USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=26 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 -114:sc= -4.24 (180deg=-1.23) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0.0119 USER MOD Set 1.3: A 124 SER OG : rot 18:sc= 0.56 USER MOD Set 1.4: A 125 GLN : amide:sc= -4.65 K(o=-8.3,f=-9.7!) USER MOD Set 2.1: A 70 THR OG1 : rot -65:sc= 0.739 USER MOD Set 2.2: A 109 THR OG1 : rot -116:sc= 0.252 USER MOD Set 3.1: A 86 HIS : no HD1:sc= -0.321 K(o=-2.4,f=-1.5) USER MOD Set 3.2: A 88 ASN : amide:sc= -2.08! C(o=-2.4!,f=-3.5!) USER MOD Set 3.3: A 108 SER OG : rot -150:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 70:sc= -3.38! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 154:sc= -1.3! USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.137 USER MOD Single : A 36 ASN : amide:sc= -1.38 X(o=-1.4,f=-1.4) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0.4) USER MOD Single : A 57 GLN : amide:sc= -0.796 X(o=-0.8,f=-0.63) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -109:sc= -1.05 USER MOD Single : A 62 MET CE :methyl -124:sc= -5.87! (180deg=-13.3!) USER MOD Single : A 65 THR OG1 : rot -160:sc= -1.15 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+ -174:sc= 0.647 (180deg=0.5!) 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 85 THR OG1 : rot 118:sc= 1.21 USER MOD Single : A 104 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0137) USER MOD Single : A 110 MET CE :methyl 145:sc= -1.47 (180deg=-3.27!) USER MOD Single : A 111 SER OG : rot 116:sc= 0.207 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.293 X(o=-0.29,f=-0.36) USER MOD Single : A 126 LYS NZ :NH3+ -123:sc= 0.0869 (180deg=-0.029) USER MOD Single : A 128 GLN : amide:sc= -0.2 X(o=-0.2,f=-0.0025) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 88:sc= 0.0385 USER MOD ----------------------------------------------------------------- ATOM 318 N ASP A 21 -4.928 -13.454 -7.990 1.00 0.00 N ATOM 319 CA ASP A 21 -4.667 -14.474 -6.979 1.00 0.00 C ATOM 320 C ASP A 21 -3.680 -13.965 -5.934 1.00 0.00 C ATOM 321 O ASP A 21 -2.556 -13.584 -6.260 1.00 0.00 O ATOM 322 CB ASP A 21 -4.127 -15.745 -7.634 1.00 0.00 C ATOM 323 CG ASP A 21 -5.221 -16.572 -8.282 1.00 0.00 C ATOM 324 OD1 ASP A 21 -5.639 -16.225 -9.407 1.00 0.00 O ATOM 325 OD2 ASP A 21 -5.659 -17.565 -7.665 1.00 0.00 O ATOM 0 HA ASP A 21 -5.608 -14.704 -6.480 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.385 -15.476 -8.386 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.616 -16.348 -6.884 1.00 0.00 H new ATOM 330 N ARG A 22 -4.109 -13.963 -4.675 1.00 0.00 N ATOM 331 CA ARG A 22 -3.269 -13.502 -3.572 1.00 0.00 C ATOM 332 C ARG A 22 -1.883 -14.148 -3.613 1.00 0.00 C ATOM 333 O ARG A 22 -0.911 -13.583 -3.109 1.00 0.00 O ATOM 334 CB ARG A 22 -3.946 -13.810 -2.233 1.00 0.00 C ATOM 335 CG ARG A 22 -4.508 -12.580 -1.538 1.00 0.00 C ATOM 336 CD ARG A 22 -5.927 -12.281 -1.994 1.00 0.00 C ATOM 337 NE ARG A 22 -6.857 -13.346 -1.630 1.00 0.00 N ATOM 338 CZ ARG A 22 -8.175 -13.182 -1.534 1.00 0.00 C ATOM 339 NH1 ARG A 22 -8.724 -11.997 -1.775 1.00 0.00 N ATOM 340 NH2 ARG A 22 -8.948 -14.205 -1.197 1.00 0.00 N ATOM 0 H ARG A 22 -5.037 -14.277 -4.392 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.142 -12.425 -3.678 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -4.753 -14.524 -2.399 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.225 -14.292 -1.573 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.496 -12.734 -0.459 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -3.870 -11.721 -1.745 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -6.260 -11.343 -1.550 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -5.939 -12.144 -3.075 1.00 0.00 H new ATOM 0 HE ARG A 22 -6.474 -14.272 -1.438 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -8.135 -11.206 -2.035 