USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=29 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 :FLIP amide:sc= -2.25! F(o=-7,f=-6.2!) USER MOD Set 1.2: A 134 GLN : amide:sc= -3.97! C(o=-6.2!,f=-13!) USER MOD Set 2.1: A 115 ASN :FLIP amide:sc= -7.98! C(o=-12!,f=-11!) USER MOD Set 2.2: A 131 GLN :FLIP amide:sc= -3.2! X(o=-11,f=-11!) USER MOD Set 3.1: A 47 HIS : no HE2:sc= -5.05! C(o=-7.3!,f=-11!) USER MOD Set 3.2: A 78 ASN : amide:sc= -2.26 X(o=-7.3,f=-7.8!) USER MOD Set 4.1: A 24 HIS : no HD1:sc= -15.8! C(o=-20!,f=-22!) USER MOD Set 4.2: A 76 MET CE :methyl 144:sc= -3.43 (180deg=-5.1!) USER MOD Set 4.3: A 136 MET CE :methyl 154:sc= -0.693 (180deg=-1.42) USER MOD Set 5.1: A 60 LYS NZ :NH3+ -122:sc= -2.23! (180deg=-6.21!) USER MOD Set 5.2: A 128 SER OG : rot 180:sc= 0.00496 USER MOD Single : A 22 HIS :FLIP no HE2:sc=-0.00745 F(o=-0.65,f=-0.0074) USER MOD Single : A 27 THR OG1 : rot 95:sc= -0.168 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 180:sc= 0 USER MOD Single : A 43 MET CE :methyl -162:sc= -13! (180deg=-13.4!) USER MOD Single : A 48 LYS NZ :NH3+ -107:sc= -2.42 (180deg=-9!) USER MOD Single : A 49 SER OG : rot -89:sc= 1.25 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 158:sc= -1.03 (180deg=-2.29!) USER MOD Single : A 64 SER OG : rot 160:sc= -1.72! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.124 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -80:sc= -2.63! USER MOD Single : A 72 HIS : no HD1:sc= -0.315 K(o=-0.31,f=-0.99) USER MOD Single : A 73 ASN : amide:sc= -0.89 X(o=-0.89,f=-0.84) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= -0.282 USER MOD Single : A 96 TYR OH : rot -104:sc= -3.28! USER MOD Single : A 106 SER OG : rot -55:sc= 0.456 USER MOD Single : A 108 LYS NZ :NH3+ 167:sc= -0.254 (180deg=-0.604) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 ASN : amide:sc= -3.77! C(o=-3.8!,f=-6.2!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -110:sc= 1.09 (180deg=-2.25!) USER MOD Single : A 124 TYR OH : rot 180:sc= -1.94! USER MOD Single : A 126 TYR OH : rot 91:sc= 0.728 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 GLN : amide:sc=-0.000123 X(o=-0.00012,f=0) USER MOD Single : A 144 THR OG1 : rot -125:sc= 0.716 USER MOD ----------------------------------------------------------------- ATOM 308 N HIS A 22 -9.340 -0.712 -9.512 1.00 0.00 N ATOM 309 CA HIS A 22 -9.143 -2.075 -9.009 1.00 0.00 C ATOM 310 C HIS A 22 -7.672 -2.514 -8.982 1.00 0.00 C ATOM 311 O HIS A 22 -7.260 -3.341 -9.791 1.00 0.00 O ATOM 312 CB HIS A 22 -9.954 -3.056 -9.859 1.00 0.00 C ATOM 313 CG HIS A 22 -10.226 -4.359 -9.174 1.00 0.00 C ATOM 314 ND1 HIS A 22 -9.575 -5.546 -9.235 1.00 0.00 N flip ATOM 315 CD2 HIS A 22 -11.282 -4.547 -8.308 1.00 0.00 C flip ATOM 316 CE1 HIS A 22 -10.244 -6.418 -8.413 1.00 0.00 C flip ATOM 317 NE2 HIS A 22 -11.268 -5.792 -7.865 1.00 0.00 N flip ATOM 0 HA HIS A 22 -9.488 -2.078 -7.975 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -10.903 -2.592 -10.129 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -9.418 -3.248 -10.788 1.00 0.00 H new ATOM 0 HD1 HIS A 22 -8.743 -5.753 -9.788 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -12.007 -3.795 -8.034 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -9.976 -7.450 -8.242 1.00 0.00 H new ATOM 326 N ILE A 23 -6.904 -1.993 -8.019 1.00 0.00 N ATOM 327 CA ILE A 23 -5.490 -2.366 -7.855 1.00 0.00 C ATOM 328 C ILE A 23 -4.969 -1.933 -6.475 1.00 0.00 C ATOM 329 O ILE A 23 -5.088 -2.671 -5.489 1.00 0.00 O ATOM 330 CB ILE A 23 -4.566 -1.760 -8.945 1.00 0.00 C ATOM 331 CG1 ILE A 23 -4.755 -2.453 -10.295 1.00 0.00 C ATOM 332 CG2 ILE A 23 -3.108 -1.859 -8.511 1.00 0.00 C ATOM 333 CD1 ILE A 23 -5.218 -1.515 -11.385 1.00 0.00 C ATOM 0 H ILE A 23 -7.237 -1.310 -7.339 1.00 0.00 H new ATOM 0 HA ILE A 23 -5.459 -3.451 -7.953 1.00 0.00 H new ATOM 0 HB ILE A 23 -4.840 -0.712 -9.065 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -3.813 -2.912 -10.595 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.481 -3.258 -10.184 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -2.469 -1.431 -9.283 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.968 -1.311 -7.579 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.844 -2.906 -8.360 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.333 -2.069 -12.317 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.175 -1.075 -11.104 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.481 -0.724 -11.522 1.00 0.00 H new ATOM 345 N HIS A 24 -4.387 -0.727 -6.409 1.00 0.00 N ATOM 346 CA HIS A 24 -3.848 -0.207 -5.162 1.00 0.00 C ATOM 347 C HIS A 24 -4.936 0.482 -4.357 1.00 0.00 C ATOM 348 O HIS A 24 -4.701 1.502 -3.707 1.00 0.00 O ATOM 349 CB HIS A 24 -2.693 0.771 -5.427 1.00 0.00 C ATOM 350 CG HIS A 24 -1.411 0.124 -5.867 1.00 0.00 C ATOM 351 ND1 HIS A 24 -0.521 -0.469 -4.995 1.00 0.00 N ATOM 352 CD2 HIS A 24 -0.866 -0.008 -7.099 1.00 0.00 C ATOM 353 CE1 HIS A 24 0.513 -0.936 -5.673 1.00 0.00 C ATOM 354 NE2 HIS A 24 0.326 -0.669 -6.951 1.00 0.00 N ATOM 0 H HIS A 24 -4.282 -0.101 -7.207 1.00 0.00 H new ATOM 0 HA HIS A 24 -3.463 -1.049 -4.588 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.006 1.483 -6.191 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.503 1.342 -4.518 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -1.292 0.343 -8.028 1.00 0.00 H new ATOM 0 HE1 HIS A 24 1.365 -1.449 -5.252 1.00 0.00 H new ATOM 0 HE2 HIS A 24 0.965 -0.915 -7.707 1.00 0.00 H new ATOM 363 N TRP A 25 -6.134 -0.073 -4.431 1.00 0.00 N ATOM 364 CA TRP A 25 -7.288 0.484 -3.745 1.00 0.00 C ATOM 365 C TRP A 25 -8.362 -0.573 -3.552 1.00 0.00 C ATOM 366 O TRP A 25 -9.509 -0.255 -3.244 1.00 0.00 O ATOM 367 CB TRP A 25 -7.843 1.628 -4.574 1.00 0.00 C ATOM 368 CG TRP A 25 -7.408 1.539 -6.001 1.00 0.00 C ATOM 369 CD1 TRP A 25 -8.047 0.880 -7.002 1.00 0.00 C ATOM 370 CD2 TRP A 25 -6.219 2.094 -6.580 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.329 0.986 -8.163 1.00 0.00 N ATOM 372 CE2 TRP A 25 -6.211 1.732 -7.935 1.00 0.00 C ATOM 373 CE3 TRP A 25 -5.167 2.864 -6.088 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -5.192 2.112 -8.802 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -4.160 3.242 -6.943 1.00 0.00 C ATOM 376 CH2 TRP A 25 -4.175 2.868 -8.291 1.00 0.00 C ATOM 0 H TRP A 25 -6.334 -0.918 -4.966 1.00 0.00 H new ATOM 0 HA TRP A 25 -6.981 0.843 -2.763 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.932 1.618 -4.524 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.513 2.577 -4.152 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -8.983 0.351 -6.898 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -7.590 0.572 -9.058 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.143 3.159 -5.049 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -5.204 1.820 -9.842 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -3.342 3.839 -6.568 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -3.370 3.182 -8.938 1.00 0.00 H new ATOM 387 N ARG A 26 -7.985 -1.834 -3.743 1.00 0.00 N ATOM 388 CA ARG A 26 -8.921 -2.940 -3.598 1.00 0.00 C ATOM 389 C ARG A 26 -9.760 -2.780 -2.328 1.00 0.00 C ATOM 390 O ARG A 26 -10.897 -3.245 -2.262 1.00 0.00 O ATOM 391 CB ARG A 26 -8.171 -4.274 -3.571 1.00 0.00 C ATOM 392 CG ARG A 26 -8.616 -5.243 -4.655 1.00 0.00 C ATOM 393 CD ARG A 26 -9.942 -5.900 -4.305 1.00 0.00 C ATOM 394 NE ARG A 26 -10.173 -7.112 -5.089 1.00 0.00 N ATOM 395 CZ ARG A 26 -11.370 -7.673 -5.247 1.00 0.00 C ATOM 396 NH1 ARG A 26 -12.444 -7.137 -4.681 1.00 0.00 N ATOM 397 NH2 ARG A 26 -11.492 -8.775 -5.976 1.00 0.00 N ATOM 0 H ARG A 26 -7.038 -2.113 -3.998 1.00 0.00 H new ATOM 0 HA ARG A 26 -9.592 -2.931 -4.457 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -7.103 -4.084 -3.681 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -8.313 -4.742 -2.597 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -8.711 -4.712 -5.602 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -7.854 -6.010 -4.794 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -9.956 -6.146 -3.243 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -10.754 -5.194 -4.480 1.00 0.00 H new ATOM 0 HE ARG A 26 -9.372 -7.553 -5.541 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -12.356 -6.289 -4.120 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -13.358 -7.573 -4.807 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -10.670 -9.190 -6.414 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -12.408 -9.207 -6.098 1.00 0.00 H new ATOM 411 N THR A 27 -9.182 -2.104 -1.327 1.00 0.00 N ATOM 412 CA THR A 27 -9.855 -1.849 -0.051 1.00 0.00 C ATOM 413 C THR A 27 -9.622 -2.983 0.939 1.00 0.00 C ATOM 414 O THR A 27 -9.502 -4.146 0.556 1.00 0.00 O ATOM 415 CB THR A 27 -11.359 -1.628 -0.250 1.00 0.00 C ATOM 416 OG1 THR A 27 -11.610 -0.947 -1.467 1.00 0.00 O ATOM 417 CG2 THR A 27 -11.999 -0.830 0.863 1.00 0.00 C ATOM 0 H THR A 27 -8.238 -1.721 -1.380 1.00 0.00 H new ATOM 0 HA THR A 27 -9.421 -0.938 0.362 1.00 0.00 H new ATOM 0 HB THR A 27 -11.798 -2.626 -0.258 1.00 0.00 H new ATOM 0 HG1 THR A 27 -11.798 -1.599 -2.174 1.00 0.00 H new ATOM 0 HG21 THR A 27 -13.063 -0.710 0.660 1.00 0.00 H new ATOM 0 HG22 THR A 27 -11.867 -1.355 1.809 1.00 0.00 H new ATOM 0 HG23 THR A 27 -11.529 0.151 0.924 1.00 0.00 H new ATOM 425 N LEU A 28 -9.561 -2.628 2.220 1.00 0.00 N ATOM 426 CA LEU A 28 -9.340 -3.605 3.280 1.00 0.00 C ATOM 427 C LEU A 28 -10.523 -4.560 3.400 1.00 0.00 C ATOM 428 O LEU A 28 -10.372 -5.693 3.856 1.00 0.00 O ATOM 429 CB LEU A 28 -9.102 -2.890 4.614 1.00 0.00 C ATOM 430 CG LEU A 28 -7.842 -3.327 5.365 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.083 -2.117 5.888 1.00 0.00 C ATOM 432 CD2 LEU A 28 -8.199 -4.268 6.506 1.00 0.00 C ATOM 0 H LEU A 28 -9.662 -1.668 2.549 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.456 -4.190 3.025 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.043 -1.817 4.429 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.966 -3.056 5.257 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.196 -3.861 4.668 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.191 -2.449 6.419 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -6.792 -1.481 5.052 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.721 -1.553 6.568 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.290 -4.568 7.028 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.866 -3.759 7.202 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.696 -5.152 6.107 1.00 0.00 H new ATOM 444 N GLU A 29 -11.703 -4.101 2.988 1.00 0.00 N ATOM 445 CA GLU A 29 -12.905 -4.925 3.051 1.00 0.00 C ATOM 446 C GLU A 29 -12.702 -6.230 2.286 1.00 0.00 C ATOM 447 O GLU A 29 -12.501 -7.288 2.883 1.00 0.00 O ATOM 448 CB GLU A 29 -14.104 -4.159 2.480 1.00 0.00 C ATOM 449 CG GLU A 29 -15.190 -3.882 3.506 1.00 0.00 C ATOM 450 CD GLU A 29 -16.498 -4.575 3.174 1.00 0.00 C ATOM 451 OE1 GLU A 29 -17.294 -4.002 2.400 1.00 0.00 O ATOM 452 OE2 GLU A 29 -16.725 -5.691 3.687 1.00 0.00 O ATOM 0 H GLU A 29 -11.851 -3.166 2.608 1.00 0.00 H new ATOM 0 HA GLU A 29 -13.104 -5.164 4.096 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -13.757 -3.213 2.066 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.531 -4.730 1.656 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -14.849 -4.210 4.488 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -15.359 -2.807 3.570 1.00 0.00 H new ATOM 459 N ASP A 30 -12.747 -6.144 0.961 1.00 0.00 N ATOM 460 CA ASP A 30 -12.557 -7.316 0.114 1.00 0.00 C ATOM 461 C ASP A 30 -11.098 -7.761 0.131 1.00 0.00 C ATOM 462 O ASP A 30 -10.792 -8.929 -0.105 1.00 0.00 O ATOM 463 CB ASP A 30 -12.997 -7.013 -1.319 1.00 0.00 C ATOM 464 CG ASP A 30 -13.659 -8.203 -1.983 1.00 0.00 C ATOM 465 OD1 ASP A 30 -13.027 -9.279 -2.041 1.00 0.00 O ATOM 466 OD2 ASP A 30 -14.810 -8.059 -2.446 1.00 0.00 O ATOM 0 H ASP A 30 -12.913 -5.276 0.451 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.171 -8.126 0.508 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.690 -6.172 -1.313 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.130 -6.708 -1.906 1.00 0.00 H new ATOM 471 N GLY A 31 -10.200 -6.820 0.411 1.00 0.00 N ATOM 472 CA GLY A 31 -8.784 -7.130 0.454 1.00 0.00 C ATOM 473 C GLY A 31 -8.421 -8.007 1.636 1.00 0.00 C ATOM 474 O GLY A 31 -7.525 -8.845 1.543 1.00 0.00 O ATOM 0 H GLY A 31 -10.430 -5.846 0.609 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.496 -7.632 -0.470 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.213 -6.203 0.504 1.00 0.00 H new ATOM 478 N LYS A 32 -9.120 -7.815 2.750 1.00 0.00 N ATOM 479 CA LYS A 32 -8.868 -8.597 3.954 1.00 0.00 C ATOM 480 C LYS A 32 -9.411 -10.011 3.803 1.00 0.00 C ATOM 481 O LYS A 32 -8.787 -10.979 4.241 1.00 0.00 O ATOM 482 CB LYS A 32 -9.504 -7.919 5.171 1.00 0.00 C ATOM 483 CG LYS A 32 -9.293 -8.677 6.471 1.00 0.00 C ATOM 484 CD LYS A 32 -9.068 -7.730 7.637 1.00 0.00 C ATOM 485 CE LYS A 32 -8.988 -8.481 8.956 1.00 0.00 C ATOM 486 NZ LYS A 32 -9.508 -7.669 10.090 1.00 0.00 N ATOM 0 H LYS A 32 -9.865 -7.125 2.844 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.790 -8.654 4.103 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.091 -6.916 5.274 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -10.574 -7.807 4.996 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.161 -9.304 6.673 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -8.435 -9.342 6.370 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -8.146 -7.170 7.480 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.880 -7.004 7.679 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.558 -9.407 8.881 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -7.953 -8.759 9.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.436 -8.217 10.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -8.948 -6.797 10.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.504 -7.425 9.915 1.00 0.00 H new ATOM 500 N LYS A 33 -10.578 -10.124 3.178 1.00 0.00 N ATOM 501 CA LYS A 33 -11.210 -11.421 2.965 1.00 0.00 C ATOM 502 C LYS A 33 -10.420 -12.259 1.964 1.00 0.00 C ATOM 503 O LYS A 33 -10.508 -13.487 1.962 1.00 0.00 O ATOM 504 CB LYS A 33 -12.645 -11.233 2.468 1.00 0.00 C ATOM 505 CG LYS A 33 -13.424 -12.532 2.352 1.00 0.00 C ATOM 506 CD LYS A 33 -14.508 -12.436 1.288 1.00 0.00 C ATOM 507 CE LYS A 33 -14.714 -13.765 0.578 1.00 0.00 C ATOM 508 NZ LYS A 33 -15.987 -14.423 0.987 1.00 0.00 N ATOM 0 H LYS A 33 -11.106 -9.333 2.810 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.225 -11.950 3.918 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -13.171 -10.563 3.148 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.622 -10.745 1.494 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.742 -13.346 2.107 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -13.876 -12.774 3.314 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.444 -12.120 1.749 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.237 -11.672 0.560 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.719 -13.604 -0.500 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -13.876 -14.427 0.