USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=31 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+ -163:sc= 0.994 (180deg=0) USER MOD Set 1.2: A 146 TYR OH : rot 180:sc= 0.859 USER MOD Set 2.1: A 123 THR OG1 : rot -56:sc= 0.579 USER MOD Set 2.2: A 142 TYR OH : rot 180:sc= 0.53 USER MOD Set 3.1: A 23 ASN : amide:sc= 0.45 K(o=0.86,f=-0.03) USER MOD Set 3.2: A 49 TYR OH : rot 100:sc= 0.405 USER MOD Set 3.3: A 53 TYR OH : rot 180:sc= 0.00362 USER MOD Single : A 28 TYR OH : rot -177:sc= 1.26 USER MOD Single : A 32 CYS SG : rot 75:sc= 1.09 USER MOD Single : A 33 SER OG : rot -89:sc= 1.48 USER MOD Single : A 37 THR OG1 : rot 130:sc= 0.139 USER MOD Single : A 51 SER OG : rot -160:sc= 0.0658 USER MOD Single : A 56 LYS NZ :NH3+ -160:sc= 0.954 (180deg=0.417) USER MOD Single : A 57 HIS : no HD1:sc= -0.675 X(o=-0.67,f=-0.7) USER MOD Single : A 58 SER OG : rot -150:sc= -0.0475 USER MOD Single : A 59 LYS NZ :NH3+ -167:sc= -0.0512 (180deg=-0.27) USER MOD Single : A 65 THR OG1 : rot -85:sc= 1.16 USER MOD Single : A 68 LYS NZ :NH3+ 165:sc= -0.0688 (180deg=-0.375) USER MOD Single : A 80 THR OG1 : rot -60:sc= 1.23 USER MOD Single : A 81 SER OG : rot -62:sc= 0.149 USER MOD Single : A 84 MET CE :methyl -116:sc= -1.02 (180deg=-4.85!) USER MOD Single : A 87 TYR OH : rot 130:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 130:sc= -0.808 USER MOD Single : A 103 HIS : no HD1:sc= -4.74! C(o=-4.7!,f=-6.2!) USER MOD Single : A 104 SER OG : rot 180:sc=0.000873 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 MET CE :methyl -153:sc= -0.905 (180deg=-2.94!) USER MOD Single : A 120 LYS NZ :NH3+ -170:sc= 1.27 (180deg=1.09) USER MOD Single : A 133 MET CE :methyl -106:sc= -0.0202 (180deg=-0.421) USER MOD Single : A 134 LYS NZ :NH3+ -150:sc= 1.34 (180deg=1.16) USER MOD Single : A 137 ASN : amide:sc= -2.13 K(o=-2.1,f=0) USER MOD Single : A 138 TYR OH : rot 180:sc= 1.01 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 TYR OH : rot 29:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 305 N TRP A 22 -1.706 -14.167 0.839 1.00 0.00 N ATOM 306 CA TRP A 22 -1.857 -12.714 0.904 1.00 0.00 C ATOM 307 C TRP A 22 -2.621 -12.307 2.166 1.00 0.00 C ATOM 308 O TRP A 22 -2.585 -11.147 2.580 1.00 0.00 O ATOM 309 CB TRP A 22 -2.599 -12.198 -0.333 1.00 0.00 C ATOM 310 CG TRP A 22 -1.929 -12.540 -1.630 1.00 0.00 C ATOM 311 CD1 TRP A 22 -2.116 -13.668 -2.374 1.00 0.00 C ATOM 312 CD2 TRP A 22 -0.969 -11.747 -2.336 1.00 0.00 C ATOM 313 NE1 TRP A 22 -1.329 -13.628 -3.498 1.00 0.00 N ATOM 314 CE2 TRP A 22 -0.616 -12.457 -3.500 1.00 0.00 C ATOM 315 CE3 TRP A 22 -0.375 -10.508 -2.099 1.00 0.00 C ATOM 316 CZ2 TRP A 22 0.309 -11.969 -4.419 1.00 0.00 C ATOM 317 CZ3 TRP A 22 0.538 -10.021 -3.013 1.00 0.00 C ATOM 318 CH2 TRP A 22 0.872 -10.750 -4.162 1.00 0.00 C ATOM 0 HA TRP A 22 -0.861 -12.272 0.935 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -3.608 -12.610 -0.337 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -2.697 -11.115 -0.260 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -2.786 -14.475 -2.116 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -1.282 -14.352 -4.215 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -0.625 -9.939 -1.216 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 0.572 -12.532 -5.302 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 1.003 -9.062 -2.839 1.00 0.00 H new ATOM 0 HH2 TRP A 22 1.589 -10.341 -4.859 1.00 0.00 H new ATOM 329 N ASN A 23 -3.325 -13.271 2.752 1.00 0.00 N ATOM 330 CA ASN A 23 -4.151 -13.032 3.934 1.00 0.00 C ATOM 331 C ASN A 23 -3.332 -12.432 5.078 1.00 0.00 C ATOM 332 O ASN A 23 -3.694 -11.390 5.628 1.00 0.00 O ATOM 333 CB ASN A 23 -4.798 -14.340 4.393 1.00 0.00 C ATOM 334 CG ASN A 23 -5.727 -14.150 5.575 1.00 0.00 C ATOM 335 OD1 ASN A 23 -5.311 -14.228 6.731 1.00 0.00 O ATOM 336 ND2 ASN A 23 -6.996 -13.914 5.292 1.00 0.00 N ATOM 0 H ASN A 23 -3.340 -14.237 2.424 1.00 0.00 H new ATOM 0 HA ASN A 23 -4.926 -12.316 3.660 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -5.356 -14.775 3.564 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -4.018 -15.052 4.660 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -7.672 -13.789 6.046 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -7.300 -13.857 4.320 1.00 0.00 H new ATOM 343 N ASP A 24 -2.224 -13.085 5.418 1.00 0.00 N ATOM 344 CA ASP A 24 -1.366 -12.626 6.513 1.00 0.00 C ATOM 345 C ASP A 24 -0.762 -11.263 6.203 1.00 0.00 C ATOM 346 O ASP A 24 -0.570 -10.442 7.104 1.00 0.00 O ATOM 347 CB ASP A 24 -0.258 -13.642 6.807 1.00 0.00 C ATOM 348 CG ASP A 24 -0.758 -14.839 7.593 1.00 0.00 C ATOM 349 OD1 ASP A 24 -1.284 -15.789 6.976 1.00 0.00 O ATOM 350 OD2 ASP A 24 -0.625 -14.840 8.838 1.00 0.00 O ATOM 0 H ASP A 24 -1.897 -13.932 4.954 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.991 -12.531 7.401 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.175 -13.984 5.867 1.00 0.00 H new ATOM 0 HB3 ASP A 24 0.540 -13.153 7.366 1.00 0.00 H new ATOM 355 N LEU A 25 -0.479 -11.020 4.928 1.00 0.00 N ATOM 356 CA LEU A 25 0.017 -9.721 4.485 1.00 0.00 C ATOM 357 C LEU A 25 -0.977 -8.627 4.856 1.00 0.00 C ATOM 358 O LEU A 25 -0.604 -7.612 5.444 1.00 0.00 O ATOM 359 CB LEU A 25 0.254 -9.724 2.973 1.00 0.00 C ATOM 360 CG LEU A 25 0.639 -8.368 2.372 1.00 0.00 C ATOM 361 CD1 LEU A 25 1.983 -7.904 2.913 1.00 0.00 C ATOM 362 CD2 LEU A 25 0.669 -8.446 0.855 1.00 0.00 C ATOM 0 H LEU A 25 -0.585 -11.707 4.181 1.00 0.00 H new ATOM 0 HA LEU A 25 0.965 -9.524 4.985 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.043 -10.441 2.746 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -0.651 -10.079 2.480 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.116 -7.637 2.662 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.238 -6.939 2.474 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.924 -7.805 3.997 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.750 -8.634 2.656 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.944 -7.474 0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.401 -9.191 0.543 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -0.317 -8.729 0.486 1.00 0.00 H new ATOM 374 N ALA A 26 -2.241 -8.856 4.518 1.00 0.00 N ATOM 375 CA ALA A 26 -3.305 -7.913 4.834 1.00 0.00 C ATOM 376 C ALA A 26 -3.387 -7.675 6.336 1.00 0.00 C ATOM 377 O ALA A 26 -3.419 -6.530 6.786 1.00 0.00 O ATOM 378 CB ALA A 26 -4.634 -8.421 4.297 1.00 0.00 C ATOM 0 H ALA A 26 -2.554 -9.691 4.023 1.00 0.00 H new ATOM 0 HA ALA A 26 -3.078 -6.961 4.354 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.421 -7.707 4.540 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -4.569 -8.536 3.215 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -4.865 -9.385 4.751 1.00 0.00 H new ATOM 384 N VAL A 27 -3.394 -8.759 7.104 1.00 0.00 N ATOM 385 CA VAL A 27 -3.438 -8.677 8.563 1.00 0.00 C ATOM 386 C VAL A 27 -2.300 -7.810 9.102 1.00 0.00 C ATOM 387 O VAL A 27 -2.507 -6.970 9.978 1.00 0.00 O ATOM 388 CB VAL A 27 -3.357 -10.076 9.211 1.00 0.00 C ATOM 389 CG1 VAL A 27 -3.336 -9.977 10.732 1.00 0.00 C ATOM 390 CG2 VAL A 27 -4.516 -10.947 8.753 1.00 0.00 C ATOM 0 H VAL A 27 -3.370 -9.711 6.739 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.393 -8.221 8.824 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.425 -10.540 8.889 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.279 -10.977 11.161 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.469 -9.397 11.047 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.246 -9.486 11.077 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.441 -11.929 9.221 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.458 -10.480 9.040 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.482 -11.058 7.669 1.00 0.00 H new ATOM 400 N TYR A 28 -1.102 -8.017 8.567 1.00 0.00 N ATOM 401 CA TYR A 28 0.068 -7.246 8.973 1.00 0.00 C ATOM 402 C TYR A 28 -0.140 -5.762 8.692 1.00 0.00 C ATOM 403 O TYR A 28 0.119 -4.918 9.551 1.00 0.00 O ATOM 404 CB TYR A 28 1.311 -7.756 8.240 1.00 0.00 C ATOM 405 CG TYR A 28 2.591 -7.045 8.616 1.00 0.00 C ATOM 406 CD1 TYR A 28 3.194 -7.267 9.847 1.00 0.00 C ATOM 407 CD2 TYR A 28 3.208 -6.167 7.733 1.00 0.00 C ATOM 408 CE1 TYR A 28 4.376 -6.638 10.187 1.00 0.00 C ATOM 409 CE2 TYR A 28 4.387 -5.531 8.068 1.00 0.00 C ATOM 410 CZ TYR A 28 4.966 -5.770 9.294 1.00 0.00 C ATOM 411 OH TYR A 28 6.149 -5.159 9.627 1.00 0.00 O ATOM 0 H TYR A 28 -0.915 -8.716 7.848 1.00 0.00 H new ATOM 0 HA TYR A 28 0.212 -7.373 10.046 1.00 0.00 H new ATOM 0 HB2 TYR A 28 1.427 -8.820 8.444 1.00 0.00 H new ATOM 0 HB3 TYR A 28 1.153 -7.652 7.166 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.731 -7.943 10.551 1.00 0.00 H new ATOM 0 HD2 TYR A 28 2.758 -5.979 6.769 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.835 -6.825 11.147 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.853 -4.849 7.372 1.00 0.00 H new ATOM 0 HH TYR A 28 6.411 -4.542 8.912 1.00 0.00 H new ATOM 421 N ILE A 29 -0.619 -5.455 7.492 1.00 0.00 N ATOM 422 CA ILE A 29 -0.901 -4.079 7.099 1.00 0.00 C ATOM 423 C ILE A 29 -1.958 -3.467 8.015 1.00 0.00 C ATOM 424 O ILE A 29 -1.826 -2.325 8.456 1.00 0.00 O ATOM 425 CB ILE A 29 -1.382 -4.007 5.632 1.00 0.00 C ATOM 426 CG1 ILE A 29 -0.314 -4.586 4.698 1.00 0.00 C ATOM 427 CG2 ILE A 29 -1.710 -2.571 5.243 1.00 0.00 C ATOM 428 CD1 ILE A 29 -0.775 -4.745 3.266 1.00 0.00 C ATOM 0 H ILE A 29 -0.821 -6.146 6.770 1.00 0.00 H new ATOM 0 HA ILE A 29 0.025 -3.512 7.190 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.291 -4.601 5.535 1.00 0.00 H new ATOM 0 HG12 ILE A 29 0.562 -3.938 4.718 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.000 -5.558 5.079 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.047 -2.543 4.207 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.499 -2.190 5.891 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.820 -1.952 5.352 1.00 0.00 H new ATOM 0 HD11 ILE A 29 0.035 -5.160 2.667 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.632 -5.417 3.232 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.061 -3.772 2.866 1.00 0.00 H new ATOM 440 N ILE A 30 -2.988 -4.251 8.310 1.00 0.00 N ATOM 441 CA ILE A 30 -4.056 -3.838 9.216 1.00 0.00 C ATOM 442 C ILE A 30 -3.495 -3.442 10.583 1.00 0.00 C ATOM 443 O ILE A 30 -3.852 -2.402 11.131 1.00 0.00 O ATOM 444 CB ILE A 30 -5.092 -4.975 9.387 1.00 0.00 C ATOM 445 CG1 ILE A 30 -5.819 -5.231 8.064 1.00 0.00 C ATOM 446 CG2 ILE A 30 -6.091 -4.645 10.490 1.00 0.00 C ATOM 447 CD1 ILE A 30 -6.592 -6.533 8.028 1.00 0.00 C ATOM 0 H ILE A 30 -3.108 -5.190 7.929 1.00 0.00 H new ATOM 0 HA ILE A 30 -4.547 -2.969 8.777 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.560 -5.881 9.677 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -6.506 -4.407 7.874 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -5.089 -5.231 7.254 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.807 -5.461 10.588 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -5.561 -4.512 11.433 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.620 -3.726 10.238 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.078 -6.641 7.058 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -5.908 -7.367 8.185 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -7.347 -6.530 8.814 1.00 0.00 H new ATOM 459 N ARG A 31 -2.588 -4.259 11.107 1.00 0.00 N ATOM 460 CA ARG A 31 -2.011 -4.020 12.428 1.00 0.00 C ATOM 461 C ARG A 31 -1.105 -2.794 12.412 1.00 0.00 C ATOM 462 O ARG A 31 -0.914 -2.130 13.431 1.00 0.00 O ATOM 463 CB ARG A 31 -1.212 -5.238 12.895 1.00 0.00 C ATOM 464 CG ARG A 31 -2.046 -6.495 13.062 1.00 0.00 C ATOM 465 CD ARG A 31 -1.194 -7.668 13.520 1.00 0.00 C ATOM 466 NE ARG A 31 -0.674 -7.473 14.874 1.00 0.00 N ATOM 467 CZ ARG A 31 0.118 -8.342 15.509 1.00 0.00 C ATOM 468 NH1 ARG A 31 0.486 -9.474 14.924 1.00 0.00 N ATOM 469 NH2 ARG A 31 0.547 -8.074 16.736 1.00 0.00 N ATOM 0 H ARG A 31 -2.235 -5.093 10.638 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.833 -3.843 13.122 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.416 -5.435 12.177 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -0.733 -5.003 13.845 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.839 -6.314 13.788 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.529 -6.741 12.117 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -1.788 -8.582 13.488 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.362 -7.804 12.828 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.933 -6.618 15.365 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.164 -9.688 13.980 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.091 -10.130 15.418 1.00 0.00 H new ATOM 0 HH21 ARG A 31 0.272 -7.205 17.194 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.152 -8.737 17.221 1.00 0.00 H new ATOM 483 N CYS A 32 -0.542 -2.506 11.250 1.00 0.00 N ATOM 484 CA CYS A 32 0.370 -1.383 11.097 1.00 0.00 C ATOM 485 C CYS A 32 -0.375 -0.096 10.743 1.00 0.00 C ATOM 486 O CYS A 32 0.235 0.970 10.630 1.00 0.00 O ATOM 487 CB CYS A 32 1.408 -1.705 10.027 1.00 0.00 C ATOM 488 SG CYS A 32 2.397 -3.174 10.387 1.00 0.00 S ATOM 0 H CYS A 32 -0.701 -3.037 10.394 1.00 0.00 H new ATOM 0 HA CYS A 32 0.870 -1.220 12.052 1.00 0.00 H new ATOM 0 HB2 CYS A 32 0.901 -1.845 9.073 1.00 0.00 H new ATOM 0 HB3 CYS A 32 2.074 -0.850 9.911 1.00 0.00 H new ATOM 0 HG CYS A 32 1.684 -4.240 10.173 1.00 0.00 H new ATOM 494 N SER A 33 -1.689 -0.190 10.571 1.00 0.00 N ATOM 495 CA SER A 33 -2.491 0.972 10.219 1.00 0.00 C ATOM 496 C SER A 33 -3.583 1.219 11.260 1.00 0.00 C ATOM 497 O SER A 33 -3.455 2.111 12.102 1.00 0.00 O ATOM 498 CB SER A 33 -3.098 0.796 8.824 1.00 0.00 C ATOM 499 OG SER A 33 -3.731 -0.466 8.689 1.00 0.00 O ATOM 0 H SER A 33 -2.218 -1.056 10.670 1.00 0.00 H new ATOM 0 HA SER A 33 -1.840 1.846 10.205 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.822 1.589 8.638 1.00 0.00 H new ATOM 0 HB3 SER A 33 -2.316 0.895 8.071 1.00 0.00 H new ATOM 0 HG SER A 33 -3.078 -1.128 8.380 1.00 0.00 H new ATOM 505 N GLY A 34 -4.641 0.421 11.209 1.00 0.00 N ATOM 506 CA GLY A 34 -5.732 0.562 12.155 1.00 0.00 C ATOM 507 C GLY A 34 -6.919 1.296 11.563 1.00 0.00 C ATOM 508 O GLY A 34 -6.785 1.978 10.546 1.00 0.00 O ATOM 0 H GLY A 34 -4.764 -0.326 10.525 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -6.049 -0.426 12.490 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.379 1.099 13.036 1.00 0.00 H new ATOM 512 N PRO A 35 -8.104 1.174 12.175 1.00 0.00 N ATOM 513 CA PRO A 35 -9.312 1.851 11.706 1.00 0.00 C ATOM 514 C PRO A 35 -9.290 3.344 12.023 1.00 0.00 C ATOM 515 O PRO A 35 -8.738 3.766 13.042 