USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 989 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 132 LYS NZ :NH3+ -167:sc= 0.645 (180deg=-0.0412) USER MOD Set 1.2: A 146 TYR OH : rot 180:sc= 0.845 USER MOD Set 2.1: A 65 THR OG1 : rot 26:sc= 0.0541 USER MOD Set 2.2: A 87 TYR OH : rot -140:sc= 0.103 USER MOD Set 3.1: A 23 ASN : amide:sc= 1.05 K(o=2.3,f=1.6) USER MOD Set 3.2: A 49 TYR OH : rot -163:sc= 1.25 USER MOD Single : A 28 TYR OH : rot -149:sc= 0.826 USER MOD Single : A 32 CYS SG : rot 77:sc= 1.17 USER MOD Single : A 33 SER OG : rot -80:sc= 1.49 USER MOD Single : A 37 THR OG1 : rot 130:sc= 0.202 USER MOD Single : A 51 SER OG : rot -131:sc= 0.421 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 178:sc= 0.871 (180deg=0.747) USER MOD Single : A 57 HIS : no HD1:sc= -0.478 K(o=-0.48,f=0.11) USER MOD Single : A 58 SER OG : rot -170:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00541) USER MOD Single : A 68 LYS NZ :NH3+ -141:sc= -0.0719 (180deg=-0.437) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl -158:sc= -0.794 (180deg=-1.5) USER MOD Single : A 94 TYR OH : rot 142:sc= -0.996 USER MOD Single : A 95 SER OG : rot -160:sc= -1.12 USER MOD Single : A 103 HIS : no HD1:sc= -7.32! C(o=-7.3!,f=-5.5!) USER MOD Single : A 104 SER OG : rot 180:sc= 0.0198 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 MET CE :methyl -112:sc= -1.16 (180deg=-3.63!) USER MOD Single : A 120 LYS NZ :NH3+ -127:sc= -1.96! (180deg=-3.8!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl 180:sc= -0.585 (180deg=-0.585) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= -1.16 K(o=-1.2,f=-0.34) USER MOD Single : A 138 TYR OH : rot 180:sc= 1 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 TYR OH : rot 180:sc= -0.262 USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 305 N TRP A 22 -3.412 -14.175 0.503 1.00 0.00 N ATOM 306 CA TRP A 22 -3.613 -12.734 0.425 1.00 0.00 C ATOM 307 C TRP A 22 -4.241 -12.184 1.705 1.00 0.00 C ATOM 308 O TRP A 22 -3.972 -11.048 2.096 1.00 0.00 O ATOM 309 CB TRP A 22 -4.489 -12.380 -0.779 1.00 0.00 C ATOM 310 CG TRP A 22 -3.806 -12.597 -2.098 1.00 0.00 C ATOM 311 CD1 TRP A 22 -3.867 -13.715 -2.882 1.00 0.00 C ATOM 312 CD2 TRP A 22 -2.954 -11.672 -2.784 1.00 0.00 C ATOM 313 NE1 TRP A 22 -3.108 -13.540 -4.014 1.00 0.00 N ATOM 314 CE2 TRP A 22 -2.536 -12.296 -3.977 1.00 0.00 C ATOM 315 CE3 TRP A 22 -2.502 -10.378 -2.510 1.00 0.00 C ATOM 316 CZ2 TRP A 22 -1.693 -11.668 -4.891 1.00 0.00 C ATOM 317 CZ3 TRP A 22 -1.662 -9.759 -3.416 1.00 0.00 C ATOM 318 CH2 TRP A 22 -1.269 -10.402 -4.594 1.00 0.00 C ATOM 0 HA TRP A 22 -2.633 -12.273 0.304 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -5.398 -12.980 -0.746 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -4.793 -11.336 -0.703 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -4.430 -14.606 -2.646 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -2.990 -14.225 -4.760 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -2.804 -9.871 -1.606 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -1.386 -12.163 -5.801 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -1.303 -8.761 -3.211 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -0.617 -9.888 -5.284 1.00 0.00 H new ATOM 329 N ASN A 23 -5.067 -12.990 2.362 1.00 0.00 N ATOM 330 CA ASN A 23 -5.770 -12.540 3.561 1.00 0.00 C ATOM 331 C ASN A 23 -4.802 -12.275 4.710 1.00 0.00 C ATOM 332 O ASN A 23 -4.951 -11.289 5.432 1.00 0.00 O ATOM 333 CB ASN A 23 -6.845 -13.539 3.997 1.00 0.00 C ATOM 334 CG ASN A 23 -8.118 -13.437 3.169 1.00 0.00 C ATOM 335 OD1 ASN A 23 -8.083 -13.147 1.975 1.00 0.00 O ATOM 336 ND2 ASN A 23 -9.261 -13.646 3.805 1.00 0.00 N ATOM 0 H ASN A 23 -5.267 -13.952 2.089 1.00 0.00 H new ATOM 0 HA ASN A 23 -6.263 -11.603 3.302 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -6.447 -14.551 3.919 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -7.086 -13.371 5.047 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -10.146 -13.568 3.303 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -9.257 -13.885 4.797 1.00 0.00 H new ATOM 343 N ASP A 24 -3.803 -13.141 4.871 1.00 0.00 N ATOM 344 CA ASP A 24 -2.790 -12.948 5.913 1.00 0.00 C ATOM 345 C ASP A 24 -2.035 -11.645 5.685 1.00 0.00 C ATOM 346 O ASP A 24 -1.728 -10.915 6.628 1.00 0.00 O ATOM 347 CB ASP A 24 -1.800 -14.120 5.964 1.00 0.00 C ATOM 348 CG ASP A 24 -2.366 -15.348 6.653 1.00 0.00 C ATOM 349 OD1 ASP A 24 -2.997 -15.198 7.721 1.00 0.00 O ATOM 350 OD2 ASP A 24 -2.173 -16.470 6.138 1.00 0.00 O ATOM 0 H ASP A 24 -3.672 -13.976 4.300 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.310 -12.902 6.870 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.506 -14.384 4.948 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.897 -13.802 6.485 1.00 0.00 H new ATOM 355 N LEU A 25 -1.752 -11.359 4.421 1.00 0.00 N ATOM 356 CA LEU A 25 -1.094 -10.119 4.028 1.00 0.00 C ATOM 357 C LEU A 25 -1.968 -8.916 4.370 1.00 0.00 C ATOM 358 O LEU A 25 -1.481 -7.911 4.890 1.00 0.00 O ATOM 359 CB LEU A 25 -0.787 -10.161 2.526 1.00 0.00 C ATOM 360 CG LEU A 25 -0.368 -8.838 1.880 1.00 0.00 C ATOM 361 CD1 LEU A 25 0.879 -8.267 2.537 1.00 0.00 C ATOM 362 CD2 LEU A 25 -0.130 -9.048 0.398 1.00 0.00 C ATOM 0 H LEU A 25 -1.971 -11.978 3.641 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.159 -10.017 4.579 1.00 0.00 H new ATOM 0 HB2 LEU A 25 0.007 -10.889 2.360 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.671 -10.530 2.007 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.174 -8.119 2.022 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.148 -7.328 2.053 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.684 -8.088 3.594 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.701 -8.976 2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.168 -8.105 -0.060 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.660 -9.785 0.257 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.047 -9.405 -0.071 1.00 0.00 H new ATOM 374 N ALA A 26 -3.259 -9.035 4.095 1.00 0.00 N ATOM 375 CA ALA A 26 -4.211 -7.979 4.404 1.00 0.00 C ATOM 376 C ALA A 26 -4.222 -7.683 5.898 1.00 0.00 C ATOM 377 O ALA A 26 -4.150 -6.525 6.307 1.00 0.00 O ATOM 378 CB ALA A 26 -5.597 -8.369 3.922 1.00 0.00 C ATOM 0 H ALA A 26 -3.673 -9.858 3.656 1.00 0.00 H new ATOM 0 HA ALA A 26 -3.905 -7.071 3.884 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.302 -7.572 4.158 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.576 -8.527 2.844 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.909 -9.288 4.418 1.00 0.00 H new ATOM 384 N VAL A 27 -4.284 -8.739 6.707 1.00 0.00 N ATOM 385 CA VAL A 27 -4.276 -8.606 8.162 1.00 0.00 C ATOM 386 C VAL A 27 -3.050 -7.823 8.636 1.00 0.00 C ATOM 387 O VAL A 27 -3.153 -6.958 9.507 1.00 0.00 O ATOM 388 CB VAL A 27 -4.299 -9.993 8.849 1.00 0.00 C ATOM 389 CG1 VAL A 27 -4.176 -9.864 10.359 1.00 0.00 C ATOM 390 CG2 VAL A 27 -5.567 -10.747 8.484 1.00 0.00 C ATOM 0 H VAL A 27 -4.341 -9.702 6.376 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.176 -8.058 8.441 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.439 -10.557 8.489 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -4.195 -10.855 10.812 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.236 -9.370 10.607 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -5.008 -9.274 10.743 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -5.566 -11.720 8.976 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.436 -10.176 8.810 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.609 -10.887 7.404 1.00 0.00 H new ATOM 400 N TYR A 28 -1.900 -8.117 8.044 1.00 0.00 N ATOM 401 CA TYR A 28 -0.656 -7.442 8.392 1.00 0.00 C ATOM 402 C TYR A 28 -0.776 -5.934 8.156 1.00 0.00 C ATOM 403 O TYR A 28 -0.380 -5.125 8.999 1.00 0.00 O ATOM 404 CB TYR A 28 0.490 -8.018 7.558 1.00 0.00 C ATOM 405 CG TYR A 28 1.863 -7.508 7.938 1.00 0.00 C ATOM 406 CD1 TYR A 28 2.539 -8.039 9.027 1.00 0.00 C ATOM 407 CD2 TYR A 28 2.490 -6.513 7.198 1.00 0.00 C ATOM 408 CE1 TYR A 28 3.799 -7.596 9.369 1.00 0.00 C ATOM 409 CE2 TYR A 28 3.751 -6.062 7.535 1.00 0.00 C ATOM 410 CZ TYR A 28 4.401 -6.608 8.624 1.00 0.00 C ATOM 411 OH TYR A 28 5.665 -6.180 8.957 1.00 0.00 O ATOM 0 H TYR A 28 -1.803 -8.824 7.315 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.450 -7.606 9.450 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.481 -9.104 7.653 1.00 0.00 H new ATOM 0 HB3 TYR A 28 0.309 -7.788 6.508 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.070 -8.813 9.617 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.983 -6.085 6.346 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.312 -8.023 10.218 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.226 -5.287 6.951 1.00 0.00 H new ATOM 0 HH TYR A 28 5.763 -5.234 8.720 1.00 0.00 H new ATOM 421 N ILE A 29 -1.337 -5.574 7.009 1.00 0.00 N ATOM 422 CA ILE A 29 -1.529 -4.176 6.637 1.00 0.00 C ATOM 423 C ILE A 29 -2.553 -3.509 7.558 1.00 0.00 C ATOM 424 O ILE A 29 -2.384 -2.361 7.975 1.00 0.00 O ATOM 425 CB ILE A 29 -2.002 -4.070 5.171 1.00 0.00 C ATOM 426 CG1 ILE A 29 -1.026 -4.816 4.253 1.00 0.00 C ATOM 427 CG2 ILE A 29 -2.124 -2.611 4.750 1.00 0.00 C ATOM 428 CD1 ILE A 29 -1.540 -5.022 2.844 1.00 0.00 C ATOM 0 H ILE A 29 -1.671 -6.239 6.312 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.573 -3.662 6.742 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.987 -4.530 5.086 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.089 -4.261 4.209 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.801 -5.788 4.692 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.458 -2.558 3.714 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.847 -2.107 5.391 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -1.154 -2.123 4.843 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.792 -5.556 2.258 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.461 -5.604 2.874 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.738 -4.054 2.384 1.00 0.00 H new ATOM 440 N ILE A 30 -3.601 -4.255 7.880 1.00 0.00 N ATOM 441 CA ILE A 30 -4.665 -3.790 8.767 1.00 0.00 C ATOM 442 C ILE A 30 -4.111 -3.435 10.144 1.00 0.00 C ATOM 443 O ILE A 30 -4.470 -2.416 10.731 1.00 0.00 O ATOM 444 CB ILE A 30 -5.761 -4.872 8.913 1.00 0.00 C ATOM 445 CG1 ILE A 30 -6.496 -5.060 7.584 1.00 0.00 C ATOM 446 CG2 ILE A 30 -6.739 -4.519 10.028 1.00 0.00 C ATOM 447 CD1 ILE A 30 -7.376 -6.290 7.540 1.00 0.00 C ATOM 0 H ILE A 30 -3.740 -5.204 7.533 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.101 -2.895 8.323 1.00 0.00 H new ATOM 0 HB ILE A 30 -5.280 -5.812 9.182 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.109 -4.179 7.391 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -5.763 -5.121 6.780 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.498 -5.298 10.107 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.201 -4.440 10.973 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -7.219 -3.567 9.803 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.863 -6.354 6.567 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -6.767 -7.179 7.700 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -8.133 -6.224 8.321 1.00 0.00 H new ATOM 459 N ARG A 31 -3.210 -4.272 10.637 1.00 0.00 N ATOM 460 CA ARG A 31 -2.621 -4.079 11.953 1.00 0.00 C ATOM 461 C ARG A 31 -1.760 -2.826 11.983 1.00 0.00 C ATOM 462 O ARG A 31 -1.738 -2.089 12.971 1.00 0.00 O ATOM 463 CB ARG A 31 -1.769 -5.286 12.332 1.00 0.00 C ATOM 464 CG ARG A 31 -2.563 -6.560 12.553 1.00 0.00 C ATOM 465 CD ARG A 31 -1.640 -7.729 12.853 1.00 0.00 C ATOM 466 NE ARG A 31 -0.770 -7.440 13.995 1.00 0.00 N ATOM 467 CZ ARG A 31 0.186 -8.249 14.449 1.00 0.00 C ATOM 468 NH1 ARG A 31 0.381 -9.441 13.900 1.00 0.00 N ATOM 469 NH2 ARG A 31 0.947 -7.859 15.463 1.00 0.00 N ATOM 0 H ARG A 31 -2.870 -5.096 10.142 1.00 0.00 H new ATOM 0 HA ARG A 31 -3.433 -3.966 12.671 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -1.035 -5.460 11.546 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -1.214 -5.054 13.241 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -3.260 -6.420 13.379 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.159 -6.780 11.667 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.233 -8.619 13.061 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -1.031 -7.949 11.976 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.906 -6.553 14.479 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.204 -9.746 13.122 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.116 -10.052 14.256 1.00 0.00 H new ATOM 0 HH21 ARG A 31 0.798 -6.945 15.890 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.681 -8.473 15.816 1.00 0.00 H new ATOM 483 N CYS A 32 -1.062 -2.582 10.889 1.00 0.00 N ATOM 484 CA CYS A 32 -0.133 -1.468 10.807 1.00 0.00 C ATOM 485 C CYS A 32 -0.872 -0.145 10.614 1.00 0.00 C ATOM 486 O CYS A 32 -0.323 0.930 10.861 1.00 0.00 O ATOM 487 CB CYS A 32 0.838 -1.704 9.655 1.00 0.00 C ATOM 488 SG CYS A 32 1.830 -3.208 9.821 1.00 0.00 S ATOM 0 H CYS A 32 -1.121 -3.144 10.040 1.00 0.00 H new ATOM 0 HA CYS A 32 0.420 -1.405 11.744 1.00 0.00 H new ATOM 0 HB2 CYS A 32 0.274 -1.754 8.723 1.00 0.00 H new ATOM 0 HB3 CYS A 32 1.507 -0.847 9.577 1.00 0.00 H new ATOM 0 HG CYS A 32 1.103 -4.243 9.518 1.00 0.00 H new ATOM 494 N SER A 33 -2.124 -0.225 10.189 1.00 0.00 N ATOM 495 CA SER A 33 -2.912 0.969 9.941 1.00 0.00 C ATOM 496 C SER A 33 -3.927 1.208 11.054 1.00 0.00 C ATOM 497 O SER A 33 -3.655 1.945 12.007 1.00 0.00 O ATOM 498 CB SER A 33 -3.609 0.859 8.585 1.00 0.00 C ATOM 499 OG SER A 33 -4.239 -0.403 8.433 1.00 0.00 O ATOM 0 H SER A 33 -2.613 -1.102 10.010 1.00 0.00 H new ATOM 0 HA SER A 33 -2.239 1.826 9.925 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.350 1.652 8.489 1.00 0.00 H new ATOM 0 HB3 SER A 33 -2.881 1.004 7.786 1.00 0.00 H new ATOM 0 HG SER A 33 -3.572 -1.073 8.174 1.00 0.00 H new ATOM 505 N GLY A 34 -5.075 0.556 10.948 1.00 0.00 N ATOM 506 CA GLY A 34 -6.138 0.754 11.909 1.00 0.00 C ATOM 507 C GLY A 34 -7.202 1.705 11.389 1.00 0.00 C ATOM 508 O GLY A 34 -6.948 2.467 10.458 1.00 0.00 O ATOM 0 H GLY A 34 -5.290 -0.112 10.207 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -6.595 -0.206 12.148 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.721 1.148 12.836 1.00 0.00 H new ATOM 512 N PRO A 35 -8.409 1.681 11.966 1.00 0.00 N ATOM 513 CA PRO A 35 -9.503 2.560 11.550 1.00 0.00 C ATOM 514 C PRO A 35 -9.253 4.010 11.949 1.00 0.00 C ATOM 515 O PRO A 35 -8.532 4.284 12.913 1.00 0.00 O ATOM 516 CB PRO A 35 -10.728 2.010 12.296 1.00 0.00 C ATOM 517 CG PRO A 35 -10.295 0.703 12.870 1.00 