5.715 1.00 0.00 C ATOM 1146 CD2 PHE A 76 -1.477 -3.353 4.928 1.00 0.00 C ATOM 1147 CE1 PHE A 76 -1.676 -5.475 6.665 1.00 0.00 C ATOM 1148 CE2 PHE A 76 -2.530 -3.426 5.877 1.00 0.00 C ATOM 1149 CZ PHE A 76 -2.608 -4.486 6.726 1.00 0.00 C ATOM 0 H PHE A 76 2.032 -4.138 1.855 1.00 0.00 H new ATOM 0 HA PHE A 76 0.340 -6.258 2.991 1.00 0.00 H new ATOM 0 HB2 PHE A 76 1.533 -4.473 4.345 1.00 0.00 H new ATOM 0 HB3 PHE A 76 0.651 -3.242 3.463 1.00 0.00 H new ATOM 0 HD1 PHE A 76 0.116 -6.188 5.666 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.415 -2.511 4.254 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -1.737 -6.316 7.340 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.269 -2.640 5.925 1.00 0.00 H new ATOM 0 HZ PHE A 76 -3.409 -4.542 7.448 1.00 0.00 H new ATOM 1159 N ARG A 77 -1.842 -5.715 2.028 1.00 0.00 N ATOM 1160 CA ARG A 77 -3.110 -5.497 1.353 1.00 0.00 C ATOM 1161 C ARG A 77 -4.269 -5.959 2.238 1.00 0.00 C ATOM 1162 O ARG A 77 -4.375 -7.141 2.561 1.00 0.00 O ATOM 1163 CB ARG A 77 -3.162 -6.250 0.022 1.00 0.00 C ATOM 1164 CG ARG A 77 -1.789 -6.816 -0.342 1.00 0.00 C ATOM 1165 CD ARG A 77 -1.858 -7.638 -1.631 1.00 0.00 C ATOM 1166 NE ARG A 77 -2.827 -7.028 -2.568 1.00 0.00 N ATOM 1167 CZ ARG A 77 -2.652 -5.839 -3.161 1.00 0.00 C ATOM 1168 NH1 ARG A 77 -1.545 -5.125 -2.917 1.00 0.00 N ATOM 1169 NH2 ARG A 77 -3.585 -5.364 -3.998 1.00 0.00 N ATOM 0 H ARG A 77 -1.801 -6.561 2.596 1.00 0.00 H new ATOM 0 HA ARG A 77 -3.202 -4.429 1.157 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -3.888 -7.061 0.087 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -3.503 -5.579 -0.766 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -1.076 -6.000 -0.465 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -1.422 -7.440 0.472 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -0.873 -7.687 -2.094 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -2.154 -8.662 -1.404 1.00 0.00 H new ATOM 0 HE ARG A 77 -3.682 -7.545 -2.776 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -0.835 -5.486 -2.280 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -1.412 -4.220 -3.368 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -4.428 -5.907 -4.183 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -3.452 -4.459 -4.449 1.00 0.00 H new ATOM 1183 N SER A 78 -5.109 -5.002 2.606 1.00 0.00 N ATOM 1184 CA SER A 78 -6.256 -5.297 3.448 1.00 0.00 C ATOM 1185 C SER A 78 -7.548 -5.148 2.642 1.00 0.00 C ATOM 1186 O SER A 78 -7.562 -4.495 1.599 1.00 0.00 O ATOM 1187 CB SER A 78 -6.288 -4.383 4.675 1.00 0.00 C ATOM 1188 OG SER A 78 -7.432 -3.534 4.679 1.00 0.00 O ATOM 0 H SER A 78 -5.018 -4.022 2.337 1.00 0.00 H new ATOM 0 HA SER A 78 -6.169 -6.326 3.797 1.00 0.00 H new ATOM 0 HB2 SER A 78 -6.285 -4.991 5.580 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.384 -3.774 4.697 1.00 0.00 H new ATOM 0 HG SER A 78 -7.503 -3.085 5.547 1.00 0.00 H new ATOM 1194 N TRP A 79 -8.603 -5.763 3.156 1.00 0.00 N ATOM 1195 CA TRP A 79 -9.897 -5.707 2.497 1.00 0.00 C ATOM 1196 C TRP A 79 -10.927 -6.356 3.424 1.00 0.00 C ATOM 1197 O TRP A 79 -10.579 -7.190 4.258 1.00 0.00 O ATOM 1198 CB TRP A 79 -9.838 -6.363 1.116 1.00 0.00 C ATOM 1199 CG TRP A 79 -9.594 -7.873 1.154 1.00 0.00 C ATOM 1200 CD1 TRP A 79 -10.473 -8.844 1.439 1.00 0.00 C ATOM 1201 CD2 TRP A 79 -8.348 -8.550 0.885 1.00 0.00 C ATOM 1202 NE1 TRP A 79 -9.887 -10.092 1.374 1.00 0.00 N ATOM 1203 CE2 TRP A 79 -8.554 -9.908 1.026 1.00 0.00 C ATOM 1204 CE3 TRP A 79 -7.089 -8.033 0.534 1.00 0.00 C ATOM 1205 CZ2 TRP A 79 -7.546 -10.860 0.835 1.00 0.00 C ATOM 1206 CZ3 TRP A 79 -6.092 -8.998 0.347 1.00 0.00 C ATOM 1207 CH2 TRP A 79 -6.283 -10.367 0.485 1.00 0.00 C ATOM 0 H TRP A 79 -8.588 -6.303 4.021 1.00 0.00 H new ATOM 0 HA TRP A 79 -10.194 -4.674 2.315 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -10.775 -6.170 0.593 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -9.045 -5.892 0.535 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -11.510 -8.672 1.688 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -10.348 -10.985 1.549 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -6.905 -6.975 0.418 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -7.732 -11.917 0.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -5.105 -8.654 0.076 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -5.461 -11.048 0.323 1.00 0.00 H new ATOM 1218 N GLY A 80 -12.175 -5.948 3.246 1.00 0.00 N ATOM 1219 CA GLY A 80 -13.259 -6.479 4.056 1.00 0.00 C ATOM 1220 C GLY A 80 -14.457 -5.528 4.060 1.00 0.00 C ATOM 1221 O GLY A 80 -14.340 -4.375 3.647 1.00 0.00 O ATOM 0 H GLY A 80 -12.460 -5.256 2.553 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -13.564 -7.452 3.670 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -12.911 -6.636 5.077 1.00 0.00 H new ATOM 1225 N ARG A 81 -15.582 -6.046 4.531 1.00 0.00 N ATOM 1226 CA ARG A 81 -16.800 -5.257 4.594 1.00 0.00 C ATOM 1227 C ARG A 81 -16.749 -4.297 5.784 1.00 0.00 C ATOM 1228 O ARG A 81 -15.996 -4.516 6.732 1.00 0.00 O ATOM 1229 CB ARG A 81 -18.032 -6.156 4.725 1.00 0.00 C ATOM 1230 CG ARG A 81 -18.866 -6.132 3.443 1.00 0.00 C ATOM 1231 CD ARG A 81 -19.933 -7.228 3.463 1.00 0.00 C ATOM 1232 NE ARG A 81 -21.207 -6.705 2.922 1.00 0.00 N ATOM 1233 CZ ARG A 81 -22.071 -5.959 3.625 1.00 0.00 C ATOM 1234 NH1 ARG A 81 -21.802 -5.644 4.899 1.00 0.00 N ATOM 1235 NH2 ARG A 81 -23.203 -5.527 3.053 1.00 0.00 N ATOM 0 H ARG A 81 -15.675 -7.003 4.873 1.00 0.00 H new ATOM 0 HA ARG A 81 -16.876 -4.689 3.667 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -17.720 -7.178 4.941 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -18.641 -5.824 5.566 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -19.342 -5.158 3.333 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -18.216 -6.268 2.579 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -19.601 -8.081 2.872 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -20.081 -7.585 4.482 1.00 0.00 H new ATOM 0 HE ARG A 81 -21.442 -6.926 1.954 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -20.940 -5.972 5.334 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -22.459 -5.076 5.434 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -23.407 -5.766 2.083 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -23.860 -4.959 3.588 1.00 0.00 H new ATOM 1328 N SER A 88 -9.607 -9.335 6.374 1.00 0.00 N ATOM 1329 CA SER A 88 -8.498 -10.140 5.892 1.00 0.00 C ATOM 1330 C SER A 88 -7.428 -9.239 5.272 1.00 0.00 C ATOM 