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -16.090 -15.326 0.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -15.972 -14.601 2.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -16.789 -13.803 0.755 1.00 0.00 H new ATOM 522 N GLU A 34 -9.648 -11.591 1.110 1.00 0.00 N ATOM 523 CA GLU A 34 -8.849 -12.281 0.105 1.00 0.00 C ATOM 524 C GLU A 34 -7.416 -12.493 0.582 1.00 0.00 C ATOM 525 O GLU A 34 -6.951 -13.628 0.687 1.00 0.00 O ATOM 526 CB GLU A 34 -8.847 -11.495 -1.204 1.00 0.00 C ATOM 527 CG GLU A 34 -8.115 -12.208 -2.324 1.00 0.00 C ATOM 528 CD GLU A 34 -8.846 -12.119 -3.650 1.00 0.00 C ATOM 529 OE1 GLU A 34 -8.963 -10.999 -4.188 1.00 0.00 O ATOM 530 OE2 GLU A 34 -9.300 -13.170 -4.150 1.00 0.00 O ATOM 0 H GLU A 34 -9.560 -10.575 1.095 1.00 0.00 H new ATOM 0 HA GLU A 34 -9.301 -13.259 -0.062 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -9.876 -11.309 -1.511 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -8.384 -10.523 -1.036 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -7.119 -11.778 -2.433 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -7.982 -13.256 -2.056 1.00 0.00 H new ATOM 537 N ALA A 35 -6.718 -11.396 0.865 1.00 0.00 N ATOM 538 CA ALA A 35 -5.333 -11.458 1.326 1.00 0.00 C ATOM 539 C ALA A 35 -5.153 -12.528 2.400 1.00 0.00 C ATOM 540 O ALA A 35 -4.086 -13.130 2.517 1.00 0.00 O ATOM 541 CB ALA A 35 -4.895 -10.103 1.859 1.00 0.00 C ATOM 0 H ALA A 35 -7.090 -10.450 0.783 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.708 -11.726 0.474 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.861 -10.163 2.199 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -4.974 -9.358 1.067 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.535 -9.816 2.693 1.00 0.00 H new ATOM 547 N ALA A 36 -6.209 -12.755 3.175 1.00 0.00 N ATOM 548 CA ALA A 36 -6.179 -13.751 4.238 1.00 0.00 C ATOM 549 C ALA A 36 -6.098 -15.161 3.664 1.00 0.00 C ATOM 550 O ALA A 36 -5.305 -15.984 4.122 1.00 0.00 O ATOM 551 CB ALA A 36 -7.411 -13.605 5.118 1.00 0.00 C ATOM 0 H ALA A 36 -7.097 -12.261 3.086 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.288 -13.584 4.843 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.383 -14.353 5.911 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.427 -12.608 5.559 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -8.308 -13.749 4.515 1.00 0.00 H new ATOM 557 N ALA A 37 -6.923 -15.432 2.658 1.00 0.00 N ATOM 558 CA ALA A 37 -6.945 -16.741 2.020 1.00 0.00 C ATOM 559 C ALA A 37 -5.768 -16.905 1.064 1.00 0.00 C ATOM 560 O ALA A 37 -4.957 -17.819 1.213 1.00 0.00 O ATOM 561 CB ALA A 37 -8.260 -16.945 1.281 1.00 0.00 C ATOM 0 H ALA A 37 -7.585 -14.761 2.268 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.856 -17.499 2.798 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.263 -17.927 0.809 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.088 -16.879 1.987 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.372 -16.175 0.518 1.00 0.00 H new ATOM 567 N SER A 38 -5.680 -16.011 0.083 1.00 0.00 N ATOM 568 CA SER A 38 -4.602 -16.053 -0.897 1.00 0.00 C ATOM 569 C SER A 38 -3.243 -15.950 -0.214 1.00 0.00 C ATOM 570 O SER A 38 -2.397 -16.834 -0.352 1.00 0.00 O ATOM 571 CB SER A 38 -4.761 -14.921 -1.912 1.00 0.00 C ATOM 572 OG SER A 38 -5.517 -15.344 -3.035 1.00 0.00 O ATOM 0 H SER A 38 -6.344 -15.248 -0.053 1.00 0.00 H new ATOM 0 HA SER A 38 -4.657 -17.009 -1.418 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.252 -14.071 -1.439 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.778 -14.581 -2.239 1.00 0.00 H new ATOM 0 HG SER A 38 -5.606 -14.601 -3.668 1.00 0.00 H new ATOM 578 N GLY A 39 -3.039 -14.865 0.525 1.00 0.00 N ATOM 579 CA GLY A 39 -1.783 -14.664 1.221 1.00 0.00 C ATOM 580 C GLY A 39 -0.956 -13.547 0.615 1.00 0.00 C ATOM 581 O GLY A 39 0.218 -13.735 0.299 1.00 0.00 O ATOM 0 H GLY A 39 -3.723 -14.120 0.654 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -1.984 -14.436 2.268 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -1.208 -15.590 1.201 1.00 0.00 H new ATOM 585 N LEU A 40 -1.571 -12.378 0.459 1.00 0.00 N ATOM 586 CA LEU A 40 -0.882 -11.222 -0.107 1.00 0.00 C ATOM 587 C LEU A 40 -1.004 -10.015 0.825 1.00 0.00 C ATOM 588 O LEU A 40 -2.037 -9.817 1.462 1.00 0.00 O ATOM 589 CB LEU A 40 -1.443 -10.882 -1.493 1.00 0.00 C ATOM 590 CG LEU A 40 -2.954 -11.072 -1.654 1.00 0.00 C ATOM 591 CD1 LEU A 40 -3.692 -9.831 -1.194 1.00 0.00 C ATOM 592 CD2 LEU A 40 -3.310 -11.396 -3.096 1.00 0.00 C ATOM 0 H LEU A 40 -2.543 -12.206 0.716 1.00 0.00 H new ATOM 0 HA LEU A 40 0.173 -11.474 -0.214 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.198 -9.845 -1.721 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.935 -11.500 -2.234 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.260 -11.913 -1.032 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.765 -9.980 -1.314 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.467 -9.642 -0.144 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.375 -8.977 -1.792 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.389 -11.526 -3.184 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.989 -10.579 -3.742 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.808 -12.315 -3.397 1.00 0.00 H new ATOM 604 N PRO A 41 0.058 -9.196 0.925 1.00 0.00 N ATOM 605 CA PRO A 41 0.066 -8.014 1.795 1.00 0.00 C ATOM 606 C PRO A 41 -0.726 -6.847 1.221 1.00 0.00 C ATOM 607 O PRO A 41 -1.305 -6.942 0.132 1.00 0.00 O ATOM 608 CB PRO A 41 1.546 -7.658 1.871 1.00 0.00 C ATOM 609 CG PRO A 41 2.083 -8.091 0.557 1.00 0.00 C ATOM 610 CD PRO A 41 1.340 -9.355 0.210 1.00 0.00 C ATOM 0 HA PRO A 41 -0.401 -8.218 2.759 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.693 -6.590 2.031 1.00 0.00 H new ATOM 0 HB3 PRO A 41 2.040 -8.174 2.694 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.927 -7.324 -0.202 1.00 0.00 H new ATOM 0 HG3 PRO A 41 3.157 -8.271 0.613 1.00 0.00 H new ATOM 0 HD2 PRO A 41 1.192 -9.454 -0.865 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.879 -10.243 0.541 1.00 0.00 H new ATOM 618 N LEU A 42 -0.749 -5.742 1.966 1.00 0.00 N ATOM 619 CA LEU A 42 -1.471 -4.551 1.543 1.00 0.00 C ATOM 620 C LEU A 42 -0.524 -3.385 1.275 1.00 0.00 C ATOM 621 O LEU A 42 0.213 -2.949 2.161 1.00 0.00 O ATOM 622 CB LEU A 42 -2.500 -4.158 2.600 1.00 0.00 C ATOM 623 CG LEU A 42 -3.914 -3.916 2.071 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.835 -5.065 2.452 1.00 0.00 C ATOM 625 CD2 LEU A 42 -4.454 -2.598 2.600 1.00 0.00 C ATOM 0 H LEU A 42 -0.275 -5.651 2.865 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.983 -4.786 0.610 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.541 -4.943 3.355 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.156 -3.253 3.100 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.872 -3.863 0.983 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -5.836 -4.872 2.066 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.454 -5.993 2.026 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -4.876 -5.154 3.538 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.461 -2.437 2.216 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.481 -2.627 3.689 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -3.807 -1.783 2.275 1.00 0.00 H new ATOM 637 N MET A 43 -0.561 -2.883 0.045 1.00 0.00 N ATOM 638 CA MET A 43 0.276 -1.761 -0.362 1.00 0.00 C ATOM 639 C MET A 43 -0.515 -0.454 -0.306 1.00 0.00 C ATOM 640 O MET A 43 -0.919 0.087 -1.337 1.00 0.00 O ATOM 641 CB MET A 43 0.808 -2.002 -1.778 1.00 0.00 C ATOM 642 CG MET A 43 1.614 -0.840 -2.339 1.00 0.00 C ATOM 643 SD MET A 43 3.388 -1.053 -2.102 1.00 0.00 S ATOM 644 CE MET A 43 3.538 -0.698 -0.353 1.00 0.00 C ATOM 0 H MET A 43 -1.168 -3.240 -0.693 1.00 0.00 H new ATOM 0 HA MET A 43 1.117 -1.680 0.326 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.432 -2.896 -1.774 1.00 0.00 H new ATOM 0 HB3 MET A 43 -0.033 -2.203 -2.442 1.00 0.00 H new ATOM 0 HG2 MET A 43 1.403 -0.736 -3.403 1.00 0.00 H new ATOM 0 HG3 MET A 43 1.295 0.085 -1.859 1.00 0.00 H new ATOM 0 HE1 MET A 43 4.578 -0.473 -0.115 1.00 0.00 H new ATOM 0 HE2 MET A 43 2.914 0.160 -0.101 1.00 0.00 H new ATOM 0 HE3 MET A 43 3.213 -1.564 0.223 1.00 0.00 H new ATOM 654 N VAL A 44 -0.746 0.044 0.903 1.00 0.00 N ATOM 655 CA VAL A 44 -1.503 1.277 1.093 1.00 0.00 C ATOM 656 C VAL A 44 -0.866 2.454 0.362 1.00 0.00 C ATOM 657 O VAL A 44 -0.078 3.205 0.936 1.00 0.00 O ATOM 658 CB VAL A 44 -1.646 1.624 2.587 1.00 0.00 C ATOM 659 CG1 VAL A 44 -2.463 2.894 2.785 1.00 0.00 C ATOM 660 CG2 VAL A 44 -2.276 0.468 3.336 1.00 0.00 C ATOM 0 H VAL A 44 -0.420 -0.387 1.768 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.492 1.099 0.671 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.648 1.803 2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -2.545 3.111 3.850 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.970 3.726 2.282 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -3.459 2.755 2.365 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -2.371 0.726 4.391 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.263 0.261 2.922 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.648 -0.417 3.235 1.00 0.00 H new ATOM 670 N ILE A 45 -1.241 2.622 -0.900 1.00 0.00 N ATOM 671 CA ILE A 45 -0.739 3.718 -1.717 1.00 0.00 C ATOM 672 C ILE A 45 -1.493 5.001 -1.383 1.00 0.00 C ATOM 673 O ILE A 45 -2.691 5.095 -1.645 1.00 0.00 O ATOM 674 CB ILE A 45 -0.920 3.411 -3.221 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.060 2.206 -3.624 1.00 0.00 C ATOM 676 CG2 ILE A 45 -0.597 4.635 -4.073 1.00 0.00 C ATOM 677 CD1 ILE A 45 0.504 2.283 -5.030 1.00 0.00 C ATOM 0 H ILE A 45 -1.897 2.007 -1.382 1.00 0.00 H new ATOM 0 HA ILE A 45 0.323 3.840 -1.503 1.00 0.00 H new ATOM 0 HB ILE A 45 -1.965 3.158 -3.400 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.766 2.112 -2.919 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.660 1.300 -3.535 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -0.733 4.391 -5.127 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.264 5.454 -3.801 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.436 4.936 -3.900 1.00 0.00 H new ATOM 0 HD11 ILE A 45 1.099 1.392 -5.233 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.314 2.344 -5.747 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.134 3.168 -5.122 1.00 0.00 H new ATOM 689 N ILE A 46 -0.819 5.987 -0.792 1.00 0.00 N ATOM 690 CA ILE A 46 -1.503 7.215 -0.445 1.00 0.00 C ATOM 691 C ILE A 46 -0.891 8.441 -1.102 1.00 0.00 C ATOM 692 O ILE A 46 0.318 8.530 -1.305 1.00 0.00 O ATOM 693 CB ILE A 46 -1.544 7.410 1.075 1.00 0.00 C ATOM 694 CG1 ILE A 46 -2.243 6.218 1.722 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.255 8.706 1.430 1.00 0.00 C ATOM 696 CD1 ILE A 46 -1.571 5.743 2.990 1.00 0.00 C ATOM 0 H ILE A 46 0.172 5.956 -0.552 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.519 7.112 -0.827 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.524 7.473 1.454 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.275 6.489 1.946 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.278 5.395 1.008 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.274 8.826 2.513 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -1.726 9.546 0.981 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.276 8.676 1.051 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.120 4.894 3.397 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.548 5.441 2.768 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.560 6.552 3.721 1.00 0.00 H new ATOM 708 N HIS A 47 -1.762 9.389 -1.408 1.00 0.00 N ATOM 709 CA HIS A 47 -1.377 10.645 -2.020 1.00 0.00 C ATOM 710 C HIS A 47 -2.201 11.756 -1.392 1.00 0.00 C ATOM 711 O HIS A 47 -2.916 12.485 -2.081 1.00 0.00 O ATOM 712 CB HIS A 47 -1.619 10.610 -3.529 1.00 0.00 C ATOM 713 CG HIS A 47 -1.171 9.342 -4.186 1.00 0.00 C ATOM 714 ND1 HIS A 47 0.036 9.221 -4.837 1.00 0.00 N ATOM 715 CD2 HIS A 47 -1.789 8.145 -4.316 1.00 0.00 C ATOM 716 CE1 HIS A 47 0.143 8.006 -5.343 1.00 0.00 C ATOM 717 NE2 HIS A 47 -0.953 7.330 -5.043 1.00 0.00 N ATOM 0 H HIS A 47 -2.764 9.305 -1.236 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.314 10.819 -1.853 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.683 10.750 -3.720 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.099 11.450 -3.990 1.00 0.00 H new ATOM 0 HD1 HIS A 47 0.739 9.956 -4.916 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.759 7.879 -3.922 1.00 0.00 H new ATOM 0 HE1 HIS A 47 0.983 7.628 -5.906 1.00 0.00 H new ATOM 726 N LYS A 48 -2.122 11.858 -0.072 1.00 0.00 N ATOM 727 CA LYS A 48 -2.896 12.867 0.650 1.00 0.00 C ATOM 728 C LYS A 48 -2.386 14.273 0.348 1.00 0.00 C ATOM 729 O LYS A 48 -1.181 14.521 0.334 1.00 0.00 O ATOM 730 CB LYS A 48 -2.869 12.588 2.153 1.00 0.00 C ATOM 731 CG LYS A 48 -4.008 11.688 2.613 1.00 0.00 C ATOM 732 CD LYS A 48 -3.836 11.255 4.060 1.00 0.00 C ATOM 733 CE LYS A 48 -5.144 11.336 4.831 1.00 0.00 C ATOM 734 NZ LYS A 48 -5.189 10.364 5.959 1.00 0.00 N ATOM 0 H LYS A 48 -1.539 11.264 0.517 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.929 12.810 0.308 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.918 12.123 2.413 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -2.920 13.533 2.693 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.956 12.215 2.501 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.056 10.807 1.973 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -3.458 10.233 4.091 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.090 11.886 4.542 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.274 12.347 5.218 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.976 11.144 4.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.837 9.586 5.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.236 9.982 6.