0.00 C ATOM 518 CD PRO A 35 -8.812 0.803 13.066 1.00 0.00 C ATOM 0 HA PRO A 35 -9.623 2.568 10.467 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -11.049 2.695 13.080 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.573 1.880 11.620 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -10.800 0.507 13.816 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -10.544 -0.119 12.199 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -8.558 1.226 14.038 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -8.328 -0.172 13.006 1.00 0.00 H new ATOM 526 N GLY A 36 -9.828 4.933 11.191 1.00 0.00 N ATOM 527 CA GLY A 36 -9.717 6.343 11.522 1.00 0.00 C ATOM 528 C GLY A 36 -8.656 7.054 10.708 1.00 0.00 C ATOM 529 O GLY A 36 -8.741 8.262 10.484 1.00 0.00 O ATOM 0 H GLY A 36 -10.371 4.732 10.351 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -10.680 6.827 11.358 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.485 6.446 12.582 1.00 0.00 H new ATOM 533 N THR A 37 -7.660 6.310 10.256 1.00 0.00 N ATOM 534 CA THR A 37 -6.572 6.886 9.485 1.00 0.00 C ATOM 535 C THR A 37 -6.794 6.616 7.999 1.00 0.00 C ATOM 536 O THR A 37 -7.885 6.215 7.600 1.00 0.00 O ATOM 537 CB THR A 37 -5.201 6.334 9.947 1.00 0.00 C ATOM 538 OG1 THR A 37 -4.135 7.030 9.283 1.00 0.00 O ATOM 539 CG2 THR A 37 -5.080 4.841 9.676 1.00 0.00 C ATOM 0 H THR A 37 -7.583 5.305 10.410 1.00 0.00 H new ATOM 0 HA THR A 37 -6.562 7.963 9.652 1.00 0.00 H new ATOM 0 HB THR A 37 -5.128 6.494 11.023 1.00 0.00 H new ATOM 0 HG1 THR A 37 -3.480 7.334 9.946 1.00 0.00 H new ATOM 0 HG21 THR A 37 -4.105 4.488 10.013 1.00 0.00 H new ATOM 0 HG22 THR A 37 -5.865 4.309 10.214 1.00 0.00 H new ATOM 0 HG23 THR A 37 -5.183 4.656 8.607 1.00 0.00 H new ATOM 547 N ARG A 38 -5.770 6.840 7.190 1.00 0.00 N ATOM 548 CA ARG A 38 -5.875 6.688 5.756 1.00 0.00 C ATOM 549 C ARG A 38 -4.727 5.849 5.210 1.00 0.00 C ATOM 550 O ARG A 38 -3.572 6.008 5.615 1.00 0.00 O ATOM 551 CB ARG A 38 -5.922 8.055 5.057 1.00 0.00 C ATOM 552 CG ARG A 38 -4.726 8.965 5.304 1.00 0.00 C ATOM 553 CD ARG A 38 -4.690 9.509 6.725 1.00 0.00 C ATOM 554 NE ARG A 38 -5.965 10.096 7.134 1.00 0.00 N ATOM 555 CZ ARG A 38 -6.215 10.543 8.361 1.00 0.00 C ATOM 556 NH1 ARG A 38 -5.261 10.519 9.290 1.00 0.00 N ATOM 557 NH2 ARG A 38 -7.417 11.012 8.659 1.00 0.00 N ATOM 0 H ARG A 38 -4.847 7.131 7.513 1.00 0.00 H new ATOM 0 HA ARG A 38 -6.809 6.167 5.547 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -6.014 7.890 3.983 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -6.824 8.576 5.378 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -3.807 8.413 5.106 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -4.756 9.797 4.601 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -4.428 8.704 7.412 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -3.906 10.262 6.802 1.00 0.00 H new ATOM 0 HE ARG A 38 -6.706 10.167 6.437 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -4.335 10.157 9.061 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -5.456 10.863 10.230 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -8.148 11.030 7.948 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -7.612 11.356 9.599 1.00 0.00 H new ATOM 571 N VAL A 39 -5.064 4.941 4.310 1.00 0.00 N ATOM 572 CA VAL A 39 -4.092 4.053 3.687 1.00 0.00 C ATOM 573 C VAL A 39 -4.255 4.103 2.174 1.00 0.00 C ATOM 574 O VAL A 39 -5.375 4.084 1.678 1.00 0.00 O ATOM 575 CB VAL A 39 -4.267 2.597 4.181 1.00 0.00 C ATOM 576 CG1 VAL A 39 -3.317 1.655 3.457 1.00 0.00 C ATOM 577 CG2 VAL A 39 -4.052 2.514 5.681 1.00 0.00 C ATOM 0 H VAL A 39 -6.021 4.797 3.989 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.093 4.389 3.965 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.288 2.287 3.957 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.462 0.639 3.824 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.519 1.686 2.386 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.288 1.964 3.641 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.179 1.483 6.010 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.044 2.851 5.923 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.778 3.149 6.188 1.00 0.00 H new ATOM 587 N VAL A 40 -3.156 4.184 1.445 1.00 0.00 N ATOM 588 CA VAL A 40 -3.225 4.313 -0.005 1.00 0.00 C ATOM 589 C VAL A 40 -2.790 3.022 -0.699 1.00 0.00 C ATOM 590 O VAL A 40 -1.727 2.472 -0.405 1.00 0.00 O ATOM 591 CB VAL A 40 -2.357 5.488 -0.509 1.00 0.00 C ATOM 592 CG1 VAL A 40 -2.543 5.690 -2.004 1.00 0.00 C ATOM 593 CG2 VAL A 40 -2.686 6.765 0.251 1.00 0.00 C ATOM 0 H VAL A 40 -2.210 4.163 1.827 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.267 4.514 -0.255 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.311 5.242 -0.325 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.923 6.522 -2.339 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.250 4.783 -2.533 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -3.590 5.910 -2.214 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.064 7.580 -0.120 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.737 7.015 0.104 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.494 6.616 1.313 1.00 0.00 H new ATOM 603 N GLU A 41 -3.630 2.539 -1.604 1.00 0.00 N ATOM 604 CA GLU A 41 -3.310 1.368 -2.408 1.00 0.00 C ATOM 605 C GLU A 41 -2.992 1.795 -3.839 1.00 0.00 C ATOM 606 O GLU A 41 -3.834 2.379 -4.526 1.00 0.00 O ATOM 607 CB GLU A 41 -4.470 0.366 -2.396 1.00 0.00 C ATOM 608 CG GLU A 41 -4.228 -0.859 -3.266 1.00 0.00 C ATOM 609 CD GLU A 41 -5.348 -1.879 -3.170 1.00 0.00 C ATOM 610 OE1 GLU A 41 -6.362 -1.731 -3.885 1.00 0.00 O ATOM 611 OE2 GLU A 41 -5.215 -2.831 -2.379 1.00 0.00 O ATOM 0 H GLU A 41 -4.545 2.944 -1.801 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.436 0.878 -1.979 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -4.649 0.043 -1.370 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -5.376 0.868 -2.735 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.116 -0.546 -4.304 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.289 -1.328 -2.972 1.00 0.00 H new ATOM 618 N VAL A 42 -1.768 1.521 -4.270 1.00 0.00 N ATOM 619 CA VAL A 42 -1.325 1.888 -5.607 1.00 0.00 C ATOM 620 C VAL A 42 -1.453 0.705 -6.560 1.00 0.00 C ATOM 621 O VAL A 42 -0.850 -0.351 -6.343 1.00 0.00 O ATOM 622 CB VAL A 42 0.141 2.383 -5.605 1.00 0.00 C ATOM 623 CG1 VAL A 42 0.592 2.763 -7.010 1.00 0.00 C ATOM 624 CG2 VAL A 42 0.307 3.560 -4.654 1.00 0.00 C ATOM 0 H VAL A 42 -1.062 1.044 -3.710 1.00 0.00 H new ATOM 0 HA VAL A 42 -1.967 2.701 -5.945 1.00 0.00 H new ATOM 0 HB VAL A 42 0.772 1.565 -5.257 1.00 0.00 H new ATOM 0 HG11 VAL A 42 1.626 3.107 -6.980 1.00 0.00 H new ATOM 0 HG12 VAL A 42 0.518 1.894 -7.663 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -0.045 3.560 -7.393 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.344 3.894 -4.666 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -0.341 4.377 -4.970 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.037 3.252 -3.644 1.00 0.00 H new ATOM 634 N GLY A 43 -2.241 0.888 -7.609 1.00 0.00 N ATOM 635 CA GLY A 43 -2.430 -0.163 -8.585 1.00 0.00 C ATOM 636 C GLY A 43 -3.631 -1.026 -8.268 1.00 0.00 C ATOM 637 O GLY A 43 -3.551 -2.252 -8.296 1.00 0.00 O ATOM 0 H GLY A 43 -2.754 1.748 -7.801 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.553 0.279 -9.574 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.537 -0.786 -8.623 1.00 0.00 H new ATOM 641 N ALA A 44 -4.754 -0.374 -7.992 1.00 0.00 N ATOM 642 CA ALA A 44 -5.986 -1.058 -7.600 1.00 0.00 C ATOM 643 C ALA A 44 -6.729 -1.617 -8.819 1.00 0.00 C ATOM 644 O ALA A 44 -7.959 -1.572 -8.890 1.00 0.00 O ATOM 645 CB ALA A 44 -6.875 -0.093 -6.826 1.00 0.00 C ATOM 0 H ALA A 44 -4.839 0.642 -8.033 1.00 0.00 H new ATOM 0 HA ALA A 44 -5.727 -1.903 -6.963 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -7.794 -0.600 -6.533 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -6.350 0.250 -5.935 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -7.118 0.763 -7.456 1.00 0.00 H new ATOM 651 N GLY A 45 -5.979 -2.181 -9.757 1.00 0.00 N ATOM 652 CA GLY A 45 -6.573 -2.710 -10.968 1.00 0.00 C ATOM 653 C GLY A 45 -7.158 -4.094 -10.764 1.00 0.00 C ATOM 654 O GLY A 45 -6.517 -5.093 -11.089 1.00 0.00 O ATOM 0 H GLY A 45 -4.966 -2.281 -9.699 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -7.356 -2.034 -11.312 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -5.818 -2.749 -11.753 1.00 0.00 H new ATOM 658 N ARG A 46 -8.374 -4.138 -10.218 1.00 0.00 N ATOM 659 CA ARG A 46 -9.086 -5.392 -9.938 1.00 0.00 C ATOM 660 C ARG A 46 -8.447 -6.143 -8.776 1.00 0.00 C ATOM 661 O ARG A 46 -8.752 -7.308 -8.528 1.00 0.00 O ATOM 662 CB ARG A 46 -9.154 -6.289 -11.177 1.00 0.00 C ATOM 663 CG ARG A 46 -10.112 -5.784 -12.243 1.00 0.00 C ATOM 664 CD ARG A 46 -10.061 -6.653 -13.486 1.00 0.00 C ATOM 665 NE ARG A 46 -8.754 -6.595 -14.138 1.00 0.00 N ATOM 666 CZ ARG A 46 -8.292 -7.524 -14.971 1.00 0.00 C ATOM 667 NH1 ARG A 46 -9.004 -8.615 -15.226 1.00 0.00 N ATOM 668 NH2 ARG A 46 -7.101 -7.369 -15.532 1.00 0.00 N ATOM 0 H ARG A 46 -8.898 -3.303 -9.955 1.00 0.00 H new ATOM 0 HA ARG A 46 -10.105 -5.125 -9.657 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -8.157 -6.375 -11.608 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -9.457 -7.291 -10.873 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -11.127 -5.772 -11.846 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -9.860 -4.756 -12.504 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -10.287 -7.685 -13.217 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -10.831 -6.330 -14.187 1.00 0.00 H new ATOM 0 HE ARG A 46 -8.158 -5.791 -13.942 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -9.913 -8.746 -14.782 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -8.642 -9.322 -15.866 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -6.543 -6.541 -15.324 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -6.742 -8.078 -16.171 1.00 0.00 H new ATOM 682 N PHE A 47 -7.578 -5.458 -8.045 1.00 0.00 N ATOM 683 CA PHE A 47 -6.946 -6.034 -6.866 1.00 0.00 C ATOM 684 C PHE A 47 -7.677 -5.571 -5.614 1.00 0.00 C ATOM 685 O PHE A 47 -7.183 -5.712 -4.494 1.00 0.00 O ATOM 686 CB PHE A 47 -5.472 -5.632 -6.799 1.00 0.00 C ATOM 687 CG PHE A 47 -4.652 -6.142 -7.949 1.00 0.00 C ATOM 688 CD1 PHE A 47 -4.389 -7.494 -8.080 1.00 0.00 C ATOM 689 CD2 PHE A 47 -4.144 -5.270 -8.897 1.00 0.00 C ATOM 690 CE1 PHE A 47 -3.633 -7.968 -9.135 1.00 0.00 C ATOM 691 CE2 PHE A 47 -3.389 -5.737 -9.954 1.00 0.00 C ATOM 692 CZ PHE A 47 -3.132 -7.088 -10.074 1.00 0.00 C ATOM 0 H PHE A 47 -7.294 -4.500 -8.249 1.00 0.00 H new ATOM 0 HA PHE A 47 -7.002 -7.121 -6.930 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.403 -4.545 -6.769 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.045 -6.004 -5.867 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -4.779 -8.187 -7.349 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -4.341 -4.212 -8.808 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -3.434 -9.026 -9.225 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -3.000 -5.046 -10.687 1.00 0.00 H new ATOM 0 HZ PHE A 47 -2.541 -7.456 -10.900 1.00 0.00 H new ATOM 702 N LEU A 48 -8.888 -5.072 -5.829 1.00 0.00 N ATOM 703 CA LEU A 48 -9.700 -4.472 -4.774 1.00 0.00 C ATOM 704 C LEU A 48 -10.047 -5.467 -3.671 1.00 0.00 C ATOM 705 O LEU A 48 -10.575 -5.080 -2.636 1.00 0.00 O ATOM 706 CB LEU A 48 -10.995 -3.914 -5.366 1.00 0.00 C ATOM 707 CG LEU A 48 -10.817 -2.870 -6.469 1.00 0.00 C ATOM 708 CD1 LEU A 48 -12.173 -2.398 -6.974 1.00 0.00 C ATOM 709 CD2 LEU A 48 -10.000 -1.694 -5.964 1.00 0.00 C ATOM 0 H LEU A 48 -9.338 -5.071 -6.744 1.00 0.00 H new ATOM 0 HA LEU A 48 -9.106 -3.672 -4.331 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -11.579 -4.743 -5.765 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -11.581 -3.471 -4.561 1.00 0.00 H new ATOM 0 HG LEU A 48 -10.279 -3.331 -7.297 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -12.031 -1.655 -7.759 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -12.728 -3.247 -7.374 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -12.733 -1.954 -6.151 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -9.884 -0.962 -6.763 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -10.511 -1.232 -5.119 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -9.017 -2.043 -5.646 1.00 0.00 H new ATOM 721 N TYR A 49 -9.767 -6.742 -3.897 1.00 0.00 N ATOM 722 CA TYR A 49 -10.041 -7.769 -2.904 1.00 0.00 C ATOM 723 C TYR A 49 -9.317 -7.465 -1.594 1.00 0.00 C ATOM 724 O TYR A 49 -9.862 -7.676 -0.511 1.00 0.00 O ATOM 725 CB TYR A 49 -9.622 -9.142 -3.430 1.00 0.00 C ATOM 726 CG TYR A 49 -9.801 -10.256 -2.419 1.00 0.00 C ATOM 727 CD1 TYR A 49 -11.069 -10.670 -2.032 1.00 0.00 C ATOM 728 CD2 TYR A 49 -8.702 -10.883 -1.847 1.00 0.00 C ATOM 729 CE1 TYR A 49 -11.236 -11.677 -1.100 1.00 0.00 C ATOM 730 CE2 TYR A 49 -8.861 -11.890 -0.918 1.00 0.00 C ATOM 731 CZ TYR A 49 -10.129 -12.282 -0.546 1.00 0.00 C ATOM 732 OH TYR A 49 -10.288 -13.286 0.384 1.00 0.00 O ATOM 0 H TYR A 49 -9.350 -7.090 -4.760 1.00 0.00 H new ATOM 0 HA TYR A 49 -11.114 -7.777 -2.710 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -10.204 -9.374 -4.322 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -8.576 -9.102 -3.734 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -11.938 -10.198 -2.466 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -7.707 -10.577 -2.134 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -12.228 -11.988 -0.808 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -7.996 -12.369 -0.484 1.00 0.00 H new ATOM 0 HH TYR A 49 -9.447 -13.419 0.869 1.00 0.00 H new ATOM 742 N VAL A 50 -8.097 -6.956 -1.700 1.00 0.00 N ATOM 743 CA VAL A 50 -7.300 -6.643 -0.524 1.00 0.00 C ATOM 744 C VAL A 50 -7.835 -5.393 0.164 1.00 0.00 C ATOM 745 O VAL A 50 -8.163 -5.422 1.351 1.00 0.00 O ATOM 746 CB VAL A 50 -5.814 -6.436 -0.891 1.00 0.00 C ATOM 747 CG1 VAL A 50 -4.979 -6.136 0.349 1.00 0.00 C ATOM 748 CG2 VAL A 50 -5.271 -7.655 -1.625 1.00 0.00 C ATOM 0 H VAL A 50 -7.639 -6.752 -2.588 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.372 -7.490 0.158 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.746 -5.575 -1.555 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.937 -5.995 0.061 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.350 -5.229 0.826 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.052 -6.970 1.047 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.223 -7.492 -1.876 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.358 -8.533 -0.986 