1331 O SER A 88 -7.746 -8.210 4.677 1.00 0.00 O ATOM 1332 CB SER A 88 -8.973 -11.178 4.873 1.00 0.00 C ATOM 1333 OG SER A 88 -9.249 -12.436 5.482 1.00 0.00 O ATOM 0 HA SER A 88 -8.068 -10.673 6.740 1.00 0.00 H new ATOM 0 HB2 SER A 88 -9.870 -10.812 4.374 1.00 0.00 H new ATOM 0 HB3 SER A 88 -8.211 -11.307 4.104 1.00 0.00 H new ATOM 0 HG SER A 88 -9.551 -13.071 4.799 1.00 0.00 H new ATOM 1339 N ASN A 89 -6.181 -9.658 5.433 1.00 0.00 N ATOM 1340 CA ASN A 89 -5.062 -8.901 4.897 1.00 0.00 C ATOM 1341 C ASN A 89 -4.111 -9.853 4.169 1.00 0.00 C ATOM 1342 O ASN A 89 -4.185 -11.068 4.348 1.00 0.00 O ATOM 1343 CB ASN A 89 -4.278 -8.212 6.015 1.00 0.00 C ATOM 1344 CG ASN A 89 -4.067 -9.156 7.200 1.00 0.00 C ATOM 1345 OD1 ASN A 89 -4.926 -9.329 8.050 1.00 0.00 O ATOM 1346 ND2 ASN A 89 -2.880 -9.756 7.210 1.00 0.00 N ATOM 0 H ASN A 89 -5.921 -10.512 5.927 1.00 0.00 H new ATOM 0 HA ASN A 89 -5.459 -8.147 4.218 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -3.312 -7.879 5.635 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -4.815 -7.323 6.345 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -2.643 -10.406 7.960 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -2.207 -9.567 6.468 1.00 0.00 H new ATOM 1353 N LYS A 90 -3.239 -9.265 3.364 1.00 0.00 N ATOM 1354 CA LYS A 90 -2.274 -10.046 2.608 1.00 0.00 C ATOM 1355 C LYS A 90 -0.885 -9.423 2.766 1.00 0.00 C ATOM 1356 O LYS A 90 -0.733 -8.206 2.681 1.00 0.00 O ATOM 1357 CB LYS A 90 -2.722 -10.187 1.152 1.00 0.00 C ATOM 1358 CG LYS A 90 -1.628 -10.838 0.302 1.00 0.00 C ATOM 1359 CD LYS A 90 -2.198 -11.975 -0.548 1.00 0.00 C ATOM 1360 CE LYS A 90 -2.363 -11.541 -2.005 1.00 0.00 C ATOM 1361 NZ LYS A 90 -2.872 -12.663 -2.826 1.00 0.00 N ATOM 0 H LYS A 90 -3.180 -8.257 3.218 1.00 0.00 H new ATOM 0 HA LYS A 90 -2.215 -11.062 2.999 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.630 -10.787 1.104 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.967 -9.205 0.746 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.171 -10.089 -0.345 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.840 -11.223 0.949 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.537 -12.840 -0.495 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.162 -12.286 -0.146 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.052 -10.698 -2.064 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.406 -11.199 -2.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.978 -12.351 -3.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.201 -13.456 -2.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -3.795 -12.971 -2.459 1.00 0.00 H new ATOM 1375 N LEU A 91 0.093 -10.287 2.994 1.00 0.00 N ATOM 1376 CA LEU A 91 1.464 -9.838 3.164 1.00 0.00 C ATOM 1377 C LEU A 91 2.390 -10.699 2.303 1.00 0.00 C ATOM 1378 O LEU A 91 2.377 -11.925 2.406 1.00 0.00 O ATOM 1379 CB LEU A 91 1.842 -9.822 4.647 1.00 0.00 C ATOM 1380 CG LEU A 91 3.204 -9.212 4.985 1.00 0.00 C ATOM 1381 CD1 LEU A 91 3.186 -7.694 4.802 1.00 0.00 C ATOM 1382 CD2 LEU A 91 3.650 -9.614 6.393 1.00 0.00 C ATOM 0 H LEU A 91 -0.037 -11.296 3.065 1.00 0.00 H new ATOM 0 HA LEU A 91 1.573 -8.810 2.819 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.074 -9.272 5.191 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.823 -10.847 5.018 1.00 0.00 H new ATOM 0 HG LEU A 91 3.940 -9.611 4.287 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.166 -7.286 5.049 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.944 -7.455 3.766 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.435 -7.257 5.460 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.621 -9.168 6.609 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.919 -9.262 7.121 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.728 -10.699 6.454 1.00 0.00 H new ATOM 1394 N GLU A 92 3.171 -10.024 1.472 1.00 0.00 N ATOM 1395 CA GLU A 92 4.101 -10.712 0.594 1.00 0.00 C ATOM 1396 C GLU A 92 5.425 -9.949 0.520 1.00 0.00 C ATOM 1397 O GLU A 92 5.453 -8.785 0.123 1.00 0.00 O ATOM 1398 CB GLU A 92 3.499 -10.903 -0.800 1.00 0.00 C ATOM 1399 CG GLU A 92 2.471 -12.036 -0.804 1.00 0.00 C ATOM 1400 CD GLU A 92 3.065 -13.313 -1.401 1.00 0.00 C ATOM 1401 OE1 GLU A 92 3.994 -13.858 -0.767 1.00 0.00 O ATOM 1402 OE2 GLU A 92 2.576 -13.715 -2.479 1.00 0.00 O ATOM 0 H GLU A 92 3.178 -9.007 1.389 1.00 0.00 H new ATOM 0 HA GLU A 92 4.297 -11.701 1.008 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.025 -9.977 -1.125 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.292 -11.124 -1.515 1.00 0.00 H new ATOM 0 HG2 GLU A 92 2.133 -12.229 0.214 1.00 0.00 H new ATOM 0 HG3 GLU A 92 1.595 -11.735 -1.379 1.00 0.00 H new ATOM 1409 N GLN A 93 6.490 -10.636 0.907 1.00 0.00 N ATOM 1410 CA GLN A 93 7.813 -10.037 0.890 1.00 0.00 C ATOM 1411 C GLN A 93 8.289 -9.842 -0.551 1.00 0.00 C ATOM 1412 O GLN A 93 8.131 -10.731 -1.386 1.00 0.00 O ATOM 1413 CB GLN A 93 8.808 -10.883 1.687 1.00 0.00 C ATOM 1414 CG GLN A 93 9.218 -12.132 0.902 1.00 0.00 C ATOM 1415 CD GLN A 93 10.356 -12.873 1.606 1.00 0.00 C ATOM 1416 OE1 GLN A 93 11.422 -12.334 1.854 1.00 0.00 O ATOM 1417 NE2 GLN A 93 10.072 -14.135 1.912 1.00 0.00 N ATOM 0 H GLN A 93 6.463 -11.602 1.234 1.00 0.00 H new ATOM 0 HA GLN A 93 7.754 -9.059 1.368 1.00 0.00 H new ATOM 0 HB2 GLN A 93 9.692 -10.289 1.920 1.00 0.00 H new ATOM 0 HB3 GLN A 93 8.362 -11.176 2.637 1.00 0.00 H new ATOM 0 HG2 GLN A 93 8.360 -12.795 0.793 1.00 0.00 H new ATOM 0 HG3 GLN A 93 9.531 -11.848 -0.103 1.00 0.00 H new ATOM 0 HE21 GLN A 93 9.159 -14.524 1.676 1.00 0.00 H new ATOM 0 HE22 GLN A 93 10.767 -14.714 2.383 1.00 0.00 H new ATOM 1426 N MET A 94 8.863 -8.674 -0.798 1.00 0.00 N ATOM 1427 CA MET A 94 9.363 -8.352 -2.124 1.00 0.00 C ATOM 1428 C MET A 94 10.874 -8.579 -2.210 1.00 0.00 C ATOM 1429 O MET A 94 11.585 -8.430 -1.218 1.00 0.00 O ATOM 1430 CB MET A 94 9.047 -6.890 -2.448 1.00 0.00 C ATOM 1431 CG MET A 94 7.630 -6.747 -3.006 1.00 0.00 C ATOM 1432 SD MET A 94 7.645 -6.977 -4.776 1.00 0.00 S ATOM 1433 CE MET A 94 6.206 -8.017 -4.966 1.00 0.00 C ATOM 0 H MET A 94 8.993 -7.939 -0.103 1.00 0.00 H new ATOM 0 HA MET A 94 8.874 -9.007 -2.845 1.00 0.00 H new ATOM 0 HB2 MET A 94 9.150 -6.284 -1.548 1.00 0.00 H new ATOM 0 HB3 MET A 94 9.767 -6.510 -3.173 1.00 0.00 H new ATOM 0 HG2 MET A 94 6.971 -7.481 -2.541 1.00 0.00 H new ATOM 0 HG3 MET A 94 7.232 -5.762 -2.762 1.00 0.00 H new ATOM 0 HE1 MET A 94 5.753 -7.837 -5.941 1.00 0.00 H new ATOM 0 HE2 MET A 94 6.501 -9.064 -4.891 1.00 0.00 H new ATOM 0 HE3 MET A 94 