USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 769 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 120 MET CE :methyl -126:sc= -3.31 (180deg=-0.325) USER MOD Set 1.2: A 125 GLN : amide:sc= -4.97! C(o=-8.3!,f=-11!) USER MOD Set 2.1: A 121 THR OG1 : rot 180:sc= 0.0144 USER MOD Set 2.2: A 124 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 85 THR OG1 : rot 74:sc= 1.15 USER MOD Set 3.2: A 111 SER OG : rot 154:sc= 0.997 USER MOD Set 4.1: A 70 THR OG1 : rot -77:sc= 0.775 USER MOD Set 4.2: A 109 THR OG1 : rot -120:sc= 1.56 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 68:sc= 0.929 USER MOD Single : A 26 SER OG : rot 180:sc= 0.0136 USER MOD Single : A 34 THR OG1 : rot 144:sc= -2.99! USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.0468 USER MOD Single : A 36 ASN : amide:sc= -2.3 K(o=-2.3,f=-0.98) USER MOD Single : A 37 ASN : amide:sc=-0.00238 K(o=-0.0024,f=0.94) USER MOD Single : A 57 GLN : amide:sc= -0.0659 X(o=-0.066,f=-0.076) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 50:sc= 1.05 USER MOD Single : A 62 MET CE :methyl 143:sc= -6.37! (180deg=-14.4!) USER MOD Single : A 65 THR OG1 : rot 62:sc= 0.107 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -168:sc= 2.73 (180deg=2.16) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 HIS : no HD1:sc= -0.546 X(o=-0.55,f=-0.064) USER MOD Single : A 88 ASN : amide:sc= -3.29! C(o=-3.3!,f=-7.8!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl -141:sc= -0.801 (180deg=-3.19!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.0152 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.807 X(o=-0.81,f=-0.76) USER MOD Single : A 126 LYS NZ :NH3+ -169:sc= -1.43 (180deg=-1.75) USER MOD Single : A 128 GLN : amide:sc= -0.931 K(o=-0.93,f=-2!) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 77:sc= 0.03 USER MOD ----------------------------------------------------------------- ATOM 318 N ASP A 21 -5.564 -13.076 -8.434 1.00 0.00 N ATOM 319 CA ASP A 21 -4.887 -14.153 -7.716 1.00 0.00 C ATOM 320 C ASP A 21 -3.873 -13.604 -6.717 1.00 0.00 C ATOM 321 O ASP A 21 -2.806 -13.126 -7.097 1.00 0.00 O ATOM 322 CB ASP A 21 -4.188 -15.089 -8.704 1.00 0.00 C ATOM 323 CG ASP A 21 -5.149 -16.066 -9.352 1.00 0.00 C ATOM 324 OD1 ASP A 21 -5.763 -15.705 -10.378 1.00 0.00 O ATOM 325 OD2 ASP A 21 -5.288 -17.194 -8.834 1.00 0.00 O ATOM 0 HA ASP A 21 -5.642 -14.710 -7.162 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.699 -14.497 -9.478 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.406 -15.643 -8.185 1.00 0.00 H new ATOM 330 N ARG A 22 -4.214 -13.680 -5.438 1.00 0.00 N ATOM 331 CA ARG A 22 -3.337 -13.190 -4.381 1.00 0.00 C ATOM 332 C ARG A 22 -1.989 -13.908 -4.401 1.00 0.00 C ATOM 333 O ARG A 22 -0.953 -13.308 -4.114 1.00 0.00 O ATOM 334 CB ARG A 22 -4.001 -13.380 -3.017 1.00 0.00 C ATOM 335 CG ARG A 22 -4.907 -12.227 -2.613 1.00 0.00 C ATOM 336 CD ARG A 22 -6.305 -12.709 -2.263 1.00 0.00 C ATOM 337 NE ARG A 22 -6.985 -13.298 -3.417 1.00 0.00 N ATOM 338 CZ ARG A 22 -7.406 -14.561 -3.476 1.00 0.00 C ATOM 339 NH1 ARG A 22 -7.225 -15.387 -2.452 1.00 0.00 N ATOM 340 NH2 ARG A 22 -8.015 -15.001 -4.570 1.00 0.00 N ATOM 0 H ARG A 22 -5.093 -14.077 -5.106 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.162 -12.129 -4.557 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -4.584 -14.301 -3.032 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.227 -13.505 -2.260 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.476 -11.708 -1.757 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.964 -11.506 -3.428 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -6.245 -13.446 -1.462 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -6.893 -11.873 -1.883 1.00 0.00 H new ATOM 0 HE ARG A 22 -7.147 -12.703 -4.229 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -6.759 -15.057 -1.607 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -7.552 -16.351 -2.511 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.159 -14.373 -5.361 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -8.339 -15.967 -4.620 1.00 0.00 H new ATOM 354 N GLU A 23 -2.010 -15.199 -4.723 1.00 0.00 N ATOM 355 CA GLU A 23 -0.786 -15.998 -4.757 1.00 0.00 C ATOM 356 C GLU A 23 -0.291 -16.249 -6.185 1.00 0.00 C ATOM 357 O GLU A 23 0.766 -16.849 -6.378 1.00 0.00 O ATOM 358 CB GLU A 23 -1.013 -17.336 -4.048 1.00 0.00 C ATOM 359 CG GLU A 23 0.167 -17.781 -3.200 1.00 0.00 C ATOM 360 CD GLU A 23 0.012 -19.200 -2.688 1.00 0.00 C ATOM 361 OE1 GLU A 23 -0.780 -19.409 -1.745 1.00 0.00 O ATOM 362 OE2 GLU A 23 0.684 -20.103 -3.229 1.00 0.00 O ATOM 0 H GLU A 23 -2.857 -15.713 -4.963 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.016 -15.427 -4.239 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -1.896 -17.257 -3.414 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -1.224 -18.102 -4.794 1.00 0.00 H new ATOM 0 HG2 GLU A 23 1.081 -17.709 -3.789 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.278 -17.103 -2.354 1.00 0.00 H new ATOM 369 N LYS A 24 -1.053 -15.805 -7.178 1.00 0.00 N ATOM 370 CA LYS A 24 -0.671 -16.010 -8.574 1.00 0.00 C ATOM 371 C LYS A 24 -0.652 -14.694 -9.345 1.00 0.00 C ATOM 372 O LYS A 24 -0.901 -14.668 -10.550 1.00 0.00 O ATOM 373 CB LYS A 24 -1.628 -16.998 -9.246 1.00 0.00 C ATOM 374 CG LYS A 24 -0.923 -18.172 -9.905 1.00 0.00 C ATOM 375 CD LYS A 24 -0.637 -19.285 -8.909 1.00 0.00 C ATOM 376 CE LYS A 24 -1.305 -20.588 -9.318 1.00 0.00 C ATOM 377 NZ LYS A 24 -2.751 -20.609 -8.956 1.00 0.00 N ATOM 0 H LYS A 24 -1.932 -15.305 -7.047 1.00 0.00 H new ATOM 0 HA LYS A 24 0.338 -16.423 -8.586 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -2.329 -17.376 -8.502 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -2.215 -16.469 -9.997 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -1.540 -18.559 -10.716 1.00 0.00 H new ATOM 0 HG3 LYS A 24 0.012 -17.832 -10.350 1.00 0.00 H new ATOM 0 HD2 LYS A 24 0.440 -19.436 -8.831 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -0.990 -18.989 -7.921 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.198 -20.729 -10.394 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.798 -21.423 -8.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -3.170 -21.514 -9.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -2.853 -20.500 -7.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -3.241 -19.828 -9.437 1.00 0.00 H new ATOM 391 N THR A 25 -0.361 -13.602 -8.647 1.00 0.00 N ATOM 392 CA THR A 25 -0.318 -12.287 -9.275 1.00 0.00 C ATOM 393 C THR A 25 1.058 -11.646 -9.123 1.00 0.00 C ATOM 394 O THR A 25 1.698 -11.758 -8.077 1.00 0.00 O ATOM 395 CB THR A 25 -1.398 -11.389 -8.666 1.00 0.00 C ATOM 396 OG1 THR A 25 -2.678 -11.791 -9.113 1.00 0.00 O ATOM 397 CG2 THR A 25 -1.240 -9.919 -8.998 1.00 0.00 C ATOM 0 H THR A 25 -0.152 -13.601 -7.649 1.00 0.00 H new ATOM 0 HA THR A 25 -0.510 -12.407 -10.341 1.00 0.00 H new ATOM 0 HB THR A 25 -1.288 -11.504 -7.588 1.00 0.00 H new ATOM 0 HG1 THR A 25 -2.895 -12.670 -8.737 1.00 0.00 H new ATOM 0 HG21 THR A 25 -2.044 -9.352 -8.529 1.00 0.00 H new ATOM 0 HG22 THR A 25 -0.280 -9.563 -8.625 1.00 0.00 H new ATOM 0 HG23 THR A 25 -1.283 -9.783 -10.079 1.00 0.00 H new ATOM 405 N SER A 26 1.502 -10.967 -10.178 1.00 0.00 N ATOM 406 CA SER A 26 2.796 -10.298 -10.168 1.00 0.00 C ATOM 407 C SER A 26 2.708 -8.969 -9.421 1.00 0.00 C ATOM 408 O SER A 26 1.621 -8.417 -9.248 1.00 0.00 O ATOM 409 CB SER A 26 3.285 -10.062 -11.598 1.00 0.00 C ATOM 410 OG SER A 26 2.253 -9.527 -12.408 1.00 0.00 O ATOM 0 H SER A 26 0.983 -10.867 -11.050 1.00 0.00 H new ATOM 0 HA SER A 26 3.509 -10.942 -9.653 1.00 0.00 H new ATOM 0 HB2 SER A 26 4.134 -9.379 -11.587 1.00 0.00 H new ATOM 0 HB3 SER A 26 3.637 -11.001 -12.025 1.00 0.00 H new ATOM 0 HG SER A 26 2.591 -9.384 -13.317 1.00 0.00 H new ATOM 416 N PRO A 27 3.854 -8.440 -8.960 1.00 0.00 N ATOM 417 CA PRO A 27 3.899 -7.180 -8.223 1.00 0.00 C ATOM 418 C PRO A 27 3.886 -5.956 -9.136 1.00 0.00 C ATOM 419 O PRO A 27 3.906 -6.077 -10.361 1.00 0.00 O ATOM 420 CB PRO A 27 5.224 -7.274 -7.478 1.00 0.00 C ATOM 421 CG PRO A 27 6.101 -8.076 -8.377 1.00 0.00 C ATOM 422 CD PRO A 27 5.195 -9.037 -9.110 1.00 0.00 C ATOM 0 HA PRO A 27 3.028 -7.051 -7.580 1.00 0.00 H new ATOM 0 HB2 PRO A 27 5.645 -6.286 -7.291 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.101 -7.757 -6.509 1.00 0.00 H new ATOM 0 HG2 PRO A 27 6.632 -7.432 -9.078 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.856 -8.614 -7.804 1.00 0.00 H new ATOM 0 HD2 PRO A 27 5.476 -9.131 -10.159 1.00 0.00 H new ATOM 0 HD3 PRO A 27 5.239 -10.037 -8.678 1.00 0.00 H new ATOM 430 N LEU A 28 3.850 -4.779 -8.520 1.00 0.00 N ATOM 431 CA LEU A 28 3.832 -3.520 -9.253 1.00 0.00 C ATOM 432 C LEU A 28 4.468 -2.411 -8.421 1.00 0.00 C ATOM 433 O LEU A 28 4.482 -2.478 -7.190 1.00 0.00 O ATOM 434 CB LEU A 28 2.394 -3.140 -9.616 1.00 0.00 C ATOM 435 CG LEU A 28 1.510 -2.745 -8.430 1.00 0.00 C ATOM 436 CD1 LEU A 28 1.463 -1.232 -8.280 1.00 0.00 C ATOM 437 CD2 LEU A 28 0.107 -3.309 -8.598 1.00 0.00 C ATOM 0 H LEU A 28 3.833 -4.672 -7.506 1.00 0.00 H new ATOM 0 HA LEU A 28 4.408 -3.646 -10.170 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.421 -2.310 -10.322 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.931 -3.982 -10.131 1.00 0.00 H new ATOM 0 HG LEU A 28 1.943 -3.167 -7.523 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.830 -0.970 -7.432 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.471 -0.852 -8.112 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.055 -0.789 -9.188 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.507 -3.018 -7.745 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.335 -2.917 -9.514 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.156 -4.396 -8.655 1.00 0.00 H new ATOM 449 N LEU A 29 4.991 -1.391 -9.093 1.00 0.00 N ATOM 450 CA LEU A 29 5.624 -0.271 -8.405 1.00 0.00 C ATOM 451 C LEU A 29 4.575 0.624 -7.751 1.00 0.00 C ATOM 452 O LEU A 29 3.662 1.117 -8.413 1.00 0.00 O ATOM 453 CB LEU A 29 6.477 0.542 -9.386 1.00 0.00 C ATOM 454 CG LEU A 29 6.987 1.889 -8.860 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.450 1.768 -7.415 1.00 0.00 C ATOM 456 CD2 LEU A 29 8.115 2.406 -9.740 1.00 0.00 C ATOM 0 H LEU A 29 4.989 -1.316 -10.110 1.00 0.00 H new ATOM 0 HA LEU A 29 6.270 -0.670 -7.624 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.336 -0.062 -9.680 1.00 0.00 H new ATOM 0 HB3 LEU A 29 5.890 0.722 -10.287 1.00 0.00 H new ATOM 0 HG LEU A 29 6.164 2.603 -8.892 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.807 2.737 -7.065 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.617 1.442 -6.792 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.258 1.039 -7.352 1.00 0.00 H new ATOM 0 HD21 LEU A 29 8.467 3.363 -9.355 1.00 0.00 H new ATOM 0 HD22 LEU A 29 8.936 1.689 -9.738 1.00 0.00 H new ATOM 0 HD23 LEU A 29 7.751 2.537 -10.759 1.00 0.00 H new ATOM 468 N LEU A 30 4.711 0.827 -6.444 1.00 0.00 N ATOM 469 CA LEU A 30 3.776 1.660 -5.696 1.00 0.00 C ATOM 470 C LEU A 30 4.520 2.646 -4.801 1.00 0.00 C ATOM 471 O LEU A 30 5.581 2.329 -4.260 1.00 0.00 O ATOM 472 CB LEU A 30 2.847 0.783 -4.853 1.00 0.00 C ATOM 473 CG LEU A 30 1.575 1.472 -4.349 1.00 0.00 C ATOM 474 CD1 LEU A 30 1.906 2.465 -3.243 1.00 0.00 C ATOM 475 CD2 LEU A 30 0.849 2.165 -5.495 1.00 0.00 C ATOM 0 H LEU A 30 5.461 0.425 -5.881 1.00 0.00 H new ATOM 0 HA LEU A 30 3.180 2.229 -6.410 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.560 -0.086 -5.444 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.405 0.413 -3.993 1.00 0.00 H new ATOM 0 HG LEU A 30 0.913 0.710 -3.938 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.990 2.944 -2.898 1.00 0.00 H new ATOM 0 HD12 LEU A 30 2.376 1.940 -2.411 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.589 3.223 -3.627 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.052 2.648 -5.116 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.503 2.915 -5.940 1.00 0.00 H new ATOM 0 HD23 LEU A 30 0.575 1.429 -6.250 1.00 0.00 H new ATOM 487 N ARG A 31 3.955 3.843 -4.651 1.00 0.00 N ATOM 488 CA ARG A 31 4.561 4.879 -3.824 1.00 0.00 C ATOM 489 C ARG A 31 3.907 4.930 -2.447 1.00 0.00 C ATOM 490 O ARG A 31 2.691 5.103 -2.327 1.00 0.00 O ATOM 491 CB ARG A 31 4.440 6.243 -4.509 1.00 0.00 C ATOM 492 CG ARG A 31 5.597 6.557 -5.442 1.00 0.00 C ATOM 493 CD ARG A 31 5.613 8.028 -5.832 1.00 0.00 C ATOM 494 NE ARG A 31 6.033 8.221 -7.218 1.00 0.00 N ATOM 495 CZ ARG A 31 5.787 9.325 -7.921 1.00 0.00 C ATOM 496 NH1 ARG A 31 5.124 10.335 -7.373 1.00 0.00 N ATOM 497 NH2 ARG A 31 6.205 9.417 -9.177 1.00 0.00 N ATOM 0 H ARG A 31 3.078 4.117 -5.093 1.00 0.00 H new ATOM 0 HA ARG A 31 5.616 4.635 -3.696 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.509 6.276 -5.074 1.00 0.00 H new ATOM 0 HB3 ARG A 31 4.377 7.019 -3.747 1.00 0.00 H new ATOM 0 HG2 ARG A 31 6.538 6.297 -4.957 1.00 0.00 H new ATOM 0 HG3 ARG A 31 5.520 5.942 -6.339 1.00 0.00 H new ATOM 0 HD2 ARG A 31 4.618 8.451 -5.692 1.00 0.00 H new ATOM 0 HD3 ARG A 31 6.287 8.572 -5.170 1.00 0.00 H new ATOM 0 HE ARG A 31 6.545 7.466 -7.674 1.00 0.00 H new ATOM 0 HH11 ARG A 31 4.800 10.269 -6.408 1.00 0.00 H new ATOM 0 HH12 ARG A 31 4.939 11.178 -7.916 1.00 0.00 H new ATOM 0 HH21 ARG A 31 6.714 8.643 -9.603 1.00 0.00 H new ATOM 0 HH22 ARG A 31 6.017 10.262 -9.716 1.00 0.00 H new ATOM 511 N VAL A 32 4.725 4.779 -1.410 1.00 0.00 N ATOM 512 CA VAL A 32 4.237 4.808 -0.038 1.00 0.00 C ATOM 513 C VAL A 32 5.040 5.787 0.809 1.00 0.00 C ATOM 514 O VAL A 32 6.266 5.710 0.868 1.00 0.00 O ATOM 515 CB VAL A 32 4.299 3.414 0.615 1.00 0.00 C ATOM 516 CG1 VAL A 32 3.136 2.553 0.149 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.627 2.737 0.312 1.00 0.00 C ATOM 0 H VAL A 32 5.731 4.635 -1.496 1.00 0.00 H new ATOM 0 HA VAL A 32 3.197 5.133 -0.082 1.00 0.00 H new ATOM 0 HB VAL A 32 4.220 3.538 1.695 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.197 1.572 0.621 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.196 3.031 0.425 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.180 2.438 -0.934 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.650 1.754 0.782 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.741 2.626 -0.766 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.443 3.345 0.702 1.00 0.00 H new ATOM 527 N PHE A 33 4.341 6.700 1.470 1.00 0.00 N ATOM 528 CA PHE A 33 4.986 7.690 2.320 1.00 0.00 C ATOM 529 C PHE A 33 4.842 7.292 3.780 1.00 0.00 C ATOM 530 O PHE A 33 3.730 7.153 4.289 1.00 0.00 O ATOM 531 CB PHE A 33 4.377 9.068 2.067 1.00 0.00 C ATOM 532 CG PHE A 33 4.179 9.356 0.606 1.00 0.00 C ATOM 533 CD1 PHE A 33 3.097 8.823 -0.079 1.00 0.00 C ATOM 534 CD2 PHE A 33 5.082 10.145 -0.086 1.00 0.00 C ATOM 535 CE1 PHE A 33 2.921 9.076 -1.426 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.910 10.402 -1.432 1.00 0.00 C ATOM 537 CZ PHE A 33 3.827 9.868 -2.104 1.00 0.00 C ATOM 0 H PHE A 33 3.324 6.775 1.433 1.00 0.00 H new ATOM 0 HA PHE A 33 6.048 7.735 2.081 1.00 0.00 H new ATOM 0 HB2 PHE A 33 3.417 9.136 2.580 1.00 0.00 H new ATOM 0 HB3 PHE A 33 5.024 9.831 2.499 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.385 8.204 0.446 1.00 0.00 H new ATOM 0 HD2 PHE A 33 5.931 10.565 0.433 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.075 8.654 -1.949 1.00 0.00 H new ATOM 0 HE2 PHE A 33 5.622 11.020 -1.959 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.689 10.069 -3.156 1.00 0.00 H new ATOM 547 N THR A 34 5.971 7.078 4.448 1.00 0.00 N ATOM 548 CA THR A 34 5.953 6.654 5.842 1.00 0.00 C ATOM 549 C THR A 34 6.467 7.733 6.787 1.00 0.00 C ATOM 550 O THR A 34 7.611 8.178 6.686 1.00 0.00 O ATOM 551 CB THR A 34 6.787 5.385 6.013 1.00 0.00 C ATOM 552 OG1 THR A 34 8.088 5.563 5.483 1.00 0.00 O ATOM 553 CG2 THR A 34 6.178 4.175 5.336 1.00 0.00 C ATOM 0 H THR A 34 6.903 7.190 4.050 1.00 0.00 H new ATOM 0 HA THR A 34 4.913 6.458 6.103 1.00 0.00 H new ATOM 0 HB THR A 34 6.821 5.204 7.087 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.736 5.082 6.039 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.819 3.308 5.495 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.192 3.980 5.758 1.00 0.00 H new ATOM 0 HG23 THR A 34 6.084 4.365 4.267 1.00 0.00 H new ATOM 561 N THR A 35 5.618 8.118 7.733 1.00 0.00 N ATOM 562 CA THR A 35 5.974 9.108 8.741 1.00 0.00 C ATOM 563 C THR A 35 6.198 8.394 10.072 1.00 0.00 C ATOM 564 O THR A 35 5.699 7.286 10.265 1.00 0.00 O ATOM 565 CB THR A 35 4.878 10.174 8.874 1.00 0.00 C ATOM 566 OG1 THR A 35 4.964 10.830 10.131 1.00 0.00 O ATOM 567 CG2 THR A 35 3.471 9.623 8.726 1.00 0.00 C ATOM 0 H THR A 35 4.669 7.755 7.822 1.00 0.00 H new ATOM 0 HA THR A 35 6.889 9.618 8.441 1.00 0.00 H new ATOM 0 HB THR A 35 5.056 10.871 8.055 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.258 11.507 10.196 1.00 0.00 H new ATOM 0 HG21 THR A 35 2.750 10.433 8.832 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.361 9.165 7.743 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.291 8.874 9.497 1.00 0.00 H new ATOM 575 N ASN A 36 6.950 9.004 10.987 1.00 0.00 N ATOM 576 CA ASN A 36 7.218 8.375 12.273 1.00 0.00 C ATOM 577 C ASN A 36 6.391 9.010 13.384 1.00 0.00 C ATOM 578 O ASN A 36 6.811 9.047 14.540 1.00 0.00 O ATOM 579 CB ASN A 36 8.707 8.469 12.608 1.00 0.00 C ATOM 580 CG ASN A 36 9.067 7.705 13.868 1.00 0.00 C ATOM 581 OD1 ASN A 36 9.751 8.225 14.749 1.00 0.00 O ATOM 582 ND2 ASN A 36 8.605 6.463 13.959 1.00 0.00 N ATOM 0 H ASN A 36 7.378 9.921 10.862 1.00 0.00 H new ATOM 0 HA ASN A 36 6.933 7.326 12.198 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.290 8.081 11.772 1.00 0.00 H new ATOM 0 HB3 ASN A 36 8.983 9.516 12.730 1.00 0.00 H new ATOM 0 HD21 ASN A 36 8.814 5.900 14.784 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.041 6.072 13.204 1.00 0.00 H new ATOM 589 N ASN A 37 5.213 9.506 13.030 1.00 0.00 N ATOM 590 CA ASN A 37 4.328 10.135 14.003 1.00 0.00 C ATOM 591 C ASN A 37 2.906 9.583 13.903 1.00 0.00 C ATOM 592 O ASN A 37 2.016 10.012 14.637 1.00 0.00 O ATOM 593 CB ASN A 37 4.312 11.651 13.802 1.00 0.00 C ATOM 594 CG ASN A 37 4.179 12.405 15.108 1.00 0.00 C ATOM 595 OD1 ASN A 37 3.226 12.204 15.863 1.00 0.00 O ATOM 596 ND2 ASN A 37 5.137 13.284 15.385 1.00 0.00 N ATOM 0 H ASN A 37 4.848 9.485 12.078 1.00 0.00 H new ATOM 0 HA ASN A 37 4.712 9.906 14.997 1.00 0.00 H new ATOM 0 HB2 ASN A 37 5.230 11.958 13.300 1.00 0.00 H new ATOM 0 HB3 ASN A 37 3.485 11.919 13.145 1.00 0.00 H new ATOM 0 HD21 ASN A 37 5.100 13.823 16.250 1.00 0.00 H new ATOM 0 HD22 ASN A 37 5.909 13.420 14.732 1.00 0.00 H new ATOM 603 N GLY A 38 2.693 8.631 12.993 1.00 0.00 N ATOM 604 CA GLY A 38 1.373 8.049 12.825 1.00 0.00 C ATOM 605 C GLY A 38 0.290 9.100 12.686 1.00 0.00 C ATOM 606 O GLY A 38 -0.675 9.110 13.451 1.00 0.00 O ATOM 0 H GLY A 38 3.410 8.255 12.372 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.371 7.410 11.942 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.149 7.411 13.680 1.00 0.00 H new ATOM 610 N ARG A 39 0.449 9.989 11.710 1.00 0.00 N ATOM 611 CA ARG A 39 -0.525 11.049 11.484 1.00 0.00 C ATOM 612 C ARG A 39 -0.882 11.162 10.003 1.00 0.00 C ATOM 613 O ARG A 39 -0.269 11.926 9.259 1.00 0.00 O ATOM 614 CB ARG A 39 0.029 12.380 12.000 1.00 0.00 C ATOM 615 CG ARG A 39 0.028 12.495 13.516 1.00 0.00 C ATOM 616 CD ARG A 39 -1.385 12.494 14.077 1.00 0.00 C ATOM 617 NE ARG A 39 -2.130 13.692 13.693 1.00 0.00 N ATOM 618 CZ ARG A 39 -2.332 14.737 14.496 1.00 0.00 C ATOM 619 NH1 ARG A 39 -1.838 14.751 15.727 1.00 0.00 N ATOM 620 NH2 ARG A 39 -3.030 15.777 14.060 1.00 0.00 N ATOM 0 H ARG A 39 1.240 9.996 11.066 1.00 0.00 H new ATOM 0 HA ARG A 39 -1.436 10.802 12.030 1.00 0.00 H new ATOM 0 HB2 ARG A 39 1.049 12.505 11.636 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -0.561 13.196 11.582 1.00 0.00 H new ATOM 0 HG2 ARG A 39 0.591 11.666 13.945 1.00 0.00 H new ATOM 0 HG3 ARG A 39 0.537 13.412 13.812 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -1.914 11.609 13.723 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -1.343 12.427 15.164 1.00 0.00 H new ATOM 0 HE ARG A 39 -2.520 13.731 12.751 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -1.297 13.957 16.068 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -1.999 15.556 16.332 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -3.410 15.775 13.113 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -3.187 16.578 14.671 1.00 0.00 H new ATOM 864 N GLU A 55 9.543 8.964 1.095 1.00 0.00 N ATOM 865 CA GLU A 55 8.723 7.961 0.421 1.00 0.00 C ATOM 866 C GLU A 55 9.539 6.719 0.084 1.00 0.00 C ATOM 867 O GLU A 55 10.755 6.787 -0.093 1.00 0.00 O ATOM 868 CB GLU A 55 8.110 8.539 -0.857 1.00 0.00 C ATOM 869 CG GLU A 55 9.054 9.438 -1.640 1.00 0.00 C ATOM 870 CD GLU A 55 8.438 9.947 -2.928 1.00 0.00 C ATOM 871 OE1 GLU A 55 8.333 9.156 -3.888 1.00 0.00 O ATOM 872 OE2 GLU A 55 8.062 11.137 -2.976 1.00 0.00 O ATOM 0 HA GLU A 55 7.923 7.675 1.104 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.790 7.718 -1.499 1.00 0.00 H new ATOM 0 HB3 GLU A 55 7.217 9.106 -0.596 1.00 0.00 H new ATOM 0 HG2 GLU A 55 9.341 10.286 -1.019 1.00 0.00 H new ATOM 0 HG3 GLU A 55 9.966 8.888 -1.870 1.00 0.00 H new ATOM 879 N LEU A 56 8.856 5.584 -0.003 1.00 0.00 N ATOM 880 CA LEU A 56 9.507 4.318 -0.319 1.00 0.00 C ATOM 881 C LEU A 56 8.752 3.583 -1.424 1.00 0.00 C ATOM 882 O LEU A 56 7.537 3.721 -1.559 1.00 0.00 O ATOM 883 CB LEU A 56 9.599 3.431 0.929 1.00 0.00 C ATOM 884 CG LEU A 56 8.620 3.775 2.055 1.00 0.00 C ATOM 885 CD1 LEU A 56 8.211 2.520 2.810 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.237 4.793 3.005 1.00 0.00 C ATOM 0 H LEU A 56 7.849 5.514 0.141 1.00 0.00 H new ATOM 0 HA LEU A 56 10.515 4.537 -0.670 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.434 2.396 0.631 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.614 3.491 1.322 1.00 0.00 H new ATOM 0 HG LEU A 56 7.727 4.215 1.612 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.515 2.785 3.606 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.729 1.823 2.124 1.00 0.00 H new ATOM 0 HD13 LEU A 56 9.095 2.051 3.242 1.00 0.00 H new ATOM 0 HD21 LEU A 56 8.528 5.026 3.799 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.147 4.379 3.441 1.00 0.00 H new ATOM 0 HD23 LEU A 56 9.479 5.703 2.456 1.00 0.00 H new ATOM 898 N GLN A 57 9.483 2.797 -2.206 1.00 0.00 N ATOM 899 CA GLN A 57 8.884 2.033 -3.293 1.00 0.00 C ATOM 900 C GLN A 57 8.786 0.559 -2.920 1.00 0.00 C ATOM 901 O GLN A 57 9.669 0.020 -2.252 1.00 0.00 O ATOM 902 CB GLN A 57 9.706 2.196 -4.575 1.00 0.00 C ATOM 903 CG GLN A 57 9.491 3.531 -5.268 1.00 0.00 C ATOM 904 CD GLN A 57 10.310 4.648 -4.651 1.00 0.00 C ATOM 905 OE1 GLN A 57 11.540 4.600 -4.645 1.00 0.00 O ATOM 906 NE2 GLN A 57 9.630 5.662 -4.129 1.00 0.00 N ATOM 0 H GLN A 57 10.491 2.672 -2.107 1.00 0.00 H new ATOM 0 HA GLN A 57 7.879 2.416 -3.468 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.764 2.086 -4.335 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.451 1.392 -5.265 1.00 0.00 H new ATOM 0 HG2 GLN A 57 9.751 3.435 -6.322 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.434 3.793 -5.223 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.610 5.660 -4.156 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.127 6.443 -3.701 1.00 0.00 H new ATOM 915 N ILE A 58 7.710 -0.090 -3.348 1.00 0.00 N ATOM 916 CA ILE A 58 7.506 -1.505 -3.049 1.00 0.00 C ATOM 917 C ILE A 58 6.810 -2.217 -4.202 1.00 0.00 C ATOM 918 O ILE A 58 5.923 -1.661 -4.848 1.00 0.00 O ATOM 919 CB ILE A 58 6.689 -1.727 -1.752 1.00 0.00 C ATOM 920 CG1 ILE A 58 6.090 -0.414 -1.224 