USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 949 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 ASN : amide:sc= 0 X(o=-0.96,f=-0.96) USER MOD Set 1.2: A 128 SER OG : rot 180:sc= -0.324 USER MOD Set 1.3: A 131 GLN : amide:sc= -0.638 K(o=-0.96,f=-2.1) USER MOD Set 2.1: A 47 HIS : no HE2:sc= -12.3! C(o=-18!,f=-15!) USER MOD Set 2.2: A 78 ASN : amide:sc= -5.36! C(o=-18!,f=-17!) USER MOD Set 3.1: A 71 SER OG : rot 140:sc= -0.297 USER MOD Set 3.2: A 76 MET CE :methyl 178:sc= -1.77 (180deg=-1.52) USER MOD Set 4.1: A 73 ASN : amide:sc= -6.83! C(o=-11!,f=-8.9!) USER MOD Set 4.2: A 140 GLN : amide:sc= -4.12! K(o=-11!,f=-8) USER MOD Set 5.1: A 24 HIS : no HE2:sc= -6.31! C(o=-11!,f=-13!) USER MOD Set 5.2: A 136 MET CE :methyl 177:sc= -4.32! (180deg=-4.47!) USER MOD Single : A 22 HIS : no HD1:sc= -1.21 K(o=-1.2,f=-0.37) USER MOD Single : A 27 THR OG1 : rot -170:sc= -2.33! USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -160:sc= -0.38 USER MOD Single : A 43 MET CE :methyl -136:sc= -4.77! (180deg=-8.41!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot -110:sc= 0.00745 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -160:sc= -0.868 (180deg=-1.9) USER MOD Single : A 60 LYS NZ :NH3+ -158:sc=-0.000696 (180deg=-0.284) USER MOD Single : A 64 SER OG : rot 140:sc= -5.76! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0225 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HD1:sc= -0.0403 X(o=-0.04,f=-0.21) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 91:sc= 0.707 USER MOD Single : A 96 TYR OH : rot -112:sc= -0.98! USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ -149:sc= -0.141 (180deg=-0.767) USER MOD Single : A 110 HIS : no HD1:sc= -0.17 K(o=-0.17,f=-0.85) USER MOD Single : A 115 ASN : amide:sc= -7.79! C(o=-7.8!,f=-7.5!) USER MOD Single : A 119 ASN : amide:sc= -0.0139 X(o=-0.014,f=-0.25) USER MOD Single : A 121 SER OG : rot 51:sc= 0.217 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -118:sc= -0.207 (180deg=-3.49!) USER MOD Single : A 124 TYR OH : rot -40:sc= -1.82! USER MOD Single : A 126 TYR OH : rot 175:sc= -1.85! USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 137 LYS NZ :NH3+ 174:sc= -3.24! (180deg=-3.25!) USER MOD Single : A 144 THR OG1 : rot -116:sc= 1.3 USER MOD ----------------------------------------------------------------- ATOM 308 N HIS A 22 -9.760 0.946 -9.996 1.00 0.00 N ATOM 309 CA HIS A 22 -10.008 -0.252 -9.171 1.00 0.00 C ATOM 310 C HIS A 22 -8.861 -1.263 -9.220 1.00 0.00 C ATOM 311 O HIS A 22 -8.900 -2.220 -9.992 1.00 0.00 O ATOM 312 CB HIS A 22 -11.303 -0.929 -9.622 1.00 0.00 C ATOM 313 CG HIS A 22 -11.392 -1.118 -11.104 1.00 0.00 C ATOM 314 ND1 HIS A 22 -12.052 -0.240 -11.936 1.00 0.00 N ATOM 315 CD2 HIS A 22 -10.896 -2.092 -11.905 1.00 0.00 C ATOM 316 CE1 HIS A 22 -11.959 -0.664 -13.184 1.00 0.00 C ATOM 317 NE2 HIS A 22 -11.262 -1.784 -13.193 1.00 0.00 N ATOM 0 HA HIS A 22 -10.091 0.088 -8.139 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.385 -1.900 -9.134 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -12.151 -0.332 -9.288 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -10.321 -2.950 -11.590 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -12.382 -0.176 -14.050 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -11.032 -2.332 -14.022 1.00 0.00 H new ATOM 326 N ILE A 23 -7.844 -1.042 -8.389 1.00 0.00 N ATOM 327 CA ILE A 23 -6.683 -1.927 -8.338 1.00 0.00 C ATOM 328 C ILE A 23 -6.098 -1.976 -6.914 1.00 0.00 C ATOM 329 O ILE A 23 -6.509 -2.801 -6.079 1.00 0.00 O ATOM 330 CB ILE A 23 -5.612 -1.461 -9.361 1.00 0.00 C ATOM 331 CG1 ILE A 23 -6.008 -1.874 -10.779 1.00 0.00 C ATOM 332 CG2 ILE A 23 -4.232 -2.004 -9.027 1.00 0.00 C ATOM 333 CD1 ILE A 23 -5.351 -1.037 -11.854 1.00 0.00 C ATOM 0 H ILE A 23 -7.801 -0.256 -7.741 1.00 0.00 H new ATOM 0 HA ILE A 23 -7.000 -2.935 -8.604 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.564 -0.374 -9.304 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.744 -2.920 -10.932 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.091 -1.800 -10.882 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.514 -1.653 -9.768 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.933 -1.655 -8.039 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -4.258 -3.094 -9.034 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.676 -1.384 -12.835 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -5.635 0.008 -11.726 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.268 -1.130 -11.777 1.00 0.00 H new ATOM 345 N HIS A 24 -5.159 -1.079 -6.620 1.00 0.00 N ATOM 346 CA HIS A 24 -4.564 -1.033 -5.294 1.00 0.00 C ATOM 347 C HIS A 24 -5.380 -0.112 -4.393 1.00 0.00 C ATOM 348 O HIS A 24 -4.840 0.536 -3.496 1.00 0.00 O ATOM 349 CB HIS A 24 -3.107 -0.567 -5.347 1.00 0.00 C ATOM 350 CG HIS A 24 -2.338 -1.107 -6.514 1.00 0.00 C ATOM 351 ND1 HIS A 24 -2.295 -2.450 -6.830 1.00 0.00 N ATOM 352 CD2 HIS A 24 -1.575 -0.480 -7.439 1.00 0.00 C ATOM 353 CE1 HIS A 24 -1.538 -2.623 -7.899 1.00 0.00 C ATOM 354 NE2 HIS A 24 -1.090 -1.444 -8.288 1.00 0.00 N ATOM 0 H HIS A 24 -4.800 -0.384 -7.275 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.573 -2.043 -4.884 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.085 0.522 -5.383 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.607 -0.865 -4.426 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -2.773 -3.192 -6.319 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -1.383 0.581 -7.498 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -1.322 -3.569 -8.374 1.00 0.00 H new ATOM 363 N TRP A 25 -6.689 -0.050 -4.653 1.00 0.00 N ATOM 364 CA TRP A 25 -7.586 0.808 -3.884 1.00 0.00 C ATOM 365 C TRP A 25 -9.001 0.245 -3.796 1.00 0.00 C ATOM 366 O TRP A 25 -9.810 0.759 -3.022 1.00 0.00 O ATOM 367 CB TRP A 25 -7.650 2.192 -4.515 1.00 0.00 C ATOM 368 CG TRP A 25 -7.181 2.205 -5.930 1.00 0.00 C ATOM 369 CD1 TRP A 25 -7.956 2.117 -7.044 1.00 0.00 C ATOM 370 CD2 TRP A 25 -5.828 2.301 -6.386 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.169 2.164 -8.164 1.00 0.00 N ATOM 372 CE2 TRP A 25 -5.860 2.278 -7.789 1.00 0.00 C ATOM 373 CE3 TRP A 25 -4.594 2.409 -5.745 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -4.707 2.361 -8.564 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.450 2.491 -6.512 1.00 0.00 C ATOM 376 CH2 TRP A 25 -3.513 2.468 -7.909 1.00 0.00 C ATOM 0 H TRP A 25 -7.148 -0.585 -5.390 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.180 0.862 -2.874 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.676 2.558 -4.474 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.042 2.882 -3.929 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.032 2.024 -7.045 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -7.507 2.121 -9.126 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -4.535 2.428 -4.667 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -4.754 2.342 -9.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -2.489 2.574 -6.025 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -2.600 2.536 -8.481 1.00 0.00 H new ATOM 387 N ARG A 26 -9.311 -0.791 -4.585 1.00 0.00 N ATOM 388 CA ARG A 26 -10.657 -1.391 -4.568 1.00 0.00 C ATOM 389 C ARG A 26 -11.369 -1.143 -3.233 1.00 0.00 C ATOM 390 O ARG A 26 -12.497 -0.649 -3.201 1.00 0.00 O ATOM 391 CB ARG A 26 -10.546 -2.890 -4.817 1.00 0.00 C ATOM 392 CG ARG A 26 -11.814 -3.692 -4.591 1.00 0.00 C ATOM 393 CD ARG A 26 -12.925 -3.254 -5.519 1.00 0.00 C ATOM 394 NE ARG A 26 -13.744 -2.187 -4.944 1.00 0.00 N ATOM 395 CZ ARG A 26 -14.867 -2.396 -4.260 1.00 0.00 C ATOM 396 NH1 ARG A 26 -15.304 -3.631 -4.037 1.00 0.00 N ATOM 397 NH2 ARG A 26 -15.556 -1.365 -3.789 1.00 0.00 N ATOM 0 H ARG A 26 -8.660 -1.229 -5.236 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.247 -0.922 -5.355 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.219 -3.045 -5.845 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -9.765 -3.290 -4.170 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.607 -4.751 -4.745 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -12.138 -3.578 -3.556 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -12.495 -2.911 -6.460 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.559 -4.110 -5.752 1.00 0.00 H new ATOM 0 HE ARG A 26 -13.436 -1.224 -5.075 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -14.778 -4.430 -4.391 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -16.166 -3.780 -3.512 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -15.225 -0.414 -3.951 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -16.417 -1.523 -3.265 1.00 0.00 H new ATOM 411 N THR A 27 -10.689 -1.481 -2.137 1.00 0.00 N ATOM 412 CA THR A 27 -11.237 -1.287 -0.792 1.00 0.00 C ATOM 413 C THR A 27 -10.311 -1.880 0.264 1.00 0.00 C ATOM 414 O THR A 27 -9.654 -2.895 0.030 1.00 0.00 O ATOM 415 CB THR A 27 -12.631 -1.912 -0.665 1.00 0.00 C ATOM 416 OG1 THR A 27 -12.829 -2.913 -1.650 1.00 0.00 O ATOM 417 CG2 THR A 27 -13.755 -0.902 -0.793 1.00 0.00 C ATOM 0 H THR A 27 -9.755 -1.892 -2.153 1.00 0.00 H new ATOM 0 HA THR A 27 -11.320 -0.213 -0.627 1.00 0.00 H new ATOM 0 HB THR A 27 -12.664 -2.340 0.337 1.00 0.00 H new ATOM 0 HG1 THR A 27 -13.770 -3.186 -1.654 1.00 0.00 H new ATOM 0 HG21 THR A 27 -14.714 -1.410 -0.694 1.00 0.00 H new ATOM 0 HG22 THR A 27 -13.660 -0.150 -0.009 1.00 0.00 H new ATOM 0 HG23 THR A 27 -13.700 -0.418 -1.768 1.00 0.00 H new ATOM 425 N LEU A 28 -10.265 -1.239 1.428 1.00 0.00 N ATOM 426 CA LEU A 28 -9.417 -1.701 2.522 1.00 0.00 C ATOM 427 C LEU A 28 -10.021 -2.924 3.205 1.00 0.00 C ATOM 428 O LEU A 28 -9.372 -3.964 3.326 1.00 0.00 O ATOM 429 CB LEU A 28 -9.218 -0.580 3.546 1.00 0.00 C ATOM 430 CG LEU A 28 -8.053 -0.791 4.513 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.667 0.522 5.178 1.00 0.00 C ATOM 432 CD2 LEU A 28 -8.413 -1.835 5.561 1.00 0.00 C ATOM 0 H LEU A 28 -10.804 -0.399 1.638 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.451 -1.983 2.104 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.062 0.357 3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.135 -0.469 4.124 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.196 -1.154 3.946 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.836 0.353 5.863 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.368 1.242 4.416 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.520 0.914 5.732 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.572 -1.973 6.241 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.284 -1.500 6.124 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.641 -2.781 5.069 1.00 0.00 H new ATOM 444 N GLU A 29 -11.267 -2.795 3.653 1.00 0.00 N ATOM 445 CA GLU A 29 -11.957 -3.891 4.326 1.00 0.00 C ATOM 446 C GLU A 29 -11.983 -5.141 3.452 1.00 0.00 C ATOM 447 O GLU A 29 -11.574 -6.220 3.881 1.00 0.00 O ATOM 448 CB GLU A 29 -13.385 -3.478 4.688 1.00 0.00 C ATOM 449 CG GLU A 29 -14.141 -4.533 5.481 1.00 0.00 C ATOM 450 CD GLU A 29 -15.226 -5.209 4.667 1.00 0.00 C ATOM 451 OE1 GLU A 29 -16.323 -4.627 4.541 1.00 0.00 O ATOM 452 OE2 GLU A 29 -14.978 -6.323 4.156 1.00 0.00 O ATOM 0 H GLU A 29 -11.819 -1.942 3.562 1.00 0.00 H new ATOM 0 HA GLU A 29 -11.410 -4.122 5.240 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -13.352 -2.555 5.267 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -13.935 -3.260 3.772 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -13.438 -5.286 5.839 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -14.588 -4.070 6.361 1.00 0.00 H new ATOM 459 N ASP A 30 -12.463 -4.987 2.222 1.00 0.00 N ATOM 460 CA ASP A 30 -12.542 -6.104 1.287 1.00 0.00 C ATOM 461 C ASP A 30 -11.162 -6.716 1.056 1.00 0.00 C ATOM 462 O ASP A 30 -11.038 -7.915 0.807 1.00 0.00 O ATOM 463 CB ASP A 30 -13.141 -5.641 -0.043 1.00 0.00 C ATOM 464 CG ASP A 30 -14.394 -6.413 -0.411 1.00 0.00 C ATOM 465 OD1 ASP A 30 -15.490 -6.011 0.033 1.00 0.00 O ATOM 466 OD2 ASP A 30 -14.279 -7.418 -1.141 1.00 0.00 O ATOM 0 H ASP A 30 -12.803 -4.100 1.850 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.189 -6.867 1.720 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.376 -4.578 0.018 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.399 -5.759 -0.833 1.00 0.00 H new ATOM 471 N GLY A 31 -10.130 -5.883 1.140 1.00 0.00 N ATOM 472 CA GLY A 31 -8.774 -6.360 0.938 1.00 0.00 C ATOM 473 C GLY A 31 -8.370 -7.410 1.955 1.00 0.00 C ATOM 474 O GLY A 31 -7.759 -8.418 1.606 1.00 0.00 O ATOM 0 H GLY A 31 -10.208 -4.887 1.344 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.685 -6.777 -0.065 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.084 -5.518 0.996 1.00 0.00 H new ATOM 478 N LYS A 32 -8.707 -7.170 3.219 1.00 0.00 N ATOM 479 CA LYS A 32 -8.371 -8.102 4.288 1.00 0.00 C ATOM 480 C LYS A 32 -9.093 -9.433 4.099 1.00 0.00 C ATOM 481 O LYS A 32 -8.560 -10.493 4.429 1.00 0.00 O ATOM 482 CB LYS A 32 -8.730 -7.499 5.650 1.00 0.00 C ATOM 483 CG LYS A 32 -7.518 -7.149 6.497 1.00 0.00 C ATOM 484 CD LYS A 32 -7.901 -6.292 7.694 1.00 0.00 C ATOM 485 CE LYS A 32 -7.695 -7.036 9.004 1.00 0.00 C ATOM 486 NZ LYS A 32 -8.003 -6.180 10.183 1.00 0.00 N ATOM 0 H LYS A 32 -9.212 -6.339 3.527 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.297 -8.286 4.252 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.326 -6.600 5.494 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -9.354 -8.205 6.198 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -7.038 -8.065 6.843 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.788 -6.617 5.887 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -7.304 -5.380 7.695 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.945 -5.990 7.607 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -8.330 -7.922 9.022 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -6.663 -7.382 9.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.850 -6.724 11.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.380 -5.348 10.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.995 -5.870 10.137 1.00 0.00 H new ATOM 500 N LYS A 33 -10.311 -9.371 3.568 1.00 0.00 N ATOM 501 CA LYS A 33 -11.107 -10.572 3.338 1.00 0.00 C ATOM 502 C LYS A 33 -10.469 -11.459 2.272 1.00 0.00 C ATOM 503 O LYS A 33 -10.149 -12.620 2.528 1.00 0.00 O ATOM 504 CB LYS A 33 -12.528 -10.193 2.918 1.00 0.00 C ATOM 505 CG LYS A 33 -13.436 -11.391 2.695 1.00 0.00 C ATOM 506 CD LYS A 33 -14.191 -11.286 1.379 1.00 0.00 C ATOM 507 CE LYS A 33 -15.328 -12.291 1.305 1.00 0.00 C ATOM 508 NZ LYS A 33 -16.502 -11.749 0.566 1.00 0.00 N ATOM 0 H LYS A 33 -10.768 -8.503 3.289 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.146 -11.133 4.272 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -12.966 -9.553 3.684 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.483 -9.606 2.001 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.842 -12.305 2.702 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.147 -11.467 3.518 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -14.588 -10.277 1.266 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -13.503 -11.452 0.550 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.978 -13.199 0.814 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -15.632 -12.570 2.