USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=27 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 -127:sc= -4.35 (180deg=-1.34) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0.00137 USER MOD Set 1.3: A 124 SER OG : rot -23:sc= -0.456! USER MOD Set 1.4: A 125 GLN : amide:sc= -5.65 K(o=-10,f=-25!) USER MOD Set 2.1: A 67 LYS NZ :NH3+ -169:sc= 0 (180deg=0) USER MOD Set 2.2: A 114 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.00268) USER MOD Set 3.1: A 70 THR OG1 : rot -63:sc= 0.714 USER MOD Set 3.2: A 109 THR OG1 : rot -115:sc= -0.0331! USER MOD Set 4.1: A 86 HIS : no HD1:sc= -0.799 K(o=-0.8,f=-0.015) USER MOD Set 4.2: A 108 SER OG : rot -150:sc= 0 USER MOD Set 5.1: A 85 THR OG1 : rot 115:sc= 1.24 USER MOD Set 5.2: A 111 SER OG : rot -131:sc= 0.32 USER MOD Set 6.1: A 35 THR OG1 : rot 119:sc= -1.7 USER MOD Set 6.2: A 37 ASN : amide:sc= -3.46 X(o=-5.2,f=-4.9!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 100:sc= -2.18! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 115:sc= -4.16! USER MOD Single : A 36 ASN : amide:sc= -1.18 X(o=-1.2,f=-0.84) USER MOD Single : A 57 GLN : amide:sc= -0.364 X(o=-0.36,f=-0.66) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -130:sc= -0.591 USER MOD Single : A 62 MET CE :methyl -159:sc= -7.51! (180deg=-11.1!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0903 USER MOD Single : A 71 SER OG : rot 48:sc= 1.17 USER MOD Single : A 74 LYS NZ :NH3+ -144:sc= 1.27 (180deg=0.101) USER MOD Single : A 77 TYR OH : rot 180:sc= -0.0705 USER MOD Single : A 82 LYS NZ :NH3+ -116:sc= 0.102 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -4.45! C(o=-4.5!,f=-9.8!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 MET CE :methyl 166:sc= -4.98! (180deg=-5.31!) USER MOD Single : A 116 THR OG1 : rot 59:sc= 1.01 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.494 X(o=-0.49,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 GLN : amide:sc= -0.136 K(o=-0.14,f=-0.83) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 77:sc= -0.659 USER MOD ----------------------------------------------------------------- ATOM 318 N ASP A 21 -5.308 -12.627 -9.064 1.00 0.00 N ATOM 319 CA ASP A 21 -5.064 -13.859 -8.322 1.00 0.00 C ATOM 320 C ASP A 21 -4.151 -13.601 -7.125 1.00 0.00 C ATOM 321 O ASP A 21 -2.940 -13.448 -7.277 1.00 0.00 O ATOM 322 CB ASP A 21 -4.445 -14.914 -9.244 1.00 0.00 C ATOM 323 CG ASP A 21 -5.303 -16.158 -9.357 1.00 0.00 C ATOM 324 OD1 ASP A 21 -5.289 -16.978 -8.417 1.00 0.00 O ATOM 325 OD2 ASP A 21 -5.990 -16.312 -10.390 1.00 0.00 O ATOM 0 HA ASP A 21 -6.018 -14.230 -7.948 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.299 -14.485 -10.236 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.460 -15.189 -8.867 1.00 0.00 H new ATOM 330 N ARG A 22 -4.745 -13.554 -5.936 1.00 0.00 N ATOM 331 CA ARG A 22 -4.000 -13.309 -4.701 1.00 0.00 C ATOM 332 C ARG A 22 -2.706 -14.124 -4.642 1.00 0.00 C ATOM 333 O ARG A 22 -1.733 -13.710 -4.012 1.00 0.00 O ATOM 334 CB ARG A 22 -4.875 -13.642 -3.489 1.00 0.00 C ATOM 335 CG ARG A 22 -5.633 -12.445 -2.938 1.00 0.00 C ATOM 336 CD ARG A 22 -6.857 -12.123 -3.781 1.00 0.00 C ATOM 337 NE ARG A 22 -7.996 -12.975 -3.440 1.00 0.00 N ATOM 338 CZ ARG A 22 -9.167 -12.934 -4.071 1.00 0.00 C ATOM 339 NH1 ARG A 22 -9.358 -12.088 -5.075 1.00 0.00 N ATOM 340 NH2 ARG A 22 -10.150 -13.741 -3.696 1.00 0.00 N ATOM 0 H ARG A 22 -5.748 -13.683 -5.800 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.730 -12.253 -4.685 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -5.589 -14.416 -3.769 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -4.247 -14.058 -2.701 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -5.940 -12.648 -1.912 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.973 -11.578 -2.907 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -7.131 -11.078 -3.639 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -6.614 -12.248 -4.836 1.00 0.00 H new ATOM 0 HE ARG A 22 -7.886 -13.639 -2.674 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -8.605 -11.465 -5.367 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -10.258 -12.061 -5.555 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.008 -14.393 -2.924 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -11.048 -13.710 -4.179 1.00 0.00 H new ATOM 354 N GLU A 23 -2.705 -15.284 -5.290 1.00 0.00 N ATOM 355 CA GLU A 23 -1.530 -16.152 -5.296 1.00 0.00 C ATOM 356 C GLU A 23 -0.700 -15.964 -6.564 1.00 0.00 C ATOM 357 O GLU A 23 0.514 -15.774 -6.501 1.00 0.00 O ATOM 358 CB GLU A 23 -1.956 -17.617 -5.161 1.00 0.00 C ATOM 359 CG GLU A 23 -1.554 -18.248 -3.838 1.00 0.00 C ATOM 360 CD GLU A 23 -2.276 -19.553 -3.572 1.00 0.00 C ATOM 361 OE1 GLU A 23 -1.936 -20.565 -4.221 1.00 0.00 O ATOM 362 OE2 GLU A 23 -3.184 -19.565 -2.714 1.00 0.00 O ATOM 0 H GLU A 23 -3.501 -15.645 -5.816 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.908 -15.876 -4.444 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -3.038 -17.684 -5.272 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -1.516 -18.191 -5.976 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.478 -18.425 -3.836 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -1.763 -17.549 -3.028 1.00 0.00 H new ATOM 369 N LYS A 24 -1.361 -16.027 -7.716 1.00 0.00 N ATOM 370 CA LYS A 24 -0.683 -15.873 -9.002 1.00 0.00 C ATOM 371 C LYS A 24 -0.680 -14.416 -9.463 1.00 0.00 C ATOM 372 O LYS A 24 -0.669 -14.138 -10.662 1.00 0.00 O ATOM 373 CB LYS A 24 -1.352 -16.755 -10.060 1.00 0.00 C ATOM 374 CG LYS A 24 -0.627 -18.068 -10.302 1.00 0.00 C ATOM 375 CD LYS A 24 -0.224 -18.225 -11.760 1.00 0.00 C ATOM 376 CE LYS A 24 -1.285 -18.967 -12.556 1.00 0.00 C ATOM 377 NZ LYS A 24 -0.814 -19.310 -13.927 1.00 0.00 N ATOM 0 H LYS A 24 -2.366 -16.184 -7.787 1.00 0.00 H new ATOM 0 HA LYS A 24 0.353 -16.187 -8.872 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -2.376 -16.966 -9.751 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -1.410 -16.203 -10.998 1.00 0.00 H new ATOM 0 HG2 LYS A 24 0.261 -18.116 -9.671 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -1.270 -18.898 -10.010 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -0.059 -17.242 -12.201 1.00 0.00 H new ATOM 0 HD3 LYS A 24 0.721 -18.764 -11.821 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.562 -19.880 -12.029 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -2.183 -18.353 -12.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -1.567 -19.815 -14.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -0.574 -18.438 -14.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 0.028 -19.917 -13.863 1.00 0.00 H new ATOM 391 N THR A 25 -0.690 -13.492 -8.509 1.00 0.00 N ATOM 392 CA THR A 25 -0.691 -12.068 -8.825 1.00 0.00 C ATOM 393 C THR A 25 0.684 -11.604 -9.298 1.00 0.00 C ATOM 394 O THR A 25 1.693 -12.264 -9.054 1.00 0.00 O ATOM 395 CB THR A 25 -1.105 -11.254 -7.599 1.00 0.00 C ATOM 396 OG1 THR A 25 -0.962 -9.869 -7.851 1.00 0.00 O ATOM 397 CG2 THR A 25 -0.296 -11.586 -6.365 1.00 0.00 C ATOM 0 H THR A 25 -0.698 -13.703 -7.511 1.00 0.00 H new ATOM 0 HA THR A 25 -1.408 -11.909 -9.631 1.00 0.00 H new ATOM 0 HB THR A 25 -2.146 -11.515 -7.410 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.836 -9.485 -8.072 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.639 -10.975 -5.530 1.00 0.00 H new ATOM 0 HG22 THR A 25 -0.423 -12.640 -6.119 1.00 0.00 H new ATOM 0 HG23 THR A 25 0.758 -11.383 -6.555 1.00 0.00 H new ATOM 405 N SER A 26 0.713 -10.455 -9.967 1.00 0.00 N ATOM 406 CA SER A 26 1.960 -9.887 -10.466 1.00 0.00 C ATOM 407 C SER A 26 2.375 -8.683 -9.621 1.00 0.00 C ATOM 408 O SER A 26 1.541 -7.846 -9.276 1.00 0.00 O ATOM 409 CB SER A 26 1.809 -9.472 -11.930 1.00 0.00 C ATOM 410 OG SER A 26 1.576 -10.598 -12.759 1.00 0.00 O ATOM 0 H SER A 26 -0.116 -9.898 -10.176 1.00 0.00 H new ATOM 0 HA SER A 26 2.736 -10.649 -10.395 1.00 0.00 H new ATOM 0 HB2 SER A 26 0.983 -8.767 -12.028 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.710 -8.955 -12.259 1.00 0.00 H new ATOM 0 HG SER A 26 1.481 -10.305 -13.689 1.00 0.00 H new ATOM 416 N PRO A 27 3.669 -8.579 -9.269 1.00 0.00 N ATOM 417 CA PRO A 27 4.175 -7.470 -8.455 1.00 0.00 C ATOM 418 C PRO A 27 4.244 -6.154 -9.226 1.00 0.00 C ATOM 419 O PRO A 27 4.726 -6.108 -10.358 1.00 0.00 O ATOM 420 CB PRO A 27 5.580 -7.930 -8.065 1.00 0.00 C ATOM 421 CG PRO A 27 5.992 -8.853 -9.158 1.00 0.00 C ATOM 422 CD PRO A 27 4.735 -9.534 -9.629 1.00 0.00 C ATOM 0 HA PRO A 27 3.523 -7.264 -7.606 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.264 -7.086 -7.981 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.577 -8.436 -7.099 1.00 0.00 H new ATOM 0 HG2 PRO A 27 6.466 -8.305 -9.972 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.718 -9.582 -8.799 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.759 -9.723 -10.702 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.593 -10.497 -9.139 1.00 0.00 H new ATOM 430 N LEU A 28 3.767 -5.085 -8.595 1.00 0.00 N ATOM 431 CA LEU A 28 3.778 -3.761 -9.206 1.00 0.00 C ATOM 432 C LEU A 28 4.329 -2.729 -8.226 1.00 0.00 C ATOM 433 O LEU A 28 3.942 -2.702 -7.058 1.00 0.00 O ATOM 434 CB LEU A 28 2.371 -3.363 -9.654 1.00 0.00 C ATOM 435 CG LEU A 28 1.317 -3.348 -8.546 1.00 0.00 C ATOM 436 CD1 LEU A 28 1.221 -1.966 -7.914 1.00 0.00 C ATOM 437 CD2 LEU A 28 -0.034 -3.788 -9.090 1.00 0.00 C ATOM 0 H LEU A 28 3.367 -5.111 -7.657 1.00 0.00 H new ATOM 0 HA LEU A 28 4.425 -3.794 -10.083 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.417 -2.371 -10.104 1.00 0.00 H new ATOM 0 HB3 LEU A 28 2.046 -4.052 -10.434 1.00 0.00 H new ATOM 0 HG LEU A 28 1.621 -4.054 -7.773 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.466 -1.977 -7.128 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.186 -1.694 -7.486 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.943 -1.237 -8.675 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.772 -3.771 -8.288 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.345 -3.109 -9.884 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.046 -4.799 -9.488 1.00 0.00 H new ATOM 449 N LEU A 29 5.239 -1.889 -8.705 1.00 0.00 N ATOM 450 CA LEU A 29 5.850 -0.865 -7.867 1.00 0.00 C ATOM 451 C LEU A 29 4.916 0.326 -7.674 1.00 0.00 C ATOM 452 O LEU A 29 4.396 0.883 -8.641 1.00 0.00 O ATOM 453 CB LEU A 29 7.167 -0.393 -8.485 1.00 0.00 C ATOM 454 CG LEU A 29 8.133 0.282 -7.512 1.00 0.00 C ATOM 455 CD1 LEU A 29 8.445 -0.639 -6.344 1.00 0.00 C ATOM 456 CD2 LEU A 29 9.412 0.691 -8.229 1.00 0.00 C ATOM 0 H LEU A 29 5.570 -1.897 -9.670 1.00 0.00 H new ATOM 0 HA LEU A 29 6.045 -1.308 -6.890 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.668 -1.251 -8.934 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.943 0.304 -9.292 1.00 0.00 H new ATOM 0 HG LEU A 29 7.656 1.181 -7.121 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.134 -0.141 -5.662 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.523 -0.881 -5.815 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.902 -1.556 -6.716 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.089 1.170 -7.521 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.892 -0.193 -8.649 1.00 0.00 H new ATOM 0 HD23 LEU A 29 9.172 1.389 -9.031 1.00 0.00 H new ATOM 468 N LEU A 30 4.716 0.717 -6.418 1.00 0.00 N ATOM 469 CA LEU A 30 3.853 1.850 -6.099 1.00 0.00 C ATOM 470 C LEU A 30 4.549 2.814 -5.144 1.00 0.00 C ATOM 471 O LEU A 30 5.555 2.466 -4.519 1.00 0.00 O ATOM 472 CB LEU A 30 2.530 1.368 -5.492 1.00 0.00 C ATOM 473 CG LEU A 30 2.634 0.714 -4.111 1.00 0.00 C ATOM 474 CD1 LEU A 30 2.899 1.760 -3.039 1.00 0.00 C ATOM 475 CD2 LEU A 30 1.362 -0.056 -3.795 1.00 0.00 C ATOM 0 H LEU A 30 5.139 0.267 -5.606 1.00 0.00 H new ATOM 0 HA LEU A 30 3.639 2.380 -7.027 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.852 2.219 -5.421 