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.842 -7.813 -2.540 1.00 0.00 H new ATOM 758 N SER A 51 -7.947 -4.311 -0.594 1.00 0.00 N ATOM 759 CA SER A 51 -8.431 -3.048 -0.067 1.00 0.00 C ATOM 760 C SER A 51 -9.849 -3.172 0.498 1.00 0.00 C ATOM 761 O SER A 51 -10.166 -2.578 1.531 1.00 0.00 O ATOM 762 CB SER A 51 -8.369 -1.981 -1.160 1.00 0.00 C ATOM 763 OG SER A 51 -8.550 -2.555 -2.446 1.00 0.00 O ATOM 0 H SER A 51 -7.706 -4.286 -1.585 1.00 0.00 H new ATOM 0 HA SER A 51 -7.787 -2.753 0.761 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.138 -1.229 -0.983 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.407 -1.469 -1.119 1.00 0.00 H new ATOM 0 HG SER A 51 -7.844 -2.238 -3.048 1.00 0.00 H new ATOM 769 N ASP A 52 -10.695 -3.954 -0.166 1.00 0.00 N ATOM 770 CA ASP A 52 -12.069 -4.152 0.290 1.00 0.00 C ATOM 771 C ASP A 52 -12.113 -5.008 1.551 1.00 0.00 C ATOM 772 O ASP A 52 -12.952 -4.791 2.429 1.00 0.00 O ATOM 773 CB ASP A 52 -12.926 -4.790 -0.804 1.00 0.00 C ATOM 774 CG ASP A 52 -14.346 -5.033 -0.348 1.00 0.00 C ATOM 775 OD1 ASP A 52 -15.087 -4.047 -0.146 1.00 0.00 O ATOM 776 OD2 ASP A 52 -14.731 -6.209 -0.190 1.00 0.00 O ATOM 0 H ASP A 52 -10.455 -4.460 -1.019 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.478 -3.169 0.524 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -12.934 -4.143 -1.681 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -12.478 -5.735 -1.109 1.00 0.00 H new ATOM 781 N TYR A 53 -11.216 -5.983 1.634 1.00 0.00 N ATOM 782 CA TYR A 53 -11.087 -6.800 2.834 1.00 0.00 C ATOM 783 C TYR A 53 -10.707 -5.912 4.017 1.00 0.00 C ATOM 784 O TYR A 53 -11.333 -5.962 5.077 1.00 0.00 O ATOM 785 CB TYR A 53 -10.035 -7.901 2.619 1.00 0.00 C ATOM 786 CG TYR A 53 -9.781 -8.789 3.826 1.00 0.00 C ATOM 787 CD1 TYR A 53 -8.840 -8.434 4.785 1.00 0.00 C ATOM 788 CD2 TYR A 53 -10.475 -9.982 4.004 1.00 0.00 C ATOM 789 CE1 TYR A 53 -8.600 -9.237 5.884 1.00 0.00 C ATOM 790 CE2 TYR A 53 -10.240 -10.787 5.102 1.00 0.00 C ATOM 791 CZ TYR A 53 -9.302 -10.411 6.038 1.00 0.00 C ATOM 792 OH TYR A 53 -9.065 -11.213 7.132 1.00 0.00 O ATOM 0 H TYR A 53 -10.568 -6.227 0.885 1.00 0.00 H new ATOM 0 HA TYR A 53 -12.041 -7.282 3.047 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -10.352 -8.528 1.785 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -9.095 -7.433 2.327 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -8.286 -7.514 4.669 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -11.209 -10.284 3.272 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -7.865 -8.945 6.619 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -10.790 -11.708 5.226 1.00 0.00 H new ATOM 0 HH TYR A 53 -9.644 -12.003 7.090 1.00 0.00 H new ATOM 802 N ILE A 54 -9.695 -5.081 3.811 1.00 0.00 N ATOM 803 CA ILE A 54 -9.209 -4.185 4.851 1.00 0.00 C ATOM 804 C ILE A 54 -10.292 -3.207 5.312 1.00 0.00 C ATOM 805 O ILE A 54 -10.572 -3.112 6.507 1.00 0.00 O ATOM 806 CB ILE A 54 -7.972 -3.397 4.371 1.00 0.00 C ATOM 807 CG1 ILE A 54 -6.835 -4.366 4.035 1.00 0.00 C ATOM 808 CG2 ILE A 54 -7.529 -2.387 5.426 1.00 0.00 C ATOM 809 CD1 ILE A 54 -5.601 -3.690 3.484 1.00 0.00 C ATOM 0 H ILE A 54 -9.192 -5.009 2.927 1.00 0.00 H new ATOM 0 HA ILE A 54 -8.928 -4.811 5.698 1.00 0.00 H new ATOM 0 HB ILE A 54 -8.238 -2.843 3.471 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -6.564 -4.919 4.934 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -7.194 -5.095 3.308 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.656 -1.844 5.065 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -8.339 -1.684 5.620 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -7.275 -2.911 6.347 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -4.840 -4.440 3.270 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.856 -3.160 2.566 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.216 -2.982 4.218 1.00 0.00 H new ATOM 821 N ARG A 55 -10.915 -2.513 4.360 1.00 0.00 N ATOM 822 CA ARG A 55 -11.869 -1.446 4.681 1.00 0.00 C ATOM 823 C ARG A 55 -13.121 -1.976 5.389 1.00 0.00 C ATOM 824 O ARG A 55 -13.842 -1.216 6.037 1.00 0.00 O ATOM 825 CB ARG A 55 -12.273 -0.675 3.417 1.00 0.00 C ATOM 826 CG ARG A 55 -13.075 -1.494 2.415 1.00 0.00 C ATOM 827 CD ARG A 55 -13.481 -0.659 1.209 1.00 0.00 C ATOM 828 NE ARG A 55 -14.254 -1.434 0.238 1.00 0.00 N ATOM 829 CZ ARG A 55 -14.786 -0.932 -0.876 1.00 0.00 C ATOM 830 NH1 ARG A 55 -14.656 0.360 -1.165 1.00 0.00 N ATOM 831 NH2 ARG A 55 -15.458 -1.728 -1.697 1.00 0.00 N ATOM 0 H ARG A 55 -10.778 -2.668 3.361 1.00 0.00 H new ATOM 0 HA ARG A 55 -11.360 -0.770 5.368 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.859 0.197 3.709 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -11.372 -0.304 2.928 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.483 -2.348 2.085 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -13.966 -1.892 2.900 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.070 0.195 1.542 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -12.588 -0.262 0.727 1.00 0.00 H new ATOM 0 HE ARG A 55 -14.395 -2.426 0.427 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.146 0.975 -0.532 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.067 0.735 -2.020 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -15.565 -2.718 -1.474 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -15.868 -1.351 -2.551 1.00 0.00 H new ATOM 845 N LYS A 56 -13.388 -3.270 5.261 1.00 0.00 N ATOM 846 CA LYS A 56 -14.542 -3.861 5.925 1.00 0.00 C ATOM 847 C LYS A 56 -14.206 -4.306 7.342 1.00 0.00 C ATOM 848 O LYS A 56 -15.020 -4.152 8.256 1.00 0.00 O ATOM 849 CB LYS A 56 -15.107 -5.035 5.129 1.00 0.00 C ATOM 850 CG LYS A 56 -16.289 -4.649 4.255 1.00 0.00 C ATOM 851 CD LYS A 56 -17.021 -5.872 3.724 1.00 0.00 C ATOM 852 CE LYS A 56 -16.495 -6.313 2.366 1.00 0.00 C ATOM 853 NZ LYS A 56 -15.063 -6.707 2.403 1.00 0.00 N ATOM 0 H LYS A 56 -12.829 -3.922 4.711 1.00 0.00 H new ATOM 0 HA LYS A 56 -15.304 -3.084 5.980 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -14.320 -5.453 4.501 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -15.415 -5.820 5.820 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -16.980 -4.033 4.830 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -15.940 -4.042 3.419 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -16.918 -6.692 4.435 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -18.085 -5.650 3.645 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -17.089 -7.153 2.007 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -16.625 -5.501 1.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -14.767 -7.030 1.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -14.485 -5.890 2.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -14.933 -7.477 3.089 1.00 0.00 H new ATOM 867 N HIS A 57 -13.011 -4.849 7.527 1.00 0.00 N ATOM 868 CA HIS A 57 -12.580 -5.304 8.843 1.00 0.00 C ATOM 869 C HIS A 57 -12.194 -4.122 9.721 1.00 0.00 C ATOM 870 O HIS A 57 -12.374 -4.159 10.939 1.00 0.00 O ATOM 871 CB HIS A 57 -11.418 -6.293 8.723 1.00 0.00 C ATOM 872 CG HIS A 57 -11.850 -7.654 8.266 1.00 0.00 C ATOM 873 ND1 HIS A 57 -11.827 -8.735 9.112 1.00 0.00 N ATOM 874 CD2 HIS A 57 -12.335 -8.047 7.064 1.00 0.00 C ATOM 875 CE1 HIS A 57 -12.300 -9.754 8.412 1.00 0.00 C ATOM 876 NE2 HIS A 57 -12.623 -9.385 7.164 1.00 0.00 N ATOM 0 H HIS A 57 -12.324 -4.985 6.786 1.00 0.00 H new ATOM 0 HA HIS A 57 -13.416 -5.820 9.315 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -10.683 -5.897 8.022 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -10.922 -6.381 9.690 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -12.470 -7.425 6.192 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -12.412 -10.757 8.798 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -13.008 -9.982 6.432 1.00 0.00 H new ATOM 884 N SER A 58 -11.662 -3.083 9.102 1.00 0.00 N ATOM 885 CA SER A 58 -11.355 -1.848 9.796 1.00 0.00 C ATOM 886 C SER A 58 -11.742 -0.663 8.934 1.00 0.00 C ATOM 887 O SER A 58 -11.353 -0.583 7.770 1.00 0.00 O ATOM 888 CB SER A 58 -9.872 -1.795 10.142 1.00 0.00 C ATOM 889 OG SER A 58 -9.525 -2.840 11.038 1.00 0.00 O ATOM 0 H SER A 58 -11.432 -3.073 8.108 1.00 0.00 H new ATOM 0 HA SER A 58 -11.927 -1.808 10.723 1.00 0.00 H new ATOM 0 HB2 SER A 58 -9.278 -1.879 9.232 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.633 -0.831 10.591 1.00 0.00 H new ATOM 0 HG SER A 58 -8.614 -2.697 11.370 1.00 0.00 H new ATOM 895 N LYS A 59 -12.515 0.254 9.499 1.00 0.00 N ATOM 896 CA LYS A 59 -12.991 1.400 8.748 1.00 0.00 C ATOM 897 C LYS A 59 -11.900 2.457 8.619 1.00 0.00 C ATOM 898 O LYS A 59 -11.995 3.567 9.153 1.00 0.00 O ATOM 899 CB LYS A 59 -14.248 1.984 9.387 1.00 0.00 C ATOM 900 CG LYS A 59 -15.035 2.895 8.456 1.00 0.00 C ATOM 901 CD LYS A 59 -15.411 2.180 7.162 1.00 0.00 C ATOM 902 CE LYS A 59 -16.348 1.006 7.413 1.00 0.00 C ATOM 903 NZ LYS A 59 -17.714 1.448 7.795 1.00 0.00 N ATOM 0 H LYS A 59 -12.823 0.225 10.471 1.00 0.00 H new ATOM 0 HA LYS A 59 -13.250 1.063 7.744 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -14.892 1.168 9.714 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -13.966 2.545 10.278 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -15.939 3.238 8.959 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -14.443 3.780 8.225 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -15.888 2.886 6.483 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -14.507 1.824 6.668 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -16.405 0.391 6.515 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -15.937 0.378 8.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -18.325 0.616 7.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -17.669 1.985 8.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -18.105 2.053 7.045 1.00 0.00 H new ATOM 917 N VAL A 60 -10.843 2.065 7.944 1.00 0.00 N ATOM 918 CA VAL A 60 -9.772 2.970 7.583 1.00 0.00 C ATOM 919 C VAL A 60 -10.116 3.663 6.265 1.00 0.00 C ATOM 920 O VAL A 60 -10.716 3.054 5.375 1.00 0.00 O ATOM 921 CB VAL A 60 -8.430 2.207 7.457 1.00 0.00 C ATOM 922 CG1 VAL A 60 -8.524 1.090 6.430 1.00 0.00 C ATOM 923 CG2 VAL A 60 -7.293 3.150 7.114 1.00 0.00 C ATOM 0 H VAL A 60 -10.700 1.106 7.628 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.661 3.720 8.367 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.219 1.758 8.427 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -7.566 0.574 6.365 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.297 0.383 6.731 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.776 1.511 5.457 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.364 2.585 7.032 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.503 3.643 6.165 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -7.194 3.900 7.898 1.00 0.00 H new ATOM 933 N ASP A 61 -9.771 4.937 6.152 1.00 0.00 N ATOM 934 CA ASP A 61 -10.036 5.689 4.933 1.00 0.00 C ATOM 935 C ASP A 61 -9.022 5.294 3.870 1.00 0.00 C ATOM 936 O ASP A 61 -7.938 5.866 3.774 1.00 0.00 O ATOM 937 CB ASP A 61 -9.983 7.195 5.206 1.00 0.00 C ATOM 938 CG ASP A 61 -10.456 8.028 4.030 1.00 0.00 C ATOM 939 OD1 ASP A 61 -11.657 7.959 3.694 1.00 0.00 O ATOM 940 OD2 ASP A 61 -9.643 8.792 3.466 1.00 0.00 O ATOM 0 H ASP A 61 -9.308 5.471 6.887 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.038 5.454 4.574 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -10.599 7.423 6.076 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.960 7.477 5.456 1.00 0.00 H new ATOM 945 N LEU A 62 -9.360 4.274 3.106 1.00 0.00 N ATOM 946 CA LEU A 62 -8.432 3.714 2.143 1.00 0.00 C ATOM 947 C LEU A 62 -8.575 4.412 0.796 1.00 0.00 C ATOM 948 O LEU A 62 -9.657 4.443 0.205 1.00 0.00 O ATOM 949 CB LEU A 62 -8.668 2.206 2.015 1.00 0.00 C ATOM 950 CG LEU A 62 -7.432 1.371 1.667 1.00 0.00 C ATOM 951 CD1 LEU A 62 -7.711 -0.098 1.914 1.00 0.00 C ATOM 952 CD2 LEU A 62 -7.014 1.586 0.222 1.00 0.00 C ATOM 0 H LEU A 62 -10.271 3.816 3.133 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.412 3.875 2.491 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.079 1.839 2.956 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.425 2.038 1.249 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.613 1.695 2.309 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -6.826 -0.683 1.664 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.961 -0.249 2.964 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.547 -0.419 1.292 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.134 0.981 0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.829 1.293 -0.440 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.778 2.638 0.064 1.00 0.00 H new ATOM 964 N VAL A 63 -7.473 4.966 0.322 1.00 0.00 N ATOM 965 CA VAL A 63 -7.450 5.699 -0.927 1.00 0.00 C ATOM 966 C VAL A 63 -6.847 4.835 -2.023 1.00 0.00 C ATOM 967 O VAL A 63 -5.718 4.363 -1.903 1.00 0.00 O ATOM 968 CB VAL A 63 -6.633 7.000 -0.805 1.00 0.00 C ATOM 969 CG1 VAL A 63 -6.703 7.802 -2.097 1.00 0.00 C ATOM 970 CG2 VAL A 63 -7.117 7.833 0.372 1.00 0.00 C ATOM 0 H VAL A 63 -6.570 4.919 0.794 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.479 5.959 -1.176 1.00 0.00 H new ATOM 0 HB VAL A 63 -5.592 6.732 -0.626 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -6.120 8.716 -1.990 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -6.299 7.208 -2.916 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -7.741 8.057 -2.311 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -6.526 8.746 0.439 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -8.167 8.090 0.229 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -7.006 7.261 1.293 1.00 0.00 H new ATOM 980 N LEU A 64 -7.608 4.614 -3.074 1.00 0.00 N ATOM 981 CA LEU A 64 -7.152 3.811 -4.192 1.00 0.00 C ATOM 982 C LEU A 64 -6.691 4.716 -5.327 1.00 0.00 C ATOM 983 O LEU A 64 -7.399 5.652 -5.697 1.00 0.00 O ATOM 984 CB LEU A 64 -8.285 2.906 -4.672 1.00 0.00 C ATOM 985 CG LEU A 64 -8.898 2.013 -3.590 1.00 0.00 C ATOM 986 CD1 LEU A 64 -10.141 1.316 -4.108 1.00 0.00 C ATOM 987 CD2 LEU A 64 -7.882 0.990 -3.116 1.00 0.00 C ATOM 0 H LEU A 64 -8.553 4.982 -3.179 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.314 3.193 -3.871 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -9.072 3.528 -5.098 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -7.909 2.273 -5.476 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.184 2.643 -2.748 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.560 0.687 -3.322 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -10.878 2.061 -4.407 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.880 