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -17.255 -12.465 0.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -16.852 -10.897 1.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -16.219 -11.506 -0.405 1.00 0.00 H new ATOM 522 N GLU A 34 -10.296 -10.908 1.076 1.00 0.00 N ATOM 523 CA GLU A 34 -9.702 -11.652 -0.030 1.00 0.00 C ATOM 524 C GLU A 34 -8.254 -12.028 0.267 1.00 0.00 C ATOM 525 O GLU A 34 -7.845 -13.170 0.062 1.00 0.00 O ATOM 526 CB GLU A 34 -9.774 -10.835 -1.320 1.00 0.00 C ATOM 527 CG GLU A 34 -9.434 -11.639 -2.564 1.00 0.00 C ATOM 528 CD GLU A 34 -10.407 -11.395 -3.700 1.00 0.00 C ATOM 529 OE1 GLU A 34 -10.349 -10.306 -4.308 1.00 0.00 O ATOM 530 OE2 GLU A 34 -11.227 -12.293 -3.982 1.00 0.00 O ATOM 0 H GLU A 34 -10.558 -9.949 0.847 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.273 -12.572 -0.155 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.778 -10.424 -1.425 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.090 -9.990 -1.245 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.426 -11.384 -2.893 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.430 -12.700 -2.316 1.00 0.00 H new ATOM 537 N ALA A 35 -7.480 -11.058 0.749 1.00 0.00 N ATOM 538 CA ALA A 35 -6.074 -11.289 1.069 1.00 0.00 C ATOM 539 C ALA A 35 -5.900 -12.537 1.928 1.00 0.00 C ATOM 540 O ALA A 35 -4.901 -13.249 1.810 1.00 0.00 O ATOM 541 CB ALA A 35 -5.488 -10.076 1.777 1.00 0.00 C ATOM 0 H ALA A 35 -7.802 -10.107 0.926 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.538 -11.447 0.133 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.439 -10.262 2.010 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.567 -9.203 1.129 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.038 -9.893 2.700 1.00 0.00 H new ATOM 547 N ALA A 36 -6.878 -12.797 2.789 1.00 0.00 N ATOM 548 CA ALA A 36 -6.836 -13.958 3.668 1.00 0.00 C ATOM 549 C ALA A 36 -6.866 -15.256 2.866 1.00 0.00 C ATOM 550 O ALA A 36 -6.069 -16.163 3.104 1.00 0.00 O ATOM 551 CB ALA A 36 -7.997 -13.914 4.650 1.00 0.00 C ATOM 0 H ALA A 36 -7.711 -12.218 2.896 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.900 -13.930 4.226 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.955 -14.787 5.302 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.930 -13.008 5.252 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -8.938 -13.916 4.101 1.00 0.00 H new ATOM 557 N ALA A 37 -7.793 -15.338 1.916 1.00 0.00 N ATOM 558 CA ALA A 37 -7.927 -16.526 1.078 1.00 0.00 C ATOM 559 C ALA A 37 -6.607 -16.866 0.394 1.00 0.00 C ATOM 560 O ALA A 37 -5.902 -17.787 0.807 1.00 0.00 O ATOM 561 CB ALA A 37 -9.023 -16.320 0.043 1.00 0.00 C ATOM 0 H ALA A 37 -8.462 -14.597 1.707 1.00 0.00 H new ATOM 0 HA ALA A 37 -8.201 -17.364 1.719 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.112 -17.213 -0.575 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.970 -16.132 0.549 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.773 -15.466 -0.587 1.00 0.00 H new ATOM 567 N SER A 38 -6.274 -16.114 -0.650 1.00 0.00 N ATOM 568 CA SER A 38 -5.034 -16.334 -1.384 1.00 0.00 C ATOM 569 C SER A 38 -3.827 -16.157 -0.470 1.00 0.00 C ATOM 570 O SER A 38 -2.775 -16.760 -0.690 1.00 0.00 O ATOM 571 CB SER A 38 -4.939 -15.370 -2.569 1.00 0.00 C ATOM 572 OG SER A 38 -5.069 -14.026 -2.141 1.00 0.00 O ATOM 0 H SER A 38 -6.845 -15.348 -1.006 1.00 0.00 H new ATOM 0 HA SER A 38 -5.038 -17.357 -1.759 1.00 0.00 H new ATOM 0 HB2 SER A 38 -3.983 -15.503 -3.075 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.719 -15.602 -3.294 1.00 0.00 H new ATOM 0 HG SER A 38 -5.322 -13.463 -2.902 1.00 0.00 H new ATOM 578 N GLY A 39 -3.986 -15.328 0.558 1.00 0.00 N ATOM 579 CA GLY A 39 -2.905 -15.087 1.494 1.00 0.00 C ATOM 580 C GLY A 39 -1.922 -14.049 0.992 1.00 0.00 C ATOM 581 O GLY A 39 -0.756 -14.050 1.389 1.00 0.00 O ATOM 0 H GLY A 39 -4.847 -14.819 0.759 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.320 -14.758 2.447 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.377 -16.022 1.682 1.00 0.00 H new ATOM 585 N LEU A 40 -2.388 -13.156 0.124 1.00 0.00 N ATOM 586 CA LEU A 40 -1.529 -12.108 -0.416 1.00 0.00 C ATOM 587 C LEU A 40 -1.515 -10.900 0.515 1.00 0.00 C ATOM 588 O LEU A 40 -2.530 -10.571 1.130 1.00 0.00 O ATOM 589 CB LEU A 40 -1.980 -11.697 -1.823 1.00 0.00 C ATOM 590 CG LEU A 40 -3.442 -11.263 -1.952 1.00 0.00 C ATOM 591 CD1 LEU A 40 -3.666 -9.919 -1.279 1.00 0.00 C ATOM 592 CD2 LEU A 40 -3.845 -11.201 -3.419 1.00 0.00 C ATOM 0 H LEU A 40 -3.349 -13.137 -0.218 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.516 -12.504 -0.489 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.346 -10.878 -2.163 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.808 -12.535 -2.499 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.067 -12.001 -1.450 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.712 -9.630 -1.383 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.414 -9.995 -0.221 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.033 -9.167 -1.749 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.887 -10.891 -3.497 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.213 -10.482 -3.940 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.724 -12.185 -3.871 1.00 0.00 H new ATOM 604 N PRO A 41 -0.360 -10.225 0.641 1.00 0.00 N ATOM 605 CA PRO A 41 -0.212 -9.055 1.515 1.00 0.00 C ATOM 606 C PRO A 41 -1.080 -7.876 1.090 1.00 0.00 C ATOM 607 O PRO A 41 -1.682 -7.884 0.016 1.00 0.00 O ATOM 608 CB PRO A 41 1.272 -8.699 1.395 1.00 0.00 C ATOM 609 CG PRO A 41 1.712 -9.307 0.109 1.00 0.00 C ATOM 610 CD PRO A 41 0.898 -10.557 -0.051 1.00 0.00 C ATOM 0 HA PRO A 41 -0.532 -9.278 2.533 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.420 -7.619 1.392 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.842 -9.096 2.235 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.547 -8.623 -0.724 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.778 -9.534 0.128 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.730 -10.797 -1.101 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.390 -11.419 0.398 1.00 0.00 H new ATOM 618 N LEU A 42 -1.145 -6.861 1.948 1.00 0.00 N ATOM 619 CA LEU A 42 -1.945 -5.679 1.665 1.00 0.00 C ATOM 620 C LEU A 42 -1.115 -4.599 0.979 1.00 0.00 C ATOM 621 O LEU A 42 0.099 -4.496 1.185 1.00 0.00 O ATOM 622 CB LEU A 42 -2.559 -5.128 2.957 1.00 0.00 C ATOM 623 CG LEU A 42 -4.019 -5.514 3.192 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.182 -7.026 3.176 1.00 0.00 C ATOM 625 CD2 LEU A 42 -4.513 -4.938 4.512 1.00 0.00 C ATOM 0 H LEU A 42 -0.654 -6.836 2.842 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.746 -5.974 0.987 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.966 -5.478 3.802 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.484 -4.041 2.943 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.621 -5.097 2.385 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -5.228 -7.281 3.345 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.865 -7.416 2.209 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.570 -7.466 3.963 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.554 -5.221 4.666 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -3.906 -5.329 5.329 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.432 -3.851 4.488 1.00 0.00 H new ATOM 637 N MET A 43 -1.788 -3.798 0.161 1.00 0.00 N ATOM 638 CA MET A 43 -1.145 -2.719 -0.569 1.00 0.00 C ATOM 639 C MET A 43 -1.656 -1.366 -0.073 1.00 0.00 C ATOM 640 O MET A 43 -2.652 -0.845 -0.585 1.00 0.00 O ATOM 641 CB MET A 43 -1.414 -2.873 -2.068 1.00 0.00 C ATOM 642 CG MET A 43 -0.739 -1.815 -2.922 1.00 0.00 C ATOM 643 SD MET A 43 1.061 -1.891 -2.828 1.00 0.00 S ATOM 644 CE MET A 43 1.373 -0.835 -1.416 1.00 0.00 C ATOM 0 H MET A 43 -2.790 -3.880 -0.012 1.00 0.00 H new ATOM 0 HA MET A 43 -0.070 -2.766 -0.397 1.00 0.00 H new ATOM 0 HB2 MET A 43 -1.074 -3.858 -2.390 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.490 -2.835 -2.241 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.050 -1.938 -3.959 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.074 -0.828 -2.603 1.00 0.00 H new ATOM 0 HE1 MET A 43 2.209 -0.171 -1.636 1.00 0.00 H new ATOM 0 HE2 MET A 43 0.484 -0.241 -1.202 1.00 0.00 H new ATOM 0 HE3 MET A 43 1.616 -1.449 -0.549 1.00 0.00 H new ATOM 654 N VAL A 44 -0.971 -0.808 0.931 1.00 0.00 N ATOM 655 CA VAL A 44 -1.361 0.477 1.502 1.00 0.00 C ATOM 656 C VAL A 44 -0.768 1.636 0.714 1.00 0.00 C ATOM 657 O VAL A 44 0.328 2.109 1.013 1.00 0.00 O ATOM 658 CB VAL A 44 -0.940 0.601 2.985 1.00 0.00 C ATOM 659 CG1 VAL A 44 -0.990 2.049 3.453 1.00 0.00 C ATOM 660 CG2 VAL A 44 -1.830 -0.264 3.860 1.00 0.00 C ATOM 0 H VAL A 44 -0.147 -1.228 1.361 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.448 0.522 1.444 1.00 0.00 H new ATOM 0 HB VAL A 44 0.089 0.253 3.072 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.689 2.104 4.499 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.312 2.651 2.848 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.006 2.431 3.347 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.522 -0.167 4.901 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.866 0.059 3.756 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.742 -1.306 3.551 1.00 0.00 H new ATOM 670 N ILE A 45 -1.507 2.101 -0.281 1.00 0.00 N ATOM 671 CA ILE A 45 -1.069 3.218 -1.100 1.00 0.00 C ATOM 672 C ILE A 45 -1.905 4.453 -0.783 1.00 0.00 C ATOM 673 O ILE A 45 -3.070 4.541 -1.155 1.00 0.00 O ATOM 674 CB ILE A 45 -1.165 2.880 -2.605 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.223 1.723 -2.942 1.00 0.00 C ATOM 676 CG2 ILE A 45 -0.843 4.094 -3.468 1.00 0.00 C ATOM 677 CD1 ILE A 45 -0.424 1.168 -4.334 1.00 0.00 C ATOM 0 H ILE A 45 -2.417 1.720 -0.541 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.024 3.422 -0.868 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.191 2.581 -2.821 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.808 2.063 -2.840 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.368 0.923 -2.216 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -0.920 3.823 -4.521 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.549 4.895 -3.247 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.170 4.434 -3.254 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.277 0.351 -4.505 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.444 0.798 -4.434 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.250 1.955 -5.068 1.00 0.00 H new ATOM 689 N ILE A 46 -1.308 5.399 -0.074 1.00 0.00 N ATOM 690 CA ILE A 46 -2.006 6.615 0.303 1.00 0.00 C ATOM 691 C ILE A 46 -1.420 7.819 -0.417 1.00 0.00 C ATOM 692 O ILE A 46 -0.213 7.891 -0.642 1.00 0.00 O ATOM 693 CB ILE A 46 -1.949 6.836 1.822 1.00 0.00 C ATOM 694 CG1 ILE A 46 -2.267 5.527 2.540 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.921 7.928 2.239 1.00 0.00 C ATOM 696 CD1 ILE A 46 -2.024 5.572 4.030 1.00 0.00 C ATOM 0 H ILE A 46 -0.343 5.347 0.251 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.049 6.502 0.008 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.945 7.157 2.099 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.311 5.269 2.360 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.662 4.730 2.107 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.867 8.071 3.318 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.660 8.859 1.736 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.935 7.638 1.962 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.273 4.606 4.469 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.975 5.798 4.221 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.649 6.345 4.477 1.00 0.00 H new ATOM 708 N HIS A 47 -2.280 8.754 -0.797 1.00 0.00 N ATOM 709 CA HIS A 47 -1.828 9.940 -1.516 1.00 0.00 C ATOM 710 C HIS A 47 -2.544 11.197 -1.040 1.00 0.00 C ATOM 711 O HIS A 47 -3.761 11.321 -1.178 1.00 0.00 O ATOM 712 CB HIS A 47 -2.040 9.779 -3.028 1.00 0.00 C ATOM 713 CG HIS A 47 -2.171 8.360 -3.499 1.00 0.00 C ATOM 714 ND1 HIS A 47 -1.525 7.881 -4.620 1.00 0.00 N ATOM 715 CD2 HIS A 47 -2.889 7.318 -3.009 1.00 0.00 C ATOM 716 CE1 HIS A 47 -1.842 6.612 -4.801 1.00 0.00 C ATOM 717 NE2 HIS A 47 -2.666 6.247 -3.837 1.00 0.00 N ATOM 0 H HIS A 47 -3.284 8.717 -0.622 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.763 10.047 -1.308 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.938 10.326 -3.315 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.203 10.244 -3.549 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -0.900 8.423 -5.216 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.518 7.330 -2.131 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -1.487 5.980 -5.602 1.00 0.00 H new ATOM 726 N LYS A 48 -1.777 12.136 -0.495 1.00 0.00 N ATOM 727 CA LYS A 48 -2.346 13.397 -0.020 1.00 0.00 C ATOM 728 C LYS A 48 -1.732 14.583 -0.759 1.00 0.00 C ATOM 729 O LYS A 48 -0.612 14.500 -1.263 1.00 0.00 O ATOM 730 CB LYS A 48 -2.137 13.552 1.488 1.00 0.00 C ATOM 731 CG LYS A 48 -3.434 13.579 2.281 1.00 0.00 C ATOM 732 CD LYS A 48 -3.213 14.101 3.692 1.00 0.00 C ATOM 733 CE LYS A 48 -4.017 13.310 4.712 1.00 0.00 C ATOM 734 NZ LYS A 48 -4.730 14.201 5.669 1.00 0.00 N ATOM 0 H LYS A 48 -0.768 12.051 -0.371 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.417 13.378 -0.224 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.518 12.730 1.847 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -1.585 14.473 1.677 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.162 14.208 1.769 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.856 12.575 2.325 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.153 14.045 3.940 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.496 15.152 3.740 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.741 12.680 4.194 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -3.351 12.645 5.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.266 13.623 6.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.038 14.784 6.