1.00 0.00 O ATOM 516 CB PRO A 35 -10.450 1.161 12.477 1.00 0.00 C ATOM 517 CG PRO A 35 -9.823 0.020 13.211 1.00 0.00 C ATOM 518 CD PRO A 35 -8.371 0.366 13.368 1.00 0.00 C ATOM 0 HA PRO A 35 -9.418 1.781 10.623 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -10.927 1.854 13.169 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.224 0.808 11.796 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -10.296 -0.124 14.183 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -9.943 -0.911 12.657 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -8.184 0.924 14.286 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -7.744 -0.525 13.403 1.00 0.00 H new ATOM 526 N GLY A 36 -9.877 4.142 11.142 1.00 0.00 N ATOM 527 CA GLY A 36 -9.963 5.571 11.374 1.00 0.00 C ATOM 528 C GLY A 36 -8.883 6.355 10.655 1.00 0.00 C ATOM 529 O GLY A 36 -8.993 7.575 10.512 1.00 0.00 O ATOM 0 H GLY A 36 -10.297 3.825 10.268 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -10.940 5.928 11.049 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.893 5.764 12.444 1.00 0.00 H new ATOM 533 N THR A 37 -7.842 5.669 10.198 1.00 0.00 N ATOM 534 CA THR A 37 -6.743 6.333 9.511 1.00 0.00 C ATOM 535 C THR A 37 -6.852 6.126 7.997 1.00 0.00 C ATOM 536 O THR A 37 -7.852 5.604 7.506 1.00 0.00 O ATOM 537 CB THR A 37 -5.368 5.837 10.026 1.00 0.00 C ATOM 538 OG1 THR A 37 -4.317 6.669 9.513 1.00 0.00 O ATOM 539 CG2 THR A 37 -5.109 4.391 9.623 1.00 0.00 C ATOM 0 H THR A 37 -7.737 4.659 10.290 1.00 0.00 H new ATOM 0 HA THR A 37 -6.815 7.399 9.727 1.00 0.00 H new ATOM 0 HB THR A 37 -5.385 5.893 11.114 1.00 0.00 H new ATOM 0 HG1 THR A 37 -3.736 6.953 10.249 1.00 0.00 H new ATOM 0 HG21 THR A 37 -4.136 4.077 10.001 1.00 0.00 H new ATOM 0 HG22 THR A 37 -5.885 3.752 10.043 1.00 0.00 H new ATOM 0 HG23 THR A 37 -5.120 4.309 8.536 1.00 0.00 H new ATOM 547 N ARG A 38 -5.828 6.542 7.267 1.00 0.00 N ATOM 548 CA ARG A 38 -5.825 6.460 5.814 1.00 0.00 C ATOM 549 C ARG A 38 -4.743 5.507 5.324 1.00 0.00 C ATOM 550 O ARG A 38 -3.615 5.534 5.814 1.00 0.00 O ATOM 551 CB ARG A 38 -5.593 7.848 5.216 1.00 0.00 C ATOM 552 CG ARG A 38 -6.742 8.818 5.445 1.00 0.00 C ATOM 553 CD ARG A 38 -6.356 10.238 5.065 1.00 0.00 C ATOM 554 NE ARG A 38 -5.873 10.331 3.689 1.00 0.00 N ATOM 555 CZ ARG A 38 -5.550 11.480 3.092 1.00 0.00 C ATOM 556 NH1 ARG A 38 -5.685 12.633 3.736 1.00 0.00 N ATOM 557 NH2 ARG A 38 -5.086 11.483 1.851 1.00 0.00 N ATOM 0 H ARG A 38 -4.979 6.945 7.663 1.00 0.00 H new ATOM 0 HA ARG A 38 -6.794 6.079 5.492 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -4.684 8.270 5.644 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.424 7.747 4.144 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -7.606 8.505 4.859 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -7.041 8.789 6.493 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -7.218 10.893 5.190 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -5.583 10.596 5.744 1.00 0.00 H new ATOM 0 HE ARG A 38 -5.777 9.468 3.154 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -6.037 12.644 4.693 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -5.436 13.508 3.274 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -4.974 10.604 1.346 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -4.841 12.365 1.400 1.00 0.00 H new ATOM 571 N VAL A 39 -5.094 4.665 4.365 1.00 0.00 N ATOM 572 CA VAL A 39 -4.134 3.766 3.740 1.00 0.00 C ATOM 573 C VAL A 39 -4.271 3.856 2.229 1.00 0.00 C ATOM 574 O VAL A 39 -5.380 3.940 1.706 1.00 0.00 O ATOM 575 CB VAL A 39 -4.332 2.294 4.174 1.00 0.00 C ATOM 576 CG1 VAL A 39 -3.291 1.389 3.529 1.00 0.00 C ATOM 577 CG2 VAL A 39 -4.276 2.156 5.683 1.00 0.00 C ATOM 0 H VAL A 39 -6.043 4.585 4.000 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.140 4.077 4.062 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.320 1.984 3.835 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.453 0.360 3.851 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.380 1.448 2.444 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.294 1.710 3.829 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.418 1.111 5.958 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.306 2.497 6.044 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.064 2.760 6.133 1.00 0.00 H new ATOM 587 N VAL A 40 -3.148 3.862 1.537 1.00 0.00 N ATOM 588 CA VAL A 40 -3.151 3.907 0.084 1.00 0.00 C ATOM 589 C VAL A 40 -2.310 2.770 -0.466 1.00 0.00 C ATOM 590 O VAL A 40 -1.254 2.453 0.086 1.00 0.00 O ATOM 591 CB VAL A 40 -2.583 5.241 -0.451 1.00 0.00 C ATOM 592 CG1 VAL A 40 -2.762 5.331 -1.960 1.00 0.00 C ATOM 593 CG2 VAL A 40 -3.231 6.431 0.245 1.00 0.00 C ATOM 0 H VAL A 40 -2.219 3.836 1.957 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.187 3.814 -0.242 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.516 5.268 -0.230 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.356 6.277 -2.319 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.235 4.505 -2.439 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -3.823 5.275 -2.205 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.812 7.356 -0.151 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -4.306 6.414 0.068 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.038 6.375 1.316 1.00 0.00 H new ATOM 603 N GLU A 41 -2.775 2.133 -1.525 1.00 0.00 N ATOM 604 CA GLU A 41 -1.946 1.165 -2.213 1.00 0.00 C ATOM 605 C GLU A 41 -1.659 1.640 -3.627 1.00 0.00 C ATOM 606 O GLU A 41 -2.384 2.469 -4.174 1.00 0.00 O ATOM 607 CB GLU A 41 -2.571 -0.240 -2.217 1.00 0.00 C ATOM 608 CG GLU A 41 -3.481 -0.552 -3.399 1.00 0.00 C ATOM 609 CD GLU A 41 -4.716 0.311 -3.436 1.00 0.00 C ATOM 610 OE1 GLU A 41 -5.449 0.339 -2.425 1.00 0.00 O ATOM 611 OE2 GLU A 41 -4.949 0.960 -4.474 1.00 0.00 O ATOM 0 H GLU A 41 -3.706 2.266 -1.921 1.00 0.00 H new ATOM 0 HA GLU A 41 -1.006 1.085 -1.667 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.767 -0.976 -2.196 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.143 -0.366 -1.298 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -2.923 -0.418 -4.325 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.778 -1.600 -3.355 1.00 0.00 H new ATOM 618 N VAL A 42 -0.573 1.149 -4.186 1.00 0.00 N ATOM 619 CA VAL A 42 -0.214 1.452 -5.558 1.00 0.00 C ATOM 620 C VAL A 42 -0.366 0.205 -6.418 1.00 0.00 C ATOM 621 O VAL A 42 0.459 -0.710 -6.352 1.00 0.00 O ATOM 622 CB VAL A 42 1.233 1.980 -5.663 1.00 0.00 C ATOM 623 CG1 VAL A 42 1.583 2.328 -7.103 1.00 0.00 C ATOM 624 CG2 VAL A 42 1.429 3.184 -4.754 1.00 0.00 C ATOM 0 H VAL A 42 0.083 0.532 -3.707 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.886 2.233 -5.915 1.00 0.00 H new ATOM 0 HB VAL A 42 1.908 1.189 -5.336 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.607 2.697 -7.149 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.490 1.438 -7.725 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.903 3.098 -7.467 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.455 3.543 -4.841 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.741 3.977 -5.047 1.00 0.00 H new ATOM 0 HG23 VAL A 42 1.232 2.896 -3.721 1.00 0.00 H new ATOM 634 N GLY A 43 -1.440 0.152 -7.191 1.00 0.00 N ATOM 635 CA GLY A 43 -1.656 -0.982 -8.065 1.00 0.00 C ATOM 636 C GLY A 43 -2.885 -1.783 -7.690 1.00 0.00 C ATOM 637 O GLY A 43 -2.803 -2.990 -7.457 1.00 0.00 O ATOM 0 H GLY A 43 -2.163 0.870 -7.229 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.756 -0.630 -9.092 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.781 -1.631 -8.034 1.00 0.00 H new ATOM 641 N ALA A 44 -4.028 -1.116 -7.636 1.00 0.00 N ATOM 642 CA ALA A 44 -5.286 -1.779 -7.329 1.00 0.00 C ATOM 643 C ALA A 44 -5.841 -2.464 -8.568 1.00 0.00 C ATOM 644 O ALA A 44 -6.748 -1.956 -9.226 1.00 0.00 O ATOM 645 CB ALA A 44 -6.298 -0.793 -6.768 1.00 0.00 C ATOM 0 H ALA A 44 -4.110 -0.113 -7.801 1.00 0.00 H new ATOM 0 HA ALA A 44 -5.094 -2.536 -6.569 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -7.230 -1.314 -6.547 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.905 -0.349 -5.854 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -6.486 -0.008 -7.501 1.00 0.00 H new ATOM 651 N GLY A 45 -5.261 -3.604 -8.897 1.00 0.00 N ATOM 652 CA GLY A 45 -5.692 -4.347 -10.061 1.00 0.00 C ATOM 653 C GLY A 45 -6.903 -5.216 -9.789 1.00 0.00 C ATOM 654 O GLY A 45 -7.677 -4.954 -8.873 1.00 0.00 O ATOM 0 H GLY A 45 -4.495 -4.031 -8.376 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -5.925 -3.650 -10.866 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -4.872 -4.974 -10.410 1.00 0.00 H new ATOM 658 N ARG A 46 -7.048 -6.270 -10.576 1.00 0.00 N ATOM 659 CA ARG A 46 -8.193 -7.171 -10.473 1.00 0.00 C ATOM 660 C ARG A 46 -8.115 -7.994 -9.185 1.00 0.00 C ATOM 661 O ARG A 46 -9.096 -8.594 -8.751 1.00 0.00 O ATOM 662 CB ARG A 46 -8.214 -8.094 -11.693 1.00 0.00 C ATOM 663 CG ARG A 46 -9.562 -8.735 -11.982 1.00 0.00 C ATOM 664 CD ARG A 46 -9.467 -9.648 -13.190 1.00 0.00 C ATOM 665 NE ARG A 46 -10.776 -10.013 -13.723 1.00 0.00 N ATOM 666 CZ ARG A 46 -10.946 -10.840 -14.752 1.00 0.00 C ATOM 667 NH1 ARG A 46 -9.909 -11.493 -15.266 1.00 0.00 N ATOM 668 NH2 ARG A 46 -12.159 -11.037 -15.243 1.00 0.00 N ATOM 0 H ARG A 46 -6.380 -6.528 -11.303 1.00 0.00 H new ATOM 0 HA ARG A 46 -9.111 -6.585 -10.444 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -7.903 -7.524 -12.568 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -7.476 -8.883 -11.548 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -9.895 -9.304 -11.114 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -10.309 -7.961 -12.161 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.887 -9.154 -13.969 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -8.926 -10.553 -12.915 1.00 0.00 H new ATOM 0 HE ARG A 46 -11.605 -9.613 -13.283 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -8.977 -11.362 -14.872 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -10.045 -12.126 -16.055 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -12.959 -10.556 -14.833 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -12.293 -11.670 -16.031 1.00 0.00 H new ATOM 682 N PHE A 47 -6.940 -7.998 -8.574 1.00 0.00 N ATOM 683 CA PHE A 47 -6.698 -8.755 -7.354 1.00 0.00 C ATOM 684 C PHE A 47 -7.032 -7.925 -6.112 1.00 0.00 C ATOM 685 O PHE A 47 -6.194 -7.721 -5.235 1.00 0.00 O ATOM 686 CB PHE A 47 -5.238 -9.225 -7.319 1.00 0.00 C ATOM 687 CG PHE A 47 -4.252 -8.193 -7.805 1.00 0.00 C ATOM 688 CD1 PHE A 47 -3.730 -7.246 -6.939 1.00 0.00 C ATOM 689 CD2 PHE A 47 -3.846 -8.177 -9.130 1.00 0.00 C ATOM 690 CE1 PHE A 47 -2.827 -6.303 -7.385 1.00 0.00 C ATOM 691 CE2 PHE A 47 -2.942 -7.235 -9.582 1.00 0.00 C ATOM 692 CZ PHE A 47 -2.430 -6.298 -8.706 1.00 0.00 C ATOM 0 H PHE A 47 -6.129 -7.478 -8.908 1.00 0.00 H new ATOM 0 HA PHE A 47 -7.352 -9.627 -7.350 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -4.981 -9.506 -6.298 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.141 -10.122 -7.930 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -4.033 -7.246 -5.903 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -4.241 -8.910 -9.818 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -2.431 -5.568 -6.700 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -2.636 -7.231 -10.618 1.00 0.00 H new ATOM 0 HZ PHE A 47 -1.720 -5.563 -9.055 1.00 0.00 H new ATOM 702 N LEU A 48 -8.280 -7.481 -6.027 1.00 0.00 N ATOM 703 CA LEU A 48 -8.729 -6.618 -4.931 1.00 0.00 C ATOM 704 C LEU A 48 -8.989 -7.407 -3.644 1.00 0.00 C ATOM 705 O LEU A 48 -9.881 -7.067 -2.869 1.00 0.00 O ATOM 706 CB LEU A 48 -10.003 -5.870 -5.341 1.00 0.00 C ATOM 707 CG LEU A 48 -9.833 -4.862 -6.479 1.00 0.00 C ATOM 708 CD1 LEU A 48 -11.177 -4.260 -6.866 1.00 0.00 C ATOM 709 CD2 LEU A 48 -8.858 -3.766 -6.075 1.00 0.00 C ATOM 0 H LEU A 48 -9.007 -7.704 -6.707 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.928 -5.907 -4.729 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -10.755 -6.602 -5.636 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -10.393 -5.346 -4.469 1.00 0.00 H new ATOM 0 HG LEU A 48 -9.428 -5.386 -7.345 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -11.036 -3.545 -7.677 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -11.850 -5.052 -7.194 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -11.609 -3.751 -6.005 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.748 -3.057 -6.895 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -9.238 -3.247 -5.195 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -7.889 -4.208 -5.845 1.00 0.00 H new ATOM 721 N TYR A 49 -8.189 -8.438 -3.405 1.00 0.00 N ATOM 722 CA TYR A 49 -8.346 -9.271 -2.219 1.00 0.00 C ATOM 723 C TYR A 49 -7.906 -8.525 -0.966 1.00 0.00 C ATOM 724 O TYR A 49 -8.663 -8.416 -0.005 1.00 0.00 O ATOM 725 CB TYR A 49 -7.538 -10.564 -2.362 1.00 0.00 C ATOM 726 CG TYR A 49 -7.539 -11.428 -1.116 1.00 0.00 C ATOM 727 CD1 TYR A 49 -8.652 -12.183 -0.770 1.00 0.00 C ATOM 728 CD2 TYR A 49 -6.420 -11.492 -0.291 1.00 0.00 C ATOM 729 CE1 TYR A 49 -8.655 -12.971 0.365 1.00 0.00 C ATOM 730 CE2 TYR A 49 -6.416 -12.277 0.845 1.00 0.00 C ATOM 731 CZ TYR A 49 -7.533 -13.015 1.168 1.00 0.00 C ATOM 732 OH TYR A 49 -7.531 -13.803 2.299 1.00 0.00 O ATOM 0 H TYR A 49 -7.423 -8.718 -4.018 1.00 0.00 H new ATOM 0 HA TYR A 49 -9.403 -9.519 -2.123 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -7.940 -11.142 -3.194 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -6.509 -10.312 -2.617 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -9.530 -12.154 -1.398 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -5.540 -10.918 -0.543 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -9.530 -13.549 0.622 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -5.541 -12.312 1.477 1.00 0.00 H new ATOM 0 HH TYR A 49 -7.060 -14.642 2.112 1.00 0.00 H new ATOM 742 N VAL A 50 -6.682 -8.010 -0.994 1.00 0.00 N ATOM 743 CA VAL A 50 -6.098 -7.337 0.160 1.00 0.00 C ATOM 744 C VAL A 50 -6.963 -6.163 0.608 1.00 0.00 C ATOM 745 O VAL A 50 -7.327 -6.061 1.778 1.00 0.00 O ATOM 746 CB VAL A 50 -4.667 -6.838 -0.149 1.00 0.00 C ATOM 747 CG1 VAL A 50 -4.043 -6.178 1.072 1.00 0.00 C ATOM 748 CG2 VAL A 50 -3.798 -7.986 -0.640 1.00 0.00 C ATOM 0 H VAL A 50 -6.071 -8.046 -1.810 1.00 0.00 H new ATOM 0 HA VAL A 50 -6.049 -8.067 0.968 1.00 0.00 H new ATOM 0 HB VAL A 50 -4.732 -6.090 -0.939 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.037 -5.836 0.827 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.651 -5.326 1.376 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.993 -6.898 1.889 