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.075 0.654 -6.179 1.00 0.00 H new ATOM 0 HG LEU A 30 3.472 0.017 -4.124 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.969 1.274 -2.066 1.00 0.00 H new ATOM 0 HD12 LEU A 30 3.835 2.274 -3.256 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.083 2.482 -3.026 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.450 -0.516 -2.811 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.512 0.627 -3.802 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.210 -0.832 -4.545 1.00 0.00 H new ATOM 487 N ARG A 31 4.007 4.025 -5.038 1.00 0.00 N ATOM 488 CA ARG A 31 4.571 5.048 -4.163 1.00 0.00 C ATOM 489 C ARG A 31 3.915 5.019 -2.783 1.00 0.00 C ATOM 490 O ARG A 31 2.689 4.960 -2.664 1.00 0.00 O ATOM 491 CB ARG A 31 4.398 6.433 -4.788 1.00 0.00 C ATOM 492 CG ARG A 31 5.181 6.621 -6.078 1.00 0.00 C ATOM 493 CD ARG A 31 5.800 8.008 -6.162 1.00 0.00 C ATOM 494 NE ARG A 31 5.037 8.897 -7.032 1.00 0.00 N ATOM 495 CZ ARG A 31 5.135 10.224 -7.008 1.00 0.00 C ATOM 496 NH1 ARG A 31 5.961 10.819 -6.157 1.00 0.00 N ATOM 497 NH2 ARG A 31 4.405 10.959 -7.837 1.00 0.00 N ATOM 0 H ARG A 31 3.176 4.322 -5.549 1.00 0.00 H new ATOM 0 HA ARG A 31 5.633 4.836 -4.043 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.340 6.603 -4.987 1.00 0.00 H new ATOM 0 HB3 ARG A 31 4.712 7.189 -4.068 1.00 0.00 H new ATOM 0 HG2 ARG A 31 5.966 5.867 -6.141 1.00 0.00 H new ATOM 0 HG3 ARG A 31 4.521 6.465 -6.931 1.00 0.00 H new ATOM 0 HD2 ARG A 31 5.857 8.440 -5.163 1.00 0.00 H new ATOM 0 HD3 ARG A 31 6.822 7.927 -6.533 1.00 0.00 H new ATOM 0 HE ARG A 31 4.390 8.476 -7.699 1.00 0.00 H new ATOM 0 HH11 ARG A 31 6.525 10.259 -5.517 1.00 0.00 H new ATOM 0 HH12 ARG A 31 6.032 11.836 -6.143 1.00 0.00 H new ATOM 0 HH21 ARG A 31 3.768 10.507 -8.493 1.00 0.00 H new ATOM 0 HH22 ARG A 31 4.481 11.976 -7.818 1.00 0.00 H new ATOM 511 N VAL A 32 4.745 5.065 -1.744 1.00 0.00 N ATOM 512 CA VAL A 32 4.255 5.046 -0.372 1.00 0.00 C ATOM 513 C VAL A 32 4.963 6.092 0.479 1.00 0.00 C ATOM 514 O VAL A 32 6.177 6.259 0.387 1.00 0.00 O ATOM 515 CB VAL A 32 4.449 3.667 0.284 1.00 0.00 C ATOM 516 CG1 VAL A 32 3.349 2.709 -0.142 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.823 3.102 -0.053 1.00 0.00 C ATOM 0 H VAL A 32 5.760 5.116 -1.828 1.00 0.00 H new ATOM 0 HA VAL A 32 3.190 5.271 -0.422 1.00 0.00 H new ATOM 0 HB VAL A 32 4.388 3.790 1.365 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.506 1.741 0.333 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.381 3.109 0.160 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.370 2.589 -1.225 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.941 2.127 0.420 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.917 2.995 -1.134 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.595 3.779 0.314 1.00 0.00 H new ATOM 527 N PHE A 33 4.200 6.787 1.312 1.00 0.00 N ATOM 528 CA PHE A 33 4.757 7.810 2.187 1.00 0.00 C ATOM 529 C PHE A 33 4.718 7.342 3.633 1.00 0.00 C ATOM 530 O PHE A 33 3.663 7.339 4.268 1.00 0.00 O ATOM 531 CB PHE A 33 3.984 9.119 2.030 1.00 0.00 C ATOM 532 CG PHE A 33 3.821 9.541 0.598 1.00 0.00 C ATOM 533 CD1 PHE A 33 3.040 8.796 -0.271 1.00 0.00 C ATOM 534 CD2 PHE A 33 4.452 10.679 0.121 1.00 0.00 C ATOM 535 CE1 PHE A 33 2.890 9.177 -1.590 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.305 11.065 -1.197 1.00 0.00 C ATOM 537 CZ PHE A 33 3.524 10.314 -2.054 1.00 0.00 C ATOM 0 H PHE A 33 3.192 6.661 1.400 1.00 0.00 H new ATOM 0 HA PHE A 33 5.795 7.984 1.905 1.00 0.00 H new ATOM 0 HB2 PHE A 33 2.999 9.009 2.484 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.501 9.907 2.578 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.543 7.907 0.087 1.00 0.00 H new ATOM 0 HD2 PHE A 33 5.064 11.270 0.786 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.279 8.588 -2.257 1.00 0.00 H new ATOM 0 HE2 PHE A 33 4.801 11.954 -1.558 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.409 10.615 -3.085 1.00 0.00 H new ATOM 547 N THR A 34 5.870 6.925 4.143 1.00 0.00 N ATOM 548 CA THR A 34 5.960 6.431 5.508 1.00 0.00 C ATOM 549 C THR A 34 6.582 7.460 6.444 1.00 0.00 C ATOM 550 O THR A 34 7.722 7.881 6.256 1.00 0.00 O ATOM 551 CB THR A 34 6.770 5.136 5.544 1.00 0.00 C ATOM 552 OG1 THR A 34 7.923 5.248 4.728 1.00 0.00 O ATOM 553 CG2 THR A 34 5.985 3.930 5.074 1.00 0.00 C ATOM 0 H THR A 34 6.753 6.920 3.632 1.00 0.00 H new ATOM 0 HA THR A 34 4.945 6.237 5.856 1.00 0.00 H new ATOM 0 HB THR A 34 7.040 4.987 6.589 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.726 5.204 5.288 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.616 3.043 5.124 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.113 3.791 5.714 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.659 4.086 4.046 1.00 0.00 H new ATOM 561 N THR A 35 5.824 7.838 7.466 1.00 0.00 N ATOM 562 CA THR A 35 6.293 8.797 8.461 1.00 0.00 C ATOM 563 C THR A 35 6.614 8.066 9.760 1.00 0.00 C ATOM 564 O THR A 35 6.231 6.911 9.929 1.00 0.00 O ATOM 565 CB THR A 35 5.235 9.881 8.706 1.00 0.00 C ATOM 566 OG1 THR A 35 5.442 10.511 9.958 1.00 0.00 O ATOM 567 CG2 THR A 35 3.815 9.353 8.688 1.00 0.00 C ATOM 0 H THR A 35 4.878 7.494 7.629 1.00 0.00 H new ATOM 0 HA THR A 35 7.196 9.282 8.089 1.00 0.00 H new ATOM 0 HB THR A 35 5.352 10.586 7.883 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.614 11.466 9.819 1.00 0.00 H new ATOM 0 HG21 THR A 35 3.120 10.173 8.868 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.605 8.906 7.716 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.697 8.600 9.467 1.00 0.00 H new ATOM 575 N ASN A 36 7.320 8.724 10.673 1.00 0.00 N ATOM 576 CA ASN A 36 7.677 8.095 11.943 1.00 0.00 C ATOM 577 C ASN A 36 6.889 8.702 13.101 1.00 0.00 C ATOM 578 O ASN A 36 7.321 8.652 14.253 1.00 0.00 O ATOM 579 CB ASN A 36 9.181 8.230 12.199 1.00 0.00 C ATOM 580 CG ASN A 36 9.626 7.488 13.445 1.00 0.00 C ATOM 581 OD1 ASN A 36 10.349 8.032 14.279 1.00 0.00 O ATOM 582 ND2 ASN A 36 9.197 6.238 13.577 1.00 0.00 N ATOM 0 H ASN A 36 7.654 9.681 10.562 1.00 0.00 H new ATOM 0 HA ASN A 36 7.421 7.037 11.877 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.729 7.848 11.337 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.436 9.285 12.297 1.00 0.00 H new ATOM 0 HD21 ASN A 36 9.466 5.690 14.394 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.599 5.826 12.861 1.00 0.00 H new ATOM 589 N ASN A 37 5.731 9.272 12.790 1.00 0.00 N ATOM 590 CA ASN A 37 4.883 9.884 13.807 1.00 0.00 C ATOM 591 C ASN A 37 3.434 9.407 13.688 1.00 0.00 C ATOM 592 O ASN A 37 2.600 9.710 14.541 1.00 0.00 O ATOM 593 CB ASN A 37 4.940 11.409 13.698 1.00 0.00 C ATOM 594 CG ASN A 37 4.841 11.892 12.263 1.00 0.00 C ATOM 595 OD1 ASN A 37 5.809 12.402 11.700 1.00 0.00 O ATOM 596 ND2 ASN A 37 3.665 11.734 11.665 1.00 0.00 N ATOM 0 H ASN A 37 5.357 9.323 11.842 1.00 0.00 H new ATOM 0 HA ASN A 37 5.262 9.578 14.782 1.00 0.00 H new ATOM 0 HB2 ASN A 37 4.127 11.843 14.281 1.00 0.00 H new ATOM 0 HB3 ASN A 37 5.872 11.767 14.135 1.00 0.00 H new ATOM 0 HD21 ASN A 37 3.538 12.041 10.701 1.00 0.00 H new ATOM 0 HD22 ASN A 37 2.889 11.306 12.170 1.00 0.00 H new ATOM 603 N GLY A 38 3.140 8.658 12.629 1.00 0.00 N ATOM 604 CA GLY A 38 1.793 8.153 12.428 1.00 0.00 C ATOM 605 C GLY A 38 0.760 9.260 12.349 1.00 0.00 C ATOM 606 O GLY A 38 -0.197 9.278 13.122 1.00 0.00 O ATOM 0 H GLY A 38 3.810 8.392 11.907 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.762 7.567 11.510 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.536 7.479 13.245 1.00 0.00 H new ATOM 610 N ARG A 39 0.954 10.188 11.417 1.00 0.00 N ATOM 611 CA ARG A 39 0.028 11.302 11.255 1.00 0.00 C ATOM 612 C ARG A 39 -0.205 11.627 9.782 1.00 0.00 C ATOM 613 O ARG A 39 0.724 11.972 9.052 1.00 0.00 O ATOM 614 CB ARG A 39 0.555 12.537 11.989 1.00 0.00 C ATOM 615 CG ARG A 39 0.571 12.380 13.501 1.00 0.00 C ATOM 616 CD ARG A 39 0.939 13.681 14.193 1.00 0.00 C ATOM 617 NE ARG A 39 2.323 14.070 13.929 1.00 0.00 N ATOM 618 CZ ARG A 39 3.027 14.886 14.710 1.00 0.00 C ATOM 619 NH1 ARG A 39 2.482 15.407 15.802 1.00 0.00 N ATOM 620 NH2 ARG A 39 4.280 15.185 14.397 1.00 0.00 N ATOM 0 H ARG A 39 1.739 10.191 10.766 1.00 0.00 H new ATOM 0 HA ARG A 39 -0.928 11.006 11.688 1.00 0.00 H new ATOM 0 HB2 ARG A 39 1.566 12.752 11.643 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -0.062 13.397 11.727 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -0.409 12.049 13.844 1.00 0.00 H new ATOM 0 HG3 ARG A 39 1.284 11.604 13.780 1.00 0.00 H new ATOM 0 HD2 ARG A 39 0.270 14.473 13.856 1.00 0.00 H new ATOM 0 HD3 ARG A 39 0.791 13.574 15.268 1.00 0.00 H new ATOM 0 HE ARG A 39 2.776 13.694 13.096 1.00 0.00 H new ATOM 0 HH11 ARG A 39 1.518 15.183 16.047 1.00 0.00 H new ATOM 0 HH12 ARG A 39 3.027 16.032 16.396 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.704 14.790 13.558 1.00 0.00 H new ATOM 0 HH22 ARG A 39 4.820 15.810 14.995 1.00 0.00 H new ATOM 864 N GLU A 55 8.904 9.392 0.659 1.00 0.00 N ATOM 865 CA GLU A 55 8.229 8.372 -0.137 1.00 0.00 C ATOM 866 C GLU A 55 9.185 7.262 -0.561 1.00 0.00 C ATOM 867 O GLU A 55 10.369 7.498 -0.797 1.00 0.00 O ATOM 868 CB GLU A 55 7.582 9.000 -1.374 1.00 0.00 C ATOM 869 CG GLU A 55 8.573 9.683 -2.303 1.00 0.00 C ATOM 870 CD GLU A 55 8.945 8.820 -3.493 1.00 0.00 C ATOM 871 OE1 GLU A 55 9.787 7.913 -3.329 1.00 0.00 O ATOM 872 OE2 GLU A 55 8.391 9.051 -4.589 1.00 0.00 O ATOM 0 HA GLU A 55 7.455 7.929 0.490 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.052 8.225 -1.929 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.837 9.728 -1.053 1.00 0.00 H new ATOM 0 HG2 GLU A 55 8.146 10.621 -2.658 1.00 0.00 H new ATOM 0 HG3 GLU A 55 9.475 9.935 -1.745 1.00 0.00 H new ATOM 879 N LEU A 56 8.650 6.048 -0.662 1.00 0.00 N ATOM 880 CA LEU A 56 9.435 4.884 -1.064 1.00 0.00 C ATOM 881 C LEU A 56 8.686 4.070 -2.115 1.00 0.00 C ATOM 882 O LEU A 56 7.616 4.470 -2.576 1.00 0.00 O ATOM 883 CB LEU A 56 9.763 3.996 0.145 1.00 0.00 C ATOM 884 CG LEU A 56 8.862 4.180 1.375 1.00 0.00 C ATOM 885 CD1 LEU A 56 8.255 2.850 1.805 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.645 4.802 2.524 1.00 0.00 C ATOM 0 H LEU A 56 7.669 5.844 -0.470 1.00 0.00 H new ATOM 0 HA LEU A 56 10.370 5.245 -1.493 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.709 2.954 -0.169 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.794 4.186 0.442 1.00 0.00 H new ATOM 0 HG LEU A 56 8.051 4.855 1.103 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.621 3.005 2.678 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.657 2.442 0.990 1.00 0.00 H new ATOM 0 HD13 LEU A 56 9.052 2.150 2.055 1.00 0.00 H new ATOM 0 HD21 LEU A 56 8.990 4.925 3.386 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.478 4.152 2.791 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.028 5.776 2.218 1.00 0.00 H new ATOM 898 N GLN A 57 9.253 2.930 -2.488 1.00 0.00 N ATOM 899 CA GLN A 57 8.638 2.060 -3.484 1.00 0.00 C ATOM 900 C GLN A 57 8.548 0.624 -2.974 1.00 0.00 C ATOM 901 O GLN A 57 9.473 0.121 -2.339 1.00 0.00 O ATOM 902 CB GLN A 57 9.435 2.100 -4.790 1.00 0.00 C ATOM 903 CG GLN A 57 9.872 3.499 -5.194 1.00 0.00 C ATOM 904 CD GLN A 57 8.717 4.354 -5.676 1.00 0.00 C ATOM 905 OE1 GLN A 57 7.996 3.979 -6.601 1.00 0.00 O ATOM 906 NE2 GLN A 57 8.536 5.511 -5.050 1.00 0.00 N ATOM 0 H GLN A 57 10.138 2.585 -2.116 1.00 0.00 H new ATOM 0 HA GLN A 57 7.628 2.424 -3.671 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.317 1.468 -4.687 1.00 0.00 H new ATOM 0 HB3 GLN A 57 8.829 1.673 -5.589 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.350 3.986 -4.344 1.00 0.00 H new ATOM 0 HG3 GLN A 57 10.621 3.428 -5.983 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.158 5.781 -4.288 1.00 0.00 H new ATOM 0 HE22 GLN A 57 7.775 6.129 -5.331 1.00 0.00 H new ATOM 915 N ILE A 58 7.423 -0.030 -3.256 1.00 0.00 N ATOM 916 CA ILE A 58 7.211 -1.411 -2.825 1.00 