5.484 -7.787 -4.182 1.00 0.00 H new ATOM 1443 N PRO A 95 11.331 -8.944 -3.438 1.00 0.00 N ATOM 1444 CA PRO A 95 12.744 -9.193 -3.667 1.00 0.00 C ATOM 1445 C PRO A 95 13.529 -7.881 -3.727 1.00 0.00 C ATOM 1446 O PRO A 95 14.571 -7.747 -3.088 1.00 0.00 O ATOM 1447 CB PRO A 95 12.799 -9.979 -4.967 1.00 0.00 C ATOM 1448 CG PRO A 95 11.465 -9.741 -5.655 1.00 0.00 C ATOM 1449 CD PRO A 95 10.517 -9.130 -4.636 1.00 0.00 C ATOM 0 HA PRO A 95 13.209 -9.755 -2.857 1.00 0.00 H new ATOM 0 HB2 PRO A 95 13.626 -9.643 -5.592 1.00 0.00 H new ATOM 0 HB3 PRO A 95 12.956 -11.041 -4.775 1.00 0.00 H new ATOM 0 HG2 PRO A 95 11.589 -9.074 -6.508 1.00 0.00 H new ATOM 0 HG3 PRO A 95 11.061 -10.678 -6.039 1.00 0.00 H new ATOM 0 HD2 PRO A 95 10.112 -8.182 -4.991 1.00 0.00 H new ATOM 0 HD3 PRO A 95 9.669 -9.786 -4.441 1.00 0.00 H new ATOM 1457 N SER A 96 12.998 -6.946 -4.501 1.00 0.00 N ATOM 1458 CA SER A 96 13.636 -5.650 -4.654 1.00 0.00 C ATOM 1459 C SER A 96 12.682 -4.541 -4.203 1.00 0.00 C ATOM 1460 O SER A 96 11.486 -4.775 -4.040 1.00 0.00 O ATOM 1461 CB SER A 96 14.073 -5.417 -6.102 1.00 0.00 C ATOM 1462 OG SER A 96 15.487 -5.293 -6.219 1.00 0.00 O ATOM 0 H SER A 96 12.133 -7.060 -5.029 1.00 0.00 H new ATOM 0 HA SER A 96 14.528 -5.632 -4.027 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.729 -6.245 -6.722 1.00 0.00 H new ATOM 0 HB3 SER A 96 13.597 -4.514 -6.484 1.00 0.00 H new ATOM 0 HG SER A 96 15.726 -5.147 -7.158 1.00 0.00 H new ATOM 1468 N LYS A 97 13.249 -3.359 -4.013 1.00 0.00 N ATOM 1469 CA LYS A 97 12.464 -2.213 -3.584 1.00 0.00 C ATOM 1470 C LYS A 97 11.503 -1.810 -4.704 1.00 0.00 C ATOM 1471 O LYS A 97 10.343 -1.491 -4.448 1.00 0.00 O ATOM 1472 CB LYS A 97 13.380 -1.079 -3.121 1.00 0.00 C ATOM 1473 CG LYS A 97 12.584 0.205 -2.878 1.00 0.00 C ATOM 1474 CD LYS A 97 13.244 1.399 -3.569 1.00 0.00 C ATOM 1475 CE LYS A 97 13.645 2.469 -2.552 1.00 0.00 C ATOM 1476 NZ LYS A 97 13.880 3.765 -3.227 1.00 0.00 N ATOM 0 H LYS A 97 14.242 -3.170 -4.148 1.00 0.00 H new ATOM 0 HA LYS A 97 11.854 -2.472 -2.719 1.00 0.00 H new ATOM 0 HB2 LYS A 97 13.893 -1.372 -2.205 1.00 0.00 H new ATOM 0 HB3 LYS A 97 14.149 -0.898 -3.872 1.00 0.00 H new ATOM 0 HG2 LYS A 97 11.567 0.082 -3.250 1.00 0.00 H new ATOM 0 HG3 LYS A 97 12.511 0.395 -1.807 1.00 0.00 H new ATOM 0 HD2 LYS A 97 14.125 1.065 -4.117 1.00 0.00 H new ATOM 0 HD3 LYS A 97 12.557 1.826 -4.300 1.00 0.00 H new ATOM 0 HE2 LYS A 97 12.861 2.579 -1.803 1.00 0.00 H new ATOM 0 HE3 LYS A 97 14.547 2.158 -2.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 14.151 4.480 -2.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 14.644 3.660 -3.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 13.010 4.068 -3.710 1.00 0.00 H new ATOM 1490 N GLU A 98 12.022 -1.837 -5.923 1.00 0.00 N ATOM 1491 CA GLU A 98 11.225 -1.478 -7.084 1.00 0.00 C ATOM 1492 C GLU A 98 10.068 -2.464 -7.259 1.00 0.00 C ATOM 1493 O GLU A 98 8.912 -2.057 -7.363 1.00 0.00 O ATOM 1494 CB GLU A 98 12.089 -1.417 -8.345 1.00 0.00 C ATOM 1495 CG GLU A 98 13.142 -0.312 -8.235 1.00 0.00 C ATOM 1496 CD GLU A 98 13.082 0.624 -9.444 1.00 0.00 C ATOM 1497 OE1 GLU A 98 11.959 1.073 -9.760 1.00 0.00 O ATOM 1498 OE2 GLU A 98 14.161 0.870 -10.026 1.00 0.00 O ATOM 0 H GLU A 98 12.985 -2.102 -6.132 1.00 0.00 H new ATOM 0 HA GLU A 98 10.808 -0.484 -6.921 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.580 -2.378 -8.501 1.00 0.00 H new ATOM 0 HB3 GLU A 98 11.457 -1.237 -9.215 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.981 0.259 -7.320 1.00 0.00 H new ATOM 0 HG3 GLU A 98 14.135 -0.756 -8.163 1.00 0.00 H new ATOM 1505 N ASP A 99 10.420 -3.741 -7.286 1.00 0.00 N ATOM 1506 CA ASP A 99 9.426 -4.788 -7.447 1.00 0.00 C ATOM 1507 C ASP A 99 8.288 -4.561 -6.449 1.00 0.00 C ATOM 1508 O ASP A 99 7.158 -4.988 -6.684 1.00 0.00 O ATOM 1509 CB ASP A 99 10.029 -6.167 -7.171 1.00 0.00 C ATOM 1510 CG ASP A 99 10.971 -6.689 -8.257 1.00 0.00 C ATOM 1511 OD1 ASP A 99 10.624 -6.508 -9.445 1.00 0.00 O ATOM 1512 OD2 ASP A 99 12.017 -7.258 -7.876 1.00 0.00 O ATOM 0 H ASP A 99 11.380 -4.074 -7.199 1.00 0.00 H new ATOM 0 HA ASP A 99 9.062 -4.753 -8.474 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.573 -6.127 -6.227 1.00 0.00 H new ATOM 0 HB3 ASP A 99 9.217 -6.883 -7.040 1.00 0.00 H new ATOM 1517 N ALA A 100 8.625 -3.891 -5.357 1.00 0.00 N ATOM 1518 CA ALA A 100 7.645 -3.603 -4.324 1.00 0.00 C ATOM 1519 C ALA A 100 6.821 -2.382 -4.735 1.00 0.00 C ATOM 1520 O ALA A 100 5.607 -2.353 -4.537 1.00 0.00 O ATOM 1521 CB ALA A 100 8.359 -3.401 -2.986 1.00 0.00 C ATOM 0 H ALA A 100 9.563 -3.539 -5.165 1.00 0.00 H new ATOM 0 HA ALA A 100 6.957 -4.440 -4.204 1.00 0.00 H new ATOM 0 HB1 ALA A 100 7.624 -3.185 -2.210 1.00 0.00 H new ATOM 0 HB2 ALA A 100 8.906 -4.307 -2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.056 -2.567 -3.068 1.00 0.00 H new ATOM 1527 N ILE A 101 7.513 -1.403 -5.299 1.00 0.00 N ATOM 1528 CA ILE A 101 6.860 -0.182 -5.739 1.00 0.00 C ATOM 1529 C ILE A 101 5.986 -0.487 -6.958 1.00 0.00 C ATOM 1530 O ILE A 101 4.816 -0.110 -6.997 1.00 0.00 O ATOM 1531 CB ILE A 101 7.892 0.920 -5.984 1.00 0.00 C ATOM 1532 CG1 ILE A 101 8.482 1.422 -4.664 1.00 0.00 C ATOM 1533 CG2 ILE A 101 7.294 2.058 -6.814 1.00 0.00 C ATOM 1534 CD1 ILE A 101 10.003 1.558 -4.759 1.00 0.00 C ATOM 0 H ILE A 101 8.520 -1.431 -5.461 1.00 0.00 H new ATOM 0 HA ILE A 101 6.200 0.199 -4.959 1.00 0.00 H new ATOM 0 HB ILE A 101 8.712 0.496 -6.563 1.00 0.00 H new ATOM 0 HG12 ILE A 101 8.042 2.386 -4.409 1.00 0.00 H new ATOM 0 HG13 ILE A 101 8.225 0.732 -3.861 1.00 0.00 H new ATOM 0 HG21 ILE A 101 8.049 2.828 -6.973 1.00 0.00 H new ATOM 0 HG22 ILE A 101 6.962 1.670 -7.777 1.00 0.00 H new ATOM 0 HG23 ILE A 101 6.444 2.488 -6.284 1.00 0.00 H new ATOM 0 HD11 ILE A 101 10.396 1.916 -3.808 1.00 0.00 H new ATOM 0 HD12 ILE A 101 10.441 0.587 -4.990 1.00 0.00 H new ATOM 0 HD13 ILE A 101 10.256 2.268 -5.547 1.00 0.00 H new ATOM 1546 N GLU A 102 6.588 -1.167 -7.922 1.00 0.00 N ATOM 1547 CA GLU A 102 5.879 -1.527 -9.139 1.00 0.00 C ATOM 1548 C GLU A 102 4.587 -2.273 -8.799 1.00 0.00 C ATOM 1549 O GLU A 102 3.529 -1.972 -9.350 1.00 0.00 O ATOM 1550 CB GLU A 102 6.767 -2.362 -10.064 1.00 0.00 C ATOM 1551 CG GLU A 102 8.145 -1.717 -10.229 1.00 0.00 C ATOM 1552 CD GLU A 102 8.639 -1.843 -11.672 1.00 0.00 C ATOM 1553 OE1 GLU A 102 8.903 -2.993 -12.084 1.00 0.00 O ATOM 1554 OE2 GLU A 102 8.742 -0.785 -12.330 1.00 0.00 O ATOM 0 H GLU A 102 7.559 -1.478 -7.886 1.00 0.00 H new ATOM 0 HA GLU A 102 5.618 -0.611 -9.669 1.00 