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.795 -7.617 -0.853 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.746 -8.757 0.128 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.230 -8.407 -1.548 1.00 0.00 H new ATOM 758 N SER A 51 -7.314 -5.302 -0.336 1.00 0.00 N ATOM 759 CA SER A 51 -8.116 -4.125 -0.042 1.00 0.00 C ATOM 760 C SER A 51 -9.474 -4.502 0.549 1.00 0.00 C ATOM 761 O SER A 51 -9.936 -3.881 1.509 1.00 0.00 O ATOM 762 CB SER A 51 -8.292 -3.302 -1.315 1.00 0.00 C ATOM 763 OG SER A 51 -8.463 -4.141 -2.445 1.00 0.00 O ATOM 0 H SER A 51 -7.054 -5.398 -1.318 1.00 0.00 H new ATOM 0 HA SER A 51 -7.594 -3.529 0.707 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.156 -2.646 -1.211 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.422 -2.662 -1.461 1.00 0.00 H new ATOM 0 HG SER A 51 -8.258 -3.637 -3.260 1.00 0.00 H new ATOM 769 N ASP A 52 -10.099 -5.528 -0.016 1.00 0.00 N ATOM 770 CA ASP A 52 -11.403 -5.974 0.457 1.00 0.00 C ATOM 771 C ASP A 52 -11.292 -6.573 1.849 1.00 0.00 C ATOM 772 O ASP A 52 -12.106 -6.286 2.722 1.00 0.00 O ATOM 773 CB ASP A 52 -12.014 -7.001 -0.501 1.00 0.00 C ATOM 774 CG ASP A 52 -13.424 -7.397 -0.103 1.00 0.00 C ATOM 775 OD1 ASP A 52 -14.361 -6.619 -0.380 1.00 0.00 O ATOM 776 OD2 ASP A 52 -13.604 -8.487 0.485 1.00 0.00 O ATOM 0 H ASP A 52 -9.726 -6.065 -0.799 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.057 -5.103 0.496 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -12.026 -6.590 -1.510 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -11.384 -7.890 -0.527 1.00 0.00 H new ATOM 781 N TYR A 53 -10.264 -7.384 2.059 1.00 0.00 N ATOM 782 CA TYR A 53 -10.061 -8.051 3.339 1.00 0.00 C ATOM 783 C TYR A 53 -9.825 -7.034 4.452 1.00 0.00 C ATOM 784 O TYR A 53 -10.402 -7.141 5.534 1.00 0.00 O ATOM 785 CB TYR A 53 -8.882 -9.024 3.245 1.00 0.00 C ATOM 786 CG TYR A 53 -8.730 -9.913 4.457 1.00 0.00 C ATOM 787 CD1 TYR A 53 -9.574 -10.997 4.648 1.00 0.00 C ATOM 788 CD2 TYR A 53 -7.746 -9.669 5.406 1.00 0.00 C ATOM 789 CE1 TYR A 53 -9.445 -11.815 5.751 1.00 0.00 C ATOM 790 CE2 TYR A 53 -7.608 -10.482 6.514 1.00 0.00 C ATOM 791 CZ TYR A 53 -8.462 -11.555 6.683 1.00 0.00 C ATOM 792 OH TYR A 53 -8.330 -12.377 7.780 1.00 0.00 O ATOM 0 H TYR A 53 -9.555 -7.597 1.357 1.00 0.00 H new ATOM 0 HA TYR A 53 -10.963 -8.613 3.581 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -9.008 -9.649 2.361 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -7.963 -8.455 3.105 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -10.345 -11.204 3.921 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -7.078 -8.830 5.276 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -10.111 -12.655 5.884 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -6.838 -10.280 7.244 1.00 0.00 H new ATOM 0 HH TYR A 53 -7.591 -12.059 8.340 1.00 0.00 H new ATOM 802 N ILE A 54 -8.988 -6.041 4.177 1.00 0.00 N ATOM 803 CA ILE A 54 -8.690 -5.002 5.155 1.00 0.00 C ATOM 804 C ILE A 54 -9.954 -4.232 5.533 1.00 0.00 C ATOM 805 O ILE A 54 -10.231 -4.022 6.715 1.00 0.00 O ATOM 806 CB ILE A 54 -7.621 -4.015 4.630 1.00 0.00 C ATOM 807 CG1 ILE A 54 -6.307 -4.751 4.356 1.00 0.00 C ATOM 808 CG2 ILE A 54 -7.394 -2.889 5.629 1.00 0.00 C ATOM 809 CD1 ILE A 54 -5.239 -3.878 3.734 1.00 0.00 C ATOM 0 H ILE A 54 -8.504 -5.933 3.286 1.00 0.00 H new ATOM 0 HA ILE A 54 -8.295 -5.500 6.040 1.00 0.00 H new ATOM 0 HB ILE A 54 -7.982 -3.582 3.697 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -5.929 -5.161 5.292 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.505 -5.595 3.695 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.639 -2.205 5.241 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -8.327 -2.348 5.785 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -7.053 -3.306 6.577 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -4.337 -4.468 3.569 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.597 -3.488 2.781 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.012 -3.048 4.403 1.00 0.00 H new ATOM 821 N ARG A 55 -10.736 -3.850 4.528 1.00 0.00 N ATOM 822 CA ARG A 55 -11.939 -3.051 4.758 1.00 0.00 C ATOM 823 C ARG A 55 -13.052 -3.889 5.393 1.00 0.00 C ATOM 824 O ARG A 55 -14.025 -3.343 5.914 1.00 0.00 O ATOM 825 CB ARG A 55 -12.430 -2.402 3.457 1.00 0.00 C ATOM 826 CG ARG A 55 -13.030 -3.377 2.456 1.00 0.00 C ATOM 827 CD ARG A 55 -13.394 -2.690 1.148 1.00 0.00 C ATOM 828 NE ARG A 55 -14.330 -1.582 1.340 1.00 0.00 N ATOM 829 CZ ARG A 55 -15.466 -1.433 0.659 1.00 0.00 C ATOM 830 NH1 ARG A 55 -15.811 -2.314 -0.276 1.00 0.00 N ATOM 831 NH2 ARG A 55 -16.250 -0.389 0.901 1.00 0.00 N ATOM 0 H ARG A 55 -10.561 -4.079 3.550 1.00 0.00 H new ATOM 0 HA ARG A 55 -11.674 -2.257 5.456 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.176 -1.646 3.702 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -11.595 -1.884 2.986 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.319 -4.180 2.260 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -13.920 -3.837 2.885 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -12.487 -2.317 0.672 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -13.834 -3.420 0.468 1.00 0.00 H new ATOM 0 HE ARG A 55 -14.098 -0.878 2.041 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -15.205 -3.110 -0.476 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -16.682 -2.194 -0.793 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -15.982 0.297 1.607 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -17.120 -0.273 0.381 1.00 0.00 H new ATOM 845 N LYS A 56 -12.918 -5.210 5.327 1.00 0.00 N ATOM 846 CA LYS A 56 -13.860 -6.107 5.990 1.00 0.00 C ATOM 847 C LYS A 56 -13.650 -6.080 7.500 1.00 0.00 C ATOM 848 O LYS A 56 -14.605 -6.193 8.274 1.00 0.00 O ATOM 849 CB LYS A 56 -13.705 -7.546 5.484 1.00 0.00 C ATOM 850 CG LYS A 56 -14.329 -7.815 4.121 1.00 0.00 C ATOM 851 CD LYS A 56 -15.823 -7.529 4.123 1.00 0.00 C ATOM 852 CE LYS A 56 -16.530 -8.234 2.976 1.00 0.00 C ATOM 853 NZ LYS A 56 -16.002 -7.824 1.650 1.00 0.00 N ATOM 0 H LYS A 56 -12.168 -5.683 4.822 1.00 0.00 H new ATOM 0 HA LYS A 56 -14.866 -5.758 5.755 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -12.643 -7.787 5.435 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -14.152 -8.222 6.212 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -13.841 -7.196 3.368 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -14.157 -8.854 3.840 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -16.254 -7.852 5.070 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.988 -6.454 4.047 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -16.418 -9.312 3.091 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -17.597 -8.017 3.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -16.702 -8.047 0.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -15.815 -6.801 1.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -15.119 -8.337 1.454 1.00 0.00 H new ATOM 867 N HIS A 57 -12.397 -5.931 7.912 1.00 0.00 N ATOM 868 CA HIS A 57 -12.046 -5.952 9.329 1.00 0.00 C ATOM 869 C HIS A 57 -12.017 -4.548 9.914 1.00 0.00 C ATOM 870 O HIS A 57 -12.771 -4.236 10.835 1.00 0.00 O ATOM 871 CB HIS A 57 -10.685 -6.629 9.542 1.00 0.00 C ATOM 872 CG HIS A 57 -10.692 -8.103 9.273 1.00 0.00 C ATOM 873 ND1 HIS A 57 -10.462 -9.018 10.273 1.00 0.00 N ATOM 874 CD2 HIS A 57 -10.896 -8.764 8.108 1.00 0.00 C ATOM 875 CE1 HIS A 57 -10.533 -10.207 9.698 1.00 0.00 C ATOM 876 NE2 HIS A 57 -10.794 -10.102 8.388 1.00 0.00 N ATOM 0 H HIS A 57 -11.605 -5.794 7.285 1.00 0.00 H new ATOM 0 HA HIS A 57 -12.815 -6.526 9.846 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -9.949 -6.155 8.893 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -10.362 -6.458 10.569 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -11.100 -8.322 7.144 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -10.398 -11.144 10.218 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -10.897 -10.871 7.726 1.00 0.00 H new ATOM 884 N SER A 58 -11.157 -3.701 9.375 1.00 0.00 N ATOM 885 CA SER A 58 -10.963 -2.371 9.921 1.00 0.00 C ATOM 886 C SER A 58 -11.584 -1.304 9.036 1.00 0.00 C ATOM 887 O SER A 58 -11.413 -1.307 7.816 1.00 0.00 O ATOM 888 CB SER A 58 -9.474 -2.099 10.111 1.00 0.00 C ATOM 889 OG SER A 58 -8.897 -3.039 11.001 1.00 0.00 O ATOM 0 H SER A 58 -10.582 -3.912 8.559 1.00 0.00 H new ATOM 0 HA SER A 58 -11.465 -2.329 10.888 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.966 -2.145 9.148 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.331 -1.090 10.499 1.00 0.00 H new ATOM 0 HG SER A 58 -8.147 -2.623 11.476 1.00 0.00 H new ATOM 895 N LYS A 59 -12.317 -0.393 9.667 1.00 0.00 N ATOM 896 CA LYS A 59 -12.874 0.756 8.977 1.00 0.00 C ATOM 897 C LYS A 59 -11.765 1.777 8.742 1.00 0.00 C ATOM 898 O LYS A 59 -11.733 2.849 9.345 1.00 0.00 O ATOM 899 CB LYS A 59 -14.020 1.366 9.795 1.00 0.00 C ATOM 900 CG LYS A 59 -15.098 2.057 8.961 1.00 0.00 C ATOM 901 CD LYS A 59 -14.643 3.399 8.398 1.00 0.00 C ATOM 902 CE LYS A 59 -14.356 4.417 9.497 1.00 0.00 C ATOM 903 NZ LYS A 59 -15.527 4.632 10.384 1.00 0.00 N ATOM 0 H LYS A 59 -12.538 -0.432 10.662 1.00 0.00 H new ATOM 0 HA LYS A 59 -13.283 0.446 8.015 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -14.486 0.578 10.387 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -13.604 2.088 10.497 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -15.389 1.403 8.139 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -15.985 2.209 9.576 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -13.746 3.253 7.797 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -15.412 3.792 7.733 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -13.509 4.076 10.093 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -14.067 5.365 9.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -15.369 5.477 10.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -16.381 4.767 9.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -15.653 3.803 10.999 1.00 0.00 H new ATOM 917 N VAL A 60 -10.814 1.392 7.922 1.00 0.00 N ATOM 918 CA VAL A 60 -9.734 2.276 7.531 1.00 0.00 C ATOM 919 C VAL A 60 -10.050 2.919 6.181 1.00 0.00 C ATOM 920 O VAL A 60 -10.733 2.320 5.346 1.00 0.00 O ATOM 921 CB VAL A 60 -8.392 1.511 7.464 1.00 0.00 C ATOM 922 CG1 VAL A 60 -8.428 0.436 6.391 1.00 0.00 C ATOM 923 CG2 VAL A 60 -7.233 2.462 7.232 1.00 0.00 C ATOM 0 H VAL A 60 -10.765 0.461 7.507 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.638 3.059 8.283 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.241 1.022 8.427 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -7.471 -0.086 6.366 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.223 -0.275 6.615 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.615 0.896 5.421 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.302 1.897 7.189 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.380 2.992 6.291 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -7.184 3.182 8.049 1.00 0.00 H new ATOM 933 N ASP A 61 -9.590 4.147 5.979 1.00 0.00 N ATOM 934 CA ASP A 61 -9.815 4.839 4.718 1.00 0.00 C ATOM 935 C ASP A 61 -8.798 4.370 3.689 1.00 0.00 C ATOM 936 O ASP A 61 -7.702 4.916 3.585 1.00 0.00 O ATOM 937 CB ASP A 61 -9.723 6.358 4.893 1.00 0.00 C ATOM 938 CG ASP A 61 -10.271 7.113 3.698 1.00 0.00 C ATOM 939 OD1 ASP A 61 -9.510 7.375 2.745 1.00 0.00 O ATOM 940 OD2 ASP A 61 -11.475 7.452 3.709 1.00 0.00 O ATOM 0 H ASP A 61 -9.062 4.681 6.669 1.00 0.00 H new ATOM 0 HA ASP A 61 -10.821 4.602 4.372 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -10.272 6.652 5.788 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.682 6.640 5.051 1.00 0.00 H new ATOM 945 N LEU A 62 -9.160 3.324 2.968 1.00 0.00 N ATOM 946 CA LEU A 62 -8.286 2.726 1.969 1.00 0.00 C ATOM 947 C LEU A 62 -8.597 3.329 0.602 1.00 0.00 C ATOM 948 O LEU A 62 -9.764 3.439 0.223 1.00 0.00 O ATOM 949 CB LEU A 62 -8.489 1.198 1.980 1.00 0.00 C ATOM 950 CG LEU A 62 -7.528 0.353 1.128 1.00 0.00 C ATOM 951 CD1 LEU A 62 -7.934 0.365 -0.337 1.00 0.00 C ATOM 952 CD2 LEU A 62 -6.097 0.838 1.289 1.00 0.00 C ATOM 0 H LEU A 62 -10.066 2.864 3.057 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.240 2.933 2.195 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -8.415 0.855 3.012 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.506 0.990 1.647 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.586 -0.676 1.484 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.235 -0.241 -0.913 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -8.939 -0.044 -0.439 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -7.919 1.389 -0.710 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.434 0.226 0.677 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.027 1.878 0.970 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.801 0.759 2.335 1.00 0.00 H new ATOM 964 N VAL A 63 -7.565 3.746 -0.119 1.00 0.00 N ATOM 965 CA VAL A 63 -7.751 4.385 -1.417 1.00 0.00 C ATOM 966 C VAL A 63 -7.153 3.534 -2.531 1.00 0.00 C ATOM 967 O VAL A 63 -5.946 3.306 -2.561 1.00 0.00 O ATOM 968 CB VAL A 63 -7.105 5.786 -1.457 1.00 0.00 C ATOM 969 CG1 VAL A 63 -7.405 6.469 -2.782 1.00 0.00 C ATOM 970 CG2 VAL A 63 -7.580 6.639 -0.289 1.00 0.00 C ATOM 0 H VAL A 63 -6.592 3.654 0.171 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.826 4.486 -1.569 1.00 0.00 H new ATOM 0 HB VAL A 63 -6.025 5.668 -1.366 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -6.943 7.456 -2.795 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -7.004 5.870 -3.599 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -8.483 6.572 -2.902 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -7.110 7.621 -0.341 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -8.663 6.752 -0.338 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -7.308 6.155 0.649 1.00 0.00 H new ATOM 980 N LEU A 64 -8.008 3.090 -3.448 1.00 0.00 N ATOM 981 CA LEU A 64 -7.579 2.239 -4.554 1.00 0.00 C ATOM 982 C LEU A 64 -7.098 3.077 -5.729 1.00 0.00 C ATOM 983 O LEU A 64 -7.801 3.980 -6.190 1.00 0.00 O ATOM 984 CB LEU A 64 -8.727 1.338 -5.016 1.00 0.00 C ATOM 985 CG LEU A 64 -9.246 0.346 -3.972 1.00 0.00 C ATOM 986 CD1 LEU A 64 -10.518 -0.326 -4.458 1.00 0.00 C ATOM 987 CD2 LEU A 64 -8.189 -0.702 -3.666 1.00 0.00 C ATOM 0 H LEU A 64 -9.005 3.306 -3.447 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.755 1.622 -4.196 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -9.556 1.970 -5.335 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -8.397 0.778 -5.891 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.470 0.898 -3.059 