0.00 C ATOM 917 C ILE A 58 6.593 -2.250 -3.937 1.00 0.00 C ATOM 918 O ILE A 58 5.603 -1.852 -4.551 1.00 0.00 O ATOM 919 CB ILE A 58 6.300 -1.494 -1.582 1.00 0.00 C ATOM 920 CG1 ILE A 58 5.463 -0.225 -1.418 1.00 0.00 C ATOM 921 CG2 ILE A 58 7.137 -1.749 -0.342 1.00 0.00 C ATOM 922 CD1 ILE A 58 4.138 -0.466 -0.725 1.00 0.00 C ATOM 0 H ILE A 58 6.646 0.373 -3.780 1.00 0.00 H new ATOM 0 HA ILE A 58 8.195 -1.805 -2.572 1.00 0.00 H new ATOM 0 HB ILE A 58 5.609 -2.326 -1.720 1.00 0.00 H new ATOM 0 HG12 ILE A 58 6.035 0.508 -0.849 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.277 0.209 -2.401 1.00 0.00 H new ATOM 0 HG21 ILE A 58 6.486 -1.806 0.531 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.677 -2.689 -0.454 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.850 -0.935 -0.210 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.595 0.475 -0.641 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.548 -1.175 -1.305 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.317 -0.872 0.271 1.00 0.00 H new ATOM 934 N TYR A 59 7.172 -3.424 -4.173 1.00 0.00 N ATOM 935 CA TYR A 59 6.664 -4.328 -5.194 1.00 0.00 C ATOM 936 C TYR A 59 5.548 -5.184 -4.611 1.00 0.00 C ATOM 937 O TYR A 59 5.771 -6.324 -4.202 1.00 0.00 O ATOM 938 CB TYR A 59 7.789 -5.219 -5.728 1.00 0.00 C ATOM 939 CG TYR A 59 8.746 -4.499 -6.649 1.00 0.00 C ATOM 940 CD1 TYR A 59 8.294 -3.885 -7.811 1.00 0.00 C ATOM 941 CD2 TYR A 59 10.103 -4.431 -6.357 1.00 0.00 C ATOM 942 CE1 TYR A 59 9.167 -3.226 -8.656 1.00 0.00 C ATOM 943 CE2 TYR A 59 10.982 -3.772 -7.196 1.00 0.00 C ATOM 944 CZ TYR A 59 10.509 -3.173 -8.344 1.00 0.00 C ATOM 945 OH TYR A 59 11.380 -2.516 -9.183 1.00 0.00 O ATOM 0 H TYR A 59 7.991 -3.769 -3.672 1.00 0.00 H new ATOM 0 HA TYR A 59 6.269 -3.739 -6.022 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.347 -5.629 -4.886 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.351 -6.063 -6.261 1.00 0.00 H new ATOM 0 HD1 TYR A 59 7.243 -3.923 -8.058 1.00 0.00 H new ATOM 0 HD2 TYR A 59 10.477 -4.901 -5.459 1.00 0.00 H new ATOM 0 HE1 TYR A 59 8.800 -2.755 -9.556 1.00 0.00 H new ATOM 0 HE2 TYR A 59 12.033 -3.727 -6.953 1.00 0.00 H new ATOM 0 HH TYR A 59 12.288 -2.570 -8.819 1.00 0.00 H new ATOM 955 N THR A 60 4.350 -4.615 -4.559 1.00 0.00 N ATOM 956 CA THR A 60 3.195 -5.307 -4.006 1.00 0.00 C ATOM 957 C THR A 60 2.147 -5.587 -5.080 1.00 0.00 C ATOM 958 O THR A 60 2.354 -5.295 -6.254 1.00 0.00 O ATOM 959 CB THR A 60 2.573 -4.479 -2.883 1.00 0.00 C ATOM 960 OG1 THR A 60 1.572 -5.226 -2.217 1.00 0.00 O ATOM 961 CG2 THR A 60 1.941 -3.191 -3.363 1.00 0.00 C ATOM 0 H THR A 60 4.154 -3.672 -4.895 1.00 0.00 H new ATOM 0 HA THR A 60 3.539 -6.262 -3.607 1.00 0.00 H new ATOM 0 HB THR A 60 3.397 -4.228 -2.215 1.00 0.00 H new ATOM 0 HG1 THR A 60 0.754 -4.691 -2.151 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.519 -2.654 -2.513 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.698 -2.572 -3.844 1.00 0.00 H new ATOM 0 HG23 THR A 60 1.150 -3.418 -4.078 1.00 0.00 H new ATOM 969 N TRP A 61 1.031 -6.151 -4.656 1.00 0.00 N ATOM 970 CA TRP A 61 -0.059 -6.468 -5.588 1.00 0.00 C ATOM 971 C TRP A 61 -1.415 -6.015 -5.068 1.00 0.00 C ATOM 972 O TRP A 61 -1.859 -6.421 -3.998 1.00 0.00 O ATOM 973 CB TRP A 61 -0.087 -7.957 -5.922 1.00 0.00 C ATOM 974 CG TRP A 61 -0.244 -8.850 -4.732 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.344 -9.590 -4.407 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.730 -9.107 -3.718 1.00 0.00 C ATOM 977 NE1 TRP A 61 -1.111 -10.298 -3.254 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.154 -10.016 -2.809 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.034 -8.658 -3.488 1.00 0.00 C ATOM 980 CZ2 TRP A 61 0.837 -10.482 -1.691 1.00 0.00 C ATOM 981 CZ3 TRP A 61 2.711 -9.123 -2.377 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.114 -10.028 -1.491 1.00 0.00 C ATOM 0 H TRP A 61 0.847 -6.401 -3.684 1.00 0.00 H new ATOM 0 HA TRP A 61 0.143 -5.910 -6.502 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -0.906 -8.147 -6.615 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.836 -8.219 -6.440 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.263 -9.615 -4.974 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.772 -10.931 -2.802 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.503 -7.961 -4.166 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.377 -11.177 -1.005 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 3.718 -8.782 -2.189 1.00 0.00 H new ATOM 0 HH2 TRP A 61 2.671 -10.375 -0.633 1.00 0.00 H new ATOM 993 N MET A 62 -2.046 -5.146 -5.849 1.00 0.00 N ATOM 994 CA MET A 62 -3.365 -4.571 -5.529 1.00 0.00 C ATOM 995 C MET A 62 -4.243 -5.518 -4.704 1.00 0.00 C ATOM 996 O MET A 62 -5.004 -5.072 -3.846 1.00 0.00 O ATOM 997 CB MET A 62 -4.103 -4.198 -6.821 1.00 0.00 C ATOM 998 CG MET A 62 -3.254 -3.411 -7.805 1.00 0.00 C ATOM 999 SD MET A 62 -2.518 -1.944 -7.059 1.00 0.00 S ATOM 1000 CE MET A 62 -3.964 -1.201 -6.316 1.00 0.00 C ATOM 0 H MET A 62 -1.660 -4.812 -6.732 1.00 0.00 H new ATOM 0 HA MET A 62 -3.180 -3.683 -4.924 1.00 0.00 H new ATOM 0 HB2 MET A 62 -4.453 -5.110 -7.305 1.00 0.00 H new ATOM 0 HB3 MET A 62 -4.987 -3.612 -6.568 1.00 0.00 H new ATOM 0 HG2 MET A 62 -2.463 -4.053 -8.193 1.00 0.00 H new ATOM 0 HG3 MET A 62 -3.869 -3.114 -8.654 1.00 0.00 H new ATOM 0 HE1 MET A 62 -3.781 -0.140 -6.144 1.00 0.00 H new ATOM 0 HE2 MET A 62 -4.817 -1.318 -6.984 1.00 0.00 H new ATOM 0 HE3 MET A 62 -4.177 -1.691 -5.366 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.142 -6.817 -4.967 1.00 0.00 N ATOM 1011 CA ASP A 63 -4.934 -7.810 -4.242 1.00 0.00 C ATOM 1012 C ASP A 63 -4.199 -8.327 -3.003 1.00 0.00 C ATOM 1013 O ASP A 63 -4.389 -9.473 -2.596 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.289 -8.977 -5.164 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.610 -8.769 -5.879 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -6.772 -7.717 -6.533 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.483 -9.657 -5.785 1.00 0.00 O ATOM 0 H ASP A 63 -3.521 -7.208 -5.675 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.849 -7.321 -3.907 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.497 -9.108 -5.901 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.336 -9.896 -4.580 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.358 -7.485 -2.411 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.592 -7.867 -1.227 1.00 0.00 C ATOM 1024 C ALA A 64 -3.340 -7.522 0.057 1.00 0.00 C ATOM 1025 O ALA A 64 -4.023 -6.502 0.133 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.234 -7.180 -1.230 1.00 0.00 C ATOM 0 H ALA A 64 -3.189 -6.532 -2.732 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.451 -8.947 -1.261 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.675 -7.475 -0.342 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.680 -7.474 -2.121 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.373 -6.099 -1.229 1.00 0.00 H new ATOM 1032 N THR A 65 -3.187 -8.369 1.071 1.00 0.00 N ATOM 1033 CA THR A 65 -3.830 -8.136 2.356 1.00 0.00 C ATOM 1034 C THR A 65 -3.028 -7.117 3.159 1.00 0.00 C ATOM 1035 O THR A 65 -1.816 -6.998 2.971 1.00 0.00 O ATOM 1036 CB THR A 65 -3.966 -9.443 3.143 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.116 -10.442 2.608 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.376 -9.990 3.147 1.00 0.00 C ATOM 0 H THR A 65 -2.625 -9.219 1.026 1.00 0.00 H new ATOM 0 HA THR A 65 -4.831 -7.743 2.177 1.00 0.00 H new ATOM 0 HB THR A 65 -3.685 -9.197 4.167 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.216 -11.268 3.125 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.405 -10.916 3.721 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.048 -9.261 3.600 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.693 -10.188 2.123 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.697 -6.382 4.047 1.00 0.00 N ATOM 1047 CA LEU A 66 -3.032 -5.373 4.867 1.00 0.00 C ATOM 1048 C LEU A 66 -1.722 -5.914 5.441 1.00 0.00 C ATOM 1049 O LEU A 66 -0.766 -5.168 5.644 1.00 0.00 O ATOM 1050 CB LEU A 66 -3.959 -4.921 5.997 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.758 -3.633 5.739 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -4.038 -2.429 6.326 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -5.009 -3.424 4.249 1.00 0.00 C ATOM 0 H LEU A 66 -4.699 -6.467 4.216 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.798 -4.516 4.235 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.663 -5.726 6.206 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.360 -4.779 6.897 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.724 -3.739 6.232 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.619 -1.528 6.133 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -3.923 -2.563 7.402 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.055 -2.332 5.865 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.576 -2.505 4.101 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.055 -3.350 3.726 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.575 -4.267 3.854 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.690 -7.219 5.692 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.500 -7.860 6.232 1.00 0.00 C ATOM 1067 C LYS A 67 0.680 -7.701 5.274 1.00 0.00 C ATOM 1068 O LYS A 67 1.736 -7.190 5.657 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.766 -9.344 6.496 1.00 0.00 C ATOM 1070 CG LYS A 67 -0.208 -9.836 7.820 1.00 0.00 C ATOM 1071 CD LYS A 67 1.245 -10.266 7.689 1.00 0.00 C ATOM 1072 CE LYS A 67 1.599 -11.347 8.697 1.00 0.00 C ATOM 1073 NZ LYS A 67 1.874 -10.780 10.046 1.00 0.00 N ATOM 0 H LYS A 67 -2.474 -7.851 5.530 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.250 -7.374 7.175 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -1.841 -9.521 6.476 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -0.332 -9.932 5.687 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -0.288 -9.045 8.566 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.805 -10.674 8.178 1.00 0.00 H new ATOM 0 HD2 LYS A 67 1.427 -10.635 6.680 1.00 0.00 H new ATOM 0 HD3 LYS A 67 1.895 -9.404 7.835 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.780 -12.063 8.764 1.00 0.00 H new ATOM 0 HE3 LYS A 67 2.474 -11.896 8.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 2.289 -11.515 10.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 2.540 -9.986 9.