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.525 10.844 6.818 1.00 0.00 H new ATOM 748 N SER A 49 -3.318 15.192 0.097 1.00 0.00 N ATOM 749 CA SER A 49 -2.974 16.576 -0.216 1.00 0.00 C ATOM 750 C SER A 49 -2.278 16.663 -1.571 1.00 0.00 C ATOM 751 O SER A 49 -2.111 15.653 -2.256 1.00 0.00 O ATOM 752 CB SER A 49 -2.074 17.163 0.872 1.00 0.00 C ATOM 753 OG SER A 49 -2.321 18.548 1.046 1.00 0.00 O ATOM 0 H SER A 49 -4.320 15.001 0.105 1.00 0.00 H new ATOM 0 HA SER A 49 -3.897 17.154 -0.259 1.00 0.00 H new ATOM 0 HB2 SER A 49 -2.246 16.639 1.812 1.00 0.00 H new ATOM 0 HB3 SER A 49 -1.028 17.007 0.607 1.00 0.00 H new ATOM 0 HG SER A 49 -1.749 19.061 0.438 1.00 0.00 H new ATOM 759 N TRP A 50 -1.871 17.871 -1.955 1.00 0.00 N ATOM 760 CA TRP A 50 -1.191 18.079 -3.232 1.00 0.00 C ATOM 761 C TRP A 50 -0.062 17.069 -3.413 1.00 0.00 C ATOM 762 O TRP A 50 0.671 16.769 -2.470 1.00 0.00 O ATOM 763 CB TRP A 50 -0.636 19.502 -3.313 1.00 0.00 C ATOM 764 CG TRP A 50 0.103 19.923 -2.080 1.00 0.00 C ATOM 765 CD1 TRP A 50 1.436 19.767 -1.828 1.00 0.00 C ATOM 766 CD2 TRP A 50 -0.451 20.567 -0.927 1.00 0.00 C ATOM 767 NE1 TRP A 50 1.744 20.277 -0.590 1.00 0.00 N ATOM 768 CE2 TRP A 50 0.603 20.773 -0.016 1.00 0.00 C ATOM 769 CE3 TRP A 50 -1.736 20.990 -0.576 1.00 0.00 C ATOM 770 CZ2 TRP A 50 0.410 21.385 1.219 1.00 0.00 C ATOM 771 CZ3 TRP A 50 -1.926 21.596 0.652 1.00 0.00 C ATOM 772 CH2 TRP A 50 -0.858 21.789 1.536 1.00 0.00 C ATOM 0 H TRP A 50 -2.000 18.719 -1.402 1.00 0.00 H new ATOM 0 HA TRP A 50 -1.917 17.935 -4.032 1.00 0.00 H new ATOM 0 HB2 TRP A 50 0.032 19.575 -4.171 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.458 20.195 -3.489 1.00 0.00 H new ATOM 0 HD1 TRP A 50 2.144 19.310 -2.503 1.00 0.00 H new ATOM 0 HE1 TRP A 50 2.672 20.285 -0.167 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -2.566 20.846 -1.252 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 1.232 21.536 1.903 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -2.915 21.926 0.934 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.039 22.267 2.488 1.00 0.00 H new ATOM 783 N CYS A 51 0.067 16.536 -4.623 1.00 0.00 N ATOM 784 CA CYS A 51 1.101 15.548 -4.907 1.00 0.00 C ATOM 785 C CYS A 51 1.287 15.364 -6.418 1.00 0.00 C ATOM 786 O CYS A 51 0.333 15.478 -7.188 1.00 0.00 O ATOM 787 CB CYS A 51 0.735 14.220 -4.220 1.00 0.00 C ATOM 788 SG CYS A 51 0.734 12.742 -5.292 1.00 0.00 S ATOM 0 H CYS A 51 -0.527 16.770 -5.418 1.00 0.00 H new ATOM 0 HA CYS A 51 2.053 15.900 -4.510 1.00 0.00 H new ATOM 0 HB2 CYS A 51 1.435 14.051 -3.402 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -0.255 14.324 -3.776 1.00 0.00 H new ATOM 793 N GLY A 52 2.521 15.072 -6.832 1.00 0.00 N ATOM 794 CA GLY A 52 2.804 14.865 -8.245 1.00 0.00 C ATOM 795 C GLY A 52 2.892 13.396 -8.594 1.00 0.00 C ATOM 796 O GLY A 52 2.496 12.984 -9.684 1.00 0.00 O ATOM 0 H GLY A 52 3.328 14.975 -6.215 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.023 15.334 -8.844 1.00 0.00 H new ATOM 0 HA3 GLY A 52 3.742 15.356 -8.503 1.00 0.00 H new ATOM 800 N ALA A 53 3.393 12.598 -7.654 1.00 0.00 N ATOM 801 CA ALA A 53 3.508 11.157 -7.855 1.00 0.00 C ATOM 802 C ALA A 53 2.155 10.552 -8.192 1.00 0.00 C ATOM 803 O ALA A 53 2.070 9.418 -8.666 1.00 0.00 O ATOM 804 CB ALA A 53 4.099 10.492 -6.621 1.00 0.00 C ATOM 0 H ALA A 53 3.725 12.925 -6.747 1.00 0.00 H new ATOM 0 HA ALA A 53 4.179 10.981 -8.696 1.00 0.00 H new ATOM 0 HB1 ALA A 53 4.177 9.418 -6.789 1.00 0.00 H new ATOM 0 HB2 ALA A 53 5.090 10.902 -6.426 1.00 0.00 H new ATOM 0 HB3 ALA A 53 3.454 10.679 -5.763 1.00 0.00 H new ATOM 810 N CYS A 54 1.102 11.320 -7.957 1.00 0.00 N ATOM 811 CA CYS A 54 -0.241 10.874 -8.249 1.00 0.00 C ATOM 812 C CYS A 54 -0.694 11.440 -9.588 1.00 0.00 C ATOM 813 O CYS A 54 -1.416 10.786 -10.343 1.00 0.00 O ATOM 814 CB CYS A 54 -1.211 11.286 -7.133 1.00 0.00 C ATOM 815 SG CYS A 54 -0.923 12.958 -6.451 1.00 0.00 S ATOM 0 H CYS A 54 1.158 12.259 -7.563 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.241 9.785 -8.306 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.229 11.236 -7.518 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -1.141 10.561 -6.323 1.00 0.00 H new ATOM 820 N LYS A 55 -0.247 12.656 -9.885 1.00 0.00 N ATOM 821 CA LYS A 55 -0.593 13.307 -11.140 1.00 0.00 C ATOM 822 C LYS A 55 0.006 12.539 -12.311 1.00 0.00 C ATOM 823 O LYS A 55 -0.674 12.284 -13.305 1.00 0.00 O ATOM 824 CB LYS A 55 -0.112 14.759 -11.147 1.00 0.00 C ATOM 825 CG LYS A 55 -1.249 15.765 -11.218 1.00 0.00 C ATOM 826 CD LYS A 55 -0.739 17.192 -11.114 1.00 0.00 C ATOM 827 CE LYS A 55 -1.853 18.157 -10.741 1.00 0.00 C ATOM 828 NZ LYS A 55 -2.686 18.525 -11.918 1.00 0.00 N ATOM 0 H LYS A 55 0.354 13.208 -9.274 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.678 13.310 -11.242 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.474 14.945 -10.247 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.553 14.911 -11.997 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -1.790 15.639 -12.156 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.958 15.572 -10.413 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.053 17.243 -10.367 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.299 17.492 -12.065 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -2.485 17.704 -9.977 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -1.422 19.058 -10.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.434 19.184 -11.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -2.089 18.980 -12.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -3.118 17.668 -12.319 1.00 0.00 H new ATOM 842 N ALA A 56 1.273 12.146 -12.183 1.00 0.00 N ATOM 843 CA ALA A 56 1.926 11.381 -13.235 1.00 0.00 C ATOM 844 C ALA A 56 1.393 9.956 -13.246 1.00 0.00 C ATOM 845 O ALA A 56 1.503 9.243 -14.242 1.00 0.00 O ATOM 846 CB ALA A 56 3.435 11.388 -13.043 1.00 0.00 C ATOM 0 H ALA A 56 1.858 12.343 -11.371 1.00 0.00 H new ATOM 0 HA ALA A 56 1.706 11.845 -14.196 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.906 10.811 -13.839 1.00 0.00 H new ATOM 0 HB2 ALA A 56 3.801 12.414 -13.074 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.681 10.944 -12.079 1.00 0.00 H new ATOM 852 N LEU A 57 0.804 9.551 -12.124 1.00 0.00 N ATOM 853 CA LEU A 57 0.241 8.219 -11.984 1.00 0.00 C ATOM 854 C LEU A 57 -1.047 8.076 -12.792 1.00 0.00 C ATOM 855 O LEU A 57 -1.445 6.974 -13.140 1.00 0.00 O ATOM 856 CB LEU A 57 -0.034 7.921 -10.507 1.00 0.00 C ATOM 857 CG LEU A 57 1.033 7.087 -9.784 1.00 0.00 C ATOM 858 CD1 LEU A 57 0.685 5.609 -9.850 1.00 0.00 C ATOM 859 CD2 LEU A 57 2.417 7.337 -10.371 1.00 0.00 C ATOM 0 H LEU A 57 0.706 10.135 -11.294 1.00 0.00 H new ATOM 0 HA LEU A 57 0.966 7.502 -12.370 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.147 8.868 -9.980 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.988 7.399 -10.433 1.00 0.00 H new ATOM 0 HG LEU A 57 1.051 7.395 -8.739 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.451 5.031 -9.333 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.280 5.441 -9.372 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.634 5.293 -10.892 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.152 6.733 -9.839 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.419 7.065 -11.427 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.671 8.392 -10.268 1.00 0.00 H new ATOM 871 N LYS A 58 -1.707 9.188 -13.075 1.00 0.00 N ATOM 872 CA LYS A 58 -2.957 9.144 -13.823 1.00 0.00 C ATOM 873 C LYS A 58 -2.762 8.633 -15.259 1.00 0.00 C ATOM 874 O LYS A 58 -3.388 7.649 -15.660 1.00 0.00 O ATOM 875 CB LYS A 58 -3.635 10.519 -13.824 1.00 0.00 C ATOM 876 CG LYS A 58 -4.292 10.871 -12.500 1.00 0.00 C ATOM 877 CD LYS A 58 -5.553 11.693 -12.704 1.00 0.00 C ATOM 878 CE LYS A 58 -5.232 13.168 -12.893 1.00 0.00 C ATOM 879 NZ LYS A 58 -4.292 13.391 -14.027 1.00 0.00 N ATOM 0 H LYS A 58 -1.404 10.123 -12.802 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.608 8.431 -13.317 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.894 11.281 -14.067 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.388 10.544 -14.612 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.536 9.956 -11.960 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.589 11.429 -11.881 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.093 11.323 -13.575 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.212 11.570 -11.844 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -6.155 13.720 -13.072 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.796 13.565 -11.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.381 14.371 -14.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -3.317 13.223 -13.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.521 12.736 -14.802 1.00 0.00 H new ATOM 893 N PRO A 59 -1.896 9.284 -16.060 1.00 0.00 N ATOM 894 CA PRO A 59 -1.651 8.884 -17.448 1.00 0.00 C ATOM 895 C PRO A 59 -0.697 7.700 -17.579 1.00 0.00 C ATOM 896 O PRO A 59 -0.631 7.067 -18.633 1.00 0.00 O ATOM 897 CB PRO A 59 -1.028 10.136 -18.089 1.00 0.00 C ATOM 898 CG PRO A 59 -0.939 11.167 -17.006 1.00 0.00 C ATOM 899 CD PRO A 59 -1.090 10.448 -15.696 1.00 0.00 C ATOM 0 HA PRO A 59 -2.574 8.551 -17.924 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.041 9.914 -18.496 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -1.640 10.494 -18.917 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.016 11.690 -17.050 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -1.720 11.918 -17.125 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.125 10.158 -15.279 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -1.587 11.067 -14.949 1.00 0.00 H new ATOM 907 N LYS A 60 0.041 7.403 -16.518 1.00 0.00 N ATOM 908 CA LYS A 60 0.987 6.292 -16.543 1.00 0.00 C ATOM 909 C LYS A 60 0.379 5.050 -15.906 1.00 0.00 C ATOM 910 O LYS A 60 0.477 3.953 -16.453 1.00 0.00 O ATOM 911 CB LYS A 60 2.273 6.667 -15.813 1.00 0.00 C ATOM 912 CG LYS A 60 2.142 6.559 -14.302 1.00 0.00 C ATOM 913 CD LYS A 60 3.222 7.322 -13.526 1.00 0.00 C ATOM 914 CE LYS A 60 4.135 8.164 -14.416 1.00 0.00 C ATOM 915 NZ LYS A 60 4.958 7.328 -15.333 1.00 0.00 N ATOM 0 H LYS A 60 0.005 7.911 -15.634 1.00 0.00 H new ATOM 0 HA LYS A 60 1.220 6.074 -17.585 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.081 6.018 -16.151 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.552 7.687 -16.078 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.163 6.934 -14.005 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.180 5.507 -14.019 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.741 7.972 -12.795 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.829 6.609 -12.968 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.530 8.855 -15.003 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.792 8.768 -13.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.966 7.521 -15.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.764 6.322 -15.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.719 7.556 -16.319 1.00 0.00 H new ATOM 929 N PHE A 61 -0.260 5.228 -14.751 1.00 0.00 N ATOM 930 CA PHE A 61 -0.880 4.114 -14.073 1.00 0.00 C ATOM 931 C PHE A 61 -2.051 3.626 -14.900 1.00 0.00 C ATOM 932 O PHE A 61 -2.458 2.475 -14.787 1.00 0.00 O ATOM 933 CB PHE A 61 -1.311 4.484 -12.660 1.00 0.00 C ATOM 934 CG PHE A 61 -1.614 3.287 -11.810 1.00 0.00 C ATOM 935 CD1 PHE A 61 -2.806 2.603 -11.961 1.00 0.00 C ATOM 936 CD2 PHE A 61 -0.703 2.842 -10.867 1.00 0.00 C ATOM 937 CE1 PHE A 61 -3.087 1.495 -11.185 1.00 0.00 C ATOM 938 CE2 PHE A 61 -0.978 1.737 -10.088 1.00 0.00 C ATOM 939 CZ PHE A 61 -2.173 1.063 -10.247 1.00 0.00 C ATOM 0 H PHE A 61 -0.356 6.126 -14.277 1.00 0.00 H new ATOM 0 HA PHE A 61 -0.152 3.310 -13.971 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.523 5.069 -12.187 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.194 5.121 -12.710 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.525 2.938 -12.693 1.00 0.00 H new ATOM 0 HD2 PHE A 61 0.233 3.366 -10.740 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.021 0.968 -11.313 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -0.260 1.400 -9.355 1.00 0.00 H new ATOM 0 HZ PHE A 61 -2.391 0.199 -9.637 1.00 0.00 H new ATOM 949 N ALA A 62 -2.550 4.486 -15.795 1.00 0.00 N ATOM 950 CA ALA A 62 -3.614 4.079 -16.693 1.00 0.00 C ATOM 951 C ALA A 62 -3.122 2.863 -17.486 1.00 0.00 C ATOM 952 O ALA A 62 -3.903 2.070 -18.010 1.00 0.00 O ATOM 953 CB ALA A 62 -3.996 5.222 -17.625 1.00 0.00 C ATOM 0 H ALA A 62 -2.235 5.449 -15.909 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.507 3.815 -16.126 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -4.796 4.897 -18.291 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.338 6.073 -17.036 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.128 5.515 -18.216 1.00 0.00 H new ATOM 959 N GLU A 63 -1.791 2.732 -17.520 1.00 0.00 N ATOM 960 CA GLU A 63 -1.097 1.638 -18.182 1.00 0.00 C ATOM 961 C GLU A 63 -1.214 0.362 -17.358 1.00 0.00 C ATOM 962 O GLU A 63 -0.938 -0.740 -17.839 1.00 0.00 O ATOM 963 CB GLU A 63 0.375 2.021 -18.353 1.00 0.00 C ATOM 964 CG GLU A 63 1.109 1.187 -19.394 1.00 0.00 C ATOM 965 CD GLU A 63 1.620 2.019 -20.555 1.00 0.00 C ATOM 966 OE1 GLU A 63 0.790 2.648 -21.244 1.00 0.00 O ATOM 967 OE2 GLU A 63 2.848 2.041 -20.774 1.00 0.00 O ATOM 0 H GLU A 63 -1.160 3.400 -17.077 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.547 1.456 -19.158 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.437 3.072 -18.634 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.882 1.917 -17.394 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.948 0.678 -18.920 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.440 0.414 -19.773 1.00 0.00 H new ATOM 974 N SER A 64 -1.634 0.524 -16.110 1.00 0.00 N ATOM 975 CA SER A 64 -1.803 -0.586 -15.193 1.00 0.00 C ATOM 976 C SER A 64 -2.772 -1.636 -15.727 1.00 0.00 C ATOM 977 O SER A 64 -3.065 -2.604 -15.033 1.00 0.00 O ATOM 978 CB SER A 64 -2.309 -0.070 -13.853 1.00 0.00 C ATOM 979 OG SER A 64 -1.302 0.655 -13.168 1.00 0.00 O ATOM 0 H SER A 64 -1.866 1.432 -15.708 1.00 0.00 H new ATOM 0 HA SER A 64 -0.830 -1.062 -15.076 1.00 0.00 H new ATOM 0 HB2 SER A 64 -3.177 0.570 -14.011 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.639 -0.908 -13.239 1.00 0.00 H new ATOM 0 HG SER A 64 -1.716 1.228 -12.489 1.00 0.00 H new ATOM 985 N THR A 65 -3.263 -1.467 -16.957 1.00 0.00 N ATOM 986 CA THR A 65 -4.170 -2.448 -17.535 1.00 0.00 C ATOM 987 C THR A 65 -3.597 -3.839 -17.309 1.00 0.00 C ATOM 988 O THR A 65 -4.317 -4.779 -16.972 1.00 0.00 O ATOM 989 CB THR A 65 -4.367 -2.190 -19.029 1.00 0.00 C ATOM 990 OG1 THR A 65 -4.028 -0.855 -19.358 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.788 -2.430 -19.492 1.00 0.00 C ATOM 0 H THR A 65 -3.050 -0.672 -17.560 1.00 0.00 H new ATOM 0 HA THR A 65 -5.144 -2.368 -17.052 1.00 0.00 H new ATOM 0 HB THR A 65 -3.710 -2.898 -19.534 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.160 -0.711 -20.318 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.861 -2.229 -20.561 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.064 -3.466 -19.298 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.464 -1.767 -18.951 1.00 0.00 H new ATOM 999 N GLU A 66 -2.280 -3.940 -17.448 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.587 -5.196 -17.210 1.00 0.00 C ATOM 1001 C GLU A 66 -1.394 -5.380 -15.721 1.00 0.00 C ATOM 1002 O GLU A 66 -1.419 -6.503 -15.216 1.00 0.00 O ATOM 1003 CB GLU A 66 -0.238 -5.228 -17.933 1.00 0.00 C ATOM 1004 CG GLU A 66 -0.012 -6.502 -18.729 1.00 0.00 C ATOM 1005 CD GLU A 66 1.400 -7.036 -18.585 1.00 0.00 C ATOM 1006 OE1 GLU A 66 1.700 -7.646 -17.536 1.00 0.00 O ATOM 1007 OE2 GLU A 66 2.205 -6.846 -19.521 1.00 0.00 O ATOM 0 H GLU A 66 -1.674 -3.168 -17.724 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.190 -6.013 -17.605 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -0.173 -4.372 -18.605 1.00 0.00 H new ATOM 0 HB3 GLU A 66 0.562 -5.119 -17.200 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.720 -7.263 -18.399 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -0.218 -6.310 -19.782 1.00 0.00 H new ATOM 1014 N ILE A 67 -1.244 -4.269 -15.008 1.00 0.00 N ATOM 1015 CA ILE A 67 -1.097 -4.332 -13.569 1.00 0.00 C ATOM 1016 C ILE A 67 -2.422 -4.743 -12.939 1.00 0.00 C ATOM 1017 O ILE A 67 -2.466 -5.149 -11.780 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.629 -2.991 -12.976 1.00 0.00 C ATOM 1019 CG1 ILE A 67 0.643 -2.516 -13.678 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -0.396 -3.122 -11.478 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.077 -1.125 -13.267 1.00 0.00 C ATOM 0 H ILE A 67 -1.222 -3.328 -15.402 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.330 -5.073 -13.345 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.411 -2.249 -13.137 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.450 -3.217 -13.465 1.00 0.00 H new ATOM 0 HG13 ILE A 67 0.482 -2.534 -14.756 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.066 -2.164 -11.076 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.324 -3.420 -10.990 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.369 -3.876 -11.293 1.00 0.00 H new ATOM 0 HD11 ILE A 67 1.986 -0.854 -13.804 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.288 -0.412 -13.506 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.271 -1.106 -12.194 1.00 0.00 H new ATOM 1033 N SER A 68 -3.501 -4.665 -13.725 1.00 0.00 N ATOM 1034 CA SER A 68 -4.814 -5.062 -13.244 1.00 0.00 C ATOM 1035 C SER A 68 -4.818 -6.561 -12.998 1.00 0.00 C ATOM 1036 O SER A 68 -5.454 -7.053 -12.067 1.00 0.00 O ATOM 1037 CB SER A 68 -5.897 -4.688 -14.259 1.00 0.00 C ATOM 1038 OG SER A 68 -7.186 -4.757 -13.676 1.00 0.00 O ATOM 0 H SER A 68 -3.485 -4.332 -14.689 1.00 0.00 H new ATOM 0 HA SER A 68 -5.030 -4.537 -12.313 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.717 -3.680 -14.633 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.845 -5.360 -15.116 1.00 0.00 H new ATOM 0 HG SER A 68 -7.860 -4.512 -14.344 1.00 0.00 H new ATOM 1044 N GLU A 69 -4.072 -7.277 -13.835 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.953 -8.719 -13.707 1.00 0.00 C ATOM 1046 C GLU A 69 -2.939 -9.050 -12.623 1.00 0.00 C ATOM 1047 O GLU A 69 -3.169 -9.919 -11.783 1.00 0.00 O ATOM 1048 CB GLU A 69 -3.530 -9.345 -15.038 1.00 0.00 C ATOM 1049 CG GLU A 69 -4.296 -8.806 -16.235 1.00 0.00 C ATOM 1050 CD GLU A 69 -5.760 -9.197 -16.214 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -6.432 -8.928 -15.197 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -6.236 -9.773 -17.217 1.00 0.00 O ATOM 0 H GLU A 69 -3.542 -6.877 -14.609 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.923 -9.131 -13.431 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.465 -9.170 -15.190 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.671 -10.424 -14.983 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -4.214 -7.719 -16.255 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -3.838 -9.177 -17.152 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.821 -8.330 -12.639 1.00 0.00 N ATOM 1060 CA LEU A 70 -0.776 -8.529 -11.642 1.00 0.00 C ATOM 1061 C LEU A 70 -1.310 -8.228 -10.243 1.00 0.00 C ATOM 1062 O LEU A 70 -0.791 -8.732 -9.246 1.00 0.00 O ATOM 1063 CB LEU A 70 0.427 -7.630 -11.938 1.00 0.00 C ATOM 1064 CG LEU A 70 1.459 -8.221 -12.900 1.00 0.00 C ATOM 1065 CD1 LEU A 70 0.966 -8.119 -14.336 1.00 0.00 C ATOM 1066 CD2 LEU A 70 2.799 -7.516 -12.738 1.00 0.00 C ATOM 0 H LEU A 70 -1.617 -7.607 -13.329 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.459 -9.571 -11.686 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.064 -6.689 -12.352 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.924 -7.394 -10.997 1.00 0.00 H new ATOM 0 HG LEU A 70 1.596 -9.275 -12.660 1.00 0.00 H new ATOM 0 HD11 LEU A 70 1.712 -8.544 -15.008 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.030 -8.668 -14.439 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.803 -7.072 -14.591 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.523 -7.948 -13.429 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.680 -6.454 -12.953 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.155 -7.641 -11.715 1.00 0.00 H new ATOM 1078 N SER A 71 -2.349 -7.399 -10.178 1.00 0.00 N ATOM 1079 CA SER A 71 -2.957 -7.022 -8.906 1.00 0.00 C ATOM 1080 C SER A 71 -3.717 -8.186 -8.284 1.00 0.00 C ATOM 1081 O SER A 71 -3.871 -8.255 -7.069 1.00 0.00 O ATOM 1082 CB SER A 71 -3.917 -5.859 -9.102 1.00 0.00 C ATOM 1083 OG SER A 71 -3.680 -4.831 -8.158 1.00 0.00 O ATOM 0 H SER A 71 -2.788 -6.975 -10.995 1.00 0.00 H new ATOM 0 HA SER A 71 -2.149 -6.730 -8.235 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.808 -5.461 -10.111 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.944 -6.212 -9.008 1.00 0.00 H new ATOM 0 HG SER A 71 -4.097 -5.069 -7.304 1.00 0.00 H new ATOM 1089 N HIS A 72 -4.188 -9.101 -9.121 1.00 0.00 N ATOM 1090 CA HIS A 72 -4.925 -10.261 -8.634 1.00 0.00 C ATOM 1091 C HIS A 72 -4.061 -11.067 -7.676 1.00 0.00 C ATOM 1092 O HIS A 72 -4.549 -11.938 -6.954 1.00 0.00 O ATOM 1093 CB HIS A 72 -5.373 -11.139 -9.804 1.00 0.00 C ATOM 1094 CG HIS A 72 -6.498 -10.549 -10.596 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -6.503 -10.502 -11.976 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -7.660 -9.981 -10.198 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -7.619 -9.929 -12.390 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -8.338 -9.604 -11.332 1.00 0.00 N ATOM 0 H HIS A 72 -4.074 -9.064 -10.134 1.00 0.00 H new ATOM 0 HA HIS A 72 -5.810 -9.912 -8.102 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -4.524 -11.310 -10.466 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -5.680 -12.112 -9.421 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -7.992 -9.849 -9.179 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -7.896 -9.756 -13.419 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -9.250 -9.147 -11.353 1.00 0.00 H new ATOM 1107 N ASN A 73 -2.766 -10.774 -7.692 1.00 0.00 N ATOM 1108 CA ASN A 73 -1.806 -11.461 -6.853 1.00 0.00 C ATOM 1109 C ASN A 73 -1.558 -10.714 -5.540 1.00 0.00 C ATOM 1110 O ASN A 73 -1.029 -11.286 -4.586 1.00 0.00 O ATOM 1111 CB ASN A 73 -0.501 -11.610 -7.625 1.00 0.00 C ATOM 1112 CG ASN A 73 -0.722 -12.074 -9.053 1.00 0.00 C ATOM 1113 OD1 ASN A 73 -1.145 -13.204 -9.291 1.00 0.00 O ATOM 1114 ND2 ASN A 73 -0.437 -11.199 -10.012 1.00 0.00 N ATOM 0 H ASN A 73 -2.358 -10.054 -8.288 1.00 0.00 H new ATOM 0 HA ASN A 73 -2.209 -12.440 -6.594 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.024 -10.655 -7.634 1.00 0.00 H new ATOM 0 HB3 ASN A 73 0.143 -12.323 -7.110 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -0.567 -11.455 -10.991 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -0.088 -10.272 -9.769 1.00 0.00 H new ATOM 1121 N PHE A 74 -1.926 -9.436 -5.498 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.729 -8.612 -4.310 1.00 0.00 C ATOM 1123 C PHE A 74 -2.971 -7.768 -4.020 1.00 0.00 C ATOM 1124 O PHE A 74 -3.921 -7.758 -4.800 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.522 -7.696 -4.517 1.00 0.00 C ATOM 1126 CG PHE A 74 0.746 -8.200 -3.885 1.00 0.00 C ATOM 1127 CD1 PHE A 74 1.238 -9.457 -4.193 1.00 0.00 C ATOM 1128 CD2 PHE A 74 1.447 -7.414 -2.985 1.00 0.00 C ATOM 1129 CE1 PHE A 74 2.403 -9.920 -3.616 1.00 0.00 C ATOM 1130 CE2 PHE A 74 2.615 -7.873 -2.406 1.00 0.00 C ATOM 1131 CZ PHE A 74 3.093 -9.130 -2.722 1.00 0.00 C ATOM 0 H PHE A 74 -2.365 -8.947 -6.278 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.552 -9.269 -3.458 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.356 -7.567 -5.587 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.752 -6.712 -4.109 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.704 -10.082 -4.893 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.077 -6.431 -2.733 1.00 0.00 H new ATOM 0 HE1 PHE A 74 2.775 -10.903 -3.865 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.153 -7.250 -1.707 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.004 -9.492 -2.270 1.00 0.00 H new ATOM 1141 N VAL A 75 -2.962 -7.050 -2.899 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.092 -6.198 -2.537 1.00 0.00 C ATOM 1143 C VAL A 75 -3.603 -4.935 -1.836 1.00 0.00 C ATOM 1144 O VAL A 75 -2.975 -5.012 -0.788 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.097 -6.942 -1.631 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -4.544 -7.124 -0.225 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -6.427 -6.207 -1.588 1.00 0.00 C ATOM 0 H VAL A 75 -2.192 -7.041 -2.231 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.604 -5.924 -3.459 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.260 -7.931 -2.059 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.275 -7.651 0.388 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.622 -7.704 -0.269 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -4.338 -6.148 0.214 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.121 -6.748 -0.944 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.275 -5.202 -1.194 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -6.840 -6.143 -2.595 1.00 0.00 H new ATOM 1157 N MET A 76 -3.863 -3.773 -2.428 1.00 0.00 N ATOM 1158 CA MET A 76 -3.408 -2.520 -1.853 1.00 0.00 C ATOM 1159 C MET A 76 -4.578 -1.596 -1.503 1.00 0.00 C ATOM 1160 O MET A 76 -5.744 -1.987 -1.612 1.00 0.00 O ATOM 1161 CB MET A 76 -2.432 -1.844 -2.808 1.00 0.00 C ATOM 1162 CG MET A 76 -2.129 -2.682 -4.050 1.00 0.00 C ATOM 1163 SD MET A 76 -1.152 -4.153 -3.682 1.00 0.00 S ATOM 1164 CE MET A 76 -0.547 -4.570 -5.316 1.00 0.00 C ATOM 0 H MET A 76 -4.383 -3.677 -3.300 1.00 0.00 H new ATOM 0 HA MET A 76 -2.893 -2.737 -0.917 1.00 0.00 H new ATOM 0 HB2 MET A 76 -2.843 -0.883 -3.117 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.501 -1.638 -2.280 1.00 0.00 H new ATOM 0 HG2 MET A 76 -3.067 -2.982 -4.517 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.594 -2.068 -4.775 1.00 0.00 H new ATOM 0 HE1 MET A 76 0.467 -4.962 -5.239 1.00 0.00 H new ATOM 0 HE2 MET A 76 -1.195 -5.324 -5.762 1.00 0.00 H new ATOM 0 HE3 MET A 76 -0.545 -3.678 -5.942 1.00 0.00 H new ATOM 1174 N VAL A 77 -4.262 -0.382 -1.047 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.292 0.570 -0.642 1.00 0.00 C ATOM 1176 C VAL A 77 -4.912 2.016 -0.971 1.00 0.00 C ATOM 1177 O VAL A 77 -3.785 2.447 -0.725 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.570 0.419 0.874 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.992 1.729 1.529 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -6.614 -0.656 1.098 1.00 0.00 C ATOM 0 H VAL A 77 -3.306 -0.039 -0.950 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.195 0.343 -1.209 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.635 0.125 1.351 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -6.174 1.563 2.591 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.200 2.468 1.407 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.905 2.094 1.058 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -6.807 -0.759 2.166 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -7.537 -0.379 0.588 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.251 -1.604 0.702 1.00 0.00 H new ATOM 1190 N ASN A 78 -5.871 2.760 -1.529 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.655 4.154 -1.895 1.00 0.00 C ATOM 1192 C ASN A 78 -6.429 5.114 -1.001 1.00 0.00 C ATOM 1193 O ASN A 78 -7.661 5.128 -1.005 1.00 0.00 O ATOM 1194 CB ASN A 78 -6.083 4.386 -3.339 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.240 5.435 -4.038 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -5.764 6.320 -4.714 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -3.927 5.339 -3.879 1.00 0.00 N ATOM 0 H ASN A 78 -6.808 2.414 -1.736 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.590 4.352 -1.771 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -6.017 3.447 -3.889 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -7.128 4.694 -3.359 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -3.308 6.015 -4.326 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -3.536 4.589 -3.309 1.00 0.00 H new ATOM 1204 N LEU A 79 -5.697 5.941 -0.270 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.316 6.941 0.598 1.00 0.00 C ATOM 1206 C LEU A 79 -5.990 8.342 0.083 1.00 0.00 C ATOM 1207 O LEU A 79 -4.870 8.605 -0.351 1.00 0.00 O ATOM 1208 CB LEU A 79 -5.856 6.770 2.056 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.308 8.033 2.739 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -6.408 9.071 2.934 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -4.663 7.681 4.072 1.00 0.00 C ATOM 0 H LEU A 79 -4.677 5.943 -0.258 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.397 6.800 0.579 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.698 6.400 2.641 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -5.085 6.001 2.085 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.548 8.466 2.089 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -5.993 9.954 3.419 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.821 9.350 1.965 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -7.197 8.652 3.558 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.280 8.587 4.542 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.404 7.219 4.724 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.842 6.984 3.906 1.00 0.00 H new ATOM 1223 N GLU A 80 -6.971 9.235 0.129 1.00 0.00 N ATOM 1224 CA GLU A 80 -6.776 10.605 -0.333 1.00 0.00 C ATOM 1225 C GLU A 80 -8.054 11.417 -0.173 1.00 0.00 C ATOM 1226 O GLU A 80 -8.665 11.842 -1.156 1.00 0.00 O ATOM 1227 CB GLU A 80 -6.326 10.616 -1.796 1.00 0.00 C ATOM 1228 CG GLU A 80 -7.124 9.679 -2.685 1.00 0.00 C ATOM 1229 CD GLU A 80 -6.716 9.772 -4.143 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -6.939 10.837 -4.755 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -6.172 8.779 -4.671 1.00 0.00 O ATOM 0 H GLU A 80 -7.908 9.037 0.481 1.00 0.00 H