1.00 0.00 C ATOM 921 CG2 ILE A 58 7.564 -2.380 -0.690 1.00 0.00 C ATOM 922 CD1 ILE A 58 4.605 -0.496 -0.951 1.00 0.00 C ATOM 0 H ILE A 58 6.967 0.337 -3.901 1.00 0.00 H new ATOM 0 HA ILE A 58 8.500 -1.927 -2.903 1.00 0.00 H new ATOM 0 HB ILE A 58 5.858 -2.391 -1.989 1.00 0.00 H new ATOM 0 HG12 ILE A 58 6.605 -0.132 -0.306 1.00 0.00 H new ATOM 0 HG13 ILE A 58 6.275 0.378 -1.949 1.00 0.00 H new ATOM 0 HG21 ILE A 58 6.981 -2.532 0.218 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.924 -3.342 -1.056 1.00 0.00 H new ATOM 0 HG23 ILE A 58 8.414 -1.734 -0.472 1.00 0.00 H new ATOM 0 HD11 ILE A 58 4.249 0.466 -0.581 1.00 0.00 H new ATOM 0 HD12 ILE A 58 4.079 -0.747 -1.872 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.415 -1.266 -0.203 1.00 0.00 H new ATOM 934 N TYR A 59 7.220 -3.457 -4.449 1.00 0.00 N ATOM 935 CA TYR A 59 6.643 -4.260 -5.521 1.00 0.00 C ATOM 936 C TYR A 59 5.589 -5.213 -4.966 1.00 0.00 C ATOM 937 O TYR A 59 5.898 -6.344 -4.587 1.00 0.00 O ATOM 938 CB TYR A 59 7.745 -5.044 -6.235 1.00 0.00 C ATOM 939 CG TYR A 59 8.559 -4.206 -7.197 1.00 0.00 C ATOM 940 CD1 TYR A 59 7.987 -3.691 -8.354 1.00 0.00 C ATOM 941 CD2 TYR A 59 9.897 -3.929 -6.948 1.00 0.00 C ATOM 942 CE1 TYR A 59 8.727 -2.924 -9.235 1.00 0.00 C ATOM 943 CE2 TYR A 59 10.642 -3.163 -7.823 1.00 0.00 C ATOM 944 CZ TYR A 59 10.054 -2.664 -8.965 1.00 0.00 C ATOM 945 OH TYR A 59 10.792 -1.901 -9.839 1.00 0.00 O ATOM 0 H TYR A 59 7.953 -3.929 -3.919 1.00 0.00 H new ATOM 0 HA TYR A 59 6.161 -3.595 -6.237 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.412 -5.477 -5.490 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.294 -5.873 -6.780 1.00 0.00 H new ATOM 0 HD1 TYR A 59 6.948 -3.893 -8.569 1.00 0.00 H new ATOM 0 HD2 TYR A 59 10.363 -4.319 -6.055 1.00 0.00 H new ATOM 0 HE1 TYR A 59 8.268 -2.531 -10.130 1.00 0.00 H new ATOM 0 HE2 TYR A 59 11.681 -2.956 -7.613 1.00 0.00 H new ATOM 0 HH TYR A 59 11.708 -1.811 -9.502 1.00 0.00 H new ATOM 955 N THR A 60 4.344 -4.748 -4.910 1.00 0.00 N ATOM 956 CA THR A 60 3.244 -5.555 -4.392 1.00 0.00 C ATOM 957 C THR A 60 2.141 -5.723 -5.430 1.00 0.00 C ATOM 958 O THR A 60 2.201 -5.148 -6.516 1.00 0.00 O ATOM 959 CB THR A 60 2.679 -4.916 -3.122 1.00 0.00 C ATOM 960 OG1 THR A 60 1.687 -5.746 -2.540 1.00 0.00 O ATOM 961 CG2 THR A 60 2.058 -3.557 -3.362 1.00 0.00 C ATOM 0 H THR A 60 4.072 -3.814 -5.218 1.00 0.00 H new ATOM 0 HA THR A 60 3.634 -6.545 -4.155 1.00 0.00 H new ATOM 0 HB THR A 60 3.533 -4.795 -2.455 1.00 0.00 H new ATOM 0 HG1 THR A 60 2.031 -6.660 -2.459 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.677 -3.160 -2.421 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.811 -2.879 -3.764 1.00 0.00 H new ATOM 0 HG23 THR A 60 1.238 -3.652 -4.074 1.00 0.00 H new ATOM 969 N TRP A 61 1.134 -6.517 -5.093 1.00 0.00 N ATOM 970 CA TRP A 61 0.022 -6.762 -6.013 1.00 0.00 C ATOM 971 C TRP A 61 -1.316 -6.286 -5.448 1.00 0.00 C ATOM 972 O TRP A 61 -1.736 -6.698 -4.370 1.00 0.00 O ATOM 973 CB TRP A 61 -0.064 -8.245 -6.390 1.00 0.00 C ATOM 974 CG TRP A 61 -0.105 -9.167 -5.215 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.178 -9.884 -4.777 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.975 -9.476 -4.331 1.00 0.00 C ATOM 977 NE1 TRP A 61 -0.834 -10.621 -3.674 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.486 -10.388 -3.378 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.310 -9.070 -4.253 1.00 0.00 C ATOM 980 CZ2 TRP A 61 1.285 -10.900 -2.359 1.00 0.00 C ATOM 981 CZ3 TRP A 61 3.104 -9.577 -3.242 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.589 -10.484 -2.307 1.00 0.00 C ATOM 0 H TRP A 61 1.060 -7.001 -4.198 1.00 0.00 H new ATOM 0 HA TRP A 61 0.227 -6.179 -6.911 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -0.956 -8.405 -6.996 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.794 -8.502 -7.011 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.157 -9.873 -5.233 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.457 -11.241 -3.157 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.714 -8.372 -4.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.891 -11.599 -1.636 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 4.137 -9.269 -3.172 1.00 0.00 H new ATOM 0 HH2 TRP A 61 3.234 -10.863 -1.528 1.00 0.00 H new ATOM 993 N MET A 62 -1.936 -5.385 -6.195 1.00 0.00 N ATOM 994 CA MET A 62 -3.229 -4.770 -5.826 1.00 0.00 C ATOM 995 C MET A 62 -4.104 -5.697 -4.965 1.00 0.00 C ATOM 996 O MET A 62 -4.820 -5.228 -4.082 1.00 0.00 O ATOM 997 CB MET A 62 -4.004 -4.370 -7.084 1.00 0.00 C ATOM 998 CG MET A 62 -3.671 -2.974 -7.583 1.00 0.00 C ATOM 999 SD MET A 62 -4.073 -1.693 -6.380 1.00 0.00 S ATOM 1000 CE MET A 62 -2.552 -0.745 -6.373 1.00 0.00 C ATOM 0 H MET A 62 -1.564 -5.049 -7.083 1.00 0.00 H new ATOM 0 HA MET A 62 -2.995 -3.888 -5.230 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.793 -5.090 -7.875 1.00 0.00 H new ATOM 0 HB3 MET A 62 -5.073 -4.428 -6.877 1.00 0.00 H new ATOM 0 HG2 MET A 62 -2.609 -2.922 -7.823 1.00 0.00 H new ATOM 0 HG3 MET A 62 -4.216 -2.783 -8.507 1.00 0.00 H new ATOM 0 HE1 MET A 62 -2.784 0.315 -6.269 1.00 0.00 H new ATOM 0 HE2 MET A 62 -1.928 -1.064 -5.538 1.00 0.00 H new ATOM 0 HE3 MET A 62 -2.017 -0.909 -7.308 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.038 -7.003 -5.214 1.00 0.00 N ATOM 1011 CA ASP A 63 -4.823 -7.970 -4.446 1.00 0.00 C ATOM 1012 C ASP A 63 -4.093 -8.404 -3.172 1.00 0.00 C ATOM 1013 O ASP A 63 -4.266 -9.530 -2.704 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.131 -9.197 -5.305 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.614 -9.510 -5.357 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -7.345 -8.799 -6.076 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.043 -10.466 -4.677 1.00 0.00 O ATOM 0 H ASP A 63 -3.451 -7.416 -5.939 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.753 -7.483 -4.154 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.762 -9.030 -6.317 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -4.594 -10.059 -4.908 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.272 -7.515 -2.618 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.517 -7.821 -1.408 1.00 0.00 C ATOM 1024 C ALA A 64 -3.300 -7.456 -0.152 1.00 0.00 C ATOM 1025 O ALA A 64 -3.967 -6.424 -0.100 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.184 -7.086 -1.418 1.00 0.00 C ATOM 0 H ALA A 64 -3.113 -6.578 -2.988 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.338 -8.896 -1.394 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.631 -7.323 -0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.604 -7.396 -2.287 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.361 -6.012 -1.465 1.00 0.00 H new ATOM 1032 N THR A 65 -3.196 -8.304 0.868 1.00 0.00 N ATOM 1033 CA THR A 65 -3.875 -8.060 2.133 1.00 0.00 C ATOM 1034 C THR A 65 -3.105 -7.020 2.938 1.00 0.00 C ATOM 1035 O THR A 65 -1.909 -6.830 2.721 1.00 0.00 O ATOM 1036 CB THR A 65 -4.002 -9.359 2.934 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.116 -10.348 2.435 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.399 -9.943 2.914 1.00 0.00 C ATOM 0 H THR A 65 -2.648 -9.164 0.841 1.00 0.00 H new ATOM 0 HA THR A 65 -4.877 -7.684 1.927 1.00 0.00 H new ATOM 0 HB THR A 65 -3.754 -9.088 3.960 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.192 -10.037 2.530 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.418 -10.862 3.501 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.100 -9.225 3.341 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.687 -10.163 1.886 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.782 -6.348 3.869 1.00 0.00 N ATOM 1047 CA LEU A 66 -3.134 -5.330 4.696 1.00 0.00 C ATOM 1048 C LEU A 66 -1.816 -5.861 5.259 1.00 0.00 C ATOM 1049 O LEU A 66 -0.870 -5.103 5.479 1.00 0.00 O ATOM 1050 CB LEU A 66 -4.061 -4.900 5.837 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.998 -3.711 5.546 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -4.589 -2.488 6.354 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -5.034 -3.371 4.062 1.00 0.00 C ATOM 0 H LEU A 66 -4.772 -6.489 4.069 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.922 -4.462 4.072 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.673 -5.756 6.121 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.446 -4.647 6.701 1.00 0.00 H new ATOM 0 HG LEU A 66 -6.002 -4.012 5.846 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -5.265 -1.662 6.132 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.639 -2.721 7.418 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.570 -2.203 6.092 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.705 -2.528 3.898 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.032 -3.108 3.725 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.391 -4.234 3.500 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.761 -7.172 5.470 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.561 -7.814 5.986 1.00 0.00 C ATOM 1067 C LYS A 67 0.603 -7.645 5.010 1.00 0.00 C ATOM 1068 O LYS A 67 1.667 -7.150 5.384 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.821 -9.301 6.242 1.00 0.00 C ATOM 1070 CG LYS A 67 -0.340 -9.780 7.603 1.00 0.00 C ATOM 1071 CD LYS A 67 1.146 -10.115 7.587 1.00 0.00 C ATOM 1072 CE LYS A 67 1.944 -9.150 8.449 1.00 0.00 C ATOM 1073 NZ LYS A 67 3.145 -9.799 9.045 1.00 0.00 N ATOM 0 H LYS A 67 -2.536 -7.810 5.291 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.295 -7.335 6.929 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -1.890 -9.494 6.156 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -0.328 -9.886 5.466 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -0.532 -9.009 8.349 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.909 -10.661 7.901 1.00 0.00 H new ATOM 0 HD2 LYS A 67 1.294 -11.133 7.946 1.00 0.00 H new ATOM 0 HD3 LYS A 67 1.517 -10.081 6.563 1.00 0.00 H new ATOM 0 HE2 LYS A 67 2.254 -8.297 7.846 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.308 -8.763 9.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 3.661 -9.107 9.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 2.848 -10.598 9.