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 0.986 -10.443 10.469 1.00 0.00 H new ATOM 1087 N GLU A 68 0.500 -8.135 4.022 1.00 0.00 N ATOM 1088 CA GLU A 68 1.550 -8.031 3.025 1.00 0.00 C ATOM 1089 C GLU A 68 2.138 -6.626 2.989 1.00 0.00 C ATOM 1090 O GLU A 68 3.352 -6.456 2.871 1.00 0.00 O ATOM 1091 CB GLU A 68 0.992 -8.402 1.649 1.00 0.00 C ATOM 1092 CG GLU A 68 0.554 -9.854 1.547 1.00 0.00 C ATOM 1093 CD GLU A 68 1.718 -10.824 1.647 1.00 0.00 C ATOM 1094 OE1 GLU A 68 2.880 -10.366 1.593 1.00 0.00 O ATOM 1095 OE2 GLU A 68 1.467 -12.040 1.780 1.00 0.00 O ATOM 0 H GLU A 68 -0.364 -8.559 3.684 1.00 0.00 H new ATOM 0 HA GLU A 68 2.348 -8.723 3.293 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.143 -7.757 1.424 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.751 -8.205 0.892 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.163 -10.070 2.339 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.038 -10.008 0.599 1.00 0.00 H new ATOM 1102 N LEU A 69 1.275 -5.623 3.095 1.00 0.00 N ATOM 1103 CA LEU A 69 1.718 -4.233 3.078 1.00 0.00 C ATOM 1104 C LEU A 69 2.549 -3.920 4.320 1.00 0.00 C ATOM 1105 O LEU A 69 3.396 -3.028 4.302 1.00 0.00 O ATOM 1106 CB LEU A 69 0.517 -3.283 2.988 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.403 -3.495 1.777 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.391 -3.941 0.561 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.491 -4.504 2.108 1.00 0.00 C ATOM 0 H LEU A 69 0.267 -5.745 3.193 1.00 0.00 H new ATOM 0 HA LEU A 69 2.342 -4.085 2.196 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.076 -3.388 3.896 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.887 -2.258 2.966 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.875 -2.542 1.537 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.285 -4.084 -0.282 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.129 -3.180 0.309 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.899 -4.880 0.782 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.135 -4.643 1.239 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.034 -5.456 2.377 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.085 -4.137 2.945 1.00 0.00 H new ATOM 1121 N THR A 70 2.303 -4.666 5.394 1.00 0.00 N ATOM 1122 CA THR A 70 3.036 -4.475 6.642 1.00 0.00 C ATOM 1123 C THR A 70 4.503 -4.863 6.467 1.00 0.00 C ATOM 1124 O THR A 70 5.392 -4.243 7.052 1.00 0.00 O ATOM 1125 CB THR A 70 2.401 -5.306 7.760 1.00 0.00 C ATOM 1126 OG1 THR A 70 1.045 -4.938 7.950 1.00 0.00 O ATOM 1127 CG2 THR A 70 3.106 -5.162 9.091 1.00 0.00 C ATOM 0 H THR A 70 1.603 -5.407 5.425 1.00 0.00 H new ATOM 0 HA THR A 70 2.987 -3.421 6.914 1.00 0.00 H new ATOM 0 HB THR A 70 2.488 -6.342 7.433 1.00 0.00 H new ATOM 0 HG1 THR A 70 0.997 -4.001 8.234 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.604 -5.778 9.837 1.00 0.00 H new ATOM 0 HG22 THR A 70 4.142 -5.486 8.991 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.081 -4.118 9.405 1.00 0.00 H new ATOM 1135 N SER A 71 4.757 -5.882 5.643 1.00 0.00 N ATOM 1136 CA SER A 71 6.121 -6.331 5.391 1.00 0.00 C ATOM 1137 C SER A 71 6.774 -5.443 4.340 1.00 0.00 C ATOM 1138 O SER A 71 7.914 -5.011 4.495 1.00 0.00 O ATOM 1139 CB SER A 71 6.126 -7.787 4.928 1.00 0.00 C ATOM 1140 OG SER A 71 4.900 -8.131 4.307 1.00 0.00 O ATOM 0 H SER A 71 4.039 -6.407 5.144 1.00 0.00 H new ATOM 0 HA SER A 71 6.690 -6.261 6.318 1.00 0.00 H new ATOM 0 HB2 SER A 71 6.948 -7.947 4.230 1.00 0.00 H new ATOM 0 HB3 SER A 71 6.301 -8.442 5.781 1.00 0.00 H new ATOM 0 HG SER A 71 4.662 -7.444 3.650 1.00 0.00 H new ATOM 1146 N LEU A 72 6.025 -5.163 3.279 1.00 0.00 N ATOM 1147 CA LEU A 72 6.499 -4.310 2.192 1.00 0.00 C ATOM 1148 C LEU A 72 7.133 -3.041 2.752 1.00 0.00 C ATOM 1149 O LEU A 72 8.283 -2.716 2.446 1.00 0.00 O ATOM 1150 CB LEU A 72 5.324 -3.977 1.273 1.00 0.00 C ATOM 1151 CG LEU A 72 4.931 -5.101 0.317 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.434 -5.093 0.066 1.00 0.00 C ATOM 1153 CD2 LEU A 72 5.697 -4.983 -0.992 1.00 0.00 C ATOM 0 H LEU A 72 5.078 -5.518 3.147 1.00 0.00 H new ATOM 0 HA LEU A 72 7.262 -4.835 1.617 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.460 -3.720 1.887 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.575 -3.091 0.689 1.00 0.00 H new ATOM 0 HG LEU A 72 5.193 -6.052 0.781 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.175 -5.902 -0.618 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.906 -5.233 1.009 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.144 -4.139 -0.374 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.403 -5.793 -1.660 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.470 -4.026 -1.461 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.767 -5.046 -0.794 1.00 0.00 H new ATOM 1165 N VAL A 73 6.387 -2.343 3.600 1.00 0.00 N ATOM 1166 CA VAL A 73 6.887 -1.129 4.227 1.00 0.00 C ATOM 1167 C VAL A 73 8.099 -1.449 5.092 1.00 0.00 C ATOM 1168 O VAL A 73 9.082 -0.711 5.098 1.00 0.00 O ATOM 1169 CB VAL A 73 5.808 -0.458 5.097 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.331 0.840 5.696 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.547 -0.205 4.284 1.00 0.00 C ATOM 0 H VAL A 73 5.436 -2.597 3.868 1.00 0.00 H new ATOM 0 HA VAL A 73 7.169 -0.439 3.431 1.00 0.00 H new ATOM 0 HB VAL A 73 5.558 -1.134 5.915 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.553 1.298 6.307 1.00 0.00 H new ATOM 0 HG12 VAL A 73 7.203 0.629 6.316 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.612 1.523 4.895 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.796 0.270 4.916 1.00 0.00 H new ATOM 0 HG22 VAL A 73 4.781 0.449 3.444 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.160 -1.152 3.909 1.00 0.00 H new ATOM 1181 N LYS A 74 8.016 -2.557 5.823 1.00 0.00 N ATOM 1182 CA LYS A 74 9.102 -2.986 6.699 1.00 0.00 C ATOM 1183 C LYS A 74 10.405 -3.143 5.925 1.00 0.00 C ATOM 1184 O LYS A 74 11.462 -2.705 6.378 1.00 0.00 O ATOM 1185 CB LYS A 74 8.732 -4.303 7.388 1.00 0.00 C ATOM 1186 CG LYS A 74 8.018 -4.133 8.727 1.00 0.00 C ATOM 1187 CD LYS A 74 7.291 -2.797 8.833 1.00 0.00 C ATOM 1188 CE LYS A 74 5.888 -2.962 9.388 1.00 0.00 C ATOM 1189 NZ LYS A 74 4.914 -2.081 8.684 1.00 0.00 N ATOM 0 H LYS A 74 7.205 -3.176 5.826 1.00 0.00 H new ATOM 0 HA LYS A 74 9.252 -2.216 7.456 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.094 -4.882 6.720 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.640 -4.885 7.545 1.00 0.00 H new ATOM 0 HG2 LYS A 74 7.302 -4.944 8.860 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.744 -4.213 9.536 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.859 -2.124 9.475 1.00 0.00 H new ATOM 0 HD3 LYS A 74 7.240 -2.332 7.849 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.577 -4.002 9.289 1.00 0.00 H new ATOM 0 HE3 LYS A 74 5.887 -2.729 10.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 4.206 -1.735 9.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 5.417 -1.272 8.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 4.439 -2.620 7.932 1.00 0.00 H new ATOM 1203 N GLU A 75 10.324 -3.763 4.755 1.00 0.00 N ATOM 1204 CA GLU A 75 11.503 -3.964 3.925 1.00 0.00 C ATOM 1205 C GLU A 75 12.093 -2.624 3.501 1.00 0.00 C ATOM 1206 O GLU A 75 13.297 -2.509 3.275 1.00 0.00 O ATOM 1207 CB GLU A 75 11.154 -4.800 2.690 1.00 0.00 C ATOM 1208 CG GLU A 75 11.728 -6.208 2.729 1.00 0.00 C ATOM 1209 CD GLU A 75 10.895 -7.154 3.570 1.00 0.00 C ATOM 1210 OE1 GLU A 75 11.035 -7.127 4.811 1.00 0.00 O ATOM 1211 OE2 GLU A 75 10.102 -7.922 2.987 1.00 0.00 O ATOM 0 H GLU A 75 9.459 -4.133 4.361 1.00 0.00 H new ATOM 0 HA GLU A 75 12.246 -4.503 4.513 1.00 0.00 H new ATOM 0 HB2 GLU A 75 10.070 -4.861 2.597 1.00 0.00 H new ATOM 0 HB3 GLU A 75 11.523 -4.290 1.800 1.00 0.00 H new ATOM 0 HG2 GLU A 75 11.797 -6.596 1.713 1.00 0.00 H new ATOM 0 HG3 GLU A 75 12.742 -6.172 3.126 1.00 0.00 H new ATOM 1218 N VAL A 76 11.237 -1.609 3.396 1.00 0.00 N ATOM 1219 CA VAL A 76 11.688 -0.276 3.000 1.00 0.00 C ATOM 1220 C VAL A 76 11.758 0.672 4.195 1.00 0.00 C ATOM 1221 O VAL A 76 11.958 1.875 4.027 1.00 0.00 O ATOM 1222 CB VAL A 76 10.767 0.354 1.930 1.00 0.00 C ATOM 1223 CG1 VAL A 76 11.580 1.195 0.959 1.00 0.00 C ATOM 1224 CG2 VAL A 76 9.975 -0.712 1.185 1.00 0.00 C ATOM 0 H VAL A 76 10.236 -1.682 3.578 1.00 0.00 H new ATOM 0 HA VAL A 76 12.685 -0.411 2.580 1.00 0.00 H new ATOM 0 HB VAL A 76 10.054 1.002 2.439 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.917 1.631 0.212 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.087 1.991 1.504 1.00 0.00 H new ATOM 0 HG13 VAL A 76 12.320 0.566 0.464 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.337 -0.237 0.440 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.663 -1.397 0.690 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.357 -1.266 1.891 1.00 0.00 H new ATOM 1234 N TYR A 77 11.584 0.134 5.397 1.00 0.00 N ATOM 1235 CA TYR A 77 11.621 0.949 6.604 1.00 0.00 C ATOM 1236 C TYR A 77 12.137 0.150 7.797 1.00 0.00 C ATOM 1237 O TYR A 77 11.467 -0.759 8.285 1.00 0.00 O ATOM 1238 CB TYR A 77 10.226 1.498 6.905 1.00 0.00 C ATOM 1239 CG TYR A 77 10.237 2.877 7.525 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.116 3.192 8.551 1.00 0.00 C ATOM 1241 CD2 TYR A 77 9.367 3.862 7.080 1.00 0.00 C ATOM 1242 CE1 TYR A 77 11.129 4.453 9.118 1.00 0.00 C ATOM 1243 CE2 TYR A 77 9.372 5.126 7.640 1.00 0.00 C ATOM 1244 CZ TYR A 77 10.255 5.416 8.658 1.00 0.00 C ATOM 1245 OH TYR A 77 10.265 6.672 9.219 1.00 0.00 O ATOM 0 H TYR A 77 11.417 -0.859 5.561 1.00 0.00 H new ATOM 0 HA TYR A 77 12.307 1.778 6.432 1.00 0.00 H new ATOM 0 HB2 TYR A 77 9.650 1.530 5.980 1.00 0.00 H new ATOM 0 HB3 TYR A 77 9.712 0.811 7.577 1.00 0.00 H new ATOM 0 HD1 TYR A 77 11.801 2.440 8.913 1.00 0.00 H new ATOM 0 HD2 TYR A 77 8.674 3.637 6.283 1.00 0.00 H new ATOM 0 HE1 TYR A 77 11.819 4.683 9.916 1.00 0.00 H new ATOM 0 HE2 TYR A 77 8.688 5.882 7.282 1.00 0.00 H new ATOM 0 HH TYR A 77 9.590 7.231 8.781 1.00 0.00 H new ATOM 1255 N PRO A 78 13.345 0.484 8.286 1.00 0.00 N ATOM 1256 CA PRO A 78 13.949 -0.203 9.427 1.00 0.00 C ATOM 1257 C PRO A 78 13.275 0.160 10.748 1.00 0.00 C ATOM 1258 O PRO A 78 13.019 -0.705 11.585 1.00 0.00 O ATOM 1259 CB PRO A 78 15.393 0.298 9.414 1.00 0.00 C ATOM 1260 CG PRO A 78 15.323 1.638 8.771 1.00 0.00 C ATOM 1261 CD PRO A 78 14.212 1.559 7.763 1.00 0.00 C ATOM 0 HA PRO A 78 13.855 -1.286 9.347 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.798 0.364 10.424 1.00 0.00 H new ATOM 0 HB3 PRO A 78 16.041 -0.376 8.854 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.125 2.415 9.510 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.268 1.889 8.290 1.00 0.00 H new ATOM 0 HD2 PRO A 78 13.675 2.504 7.683 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.589 1.322 6.768 1.00 0.00 H new ATOM 1269 N GLU A 79 12.998 1.447 10.928 1.00 0.00 N ATOM 1270 CA GLU A 79 12.359 1.934 12.147 1.00 0.00 C ATOM 1271 C GLU A 79 10.981 1.305 12.348 1.00 0.00 C ATOM 1272 O GLU A 79 10.453 1.300 13.460 1.00 0.00 O ATOM 1273 CB GLU A 79 12.232 3.458 12.100 1.00 0.00 C ATOM 1274 CG GLU A 79 12.228 4.111 13.472 1.00 0.00 C ATOM 1275 CD GLU A 79 13.605 4.581 13.898 1.00 0.00 C ATOM 1276 OE1 GLU A 79 14.507 3.728 14.039 1.00 0.00 O ATOM 1277 OE2 GLU A 79 13.783 5.803 14.090 1.00 0.00 O ATOM 0 H GLU A 79 13.206 2.174 10.244 1.00 0.00 H new ATOM 0 HA GLU A 79 12.987 1.646 12.990 1.00 0.00 H new ATOM 0 HB2 GLU A 79 13.057 3.865 11.516 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.312 3.722 11.579 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.545 4.960 13.464 1.00 0.00 H new ATOM 0 HG3 GLU A 79 11.847 3.402 14.207 1.00 0.00 H new ATOM 1284 N ALA A 80 10.399 0.783 11.272 1.00 0.00 N ATOM 1285 CA ALA A 80 9.080 0.162 11.345 1.00 0.00 C ATOM 1286 C ALA A 80 9.166 -1.280 11.833 1.00 0.00 C ATOM 1287 O ALA A 80 8.238 -1.785 12.467 1.00 0.00 O ATOM 1288 CB ALA A 80 8.395 0.219 9.988 1.00 0.00 C ATOM 0 H ALA A 80 10.818 0.777 10.342 1.00 0.00 H new ATOM 0 HA ALA A 80 8.488 0.723 12.068 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.412 -0.248 10.057 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.282 1.259 9.681 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.999 -0.313 9.253 1.00 0.00 H new ATOM 1294 N ARG A 81 10.276 -1.943 11.528 1.00 0.00 N ATOM 1295 CA ARG A 81 10.475 -3.333 11.933 1.00 0.00 C ATOM 1296 C ARG A 81 10.305 -3.509 13.441 1.00 0.00 C ATOM 1297 O ARG A 81 10.051 -4.615 13.918 1.00 0.00 O ATOM 1298 CB ARG A 81 11.859 -3.820 11.506 1.00 0.00 C ATOM 1299 CG ARG A 81 11.930 -5.319 11.268 1.00 0.00 C ATOM 1300 CD ARG A 81 11.364 -5.695 9.907 1.00 0.00 C ATOM 1301 NE ARG A 81 10.936 -7.092 9.858 1.00 0.00 N ATOM 1302 CZ ARG A 81 9.753 -7.522 10.296 1.00 0.00 C ATOM 1303 NH1 ARG A 81 8.878 -6.671 10.820 1.00 0.00 N ATOM 1304 NH2 ARG A 81 9.443 -8.808 10.209 1.00 0.00 N ATOM 0 H ARG A 81 11.052 -1.542 11.002 1.00 0.00 H new ATOM 0 HA ARG A 81 9.713 -3.932 11.435 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.152 -3.301 10.593 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.584 -3.548 12.274 1.00 0.00 H new ATOM 0 HG2 ARG A 81 12.966 -5.651 11.337 1.00 0.00 H new ATOM 0 HG3 ARG A 81 11.376 -5.839 12.050 1.00 0.00 H new ATOM 0 HD2 ARG A 81 10.518 -5.048 9.675 1.00 0.00 H new ATOM 0 HD3 ARG A 81 12.118 -5.520 9.140 1.00 0.00 H new ATOM 0 HE ARG A 81 11.581 -7.778 9.465 1.00 0.00 H new ATOM 0 HH11 ARG A 81 9.109 -5.680 10.890 1.00 0.00 H new ATOM 0 HH12 ARG A 81 7.975 -7.009 11.153 1.00 0.00 H new ATOM 0 HH21 ARG A 81 10.110 -9.467 9.807 1.00 0.00 H new ATOM 0 HH22 ARG A 81 8.538 -9.138 10.544 1.00 0.00 H new ATOM 1318 N LYS A 82 10.447 -2.418 14.190 1.00 0.00 N ATOM 1319 CA LYS A 82 10.308 -2.466 15.642 1.00 0.00 C ATOM 1320 C LYS A 82 8.962 -3.061 16.044 1.00 0.00 C ATOM 1321 O LYS A 82 7.919 -2.675 15.516 1.00 0.00 O ATOM 1322 CB LYS A 82 10.460 -1.063 16.235 1.00 0.00 C ATOM 1323 CG LYS A 82 11.825 -0.811 16.854 1.00 0.00 C ATOM 1324 CD LYS A 82 12.785 -0.191 15.852 1.00 0.00 C ATOM 1325 CE LYS A 82 12.775 1.326 15.931 1.00 0.00 C ATOM 1326 NZ LYS A 82 14.046 1.862 16.492 1.00 0.00 N ATOM 0 H LYS A 82 10.658 -1.493 13.816 1.00 0.00 H new ATOM 0 HA LYS A 82 11.096 -3.107 16.036 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.283 -0.325 15.452 1.00 0.00 H new ATOM 0 HB3 LYS A 82 9.692 -0.913 16.994 1.00 0.00 H new ATOM 0 HG2 LYS A 82 11.719 -0.151 17.715 1.00 0.00 H new ATOM 0 HG3 LYS A 82 12.238 -1.750 17.222 1.00 0.00 H new ATOM 0 HD2 LYS A 82 13.794 -0.559 16.039 1.00 0.00 H new ATOM 0 HD3 LYS A 82 12.513 -0.505 14.844 1.00 0.00 H new ATOM 0 HE2 LYS A 82 12.615 1.740 14.936 1.00 0.00 H new ATOM 0 HE3 LYS A 82 11.939 1.652 16.