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.871 -1.027 -3.702 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.283 0.429 -4.637 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -10.315 -0.863 -5.384 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.573 -1.400 -2.922 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -7.940 -1.245 -4.578 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -7.295 -0.214 -3.278 1.00 0.00 H new ATOM 999 N THR A 65 -5.905 2.773 -6.208 1.00 0.00 N ATOM 1000 CA THR A 65 -5.346 3.457 -7.363 1.00 0.00 C ATOM 1001 C THR A 65 -5.149 2.487 -8.528 1.00 0.00 C ATOM 1002 O THR A 65 -4.470 1.464 -8.398 1.00 0.00 O ATOM 1003 CB THR A 65 -3.998 4.130 -7.037 1.00 0.00 C ATOM 1004 OG1 THR A 65 -3.047 3.147 -6.598 1.00 0.00 O ATOM 1005 CG2 THR A 65 -4.161 5.202 -5.968 1.00 0.00 C ATOM 0 H THR A 65 -5.301 2.053 -5.813 1.00 0.00 H new ATOM 0 HA THR A 65 -6.061 4.230 -7.645 1.00 0.00 H new ATOM 0 HB THR A 65 -3.633 4.606 -7.947 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.158 2.991 -5.637 1.00 0.00 H new ATOM 0 HG21 THR A 65 -3.193 5.658 -5.760 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.854 5.966 -6.321 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.553 4.750 -5.057 1.00 0.00 H new ATOM 1013 N ASP A 66 -5.748 2.806 -9.663 1.00 0.00 N ATOM 1014 CA ASP A 66 -5.643 1.965 -10.848 1.00 0.00 C ATOM 1015 C ASP A 66 -5.714 2.816 -12.099 1.00 0.00 C ATOM 1016 O ASP A 66 -6.533 3.732 -12.191 1.00 0.00 O ATOM 1017 CB ASP A 66 -6.760 0.915 -10.858 1.00 0.00 C ATOM 1018 CG ASP A 66 -6.785 0.053 -12.110 1.00 0.00 C ATOM 1019 OD1 ASP A 66 -5.716 -0.451 -12.524 1.00 0.00 O ATOM 1020 OD2 ASP A 66 -7.883 -0.133 -12.683 1.00 0.00 O ATOM 0 H ASP A 66 -6.315 3.644 -9.791 1.00 0.00 H new ATOM 0 HA ASP A 66 -4.682 1.450 -10.826 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.646 0.270 -9.987 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -7.721 1.420 -10.757 1.00 0.00 H new ATOM 1025 N ILE A 67 -4.842 2.525 -13.049 1.00 0.00 N ATOM 1026 CA ILE A 67 -4.834 3.242 -14.311 1.00 0.00 C ATOM 1027 C ILE A 67 -6.080 2.879 -15.094 1.00 0.00 C ATOM 1028 O ILE A 67 -6.205 1.747 -15.563 1.00 0.00 O ATOM 1029 CB ILE A 67 -3.589 2.914 -15.163 1.00 0.00 C ATOM 1030 CG1 ILE A 67 -2.310 3.186 -14.368 1.00 0.00 C ATOM 1031 CG2 ILE A 67 -3.601 3.723 -16.457 1.00 0.00 C ATOM 1032 CD1 ILE A 67 -1.047 2.922 -15.155 1.00 0.00 C ATOM 0 H ILE A 67 -4.131 1.798 -12.970 1.00 0.00 H new ATOM 0 HA ILE A 67 -4.810 4.308 -14.087 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.614 1.855 -15.420 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.312 4.224 -14.035 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -2.308 2.564 -13.473 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -2.717 3.480 -17.046 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -4.496 3.480 -17.029 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -3.599 4.787 -16.221 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.179 3.135 -14.532 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -1.023 1.877 -15.465 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -1.027 3.563 -16.036 1.00 0.00 H new ATOM 1044 N LYS A 68 -6.988 3.841 -15.230 1.00 0.00 N ATOM 1045 CA LYS A 68 -8.301 3.592 -15.812 1.00 0.00 C ATOM 1046 C LYS A 68 -9.056 2.606 -14.921 1.00 0.00 C ATOM 1047 O LYS A 68 -9.013 1.398 -15.156 1.00 0.00 O ATOM 1048 CB LYS A 68 -8.189 3.030 -17.239 1.00 0.00 C ATOM 1049 CG LYS A 68 -7.207 3.777 -18.132 1.00 0.00 C ATOM 1050 CD LYS A 68 -7.719 5.154 -18.514 1.00 0.00 C ATOM 1051 CE LYS A 68 -6.729 5.880 -19.409 1.00 0.00 C ATOM 1052 NZ LYS A 68 -6.429 5.112 -20.646 1.00 0.00 N ATOM 0 H LYS A 68 -6.835 4.808 -14.942 1.00 0.00 H new ATOM 0 HA LYS A 68 -8.841 4.537 -15.873 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -7.887 1.984 -17.182 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -9.175 3.053 -17.704 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -6.251 3.876 -17.617 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -7.024 3.195 -19.035 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -8.676 5.059 -19.027 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.897 5.741 -17.613 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -7.132 6.857 -19.677 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -5.805 6.057 -18.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -5.963 5.734 -21.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -5.800 4.316 -20.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -7.314 4.747 -21.051 1.00 0.00 H new ATOM 1066 N PRO A 69 -9.736 3.121 -13.873 1.00 0.00 N ATOM 1067 CA PRO A 69 -10.405 2.303 -12.850 1.00 0.00 C ATOM 1068 C PRO A 69 -11.191 1.152 -13.449 1.00 0.00 C ATOM 1069 O PRO A 69 -12.227 1.342 -14.091 1.00 0.00 O ATOM 1070 CB PRO A 69 -11.332 3.293 -12.129 1.00 0.00 C ATOM 1071 CG PRO A 69 -11.253 4.568 -12.906 1.00 0.00 C ATOM 1072 CD PRO A 69 -9.930 4.547 -13.612 1.00 0.00 C ATOM 0 HA PRO A 69 -9.687 1.827 -12.182 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -12.355 2.918 -12.097 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -11.015 3.444 -11.097 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -12.074 4.640 -13.620 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -11.328 5.432 -12.245 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -9.952 5.129 -14.533 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -9.133 4.959 -12.993 1.00 0.00 H new ATOM 1122 N ILE A 74 -12.790 2.965 -7.907 1.00 0.00 N ATOM 1123 CA ILE A 74 -11.343 3.051 -7.915 1.00 0.00 C ATOM 1124 C ILE A 74 -10.911 4.420 -8.433 1.00 0.00 C ATOM 1125 O ILE A 74 -11.539 4.966 -9.340 1.00 0.00 O ATOM 1126 CB ILE A 74 -10.747 1.940 -8.803 1.00 0.00 C ATOM 1127 CG1 ILE A 74 -11.076 0.568 -8.222 1.00 0.00 C ATOM 1128 CG2 ILE A 74 -9.247 2.112 -8.954 1.00 0.00 C ATOM 1129 CD1 ILE A 74 -10.729 -0.571 -9.148 1.00 0.00 C ATOM 0 HA ILE A 74 -10.975 2.920 -6.897 1.00 0.00 H new ATOM 0 HB ILE A 74 -11.194 2.016 -9.794 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.538 0.440 -7.283 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -12.140 0.526 -7.988 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -8.851 1.316 -9.585 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.036 3.078 -9.413 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -8.775 2.066 -7.973 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -10.988 -1.517 -8.674 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -11.287 -0.466 -10.078 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -9.660 -0.553 -9.362 1.00 0.00 H new ATOM 1141 N VAL A 75 -9.860 4.982 -7.849 1.00 0.00 N ATOM 1142 CA VAL A 75 -9.359 6.273 -8.287 1.00 0.00 C ATOM 1143 C VAL A 75 -8.518 6.098 -9.546 1.00 0.00 C ATOM 1144 O VAL A 75 -7.722 5.165 -9.646 1.00 0.00 O ATOM 1145 CB VAL A 75 -8.524 6.967 -7.186 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -8.088 8.356 -7.625 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -9.314 7.044 -5.887 1.00 0.00 C ATOM 0 H VAL A 75 -9.342 4.565 -7.075 1.00 0.00 H new ATOM 0 HA VAL A 75 -10.217 6.910 -8.502 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.629 6.370 -7.015 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.503 8.821 -6.832 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.481 8.279 -8.527 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.968 8.965 -7.831 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.711 7.535 -5.123 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.228 7.615 -6.050 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.569 6.037 -5.556 1.00 0.00 H new ATOM 1157 N ARG A 76 -8.702 7.002 -10.500 1.00 0.00 N ATOM 1158 CA ARG A 76 -8.017 6.928 -11.789 1.00 0.00 C ATOM 1159 C ARG A 76 -6.552 7.350 -11.677 1.00 0.00 C ATOM 1160 O ARG A 76 -5.889 7.588 -12.690 1.00 0.00 O ATOM 1161 CB ARG A 76 -8.725 7.827 -12.807 1.00 0.00 C ATOM 1162 CG ARG A 76 -8.761 9.295 -12.409 1.00 0.00 C ATOM 1163 CD ARG A 76 -8.199 10.187 -13.503 1.00 0.00 C ATOM 1164 NE ARG A 76 -6.799 9.879 -13.802 1.00 0.00 N ATOM 1165 CZ ARG A 76 -5.981 10.687 -14.476 1.00 0.00 C ATOM 1166 NH1 ARG A 76 -6.409 11.869 -14.898 1.00 0.00 N ATOM 1167 NH2 ARG A 76 -4.729 10.316 -14.718 1.00 0.00 N ATOM 0 H ARG A 76 -9.326 7.803 -10.405 1.00 0.00 H new ATOM 0 HA ARG A 76 -8.048 5.890 -12.119 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -8.224 7.734 -13.771 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -9.747 7.472 -12.943 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -9.788 9.588 -12.192 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -8.188 9.438 -11.493 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.796 10.070 -14.407 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -8.283 11.230 -13.198 1.00 0.00 H new ATOM 0 HE ARG A 76 -6.426 8.989 -13.473 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -7.367 12.162 -14.707 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -5.780 12.485 -15.414 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -4.392 9.412 -14.388 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -4.104 10.935 -15.234 1.00 0.00 H new ATOM 1181 N ASP A 77 -6.053 7.438 -10.455 1.00 0.00 N ATOM 1182 CA ASP A 77 -4.702 7.913 -10.215 1.00 0.00 C ATOM 1183 C ASP A 77 -3.697 6.881 -10.707 1.00 0.00 C ATOM 1184 O ASP A 77 -3.721 5.726 -10.279 1.00 0.00 O ATOM 1185 CB ASP A 77 -4.505 8.200 -8.731 1.00 0.00 C ATOM 1186 CG ASP A 77 -3.379 9.177 -8.483 1.00 0.00 C ATOM 1187 OD1 ASP A 77 -3.372 10.247 -9.132 1.00 0.00 O ATOM 1188 OD2 ASP A 77 -2.511 8.896 -7.638 1.00 0.00 O ATOM 0 H ASP A 77 -6.567 7.185 -9.611 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.542 8.840 -10.766 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.429 8.600 -8.314 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -4.297 7.267 -8.207 1.00 0.00 H new ATOM 1193 N ASP A 78 -2.832 7.295 -11.621 1.00 0.00 N ATOM 1194 CA ASP A 78 -1.938 6.362 -12.286 1.00 0.00 C ATOM 1195 C ASP A 78 -0.536 6.415 -11.696 1.00 0.00 C ATOM 1196 O ASP A 78 -0.201 7.313 -10.927 1.00 0.00 O ATOM 1197 CB ASP A 78 -1.897 6.629 -13.795 1.00 0.00 C ATOM 1198 CG ASP A 78 -1.228 7.929 -14.161 1.00 0.00 C ATOM 1199 OD1 ASP A 78 0.015 7.951 -14.247 1.00 0.00 O ATOM 1200 OD2 ASP A 78 -1.946 8.923 -14.394 1.00 0.00 O ATOM 0 H ASP A 78 -2.731 8.266 -11.917 1.00 0.00 H new ATOM 0 HA ASP A 78 -2.330 5.358 -12.122 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -1.372 5.809 -14.286 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.916 6.633 -14.182 1.00 0.00 H new ATOM 1205 N ILE A 79 0.282 5.452 -12.092 1.00 0.00 N ATOM 1206 CA ILE A 79 1.591 5.243 -11.490 1.00 0.00 C ATOM 1207 C ILE A 79 2.634 6.256 -11.984 1.00 0.00 C ATOM 1208 O ILE A 79 3.690 6.417 -11.375 1.00 0.00 O ATOM 1209 CB ILE A 79 2.076 3.805 -11.759 1.00 0.00 C ATOM 1210 CG1 ILE A 79 3.268 3.470 -10.870 1.00 0.00 C ATOM 1211 CG2 ILE A 79 2.432 3.612 -13.228 1.00 0.00 C ATOM 1212 CD1 ILE A 79 3.383 1.998 -10.586 1.00 0.00 C ATOM 0 H ILE A 79 0.058 4.794 -12.839 1.00 0.00 H new ATOM 0 HA ILE A 79 1.479 5.396 -10.417 1.00 0.00 H new ATOM 0 HB ILE A 79 1.261 3.123 -11.519 1.00 0.00 H new ATOM 0 HG12 ILE A 79 4.183 3.816 -11.350 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.178 4.012 -9.928 1.00 0.00 H new ATOM 0 HG21 ILE A 79 2.771 2.589 -13.389 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.553 3.804 -13.844 1.00 0.00 H new ATOM 0 HG23 ILE A 79 3.227 4.305 -13.504 1.00 0.00 H new ATOM 0 HD11 ILE A 79 4.249 1.817 -9.949 1.00 0.00 H new ATOM 0 HD12 ILE A 79 2.481 1.654 -10.080 1.00 0.00 H new ATOM 0 HD13 ILE A 79 3.502 1.455 -11.523 1.00 0.00 H new ATOM 1224 N THR A 80 2.335 6.949 -13.075 1.00 0.00 N ATOM 1225 CA THR A 80 3.273 7.917 -13.633 1.00 0.00 C ATOM 1226 C THR A 80 2.971 9.296 -13.083 1.00 0.00 C ATOM 1227 O THR A 80 3.835 10.177 -13.032 1.00 0.00 O ATOM 1228 CB THR A 80 3.189 7.979 -15.174 1.00 0.00 C ATOM 1229 OG1 THR A 80 2.053 8.751 -15.585 1.00 0.00 O ATOM 1230 CG2 THR A 80 3.059 6.590 -15.758 1.00 0.00 C ATOM 0 H THR A 80 1.458 6.861 -13.588 1.00 0.00 H new ATOM 0 HA THR A 80 4.276 7.596 -13.351 1.00 0.00 H new ATOM 0 HB THR A 80 4.105 8.446 -15.535 1.00 0.00 H new ATOM 0 HG1 THR A 80 1.235 8.341 -15.235 1.00 0.00 H new ATOM 0 HG21 THR A 80 3.001 6.656 -16.844 1.00 0.00 H new ATOM 0 HG22 THR A 80 3.927 5.994 -15.476 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.155 6.117 -15.375 1.00 0.00 H new ATOM 1238 N SER A 81 1.734 9.460 -12.657 1.00 0.00 N ATOM 1239 CA SER A 81 1.215 10.753 -12.289 1.00 0.00 C ATOM 1240 C SER A 81 0.349 10.647 -11.030 1.00 0.00 C ATOM 1241 O SER A 81 -0.822 11.031 -11.043 1.00 0.00 O ATOM 1242 CB SER A 81 0.395 11.272 -13.471 1.00 0.00 C ATOM 1243 OG SER A 81 -0.029 12.614 -13.270 1.00 0.00 O ATOM 0 H SER A 81 1.064 8.697 -12.558 1.00 0.00 H new ATOM 0 HA SER A 81 2.029 11.442 -12.062 1.00 0.00 H new ATOM 0 HB2 SER A 81 0.991 11.212 -14.382 1.00 0.00 H new ATOM 0 HB3 SER A 81 -0.476 10.633 -13.617 1.00 0.00 H new ATOM 0 HG SER A 81 -0.618 12.657 -12.488 1.00 0.00 H new ATOM 1249 N PRO A 82 0.919 10.150 -9.916 1.00 0.00 N ATOM 1250 CA PRO A 82 0.167 9.898 -8.693 1.00 0.00 C ATOM 1251 C PRO A 82 -0.105 11.178 -7.912 1.00 0.00 C ATOM 1252 O PRO A 82 0.756 12.059 -7.818 1.00 0.00 O ATOM 1253 CB PRO A 82 1.077 8.961 -7.881 1.00 0.00 C ATOM 1254 CG PRO A 82 2.284 8.712 -8.728 1.00 0.00 C ATOM 1255 CD PRO A 82 2.332 9.819 -9.739 1.00 0.00 C ATOM 0 HA PRO A 82 -0.814 9.472 -8.906 1.00 0.00 H new ATOM 0 HB2 PRO A 82 1.356 9.417 -6.931 1.00 0.00 H new ATOM 0 HB3 PRO A 82 0.565 8.027 -7.649 1.00 0.00 H new ATOM 0 HG2 PRO A 82 3.189 8.702 -8.120 1.00 0.00 H new ATOM 0 HG3 PRO A 82 2.220 7.741 -9.219 1.00 0.00 H new ATOM 0 HD2 PRO A 82 2.906 10.673 -9.379 1.00 0.00 H new ATOM 0 HD3 PRO A 82 2.793 9.496 -10.672 1.00 0.00 H new ATOM 1263 N ARG A 83 -1.301 11.281 -7.361 1.00 0.00 N ATOM 1264 CA ARG A 83 -1.668 12.435 -6.561 1.00 0.00 C ATOM 1265 C ARG A 83 -1.118 12.310 -5.163 1.00 0.00 C ATOM 1266 O ARG A 83 -1.550 11.463 -4.383 1.00 0.00 O ATOM 1267 CB ARG A 83 -3.177 12.616 -6.469 1.00 0.00 C ATOM 1268 CG ARG A 83 -3.832 13.007 -7.768 1.00 0.00 C ATOM 1269 CD ARG A 83 -3.050 14.095 -8.470 1.00 0.00 C ATOM 1270 NE ARG A 83 -3.746 14.608 -9.646 1.00 0.00 N ATOM 1271 CZ ARG A 83 -3.662 14.068 -10.863 1.00 0.00 C ATOM 1272 NH1 ARG A 83 -3.009 12.922 -11.050 1.00 0.00 N ATOM 1273 NH2 ARG A 83 -4.259 14.653 -11.891 1.00 0.00 N ATOM 0 H ARG A 83 -2.035 10.579 -7.453 1.00 0.00 H new ATOM 0 HA ARG A 83 -1.241 13.304 -7.061 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.622 