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 3.765 -10.145 8.285 1.00 0.00 H new ATOM 1087 N GLU A 68 0.397 -8.057 3.755 1.00 0.00 N ATOM 1088 CA GLU A 68 1.429 -7.949 2.736 1.00 0.00 C ATOM 1089 C GLU A 68 2.044 -6.554 2.716 1.00 0.00 C ATOM 1090 O GLU A 68 3.262 -6.407 2.603 1.00 0.00 O ATOM 1091 CB GLU A 68 0.841 -8.281 1.366 1.00 0.00 C ATOM 1092 CG GLU A 68 1.786 -9.067 0.474 1.00 0.00 C ATOM 1093 CD GLU A 68 2.863 -8.198 -0.142 1.00 0.00 C ATOM 1094 OE1 GLU A 68 2.627 -7.647 -1.238 1.00 0.00 O ATOM 1095 OE2 GLU A 68 3.943 -8.067 0.472 1.00 0.00 O ATOM 0 H GLU A 68 -0.477 -8.467 3.427 1.00 0.00 H new ATOM 0 HA GLU A 68 2.219 -8.661 2.975 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -0.077 -8.853 1.503 1.00 0.00 H new ATOM 0 HB3 GLU A 68 0.567 -7.354 0.863 1.00 0.00 H new ATOM 0 HG2 GLU A 68 2.254 -9.861 1.057 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.215 -9.548 -0.320 1.00 0.00 H new ATOM 1102 N LEU A 69 1.202 -5.533 2.824 1.00 0.00 N ATOM 1103 CA LEU A 69 1.683 -4.155 2.816 1.00 0.00 C ATOM 1104 C LEU A 69 2.513 -3.876 4.064 1.00 0.00 C ATOM 1105 O LEU A 69 3.429 -3.053 4.040 1.00 0.00 O ATOM 1106 CB LEU A 69 0.512 -3.168 2.720 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.468 -3.397 1.554 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.237 -3.977 0.336 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.608 -4.301 1.992 1.00 0.00 C ATOM 0 H LEU A 69 0.191 -5.630 2.917 1.00 0.00 H new ATOM 0 HA LEU A 69 2.315 -4.019 1.938 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.049 -3.208 3.654 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.918 -2.160 2.635 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.877 -2.428 1.267 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.486 -4.125 -0.466 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.013 -3.288 0.003 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.689 -4.934 0.598 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.292 -4.454 1.158 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.207 -5.262 2.313 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.143 -3.836 2.820 1.00 0.00 H new ATOM 1121 N THR A 70 2.199 -4.581 5.149 1.00 0.00 N ATOM 1122 CA THR A 70 2.928 -4.423 6.402 1.00 0.00 C ATOM 1123 C THR A 70 4.401 -4.771 6.200 1.00 0.00 C ATOM 1124 O THR A 70 5.290 -4.153 6.793 1.00 0.00 O ATOM 1125 CB THR A 70 2.318 -5.315 7.486 1.00 0.00 C ATOM 1126 OG1 THR A 70 0.927 -5.074 7.611 1.00 0.00 O ATOM 1127 CG2 THR A 70 2.940 -5.114 8.851 1.00 0.00 C ATOM 0 H THR A 70 1.445 -5.267 5.184 1.00 0.00 H new ATOM 0 HA THR A 70 2.853 -3.384 6.722 1.00 0.00 H new ATOM 0 HB THR A 70 2.516 -6.336 7.161 1.00 0.00 H new ATOM 0 HG1 THR A 70 0.783 -4.242 8.108 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.460 -5.777 9.571 1.00 0.00 H new ATOM 0 HG22 THR A 70 4.005 -5.341 8.802 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.803 -4.079 9.164 1.00 0.00 H new ATOM 1135 N SER A 71 4.654 -5.765 5.354 1.00 0.00 N ATOM 1136 CA SER A 71 6.019 -6.194 5.066 1.00 0.00 C ATOM 1137 C SER A 71 6.679 -5.233 4.085 1.00 0.00 C ATOM 1138 O SER A 71 7.851 -4.884 4.232 1.00 0.00 O ATOM 1139 CB SER A 71 6.028 -7.613 4.494 1.00 0.00 C ATOM 1140 OG SER A 71 7.194 -8.314 4.884 1.00 0.00 O ATOM 0 H SER A 71 3.933 -6.288 4.857 1.00 0.00 H new ATOM 0 HA SER A 71 6.583 -6.191 5.999 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.145 -8.152 4.837 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.973 -7.570 3.406 1.00 0.00 H new ATOM 0 HG SER A 71 7.174 -9.218 4.507 1.00 0.00 H new ATOM 1146 N LEU A 72 5.909 -4.798 3.089 1.00 0.00 N ATOM 1147 CA LEU A 72 6.401 -3.859 2.082 1.00 0.00 C ATOM 1148 C LEU A 72 7.190 -2.734 2.742 1.00 0.00 C ATOM 1149 O LEU A 72 8.375 -2.536 2.461 1.00 0.00 O ATOM 1150 CB LEU A 72 5.224 -3.278 1.295 1.00 0.00 C ATOM 1151 CG LEU A 72 4.453 -4.280 0.434 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.327 -3.581 -0.307 1.00 0.00 C ATOM 1153 CD2 LEU A 72 5.381 -4.983 -0.547 1.00 0.00 C ATOM 0 H LEU A 72 4.938 -5.082 2.958 1.00 0.00 H new ATOM 0 HA LEU A 72 7.062 -4.393 1.399 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.529 -2.819 1.999 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.597 -2.482 0.650 1.00 0.00 H new ATOM 0 HG LEU A 72 4.023 -5.035 1.092 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.787 -4.306 -0.916 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.643 -3.130 0.412 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.741 -2.805 -0.950 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.808 -5.690 -1.147 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.846 -4.245 -1.201 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.155 -5.518 0.004 1.00 0.00 H new ATOM 1165 N VAL A 73 6.528 -2.013 3.637 1.00 0.00 N ATOM 1166 CA VAL A 73 7.169 -0.922 4.351 1.00 0.00 C ATOM 1167 C VAL A 73 8.352 -1.436 5.157 1.00 0.00 C ATOM 1168 O VAL A 73 9.403 -0.805 5.201 1.00 0.00 O ATOM 1169 CB VAL A 73 6.185 -0.207 5.297 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.838 1.012 5.929 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.915 0.182 4.555 1.00 0.00 C ATOM 0 H VAL A 73 5.550 -2.165 3.884 1.00 0.00 H new ATOM 0 HA VAL A 73 7.515 -0.207 3.604 1.00 0.00 H new ATOM 0 HB VAL A 73 5.913 -0.898 6.095 1.00 0.00 H new ATOM 0 HG11 VAL A 73 6.127 1.503 6.593 1.00 0.00 H new ATOM 0 HG12 VAL A 73 7.713 0.701 6.500 1.00 0.00 H new ATOM 0 HG13 VAL A 73 7.143 1.707 5.147 1.00 0.00 H new ATOM 0 HG21 VAL A 73 4.233 0.686 5.240 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.165 0.853 3.733 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.436 -0.714 4.159 1.00 0.00 H new ATOM 1181 N LYS A 74 8.172 -2.591 5.799 1.00 0.00 N ATOM 1182 CA LYS A 74 9.233 -3.186 6.608 1.00 0.00 C ATOM 1183 C LYS A 74 10.524 -3.344 5.810 1.00 0.00 C ATOM 1184 O LYS A 74 11.602 -2.986 6.284 1.00 0.00 O ATOM 1185 CB LYS A 74 8.784 -4.545 7.156 1.00 0.00 C ATOM 1186 CG LYS A 74 7.823 -4.474 8.345 1.00 0.00 C ATOM 1187 CD LYS A 74 7.436 -3.046 8.708 1.00 0.00 C ATOM 1188 CE LYS A 74 6.037 -2.977 9.292 1.00 0.00 C ATOM 1189 NZ LYS A 74 5.145 -2.109 8.476 1.00 0.00 N ATOM 0 H LYS A 74 7.306 -3.130 5.774 1.00 0.00 H new ATOM 0 HA LYS A 74 9.433 -2.511 7.440 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.304 -5.104 6.353 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.667 -5.110 7.454 1.00 0.00 H new ATOM 0 HG2 LYS A 74 6.922 -5.042 8.112 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.286 -4.951 9.209 1.00 0.00 H new ATOM 0 HD2 LYS A 74 8.151 -2.646 9.427 1.00 0.00 H new ATOM 0 HD3 LYS A 74 7.491 -2.417 7.820 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.616 -3.981 9.349 1.00 0.00 H new ATOM 0 HE3 LYS A 74 6.086 -2.593 10.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 4.268 -1.920 9.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 5.627 -1.210 8.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 4.915 -2.590 7.583 1.00 0.00 H new ATOM 1203 N GLU A 75 10.411 -3.877 4.601 1.00 0.00 N ATOM 1204 CA GLU A 75 11.579 -4.078 3.750 1.00 0.00 C ATOM 1205 C GLU A 75 12.242 -2.747 3.412 1.00 0.00 C ATOM 1206 O GLU A 75 13.452 -2.686 3.190 1.00 0.00 O ATOM 1207 CB GLU A 75 11.183 -4.803 2.463 1.00 0.00 C ATOM 1208 CG GLU A 75 10.754 -6.244 2.686 1.00 0.00 C ATOM 1209 CD GLU A 75 11.711 -7.240 2.058 1.00 0.00 C ATOM 1210 OE1 GLU A 75 12.766 -7.516 2.669 1.00 0.00 O ATOM 1211 OE2 GLU A 75 11.405 -7.744 0.958 1.00 0.00 O ATOM 0 H GLU A 75 9.528 -4.177 4.188 1.00 0.00 H new ATOM 0 HA GLU A 75 12.293 -4.692 4.299 1.00 0.00 H new ATOM 0 HB2 GLU A 75 10.368 -4.259 1.985 1.00 0.00 H new ATOM 0 HB3 GLU A 75 12.026 -4.786 1.772 1.00 0.00 H new ATOM 0 HG2 GLU A 75 10.685 -6.437 3.756 1.00 0.00 H new ATOM 0 HG3 GLU A 75 9.757 -6.391 2.270 1.00 0.00 H new ATOM 1218 N VAL A 76 11.447 -1.681 3.367 1.00 0.00 N ATOM 1219 CA VAL A 76 11.979 -0.355 3.046 1.00 0.00 C ATOM 1220 C VAL A 76 12.080 0.529 4.287 1.00 0.00 C ATOM 1221 O VAL A 76 12.304 1.734 4.180 1.00 0.00 O ATOM 1222 CB VAL A 76 11.116 0.376 1.993 1.00 0.00 C ATOM 1223 CG1 VAL A 76 11.999 1.176 1.049 1.00 0.00 C ATOM 1224 CG2 VAL A 76 10.247 -0.602 1.214 1.00 0.00 C ATOM 0 H VAL A 76 10.443 -1.705 3.546 1.00 0.00 H new ATOM 0 HA VAL A 76 12.975 -0.526 2.638 1.00 0.00 H new ATOM 0 HB VAL A 76 10.453 1.063 2.519 1.00 0.00 H new ATOM 0 HG11 VAL A 76 11.377 1.685 0.313 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.566 1.913 1.618 1.00 0.00 H new ATOM 0 HG13 VAL A 76 12.689 0.504 0.538 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.652 -0.056 0.481 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.882 -1.324 0.701 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.584 -1.127 1.902 1.00 0.00 H new ATOM 1234 N TYR A 77 11.905 -0.068 5.461 1.00 0.00 N ATOM 1235 CA TYR A 77 11.971 0.678 6.710 1.00 0.00 C ATOM 1236 C TYR A 77 12.474 -0.203 7.848 1.00 0.00 C ATOM 1237 O TYR A 77 11.790 -1.133 8.275 1.00 0.00 O ATOM 1238 CB TYR A 77 10.592 1.246 7.050 1.00 0.00 C ATOM 1239 CG TYR A 77 10.640 2.593 7.736 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.417 2.789 8.870 1.00 0.00 C ATOM 1241 CD2 TYR A 77 9.910 3.669 7.247 1.00 0.00 C ATOM 1242 CE1 TYR A 77 11.464 4.018 9.500 1.00 0.00 C ATOM 1243 CE2 TYR A 77 9.952 4.902 7.869 1.00 0.00 C ATOM 1244 CZ TYR A 77 10.731 5.071 8.994 1.00 0.00 C ATOM 1245 OH TYR A 77 10.774 6.298 9.618 1.00 0.00 O ATOM 0 H TYR A 77 11.717 -1.064 5.573 1.00 0.00 H new ATOM 0 HA TYR A 77 12.676 1.500 6.583 1.00 0.00 H new ATOM 0 HB2 TYR A 77 10.010 1.336 6.133 1.00 0.00 H new ATOM 0 HB3 TYR A 77 10.067 0.540 7.693 1.00 0.00 H new ATOM 0 HD1 TYR A 77 11.994 1.967 9.266 1.00 0.00 H new ATOM 0 HD2 TYR A 77 9.299 3.540 6.366 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.071 4.153 10.383 1.00 0.00 H new ATOM 0 HE2 TYR A 77 9.378 5.728 7.476 1.00 0.00 H new ATOM 0 HH TYR A 77 10.203 6.931 9.135 1.00 0.00 H new ATOM 1255 N PRO A 78 13.685 0.078 8.357 1.00 0.00 N ATOM 1256 CA PRO A 78 14.281 -0.696 9.450 1.00 0.00 C ATOM 1257 C PRO A 78 13.617 -0.414 10.795 1.00 0.00 C ATOM 1258 O PRO A 78 13.371 -1.331 11.580 1.00 0.00 O ATOM 1259 CB PRO A 78 15.732 -0.222 9.463 1.00 0.00 C ATOM 1260 CG PRO A 78 15.687 1.159 8.911 1.00 0.00 C ATOM 1261 CD PRO A 78 14.571 1.168 7.905 1.00 0.00 C ATOM 0 HA PRO A 78 14.167 -1.769 9.299 1.00 0.00 H new ATOM 0 HB2 PRO A 78 16.142 -0.231 10.473 1.00 0.00 H new ATOM 0 HB3 PRO A 78 16.365 -0.870 8.857 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.506 1.889 9.700 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.636 1.423 8.444 1.00 0.00 H new ATOM 0 HD2 PRO A 78 14.052 2.126 7.891 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.941 0.991 6.895 1.00 0.00 H new ATOM 1269 N GLU A 79 13.339 0.857 11.060 1.00 0.00 N ATOM 1270 CA GLU A 79 12.713 1.261 12.315 1.00 0.00 C ATOM 1271 C GLU A 79 11.317 0.656 12.466 1.00 0.00 C ATOM 1272 O GLU A 79 10.803 0.539 13.578 1.00 0.00 O ATOM 1273 CB GLU A 79 12.630 2.786 12.398 1.00 0.00 C ATOM 1274 CG GLU A 79 12.803 3.328 13.807 1.00 0.00 C ATOM 1275 CD GLU A 79 13.701 4.550 13.856 1.00 0.00 C ATOM 1276 OE1 GLU A 79 13.184 5.674 13.684 1.00 0.00 O ATOM 1277 OE2 GLU A 79 14.920 4.383 14.066 1.00 0.00 O ATOM 0 H GLU A 79 13.537 1.628 10.422 1.00 0.00 H new ATOM 0 HA GLU A 79 13.333 0.887 13.129 1.00 0.00 H new ATOM 0 HB2 GLU A 79 13.396 3.219 11.754 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.665 3.111 12.008 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.826 3.583 14.217 1.00 0.00 H new ATOM 0 HG3 GLU A 79 13.222 2.548 14.443 1.00 0.00 H new ATOM 1284 N ALA A 80 10.707 0.275 11.348 1.00 0.00 N ATOM 1285 CA ALA A 80 9.371 -0.311 11.374 1.00 0.00 C ATOM 1286 C ALA A 80 9.398 -1.729 11.938 1.00 0.00 C ATOM 1287 O ALA A 80 8.444 -2.168 12.580 1.00 0.00 O ATOM 1288 CB ALA A 80 8.766 -0.313 9.977 1.00 0.00 C ATOM 0 H ALA A 80 11.114 0.361 10.417 1.00 0.00 H new ATOM 0 HA ALA A 80 8.751 0.301 12.029 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.769 -0.753 10.013 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.698 0.711 9.609 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.397 -0.898 9.308 1.00 0.00 H new ATOM 1294 N ARG A 81 10.492 -2.439 11.694 1.00 0.00 N ATOM 1295 CA ARG A 81 10.641 -3.808 12.177 1.00 0.00 C ATOM 1296 C ARG A 81 10.565 -3.867 13.703 1.00 0.00 C ATOM 1297 O ARG A 81 10.323 -4.929 14.278 1.00 0.00 O ATOM 1298 CB ARG A 81 11.967 -4.401 11.694 1.00 0.00 C ATOM 1299 CG ARG A 81 11.796 -5.621 10.801 1.00 0.00 C ATOM 1300 CD ARG A 81 12.611 -5.496 9.523 1.00 0.00 C ATOM 1301 NE ARG A 81 13.993 -5.935 9.710 1.00 0.00 N ATOM 1302 CZ ARG A 81 14.490 -7.072 9.225 1.00 0.00 C ATOM 1303 NH1 ARG A 81 13.728 -7.904 8.525 1.00 0.00 N ATOM 1304 NH2 ARG A 81 15.763 -7.381 9.444 1.00 0.00 N ATOM 0 H ARG A 81 11.291 -2.090 11.164 1.00 0.00 H new ATOM 0 HA ARG A 81 9.818 -4.398 11.772 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.521 -3.636 11.149 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.570 -4.676 12.560 1.00 0.00 H new ATOM 0 HG2 ARG A 81 12.103 -6.516 11.343 1.00 0.00 H new ATOM 0 HG3 ARG A 81 10.742 -5.745 10.551 1.00 0.00 H new ATOM 0 HD2 ARG A 81 12.145 -6.090 8.736 1.00 0.00 H new ATOM 0 HD3 ARG A 81 12.602 -4.459 9.187 1.00 0.00 H new ATOM 0 HE ARG A 81 14.617 -5.332 10.246 1.00 0.00 H new ATOM 0 HH11 ARG A 81 12.749 -7.676 8.353 1.00 0.00 H new ATOM 0 HH12 ARG A 81 14.122 -8.771 8.160 1.00 0.00 H new ATOM 0 HH21 ARG A 81 16.356 -6.749 9.982 1.00 0.00 H new ATOM 0 HH22 ARG A 81 16.148 -8.250 9.075 1.00 0.00 H new ATOM 1318 N LYS A 82 10.771 -2.726 14.354 1.00 0.00 N ATOM 1319 CA LYS A 82 10.725 -2.660 15.809 1.00 0.00 C ATOM 1320 C LYS A 82 9.348 -3.063 16.326 1.00 0.00 C ATOM 1321 O LYS A 82 8.324 -2.651 15.782 1.00 0.00 O ATOM 1322 CB LYS A 82 11.072 -1.250 16.290 1.00 0.00 C ATOM 1323 CG LYS A 82 11.904 -1.230 17.563 1.00 0.00 C ATOM 1324 CD LYS A 82 11.594 -0.008 18.413 1.00 0.00 C ATOM 1325 CE LYS A 82 12.855 0.577 19.028 1.00 0.00 C ATOM 1326 NZ LYS A 82 12.563 1.759 19.886 1.00 0.00 N ATOM 0 H LYS A 82 10.971 -1.836 13.897 1.00 0.00 H new ATOM 0 HA LYS A 82 11.462 -3.360 16.203 1.00 0.00 H new ATOM 0 HB2 LYS A 82 11.616 -0.730 15.502 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.149 -0.695 16.460 1.00 0.00 H new ATOM 0 HG2 LYS A 82 11.710 -2.134 18.140 1.00 0.00 H new ATOM 0 HG3 LYS A 82 12.963 -1.237 17.307 1.00 0.00 H new ATOM 0 HD2 LYS A 82 11.102 0.748 17.800 1.00 0.00 H new ATOM 0 HD3 LYS A 82 10.895 -0.281 19.204 1.00 0.00 H new ATOM 0 HE2 LYS A 82 13.356 -0.187 19.622 1.00 0.00 H new ATOM 0 HE3 LYS A 82 13.544 0.867 18.