0.00 H new ATOM 0 HB2 GLU A 102 6.878 -3.367 -9.658 1.00 0.00 H new ATOM 0 HB3 GLU A 102 6.290 -2.463 -11.039 1.00 0.00 H new ATOM 0 HG2 GLU A 102 8.094 -0.665 -9.949 1.00 0.00 H new ATOM 0 HG3 GLU A 102 8.857 -2.193 -9.554 1.00 0.00 H new ATOM 1561 N HIS A 103 4.715 -3.232 -7.894 1.00 0.00 N ATOM 1562 CA HIS A 103 3.571 -4.023 -7.474 1.00 0.00 C ATOM 1563 C HIS A 103 2.549 -3.120 -6.781 1.00 0.00 C ATOM 1564 O HIS A 103 1.366 -3.145 -7.114 1.00 0.00 O ATOM 1565 CB HIS A 103 4.014 -5.197 -6.600 1.00 0.00 C ATOM 1566 CG HIS A 103 3.103 -6.399 -6.679 1.00 0.00 C ATOM 1567 ND1 HIS A 103 2.367 -6.709 -7.809 1.00 0.00 N ATOM 1568 CD2 HIS A 103 2.819 -7.364 -5.758 1.00 0.00 C ATOM 1569 CE1 HIS A 103 1.674 -7.812 -7.567 1.00 0.00 C ATOM 1570 NE2 HIS A 103 1.955 -8.216 -6.295 1.00 0.00 N ATOM 0 H HIS A 103 5.594 -3.479 -7.440 1.00 0.00 H new ATOM 0 HA HIS A 103 3.085 -4.459 -8.347 1.00 0.00 H new ATOM 0 HB2 HIS A 103 5.020 -5.496 -6.894 1.00 0.00 H new ATOM 0 HB3 HIS A 103 4.071 -4.864 -5.564 1.00 0.00 H new ATOM 0 HD2 HIS A 103 3.228 -7.424 -4.760 1.00 0.00 H new ATOM 0 HE1 HIS A 103 1.004 -8.305 -8.256 1.00 0.00 H new ATOM 0 HE2 HIS A 103 1.565 -9.038 -5.833 1.00 0.00 H new ATOM 1578 N PHE A 104 3.044 -2.343 -5.828 1.00 0.00 N ATOM 1579 CA PHE A 104 2.189 -1.433 -5.084 1.00 0.00 C ATOM 1580 C PHE A 104 1.591 -0.367 -6.005 1.00 0.00 C ATOM 1581 O PHE A 104 0.515 0.162 -5.730 1.00 0.00 O ATOM 1582 CB PHE A 104 3.068 -0.750 -4.036 1.00 0.00 C ATOM 1583 CG PHE A 104 2.361 0.365 -3.262 1.00 0.00 C ATOM 1584 CD1 PHE A 104 1.674 0.073 -2.125 1.00 0.00 C ATOM 1585 CD2 PHE A 104 2.420 1.647 -3.710 1.00 0.00 C ATOM 1586 CE1 PHE A 104 1.018 1.107 -1.406 1.00 0.00 C ATOM 1587 CE2 PHE A 104 1.764 2.682 -2.992 1.00 0.00 C ATOM 1588 CZ PHE A 104 1.076 2.390 -1.855 1.00 0.00 C ATOM 0 H PHE A 104 4.026 -2.325 -5.554 1.00 0.00 H new ATOM 0 HA PHE A 104 1.366 -1.984 -4.628 1.00 0.00 H new ATOM 0 HB2 PHE A 104 3.423 -1.500 -3.329 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.947 -0.335 -4.529 1.00 0.00 H new ATOM 0 HD1 PHE A 104 1.627 -0.946 -1.769 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.966 1.879 -4.613 1.00 0.00 H new ATOM 0 HE1 PHE A 104 0.473 0.875 -0.503 1.00 0.00 H new ATOM 0 HE2 PHE A 104 1.811 3.700 -3.348 1.00 0.00 H new ATOM 0 HZ PHE A 104 0.576 3.176 -1.309 1.00 0.00 H new ATOM 1598 N MET A 105 2.315 -0.084 -7.078 1.00 0.00 N ATOM 1599 CA MET A 105 1.869 0.909 -8.040 1.00 0.00 C ATOM 1600 C MET A 105 0.806 0.329 -8.975 1.00 0.00 C ATOM 1601 O MET A 105 -0.161 1.007 -9.318 1.00 0.00 O ATOM 1602 CB MET A 105 3.064 1.395 -8.863 1.00 0.00 C ATOM 1603 CG MET A 105 3.612 2.712 -8.310 1.00 0.00 C ATOM 1604 SD MET A 105 3.750 3.915 -9.622 1.00 0.00 S ATOM 1605 CE MET A 105 4.775 3.008 -10.768 1.00 0.00 C ATOM 0 H MET A 105 3.207 -0.525 -7.302 1.00 0.00 H new ATOM 0 HA MET A 105 1.429 1.744 -7.495 1.00 0.00 H new ATOM 0 HB2 MET A 105 3.848 0.638 -8.854 1.00 0.00 H new ATOM 0 HB3 MET A 105 2.764 1.530 -9.902 1.00 0.00 H new ATOM 0 HG2 MET A 105 2.954 3.089 -7.527 1.00 0.00 H new ATOM 0 HG3 MET A 105 4.588 2.546 -7.853 1.00 0.00 H new ATOM 0 HE1 MET A 105 5.410 3.703 -11.317 1.00 0.00 H new ATOM 0 HE2 MET A 105 5.399 2.303 -10.219 1.00 0.00 H new ATOM 0 HE3 MET A 105 4.143 2.463 -11.469 1.00 0.00 H new ATOM 1615 N LYS A 106 1.022 -0.920 -9.361 1.00 0.00 N ATOM 1616 CA LYS A 106 0.095 -1.600 -10.250 1.00 0.00 C ATOM 1617 C LYS A 106 -1.106 -2.097 -9.443 1.00 0.00 C ATOM 1618 O LYS A 106 -2.248 -1.972 -9.883 1.00 0.00 O ATOM 1619 CB LYS A 106 0.812 -2.704 -11.029 1.00 0.00 C ATOM 1620 CG LYS A 106 -0.122 -3.888 -11.287 1.00 0.00 C ATOM 1621 CD LYS A 106 0.623 -5.035 -11.973 1.00 0.00 C ATOM 1622 CE LYS A 106 -0.147 -6.349 -11.836 1.00 0.00 C ATOM 1623 NZ LYS A 106 -1.232 -6.421 -12.841 1.00 0.00 N ATOM 0 H LYS A 106 1.826 -1.479 -9.074 1.00 0.00 H new ATOM 0 HA LYS A 106 -0.289 -0.910 -11.001 1.00 0.00 H new ATOM 0 HB2 LYS A 106 1.174 -2.308 -11.978 1.00 0.00 H new ATOM 0 HB3 LYS A 106 1.685 -3.040 -10.470 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -0.543 -4.236 -10.344 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -0.957 -3.568 -11.910 1.00 0.00 H new ATOM 0 HD2 LYS A 106 0.765 -4.801 -13.028 1.00 0.00 H new ATOM 0 HD3 LYS A 106 1.615 -5.143 -11.534 1.00 0.00 H new ATOM 0 HE2 LYS A 106 0.533 -7.191 -11.965 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -0.566 -6.429 -10.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -1.745 -7.319 -12.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -1.890 -5.628 -12.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -0.825 -6.366 -13.796 1.00 0.00 H new ATOM 1637 N LEU A 107 -0.807 -2.650 -8.277 1.00 0.00 N ATOM 1638 CA LEU A 107 -1.848 -3.167 -7.405 1.00 0.00 C ATOM 1639 C LEU A 107 -2.888 -2.073 -7.155 1.00 0.00 C ATOM 1640 O LEU A 107 -4.088 -2.313 -7.276 1.00 0.00 O ATOM 1641 CB LEU A 107 -1.238 -3.740 -6.124 1.00 0.00 C ATOM 1642 CG LEU A 107 -0.752 -5.188 -6.202 1.00 0.00 C ATOM 1643 CD1 LEU A 107 0.095 -5.549 -4.980 1.00 0.00 C ATOM 1644 CD2 LEU A 107 -1.926 -6.151 -6.390 1.00 0.00 C ATOM 0 H LEU A 107 0.141 -2.751 -7.916 1.00 0.00 H new ATOM 0 HA LEU A 107 -2.367 -3.998 -7.883 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -0.397 -3.111 -5.833 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -1.980 -3.669 -5.329 1.00 0.00 H new ATOM 0 HG LEU A 107 -0.111 -5.286 -7.078 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.428 -6.584 -5.061 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.963 -4.891 -4.932 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -0.501 -5.429 -4.076 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -1.553 -7.174 -6.442 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -2.612 -6.058 -5.548 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -2.451 -5.909 -7.314 1.00 0.00 H new ATOM 1656 N TYR A 108 -2.389 -0.894 -6.812 1.00 0.00 N ATOM 1657 CA TYR A 108 -3.260 0.238 -6.544 1.00 0.00 C ATOM 1658 C TYR A 108 -3.941 0.721 -7.826 1.00 0.00 C ATOM 1659 O TYR A 108 -4.821 1.579 -7.780 1.00 0.00 O ATOM 1660 CB TYR A 108 -2.354 1.350 -6.012 1.00 0.00 C ATOM 1661 CG TYR A 108 -3.110 2.580 -5.505 1.00 0.00 C ATOM 1662 CD1 TYR A 108 -3.683 2.568 -4.249 1.00 0.00 C ATOM 1663 CD2 TYR A 108 -3.220 3.700 -6.303 1.00 0.00 C ATOM 1664 CE1 TYR A 108 -4.395 3.725 -3.772 1.00 0.00 C ATOM 1665 CE2 TYR A 108 -3.932 4.857 -5.826 1.00 0.00 C ATOM 1666 CZ TYR A 108 -4.485 4.812 -4.583 1.00 0.00 C ATOM 1667 OH TYR A 108 -5.157 5.905 -4.133 