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.384 14.818 5.147 1.00 0.00 H new ATOM 748 N SER A 49 -2.474 15.685 -0.821 1.00 0.00 N ATOM 749 CA SER A 49 -2.005 16.890 -1.501 1.00 0.00 C ATOM 750 C SER A 49 -1.828 16.633 -2.995 1.00 0.00 C ATOM 751 O SER A 49 -2.312 15.631 -3.523 1.00 0.00 O ATOM 752 CB SER A 49 -0.687 17.367 -0.886 1.00 0.00 C ATOM 753 OG SER A 49 -0.805 18.689 -0.390 1.00 0.00 O ATOM 0 H SER A 49 -3.403 15.769 -0.409 1.00 0.00 H new ATOM 0 HA SER A 49 -2.756 17.670 -1.373 1.00 0.00 H new ATOM 0 HB2 SER A 49 -0.396 16.697 -0.078 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.104 17.325 -1.635 1.00 0.00 H new ATOM 0 HG SER A 49 -0.282 19.297 -0.953 1.00 0.00 H new ATOM 759 N TRP A 50 -1.129 17.542 -3.673 1.00 0.00 N ATOM 760 CA TRP A 50 -0.886 17.408 -5.108 1.00 0.00 C ATOM 761 C TRP A 50 -0.383 16.007 -5.443 1.00 0.00 C ATOM 762 O TRP A 50 -0.715 15.451 -6.489 1.00 0.00 O ATOM 763 CB TRP A 50 0.131 18.453 -5.572 1.00 0.00 C ATOM 764 CG TRP A 50 1.443 18.359 -4.855 1.00 0.00 C ATOM 765 CD1 TRP A 50 2.473 17.508 -5.138 1.00 0.00 C ATOM 766 CD2 TRP A 50 1.866 19.143 -3.735 1.00 0.00 C ATOM 767 NE1 TRP A 50 3.512 17.716 -4.263 1.00 0.00 N ATOM 768 CE2 TRP A 50 3.164 18.716 -3.393 1.00 0.00 C ATOM 769 CE3 TRP A 50 1.276 20.168 -2.989 1.00 0.00 C ATOM 770 CZ2 TRP A 50 3.878 19.276 -2.336 1.00 0.00 C ATOM 771 CZ3 TRP A 50 1.987 20.723 -1.940 1.00 0.00 C ATOM 772 CH2 TRP A 50 3.276 20.276 -1.623 1.00 0.00 C ATOM 0 H TRP A 50 -0.722 18.377 -3.253 1.00 0.00 H new ATOM 0 HA TRP A 50 -1.829 17.571 -5.631 1.00 0.00 H new ATOM 0 HB2 TRP A 50 0.300 18.336 -6.642 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -0.287 19.449 -5.423 1.00 0.00 H new ATOM 0 HD1 TRP A 50 2.471 16.778 -5.934 1.00 0.00 H new ATOM 0 HE1 TRP A 50 4.397 17.209 -4.261 1.00 0.00 H new ATOM 0 HE3 TRP A 50 0.283 20.520 -3.227 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 4.872 18.933 -2.088 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 1.541 21.514 -1.356 1.00 0.00 H new ATOM 0 HH2 TRP A 50 3.805 20.730 -0.799 1.00 0.00 H new ATOM 783 N CYS A 51 0.416 15.450 -4.537 1.00 0.00 N ATOM 784 CA CYS A 51 0.978 14.108 -4.696 1.00 0.00 C ATOM 785 C CYS A 51 1.401 13.825 -6.142 1.00 0.00 C ATOM 786 O CYS A 51 0.584 13.417 -6.967 1.00 0.00 O ATOM 787 CB CYS A 51 -0.033 13.050 -4.237 1.00 0.00 C ATOM 788 SG CYS A 51 -1.599 13.041 -5.175 1.00 0.00 S ATOM 0 H CYS A 51 0.693 15.914 -3.672 1.00 0.00 H new ATOM 0 HA CYS A 51 1.871 14.059 -4.073 1.00 0.00 H new ATOM 0 HB2 CYS A 51 0.429 12.066 -4.316 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -0.257 13.213 -3.183 1.00 0.00 H new ATOM 793 N GLY A 52 2.684 14.023 -6.442 1.00 0.00 N ATOM 794 CA GLY A 52 3.168 13.759 -7.787 1.00 0.00 C ATOM 795 C GLY A 52 2.913 12.324 -8.198 1.00 0.00 C ATOM 796 O GLY A 52 2.783 12.020 -9.383 1.00 0.00 O ATOM 0 H GLY A 52 3.389 14.358 -5.786 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.677 14.432 -8.490 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.236 13.969 -7.838 1.00 0.00 H new ATOM 800 N ALA A 53 2.824 11.444 -7.207 1.00 0.00 N ATOM 801 CA ALA A 53 2.562 10.035 -7.454 1.00 0.00 C ATOM 802 C ALA A 53 1.204 9.844 -8.109 1.00 0.00 C ATOM 803 O ALA A 53 0.900 8.770 -8.625 1.00 0.00 O ATOM 804 CB ALA A 53 2.648 9.241 -6.159 1.00 0.00 C ATOM 0 H ALA A 53 2.930 11.685 -6.222 1.00 0.00 H new ATOM 0 HA ALA A 53 3.324 9.662 -8.138 1.00 0.00 H new ATOM 0 HB1 ALA A 53 2.449 8.189 -6.363 1.00 0.00 H new ATOM 0 HB2 ALA A 53 3.646 9.346 -5.734 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.910 9.619 -5.451 1.00 0.00 H new ATOM 810 N CYS A 54 0.380 10.882 -8.079 1.00 0.00 N ATOM 811 CA CYS A 54 -0.940 10.805 -8.672 1.00 0.00 C ATOM 812 C CYS A 54 -0.968 11.475 -10.045 1.00 0.00 C ATOM 813 O CYS A 54 -1.755 11.093 -10.911 1.00 0.00 O ATOM 814 CB CYS A 54 -1.977 11.456 -7.748 1.00 0.00 C ATOM 815 SG CYS A 54 -1.683 11.172 -5.970 1.00 0.00 S ATOM 0 H CYS A 54 0.604 11.781 -7.652 1.00 0.00 H new ATOM 0 HA CYS A 54 -1.189 9.752 -8.802 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -1.990 12.530 -7.935 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -2.965 11.076 -8.006 1.00 0.00 H new ATOM 820 N LYS A 55 -0.117 12.483 -10.232 1.00 0.00 N ATOM 821 CA LYS A 55 -0.063 13.217 -11.495 1.00 0.00 C ATOM 822 C LYS A 55 0.652 12.428 -12.596 1.00 0.00 C ATOM 823 O LYS A 55 0.175 12.366 -13.728 1.00 0.00 O ATOM 824 CB LYS A 55 0.617 14.579 -11.293 1.00 0.00 C ATOM 825 CG LYS A 55 2.137 14.518 -11.248 1.00 0.00 C ATOM 826 CD LYS A 55 2.747 15.907 -11.156 1.00 0.00 C ATOM 827 CE LYS A 55 2.517 16.531 -9.790 1.00 0.00 C ATOM 828 NZ LYS A 55 2.545 18.018 -9.844 1.00 0.00 N ATOM 0 H LYS A 55 0.543 12.809 -9.526 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.092 13.371 -11.821 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.315 15.246 -12.100 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.255 15.019 -10.364 1.00 0.00 H new ATOM 0 HG2 LYS A 55 2.453 13.923 -10.391 1.00 0.00 H new ATOM 0 HG3 LYS A 55 2.509 14.014 -12.140 1.00 0.00 H new ATOM 0 HD2 LYS A 55 3.817 15.849 -11.354 1.00 0.00 H new ATOM 0 HD3 LYS A 55 2.315 16.546 -11.926 1.00 0.00 H new ATOM 0 HE2 LYS A 55 1.555 16.201 -9.398 1.00 0.00 H new ATOM 0 HE3 LYS A 55 3.281 16.179 -9.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 2.384 18.403 -8.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 3.472 18.335 -10.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.799 18.356 -10.485 1.00 0.00 H new ATOM 842 N ALA A 56 1.799 11.839 -12.275 1.00 0.00 N ATOM 843 CA ALA A 56 2.558 11.078 -13.263 1.00 0.00 C ATOM 844 C ALA A 56 1.971 9.691 -13.486 1.00 0.00 C ATOM 845 O ALA A 56 2.326 9.012 -14.447 1.00 0.00 O ATOM 846 CB ALA A 56 4.017 10.976 -12.847 1.00 0.00 C ATOM 0 H ALA A 56 2.221 11.873 -11.347 1.00 0.00 H new ATOM 0 HA ALA A 56 2.494 11.616 -14.209 1.00 0.00 H new ATOM 0 HB1 ALA A 56 4.569 10.406 -13.594 1.00 0.00 H new ATOM 0 HB2 ALA A 56 4.443 11.976 -12.766 1.00 0.00 H new ATOM 0 HB3 ALA A 56 4.086 10.473 -11.882 1.00 0.00 H new ATOM 852 N LEU A 57 1.090 9.265 -12.594 1.00 0.00 N ATOM 853 CA LEU A 57 0.485 7.949 -12.712 1.00 0.00 C ATOM 854 C LEU A 57 -0.791 7.979 -13.557 1.00 0.00 C ATOM 855 O LEU A 57 -1.151 6.984 -14.173 1.00 0.00 O ATOM 856 CB LEU A 57 0.198 7.380 -11.319 1.00 0.00 C ATOM 857 CG LEU A 57 1.435 6.922 -10.533 1.00 0.00 C ATOM 858 CD1 LEU A 57 1.953 5.595 -11.064 1.00 0.00 C ATOM 859 CD2 LEU A 57 2.533 7.975 -10.589 1.00 0.00 C ATOM 0 H LEU A 57 0.780 9.807 -11.787 1.00 0.00 H new ATOM 0 HA LEU A 57 1.194 7.300 -13.226 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.324 8.138 -10.735 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.481 6.534 -11.422 1.00 0.00 H new ATOM 0 HG LEU A 57 1.138 6.786 -9.493 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.829 5.291 -10.492 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.176 4.837 -10.968 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.225 5.705 -12.114 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.399 7.628 -10.025 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.820 8.146 -11.626 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.167 8.906 -10.156 1.00 0.00 H new ATOM 871 N LYS A 58 -1.486 9.112 -13.594 1.00 0.00 N ATOM 872 CA LYS A 58 -2.721 9.192 -14.384 1.00 0.00 C ATOM 873 C LYS A 58 -2.506 8.685 -15.816 1.00 0.00 C ATOM 874 O LYS A 58 -3.037 7.638 -16.195 1.00 0.00 O ATOM 875 CB LYS A 58 -3.330 10.612 -14.417 1.00 0.00 C ATOM 876 CG LYS A 58 -2.506 11.700 -13.742 1.00 0.00 C ATOM 877 CD LYS A 58 -3.386 12.847 -13.266 1.00 0.00 C ATOM 878 CE LYS A 58 -3.091 14.129 -14.029 1.00 0.00 C ATOM 879 NZ LYS A 58 -2.095 14.980 -13.321 1.00 0.00 N ATOM 0 H LYS A 58 -1.229 9.968 -13.103 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.435 8.543 -13.877 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.489 10.895 -15.458 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.311 10.578 -13.943 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.967 11.277 -12.894 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -1.758 12.078 -14.439 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.435 12.579 -13.394 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.226 13.012 -12.200 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.717 13.882 -15.022 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.015 14.690 -14.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -2.166 15.958 -13.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -2.285 14.959 -12.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -1.137 14.618 -13.503 1.00 0.00 H new ATOM 893 N PRO A 59 -1.732 9.418 -16.638 1.00 0.00 N ATOM 894 CA PRO A 59 -1.472 9.032 -18.031 1.00 0.00 C ATOM 895 C PRO A 59 -0.588 7.798 -18.163 1.00 0.00 C ATOM 896 O PRO A 59 -0.703 7.050 -19.134 1.00 0.00 O ATOM 897 CB PRO A 59 -0.756 10.254 -18.609 1.00 0.00 C ATOM 898 CG PRO A 59 -0.118 10.901 -17.434 1.00 0.00 C ATOM 899 CD PRO A 59 -1.057 10.678 -16.283 1.00 0.00 C ATOM 0 HA PRO A 59 -2.396 8.765 -18.544 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.015 9.964 -19.354 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -1.456 10.928 -19.102 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.860 10.465 -17.231 1.00 0.00 H new ATOM 0 HG3 PRO A 59 0.038 11.965 -17.611 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.522 10.595 -15.337 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -1.766 11.499 -16.177 1.00 0.00 H new ATOM 907 N LYS A 60 0.296 7.582 -17.195 1.00 0.00 N ATOM 908 CA LYS A 60 1.186 6.428 -17.241 1.00 0.00 C ATOM 909 C LYS A 60 0.547 5.224 -16.568 1.00 0.00 C ATOM 910 O LYS A 60 0.330 4.193 -17.201 1.00 0.00 O ATOM 911 CB LYS A 60 2.538 6.759 -16.595 1.00 0.00 C ATOM 912 CG LYS A 60 3.006 5.752 -15.547 1.00 0.00 C ATOM 913 CD LYS A 60 4.425 5.278 -15.822 1.00 0.00 C ATOM 914 CE LYS A 60 5.435 6.398 -15.626 1.00 0.00 C ATOM 915 NZ LYS A 60 5.995 6.872 -16.922 1.00 0.00 N ATOM 0 H LYS A 60 0.415 8.182 -16.379 1.00 0.00 H new ATOM 0 HA LYS A 60 1.361 6.177 -18.287 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.293 6.826 -17.378 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.473 7.743 -16.130 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.959 6.207 -14.558 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.331 4.896 -15.537 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.667 4.448 -15.158 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.492 4.901 -16.842 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.958 7.231 -15.110 1.00 0.00 H new ATOM 0 HE3 LYS A 60 6.245 6.049 -14.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 6.909 7.340 -16.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 6.132 6.061 -17.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 5.335 7.547 -17.359 1.00 0.00 H new ATOM 929 N PHE A 61 0.249 5.358 -15.275 1.00 0.00 N ATOM 930 CA PHE A 61 -0.365 4.269 -14.533 1.00 0.00 C ATOM 931 C PHE A 61 -1.635 3.812 -15.222 1.00 0.00 C ATOM 932 O PHE A 61 -2.120 2.714 -14.967 1.00 0.00 O ATOM 933 CB PHE A 61 -0.633 4.666 -13.091 1.00 0.00 C ATOM 934 CG PHE A 61 -0.861 3.487 -12.185 1.00 0.00 C ATOM 935 CD1 PHE A 61 0.210 2.793 -11.647 1.00 0.00 C ATOM 936 CD2 PHE A 61 -2.147 3.071 -11.881 1.00 0.00 C ATOM 937 CE1 PHE A 61 0.003 1.706 -10.821 1.00 0.00 C ATOM 938 CE2 PHE A 61 -2.360 1.983 -11.055 1.00 0.00 C ATOM 939 CZ PHE A 61 -1.283 1.300 -10.523 1.00 0.00 C ATOM 0 H PHE A 61 0.422 6.202 -14.729 1.00 0.00 H new ATOM 0 HA PHE A 61 0.334 3.433 -14.514 1.00 0.00 H new ATOM 0 HB2 PHE A 61 0.211 5.245 -12.717 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.507 5.317 -13.056 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.218 3.105 -11.876 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.992 3.602 -12.294 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.847 1.173 -10.408 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.367 1.667 -10.826 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.446 0.451 -9.876 1.00 0.00 H new ATOM 949 N ALA A 62 -2.142 4.625 -16.154 1.00 0.00 N ATOM 950 CA ALA A 62 -3.304 4.226 -16.921 1.00 0.00 C ATOM 951 C ALA A 62 -2.973 2.903 -17.630 1.00 0.00 C ATOM 952 O ALA A 62 -3.857 2.163 -18.063 1.00 0.00 O ATOM 953 CB ALA A 62 -3.678 5.311 -17.922 1.00 0.00 C ATOM 0 H ALA A 62 -1.768 5.545 -16.386 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.163 4.084 -16.265 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -4.553 4.996 -18.490 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -3.905 6.235 -17.390 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.844 5.480 -18.604 1.00 0.00 H new ATOM 959 N GLU A 63 -1.663 2.622 -17.693 1.00 0.00 N ATOM 960 CA GLU A 63 -1.112 1.408 -18.283 1.00 0.00 C ATOM 961 C GLU A 63 -1.298 0.234 -17.330 1.00 0.00 C ATOM 962 O GLU A 63 -1.128 -0.926 -17.705 1.00 0.00 O ATOM 963 CB GLU A 63 0.377 1.621 -18.571 1.00 0.00 C ATOM 964 CG GLU A 63 0.914 0.747 -19.692 1.00 0.00 C ATOM 965 CD GLU A 63 0.910 1.453 -21.033 1.00 0.00 C ATOM 966 OE1 GLU A 63 -0.182 1.851 -21.493 1.00 0.00 O ATOM 967 OE2 GLU A 63 1.999 1.608 -21.626 1.00 0.00 O ATOM 0 H GLU A 63 -0.948 3.250 -17.326 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.634 1.186 -19.214 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.542 2.667 -18.827 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.946 1.422 -17.663 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.931 0.438 -19.451 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.313 -0.160 -19.761 1.00 0.00 H new ATOM 974 N SER A 64 -1.635 0.564 -16.087 1.00 0.00 N ATOM 975 CA SER A 64 -1.848 -0.414 -15.029 1.00 0.00 C ATOM 976 C SER A 64 -2.759 -1.562 -15.453 1.00 0.00 C ATOM 977 O SER A 64 -2.910 -2.529 -14.711 1.00 0.00 O ATOM 978 CB SER A 64 -2.431 0.288 -13.810 1.00 0.00 C ATOM 979 OG SER A 64 -2.825 -0.640 -12.815 1.00 0.00 O ATOM 0 H SER A 64 -1.769 1.529 -15.784 1.00 0.00 H new ATOM 0 HA SER A 64 -0.880 -0.855 -14.792 1.00 0.00 H new ATOM 0 HB2 SER A 64 -1.692 0.975 -13.396 1.00 0.00 H new ATOM 0 HB3 SER A 64 -3.290 0.887 -14.111 1.00 0.00 H new ATOM 0 HG SER A 64 -2.584 -0.293 -11.931 1.00 0.00 H new ATOM 985 N THR A 65 -3.355 -1.477 -16.642 1.00 0.00 N ATOM 986 CA THR A 65 -4.219 -2.550 -17.125 1.00 0.00 C ATOM 987 C THR A 65 -3.543 -3.894 -16.879 1.00 0.00 C ATOM 988 O THR A 65 -4.190 -4.870 -16.497 1.00 0.00 O ATOM 989 CB THR A 65 -4.520 -2.371 -18.613 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.464 -1.680 -19.259 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.799 -1.605 -18.877 1.00 0.00 C ATOM 0 H THR A 65 -3.257 -0.687 -17.280 1.00 0.00 H new ATOM 0 HA THR A 65 -5.164 -2.517 -16.583 1.00 0.00 H new ATOM 0 HB THR A 65 -4.632 -3.381 -19.009 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.674 -1.577 -20.211 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.953 -1.514 -19.952 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.640 -2.138 -18.434 