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 13.451 2.126 20.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 12.108 2.499 19.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 11.926 1.478 20.659 1.00 0.00 H new ATOM 1340 N LYS A 83 9.332 -3.871 17.380 1.00 0.00 N ATOM 1341 CA LYS A 83 8.079 -4.330 17.969 1.00 0.00 C ATOM 1342 C LYS A 83 7.304 -3.164 18.575 1.00 0.00 C ATOM 1343 O LYS A 83 7.878 -2.291 19.226 1.00 0.00 O ATOM 1344 CB LYS A 83 8.345 -5.396 19.036 1.00 0.00 C ATOM 1345 CG LYS A 83 9.147 -4.892 20.225 1.00 0.00 C ATOM 1346 CD LYS A 83 10.644 -5.019 19.981 1.00 0.00 C ATOM 1347 CE LYS A 83 11.349 -5.691 21.149 1.00 0.00 C ATOM 1348 NZ LYS A 83 12.372 -6.670 20.690 1.00 0.00 N ATOM 0 H LYS A 83 10.170 -4.221 17.844 1.00 0.00 H new ATOM 0 HA LYS A 83 7.476 -4.770 17.175 1.00 0.00 H new ATOM 0 HB2 LYS A 83 7.391 -5.785 19.392 1.00 0.00 H new ATOM 0 HB3 LYS A 83 8.878 -6.229 18.578 1.00 0.00 H new ATOM 0 HG2 LYS A 83 8.896 -3.849 20.419 1.00 0.00 H new ATOM 0 HG3 LYS A 83 8.873 -5.457 21.116 1.00 0.00 H new ATOM 0 HD2 LYS A 83 10.817 -5.594 19.072 1.00 0.00 H new ATOM 0 HD3 LYS A 83 11.071 -4.030 19.818 1.00 0.00 H new ATOM 0 HE2 LYS A 83 11.825 -4.933 21.771 1.00 0.00 H new ATOM 0 HE3 LYS A 83 10.614 -6.199 21.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 12.830 -7.106 21.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.914 -7.408 20.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 13.088 -6.181 20.116 1.00 0.00 H new ATOM 1362 N GLY A 84 5.995 -3.162 18.355 1.00 0.00 N ATOM 1363 CA GLY A 84 5.154 -2.103 18.884 1.00 0.00 C ATOM 1364 C GLY A 84 4.903 -0.989 17.882 1.00 0.00 C ATOM 1365 O GLY A 84 4.337 0.047 18.231 1.00 0.00 O ATOM 0 H GLY A 84 5.500 -3.875 17.819 1.00 0.00 H new ATOM 0 HA2 GLY A 84 4.199 -2.526 19.196 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.623 -1.685 19.775 1.00 0.00 H new ATOM 1369 N THR A 85 5.322 -1.196 16.635 1.00 0.00 N ATOM 1370 CA THR A 85 5.132 -0.191 15.595 1.00 0.00 C ATOM 1371 C THR A 85 3.718 -0.250 15.023 1.00 0.00 C ATOM 1372 O THR A 85 3.387 -1.146 14.248 1.00 0.00 O ATOM 1373 CB THR A 85 6.150 -0.386 14.470 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.465 -0.459 14.993 1.00 0.00 O ATOM 1375 CG2 THR A 85 6.125 0.725 13.443 1.00 0.00 C ATOM 0 H THR A 85 5.792 -2.046 16.323 1.00 0.00 H new ATOM 0 HA THR A 85 5.282 0.788 16.050 1.00 0.00 H new ATOM 0 HB THR A 85 5.867 -1.318 13.980 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.594 -1.324 15.435 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.870 0.526 12.673 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.137 0.776 12.986 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.350 1.675 13.929 1.00 0.00 H new ATOM 1383 N HIS A 86 2.892 0.720 15.405 1.00 0.00 N ATOM 1384 CA HIS A 86 1.517 0.788 14.923 1.00 0.00 C ATOM 1385 C HIS A 86 1.414 1.754 13.749 1.00 0.00 C ATOM 1386 O HIS A 86 1.506 2.969 13.923 1.00 0.00 O ATOM 1387 CB HIS A 86 0.579 1.225 16.050 1.00 0.00 C ATOM 1388 CG HIS A 86 -0.794 0.639 15.947 1.00 0.00 C ATOM 1389 ND1 HIS A 86 -1.913 1.388 15.647 1.00 0.00 N ATOM 1390 CD2 HIS A 86 -1.228 -0.634 16.108 1.00 0.00 C ATOM 1391 CE1 HIS A 86 -2.975 0.603 15.627 1.00 0.00 C ATOM 1392 NE2 HIS A 86 -2.587 -0.629 15.904 1.00 0.00 N ATOM 0 H HIS A 86 3.151 1.469 16.047 1.00 0.00 H new ATOM 0 HA HIS A 86 1.219 -0.205 14.586 1.00 0.00 H new ATOM 0 HB2 HIS A 86 1.016 0.939 17.007 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.502 2.312 16.047 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -0.620 -1.493 16.351 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -3.988 0.915 15.420 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -3.197 -1.445 15.958 1.00 0.00 H new ATOM 1400 N PHE A 87 1.237 1.207 12.551 1.00 0.00 N ATOM 1401 CA PHE A 87 1.138 2.025 11.343 1.00 0.00 C ATOM 1402 C PHE A 87 -0.262 1.960 10.743 1.00 0.00 C ATOM 1403 O PHE A 87 -0.971 0.968 10.901 1.00 0.00 O ATOM 1404 CB PHE A 87 2.173 1.578 10.305 1.00 0.00 C ATOM 1405 CG PHE A 87 2.724 0.204 10.556 1.00 0.00 C ATOM 1406 CD1 PHE A 87 2.048 -0.917 10.110 1.00 0.00 C ATOM 1407 CD2 PHE A 87 3.912 0.036 11.249 1.00 0.00 C ATOM 1408 CE1 PHE A 87 2.545 -2.183 10.348 1.00 0.00 C ATOM 1409 CE2 PHE A 87 4.416 -1.226 11.488 1.00 0.00 C ATOM 1410 CZ PHE A 87 3.731 -2.337 11.037 1.00 0.00 C ATOM 0 H PHE A 87 1.159 0.203 12.388 1.00 0.00 H new ATOM 0 HA PHE A 87 1.341 3.058 11.626 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.716 1.602 9.316 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.995 2.293 10.293 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.120 -0.801 9.569 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.449 0.902 11.606 1.00 0.00 H new ATOM 0 HE1 PHE A 87 2.007 -3.051 9.996 1.00 0.00 H new ATOM 0 HE2 PHE A 87 5.344 -1.345 12.027 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.123 -3.326 11.223 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.651 3.031 10.056 1.00 0.00 N ATOM 1421 CA ASN A 88 -1.967 3.103 9.431 1.00 0.00 C ATOM 1422 C ASN A 88 -1.857 3.337 7.929 1.00 0.00 C ATOM 1423 O ASN A 88 -0.908 3.959 7.454 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.795 4.222 10.067 1.00 0.00 C ATOM 1425 CG ASN A 88 -3.024 4.006 11.550 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -2.102 3.672 12.292 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -4.264 4.198 11.990 1.00 0.00 N ATOM 0 H ASN A 88 -0.073 3.860 9.919 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.463 2.146 9.593 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -2.288 5.175 9.916 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.758 4.290 9.560 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.480 4.068 12.978 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.999 4.475 11.339 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.846 2.844 7.190 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.877 3.007 5.741 1.00 0.00 C ATOM 1436 C PHE A 89 -3.981 3.978 5.342 1.00 0.00 C ATOM 1437 O PHE A 89 -5.140 3.811 5.729 1.00 0.00 O ATOM 1438 CB PHE A 89 -3.087 1.659 5.050 1.00 0.00 C ATOM 1439 CG PHE A 89 -2.115 0.608 5.494 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -0.901 0.445 4.848 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -2.417 -0.218 6.561 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -0.006 -0.526 5.260 1.00 0.00 C ATOM 1443 CE2 PHE A 89 -1.532 -1.185 6.978 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.324 -1.342 6.329 1.00 0.00 C ATOM 0 H PHE A 89 -3.638 2.327 7.572 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.917 3.413 5.422 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -4.102 1.312 5.246 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.999 1.793 3.972 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.650 1.083 4.013 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.360 -0.102 7.074 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.937 -0.646 4.748 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.783 -1.822 7.814 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.371 -2.101 6.656 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.614 4.976 4.545 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.563 5.972 4.077 1.00 0.00 C ATOM 1456 C ALA A 90 -4.166 6.484 2.700 1.00 0.00 C ATOM 1457 O ALA A 90 -2.985 6.557 2.382 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.634 7.128 5.066 1.00 0.00 C ATOM 0 H ALA A 90 -2.661 5.114 4.210 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.546 5.507 4.002 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.347 7.870 4.708 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.955 6.755 6.039 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.650 7.587 5.160 1.00 0.00 H new ATOM 1464 N ILE A 91 -5.152 6.848 1.889 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.879 7.365 0.553 1.00 0.00 C ATOM 1466 C ILE A 91 -4.807 8.884 0.588 1.00 0.00 C ATOM 1467 O ILE A 91 -5.801 9.551 0.881 1.00 0.00 O ATOM 1468 CB ILE A 91 -5.957 6.932 -0.457 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -6.179 5.418 -0.386 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.566 7.353 -1.868 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -7.635 5.017 -0.468 1.00 0.00 C ATOM 0 H ILE A 91 -6.142 6.796 2.130 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.923 6.952 0.231 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.893 7.428 -0.199 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -5.632 4.940 -1.199 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -5.758 5.040 0.546 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.339 7.039 -2.569 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.459 8.437 -1.908 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.620 6.885 -2.138 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -7.717 3.932 -0.412 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -8.183 5.466 0.360 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -8.055 5.364 -1.412 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.623 9.426 0.309 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.423 10.873 0.333 1.00 0.00 C ATOM 1485 C VAL A 92 -2.650 11.360 -0.890 1.00 0.00 C ATOM 1486 O VAL A 92 -1.997 10.579 -1.579 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.690 11.321 1.627 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -2.964 10.351 2.767 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -1.190 11.464 1.396 1.00 0.00 C ATOM 0 H VAL A 92 -2.792 8.888 0.065 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.415 11.325 0.315 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.081 12.300 1.904 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.440 10.685 3.663 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.035 10.315 2.965 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.613 9.357 2.491 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.708 11.779 2.321 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.778 10.506 1.079 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.011 12.210 0.622 1.00 0.00 H new ATOM 1673 N VAL A 103 -7.858 13.783 2.343 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.411 12.395 2.291 1.00 0.00 C ATOM 1675 C VAL A 103 -8.059 11.580 3.411 1.00 0.00 C ATOM 1676 O VAL A 103 -8.562 12.146 4.382 1.00 0.00 O ATOM 1677 CB VAL A 103 -5.863 12.297 2.358 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -5.222 13.443 1.581 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.355 12.278 3.796 1.00 0.00 C ATOM 0 HA VAL A 103 -7.726 11.976 1.335 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.575 11.352 1.898 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.137 13.359 1.638 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.535 13.395 0.538 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.536 14.394 2.011 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.267 12.209 3.797 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.661 13.194 4.302 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.774 11.418 4.318 1.00 0.00 H new ATOM 1689 N LYS A 104 -8.069 10.255 3.269 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.691 9.400 4.281 1.00 0.00 C ATOM 1691 C LYS A 104 -7.951 8.075 4.457 1.00 0.00 C ATOM 1692 O LYS A 104 -7.159 7.671 3.606 1.00 0.00 O ATOM 1693 CB LYS A 104 -10.149 9.128 3.911 1.00 0.00 C ATOM 1694 CG LYS A 104 -11.082 9.071 5.110 1.00 0.00 C ATOM 1695 CD LYS A 104 -12.525 9.326 4.704 1.00 0.00 C ATOM 1696 CE LYS A 104 -13.267 8.027 4.430 1.00 0.00 C ATOM 1697 NZ LYS A 104 -14.073 8.102 3.180 1.00 0.00 N ATOM 0 H LYS A 104 -7.661 9.756 2.478 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.639 9.934 5.230 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.493 9.906 3.230 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.208 8.183 3.371 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -11.004 8.094 5.587 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -10.774 9.812 5.848 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -13.034 9.877 5.495 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -12.548 9.954 3.813 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -12.551 7.209 4.352 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -13.922 7.798 5.