1.00 0.00 O ATOM 0 H TYR A 108 -1.393 -0.698 -6.714 1.00 0.00 H new ATOM 0 HA TYR A 108 -4.042 -0.038 -5.837 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -1.745 0.951 -5.201 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -1.670 1.657 -6.803 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -3.597 1.691 -3.624 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -2.772 3.709 -7.286 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -4.848 3.729 -2.791 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -4.025 5.740 -6.440 1.00 0.00 H new ATOM 0 HH TYR A 108 -5.139 6.605 -4.818 1.00 0.00 H new ATOM 1677 N GLU A 109 -3.509 0.148 -8.940 1.00 0.00 N ATOM 1678 CA GLU A 109 -4.066 0.509 -10.232 1.00 0.00 C ATOM 1679 C GLU A 109 -5.127 -0.509 -10.656 1.00 0.00 C ATOM 1680 O GLU A 109 -6.004 -0.198 -11.460 1.00 0.00 O ATOM 1681 CB GLU A 109 -2.967 0.629 -11.289 1.00 0.00 C ATOM 1682 CG GLU A 109 -3.565 0.726 -12.694 1.00 0.00 C ATOM 1683 CD GLU A 109 -2.468 0.896 -13.747 1.00 0.00 C ATOM 1684 OE1 GLU A 109 -2.066 2.059 -13.965 1.00 0.00 O ATOM 1685 OE2 GLU A 109 -2.056 -0.142 -14.309 1.00 0.00 O ATOM 0 H GLU A 109 -2.779 -0.564 -8.974 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.543 1.485 -10.140 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -2.358 1.511 -11.087 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -2.305 -0.235 -11.230 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -4.144 -0.172 -12.909 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -4.254 1.569 -12.742 1.00 0.00 H new ATOM 1692 N GLU A 110 -5.011 -1.704 -10.096 1.00 0.00 N ATOM 1693 CA GLU A 110 -5.948 -2.770 -10.406 1.00 0.00 C ATOM 1694 C GLU A 110 -7.203 -2.641 -9.540 1.00 0.00 C ATOM 1695 O GLU A 110 -8.297 -3.008 -9.968 1.00 0.00 O ATOM 1696 CB GLU A 110 -5.297 -4.143 -10.227 1.00 0.00 C ATOM 1697 CG GLU A 110 -5.564 -4.697 -8.826 1.00 0.00 C ATOM 1698 CD GLU A 110 -4.998 -6.112 -8.680 1.00 0.00 C ATOM 1699 OE1 GLU A 110 -3.784 -6.267 -8.935 1.00 0.00 O ATOM 1700 OE2 GLU A 110 -5.792 -7.006 -8.316 1.00 0.00 O ATOM 0 H GLU A 110 -4.282 -1.958 -9.429 1.00 0.00 H new ATOM 0 HA GLU A 110 -6.240 -2.677 -11.452 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -5.685 -4.834 -10.975 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.222 -4.064 -10.392 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.114 -4.042 -8.080 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -6.637 -4.709 -8.634 1.00 0.00 H new ATOM 1707 N LYS A 111 -7.004 -2.120 -8.339 1.00 0.00 N ATOM 1708 CA LYS A 111 -8.106 -1.938 -7.409 1.00 0.00 C ATOM 1709 C LYS A 111 -8.910 -0.701 -7.814 1.00 0.00 C ATOM 1710 O LYS A 111 -10.095 -0.802 -8.126 1.00 0.00 O ATOM 1711 CB LYS A 111 -7.590 -1.893 -5.969 1.00 0.00 C ATOM 1712 CG LYS A 111 -6.906 -3.208 -5.590 1.00 0.00 C ATOM 1713 CD LYS A 111 -7.869 -4.388 -5.732 1.00 0.00 C ATOM 1714 CE LYS A 111 -7.862 -5.256 -4.472 1.00 0.00 C ATOM 1715 NZ LYS A 111 -9.154 -5.145 -3.759 1.00 0.00 N ATOM 0 H LYS A 111 -6.095 -1.818 -7.988 1.00 0.00 H new ATOM 0 HA LYS A 111 -8.786 -2.789 -7.452 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -6.887 -1.068 -5.857 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -8.419 -1.701 -5.288 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -6.035 -3.366 -6.227 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -6.544 -3.151 -4.563 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -8.878 -4.019 -5.918 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -7.586 -4.991 -6.595 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -7.676 -6.296 -4.741 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -7.049 -4.947 -3.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -8.979 -4.957 -2.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -9.709 -4.365 -4.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -9.683 -6.035 -3.858 1.00 0.00 H new ATOM 1729 N THR A 112 -8.233 0.438 -7.795 1.00 0.00 N ATOM 1730 CA THR A 112 -8.869 1.693 -8.156 1.00 0.00 C ATOM 1731 C THR A 112 -9.101 1.758 -9.667 1.00 0.00 C ATOM 1732 O THR A 112 -10.019 2.435 -10.129 1.00 0.00 O ATOM 1733 CB THR A 112 -7.999 2.834 -7.625 1.00 0.00 C ATOM 1734 OG1 THR A 112 -6.886 2.865 -8.514 1.00 0.00 O ATOM 1735 CG2 THR A 112 -7.380 2.513 -6.263 1.00 0.00 C ATOM 0 H THR A 112 -7.250 0.518 -7.535 1.00 0.00 H new ATOM 0 HA THR A 112 -9.857 1.781 -7.703 1.00 0.00 H new ATOM 0 HB THR A 112 -8.598 3.741 -7.546 1.00 0.00 H new ATOM 0 HG1 THR A 112 -6.312 2.088 -8.347 1.00 0.00 H new ATOM 0 HG21 THR A 112 -6.773 3.355 -5.932 1.00 0.00 H new ATOM 0 HG22 THR A 112 -8.172 2.330 -5.537 1.00 0.00 H new ATOM 0 HG23 THR A 112 -6.753 1.625 -6.348 1.00 0.00 H new ATOM 1743 N GLY A 113 -8.254 1.046 -10.395 1.00 0.00 N ATOM 1744 CA GLY A 113 -8.355 1.014 -11.844 1.00 0.00 C ATOM 1745 C GLY A 113 -7.508 2.120 -12.477 1.00 0.00 C ATOM 1746 O GLY A 113 -7.132 2.027 -13.644 1.00 0.00 O ATOM 0 H GLY A 113 -7.494 0.486 -10.008 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -8.026 0.043 -12.214 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -9.397 1.133 -12.142 1.00 0.00 H new ATOM 1750 N ASN A 114 -7.232 3.140 -11.678 1.00 0.00 N ATOM 1751 CA ASN A 114 -6.436 4.262 -12.146 1.00 0.00 C ATOM 1752 C ASN A 114 -5.009 4.128 -11.611 1.00 0.00 C ATOM 1753 O ASN A 114 -4.800 3.618 -10.511 1.00 0.00 O ATOM 1754 CB ASN A 114 -7.006 5.590 -11.643 1.00 0.00 C ATOM 1755 CG ASN A 114 -8.228 6.009 -12.463 1.00 0.00 C ATOM 1756 OD1 ASN A 114 -8.179 6.136 -13.676 1.00 0.00 O ATOM 1757 ND2 ASN A 114 -9.322 6.215 -11.737 1.00 0.00 N ATOM 0 H ASN A 114 -7.545 3.213 -10.710 1.00 0.00 H new ATOM 0 HA ASN A 114 -6.450 4.253 -13.236 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -7.283 5.496 -10.593 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -6.241 6.364 -11.703 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -10.190 6.497 -12.192 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -9.293 6.091 -10.725 1.00 0.00 H new ATOM 1764 N ALA A 115 -4.064 4.593 -12.414 1.00 0.00 N ATOM 1765 CA ALA A 115 -2.662 4.531 -12.036 1.00 0.00 C ATOM 1766 C ALA A 115 -2.457 5.299 -10.728 1.00 0.00 C ATOM 1767 O ALA A 115 -3.233 6.196 -10.403 1.00 0.00 O ATOM 1768 CB ALA A 115 -1.801 5.080 -13.175 1.00 0.00 C ATOM 0 H ALA A 115 -4.241 5.015 -13.326 1.00 0.00 H new ATOM 0 HA ALA A 115 -2.356 3.499 -11.865 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.750 5.033 -12.891 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -1.961 