new ATOM 0 HA GLU A 80 -5.998 11.062 0.279 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.409 11.631 -2.185 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -5.272 10.341 -1.845 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.991 8.654 -2.339 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -8.185 9.912 -2.593 1.00 0.00 H new ATOM 1238 N ASP A 81 -8.456 11.630 1.073 1.00 0.00 N ATOM 1239 CA ASP A 81 -9.663 12.394 1.366 1.00 0.00 C ATOM 1240 C ASP A 81 -9.419 13.386 2.497 1.00 0.00 C ATOM 1241 O ASP A 81 -9.387 14.596 2.277 1.00 0.00 O ATOM 1242 CB ASP A 81 -10.825 11.459 1.729 1.00 0.00 C ATOM 1243 CG ASP A 81 -10.364 10.181 2.407 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -9.602 9.417 1.781 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -10.768 9.946 3.566 1.00 0.00 O ATOM 0 H ASP A 81 -7.965 11.285 1.897 1.00 0.00 H new ATOM 0 HA ASP A 81 -9.930 12.951 0.468 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -11.516 11.985 2.388 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -11.377 11.206 0.824 1.00 0.00 H new ATOM 1250 N GLU A 82 -9.242 12.865 3.708 1.00 0.00 N ATOM 1251 CA GLU A 82 -8.994 13.708 4.872 1.00 0.00 C ATOM 1252 C GLU A 82 -7.751 14.565 4.655 1.00 0.00 C ATOM 1253 O GLU A 82 -7.694 15.716 5.087 1.00 0.00 O ATOM 1254 CB GLU A 82 -8.825 12.848 6.126 1.00 0.00 C ATOM 1255 CG GLU A 82 -9.849 11.731 6.241 1.00 0.00 C ATOM 1256 CD GLU A 82 -9.934 11.159 7.642 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -10.733 11.679 8.448 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -9.199 10.193 7.933 1.00 0.00 O ATOM 0 H GLU A 82 -9.266 11.865 3.908 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.853 14.365 5.009 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.825 12.414 6.127 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.896 13.487 7.006 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -10.828 12.109 5.947 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.592 10.935 5.543 1.00 0.00 H new ATOM 1265 N GLU A 83 -6.762 13.989 3.977 1.00 0.00 N ATOM 1266 CA GLU A 83 -5.513 14.688 3.685 1.00 0.00 C ATOM 1267 C GLU A 83 -4.702 14.960 4.952 1.00 0.00 C ATOM 1268 O GLU A 83 -3.683 15.647 4.903 1.00 0.00 O ATOM 1269 CB GLU A 83 -5.797 16.000 2.957 1.00 0.00 C ATOM 1270 CG GLU A 83 -6.576 15.824 1.664 1.00 0.00 C ATOM 1271 CD GLU A 83 -7.683 16.848 1.505 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -8.543 16.937 2.405 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -7.688 17.560 0.479 1.00 0.00 O ATOM 0 H GLU A 83 -6.802 13.035 3.618 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.919 14.038 3.043 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.356 16.660 3.621 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -4.851 16.495 2.737 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -5.892 15.900 0.819 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -7.006 14.823 1.637 1.00 0.00 H new ATOM 1280 N GLU A 84 -5.147 14.416 6.083 1.00 0.00 N ATOM 1281 CA GLU A 84 -4.444 14.608 7.344 1.00 0.00 C ATOM 1282 C GLU A 84 -4.907 13.594 8.387 1.00 0.00 C ATOM 1283 O GLU A 84 -5.841 13.852 9.146 1.00 0.00 O ATOM 1284 CB GLU A 84 -4.654 16.033 7.862 1.00 0.00 C ATOM 1285 CG GLU A 84 -3.435 16.926 7.700 1.00 0.00 C ATOM 1286 CD GLU A 84 -2.296 16.528 8.618 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -2.001 15.317 8.708 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -1.700 17.426 9.248 1.00 0.00 O ATOM 0 H GLU A 84 -5.987 13.842 6.149 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.380 14.453 7.164 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -5.495 16.482 7.334 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -4.925 15.991 8.917 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -3.094 16.886 6.665 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -3.716 17.959 7.903 1.00 0.00 H new ATOM 1295 N PRO A 85 -4.254 12.418 8.439 1.00 0.00 N ATOM 1296 CA PRO A 85 -4.600 11.365 9.395 1.00 0.00 C ATOM 1297 C PRO A 85 -4.084 11.665 10.798 1.00 0.00 C ATOM 1298 O PRO A 85 -3.671 12.786 11.091 1.00 0.00 O ATOM 1299 CB PRO A 85 -3.899 10.136 8.819 1.00 0.00 C ATOM 1300 CG PRO A 85 -2.710 10.684 8.108 1.00 0.00 C ATOM 1301 CD PRO A 85 -3.125 12.029 7.570 1.00 0.00 C ATOM 0 HA PRO A 85 -5.678 11.249 9.510 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -3.606 9.441 9.606 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -4.552 9.589 8.138 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -1.862 10.781 8.786 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -2.399 10.021 7.301 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -2.310 12.751 7.624 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -3.427 11.967 6.524 1.00 0.00 H new ATOM 1309 N LYS A 86 -4.112 10.656 11.662 1.00 0.00 N ATOM 1310 CA LYS A 86 -3.647 10.811 13.034 1.00 0.00 C ATOM 1311 C LYS A 86 -2.815 9.606 13.466 1.00 0.00 C ATOM 1312 O LYS A 86 -3.113 8.958 14.468 1.00 0.00 O ATOM 1313 CB LYS A 86 -4.836 10.993 13.979 1.00 0.00 C ATOM 1314 CG LYS A 86 -4.499 11.785 15.233 1.00 0.00 C ATOM 1315 CD LYS A 86 -5.447 12.958 15.427 1.00 0.00 C ATOM 1316 CE LYS A 86 -4.901 14.227 14.793 1.00 0.00 C ATOM 1317 NZ LYS A 86 -5.826 15.379 14.971 1.00 0.00 N ATOM 0 H LYS A 86 -4.452 9.722 11.435 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.017 11.699 13.081 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -5.640 11.499 13.445 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.213 10.012 14.269 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.548 11.129 16.102 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.475 12.152 15.168 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.417 12.720 14.990 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -5.610 13.123 16.492 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -3.934 14.466 15.235 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -4.732 14.058 13.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -5.417 16.225 14.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -6.741 15.161 14.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -5.967 15.557 15.986 1.00 0.00 H new ATOM 1331 N ASP A 87 -1.770 9.312 12.698 1.00 0.00 N ATOM 1332 CA ASP A 87 -0.895 8.184 13.001 1.00 0.00 C ATOM 1333 C ASP A 87 0.316 8.168 12.074 1.00 0.00 C ATOM 1334 O ASP A 87 0.338 8.849 11.048 1.00 0.00 O ATOM 1335 CB ASP A 87 -1.665 6.868 12.878 1.00 0.00 C ATOM 1336 CG ASP A 87 -1.332 5.900 13.998 1.00 0.00 C ATOM 1337 OD1 ASP A 87 -1.194 6.353 15.153 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -1.208 4.689 13.718 1.00 0.00 O ATOM 0 H ASP A 87 -1.509 9.837 11.864 1.00 0.00 H new ATOM 0 HA ASP A 87 -0.542 8.296 14.026 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -2.735 7.074 12.885 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.436 6.404 11.919 1.00 0.00 H new ATOM 1343 N GLU A 88 1.324 7.383 12.442 1.00 0.00 N ATOM 1344 CA GLU A 88 2.541 7.271 11.645 1.00 0.00 C ATOM 1345 C GLU A 88 2.404 6.188 10.576 1.00 0.00 C ATOM 1346 O GLU A 88 3.199 6.126 9.639 1.00 0.00 O ATOM 1347 CB GLU A 88 3.739 6.965 12.548 1.00 0.00 C ATOM 1348 CG GLU A 88 4.517 8.201 12.966 1.00 0.00 C ATOM 1349 CD GLU A 88 5.280 8.826 11.815 1.00 0.00 C ATOM 1350 OE1 GLU A 88 6.381 8.330 11.494 1.00 0.00 O ATOM 1351 OE2 GLU A 88 4.777 9.809 11.233 1.00 0.00 O ATOM 0 H GLU A 88 1.322 6.814 13.289 1.00 0.00 H new ATOM 0 HA GLU A 88 2.703 8.226 11.144 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.388 6.448 13.441 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.410 6.282 12.028 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.828 8.936 13.382 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.216 7.935 13.759 1.00 0.00 H new ATOM 1358 N ASP A 89 1.390 5.336 10.721 1.00 0.00 N ATOM 1359 CA ASP A 89 1.150 4.256 9.767 1.00 0.00 C ATOM 1360 C ASP A 89 1.101 4.780 8.331 1.00 0.00 C ATOM 1361 O ASP A 89 1.353 4.039 7.383 1.00 0.00 O ATOM 1362 CB ASP A 89 -0.160 3.539 10.107 1.00 0.00 C ATOM 1363 CG ASP A 89 0.070 2.158 10.688 1.00 0.00 C ATOM 1364 OD1 ASP A 89 0.738 2.058 11.739 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -0.420 1.174 10.093 1.00 0.00 O ATOM 0 H ASP A 89 0.722 5.373 11.491 1.00 0.00 H new ATOM 0 HA ASP A 89 1.979 3.552 9.840 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.726 4.140 10.819 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.769 3.455 9.207 1.00 0.00 H new ATOM 1370 N PHE A 90 0.774 6.059 8.179 1.00 0.00 N ATOM 1371 CA PHE A 90 0.689 6.676 6.858 1.00 0.00 C ATOM 1372 C PHE A 90 2.046 7.226 6.411 1.00 0.00 C ATOM 1373 O PHE A 90 2.248 7.530 5.227 1.00 0.00 O ATOM 1374 CB PHE A 90 -0.359 7.792 6.870 1.00 0.00 C ATOM 1375 CG PHE A 90 -1.640 7.398 7.547 1.00 0.00 C ATOM 1376 CD1 PHE A 90 -1.754 7.451 8.928 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -2.730 6.973 6.805 1.00 0.00 C ATOM 1378 CE1 PHE A 90 -2.932 7.087 9.554 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -3.910 6.609 7.425 1.00 0.00 C ATOM 1380 CZ PHE A 90 -4.011 6.666 8.801 1.00 0.00 C ATOM 0 H PHE A 90 0.563 6.689 8.953 1.00 0.00 H new ATOM 0 HA PHE A 90 0.389 5.909 6.144 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.056 8.665 7.374 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.575 8.089 5.844 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.914 7.780 9.521 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.657 6.926 5.729 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -3.008 7.132 10.630 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.752 6.280 6.834 1.00 0.00 H new ATOM 0 HZ PHE A 90 -4.932 6.382 9.288 1.00 0.00 H new ATOM 1390 N SER A 91 2.976 7.347 7.360 1.00 0.00 N ATOM 1391 CA SER A 91 4.313 7.852 7.066 1.00 0.00 C ATOM 1392 C SER A 91 5.328 7.345 8.089 1.00 0.00 C ATOM 1393 O SER A 91 5.565 7.986 9.113 1.00 0.00 O ATOM 1394 CB SER A 91 4.316 9.381 7.040 1.00 0.00 C ATOM 1395 OG SER A 91 3.004 9.892 6.882 1.00 0.00 O ATOM 0 H SER A 91 2.825 7.101 8.338 1.00 0.00 H new ATOM 0 HA SER A 91 4.601 7.481 6.082 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.749 9.762 7.965 1.00 0.00 H new ATOM 0 HB3 SER A 91 4.947 9.732 6.224 1.00 0.00 H new ATOM 0 HG SER A 91 3.034 10.871 6.870 1.00 0.00 H new ATOM 1401 N PRO A 92 5.938 6.179 7.820 1.00 0.00 N ATOM 1402 CA PRO A 92 6.929 5.578 8.721 1.00 0.00 C ATOM 1403 C PRO A 92 8.254 6.340 8.743 1.00 0.00 C ATOM 1404 O PRO A 92 8.727 6.741 9.806 1.00 0.00 O ATOM 1405 CB PRO A 92 7.128 4.175 8.145 1.00 0.00 C ATOM 1406 CG PRO A 92 6.773 4.300 6.702 1.00 0.00 C ATOM 1407 CD PRO A 92 5.703 5.351 6.622 1.00 0.00 C ATOM 0 HA PRO A 92 6.588 5.588 9.756 1.00 0.00 H new ATOM 0 HB2 PRO A 92 8.157 3.838 8.271 1.00 0.00 H new ATOM 0 HB3 PRO A 92 6.491 3.447 8.647 1.00 0.00 H new ATOM 0 HG2 PRO A 92 7.643 4.585 6.111 1.00 0.00 H new ATOM 0 HG3 PRO A 92 6.415 3.350 6.306 1.00 0.00 H new ATOM 0 HD2 PRO A 92 5.785 5.938 5.707 1.00 0.00 H new ATOM 0 HD3 PRO A 92 4.706 4.910 6.629 1.00 0.00 H new ATOM 1415 N ASP A 93 8.855 6.532 7.569 1.00 0.00 N ATOM 1416 CA ASP A 93 10.128 7.241 7.473 1.00 0.00 C ATOM 1417 C ASP A 93 9.991 8.519 6.645 1.00 0.00 C ATOM 1418 O ASP A 93 10.568 9.552 6.981 1.00 0.00 O ATOM 1419 CB ASP A 93 11.207 6.326 6.869 1.00 0.00 C ATOM 1420 CG ASP A 93 11.159 6.257 5.352 1.00 0.00 C ATOM 1421 OD1 ASP A 93 11.384 7.298 4.700 1.00 0.00 O ATOM 1422 OD2 ASP A 93 10.907 5.157 4.818 1.00 0.00 O ATOM 0 H ASP A 93 8.482 6.208 6.676 1.00 0.00 H new ATOM 0 HA ASP A 93 10.430 7.525 8.481 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.190 6.682 7.178 1.00 0.00 H new ATOM 0 HB3 ASP A 93 11.090 5.321 7.275 1.00 0.00 H new ATOM 1427 N GLY A 94 9.231 8.435 5.559 1.00 0.00 N ATOM 1428 CA GLY A 94 9.040 9.582 4.699 1.00 0.00 C ATOM 1429 C GLY A 94 8.194 10.659 5.342 1.00 0.00 C ATOM 1430 O GLY A 94 7.125 10.383 5.886 1.00 0.00 O ATOM 0 H GLY A 94 8.744 7.590 5.260 1.00 0.00 H new ATOM 0 HA2 GLY A 94 10.012 9.999 4.435 1.00 0.00 H new ATOM 0 HA3 GLY A 94 8.568 9.260 3.771 1.00 0.00 H new ATOM 1434 N GLY A 95 8.677 11.893 5.270 1.00 0.00 N ATOM 1435 CA GLY A 95 7.952 13.012 5.846 1.00 0.00 C ATOM 1436 C GLY A 95 6.772 13.446 4.991 1.00 0.00 C ATOM 1437 O GLY A 95 6.055 14.381 5.345 1.00 0.00 O ATOM 0 H GLY A 95 9.559 12.140 4.822 1.00 0.00 H new ATOM 0 HA2 GLY A 95 7.595 12.737 6.838 1.00 0.00 H new ATOM 0 HA3 GLY A 95 8.632 13.854 5.974 1.00 0.00 H new ATOM 1441 N TYR A 96 6.571 12.764 3.864 1.00 0.00 N ATOM 1442 CA TYR A 96 5.471 13.075 2.953 1.00 0.00 C ATOM 1443 C TYR A 96 4.134 13.088 3.690 1.00 0.00 C ATOM 1444 O TYR A 96 4.090 12.970 4.915 1.00 0.00 O ATOM 1445 CB TYR A 96 5.436 12.048 1.819 1.00 0.00 C ATOM 1446 CG TYR A 96 5.636 10.619 2.286 1.00 0.00 C ATOM 1447 CD1 TYR A 96 4.955 10.130 3.394 1.00 0.00 C ATOM 1448 CD2 TYR A 96 6.503 9.759 1.620 1.00 0.00 C ATOM 1449 CE1 TYR A 96 5.131 8.832 3.825 1.00 0.00 C ATOM 1450 CE2 TYR A 96 6.684 8.455 2.049 1.00 0.00 C ATOM 1451 CZ TYR A 96 5.996 7.998 3.153 1.00 0.00 C ATOM 1452 OH TYR A 96 6.169 6.704 3.588 1.00 0.00 O ATOM 0 H TYR A 96 7.159 11.988 3.559 1.00 0.00 H new ATOM 0 HA TYR A 96 5.637 14.069 2.538 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.479 12.122 1.303 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.210 12.295 1.092 1.00 0.00 H new ATOM 0 HD1 TYR A 96 4.276 10.778 3.927 1.00 0.00 H new ATOM 0 HD2 TYR A 96 7.043 10.114 0.755 1.00 0.00 H new ATOM 0 HE1 TYR A 96 4.591 8.470 4.688 1.00 0.00 H new ATOM 0 HE2 TYR A 96 7.361 7.799 1.521 1.00 0.00 H new ATOM 0 HH TYR A 96 7.027 6.628 4.056 1.00 0.00 H new ATOM 1462 N ILE A 97 3.042 13.228 2.942 1.00 0.00 N ATOM 1463 CA ILE A 97 1.715 13.249 3.543 1.00 0.00 C ATOM 1464 C ILE A 97 0.627 12.742 2.550 1.00 0.00 C ATOM 1465 O ILE A 97 -0.268 13.571 2.387 1.00 0.00 O ATOM 1466 CB ILE A 97 1.338 14.663 3.994 1.00 0.00 C ATOM 1467 CG1 ILE A 97 1.513 15.645 2.833 1.00 0.00 C ATOM 1468 CG2 ILE A 97 2.176 15.084 5.188 1.00 0.00 C ATOM 1469 CD1 ILE A 97 0.387 16.643 2.705 1.00 0.00 C ATOM 0 H ILE A 97 3.051 13.328 1.927 1.00 0.00 H new ATOM 0 HA ILE A 97 1.754 12.583 4.405 1.00 0.00 H new ATOM 0 HB ILE A 97 0.292 14.668 4.300 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.451 16.184 2.964 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.595 15.083 1.903 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.893 16.091 5.494 1.00 0.00 H new ATOM 0 HG22 ILE A 97 2.006 14.393 6.014 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.231 15.070 4.915 1.00 0.00 H new ATOM 0 HD11 ILE A 97 0.581 17.305 1.861 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.552 16.114 2.542 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.317 17.232 3.619 1.00 0.00 H new ATOM 1481 N PRO A 98 0.218 11.473 2.803 1.00 0.00 N