0.698 -4.967 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.330 0.361 -2.347 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -7.571 0.369 -3.956 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -7.013 1.504 -2.704 1.00 0.00 H new ATOM 999 N THR A 65 -5.509 4.449 -5.864 1.00 0.00 N ATOM 1000 CA THR A 65 -4.985 5.228 -6.978 1.00 0.00 C ATOM 1001 C THR A 65 -4.455 4.320 -8.085 1.00 0.00 C ATOM 1002 O THR A 65 -3.800 3.307 -7.817 1.00 0.00 O ATOM 1003 CB THR A 65 -3.868 6.196 -6.524 1.00 0.00 C ATOM 1004 OG1 THR A 65 -2.930 5.511 -5.683 1.00 0.00 O ATOM 1005 CG2 THR A 65 -4.451 7.390 -5.778 1.00 0.00 C ATOM 0 H THR A 65 -4.894 3.699 -5.547 1.00 0.00 H new ATOM 0 HA THR A 65 -5.815 5.817 -7.368 1.00 0.00 H new ATOM 0 HB THR A 65 -3.355 6.560 -7.414 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.934 4.555 -5.900 1.00 0.00 H new ATOM 0 HG21 THR A 65 -3.645 8.055 -5.470 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.136 7.929 -6.433 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.990 7.041 -4.897 1.00 0.00 H new ATOM 1013 N ASP A 66 -4.764 4.678 -9.325 1.00 0.00 N ATOM 1014 CA ASP A 66 -4.286 3.941 -10.490 1.00 0.00 C ATOM 1015 C ASP A 66 -4.492 4.781 -11.743 1.00 0.00 C ATOM 1016 O ASP A 66 -5.318 5.697 -11.746 1.00 0.00 O ATOM 1017 CB ASP A 66 -5.015 2.597 -10.625 1.00 0.00 C ATOM 1018 CG ASP A 66 -4.467 1.752 -11.760 1.00 0.00 C ATOM 1019 OD1 ASP A 66 -3.233 1.579 -11.833 1.00 0.00 O ATOM 1020 OD2 ASP A 66 -5.262 1.277 -12.592 1.00 0.00 O ATOM 0 H ASP A 66 -5.349 5.482 -9.552 1.00 0.00 H new ATOM 0 HA ASP A 66 -3.223 3.736 -10.363 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -4.928 2.044 -9.690 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -6.077 2.778 -10.791 1.00 0.00 H new ATOM 1025 N ILE A 67 -3.743 4.482 -12.795 1.00 0.00 N ATOM 1026 CA ILE A 67 -3.842 5.240 -14.033 1.00 0.00 C ATOM 1027 C ILE A 67 -5.152 4.921 -14.750 1.00 0.00 C ATOM 1028 O ILE A 67 -5.255 3.917 -15.458 1.00 0.00 O ATOM 1029 CB ILE A 67 -2.656 4.952 -14.982 1.00 0.00 C ATOM 1030 CG1 ILE A 67 -1.319 5.198 -14.270 1.00 0.00 C ATOM 1031 CG2 ILE A 67 -2.754 5.819 -16.234 1.00 0.00 C ATOM 1032 CD1 ILE A 67 -1.097 6.636 -13.845 1.00 0.00 C ATOM 0 H ILE A 67 -3.062 3.722 -12.816 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.816 6.296 -13.765 1.00 0.00 H new ATOM 0 HB ILE A 67 -2.702 3.904 -15.277 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -1.266 4.558 -13.389 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -0.507 4.897 -14.932 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -1.912 5.604 -16.892 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -3.686 5.601 -16.755 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -2.734 6.871 -15.950 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.130 6.724 -13.350 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -1.115 7.282 -14.723 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -1.886 6.938 -13.156 1.00 0.00 H new ATOM 1044 N LYS A 68 -6.146 5.783 -14.535 1.00 0.00 N ATOM 1045 CA LYS A 68 -7.465 5.655 -15.160 1.00 0.00 C ATOM 1046 C LYS A 68 -8.176 4.376 -14.713 1.00 0.00 C ATOM 1047 O LYS A 68 -8.027 3.319 -15.330 1.00 0.00 O ATOM 1048 CB LYS A 68 -7.355 5.699 -16.687 1.00 0.00 C ATOM 1049 CG LYS A 68 -6.663 6.947 -17.208 1.00 0.00 C ATOM 1050 CD LYS A 68 -6.599 6.959 -18.724 1.00 0.00 C ATOM 1051 CE LYS A 68 -5.905 8.211 -19.237 1.00 0.00 C ATOM 1052 NZ LYS A 68 -6.562 9.451 -18.743 1.00 0.00 N ATOM 0 H LYS A 68 -6.060 6.593 -13.921 1.00 0.00 H new ATOM 0 HA LYS A 68 -8.064 6.505 -14.832 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -6.809 4.820 -17.030 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -8.355 5.641 -17.117 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -7.196 7.832 -16.859 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -5.654 7.001 -16.800 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.066 6.075 -19.075 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.608 6.906 -19.133 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -4.862 8.203 -18.922 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -5.909 8.208 -20.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.574 10.163 -19.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -7.538 9.236 -18.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -6.034 9.822 -17.928 1.00 0.00 H new ATOM 1066 N PRO A 69 -8.950 4.460 -13.626 1.00 0.00 N ATOM 1067 CA PRO A 69 -9.674 3.317 -13.079 1.00 0.00 C ATOM 1068 C PRO A 69 -11.011 3.078 -13.775 1.00 0.00 C ATOM 1069 O PRO A 69 -11.471 3.901 -14.568 1.00 0.00 O ATOM 1070 CB PRO A 69 -9.895 3.733 -11.630 1.00 0.00 C ATOM 1071 CG PRO A 69 -10.043 5.215 -11.689 1.00 0.00 C ATOM 1072 CD PRO A 69 -9.172 5.681 -12.828 1.00 0.00 C ATOM 0 HA PRO A 69 -9.128 2.382 -13.204 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -10.784 3.261 -11.212 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -9.054 3.442 -11.000 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -11.083 5.496 -11.855 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -9.734 5.674 -10.750 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -9.663 6.458 -13.414 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -8.232 6.099 -12.467 1.00 0.00 H new ATOM 1122 N ILE A 74 -12.030 4.938 -7.073 1.00 0.00 N ATOM 1123 CA ILE A 74 -10.590 5.013 -7.236 1.00 0.00 C ATOM 1124 C ILE A 74 -10.196 6.345 -7.865 1.00 0.00 C ATOM 1125 O ILE A 74 -10.819 6.796 -8.829 1.00 0.00 O ATOM 1126 CB ILE A 74 -10.078 3.854 -8.118 1.00 0.00 C ATOM 1127 CG1 ILE A 74 -10.527 2.516 -7.529 1.00 0.00 C ATOM 1128 CG2 ILE A 74 -8.561 3.899 -8.252 1.00 0.00 C ATOM 1129 CD1 ILE A 74 -10.175 1.329 -8.389 1.00 0.00 C ATOM 0 HA ILE A 74 -10.134 4.932 -6.249 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.504 3.963 -9.116 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.072 2.390 -6.547 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -11.606 2.538 -7.380 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -8.226 3.072 -8.878 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -8.264 4.843 -8.709 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -8.106 3.814 -7.265 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -10.524 0.415 -7.908 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -10.652 1.432 -9.364 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -9.094 1.281 -8.518 1.00 0.00 H new ATOM 1141 N VAL A 75 -9.169 6.970 -7.309 1.00 0.00 N ATOM 1142 CA VAL A 75 -8.678 8.239 -7.815 1.00 0.00 C ATOM 1143 C VAL A 75 -7.944 8.028 -9.135 1.00 0.00 C ATOM 1144 O VAL A 75 -7.112 7.125 -9.255 1.00 0.00 O ATOM 1145 CB VAL A 75 -7.738 8.924 -6.799 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -7.270 10.276 -7.314 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -8.427 9.078 -5.452 1.00 0.00 C ATOM 0 H VAL A 75 -8.658 6.614 -6.501 1.00 0.00 H new ATOM 0 HA VAL A 75 -9.538 8.890 -7.976 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.862 8.288 -6.670 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.610 10.737 -6.579 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.731 10.141 -8.252 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.133 10.921 -7.480 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.749 9.563 -4.750 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -9.324 9.687 -5.569 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -8.703 8.095 -5.070 1.00 0.00 H new ATOM 1157 N ARG A 76 -8.253 8.863 -10.115 1.00 0.00 N ATOM 1158 CA ARG A 76 -7.687 8.735 -11.456 1.00 0.00 C ATOM 1159 C ARG A 76 -6.351 9.470 -11.555 1.00 0.00 C ATOM 1160 O ARG A 76 -5.979 9.972 -12.618 1.00 0.00 O ATOM 1161 CB ARG A 76 -8.677 9.298 -12.480 1.00 0.00 C ATOM 1162 CG ARG A 76 -8.889 10.799 -12.359 1.00 0.00 C ATOM 1163 CD ARG A 76 -10.045 11.276 -13.216 1.00 0.00 C ATOM 1164 NE ARG A 76 -11.334 10.857 -12.677 1.00 0.00 N ATOM 1165 CZ ARG A 76 -12.446 11.579 -12.774 1.00 0.00 C ATOM 1166 NH1 ARG A 76 -12.420 12.765 -13.370 1.00 0.00 N ATOM 1167 NH2 ARG A 76 -13.580 11.125 -12.262 1.00 0.00 N ATOM 0 H ARG A 76 -8.899 9.645 -10.008 1.00 0.00 H new ATOM 0 HA ARG A 76 -7.507 7.680 -11.664 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -8.318 9.070 -13.484 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -9.636 8.793 -12.362 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -9.079 11.056 -11.317 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -7.978 11.320 -12.655 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -10.018 12.363 -13.288 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -9.931 10.887 -14.228 1.00 0.00 H new ATOM 0 HE ARG A 76 -11.385 9.958 -12.198 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -11.546 13.124 -13.754 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -13.274 13.318 -13.444 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -13.601 10.220 -11.792 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -14.432 11.681 -12.337 1.00 0.00 H new ATOM 1181 N ASP A 77 -5.619 9.495 -10.449 1.00 0.00 N ATOM 1182 CA ASP A 77 -4.382 10.260 -10.359 1.00 0.00 C ATOM 1183 C ASP A 77 -3.245 9.533 -11.077 1.00 0.00 C ATOM 1184 O ASP A 77 -3.483 8.681 -11.932 1.00 0.00 O ATOM 1185 CB ASP A 77 -4.019 10.501 -8.891 1.00 0.00 C ATOM 1186 CG ASP A 77 -3.268 11.803 -8.693 1.00 0.00 C ATOM 1187 OD1 ASP A 77 -2.019 11.801 -8.780 1.00 0.00 O ATOM 1188 OD2 ASP A 77 -3.928 12.834 -8.458 1.00 0.00 O ATOM 0 H ASP A 77 -5.863 8.991 -9.596 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.533 11.223 -10.847 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -4.929 10.513 -8.291 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -3.409 9.673 -8.529 1.00 0.00 H new ATOM 1193 N ASP A 78 -2.014 9.867 -10.732 1.00 0.00 N ATOM 1194 CA ASP A 78 -0.865 9.327 -11.435 1.00 0.00 C ATOM 1195 C ASP A 78 0.094 8.657 -10.447 1.00 0.00 C ATOM 1196 O ASP A 78 -0.211 8.532 -9.260 1.00 0.00 O ATOM 1197 CB ASP A 78 -0.160 10.456 -12.192 1.00 0.00 C ATOM 1198 CG ASP A 78 0.633 9.974 -13.390 1.00 0.00 C ATOM 1199 OD1 ASP A 78 1.700 9.364 -13.196 1.00 0.00 O ATOM 1200 OD2 ASP A 78 0.195 10.218 -14.533 1.00 0.00 O ATOM 0 H ASP A 78 -1.785 10.507 -9.972 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.196 8.572 -12.148 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.904 11.180 -12.525 1.00 0.00 H new ATOM 0 HB3 ASP A 78 0.510 10.979 -11.509 1.00 0.00 H new ATOM 1205 N ILE A 79 1.245 8.226 -10.942 1.00 0.00 N ATOM 1206 CA ILE A 79 2.253 7.593 -10.110 1.00 0.00 C ATOM 1207 C ILE A 79 3.652 8.064 -10.515 1.00 0.00 C ATOM 1208 O ILE A 79 4.551 8.165 -9.680 1.00 0.00 O ATOM 1209 CB ILE A 79 2.161 6.049 -10.179 1.00 0.00 C ATOM 1210 CG1 ILE A 79 3.133 5.408 -9.187 1.00 0.00 C ATOM 1211 CG2 ILE A 79 2.427 5.541 -11.591 1.00 0.00 C ATOM 1212 CD1 ILE A 79 2.862 5.791 -7.748 1.00 0.00 C ATOM 0 H ILE A 79 1.504 8.305 -11.925 1.00 0.00 H new ATOM 0 HA ILE A 79 2.065 7.890 -9.078 1.00 0.00 H new ATOM 0 HB ILE A 79 1.145 5.763 -9.906 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.077 4.324 -9.284 1.00 0.00 H new ATOM 0 HG13 ILE A 79 4.151 5.699 -9.447 1.00 0.00 H new ATOM 0 HG21 ILE A 79 2.355 4.453 -11.606 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.690 5.963 -12.274 1.00 0.00 H new ATOM 0 HG23 ILE A 79 3.427 5.843 -11.904 1.00 0.00 H new ATOM 0 HD11 ILE A 79 3.588 5.302 -7.098 1.00 0.00 H new ATOM 0 HD12 ILE A 79 2.947 6.872 -7.637 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.856 5.476 -7.471 1.00 0.00 H new ATOM 1224 N THR A 80 3.827 8.378 -11.796 1.00 0.00 N ATOM 1225 CA THR A 80 5.097 8.896 -12.282 1.00 0.00 C ATOM 1226 C THR A 80 5.126 10.411 -12.098 1.00 0.00 C ATOM 1227 O THR A 80 6.188 11.036 -12.066 1.00 0.00 O ATOM 1228 CB THR A 80 5.348 8.518 -13.765 1.00 0.00 C ATOM 1229 OG1 THR A 80 6.637 8.979 -14.192 1.00 0.00 O ATOM 1230 CG2 THR A 80 4.280 9.096 -14.681 1.00 0.00 C ATOM 0 H THR A 80 3.107 8.282 -12.512 1.00 0.00 H new ATOM 0 HA THR A 80 5.899 8.441 -11.701 1.00 0.00 H new ATOM 0 HB THR A 80 5.308 7.431 -13.830 1.00 0.00 H new ATOM 0 HG1 THR A 80 6.779 8.731 -15.129 1.00 0.00 H new ATOM 0 HG21 THR A 80 4.490 8.809 -15.711 1.00 0.00 H new ATOM 0 HG22 THR A 80 3.303 8.710 -14.389 1.00 0.00 H new ATOM 0 HG23 THR A 80 4.280 10.183 -14.599 1.00 0.00 H new ATOM 1238 N SER A 81 3.939 10.986 -11.974 1.00 0.00 N ATOM 1239 CA SER A 81 3.784 12.385 -11.618 1.00 0.00 C ATOM 1240 C SER A 81 2.464 12.553 -10.869 1.00 0.00 C ATOM 1241 O SER A 81 1.487 13.068 -11.415 1.00 0.00 O ATOM 1242 CB SER A 81 3.819 13.273 -12.866 1.00 0.00 C ATOM 1243 OG SER A 81 3.909 14.646 -12.521 1.00 0.00 O ATOM 0 H SER A 81 3.057 10.494 -12.118 1.00 0.00 H new ATOM 0 HA SER A 81 4.611 12.693 -10.978 1.00 0.00 H new ATOM 0 HB2 SER A 81 4.670 12.996 -13.488 1.00 0.00 H new ATOM 0 HB3 SER A 81 2.921 13.104 -13.460 1.00 0.00 H new ATOM 0 HG SER A 81 3.931 15.188 -13.337 1.00 0.00 H new ATOM 1249 N PRO A 82 2.409 12.078 -9.617 1.00 0.00 N ATOM 1250 CA PRO A 82 1.183 12.053 -8.831 1.00 0.00 C ATOM 1251 C PRO A 82 0.969 13.320 -8.016 1.00 0.00 C ATOM 1252 O PRO A 82 1.845 14.185 -7.937 1.00 0.00 O ATOM 1253 CB PRO A 82 1.424 10.870 -7.904 1.00 0.00 C ATOM 1254 CG PRO A 82 2.898 10.871 -7.657 1.00 0.00 C ATOM 1255 CD PRO A 82 3.545 11.521 -8.858 1.00 0.00 C ATOM 0 HA PRO A 82 0.294 11.978 -9.457 1.00 0.00 H new ATOM 0 HB2 PRO A 82 0.867 10.977 -6.973 1.00 0.00 H new ATOM 0 HB3 PRO A 82 1.101 9.936 -8.363 1.00 0.00 H new ATOM 0 HG2 PRO A 82 3.136 11.420 -6.746 1.00 0.00 H new ATOM 0 HG3 PRO A 82 3.268 9.854 -7.523 1.00 0.00 H new ATOM 0 HD2 PRO A 82 4.247 12.300 -8.561 1.00 0.00 H new ATOM 0 HD3 PRO A 82 4.105 10.797 -9.451 1.00 0.00 H new ATOM 1263 N ARG A 83 -0.208 13.429 -7.426 1.00 0.00 N ATOM 1264 CA ARG A 83 -0.485 14.486 -6.475 1.00 0.00 C ATOM 1265 C ARG A 83 -0.101 14.028 -5.082 1.00 0.00 C ATOM 1266 O ARG A 83 -0.740 13.147 -4.506 1.00 0.00 O ATOM 1267 CB ARG A 83 -1.960 14.872 -6.507 1.00 0.00 C ATOM 1268 CG ARG A 83 -2.366 15.631 -7.754 1.00 0.00 C ATOM 1269 CD ARG A 83 -3.867 15.838 -7.796 1.00 0.00 C ATOM 1270 NE ARG A 83 -4.308 16.483 -9.030 1.00 0.00 N ATOM 1271 CZ ARG A 83 -5.283 16.005 -9.800 1.00 0.00 C ATOM 1272 NH1 ARG A 83 -5.802 14.813 -9.535 1.00 0.00 N ATOM 1273 NH2 ARG A 83 -5.690 16.690 -10.864 1.00 0.00 N ATOM 0 H ARG A 83 -0.989 12.794 -7.591 1.00 0.00 H new ATOM 0 HA ARG A 83 0.103 15.362 -6.747 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.564 13.968 -6.430 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.186 15.482 -5.632 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.861 16.597 -7.778 