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.726 -0.611 -18.435 1.00 0.00 H new ATOM 999 N GLU A 66 -2.224 -3.918 -17.058 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.442 -5.120 -16.816 1.00 0.00 C ATOM 1001 C GLU A 66 -1.208 -5.272 -15.327 1.00 0.00 C ATOM 1002 O GLU A 66 -1.200 -6.385 -14.801 1.00 0.00 O ATOM 1003 CB GLU A 66 -0.112 -5.076 -17.568 1.00 0.00 C ATOM 1004 CG GLU A 66 0.721 -3.852 -17.244 1.00 0.00 C ATOM 1005 CD GLU A 66 0.759 -2.852 -18.382 1.00 0.00 C ATOM 1006 OE1 GLU A 66 -0.237 -2.764 -19.131 1.00 0.00 O ATOM 1007 OE2 GLU A 66 1.784 -2.153 -18.526 1.00 0.00 O ATOM 0 H GLU A 66 -1.677 -3.116 -17.370 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.998 -5.982 -17.186 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.462 -5.971 -17.329 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -0.308 -5.100 -18.640 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.318 -3.368 -16.354 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.738 -4.163 -17.005 1.00 0.00 H new ATOM 1014 N ILE A 67 -1.064 -4.144 -14.637 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.887 -4.182 -13.201 1.00 0.00 C ATOM 1016 C ILE A 67 -2.169 -4.685 -12.550 1.00 0.00 C ATOM 1017 O ILE A 67 -2.164 -5.118 -11.397 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.516 -2.801 -12.628 1.00 0.00 C ATOM 1019 CG1 ILE A 67 0.710 -2.238 -13.350 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -0.260 -2.894 -11.133 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.047 -0.818 -12.949 1.00 0.00 C ATOM 0 H ILE A 67 -1.067 -3.210 -15.047 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.061 -4.859 -12.981 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.354 -2.123 -12.789 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.568 -2.878 -13.146 1.00 0.00 H new ATOM 0 HG13 ILE A 67 0.536 -2.272 -14.425 1.00 0.00 H new ATOM 0 HG21 ILE A 67 0.001 -1.909 -10.747 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.158 -3.254 -10.632 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.562 -3.586 -10.947 1.00 0.00 H new ATOM 0 HD11 ILE A 67 1.926 -0.483 -13.500 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.205 -0.165 -13.179 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.253 -0.781 -11.879 1.00 0.00 H new ATOM 1033 N SER A 68 -3.265 -4.662 -13.315 1.00 0.00 N ATOM 1034 CA SER A 68 -4.542 -5.152 -12.825 1.00 0.00 C ATOM 1035 C SER A 68 -4.460 -6.663 -12.655 1.00 0.00 C ATOM 1036 O SER A 68 -5.118 -7.243 -11.792 1.00 0.00 O ATOM 1037 CB SER A 68 -5.669 -4.785 -13.793 1.00 0.00 C ATOM 1038 OG SER A 68 -6.762 -4.202 -13.106 1.00 0.00 O ATOM 0 H SER A 68 -3.286 -4.309 -14.272 1.00 0.00 H new ATOM 0 HA SER A 68 -4.762 -4.687 -11.864 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.295 -4.089 -14.544 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.003 -5.677 -14.323 1.00 0.00 H new ATOM 0 HG SER A 68 -7.468 -3.975 -13.747 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.618 -7.288 -13.477 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.412 -8.724 -13.416 1.00 0.00 C ATOM 1046 C GLU A 69 -2.396 -9.044 -12.331 1.00 0.00 C ATOM 1047 O GLU A 69 -2.555 -10.004 -11.576 1.00 0.00 O ATOM 1048 CB GLU A 69 -2.932 -9.257 -14.767 1.00 0.00 C ATOM 1049 CG GLU A 69 -3.882 -8.951 -15.913 1.00 0.00 C ATOM 1050 CD GLU A 69 -5.061 -9.902 -15.964 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -4.840 -11.113 -16.170 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -6.208 -9.434 -15.795 1.00 0.00 O ATOM 0 H GLU A 69 -3.068 -6.815 -14.194 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.359 -9.209 -13.177 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.955 -8.828 -14.991 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.798 -10.336 -14.696 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -4.248 -7.929 -15.813 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -3.337 -9.003 -16.855 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.359 -8.215 -12.246 1.00 0.00 N ATOM 1060 CA LEU A 70 -0.323 -8.392 -11.232 1.00 0.00 C ATOM 1061 C LEU A 70 -0.925 -8.340 -9.830 1.00 0.00 C ATOM 1062 O LEU A 70 -0.318 -8.795 -8.864 1.00 0.00 O ATOM 1063 CB LEU A 70 0.747 -7.304 -11.359 1.00 0.00 C ATOM 1064 CG LEU A 70 1.808 -7.550 -12.434 1.00 0.00 C ATOM 1065 CD1 LEU A 70 1.820 -6.405 -13.432 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.183 -7.721 -11.799 1.00 0.00 C ATOM 0 H LEU A 70 -1.214 -7.417 -12.864 1.00 0.00 H new ATOM 0 HA LEU A 70 0.134 -9.369 -11.391 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.253 -6.355 -11.570 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.247 -7.196 -10.397 1.00 0.00 H new ATOM 0 HG LEU A 70 1.560 -8.470 -12.964 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.579 -6.592 -14.191 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.842 -6.327 -13.908 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.047 -5.473 -12.914 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.925 -7.895 -12.579 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.443 -6.819 -11.246 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.166 -8.572 -11.118 1.00 0.00 H new ATOM 1078 N SER A 71 -2.125 -7.776 -9.722 1.00 0.00 N ATOM 1079 CA SER A 71 -2.809 -7.649 -8.436 1.00 0.00 C ATOM 1080 C SER A 71 -2.726 -8.925 -7.602 1.00 0.00 C ATOM 1081 O SER A 71 -2.862 -8.879 -6.384 1.00 0.00 O ATOM 1082 CB SER A 71 -4.275 -7.308 -8.654 1.00 0.00 C ATOM 1083 OG SER A 71 -4.668 -6.201 -7.861 1.00 0.00 O ATOM 0 H SER A 71 -2.647 -7.398 -10.513 1.00 0.00 H new ATOM 0 HA SER A 71 -2.304 -6.851 -7.891 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.446 -7.083 -9.707 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.892 -8.172 -8.408 1.00 0.00 H new ATOM 0 HG SER A 71 -5.262 -5.620 -8.381 1.00 0.00 H new ATOM 1089 N HIS A 72 -2.486 -10.061 -8.248 1.00 0.00 N ATOM 1090 CA HIS A 72 -2.373 -11.324 -7.530 1.00 0.00 C ATOM 1091 C HIS A 72 -1.317 -11.205 -6.438 1.00 0.00 C ATOM 1092 O HIS A 72 -1.279 -11.996 -5.495 1.00 0.00 O ATOM 1093 CB HIS A 72 -2.015 -12.458 -8.492 1.00 0.00 C ATOM 1094 CG HIS A 72 -3.173 -12.924 -9.319 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -4.393 -13.271 -8.777 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -3.295 -13.097 -10.656 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -5.214 -13.639 -9.745 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -4.572 -13.542 -10.895 1.00 0.00 N ATOM 0 H HIS A 72 -2.367 -10.133 -9.258 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.335 -11.554 -7.072 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -1.216 -12.124 -9.154 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -1.624 -13.300 -7.920 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -2.530 -12.918 -11.397 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -6.236 -13.964 -9.617 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -4.961 -13.762 -11.812 1.00 0.00 H new ATOM 1107 N ASN A 73 -0.465 -10.194 -6.580 1.00 0.00 N ATOM 1108 CA ASN A 73 0.598 -9.931 -5.627 1.00 0.00 C ATOM 1109 C ASN A 73 0.042 -9.559 -4.250 1.00 0.00 C ATOM 1110 O ASN A 73 0.431 -10.134 -3.234 1.00 0.00 O ATOM 1111 CB ASN A 73 1.455 -8.796 -6.167 1.00 0.00 C ATOM 1112 CG ASN A 73 2.164 -9.186 -7.444 1.00 0.00 C ATOM 1113 OD1 ASN A 73 2.917 -10.157 -7.478 1.00 0.00 O ATOM 1114 ND2 ASN A 73 1.927 -8.429 -8.506 1.00 0.00 N ATOM 0 H ASN A 73 -0.495 -9.537 -7.360 1.00 0.00 H new ATOM 0 HA ASN A 73 1.194 -10.835 -5.502 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.828 -7.923 -6.351 1.00 0.00 H new ATOM 0 HB3 ASN A 73 2.191 -8.507 -5.416 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.377 -8.643 -9.396 1.00 0.00 H new ATOM 0 HD22 ASN A 73 1.295 -7.632 -8.433 1.00 0.00 H new ATOM 1121 N PHE A 74 -0.853 -8.579 -4.236 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.467 -8.091 -3.006 1.00 0.00 C ATOM 1123 C PHE A 74 -2.892 -7.623 -3.298 1.00 0.00 C ATOM 1124 O PHE A 74 -3.469 -8.014 -4.311 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.624 -6.947 -2.442 1.00 0.00 C ATOM 1126 CG PHE A 74 0.066 -6.147 -3.508 1.00 0.00 C ATOM 1127 CD1 PHE A 74 -0.664 -5.337 -4.363 1.00 0.00 C ATOM 1128 CD2 PHE A 74 1.440 -6.221 -3.668 1.00 0.00 C ATOM 1129 CE1 PHE A 74 -0.035 -4.617 -5.358 1.00 0.00 C ATOM 1130 CE2 PHE A 74 2.075 -5.499 -4.659 1.00 0.00 C ATOM 1131 CZ PHE A 74 1.334 -4.699 -5.506 1.00 0.00 C ATOM 0 H PHE A 74 -1.174 -8.100 -5.077 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.511 -8.891 -2.267 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.263 -6.286 -1.856 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.123 -7.355 -1.761 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.736 -5.269 -4.250 1.00 0.00 H new ATOM 0 HD2 PHE A 74 2.021 -6.850 -3.010 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.614 -3.990 -6.020 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.147 -5.560 -4.771 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.827 -4.137 -6.285 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.474 -6.793 -2.434 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.835 -6.325 -2.687 1.00 0.00 C ATOM 1143 C VAL A 75 -5.045 -4.846 -2.383 1.00 0.00 C ATOM 1144 O VAL A 75 -4.536 -4.290 -1.411 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.901 -7.135 -1.909 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.697 -6.985 -0.410 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -7.323 -6.704 -2.312 1.00 0.00 C ATOM 0 H VAL A 75 -3.042 -6.440 -1.580 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.964 -6.480 -3.758 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.783 -8.187 -2.168 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.455 -7.561 0.120 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.707 -7.352 -0.139 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.782 -5.934 -0.135 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.053 -7.288 -1.751 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.459 -5.645 -2.091 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.466 -6.873 -3.379 1.00 0.00 H new ATOM 1157 N MET A 76 -5.844 -4.259 -3.251 1.00 0.00 N ATOM 1158 CA MET A 76 -6.262 -2.877 -3.222 1.00 0.00 C ATOM 1159 C MET A 76 -6.492 -2.292 -1.827 1.00 0.00 C ATOM 1160 O MET A 76 -7.516 -2.563 -1.191 1.00 0.00 O ATOM 1161 CB MET A 76 -7.601 -2.858 -3.954 1.00 0.00 C ATOM 1162 CG MET A 76 -8.191 -4.267 -4.168 1.00 0.00 C ATOM 1163 SD MET A 76 -8.352 -4.746 -5.904 1.00 0.00 S ATOM 1164 CE MET A 76 -7.006 -5.915 -6.065 1.00 0.00 C ATOM 0 H MET A 76 -6.241 -4.767 -4.042 1.00 0.00 H new ATOM 0 HA MET A 76 -5.469 -2.273 -3.664 1.00 0.00 H new ATOM 0 HB2 MET A 76 -8.310 -2.255 -3.387 1.00 0.00 H new ATOM 0 HB3 MET A 76 -7.473 -2.373 -4.922 1.00 0.00 H new ATOM 0 HG2 MET A 76 -7.559 -4.995 -3.659 1.00 0.00 H new ATOM 0 HG3 MET A 76 -9.173 -4.313 -3.697 1.00 0.00 H new ATOM 0 HE1 MET A 76 -6.999 -6.325 -7.075 1.00 0.00 H new ATOM 0 HE2 MET A 76 -6.060 -5.409 -5.872 1.00 0.00 H new ATOM 0 HE3 MET A 76 -7.138 -6.724 -5.346 1.00 0.00 H new ATOM 1174 N VAL A 77 -5.565 -1.429 -1.391 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.694 -0.748 -0.107 1.00 0.00 C ATOM 1176 C VAL A 77 -5.081 0.648 -0.165 1.00 0.00 C ATOM 1177 O VAL A 77 -4.151 0.966 0.569 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.064 -1.558 1.048 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -4.968 -0.729 2.324 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -5.876 -2.806 1.299 1.00 0.00 C ATOM 0 H VAL A 77 -4.721 -1.190 -1.911 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.761 -0.658 0.096 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.051 -1.835 0.755 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.520 -1.330 3.116 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.349 0.150 2.141 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.966 -0.413 2.629 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.428 -3.374 2.114 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.895 -2.529 1.567 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.892 -3.417 0.397 1.00 0.00 H new ATOM 1190 N ASN A 78 -5.620 1.487 -1.037 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.134 2.847 -1.170 1.00 0.00 C ATOM 1192 C ASN A 78 -6.042 3.809 -0.421 1.00 0.00 C ATOM 1193 O ASN A 78 -7.185 4.043 -0.812 1.00 0.00 O ATOM 1194 CB ASN A 78 -5.016 3.239 -2.647 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.521 4.642 -2.957 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -6.336 4.839 -3.856 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -5.029 5.626 -2.218 1.00 0.00 N ATOM 0 H ASN A 78 -6.392 1.249 -1.660 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.139 2.904 -0.729 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -3.972 3.165 -2.950 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -5.574 2.522 -3.249 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -5.325 6.587 -2.386 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.354 5.422 -1.481 1.00 0.00 H new ATOM 1204 N LEU A 79 -5.516 4.360 0.655 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.267 5.304 1.474 1.00 0.00 C ATOM 1206 C LEU A 79 -6.045 6.740 0.985 1.00 0.00 C ATOM 1207 O LEU A 79 -4.949 7.102 0.549 1.00 0.00 O ATOM 1208 CB LEU A 79 -5.878 5.140 2.955 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.788 6.423 3.786 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -7.178 6.921 4.153 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -4.958 6.189 5.041 1.00 0.00 C ATOM 0 H LEU A 79 -4.570 4.173 0.987 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.332 5.091 1.379 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.605 4.479 3.427 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.912 4.636 3.000 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.296 7.187 3.184 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.093 7.833 4.743 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -7.742 7.128 3.244 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -7.696 6.159 4.735 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.905 7.111 5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.422 5.409 5.644 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.952 5.879 4.759 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.095 7.552 1.050 1.00 0.00 N ATOM 1224 CA GLU A 80 -7.015 8.941 0.608 1.00 0.00 C ATOM 1225 C GLU A 80 -7.039 9.894 1.799 1.00 0.00 C ATOM 1226 O GLU A 80 -6.933 9.470 2.949 1.00 0.00 O ATOM 1227 CB GLU A 80 -8.169 9.262 -0.345 1.00 0.00 C ATOM 1228 CG GLU A 80 -7.727 9.975 -1.613 1.00 0.00 C ATOM 1229 CD GLU A 80 -8.854 10.131 -2.616 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -9.749 