4.483 -14.073 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -2.078 6.115 -13.374 1.00 0.00 H new ATOM 1774 N TRP A 116 -1.409 4.917 -10.013 1.00 0.00 N ATOM 1775 CA TRP A 116 -1.092 5.558 -8.748 1.00 0.00 C ATOM 1776 C TRP A 116 -0.773 7.028 -9.030 1.00 0.00 C ATOM 1777 O TRP A 116 -1.291 7.919 -8.358 1.00 0.00 O ATOM 1778 CB TRP A 116 0.044 4.826 -8.032 1.00 0.00 C ATOM 1779 CG TRP A 116 0.761 5.671 -6.977 1.00 0.00 C ATOM 1780 CD1 TRP A 116 1.686 6.621 -7.170 1.00 0.00 C ATOM 1781 CD2 TRP A 116 0.573 5.602 -5.548 1.00 0.00 C ATOM 1782 NE1 TRP A 116 2.106 7.168 -5.975 1.00 0.00 N ATOM 1783 CE2 TRP A 116 1.408 6.529 -4.957 1.00 0.00 C ATOM 1784 CE3 TRP A 116 -0.274 4.785 -4.780 1.00 0.00 C ATOM 1785 CZ2 TRP A 116 1.477 6.725 -3.572 1.00 0.00 C ATOM 1786 CZ3 TRP A 116 -0.193 4.993 -3.398 1.00 0.00 C ATOM 1787 CH2 TRP A 116 0.642 5.922 -2.787 1.00 0.00 C ATOM 0 H TRP A 116 -0.768 4.172 -10.286 1.00 0.00 H new ATOM 0 HA TRP A 116 -1.942 5.511 -8.068 1.00 0.00 H new ATOM 0 HB2 TRP A 116 -0.357 3.932 -7.555 1.00 0.00 H new ATOM 0 HB3 TRP A 116 0.772 4.493 -8.772 1.00 0.00 H new ATOM 0 HD1 TRP A 116 2.056 6.921 -8.139 1.00 0.00 H new ATOM 0 HE1 TRP A 116 2.801 7.906 -5.860 1.00 0.00 H new ATOM 0 HE3 TRP A 116 -0.935 4.054 -5.221 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 2.139 7.457 -3.133 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 -0.823 4.390 -2.762 1.00 0.00 H new ATOM 0 HH2 TRP A 116 0.646 6.023 -1.712 1.00 0.00 H new ATOM 1798 N HIS A 117 0.078 7.235 -10.024 1.00 0.00 N ATOM 1799 CA HIS A 117 0.473 8.582 -10.402 1.00 0.00 C ATOM 1800 C HIS A 117 -0.287 9.004 -11.661 1.00 0.00 C ATOM 1801 O HIS A 117 0.281 9.037 -12.752 1.00 0.00 O ATOM 1802 CB HIS A 117 1.991 8.677 -10.566 1.00 0.00 C ATOM 1803 CG HIS A 117 2.633 9.752 -9.721 1.00 0.00 C ATOM 1804 ND1 HIS A 117 3.505 9.469 -8.684 1.00 0.00 N ATOM 1805 CD2 HIS A 117 2.523 11.110 -9.772 1.00 0.00 C ATOM 1806 CE1 HIS A 117 3.894 10.613 -8.141 1.00 0.00 C ATOM 1807 NE2 HIS A 117 3.284 11.629 -8.817 1.00 0.00 N ATOM 0 H HIS A 117 0.505 6.493 -10.579 1.00 0.00 H new ATOM 0 HA HIS A 117 0.208 9.280 -9.608 1.00 0.00 H new ATOM 0 HB2 HIS A 117 2.435 7.715 -10.311 1.00 0.00 H new ATOM 0 HB3 HIS A 117 2.222 8.867 -11.614 1.00 0.00 H new ATOM 0 HD2 HIS A 117 1.919 11.669 -10.471 1.00 0.00 H new ATOM 0 HE1 HIS A 117 4.574 10.722 -7.309 1.00 0.00 H new ATOM 0 HE2 HIS A 117 3.395 12.624 -8.621 1.00 0.00 H new ATOM 1815 N SER A 118 -1.560 9.317 -11.468 1.00 0.00 N ATOM 1816 CA SER A 118 -2.404 9.736 -12.574 1.00 0.00 C ATOM 1817 C SER A 118 -3.164 11.010 -12.199 1.00 0.00 C ATOM 1818 O SER A 118 -3.731 11.101 -11.112 1.00 0.00 O ATOM 1819 CB SER A 118 -3.384 8.630 -12.970 1.00 0.00 C ATOM 1820 OG SER A 118 -4.260 9.042 -14.015 1.00 0.00 O ATOM 0 H SER A 118 -2.027 9.289 -10.562 1.00 0.00 H new ATOM 0 HA SER A 118 -1.765 9.941 -13.433 1.00 0.00 H new ATOM 0 HB2 SER A 118 -2.827 7.750 -13.290 1.00 0.00 H new ATOM 0 HB3 SER A 118 -3.971 8.337 -12.099 1.00 0.00 H new ATOM 0 HG SER A 118 -4.869 8.308 -14.240 1.00 0.00 H new ATOM 1826 N LYS A 119 -3.151 11.962 -13.121 1.00 0.00 N ATOM 1827 CA LYS A 119 -3.833 13.226 -12.901 1.00 0.00 C ATOM 1828 C LYS A 119 -5.340 13.024 -13.066 1.00 0.00 C ATOM 1829 O LYS A 119 -5.778 12.010 -13.608 1.00 0.00 O ATOM 1830 CB LYS A 119 -3.255 14.312 -13.810 1.00 0.00 C ATOM 1831 CG LYS A 119 -2.174 15.116 -13.085 1.00 0.00 C ATOM 1832 CD LYS A 119 -0.775 14.658 -13.504 1.00 0.00 C ATOM 1833 CE LYS A 119 0.278 15.703 -13.131 1.00 0.00 C ATOM 1834 NZ LYS A 119 1.306 15.109 -12.246 1.00 0.00 N ATOM 0 H LYS A 119 -2.679 11.883 -14.022 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.668 13.575 -11.882 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -2.834 13.855 -14.706 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -4.052 14.980 -14.137 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -2.295 16.176 -13.306 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.291 15.000 -12.008 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -0.539 13.710 -13.021 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -0.753 14.482 -14.579 1.00 0.00 H new ATOM 0 HE2 LYS A 119 0.748 16.093 -14.034 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -0.199 16.546 -12.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 2.013 15.831 -12.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 0.855 14.758 -11.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 1.772 14.320 -12.737 1.00 0.00 H new ATOM 1848 N ASN A 120 -6.092 14.004 -12.589 1.00 0.00 N ATOM 1849 CA ASN A 120 -7.542 13.947 -12.677 1.00 0.00 C ATOM 1850 C ASN A 120 -8.011 12.526 -12.359 1.00 0.00 C ATOM 1851 O ASN A 120 -8.132 11.693 -13.256 1.00 0.00 O ATOM 1852 CB ASN A 120 -8.022 14.299 -14.086 1.00 0.00 C ATOM 1853 CG ASN A 120 -9.324 15.102 -14.037 1.00 0.00 C ATOM 1854 OD1 ASN A 120 -9.851 15.414 -12.982 1.00 0.00 O ATOM 1855 ND2 ASN A 120 -9.811 15.417 -15.234 1.00 0.00 N ATOM 0 H ASN A 120 -5.725 14.843 -12.140 1.00 0.00 H new ATOM 0 HA ASN A 120 -7.952 14.665 -11.967 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -7.254 14.875 -14.602 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -8.175 13.386 -14.661 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -10.677 15.952 -15.308 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -9.319 15.124 -16.078 1.00 0.00 H new ATOM 1862 N PHE A 121 -8.264 12.292 -11.080 1.00 0.00 N ATOM 1863 CA PHE A 121 -8.717 10.987 -10.632 1.00 0.00 C ATOM 1864 C PHE A 121 -10.202 10.787 -10.941 1.00 0.00 C ATOM 1865 O PHE A 121 -11.055 11.472 -10.378 1.00 0.00 O ATOM 1866 CB PHE A 121 -8.512 10.937 -9.117 1.00 0.00 C ATOM 1867 CG PHE A 121 -8.905 9.603 -8.479 1.00 0.00 C ATOM 1868 CD1 PHE A 121 -8.109 8.512 -8.638 1.00 0.00 C ATOM 1869 CD2 PHE A 121 -10.052 9.507 -7.753 1.00 0.00 C ATOM 1870 CE1 PHE A 121 -8.473 7.274 -8.046 1.00 0.00 C ATOM 1871 CE2 PHE A 121 -10.417 8.269 -7.162 1.00 0.00 C ATOM 1872 CZ PHE A 121 -9.620 7.179 -7.320 1.00 0.00 C ATOM 0 H PHE A 121 -8.164 12.986 -10.339 1.00 0.00 H new ATOM 0 HA PHE A 121 -8.158 10.204 -11.143 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -7.464 11.139 -8.896 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -9.095 11.734 -8.655 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -7.199 8.587 -9.215 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -10.685 10.373 -7.626 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -7.840 6.408 -8.172 