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.046 15.082 -8.639 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.366 14.874 -7.695 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.171 16.446 -6.944 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.844 17.345 -9.317 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.454 14.269 -8.745 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -6.549 14.440 -10.121 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -5.255 17.584 -11.092 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -6.437 16.322 -11.452 1.00 0.00 H new ATOM 1287 N MET A 84 0.941 14.636 -4.536 1.00 0.00 N ATOM 1288 CA MET A 84 1.453 14.247 -3.231 1.00 0.00 C ATOM 1289 C MET A 84 0.446 14.585 -2.145 1.00 0.00 C ATOM 1290 O MET A 84 0.479 14.012 -1.059 1.00 0.00 O ATOM 1291 CB MET A 84 2.786 14.940 -2.944 1.00 0.00 C ATOM 1292 CG MET A 84 3.908 14.528 -3.885 1.00 0.00 C ATOM 1293 SD MET A 84 4.219 12.749 -3.872 1.00 0.00 S ATOM 1294 CE MET A 84 4.624 12.478 -2.147 1.00 0.00 C ATOM 0 H MET A 84 1.449 15.402 -4.977 1.00 0.00 H new ATOM 0 HA MET A 84 1.617 13.169 -3.237 1.00 0.00 H new ATOM 0 HB2 MET A 84 2.646 16.019 -3.011 1.00 0.00 H new ATOM 0 HB3 MET A 84 3.085 14.721 -1.919 1.00 0.00 H new ATOM 0 HG2 MET A 84 3.658 14.841 -4.899 1.00 0.00 H new ATOM 0 HG3 MET A 84 4.821 15.053 -3.605 1.00 0.00 H new ATOM 0 HE1 MET A 84 5.202 11.559 -2.049 1.00 0.00 H new ATOM 0 HE2 MET A 84 5.211 13.318 -1.775 1.00 0.00 H new ATOM 0 HE3 MET A 84 3.705 12.392 -1.567 1.00 0.00 H new ATOM 1304 N GLU A 85 -0.468 15.498 -2.462 1.00 0.00 N ATOM 1305 CA GLU A 85 -1.497 15.931 -1.519 1.00 0.00 C ATOM 1306 C GLU A 85 -2.383 14.761 -1.087 1.00 0.00 C ATOM 1307 O GLU A 85 -2.944 14.770 0.007 1.00 0.00 O ATOM 1308 CB GLU A 85 -2.362 17.026 -2.154 1.00 0.00 C ATOM 1309 CG GLU A 85 -2.933 16.630 -3.505 1.00 0.00 C ATOM 1310 CD GLU A 85 -3.874 17.668 -4.073 1.00 0.00 C ATOM 1311 OE1 GLU A 85 -3.405 18.762 -4.447 1.00 0.00 O ATOM 1312 OE2 GLU A 85 -5.088 17.395 -4.146 1.00 0.00 O ATOM 0 H GLU A 85 -0.517 15.956 -3.372 1.00 0.00 H new ATOM 0 HA GLU A 85 -0.997 16.326 -0.634 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.181 17.270 -1.478 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -1.764 17.930 -2.270 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -2.114 16.467 -4.206 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -3.462 15.682 -3.406 1.00 0.00 H new ATOM 1319 N ILE A 86 -2.502 13.761 -1.952 1.00 0.00 N ATOM 1320 CA ILE A 86 -3.340 12.602 -1.676 1.00 0.00 C ATOM 1321 C ILE A 86 -2.626 11.615 -0.753 1.00 0.00 C ATOM 1322 O ILE A 86 -3.232 11.042 0.152 1.00 0.00 O ATOM 1323 CB ILE A 86 -3.741 11.884 -2.986 1.00 0.00 C ATOM 1324 CG1 ILE A 86 -4.463 12.860 -3.920 1.00 0.00 C ATOM 1325 CG2 ILE A 86 -4.619 10.673 -2.696 1.00 0.00 C ATOM 1326 CD1 ILE A 86 -4.822 12.266 -5.264 1.00 0.00 C ATOM 0 H ILE A 86 -2.026 13.730 -2.854 1.00 0.00 H new ATOM 0 HA ILE A 86 -4.240 12.963 -1.179 1.00 0.00 H new ATOM 0 HB ILE A 86 -2.834 11.531 -3.478 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -5.373 13.209 -3.432 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.830 13.734 -4.077 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.887 10.185 -3.633 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.074 9.971 -2.065 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.525 10.995 -2.182 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.330 13.017 -5.869 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.914 11.943 -5.773 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.481 11.410 -5.119 1.00 0.00 H new ATOM 1338 N TYR A 87 -1.335 11.426 -0.984 1.00 0.00 N ATOM 1339 CA TYR A 87 -0.558 10.461 -0.217 1.00 0.00 C ATOM 1340 C TYR A 87 -0.105 11.040 1.123 1.00 0.00 C ATOM 1341 O TYR A 87 0.034 10.308 2.103 1.00 0.00 O ATOM 1342 CB TYR A 87 0.664 9.996 -1.020 1.00 0.00 C ATOM 1343 CG TYR A 87 0.319 9.403 -2.368 1.00 0.00 C ATOM 1344 CD1 TYR A 87 0.207 10.204 -3.498 1.00 0.00 C ATOM 1345 CD2 TYR A 87 0.098 8.042 -2.505 1.00 0.00 C ATOM 1346 CE1 TYR A 87 -0.120 9.660 -4.727 1.00 0.00 C ATOM 1347 CE2 TYR A 87 -0.224 7.490 -3.729 1.00 0.00 C ATOM 1348 CZ TYR A 87 -0.336 8.302 -4.836 1.00 0.00 C ATOM 1349 OH TYR A 87 -0.669 7.752 -6.052 1.00 0.00 O ATOM 0 H TYR A 87 -0.803 11.927 -1.696 1.00 0.00 H new ATOM 0 HA TYR A 87 -1.205 9.607 -0.017 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.334 10.843 -1.167 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.210 9.255 -0.436 1.00 0.00 H new ATOM 0 HD1 TYR A 87 0.378 11.267 -3.415 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.179 7.402 -1.639 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -0.206 10.295 -5.596 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -0.387 6.426 -3.818 1.00 0.00 H new ATOM 0 HH TYR A 87 -1.348 7.058 -5.922 1.00 0.00 H new ATOM 1359 N ARG A 88 0.127 12.351 1.172 1.00 0.00 N ATOM 1360 CA ARG A 88 0.646 12.971 2.386 1.00 0.00 C ATOM 1361 C ARG A 88 -0.382 12.967 3.491 1.00 0.00 C ATOM 1362 O ARG A 88 -1.447 13.579 3.392 1.00 0.00 O ATOM 1363 CB ARG A 88 1.153 14.386 2.133 1.00 0.00 C ATOM 1364 CG ARG A 88 2.359 14.403 1.226 1.00 0.00 C ATOM 1365 CD ARG A 88 2.997 15.778 1.142 1.00 0.00 C ATOM 1366 NE ARG A 88 3.898 16.018 2.267 1.00 0.00 N ATOM 1367 CZ ARG A 88 5.174 16.374 2.132 1.00 0.00 C ATOM 1368 NH1 ARG A 88 5.672 16.614 0.923 1.00 0.00 N ATOM 1369 NH2 ARG A 88 5.946 16.502 3.202 1.00 0.00 N ATOM 0 H ARG A 88 -0.034 12.994 0.397 1.00 0.00 H new ATOM 0 HA ARG A 88 1.495 12.367 2.707 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.356 14.982 1.687 1.00 0.00 H new ATOM 0 HB3 ARG A 88 1.408 14.855 3.083 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.094 13.685 1.589 1.00 0.00 H new ATOM 0 HG3 ARG A 88 2.065 14.080 0.228 1.00 0.00 H new ATOM 0 HD2 ARG A 88 3.549 15.868 0.206 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.219 16.541 1.128 1.00 0.00 H new ATOM 0 HE ARG A 88 3.528 15.906 3.211 1.00 0.00 H new ATOM 0 HH11 ARG A 88 5.077 16.525 0.099 1.00 0.00 H new ATOM 0 HH12 ARG A 88 6.649 16.887 0.819 1.00 0.00 H new ATOM 0 HH21 ARG A 88 5.563 16.328 4.131 1.00 0.00 H new ATOM 0 HH22 ARG A 88 6.923 16.775 3.096 1.00 0.00 H new ATOM 1383 N GLY A 89 -0.036 12.263 4.540 1.00 0.00 N ATOM 1384 CA GLY A 89 -0.921 12.111 5.669 1.00 0.00 C ATOM 1385 C GLY A 89 -1.334 10.669 5.868 1.00 0.00 C ATOM 1386 O GLY A 89 -1.782 10.290 6.950 1.00 0.00 O ATOM 0 H GLY A 89 0.859 11.783 4.636 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.427 12.475 6.570 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.808 12.726 5.521 1.00 0.00 H new ATOM 1390 N ALA A 90 -1.177 9.863 4.824 1.00 0.00 N ATOM 1391 CA ALA A 90 -1.517 8.449 4.890 1.00 0.00 C ATOM 1392 C ALA A 90 -0.591 7.721 5.855 1.00 0.00 C ATOM 1393 O ALA A 90 0.594 8.031 5.938 1.00 0.00 O ATOM 1394 CB ALA A 90 -1.443 7.819 3.508 1.00 0.00 C ATOM 0 H ALA A 90 -0.815 10.167 3.920 1.00 0.00 H new ATOM 0 HA ALA A 90 -2.539 8.358 5.258 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -1.700 6.762 3.576 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -2.144 8.321 2.841 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.432 7.922 3.115 1.00 0.00 H new ATOM 1400 N ALA A 91 -1.135 6.760 6.583 1.00 0.00 N ATOM 1401 CA ALA A 91 -0.354 6.017 7.559 1.00 0.00 C ATOM 1402 C ALA A 91 0.426 4.896 6.887 1.00 0.00 C ATOM 1403 O ALA A 91 1.507 4.519 7.341 1.00 0.00 O ATOM 1404 CB ALA A 91 -1.255 5.461 8.651 1.00 0.00 C ATOM 0 H ALA A 91 -2.112 6.476 6.517 1.00 0.00 H new ATOM 0 HA ALA A 91 0.361 6.702 8.016 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -0.654 4.908 9.372 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.764 6.282 9.156 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.994 4.794 8.208 1.00 0.00 H new ATOM 1410 N LEU A 92 -0.116 4.382 5.793 1.00 0.00 N ATOM 1411 CA LEU A 92 0.501 3.271 5.091 1.00 0.00 C ATOM 1412 C LEU A 92 0.183 3.355 3.602 1.00 0.00 C ATOM 1413 O LEU A 92 -0.907 3.780 3.214 1.00 0.00 O ATOM 1414 CB LEU A 92 0.005 1.946 5.694 1.00 0.00 C ATOM 1415 CG LEU A 92 0.860 0.711 5.399 1.00 0.00 C ATOM 1416 CD1 LEU A 92 0.683 -0.320 6.500 1.00 0.00 C ATOM 1417 CD2 LEU A 92 0.494 0.094 4.059 1.00 0.00 C ATOM 0 H LEU A 92 -0.983 4.718 5.373 1.00 0.00 H new ATOM 0 HA LEU A 92 1.584 3.318 5.205 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.064 2.065 6.775 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.005 1.759 5.329 1.00 0.00 H new ATOM 0 HG LEU A 92 1.902 1.027 5.358 1.00 0.00 H new ATOM 0 HD11 LEU A 92 1.295 -1.195 6.281 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.991 0.109 7.453 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.365 -0.615 6.557 1.00 0.00 H new ATOM 0 HD21 LEU A 92 1.119 -0.781 3.879 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.554 -0.205 4.070 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.655 0.824 3.266 1.00 0.00 H new ATOM 1429 N ILE A 93 1.149 2.979 2.779 1.00 0.00 N ATOM 1430 CA ILE A 93 0.971 2.944 1.335 1.00 0.00 C ATOM 1431 C ILE A 93 1.447 1.598 0.807 1.00 0.00 C ATOM 1432 O ILE A 93 2.560 1.171 1.102 1.00 0.00 O ATOM 1433 CB ILE A 93 1.761 4.069 0.627 1.00 0.00 C ATOM 1434 CG1 ILE A 93 1.348 5.442 1.163 1.00 0.00 C ATOM 1435 CG2 ILE A 93 1.546 3.998 -0.878 1.00 0.00 C ATOM 1436 CD1 ILE A 93 2.112 6.590 0.539 1.00 0.00 C ATOM 0 H ILE A 93 2.076 2.690 3.091 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.088 3.093 1.125 1.00 0.00 H new ATOM 0 HB ILE A 93 2.822 3.928 0.835 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.282 5.587 0.986 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.497 5.461 2.243 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.108 4.796 -1.364 1.00 0.00 H new ATOM 0 HG22 ILE A 93 1.891 3.033 -1.250 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.485 4.114 -1.100 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.767 7.532 0.966 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.177 6.470 0.739 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.943 6.597 -0.538 1.00 0.00 H new ATOM 1448 N TYR A 94 0.611 0.914 0.047 1.00 0.00 N ATOM 1449 CA TYR A 94 0.993 -0.385 -0.472 1.00 0.00 C ATOM 1450 C TYR A 94 0.554 -0.556 -1.917 1.00 0.00 C ATOM 1451 O TYR A 94 -0.509 -0.093 -2.317 1.00 0.00 O ATOM 1452 CB TYR A 94 0.442 -1.516 0.410 1.00 0.00 C ATOM 1453 CG TYR A 94 -1.066 -1.627 0.458 1.00 0.00 C ATOM 1454 CD1 TYR A 94 -1.832 -0.720 1.177 1.00 0.00 C ATOM 1455 CD2 TYR A 94 -1.722 -2.664 -0.196 1.00 0.00 C ATOM 1456 CE1 TYR A 94 -3.204 -0.838 1.239 1.00 0.00 C ATOM 1457 CE2 TYR A 94 -3.095 -2.791 -0.132 1.00 0.00 C ATOM 1458 CZ TYR A 94 -3.831 -1.873 0.587 1.00 0.00 C ATOM 1459 OH TYR A 94 -5.197 -1.992 0.659 1.00 0.00 O ATOM 0 H TYR A 94 -0.321 1.230 -0.221 1.00 0.00 H new ATOM 0 HA TYR A 94 2.081 -0.441 -0.450 1.00 0.00 H new ATOM 0 HB2 TYR A 94 0.848 -2.463 0.053 1.00 0.00 H new ATOM 0 HB3 TYR A 94 0.811 -1.374 1.426 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -1.345 0.092 1.697 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -1.148 -3.382 -0.763 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -3.785 -0.119 1.798 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -3.590 -3.604 -0.642 1.00 0.00 H new ATOM 0 HH TYR A 94 -5.546 -2.283 -0.209 1.00 0.00 H new ATOM 1469 N SER A 95 1.393 -1.218 -2.691 1.00 0.00 N ATOM 1470 CA SER A 95 1.133 -1.421 -4.107 1.00 0.00 C ATOM 1471 C SER A 95 1.014 -2.910 -4.408 1.00 0.00 C ATOM 1472 O SER A 95 1.693 -3.733 -3.781 1.00 0.00 O ATOM 1473 CB SER A 95 2.263 -0.806 -4.930 1.00 0.00 C ATOM 1474 OG SER A 95 2.551 0.506 -4.482 1.00 0.00 O ATOM 0 H SER A 95 2.267 -1.628 -2.362 1.00 0.00 H new ATOM 0 HA SER A 95 0.194 -0.935 -4.372 1.00 0.00 H new ATOM 0 HB2 SER A 95 3.156 -1.426 -4.852 1.00 0.00 H new ATOM 0 HB3 SER A 95 1.982 -0.783 -5.983 1.00 0.00 H new ATOM 0 HG SER A 95 3.027 0.995 -5.185 1.00 0.00 H new ATOM 1480 N ILE A 96 0.143 -3.261 -5.341 1.00 0.00 N ATOM 1481 CA ILE A 96 -0.046 -4.653 -5.708 1.00 0.00 C ATOM 1482 C ILE A 96 0.464 -4.905 -7.120 1.00 0.00 C ATOM 1483 O ILE A 96 -0.153 -4.483 -8.096 1.00 0.00 O ATOM 1484 CB ILE A 96 -1.524 -5.082 -5.596 1.00 0.00 C ATOM 1485 CG1 ILE A 96 -2.059 -4.754 -4.197 1.00 0.00 C ATOM 1486 CG2 ILE A 96 -1.664 -6.571 -5.888 1.00 0.00 C ATOM 1487 CD1 ILE A 96 -3.503 -5.152 -3.982 1.00 0.00 C ATOM 0 H ILE A 96 -0.442 -2.603 -5.856 1.00 0.00 H new ATOM 0 HA ILE A 96 0.529 -5.255 -5.005 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.111 -4.531 -6.331 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -1.440 -5.258 -3.455 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -1.958 -3.683 -4.022 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.711 -6.861 -5.806 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -1.308 -6.779 -6.897 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -1.073 -7.140 -5.170 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -3.807 -4.887 -2.969 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -4.135 -4.628 -4.699 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -3.609 -6.228 -4.123 1.00 0.00 H new ATOM 1499 N ARG A 97 1.604 -5.587 -7.195 1.00 0.00 N ATOM 1500 CA ARG A 97 2.284 -5.882 -8.454 1.00 0.00 C ATOM 1501 C ARG A 97 2.465 -4.611 -9.298 1.00 0.00 C ATOM 1502 O ARG A 97 1.724 -4.370 -10.256 1.00 0.00 O ATOM 1503 CB ARG A 97 1.530 -6.975 -9.227 1.00 0.00 C ATOM 1504 CG ARG A 97 2.390 -7.723 -10.236 1.00 0.00 C ATOM 1505 CD ARG A 97 2.574 -6.934 -11.517 1.00 0.00 C ATOM 1506 NE ARG A 97 3.969 -6.870 -11.939 1.00 0.00 N ATOM 1507 CZ ARG A 97 4.418 -6.006 -12.846 1.00 0.00 C ATOM 1508 NH1 ARG A 97 3.586 -5.123 -13.383 1.00 0.00 N ATOM 1509 NH2 ARG A 97 5.693 -6.030 -13.209 1.00 0.00 N ATOM 0 H ARG A 97 2.087 -5.954 -6.375 1.00 0.00 H new ATOM 0 HA ARG A 97 3.281 -6.260 -8.227 1.00 0.00 H new ATOM 0 HB2 ARG A 97 1.117 -7.690 -8.516 1.00 0.00 H new ATOM 0 HB3 ARG A 97 0.687 -6.521 -9.748 1.00 0.00 H new ATOM 0 HG2 ARG A 97 3.365 -7.934 -9.796 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.929 -8.684 -10.465 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.979 -7.389 -12.309 1.00 0.00 H new ATOM 0 HD3 ARG A 97 2.194 -5.922 -11.374 1.00 0.00 H new ATOM 0 HE ARG A 97 4.633 -7.520 -11.518 1.00 0.00 H new ATOM 0 HH11 ARG A 97 2.606 -5.108 -13.100 1.00 0.00 H new ATOM 0 HH12 ARG A 97 3.926 -4.459 -14.079 1.00 0.00 H new ATOM 0 HH21 ARG A 97 6.329 -6.710 -12.793 1.00 0.00 H new ATOM 0 HH22 ARG A 97 6.038 -5.368 -13.904 1.00 0.00 H new ATOM 1523 N PRO A 98 3.438 -3.765 -8.921 1.00 0.00 N ATOM 1524 CA PRO A 98 3.744 -2.536 -9.633 1.00 0.00 C ATOM 1525 C PRO A 98 4.896 -2.700 -10.625 1.00 0.00 C ATOM 1526 O PRO A 98 5.686 -3.640 -10.520 1.00 0.00 O ATOM 1527 CB PRO A 98 4.151 -1.601 -8.491 1.00 0.00 C ATOM 1528 CG PRO A 98 4.690 -2.492 -7.408 1.00 0.00 C ATOM 1529 CD PRO A 98 4.313 -3.916 -7.754 1.00 0.00 C ATOM 0 HA PRO A 98 2.910 -2.183 -10.239 1.00 0.00 H new ATOM 0 HB2 PRO A 98 4.904 -0.886 -8.820 1.00 0.00 H new ATOM 0 HB3 PRO A 98 3.298 -1.024 -8.135 1.00 0.00 H new ATOM 0 HG2 PRO A 98 5.773 -2.391 -7.333 1.00 0.00 H new ATOM 0 HG3 PRO A 98 4.275 -2.211 -6.440 1.00 0.00 H new ATOM 0 HD2 PRO A 98 5.191 -4.518 -7.986 1.00 0.00 H new ATOM 0 HD3 PRO A 98 3.799 -4.407 -6.928 1.00 0.00 H new ATOM 1537 N PRO A 99 4.995 -1.798 -11.613 1.00 0.00 N ATOM 1538 CA PRO A 99 6.118 -1.784 -12.549 1.00 0.00 C ATOM 1539 C PRO A 99 7.432 -1.483 -11.834 1.00 0.00 C ATOM 1540 O PRO A 99 7.503 -0.579 -11.005 1.00 0.00 O ATOM 1541 CB PRO A 99 5.781 -0.656 -13.529 1.00 0.00 C ATOM 1542 CG PRO A 99 4.341 -0.342 -13.312 1.00 0.00 C ATOM 1543 CD PRO A 99 4.024 -0.731 -11.896 1.00 0.00 C ATOM 0 HA PRO A 99 6.251 -2.749 -13.039 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.404 0.220 -13.345 1.00 0.00 H new ATOM 0 HB3 PRO A 99 5.962 -0.966 -14.558 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.147 0.718 -13.475 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.715 -0.892 -14.014 1.00 0.00 H new ATOM 0 HD2 PRO A 99 4.140 0.110 -11.212 1.00 0.00 H new ATOM 0 HD3 PRO A 99 2.998 -1.084 -11.796 1.00 0.00 H new ATOM 1551 N ALA A 100 8.475 -2.225 -12.179 1.00 0.00 N ATOM 1552 CA ALA A 100 9.760 -2.113 -11.497 1.00 0.00 C ATOM 1553 C ALA A 100 10.444 -0.780 -11.790 1.00 0.00 C ATOM 1554 O ALA A 100 11.383 -0.383 -11.097 1.00 0.00 O ATOM 1555 CB ALA A 100 10.659 -3.271 -11.888 1.00 0.00 C ATOM 0 H ALA A 100 8.457 -2.914 -12.930 1.00 0.00 H new ATOM 0 HA ALA A 100 9.573 -2.152 -10.424 1.00 0.00 H new ATOM 0 HB1 ALA A 100 11.616 -3.179 -11.374 1.00 0.00 H new ATOM 0 HB2 ALA A 100 10.185 -4.211 -11.606 1.00 0.00 H new ATOM 0 HB3 ALA A 100 10.823 -3.256 -12.965 1.00 0.00 H new ATOM 1561 N GLU A 101 9.968 -0.094 -12.818 1.00 0.00 N ATOM 1562 CA GLU A 101 10.508 1.206 -13.188 1.00 0.00 C ATOM 1563 C GLU A 101 10.037 2.309 -12.241 1.00 0.00 C ATOM 1564 O GLU A 101 10.648 3.376 -12.180 1.00 0.00 O ATOM 1565 CB GLU A 101 10.140 1.572 -14.635 1.00 0.00 C ATOM 1566 CG GLU A 101 8.748 1.126 -15.074 1.00 0.00 C ATOM 1567 CD GLU A 101 8.743 -0.285 -15.624 1.00 0.00 C ATOM 1568 OE1 GLU A 101 8.953 -0.452 -16.843 1.00 0.00 O ATOM 1569 OE2 GLU A 101 8.543 -1.231 -14.846 1.00 0.00 O ATOM 0 H GLU A 101 9.206 -0.417 -13.413 1.00 0.00 H new ATOM 0 HA GLU A 101 11.592 1.127 -13.108 1.00 0.00 H new ATOM 0 HB2 GLU A 101 10.213 2.653 -14.751 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.876 1.129 -15.305 1.00 0.00 H new ATOM 0 HG2 GLU A 101 8.066 1.185 -14.226 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.372 1.811 -15.834 1.00 0.00 H new ATOM 1576 N ILE A 102 8.963 2.062 -11.493 1.00 0.00 N ATOM 1577 CA ILE A 102 8.421 3.091 -10.607 1.00 0.00 C ATOM 1578 C ILE A 102 8.563 2.728 -9.133 1.00 0.00 C ATOM 1579 O ILE A 102 8.040 3.429 -8.265 1.00 0.00 O ATOM 1580 CB ILE A 102 6.946 3.429 -10.922 1.00 0.00 C ATOM 1581 CG1 ILE A 102 6.078 2.170 -11.044 1.00 0.00 C ATOM 1582 CG2 ILE A 102 6.850 4.268 -12.190 1.00 0.00 C ATOM 1583 CD1 ILE A 102 5.510 1.675 -9.729 1.00 0.00 C ATOM 0 H ILE A 102 8.459 1.176 -11.481 1.00 0.00 H new ATOM 0 HA ILE A 102 9.023 3.979 -10.800 1.00 0.00 H new ATOM 0 HB ILE A 102 6.560 4.008 -10.083 1.00 0.00 H new ATOM 0 HG12 ILE A 102 5.254 2.375 -11.728 1.00 0.00 H new ATOM 0 HG13 ILE A 102 6.673 1.374 -11.492 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.804 4.497 -12.397 1.00 0.00 H new ATOM 0 HG22 ILE A 102 7.405 5.197 -12.055 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.272 3.712 -13.027 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.910 0.782 -9.905 1.00 0.00 H new ATOM 0 HD12 ILE A 102 6.326 1.435 -9.048 1.00 0.00 H new ATOM 0 HD13 ILE A 102 4.885 2.451 -9.287 1.00 0.00 H new ATOM 1595 N HIS A 103 9.284 1.651 -8.854 1.00 0.00 N ATOM 1596 CA HIS A 103 9.558 1.246 -7.473 1.00 0.00 C ATOM 1597 C HIS A 103 10.261 2.368 -6.708 1.00 0.00 C ATOM 1598 O HIS A 103 9.923 2.664 -5.561 1.00 0.00 O ATOM 1599 CB HIS A 103 10.427 -0.016 -7.430 1.00 0.00 C ATOM 1600 CG HIS A 103 9.740 -1.272 -7.882 1.00 0.00 C ATOM 1601 ND1 HIS A 103 8.374 -1.353 -8.002 1.00 0.00 N ATOM 1602 CD2 HIS A 103 10.283 -2.465 -8.228 1.00 0.00 C ATOM 1603 CE1 HIS A 103 8.119 -2.587 -8.413 1.00 0.00 C ATOM 1604 NE2 HIS A 103 9.246 -3.295 -8.560 1.00 0.00 N ATOM 0 H HIS A 103 9.691 1.039 -9.561 1.00 0.00 H new ATOM 0 HA HIS A 103 8.599 1.033 -7.000 1.00 0.00 H new ATOM 0 HB2 HIS A 103 11.306 0.145 -8.054 1.00 0.00 H new ATOM 0 HB3 HIS A 103 10.782 -0.160 -6.410 1.00 0.00 H new ATOM 0 HD2 HIS A 103 11.334 -2.713 -8.240 1.00 0.00 H new ATOM 0 HE1 HIS A 103 7.129 -2.972 -8.605 1.00 0.00 H new ATOM 0 HE2 HIS A 103 9.318 -4.267 -8.862 1.00 0.00 H new ATOM 1612 N SER A 104 11.224 3.007 -7.361 1.00 0.00 N ATOM 1613 CA SER A 104 11.984 4.082 -6.740 1.00 0.00 C ATOM 1614 C SER A 104 11.117 5.324 -6.540 1.00 0.00 C ATOM 1615 O SER A 104 11.366 6.126 -5.633 1.00 0.00 O ATOM 1616 CB SER A 104 13.216 4.400 -7.586 1.00 0.00 C ATOM 1617 OG SER A 104 12.882 4.464 -8.960 1.00 0.00 O ATOM 0 H SER A 104 11.497 2.798 -8.321 1.00 0.00 H new ATOM 0 HA SER A 104 12.313 3.754 -5.754 1.00 0.00 H new ATOM 0 HB2 SER A 104 13.646 5.350 -7.267 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.978 3.637 -7.428 1.00 0.00 H new ATOM 0 HG SER A 104 13.685 4.670 -9.483 1.00 0.00 H new ATOM 1623 N SER A 105 10.097 5.480 -7.379 1.00 0.00 N ATOM 1624 CA SER A 105 9.137 6.560 -7.210 1.00 0.00 C ATOM 1625 C SER A 105 8.272 6.293 -5.985 1.00 0.00 C ATOM 1626 O SER A 105 8.055 7.180 -5.166 1.00 0.00 O ATOM 1627 CB SER A 105 8.268 6.723 -8.462 1.00 0.00 C ATOM 1628 OG SER A 105 9.048 7.136 -9.575 1.00 0.00 O ATOM 0 H SER A 105 9.916 4.874 -8.179 1.00 0.00 H new ATOM 0 HA SER A 105 9.683 7.492 -7.062 1.00 0.00 H new ATOM 0 HB2 SER A 105 7.773 5.779 -8.691 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.484 7.456 -8.271 1.00 0.00 H new ATOM 0 HG SER A 105 8.471 7.231 -10.361 1.00 0.00 H new ATOM 1634 N LEU A 106 7.806 5.054 -5.849 1.00 0.00 N ATOM 1635 CA LEU A 106 7.043 4.643 -4.673 1.00 0.00 C ATOM 1636 C LEU A 106 7.849 4.892 -3.405 1.00 0.00 C ATOM 1637 O LEU A 106 7.322 5.374 -2.401 1.00 0.00 O ATOM 1638 CB LEU A 106 6.683 3.161 -4.774 1.00 0.00 C ATOM 1639 CG LEU A 106 5.688 2.807 -5.880 1.00 0.00 C ATOM 1640 CD1 LEU A 106 5.564 1.301 -6.028 1.00 0.00 C ATOM 1641 CD2 LEU A 106 4.329 3.421 -5.586 1.00 0.00 C ATOM 0 H LEU A 106 7.944 4.316 -6.540 1.00 0.00 H new ATOM 0 HA LEU A 106 6.127 5.232 -4.630 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.598 2.591 -4.935 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.270 2.838 -3.818 1.00 0.00 H new ATOM 0 HG LEU A 106 6.061 3.216 -6.819 1.00 0.00 H new ATOM 0 HD11 LEU A 106 4.851 1.071 -6.820 1.00 0.00 H new ATOM 0 HD12 LEU A 106 6.537 0.879 -6.281 1.00 0.00 H new ATOM 0 HD13 LEU A 106 5.215 0.871 -5.089 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.632 3.160 -6.382 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.955 3.039 -4.636 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.424 4.505 -5.528 1.00 0.00 H new ATOM 1653 N MET A 107 9.134 4.573 -3.479 1.00 0.00 N ATOM 1654 CA MET A 107 10.056 4.776 -2.370 1.00 0.00 C ATOM 1655 C MET A 107 10.053 6.230 -1.903 1.00 0.00 C ATOM 1656 O MET A 107 9.862 6.508 -0.719 1.00 0.00 O ATOM 1657 CB MET A 107 11.469 4.371 -2.794 1.00 0.00 C ATOM 1658 CG MET A 107 12.506 4.494 -1.689 1.00 0.00 C ATOM 1659 SD MET A 107 12.224 3.342 -0.337 1.00 0.00 S ATOM 1660 CE MET A 107 12.313 1.776 -1.204 1.00 0.00 C ATOM 0 H MET A 107 9.566 4.167 -4.309 1.00 0.00 H new ATOM 0 HA MET A 107 9.728 4.153 -1.537 1.00 0.00 H new ATOM 0 HB2 MET A 107 11.450 3.340 -3.147 1.00 0.00 H new ATOM 0 HB3 MET A 107 11.776 4.991 -3.637 1.00 0.00 H new ATOM 0 HG2 MET A 107 13.498 4.321 -2.107 1.00 0.00 H new ATOM 0 HG3 MET A 107 12.497 5.512 -1.300 1.00 0.00 H new ATOM 0 HE1 MET A 107 11.328 1.309 -1.214 1.00 0.00 H new ATOM 0 HE2 MET A 107 12.644 1.946 -2.229 1.00 0.00 H new ATOM 0 HE3 MET A 107 13.021 1.120 -0.698 1.00 0.00 H new ATOM 1670 N ARG A 108 10.252 7.156 -2.835 1.00 0.00 N ATOM 1671 CA ARG A 108 10.326 8.571 -2.486 1.00 0.00 C ATOM 1672 C ARG A 108 8.964 9.130 -2.085 1.00 0.00 C ATOM 1673 O ARG A 108 8.889 10.141 -1.392 1.00 0.00 O ATOM 1674 CB ARG A 108 10.922 9.401 -3.622 1.00 0.00 C ATOM 1675 CG ARG A 108 10.200 9.255 -4.946 1.00 0.00 C ATOM 1676 CD ARG A 108 10.473 10.438 -5.852 1.00 0.00 C ATOM 1677 NE ARG A 108 11.903 10.689 -6.027 1.00 0.00 N ATOM 1678 CZ ARG A 108 12.401 11.555 -6.907 1.00 0.00 C ATOM 1679 NH1 ARG A 108 11.600 12.166 -7.773 1.00 0.00 N ATOM 1680 NH2 ARG A 108 13.708 11.784 -6.931 1.00 0.00 N ATOM 0 H ARG A 108 10.364 6.956 -3.829 1.00 0.00 H new ATOM 0 HA ARG A 108 10.989 8.643 -1.624 1.00 0.00 H new ATOM 0 HB2 ARG A 108 10.915 10.452 -3.331 1.00 0.00 H new ATOM 0 HB3 ARG A 108 11.965 9.115 -3.757 1.00 0.00 H new ATOM 0 HG2 ARG A 108 10.519 8.336 -5.438 1.00 0.00 H new ATOM 0 HG3 ARG A 108 9.128 9.167 -4.771 1.00 0.00 H new ATOM 0 HD2 ARG A 108 10.017 10.259 -6.826 1.00 0.00 H new ATOM 0 HD3 ARG A 108 9.999 11.327 -5.436 1.00 0.00 H new ATOM 0 HE ARG A 108 12.557 10.170 -5.441 1.00 0.00 H new ATOM 0 HH11 ARG A 108 10.599 11.972 -7.766 1.00 0.00 H new ATOM 0 HH12 ARG A 108 11.986 12.829 -8.445 1.00 0.00 H new ATOM 0 HH21 ARG A 108 14.323 11.298 -6.278 1.00 0.00 H new ATOM 0 HH22 ARG A 108 14.098 12.446 -7.602 1.00 0.00 H new ATOM 1694 N VAL A 109 7.887 8.484 -2.523 1.00 0.00 N ATOM 1695 CA VAL A 109 6.553 8.887 -2.098 1.00 0.00 C ATOM 1696 C VAL A 109 6.349 8.543 -0.631 1.00 0.00 C ATOM 1697 O VAL A 109 5.917 9.385 0.156 1.00 0.00 O ATOM 1698 CB VAL A 109 5.435 8.235 -2.937 1.00 0.00 C ATOM 1699 CG1 VAL A 109 4.065 8.586 -2.370 1.00 0.00 C ATOM 1700 CG2 VAL A 109 5.531 8.667 -4.391 1.00 0.00 C ATOM 0 H VAL A 109 7.911 7.690 -3.163 1.00 0.00 H new ATOM 0 HA VAL A 109 6.487 9.965 -2.248 1.00 0.00 H new ATOM 0 HB VAL A 109 5.563 7.154 -2.890 1.00 0.00 H new ATOM 0 HG11 VAL A 109 3.290 8.117 -2.975 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.992 8.225 -1.344 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.932 9.668 -2.384 1.00 0.00 H new ATOM 0 HG21 VAL A 109 4.733 8.195 -4.964 1.00 0.00 H new ATOM 0 HG22 VAL A 109 5.433 9.751 -4.456 1.00 0.00 H new ATOM 0 HG23 VAL A 109 6.496 8.365 -4.797 1.00 0.00 H new ATOM 1710 N ALA A 110 6.687 7.311 -0.261 1.00 0.00 N ATOM 1711 CA ALA A 110 6.595 6.890 1.130 1.00 0.00 C ATOM 1712 C ALA A 110 7.506 7.753 1.989 1.00 0.00 C ATOM 1713 O ALA A 110 7.110 8.225 3.052 1.00 0.00 O ATOM 1714 CB ALA A 110 6.966 5.421 1.284 1.00 0.00 C ATOM 0 H ALA A 110 7.025 6.592 -0.901 1.00 0.00 H new ATOM 0 HA ALA A 110 5.563 7.013 1.459 1.00 0.00 H new ATOM 0 HB1 ALA A 110 6.888 5.134 2.333 1.00 0.00 H new ATOM 0 HB2 ALA A 110 6.287 4.810 0.689 1.00 0.00 H new ATOM 0 HB3 ALA A 110 7.989 5.266 0.940 1.00 0.00 H new ATOM 1720 N ASP A 111 8.718 7.969 1.493 1.00 0.00 N ATOM 1721 CA ASP A 111 9.723 8.776 2.184 1.00 0.00 C ATOM 1722 C ASP A 111 9.232 10.208 2.386 1.00 0.00 C ATOM 1723 O ASP A 111 9.544 10.852 3.385 1.00 0.00 O ATOM 1724 CB ASP A 111 11.016 8.785 1.365 1.00 0.00 C ATOM 1725 CG ASP A 111 12.167 9.463 2.077 1.00 0.00 C ATOM 1726 OD1 ASP A 111 12.833 8.801 2.897 1.00 0.00 O ATOM 1727 OD2 ASP A 111 12.418 10.654 1.807 1.00 0.00 O ATOM 0 H ASP A 111 9.035 7.591 0.600 1.00 0.00 H new ATOM 0 HA ASP A 111 9.907 8.337 3.165 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.297 7.758 1.130 1.00 0.00 H new ATOM 0 HB3 ASP A 111 10.835 9.291 0.417 1.00 0.00 H new ATOM 1732 N ALA A 112 8.461 10.695 1.423 1.00 0.00 N ATOM 1733 CA ALA A 112 7.931 12.051 1.470 1.00 0.00 C ATOM 1734 C ALA A 112 6.789 12.178 2.470 1.00 0.00 C ATOM 1735 O ALA A 112 6.726 13.138 3.240 1.00 0.00 O ATOM 1736 CB ALA A 112 7.449 12.473 0.094 1.00 0.00 C ATOM 0 H ALA A 112 8.187 10.167 0.594 1.00 0.00 H new ATOM 0 HA ALA A 112 8.740 12.706 1.795 1.00 0.00 H new ATOM 0 HB1 ALA A 112 7.055 13.488 0.142 1.00 0.00 H new ATOM 0 HB2 ALA A 112 8.281 12.440 -0.609 1.00 0.00 H new ATOM 0 HB3 ALA A 112 6.664 11.795 -0.240 1.00 0.00 H new ATOM 1742 N VAL A 113 5.882 11.212 2.450 1.00 0.00 N ATOM 1743 CA VAL A 113 4.663 11.299 3.241 1.00 0.00 C ATOM 1744 C VAL A 113 4.858 10.751 4.655 1.00 0.00 C ATOM 1745 O VAL A 113 4.212 11.214 5.597 1.00 0.00 O ATOM 1746 CB VAL A 113 3.490 10.572 2.546 1.00 0.00 C ATOM 1747 CG1 VAL A 113 3.330 11.083 1.123 1.00 0.00 C ATOM 1748 CG2 VAL A 113 3.679 9.064 2.541 1.00 0.00 C ATOM 0 H VAL A 113 5.967 10.360 1.896 1.00 0.00 H new ATOM 0 HA VAL A 113 4.418 12.358 3.322 1.00 0.00 H new ATOM 0 HB VAL A 113 2.586 10.788 3.115 1.00 0.00 H new ATOM 0 HG11 VAL A 113 2.501 10.565 0.641 1.00 0.00 H new ATOM 0 HG12 VAL A 113 3.127 12.154 1.142 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.247 10.897 0.564 1.00 0.00 H new ATOM 0 HG21 VAL A 113 2.832 8.593 2.043 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.597 8.814 2.009 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.744 8.702 3.567 1.00 0.00 H new ATOM 1758 N GLY A 114 5.764 9.795 4.799 1.00 0.00 N ATOM 1759 CA GLY A 114 6.010 9.192 6.096 1.00 0.00 C ATOM 1760 C GLY A 114 5.084 8.024 6.375 1.00 0.00 C ATOM 1761 O GLY A 114 4.411 7.985 7.407 1.00 0.00 O ATOM 0 H GLY A 114 6.335 9.424 4.040 1.00 0.00 H new ATOM 0 HA2 GLY A 114 7.044 8.852 6.145 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.885 9.945 6.874 1.00 0.00 H new ATOM 1765 N ALA A 115 5.053 7.064 5.459 1.00 0.00 N ATOM 1766 CA ALA A 115 4.175 5.910 5.594 1.00 0.00 C ATOM 1767 C ALA A 115 4.931 4.614 5.339 1.00 0.00 C ATOM 1768 O ALA A 115 6.000 4.619 4.730 1.00 0.00 O ATOM 1769 CB ALA A 115 3.001 6.029 4.634 1.00 0.00 C ATOM 0 H ALA A 115 5.626 7.062 4.615 1.00 0.00 H new ATOM 0 HA ALA A 115 3.799 5.888 6.617 1.00 0.00 H new ATOM 0 HB1 ALA A 115 2.352 5.161 4.744 1.00 0.00 H new ATOM 0 HB2 ALA A 115 2.437 6.934 4.859 1.00 0.00 H new ATOM 0 HB3 ALA A 115 3.372 6.077 3.610 1.00 0.00 H new ATOM 1775 N ARG A 116 4.377 3.505 5.810 1.00 0.00 N ATOM 1776 CA ARG A 116 4.965 2.199 5.550 1.00 0.00 C ATOM 1777 C ARG A 116 4.601 1.747 4.142 1.00 0.00 C ATOM 1778 O ARG A 116 3.425 1.695 3.791 1.00 0.00 O ATOM 1779 CB ARG A 116 4.486 1.166 6.575 1.00 0.00 C ATOM 1780 CG ARG A 116 5.209 -0.171 6.475 1.00 0.00 C ATOM 1781 CD ARG A 116 4.714 -1.163 7.517 1.00 0.00 C ATOM 1782 NE ARG A 116 4.855 -0.652 8.884 1.00 0.00 N ATOM 