11.686 -6.116 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -3.395 13.378 -5.721 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -3.908 12.134 -8.417 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -4.848 13.352 -7.576 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -2.866 14.913 -7.774 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -2.077 13.705 -8.768 1.00 0.00 H new ATOM 0 HE ARG A 83 -4.335 15.433 -9.530 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -2.569 12.451 -10.260 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -2.949 12.516 -11.984 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.783 15.517 -11.752 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -4.194 14.240 -12.821 1.00 0.00 H new ATOM 1287 N MET A 84 -0.195 13.182 -4.831 1.00 0.00 N ATOM 1288 CA MET A 84 0.383 13.178 -3.505 1.00 0.00 C ATOM 1289 C MET A 84 -0.623 13.708 -2.495 1.00 0.00 C ATOM 1290 O MET A 84 -0.451 13.537 -1.291 1.00 0.00 O ATOM 1291 CB MET A 84 1.678 13.984 -3.457 1.00 0.00 C ATOM 1292 CG MET A 84 2.788 13.383 -4.299 1.00 0.00 C ATOM 1293 SD MET A 84 4.420 13.763 -3.646 1.00 0.00 S ATOM 1294 CE MET A 84 4.310 12.944 -2.056 1.00 0.00 C ATOM 0 H MET A 84 0.171 13.900 -5.456 1.00 0.00 H new ATOM 0 HA MET A 84 0.632 12.149 -3.246 1.00 0.00 H new ATOM 0 HB2 MET A 84 1.479 14.999 -3.800 1.00 0.00 H new ATOM 0 HB3 MET A 84 2.014 14.057 -2.423 1.00 0.00 H new ATOM 0 HG2 MET A 84 2.661 12.302 -4.346 1.00 0.00 H new ATOM 0 HG3 MET A 84 2.711 13.758 -5.320 1.00 0.00 H new ATOM 0 HE1 MET A 84 4.376 13.685 -1.260 1.00 0.00 H new ATOM 0 HE2 MET A 84 3.359 12.417 -1.983 1.00 0.00 H new ATOM 0 HE3 MET A 84 5.128 12.231 -1.957 1.00 0.00 H new ATOM 1304 N GLU A 85 -1.697 14.317 -2.998 1.00 0.00 N ATOM 1305 CA GLU A 85 -2.780 14.776 -2.137 1.00 0.00 C ATOM 1306 C GLU A 85 -3.534 13.575 -1.581 1.00 0.00 C ATOM 1307 O GLU A 85 -4.186 13.651 -0.539 1.00 0.00 O ATOM 1308 CB GLU A 85 -3.739 15.688 -2.909 1.00 0.00 C ATOM 1309 CG GLU A 85 -4.396 15.013 -4.103 1.00 0.00 C ATOM 1310 CD GLU A 85 -5.408 15.896 -4.798 1.00 0.00 C ATOM 1311 OE1 GLU A 85 -5.009 16.689 -5.679 1.00 0.00 O ATOM 1312 OE2 GLU A 85 -6.608 15.797 -4.468 1.00 0.00 O ATOM 0 H GLU A 85 -1.837 14.502 -3.991 1.00 0.00 H new ATOM 0 HA GLU A 85 -2.354 15.349 -1.314 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -4.515 16.042 -2.230 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -3.193 16.566 -3.254 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -3.626 14.721 -4.817 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -4.887 14.098 -3.771 1.00 0.00 H new ATOM 1319 N ILE A 86 -3.422 12.461 -2.288 1.00 0.00 N ATOM 1320 CA ILE A 86 -4.055 11.218 -1.889 1.00 0.00 C ATOM 1321 C ILE A 86 -3.185 10.488 -0.868 1.00 0.00 C ATOM 1322 O ILE A 86 -3.695 9.847 0.053 1.00 0.00 O ATOM 1323 CB ILE A 86 -4.304 10.324 -3.130 1.00 0.00 C ATOM 1324 CG1 ILE A 86 -5.317 11.002 -4.061 1.00 0.00 C ATOM 1325 CG2 ILE A 86 -4.791 8.940 -2.724 1.00 0.00 C ATOM 1326 CD1 ILE A 86 -5.424 10.368 -5.433 1.00 0.00 C ATOM 0 H ILE A 86 -2.889 12.395 -3.155 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.016 11.443 -1.426 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.360 10.198 -3.660 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -6.298 10.982 -3.587 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -5.041 12.050 -4.178 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.957 8.336 -3.616 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.041 8.460 -2.096 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.725 9.031 -2.169 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -6.161 10.908 -6.027 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -4.455 10.412 -5.930 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.733 9.328 -5.330 1.00 0.00 H new ATOM 1338 N TYR A 87 -1.871 10.619 -1.017 1.00 0.00 N ATOM 1339 CA TYR A 87 -0.930 9.953 -0.123 1.00 0.00 C ATOM 1340 C TYR A 87 -0.728 10.742 1.168 1.00 0.00 C ATOM 1341 O TYR A 87 -0.589 10.156 2.239 1.00 0.00 O ATOM 1342 CB TYR A 87 0.423 9.744 -0.810 1.00 0.00 C ATOM 1343 CG TYR A 87 0.362 8.868 -2.041 1.00 0.00 C ATOM 1344 CD1 TYR A 87 0.296 7.487 -1.929 1.00 0.00 C ATOM 1345 CD2 TYR A 87 0.371 9.422 -3.313 1.00 0.00 C ATOM 1346 CE1 TYR A 87 0.243 6.681 -3.051 1.00 0.00 C ATOM 1347 CE2 TYR A 87 0.319 8.624 -4.440 1.00 0.00 C ATOM 1348 CZ TYR A 87 0.253 7.256 -4.304 1.00 0.00 C ATOM 1349 OH TYR A 87 0.202 6.456 -5.422 1.00 0.00 O ATOM 0 H TYR A 87 -1.433 11.180 -1.748 1.00 0.00 H new ATOM 0 HA TYR A 87 -1.360 8.983 0.127 1.00 0.00 H new ATOM 0 HB2 TYR A 87 0.831 10.716 -1.089 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.116 9.300 -0.096 1.00 0.00 H new ATOM 0 HD1 TYR A 87 0.286 7.034 -0.949 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.419 10.495 -3.424 1.00 0.00 H new ATOM 0 HE1 TYR A 87 0.194 5.607 -2.947 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.330 9.072 -5.423 1.00 0.00 H new ATOM 0 HH TYR A 87 -0.500 6.780 -6.024 1.00 0.00 H new ATOM 1359 N ARG A 88 -0.698 12.070 1.068 1.00 0.00 N ATOM 1360 CA ARG A 88 -0.486 12.908 2.244 1.00 0.00 C ATOM 1361 C ARG A 88 -1.601 12.736 3.253 1.00 0.00 C ATOM 1362 O ARG A 88 -2.756 13.061 2.991 1.00 0.00 O ATOM 1363 CB ARG A 88 -0.346 14.381 1.878 1.00 0.00 C ATOM 1364 CG ARG A 88 1.007 14.721 1.290 1.00 0.00 C ATOM 1365 CD ARG A 88 1.169 16.218 1.083 1.00 0.00 C ATOM 1366 NE ARG A 88 1.192 16.946 2.356 1.00 0.00 N ATOM 1367 CZ ARG A 88 1.869 18.076 2.563 1.00 0.00 C ATOM 1368 NH1 ARG A 88 2.533 18.653 1.570 1.00 0.00 N ATOM 1369 NH2 ARG A 88 1.877 18.631 3.769 1.00 0.00 N ATOM 0 H ARG A 88 -0.816 12.583 0.194 1.00 0.00 H new ATOM 0 HA ARG A 88 0.450 12.578 2.694 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -1.124 14.647 1.162 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -0.511 14.988 2.768 1.00 0.00 H new ATOM 0 HG2 ARG A 88 1.793 14.358 1.952 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.130 14.206 0.337 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.093 16.411 0.537 1.00 0.00 H new ATOM 0 HD3 ARG A 88 0.351 16.590 0.467 1.00 0.00 H new ATOM 0 HE ARG A 88 0.655 16.563 3.134 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.528 18.232 0.641 1.00 0.00 H new ATOM 0 HH12 ARG A 88 3.049 19.517 1.736 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.366 18.193 4.535 1.00 0.00 H new ATOM 0 HH22 ARG A 88 2.394 19.495 3.929 1.00 0.00 H new ATOM 1383 N GLY A 89 -1.229 12.226 4.410 1.00 0.00 N ATOM 1384 CA GLY A 89 -2.194 11.970 5.457 1.00 0.00 C ATOM 1385 C GLY A 89 -2.383 10.489 5.706 1.00 0.00 C ATOM 1386 O GLY A 89 -3.017 10.090 6.685 1.00 0.00 O ATOM 0 H GLY A 89 -0.268 11.982 4.647 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.867 12.453 6.378 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -3.150 12.417 5.185 1.00 0.00 H new ATOM 1390 N ALA A 90 -1.829 9.670 4.821 1.00 0.00 N ATOM 1391 CA ALA A 90 -1.931 8.226 4.950 1.00 0.00 C ATOM 1392 C ALA A 90 -0.940 7.709 5.983 1.00 0.00 C ATOM 1393 O ALA A 90 0.132 8.281 6.176 1.00 0.00 O ATOM 1394 CB ALA A 90 -1.704 7.549 3.607 1.00 0.00 C ATOM 0 H ALA A 90 -1.304 9.984 4.005 1.00 0.00 H new ATOM 0 HA ALA A 90 -2.938 7.984 5.289 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -1.785 6.469 3.726 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -2.454 7.893 2.895 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.710 7.800 3.236 1.00 0.00 H new ATOM 1400 N ALA A 91 -1.308 6.629 6.649 1.00 0.00 N ATOM 1401 CA ALA A 91 -0.464 6.041 7.674 1.00 0.00 C ATOM 1402 C ALA A 91 0.397 4.929 7.092 1.00 0.00 C ATOM 1403 O ALA A 91 1.434 4.568 7.657 1.00 0.00 O ATOM 1404 CB ALA A 91 -1.317 5.508 8.816 1.00 0.00 C ATOM 0 H ALA A 91 -2.190 6.139 6.497 1.00 0.00 H new ATOM 0 HA ALA A 91 0.197 6.816 8.062 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -0.672 5.070 9.578 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.892 6.325 9.253 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.999 4.747 8.436 1.00 0.00 H new ATOM 1410 N LEU A 92 -0.030 4.388 5.957 1.00 0.00 N ATOM 1411 CA LEU A 92 0.683 3.289 5.332 1.00 0.00 C ATOM 1412 C LEU A 92 0.407 3.250 3.833 1.00 0.00 C ATOM 1413 O LEU A 92 -0.698 3.566 3.383 1.00 0.00 O ATOM 1414 CB LEU A 92 0.274 1.969 5.997 1.00 0.00 C ATOM 1415 CG LEU A 92 1.261 0.809 5.832 1.00 0.00 C ATOM 1416 CD1 LEU A 92 1.129 -0.161 6.994 1.00 0.00 C ATOM 1417 CD2 LEU A 92 1.034 0.075 4.518 1.00 0.00 C ATOM 0 H LEU A 92 -0.864 4.694 5.455 1.00 0.00 H new ATOM 0 HA LEU A 92 1.754 3.436 5.468 1.00 0.00 H new ATOM 0 HB2 LEU A 92 0.129 2.150 7.062 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.690 1.662 5.591 1.00 0.00 H new ATOM 0 HG LEU A 92 2.268 1.225 5.821 1.00 0.00 H new ATOM 0 HD11 LEU A 92 1.835 -0.981 6.865 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.342 0.359 7.928 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.114 -0.558 7.023 1.00 0.00 H new ATOM 0 HD21 LEU A 92 1.749 -0.743 4.430 1.00 0.00 H new ATOM 0 HD22 LEU A 92 0.021 -0.326 4.495 1.00 0.00 H new ATOM 0 HD23 LEU A 92 1.169 0.767 3.687 1.00 0.00 H new ATOM 1429 N ILE A 93 1.424 2.879 3.070 1.00 0.00 N ATOM 1430 CA ILE A 93 1.306 2.734 1.628 1.00 0.00 C ATOM 1431 C ILE A 93 1.887 1.388 1.212 1.00 0.00 C ATOM 1432 O ILE A 93 3.013 1.062 1.574 1.00 0.00 O ATOM 1433 CB ILE A 93 2.054 3.865 0.882 1.00 0.00 C ATOM 1434 CG1 ILE A 93 1.570 5.240 1.357 1.00 0.00 C ATOM 1435 CG2 ILE A 93 1.862 3.726 -0.625 1.00 0.00 C ATOM 1436 CD1 ILE A 93 2.358 6.395 0.776 1.00 0.00 C ATOM 0 H ILE A 93 2.354 2.670 3.433 1.00 0.00 H new ATOM 0 HA ILE A 93 0.250 2.793 1.364 1.00 0.00 H new ATOM 0 HB ILE A 93 3.117 3.779 1.107 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.520 5.358 1.091 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.630 5.281 2.445 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.394 4.529 -1.135 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.254 2.764 -0.955 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.800 3.786 -0.864 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.959 7.335 1.156 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.405 6.302 1.064 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.278 6.380 -0.311 1.00 0.00 H new ATOM 1448 N TYR A 94 1.126 0.595 0.477 1.00 0.00 N ATOM 1449 CA TYR A 94 1.611 -0.712 0.051 1.00 0.00 C ATOM 1450 C TYR A 94 1.427 -0.897 -1.448 1.00 0.00 C ATOM 1451 O TYR A 94 0.679 -0.163 -2.083 1.00 0.00 O ATOM 1452 CB TYR A 94 0.936 -1.848 0.841 1.00 0.00 C ATOM 1453 CG TYR A 94 -0.567 -1.953 0.686 1.00 0.00 C ATOM 1454 CD1 TYR A 94 -1.420 -1.099 1.375 1.00 0.00 C ATOM 1455 CD2 TYR A 94 -1.132 -2.929 -0.127 1.00 0.00 C ATOM 1456 CE1 TYR A 94 -2.793 -1.211 1.255 1.00 0.00 C ATOM 1457 CE2 TYR A 94 -2.504 -3.049 -0.251 1.00 0.00 C ATOM 1458 CZ TYR A 94 -3.329 -2.187 0.442 1.00 0.00 C ATOM 1459 OH TYR A 94 -4.694 -2.301 0.321 1.00 0.00 O ATOM 0 H TYR A 94 0.183 0.826 0.165 1.00 0.00 H new ATOM 0 HA TYR A 94 2.679 -0.756 0.266 1.00 0.00 H new ATOM 0 HB2 TYR A 94 1.381 -2.794 0.533 1.00 0.00 H new ATOM 0 HB3 TYR A 94 1.165 -1.717 1.898 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -1.003 -0.335 2.015 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.489 -3.605 -0.671 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -3.442 -0.538 1.795 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -2.927 -3.813 -0.886 1.00 0.00 H new ATOM 0 HH TYR A 94 -4.908 -3.037 -0.290 1.00 0.00 H new ATOM 1469 N SER A 95 2.140 -1.854 -2.021 1.00 0.00 N ATOM 1470 CA SER A 95 2.055 -2.111 -3.452 1.00 0.00 C ATOM 1471 C SER A 95 2.193 -3.601 -3.744 1.00 0.00 C ATOM 1472 O SER A 95 2.921 -4.318 -3.052 1.00 0.00 O ATOM 1473 CB SER A 95 3.140 -1.329 -4.197 1.00 0.00 C ATOM 1474 OG SER A 95 3.132 0.035 -3.813 1.00 0.00 O ATOM 0 H SER A 95 2.784 -2.465 -1.519 1.00 0.00 H new ATOM 0 HA SER A 95 1.076 -1.780 -3.799 1.00 0.00 H new ATOM 0 HB2 SER A 95 4.117 -1.765 -3.987 1.00 0.00 H new ATOM 0 HB3 SER A 95 2.979 -1.410 -5.272 1.00 0.00 H new ATOM 0 HG SER A 95 4.041 0.313 -3.575 1.00 0.00 H new ATOM 1480 N ILE A 96 1.484 -4.059 -4.767 1.00 0.00 N ATOM 1481 CA ILE A 96 1.516 -5.458 -5.161 1.00 0.00 C ATOM 1482 C ILE A 96 2.151 -5.601 -6.541 1.00 0.00 C ATOM 1483 O ILE A 96 1.560 -5.206 -7.544 1.00 0.00 O ATOM 1484 CB ILE A 96 0.095 -6.065 -5.177 1.00 0.00 C ATOM 1485 CG1 ILE A 96 -0.548 -5.934 -3.789 1.00 0.00 C ATOM 1486 CG2 ILE A 96 0.142 -7.526 -5.614 1.00 0.00 C ATOM 1487 CD1 ILE A 96 -1.984 -6.411 -3.727 1.00 0.00 C ATOM 0 H ILE A 96 0.876 -3.476 -5.342 1.00 0.00 H new ATOM 0 HA ILE A 96 2.114 -6.000 -4.428 1.00 0.00 H new ATOM 0 HB ILE A 96 -0.513 -5.516 -5.896 1.00 0.00 H new ATOM 0 HG12 ILE A 96 0.044 -6.502 -3.071 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -0.509 -4.890 -3.479 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -0.868 -7.937 -5.619 1.00 0.00 H new ATOM 0 HG22 ILE A 96 0.566 -7.593 -6.616 1.00 0.00 H new ATOM 0 HG23 ILE A 96 0.761 -8.094 -4.919 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.366 -6.285 -2.714 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.591 -5.827 -4.419 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.030 -7.464 -4.004 1.00 0.00 H new ATOM 1499 N ARG A 97 3.361 -6.160 -6.564 1.00 0.00 N ATOM 1500 CA ARG A 97 4.131 -6.342 -7.798 1.00 0.00 C ATOM 1501 C ARG A 97 4.401 -5.000 -8.491 1.00 0.00 C ATOM 1502 O ARG A 97 3.698 -4.612 -9.424 1.00 0.00 O ATOM 1503 CB ARG A 97 3.417 -7.307 -8.757 1.00 0.00 C ATOM 1504 CG ARG A 97 4.175 -7.561 -10.052 1.00 0.00 C ATOM 1505 CD ARG A 97 3.365 -8.414 -11.015 1.00 0.00 C ATOM 1506 NE ARG A 97 3.230 -9.798 -10.557 1.00 0.00 N ATOM 1507 CZ ARG A 97 2.066 -10.445 -10.472 1.00 0.00 C ATOM 1508 NH1 ARG A 97 0.933 -9.814 -10.758 1.00 0.00 N ATOM 1509 NH2 ARG A 97 2.037 -11.721 -10.096 1.00 0.00 N ATOM 0 H ARG A 97 3.837 -6.500 -5.728 1.00 0.00 H new ATOM 0 HA ARG A 97 5.091 -6.779 -7.522 1.00 0.00 H new ATOM 0 HB2 ARG A 97 3.257 -8.258 -8.248 1.00 0.00 H new ATOM 0 HB3 ARG A 97 2.433 -6.904 -8.996 1.00 0.00 H new ATOM 0 HG2 ARG A 97 4.419 -6.609 -10.524 1.00 0.00 H new ATOM 0 HG3 ARG A 97 5.119 -8.058 -9.830 1.00 0.00 H new ATOM 0 HD2 ARG A 97 2.374 -7.977 -11.138 1.00 0.00 H new ATOM 0 HD3 ARG A 97 3.842 -8.403 -11.995 1.00 0.00 H new ATOM 0 HE ARG A 97 4.077 -10.298 -10.287 1.00 0.00 H new ATOM 0 HH11 ARG A 97 0.952 -8.835 -11.043 1.00 0.00 H new ATOM 0 HH12 ARG A 97 0.043 -10.309 -10.693 1.00 0.00 H new ATOM 0 HH21 ARG A 97 2.906 -12.207 -9.872 1.00 0.00 H new ATOM 0 HH22 ARG A 97 1.146 -12.214 -10.032 1.00 0.00 H new ATOM 1523 N PRO A 98 5.415 -4.262 -8.022 1.00 0.00 N ATOM 1524 CA PRO A 98 5.788 -2.980 -8.602 1.00 0.00 C ATOM 1525 C PRO A 98 6.797 -3.121 -9.742 1.00 0.00 C ATOM 1526 O PRO A 98 7.781 -3.860 -9.629 1.00 0.00 O ATOM 1527 CB PRO A 98 6.411 -2.255 -7.414 1.00 0.00 C ATOM 1528 CG PRO A 98 7.047 -3.337 -6.602 1.00 0.00 C ATOM 1529 CD PRO A 98 6.274 -4.608 -6.876 1.00 0.00 C ATOM 0 HA PRO A 98 4.941 -2.462 -9.052 1.00 0.00 H new ATOM 0 HB2 PRO A 98 7.147 -1.520 -7.740 1.00 0.00 H new ATOM 0 HB3 PRO A 98 5.657 -1.718 -6.838 1.00 0.00 H new ATOM 0 HG2 PRO A 98 8.096 -3.457 -6.874 1.00 0.00 H new ATOM 0 HG3 PRO A 98 7.019 -3.090 -5.541 1.00 0.00 H new ATOM 0 HD2 PRO A 98 6.940 -5.437 -7.113 1.00 0.00 H new ATOM 0 HD3 PRO A 98 5.683 -4.910 -6.011 1.00 0.00 H new ATOM 1537 N PRO A 99 6.551 -2.431 -10.866 1.00 0.00 N ATOM 1538 CA PRO A 99 7.487 -2.393 -11.991 1.00 0.00 C ATOM 1539 C PRO A 99 8.844 -1.835 -11.570 1.00 0.00 C ATOM 1540 O PRO A 99 8.918 -0.871 -10.808 1.00 0.00 O ATOM 1541 CB PRO A 99 6.817 -1.451 -12.998 1.00 0.00 C ATOM 1542 CG PRO A 99 5.377 -1.428 -12.617 1.00 0.00 C ATOM 1543 CD PRO A 99 5.333 -1.644 -11.131 1.00 0.00 C ATOM 0 HA PRO A 99 7.682 -3.387 -12.394 1.00 0.00 H new ATOM 0 HB2 PRO A 99 7.252 -0.453 -12.952 1.00 0.00 H new ATOM 0 HB3 PRO A 99 6.948 -1.809 -14.019 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.918 -0.476 -12.886 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.823 -2.208 -13.140 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.338 -0.699 -10.587 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.434 -2.181 -10.829 1.00 0.00 H new ATOM 1551 N ALA A 100 9.914 -2.411 -12.102 1.00 0.00 N ATOM 1552 CA ALA A 100 11.268 -2.062 -11.681 1.00 0.00 C ATOM 1553 C ALA A 100 11.687 -0.676 -12.176 1.00 0.00 C ATOM 1554 O ALA A 100 12.824 -0.254 -11.967 1.00 0.00 O ATOM 1555 CB ALA A 100 12.256 -3.121 -12.152 1.00 0.00 C ATOM 0 H ALA A 100 9.872 -3.125 -12.829 1.00 0.00 H new ATOM 0 HA ALA A 100 11.274 -2.028 -10.592 1.00 0.00 H new ATOM 0 HB1 ALA A 100 13.262 -2.849 -11.832 1.00 0.00 H new ATOM 0 HB2 ALA A 100 11.987 -4.086 -11.722 1.00 0.00 H new ATOM 0 HB3 ALA A 100 12.227 -3.187 -13.240 1.00 0.00 H new ATOM 1561 N GLU A 101 10.765 0.031 -12.815 1.00 0.00 N ATOM 1562 CA GLU A 101 11.046 1.361 -13.333 1.00 0.00 C ATOM 1563 C GLU A 101 10.592 2.452 -12.362 1.00 0.00 C ATOM 1564 O GLU A 101 11.074 3.585 -12.424 1.00 0.00 O ATOM 1565 CB GLU A 101 10.343 1.567 -14.676 1.00 0.00 C ATOM 1566 CG GLU A 101 8.827 1.470 -14.589 1.00 0.00 C ATOM 1567 CD GLU A 101 8.135 1.983 -15.834 1.00 0.00 C ATOM 1568 OE1 GLU A 101 8.101 3.214 -16.032 1.00 0.00 O ATOM 1569 OE2 GLU A 101 7.624 1.160 -16.622 1.00 0.00 O ATOM 0 H GLU A 101 9.814 -0.296 -12.987 1.00 0.00 H new ATOM 0 HA GLU A 101 12.126 1.436 -13.462 1.00 0.00 H new ATOM 0 HB2 GLU A 101 10.614 2.545 -15.073 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.707 0.823 -15.385 1.00 0.00 H new ATOM 0 HG2 GLU A 101 8.543 0.431 -14.423 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.480 2.038 -13.726 1.00 0.00 H new ATOM 1576 N ILE A 102 9.671 2.117 -11.465 1.00 0.00 N ATOM 1577 CA ILE A 102 9.025 3.136 -10.638 1.00 0.00 C ATOM 1578 C ILE A 102 9.332 2.984 -9.153 1.00 0.00 C ATOM 1579 O ILE A 102 8.722 3.654 -8.320 1.00 0.00 O ATOM 1580 CB ILE A 102 7.495 3.147 -10.840 1.00 0.00 C ATOM 1581 CG1 ILE A 102 6.912 1.729 -10.817 1.00 0.00 C ATOM 1582 CG2 ILE A 102 7.136 3.852 -12.139 1.00 0.00 C ATOM 1583 CD1 ILE A 102 6.726 1.152 -9.428 1.00 0.00 C ATOM 0 H ILE A 102 9.357 1.162 -11.291 1.00 0.00 H new ATOM 0 HA ILE A 102 9.444 4.085 -10.972 1.00 0.00 H new ATOM 0 HB ILE A 102 7.055 3.697 -10.008 1.00 0.00 H new ATOM 0 HG12 ILE A 102 5.948 1.737 -11.326 1.00 0.00 H new ATOM 0 HG13 ILE A 102 7.568 1.070 -11.386 1.00 0.00 H new ATOM 0 HG21 ILE A 102 6.053 3.851 -12.266 1.00 0.00 H new ATOM 0 HG22 ILE A 102 7.497 4.880 -12.107 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.600 3.331 -12.976 1.00 0.00 H new ATOM 0 HD11 ILE A 102 6.310 0.148 -9.504 1.00 0.00 H new ATOM 0 HD12 ILE A 102 7.690 1.108 -8.920 1.00 0.00 H new ATOM 0 HD13 ILE A 102 6.045 1.785 -8.859 1.00 0.00 H new ATOM 1595 N HIS A 103 10.282 2.122 -8.829 1.00 0.00 N ATOM 1596 CA HIS A 103 10.662 1.892 -7.434 1.00 0.00 C ATOM 1597 C HIS A 103 11.037 3.202 -6.742 1.00 0.00 C ATOM 1598 O HIS A 103 10.518 3.527 -5.672 1.00 0.00 O ATOM 1599 CB HIS A 103 11.837 0.915 -7.342 1.00 0.00 C ATOM 1600 CG HIS A 103 11.533 -0.471 -7.830 1.00 0.00 C ATOM 1601 ND1 HIS A 103 10.297 -1.046 -7.649 1.00 0.00 N ATOM 1602 CD2 HIS A 103 12.340 -1.354 -8.465 1.00 0.00 C ATOM 1603 CE1 HIS A 103 10.381 -2.257 -8.172 1.00 0.00 C ATOM 1604 NE2 HIS A 103 11.601 -2.489 -8.679 1.00 0.00 N ATOM 0 H HIS A 103 10.806 1.569 -9.507 1.00 0.00 H new ATOM 0 HA HIS A 103 9.798 1.460 -6.929 1.00 0.00 H new ATOM 0 HB2 HIS A 103 12.671 1.315 -7.918 1.00 0.00 H new ATOM 0 HB3 HIS A 103 12.165 0.857 -6.304 1.00 0.00 H new ATOM 0 HD2 HIS A 103 13.370 -1.195 -8.749 1.00 0.00 H new ATOM 0 HE1 HIS A 103 9.570 -2.970 -8.189 1.00 0.00 H new ATOM 0 HE2 HIS A 103 11.918 -3.344 -9.135 1.00 0.00 H new ATOM 1612 N SER A 104 11.913 3.968 -7.382 1.00 0.00 N ATOM 1613 CA SER A 104 12.409 5.218 -6.818 1.00 0.00 C ATOM 1614 C SER A 104 11.281 6.237 -6.672 1.00 0.00 C ATOM 1615 O SER A 104 11.330 7.117 -5.811 1.00 0.00 O ATOM 1616 CB SER A 104 13.509 5.790 -7.714 1.00 0.00 C ATOM 1617 OG SER A 104 14.425 4.780 -8.100 1.00 0.00 O ATOM 0 H SER A 104 12.297 3.743 -8.300 1.00 0.00 H new ATOM 0 HA SER A 104 12.815 5.010 -5.828 1.00 0.00 H new ATOM 0 HB2 SER A 104 13.063 6.240 -8.601 1.00 0.00 H new ATOM 0 HB3 SER A 104 14.038 6.583 -7.186 1.00 0.00 H new ATOM 0 HG SER A 104 15.118 5.169 -8.674 1.00 0.00 H new ATOM 1623 N SER A 105 10.259 6.097 -7.506 1.00 0.00 N ATOM 1624 CA SER A 105 9.131 7.013 -7.493 1.00 0.00 C ATOM 1625 C SER A 105 8.280 6.777 -6.252 1.00 0.00 C ATOM 1626 O SER A 105 7.799 7.718 -5.628 1.00 0.00 O ATOM 1627 CB SER A 105 8.294 6.827 -8.760 1.00 0.00 C ATOM 1628 OG SER A 105 9.100 6.939 -9.922 1.00 0.00 O ATOM 0 H SER A 105 10.190 5.354 -8.202 1.00 0.00 H new ATOM 0 HA SER A 105 9.503 8.037 -7.468 1.00 0.00 H new ATOM 0 HB2 SER A 105 7.811 5.850 -8.741 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.501 7.574 -8.789 1.00 0.00 H new ATOM 0 HG SER A 105 8.544 6.815 -10.719 1.00 0.00 H new ATOM 1634 N LEU A 106 8.121 5.513 -5.889 1.00 0.00 N ATOM 1635 CA LEU A 106 7.339 5.143 -4.719 1.00 0.00 C ATOM 1636 C LEU A 106 8.090 5.479 -3.436 1.00 0.00 C ATOM 1637 O LEU A 106 7.507 5.992 -2.477 1.00 0.00 O ATOM 1638 CB LEU A 106 7.017 3.650 -4.757 1.00 0.00 C ATOM 1639 CG LEU A 106 6.134 3.202 -5.924 1.00 0.00 C ATOM 1640 CD1 LEU A 106 5.832 1.715 -5.824 1.00 0.00 C ATOM 1641 CD2 LEU A 106 4.844 4.012 -5.965 1.00 0.00 C ATOM 0 H LEU A 106 8.526 4.723 -6.391 1.00 0.00 H new ATOM 0 HA LEU A 106 6.410 5.713 -4.734 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.954 3.094 -4.797 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.524 3.377 -3.824 1.00 0.00 H new ATOM 0 HG LEU A 106 6.677 3.380 -6.853 1.00 0.00 H new ATOM 0 HD11 LEU A 106 5.203 1.414 -6.662 1.00 0.00 H new ATOM 0 HD12 LEU A 106 6.765 1.152 -5.850 1.00 0.00 H new ATOM 0 HD13 LEU A 106 5.311 1.512 -4.888 1.00 0.00 H new ATOM 0 HD21 LEU A 106 4.231 3.678 -6.802 1.00 0.00 H new ATOM 0 HD22 LEU A 106 4.296 3.870 -5.034 1.00 0.00 H new ATOM 0 HD23 LEU A 106 5.082 5.069 -6.089 1.00 0.00 H new ATOM 1653 N MET A 107 9.387 5.199 -3.437 1.00 0.00 N ATOM 1654 CA MET A 107 10.230 5.424 -2.266 1.00 0.00 C ATOM 1655 C MET A 107 10.174 6.875 -1.795 1.00 0.00 C ATOM 1656 O MET A 107 10.118 7.143 -0.592 1.00 0.00 O ATOM 1657 CB MET A 107 11.682 5.039 -2.565 1.00 0.00 C ATOM 1658 CG MET A 107 11.878 3.574 -2.925 1.00 0.00 C ATOM 1659 SD MET A 107 11.278 2.448 -1.653 1.00 0.00 S ATOM 1660 CE MET A 107 12.249 2.971 -0.248 1.00 0.00 C ATOM 0 H MET A 107 9.882 4.813 -4.241 1.00 0.00 H new ATOM 0 HA MET A 107 9.842 4.792 -1.467 1.00 0.00 H new ATOM 0 HB2 MET A 107 12.048 5.655 -3.386 1.00 0.00 H new ATOM 0 HB3 MET A 107 12.295 5.273 -1.694 1.00 0.00 H new ATOM 0 HG2 MET A 107 11.361 3.364 -3.861 1.00 0.00 H new ATOM 0 HG3 MET A 107 12.938 3.387 -3.097 1.00 0.00 H new ATOM 0 HE1 MET A 107 12.371 2.135 0.441 1.00 0.00 H new ATOM 0 HE2 MET A 107 13.229 3.307 -0.588 1.00 0.00 H new ATOM 0 HE3 MET A 107 11.741 3.790 0.261 1.00 0.00 H new ATOM 1670 N ARG A 108 10.187 7.811 -2.737 1.00 0.00 N ATOM 1671 CA ARG A 108 10.172 9.225 -2.384 1.00 0.00 C ATOM 1672 C ARG A 108 8.800 9.655 -1.884 1.00 0.00 C ATOM 1673 O ARG A 108 8.692 10.562 -1.063 1.00 0.00 O ATOM 1674 CB ARG A 108 10.602 10.097 -3.561 1.00 0.00 C ATOM 1675 CG ARG A 108 9.690 10.014 -4.769 1.00 0.00 C ATOM 1676 CD ARG A 108 10.083 11.037 -5.812 1.00 0.00 C ATOM 1677 NE ARG A 108 11.430 10.808 -6.328 1.00 0.00 N ATOM 1678 CZ ARG A 108 12.372 11.750 -6.398 1.00 0.00 C ATOM 1679 NH1 ARG A 108 12.116 12.986 -5.992 1.00 0.00 N ATOM 1680 NH2 ARG A 108 13.570 11.457 -6.879 1.00 0.00 N ATOM 0 H ARG A 108 10.208 7.620 -3.739 1.00 0.00 H new ATOM 0 HA ARG A 108 10.891 9.362 -1.576 1.00 0.00 H new ATOM 0 HB2 ARG A 108 10.652 11.134 -3.230 1.00 0.00 H new ATOM 0 HB3 ARG A 108 11.610 9.809 -3.861 1.00 0.00 H new ATOM 0 HG2 ARG A 108 9.739 9.013 -5.199 1.00 0.00 H new ATOM 0 HG3 ARG A 108 8.657 10.179 -4.462 1.00 0.00 H new ATOM 0 HD2 ARG A 108 9.370 11.006 -6.636 1.00 0.00 H new ATOM 0 HD3 ARG A 108 10.026 12.036 -5.379 1.00 0.00 H new ATOM 0 HE ARG A 108 11.665 9.871 -6.655 1.00 0.00 H new ATOM 0 HH11 ARG A 108 11.194 13.221 -5.623 1.00 0.00 H new ATOM 0 HH12 ARG A 108 12.841 13.702 -6.048 1.00 0.00 H new ATOM 0 HH21 ARG A 108 13.774 10.510 -7.197 1.00 0.00 H new ATOM 0 HH22 ARG A 108 14.289 12.179 -6.932 1.00 0.00 H new ATOM 1694 N VAL A 109 7.750 8.998 -2.367 1.00 0.00 N ATOM 1695 CA VAL A 109 6.395 9.338 -1.954 1.00 0.00 C ATOM 1696 C VAL A 109 6.172 8.963 -0.498 1.00 0.00 C ATOM 1697 O VAL A 109 5.638 9.756 0.279 1.00 0.00 O ATOM 1698 CB VAL A 109 5.325 8.649 -2.829 1.00 0.00 C ATOM 1699 CG1 VAL A 109 3.929 8.921 -2.286 1.00 0.00 C ATOM 1700 CG2 VAL A 109 5.431 9.119 -4.271 1.00 0.00 C ATOM 0 H VAL A 109 7.811 8.233 -3.039 1.00 0.00 H new ATOM 0 HA VAL A 109 6.290 10.416 -2.079 1.00 0.00 H new ATOM 0 HB VAL A 109 5.503 7.574 -2.800 1.00 0.00 H new ATOM 0 HG11 VAL A 109 3.190 8.427 -2.917 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.853 8.536 -1.269 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.743 9.995 -2.283 1.00 0.00 H new ATOM 0 HG21 VAL A 109 4.669 8.623 -4.872 1.00 0.00 H new ATOM 0 HG22 VAL A 109 5.281 10.198 -4.314 1.00 0.00 H new ATOM 0 HG23 VAL A 109 6.418 8.874 -4.662 1.00 0.00 H new ATOM 1710 N ALA A 110 6.598 7.760 -0.128 1.00 0.00 N ATOM 1711 CA ALA A 110 6.462 7.306 1.248 1.00 0.00 C ATOM 1712 C ALA A 110 7.250 8.210 2.181 1.00 0.00 C ATOM 1713 O ALA A 110 6.753 8.619 3.228 1.00 0.00 O ATOM 1714 CB ALA A 110 6.923 5.863 1.392 1.00 0.00 C ATOM 0 H ALA A 110 7.037 7.088 -0.757 1.00 0.00 H new ATOM 0 HA ALA A 110 5.408 7.354 1.521 1.00 0.00 H new ATOM 0 HB1 ALA A 110 6.812 5.547 2.429 1.00 0.00 H new ATOM 0 HB2 ALA A 110 6.318 5.222 0.751 1.00 0.00 H new ATOM 0 HB3 ALA A 110 7.970 5.785 1.099 1.00 0.00 H new ATOM 1720 N ASP A 111 8.472 8.534 1.772 1.00 0.00 N ATOM 1721 CA ASP A 111 9.352 9.398 2.555 1.00 0.00 C ATOM 1722 C ASP A 111 8.765 10.798 2.688 1.00 0.00 C ATOM 1723 O ASP A 111 8.920 11.456 3.715 1.00 0.00 O ATOM 1724 CB ASP A 111 10.728 9.473 1.890 1.00 0.00 C ATOM 1725 CG ASP A 111 11.768 10.173 2.745 1.00 0.00 C ATOM 1726 OD1 ASP A 111 11.909 11.410 2.633 1.00 0.00 O ATOM 1727 OD2 ASP A 111 12.471 9.479 3.516 1.00 0.00 O ATOM 0 H ASP A 111 8.879 8.209 0.895 1.00 0.00 H new ATOM 0 HA ASP A 111 9.452 8.973 3.554 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.071 8.463 1.666 1.00 0.00 H new ATOM 0 HB3 ASP A 111 10.637 9.997 0.939 1.00 0.00 H new ATOM 1732 N ALA A 112 8.081 11.239 1.642 1.00 0.00 N ATOM 1733 CA ALA A 112 7.488 12.567 1.615 1.00 0.00 C ATOM 1734 C ALA A 112 6.296 12.678 2.558 1.00 0.00 C ATOM 1735 O ALA A 112 6.153 13.673 3.269 1.00 0.00 O ATOM 1736 CB ALA A 112 7.066 12.919 0.199 1.00 0.00 C ATOM 0 H ALA A 112 7.923 10.692 0.796 1.00 0.00 H new ATOM 0 HA ALA A 112 8.245 13.273 1.957 1.00 0.00 H new ATOM 0 HB1 ALA A 112 6.623 13.915 0.188 1.00 0.00 H new ATOM 0 HB2 ALA A 112 7.938 12.902 -0.455 1.00 0.00 H new ATOM 0 HB3 ALA A 112 6.334 12.193 -0.154 1.00 0.00 H new ATOM 1742 N VAL A 113 5.437 11.663 2.560 1.00 0.00 N ATOM 1743 CA VAL A 113 4.209 11.717 3.346 1.00 0.00 C ATOM 1744 C VAL A 113 4.417 11.187 4.761 1.00 0.00 C ATOM 1745 O VAL A 113 3.674 11.537 5.676 1.00 0.00 O ATOM 1746 CB VAL A 113 3.058 10.942 2.668 1.00 0.00 C ATOM 1747 CG1 VAL A 113 2.807 11.478 1.268 1.00 0.00 C ATOM 1748 CG2 VAL A 113 3.343 9.447 2.631 1.00 0.00 C ATOM 0 H VAL A 113 5.567 10.800 2.031 1.00 0.00 H new ATOM 0 HA VAL A 113 3.933 12.770 3.405 1.00 0.00 H new ATOM 0 HB VAL A 113 2.157 11.092 3.263 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.993 10.920 0.805 1.00 0.00 H new ATOM 0 HG12 VAL A 113 2.538 12.533 1.325 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.710 11.366 0.668 1.00 0.00 H new ATOM 0 HG21 VAL A 113 2.514 8.930 2.148 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.260 9.265 2.071 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.460 9.074 3.648 1.00 0.00 H new ATOM 1758 N GLY A 114 5.424 10.343 4.931 1.00 0.00 N ATOM 1759 CA GLY A 114 5.725 9.803 6.242 1.00 0.00 C ATOM 1760 C GLY A 114 4.889 8.584 6.567 1.00 0.00 C ATOM 1761 O GLY A 114 4.221 8.530 7.602 1.00 0.00 O ATOM 0 H GLY A 114 6.039 10.022 4.184 1.00 0.00 H new ATOM 0 HA2 GLY A 114 6.782 9.540 6.290 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.553 10.570 6.997 1.00 0.00 H new ATOM 1765 N ALA A 115 4.920 7.602 5.681 1.00 0.00 N ATOM 1766 CA ALA A 115 4.149 6.384 5.866 1.00 0.00 C ATOM 1767 C ALA A 115 5.027 5.159 5.677 1.00 0.00 C ATOM 1768 O ALA A 115 6.098 5.244 5.074 1.00 0.00 O ATOM 1769 CB ALA A 115 2.982 6.341 4.895 1.00 0.00 C ATOM 0 H ALA A 115 5.473 7.625 4.824 1.00 0.00 H new ATOM 0 HA ALA A 115 3.760 6.380 6.884 1.00 0.00 H new ATOM 0 HB1 ALA A 115 2.416 5.422 5.047 1.00 0.00 H new ATOM 0 HB2 ALA A 115 2.334 7.200 5.067 1.00 0.00 H new ATOM 0 HB3 ALA A 115 3.358 6.370 3.872 1.00 0.00 H new ATOM 1775 N ARG A 116 4.579 4.024 6.196 1.00 0.00 N ATOM 1776 CA ARG A 116 5.296 2.777 6.000 1.00 0.00 C ATOM 1777 C ARG A 116 4.980 2.228 4.617 1.00 0.00 C ATOM 1778 O ARG A 116 3.814 2.036 4.274 1.00 0.00 O ATOM 1779 CB ARG A 116 4.915 1.745 7.064 1.00 0.00 C ATOM 1780 CG ARG A 116 5.859 0.550 7.105 1.00 0.00 C ATOM 1781 CD ARG