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -14.563 7.198 3.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -14.774 8.866 3.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -13.446 8.295 2.373 1.00 0.00 H new ATOM 1711 N GLU A 105 -8.231 7.407 5.577 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.612 6.122 5.899 1.00 0.00 C ATOM 1713 C GLU A 105 -8.624 4.985 5.753 1.00 0.00 C ATOM 1714 O GLU A 105 -9.823 5.184 5.946 1.00 0.00 O ATOM 1715 CB GLU A 105 -7.041 6.166 7.323 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.515 4.832 7.835 1.00 0.00 C ATOM 1717 CD GLU A 105 -7.003 4.514 9.234 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -8.143 4.021 9.369 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -6.245 4.754 10.197 1.00 0.00 O ATOM 0 H GLU A 105 -8.889 7.739 6.282 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.797 5.935 5.200 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.233 6.897 7.354 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.817 6.520 8.001 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.826 4.038 7.156 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.425 4.848 7.829 1.00 0.00 H new ATOM 1726 N ILE A 106 -8.136 3.796 5.395 1.00 0.00 N ATOM 1727 CA ILE A 106 -9.007 2.639 5.206 1.00 0.00 C ATOM 1728 C ILE A 106 -8.702 1.510 6.191 1.00 0.00 C ATOM 1729 O ILE A 106 -9.539 0.633 6.409 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.905 2.086 3.773 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -7.453 2.114 3.284 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -9.802 2.877 2.833 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.531 1.214 4.077 1.00 0.00 C ATOM 0 H ILE A 106 -7.146 3.611 5.231 1.00 0.00 H new ATOM 0 HA ILE A 106 -10.020 2.998 5.391 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.242 1.049 3.780 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.425 1.816 2.236 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.081 3.137 3.335 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.718 2.473 1.824 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.836 2.803 3.169 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.495 3.923 2.832 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.520 1.284 3.675 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.529 1.525 5.122 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.879 0.183 4.006 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.511 1.522 6.780 1.00 0.00 N ATOM 1746 CA GLY A 107 -7.148 0.472 7.723 1.00 0.00 C ATOM 1747 C GLY A 107 -5.712 0.591 8.188 1.00 0.00 C ATOM 1748 O GLY A 107 -4.871 1.117 7.466 1.00 0.00 O ATOM 0 H GLY A 107 -6.794 2.231 6.626 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.812 0.516 8.586 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.297 -0.501 7.255 1.00 0.00 H new ATOM 1752 N SER A 108 -5.430 0.117 9.405 1.00 0.00 N ATOM 1753 CA SER A 108 -4.086 0.208 9.962 1.00 0.00 C ATOM 1754 C SER A 108 -3.608 -1.134 10.519 1.00 0.00 C ATOM 1755 O SER A 108 -4.382 -1.889 11.108 1.00 0.00 O ATOM 1756 CB SER A 108 -4.063 1.260 11.065 1.00 0.00 C ATOM 1757 OG SER A 108 -4.815 0.837 12.190 1.00 0.00 O ATOM 0 H SER A 108 -6.113 -0.330 10.017 1.00 0.00 H new ATOM 0 HA SER A 108 -3.408 0.493 9.157 1.00 0.00 H new ATOM 0 HB2 SER A 108 -3.033 1.455 11.365 1.00 0.00 H new ATOM 0 HB3 SER A 108 -4.467 2.198 10.685 1.00 0.00 H new ATOM 0 HG SER A 108 -4.783 1.529 12.884 1.00 0.00 H new ATOM 1763 N THR A 109 -2.314 -1.405 10.351 1.00 0.00 N ATOM 1764 CA THR A 109 -1.705 -2.635 10.854 1.00 0.00 C ATOM 1765 C THR A 109 -0.550 -2.296 11.789 1.00 0.00 C ATOM 1766 O THR A 109 -0.378 -1.141 12.178 1.00 0.00 O ATOM 1767 CB THR A 109 -1.203 -3.511 9.702 1.00 0.00 C ATOM 1768 OG1 THR A 109 -0.223 -2.835 8.933 1.00 0.00 O ATOM 1769 CG2 THR A 109 -2.303 -3.957 8.765 1.00 0.00 C ATOM 0 H THR A 109 -1.664 -0.785 9.867 1.00 0.00 H new ATOM 0 HA THR A 109 -2.464 -3.193 11.402 1.00 0.00 H new ATOM 0 HB THR A 109 -0.778 -4.393 10.182 1.00 0.00 H new ATOM 0 HG1 THR A 109 -0.530 -2.758 8.006 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.878 -4.573 7.973 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.041 -4.537 9.320 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.784 -3.083 8.326 1.00 0.00 H new ATOM 1777 N MET A 110 0.247 -3.298 12.145 1.00 0.00 N ATOM 1778 CA MET A 110 1.384 -3.080 13.028 1.00 0.00 C ATOM 1779 C MET A 110 2.409 -4.203 12.891 1.00 0.00 C ATOM 1780 O MET A 110 2.119 -5.259 12.331 1.00 0.00 O ATOM 1781 CB MET A 110 0.919 -2.926 14.482 1.00 0.00 C ATOM 1782 CG MET A 110 0.614 -4.233 15.197 1.00 0.00 C ATOM 1783 SD MET A 110 0.760 -4.081 16.988 1.00 0.00 S ATOM 1784 CE MET A 110 2.417 -3.419 17.136 1.00 0.00 C ATOM 0 H MET A 110 0.127 -4.263 11.837 1.00 0.00 H new ATOM 0 HA MET A 110 1.872 -2.152 12.731 1.00 0.00 H new ATOM 0 HB2 MET A 110 1.689 -2.394 15.040 1.00 0.00 H new ATOM 0 HB3 MET A 110 0.025 -2.302 14.499 1.00 0.00 H new ATOM 0 HG2 MET A 110 -0.395 -4.557 14.943 1.00 0.00 H new ATOM 0 HG3 MET A 110 1.296 -5.006 14.843 1.00 0.00 H new ATOM 0 HE1 MET A 110 2.915 -3.873 17.992 1.00 0.00 H new ATOM 0 HE2 MET A 110 2.980 -3.641 16.229 1.00 0.00 H new ATOM 0 HE3 MET A 110 2.366 -2.339 17.277 1.00 0.00 H new ATOM 1794 N SER A 111 3.616 -3.950 13.385 1.00 0.00 N ATOM 1795 CA SER A 111 4.702 -4.921 13.298 1.00 0.00 C ATOM 1796 C SER A 111 4.528 -6.071 14.289 1.00 0.00 C ATOM 1797 O SER A 111 4.619 -5.878 15.500 1.00 0.00 O ATOM 1798 CB SER A 111 6.042 -4.228 13.546 1.00 0.00 C ATOM 1799 OG SER A 111 6.031 -3.518 14.771 1.00 0.00 O ATOM 0 H SER A 111 3.868 -3.078 13.851 1.00 0.00 H new ATOM 0 HA SER A 111 4.681 -5.343 12.293 1.00 0.00 H new ATOM 0 HB2 SER A 111 6.841 -4.969 13.559 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.257 -3.542 12.727 1.00 0.00 H new ATOM 0 HG SER A 111 6.945 -3.449 15.117 1.00 0.00 H new ATOM 1805 N GLY A 112 4.309 -7.274 13.760 1.00 0.00 N ATOM 1806 CA GLY A 112 4.164 -8.444 14.608 1.00 0.00 C ATOM 1807 C GLY A 112 2.761 -8.643 15.151 1.00 0.00 C ATOM 1808 O GLY A 112 2.584 -9.289 16.184 1.00 0.00 O ATOM 0 H GLY A 112 4.230 -7.458 12.760 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.452 -9.329 14.041 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.858 -8.362 15.445 1.00 0.00 H new ATOM 1812 N ARG A 113 1.758 -8.099 14.470 1.00 0.00 N ATOM 1813 CA ARG A 113 0.380 -8.245 14.927 1.00 0.00 C ATOM 1814 C ARG A 113 -0.603 -8.221 13.761 1.00 0.00 C ATOM 1815 O ARG A 113 -0.447 -7.448 12.817 1.00 0.00 O ATOM 1816 CB ARG A 113 0.037 -7.143 15.930 1.00 0.00 C ATOM 1817 CG ARG A 113 -0.404 -7.669 17.287 1.00 0.00 C ATOM 1818 CD ARG A 113 0.712 -7.565 18.317 1.00 0.00 C ATOM 1819 NE ARG A 113 0.809 -8.764 19.147 1.00 0.00 N ATOM 1820 CZ ARG A 113 0.174 -8.923 20.307 1.00 0.00 C ATOM 1821 NH1 ARG A 113 -0.620 -7.969 20.777 1.00 0.00 N ATOM 1822 NH2 ARG A 113 0.331 -10.043 20.998 1.00 0.00 N ATOM 0 H ARG A 113 1.870 -7.560 13.611 1.00 0.00 H new ATOM 0 HA ARG A 113 0.292 -9.215 15.416 1.00 0.00 H new ATOM 0 HB2 ARG A 113 0.908 -6.502 16.064 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.756 -6.521 15.516 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -1.272 -7.106 17.632 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -0.716 -8.709 17.191 1.00 0.00 H new ATOM 0 HD2 ARG A 113 1.661 -7.400 17.807 1.00 0.00 H new ATOM 0 HD3 ARG A 113 0.537 -6.697 18.953 1.00 0.00 H new ATOM 0 HE ARG A 113 1.400 -9.527 18.817 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -0.748 -7.106 20.249 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -1.102 -8.099 21.666 1.00 0.00 H new ATOM 0 HH21 ARG A 113 0.937 -10.782 20.641 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -0.155 -10.166 21.887 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.620 -9.076 13.842 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.637 -9.160 12.802 1.00 0.00 C ATOM 1838 C LYS A 114 -3.951 -8.551 13.284 1.00 0.00 C ATOM 1839 O LYS A 114 -4.717 -9.193 14.002 1.00 0.00 O ATOM 1840 CB LYS A 114 -2.856 -10.618 12.390 1.00 0.00 C ATOM 1841 CG LYS A 114 -2.931 -10.822 10.886 1.00 0.00 C ATOM 1842 CD LYS A 114 -2.850 -12.294 10.519 1.00 0.00 C ATOM 1843 CE LYS A 114 -1.431 -12.701 10.152 1.00 0.00 C ATOM 1844 NZ LYS A 114 -1.241 -14.177 10.222 1.00 0.00 N ATOM 0 H LYS A 114 -1.760 -9.721 14.620 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.289 -8.596 11.937 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.044 -11.225 12.790 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.779 -10.980 12.844 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.863 -10.402 10.507 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.118 -10.280 10.403 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -3.198 -12.898 11.357 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -3.516 -12.498 9.681 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -1.202 -12.353 9.145 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -0.727 -12.212 10.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -0.261 -14.413 9.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -1.434 -14.506 11.