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 13.852 2.343 17.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 14.712 1.079 16.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 14.463 2.539 15.822 1.00 0.00 H new ATOM 1340 N LYS A 83 8.994 -4.003 16.980 1.00 0.00 N ATOM 1341 CA LYS A 83 7.779 -4.654 17.453 1.00 0.00 C ATOM 1342 C LYS A 83 6.897 -3.672 18.219 1.00 0.00 C ATOM 1343 O LYS A 83 7.384 -2.893 19.038 1.00 0.00 O ATOM 1344 CB LYS A 83 8.127 -5.847 18.345 1.00 0.00 C ATOM 1345 CG LYS A 83 6.975 -6.822 18.536 1.00 0.00 C ATOM 1346 CD LYS A 83 6.453 -6.799 19.963 1.00 0.00 C ATOM 1347 CE LYS A 83 7.323 -7.631 20.891 1.00 0.00 C ATOM 1348 NZ LYS A 83 6.510 -8.462 21.820 1.00 0.00 N ATOM 0 H LYS A 83 9.850 -4.333 17.426 1.00 0.00 H new ATOM 0 HA LYS A 83 7.226 -5.009 16.583 1.00 0.00 H new ATOM 0 HB2 LYS A 83 8.974 -6.379 17.912 1.00 0.00 H new ATOM 0 HB3 LYS A 83 8.446 -5.480 19.320 1.00 0.00 H new ATOM 0 HG2 LYS A 83 6.167 -6.571 17.848 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.305 -7.830 18.285 1.00 0.00 H new ATOM 0 HD2 LYS A 83 6.418 -5.770 20.322 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.431 -7.179 19.983 1.00 0.00 H new ATOM 0 HE2 LYS A 83 7.970 -8.277 20.298 1.00 0.00 H new ATOM 0 HE3 LYS A 83 7.972 -6.972 21.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 7.141 -9.014 22.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 5.910 -7.844 22.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.909 -9.109 21.271 1.00 0.00 H new ATOM 1362 N GLY A 84 5.596 -3.716 17.944 1.00 0.00 N ATOM 1363 CA GLY A 84 4.667 -2.825 18.616 1.00 0.00 C ATOM 1364 C GLY A 84 4.397 -1.554 17.829 1.00 0.00 C ATOM 1365 O GLY A 84 3.714 -0.653 18.317 1.00 0.00 O ATOM 0 H GLY A 84 5.170 -4.351 17.269 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.726 -3.349 18.785 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.066 -2.562 19.596 1.00 0.00 H new ATOM 1369 N THR A 85 4.933 -1.478 16.615 1.00 0.00 N ATOM 1370 CA THR A 85 4.744 -0.305 15.770 1.00 0.00 C ATOM 1371 C THR A 85 3.359 -0.307 15.126 1.00 0.00 C ATOM 1372 O THR A 85 2.989 -1.253 14.431 1.00 0.00 O ATOM 1373 CB THR A 85 5.823 -0.258 14.688 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.115 -0.338 15.265 1.00 0.00 O ATOM 1375 CG2 THR A 85 5.774 0.997 13.847 1.00 0.00 C ATOM 0 H THR A 85 5.501 -2.214 16.195 1.00 0.00 H new ATOM 0 HA THR A 85 4.826 0.582 16.399 1.00 0.00 H new ATOM 0 HB THR A 85 5.623 -1.115 14.044 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.550 -1.168 14.979 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.567 0.965 13.099 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.807 1.063 13.348 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.913 1.869 14.486 1.00 0.00 H new ATOM 1383 N HIS A 86 2.602 0.761 15.360 1.00 0.00 N ATOM 1384 CA HIS A 86 1.257 0.890 14.805 1.00 0.00 C ATOM 1385 C HIS A 86 1.259 1.823 13.596 1.00 0.00 C ATOM 1386 O HIS A 86 1.497 3.021 13.729 1.00 0.00 O ATOM 1387 CB HIS A 86 0.298 1.424 15.872 1.00 0.00 C ATOM 1388 CG HIS A 86 -1.143 1.160 15.570 1.00 0.00 C ATOM 1389 ND1 HIS A 86 -2.051 2.162 15.298 1.00 0.00 N ATOM 1390 CD2 HIS A 86 -1.835 -0.002 15.502 1.00 0.00 C ATOM 1391 CE1 HIS A 86 -3.240 1.628 15.076 1.00 0.00 C ATOM 1392 NE2 HIS A 86 -3.135 0.318 15.193 1.00 0.00 N ATOM 0 H HIS A 86 2.898 1.552 15.932 1.00 0.00 H new ATOM 0 HA HIS A 86 0.923 -0.096 14.482 1.00 0.00 H new ATOM 0 HB2 HIS A 86 0.548 0.972 16.832 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.447 2.499 15.977 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.439 -0.994 15.661 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -4.143 2.171 14.839 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -3.897 -0.350 15.073 1.00 0.00 H new ATOM 1400 N PHE A 87 0.995 1.265 12.416 1.00 0.00 N ATOM 1401 CA PHE A 87 0.977 2.061 11.187 1.00 0.00 C ATOM 1402 C PHE A 87 -0.423 2.128 10.586 1.00 0.00 C ATOM 1403 O PHE A 87 -1.104 1.112 10.456 1.00 0.00 O ATOM 1404 CB PHE A 87 1.956 1.493 10.154 1.00 0.00 C ATOM 1405 CG PHE A 87 2.542 0.168 10.540 1.00 0.00 C ATOM 1406 CD1 PHE A 87 1.822 -1.002 10.363 1.00 0.00 C ATOM 1407 CD2 PHE A 87 3.812 0.095 11.082 1.00 0.00 C ATOM 1408 CE1 PHE A 87 2.360 -2.220 10.721 1.00 0.00 C ATOM 1409 CE2 PHE A 87 4.356 -1.120 11.443 1.00 0.00 C ATOM 1410 CZ PHE A 87 3.629 -2.280 11.262 1.00 0.00 C ATOM 0 H PHE A 87 0.792 0.274 12.283 1.00 0.00 H new ATOM 0 HA PHE A 87 1.287 3.072 11.453 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.441 1.388 9.199 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.765 2.207 10.003 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.829 -0.960 9.940 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.385 1.000 11.224 1.00 0.00 H new ATOM 0 HE1 PHE A 87 1.790 -3.126 10.578 1.00 0.00 H new ATOM 0 HE2 PHE A 87 5.349 -1.164 11.866 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.052 -3.233 11.543 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.842 3.336 10.218 1.00 0.00 N ATOM 1421 CA ASN A 88 -2.159 3.547 9.627 1.00 0.00 C ATOM 1422 C ASN A 88 -2.065 3.730 8.114 1.00 0.00 C ATOM 1423 O ASN A 88 -1.385 4.634 7.629 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.826 4.774 10.257 1.00 0.00 C ATOM 1425 CG ASN A 88 -4.004 4.408 11.138 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -5.053 3.988 10.650 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -3.835 4.567 12.446 1.00 0.00 N ATOM 0 H ASN A 88 -0.286 4.185 10.319 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.763 2.661 9.826 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -2.090 5.320 10.848 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.162 5.446 9.467 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.592 4.338 13.090 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -2.948 4.918 12.807 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.762 2.872 7.375 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.769 2.944 5.918 1.00 0.00 C ATOM 1436 C PHE A 89 -3.863 3.889 5.435 1.00 0.00 C ATOM 1437 O PHE A 89 -5.027 3.752 5.816 1.00 0.00 O ATOM 1438 CB PHE A 89 -2.976 1.553 5.312 1.00 0.00 C ATOM 1439 CG PHE A 89 -1.949 0.550 5.748 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -2.139 -0.191 6.900 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -0.793 0.349 5.010 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -1.203 -1.113 7.309 1.00 0.00 C ATOM 1443 CE2 PHE A 89 0.151 -0.575 5.415 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.054 -1.308 6.569 1.00 0.00 C ATOM 0 H PHE A 89 -3.330 2.118 7.762 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.803 3.329 5.592 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.966 1.190 5.587 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.956 1.632 4.225 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.034 -0.044 7.486 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.628 0.921 4.109 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.367 -1.685 8.210 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.047 -0.724 4.831 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.682 -2.030 6.890 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.477 4.850 4.599 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.416 5.827 4.063 1.00 0.00 C ATOM 1456 C ALA A 90 -4.011 6.271 2.663 1.00 0.00 C ATOM 1457 O ALA A 90 -2.920 5.951 2.191 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.503 7.031 4.990 1.00 0.00 C ATOM 0 H ALA A 90 -2.516 4.971 4.278 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.396 5.354 3.996 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.207 7.755 4.581 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.845 6.709 5.974 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.520 7.492 5.081 1.00 0.00 H new ATOM 1464 N ILE A 91 -4.896 7.010 2.002 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.629 7.500 0.655 1.00 0.00 C ATOM 1466 C ILE A 91 -4.624 9.025 0.620 1.00 0.00 C ATOM 1467 O ILE A 91 -5.652 9.661 0.859 1.00 0.00 O ATOM 1468 CB ILE A 91 -5.671 6.978 -0.352 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -5.809 5.458 -0.237 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.291 7.379 -1.772 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -7.197 4.952 -0.561 1.00 0.00 C ATOM 0 H ILE A 91 -5.804 7.283 2.377 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.645 7.127 0.371 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.635 7.429 -0.118 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -5.092 4.984 -0.908 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -5.547 5.153 0.776 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.039 7.001 -2.469 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.245 8.466 -1.843 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.317 6.957 -2.021 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -7.222 3.867 -0.459 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -7.916 5.398 0.126 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -7.455 5.226 -1.584 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.463 9.600 0.318 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.317 11.051 0.244 1.00 0.00 C ATOM 1485 C VAL A 92 -2.543 11.463 -1.005 1.00 0.00 C ATOM 1486 O VAL A 92 -1.541 10.843 -1.355 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.599 11.614 1.486 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -1.160 11.122 1.548 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -2.647 13.132 1.485 1.00 0.00 C ATOM 0 H VAL A 92 -2.607 9.082 0.120 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.325 11.465 0.200 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.118 11.253 2.374 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.673 11.532 2.433 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.150 10.033 1.600 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.625 11.448 0.656 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.135 13.513 2.369 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.155 13.511 0.589 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.685 13.463 1.496 1.00 0.00 H new ATOM 1673 N VAL A 103 -8.478 12.771 1.260 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.542 11.850 1.894 1.00 0.00 C ATOM 1675 C VAL A 103 -8.187 11.168 3.097 1.00 0.00 C ATOM 1676 O VAL A 103 -8.845 11.819 3.909 1.00 0.00 O ATOM 1677 CB VAL A 103 -6.253 12.580 2.342 