10.968 -2.379 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -8.840 9.414 -3.640 1.00 0.00 O ATOM 0 H GLU A 80 -8.010 7.274 1.404 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.071 9.075 0.080 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.675 8.335 -0.616 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.898 9.882 0.176 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -7.336 10.959 -1.355 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.910 9.418 -2.073 1.00 0.00 H new ATOM 1238 N ASP A 81 -7.180 11.184 1.513 1.00 0.00 N ATOM 1239 CA ASP A 81 -7.216 12.201 2.558 1.00 0.00 C ATOM 1240 C ASP A 81 -8.555 12.190 3.292 1.00 0.00 C ATOM 1241 O ASP A 81 -8.658 12.679 4.417 1.00 0.00 O ATOM 1242 CB ASP A 81 -6.961 13.585 1.957 1.00 0.00 C ATOM 1243 CG ASP A 81 -8.023 13.981 0.950 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -7.871 13.630 -0.240 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -9.004 14.641 1.349 1.00 0.00 O ATOM 0 H ASP A 81 -7.271 11.550 0.565 1.00 0.00 H new ATOM 0 HA ASP A 81 -6.431 11.972 3.278 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -6.928 14.325 2.757 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -5.984 13.594 1.474 1.00 0.00 H new ATOM 1250 N GLU A 82 -9.579 11.634 2.649 1.00 0.00 N ATOM 1251 CA GLU A 82 -10.911 11.564 3.244 1.00 0.00 C ATOM 1252 C GLU A 82 -10.861 10.942 4.638 1.00 0.00 C ATOM 1253 O GLU A 82 -11.681 11.261 5.499 1.00 0.00 O ATOM 1254 CB GLU A 82 -11.850 10.756 2.346 1.00 0.00 C ATOM 1255 CG GLU A 82 -13.258 11.322 2.274 1.00 0.00 C ATOM 1256 CD GLU A 82 -13.380 12.458 1.277 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -13.501 12.175 0.066 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -13.352 13.630 1.707 1.00 0.00 O ATOM 0 H GLU A 82 -9.512 11.226 1.717 1.00 0.00 H new ATOM 0 HA GLU A 82 -11.291 12.581 3.338 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -11.432 10.715 1.340 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -11.898 9.731 2.713 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -13.952 10.527 2.000 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.554 11.677 3.261 1.00 0.00 H new ATOM 1265 N GLU A 83 -9.894 10.055 4.852 1.00 0.00 N ATOM 1266 CA GLU A 83 -9.739 9.392 6.141 1.00 0.00 C ATOM 1267 C GLU A 83 -8.383 9.716 6.758 1.00 0.00 C ATOM 1268 O GLU A 83 -7.338 9.437 6.169 1.00 0.00 O ATOM 1269 CB GLU A 83 -9.891 7.878 5.981 1.00 0.00 C ATOM 1270 CG GLU A 83 -10.589 7.210 7.154 1.00 0.00 C ATOM 1271 CD GLU A 83 -11.453 6.039 6.729 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -12.608 6.273 6.316 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -10.974 4.888 6.807 1.00 0.00 O ATOM 0 H GLU A 83 -9.207 9.779 4.150 1.00 0.00 H new ATOM 0 HA GLU A 83 -10.519 9.760 6.807 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -10.452 7.672 5.070 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -8.904 7.433 5.855 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -9.841 6.865 7.868 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -11.207 7.944 7.670 1.00 0.00 H new ATOM 1280 N GLU A 84 -8.406 10.306 7.949 1.00 0.00 N ATOM 1281 CA GLU A 84 -7.178 10.667 8.646 1.00 0.00 C ATOM 1282 C GLU A 84 -6.900 9.703 9.797 1.00 0.00 C ATOM 1283 O GLU A 84 -7.335 9.929 10.926 1.00 0.00 O ATOM 1284 CB GLU A 84 -7.273 12.099 9.179 1.00 0.00 C ATOM 1285 CG GLU A 84 -8.582 12.397 9.892 1.00 0.00 C ATOM 1286 CD GLU A 84 -8.432 13.457 10.966 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -8.120 14.616 10.618 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -8.625 13.128 12.155 1.00 0.00 O ATOM 0 H GLU A 84 -9.262 10.544 8.451 1.00 0.00 H new ATOM 0 HA GLU A 84 -6.354 10.603 7.935 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -6.446 12.278 9.866 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -7.154 12.795 8.349 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -9.322 12.726 9.163 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -8.963 11.480 10.342 1.00 0.00 H new ATOM 1295 N PRO A 85 -6.166 8.610 9.525 1.00 0.00 N ATOM 1296 CA PRO A 85 -5.832 7.611 10.547 1.00 0.00 C ATOM 1297 C PRO A 85 -4.861 8.153 11.589 1.00 0.00 C ATOM 1298 O PRO A 85 -4.608 9.356 11.651 1.00 0.00 O ATOM 1299 CB PRO A 85 -5.181 6.482 9.743 1.00 0.00 C ATOM 1300 CG PRO A 85 -4.650 7.144 8.521 1.00 0.00 C ATOM 1301 CD PRO A 85 -5.606 8.261 8.206 1.00 0.00 C ATOM 0 HA PRO A 85 -6.709 7.297 11.112 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -4.384 6.001 10.310 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -5.905 5.707 9.491 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -3.644 7.528 8.691 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -4.586 6.439 7.692 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -5.097 9.109 7.748 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -6.383 7.942 7.511 1.00 0.00 H new ATOM 1309 N LYS A 86 -4.320 7.255 12.407 1.00 0.00 N ATOM 1310 CA LYS A 86 -3.376 7.642 13.449 1.00 0.00 C ATOM 1311 C LYS A 86 -2.298 6.576 13.626 1.00 0.00 C ATOM 1312 O LYS A 86 -2.024 6.135 14.743 1.00 0.00 O ATOM 1313 CB LYS A 86 -4.110 7.870 14.771 1.00 0.00 C ATOM 1314 CG LYS A 86 -4.980 6.696 15.194 1.00 0.00 C ATOM 1315 CD LYS A 86 -4.372 5.942 16.366 1.00 0.00 C ATOM 1316 CE LYS A 86 -5.443 5.283 17.219 1.00 0.00 C ATOM 1317 NZ LYS A 86 -4.986 5.076 18.623 1.00 0.00 N ATOM 0 H LYS A 86 -4.519 6.255 12.368 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.895 8.572 13.145 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.378 8.070 15.554 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -4.733 8.760 14.682 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -5.971 7.057 15.468 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.110 6.017 14.352 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.683 5.183 15.994 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -3.789 6.629 16.979 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -6.340 5.902 17.217 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -5.716 4.323 16.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -5.745 4.624 19.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.144 4.465 18.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -4.749 5.994 19.050 1.00 0.00 H new ATOM 1331 N ASP A 87 -1.692 6.163 12.518 1.00 0.00 N ATOM 1332 CA ASP A 87 -0.646 5.148 12.553 1.00 0.00 C ATOM 1333 C ASP A 87 0.390 5.390 11.460 1.00 0.00 C ATOM 1334 O ASP A 87 0.210 6.249 10.597 1.00 0.00 O ATOM 1335 CB ASP A 87 -1.259 3.753 12.395 1.00 0.00 C ATOM 1336 CG ASP A 87 -0.991 2.866 13.595 1.00 0.00 C ATOM 1337 OD1 ASP A 87 -1.614 3.093 14.653 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -0.156 1.944 13.477 1.00 0.00 O ATOM 0 H ASP A 87 -1.907 6.515 11.585 1.00 0.00 H new ATOM 0 HA ASP A 87 -0.144 5.212 13.519 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -2.335 3.846 12.248 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.855 3.281 11.500 1.00 0.00 H new ATOM 1343 N GLU A 88 1.475 4.624 11.505 1.00 0.00 N ATOM 1344 CA GLU A 88 2.549 4.745 10.523 1.00 0.00 C ATOM 1345 C GLU A 88 2.080 4.320 9.131 1.00 0.00 C ATOM 1346 O GLU A 88 2.751 4.587 8.134 1.00 0.00 O ATOM 1347 CB GLU A 88 3.751 3.900 10.947 1.00 0.00 C ATOM 1348 CG GLU A 88 4.574 4.528 12.059 1.00 0.00 C ATOM 1349 CD GLU A 88 5.191 5.850 11.650 1.00 0.00 C ATOM 1350 OE1 GLU A 88 4.474 6.872 11.664 1.00 0.00 O ATOM 1351 OE2 GLU A 88 6.395 5.865 11.316 1.00 0.00 O ATOM 0 H GLU A 88 1.635 3.909 12.215 1.00 0.00 H new ATOM 0 HA GLU A 88 2.843 5.794 10.478 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.399 2.922 11.275 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.392 3.735 10.081 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.941 4.681 12.933 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.364 3.838 12.355 1.00 0.00 H new ATOM 1358 N ASP A 89 0.931 3.648 9.071 1.00 0.00 N ATOM 1359 CA ASP A 89 0.376 3.173 7.804 1.00 0.00 C ATOM 1360 C ASP A 89 0.348 4.268 6.731 1.00 0.00 C ATOM 1361 O ASP A 89 0.219 3.966 5.546 1.00 0.00 O ATOM 1362 CB ASP A 89 -1.033 2.618 8.022 1.00 0.00 C ATOM 1363 CG ASP A 89 -1.038 1.393 8.921 1.00 0.00 C ATOM 1364 OD1 ASP A 89 -0.804 0.274 8.411 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -1.278 1.551 10.137 1.00 0.00 O ATOM 0 H ASP A 89 0.365 3.420 9.888 1.00 0.00 H new ATOM 0 HA ASP A 89 1.032 2.381 7.442 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -1.662 3.392 8.463 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -1.473 2.361 7.058 1.00 0.00 H new ATOM 1370 N PHE A 90 0.470 5.534 7.139 1.00 0.00 N ATOM 1371 CA PHE A 90 0.458 6.647 6.186 1.00 0.00 C ATOM 1372 C PHE A 90 1.881 7.083 5.827 1.00 0.00 C ATOM 1373 O PHE A 90 2.146 7.523 4.700 1.00 0.00 O ATOM 1374 CB PHE A 90 -0.342 7.829 6.757 1.00 0.00 C ATOM 1375 CG PHE A 90 0.483 8.815 7.545 1.00 0.00 C ATOM 1376 CD1 PHE A 90 1.194 8.411 8.662 1.00 0.00 C ATOM 1377 CD2 PHE A 90 0.541 10.146 7.163 1.00 0.00 C ATOM 1378 CE1 PHE A 90 1.950 9.313 9.384 1.00 0.00 C ATOM 1379 CE2 PHE A 90 1.296 11.054 7.882 1.00 0.00 C ATOM 1380 CZ PHE A 90 2.000 10.637 8.994 1.00 0.00 C ATOM 0 H PHE A 90 0.577 5.813 8.114 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.027 6.305 5.271 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.827 8.355 5.935 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.133 7.441 7.398 1.00 0.00 H new ATOM 0 HD1 PHE A 90 1.157 7.377 8.973 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.009 10.477 6.295 1.00 0.00 H new ATOM 0 HE1 PHE A 90 2.501 8.984 10.252 1.00 0.00 H new ATOM 0 HE2 PHE A 90 1.335 12.088 7.574 1.00 0.00 H new ATOM 0 HZ PHE A 90 2.589 11.345 9.558 1.00 0.00 H new ATOM 1390 N SER A 91 2.787 6.957 6.796 1.00 0.00 N ATOM 1391 CA SER A 91 4.185 7.332 6.609 1.00 0.00 C ATOM 1392 C SER A 91 5.058 6.697 7.692 1.00 0.00 C ATOM 1393 O SER A 91 4.993 7.091 8.857 1.00 0.00 O ATOM 1394 CB SER A 91 4.333 8.855 6.647 1.00 0.00 C ATOM 1395 OG SER A 91 3.291 9.486 5.927 1.00 0.00 O ATOM 0 H SER A 91 2.573 6.595 7.725 1.00 0.00 H new ATOM 0 HA SER A 91 4.513 6.967 5.636 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.324 9.199 7.681 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.296 9.141 6.224 1.00 0.00 H new ATOM 0 HG SER A 91 2.541 9.669 6.530 1.00 0.00 H new ATOM 1401 N PRO A 92 5.877 5.693 7.330 1.00 0.00 N ATOM 1402 CA PRO A 92 6.740 5.001 8.274 1.00 0.00 C ATOM 1403 C PRO A 92 8.147 5.600 8.369 1.00 0.00 C ATOM 1404 O PRO A 92 8.468 6.287 9.337 1.00 0.00 O ATOM 1405 CB PRO A 92 6.791 3.583 7.699 1.00 0.00 C ATOM 1406 CG PRO A 92 6.495 3.719 6.233 1.00 0.00 C ATOM 1407 CD PRO A 92 6.020 5.133 5.982 1.00 0.00 C ATOM 0 HA PRO A 92 6.361 5.064 9.294 1.00 0.00 H new ATOM 0 HB2 PRO A 92 7.770 3.132 7.859 1.00 0.00 H new ATOM 0 HB3 PRO A 92 6.060 2.938 8.186 1.00 0.00 H new ATOM 0 HG2 PRO A 92 7.386 3.506 5.643 1.00 0.00 H new ATOM 0 HG3 PRO A 92 5.733 3.001 5.930 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.738 5.698 5.387 1.00 0.00 H new ATOM 0 HD3 PRO A 92 5.075 5.148 5.439 1.00 0.00 H new ATOM 1415 N ASP A 93 8.984 5.323 7.370 1.00 0.00 N ATOM 1416 CA ASP A 93 10.358 5.824 7.366 1.00 0.00 C ATOM 1417 C ASP A 93 10.401 7.351 7.414 1.00 0.00 C ATOM 1418 O ASP A 93 11.140 7.933 8.209 1.00 0.00 O ATOM 1419 CB ASP A 93 11.114 5.302 6.133 1.00 0.00 C ATOM 1420 CG ASP A 93 10.851 6.117 4.879 1.00 0.00 C ATOM 1421 OD1 ASP A 93 9.672 6.410 4.595 1.00 0.00 O ATOM 1422 OD2 ASP A 93 11.828 6.461 4.181 1.00 0.00 O ATOM 0 H ASP A 93 8.737 4.758 6.558 1.00 0.00 H new ATOM 0 HA ASP A 93 10.850 5.453 8.265 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.184 5.305 6.343 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.828 4.266 5.952 1.00 0.00 H new ATOM 1427 N GLY A 94 9.618 7.995 6.557 1.00 0.00 N ATOM 1428 CA GLY A 94 9.595 9.445 6.519 1.00 0.00 C ATOM 1429 C GLY A 94 8.326 10.026 7.104 1.00 0.00 C ATOM 1430 O GLY A 94 7.515 9.306 7.688 1.00 0.00 O ATOM 0 H GLY A 94 8.998 7.539 5.887 1.00 0.00 H new ATOM 0 HA2 GLY A 94 10.453 9.832 7.068 1.00 0.00 H new ATOM 0 HA3 GLY A 94 9.700 9.779 5.487 1.00 0.00 H new ATOM 1434 N GLY A 95 8.154 11.333 6.947 1.00 0.00 N ATOM 1435 CA GLY A 95 6.974 11.993 7.468 1.00 0.00 C ATOM 1436 C GLY A 95 6.222 12.765 6.401 1.00 0.00 C ATOM 1437 O GLY A 95 5.521 13.730 6.705 1.00 0.00 O ATOM 0 H GLY A 95 8.812 11.947 6.467 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.311 11.249 7.909 1.00 0.00 H new ATOM 0 HA3 GLY A 95 7.266 12.674 8.267 1.00 0.00 H new ATOM 1441 N TYR A 96 6.364 12.340 5.148 1.00 0.00 N ATOM 1442 CA TYR A 96 5.684 13.004 4.041 1.00 0.00 C ATOM 1443 C TYR A 96 4.167 12.958 4.245 1.00 0.00 C ATOM 1444 O TYR A 96 3.706 12.700 5.357 1.00 0.00 O ATOM 1445 CB TYR A 96 6.090 12.370 2.709 1.00 0.00 C ATOM 1446 CG TYR A 96 6.070 10.857 2.699 1.00 0.00 C ATOM 1447 CD1 TYR A 96 5.331 10.134 3.629 1.00 0.00 C ATOM 1448 CD2 TYR A 96 6.772 10.151 1.731 1.00 0.00 C ATOM 1449 CE1 TYR A 96 5.300 8.755 3.596 1.00 0.00 C ATOM 1450 CE2 TYR A 96 6.741 8.771 1.690 1.00 0.00 C ATOM 1451 CZ TYR A 96 6.004 8.079 2.626 1.00 0.00 C ATOM 1452 OH TYR A 96 5.968 6.704 2.591 1.00 0.00 O ATOM 0 H TYR A 96 6.940 11.544 4.876 1.00 0.00 H new ATOM 0 HA TYR A 96 5.986 14.051 4.016 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.421 12.734 1.929 1.00 0.00 H new ATOM 0 HB3 TYR A 96 7.094 12.709 2.451 1.00 0.00 H new ATOM 0 HD1 TYR A 96 4.773 10.660 4.389 1.00 0.00 H new ATOM 0 HD2 TYR A 96 7.352 10.691 0.997 1.00 0.00 H new ATOM 0 HE1 TYR A 96 4.725 8.208 4.329 1.00 0.00 H new ATOM 0 HE2 TYR A 96 7.291 8.238 0.929 1.00 0.00 H new ATOM 0 HH TYR A 96 6.849 6.348 2.828 1.00 0.00 H new ATOM 1462 N ILE A 97 3.386 13.232 3.198 1.00 0.00 N ATOM 1463 CA ILE A 97 1.930 13.237 3.346 1.00 0.00 C ATOM 1464 C ILE A 97 1.180 12.972 2.001 1.00 0.00 C ATOM 1465 O ILE A 97 0.564 13.969 1.621 1.00 0.00 O ATOM 1466 CB ILE A 97 1.484 14.599 3.889 1.00 0.00 C ATOM 1467 CG1 ILE A 97 2.010 15.704 2.978 1.00 0.00 C ATOM 1468 CG2 ILE A 97 2.001 14.789 5.301 1.00 0.00 C ATOM 1469 CD1 ILE A 97 1.026 16.829 2.754 1.00 0.00 C ATOM 0 H ILE A 97 3.726 13.448 2.261 1.00 0.00 H new ATOM 0 HA ILE A 97 1.677 12.429 4.032 1.00 0.00 H new ATOM 0 HB ILE A 97 0.395 14.643 3.911 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.924 16.113 3.409 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.278 15.271 2.014 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.679 15.760 5.679 1.00 0.00 H new ATOM 0 HG22 ILE A 97 1.606 14.001 5.942 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.090 14.743 5.299 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.471 17.576 2.097 1.00 0.00 H new ATOM 0 HD12 ILE A 97 0.120 16.434 2.294 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.776 