ATOM 1482 CA PRO A 98 0.878 10.150 3.050 1.00 0.00 C ATOM 1483 C PRO A 98 1.246 9.482 1.735 1.00 0.00 C ATOM 1484 O PRO A 98 0.821 9.932 0.663 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.143 9.334 3.819 1.00 0.00 C ATOM 1486 CG PRO A 98 -0.577 10.348 4.738 1.00 0.00 C ATOM 1487 CD PRO A 98 0.326 11.462 4.329 1.00 0.00 C ATOM 0 HA PRO A 98 1.809 10.251 3.608 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.950 8.962 3.187 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.295 8.470 4.318 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.631 10.598 4.617 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -0.436 10.057 5.779 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.010 12.412 4.760 1.00 0.00 H new ATOM 0 HD3 PRO A 98 1.351 11.288 4.657 1.00 0.00 H new ATOM 1495 N ARG A 99 2.080 8.442 1.835 1.00 0.00 N ATOM 1496 CA ARG A 99 2.600 7.722 0.686 1.00 0.00 C ATOM 1497 C ARG A 99 2.297 6.227 0.743 1.00 0.00 C ATOM 1498 O ARG A 99 1.459 5.776 1.522 1.00 0.00 O ATOM 1499 CB ARG A 99 4.104 7.947 0.621 1.00 0.00 C ATOM 1500 CG ARG A 99 4.546 8.784 -0.558 1.00 0.00 C ATOM 1501 CD ARG A 99 3.950 10.180 -0.514 1.00 0.00 C ATOM 1502 NE ARG A 99 3.448 10.597 -1.822 1.00 0.00 N ATOM 1503 CZ ARG A 99 3.510 11.845 -2.281 1.00 0.00 C ATOM 1504 NH1 ARG A 99 4.012 12.820 -1.530 1.00 0.00 N ATOM 1505 NH2 ARG A 99 3.062 12.122 -3.499 1.00 0.00 N ATOM 0 H ARG A 99 2.412 8.079 2.729 1.00 0.00 H new ATOM 0 HA ARG A 99 2.109 8.104 -0.209 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.429 8.432 1.541 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.605 6.980 0.576 1.00 0.00 H new ATOM 0 HG2 ARG A 99 5.634 8.853 -0.567 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.250 8.292 -1.484 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.138 10.206 0.212 1.00 0.00 H new ATOM 0 HD3 ARG A 99 4.706 10.887 -0.172 1.00 0.00 H new ATOM 0 HE ARG A 99 3.024 9.888 -2.420 1.00 0.00 H new ATOM 0 HH11 ARG A 99 4.355 12.616 -0.591 1.00 0.00 H new ATOM 0 HH12 ARG A 99 4.054 13.773 -1.892 1.00 0.00 H new ATOM 0 HH21 ARG A 99 2.672 11.380 -4.080 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.108 13.077 -3.854 1.00 0.00 H new ATOM 1519 N ILE A 100 2.976 5.478 -0.125 1.00 0.00 N ATOM 1520 CA ILE A 100 2.796 4.032 -0.232 1.00 0.00 C ATOM 1521 C ILE A 100 3.657 3.250 0.765 1.00 0.00 C ATOM 1522 O ILE A 100 4.854 3.494 0.887 1.00 0.00 O ATOM 1523 CB ILE A 100 3.160 3.558 -1.651 1.00 0.00 C ATOM 1524 CG1 ILE A 100 2.386 4.360 -2.698 1.00 0.00 C ATOM 1525 CG2 ILE A 100 2.893 2.068 -1.804 1.00 0.00 C ATOM 1526 CD1 ILE A 100 3.258 5.271 -3.532 1.00 0.00 C ATOM 0 H ILE A 100 3.666 5.857 -0.773 1.00 0.00 H new ATOM 0 HA ILE A 100 1.747 3.837 -0.007 1.00 0.00 H new ATOM 0 HB ILE A 100 4.225 3.729 -1.809 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.862 3.669 -3.358 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.626 4.959 -2.196 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.157 1.753 -2.814 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.494 1.515 -1.083 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.837 1.867 -1.626 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.640 5.807 -4.252 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.762 5.987 -2.883 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.002 4.677 -4.063 1.00 0.00 H new ATOM 1538 N LEU A 101 3.042 2.279 1.444 1.00 0.00 N ATOM 1539 CA LEU A 101 3.759 1.428 2.396 1.00 0.00 C ATOM 1540 C LEU A 101 3.084 0.068 2.530 1.00 0.00 C ATOM 1541 O LEU A 101 1.866 -0.022 2.693 1.00 0.00 O ATOM 1542 CB LEU A 101 3.901 2.092 3.774 1.00 0.00 C ATOM 1543 CG LEU A 101 2.775 3.038 4.190 1.00 0.00 C ATOM 1544 CD1 LEU A 101 2.853 4.330 3.405 1.00 0.00 C ATOM 1545 CD2 LEU A 101 1.422 2.373 4.004 1.00 0.00 C ATOM 0 H LEU A 101 2.049 2.063 1.352 1.00 0.00 H new ATOM 0 HA LEU A 101 4.763 1.283 1.996 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.983 1.307 4.525 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.838 2.648 3.791 1.00 0.00 H new ATOM 0 HG LEU A 101 2.894 3.273 5.248 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.044 4.992 3.713 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.811 4.814 3.595 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.760 4.115 2.340 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.633 3.062 4.306 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.289 2.106 2.956 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.371 1.473 4.617 1.00 0.00 H new ATOM 1557 N PHE A 102 3.888 -0.993 2.449 1.00 0.00 N ATOM 1558 CA PHE A 102 3.374 -2.354 2.554 1.00 0.00 C ATOM 1559 C PHE A 102 3.175 -2.744 4.015 1.00 0.00 C ATOM 1560 O PHE A 102 3.756 -2.134 4.914 1.00 0.00 O ATOM 1561 CB PHE A 102 4.340 -3.331 1.880 1.00 0.00 C ATOM 1562 CG PHE A 102 3.864 -3.841 0.550 1.00 0.00 C ATOM 1563 CD1 PHE A 102 2.662 -4.521 0.442 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.625 -3.645 -0.591 1.00 0.00 C ATOM 1565 CE1 PHE A 102 2.227 -4.994 -0.782 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.194 -4.116 -1.817 1.00 0.00 C ATOM 1567 CZ PHE A 102 2.994 -4.791 -1.913 1.00 0.00 C ATOM 0 H PHE A 102 4.897 -0.933 2.311 1.00 0.00 H new ATOM 0 HA PHE A 102 2.409 -2.398 2.050 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.303 -2.839 1.745 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.506 -4.179 2.545 1.00 0.00 H new ATOM 0 HD1 PHE A 102 2.059 -4.683 1.323 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.565 -3.118 -0.522 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.288 -5.522 -0.854 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.796 -3.956 -2.699 1.00 0.00 H new ATOM 0 HZ PHE A 102 2.655 -5.160 -2.870 1.00 0.00 H new ATOM 1577 N LEU A 103 2.354 -3.762 4.252 1.00 0.00 N ATOM 1578 CA LEU A 103 2.098 -4.218 5.613 1.00 0.00 C ATOM 1579 C LEU A 103 1.675 -5.668 5.662 1.00 0.00 C ATOM 1580 O LEU A 103 1.441 -6.304 4.631 1.00 0.00 O ATOM 1581 CB LEU A 103 1.010 -3.384 6.275 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.123 -2.923 5.367 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.142 -4.033 5.194 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.786 -1.675 5.921 1.00 0.00 C ATOM 0 H LEU A 103 1.859 -4.282 3.527 1.00 0.00 H new ATOM 0 HA LEU A 103 3.040 -4.104 6.149 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.581 -3.965 7.092 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.474 -2.504 6.719 1.00 0.00 H new ATOM 0 HG LEU A 103 0.297 -2.679 4.391 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.946 -3.690 4.543 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.660 -4.903 4.748 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.553 -4.304 6.166 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.592 -1.365 5.255 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.193 -1.888 6.909 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.050 -0.875 5.997 1.00 0.00 H new ATOM 1596 N ASP A 104 1.541 -6.172 6.887 1.00 0.00 N ATOM 1597 CA ASP A 104 1.107 -7.540 7.102 1.00 0.00 C ATOM 1598 C ASP A 104 -0.280 -7.721 6.503 1.00 0.00 C ATOM 1599 O ASP A 104 -1.202 -6.978 6.855 1.00 0.00 O ATOM 1600 CB ASP A 104 1.090 -7.869 8.594 1.00 0.00 C ATOM 1601 CG ASP A 104 2.225 -8.789 8.995 1.00 0.00 C ATOM 1602 OD1 ASP A 104 2.042 -10.023 8.930 1.00 0.00 O ATOM 1603 OD2 ASP A 104 3.300 -8.277 9.376 1.00 0.00 O ATOM 0 H ASP A 104 1.728 -5.649 7.742 1.00 0.00 H new ATOM 0 HA ASP A 104 1.805 -8.221 6.615 1.00 0.00 H new ATOM 0 HB2 ASP A 104 1.155 -6.945 9.168 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.139 -8.337 8.849 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.429 -8.691 5.571 1.00 0.00 N ATOM 1609 CA PRO A 105 -1.692 -8.976 4.875 1.00 0.00 C ATOM 1610 C PRO A 105 -2.927 -8.917 5.765 1.00 0.00 C ATOM 1611 O PRO A 105 -3.326 -9.924 6.349 1.00 0.00 O ATOM 1612 CB PRO A 105 -1.479 -10.401 4.372 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.019 -10.481 4.094 1.00 0.00 C ATOM 1614 CD PRO A 105 0.654 -9.582 5.098 1.00 0.00 C ATOM 0 HA PRO A 105 -1.891 -8.233 4.103 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -1.782 -11.135 5.118 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.066 -10.598 3.475 1.00 0.00 H new ATOM 0 HG2 PRO A 105 0.339 -11.506 4.189 1.00 0.00 H new ATOM 0 HG3 PRO A 105 0.201 -10.160 3.076 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.086 -10.155 5.919 1.00 0.00 H new ATOM 0 HD3 PRO A 105 1.466 -9.015 4.643 1.00 0.00 H new ATOM 1622 N SER A 106 -3.530 -7.733 5.861 1.00 0.00 N ATOM 1623 CA SER A 106 -4.725 -7.541 6.675 1.00 0.00 C ATOM 1624 C SER A 106 -4.314 -7.431 8.124 1.00 0.00 C ATOM 1625 O SER A 106 -4.943 -7.992 9.021 1.00 0.00 O ATOM 1626 CB SER A 106 -5.725 -8.689 6.477 1.00 0.00 C ATOM 1627 OG SER A 106 -5.507 -9.733 7.411 1.00 0.00 O ATOM 0 H SER A 106 -3.208 -6.891 5.383 1.00 0.00 H new ATOM 0 HA SER A 106 -5.226 -6.624 6.365 1.00 0.00 H new ATOM 0 HB2 SER A 106 -6.742 -8.310 6.583 1.00 0.00 H new ATOM 0 HB3 SER A 106 -5.635 -9.081 5.464 1.00 0.00 H new ATOM 0 HG SER A 106 -4.576 -10.035 7.353 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.228 -6.710 8.329 1.00 0.00 N ATOM 1634 CA GLY A 107 -2.697 -6.530 9.646 1.00 0.00 C ATOM 1635 C GLY A 107 -2.408 -5.084 9.959 1.00 0.00 C ATOM 1636 O GLY A 107 -3.157 -4.451 10.703 1.00 0.00 O ATOM 0 H GLY A 107 -2.702 -6.242 7.591 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.405 -6.922 10.376 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -1.780 -7.111 9.747 1.00 0.00 H new ATOM 1640 N LYS A 108 -1.326 -4.547 9.396 1.00 0.00 N ATOM 1641 CA LYS A 108 -0.987 -3.137 9.664 1.00 0.00 C ATOM 1642 C LYS A 108 0.315 -2.669 9.008 1.00 0.00 C ATOM 1643 O LYS A 108 1.301 -3.409 8.952 1.00 0.00 O ATOM 1644 CB LYS A 108 -0.894 -2.895 11.173 1.00 0.00 C ATOM 1645 CG LYS A 108 0.007 -3.888 11.892 1.00 0.00 C ATOM 1646 CD LYS A 108 -0.790 -4.806 12.806 1.00 0.00 C ATOM 1647 CE LYS A 108 -0.974 -4.193 14.185 1.00 0.00 C ATOM 1648 NZ LYS A 108 -1.970 -3.087 14.172 1.00 0.00 N ATOM 0 H LYS A 108 -0.686 -5.039 8.773 1.00 0.00 H new ATOM 0 HA LYS A 108 -1.794 -2.554 9.219 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.522 -1.886 11.349 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -1.894 -2.946 11.604 1.00 0.00 H new ATOM 0 HG2 LYS A 108 0.550 -4.485 11.159 1.00 0.00 H new ATOM 0 HG3 LYS A 108 0.751 -3.348 12.477 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -1.765 -5.006 12.362 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -0.279 -5.764 12.897 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.297 -4.964 14.885 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -0.017 -3.816 14.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -2.231 -2.844 15.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -1.557 -2.254 13.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -2.818 -3.390 13.652 1.00 0.00 H new ATOM 1662 N VAL A 109 0.308 -1.409 8.553 1.00 0.00 N ATOM 1663 CA VAL A 109 1.463 -0.771 7.938 1.00 0.00 C ATOM 1664 C VAL A 109 2.740 -1.057 8.706 1.00 0.00 C ATOM 1665 O VAL A 109 3.025 -0.428 9.724 1.00 0.00 O ATOM 1666 CB VAL A 109 1.284 0.758 7.861 1.00 0.00 C ATOM 1667 CG1 VAL A 109 2.346 1.348 6.965 1.00 0.00 C ATOM 1668 CG2 VAL A 109 -0.107 1.142 7.365 1.00 0.00 C ATOM 0 H VAL A 109 -0.512 -0.804 8.605 1.00 0.00 H new ATOM 0 HA VAL A 109 1.541 -1.188 6.934 1.00 0.00 H new ATOM 0 HB VAL A 109 1.391 1.163 8.867 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.218 2.429 6.912 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.332 1.119 7.370 1.00 0.00 H new ATOM 0 HG13 VAL A 109 2.256 0.922 5.966 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -0.192 2.228 7.325 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -0.265 0.729 6.369 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.859 0.744 8.046 1.00 0.00 H new ATOM 1678 N HIS A 110 3.521 -1.987 8.186 1.00 0.00 N ATOM 1679 CA HIS A 110 4.787 -2.335 8.794 1.00 0.00 C ATOM 1680 C HIS A 110 5.906 -1.680 7.999 1.00 0.00 C ATOM 1681 O HIS A 110 6.063 -1.954 6.808 1.00 0.00 O ATOM 1682 CB HIS A 110 4.971 -3.855 8.821 1.00 0.00 C ATOM 1683 CG HIS A 110 4.701 -4.466 10.162 1.00 0.00 C ATOM 1684 ND1 HIS A 110 3.528 -5.125 10.467 1.00 0.00 N ATOM 1685 CD2 HIS A 110 5.461 -4.514 11.283 1.00 0.00 C ATOM 1686 CE1 HIS A 110 3.578 -5.550 11.717 1.00 0.00 C ATOM 1687 NE2 HIS A 110 4.739 -5.194 12.233 1.00 0.00 N ATOM 0 H HIS A 110 3.298 -2.514 7.342 1.00 0.00 H new ATOM 0 HA HIS A 110 4.808 -1.977 9.823 1.00 0.00 H new ATOM 0 HB2 HIS A 110 4.306 -4.307 8.084 1.00 0.00 H new ATOM 0 HB3 HIS A 110 5.991 -4.095 8.520 1.00 0.00 H new ATOM 0 HD2 HIS A 110 6.449 -4.096 11.406 1.00 0.00 H new ATOM 0 HE1 HIS A 110 2.800 -6.096 12.230 1.00 0.00 H new ATOM 0 HE2 HIS A 110 5.050 -5.392 13.184 1.00 0.00 H new ATOM 1696 N PRO A 111 6.696 -0.795 8.628 1.00 0.00 N ATOM 1697 CA PRO A 111 7.794 -0.106 7.947 1.00 0.00 C ATOM 1698 C PRO A 111 8.917 -1.063 7.575 1.00 0.00 C ATOM 1699 O PRO A 111 10.096 -0.760 7.757 1.00 0.00 O ATOM 1700 CB PRO A 111 8.276 0.916 8.980 1.00 0.00 C ATOM 1701 CG PRO A 111 7.855 0.357 10.294 1.00 0.00 C ATOM 1702 CD PRO A 111 6.578 -0.394 10.038 1.00 0.00 C ATOM 0 HA PRO A 111 7.476 0.347 7.008 1.00 0.00 H new ATOM 0 HB2 PRO A 111 9.357 1.045 8.933 1.00 0.00 H new ATOM 0 HB3 PRO A 111 7.830 1.895 8.806 1.00 0.00 H new ATOM 0 HG2 PRO A 111 8.621 -0.304 10.700 1.00 0.00 H new ATOM 0 HG3 PRO A 111 7.700 1.152 11.024 1.00 0.00 H new ATOM 0 HD2 PRO A 111 6.481 -1.258 10.695 1.00 0.00 H new ATOM 0 HD3 PRO A 111 5.702 0.233 10.206 1.00 0.00 H new ATOM 1710 N GLU A 112 8.536 -2.226 7.063 1.00 0.00 N ATOM 1711 CA GLU A 112 9.505 -3.245 6.671 1.00 0.00 C ATOM 1712 C GLU A 112 9.688 -3.279 5.158 1.00 0.00 C ATOM 1713 O GLU A 112 10.815 -3.279 4.661 1.00 0.00 O ATOM 1714 CB GLU A 112 9.056 -4.619 7.172 1.00 0.00 C ATOM 1715 CG GLU A 112 9.482 -4.916 8.600 1.00 0.00 C ATOM 1716 CD GLU A 112 8.838 -6.173 9.150 1.00 0.00 C ATOM 1717 OE1 GLU A 112 7.601 -6.180 9.319 1.00 0.00 O ATOM 1718 OE2 GLU A 112 9.571 -7.150 9.412 1.00 0.00 O ATOM 0 H GLU A 112 7.563 -2.489 6.909 1.00 0.00 H new ATOM 0 HA GLU A 112 10.463 -2.991 7.125 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.970 -4.684 7.105 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.462 -5.387 6.514 1.00 0.00 H new ATOM 0 HG2 GLU A 112 10.566 -5.021 8.637 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.222 -4.070 9.236 1.00 0.00 H new ATOM 1725 N ILE A 113 8.578 -3.319 4.430 1.00 0.00 N ATOM 1726 CA ILE A 113 8.625 -3.363 2.974 1.00 0.00 C ATOM 1727 C ILE A 113 8.478 -1.968 2.367 1.00 0.00 C ATOM 1728 O ILE A 113 7.371 -1.424 2.274 1.00 0.00 O ATOM 1729 CB ILE A 113 7.531 -4.291 2.407 1.00 0.00 C ATOM 1730 CG1 ILE A 113 7.666 -5.695 