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -6.596 13.859 3.087 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.375 11.676 3.198 1.00 0.00 C ATOM 0 HA VAL A 103 -7.275 11.095 1.154 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.688 12.842 1.448 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.677 14.359 3.394 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.167 14.519 2.434 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.190 13.618 3.968 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.477 12.218 3.497 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.926 11.369 4.087 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.092 10.794 2.624 1.00 0.00 H new ATOM 1689 N LYS A 104 -8.003 9.854 3.203 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.582 9.098 4.311 1.00 0.00 C ATOM 1691 C LYS A 104 -7.845 7.780 4.540 1.00 0.00 C ATOM 1692 O LYS A 104 -7.132 7.291 3.664 1.00 0.00 O ATOM 1693 CB LYS A 104 -10.063 8.823 4.043 1.00 0.00 C ATOM 1694 CG LYS A 104 -10.992 9.882 4.617 1.00 0.00 C ATOM 1695 CD LYS A 104 -11.582 10.763 3.526 1.00 0.00 C ATOM 1696 CE LYS A 104 -13.051 11.056 3.780 1.00 0.00 C ATOM 1697 NZ LYS A 104 -13.240 12.298 4.578 1.00 0.00 N ATOM 0 H LYS A 104 -7.463 9.295 2.542 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.479 9.702 5.212 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.223 8.756 2.967 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.326 7.853 4.465 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -11.797 9.399 5.170 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -10.444 10.501 5.328 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -11.027 11.700 3.474 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -11.470 10.271 2.560 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -13.571 11.154 2.827 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -13.503 10.215 4.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -14.256 12.462 4.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -12.765 12.195 5.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -12.831 13.105 4.066 1.00 0.00 H new ATOM 1711 N GLU A 105 -8.034 7.211 5.729 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.403 5.946 6.091 1.00 0.00 C ATOM 1713 C GLU A 105 -8.384 4.789 5.913 1.00 0.00 C ATOM 1714 O GLU A 105 -9.594 4.960 6.070 1.00 0.00 O ATOM 1715 CB GLU A 105 -6.891 6.011 7.536 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.529 4.661 8.140 1.00 0.00 C ATOM 1717 CD GLU A 105 -7.521 4.208 9.194 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -7.432 4.693 10.340 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -8.387 3.367 8.870 1.00 0.00 O ATOM 0 H GLU A 105 -8.622 7.610 6.461 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.554 5.772 5.430 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.013 6.656 7.568 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.654 6.480 8.157 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.480 3.914 7.348 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.535 4.720 8.584 1.00 0.00 H new ATOM 1726 N ILE A 106 -7.861 3.614 5.569 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.700 2.440 5.352 1.00 0.00 C ATOM 1728 C ILE A 106 -8.420 1.337 6.373 1.00 0.00 C ATOM 1729 O ILE A 106 -9.272 0.479 6.608 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.513 1.860 3.936 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -7.028 1.828 3.553 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -9.309 2.667 2.922 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.234 0.776 4.294 1.00 0.00 C ATOM 0 H ILE A 106 -6.863 3.451 5.435 1.00 0.00 H new ATOM 0 HA ILE A 106 -9.728 2.783 5.471 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.887 0.836 3.934 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -6.942 1.648 2.481 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.590 2.807 3.749 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.166 2.244 1.928 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.367 2.635 3.181 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -8.965 3.701 2.929 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.193 0.812 3.972 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.289 0.966 5.366 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.646 -0.210 4.079 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.247 1.378 7.007 1.00 0.00 N ATOM 1746 CA GLY A 107 -6.916 0.373 8.000 1.00 0.00 C ATOM 1747 C GLY A 107 -5.474 0.468 8.451 1.00 0.00 C ATOM 1748 O GLY A 107 -4.635 1.009 7.736 1.00 0.00 O ATOM 0 H GLY A 107 -6.528 2.084 6.851 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.573 0.487 8.862 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.101 -0.618 7.587 1.00 0.00 H new ATOM 1752 N SER A 108 -5.186 -0.035 9.654 1.00 0.00 N ATOM 1753 CA SER A 108 -3.837 0.018 10.207 1.00 0.00 C ATOM 1754 C SER A 108 -3.372 -1.356 10.690 1.00 0.00 C ATOM 1755 O SER A 108 -4.145 -2.110 11.284 1.00 0.00 O ATOM 1756 CB SER A 108 -3.795 1.009 11.370 1.00 0.00 C ATOM 1757 OG SER A 108 -4.633 0.584 12.431 1.00 0.00 O ATOM 0 H SER A 108 -5.872 -0.483 10.262 1.00 0.00 H new ATOM 0 HA SER A 108 -3.163 0.344 9.414 1.00 0.00 H new ATOM 0 HB2 SER A 108 -2.771 1.110 11.729 1.00 0.00 H new ATOM 0 HB3 SER A 108 -4.111 1.994 11.025 1.00 0.00 H new ATOM 0 HG SER A 108 -4.973 1.367 12.913 1.00 0.00 H new ATOM 1763 N THR A 109 -2.096 -1.661 10.458 1.00 0.00 N ATOM 1764 CA THR A 109 -1.519 -2.934 10.885 1.00 0.00 C ATOM 1765 C THR A 109 -0.456 -2.709 11.959 1.00 0.00 C ATOM 1766 O THR A 109 -0.327 -1.608 12.494 1.00 0.00 O ATOM 1767 CB THR A 109 -0.908 -3.679 9.697 1.00 0.00 C ATOM 1768 OG1 THR A 109 0.129 -2.919 9.104 1.00 0.00 O ATOM 1769 CG2 THR A 109 -1.914 -4.009 8.620 1.00 0.00 C ATOM 0 H THR A 109 -1.442 -1.044 9.977 1.00 0.00 H new ATOM 0 HA THR A 109 -2.321 -3.542 11.304 1.00 0.00 H new ATOM 0 HB THR A 109 -0.522 -4.612 10.108 1.00 0.00 H new ATOM 0 HG1 THR A 109 -0.129 -2.669 8.192 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.416 -4.537 7.806 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.698 -4.641 9.036 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.354 -3.088 8.239 1.00 0.00 H new ATOM 1777 N MET A 110 0.299 -3.756 12.274 1.00 0.00 N ATOM 1778 CA MET A 110 1.342 -3.663 13.288 1.00 0.00 C ATOM 1779 C MET A 110 2.541 -4.534 12.933 1.00 0.00 C ATOM 1780 O MET A 110 2.467 -5.379 12.041 1.00 0.00 O ATOM 1781 CB MET A 110 0.788 -4.080 14.647 1.00 0.00 C ATOM 1782 CG MET A 110 -0.282 -3.143 15.185 1.00 0.00 C ATOM 1783 SD MET A 110 -0.161 -2.907 16.968 1.00 0.00 S ATOM 1784 CE MET A 110 1.551 -2.408 17.117 1.00 0.00 C ATOM 0 H MET A 110 0.208 -4.676 11.843 1.00 0.00 H new ATOM 0 HA MET A 110 1.675 -2.626 13.331 1.00 0.00 H new ATOM 0 HB2 MET A 110 0.372 -5.084 14.567 1.00 0.00 H new ATOM 0 HB3 MET A 110 1.608 -4.131 15.364 1.00 0.00 H new ATOM 0 HG2 MET A 110 -0.198 -2.177 14.687 1.00 0.00 H new ATOM 0 HG3 MET A 110 -1.266 -3.543 14.941 1.00 0.00 H new ATOM 0 HE1 MET A 110 1.723 -1.988 18.108 1.00 0.00 H new ATOM 0 HE2 MET A 110 2.196 -3.275 16.974 1.00 0.00 H new ATOM 0 HE3 MET A 110 1.778 -1.657 16.360 1.00 0.00 H new ATOM 1794 N SER A 111 3.645 -4.317 13.640 1.00 0.00 N ATOM 1795 CA SER A 111 4.868 -5.077 13.404 1.00 0.00 C ATOM 1796 C SER A 111 4.797 -6.449 14.068 1.00 0.00 C ATOM 1797 O SER A 111 5.446 -6.693 15.086 1.00 0.00 O ATOM 1798 CB SER A 111 6.078 -4.306 13.936 1.00 0.00 C ATOM 1799 OG SER A 111 6.279 -3.108 13.208 1.00 0.00 O ATOM 0 H SER A 111 3.718 -3.621 14.382 1.00 0.00 H new ATOM 0 HA SER A 111 4.975 -5.220 12.329 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.930 -4.074 14.991 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.969 -4.930 13.869 1.00 0.00 H new ATOM 0 HG SER A 111 7.219 -3.042 12.940 1.00 0.00 H new ATOM 1805 N GLY A 112 4.010 -7.345 13.484 1.00 0.00 N ATOM 1806 CA GLY A 112 3.876 -8.682 14.033 1.00 0.00 C ATOM 1807 C GLY A 112 2.593 -8.871 14.820 1.00 0.00 C ATOM 1808 O GLY A 112 2.456 -9.840 15.567 1.00 0.00 O ATOM 0 H GLY A 112 3.463 -7.170 12.641 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.908 -9.408 13.220 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.728 -8.890 14.681 1.00 0.00 H new ATOM 1812 N ARG A 113 1.645 -7.951 14.654 1.00 0.00 N ATOM 1813 CA ARG A 113 0.370 -8.036 15.356 1.00 0.00 C ATOM 1814 C ARG A 113 -0.788 -8.085 14.366 1.00 0.00 C ATOM 1815 O ARG A 113 -0.960 -7.179 13.549 1.00 0.00 O ATOM 1816 CB ARG A 113 0.196 -6.850 16.308 1.00 0.00 C ATOM 1817 CG ARG A 113 -0.379 -7.236 17.661 1.00 0.00 C ATOM 1818 CD ARG A 113 0.716 -7.558 18.666 1.00 0.00 C ATOM 1819 NE ARG A 113 0.758 -8.981 18.991 1.00 0.00 N ATOM 1820 CZ ARG A 113 1.491 -9.495 19.977 1.00 0.00 C ATOM 1821 NH1 ARG A 113 2.242 -8.706 20.735 1.00 0.00 N ATOM 1822 NH2 ARG A 113 1.470 -10.800 20.207 1.00 0.00 N ATOM 0 H ARG A 113 1.737 -7.141 14.041 1.00 0.00 H new ATOM 0 HA ARG A 113 0.369 -8.956 15.941 1.00 0.00 H new ATOM 0 HB2 ARG A 113 1.163 -6.369 16.457 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.458 -6.113 15.841 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -0.994 -6.420 18.041 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -1.033 -8.101 17.545 1.00 0.00 H new ATOM 0 HD2 ARG A 113 1.681 -7.249 18.263 1.00 0.00 H new ATOM 0 HD3 ARG A 113 0.553 -6.983 19.577 1.00 0.00 H new ATOM 0 HE ARG A 113 0.193 -9.619 18.430 1.00 0.00 H new ATOM 0 HH11 ARG A 113 2.260 -7.701 20.564 1.00 0.00 H new ATOM 0 HH12 ARG A 113 2.801 -9.105 21.489 1.00 0.00 H new ATOM 0 HH21 ARG A 113 0.893 -11.411 19.629 1.00 0.00 H new ATOM 0 HH22 ARG A 113 2.031 -11.194 20.962 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.577 -9.151 14.440 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.717 -9.321 13.548 1.00 0.00 C ATOM 1838 C LYS A 114 -3.820 -8.316 13.865 1.00 0.00 C ATOM 1839 O LYS A 114 -4.653 -8.551 14.740 1.00 0.00 O ATOM 1840 CB LYS A 114 -3.265 -10.745 13.653 1.00 0.00 C ATOM 1841 CG LYS A 114 -2.574 -11.733 12.725 1.00 0.00 C ATOM 1842 CD LYS A 114 -1.781 -12.771 13.503 1.00 0.00 C ATOM 1843 CE LYS A 114 -0.314 -12.389 13.606 1.00 0.00 C ATOM 1844 NZ LYS A 114 0.419 -12.647 12.337 1.00 0.00 N ATOM 0 H LYS A 114 -1.448 -9.910 15.109 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.374 -9.142 12.529 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.160 -11.091 14.681 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -4.331 -10.733 13.428 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.318 -12.233 12.105 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -1.907 -11.195 12.051 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.201 -12.877 14.503 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.872 -13.741 13.014 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -0.231 -11.333 13.864 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.152 -12.952 14.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 1.284 -12.070 12.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 0.672 -13.654 12.