17.289 3.710 1.00 0.00 H new ATOM 1481 N PRO A 98 0.464 11.813 1.992 1.00 0.00 N ATOM 1482 CA PRO A 98 0.657 10.362 2.314 1.00 0.00 C ATOM 1483 C PRO A 98 1.198 9.660 1.084 1.00 0.00 C ATOM 1484 O PRO A 98 1.012 10.157 -0.031 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.733 9.845 2.643 1.00 0.00 C ATOM 1486 CG PRO A 98 -1.155 10.911 3.507 1.00 0.00 C ATOM 1487 CD PRO A 98 0.069 11.770 3.475 1.00 0.00 C ATOM 0 HA PRO A 98 1.354 10.195 3.135 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.365 9.739 1.761 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -0.717 8.876 3.142 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -2.037 11.428 3.130 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.394 10.563 4.512 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.136 12.769 3.861 1.00 0.00 H new ATOM 0 HD3 PRO A 98 0.867 11.349 4.087 1.00 0.00 H new ATOM 1495 N ARG A 99 1.903 8.544 1.265 1.00 0.00 N ATOM 1496 CA ARG A 99 2.497 7.859 0.115 1.00 0.00 C ATOM 1497 C ARG A 99 2.367 6.338 0.180 1.00 0.00 C ATOM 1498 O ARG A 99 1.606 5.801 0.985 1.00 0.00 O ATOM 1499 CB ARG A 99 3.952 8.293 -0.031 1.00 0.00 C ATOM 1500 CG ARG A 99 4.147 9.761 0.328 1.00 0.00 C ATOM 1501 CD ARG A 99 5.119 10.466 -0.595 1.00 0.00 C ATOM 1502 NE ARG A 99 4.593 10.582 -1.952 1.00 0.00 N ATOM 1503 CZ ARG A 99 3.717 11.508 -2.333 1.00 0.00 C ATOM 1504 NH1 ARG A 99 3.265 12.404 -1.463 1.00 0.00 N ATOM 1505 NH2 ARG A 99 3.291 11.540 -3.589 1.00 0.00 N ATOM 0 H ARG A 99 2.075 8.104 2.169 1.00 0.00 H new ATOM 0 HA ARG A 99 1.936 8.154 -0.772 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.581 7.676 0.611 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.280 8.124 -1.057 1.00 0.00 H new ATOM 0 HG2 ARG A 99 3.184 10.270 0.292 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.508 9.835 1.354 1.00 0.00 H new ATOM 0 HD2 ARG A 99 5.336 11.460 -0.203 1.00 0.00 H new ATOM 0 HD3 ARG A 99 6.062 9.919 -0.616 1.00 0.00 H new ATOM 0 HE ARG A 99 4.917 9.913 -2.650 1.00 0.00 H new ATOM 0 HH11 ARG A 99 3.589 12.385 -0.496 1.00 0.00 H new ATOM 0 HH12 ARG A 99 2.593 13.111 -1.762 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.635 10.855 -4.262 1.00 0.00 H new ATOM 0 HH22 ARG A 99 2.619 12.250 -3.882 1.00 0.00 H new ATOM 1519 N ILE A 100 3.092 5.653 -0.710 1.00 0.00 N ATOM 1520 CA ILE A 100 3.032 4.191 -0.794 1.00 0.00 C ATOM 1521 C ILE A 100 3.679 3.517 0.408 1.00 0.00 C ATOM 1522 O ILE A 100 4.756 3.903 0.845 1.00 0.00 O ATOM 1523 CB ILE A 100 3.693 3.680 -2.094 1.00 0.00 C ATOM 1524 CG1 ILE A 100 2.853 4.082 -3.308 1.00 0.00 C ATOM 1525 CG2 ILE A 100 3.869 2.167 -2.054 1.00 0.00 C ATOM 1526 CD1 ILE A 100 2.818 5.574 -3.562 1.00 0.00 C ATOM 0 H ILE A 100 3.726 6.087 -1.381 1.00 0.00 H new ATOM 0 HA ILE A 100 1.975 3.926 -0.801 1.00 0.00 H new ATOM 0 HB ILE A 100 4.679 4.137 -2.179 1.00 0.00 H new ATOM 0 HG12 ILE A 100 3.248 3.582 -4.192 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.833 3.723 -3.167 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.336 1.830 -2.980 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.502 1.897 -1.209 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.895 1.690 -1.945 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.203 5.780 -4.438 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.395 6.081 -2.695 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.831 5.937 -3.736 1.00 0.00 H new ATOM 1538 N LEU A 101 2.998 2.505 0.938 1.00 0.00 N ATOM 1539 CA LEU A 101 3.474 1.763 2.096 1.00 0.00 C ATOM 1540 C LEU A 101 3.122 0.277 1.979 1.00 0.00 C ATOM 1541 O LEU A 101 1.943 -0.082 1.973 1.00 0.00 O ATOM 1542 CB LEU A 101 2.821 2.328 3.360 1.00 0.00 C ATOM 1543 CG LEU A 101 3.592 3.440 4.072 1.00 0.00 C ATOM 1544 CD1 LEU A 101 3.712 4.677 3.194 1.00 0.00 C ATOM 1545 CD2 LEU A 101 2.905 3.789 5.378 1.00 0.00 C ATOM 0 H LEU A 101 2.102 2.178 0.576 1.00 0.00 H new ATOM 0 HA LEU A 101 4.558 1.864 2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.834 2.708 3.096 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.670 1.510 4.064 1.00 0.00 H new ATOM 0 HG LEU A 101 4.599 3.078 4.280 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.265 5.450 3.728 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.240 4.421 2.276 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.717 5.047 2.949 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.459 4.582 5.880 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.889 4.129 5.175 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.872 2.908 6.019 1.00 0.00 H new ATOM 1557 N PHE A 102 4.133 -0.594 1.902 1.00 0.00 N ATOM 1558 CA PHE A 102 3.865 -2.027 1.813 1.00 0.00 C ATOM 1559 C PHE A 102 3.647 -2.603 3.211 1.00 0.00 C ATOM 1560 O PHE A 102 4.298 -2.178 4.173 1.00 0.00 O ATOM 1561 CB PHE A 102 5.008 -2.746 1.100 1.00 0.00 C ATOM 1562 CG PHE A 102 4.699 -3.077 -0.331 1.00 0.00 C ATOM 1563 CD1 PHE A 102 4.099 -4.280 -0.665 1.00 0.00 C ATOM 1564 CD2 PHE A 102 5.007 -2.182 -1.343 1.00 0.00 C ATOM 1565 CE1 PHE A 102 3.811 -4.584 -1.981 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.721 -2.481 -2.662 1.00 0.00 C ATOM 1567 CZ PHE A 102 4.122 -3.684 -2.980 1.00 0.00 C ATOM 0 H PHE A 102 5.120 -0.338 1.900 1.00 0.00 H new ATOM 0 HA PHE A 102 2.958 -2.180 1.228 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.900 -2.121 1.137 1.00 0.00 H new ATOM 0 HB3 PHE A 102 5.241 -3.666 1.637 1.00 0.00 H new ATOM 0 HD1 PHE A 102 3.854 -4.988 0.113 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.476 -1.240 -1.099 1.00 0.00 H new ATOM 0 HE1 PHE A 102 3.343 -5.525 -2.228 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.965 -1.775 -3.442 1.00 0.00 H new ATOM 0 HZ PHE A 102 3.897 -3.920 -4.010 1.00 0.00 H new ATOM 1577 N LEU A 103 2.711 -3.545 3.345 1.00 0.00 N ATOM 1578 CA LEU A 103 2.427 -4.112 4.658 1.00 0.00 C ATOM 1579 C LEU A 103 1.937 -5.556 4.594 1.00 0.00 C ATOM 1580 O LEU A 103 1.617 -6.079 3.525 1.00 0.00 O ATOM 1581 CB LEU A 103 1.396 -3.245 5.375 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.033 -3.360 4.864 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.000 -2.731 5.847 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.160 -2.709 3.497 1.00 0.00 C ATOM 0 H LEU A 103 2.151 -3.922 2.580 1.00 0.00 H new ATOM 0 HA LEU A 103 3.366 -4.125 5.211 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.405 -3.502 6.434 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.707 -2.203 5.297 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.283 -4.417 4.767 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.017 -2.822 5.466 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.925 -3.241 6.808 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.754 -1.677 5.976 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.188 -2.799 3.145 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.107 -1.655 3.570 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.509 -3.205 2.794 1.00 0.00 H new ATOM 1596 N ASP A 104 1.878 -6.186 5.768 1.00 0.00 N ATOM 1597 CA ASP A 104 1.429 -7.570 5.887 1.00 0.00 C ATOM 1598 C ASP A 104 -0.083 -7.669 5.695 1.00 0.00 C ATOM 1599 O ASP A 104 -0.818 -6.722 5.999 1.00 0.00 O ATOM 1600 CB ASP A 104 1.822 -8.135 7.255 1.00 0.00 C ATOM 1601 CG ASP A 104 2.665 -9.391 7.146 1.00 0.00 C ATOM 1602 OD1 ASP A 104 3.191 -9.662 6.045 1.00 0.00 O ATOM 1603 OD2 ASP A 104 2.799 -10.105 8.162 1.00 0.00 O ATOM 0 H ASP A 104 2.138 -5.754 6.655 1.00 0.00 H new ATOM 0 HA ASP A 104 1.914 -8.156 5.106 1.00 0.00 H new ATOM 0 HB2 ASP A 104 2.374 -7.378 7.812 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.920 -8.355 7.826 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.565 -8.823 5.190 1.00 0.00 N ATOM 1609 CA PRO A 105 -1.995 -9.049 4.953 1.00 0.00 C ATOM 1610 C PRO A 105 -2.809 -9.038 6.239 1.00 0.00 C ATOM 1611 O PRO A 105 -2.946 -10.062 6.909 1.00 0.00 O ATOM 1612 CB PRO A 105 -2.054 -10.432 4.295 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.760 -11.093 4.629 1.00 0.00 C ATOM 1614 CD PRO A 105 0.251 -9.993 4.817 1.00 0.00 C ATOM 0 HA PRO A 105 -2.423 -8.258 4.337 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -2.898 -11.010 4.673 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.183 -10.347 3.216 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.854 -11.692 5.535 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.453 -11.769 3.831 1.00 0.00 H new ATOM 0 HD2 PRO A 105 0.972 -10.242 5.595 1.00 0.00 H new ATOM 0 HD3 PRO A 105 0.818 -9.810 3.904 1.00 0.00 H new ATOM 1622 N SER A 106 -3.348 -7.867 6.568 1.00 0.00 N ATOM 1623 CA SER A 106 -4.159 -7.678 7.770 1.00 0.00 C ATOM 1624 C SER A 106 -4.176 -6.206 8.165 1.00 0.00 C ATOM 1625 O SER A 106 -5.118 -5.731 8.800 1.00 0.00 O ATOM 1626 CB SER A 106 -3.624 -8.515 8.939 1.00 0.00 C ATOM 1627 OG SER A 106 -4.103 -8.025 10.180 1.00 0.00 O ATOM 0 H SER A 106 -3.235 -7.021 6.009 1.00 0.00 H new ATOM 0 HA SER A 106 -5.173 -8.009 7.544 1.00 0.00 H new ATOM 0 HB2 SER A 106 -3.927 -9.555 8.814 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.534 -8.497 8.934 1.00 0.00 H new ATOM 0 HG SER A 106 -3.749 -8.577 10.908 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.120 -5.490 7.789 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.018 -4.084 8.115 1.00 0.00 C ATOM 1635 C GLY A 107 -1.830 -3.803 9.012 1.00 0.00 C ATOM 1636 O GLY A 107 -1.961 -3.106 10.019 1.00 0.00 O ATOM 0 H GLY A 107 -2.331 -5.864 7.262 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -2.927 -3.503 7.197 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -3.933 -3.757 8.609 1.00 0.00 H new ATOM 1640 N LYS A 108 -0.669 -4.363 8.665 1.00 0.00 N ATOM 1641 CA LYS A 108 0.527 -4.173 9.482 1.00 0.00 C ATOM 1642 C LYS A 108 1.681 -3.524 8.711 1.00 0.00 C ATOM 1643 O LYS A 108 2.726 -4.145 8.505 1.00 0.00 O ATOM 1644 CB LYS A 108 0.974 -5.514 10.069 1.00 0.00 C ATOM 1645 CG LYS A 108 0.598 -5.686 11.531 1.00 0.00 C ATOM 1646 CD LYS A 108 1.680 -6.422 12.301 1.00 0.00 C ATOM 1647 CE LYS A 108 1.346 -7.896 12.462 1.00 0.00 C ATOM 1648 NZ LYS A 108 0.081 -8.098 13.219 1.00 0.00 N ATOM 0 H LYS A 108 -0.534 -4.943 7.837 1.00 0.00 H new ATOM 0 HA LYS A 108 0.259 -3.485 10.284 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.529 -6.323 9.489 1.00 0.00 H new ATOM 0 HB3 LYS A 108 2.055 -5.605 9.966 1.00 0.00 H new ATOM 0 HG2 LYS A 108 0.430 -4.708 11.982 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.340 -6.236 11.604 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.632 -6.319 11.781 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.802 -5.966 13.284 1.00 0.00 H new ATOM 0 HE2 LYS A 108 1.259 -8.358 11.479 1.00 0.00 H new ATOM 0 HE3 LYS A 108 2.163 -8.399 12.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 0.134 -8.989 13.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -0.058 -7.307 13.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.718 -8.139 12.555 1.00 0.00 H new ATOM 1662 N VAL A 109 1.500 -2.267 8.305 1.00 0.00 N ATOM 1663 CA VAL A 109 2.543 -1.530 7.587 1.00 0.00 C ATOM 1664 C VAL A 109 3.845 -1.543 8.369 1.00 0.00 C ATOM 1665 O VAL A 109 3.860 -1.342 9.583 1.00 0.00 O ATOM 1666 CB VAL A 109 2.117 -0.064 7.315 1.00 0.00 C ATOM 1667 CG1 VAL A 109 3.247 0.913 7.615 1.00 0.00 C ATOM 1668 CG2 VAL A 109 1.642 0.099 5.878 1.00 0.00 C ATOM 0 H VAL A 109 0.642 -1.737 8.460 1.00 0.00 H new ATOM 0 HA VAL A 109 2.692 -2.030 6.630 1.00 0.00 H new ATOM 0 HB VAL A 109 1.290 0.167 7.986 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.912 1.930 7.413 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.534 0.827 8.663 1.00 0.00 H new ATOM 0 HG13 VAL A 109 4.105 0.682 6.984 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.348 1.135 5.707 1.00 0.00 H new ATOM 0 HG22 VAL A 109 2.450 -0.166 5.196 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.788 -0.555 5.701 1.00 0.00 H new ATOM 1678 N HIS A 110 4.935 -1.774 7.655 1.00 0.00 N ATOM 1679 CA HIS A 110 6.247 -1.805 8.272 1.00 0.00 C ATOM 1680 C HIS A 110 7.271 -1.133 7.367 1.00 0.00 C ATOM 1681 O HIS A 110 7.245 -1.314 6.150 1.00 0.00 O ATOM 1682 CB HIS A 110 6.667 -3.248 8.563 1.00 0.00 C ATOM 1683 CG HIS A 110 6.611 -3.605 10.016 1.00 0.00 C ATOM 1684 ND1 HIS A 110 7.636 -3.334 10.899 1.00 0.00 N ATOM 1685 CD2 HIS A 110 5.644 -4.216 10.743 1.00 0.00 C ATOM 1686 CE1 HIS A 110 7.303 -3.761 12.103 1.00 0.00 C ATOM 1687 NE2 HIS A 110 6.099 -4.301 12.035 1.00 0.00 N ATOM 0 H HIS A 110 4.935 -1.942 6.649 1.00 0.00 H new ATOM 0 HA HIS A 110 6.199 -1.260 9.215 1.00 0.00 H new ATOM 0 HB2 HIS A 110 6.021 -3.926 8.005 1.00 0.00 H new ATOM 0 HB3 HIS A 110 7.682 -3.403 8.198 1.00 0.00 H new ATOM 0 HD2 HIS A 110 4.693 -4.570 10.374 1.00 0.00 H new ATOM 0 HE1 HIS A 110 7.911 -3.682 12.992 1.00 0.00 H new ATOM 0 HE2 HIS A 110 5.590 -4.714 12.816 1.00 0.00 H new ATOM 1696 N PRO A 111 8.194 -0.351 7.945 1.00 0.00 N ATOM 1697 CA PRO A 111 9.230 0.337 7.175 1.00 0.00 C ATOM 1698 C PRO A 111 10.262 -0.640 6.625 1.00 0.00 C ATOM 1699 O PRO A 111 11.463 -0.380 6.669 1.00 0.00 O ATOM 1700 CB PRO A 111 9.877 1.271 8.199 1.00 0.00 C ATOM 1701 CG PRO A 111 9.623 0.626 9.516 1.00 0.00 C ATOM 1702 CD PRO A 111 8.304 -0.084 9.389 1.00 0.00 C ATOM 0 HA PRO A 111 8.823 0.857 6.308 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.945 1.383 8.013 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.440 2.269 8.156 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.420 -0.075 9.766 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.590 1.369 10.313 1.00 0.00 H new ATOM 0 HD2 PRO A 111 8.287 -1.006 9.970 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.480 0.533 9.747 1.00 0.00 H new ATOM 1710 N GLU A 112 9.784 -1.774 6.122 1.00 0.00 N ATOM 1711 CA GLU A 112 10.670 -2.798 5.581 1.00 0.00 C ATOM 1712 C GLU A 112 10.492 -2.974 4.076 1.00 0.00 C ATOM 1713 O GLU A 112 11.318 -3.609 3.421 1.00 0.00 O ATOM 1714 CB GLU A 112 10.426 -4.130 6.289 1.00 0.00 C ATOM 1715 CG GLU A 112 11.692 -4.944 6.510 1.00 0.00 C ATOM 1716 CD GLU A 112 12.081 -5.756 5.292 1.00 0.00 C ATOM 1717 OE1 GLU A 112 11.593 -6.899 5.159 1.00 0.00 O ATOM 1718 OE2 GLU A 112 12.876 -5.253 4.470 1.00 0.00 O ATOM 0 H GLU A 112 8.792 -2.006 6.078 1.00 0.00 H new ATOM 0 HA GLU A 112 11.694 -2.468 5.757 1.00 0.00 H new ATOM 0 HB2 GLU A 112 9.955 -3.938 7.253 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.723 -4.720 5.702 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.510 -4.273 6.771 1.00 0.00 H new ATOM 0 HG3 GLU A 112 11.546 -5.614 7.357 1.00 0.00 H new ATOM 1725 N ILE A 113 9.414 -2.422 3.525 1.00 0.00 N ATOM 1726 CA ILE A 113 9.157 -2.549 2.096 1.00 0.00 C ATOM 1727 C ILE A 113 8.808 -1.208 1.455 1.00 0.00 C ATOM 1728 O ILE A 113 7.652 -0.757 1.492 1.00 0.00 O ATOM 1729 CB ILE