1783 CZ ARG A 116 5.360 -1.356 9.897 1.00 0.00 C ATOM 1784 NH1 ARG A 116 5.854 -2.566 9.689 1.00 0.00 N ATOM 1785 NH2 ARG A 116 5.392 -0.830 11.115 1.00 0.00 N ATOM 0 H ARG A 116 3.526 3.484 6.371 1.00 0.00 H new ATOM 0 HA ARG A 116 6.048 2.283 5.637 1.00 0.00 H new ATOM 0 HB2 ARG A 116 4.624 1.570 7.578 1.00 0.00 H new ATOM 0 HB3 ARG A 116 3.417 1.002 6.441 1.00 0.00 H new ATOM 0 HG2 ARG A 116 5.064 -0.588 5.479 1.00 0.00 H new ATOM 0 HG3 ARG A 116 6.280 -0.015 6.602 1.00 0.00 H new ATOM 0 HD2 ARG A 116 3.667 -1.396 7.325 1.00 0.00 H new ATOM 0 HD3 ARG A 116 5.271 -2.095 7.421 1.00 0.00 H new ATOM 0 HE ARG A 116 4.547 0.302 9.072 1.00 0.00 H new ATOM 0 HH11 ARG A 116 5.850 -2.964 8.750 1.00 0.00 H new ATOM 0 HH12 ARG A 116 6.239 -3.100 10.468 1.00 0.00 H new ATOM 0 HH21 ARG A 116 5.031 0.111 11.274 1.00 0.00 H new ATOM 0 HH22 ARG A 116 5.778 -1.366 11.892 1.00 0.00 H new ATOM 1799 N LEU A 117 5.609 1.448 3.342 1.00 0.00 N ATOM 1800 CA LEU A 117 5.403 1.015 1.969 1.00 0.00 C ATOM 1801 C LEU A 117 5.473 -0.503 1.881 1.00 0.00 C ATOM 1802 O LEU A 117 6.496 -1.095 2.200 1.00 0.00 O ATOM 1803 CB LEU A 117 6.465 1.641 1.059 1.00 0.00 C ATOM 1804 CG LEU A 117 6.376 1.259 -0.422 1.00 0.00 C ATOM 1805 CD1 LEU A 117 5.094 1.797 -1.041 1.00 0.00 C ATOM 1806 CD2 LEU A 117 7.591 1.775 -1.178 1.00 0.00 C ATOM 0 H LEU A 117 6.588 1.498 3.622 1.00 0.00 H new ATOM 0 HA LEU A 117 4.416 1.341 1.641 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.394 2.726 1.141 1.00 0.00 H new ATOM 0 HB3 LEU A 117 7.449 1.357 1.431 1.00 0.00 H new ATOM 0 HG LEU A 117 6.359 0.172 -0.495 1.00 0.00 H new ATOM 0 HD11 LEU A 117 5.051 1.514 -2.093 1.00 0.00 H new ATOM 0 HD12 LEU A 117 4.234 1.379 -0.518 1.00 0.00 H new ATOM 0 HD13 LEU A 117 5.077 2.884 -0.956 1.00 0.00 H new ATOM 0 HD21 LEU A 117 7.512 1.495 -2.228 1.00 0.00 H new ATOM 0 HD22 LEU A 117 7.637 2.861 -1.094 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.496 1.339 -0.754 1.00 0.00 H new ATOM 1818 N ILE A 118 4.385 -1.132 1.467 1.00 0.00 N ATOM 1819 CA ILE A 118 4.361 -2.582 1.326 1.00 0.00 C ATOM 1820 C ILE A 118 4.126 -2.976 -0.126 1.00 0.00 C ATOM 1821 O ILE A 118 3.055 -2.731 -0.690 1.00 0.00 O ATOM 1822 CB ILE A 118 3.277 -3.233 2.217 1.00 0.00 C ATOM 1823 CG1 ILE A 118 3.477 -2.824 3.680 1.00 0.00 C ATOM 1824 CG2 ILE A 118 3.318 -4.750 2.078 1.00 0.00 C ATOM 1825 CD1 ILE A 118 2.445 -3.398 4.626 1.00 0.00 C ATOM 0 H ILE A 118 3.511 -0.666 1.224 1.00 0.00 H new ATOM 0 HA ILE A 118 5.334 -2.948 1.652 1.00 0.00 H new ATOM 0 HB ILE A 118 2.298 -2.882 1.889 1.00 0.00 H new ATOM 0 HG12 ILE A 118 4.468 -3.142 4.003 1.00 0.00 H new ATOM 0 HG13 ILE A 118 3.453 -1.736 3.749 1.00 0.00 H new ATOM 0 HG21 ILE A 118 2.550 -5.194 2.711 1.00 0.00 H new ATOM 0 HG22 ILE A 118 3.136 -5.025 1.039 1.00 0.00 H new ATOM 0 HG23 ILE A 118 4.297 -5.117 2.385 1.00 0.00 H new ATOM 0 HD11 ILE A 118 2.656 -3.062 5.641 1.00 0.00 H new ATOM 0 HD12 ILE A 118 1.452 -3.059 4.330 1.00 0.00 H new ATOM 0 HD13 ILE A 118 2.483 -4.487 4.589 1.00 0.00 H new ATOM 1837 N ILE A 119 5.118 -3.614 -0.722 1.00 0.00 N ATOM 1838 CA ILE A 119 5.043 -4.010 -2.117 1.00 0.00 C ATOM 1839 C ILE A 119 4.870 -5.516 -2.222 1.00 0.00 C ATOM 1840 O ILE A 119 5.525 -6.279 -1.513 1.00 0.00 O ATOM 1841 CB ILE A 119 6.300 -3.576 -2.909 1.00 0.00 C ATOM 1842 CG1 ILE A 119 6.404 -2.048 -2.945 1.00 0.00 C ATOM 1843 CG2 ILE A 119 6.273 -4.142 -4.327 1.00 0.00 C ATOM 1844 CD1 ILE A 119 7.548 -1.540 -3.796 1.00 0.00 C ATOM 0 H ILE A 119 5.990 -3.870 -0.258 1.00 0.00 H new ATOM 0 HA ILE A 119 4.181 -3.506 -2.554 1.00 0.00 H new ATOM 0 HB ILE A 119 7.178 -3.975 -2.401 1.00 0.00 H new ATOM 0 HG12 ILE A 119 5.469 -1.637 -3.325 1.00 0.00 H new ATOM 0 HG13 ILE A 119 6.525 -1.676 -1.928 1.00 0.00 H new ATOM 0 HG21 ILE A 119 7.167 -3.823 -4.863 1.00 0.00 H new ATOM 0 HG22 ILE A 119 6.245 -5.231 -4.284 1.00 0.00 H new ATOM 0 HG23 ILE A 119 5.388 -3.777 -4.848 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.561 -0.450 -3.775 1.00 0.00 H new ATOM 0 HD12 ILE A 119 8.491 -1.922 -3.404 1.00 0.00 H new ATOM 0 HD13 ILE A 119 7.417 -1.882 -4.823 1.00 0.00 H new ATOM 1856 N LYS A 120 3.967 -5.933 -3.096 1.00 0.00 N ATOM 1857 CA LYS A 120 3.682 -7.344 -3.290 1.00 0.00 C ATOM 1858 C LYS A 120 3.713 -7.690 -4.779 1.00 0.00 C ATOM 1859 O LYS A 120 2.728 -7.514 -5.494 1.00 0.00 O ATOM 1860 CB LYS A 120 2.329 -7.691 -2.651 1.00 0.00 C ATOM 1861 CG LYS A 120 1.170 -6.835 -3.148 1.00 0.00 C ATOM 1862 CD LYS A 120 0.063 -6.736 -2.116 1.00 0.00 C ATOM 1863 CE LYS A 120 0.480 -5.868 -0.938 1.00 0.00 C ATOM 1864 NZ LYS A 120 0.691 -4.452 -1.342 1.00 0.00 N ATOM 0 H LYS A 120 3.416 -5.309 -3.685 1.00 0.00 H new ATOM 0 HA LYS A 120 4.449 -7.944 -2.800 1.00 0.00 H new ATOM 0 HB2 LYS A 120 2.104 -8.739 -2.849 1.00 0.00 H new ATOM 0 HB3 LYS A 120 2.411 -7.581 -1.570 1.00 0.00 H new ATOM 0 HG2 LYS A 120 1.533 -5.836 -3.389 1.00 0.00 H new ATOM 0 HG3 LYS A 120 0.772 -7.261 -4.069 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -0.832 -6.319 -2.578 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -0.197 -7.733 -1.761 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -0.285 -5.915 -0.163 1.00 0.00 H new ATOM 0 HE3 LYS A 120 1.398 -6.262 -0.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 1.633 -4.139 -1.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 0.623 -4.372 -2.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -0.035 -3.853 -0.900 1.00 0.00 H new ATOM 1878 N PRO A 121 4.880 -8.111 -5.274 1.00 0.00 N ATOM 1879 CA PRO A 121 5.067 -8.491 -6.666 1.00 0.00 C ATOM 1880 C PRO A 121 4.959 -10.002 -6.884 1.00 0.00 C ATOM 1881 O PRO A 121 4.446 -10.736 -6.032 1.00 0.00 O ATOM 1882 CB PRO A 121 6.494 -8.013 -6.921 1.00 0.00 C ATOM 1883 CG PRO A 121 7.203 -8.199 -5.612 1.00 0.00 C ATOM 1884 CD PRO A 121 6.145 -8.223 -4.528 1.00 0.00 C ATOM 0 HA PRO A 121 4.313 -8.068 -7.329 1.00 0.00 H new ATOM 0 HB2 PRO A 121 6.969 -8.592 -7.713 1.00 0.00 H new ATOM 0 HB3 PRO A 121 6.511 -6.969 -7.235 1.00 0.00 H new ATOM 0 HG2 PRO A 121 7.774 -9.127 -5.613 1.00 0.00 H new ATOM 0 HG3 PRO A 121 7.912 -7.389 -5.440 1.00 0.00 H new ATOM 0 HD2 PRO A 121 6.187 -9.144 -3.947 1.00 0.00 H new ATOM 0 HD3 PRO A 121 6.271 -7.398 -3.827 1.00 0.00 H new ATOM 1892 N LEU A 122 5.430 -10.454 -8.038 1.00 0.00 N ATOM 1893 CA LEU A 122 5.499 -11.878 -8.344 1.00 0.00 C ATOM 1894 C LEU A 122 6.647 -12.535 -7.577 1.00 0.00 C ATOM 1895 O LEU A 122 7.576 -11.855 -7.140 1.00 0.00 O ATOM 1896 CB LEU A 122 5.684 -12.083 -9.855 1.00 0.00 C ATOM 1897 CG LEU A 122 4.395 -12.229 -10.673 1.00 0.00 C ATOM 1898 CD1 LEU A 122 3.614 -13.454 -10.238 1.00 0.00 C ATOM 1899 CD2 LEU A 122 3.534 -10.986 -10.549 1.00 0.00 C ATOM 0 H LEU A 122 5.773 -9.850 -8.785 1.00 0.00 H new ATOM 0 HA LEU A 122 4.565 -12.347 -8.035 1.00 0.00 H new ATOM 0 HB2 LEU A 122 6.249 -11.239 -10.250 1.00 0.00 H new ATOM 0 HB3 LEU A 122 6.293 -12.974 -10.010 1.00 0.00 H new ATOM 0 HG LEU A 122 4.676 -12.353 -11.719 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.704 -13.536 -10.833 1.00 0.00 H new ATOM 0 HD12 LEU A 122 4.224 -14.345 -10.384 1.00 0.00 H new ATOM 0 HD13 LEU A 122 3.351 -13.363 -9.184 1.00 0.00 H new ATOM 0 HD21 LEU A 122 2.625 -11.113 -11.138 1.00 0.00 H new ATOM 0 HD22 LEU A 122 3.270 -10.829 -9.503 1.00 0.00 H new ATOM 0 HD23 LEU A 122 4.087 -10.122 -10.917 1.00 0.00 H new ATOM 1911 N THR A 123 6.580 -13.856 -7.415 1.00 0.00 N ATOM 1912 CA THR A 123 7.604 -14.595 -6.681 1.00 0.00 C ATOM 1913 C THR A 123 8.985 -14.383 -7.305 1.00 0.00 C ATOM 1914 O THR A 123 9.970 -14.155 -6.602 1.00 0.00 O ATOM 1915 CB THR A 123 7.287 -16.104 -6.643 1.00 0.00 C ATOM 1916 OG1 THR A 123 5.949 -16.306 -6.170 1.00 0.00 O ATOM 1917 CG2 THR A 123 8.259 -16.850 -5.740 1.00 0.00 C ATOM 0 H THR A 123 5.826 -14.436 -7.783 1.00 0.00 H new ATOM 0 HA THR A 123 7.609 -14.211 -5.661 1.00 0.00 H new ATOM 0 HB THR A 123 7.388 -16.495 -7.655 1.00 0.00 H new ATOM 0 HG1 THR A 123 5.751 -17.266 -6.149 1.00 0.00 H new ATOM 0 HG21 THR A 123 8.009 -17.911 -5.734 1.00 0.00 H new ATOM 0 HG22 THR A 123 9.275 -16.718 -6.112 1.00 0.00 H new ATOM 0 HG23 THR A 123 8.190 -16.456 -4.726 1.00 0.00 H new ATOM 1925 N GLY A 124 9.043 -14.441 -8.629 1.00 0.00 N ATOM 1926 CA GLY A 124 10.294 -14.218 -9.328 1.00 0.00 C ATOM 1927 C GLY A 124 10.372 -12.815 -9.899 1.00 0.00 C ATOM 1928 O GLY A 124 10.877 -12.609 -11.005 1.00 0.00 O ATOM 0 H GLY A 124 8.245 -14.639 -9.232 1.00 0.00 H new ATOM 0 HA2 GLY A 124 11.127 -14.380 -8.644 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.396 -14.945 -10.133 1.00 0.00 H new ATOM 1932 N GLU A 125 9.861 -11.854 -9.148 1.00 0.00 N ATOM 1933 CA GLU A 125 9.820 -10.474 -9.593 1.00 0.00 C ATOM 1934 C GLU A 125 10.544 -9.590 -8.584 1.00 0.00 C ATOM 1935 O GLU A 125 10.143 -9.494 -7.423 1.00 0.00 O ATOM 1936 CB GLU A 125 8.363 -10.040 -9.773 1.00 0.00 C ATOM 1937 CG GLU A 125 8.189 -8.727 -10.506 1.00 0.00 C ATOM 1938 CD GLU A 125 6.758 -8.499 -10.950 1.00 0.00 C ATOM 1939 OE1 GLU A 125 5.858 -8.427 -10.088 1.00 0.00 O ATOM 1940 OE2 GLU A 125 6.530 -8.389 -12.174 1.00 0.00 O ATOM 0 H GLU A 125 9.466 -12.008 -8.220 1.00 0.00 H new ATOM 0 HA GLU A 125 10.326 -10.375 -10.553 1.00 0.00 H new ATOM 0 HB2 GLU A 125 7.829 -10.819 -10.316 1.00 0.00 H new ATOM 0 HB3 GLU A 125 7.897 -9.959 -8.791 1.00 0.00 H new ATOM 0 HG2 GLU A 125 8.500 -7.908 -9.858 1.00 0.00 H new ATOM 0 HG3 GLU A 125 8.844 -8.711 -11.377 1.00 0.00 H new ATOM 1947 N ASP A 126 11.622 -8.967 -9.032 1.00 0.00 N ATOM 1948 CA ASP A 126 12.500 -8.211 -8.143 1.00 0.00 C ATOM 1949 C ASP A 126 12.046 -6.766 -8.006 1.00 0.00 C ATOM 1950 O ASP A 126 11.245 -6.264 -8.797 1.00 0.00 O ATOM 1951 CB ASP A 126 13.936 -8.230 -8.677 1.00 0.00 C ATOM 1952 CG ASP A 126 14.950 -7.655 -7.703 1.00 0.00 C ATOM 1953 OD1 ASP A 126 14.917 -8.019 -6.509 1.00 0.00 O ATOM 1954 OD2 ASP A 126 15.798 -6.843 -8.134 1.00 0.00 O ATOM 0 H ASP A 126 11.914 -8.968 -10.009 1.00 0.00 H new ATOM 0 HA ASP A 126 12.458 -8.686 -7.163 1.00 0.00 H new ATOM 0 HB2 ASP A 126 14.214 -9.257 -8.915 1.00 0.00 H new ATOM 0 HB3 ASP A 126 13.977 -7.665 -9.608 1.00 0.00 H new ATOM 1959 N ILE A 127 12.579 -6.107 -6.998 1.00 0.00 N ATOM 1960 CA ILE A 127 12.380 -4.688 -6.811 1.00 0.00 C ATOM 1961 C ILE A 127 13.623 -3.958 -7.288 1.00 0.00 C ATOM 1962 O ILE A 127 14.655 -3.975 -6.614 1.00 0.00 O ATOM 1963 CB ILE A 127 12.104 -4.330 -5.332 1.00 0.00 C ATOM 1964 CG1 ILE A 127 10.827 -5.027 -4.852 1.00 0.00 C ATOM 1965 CG2 ILE A 127 12.000 -2.818 -5.148 1.00 0.00 C ATOM 1966 CD1 ILE A 127 10.441 -4.682 -3.430 1.00 0.00 C ATOM 0 H ILE A 127 13.163 -6.543 -6.285 1.00 0.00 H new ATOM 0 HA ILE A 127 11.506 -4.385 -7.387 1.00 0.00 H new ATOM 0 HB ILE A 127 12.940 -4.681 -4.728 1.00 0.00 H new ATOM 0 HG12 ILE A 127 10.006 -4.759 -5.517 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.961 -6.106 -4.931 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.806 -2.592 -4.100 1.00 0.00 H new ATOM 0 HG22 ILE A 127 12.936 -2.349 -5.453 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.184 -2.432 -5.760 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.528 -5.213 -3.162 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.244 -4.976 -2.754 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.273 -3.608 -3.349 1.00 0.00 H new ATOM 2047 N LYS A 132 16.661 -0.667 0.715 1.00 0.00 N ATOM 2048 CA LYS A 132 16.089 0.199 1.732 1.00 0.00 C ATOM 2049 C LYS A 132 14.911 -0.500 2.401 1.00 0.00 C ATOM 2050 O LYS A 132 14.620 -0.267 3.575 1.00 0.00 O ATOM 2051 CB LYS A 132 15.638 1.533 1.131 1.00 0.00 C ATOM 2052 CG LYS A 132 16.778 2.508 0.886 1.00 0.00 C ATOM 2053 CD LYS A 132 16.302 3.782 0.202 1.00 0.00 C ATOM 2054 CE LYS A 132 15.219 4.495 0.999 1.00 0.00 C ATOM 2055 NZ LYS A 132 15.680 4.903 2.355 1.00 0.00 N ATOM 0 HA LYS A 132 16.857 0.408 2.477 1.00 0.00 H new ATOM 0 HB2 LYS A 132 15.126 1.342 0.188 1.00 0.00 H new ATOM 0 HB3 LYS A 132 14.913 1.996 1.800 1.00 0.00 H new ATOM 0 HG2 LYS A 132 17.249 2.761 1.836 1.00 0.00 H new ATOM 0 HG3 LYS A 132 17.539 2.029 0.270 1.00 0.00 H new ATOM 0 HD2 LYS A 132 17.148 4.454 0.061 1.00 0.00 H new ATOM 0 HD3 LYS A 132 15.920 3.539 -0.789 1.00 0.00 H new ATOM 0 HE2 LYS A 132 14.891 5.378 0.450 1.00 0.00 H new ATOM 0 HE3 LYS A 132 14.353 3.840 1.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 14.860 5.180 2.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 16.169 4.106 2.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 16.333 5.708 2.272 1.00 0.00 H new ATOM 2069 N MET A 133 14.249 -1.376 1.647 1.00 0.00 N ATOM 2070 CA MET A 133 13.104 -2.117 2.162 1.00 0.00 C ATOM 2071 C MET A 133 13.572 -3.353 2.920 1.00 0.00 C ATOM 2072 O MET A 133 14.774 -3.590 3.053 1.00 0.00 O ATOM 2073 CB MET A 133 12.166 -2.523 1.020 1.00 0.00 C ATOM 2074 CG MET A 133 11.656 -1.344 0.211 1.00 0.00 C ATOM 2075 SD MET A 133 10.437 -1.808 -1.033 1.00 0.00 S ATOM 2076 CE MET A 133 9.059 -2.277 0.009 1.00 0.00 C ATOM 0 H MET A 133 14.487 -1.588 0.678 1.00 0.00 H new ATOM 0 HA MET A 133 12.556 -1.470 2.847 1.00 0.00 H new ATOM 0 HB2 MET A 133 12.690 -3.210 0.356 1.00 0.00 H new ATOM 0 HB3 MET A 133 11.316 -3.066 1.433 1.00 0.00 H new ATOM 0 HG2 MET A 133 11.214 -0.612 0.887 1.00 0.00 H new ATOM 0 HG3 MET A 133 12.499 -0.857 -0.280 1.00 0.00 H new ATOM 0 HE1 MET A 133 8.222 -2.590 -0.614 1.00 0.00 H new ATOM 0 HE2 MET A 133 9.357 -3.101 0.657 1.00 0.00 H new ATOM 0 HE3 MET A 133 8.758 -1.426 0.619 1.00 0.00 H new ATOM 2086 N LYS A 134 12.623 -4.127 3.423 1.00 0.00 N ATOM 2087 CA LYS A 134 12.938 -5.330 4.178 1.00 0.00 C ATOM 2088 C LYS A 134 11.943 -6.446 3.873 1.00 0.00 C ATOM 2089 O LYS A 134 10.733 -6.216 3.801 1.00 0.00 O ATOM 2090 CB LYS A 134 12.952 -5.024 5.681 1.00 0.00 C ATOM 2091 CG LYS A 134 11.717 -4.274 6.161 1.00 0.00 C ATOM 2092 CD LYS A 134 11.787 -3.938 7.642 1.00 0.00 C ATOM 2093 CE LYS A 134 11.664 -5.181 8.513 1.00 0.00 C ATOM 2094 NZ LYS A 134 11.738 -4.849 9.960 1.00 0.00 N ATOM 0 H LYS A 134 11.625 -3.943 3.322 1.00 0.00 H new ATOM 0 HA LYS A 134 13.929 -5.670 3.877 1.00 0.00 H new ATOM 0 HB2 LYS A 134 13.036 -5.960 6.233 1.00 0.00 H new ATOM 0 HB3 LYS A 134 13.839 -4.435 5.915 1.00 0.00 H new ATOM 0 HG2 LYS A 134 11.607 -3.354 5.587 1.00 0.00 H new ATOM 0 HG3 LYS A 134 10.830 -4.878 5.969 1.00 0.00 H new ATOM 0 HD2 LYS A 134 12.731 -3.437 7.856 1.00 0.00 H new ATOM 0 HD3 LYS A 134 10.990 -3.238 7.894 1.00 0.00 H new ATOM 0 HE2 LYS A 134 10.718 -5.681 8.302 1.00 0.00 H new ATOM 0 HE3 LYS A 134 12.459 -5.883 8.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 11.651 -5.720 10.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 12.651 -4.395 10.