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.187 -12.397 11.529 1.00 0.00 H new ATOM 1858 N GLY A 115 -3.819 -7.197 13.147 1.00 0.00 N ATOM 1859 CA GLY A 115 -4.829 -6.178 13.366 1.00 0.00 C ATOM 1860 C GLY A 115 -6.201 -6.622 12.902 1.00 0.00 C ATOM 1861 O GLY A 115 -6.404 -7.797 12.598 1.00 0.00 O ATOM 0 H GLY A 115 -3.139 -6.978 12.419 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -4.869 -5.931 14.427 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -4.545 -5.268 12.837 1.00 0.00 H new ATOM 1865 N THR A 116 -7.146 -5.684 12.838 1.00 0.00 N ATOM 1866 CA THR A 116 -8.497 -5.995 12.397 1.00 0.00 C ATOM 1867 C THR A 116 -8.611 -5.892 10.880 1.00 0.00 C ATOM 1868 O THR A 116 -9.445 -6.556 10.265 1.00 0.00 O ATOM 1869 CB THR A 116 -9.503 -5.053 13.064 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.041 -3.713 13.023 1.00 0.00 O ATOM 1871 CG2 THR A 116 -9.785 -5.402 14.509 1.00 0.00 C ATOM 0 H THR A 116 -6.997 -4.706 13.086 1.00 0.00 H new ATOM 0 HA THR A 116 -8.722 -7.020 12.690 1.00 0.00 H new ATOM 0 HB THR A 116 -10.426 -5.168 12.496 1.00 0.00 H new ATOM 0 HG1 THR A 116 -8.911 -3.440 12.091 1.00 0.00 H new ATOM 0 HG21 THR A 116 -10.505 -4.695 14.920 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.193 -6.411 14.567 1.00 0.00 H new ATOM 0 HG23 THR A 116 -8.860 -5.352 15.083 1.00 0.00 H new ATOM 1879 N ASP A 117 -7.773 -5.047 10.285 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.784 -4.849 8.839 1.00 0.00 C ATOM 1881 C ASP A 117 -6.718 -5.695 8.149 1.00 0.00 C ATOM 1882 O ASP A 117 -6.699 -5.797 6.923 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.566 -3.371 8.509 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.526 -2.463 9.252 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -8.597 -2.562 10.495 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -9.210 -1.653 8.590 1.00 0.00 O ATOM 0 H ASP A 117 -7.078 -4.489 10.782 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.759 -5.166 8.468 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.542 -3.094 8.758 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.685 -3.220 7.436 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.831 -6.300 8.936 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.761 -7.132 8.395 1.00 0.00 C ATOM 1893 C ASP A 118 -5.294 -8.132 7.368 1.00 0.00 C ATOM 1894 O ASP A 118 -4.648 -8.401 6.356 1.00 0.00 O ATOM 1895 CB ASP A 118 -4.052 -7.879 9.525 1.00 0.00 C ATOM 1896 CG ASP A 118 -4.987 -8.794 10.290 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -6.216 -8.581 10.219 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -4.492 -9.725 10.959 1.00 0.00 O ATOM 0 H ASP A 118 -5.833 -6.229 9.953 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.052 -6.475 7.892 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -3.233 -8.466 9.110 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.611 -7.158 10.213 1.00 0.00 H new ATOM 1903 N SER A 119 -6.473 -8.685 7.641 1.00 0.00 N ATOM 1904 CA SER A 119 -7.088 -9.661 6.745 1.00 0.00 C ATOM 1905 C SER A 119 -7.712 -8.990 5.522 1.00 0.00 C ATOM 1906 O SER A 119 -8.104 -9.667 4.571 1.00 0.00 O ATOM 1907 CB SER A 119 -8.148 -10.468 7.494 1.00 0.00 C ATOM 1908 OG SER A 119 -7.635 -10.978 8.713 1.00 0.00 O ATOM 0 H SER A 119 -7.021 -8.474 8.475 1.00 0.00 H new ATOM 0 HA SER A 119 -6.302 -10.330 6.395 1.00 0.00 H new ATOM 0 HB2 SER A 119 -9.014 -9.838 7.696 1.00 0.00 H new ATOM 0 HB3 SER A 119 -8.492 -11.291 6.868 1.00 0.00 H new ATOM 0 HG SER A 119 -8.333 -11.489 9.174 1.00 0.00 H new ATOM 1914 N MET A 120 -7.799 -7.664 5.544 1.00 0.00 N ATOM 1915 CA MET A 120 -8.372 -6.922 4.428 1.00 0.00 C ATOM 1916 C MET A 120 -7.364 -6.806 3.293 1.00 0.00 C ATOM 1917 O MET A 120 -6.159 -6.934 3.505 1.00 0.00 O ATOM 1918 CB MET A 120 -8.815 -5.531 4.885 1.00 0.00 C ATOM 1919 CG MET A 120 -10.272 -5.224 4.578 1.00 0.00 C ATOM 1920 SD MET A 120 -10.961 -3.960 5.663 1.00 0.00 S ATOM 1921 CE MET A 120 -9.750 -2.654 5.472 1.00 0.00 C ATOM 0 H MET A 120 -7.481 -7.083 6.320 1.00 0.00 H new ATOM 0 HA MET A 120 -9.244 -7.465 4.065 1.00 0.00 H new ATOM 0 HB2 MET A 120 -8.652 -5.442 5.959 1.00 0.00 H new ATOM 0 HB3 MET A 120 -8.186 -4.782 4.404 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.359 -4.895 3.543 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.859 -6.137 4.673 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.396 -2.340 6.454 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.909 -3.021 4.883 1.00 0.00 H new ATOM 0 HE3 MET A 120 -10.207 -1.806 4.963 1.00 0.00 H new ATOM 1931 N THR A 121 -7.862 -6.565 2.084 1.00 0.00 N ATOM 1932 CA THR A 121 -6.999 -6.436 0.912 1.00 0.00 C ATOM 1933 C THR A 121 -7.019 -5.008 0.377 1.00 0.00 C ATOM 1934 O THR A 121 -7.951 -4.254 0.651 1.00 0.00 O ATOM 1935 CB THR A 121 -7.434 -7.411 -0.187 1.00 0.00 C ATOM 1936 OG1 THR A 121 -8.845 -7.521 -0.232 1.00 0.00 O ATOM 1937 CG2 THR A 121 -6.868 -8.803 -0.005 1.00 0.00 C ATOM 0 H THR A 121 -8.857 -6.455 1.889 1.00 0.00 H new ATOM 0 HA THR A 121 -5.981 -6.679 1.217 1.00 0.00 H new ATOM 0 HB THR A 121 -7.044 -6.995 -1.116 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.102 -8.147 -0.941 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.213 -9.445 -0.815 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.779 -8.757 -0.017 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.204 -9.210 0.949 1.00 0.00 H new ATOM 1945 N LEU A 122 -5.988 -4.642 -0.383 1.00 0.00 N ATOM 1946 CA LEU A 122 -5.899 -3.301 -0.947 1.00 0.00 C ATOM 1947 C LEU A 122 -7.069 -3.026 -1.887 1.00 0.00 C ATOM 1948 O LEU A 122 -7.711 -1.981 -1.806 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.575 -3.132 -1.696 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.498 -2.351 -0.941 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -2.174 -2.408 -1.687 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -3.935 -0.909 -0.735 1.00 0.00 C ATOM 0 H LEU A 122 -5.207 -5.254 -0.620 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.941 -2.583 -0.128 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.183 -4.120 -1.938 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.772 -2.627 -2.642 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.359 -2.812 0.037 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.421 -1.847 -1.134 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.855 -3.446 -1.783 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.296 -1.972 -2.679 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.158 -0.367 -0.196 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.102 -0.437 -1.703 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.859 -0.888 -0.157 1.00 0.00 H new ATOM 1964 N GLN A 123 -7.326 -3.967 -2.791 1.00 0.00 N ATOM 1965 CA GLN A 123 -8.408 -3.833 -3.768 1.00 0.00 C ATOM 1966 C GLN A 123 -9.694 -3.301 -3.132 1.00 0.00 C ATOM 1967 O GLN A 123 -10.397 -2.485 -3.729 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.683 -5.186 -4.430 1.00 0.00 C ATOM 1969 CG GLN A 123 -9.644 -5.105 -5.605 1.00 0.00 C ATOM 1970 CD GLN A 123 -10.358 -6.419 -5.862 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -11.552 -6.442 -6.163 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -9.628 -7.523 -5.744 1.00 0.00 N ATOM 0 H GLN A 123 -6.798 -4.836 -2.869 1.00 0.00 H new ATOM 0 HA GLN A 123 -8.084 -3.110 -4.517 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -7.740 -5.612 -4.772 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -9.090 -5.869 -3.685 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -10.382 -4.325 -5.414 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -9.095 -4.812 -6.500 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.642 -7.458 -5.493 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -10.054 -8.436 -5.905 1.00 0.00 H new ATOM 1981 N SER A 124 -10.002 -3.771 -1.927 1.00 0.00 N ATOM 1982 CA SER A 124 -11.211 -3.343 -1.227 1.00 0.00 C ATOM 1983 C SER A 124 -11.070 -1.924 -0.672 1.00 0.00 C ATOM 1984 O SER A 124 -12.063 -1.292 -0.310 1.00 0.00 O ATOM 1985 CB SER A 124 -11.540 -4.314 -0.092 1.00 0.00 C ATOM 1986 OG SER A 124 -10.386 -4.621 0.670 1.00 0.00 O ATOM 0 H SER A 124 -9.434 -4.446 -1.415 1.00 0.00 H new ATOM 0 HA SER A 124 -12.026 -3.342 -1.951 1.00 0.00 H new ATOM 0 HB2 SER A 124 -12.301 -3.877 0.555 1.00 0.00 H new ATOM 0 HB3 SER A 124 -11.961 -5.231 -0.505 1.00 0.00 H new ATOM 0 HG SER A 124 -9.585 -4.469 0.126 1.00 0.00 H new ATOM 1992 N GLN A 125 -9.838 -1.428 -0.603 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.582 -0.086 -0.090 1.00 0.00 C ATOM 1994 C GLN A 125 -9.696 0.964 -1.197 1.00 0.00 C ATOM 1995 O GLN A 125 -9.426 2.144 -0.970 1.00 0.00 O ATOM 1996 CB GLN A 125 -8.191 -0.008 0.549 1.00 0.00 C ATOM 1997 CG GLN A 125 -7.736 -1.302 1.209 1.00 0.00 C ATOM 1998 CD GLN A 125 -8.630 -1.720 2.362 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -8.459 -1.262 3.491 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -9.585 -2.599 2.083 1.00 0.00 N ATOM 0 H GLN A 125 -9.002 -1.934 -0.895 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.338 0.124 0.667 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.467 0.271 -0.216 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -8.190 0.787 1.294 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.716 -2.097 0.464 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -6.716 -1.180 1.572 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -9.691 -2.953 1.132 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -10.213 -2.921 2.820 1.00 0.00 H new ATOM 2009 N LYS A 126 -10.100 0.531 -2.390 1.00 0.00 N ATOM 2010 CA LYS A 126 -10.255 1.432 -3.532 1.00 0.00 C ATOM 2011 C LYS A 126 -8.905 1.886 -4.090 1.00 0.00 C ATOM 2012 O LYS A 126 -8.855 2.712 -5.002 1.00 0.00 O ATOM 2013 CB LYS A 126 -11.099 2.652 -3.149 1.00 0.00 C ATOM 2014 CG LYS A 126 -12.433 2.293 -2.515 1.00 0.00 C ATOM 2015 CD LYS A 126 -12.786 3.241 -1.380 1.00 0.00 C ATOM 2016 CE LYS A 126 -13.676 2.568 -0.347 1.00 0.00 C ATOM 2017 NZ LYS A 126 -15.106 2.949 -0.512 1.00 0.00 N ATOM 0 H LYS A 126 -10.327 -0.443 -2.592 1.00 0.00 H new ATOM 0 HA LYS A 126 -10.769 0.872 -4.313 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -10.532 3.273 -2.455 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -11.280 3.253 -4.040 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -13.216 2.323 -3.272 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -12.394 1.271 -2.138 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -11.872 3.592 -0.901 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -13.293 4.118 -1.782 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -13.577 1.486 -0.432 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -13.341 2.841 0.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -15.679 2.469 0.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -15.205 3.979 -0.