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.895 -14.643 9.561 1.00 0.00 H new ATOM 1858 N GLY A 115 -4.202 -7.309 12.886 1.00 0.00 N ATOM 1859 CA GLY A 115 -5.421 -6.633 13.289 1.00 0.00 C ATOM 1860 C GLY A 115 -6.630 -7.086 12.492 1.00 0.00 C ATOM 1861 O GLY A 115 -6.606 -8.146 11.867 1.00 0.00 O ATOM 0 H GLY A 115 -3.583 -6.758 12.291 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -5.600 -6.815 14.349 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -5.293 -5.557 13.168 1.00 0.00 H new ATOM 1865 N THR A 116 -7.685 -6.282 12.514 1.00 0.00 N ATOM 1866 CA THR A 116 -8.909 -6.604 11.787 1.00 0.00 C ATOM 1867 C THR A 116 -8.767 -6.264 10.308 1.00 0.00 C ATOM 1868 O THR A 116 -9.337 -6.936 9.450 1.00 0.00 O ATOM 1869 CB THR A 116 -10.096 -5.849 12.387 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.773 -4.484 12.588 1.00 0.00 O ATOM 1871 CG2 THR A 116 -10.556 -6.413 13.714 1.00 0.00 C ATOM 0 H THR A 116 -7.719 -5.401 13.027 1.00 0.00 H new ATOM 0 HA THR A 116 -9.087 -7.675 11.878 1.00 0.00 H new ATOM 0 HB THR A 116 -10.904 -5.961 11.664 1.00 0.00 H new ATOM 0 HG1 THR A 116 -10.545 -4.018 12.971 1.00 0.00 H new ATOM 0 HG21 THR A 116 -11.400 -5.831 14.084 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.861 -7.451 13.582 1.00 0.00 H new ATOM 0 HG23 THR A 116 -9.739 -6.363 14.433 1.00 0.00 H new ATOM 1879 N ASP A 117 -8.002 -5.216 10.018 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.785 -4.787 8.642 1.00 0.00 C ATOM 1881 C ASP A 117 -6.740 -5.662 7.957 1.00 0.00 C ATOM 1882 O ASP A 117 -6.753 -5.817 6.739 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.341 -3.323 8.607 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.393 -2.387 9.167 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -8.393 -2.161 10.396 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -9.218 -1.878 8.379 1.00 0.00 O ATOM 0 H ASP A 117 -7.523 -4.649 10.717 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.727 -4.888 8.104 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.419 -3.212 9.178 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.116 -3.039 7.579 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.834 -6.227 8.751 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.771 -7.089 8.233 1.00 0.00 C ATOM 1893 C ASP A 118 -5.296 -8.077 7.190 1.00 0.00 C ATOM 1894 O ASP A 118 -4.670 -8.288 6.152 1.00 0.00 O ATOM 1895 CB ASP A 118 -4.110 -7.854 9.383 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.779 -7.255 9.785 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -1.820 -7.355 8.992 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -2.694 -6.683 10.892 1.00 0.00 O ATOM 0 H ASP A 118 -5.814 -6.103 9.763 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.036 -6.448 7.746 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.778 -7.859 10.244 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.963 -8.893 9.088 1.00 0.00 H new ATOM 1903 N SER A 119 -6.442 -8.690 7.480 1.00 0.00 N ATOM 1904 CA SER A 119 -7.042 -9.670 6.574 1.00 0.00 C ATOM 1905 C SER A 119 -7.756 -9.006 5.394 1.00 0.00 C ATOM 1906 O SER A 119 -8.313 -9.691 4.538 1.00 0.00 O ATOM 1907 CB SER A 119 -8.027 -10.556 7.339 1.00 0.00 C ATOM 1908 OG SER A 119 -7.371 -11.681 7.899 1.00 0.00 O ATOM 0 H SER A 119 -6.974 -8.526 8.335 1.00 0.00 H new ATOM 0 HA SER A 119 -6.231 -10.277 6.171 1.00 0.00 H new ATOM 0 HB2 SER A 119 -8.503 -9.977 8.131 1.00 0.00 H new ATOM 0 HB3 SER A 119 -8.819 -10.889 6.668 1.00 0.00 H new ATOM 0 HG SER A 119 -8.021 -12.231 8.384 1.00 0.00 H new ATOM 1914 N MET A 120 -7.737 -7.678 5.348 1.00 0.00 N ATOM 1915 CA MET A 120 -8.383 -6.943 4.266 1.00 0.00 C ATOM 1916 C MET A 120 -7.452 -6.816 3.067 1.00 0.00 C ATOM 1917 O MET A 120 -6.232 -6.809 3.220 1.00 0.00 O ATOM 1918 CB MET A 120 -8.807 -5.554 4.745 1.00 0.00 C ATOM 1919 CG MET A 120 -10.119 -5.080 4.144 1.00 0.00 C ATOM 1920 SD MET A 120 -10.901 -3.779 5.116 1.00 0.00 S ATOM 1921 CE MET A 120 -9.572 -2.581 5.213 1.00 0.00 C ATOM 0 H MET A 120 -7.282 -7.089 6.046 1.00 0.00 H new ATOM 0 HA MET A 120 -9.269 -7.500 3.960 1.00 0.00 H new ATOM 0 HB2 MET A 120 -8.897 -5.565 5.831 1.00 0.00 H new ATOM 0 HB3 MET A 120 -8.023 -4.838 4.497 1.00 0.00 H new ATOM 0 HG2 MET A 120 -9.939 -4.714 3.133 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.802 -5.925 4.060 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.383 -2.330 6.257 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.669 -3.003 4.772 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.854 -1.680 4.669 1.00 0.00 H new ATOM 1931 N THR A 121 -8.034 -6.711 1.875 1.00 0.00 N ATOM 1932 CA THR A 121 -7.252 -6.580 0.649 1.00 0.00 C ATOM 1933 C THR A 121 -7.318 -5.153 0.117 1.00 0.00 C ATOM 1934 O THR A 121 -8.291 -4.438 0.355 1.00 0.00 O ATOM 1935 CB THR A 121 -7.758 -7.561 -0.410 1.00 0.00 C ATOM 1936 OG1 THR A 121 -9.155 -7.756 -0.287 1.00 0.00 O ATOM 1937 CG2 THR A 121 -7.094 -8.918 -0.332 1.00 0.00 C ATOM 0 H THR A 121 -9.044 -6.714 1.732 1.00 0.00 H new ATOM 0 HA THR A 121 -6.213 -6.814 0.879 1.00 0.00 H new ATOM 0 HB THR A 121 -7.508 -7.107 -1.369 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.459 -8.385 -0.974 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.498 -9.566 -1.110 1.00 0.00 H new ATOM 0 HG22 THR A 121 -6.019 -8.806 -0.475 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.286 -9.361 0.645 1.00 0.00 H new ATOM 1945 N LEU A 122 -6.276 -4.740 -0.599 1.00 0.00 N ATOM 1946 CA LEU A 122 -6.221 -3.392 -1.158 1.00 0.00 C ATOM 1947 C LEU A 122 -7.400 -3.138 -2.094 1.00 0.00 C ATOM 1948 O LEU A 122 -8.052 -2.097 -2.019 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.902 -3.184 -1.905 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.833 -2.413 -1.130 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -2.504 -2.456 -1.871 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -4.274 -0.972 -0.902 1.00 0.00 C ATOM 0 H LEU A 122 -5.461 -5.317 -0.806 1.00 0.00 H new ATOM 0 HA LEU A 122 -6.281 -2.681 -0.334 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.499 -4.159 -2.177 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.108 -2.654 -2.835 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.700 -2.888 -0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.754 -1.902 -1.306 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -2.183 -3.492 -1.982 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.622 -2.005 -2.856 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.501 -0.438 -0.349 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.435 -0.484 -1.863 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.202 -0.962 -0.330 1.00 0.00 H new ATOM 1964 N GLN A 123 -7.667 -4.098 -2.975 1.00 0.00 N ATOM 1965 CA GLN A 123 -8.765 -3.981 -3.931 1.00 0.00 C ATOM 1966 C GLN A 123 -10.068 -3.590 -3.235 1.00 0.00 C ATOM 1967 O GLN A 123 -10.932 -2.949 -3.833 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.954 -5.301 -4.680 1.00 0.00 C ATOM 1969 CG GLN A 123 -9.246 -6.481 -3.767 1.00 0.00 C ATOM 1970 CD GLN A 123 -9.760 -7.691 -4.523 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -10.540 -7.562 -5.467 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -9.324 -8.876 -4.110 1.00 0.00 N ATOM 0 H GLN A 123 -7.138 -4.967 -3.047 1.00 0.00 H new ATOM 0 HA GLN A 123 -8.508 -3.195 -4.641 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -9.772 -5.192 -5.392 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -8.055 -5.513 -5.258 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -8.338 -6.752 -3.229 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -9.982 -6.184 -3.020 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.678 -8.936 -3.323 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -9.635 -9.726 -4.580 1.00 0.00 H new ATOM 1981 N SER A 124 -10.204 -3.982 -1.973 1.00 0.00 N ATOM 1982 CA SER A 124 -11.402 -3.674 -1.201 1.00 0.00 C ATOM 1983 C SER A 124 -11.347 -2.262 -0.625 1.00 0.00 C ATOM 1984 O SER A 124 -12.371 -1.705 -0.231 1.00 0.00 O ATOM 1985 CB SER A 124 -11.581 -4.690 -0.071 1.00 0.00 C ATOM 1986 OG SER A 124 -11.998 -5.946 -0.574 1.00 0.00 O ATOM 0 H SER A 124 -9.499 -4.514 -1.463 1.00 0.00 H new ATOM 0 HA SER A 124 -12.255 -3.732 -1.877 1.00 0.00 H new ATOM 0 HB2 SER A 124 -10.642 -4.805 0.470 1.00 0.00 H new ATOM 0 HB3 SER A 124 -12.316 -4.319 0.643 1.00 0.00 H new ATOM 0 HG SER A 124 -12.103 -6.577 0.168 1.00 0.00 H new ATOM 1992 N GLN A 125 -10.149 -1.685 -0.575 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.973 -0.338 -0.044 1.00 0.00 C ATOM 1994 C GLN A 125 -10.086 0.717 -1.142 1.00 0.00 C ATOM 1995 O GLN A 125 -9.749 1.881 -0.929 1.00 0.00 O ATOM 1996 CB GLN A 125 -8.621 -0.223 0.658 1.00 0.00 C ATOM 1997 CG GLN A 125 -8.637 -0.752 2.080 1.00 0.00 C ATOM 1998 CD GLN A 125 -8.803 -2.256 2.142 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -9.918 -2.772 2.058 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -7.693 -2.969 2.285 1.00 0.00 N ATOM 0 H GLN A 125 -9.288 -2.129 -0.895 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.770 -0.156 0.676 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.873 -0.769 0.083 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -8.313 0.823 0.670 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.709 -0.472 2.578 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -9.449 -0.278 2.631 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -6.790 -2.499 2.350 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -7.743 -3.987 2.329 1.00 0.00 H new ATOM 2009 N LYS A 126 -10.567 0.303 -2.314 1.00 0.00 N ATOM 2010 CA LYS A 126 -10.740 1.205 -3.453 1.00 0.00 C ATOM 2011 C LYS A 126 -9.403 1.621 -4.074 1.00 0.00 C ATOM 2012 O LYS A 126 -9.380 2.329 -5.080 1.00 0.00 O ATOM 2013 CB LYS A 126 -11.533 2.451 -3.042 1.00 0.00 C ATOM 2014 CG LYS A 126 -12.952 2.148 -2.581 1.00 0.00 C ATOM 2015 CD LYS A 126 -13.081 2.222 -1.067 1.00 0.00 C ATOM 2016 CE LYS A 126 -13.320 3.646 -0.593 1.00 0.00 C ATOM 2017 NZ LYS A 126 -12.208 4.557 -0.982 1.00 0.00 N ATOM 0 H LYS A 126 -10.846 -0.660 -2.500 1.00 0.00 H new ATOM 0 HA LYS A 126 -11.299 0.653 -4.209 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -11.001 2.961 -2.239 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -11.574 3.140 -3.886 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -13.642 2.856 -3.040 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -13.241 1.154 -2.922 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -13.904 1.587 -0.740 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -12.174 1.832 -0.605 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -14.255 4.016 -1.013 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -13.432 3.653 0.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -12.314 5.465 -0.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -11.298 4.125 -0.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -12.234 4.718 -2.009 1.00 0.00 H new ATOM 2031 N PHE A 127 -8.289 1.184 -3.485 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.973 1.526 -4.010 1.00 0.00 C ATOM 2033 C PHE A 127 -6.771 0.939 -5.403 1.00 0.00 C ATOM 2034 O PHE A 127 -7.398 -0.056 -5.766 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.877 1.022 -3.071 1.00 0.00 C ATOM 2036 CG PHE A 127 -4.524 1.594 -3.377 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -4.319 2.962 -3.356 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.460 0.764 -3.689 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -3.076 3.494 -3.639 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -2.214 1.291 -3.973 1.00 0.00 C ATOM 2041 CZ PHE A 127 -2.023 2.657 -3.949 1.00 0.00 C ATOM 0 H PHE A 127 -8.274 0.597 -2.651 1.00 0.00 H new ATOM 0 HA PHE A 127 -6.912 2.612 -4.080 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -6.145 1.271 -2.044 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.827 -0.065 -3.133 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -5.140 3.621 -3.116 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -3.605 -0.306 -3.711 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -2.928 4.564 -3.618 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.391 0.634 -4.213 1.00 0.00 H new ATOM 0 HZ PHE A 127 -1.051 3.071 -4.172 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.890 1.563 -6.179 1.00 0.00 N ATOM 2052 CA GLN A 128 -5.598 1.104 -7.531 1.00 0.00 C ATOM 2053 C GLN A 128 -4.149 1.406 -7.902 1.00 0.00 C ATOM 2054 O GLN A 128 -3.493 2.227 -7.260 1.00 0.00 O ATOM 2055 CB GLN A 128 -6.548 1.765 -8.534 1.00 0.00 C ATOM 2056 CG GLN A 128 -7.484 0.785 -9.223 1.00 0.00 C ATOM 2057 CD GLN A 128 -8.788 0.599 -8.473 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -8.944 -0.345 -7.700 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -9.735 1.503 -8.698 1.00 0.00 N ATOM 0 H GLN A 128 -5.365 2.390 -5.893 1.00 0.00 H new ATOM 0 HA GLN A 128 -5.745 0.025 -7.565 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -7.142 2.519 -8.017 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.960 2.285 -9.290 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -7.697 1.139 -10.232 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -6.986 -0.179 -9.322 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -9.563 2.271 -9.348 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -10.634 1.430 -8.221 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.653 0.737 -8.938 1.00 0.00 N ATOM 2069 CA ILE A 129 -2.279 0.937 -9.387 1.00 0.00 C ATOM 2070 C ILE A 129 -2.041 2.389 -9.791 1.00 0.00 C ATOM 2071 O ILE A 129 -2.766 2.942 -10.616 1.00 0.00 O ATOM 2072 CB ILE A 129 -1.933 0.020 -10.580 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -2.239 -1.440 -10.235 1.00 0.00 C ATOM 2074 CG2 ILE A 129 -0.470 0.184 -10.967 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.897 -2.410 -11.346 1.00 0.00 C ATOM 0 H ILE A 129 -4.180 0.053 -9.481 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.633 0.683 -8.547 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.548 0.309 -11.432 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -1.684 -1.717 -9.339 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -3.298 -1.534 -9.996 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -0.241 -0.469 -11.809 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -0.282 1.220 -11.249 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.162 -0.082 -10.120 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -2.140 -3.425 -11.031 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -2.472 -2.159 -12.238 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.832 -2.345 -11.571 1.00 0.00 H new ATOM 2087 N GLY A 130 -1.015 2.997 -9.203 1.00 0.00 N ATOM 2088 CA GLY A 130 -0.697 4.378 -9.515 1.00 0.00 C ATOM 2089 C GLY A 130 -1.190 5.349 -8.457 1.00 0.00 C ATOM 2090 O GLY A 130 -0.771 6.506 -8.429 1.00 0.00 O ATOM 0 H GLY A 130 -0.400 2.559 -8.518 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.383 4.482 -9.622 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -1.139 4.640 -10.476 1.00 0.00 H new ATOM 2094 N ASP A 131 -2.082 4.883 -7.587 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.627 5.729 -6.529 1.00 0.00 C ATOM 2096 C ASP A 131 -1.597 5.966 -5.428 1.00 0.00 C ATOM 2097 O ASP A 131 -0.690 5.160 -5.222 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.896 5.103 -5.952 1.00 0.00 C ATOM 2099 CG ASP A 131 -5.133 5.456 -6.754 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -5.277 4.940 -7.881 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -5.958 6.250 -6.253 1.00 0.00 O ATOM 0 H ASP A 131 -2.442 3.929 -7.593 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.880 6.696 -6.963 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.782 4.019 -5.924 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -4.027 5.437 -4.923 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.733 7.093 -4.750 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.805 7.476 -3.682 1.00 0.00 C ATOM 2108 C TYR A 132 -1.286 6.997 -2.313 1.00 0.00 C ATOM 2109 O TYR A 132 -2.332 7.420 -1.824 1.00 0.00 O ATOM 2110 CB TYR A 132 -0.619 8.993 -3.662 1.00 0.00 C ATOM 2111 CG TYR A 132 -0.192 9.564 -4.996 1.00 0.00 C ATOM 2112 CD1 TYR A 132 -1.121 9.804 -6.001 1.00 0.00 C ATOM 2113 CD2 TYR A 132 1.140 9.862 -5.251 1.00 0.00 C ATOM 2114 CE1 TYR A 132 -0.735 10.325 -7.220 1.00 0.00 C ATOM 2115 CE2 TYR A 132 1.535 10.384 -6.468 1.00 0.00 C ATOM 2116 CZ TYR A 132 0.593 10.614 -7.449 1.00 0.00 C ATOM 2117 OH TYR A 132 0.983 11.133 -8.662 1.00 0.00 O ATOM 0 H TYR A 132 -2.480 7.767 -4.917 1.00 0.00 H new ATOM 0 HA TYR A 132 0.150 6.993 -3.890 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.554 9.462 -3.357 1.00 0.00 H new ATOM 0 HB3 TYR A 132 0.127 9.250 -2.910 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -2.163 9.579 -5.826 1.00 0.00 H new ATOM 0 HD2 TYR A 132 1.880 9.683 -4.485 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -1.470 10.505 -7.990 1.00 0.00 H new ATOM 0 HE2 TYR A 132 2.575 10.611 -6.650 1.00 0.00 H new ATOM 0 HH TYR A 132 1.952 11.280 -8.658 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.497 6.119 -1.700 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.818 5.582 -0.382 1.00 0.00 C ATOM 2129 C LEU A 133 0.110 6.193 0.669 1.00 0.00 C ATOM 2130 O LEU A 133 1.328 6.056 0.571 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.645 4.056 -0.381 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.917 3.203 -0.520 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.712 1.848 0.135 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -3.134 3.893 0.078 1.00 0.00 C ATOM 0 H LEU A 133 0.373 5.763 -2.097 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.852 5.831 -0.145 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.029 3.792 -1.196 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.149 3.773 0.547 1.00 0.00 H new ATOM 0 HG LEU A 133 -2.106 3.068 -1.585 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.619 1.252 0.031 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.882 1.332 -0.348 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.488 1.985 1.193 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -4.010 3.255 -0.042 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -2.963 4.078 1.138 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.303 4.841 -0.433 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.454 6.855 1.680 1.00 0.00 N ATOM 2147 CA ASP A 134 0.348 7.456 2.733 1.00 0.00 C ATOM 2148 C ASP A 134 0.207 6.656 4.023 1.00 0.00 C ATOM 2149 O ASP A 134 -0.869 6.613 4.621 1.00 0.00 O ATOM 2150 CB ASP A 134 -0.088 8.906 2.970 1.00 0.00 C ATOM 2151 CG ASP A 134 1.085 9.865 2.993 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.765 9.946 4.037 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.324 10.538 1.968 1.00 0.00 O ATOM 0 H ASP A 134 -1.460 6.985 1.787 1.00 0.00 H new ATOM 0 HA ASP A 134 1.393 7.447 2.422 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.784 9.206 2.187 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -0.626 8.971 3.916 1.00 0.00 H new ATOM 2158 N ILE A 135 1.294 6.018 4.445 1.00 0.00 N ATOM 2159 CA ILE A 135 1.278 5.220 5.665 1.00 0.00 C ATOM 2160 C ILE A 135 1.802 6.022 6.854 1.00 0.00 C ATOM 2161 O ILE A 135 2.840 6.676 6.767 1.00 0.00 O ATOM 2162 CB ILE A 135 2.111 3.929 5.503 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.444 2.992 4.491 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.290 3.223 6.844 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.330 2.636 3.319 1.00 0.00 C ATOM 0 H ILE A 135 2.193 6.038 3.963 1.00 0.00 H new ATOM 0 HA ILE A 135 0.240 4.945 5.854 1.00 0.00 H new ATOM 0 HB ILE A 135 3.098 4.204 5.131 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.144 2.076 5.000 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.534 3.462 4.118 1.00 0.00 H new ATOM 0 HG21 ILE A 135 2.880 2.317 6.703 1.00 0.00 H new ATOM 0 HG22 ILE A 135 2.805 3.887 7.539 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.313 2.960 7.250 1.00 0.00 H new ATOM 0 HD11 ILE A 135 1.791 1.970 2.645 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.610 3.544 2.785 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.229 2.136 3.681 1.00 0.00 H new ATOM 2177 N ALA A 136 1.074 5.960 7.964 1.00 0.00 N ATOM 2178 CA ALA A 136 1.461 6.671 9.175 1.00 0.00 C ATOM 2179 C ALA A 136 1.980 5.699 10.230 1.00 0.00 C ATOM 2180 O ALA A 136 1.198 5.010 10.883 1.00 0.00 O ATOM 2181 CB ALA A 136 0.282 7.464 9.718 1.00 0.00 C ATOM 0 H ALA A 136 0.211 5.423 8.049 1.00 0.00 H new ATOM 0 HA ALA A 136 2.265 7.364 8.926 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.584 7.991 10.623 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -0.046 8.186 8.970 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.538 6.784 9.950 1.00 0.00 H new ATOM 2187 N ILE A 137 3.299 5.644 10.386 1.00 0.00 N ATOM 2188 CA ILE A 137 3.919 4.752 11.357 1.00 0.00 C ATOM 2189 C ILE A 137 4.035 5.419 12.724 1.00 0.00 C ATOM 2190 O ILE A 137 4.570 6.521 12.845 1.00 0.00 O ATOM 2191 CB ILE A 137 5.320 4.307 10.890 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.252 3.737 9.471 1.00 0.00 C ATOM 2193 CG2 ILE A 137 5.904 3.282 11.851 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.611 3.460 8.865 1.00 0.00 C ATOM 0 H ILE A 137 3.959 6.208 9.851 1.00 0.00 H new ATOM 0 HA ILE A 137 3.276 3.876 11.441 1.00 0.00 H new ATOM 0 HB ILE A 137 5.975 5.179 10.882 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.675 2.812 9.487 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.714 4.438 8.832 1.00 0.00 H new ATOM 0 HG21 ILE A 137 6.892 2.980 11.505 1.00 0.00 H new ATOM 0 HG22 ILE A 137 5.986 3.721 12.845 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.252 2.409 11.892 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.486 3.058 7.860 1.00 0.00 H new ATOM 0 HD12 ILE A 137 7.184 4.386 8.817 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.144 2.736 9.482 1.00 0.00 H new ATOM 2206 N THR A 138 3.528 4.743 13.749 1.00 0.00 N ATOM 2207 CA THR A 138 3.573 5.267 15.109 1.00 0.00 C ATOM 2208 C THR A 138 4.526 4.450 15.980 1.00 0.00 C ATOM 2209 O THR A 138 4.238 3.300 16.310 1.00 0.00 O ATOM 2210 CB THR A 138 2.174 5.256 15.727 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.185 5.488 14.740 1.00 0.00 O ATOM 2212 CG2 THR A 138 1.991 6.293 16.814 1.00 0.00 C ATOM 0 H THR A 138 3.081 3.830 13.664 1.00 0.00 H new ATOM 0 HA THR A 138 3.939 6.293 15.062 1.00 0.00 H new ATOM 0 HB THR A 138 2.064 4.266 16.169 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.053 4.673 14.212 1.00 0.00 H new ATOM 0 HG21 THR A 138 0.977 6.231 17.209 1.00 0.00 H new ATOM 0 HG22 THR A 138 2.705 6.109 17.617 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.159 7.287 16.400 1.00 0.00 H new ATOM 2220 N PRO A 139 5.676 5.030 16.368 1.00 0.00 N ATOM 2221 CA PRO A 139 6.660 4.337 17.206 1.00 0.00 C ATOM 2222 C PRO A 139 6.125 4.073 18.613 1.00 0.00 C ATOM 2223 O PRO A 139 5.340 4.859 19.143 1.00 0.00 O ATOM 2224 CB PRO A 139 7.843 5.307 17.253 1.00 0.00 C ATOM 2225 CG PRO A 139 7.254 6.644 16.968 1.00 0.00 C ATOM 2226 CD PRO A 139 6.107 6.399 16.027 1.00 0.00 C ATOM 0 HA PRO A 139 6.921 3.357 16.807 1.00 0.00 H new ATOM 0 HB2 PRO A 139 8.330 5.289 18.228 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.600 5.043 16.514 1.00 0.00 H new ATOM 0 HG2 PRO A 139 6.911 7.123 17.885 1.00 0.00 H new ATOM 0 HG3 PRO A 139 7.992 7.308 16.519 1.00 0.00 H new ATOM 0 HD2 PRO A 139 5.305 7.122 16.174 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.418 6.475 14.985 1.00 0.00 H new ATOM 2234 N PRO A 140 6.539 2.956 19.238 1.00 0.00 N ATOM 2235 CA PRO A 140 6.088 2.593 20.583 1.00 0.00 C ATOM 2236 C PRO A 140 6.780 3.397 21.681 1.00 0.00 C ATOM 2237 O PRO A 140 6.318 3.428 22.822 1.00 0.00 O ATOM 2238 CB PRO A 140 6.464 1.116 20.686 1.00 0.00 C ATOM 2239 CG PRO A 140 7.657 0.972 19.802 1.00 0.00 C ATOM 2240 CD PRO A 140 7.470 1.956 18.678 1.00 0.00 C ATOM 0 HA PRO A 140 5.026 2.796 20.722 1.00 0.00 H new ATOM 0 HB2 PRO A 140 6.695 0.836 21.714 1.00 0.00 H new ATOM 0 HB3 PRO A 140 5.646 0.474 20.357 1.00 0.00 H new ATOM 0 HG2 PRO A 140 8.575 1.179 20.351 1.00 0.00 H new ATOM 0 HG3 PRO A 140 7.737 -0.045 19.419 1.00 0.00 H new ATOM 0 HD2 PRO A 140 8.416 2.411 18.383 1.00 0.00 H new ATOM 0 HD3 PRO A 140 7.056 1.476 17.791 1.00 0.00 H new