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -11.328 8.193 -6.587 1.00 0.00 H new ATOM 0 HZ PHE A 121 -9.897 6.238 -6.869 1.00 0.00 H new ATOM 1882 N THR A 122 -10.467 9.845 -11.835 1.00 0.00 N ATOM 1883 CA THR A 122 -11.834 9.547 -12.225 1.00 0.00 C ATOM 1884 C THR A 122 -12.445 8.511 -11.280 1.00 0.00 C ATOM 1885 O THR A 122 -11.994 7.367 -11.232 1.00 0.00 O ATOM 1886 CB THR A 122 -11.821 9.101 -13.689 1.00 0.00 C ATOM 1887 OG1 THR A 122 -11.800 10.322 -14.424 1.00 0.00 O ATOM 1888 CG2 THR A 122 -13.133 8.435 -14.110 1.00 0.00 C ATOM 0 H THR A 122 -9.758 9.278 -12.300 1.00 0.00 H new ATOM 0 HA THR A 122 -12.469 10.429 -12.144 1.00 0.00 H new ATOM 0 HB THR A 122 -10.995 8.409 -13.850 1.00 0.00 H new ATOM 0 HG1 THR A 122 -11.789 10.126 -15.384 1.00 0.00 H new ATOM 0 HG21 THR A 122 -13.071 8.138 -15.157 1.00 0.00 H new ATOM 0 HG22 THR A 122 -13.308 7.554 -13.493 1.00 0.00 H new ATOM 0 HG23 THR A 122 -13.956 9.138 -13.981 1.00 0.00 H new ATOM 1896 N LYS A 123 -13.461 8.948 -10.551 1.00 0.00 N ATOM 1897 CA LYS A 123 -14.138 8.073 -9.609 1.00 0.00 C ATOM 1898 C LYS A 123 -14.887 6.984 -10.380 1.00 0.00 C ATOM 1899 O LYS A 123 -16.033 7.180 -10.782 1.00 0.00 O ATOM 1900 CB LYS A 123 -15.030 8.885 -8.668 1.00 0.00 C ATOM 1901 CG LYS A 123 -15.097 8.240 -7.283 1.00 0.00 C ATOM 1902 CD LYS A 123 -16.254 7.243 -7.197 1.00 0.00 C ATOM 1903 CE LYS A 123 -17.301 7.704 -6.181 1.00 0.00 C ATOM 1904 NZ LYS A 123 -17.873 9.009 -6.583 1.00 0.00 N ATOM 0 H LYS A 123 -13.832 9.897 -10.594 1.00 0.00 H new ATOM 0 HA LYS A 123 -13.414 7.570 -8.968 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -14.644 9.901 -8.582 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -16.033 8.960 -9.087 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -14.157 7.731 -7.069 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -15.221 9.012 -6.524 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -16.717 7.133 -8.177 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -15.873 6.262 -6.912 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -18.094 6.960 -6.104 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -16.846 7.788 -5.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -18.794 9.142 -6.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -17.228 9.773 -6.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -18.000 9.029 -7.615 1.00 0.00 H new ATOM 1918 N TYR A 124 -14.210 5.860 -10.562 1.00 0.00 N ATOM 1919 CA TYR A 124 -14.797 4.740 -11.278 1.00 0.00 C ATOM 1920 C TYR A 124 -15.950 4.125 -10.481 1.00 0.00 C ATOM 1921 O TYR A 124 -16.164 4.474 -9.322 1.00 0.00 O ATOM 1922 CB TYR A 124 -13.683 3.702 -11.424 1.00 0.00 C ATOM 1923 CG TYR A 124 -12.895 3.815 -12.730 1.00 0.00 C ATOM 1924 CD1 TYR A 124 -13.520 3.573 -13.936 1.00 0.00 C ATOM 1925 CD2 TYR A 124 -11.558 4.158 -12.702 1.00 0.00 C ATOM 1926 CE1 TYR A 124 -12.777 3.680 -15.166 1.00 0.00 C ATOM 1927 CE2 TYR A 124 -10.816 4.265 -13.931 1.00 0.00 C ATOM 1928 CZ TYR A 124 -11.462 4.020 -15.102 1.00 0.00 C ATOM 1929 OH TYR A 124 -10.761 4.121 -16.263 1.00 0.00 O ATOM 0 H TYR A 124 -13.260 5.701 -10.226 1.00 0.00 H new ATOM 0 HA TYR A 124 -15.194 5.064 -12.240 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -12.994 3.803 -10.586 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -14.119 2.705 -11.360 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -14.566 3.304 -13.958 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -11.069 4.346 -11.758 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -13.254 3.494 -16.117 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -9.770 4.534 -13.923 1.00 0.00 H new ATOM 0 HH TYR A 124 -9.835 4.372 -16.065 1.00 0.00 H new ATOM 1939 N PRO A 125 -16.682 3.196 -11.154 1.00 0.00 N ATOM 1940 CA PRO A 125 -17.807 2.529 -10.521 1.00 0.00 C ATOM 1941 C PRO A 125 -17.328 1.477 -9.519 1.00 0.00 C ATOM 1942 O PRO A 125 -17.044 1.797 -8.366 1.00 0.00 O ATOM 1943 CB PRO A 125 -18.608 1.935 -11.669 1.00 0.00 C ATOM 1944 CG PRO A 125 -17.662 1.891 -12.858 1.00 0.00 C ATOM 1945 CD PRO A 125 -16.457 2.758 -12.528 1.00 0.00 C ATOM 0 HA PRO A 125 -18.423 3.209 -9.933 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -18.968 0.937 -11.419 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -19.485 2.544 -11.890 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -17.351 0.866 -13.060 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -18.160 2.256 -13.756 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -15.528 2.195 -12.617 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -16.382 3.607 -13.207 1.00 0.00 H new ATOM 1953 N LYS A 126 -17.254 0.243 -9.995 1.00 0.00 N ATOM 1954 CA LYS A 126 -16.815 -0.858 -9.155 1.00 0.00 C ATOM 1955 C LYS A 126 -15.296 -0.789 -8.984 1.00 0.00 C ATOM 1956 O LYS A 126 -14.585 -1.733 -9.328 1.00 0.00 O ATOM 1957 CB LYS A 126 -17.310 -2.192 -9.717 1.00 0.00 C ATOM 1958 CG LYS A 126 -18.836 -2.202 -9.839 1.00 0.00 C ATOM 1959 CD LYS A 126 -19.294 -3.204 -10.901 1.00 0.00 C ATOM 1960 CE LYS A 126 -20.506 -4.001 -10.416 1.00 0.00 C ATOM 1961 NZ LYS A 126 -21.710 -3.142 -10.379 1.00 0.00 N ATOM 0 H LYS A 126 -17.491 -0.019 -10.952 1.00 0.00 H new ATOM 0 HA LYS A 126 -17.253 -0.776 -8.160 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -16.862 -2.368 -10.695 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -16.988 -3.006 -9.068 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -19.280 -2.458 -8.877 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -19.190 -1.204 -10.098 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -19.546 -2.675 -11.820 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -18.478 -3.886 -11.139 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -20.678 -4.850 -11.077 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -20.309 -4.405 -9.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -22.524 -3.699 -10.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -21.548 -2.345 -9.