A 116 5.338 -0.565 8.002 1.00 0.00 C ATOM 1782 NE ARG A 116 5.007 -0.099 9.350 1.00 0.00 N ATOM 1783 CZ ARG A 116 5.330 -0.757 10.464 1.00 0.00 C ATOM 1784 NH1 ARG A 116 6.091 -1.844 10.406 1.00 0.00 N ATOM 1785 NH2 ARG A 116 4.908 -0.309 11.641 1.00 0.00 N ATOM 0 H ARG A 116 3.728 3.943 6.752 1.00 0.00 H new ATOM 0 HA ARG A 116 6.364 2.975 6.089 1.00 0.00 H new ATOM 0 HB2 ARG A 116 4.906 2.227 8.042 1.00 0.00 H new ATOM 0 HB3 ARG A 116 3.901 1.393 6.873 1.00 0.00 H new ATOM 0 HG2 ARG A 116 5.999 0.165 6.095 1.00 0.00 H new ATOM 0 HG3 ARG A 116 6.837 0.874 7.462 1.00 0.00 H new ATOM 0 HD2 ARG A 116 4.452 -1.007 7.547 1.00 0.00 H new ATOM 0 HD3 ARG A 116 6.089 -1.353 8.069 1.00 0.00 H new ATOM 0 HE ARG A 116 4.499 0.781 9.442 1.00 0.00 H new ATOM 0 HH11 ARG A 116 6.432 -2.180 9.505 1.00 0.00 H new ATOM 0 HH12 ARG A 116 6.334 -2.342 11.262 1.00 0.00 H new ATOM 0 HH21 ARG A 116 4.339 0.536 11.691 1.00 0.00 H new ATOM 0 HH22 ARG A 116 5.153 -0.810 12.495 1.00 0.00 H new ATOM 1799 N LEU A 117 6.010 2.001 3.822 1.00 0.00 N ATOM 1800 CA LEU A 117 5.830 1.453 2.488 1.00 0.00 C ATOM 1801 C LEU A 117 6.007 -0.057 2.529 1.00 0.00 C ATOM 1802 O LEU A 117 7.069 -0.549 2.889 1.00 0.00 O ATOM 1803 CB LEU A 117 6.834 2.080 1.512 1.00 0.00 C ATOM 1804 CG LEU A 117 6.716 1.622 0.055 1.00 0.00 C ATOM 1805 CD1 LEU A 117 5.370 2.028 -0.529 1.00 0.00 C ATOM 1806 CD2 LEU A 117 7.857 2.197 -0.771 1.00 0.00 C ATOM 0 H LEU A 117 6.980 2.187 4.076 1.00 0.00 H new ATOM 0 HA LEU A 117 4.823 1.686 2.141 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.716 3.163 1.544 1.00 0.00 H new ATOM 0 HB3 LEU A 117 7.842 1.858 1.863 1.00 0.00 H new ATOM 0 HG LEU A 117 6.782 0.534 0.027 1.00 0.00 H new ATOM 0 HD11 LEU A 117 5.307 1.693 -1.564 1.00 0.00 H new ATOM 0 HD12 LEU A 117 4.569 1.569 0.050 1.00 0.00 H new ATOM 0 HD13 LEU A 117 5.269 3.113 -0.492 1.00 0.00 H new ATOM 0 HD21 LEU A 117 7.762 1.864 -1.805 1.00 0.00 H new ATOM 0 HD22 LEU A 117 7.819 3.286 -0.736 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.809 1.854 -0.366 1.00 0.00 H new ATOM 1818 N ILE A 118 4.964 -0.791 2.185 1.00 0.00 N ATOM 1819 CA ILE A 118 5.030 -2.245 2.196 1.00 0.00 C ATOM 1820 C ILE A 118 4.869 -2.802 0.787 1.00 0.00 C ATOM 1821 O ILE A 118 3.822 -2.660 0.161 1.00 0.00 O ATOM 1822 CB ILE A 118 3.962 -2.866 3.125 1.00 0.00 C ATOM 1823 CG1 ILE A 118 4.160 -2.373 4.564 1.00 0.00 C ATOM 1824 CG2 ILE A 118 4.026 -4.390 3.068 1.00 0.00 C ATOM 1825 CD1 ILE A 118 3.159 -2.945 5.547 1.00 0.00 C ATOM 0 H ILE A 118 4.064 -0.408 1.895 1.00 0.00 H new ATOM 0 HA ILE A 118 6.013 -2.515 2.583 1.00 0.00 H new ATOM 0 HB ILE A 118 2.976 -2.551 2.782 1.00 0.00 H new ATOM 0 HG12 ILE A 118 5.167 -2.632 4.892 1.00 0.00 H new ATOM 0 HG13 ILE A 118 4.090 -1.285 4.579 1.00 0.00 H new ATOM 0 HG21 ILE A 118 3.267 -4.811 3.728 1.00 0.00 H new ATOM 0 HG22 ILE A 118 3.844 -4.724 2.046 1.00 0.00 H new ATOM 0 HG23 ILE A 118 5.012 -4.725 3.389 1.00 0.00 H new ATOM 0 HD11 ILE A 118 3.362 -2.551 6.543 1.00 0.00 H new ATOM 0 HD12 ILE A 118 2.150 -2.664 5.244 1.00 0.00 H new ATOM 0 HD13 ILE A 118 3.244 -4.032 5.562 1.00 0.00 H new ATOM 1837 N ILE A 119 5.913 -3.427 0.288 1.00 0.00 N ATOM 1838 CA ILE A 119 5.883 -4.023 -1.032 1.00 0.00 C ATOM 1839 C ILE A 119 6.030 -5.529 -0.924 1.00 0.00 C ATOM 1840 O ILE A 119 6.986 -6.027 -0.328 1.00 0.00 O ATOM 1841 CB ILE A 119 7.002 -3.464 -1.938 1.00 0.00 C ATOM 1842 CG1 ILE A 119 6.770 -1.975 -2.217 1.00 0.00 C ATOM 1843 CG2 ILE A 119 7.085 -4.248 -3.241 1.00 0.00 C ATOM 1844 CD1 ILE A 119 7.828 -1.347 -3.101 1.00 0.00 C ATOM 0 H ILE A 119 6.800 -3.537 0.780 1.00 0.00 H new ATOM 0 HA ILE A 119 4.923 -3.773 -1.483 1.00 0.00 H new ATOM 0 HB ILE A 119 7.953 -3.574 -1.416 1.00 0.00 H new ATOM 0 HG12 ILE A 119 5.795 -1.851 -2.689 1.00 0.00 H new ATOM 0 HG13 ILE A 119 6.736 -1.438 -1.269 1.00 0.00 H new ATOM 0 HG21 ILE A 119 7.880 -3.837 -3.863 1.00 0.00 H new ATOM 0 HG22 ILE A 119 7.299 -5.294 -3.023 1.00 0.00 H new ATOM 0 HG23 ILE A 119 6.135 -4.175 -3.771 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.596 -0.293 -3.254 1.00 0.00 H new ATOM 0 HD12 ILE A 119 8.803 -1.438 -2.622 1.00 0.00 H new ATOM 0 HD13 ILE A 119 7.847 -1.857 -4.064 1.00 0.00 H new ATOM 1856 N LYS A 120 5.074 -6.254 -1.477 1.00 0.00 N ATOM 1857 CA LYS A 120 5.150 -7.702 -1.494 1.00 0.00 C ATOM 1858 C LYS A 120 5.389 -8.179 -2.921 1.00 0.00 C ATOM 1859 O LYS A 120 4.462 -8.242 -3.729 1.00 0.00 O ATOM 1860 CB LYS A 120 3.872 -8.319 -0.907 1.00 0.00 C ATOM 1861 CG LYS A 120 4.003 -9.792 -0.522 1.00 0.00 C ATOM 1862 CD LYS A 120 3.889 -10.714 -1.726 1.00 0.00 C ATOM 1863 CE LYS A 120 4.140 -12.167 -1.350 1.00 0.00 C ATOM 1864 NZ LYS A 120 5.564 -12.418 -0.999 1.00 0.00 N ATOM 0 H LYS A 120 4.240 -5.865 -1.918 1.00 0.00 H new ATOM 0 HA LYS A 120 5.984 -8.027 -0.872 1.00 0.00 H new ATOM 0 HB2 LYS A 120 3.580 -7.750 -0.024 1.00 0.00 H new ATOM 0 HB3 LYS A 120 3.066 -8.216 -1.634 1.00 0.00 H new ATOM 0 HG2 LYS A 120 4.964 -9.954 -0.033 1.00 0.00 H new ATOM 0 HG3 LYS A 120 3.229 -10.046 0.203 1.00 0.00 H new ATOM 0 HD2 LYS A 120 2.896 -10.618 -2.165 1.00 0.00 H new ATOM 0 HD3 LYS A 120 4.605 -10.407 -2.488 1.00 0.00 H new ATOM 0 HE2 LYS A 120 3.506 -12.437 -0.505 1.00 0.00 H new ATOM 0 HE3 LYS A 120 3.854 -12.811 -2.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 5.726 -13.442 -0.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 6.178 -12.030 -1.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 5.785 -11.957 -0.093 1.00 0.00 H new ATOM 1878 N PRO A 121 6.650 -8.465 -3.260 1.00 0.00 N ATOM 1879 CA PRO A 121 7.013 -9.001 -4.561 1.00 0.00 C ATOM 1880 C PRO A 121 6.941 -10.523 -4.588 1.00 0.00 C ATOM 1881 O PRO A 121 6.580 -11.160 -3.590 1.00 0.00 O ATOM 1882 CB PRO A 121 8.451 -8.522 -4.721 1.00 0.00 C ATOM 1883 CG PRO A 121 9.000 -8.527 -3.337 1.00 0.00 C ATOM 1884 CD PRO A 121 7.837 -8.260 -2.410 1.00 0.00 C ATOM 0 HA PRO A 121 6.346 -8.675 -5.359 1.00 0.00 H new ATOM 0 HB2 PRO A 121 9.019 -9.182 -5.376 1.00 0.00 H new ATOM 0 HB3 PRO A 121 8.491 -7.525 -5.161 1.00 0.00 H new ATOM 0 HG2 PRO A 121 9.465 -9.486 -3.108 1.00 0.00 H new ATOM 0 HG3 PRO A 121 9.770 -7.764 -3.223 1.00 0.00 H new ATOM 0 HD2 PRO A 121 7.841 -8.941 -1.559 1.00 0.00 H new ATOM 0 HD3 PRO A 121 7.871 -7.247 -2.009 1.00 0.00 H new ATOM 1892 N LEU A 122 7.291 -11.100 -5.722 1.00 0.00 N ATOM 1893 CA LEU A 122 7.244 -12.538 -5.888 1.00 0.00 C ATOM 1894 C LEU A 122 8.654 -13.110 -5.927 1.00 0.00 C ATOM 1895 O LEU A 122 9.627 -12.372 -6.062 1.00 0.00 O ATOM 1896 CB LEU A 122 6.487 -12.911 -7.169 1.00 0.00 C ATOM 1897 CG LEU A 122 4.957 -12.793 -7.100 1.00 0.00 C ATOM 1898 CD1 LEU A 122 4.510 -11.338 -7.127 1.00 0.00 C ATOM 1899 CD2 LEU A 122 4.311 -13.570 -8.238 1.00 0.00 C ATOM 0 H LEU A 122 7.612 -10.591 -6.545 1.00 0.00 H new ATOM 0 HA LEU A 122 6.713 -12.965 -5.037 1.00 0.00 H new ATOM 0 HB2 LEU A 122 6.845 -12.275 -7.978 1.00 0.00 H new ATOM 0 HB3 LEU A 122 6.742 -13.937 -7.433 1.00 0.00 H new ATOM 0 HG LEU A 122 4.632 -13.224 -6.153 1.00 0.00 H new ATOM 0 HD11 LEU A 122 3.422 -11.291 -7.077 1.00 0.00 H new ATOM 0 HD12 LEU A 122 4.936 -10.811 -6.274 1.00 0.00 H new ATOM 0 HD13 LEU A 122 4.851 -10.870 -8.050 1.00 0.00 H new ATOM 0 HD21 LEU A 122 3.227 -13.476 -8.174 1.00 0.00 H new ATOM 0 HD22 LEU A 122 4.654 -13.170 -9.192 1.00 0.00 H new ATOM 0 HD23 LEU A 122 4.589 -14.621 -8.164 1.00 0.00 H new ATOM 1911 N THR A 123 8.760 -14.423 -5.806 1.00 0.00 N ATOM 1912 CA THR A 123 10.050 -15.092 -5.846 1.00 0.00 C ATOM 1913 C THR A 123 10.707 -14.918 -7.214 1.00 0.00 C ATOM 1914 O THR A 123 10.214 -15.423 -8.221 1.00 0.00 O ATOM 1915 CB THR A 123 9.890 -16.587 -5.525 1.00 0.00 C ATOM 1916 OG1 THR A 123 9.140 -16.736 -4.310 1.00 0.00 O ATOM 1917 CG2 THR A 123 11.244 -17.261 -5.371 1.00 0.00 C ATOM 0 H THR A 123 7.965 -15.049 -5.679 1.00 0.00 H new ATOM 0 HA THR A 123 10.692 -14.636 -5.092 1.00 0.00 H new ATOM 0 HB THR A 123 9.362 -17.063 -6.351 1.00 0.00 H new ATOM 0 HG1 THR A 123 9.583 -16.241 -3.589 1.00 0.00 H new ATOM 0 HG21 THR A 123 11.101 -18.318 -5.144 1.00 0.00 H new ATOM 0 HG22 THR A 123 11.807 -17.162 -6.299 1.00 0.00 H new ATOM 0 HG23 THR A 123 11.796 -16.787 -4.559 1.00 0.00 H new ATOM 1925 N GLY A 124 11.801 -14.164 -7.247 1.00 0.00 N ATOM 1926 CA GLY A 124 12.469 -13.873 -8.501 1.00 0.00 C ATOM 1927 C GLY A 124 11.952 -12.589 -9.115 1.00 0.00 C ATOM 1928 O GLY A 124 12.692 -11.849 -9.768 1.00 0.00 O ATOM 0 H GLY A 124 12.238 -13.748 -6.424 1.00 0.00 H new ATOM 0 HA2 GLY A 124 13.543 -13.792 -8.333 1.00 0.00 H new ATOM 0 HA3 GLY A 124 12.317 -14.698 -9.197 1.00 0.00 H new ATOM 1932 N GLU A 125 10.673 -12.330 -8.887 1.00 0.00 N ATOM 1933 CA GLU A 125 10.027 -11.107 -9.329 1.00 0.00 C ATOM 1934 C GLU A 125 10.119 -10.078 -8.203 1.00 0.00 C ATOM 1935 O GLU A 125 9.147 -9.810 -7.493 1.00 0.00 O ATOM 1936 CB GLU A 125 8.576 -11.420 -9.709 1.00 0.00 C ATOM 1937 CG GLU A 125 7.816 -10.272 -10.347 1.00 0.00 C ATOM 1938 CD GLU A 125 6.651 -10.767 -11.180 1.00 0.00 C ATOM 1939 OE1 GLU A 125 5.585 -11.082 -10.609 1.00 0.00 O ATOM 1940 OE2 GLU A 125 6.800 -10.867 -12.416 1.00 0.00 O ATOM 0 H GLU A 125 10.052 -12.967 -8.387 1.00 0.00 H new ATOM 0 HA GLU A 125 10.518 -10.693 -10.210 1.00 0.00 H new ATOM 0 HB2 GLU A 125 8.571 -12.265 -10.397 1.00 0.00 H new ATOM 0 HB3 GLU A 125 8.042 -11.735 -8.813 1.00 0.00 H new ATOM 0 HG2 GLU A 125 7.449 -9.602 -9.570 1.00 0.00 H new ATOM 0 HG3 GLU A 125 8.492 -9.692 -10.975 1.00 0.00 H new ATOM 1947 N ASP A 126 11.318 -9.536 -8.042 1.00 0.00 N ATOM 1948 CA ASP A 126 11.681 -8.758 -6.859 1.00 0.00 C ATOM 1949 C ASP A 126 11.927 -7.290 -7.223 1.00 0.00 C ATOM 1950 O ASP A 126 11.770 -6.892 -8.380 1.00 0.00 O ATOM 1951 CB ASP A 126 12.941 -9.396 -6.237 1.00 0.00 C ATOM 1952 CG ASP A 126 13.383 -8.760 -4.932 1.00 0.00 C ATOM 1953 OD1 ASP A 126 12.847 -9.126 -3.874 1.00 0.00 O ATOM 1954 OD2 ASP A 126 14.276 -7.884 -4.968 1.00 0.00 O ATOM 0 H ASP A 126 12.069 -9.622 -8.727 1.00 0.00 H new ATOM 0 HA ASP A 126 10.864 -8.772 -6.137 1.00 0.00 H new ATOM 0 HB2 ASP A 126 12.751 -10.455 -6.065 1.00 0.00 H new ATOM 0 HB3 ASP A 126 13.759 -9.331 -6.955 1.00 0.00 H new ATOM 1959 N ILE A 127 12.295 -6.488 -6.228 1.00 0.00 N ATOM 1960 CA ILE A 127 12.641 -5.089 -6.438 1.00 0.00 C ATOM 1961 C ILE A 127 13.986 -4.998 -7.157 1.00 0.00 C ATOM 1962 O ILE A 127 14.256 -4.035 -7.880 1.00 0.00 O ATOM 1963 CB ILE A 127 12.732 -4.324 -5.093 1.00 0.00 C ATOM 1964 CG1 ILE A 127 11.651 -4.809 -4.124 1.00 0.00 C ATOM 1965 CG2 ILE A 127 12.592 -2.827 -5.322 1.00 0.00 C ATOM 1966 CD1 ILE A 127 11.736 -4.182 -2.748 1.00 0.00 C ATOM 0 H ILE A 127 12.361 -6.790 -5.256 1.00 0.00 H new ATOM 0 HA ILE A 127 11.857 -4.634 -7.043 1.00 0.00 H new ATOM 0 HB ILE A 127 13.710 -4.522 -4.654 1.00 0.00 H new ATOM 0 HG12 ILE A 127 10.671 -4.594 -4.551 1.00 0.00 H new ATOM 0 HG13 ILE A 127 11.725 -5.892 -4.025 1.00 0.00 H new ATOM 0 HG21 ILE A 127 12.658 -2.305 -4.367 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.390 -2.483 -5.980 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.627 -2.618 -5.783 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.937 -4.575 -2.119 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.701 -4.418 -2.300 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.631 -3.100 -2.834 1.00 0.00 H new ATOM 2047 N LYS A 132 17.249 0.191 0.439 1.00 0.00 N ATOM 2048 CA LYS A 132 16.341 1.009 1.235 1.00 0.00 C ATOM 2049 C LYS A 132 15.374 0.163 2.054 1.00 0.00 C ATOM 2050 O LYS A 132 15.220 0.372 3.256 1.00 0.00 O ATOM 2051 CB LYS A 132 15.549 1.945 0.319 1.00 0.00 C ATOM 2052 CG LYS A 132 16.142 3.337 0.193 1.00 0.00 C ATOM 2053 CD LYS A 132 15.934 4.141 1.465 1.00 0.00 C ATOM 2054 CE LYS A 132 16.436 5.566 1.311 1.00 0.00 C ATOM 2055 NZ LYS A 132 16.118 6.402 2.499 1.00 0.00 N ATOM 0 HA LYS A 132 16.948 1.588 1.931 1.00 0.00 H new ATOM 0 HB2 LYS A 132 15.486 1.497 -0.673 1.00 0.00 H new ATOM 0 HB3 LYS A 132 14.530 2.029 0.696 1.00 0.00 H new ATOM 0 HG2 LYS A 132 17.208 3.263 -0.023 1.00 0.00 H new ATOM 0 HG3 LYS A 132 15.682 3.856 -0.648 1.00 0.00 H new ATOM 0 HD2 LYS A 132 14.874 4.153 1.720 1.00 0.00 H new ATOM 0 HD3 LYS A 132 16.455 3.658 2.291 1.00 0.00 H new ATOM 0 HE2 LYS A 132 17.515 5.555 1.154 1.00 0.00 H new ATOM 0 HE3 LYS A 132 15.989 6.013 0.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 16.210 7.408 2.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 15.144 6.209 2.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 16.778 6.174 3.270 1.00 0.00 H new ATOM 2069 N MET A 133 14.725 -0.787 1.400 1.00 0.00 N ATOM 2070 CA MET A 133 13.674 -1.561 2.045 1.00 0.00 C ATOM 2071 C MET A 133 14.235 -2.779 2.762 1.00 0.00 C ATOM 2072 O MET A 133 15.292 -3.303 2.399 1.00 0.00 O ATOM 2073 CB MET A 133 12.616 -1.986 1.026 1.00 0.00 C ATOM 2074 CG MET A 133 11.989 -0.808 0.304 1.00 0.00 C ATOM 2075 SD MET A 133 10.579 -1.273 -0.709 1.00 0.00 S ATOM 2076 CE MET A 133 9.348 -1.569 0.554 1.00 0.00 C ATOM 0 H MET A 133 14.905 -1.040 0.429 1.00 0.00 H new ATOM 0 HA MET A 133 13.207 -0.920 2.792 1.00 0.00 H new ATOM 0 HB2 MET A 133 13.070 -2.655 0.295 1.00 0.00 H new ATOM 0 HB3 MET A 133 11.835 -2.552 1.534 1.00 0.00 H new ATOM 0 HG2 MET A 133 11.673 -0.066 1.037 1.00 0.00 H new ATOM 0 HG3 MET A 133 12.741 -0.333 -0.326 1.00 0.00 H new ATOM 0 HE1 MET A 133 9.186 -2.642 0.659 1.00 0.00 H new ATOM 0 HE2 MET A 133 9.694 -1.159 1.503 1.00 0.00 H new ATOM 0 HE3 MET A 133 8.413 -1.087 0.271 1.00 0.00 H new ATOM 2086 N LYS A 134 13.510 -3.219 3.774 1.00 0.00 N ATOM 2087 CA LYS A 134 13.921 -4.337 4.609 1.00 0.00 C ATOM 2088 C LYS A 134 12.987 -5.524 4.404 1.00 0.00 C ATOM 2089 O LYS A 134 11.780 -5.354 4.228 1.00 0.00 O ATOM 2090 CB LYS A 134 13.918 -3.912 6.081 1.00 0.00 C ATOM 2091 CG LYS A 134 12.676 -3.121 6.460 1.00 0.00 C ATOM 2092 CD LYS A 134 12.590 -2.839 7.946 1.00 0.00 C ATOM 2093 CE LYS A 134 12.395 -4.115 8.743 1.00 0.00 C ATOM 2094 NZ LYS A 134 11.774 -3.847 10.063 1.00 0.00 N ATOM 0 H LYS A 134 12.615 -2.810 4.043 1.00 0.00 H new ATOM 0 HA LYS A 134 14.930 -4.637 4.325 1.00 0.00 H new ATOM 0 HB2 LYS A 134 13.986 -4.799 6.711 1.00 0.00 H new ATOM 0 HB3 LYS A 134 14.803 -3.309 6.283 1.00 0.00 H new ATOM 0 HG2 LYS A 134 12.672 -2.177 5.915 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.790 -3.673 6.148 1.00 0.00 H new ATOM 0 HD2 LYS A 134 13.500 -2.338 8.276 1.00 0.00 H new ATOM 0 HD3 LYS A 134 11.762 -2.157 8.141 1.00 0.00 H new ATOM 0 HE2 LYS A 134 11.767 -4.804 8.179 1.00 0.00 H new ATOM 0 HE3 LYS A 134 13.358 -4.605 8.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 12.098 -4.558 10.