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -9.734 -11.878 -1.700 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.533 -15.118 -1.011 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.958 -14.079 -1.124 1.00 0.00 H new ATOM 354 N GLU A 23 -1.800 -15.336 -4.205 1.00 0.00 N ATOM 355 CA GLU A 23 -0.533 -16.059 -4.299 1.00 0.00 C ATOM 356 C GLU A 23 0.081 -15.933 -5.692 1.00 0.00 C ATOM 357 O GLU A 23 1.278 -15.683 -5.831 1.00 0.00 O ATOM 358 CB GLU A 23 -0.741 -17.536 -3.956 1.00 0.00 C ATOM 359 CG GLU A 23 -0.769 -17.813 -2.462 1.00 0.00 C ATOM 360 CD GLU A 23 -2.006 -18.576 -2.032 1.00 0.00 C ATOM 361 OE1 GLU A 23 -3.123 -18.044 -2.206 1.00 0.00 O ATOM 362 OE2 GLU A 23 -1.859 -19.708 -1.524 1.00 0.00 O ATOM 0 H GLU A 23 -2.593 -15.819 -4.627 1.00 0.00 H new ATOM 0 HA GLU A 23 0.157 -15.613 -3.583 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -1.678 -17.875 -4.398 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.057 -18.123 -4.411 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.118 -18.382 -2.185 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.723 -16.868 -1.920 1.00 0.00 H new ATOM 369 N LYS A 24 -0.743 -16.107 -6.722 1.00 0.00 N ATOM 370 CA LYS A 24 -0.276 -16.014 -8.103 1.00 0.00 C ATOM 371 C LYS A 24 -0.423 -14.589 -8.636 1.00 0.00 C ATOM 372 O LYS A 24 -0.618 -14.379 -9.833 1.00 0.00 O ATOM 373 CB LYS A 24 -1.051 -16.989 -8.993 1.00 0.00 C ATOM 374 CG LYS A 24 -0.174 -18.051 -9.638 1.00 0.00 C ATOM 375 CD LYS A 24 -0.054 -17.844 -11.142 1.00 0.00 C ATOM 376 CE LYS A 24 1.399 -17.803 -11.586 1.00 0.00 C ATOM 377 NZ LYS A 24 2.050 -16.509 -11.240 1.00 0.00 N ATOM 0 H LYS A 24 -1.737 -16.313 -6.627 1.00 0.00 H new ATOM 0 HA LYS A 24 0.781 -16.280 -8.121 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.821 -17.478 -8.397 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -1.562 -16.427 -9.775 1.00 0.00 H new ATOM 0 HG2 LYS A 24 0.818 -18.027 -9.187 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -0.591 -19.038 -9.438 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -0.572 -18.649 -11.663 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -0.547 -16.913 -11.422 1.00 0.00 H new ATOM 0 HE2 LYS A 24 1.945 -18.621 -11.116 1.00 0.00 H new ATOM 0 HE3 LYS A 24 1.454 -17.960 -12.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 3.040 -16.522 -11.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 1.545 -15.730 -11.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 2.021 -16.370 -10.210 1.00 0.00 H new ATOM 391 N THR A 25 -0.332 -13.617 -7.736 1.00 0.00 N ATOM 392 CA THR A 25 -0.460 -12.211 -8.100 1.00 0.00 C ATOM 393 C THR A 25 0.832 -11.670 -8.706 1.00 0.00 C ATOM 394 O THR A 25 1.906 -12.245 -8.524 1.00 0.00 O ATOM 395 CB THR A 25 -0.828 -11.387 -6.867 1.00 0.00 C ATOM 396 OG1 THR A 25 -0.640 -10.006 -7.115 1.00 0.00 O ATOM 397 CG2 THR A 25 -0.016 -11.754 -5.642 1.00 0.00 C ATOM 0 H THR A 25 -0.169 -13.779 -6.742 1.00 0.00 H new ATOM 0 HA THR A 25 -1.248 -12.131 -8.849 1.00 0.00 H new ATOM 0 HB THR A 25 -1.876 -11.610 -6.667 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.317 -9.693 -7.751 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.325 -11.133 -4.801 1.00 0.00 H new ATOM 0 HG22 THR A 25 -0.180 -12.804 -5.398 1.00 0.00 H new ATOM 0 HG23 THR A 25 1.042 -11.590 -5.844 1.00 0.00 H new ATOM 405 N SER A 26 0.718 -10.549 -9.415 1.00 0.00 N ATOM 406 CA SER A 26 1.872 -9.911 -10.039 1.00 0.00 C ATOM 407 C SER A 26 2.258 -8.643 -9.277 1.00 0.00 C ATOM 408 O SER A 26 1.393 -7.852 -8.902 1.00 0.00 O ATOM 409 CB SER A 26 1.567 -9.572 -11.500 1.00 0.00 C ATOM 410 OG SER A 26 1.500 -10.745 -12.293 1.00 0.00 O ATOM 0 H SER A 26 -0.165 -10.063 -9.571 1.00 0.00 H new ATOM 0 HA SER A 26 2.710 -10.608 -10.007 1.00 0.00 H new ATOM 0 HB2 SER A 26 0.622 -9.033 -11.562 