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 10.965 -4.199 10.207 1.00 0.00 H new ATOM 2108 N LEU A 135 12.473 -7.643 3.664 1.00 0.00 N ATOM 2109 CA LEU A 135 11.656 -8.830 3.451 1.00 0.00 C ATOM 2110 C LEU A 135 10.980 -9.248 4.753 1.00 0.00 C ATOM 2111 O LEU A 135 11.646 -9.475 5.763 1.00 0.00 O ATOM 2112 CB LEU A 135 12.515 -9.984 2.924 1.00 0.00 C ATOM 2113 CG LEU A 135 11.765 -11.297 2.681 1.00 0.00 C ATOM 2114 CD1 LEU A 135 10.796 -11.154 1.518 1.00 0.00 C ATOM 2115 CD2 LEU A 135 12.741 -12.433 2.426 1.00 0.00 C ATOM 0 H LEU A 135 13.477 -7.819 3.637 1.00 0.00 H new ATOM 0 HA LEU A 135 10.891 -8.591 2.712 1.00 0.00 H new ATOM 0 HB2 LEU A 135 12.981 -9.672 1.989 1.00 0.00 H new ATOM 0 HB3 LEU A 135 13.320 -10.170 3.635 1.00 0.00 H new ATOM 0 HG LEU A 135 11.192 -11.533 3.578 1.00 0.00 H new ATOM 0 HD11 LEU A 135 10.273 -12.098 1.362 1.00 0.00 H new ATOM 0 HD12 LEU A 135 10.072 -10.371 1.742 1.00 0.00 H new ATOM 0 HD13 LEU A 135 11.347 -10.891 0.615 1.00 0.00 H new ATOM 0 HD21 LEU A 135 12.188 -13.357 2.256 1.00 0.00 H new ATOM 0 HD22 LEU A 135 13.344 -12.204 1.547 1.00 0.00 H new ATOM 0 HD23 LEU A 135 13.392 -12.554 3.292 1.00 0.00 H new ATOM 2127 N VAL A 136 9.665 -9.350 4.721 1.00 0.00 N ATOM 2128 CA VAL A 136 8.899 -9.736 5.895 1.00 0.00 C ATOM 2129 C VAL A 136 8.075 -10.987 5.626 1.00 0.00 C ATOM 2130 O VAL A 136 7.471 -11.130 4.562 1.00 0.00 O ATOM 2131 CB VAL A 136 7.957 -8.607 6.369 1.00 0.00 C ATOM 2132 CG1 VAL A 136 8.575 -7.831 7.515 1.00 0.00 C ATOM 2133 CG2 VAL A 136 7.627 -7.663 5.225 1.00 0.00 C ATOM 0 H VAL A 136 9.101 -9.170 3.891 1.00 0.00 H new ATOM 0 HA VAL A 136 9.625 -9.939 6.683 1.00 0.00 H new ATOM 0 HB VAL A 136 7.035 -9.071 6.719 1.00 0.00 H new ATOM 0 HG11 VAL A 136 7.892 -7.042 7.830 1.00 0.00 H new ATOM 0 HG12 VAL A 136 8.762 -8.505 8.351 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.516 -7.388 7.189 1.00 0.00 H new ATOM 0 HG21 VAL A 136 6.963 -6.876 5.583 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.546 -7.217 4.845 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.135 -8.218 4.426 1.00 0.00 H new ATOM 2143 N ASN A 137 8.068 -11.892 6.591 1.00 0.00 N ATOM 2144 CA ASN A 137 7.288 -13.116 6.502 1.00 0.00 C ATOM 2145 C ASN A 137 6.138 -13.048 7.496 1.00 0.00 C ATOM 2146 O ASN A 137 6.361 -12.789 8.678 1.00 0.00 O ATOM 2147 CB ASN A 137 8.163 -14.336 6.817 1.00 0.00 C ATOM 2148 CG ASN A 137 9.379 -14.445 5.913 1.00 0.00 C ATOM 2149 OD1 ASN A 137 10.426 -13.855 6.185 1.00 0.00 O ATOM 2150 ND2 ASN A 137 9.261 -15.221 4.846 1.00 0.00 N ATOM 0 H ASN A 137 8.601 -11.800 7.456 1.00 0.00 H new ATOM 0 HA ASN A 137 6.901 -13.216 5.488 1.00 0.00 H new ATOM 0 HB2 ASN A 137 8.492 -14.281 7.855 1.00 0.00 H new ATOM 0 HB3 ASN A 137 7.563 -15.241 6.720 1.00 0.00 H new ATOM 0 HD21 ASN A 137 10.054 -15.346 4.216 1.00 0.00 H new ATOM 0 HD22 ASN A 137 8.378 -15.693 4.654 1.00 0.00 H new ATOM 2157 N TYR A 138 4.917 -13.256 7.026 1.00 0.00 N ATOM 2158 CA TYR A 138 3.754 -13.197 7.904 1.00 0.00 C ATOM 2159 C TYR A 138 2.724 -14.262 7.532 1.00 0.00 C ATOM 2160 O TYR A 138 2.181 -14.264 6.425 1.00 0.00 O ATOM 2161 CB TYR A 138 3.129 -11.797 7.849 1.00 0.00 C ATOM 2162 CG TYR A 138 2.081 -11.543 8.910 1.00 0.00 C ATOM 2163 CD1 TYR A 138 2.451 -11.275 10.221 1.00 0.00 C ATOM 2164 CD2 TYR A 138 0.728 -11.556 8.600 1.00 0.00 C ATOM 2165 CE1 TYR A 138 1.502 -11.031 11.194 1.00 0.00 C ATOM 2166 CE2 TYR A 138 -0.227 -11.309 9.567 1.00 0.00 C ATOM 2167 CZ TYR A 138 0.165 -11.048 10.862 1.00 0.00 C ATOM 2168 OH TYR A 138 -0.784 -10.796 11.828 1.00 0.00 O ATOM 0 H TYR A 138 4.705 -13.465 6.051 1.00 0.00 H new ATOM 0 HA TYR A 138 4.083 -13.399 8.923 1.00 0.00 H new ATOM 0 HB2 TYR A 138 3.920 -11.054 7.951 1.00 0.00 H new ATOM 0 HB3 TYR A 138 2.679 -11.651 6.867 1.00 0.00 H new ATOM 0 HD1 TYR A 138 3.498 -11.257 10.484 1.00 0.00 H new ATOM 0 HD2 TYR A 138 0.417 -11.763 7.587 1.00 0.00 H new ATOM 0 HE1 TYR A 138 1.806 -10.828 12.210 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -1.276 -11.320 9.309 1.00 0.00 H new ATOM 0 HH TYR A 138 -1.678 -10.845 11.429 1.00 0.00 H new ATOM 2178 N GLY A 139 2.486 -15.183 8.459 1.00 0.00 N ATOM 2179 CA GLY A 139 1.474 -16.200 8.273 1.00 0.00 C ATOM 2180 C GLY A 139 1.938 -17.304 7.351 1.00 0.00 C ATOM 2181 O GLY A 139 2.564 -18.271 7.785 1.00 0.00 O ATOM 0 H GLY A 139 2.985 -15.241 9.347 1.00 0.00 H new ATOM 0 HA2 GLY A 139 1.206 -16.625 9.240 1.00 0.00 H new ATOM 0 HA3 GLY A 139 0.572 -15.743 7.865 1.00 0.00 H new ATOM 2185 N ARG A 140 1.639 -17.141 6.079 1.00 0.00 N ATOM 2186 CA ARG A 140 2.001 -18.119 5.058 1.00 0.00 C ATOM 2187 C ARG A 140 2.476 -17.427 3.791 1.00 0.00 C ATOM 2188 O ARG A 140 2.553 -18.038 2.724 1.00 0.00 O ATOM 2189 CB ARG A 140 0.824 -19.035 4.736 1.00 0.00 C ATOM 2190 CG ARG A 140 0.688 -20.189 5.708 1.00 0.00 C ATOM 2191 CD ARG A 140 -0.259 -21.244 5.181 1.00 0.00 C ATOM 2192 NE ARG A 140 -1.661 -20.843 5.278 1.00 0.00 N ATOM 2193 CZ ARG A 140 -2.644 -21.405 4.571 1.00 0.00 C ATOM 2194 NH1 ARG A 140 -2.366 -22.272 3.600 1.00 0.00 N ATOM 2195 NH2 ARG A 140 -3.905 -21.073 4.810 1.00 0.00 N ATOM 0 H ARG A 140 1.138 -16.329 5.717 1.00 0.00 H new ATOM 0 HA ARG A 140 2.816 -18.724 5.456 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -0.096 -18.451 4.743 1.00 0.00 H new ATOM 0 HB3 ARG A 140 0.943 -19.429 3.727 1.00 0.00 H new ATOM 0 HG2 ARG A 140 1.667 -20.633 5.887 1.00 0.00 H new ATOM 0 HG3 ARG A 140 0.326 -19.819 6.667 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -0.017 -21.456 4.139 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -0.111 -22.170 5.737 1.00 0.00 H new ATOM 0 HE ARG A 140 -1.902 -20.091 5.923 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -1.396 -22.511 3.392 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -3.122 -22.697 3.064 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -4.124 -20.388 5.534 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -4.656 -21.502 4.270 1.00 0.00 H new ATOM 2209 N THR A 141 2.805 -16.153 3.912 1.00 0.00 N ATOM 2210 CA THR A 141 3.253 -15.383 2.772 1.00 0.00 C ATOM 2211 C THR A 141 4.430 -14.494 3.164 1.00 0.00 C ATOM 2212 O THR A 141 4.638 -14.211 4.349 1.00 0.00 O ATOM 2213 CB THR A 141 2.099 -14.528 2.193 1.00 0.00 C ATOM 2214 OG1 THR A 141 2.511 -13.891 0.978 1.00 0.00 O ATOM 2215 CG2 THR A 141 1.639 -13.473 3.192 1.00 0.00 C ATOM 0 H THR A 141 2.769 -15.633 4.789 1.00 0.00 H new ATOM 0 HA THR A 141 3.580 -16.078 1.998 1.00 0.00 H new ATOM 0 HB THR A 141 1.263 -15.197 1.986 1.00 0.00 H new ATOM 0 HG1 THR A 141 1.771 -13.355 0.622 1.00 0.00 H new ATOM 0 HG21 THR A 141 0.828 -12.889 2.757 1.00 0.00 H new ATOM 0 HG22 THR A 141 1.287 -13.961 4.101 1.00 0.00 H new ATOM 0 HG23 THR A 141 2.472 -12.813 3.434 1.00 0.00 H new ATOM 2223 N TYR A 142 5.206 -14.078 2.177 1.00 0.00 N ATOM 2224 CA TYR A 142 6.332 -13.196 2.419 1.00 0.00 C ATOM 2225 C TYR A 142 6.338 -12.074 1.394 1.00 0.00 C ATOM 2226 O TYR A 142 6.051 -12.292 0.216 1.00 0.00 O ATOM 2227 CB TYR A 142 7.662 -13.962 2.409 1.00 0.00 C ATOM 2228 CG TYR A 142 8.009 -14.633 1.097 1.00 0.00 C ATOM 2229 CD1 TYR A 142 7.431 -15.844 0.737 1.00 0.00 C ATOM 2230 CD2 TYR A 142 8.932 -14.062 0.229 1.00 0.00 C ATOM 2231 CE1 TYR A 142 7.763 -16.467 -0.450 1.00 0.00 C ATOM 2232 CE2 TYR A 142 9.265 -14.676 -0.961 1.00 0.00 C ATOM 2233 CZ TYR A 142 8.680 -15.879 -1.295 1.00 0.00 C ATOM 2234 OH TYR A 142 9.018 -16.498 -2.477 1.00 0.00 O ATOM 0 H TYR A 142 5.075 -14.338 1.199 1.00 0.00 H new ATOM 0 HA TYR A 142 6.221 -12.763 3.413 1.00 0.00 H new ATOM 0 HB2 TYR A 142 8.463 -13.270 2.668 1.00 0.00 H new ATOM 0 HB3 TYR A 142 7.632 -14.721 3.190 1.00 0.00 H new ATOM 0 HD1 TYR A 142 6.711 -16.306 1.396 1.00 0.00 H new ATOM 0 HD2 TYR A 142 9.396 -13.122 0.490 1.00 0.00 H new ATOM 0 HE1 TYR A 142 7.307 -17.409 -0.715 1.00 0.00 H new ATOM 0 HE2 TYR A 142 9.980 -14.217 -1.627 1.00 0.00 H new ATOM 0 HH TYR A 142 9.676 -15.952 -2.956 1.00 0.00 H new ATOM 2244 N PHE A 143 6.649 -10.880 1.855 1.00 0.00 N ATOM 2245 CA PHE A 143 6.557 -9.686 1.033 1.00 0.00 C ATOM 2246 C PHE A 143 7.613 -8.674 1.459 1.00 0.00 C ATOM 2247 O PHE A 143 8.469 -8.980 2.287 1.00 0.00 O ATOM 2248 CB PHE A 143 5.147 -9.085 1.147 1.00 0.00 C ATOM 2249 CG PHE A 143 4.604 -9.092 2.550 1.00 0.00 C ATOM 2250 CD1 PHE A 143 4.859 -8.043 3.415 1.00 0.00 C ATOM 2251 CD2 PHE A 143 3.848 -10.162 3.005 1.00 0.00 C ATOM 2252 CE1 PHE A 143 4.368 -8.058 4.708 1.00 0.00 C ATOM 2253 CE2 PHE A 143 3.355 -10.181 4.293 1.00 0.00 C ATOM 2254 CZ PHE A 143 3.615 -9.129 5.147 1.00 0.00 C ATOM 0 H PHE A 143 6.972 -10.708 2.807 1.00 0.00 H new ATOM 0 HA PHE A 143 6.739 -9.950 -0.009 1.00 0.00 H new ATOM 0 HB2 PHE A 143 5.167 -8.059 0.779 1.00 0.00 H new ATOM 0 HB3 PHE A 143 4.469 -9.643 0.501 1.00 0.00 H new ATOM 0 HD1 PHE A 143 5.448 -7.203 3.077 1.00 0.00 H new ATOM 0 HD2 PHE A 143 3.643 -10.990 2.343 1.00 0.00 H new ATOM 0 HE1 PHE A 143 4.573 -7.233 5.374 1.00 0.00 H new ATOM 0 HE2 PHE A 143 2.765 -11.019 4.633 1.00 0.00 H new ATOM 0 HZ PHE A 143 3.231 -9.143 6.156 1.00 0.00 H new ATOM 2264 N TYR A 144 7.558 -7.478 0.898 1.00 0.00 N ATOM 2265 CA TYR A 144 8.531 -6.447 1.221 1.00 0.00 C ATOM 2266 C TYR A 144 7.844 -5.231 1.819 1.00 0.00 C ATOM 2267 O TYR A 144 6.882 -4.712 1.248 1.00 0.00 O ATOM 2268 CB TYR A 144 9.304 -6.023 -0.029 1.00 0.00 C ATOM 2269 CG TYR A 144 10.141 -7.121 -0.646 1.00 0.00 C ATOM 2270 CD1 TYR A 144 11.411 -7.403 -0.161 1.00 0.00 C ATOM 2271 CD2 TYR A 144 9.669 -7.863 -1.722 1.00 0.00 C ATOM 2272 CE1 TYR A 144 12.187 -8.394 -0.730 1.00 0.00 C ATOM 2273 CE2 TYR A 144 10.439 -8.854 -2.297 1.00 0.00 C ATOM 2274 CZ TYR A 144 11.698 -9.116 -1.797 1.00 0.00 C ATOM 2275 OH TYR A 144 12.472 -10.097 -2.371 1.00 0.00 O ATOM 0 H TYR A 144 6.852 -7.197 0.218 1.00 0.00 H new ATOM 0 HA TYR A 144 9.226 -6.863 1.950 1.00 0.00 H new ATOM 0 HB2 TYR A 144 8.596 -5.660 -0.774 1.00 0.00 H new ATOM 0 HB3 TYR A 144 9.954 -5.187 0.227 1.00 0.00 H new ATOM 0 HD1 TYR A 144 11.798 -6.839 0.674 1.00 0.00 H new ATOM 0 HD2 TYR A 144 8.683 -7.661 -2.115 1.00 0.00 H new ATOM 0 HE1 TYR A 144 13.173 -8.602 -0.340 1.00 0.00 H new ATOM 0 HE2 TYR A 144 10.058 -9.421 -3.134 1.00 0.00 H new ATOM 0 HH TYR A 144 11.980 -10.511 -3.110 1.00 0.00 H new ATOM 2285 N GLU A 145 8.333 -4.782 2.964 1.00 0.00 N ATOM 2286 CA GLU A 145 7.829 -3.563 3.568 1.00 0.00 C ATOM 2287 C GLU A 145 8.957 -2.552 3.714 1.00 0.00 C ATOM 2288 O GLU A 145 10.137 -2.905 3.667 1.00 0.00 O ATOM 2289 CB GLU A 145 7.186 -3.834 4.936 1.00 0.00 C ATOM 2290 CG GLU A 145 8.185 -4.124 6.047 1.00 0.00 C ATOM 2291 CD GLU A 145 7.538 -4.213 7.418 1.00 0.00 C ATOM 2292 OE1 GLU A 145 6.309 -4.007 7.520 1.00 0.00 O ATOM 2293 OE2 GLU A 145 8.256 -4.483 8.406 1.00 0.00 O ATOM 0 H GLU A 145 9.075 -5.242 3.491 1.00 0.00 H new ATOM 0 HA GLU A 145 7.059 -3.158 2.912 1.00 0.00 H new ATOM 0 HB2 GLU A 145 6.584 -2.971 5.220 1.00 0.00 H new ATOM 0 HB3 GLU A 145 6.506 -4.681 4.844 1.00 0.00 H new ATOM 0 HG2 GLU A 145 8.698 -5.062 5.832 1.00 0.00 H new ATOM 0 HG3 GLU A 145 8.944 -3.341 6.059 1.00 0.00 H new ATOM 2300 N TYR A 146 8.589 -1.296 3.853 1.00 0.00 N ATOM 2301 CA TYR A 146 9.549 -0.235 4.077 1.00 0.00 C ATOM 2302 C TYR A 146 8.994 0.757 5.081 1.00 0.00 C ATOM 2303 O TYR A 146 7.876 1.248 4.926 1.00 0.00 O ATOM 2304 CB TYR A 146 9.883 0.483 2.765 1.00 0.00 C ATOM 2305 CG TYR A 146 10.743 1.711 2.958 1.00 0.00 C ATOM 2306 CD1 TYR A 146 12.030 1.600 3.461 1.00 0.00 C ATOM 2307 CD2 TYR A 146 10.263 2.978 2.653 1.00 0.00 C ATOM 2308 CE1 TYR A 146 12.817 2.716 3.658 1.00 0.00 C ATOM 2309 CE2 TYR A 146 11.048 4.101 2.842 1.00 0.00 C ATOM 2310 CZ TYR A 146 12.323 3.965 3.347 1.00 0.00 C ATOM 2311 OH TYR A 146 13.111 5.079 3.541 1.00 0.00 O ATOM 0 H TYR A 146 7.619 -0.982 3.814 1.00 0.00 H new ATOM 0 HA TYR A 146 10.465 -0.676 4.471 1.00 0.00 H new ATOM 0 HB2 TYR A 146 10.397 -0.211 2.100 1.00 0.00 H new ATOM 0 HB3 TYR A 146 8.956 0.771 2.270 1.00 0.00 H new ATOM 0 HD1 TYR A 146 12.423 0.624 3.703 1.00 0.00 H new ATOM 0 HD2 TYR A 146 9.262 3.088 2.263 1.00 0.00 H new ATOM 0 HE1 TYR A 146 13.816 2.612 4.054 1.00 0.00 H new ATOM 0 HE2 TYR A 146 10.664 5.080 2.595 1.00 0.00 H new ATOM 0 HH TYR A 146 12.616 5.881 3.272 1.00 0.00 H new ATOM 2321 N ILE A 147 9.768 1.044 6.110 1.00 0.00 N ATOM 2322 CA ILE A 147 9.354 1.998 7.118 1.00 0.00 C ATOM 2323 C ILE A 147 9.912 3.373 6.782 1.00 0.00 C ATOM 2324 O ILE A 147 11.094 3.646 6.989 1.00 0.00 O ATOM 2325 CB ILE A 147 9.792 1.585 8.551 1.00 0.00 C ATOM 2326 CG1 ILE A 147 9.053 0.321 9.017 1.00 0.00 C ATOM 2327 CG2 ILE A 147 9.542 2.719 9.537 1.00 0.00 C ATOM 2328 CD1 ILE A 147 9.510 -0.959 8.347 1.00 0.00 C ATOM 0 H ILE A 147 10.686 0.630 6.269 1.00 0.00 H new ATOM 0 HA ILE A 147 8.264 2.022 7.112 1.00 0.00 H new ATOM 0 HB ILE A 147 10.860 1.369 8.518 1.00 0.00 H new ATOM 0 HG12 ILE A 147 9.181 0.217 10.095 1.00 0.00 H new ATOM 0 HG13 ILE A 147 7.986 0.451 8.834 1.00 0.00 H new ATOM 0 HG21 ILE A 147 9.855 2.410 10.534 1.00 0.00 H new ATOM 0 HG22 ILE A 147 10.112 3.597 9.234 1.00 0.00 H new ATOM 0 HG23 ILE A 147 8.480 2.963 9.550 1.00 0.00 H new ATOM 0 HD11 ILE A 147 8.935 -1.799 8.736 1.00 0.00 H new ATOM 0 HD12 ILE A 147 9.356 -0.881 7.271 1.00 0.00 H new ATOM 0 HD13 ILE A 147 10.569 -1.119 8.551 1.00 0.00 H new ATOM 2340 N ALA A 148 9.068 4.214 6.215 1.00 0.00 N ATOM 2341 CA ALA A 148 9.452 5.575 5.900 1.00 0.00 C ATOM 2342 C ALA A 148 9.113 6.487 7.064 1.00 0.00 C ATOM 2343 O ALA A 148 7.974 6.506 7.533 1.00 0.00 O ATOM 2344 CB ALA A 148 8.761 6.049 4.639 1.00 0.00 C ATOM 0 H ALA A 148 8.109 3.976 5.963 1.00 0.00 H new ATOM 0 HA ALA A 148 10.528 5.604 5.727 1.00 0.00 H new ATOM 0 HB1 ALA A 148 9.064 7.073 4.421 1.00 0.00 H new ATOM 0 HB2 ALA A 148 9.040 5.403 3.806 1.00 0.00 H new ATOM 0 HB3 ALA A 148 7.681 6.012 4.780 1.00 0.00 H new ATOM 2350 N GLU A 149 10.099 7.223 7.542 1.00 0.00 N ATOM 2351 CA GLU A 149 9.887 8.119 8.657 1.00 0.00 C ATOM 2352 C GLU A 149 9.227 9.406 8.179 1.00 0.00 C ATOM 2353 O GLU A 149 9.249 9.728 6.988 1.00 0.00 O ATOM 2354 CB GLU A 149 11.210 8.419 9.367 1.00 0.00 C ATOM 2355 CG GLU A 149 12.181 9.252 8.545 1.00 0.00 C ATOM 2356 CD GLU A 149 13.502 9.474 9.250 1.00 0.00 C ATOM 2357 OE1 GLU A 149 13.591 10.413 10.073 1.00 0.00 O ATOM 2358 OE2 GLU A 149 14.457 8.710 8.994 1.00 0.00 O ATOM 0 H GLU A 149 11.051 7.216 7.175 1.00 0.00 H new ATOM 0 HA GLU A 149 9.222 7.634 9.372 1.00 0.00 H new ATOM 0 HB2 GLU A 149 10.999 8.942 10.300 1.00 0.00 H new ATOM 0 HB3 GLU A 149 11.690 7.477 9.631 1.00 0.00 H new ATOM 0 HG2 GLU A 149 12.362 8.756 7.591 1.00 0.00 H new ATOM 0 HG3 GLU A 149 11.726 10.217 8.321 1.00 0.00 H new