A 113 8.034 -3.561 1.821 1.00 0.00 C ATOM 1730 CG1 ILE A 113 8.343 -4.886 2.522 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.855 -3.770 0.321 1.00 0.00 C ATOM 1732 CD1 ILE A 113 9.532 -5.619 1.937 1.00 0.00 C ATOM 0 H ILE A 113 8.713 -1.889 4.040 1.00 0.00 H new ATOM 0 HA ILE A 113 10.081 -2.911 1.646 1.00 0.00 H new ATOM 0 HB ILE A 113 7.099 -3.166 2.218 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.529 -4.693 3.579 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.466 -5.531 2.465 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.055 -4.490 0.147 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.598 -2.821 -0.150 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.783 -4.148 -0.107 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.691 -6.548 2.484 1.00 0.00 H new ATOM 0 HD12 ILE A 113 9.341 -5.843 0.888 1.00 0.00 H new ATOM 0 HD13 ILE A 113 10.421 -4.993 2.018 1.00 0.00 H new ATOM 1744 N ILE A 114 9.830 -0.594 0.857 1.00 0.00 N ATOM 1745 CA ILE A 114 9.694 0.690 0.180 1.00 0.00 C ATOM 1746 C ILE A 114 9.729 0.506 -1.339 1.00 0.00 C ATOM 1747 O ILE A 114 9.471 -0.588 -1.843 1.00 0.00 O ATOM 1748 CB ILE A 114 10.807 1.673 0.620 1.00 0.00 C ATOM 1749 CG1 ILE A 114 12.173 1.270 0.033 1.00 0.00 C ATOM 1750 CG2 ILE A 114 10.872 1.757 2.139 1.00 0.00 C ATOM 1751 CD1 ILE A 114 12.814 0.071 0.705 1.00 0.00 C ATOM 0 H ILE A 114 10.775 -0.976 0.830 1.00 0.00 H new ATOM 0 HA ILE A 114 8.730 1.113 0.462 1.00 0.00 H new ATOM 0 HB ILE A 114 10.560 2.660 0.230 1.00 0.00 H new ATOM 0 HG12 ILE A 114 12.049 1.053 -1.028 1.00 0.00 H new ATOM 0 HG13 ILE A 114 12.852 2.119 0.108 1.00 0.00 H new ATOM 0 HG21 ILE A 114 11.659 2.452 2.432 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.915 2.109 2.525 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.088 0.770 2.549 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.771 -0.144 0.230 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.974 0.288 1.761 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.158 -0.794 0.607 1.00 0.00 H new ATOM 1763 N ASN A 115 10.045 1.574 -2.064 1.00 0.00 N ATOM 1764 CA ASN A 115 10.107 1.523 -3.521 1.00 0.00 C ATOM 1765 C ASN A 115 11.491 1.102 -4.002 1.00 0.00 C ATOM 1766 O ASN A 115 11.622 0.366 -4.979 1.00 0.00 O ATOM 1767 CB ASN A 115 9.747 2.888 -4.105 1.00 0.00 C ATOM 1768 CG ASN A 115 9.697 2.876 -5.620 1.00 0.00 C ATOM 1769 OD1 ASN A 115 10.230 1.973 -6.264 1.00 0.00 O ATOM 1770 ND2 ASN A 115 9.050 3.882 -6.198 1.00 0.00 N ATOM 0 H ASN A 115 10.263 2.487 -1.666 1.00 0.00 H new ATOM 0 HA ASN A 115 9.388 0.779 -3.864 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.779 3.203 -3.715 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.479 3.625 -3.775 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.981 3.927 -7.215 1.00 0.00 H new ATOM 0 HD22 ASN A 115 8.623 4.610 -5.625 1.00 0.00 H new ATOM 1777 N GLU A 116 12.521 1.581 -3.314 1.00 0.00 N ATOM 1778 CA GLU A 116 13.901 1.262 -3.671 1.00 0.00 C ATOM 1779 C GLU A 116 14.326 2.028 -4.921 1.00 0.00 C ATOM 1780 O GLU A 116 15.237 2.855 -4.876 1.00 0.00 O ATOM 1781 CB GLU A 116 14.067 -0.244 -3.897 1.00 0.00 C ATOM 1782 CG GLU A 116 15.304 -0.823 -3.230 1.00 0.00 C ATOM 1783 CD GLU A 116 16.591 -0.240 -3.780 1.00 0.00 C ATOM 1784 OE1 GLU A 116 16.987 0.856 -3.329 1.00 0.00 O ATOM 1785 OE2 GLU A 116 17.204 -0.879 -4.660 1.00 0.00 O ATOM 0 H GLU A 116 12.428 2.193 -2.504 1.00 0.00 H new ATOM 0 HA GLU A 116 14.541 1.564 -2.842 1.00 0.00 H new ATOM 0 HB2 GLU A 116 13.184 -0.760 -3.519 1.00 0.00 H new ATOM 0 HB3 GLU A 116 14.116 -0.440 -4.968 1.00 0.00 H new ATOM 0 HG2 GLU A 116 15.255 -0.637 -2.157 1.00 0.00 H new ATOM 0 HG3 GLU A 116 15.313 -1.905 -3.365 1.00 0.00 H new ATOM 1792 N ASN A 117 13.656 1.751 -6.036 1.00 0.00 N ATOM 1793 CA ASN A 117 13.960 2.416 -7.297 1.00 0.00 C ATOM 1794 C ASN A 117 13.652 3.910 -7.220 1.00 0.00 C ATOM 1795 O ASN A 117 14.172 4.700 -8.007 1.00 0.00 O ATOM 1796 CB ASN A 117 13.164 1.779 -8.438 1.00 0.00 C ATOM 1797 CG ASN A 117 13.930 1.780 -9.746 1.00 0.00 C ATOM 1798 OD1 ASN A 117 13.633 2.560 -10.651 1.00 0.00 O ATOM 1799 ND2 ASN A 117 14.920 0.902 -9.852 1.00 0.00 N ATOM 0 H ASN A 117 12.899 1.070 -6.091 1.00 0.00 H new ATOM 0 HA ASN A 117 15.026 2.295 -7.491 1.00 0.00 H new ATOM 0 HB2 ASN A 117 12.908 0.754 -8.171 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.226 2.318 -8.569 1.00 0.00 H new ATOM 0 HD21 ASN A 117 15.470 0.855 -10.710 1.00 0.00 H new ATOM 0 HD22 ASN A 117 15.131 0.275 -9.076 1.00 0.00 H new ATOM 1806 N GLY A 118 12.803 4.291 -6.269 1.00 0.00 N ATOM 1807 CA GLY A 118 12.443 5.687 -6.113 1.00 0.00 C ATOM 1808 C GLY A 118 13.648 6.577 -5.880 1.00 0.00 C ATOM 1809 O GLY A 118 14.789 6.143 -6.036 1.00 0.00 O ATOM 0 H GLY A 118 12.359 3.657 -5.605 1.00 0.00 H new ATOM 0 HA2 GLY A 118 11.914 6.024 -7.005 1.00 0.00 H new ATOM 0 HA3 GLY A 118 11.753 5.789 -5.275 1.00 0.00 H new ATOM 1813 N ASN A 119 13.393 7.827 -5.505 1.00 0.00 N ATOM 1814 CA ASN A 119 14.462 8.783 -5.249 1.00 0.00 C ATOM 1815 C ASN A 119 15.257 8.392 -4.005 1.00 0.00 C ATOM 1816 O ASN A 119 14.805 7.576 -3.202 1.00 0.00 O ATOM 1817 CB ASN A 119 13.878 10.186 -5.074 1.00 0.00 C ATOM 1818 CG ASN A 119 13.661 10.893 -6.396 1.00 0.00 C ATOM 1819 OD1 ASN A 119 14.556 10.939 -7.242 1.00 0.00 O ATOM 1820 ND2 ASN A 119 12.470 11.449 -6.584 1.00 0.00 N ATOM 0 H ASN A 119 12.453 8.201 -5.372 1.00 0.00 H new ATOM 0 HA ASN A 119 15.138 8.777 -6.104 1.00 0.00 H new ATOM 0 HB2 ASN A 119 12.929 10.117 -4.542 1.00 0.00 H new ATOM 0 HB3 ASN A 119 14.549 10.780 -4.454 1.00 0.00 H new ATOM 0 HD21 ASN A 119 12.267 11.938 -7.456 1.00 0.00 H new ATOM 0 HD22 ASN A 119 11.758 11.387 -5.857 1.00 0.00 H new ATOM 1827 N PRO A 120 16.458 8.972 -3.828 1.00 0.00 N ATOM 1828 CA PRO A 120 17.316 8.684 -2.679 1.00 0.00 C ATOM 1829 C PRO A 120 16.963 9.526 -1.454 1.00 0.00 C ATOM 1830 O PRO A 120 17.824 9.831 -0.630 1.00 0.00 O ATOM 1831 CB PRO A 120 18.699 9.055 -3.202 1.00 0.00 C ATOM 1832 CG PRO A 120 18.447 10.186 -4.143 1.00 0.00 C ATOM 1833 CD PRO A 120 17.078 9.956 -4.738 1.00 0.00 C ATOM 0 HA PRO A 120 17.223 7.653 -2.339 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.364 9.353 -2.391 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.171 8.214 -3.709 1.00 0.00 H new ATOM 0 HG2 PRO A 120 18.486 11.141 -3.620 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.208 10.218 -4.923 1.00 0.00 H new ATOM 0 HD2 PRO A 120 16.501 10.880 -4.782 1.00 0.00 H new ATOM 0 HD3 PRO A 120 17.144 9.573 -5.756 1.00 0.00 H new ATOM 1841 N SER A 121 15.692 9.899 -1.345 1.00 0.00 N ATOM 1842 CA SER A 121 15.218 10.704 -0.229 1.00 0.00 C ATOM 1843 C SER A 121 13.699 10.725 -0.224 1.00 0.00 C ATOM 1844 O SER A 121 13.078 11.735 0.107 1.00 0.00 O ATOM 1845 CB SER A 121 15.758 12.132 -0.331 1.00 0.00 C ATOM 1846 OG SER A 121 16.819 12.344 0.584 1.00 0.00 O ATOM 0 H SER A 121 14.969 9.654 -2.022 1.00 0.00 H new ATOM 0 HA SER A 121 15.578 10.263 0.701 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.107 12.320 -1.346 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.955 12.842 -0.133 1.00 0.00 H new ATOM 0 HG SER A 121 17.483 11.630 0.486 1.00 0.00 H new ATOM 1852 N TYR A 122 13.107 9.606 -0.620 1.00 0.00 N ATOM 1853 CA TYR A 122 11.662 9.502 -0.688 1.00 0.00 C ATOM 1854 C TYR A 122 11.209 8.043 -0.659 1.00 0.00 C ATOM 1855 O TYR A 122 10.243 7.700 0.021 1.00 0.00 O ATOM 1856 CB TYR A 122 11.171 10.191 -1.958 1.00 0.00 C ATOM 1857 CG TYR A 122 10.416 11.475 -1.696 1.00 0.00 C ATOM 1858 CD1 TYR A 122 9.231 11.474 -0.970 1.00 0.00 C ATOM 1859 CD2 TYR A 122 10.892 12.689 -2.172 1.00 0.00 C ATOM 1860 CE1 TYR A 122 8.542 12.647 -0.730 1.00 0.00 C ATOM 1861 CE2 TYR A 122 10.210 13.866 -1.935 1.00 0.00 C ATOM 1862 CZ TYR A 122 9.035 13.841 -1.214 1.00 0.00 C ATOM 1863 OH TYR A 122 8.353 15.011 -0.976 1.00 0.00 O ATOM 0 H TYR A 122 13.607 8.761 -0.898 1.00 0.00 H new ATOM 0 HA TYR A 122 11.232 9.993 0.185 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.026 10.406 -2.599 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.526 9.505 -2.507 1.00 0.00 H new ATOM 0 HD1 TYR A 122 8.843 10.542 -0.587 1.00 0.00 H new ATOM 0 HD2 TYR A 122 11.812 12.713 -2.738 1.00 0.00 H new ATOM 0 HE1 TYR A 122 7.621 12.629 -0.166 1.00 0.00 H new ATOM 0 HE2 TYR A 122 10.595 14.802 -2.313 1.00 0.00 H new ATOM 0 HH TYR A 122 8.836 15.760 -1.384 1.00 0.00 H new ATOM 1873 N LYS A 123 11.917 7.191 -1.396 1.00 0.00 N ATOM 1874 CA LYS A 123 11.598 5.764 -1.451 1.00 0.00 C ATOM 1875 C LYS A 123 10.118 5.526 -1.759 1.00 0.00 C ATOM 1876 O LYS A 123 9.735 5.349 -2.914 1.00 0.00 O ATOM 1877 CB LYS A 123 11.980 5.096 -0.125 1.00 0.00 C ATOM 1878 CG LYS A 123 13.467 4.798 0.007 1.00 0.00 C ATOM 1879 CD LYS A 123 13.981 3.982 -1.170 1.00 0.00 C ATOM 1880 CE LYS A 123 14.941 4.785 -2.035 1.00 0.00 C ATOM 1881 NZ LYS A 123 14.383 5.039 -3.393 1.00 0.00 N ATOM 0 H LYS A 123 12.718 7.464 -1.966 1.00 0.00 H new ATOM 0 HA LYS A 123 12.176 5.320 -2.262 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.674 5.742 0.698 1.00 0.00 H new ATOM 0 HB3 LYS A 123 11.422 4.165 -0.024 1.00 0.00 H new ATOM 0 HG2 LYS A 123 14.022 5.734 0.072 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.649 4.255 0.934 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.484 3.088 -0.801 1.00 0.00 H new ATOM 0 HD3 LYS A 123 13.139 3.647 -1.776 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.160 5.736 -1.549 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.885 4.248 -2.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.993 4.594 -4.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 13.426 4.637 -3.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 14.340 6.064 -3.565 1.00 0.00 H new ATOM 1895 N TYR A 124 9.292 5.526 -0.718 1.00 0.00 N ATOM 1896 CA TYR A 124 7.854 5.306 -0.858 1.00 0.00 C ATOM 1897 C TYR A 124 7.217 6.210 -1.922 1.00 0.00 C ATOM 1898 O TYR A 124 6.057 6.008 -2.293 1.00 0.00 O ATOM 1899 CB TYR A 124 7.173 5.520 0.489 1.00 0.00 C ATOM 1900 CG TYR A 124 7.574 4.502 1.530 1.00 0.00 C ATOM 1901 CD1 TYR A 124 7.230 3.165 1.392 1.00 0.00 C ATOM 1902 CD2 TYR A 124 8.302 4.880 2.649 1.00 0.00 C ATOM 1903 CE1 TYR A 124 7.596 2.233 2.342 1.00 0.00 C ATOM 1904 CE2 TYR A 124 8.675 3.953 3.603 1.00 0.00 C ATOM 1905 CZ TYR A 124 8.318 2.632 3.446 1.00 0.00 C ATOM 1906 OH TYR A 124 8.687 1.705 4.392 1.00 0.00 O ATOM 0 H TYR A 124 9.597 5.678 0.243 1.00 0.00 H new ATOM 0 HA TYR A 124 7.711 4.278 -1.192 1.00 0.00 H new ATOM 0 HB2 TYR A 124 7.414 6.518 0.855 1.00 0.00 H new ATOM 0 HB3 TYR A 124 6.092 5.483 0.352 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.666 2.848 0.527 1.00 0.00 H new ATOM 0 HD2 TYR A 124 8.582 5.915 2.776 1.00 0.00 H new ATOM 0 HE1 TYR A 124 7.318 1.196 2.221 1.00 0.00 H new ATOM 0 HE2 TYR A 124 9.244 4.263 4.467 1.00 0.00 H new ATOM 0 HH TYR A 124 7.950 1.076 4.538 1.00 0.00 H new ATOM 1916 N PHE A 125 7.968 7.195 -2.411 1.00 0.00 N ATOM 1917 CA PHE A 125 7.465 8.102 -3.439 1.00 0.00 C ATOM 1918 C PHE A 125 7.423 7.395 -4.792 1.00 0.00 C ATOM 1919 O PHE A 125 8.459 6.982 -5.315 1.00 0.00 O ATOM 1920 CB PHE A 125 8.359 9.340 -3.526 1.00 0.00 C ATOM 1921 CG PHE A 125 7.765 10.470 -4.318 1.00 0.00 C ATOM 1922 CD1 PHE A 125 6.876 11.351 -3.729 1.00 0.00 C ATOM 1923 CD2 PHE A 125 8.100 10.652 -5.650 1.00 0.00 C ATOM 1924 CE1 PHE A 125 6.328 12.394 -4.452 1.00 0.00 C ATOM 1925 CE2 PHE A 125 7.557 11.693 -6.378 1.00 0.00 C ATOM 1926 CZ PHE A 125 6.670 12.565 -5.778 1.00 0.00 C ATOM 0 H PHE A 125 8.925 7.385 -2.112 1.00 0.00 H new ATOM 0 HA PHE A 125 6.454 8.410 -3.171 1.00 0.00 H new ATOM 0 HB2 PHE A 125 8.574 9.691 -2.517 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.311 9.057 -3.975 1.00 0.00 H new ATOM 0 HD1 PHE A 125 6.607 11.222 -2.691 1.00 0.00 H new ATOM 0 HD2 PHE A 125 8.793 9.973 -6.124 1.00 0.00 H new ATOM 0 HE1 PHE A 125 5.634 13.074 -3.980 1.00 0.00 H new ATOM 0 HE2 PHE A 125 7.826 11.825 -7.416 1.00 0.00 H new ATOM 0 HZ PHE A 125 6.245 13.379 -6.346 1.00 0.00 H new ATOM 1936 N TYR A 126 6.228 7.250 -5.353 1.00 0.00 N ATOM 1937 CA TYR A 126 6.069 6.583 -6.644 1.00 0.00 C ATOM 1938 C TYR A 126 5.543 7.545 -7.704 1.00 0.00 C ATOM 1939 O TYR A 126 4.336 7.745 -7.827 1.00 0.00 O ATOM 1940 CB TYR A 126 5.115 5.394 -6.521 1.00 0.00 C ATOM 1941 CG TYR A 126 5.710 4.190 -5.826 1.00 0.00 C ATOM 1942 CD1 TYR A 126 5.652 4.068 -4.446 1.00 0.00 C ATOM 1943 CD2 TYR A 126 6.313 3.168 -6.548 1.00 0.00 C ATOM 1944 CE1 TYR A 126 6.178 2.965 -3.802 1.00 0.00 C ATOM 1945 CE2 TYR A 126 6.838 2.059 -5.912 1.00 0.00 C ATOM 1946 CZ TYR A 126 6.768 1.963 -4.540 1.00 0.00 C ATOM 1947 OH TYR A 126 7.284 0.860 -3.902 1.00 0.00 O ATOM 0 H TYR A 126 5.358 7.583 -4.938 1.00 0.00 H new ATOM 0 HA TYR A 126 7.053 6.229 -6.951 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.226 5.711 -5.976 1.00 0.00 H new ATOM 0 HB3 TYR A 126 4.789 5.099 -7.519 1.00 0.00 H new ATOM 0 HD1 TYR A 126 5.187 4.850 -3.864 1.00 0.00 H new ATOM 0 HD2 TYR A 126 6.373 3.241 -7.624 1.00 0.00 H new ATOM 0 HE1 TYR A 126 6.127 2.889 -2.726 1.00 0.00 H new ATOM 0 HE2 TYR A 126 7.301 1.271 -6.488 1.00 0.00 H new ATOM 0 HH TYR A 126 7.592 0.211 -4.568 1.00 0.00 H new ATOM 1957 N VAL A 127 6.455 8.124 -8.473 1.00 0.00 N ATOM 1958 CA VAL A 127 6.083 9.054 -9.533 1.00 0.00 C ATOM 1959 C VAL A 127 6.395 8.453 -10.900 1.00 0.00 C ATOM 1960 O VAL A 127 7.100 9.053 -11.711 1.00 0.00 O ATOM 1961 CB VAL A 127 6.815 10.400 -9.377 1.00 0.00 C ATOM 1962 CG1 VAL A 127 8.323 10.196 -9.378 1.00 0.00 C ATOM 1963 CG2 VAL A 127 6.400 11.373 -10.470 1.00 0.00 C ATOM 0 H VAL A 127 7.459 7.967 -8.383 1.00 0.00 H new ATOM 0 HA VAL A 127 5.011 9.235 -9.455 1.00 0.00 H new ATOM 0 HB VAL A 127 6.531 10.831 -8.417 1.00 0.00 H new ATOM 0 HG11 VAL A 127 8.821 11.159 -9.267 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.603 9.545 -8.549 1.00 0.00 H new ATOM 0 HG13 VAL A 127 8.627 9.737 -10.319 1.00 0.00 H new ATOM 0 HG21 VAL A 127 6.930 12.316 -10.338 1.00 0.00 H new ATOM 0 HG22 VAL A 127 6.646 10.952 -11.445 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.326 11.550 -10.411 1.00 0.00 H new ATOM 1973 N SER A 128 5.862 7.256 -11.140 1.00 0.00 N ATOM 1974 CA SER A 128 6.068 6.542 -12.400 1.00 0.00 C ATOM 1975 C SER A 128 5.640 5.081 -12.263 1.00 0.00 C ATOM 1976 O SER A 128 6.336 4.273 -11.648 1.00 0.00 O ATOM 1977 CB SER A 128 7.537 6.614 -12.834 1.00 0.00 C ATOM 1978 OG SER A 128 8.402 6.251 -11.771 1.00 0.00 O ATOM 0 H SER A 128 5.278 6.755 -10.470 1.00 0.00 H new ATOM 0 HA SER A 128 5.455 7.022 -13.163 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.701 5.951 -13.683 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.771 7.625 -13.169 1.00 0.00 H new ATOM 0 HG SER A 128 9.333 6.304 -12.074 1.00 