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 12.050 -2.899 10.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 10.739 -3.896 9.976 1.00 0.00 H new ATOM 2108 N LEU A 135 13.552 -6.720 4.420 1.00 0.00 N ATOM 2109 CA LEU A 135 12.779 -7.940 4.236 1.00 0.00 C ATOM 2110 C LEU A 135 12.170 -8.389 5.560 1.00 0.00 C ATOM 2111 O LEU A 135 12.879 -8.606 6.542 1.00 0.00 O ATOM 2112 CB LEU A 135 13.662 -9.051 3.663 1.00 0.00 C ATOM 2113 CG LEU A 135 12.936 -10.360 3.334 1.00 0.00 C ATOM 2114 CD1 LEU A 135 11.935 -10.148 2.209 1.00 0.00 C ATOM 2115 CD2 LEU A 135 13.936 -11.442 2.963 1.00 0.00 C ATOM 0 H LEU A 135 14.551 -6.874 4.560 1.00 0.00 H new ATOM 0 HA LEU A 135 11.974 -7.733 3.531 1.00 0.00 H new ATOM 0 HB2 LEU A 135 14.139 -8.681 2.755 1.00 0.00 H new ATOM 0 HB3 LEU A 135 14.457 -9.265 4.377 1.00 0.00 H new ATOM 0 HG LEU A 135 12.390 -10.684 4.220 1.00 0.00 H new ATOM 0 HD11 LEU A 135 11.430 -11.089 1.990 1.00 0.00 H new ATOM 0 HD12 LEU A 135 11.199 -9.403 2.512 1.00 0.00 H new ATOM 0 HD13 LEU A 135 12.458 -9.800 1.318 1.00 0.00 H new ATOM 0 HD21 LEU A 135 13.404 -12.365 2.732 1.00 0.00 H new ATOM 0 HD22 LEU A 135 14.508 -11.125 2.091 1.00 0.00 H new ATOM 0 HD23 LEU A 135 14.614 -11.613 3.799 1.00 0.00 H new ATOM 2127 N VAL A 136 10.857 -8.525 5.579 1.00 0.00 N ATOM 2128 CA VAL A 136 10.140 -8.936 6.774 1.00 0.00 C ATOM 2129 C VAL A 136 9.341 -10.207 6.519 1.00 0.00 C ATOM 2130 O VAL A 136 8.833 -10.423 5.419 1.00 0.00 O ATOM 2131 CB VAL A 136 9.175 -7.838 7.274 1.00 0.00 C ATOM 2132 CG1 VAL A 136 9.743 -7.129 8.490 1.00 0.00 C ATOM 2133 CG2 VAL A 136 8.873 -6.831 6.173 1.00 0.00 C ATOM 0 H VAL A 136 10.259 -8.355 4.771 1.00 0.00 H new ATOM 0 HA VAL A 136 10.894 -9.119 7.540 1.00 0.00 H new ATOM 0 HB VAL A 136 8.243 -8.325 7.560 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.045 -6.361 8.822 1.00 0.00 H new ATOM 0 HG12 VAL A 136 9.898 -7.850 9.292 1.00 0.00 H new ATOM 0 HG13 VAL A 136 10.695 -6.666 8.230 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.192 -6.070 6.553 1.00 0.00 H new ATOM 0 HG22 VAL A 136 9.800 -6.358 5.848 1.00 0.00 H new ATOM 0 HG23 VAL A 136 8.411 -7.343 5.329 1.00 0.00 H new ATOM 2143 N ASN A 137 9.259 -11.057 7.532 1.00 0.00 N ATOM 2144 CA ASN A 137 8.439 -12.261 7.465 1.00 0.00 C ATOM 2145 C ASN A 137 7.257 -12.124 8.411 1.00 0.00 C ATOM 2146 O ASN A 137 7.428 -11.747 9.572 1.00 0.00 O ATOM 2147 CB ASN A 137 9.242 -13.515 7.848 1.00 0.00 C ATOM 2148 CG ASN A 137 10.166 -14.020 6.749 1.00 0.00 C ATOM 2149 OD1 ASN A 137 10.375 -15.225 6.619 1.00 0.00 O ATOM 2150 ND2 ASN A 137 10.735 -13.119 5.965 1.00 0.00 N ATOM 0 H ASN A 137 9.753 -10.935 8.416 1.00 0.00 H new ATOM 0 HA ASN A 137 8.095 -12.373 6.437 1.00 0.00 H new ATOM 0 HB2 ASN A 137 9.836 -13.296 8.735 1.00 0.00 H new ATOM 0 HB3 ASN A 137 8.547 -14.310 8.118 1.00 0.00 H new ATOM 0 HD21 ASN A 137 11.370 -13.416 5.224 1.00 0.00 H new ATOM 0 HD22 ASN A 137 10.539 -12.127 6.101 1.00 0.00 H new ATOM 2157 N TYR A 138 6.064 -12.400 7.914 1.00 0.00 N ATOM 2158 CA TYR A 138 4.875 -12.382 8.753 1.00 0.00 C ATOM 2159 C TYR A 138 3.869 -13.403 8.251 1.00 0.00 C ATOM 2160 O TYR A 138 3.305 -13.249 7.170 1.00 0.00 O ATOM 2161 CB TYR A 138 4.244 -10.985 8.785 1.00 0.00 C ATOM 2162 CG TYR A 138 3.088 -10.860 9.758 1.00 0.00 C ATOM 2163 CD1 TYR A 138 3.307 -10.482 11.078 1.00 0.00 C ATOM 2164 CD2 TYR A 138 1.782 -11.113 9.359 1.00 0.00 C ATOM 2165 CE1 TYR A 138 2.259 -10.363 11.969 1.00 0.00 C ATOM 2166 CE2 TYR A 138 0.728 -10.995 10.245 1.00 0.00 C ATOM 2167 CZ TYR A 138 0.973 -10.619 11.549 1.00 0.00 C ATOM 2168 OH TYR A 138 -0.072 -10.502 12.438 1.00 0.00 O ATOM 0 H TYR A 138 5.891 -12.639 6.937 1.00 0.00 H new ATOM 0 HA TYR A 138 5.170 -12.642 9.770 1.00 0.00 H new ATOM 0 HB2 TYR A 138 5.010 -10.256 9.049 1.00 0.00 H new ATOM 0 HB3 TYR A 138 3.894 -10.731 7.784 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.314 -10.278 11.412 1.00 0.00 H new ATOM 0 HD2 TYR A 138 1.587 -11.407 8.338 1.00 0.00 H new ATOM 0 HE1 TYR A 138 2.447 -10.070 12.991 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -0.282 -11.196 9.918 1.00 0.00 H new ATOM 0 HH TYR A 138 -0.914 -10.716 11.984 1.00 0.00 H new ATOM 2178 N GLY A 139 3.661 -14.447 9.034 1.00 0.00 N ATOM 2179 CA GLY A 139 2.721 -15.478 8.655 1.00 0.00 C ATOM 2180 C GLY A 139 3.214 -16.290 7.479 1.00 0.00 C ATOM 2181 O GLY A 139 2.490 -16.475 6.501 1.00 0.00 O ATOM 0 H GLY A 139 4.128 -14.600 9.928 1.00 0.00 H new ATOM 0 HA2 GLY A 139 2.546 -16.139 9.504 1.00 0.00 H new ATOM 0 HA3 GLY A 139 1.764 -15.021 8.404 1.00 0.00 H new ATOM 2185 N ARG A 140 4.466 -16.749 7.574 1.00 0.00 N ATOM 2186 CA ARG A 140 5.101 -17.599 6.561 1.00 0.00 C ATOM 2187 C ARG A 140 5.533 -16.801 5.331 1.00 0.00 C ATOM 2188 O ARG A 140 6.615 -17.029 4.784 1.00 0.00 O ATOM 2189 CB ARG A 140 4.176 -18.745 6.143 1.00 0.00 C ATOM 2190 CG ARG A 140 3.741 -19.637 7.290 1.00 0.00 C ATOM 2191 CD ARG A 140 4.918 -20.349 7.924 1.00 0.00 C ATOM 2192 NE ARG A 140 5.559 -21.284 6.999 1.00 0.00 N ATOM 2193 CZ ARG A 140 5.553 -22.605 7.162 1.00 0.00 C ATOM 2194 NH1 ARG A 140 4.893 -23.147 8.178 1.00 0.00 N ATOM 2195 NH2 ARG A 140 6.192 -23.385 6.300 1.00 0.00 N ATOM 0 H ARG A 140 5.074 -16.539 8.365 1.00 0.00 H new ATOM 0 HA ARG A 140 5.996 -18.018 7.020 1.00 0.00 H new ATOM 0 HB2 ARG A 140 3.290 -18.327 5.665 1.00 0.00 H new ATOM 0 HB3 ARG A 140 4.684 -19.354 5.395 1.00 0.00 H new ATOM 0 HG2 ARG A 140 3.230 -19.038 8.043 1.00 0.00 H new ATOM 0 HG3 ARG A 140 3.023 -20.373 6.927 1.00 0.00 H new ATOM 0 HD2 ARG A 140 5.649 -19.613 8.259 1.00 0.00 H new ATOM 0 HD3 ARG A 140 4.581 -20.889 8.809 1.00 0.00 H new ATOM 0 HE ARG A 140 6.037 -20.902 6.183 1.00 0.00 H new ATOM 0 HH11 ARG A 140 4.390 -22.551 8.835 1.00 0.00 H new ATOM 0 HH12 ARG A 140 4.889 -24.159 8.302 1.00 0.00 H new ATOM 0 HH21 ARG A 140 6.689 -22.973 5.511 1.00 0.00 H new ATOM 0 HH22 ARG A 140 6.186 -24.397 6.427 1.00 0.00 H new ATOM 2209 N THR A 141 4.699 -15.867 4.903 1.00 0.00 N ATOM 2210 CA THR A 141 4.984 -15.077 3.718 1.00 0.00 C ATOM 2211 C THR A 141 6.026 -14.002 4.025 1.00 0.00 C ATOM 2212 O THR A 141 6.103 -13.486 5.147 1.00 0.00 O ATOM 2213 CB THR A 141 3.699 -14.437 3.134 1.00 0.00 C ATOM 2214 OG1 THR A 141 3.964 -13.864 1.845 1.00 0.00 O ATOM 2215 CG2 THR A 141 3.136 -13.363 4.056 1.00 0.00 C ATOM 0 H THR A 141 3.817 -15.638 5.361 1.00 0.00 H new ATOM 0 HA THR A 141 5.389 -15.752 2.964 1.00 0.00 H new ATOM 0 HB THR A 141 2.959 -15.231 3.037 1.00 0.00 H new ATOM 0 HG1 THR A 141 3.142 -13.466 1.489 1.00 0.00 H new ATOM 0 HG21 THR A 141 2.236 -12.938 3.612 1.00 0.00 H new ATOM 0 HG22 THR A 141 2.891 -13.805 5.022 1.00 0.00 H new ATOM 0 HG23 THR A 141 3.878 -12.577 4.195 1.00 0.00 H new ATOM 2223 N TYR A 142 6.848 -13.692 3.035 1.00 0.00 N ATOM 2224 CA TYR A 142 7.869 -12.675 3.196 1.00 0.00 C ATOM 2225 C TYR A 142 7.630 -11.514 2.241 1.00 0.00 C ATOM 2226 O TYR A 142 7.180 -11.702 1.105 1.00 0.00 O ATOM 2227 CB TYR A 142 9.279 -13.261 3.012 1.00 0.00 C ATOM 2228 CG TYR A 142 9.590 -13.792 1.626 1.00 0.00 C ATOM 2229 CD1 TYR A 142 9.229 -15.078 1.252 1.00 0.00 C ATOM 2230 CD2 TYR A 142 10.278 -13.010 0.703 1.00 0.00 C ATOM 2231 CE1 TYR A 142 9.537 -15.570 -0.003 1.00 0.00 C ATOM 2232 CE2 TYR A 142 10.585 -13.492 -0.555 1.00 0.00 C ATOM 2233 CZ TYR A 142 10.215 -14.775 -0.903 1.00 0.00 C ATOM 2234 OH TYR A 142 10.533 -15.266 -2.152 1.00 0.00 O ATOM 0 H TYR A 142 6.827 -14.130 2.114 1.00 0.00 H new ATOM 0 HA TYR A 142 7.803 -12.295 4.216 1.00 0.00 H new ATOM 0 HB2 TYR A 142 10.009 -12.490 3.259 1.00 0.00 H new ATOM 0 HB3 TYR A 142 9.414 -14.069 3.730 1.00 0.00 H new ATOM 0 HD1 TYR A 142 8.698 -15.706 1.953 1.00 0.00 H new ATOM 0 HD2 TYR A 142 10.577 -12.009 0.975 1.00 0.00 H new ATOM 0 HE1 TYR A 142 9.248 -16.574 -0.277 1.00 0.00 H new ATOM 0 HE2 TYR A 142 11.112 -12.868 -1.262 1.00 0.00 H new ATOM 0 HH TYR A 142 11.009 -14.578 -2.663 1.00 0.00 H new ATOM 2244 N PHE A 143 7.910 -10.316 2.719 1.00 0.00 N ATOM 2245 CA PHE A 143 7.706 -9.103 1.945 1.00 0.00 C ATOM 2246 C PHE A 143 8.682 -8.028 2.406 1.00 0.00 C ATOM 2247 O PHE A 143 9.483 -8.261 3.307 1.00 0.00 O ATOM 2248 CB PHE A 143 6.258 -8.615 2.088 1.00 0.00 C ATOM 2249 CG PHE A 143 5.738 -8.671 3.495 1.00 0.00 C ATOM 2250 CD1 PHE A 143 6.029 -7.665 4.398 1.00 0.00 C ATOM 2251 CD2 PHE A 143 4.968 -9.744 3.916 1.00 0.00 C ATOM 2252 CE1 PHE A 143 5.559 -7.722 5.695 1.00 0.00 C ATOM 2253 CE2 PHE A 143 4.493 -9.808 5.211 1.00 0.00 C ATOM 2254 CZ PHE A 143 4.792 -8.797 6.103 1.00 0.00 C ATOM 0 H PHE A 143 8.285 -10.155 3.654 1.00 0.00 H new ATOM 0 HA PHE A 143 7.890 -9.317 0.892 1.00 0.00 H new ATOM 0 HB2 PHE A 143 6.193 -7.589 1.727 1.00 0.00 H new ATOM 0 HB3 PHE A 143 5.615 -9.220 1.448 1.00 0.00 H new ATOM 0 HD1 PHE A 143 6.631 -6.825 4.085 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.737 -10.539 3.223 1.00 0.00 H new ATOM 0 HE1 PHE A 143 5.790 -6.928 6.390 1.00 0.00 H new ATOM 0 HE2 PHE A 143 3.889 -10.646 5.525 1.00 0.00 H new ATOM 0 HZ PHE A 143 4.427 -8.846 7.118 1.00 0.00 H new ATOM 2264 N TYR A 144 8.622 -6.861 1.790 1.00 0.00 N ATOM 2265 CA TYR A 144 9.513 -5.770 2.154 1.00 0.00 C ATOM 2266 C TYR A 144 8.726 -4.607 2.727 1.00 0.00 C ATOM 2267 O TYR A 144 7.663 -4.256 2.216 1.00 0.00 O ATOM 2268 CB TYR A 144 10.307 -5.285 0.938 1.00 0.00 C ATOM 2269 CG TYR A 144 11.239 -6.315 0.348 1.00 0.00 C ATOM 2270 CD1 TYR A 144 10.774 -7.264 -0.550 1.00 0.00 C ATOM 2271 CD2 TYR A 144 12.589 -6.325 0.675 1.00 0.00 C ATOM 2272 CE1 TYR A 144 11.625 -8.196 -1.106 1.00 0.00 C ATOM 2273 CE2 TYR A 144 13.447 -7.257 0.124 1.00 0.00 C ATOM 2274 CZ TYR A 144 12.959 -8.190 -0.769 1.00 0.00 C ATOM 2275 OH TYR A 144 13.805 -9.114 -1.336 1.00 0.00 O ATOM 0 H TYR A 144 7.969 -6.643 1.038 1.00 0.00 H new ATOM 0 HA TYR A 144 10.205 -6.147 2.907 1.00 0.00 H new ATOM 0 HB2 TYR A 144 9.607 -4.963 0.167 1.00 0.00 H new ATOM 0 HB3 TYR A 144 10.889 -4.409 1.226 1.00 0.00 H new ATOM 0 HD1 TYR A 144 9.728 -7.273 -0.818 1.00 0.00 H new ATOM 0 HD2 TYR A 144 12.973 -5.593 1.370 1.00 0.00 H new ATOM 0 HE1 TYR A 144 11.246 -8.928 -1.804 1.00 0.00 H new ATOM 0 HE2 TYR A 144 14.494 -7.256 0.390 1.00 0.00 H new ATOM 0 HH TYR A 144 13.471 -9.363 -2.223 1.00 0.00 H new ATOM 2285 N GLU A 145 9.244 -4.010 3.783 1.00 0.00 N ATOM 2286 CA GLU A 145 8.643 -2.807 4.330 1.00 0.00 C ATOM 2287 C GLU A 145 9.687 -1.701 4.370 1.00 0.00 C ATOM 2288 O GLU A 145 10.888 -1.966 4.294 1.00 0.00 O ATOM 2289 CB GLU A 145 8.057 -3.047 5.733 1.00 0.00 C ATOM 2290 CG GLU A 145 9.097 -3.146 6.840 1.00 0.00 C ATOM 2291 CD GLU A 145 8.483 -3.312 8.218 1.00 0.00 C ATOM 2292 OE1 GLU A 145 7.257 -3.105 8.360 1.00 0.00 O ATOM 2293 OE2 GLU A 145 9.229 -3.637 9.172 1.00 0.00 O ATOM 0 H GLU A 145 10.075 -4.335 4.278 1.00 0.00 H new ATOM 0 HA GLU A 145 7.816 -2.511 3.685 1.00 0.00 H new ATOM 0 HB2 GLU A 145 7.368 -2.236 5.970 1.00 0.00 H new ATOM 0 HB3 GLU A 145 7.472 -3.967 5.717 1.00 0.00 H new ATOM 0 HG2 GLU A 145 9.756 -3.991 6.638 1.00 0.00 H new ATOM 0 HG3 GLU A 145 9.717 -2.249 6.830 1.00 0.00 H new ATOM 2300 N TYR A 146 9.230 -0.468 4.447 1.00 0.00 N ATOM 2301 CA TYR A 146 10.120 0.668 4.561 1.00 0.00 C ATOM 2302 C TYR A 146 9.531 1.708 5.491 1.00 0.00 C ATOM 2303 O TYR A 146 8.393 2.147 5.315 1.00 0.00 O ATOM 2304 CB TYR A 146 10.394 1.295 3.190 1.00 0.00 C ATOM 2305 CG TYR A 146 11.204 2.573 3.271 1.00 0.00 C ATOM 2306 CD1 TYR A 146 12.487 2.566 3.798 1.00 0.00 C ATOM 2307 CD2 TYR A 146 10.683 3.782 2.828 1.00 0.00 C ATOM 2308 CE1 TYR A 146 13.230 3.727 3.884 1.00 0.00 C ATOM 2309 CE2 TYR A 146 11.420 4.951 2.909 1.00 0.00 C ATOM 2310 CZ TYR A 146 12.694 4.918 3.438 1.00 0.00 C ATOM 2311 OH TYR A 146 13.438 6.076 3.515 1.00 0.00 O ATOM 0 H TYR A 146 8.239 -0.227 4.432 1.00 0.00 H new ATOM 0 HA TYR A 146 11.064 0.312 4.972 1.00 0.00 H new ATOM 0 HB2 TYR A 146 10.925 0.575 2.567 1.00 0.00 H new ATOM 0 HB3 TYR A 146 9.445 1.504 2.697 1.00 0.00 H new ATOM 0 HD1 TYR A 146 12.912 1.637 4.147 1.00 0.00 H new ATOM 0 HD2 TYR A 146 9.686 3.810 2.413 1.00 0.00 H new ATOM 0 HE1 TYR A 146 14.227 3.703 4.299 1.00 0.00 H new ATOM 0 HE2 TYR A 146 11.000 5.883 2.560 1.00 0.00 H new ATOM 0 HH TYR A 146 12.916 6.825 3.159 1.00 0.00 H new ATOM 2321 N ILE A 147 10.309 2.094 6.483 1.00 0.00 N ATOM 2322 CA ILE A 147 9.898 3.132 7.402 1.00 0.00 C ATOM 2323 C ILE A 147 10.409 4.474 6.908 1.00 0.00 C ATOM 2324 O ILE A 147 11.613 4.741 6.919 1.00 0.00 O ATOM 2325 CB ILE A 147 10.396 2.875 8.847 1.00 0.00 C ATOM 2326 CG1 ILE A 147 9.585 1.755 9.521 1.00 0.00 C ATOM 2327 CG2 ILE A 147 10.319 4.149 9.681 1.00 0.00 C ATOM 2328 CD1 ILE A 147 9.824 0.372 8.950 1.00 0.00 C ATOM 0 H ILE A 147 11.232 1.702 6.672 1.00 0.00 H new ATOM 0 HA ILE A 147 8.808 3.132 7.435 1.00 0.00 H new ATOM 0 HB ILE A 147 11.437 2.558 8.786 1.00 0.00 H new ATOM 0 HG12 ILE A 147 9.824 1.741 10.584 1.00 0.00 H new ATOM 0 HG13 ILE A 147 8.524 1.991 9.436 1.00 0.00 H new ATOM 0 HG21 ILE A 147 10.673 3.945 10.691 1.00 0.00 H new ATOM 0 HG22 ILE A 147 10.942 4.919 9.227 1.00 0.00 H new ATOM 0 HG23 ILE A 147 9.286 4.495 9.722 1.00 0.00 H new ATOM 0 HD11 ILE A 147 9.211 -0.353 9.485 1.00 0.00 H new ATOM 0 HD12 ILE A 147 9.557 0.363 7.893 1.00 0.00 H new ATOM 0 HD13 ILE A 147 10.876 0.110 9.060 1.00 0.00 H new ATOM 2340 N ALA A 148 9.494 5.291 6.423 1.00 0.00 N ATOM 2341 CA ALA A 148 9.829 6.627 5.991 1.00 0.00 C ATOM 2342 C ALA A 148 10.150 7.498 7.189 1.00 0.00 C ATOM 2343 O ALA A 148 9.393 7.532 8.163 1.00 0.00 O ATOM 2344 CB ALA A 148 8.686 7.220 5.195 1.00 0.00 C ATOM 0 H ALA A 148 8.509 5.048 6.319 1.00 0.00 H new ATOM 0 HA ALA A 148 10.710 6.581 5.350 1.00 0.00 H new ATOM 0 HB1 ALA A 148 8.950 8.228 4.875 1.00 0.00 H new ATOM 0 HB2 ALA A 148 8.492 6.600 4.320 1.00 0.00 H new ATOM 0 HB3 ALA A 148 7.792 7.260 5.817 1.00 0.00 H new ATOM 2350 N GLU A 149 11.287 8.168 7.126 1.00 0.00 N ATOM 2351 CA GLU A 149 11.697 9.077 8.182 1.00 0.00 C ATOM 2352 C GLU A 149 10.744 10.248 8.304 1.00 0.00 C ATOM 2353 O GLU A 149 9.908 10.498 7.433 1.00 0.00 O ATOM 2354 CB GLU A 149 13.104 9.614 7.939 1.00 0.00 C ATOM 2355 CG GLU A 149 14.204 8.668 8.370 1.00 0.00 C ATOM 2356 CD GLU A 149 14.150 8.339 9.846 1.00 0.00 C ATOM 2357 OE1 GLU A 149 14.639 9.149 10.659 1.00 0.00 O ATOM 2358 OE2 GLU A 149 13.624 7.266 10.201 1.00 0.00 O ATOM 0 H GLU A 149 11.946 8.099 6.350 1.00 0.00 H new ATOM 0 HA GLU A 149 11.684 8.503 9.109 1.00 0.00 H new ATOM 0 HB2 GLU A 149 13.221 9.832 6.877 1.00 0.00 H new ATOM 0 HB3 GLU A 149 13.220 10.557 8.473 1.00 0.00 H new ATOM 0 HG2 GLU A 149 14.130 7.746 7.794 1.00 0.00 H new ATOM 0 HG3 GLU A 149 15.171 9.113 8.137 1.00 0.00 H new