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -15.434 2.666 -1.457 1.00 0.00 H new ATOM 2031 N PHE A 127 -7.814 1.346 -3.551 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.480 1.708 -4.019 1.00 0.00 C ATOM 2033 C PHE A 127 -6.237 1.163 -5.424 1.00 0.00 C ATOM 2034 O PHE A 127 -6.768 0.116 -5.794 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.416 1.174 -3.058 1.00 0.00 C ATOM 2036 CG PHE A 127 -4.011 1.484 -3.488 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -3.551 2.790 -3.513 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.151 0.468 -3.871 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -2.259 3.078 -3.911 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -1.859 0.748 -4.272 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.412 2.056 -4.292 1.00 0.00 C ATOM 0 H PHE A 127 -7.828 0.661 -2.795 1.00 0.00 H new ATOM 0 HA PHE A 127 -6.412 2.795 -4.051 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -5.586 1.597 -2.068 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.530 0.094 -2.967 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -4.210 3.593 -3.218 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -3.495 -0.556 -3.856 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.912 4.101 -3.924 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.199 -0.054 -4.569 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.402 2.278 -4.605 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.434 1.880 -6.206 1.00 0.00 N ATOM 2052 CA GLN A 128 -5.127 1.465 -7.571 1.00 0.00 C ATOM 2053 C GLN A 128 -3.636 1.603 -7.863 1.00 0.00 C ATOM 2054 O GLN A 128 -2.889 2.183 -7.076 1.00 0.00 O ATOM 2055 CB GLN A 128 -5.933 2.295 -8.571 1.00 0.00 C ATOM 2056 CG GLN A 128 -7.406 1.918 -8.626 1.00 0.00 C ATOM 2057 CD GLN A 128 -8.320 3.080 -8.288 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -8.080 3.816 -7.332 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -9.374 3.252 -9.076 1.00 0.00 N ATOM 0 H GLN A 128 -4.985 2.749 -5.918 1.00 0.00 H new ATOM 0 HA GLN A 128 -5.401 0.415 -7.674 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -5.846 3.350 -8.309 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.498 2.176 -9.564 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -7.646 1.551 -9.624 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -7.594 1.099 -7.931 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -9.535 2.618 -9.858 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -10.023 4.019 -8.899 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.208 1.065 -9.001 1.00 0.00 N ATOM 2069 CA ILE A 129 -1.806 1.130 -9.395 1.00 0.00 C ATOM 2070 C ILE A 129 -1.392 2.564 -9.700 1.00 0.00 C ATOM 2071 O ILE A 129 -1.920 3.193 -10.617 1.00 0.00 O ATOM 2072 CB ILE A 129 -1.527 0.245 -10.627 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -2.031 -1.176 -10.376 1.00 0.00 C ATOM 2074 CG2 ILE A 129 -0.038 0.240 -10.949 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.733 -2.138 -11.505 1.00 0.00 C ATOM 0 H ILE A 129 -3.811 0.580 -9.665 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.219 0.758 -8.555 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.060 0.655 -11.485 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -1.579 -1.555 -9.459 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -3.108 -1.146 -10.212 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.144 -0.389 -11.821 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.292 1.257 -11.160 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.517 -0.152 -10.097 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -2.121 -3.125 -11.254 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -2.208 -1.784 -12.420 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.655 -2.199 -11.656 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.446 3.076 -8.922 1.00 0.00 N ATOM 2088 CA GLY A 130 0.020 4.435 -9.118 1.00 0.00 C ATOM 2089 C GLY A 130 -0.553 5.401 -8.097 1.00 0.00 C ATOM 2090 O GLY A 130 -0.095 6.538 -7.985 1.00 0.00 O ATOM 0 H GLY A 130 0.007 2.574 -8.158 1.00 0.00 H new ATOM 0 HA2 GLY A 130 1.108 4.454 -9.060 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.252 4.767 -10.120 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.559 4.948 -7.349 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.190 5.783 -6.338 1.00 0.00 C ATOM 2096 C ASP A 131 -1.217 6.107 -5.210 1.00 0.00 C ATOM 2097 O ASP A 131 -0.188 5.449 -5.053 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.437 5.096 -5.775 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.721 5.735 -6.267 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -5.053 5.562 -7.459 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -5.395 6.411 -5.461 1.00 0.00 O ATOM 0 H ASP A 131 -1.951 4.009 -7.427 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.487 6.717 -6.814 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.427 4.043 -6.057 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -3.409 5.134 -4.686 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.548 7.131 -4.434 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.706 7.559 -3.325 1.00 0.00 C ATOM 2108 C TYR A 132 -1.162 6.949 -2.003 1.00 0.00 C ATOM 2109 O TYR A 132 -2.214 7.305 -1.472 1.00 0.00 O ATOM 2110 CB TYR A 132 -0.712 9.086 -3.217 1.00 0.00 C ATOM 2111 CG TYR A 132 -0.134 9.788 -4.425 1.00 0.00 C ATOM 2112 CD1 TYR A 132 -0.705 9.635 -5.683 1.00 0.00 C ATOM 2113 CD2 TYR A 132 0.982 10.606 -4.305 1.00 0.00 C ATOM 2114 CE1 TYR A 132 -0.177 10.278 -6.787 1.00 0.00 C ATOM 2115 CE2 TYR A 132 1.514 11.252 -5.405 1.00 0.00 C ATOM 2116 CZ TYR A 132 0.931 11.084 -6.643 1.00 0.00 C ATOM 2117 OH TYR A 132 1.459 11.726 -7.740 1.00 0.00 O ATOM 0 H TYR A 132 -2.398 7.683 -4.553 1.00 0.00 H new ATOM 0 HA TYR A 132 0.307 7.210 -3.527 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.737 9.426 -3.067 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -0.146 9.380 -2.333 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -1.574 9.004 -5.800 1.00 0.00 H new ATOM 0 HD2 TYR A 132 1.441 10.739 -3.337 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -0.631 10.149 -7.758 1.00 0.00 H new ATOM 0 HE2 TYR A 132 2.382 11.885 -5.295 1.00 0.00 H new ATOM 0 HH TYR A 132 2.237 12.255 -7.466 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.351 6.043 -1.464 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.661 5.401 -0.187 1.00 0.00 C ATOM 2129 C LEU A 133 0.261 5.941 0.906 1.00 0.00 C ATOM 2130 O LEU A 133 1.477 5.797 0.807 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.493 3.877 -0.296 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.783 3.050 -0.407 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.533 1.630 0.077 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -2.925 3.677 0.385 1.00 0.00 C ATOM 0 H LEU A 133 0.524 5.736 -1.889 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.697 5.624 0.070 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.125 3.664 -1.168 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.059 3.532 0.578 1.00 0.00 H new ATOM 0 HG LEU A 133 -2.077 3.032 -1.456 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.453 1.050 -0.005 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.757 1.168 -0.534 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.210 1.652 1.118 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -3.820 3.063 0.281 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -2.647 3.739 1.437 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.126 4.678 0.003 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.310 6.563 1.939 1.00 0.00 N ATOM 2147 CA ASP A 134 0.488 7.114 3.021 1.00 0.00 C ATOM 2148 C ASP A 134 0.423 6.226 4.257 1.00 0.00 C ATOM 2149 O ASP A 134 -0.616 6.136 4.910 1.00 0.00 O ATOM 2150 CB ASP A 134 -0.003 8.518 3.368 1.00 0.00 C ATOM 2151 CG ASP A 134 1.087 9.383 3.967 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.564 9.051 5.071 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.464 10.388 3.329 1.00 0.00 O ATOM 0 H ASP A 134 -1.316 6.694 2.044 1.00 0.00 H new ATOM 0 HA ASP A 134 1.525 7.163 2.687 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.389 8.997 2.468 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -0.833 8.446 4.071 1.00 0.00 H new ATOM 2158 N ILE A 135 1.537 5.579 4.573 1.00 0.00 N ATOM 2159 CA ILE A 135 1.605 4.706 5.738 1.00 0.00 C ATOM 2160 C ILE A 135 2.123 5.463 6.960 1.00 0.00 C ATOM 2161 O ILE A 135 3.331 5.632 7.138 1.00 0.00 O ATOM 2162 CB ILE A 135 2.505 3.481 5.469 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.885 2.599 4.383 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.724 2.678 6.748 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.788 2.396 3.189 1.00 0.00 C ATOM 0 H ILE A 135 2.405 5.642 4.040 1.00 0.00 H new ATOM 0 HA ILE A 135 0.592 4.358 5.939 1.00 0.00 H new ATOM 0 HB ILE A 135 3.475 3.836 5.121 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.637 1.628 4.811 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.950 3.049 4.050 1.00 0.00 H new ATOM 0 HG21 ILE A 135 3.361 1.820 6.534 1.00 0.00 H new ATOM 0 HG22 ILE A 135 3.204 3.309 7.496 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.763 2.331 7.129 1.00 0.00 H new ATOM 0 HD11 ILE A 135 2.287 1.762 2.458 1.00 0.00 H new ATOM 0 HD12 ILE A 135 3.016 3.361 2.737 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.714 1.918 3.510 1.00 0.00 H new ATOM 2177 N ALA A 136 1.200 5.908 7.801 1.00 0.00 N ATOM 2178 CA ALA A 136 1.557 6.635 9.011 1.00 0.00 C ATOM 2179 C ALA A 136 2.048 5.675 10.087 1.00 0.00 C ATOM 2180 O ALA A 136 1.249 5.001 10.735 1.00 0.00 O ATOM 2181 CB ALA A 136 0.366 7.436 9.514 1.00 0.00 C ATOM 0 H ALA A 136 0.197 5.778 7.667 1.00 0.00 H new ATOM 0 HA ALA A 136 2.366 7.326 8.775 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.646 7.975 10.419 1.00 0.00 H new ATOM 0 HB2 ALA A 136 0.057 8.148 8.749 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.460 6.760 9.735 1.00 0.00 H new ATOM 2187 N ILE A 137 3.363 5.612 10.272 1.00 0.00 N ATOM 2188 CA ILE A 137 3.952 4.726 11.270 1.00 0.00 C ATOM 2189 C ILE A 137 4.059 5.412 12.628 1.00 0.00 C ATOM 2190 O ILE A 137 4.583 6.520 12.735 1.00 0.00 O ATOM 2191 CB ILE A 137 5.349 4.241 10.835 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.305 3.704 9.404 1.00 0.00 C ATOM 2193 CG2 ILE A 137 5.867 3.179 11.792 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.670 3.568 8.765 1.00 0.00 C ATOM 0 H ILE A 137 4.040 6.163 9.745 1.00 0.00 H new ATOM 0 HA ILE A 137 3.288 3.866 11.358 1.00 0.00 H new ATOM 0 HB ILE A 137 6.034 5.088 10.863 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.815 2.730 9.405 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.692 4.368 8.794 1.00 0.00 H new ATOM 0 HG21 ILE A 137 6.854 2.849 11.469 1.00 0.00 H new ATOM 0 HG22 ILE A 137 5.935 3.596 12.797 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.184 2.330 11.797 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.560 3.182 7.752 1.00 0.00 H new ATOM 0 HD12 ILE A 137 7.155 4.544 8.731 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.279 2.880 9.351 1.00 0.00 H new ATOM 2206 N THR A 138 3.552 4.746 13.662 1.00 0.00 N ATOM 2207 CA THR A 138 3.584 5.289 15.016 1.00 0.00 C ATOM 2208 C THR A 138 4.465 4.440 15.932 1.00 0.00 C ATOM 2209 O THR A 138 4.115 3.305 16.257 1.00 0.00 O ATOM 2210 CB THR A 138 2.167 5.362 15.589 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.239 5.744 14.584 1.00 0.00 O ATOM 2212 CG2 THR A 138 2.042 6.333 16.746 1.00 0.00 C ATOM 0 H THR A 138 3.114 3.828 13.587 1.00 0.00 H new ATOM 0 HA THR A 138 4.008 6.292 14.964 1.00 0.00 H new ATOM 0 HB THR A 138 1.946 4.361 15.959 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.048 4.976 14.007 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.014 6.338 17.107 1.00 0.00 H new ATOM 0 HG22 THR A 138 2.708 6.026 17.552 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.314 7.334 16.412 1.00 0.00 H new ATOM 2220 N PRO A 139 5.621 4.974 16.366 1.00 0.00 N ATOM 2221 CA PRO A 139 6.538 4.249 17.253 1.00 0.00 C ATOM 2222 C PRO A 139 5.929 4.007 18.633 1.00 0.00 C ATOM 2223 O PRO A 139 5.072 4.768 19.083 1.00 0.00 O ATOM 2224 CB PRO A 139 7.751 5.179 17.360 1.00 0.00 C ATOM 2225 CG PRO A 139 7.225 6.533 17.034 1.00 0.00 C ATOM 2226 CD PRO A 139 6.122 6.323 16.037 1.00 0.00 C ATOM 0 HA PRO A 139 6.781 3.260 16.866 1.00 0.00 H new ATOM 0 HB2 PRO A 139 8.182 5.153 18.361 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.538 4.883 16.666 1.00 0.00 H new ATOM 0 HG2 PRO A 139 6.852 7.032 17.928 1.00 0.00 H new ATOM 0 HG3 PRO A 139 8.009 7.166 16.620 1.00 0.00 H new ATOM 0 HD2 PRO A 139 5.341 7.077 16.136 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.490 6.377 15.012 1.00 0.00 H new ATOM 2234 N PRO A 140 6.362 2.938 19.324 1.00 0.00 N ATOM 2235 CA PRO A 140 5.849 2.600 20.653 1.00 0.00 C ATOM 2236 C PRO A 140 6.413 3.500 21.746 1.00 0.00 C ATOM 2237 O PRO A 140 5.800 3.682 22.799 1.00 0.00 O ATOM 2238 CB PRO A 140 6.316 1.159 20.850 1.00 0.00 C ATOM 2239 CG PRO A 140 7.564 1.058 20.043 1.00 0.00 C ATOM 2240 CD PRO A 140 7.379 1.973 18.861 1.00 0.00 C ATOM 0 HA PRO A 140 4.769 2.728 20.718 1.00 0.00 H new ATOM 0 HB2 PRO A 140 6.505 0.943 21.902 1.00 0.00 H new ATOM 0 HB3 PRO A 140 5.564 0.448 20.509 1.00 0.00 H new ATOM 0 HG2 PRO A 140 8.432 1.354 20.631 1.00 0.00 H new ATOM 0 HG3 PRO A 140 7.734 0.032 19.717 1.00 0.00 H new ATOM 0 HD2 PRO A 140 8.310 2.471 18.590 1.00 0.00 H new ATOM 0 HD3 PRO A 140 7.042 1.427 17.980 1.00 0.00 H new