0.00 H new ATOM 1984 N ALA A 129 4.487 4.755 -12.840 1.00 0.00 N ATOM 1985 CA ALA A 129 3.936 3.400 -12.791 1.00 0.00 C ATOM 1986 C ALA A 129 4.996 2.327 -13.040 1.00 0.00 C ATOM 1987 O ALA A 129 4.858 1.196 -12.584 1.00 0.00 O ATOM 1988 CB ALA A 129 2.806 3.257 -13.797 1.00 0.00 C ATOM 0 H ALA A 129 3.908 5.419 -13.354 1.00 0.00 H new ATOM 0 HA ALA A 129 3.553 3.247 -11.782 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.404 2.245 -13.751 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.017 3.972 -13.562 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.185 3.452 -14.800 1.00 0.00 H new ATOM 1994 N GLU A 130 6.046 2.674 -13.777 1.00 0.00 N ATOM 1995 CA GLU A 130 7.104 1.716 -14.082 1.00 0.00 C ATOM 1996 C GLU A 130 7.722 1.134 -12.809 1.00 0.00 C ATOM 1997 O GLU A 130 7.676 -0.074 -12.581 1.00 0.00 O ATOM 1998 CB GLU A 130 8.192 2.365 -14.944 1.00 0.00 C ATOM 1999 CG GLU A 130 8.547 3.781 -14.521 1.00 0.00 C ATOM 2000 CD GLU A 130 10.010 3.927 -14.144 1.00 0.00 C ATOM 2001 OE1 GLU A 130 10.833 4.184 -15.046 1.00 0.00 O ATOM 2002 OE2 GLU A 130 10.329 3.782 -12.944 1.00 0.00 O ATOM 0 H GLU A 130 6.187 3.604 -14.172 1.00 0.00 H new ATOM 0 HA GLU A 130 6.649 0.898 -14.641 1.00 0.00 H new ATOM 0 HB2 GLU A 130 9.090 1.748 -14.904 1.00 0.00 H new ATOM 0 HB3 GLU A 130 7.860 2.378 -15.982 1.00 0.00 H new ATOM 0 HG2 GLU A 130 8.315 4.468 -15.334 1.00 0.00 H new ATOM 0 HG3 GLU A 130 7.926 4.069 -13.673 1.00 0.00 H new ATOM 2009 N GLN A 131 8.310 1.987 -11.983 1.00 0.00 N ATOM 2010 CA GLN A 131 8.938 1.520 -10.755 1.00 0.00 C ATOM 2011 C GLN A 131 7.923 0.934 -9.784 1.00 0.00 C ATOM 2012 O GLN A 131 8.277 0.121 -8.930 1.00 0.00 O ATOM 2013 CB GLN A 131 9.705 2.640 -10.068 1.00 0.00 C ATOM 2014 CG GLN A 131 8.858 3.862 -9.754 1.00 0.00 C ATOM 2015 CD GLN A 131 9.687 5.039 -9.279 1.00 0.00 C ATOM 2016 OE1 GLN A 131 10.918 5.005 -9.325 1.00 0.00 O ATOM 2017 NE2 GLN A 131 9.016 6.088 -8.820 1.00 0.00 N ATOM 0 H GLN A 131 8.366 2.994 -12.137 1.00 0.00 H new ATOM 0 HA GLN A 131 9.634 0.733 -11.044 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.133 2.259 -9.141 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.538 2.941 -10.704 1.00 0.00 H new ATOM 0 HG2 GLN A 131 8.300 4.151 -10.644 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.126 3.605 -8.988 1.00 0.00 H new ATOM 0 HE21 GLN A 131 7.996 6.072 -8.800 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.520 6.910 -8.487 1.00 0.00 H new ATOM 2026 N VAL A 132 6.666 1.342 -9.903 1.00 0.00 N ATOM 2027 CA VAL A 132 5.637 0.831 -9.012 1.00 0.00 C ATOM 2028 C VAL A 132 5.505 -0.677 -9.175 1.00 0.00 C ATOM 2029 O VAL A 132 5.300 -1.395 -8.202 1.00 0.00 O ATOM 2030 CB VAL A 132 4.262 1.520 -9.216 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.428 2.984 -9.592 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.406 0.794 -10.250 1.00 0.00 C ATOM 0 H VAL A 132 6.339 2.015 -10.597 1.00 0.00 H new ATOM 0 HA VAL A 132 5.954 1.064 -7.995 1.00 0.00 H new ATOM 0 HB VAL A 132 3.739 1.468 -8.261 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.447 3.438 -9.728 1.00 0.00 H new ATOM 0 HG12 VAL A 132 4.962 3.505 -8.798 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.994 3.059 -10.520 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.453 1.311 -10.361 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.925 0.782 -11.208 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.228 -0.230 -9.921 1.00 0.00 H new ATOM 2042 N VAL A 133 5.643 -1.151 -10.411 1.00 0.00 N ATOM 2043 CA VAL A 133 5.550 -2.576 -10.685 1.00 0.00 C ATOM 2044 C VAL A 133 6.829 -3.286 -10.274 1.00 0.00 C ATOM 2045 O VAL A 133 6.804 -4.474 -9.975 1.00 0.00 O ATOM 2046 CB VAL A 133 5.278 -2.874 -12.172 1.00 0.00 C ATOM 2047 CG1 VAL A 133 6.397 -2.323 -13.036 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.121 -4.372 -12.395 1.00 0.00 C ATOM 0 H VAL A 133 5.818 -0.571 -11.231 1.00 0.00 H new ATOM 0 HA VAL A 133 4.707 -2.945 -10.100 1.00 0.00 H new ATOM 0 HB VAL A 133 4.347 -2.384 -12.458 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.189 -2.542 -14.083 1.00 0.00 H new ATOM 0 HG12 VAL A 133 6.466 -1.244 -12.898 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.341 -2.787 -12.749 1.00 0.00 H new ATOM 0 HG21 VAL A 133 4.929 -4.565 -13.451 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.035 -4.883 -12.093 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.286 -4.743 -11.801 1.00 0.00 H new ATOM 2058 N GLN A 134 7.950 -2.563 -10.258 1.00 0.00 N ATOM 2059 CA GLN A 134 9.215 -3.166 -9.872 1.00 0.00 C ATOM 2060 C GLN A 134 9.225 -3.403 -8.374 1.00 0.00 C ATOM 2061 O GLN A 134 9.536 -4.496 -7.901 1.00 0.00 O ATOM 2062 CB GLN A 134 10.383 -2.270 -10.267 1.00 0.00 C ATOM 2063 CG GLN A 134 10.210 -1.583 -11.610 1.00 0.00 C ATOM 2064 CD GLN A 134 10.812 -2.373 -12.755 1.00 0.00 C ATOM 2065 OE1 GLN A 134 10.145 -3.207 -13.369 1.00 0.00 O ATOM 2066 NE2 GLN A 134 12.081 -2.116 -13.050 1.00 0.00 N ATOM 0 H GLN A 134 8.003 -1.575 -10.505 1.00 0.00 H new ATOM 0 HA GLN A 134 9.324 -4.117 -10.392 1.00 0.00 H new ATOM 0 HB2 GLN A 134 10.521 -1.510 -9.497 1.00 0.00 H new ATOM 0 HB3 GLN A 134 11.294 -2.868 -10.291 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.148 -1.429 -11.800 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.674 -0.597 -11.571 1.00 0.00 H new ATOM 0 HE21 GLN A 134 12.597 -1.417 -12.516 1.00 0.00 H new ATOM 0 HE22 GLN A 134 12.539 -2.618 -13.811 1.00 0.00 H new ATOM 2075 N GLY A 135 8.847 -2.372 -7.633 1.00 0.00 N ATOM 2076 CA GLY A 135 8.779 -2.484 -6.196 1.00 0.00 C ATOM 2077 C GLY A 135 7.580 -3.306 -5.772 1.00 0.00 C ATOM 2078 O GLY A 135 7.493 -3.748 -4.627 1.00 0.00 O ATOM 0 H GLY A 135 8.586 -1.459 -8.005 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.692 -2.945 -5.820 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.718 -1.490 -5.753 1.00 0.00 H new ATOM 2082 N MET A 136 6.654 -3.516 -6.710 1.00 0.00 N ATOM 2083 CA MET A 136 5.453 -4.298 -6.431 1.00 0.00 C ATOM 2084 C MET A 136 5.645 -5.745 -6.860 1.00 0.00 C ATOM 2085 O MET A 136 5.067 -6.659 -6.279 1.00 0.00 O ATOM 2086 CB MET A 136 4.242 -3.701 -7.148 1.00 0.00 C ATOM 2087 CG MET A 136 3.632 -2.508 -6.426 1.00 0.00 C ATOM 2088 SD MET A 136 2.505 -1.546 -7.462 1.00 0.00 S ATOM 2089 CE MET A 136 1.942 -2.775 -8.640 1.00 0.00 C ATOM 0 H MET A 136 6.714 -3.157 -7.663 1.00 0.00 H new ATOM 0 HA MET A 136 5.274 -4.270 -5.356 1.00 0.00 H new ATOM 0 HB2 MET A 136 4.539 -3.395 -8.151 1.00 0.00 H new ATOM 0 HB3 MET A 136 3.481 -4.473 -7.263 1.00 0.00 H new ATOM 0 HG2 MET A 136 3.094 -2.861 -5.546 1.00 0.00 H new ATOM 0 HG3 MET A 136 4.432 -1.859 -6.071 1.00 0.00 H new ATOM 0 HE1 MET A 136 1.201 -2.330 -9.304 1.00 0.00 H new ATOM 0 HE2 MET A 136 2.789 -3.131 -9.227 1.00 0.00 H new ATOM 0 HE3 MET A 136 1.493 -3.612 -8.106 1.00 0.00 H new ATOM 2099 N LYS A 137 6.466 -5.939 -7.879 1.00 0.00 N ATOM 2100 CA LYS A 137 6.753 -7.267 -8.403 1.00 0.00 C ATOM 2101 C LYS A 137 7.840 -7.958 -7.583 1.00 0.00 C ATOM 2102 O LYS A 137 8.050 -9.165 -7.702 1.00 0.00 O ATOM 2103 CB LYS A 137 7.139 -7.188 -9.884 1.00 0.00 C ATOM 2104 CG LYS A 137 8.478 -6.533 -10.163 1.00 0.00 C ATOM 2105 CD LYS A 137 8.556 -6.033 -11.603 1.00 0.00 C ATOM 2106 CE LYS A 137 8.058 -7.076 -12.596 1.00 0.00 C ATOM 2107 NZ LYS A 137 6.689 -6.778 -13.098 1.00 0.00 N ATOM 0 H LYS A 137 6.951 -5.185 -8.365 1.00 0.00 H new ATOM 0 HA LYS A 137 5.849 -7.870 -8.321 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.153 -8.198 -10.295 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.364 -6.637 -10.417 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.629 -5.700 -9.477 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.281 -7.247 -9.979 1.00 0.00 H new ATOM 0 HD2 LYS A 137 7.963 -5.124 -11.704 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.587 -5.769 -11.840 1.00 0.00 H new ATOM 0 HE2 LYS A 137 8.747 -7.128 -13.439 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.061 -8.057 -12.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 6.437 -7.458 -13.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 6.008 -6.854 -12.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 6.664 -5.813 -13.486 1.00 0.00 H new ATOM 2121 N GLU A 138 8.521 -7.182 -6.744 1.00 0.00 N ATOM 2122 CA GLU A 138 9.580 -7.707 -5.892 1.00 0.00 C ATOM 2123 C GLU A 138 9.059 -7.921 -4.480 1.00 0.00 C ATOM 2124 O GLU A 138 9.077 -9.036 -3.956 1.00 0.00 O ATOM 2125 CB GLU A 138 10.770 -6.746 -5.865 1.00 0.00 C ATOM 2126 CG GLU A 138 12.042 -7.334 -6.454 1.00 0.00 C ATOM 2127 CD GLU A 138 13.247 -7.133 -5.556 1.00 0.00 C ATOM 2128 OE1 GLU A 138 13.201 -7.583 -4.392 1.00 0.00 O ATOM 2129 OE2 GLU A 138 14.234 -6.521 -6.015 1.00 0.00 O ATOM 0 H GLU A 138 8.355 -6.181 -6.637 1.00 0.00 H new ATOM 0 HA GLU A 138 9.909 -8.663 -6.300 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.509 -5.842 -6.416 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.961 -6.447 -4.834 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.898 -8.400 -6.629 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.235 -6.875 -7.423 1.00 0.00 H new ATOM 2136 N ALA A 139 8.586 -6.840 -3.873 1.00 0.00 N ATOM 2137 CA ALA A 139 8.045 -6.893 -2.524 1.00 0.00 C ATOM 2138 C ALA A 139 6.945 -7.939 -2.429 1.00 0.00 C ATOM 2139 O ALA A 139 6.773 -8.589 -1.397 1.00 0.00 O ATOM 2140 CB ALA A 139 7.504 -5.531 -2.118 1.00 0.00 C ATOM 0 H ALA A 139 8.567 -5.913 -4.297 1.00 0.00 H new ATOM 0 HA ALA A 139 8.850 -7.171 -1.843 1.00 0.00 H new ATOM 0 HB1 ALA A 139 7.102 -5.586 -1.106 1.00 0.00 H new ATOM 0 HB2 ALA A 139 8.308 -4.796 -2.150 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.713 -5.234 -2.807 1.00 0.00 H new ATOM 2146 N GLN A 140 6.200 -8.092 -3.517 1.00 0.00 N ATOM 2147 CA GLN A 140 5.111 -9.048 -3.570 1.00 0.00 C ATOM 2148 C GLN A 140 5.581 -10.464 -3.239 1.00 0.00 C ATOM 2149 O GLN A 140 4.771 -11.328 -2.909 1.00 0.00 O ATOM 2150 CB GLN A 140 4.465 -9.014 -4.950 1.00 0.00 C ATOM 2151 CG GLN A 140 5.421 -9.338 -6.083 1.00 0.00 C ATOM 2152 CD GLN A 140 5.603 -10.828 -6.281 1.00 0.00 C ATOM 2153 OE1 GLN A 140 4.632 -11.569 -6.439 1.00 0.00 O ATOM 2154 NE2 GLN A 140 6.850 -11.279 -6.273 1.00 0.00 N ATOM 0 H GLN A 140 6.335 -7.561 -4.377 1.00 0.00 H new ATOM 0 HA GLN A 140 4.377 -8.765 -2.816 1.00 0.00 H new ATOM 0 HB2 GLN A 140 3.638 -9.724 -4.971 1.00 0.00 H new ATOM 0 HB3 GLN A 140 4.040 -8.024 -5.118 1.00 0.00 H new ATOM 0 HG2 GLN A 140 5.048 -8.895 -7.006 1.00 0.00 H new ATOM 0 HG3 GLN A 140 6.389 -8.881 -5.879 1.00 0.00 H new ATOM 0 HE21 GLN A 140 7.626 -10.631 -6.139 1.00 0.00 H new ATOM 0 HE22 GLN A 140 7.033 -12.274 -6.401 1.00 0.00 H new ATOM 2163 N GLU A 141 6.888 -10.700 -3.332 1.00 0.00 N ATOM 2164 CA GLU A 141 7.451 -12.018 -3.044 1.00 0.00 C ATOM 2165 C GLU A 141 7.852 -12.142 -1.573 1.00 0.00 C ATOM 2166 O GLU A 141 7.894 -13.243 -1.025 1.00 0.00 O ATOM 2167 CB GLU A 141 8.664 -12.280 -3.943 1.00 0.00 C ATOM 2168 CG GLU A 141 9.523 -13.452 -3.494 1.00 0.00 C ATOM 2169 CD GLU A 141 10.436 -13.962 -4.590 1.00 0.00 C ATOM 2170 OE1 GLU A 141 11.554 -13.423 -4.733 1.00 0.00 O ATOM 2171 OE2 GLU A 141 10.034 -14.903 -5.307 1.00 0.00 O ATOM 0 H GLU A 141 7.576 -9.998 -3.604 1.00 0.00 H new ATOM 0 HA GLU A 141 6.683 -12.764 -3.248 1.00 0.00 H new ATOM 0 HB2 GLU A 141 8.317 -12.465 -4.960 1.00 0.00 H new ATOM 0 HB3 GLU A 141 9.281 -11.382 -3.975 1.00 0.00 H new ATOM 0 HG2 GLU A 141 10.125 -13.149 -2.637 1.00 0.00 H new ATOM 0 HG3 GLU A 141 8.877 -14.263 -3.158 1.00 0.00 H new ATOM 2178 N ARG A 142 8.163 -11.014 -0.944 1.00 0.00 N ATOM 2179 CA ARG A 142 8.577 -11.010 0.456 1.00 0.00 C ATOM 2180 C ARG A 142 7.380 -10.965 1.403 1.00 0.00 C ATOM 2181 O ARG A 142 7.270 -11.782 2.316 1.00 0.00 O ATOM 2182 CB ARG A 142 9.496 -9.817 0.731 1.00 0.00 C ATOM 2183 CG ARG A 142 10.596 -9.641 -0.304 1.00 0.00 C ATOM 2184 CD ARG A 142 10.868 -8.171 -0.580 1.00 0.00 C ATOM 2185 NE ARG A 142 11.992 -7.666 0.206 1.00 0.00 N ATOM 2186 CZ ARG A 142 13.269 -7.908 -0.082 1.00 0.00 C ATOM 2187 NH1 ARG A 142 13.590 -8.650 -1.134 1.00 0.00 N ATOM 2188 NH2 ARG A 142 14.228 -7.406 0.684 1.00 0.00 N ATOM 0 H ARG A 142 8.137 -10.092 -1.379 1.00 0.00 H new ATOM 0 HA ARG A 142 9.116 -11.940 0.640 1.00 0.00 H new ATOM 0 HB2 ARG A 142 8.895 -8.908 0.768 1.00 0.00 H new ATOM 0 HB3 ARG A 142 9.951 -9.939 1.714 1.00 0.00 H new ATOM 0 HG2 ARG A 142 11.509 -10.122 0.048 1.00 0.00 H new ATOM 0 HG3 ARG A 142 10.310 -10.140 -1.230 1.00 0.00 H new ATOM 0 HD2 ARG A 142 11.077 -8.034 -1.641 1.00 0.00 H new ATOM 0 HD3 ARG A 142 9.975 -7.588 -0.353 1.00 0.00 H new ATOM 0 HE ARG A 142 11.786 -7.094 1.025 1.00 0.00 H new ATOM 0 HH11 ARG A 142 12.857 -9.038 -1.727 1.00 0.00 H new ATOM 0 HH12 ARG A 142 14.570 -8.832 -1.350 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.987 -6.835 1.494 1.00 0.00 H new ATOM 0 HH22 ARG A 142 15.206 -7.591 0.463 1.00 0.00 H new ATOM 2202 N LEU A 143 6.494 -9.998 1.188 1.00 0.00 N ATOM 2203 CA LEU A 143 5.314 -9.837 2.034 1.00 0.00 C ATOM 2204 C LEU A 143 4.380 -11.046 1.957 1.00 0.00 C ATOM 2205 O LEU A 143 3.486 -11.194 2.790 1.00 0.00 O ATOM 2206 CB LEU A 143 4.550 -8.567 1.645 1.00 0.00 C ATOM 2207 CG LEU A 143 5.269 -7.247 1.934 1.00 0.00 C ATOM 2208 CD1 LEU A 143 5.997 -7.300 3.270 1.00 0.00 C ATOM 2209 CD2 LEU A 143 6.233 -6.915 0.807 1.00 0.00 C ATOM 0 H LEU A 143 6.570 -9.313 0.436 1.00 0.00 H new ATOM 0 HA LEU A 143 5.665 -9.753 3.063 1.00 0.00 H new ATOM 0 HB2 LEU A 143 4.326 -8.612 0.579 1.00 0.00 H new ATOM 0 HB3 LEU A 143 3.596 -8.563 2.172 1.00 0.00 H new ATOM 0 HG LEU A 143 4.521 -6.457 1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 143 6.499 -6.349 3.449 1.00 0.00 H new ATOM 0 HD12 LEU A 143 5.279 -7.487 4.068 1.00 0.00 H new ATOM 0 HD13 LEU A 143 6.735 -8.102 3.250 1.00 0.00 H new ATOM 0 HD21 LEU A 143 6.738 -5.974 1.025 1.00 0.00 H new ATOM 0 HD22 LEU A 143 6.973 -7.710 0.715 1.00 0.00 H new ATOM 0 HD23 LEU A 143 5.681 -6.822 -0.128 1.00 0.00 H new ATOM 2221 N THR A 144 4.582 -11.902 0.956 1.00 0.00 N ATOM 2222 CA THR A 144 3.749 -13.088 0.775 1.00 0.00 C ATOM 2223 C THR A 144 3.452 -13.787 2.102 1.00 0.00 C ATOM 2224 O THR A 144 2.375 -13.616 2.674 1.00 0.00 O ATOM 2225 CB THR A 144 4.430 -14.062 -0.181 1.00 0.00 C ATOM 2226 OG1 THR A 144 5.805 -14.204 0.134 1.00 0.00 O ATOM 2227 CG2 THR A 144 4.328 -13.647 -1.632 1.00 0.00 C ATOM 0 H THR A 144 5.317 -11.795 0.257 1.00 0.00 H new ATOM 0 HA THR A 144 2.799 -12.760 0.353 1.00 0.00 H new ATOM 0 HB THR A 144 3.900 -15.006 -0.053 1.00 0.00 H new ATOM 0 HG1 THR A 144 6.347 -13.873 -0.612 1.00 0.00 H new ATOM 0 HG21 THR A 144 4.833 -14.383 -2.257 1.00 0.00 H new ATOM 0 HG22 THR A 144 3.279 -13.585 -1.920 1.00 0.00 H new ATOM 0 HG23 THR A 144 4.799 -12.673 -1.766 1.00 0.00 H new