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -21.906 -2.777 -11.333 1.00 0.00 H new ATOM 1975 N LYS A 127 -14.842 0.337 -8.454 1.00 0.00 N ATOM 1976 CA LYS A 127 -13.421 0.541 -8.234 1.00 0.00 C ATOM 1977 C LYS A 127 -13.200 1.073 -6.816 1.00 0.00 C ATOM 1978 O LYS A 127 -14.115 1.622 -6.206 1.00 0.00 O ATOM 1979 CB LYS A 127 -12.833 1.438 -9.326 1.00 0.00 C ATOM 1980 CG LYS A 127 -12.940 0.772 -10.699 1.00 0.00 C ATOM 1981 CD LYS A 127 -12.123 -0.522 -10.746 1.00 0.00 C ATOM 1982 CE LYS A 127 -11.214 -0.552 -11.976 1.00 0.00 C ATOM 1983 NZ LYS A 127 -11.572 -1.685 -12.858 1.00 0.00 N ATOM 0 H LYS A 127 -15.434 1.118 -8.170 1.00 0.00 H new ATOM 0 HA LYS A 127 -12.884 -0.405 -8.307 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -13.358 2.393 -9.339 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -11.788 1.652 -9.102 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -13.985 0.555 -10.921 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -12.586 1.458 -11.469 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.520 -0.609 -9.842 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -12.795 -1.380 -10.765 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -11.303 0.386 -12.524 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -10.173 -0.641 -11.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -10.945 -1.690 -13.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.464 -2.578 -12.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -12.559 -1.584 -13.170 1.00 0.00 H new ATOM 1997 N PHE A 128 -11.979 0.892 -6.334 1.00 0.00 N ATOM 1998 CA PHE A 128 -11.626 1.346 -5.000 1.00 0.00 C ATOM 1999 C PHE A 128 -10.916 2.701 -5.052 1.00 0.00 C ATOM 2000 O PHE A 128 -9.830 2.814 -5.618 1.00 0.00 O ATOM 2001 CB PHE A 128 -10.672 0.306 -4.411 1.00 0.00 C ATOM 2002 CG PHE A 128 -11.366 -0.964 -3.913 1.00 0.00 C ATOM 2003 CD1 PHE A 128 -12.129 -0.924 -2.788 1.00 0.00 C ATOM 2004 CD2 PHE A 128 -11.220 -2.131 -4.595 1.00 0.00 C ATOM 2005 CE1 PHE A 128 -12.774 -2.102 -2.325 1.00 0.00 C ATOM 2006 CE2 PHE A 128 -11.865 -3.309 -4.133 1.00 0.00 C ATOM 2007 CZ PHE A 128 -12.628 -3.270 -3.008 1.00 0.00 C ATOM 0 H PHE A 128 -11.222 0.437 -6.844 1.00 0.00 H new ATOM 0 HA PHE A 128 -12.526 1.460 -4.396 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -9.937 0.033 -5.168 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -10.125 0.757 -3.583 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -12.245 0.003 -2.247 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -10.614 -2.162 -5.488 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -13.380 -2.071 -1.432 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -11.749 -4.236 -4.675 1.00 0.00 H new ATOM 0 HZ PHE A 128 -13.118 -4.166 -2.657 1.00 0.00 H new ATOM 2017 N TYR A 129 -11.558 3.693 -4.454 1.00 0.00 N ATOM 2018 CA TYR A 129 -11.001 5.035 -4.426 1.00 0.00 C ATOM 2019 C TYR A 129 -10.445 5.368 -3.040 1.00 0.00 C ATOM 2020 O TYR A 129 -10.757 4.691 -2.062 1.00 0.00 O ATOM 2021 CB TYR A 129 -12.163 5.980 -4.736 1.00 0.00 C ATOM 2022 CG TYR A 129 -13.235 6.028 -3.645 1.00 0.00 C ATOM 2023 CD1 TYR A 129 -12.947 6.595 -2.420 1.00 0.00 C ATOM 2024 CD2 TYR A 129 -14.489 5.505 -3.886 1.00 0.00 C ATOM 2025 CE1 TYR A 129 -13.956 6.640 -1.393 1.00 0.00 C ATOM 2026 CE2 TYR A 129 -15.498 5.550 -2.859 1.00 0.00 C ATOM 2027 CZ TYR A 129 -15.181 6.115 -1.663 1.00 0.00 C ATOM 2028 OH TYR A 129 -16.134 6.158 -0.693 1.00 0.00 O ATOM 0 H TYR A 129 -12.458 3.595 -3.985 1.00 0.00 H new ATOM 0 HA TYR A 129 -10.185 5.127 -5.142 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.770 6.985 -4.889 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.627 5.673 -5.673 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.966 7.005 -2.232 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -14.714 5.062 -4.845 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -13.744 7.081 -0.430 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -16.483 5.144 -3.035 1.00 0.00 H new ATOM 0 HH TYR A 129 -16.959 5.748 -1.027 1.00 0.00 H new ATOM 2038 N PRO A 130 -9.608 6.439 -2.999 1.00 0.00 N ATOM 2039 CA PRO A 130 -9.004 6.870 -1.749 1.00 0.00 C ATOM 2040 C PRO A 130 -10.026 7.591 -0.868 1.00 0.00 C ATOM 2041 O PRO A 130 -10.544 8.641 -1.243 1.00 0.00 O ATOM 2042 CB PRO A 130 -7.842 7.759 -2.160 1.00 0.00 C ATOM 2043 CG PRO A 130 -8.117 8.168 -3.598 1.00 0.00 C ATOM 2044 CD PRO A 130 -9.215 7.265 -4.137 1.00 0.00 C ATOM 0 HA PRO A 130 -8.654 6.036 -1.140 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -7.771 8.633 -1.512 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -6.895 7.225 -2.080 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -8.424 9.213 -3.646 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -7.214 8.073 -4.201 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -10.057 7.846 -4.514 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -8.854 6.654 -4.964 1.00 0.00 H new ATOM 2052 N LEU A 131 -10.285 6.998 0.289 1.00 0.00 N ATOM 2053 CA LEU A 131 -11.235 7.571 1.227 1.00 0.00 C ATOM 2054 C LEU A 131 -10.704 8.916 1.727 1.00 0.00 C ATOM 2055 O LEU A 131 -11.137 9.969 1.263 1.00 0.00 O ATOM 2056 CB LEU A 131 -11.546 6.577 2.348 1.00 0.00 C ATOM 2057 CG LEU A 131 -12.191 5.259 1.916 1.00 0.00 C ATOM 2058 CD1 LEU A 131 -12.148 4.230 3.048 1.00 0.00 C ATOM 2059 CD2 LEU A 131 -13.614 5.487 1.403 1.00 0.00 C ATOM 0 H LEU A 131 -9.853 6.127 0.598 1.00 0.00 H new ATOM 0 HA LEU A 131 -12.187 7.768 0.733 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -10.618 6.350 2.873 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -12.207 7.064 3.065 1.00 0.00 H new ATOM 0 HG LEU A 131 -11.612 4.851 1.088 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -12.613 3.302 2.714 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -11.112 4.037 3.325 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -12.689 4.617 3.912 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -14.049 4.534 1.102 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -14.219 5.929 2.194 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -13.588 6.160 0.546 1.00 0.00 H new ATOM 2071 N GLU A 132 -9.774 8.836 2.668 1.00 0.00 N ATOM 2072 CA GLU A 132 -9.180 10.034 3.236 1.00 0.00 C ATOM 2073 C GLU A 132 -8.380 10.786 2.171 1.00 0.00 C ATOM 2074 O GLU A 132 -7.309 10.338 1.763 1.00 0.00 O ATOM 2075 CB GLU A 132 -8.302 9.691 4.442 1.00 0.00 C ATOM 2076 CG GLU A 132 -8.756 10.458 5.686 1.00 0.00 C ATOM 2077 CD GLU A 132 -7.561 10.830 6.566 1.00 0.00 C ATOM 2078 OE1 GLU A 132 -6.913 9.887 7.071 1.00 0.00 O ATOM 2079 OE2 GLU A 132 -7.322 12.048 6.715 1.00 0.00 O ATOM 0 H GLU A 132 -9.418 7.960 3.051 1.00 0.00 H new ATOM 0 HA GLU A 132 -9.982 10.684 3.585 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -8.346 8.619 4.635 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -7.263 9.933 4.220 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -9.287 11.361 5.387 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -9.458 9.850 6.257 1.00 0.00 H new