3.000 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.607 -4.345 0.886 1.00 0.00 C ATOM 1732 CD1 ILE A 113 9.037 -6.306 2.803 1.00 0.00 C ATOM 0 H ILE A 113 7.637 -3.322 4.823 1.00 0.00 H new ATOM 0 HA ILE A 113 9.602 -3.761 2.701 1.00 0.00 H new ATOM 0 HB ILE A 113 6.558 -3.887 2.686 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.446 -5.653 4.067 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.919 -6.346 2.546 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.827 -5.005 0.506 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.466 -3.344 0.479 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.583 -4.725 0.584 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.060 -7.301 3.248 1.00 0.00 H new ATOM 0 HD12 ILE A 113 9.252 -6.381 1.737 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.788 -5.677 3.281 1.00 0.00 H new ATOM 1744 N ILE A 114 9.611 -1.406 1.951 1.00 0.00 N ATOM 1745 CA ILE A 114 9.649 -0.082 1.342 1.00 0.00 C ATOM 1746 C ILE A 114 9.469 -0.175 -0.170 1.00 0.00 C ATOM 1747 O ILE A 114 9.105 -1.228 -0.696 1.00 0.00 O ATOM 1748 CB ILE A 114 10.981 0.636 1.653 1.00 0.00 C ATOM 1749 CG1 ILE A 114 12.169 -0.158 1.079 1.00 0.00 C ATOM 1750 CG2 ILE A 114 11.133 0.853 3.154 1.00 0.00 C ATOM 1751 CD1 ILE A 114 12.783 -1.160 2.038 1.00 0.00 C ATOM 0 H ILE A 114 10.524 -1.855 2.027 1.00 0.00 H new ATOM 0 HA ILE A 114 8.828 0.495 1.767 1.00 0.00 H new ATOM 0 HB ILE A 114 10.971 1.615 1.173 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.837 -0.687 0.185 1.00 0.00 H new ATOM 0 HG13 ILE A 114 12.941 0.545 0.766 1.00 0.00 H new ATOM 0 HG21 ILE A 114 12.077 1.360 3.355 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.308 1.465 3.519 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.123 -0.110 3.664 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.612 -1.672 1.548 1.00 0.00 H new ATOM 0 HD12 ILE A 114 13.150 -0.639 2.923 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.029 -1.890 2.333 1.00 0.00 H new ATOM 1763 N ASN A 115 9.727 0.927 -0.866 1.00 0.00 N ATOM 1764 CA ASN A 115 9.595 0.964 -2.318 1.00 0.00 C ATOM 1765 C ASN A 115 10.883 0.511 -2.996 1.00 0.00 C ATOM 1766 O ASN A 115 10.859 -0.029 -4.103 1.00 0.00 O ATOM 1767 CB ASN A 115 9.237 2.375 -2.775 1.00 0.00 C ATOM 1768 CG ASN A 115 8.880 2.433 -4.248 1.00 0.00 C ATOM 1769 OD1 ASN A 115 8.605 3.632 -4.743 1.00 0.00 O flip ATOM 1770 ND2 ASN A 115 8.851 1.409 -4.932 1.00 0.00 N flip ATOM 0 H ASN A 115 10.029 1.807 -0.448 1.00 0.00 H new ATOM 0 HA ASN A 115 8.797 0.278 -2.604 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.397 2.743 -2.186 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.078 3.041 -2.581 1.00 0.00 H new ATOM 0 HD21 ASN A 115 9.070 0.507 -4.509 1.00 0.00 H new ATOM 0 HD22 ASN A 115 8.608 1.463 -5.921 1.00 0.00 H new ATOM 1777 N GLU A 116 12.012 0.740 -2.328 1.00 0.00 N ATOM 1778 CA GLU A 116 13.320 0.362 -2.862 1.00 0.00 C ATOM 1779 C GLU A 116 13.751 1.310 -3.978 1.00 0.00 C ATOM 1780 O GLU A 116 14.783 1.975 -3.876 1.00 0.00 O ATOM 1781 CB GLU A 116 13.297 -1.082 -3.374 1.00 0.00 C ATOM 1782 CG GLU A 116 14.423 -1.936 -2.819 1.00 0.00 C ATOM 1783 CD GLU A 116 15.773 -1.578 -3.413 1.00 0.00 C ATOM 1784 OE1 GLU A 116 16.426 -0.654 -2.887 1.00 0.00 O ATOM 1785 OE2 GLU A 116 16.174 -2.223 -4.405 1.00 0.00 O ATOM 0 H GLU A 116 12.047 1.187 -1.412 1.00 0.00 H new ATOM 0 HA GLU A 116 14.046 0.435 -2.052 1.00 0.00 H new ATOM 0 HB2 GLU A 116 12.342 -1.538 -3.112 1.00 0.00 H new ATOM 0 HB3 GLU A 116 13.359 -1.075 -4.462 1.00 0.00 H new ATOM 0 HG2 GLU A 116 14.464 -1.818 -1.736 1.00 0.00 H new ATOM 0 HG3 GLU A 116 14.210 -2.986 -3.018 1.00 0.00 H new ATOM 1792 N ASN A 117 12.959 1.367 -5.044 1.00 0.00 N ATOM 1793 CA ASN A 117 13.263 2.235 -6.178 1.00 0.00 C ATOM 1794 C ASN A 117 13.004 3.706 -5.844 1.00 0.00 C ATOM 1795 O ASN A 117 13.314 4.592 -6.641 1.00 0.00 O ATOM 1796 CB ASN A 117 12.430 1.825 -7.394 1.00 0.00 C ATOM 1797 CG ASN A 117 13.198 0.924 -8.342 1.00 0.00 C ATOM 1798 OD1 ASN A 117 13.345 1.365 -9.586 1.00 0.00 O flip ATOM 1799 ND2 ASN A 117 13.653 -0.154 -7.960 1.00 0.00 N flip ATOM 0 H ASN A 117 12.102 0.823 -5.147 1.00 0.00 H new ATOM 0 HA ASN A 117 14.322 2.122 -6.408 1.00 0.00 H new ATOM 0 HB2 ASN A 117 11.529 1.311 -7.058 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.107 2.719 -7.928 1.00 0.00 H new ATOM 0 HD21 ASN A 117 13.515 -0.452 -6.994 1.00 0.00 H new ATOM 0 HD22 ASN A 117 14.168 -0.749 -8.609 1.00 0.00 H new ATOM 1806 N GLY A 118 12.430 3.962 -4.671 1.00 0.00 N ATOM 1807 CA GLY A 118 12.138 5.327 -4.269 1.00 0.00 C ATOM 1808 C GLY A 118 13.357 6.228 -4.314 1.00 0.00 C ATOM 1809 O GLY A 118 13.765 6.682 -5.383 1.00 0.00 O ATOM 0 H GLY A 118 12.162 3.249 -3.993 1.00 0.00 H new ATOM 0 HA2 GLY A 118 11.366 5.735 -4.921 1.00 0.00 H new ATOM 0 HA3 GLY A 118 11.732 5.324 -3.258 1.00 0.00 H new ATOM 1813 N ASN A 119 13.935 6.497 -3.146 1.00 0.00 N ATOM 1814 CA ASN A 119 15.110 7.356 -3.051 1.00 0.00 C ATOM 1815 C ASN A 119 15.758 7.239 -1.672 1.00 0.00 C ATOM 1816 O ASN A 119 15.201 6.618 -0.768 1.00 0.00 O ATOM 1817 CB ASN A 119 14.717 8.809 -3.325 1.00 0.00 C ATOM 1818 CG ASN A 119 15.565 9.445 -4.410 1.00 0.00 C ATOM 1819 OD1 ASN A 119 16.197 8.752 -5.206 1.00 0.00 O ATOM 1820 ND2 ASN A 119 15.581 10.772 -4.446 1.00 0.00 N ATOM 0 H ASN A 119 13.608 6.132 -2.252 1.00 0.00 H new ATOM 0 HA ASN A 119 15.835 7.033 -3.798 1.00 0.00 H new ATOM 0 HB2 ASN A 119 13.668 8.849 -3.618 1.00 0.00 H new ATOM 0 HB3 ASN A 119 14.814 9.388 -2.406 1.00 0.00 H new ATOM 0 HD21 ASN A 119 16.133 11.256 -5.154 1.00 0.00 H new ATOM 0 HD22 ASN A 119 15.041 11.307 -3.766 1.00 0.00 H new ATOM 1827 N PRO A 120 16.950 7.837 -1.491 1.00 0.00 N ATOM 1828 CA PRO A 120 17.677 7.799 -0.219 1.00 0.00 C ATOM 1829 C PRO A 120 17.093 8.745 0.832 1.00 0.00 C ATOM 1830 O PRO A 120 17.733 9.024 1.847 1.00 0.00 O ATOM 1831 CB PRO A 120 19.104 8.238 -0.596 1.00 0.00 C ATOM 1832 CG PRO A 120 19.115 8.372 -2.087 1.00 0.00 C ATOM 1833 CD PRO A 120 17.691 8.592 -2.502 1.00 0.00 C ATOM 0 HA PRO A 120 17.625 6.809 0.234 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.360 9.183 -0.118 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.838 7.504 -0.265 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.744 9.207 -2.397 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.522 7.475 -2.555 1.00 0.00 H new ATOM 0 HD2 PRO A 120 17.425 9.649 -2.496 1.00 0.00 H new ATOM 0 HD3 PRO A 120 17.499 8.220 -3.509 1.00 0.00 H new ATOM 1841 N SER A 121 15.880 9.234 0.591 1.00 0.00 N ATOM 1842 CA SER A 121 15.218 10.141 1.519 1.00 0.00 C ATOM 1843 C SER A 121 13.731 10.181 1.210 1.00 0.00 C ATOM 1844 O SER A 121 13.080 11.215 1.346 1.00 0.00 O ATOM 1845 CB SER A 121 15.813 11.548 1.410 1.00 0.00 C ATOM 1846 OG SER A 121 16.550 11.881 2.574 1.00 0.00 O ATOM 0 H SER A 121 15.335 9.015 -0.243 1.00 0.00 H new ATOM 0 HA SER A 121 15.370 9.781 2.537 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.462 11.605 0.536 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.014 12.274 1.262 1.00 0.00 H new ATOM 0 HG SER A 121 16.921 12.783 2.479 1.00 0.00 H new ATOM 1852 N TYR A 122 13.210 9.046 0.768 1.00 0.00 N ATOM 1853 CA TYR A 122 11.810 8.945 0.406 1.00 0.00 C ATOM 1854 C TYR A 122 11.322 7.505 0.511 1.00 0.00 C ATOM 1855 O TYR A 122 10.382 7.207 1.249 1.00 0.00 O ATOM 1856 CB TYR A 122 11.633 9.469 -1.016 1.00 0.00 C ATOM 1857 CG TYR A 122 10.977 10.829 -1.082 1.00 0.00 C ATOM 1858 CD1 TYR A 122 9.733 11.054 -0.511 1.00 0.00 C ATOM 1859 CD2 TYR A 122 11.612 11.891 -1.714 1.00 0.00 C ATOM 1860 CE1 TYR A 122 9.135 12.298 -0.568 1.00 0.00 C ATOM 1861 CE2 TYR A 122 11.023 13.140 -1.774 1.00 0.00 C ATOM 1862 CZ TYR A 122 9.784 13.338 -1.200 1.00 0.00 C ATOM 1863 OH TYR A 122 9.194 14.579 -1.259 1.00 0.00 O ATOM 0 H TYR A 122 13.740 8.182 0.652 1.00 0.00 H new ATOM 0 HA TYR A 122 11.214 9.543 1.096 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.609 9.522 -1.499 1.00 0.00 H new ATOM 0 HB3 TYR A 122 11.034 8.758 -1.585 1.00 0.00 H new ATOM 0 HD1 TYR A 122 9.223 10.242 -0.013 1.00 0.00 H new ATOM 0 HD2 TYR A 122 12.581 11.738 -2.166 1.00 0.00 H new ATOM 0 HE1 TYR A 122 8.165 12.455 -0.120 1.00 0.00 H new ATOM 0 HE2 TYR A 122 11.530 13.956 -2.267 1.00 0.00 H new ATOM 0 HH TYR A 122 9.783 15.199 -1.738 1.00 0.00 H new ATOM 1873 N LYS A 123 11.974 6.617 -0.227 1.00 0.00 N ATOM 1874 CA LYS A 123 11.625 5.198 -0.220 1.00 0.00 C ATOM 1875 C LYS A 123 10.138 4.987 -0.523 1.00 0.00 C ATOM 1876 O LYS A 123 9.745 4.830 -1.677 1.00 0.00 O ATOM 1877 CB LYS A 123 11.993 4.574 1.134 1.00 0.00 C ATOM 1878 CG LYS A 123 13.350 3.882 1.157 1.00 0.00 C ATOM 1879 CD LYS A 123 13.517 2.921 -0.009 1.00 0.00 C ATOM 1880 CE LYS A 123 14.358 3.527 -1.122 1.00 0.00 C ATOM 1881 NZ LYS A 123 15.519 2.665 -1.475 1.00 0.00 N ATOM 0 H LYS A 123 12.752 6.854 -0.842 1.00 0.00 H new ATOM 0 HA LYS A 123 12.195 4.703 -1.007 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.983 5.354 1.895 1.00 0.00 H new ATOM 0 HB3 LYS A 123 11.225 3.851 1.409 1.00 0.00 H new ATOM 0 HG2 LYS A 123 14.140 4.632 1.125 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.464 3.338 2.095 1.00 0.00 H new ATOM 0 HD2 LYS A 123 13.986 2.001 0.342 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.536 2.650 -0.400 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.737 3.678 -2.005 1.00 0.00 H new ATOM 0 HE3 LYS A 123 14.716 4.509 -0.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.399 3.123 -1.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.423 1.743 -1.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.548 2.526 -2.505 1.00 0.00 H new ATOM 1895 N TYR A 124 9.324 4.977 0.525 1.00 0.00 N ATOM 1896 CA TYR A 124 7.883 4.770 0.402 1.00 0.00 C ATOM 1897 C TYR A 124 7.232 5.684 -0.641 1.00 0.00 C ATOM 1898 O TYR A 124 6.101 5.435 -1.067 1.00 0.00 O ATOM 1899 CB TYR A 124 7.234 4.961 1.769 1.00 0.00 C ATOM 1900 CG TYR A 124 7.642 3.894 2.758 1.00 0.00 C ATOM 1901 CD1 TYR A 124 7.135 2.604 2.669 1.00 0.00 C ATOM 1902 CD2 TYR A 124 8.550 4.172 3.771 1.00 0.00 C ATOM 1903 CE1 TYR A 124 7.521 1.621 3.562 1.00 0.00 C ATOM 1904 CE2 TYR A 124 8.940 3.196 4.668 1.00 0.00 C ATOM 1905 CZ TYR A 124 8.424 1.923 4.558 1.00 0.00 C ATOM 1906 OH TYR A 124 8.816 0.948 5.445 1.00 0.00 O ATOM 0 H TYR A 124 9.642 5.112 1.485 1.00 0.00 H new ATOM 0 HA TYR A 124 7.723 3.751 0.049 1.00 0.00 H new ATOM 0 HB2 TYR A 124 7.506 5.940 2.163 1.00 0.00 H new ATOM 0 HB3 TYR A 124 6.150 4.953 1.657 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.427 2.364 1.889 1.00 0.00 H new ATOM 0 HD2 TYR A 124 8.958 5.168 3.859 1.00 0.00 H new ATOM 0 HE1 TYR A 124 7.117 0.623 3.479 1.00 0.00 H new ATOM 0 HE2 TYR A 124 9.646 3.430 5.451 1.00 0.00 H new ATOM 0 HH TYR A 124 9.457 1.325 6.083 1.00 0.00 H new ATOM 1916 N PHE A 125 7.939 6.729 -1.062 1.00 0.00 N ATOM 1917 CA PHE A 125 7.411 7.646 -2.068 1.00 0.00 C ATOM 1918 C PHE A 125 7.672 7.096 -3.467 1.00 0.00 C ATOM 1919 O PHE A 125 8.819 6.848 -3.842 1.00 0.00 O ATOM 1920 CB PHE A 125 8.046 9.031 -1.912 1.00 0.00 C ATOM 1921 CG PHE A 125 7.752 9.967 -3.052 1.00 0.00 C ATOM 1922 CD1 PHE A 125 6.451 10.354 -3.330 1.00 0.00 C ATOM 1923 CD2 PHE A 125 8.776 10.459 -3.843 1.00 0.00 C ATOM 1924 CE1 PHE A 125 6.177 11.213 -4.376 1.00 0.00 C ATOM 1925 CE2 PHE A 125 8.509 11.319 -4.892 1.00 0.00 C ATOM 1926 CZ PHE A 125 7.208 11.697 -5.158 1.00 0.00 C ATOM 0 H PHE A 125 8.873 6.961 -0.725 1.00 0.00 H new ATOM 0 HA PHE A 125 6.335 7.742 -1.925 1.00 0.00 H new ATOM 0 HB2 PHE A 125 7.691 9.481 -0.985 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.126 8.917 -1.818 1.00 0.00 H new ATOM 0 HD1 PHE A 125 5.641 9.979 -2.721 1.00 0.00 H new ATOM 0 HD2 PHE A 125 9.796 10.168 -3.638 1.00 0.00 H new ATOM 0 HE1 PHE A 125 5.158 11.506 -4.582 1.00 0.00 H new ATOM 0 HE2 PHE A 125 9.317 11.695 -5.502 1.00 0.00 H new ATOM 0 HZ PHE A 125 6.997 12.370 -5.976 1.00 0.00 H new ATOM 1936 N TYR A 126 6.604 6.892 -4.233 1.00 0.00 N ATOM 1937 CA TYR A 126 6.726 6.356 -5.585 1.00 0.00 C ATOM 1938 C TYR A 126 6.718 7.465 -6.634 1.00 0.00 C ATOM 1939 O TYR A 126 6.429 8.621 -6.331 1.00 0.00 O ATOM 1940 CB TYR A 126 5.597 5.365 -5.870 1.00 0.00 C ATOM 1941 CG TYR A 126 5.753 4.038 -5.160 1.00 0.00 C ATOM 1942 CD1 TYR A 126 5.956 3.983 -3.785 1.00 0.00 C ATOM 1943 CD2 TYR A 126 5.695 2.841 -5.861 1.00 0.00 C ATOM 1944 CE1 TYR A 126 6.098 2.773 -3.133 1.00 0.00 C ATOM 1945 CE2 TYR A 126 5.834 1.628 -5.215 1.00 0.00 C ATOM 1946 CZ TYR A 126 6.036 1.599 -3.851 1.00 0.00 C ATOM 1947 OH TYR A 126 6.176 0.392 -3.205 1.00 0.00 O ATOM 0 H TYR A 126 5.647 7.089 -3.941 1.00 0.00 H new ATOM 0 HA TYR A 126 7.684 5.840 -5.646 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.649 5.815 -5.575 1.00 0.00 H new ATOM 0 HB3 TYR A 126 5.545 5.187 -6.944 1.00 0.00 H new ATOM 0 HD1 TYR A 126 6.003 4.901 -3.218 1.00 0.00 H new ATOM 0 HD2 TYR A 126 5.539 2.859 -6.929 1.00 0.00 H new ATOM 0 HE1 TYR A 126 6.257 2.748 -2.065 1.00 0.00 H new ATOM 0 HE2 TYR A 126 5.785 0.706 -5.776 1.00 0.00 H new ATOM 0 HH TYR A 126 5.295 0.066 -2.927 1.00 0.00 H new ATOM 1957 N VAL A 127 7.038 7.082 -7.867 1.00 0.00 N ATOM 1958 CA VAL A 127 7.084 7.998 -8.997 1.00 0.00 C ATOM 1959 C VAL A 127 7.288 7.212 -10.285 1.00 0.00 C ATOM 1960 O VAL A 127 8.390 6.740 -10.559 1.00 0.00 O ATOM 1961 CB VAL A 127 8.223 9.027 -8.856 1.00 0.00 C ATOM 1962 CG1 VAL A 127 7.806 10.163 -7.942 1.00 0.00 C ATOM 1963 CG2 VAL A 127 9.491 8.363 -8.341 1.00 0.00 C ATOM 0 H VAL A 127 7.274 6.120 -8.109 1.00 0.00 H new ATOM 0 HA VAL A 127 6.137 8.536 -9.022 1.00 0.00 H new ATOM 0 HB VAL A 127 8.432 9.439 -9.843 1.00 0.00 H new ATOM 0 HG11 VAL A 127 8.623 10.879 -7.855 1.00 0.00 H new ATOM 0 HG12 VAL A 127 6.930 10.661 -8.357 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.565 9.767 -6.956 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.281 9.109 -8.250 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.298 7.917 -7.365 1.00 0.00 H new ATOM 0 HG23 VAL A 127 9.804 7.586 -9.039 1.00 0.00 H new ATOM 1973 N SER A 128 6.214 7.063 -11.059 1.00 0.00 N ATOM 1974 CA SER A 128 6.252 6.316 -12.326 1.00 0.00 C ATOM 1975 C SER A 128 5.740 4.888 -12.136 1.00 0.00 C ATOM 1976 O SER A 128 6.162 4.177 -11.219 1.00 0.00 O ATOM 1977 CB SER A 128 7.664 6.281 -12.923 1.00 0.00 C ATOM 1978 OG SER A 128 7.619 6.059 -14.322 1.00 0.00 O ATOM 0 H SER A 128 5.298 7.451 -10.833 1.00 0.00 H new ATOM 0 HA SER A 128 5.598 6.841 -13.022 1.00 0.00 H new ATOM 0 HB2 SER A 128 8.173 7.222 -12.717 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.245 5.493 -12.445 1.00 0.00 H new ATOM 0 HG SER A 128 8.531 6.042 -14.680 1.00 0.00 H new ATOM 1984 N ALA A 129 4.829 4.474 -13.013 1.00 0.00 N ATOM 1985 CA ALA A 129 4.248 3.137 -12.957 1.00 0.00 C ATOM 1986 C ALA A 129 5.309 2.059 -13.158 1.00 0.00 C ATOM 1987 O ALA A 129 5.135 0.915 -12.737 1.00 0.00 O ATOM 1988 CB ALA A 129 3.155 2.998 -14.004 1.00 0.00 C ATOM 0 H ALA A 129 4.476 5.051 -13.776 1.00 0.00 H new ATOM 0 HA ALA A 129 3.816 3.000 -11.966 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.728 1.996 -13.954 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.374 3.735 -13.815 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.578 3.163 -14.995 1.00 0.00 H new ATOM 1994 N GLU A 130 6.407 2.425 -13.811 1.00 0.00 N ATOM 1995 CA GLU A 130 7.489 1.484 -14.074 1.00 0.00 C ATOM 1996 C GLU A 130 7.998 0.843 -12.785 1.00 0.00 C ATOM 1997 O GLU A 130 8.004 -0.382 -12.642 1.00 0.00 O ATOM 1998 CB GLU A 130 8.638 2.189 -14.799 1.00 0.00 C ATOM 1999 CG GLU A 130 9.087 1.476 -16.064 1.00 0.00 C ATOM 2000 CD GLU A 130 7.994 1.417 -17.114 1.00 0.00 C ATOM 2001 OE1 GLU A 130 7.107 0.545 -16.998 1.00 0.00 O ATOM 2002 OE2 GLU A 130 8.026 2.240 -18.051 1.00 0.00 O ATOM 0 H GLU A 130 6.571 3.366 -14.168 1.00 0.00 H new ATOM 0 HA GLU A 130 7.094 0.692 -14.710 1.00 0.00 H new ATOM 0 HB2 GLU A 130 8.329 3.203 -15.054 1.00 0.00 H new ATOM 0 HB3 GLU A 130 9.486 2.276 -14.120 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.956 1.988 -16.477 1.00 0.00 H new ATOM 0 HG3 GLU A 130 9.402 0.463 -15.814 1.00 0.00 H new ATOM 2009 N GLN A 131 8.440 1.668 -11.846 1.00 0.00 N ATOM 2010 CA GLN A 131 8.960 1.143 -10.596 1.00 0.00 C ATOM 2011 C GLN A 131 7.883 0.427 -9.788 1.00 0.00 C ATOM 2012 O GLN A 131 8.142 -0.611 -9.181 1.00 0.00 O ATOM 2013 CB GLN A 131 9.593 2.229 -9.741 1.00 0.00 C ATOM 2014 CG GLN A 131 8.700 3.431 -9.493 1.00 0.00 C ATOM 2015 CD GLN A 131 9.494 4.679 -9.160 1.00 0.00 C ATOM 2016 OE1 GLN A 131 9.338 5.174 -7.938 1.00 0.00 O flip ATOM 2017 NE2 GLN A 131 10.241 5.192 -9.992 1.00 0.00 N flip ATOM 0 H GLN A 131 8.449 2.685 -11.925 1.00 0.00 H new ATOM 0 HA GLN A 131 9.730 0.422 -10.871 1.00 0.00 H new ATOM 0 HB2 GLN A 131 9.878 1.799 -8.781 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.510 2.566 -10.224 1.00 0.00 H new ATOM 0 HG2 GLN A 131 8.090 3.616 -10.377 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.015 3.209 -8.674 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.331 4.779 -10.920 1.00 0.00 H new ATOM 0 HE22 GLN A 131 10.770 6.031 -9.754 1.00 0.00 H new ATOM 2026 N VAL A 132 6.676 0.987 -9.767 1.00 0.00 N ATOM 2027 CA VAL A 132 5.582 0.385 -9.007 1.00 0.00 C ATOM 2028 C VAL A 132 5.429 -1.097 -9.344 1.00 0.00 C ATOM 2029 O VAL A 132 4.978 -1.887 -8.514 1.00 0.00 O ATOM 2030 CB VAL A 132 4.226 1.109 -9.226 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.426 2.590 -9.505 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.414 0.459 -10.342 1.00 0.00 C ATOM 0 H VAL A 132 6.432 1.846 -10.260 1.00 0.00 H new ATOM 0 HA VAL A 132 5.850 0.495 -7.956 1.00 0.00 H new ATOM 0 HB VAL A 132 3.660 1.011 -8.299 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.457 3.066 -9.653 1.00 0.00 H new ATOM 0 HG12 VAL A 132 4.933 3.054 -8.659 1.00 0.00 H new ATOM 0 HG13 VAL A 132 5.032 2.713 -10.403 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.472 0.994 -10.465 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.979 0.499 -11.273 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.210 -0.581 -10.086 1.00 0.00 H new ATOM 2042 N VAL A 133 5.797 -1.468 -10.566 1.00 0.00 N ATOM 2043 CA VAL A 133 5.688 -2.855 -10.996 1.00 0.00 C ATOM 2044 C VAL A 133 6.882 -3.685 -10.534 1.00 0.00 C ATOM 2045 O VAL A 133 6.732 -4.870 -10.237 1.00 0.00 O ATOM 2046 CB VAL A 133 5.535 -2.980 -12.526 1.00 0.00 C ATOM 2047 CG1 VAL A 133 6.847 -2.691 -13.236 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.022 -4.366 -12.890 1.00 0.00 C ATOM 0 H VAL A 133 6.170 -0.832 -11.271 1.00 0.00 H new ATOM 0 HA VAL A 133 4.785 -3.245 -10.527 1.00 0.00 H new ATOM 0 HB VAL A 133 4.809 -2.238 -12.857 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.707 -2.787 -14.313 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.172 -1.677 -13.001 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.604 -3.401 -12.904 1.00 0.00 H new ATOM 0 HG21 VAL A 133 4.918 -4.443 -13.972 1.00 0.00 H new ATOM 0 HG22 VAL A 133 5.728 -5.119 -12.539 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.053 -4.530 -12.420 1.00 0.00 H new ATOM 2058 N GLN A 134 8.069 -3.075 -10.461 1.00 0.00 N ATOM 2059 CA GLN A 134 9.243 -3.825 -10.013 1.00 0.00 C ATOM 2060 C GLN A 134 9.161 -4.039 -8.514 1.00 0.00 C ATOM 2061 O GLN A 134 9.599 -5.065 -7.998 1.00 0.00 O ATOM 2062 CB GLN A 134 10.556 -3.132 -10.387 1.00 0.00 C ATOM 2063 CG GLN A 134 10.481 -1.621 -10.380 1.00 0.00 C ATOM 2064 CD GLN A 134 11.790 -0.970 -10.784 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.807 -1.127 -10.110 1.00 0.00 O ATOM 2066 NE2 GLN A 134 11.768 -0.235 -11.889 1.00 0.00 N ATOM 0 H GLN A 134 8.239 -2.098 -10.698 1.00 0.00 H new ATOM 0 HA GLN A 134 9.242 -4.787 -10.525 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.333 -3.450 -9.692 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.861 -3.465 -11.379 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.693 -1.297 -11.060 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.202 -1.279 -9.383 1.00 0.00 H new ATOM 0 HE21 GLN A 134 10.901 -0.133 -12.416 1.00 0.00 H new ATOM 0 HE22 GLN A 134 12.618 0.228 -12.211 1.00 0.00 H new ATOM 2075 N GLY A 135 8.558 -3.078 -7.828 1.00 0.00 N ATOM 2076 CA GLY A 135 8.383 -3.197 -6.400 1.00 0.00 C ATOM 2077 C GLY A 135 7.263 -4.162 -6.081 1.00 0.00 C ATOM 2078 O GLY A 135 7.258 -4.802 -5.027 1.00 0.00 O ATOM 0 H GLY A 135 8.188 -2.220 -8.237 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.310 -3.542 -5.942 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.161 -2.219 -5.972 1.00 0.00 H new ATOM 2082 N MET A 136 6.319 -4.284 -7.017 1.00 0.00 N ATOM 2083 CA MET A 136 5.195 -5.193 -6.852 1.00 0.00 C ATOM 2084 C MET A 136 5.651 -6.620 -7.111 1.00 0.00 C ATOM 2085 O MET A 136 5.291 -7.545 -6.385 1.00 0.00 O ATOM 2086 CB MET A 136 4.059 -4.818 -7.806 1.00 0.00 C ATOM 2087 CG MET A 136 2.914 -4.082 -7.129 1.00 0.00 C ATOM 2088 SD MET A 136 1.316 -4.449 -7.878 1.00 0.00 S ATOM 2089 CE MET A 136 1.188 -6.206 -7.558 1.00 0.00 C ATOM 0 H MET A 136 6.315 -3.763 -7.894 1.00 0.00 H new ATOM 0 HA MET A 136 4.823 -5.116 -5.830 1.00 0.00 H new ATOM 0 HB2 MET A 136 4.458 -4.194 -8.606 1.00 0.00 H new ATOM 0 HB3 MET A 136 3.672 -5.725 -8.272 1.00 0.00 H new ATOM 0 HG2 MET A 136 2.887 -4.352 -6.073 1.00 0.00 H new ATOM 0 HG3 MET A 136 3.097 -3.009 -7.179 1.00 0.00 H new ATOM 0 HE1 MET A 136 0.137 -6.494 -7.523 1.00 0.00 H new ATOM 0 HE2 MET A 136 1.689 -6.758 -8.353 1.00 0.00 H new ATOM 0 HE3 MET A 136 1.659 -6.437 -6.603 1.00 0.00 H new ATOM 2099 N LYS A 137 6.463 -6.784 -8.148 1.00 0.00 N ATOM 2100 CA LYS A 137 6.989 -8.090 -8.512 1.00 0.00 C ATOM 2101 C LYS A 137 8.109 -8.515 -7.557 1.00 0.00 C ATOM 2102 O LYS A 137 8.494 -9.682 -7.520 1.00 0.00 O ATOM 2103 CB LYS A 137 7.485 -8.079 -9.962 1.00 0.00 C ATOM 2104 CG LYS A 137 8.758 -7.284 -10.189 1.00 0.00 C ATOM 2105 CD LYS A 137 8.859 -6.786 -11.628 1.00 0.00 C ATOM 2106 CE LYS A 137 8.527 -7.879 -12.636 1.00 0.00 C ATOM 2107 NZ LYS A 137 9.538 -8.972 -12.623 1.00 0.00 N ATOM 0 H LYS A 137 6.772 -6.023 -8.753 1.00 0.00 H new ATOM 0 HA LYS A 137 6.184 -8.820 -8.428 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.653 -9.107 -10.283 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.699 -7.671 -10.598 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.784 -6.434 -9.507 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.623 -7.906 -9.957 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.180 -5.945 -11.769 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.867 -6.416 -11.814 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.543 -8.292 -12.413 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.472 -7.447 -13.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 9.276 -9.696 -13.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.473 -8.583 -12.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.572 -9.402 -11.677 1.00 0.00 H new ATOM 2121 N GLU A 138 8.618 -7.560 -6.778 1.00 0.00 N ATOM 2122 CA GLU A 138 9.681 -7.842 -5.817 1.00 0.00 C ATOM 2123 C GLU A 138 9.126 -8.608 -4.627 1.00 0.00 C ATOM 2124 O GLU A 138 9.428 -9.786 -4.436 1.00 0.00 O ATOM 2125 CB GLU A 138 10.334 -6.544 -5.333 1.00 0.00 C ATOM 2126 CG GLU A 138 11.838 -6.656 -5.142 1.00 0.00 C ATOM 2127 CD GLU A 138 12.209 -7.373 -3.860 1.00 0.00 C ATOM 2128 OE1 GLU A 138 12.293 -8.619 -3.878 1.00 0.00 O ATOM 2129 OE2 GLU A 138 12.417 -6.689 -2.836 1.00 0.00 O ATOM 0 H GLU A 138 8.311 -6.587 -6.795 1.00 0.00 H new ATOM 0 HA GLU A 138 10.436 -8.450 -6.316 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.125 -5.752 -6.052 1.00 0.00 H new ATOM 0 HB3 GLU A 138 9.877 -6.247 -4.389 1.00 0.00 H new ATOM 0 HG2 GLU A 138 12.270 -7.188 -5.990 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.275 -5.658 -5.136 1.00 0.00 H new ATOM 2136 N ALA A 139 8.304 -7.932 -3.840 1.00 0.00 N ATOM 2137 CA ALA A 139 7.689 -8.550 -2.673 1.00 0.00 C ATOM 2138 C ALA A 139 6.782 -9.703 -3.090 1.00 0.00 C ATOM 2139 O ALA A 139 6.424 -10.552 -2.275 1.00 0.00 O ATOM 2140 CB ALA A 139 6.904 -7.516 -1.879 1.00 0.00 C ATOM 0 H ALA A 139 8.047 -6.956 -3.987 1.00 0.00 H new ATOM 0 HA ALA A 139 8.480 -8.949 -2.038 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.450 -7.992 -1.010 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.576 -6.724 -1.549 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.123 -7.090 -2.509 1.00 0.00 H new ATOM 2146 N GLN A 140 6.416 -9.728 -4.370 1.00 0.00 N ATOM 2147 CA GLN A 140 5.553 -10.771 -4.904 1.00 0.00 C ATOM 2148 C GLN A 140 6.201 -12.150 -4.780 1.00 0.00 C ATOM 2149 O GLN A 140 5.529 -13.174 -4.909 1.00 0.00 O ATOM 2150 CB GLN A 140 5.227 -10.482 -6.372 1.00 0.00 C ATOM 2151 CG GLN A 140 3.784 -10.067 -6.608 1.00 0.00 C ATOM 2152 CD GLN A 140 3.280 -10.467 -7.982 1.00 0.00 C ATOM 2153 OE1 GLN A 140 3.406 -9.711 -8.945 1.00 0.00 O ATOM 2154 NE2 GLN A 140 2.706 -11.661 -8.077 1.00 0.00 N ATOM 0 H GLN A 140 6.707 -9.033 -5.057 1.00 0.00 H new ATOM 0 HA GLN A 140 4.633 -10.775 -4.320 1.00 0.00 H new ATOM 0 HB2 GLN A 140 5.886 -9.692 -6.733 1.00 0.00 H new ATOM 0 HB3 GLN A 140 5.441 -11.372 -6.964 1.00 0.00 H new ATOM 0 HG2 GLN A 140 3.150 -10.521 -5.846 1.00 0.00 H new ATOM 0 HG3 GLN A 140 3.697 -8.987 -6.493 1.00 0.00 H new ATOM 0 HE21 GLN A 140 2.623 -12.254 -7.251 1.00 0.00 H new ATOM 0 HE22 GLN A 140 2.348 -11.985 -8.976 1.00 0.00 H new ATOM 2163 N GLU A 141 7.511 -12.174 -4.547 1.00 0.00 N ATOM 2164 CA GLU A 141 8.242 -13.429 -4.427 1.00 0.00 C ATOM 2165 C GLU A 141 8.454 -13.832 -2.966 1.00 0.00 C ATOM 2166 O GLU A 141 8.757 -14.988 -2.674 1.00 0.00 O ATOM 2167 CB GLU A 141 9.594 -13.311 -5.133 1.00 0.00 C ATOM 2168 CG GLU A 141 10.512 -14.491 -4.878 1.00 0.00 C ATOM 2169 CD GLU A 141 11.475 -14.744 -6.020 1.00 0.00 C ATOM 2170 OE1 GLU A 141 12.539 -14.093 -6.057 1.00 0.00 O ATOM 2171 OE2 GLU A 141 11.164 -15.595 -6.881 1.00 0.00 O ATOM 0 H GLU A 141 8.086 -11.339 -4.438 1.00 0.00 H new ATOM 0 HA GLU A 141 7.642 -14.206 -4.900 1.00 0.00 H new ATOM 0 HB2 GLU A 141 9.428 -13.215 -6.206 1.00 0.00 H new ATOM 0 HB3 GLU A 141 10.089 -12.397 -4.804 1.00 0.00 H new ATOM 0 HG2 GLU A 141 11.078 -14.314 -3.964 1.00 0.00 H new ATOM 0 HG3 GLU A 141 9.910 -15.384 -4.712 1.00 0.00 H new ATOM 2178 N ARG A 142 8.310 -12.878 -2.053 1.00 0.00 N ATOM 2179 CA ARG A 142 8.506 -13.155 -0.629 1.00 0.00 C ATOM 2180 C ARG A 142 7.244 -12.870 0.182 1.00 0.00 C ATOM 2181 O ARG A 142 6.779 -13.720 0.940 1.00 0.00 O ATOM 2182 CB ARG A 142 9.676 -12.334 -0.062 1.00 0.00 C ATOM 2183 CG ARG A 142 10.518 -11.609 -1.107 1.00 0.00 C ATOM 2184 CD ARG A 142 10.984 -10.255 -0.595 1.00 0.00 C ATOM 2185 NE ARG A 142 12.322 -9.919 -1.075 1.00 0.00 N ATOM 2186 CZ ARG A 142 13.080 -8.964 -0.540 1.00 0.00 C ATOM 2187 NH1 ARG A 142 12.636 -8.250 0.487 1.00 0.00 N ATOM 2188 NH2 ARG A 142 14.287 -8.723 -1.034 1.00 0.00 N ATOM 0 H ARG A 142 8.060 -11.913 -2.268 1.00 0.00 H new ATOM 0 HA ARG A 142 8.739 -14.216 -0.544 1.00 0.00 H new ATOM 0 HB2 ARG A 142 9.279 -11.598 0.638 1.00 0.00 H new ATOM 0 HB3 ARG A 142 10.325 -12.999 0.508 1.00 0.00 H new ATOM 0 HG2 ARG A 142 11.383 -12.219 -1.368 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.935 -11.475 -2.018 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.281 -9.485 -0.914 1.00 0.00 H new ATOM 0 HD3 ARG A 142 10.980 -10.259 0.495 1.00 0.00 H new ATOM 0 HE ARG A 142 12.697 -10.445 -1.864 1.00 0.00 H new ATOM 0 HH11 ARG A 142 11.709 -8.431 0.871 1.00 0.00 H new ATOM 0 HH12 ARG A 142 13.222 -7.520 0.892 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.634 -9.269 -1.823 1.00 0.00 H new ATOM 0 HH22 ARG A 142 14.869 -7.992 -0.625 1.00 0.00 H new ATOM 2202 N LEU A 143 6.709 -11.663 0.037 1.00 0.00 N ATOM 2203 CA LEU A 143 5.514 -11.264 0.774 1.00 0.00 C ATOM 2204 C LEU A 143 4.344 -12.207 0.509 1.00 0.00 C ATOM 2205 O LEU A 143 3.436 -12.323 1.332 1.00 0.00 O ATOM 2206 CB LEU A 143 5.130 -9.827 0.415 1.00 0.00 C ATOM 2207 CG LEU A 143 5.346 -8.807 1.536 1.00 0.00 C ATOM 2208 CD1 LEU A 143 4.480 -9.143 2.740 1.00 0.00 C ATOM 2209 CD2 LEU A 143 6.813 -8.757 1.930 1.00 0.00 C ATOM 0 H LEU A 143 7.083 -10.944 -0.583 1.00 0.00 H new ATOM 0 HA LEU A 143 5.746 -11.320 1.838 1.00 0.00 H new ATOM 0 HB2 LEU A 143 5.709 -9.518 -0.455 1.00 0.00 H new ATOM 0 HB3 LEU A 143 4.080 -9.808 0.123 1.00 0.00 H new ATOM 0 HG LEU A 143 5.053 -7.823 1.169 1.00 0.00 H new ATOM 0 HD11 LEU A 143 4.648 -8.407 3.526 1.00 0.00 H new ATOM 0 HD12 LEU A 143 3.430 -9.129 2.448 1.00 0.00 H new ATOM 0 HD13 LEU A 143 4.741 -10.134 3.110 1.00 0.00 H new ATOM 0 HD21 LEU A 143 6.951 -8.027 2.728 1.00 0.00 H new ATOM 0 HD22 LEU A 143 7.130 -9.740 2.278 1.00 0.00 H new ATOM 0 HD23 LEU A 143 7.412 -8.468 1.067 1.00 0.00 H new ATOM 2221 N THR A 144 4.365 -12.880 -0.636 1.00 0.00 N ATOM 2222 CA THR A 144 3.302 -13.809 -0.994 1.00 0.00 C ATOM 2223 C THR A 144 3.248 -14.976 -0.013 1.00 0.00 C ATOM 2224 O THR A 144 3.769 -16.056 -0.289 1.00 0.00 O ATOM 2225 CB THR A 144 3.517 -14.331 -2.410 1.00 0.00 C ATOM 2226 OG1 THR A 144 4.854 -14.758 -2.591 1.00 0.00 O ATOM 2227 CG2 THR A 144 3.211 -13.306 -3.480 1.00 0.00 C ATOM 0 H THR A 144 5.107 -12.799 -1.331 1.00 0.00 H new ATOM 0 HA THR A 144 2.353 -13.275 -0.949 1.00 0.00 H new ATOM 0 HB THR A 144 2.821 -15.162 -2.519 1.00 0.00 H new ATOM 0 HG1 THR A 144 5.242 -14.300 -3.366 1.00 0.00 H new ATOM 0 HG21 THR A 144 3.385 -13.743 -4.463 1.00 0.00 H new ATOM 0 HG22 THR A 144 2.169 -12.996 -3.400 1.00 0.00 H new ATOM 0 HG23 THR A 144 3.858 -12.439 -3.349 1.00 0.00 H new