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.338 -8.908 -11.891 1.00 0.00 H new ATOM 0 HG SER A 26 1.302 -10.501 -13.221 1.00 0.00 H new ATOM 416 N PRO A 27 3.563 -8.433 -9.029 1.00 0.00 N ATOM 417 CA PRO A 27 4.048 -7.259 -8.300 1.00 0.00 C ATOM 418 C PRO A 27 4.123 -6.007 -9.171 1.00 0.00 C ATOM 419 O PRO A 27 4.453 -6.080 -10.355 1.00 0.00 O ATOM 420 CB PRO A 27 5.446 -7.685 -7.861 1.00 0.00 C ATOM 421 CG PRO A 27 5.903 -8.619 -8.927 1.00 0.00 C ATOM 422 CD PRO A 27 4.669 -9.327 -9.428 1.00 0.00 C ATOM 0 HA PRO A 27 3.383 -6.985 -7.481 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.113 -6.827 -7.772 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.424 -8.174 -6.887 1.00 0.00 H new ATOM 0 HG2 PRO A 27 6.395 -8.077 -9.735 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.628 -9.332 -8.534 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.700 -9.468 -10.508 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.566 -10.316 -8.981 1.00 0.00 H new ATOM 430 N LEU A 28 3.826 -4.858 -8.570 1.00 0.00 N ATOM 431 CA LEU A 28 3.867 -3.583 -9.281 1.00 0.00 C ATOM 432 C LEU A 28 4.479 -2.498 -8.397 1.00 0.00 C ATOM 433 O LEU A 28 4.492 -2.619 -7.172 1.00 0.00 O ATOM 434 CB LEU A 28 2.464 -3.168 -9.732 1.00 0.00 C ATOM 435 CG LEU A 28 1.422 -3.075 -8.617 1.00 0.00 C ATOM 436 CD1 LEU A 28 1.353 -1.659 -8.066 1.00 0.00 C ATOM 437 CD2 LEU A 28 0.057 -3.517 -9.126 1.00 0.00 C ATOM 0 H LEU A 28 3.554 -4.784 -7.590 1.00 0.00 H new ATOM 0 HA LEU A 28 4.491 -3.707 -10.166 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.531 -2.199 -10.227 1.00 0.00 H new ATOM 0 HB3 LEU A 28 2.113 -3.883 -10.477 1.00 0.00 H new ATOM 0 HG LEU A 28 1.722 -3.743 -7.809 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.606 -1.613 -7.274 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.326 -1.377 -7.664 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.077 -0.971 -8.865 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.673 -3.445 -8.320 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.249 -2.874 -9.951 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.114 -4.549 -9.472 1.00 0.00 H new ATOM 449 N LEU A 29 4.991 -1.445 -9.026 1.00 0.00 N ATOM 450 CA LEU A 29 5.612 -0.345 -8.295 1.00 0.00 C ATOM 451 C LEU A 29 4.561 0.570 -7.673 1.00 0.00 C ATOM 452 O LEU A 29 3.685 1.089 -8.366 1.00 0.00 O ATOM 453 CB LEU A 29 6.525 0.459 -9.224 1.00 0.00 C ATOM 454 CG LEU A 29 7.117 1.737 -8.619 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.627 1.481 -7.208 1.00 0.00 C ATOM 456 CD2 LEU A 29 8.233 2.273 -9.503 1.00 0.00 C ATOM 0 H LEU A 29 4.988 -1.330 -10.039 1.00 0.00 H new ATOM 0 HA LEU A 29 6.208 -0.772 -7.489 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.344 -0.184 -9.546 1.00 0.00 H new ATOM 0 HB3 LEU A 29 5.961 0.728 -10.117 1.00 0.00 H new ATOM 0 HG LEU A 29 6.329 2.487 -8.563 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.043 2.402 -6.799 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.803 1.144 -6.579 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.401 0.714 -7.234 1.00 0.00 H new ATOM 0 HD21 LEU A 29 8.644 3.181 -9.060 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.020 1.524 -9.590 1.00 0.00 H new ATOM 0 HD23 LEU A 29 7.836 2.499 -10.493 1.00 0.00 H new ATOM 468 N LEU A 30 4.656 0.764 -6.360 1.00 0.00 N ATOM 469 CA LEU A 30 3.715 1.618 -5.642 1.00 0.00 C ATOM 470 C LEU A 30 4.450 2.680 -4.829 1.00 0.00 C ATOM 471 O LEU A 30 5.523 2.423 -4.280 1.00 0.00 O ATOM 472 CB LEU A 30 2.834 0.772 -4.717 1.00 0.00 C ATOM 473 CG LEU A 30 1.624 1.495 -4.121 1.00 0.00 C ATOM 474 CD1 LEU A 30 2.059 2.502 -3.067 1.00 0.00 C ATOM 475 CD2 LEU A 30 0.815 2.179 -5.215 1.00 0.00 C ATOM 0 H LEU A 30 5.375 0.341 -5.772 1.00 0.00 H new ATOM 0 HA LEU A 30 3.086 2.121 -6.377 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.480 -0.095 -5.274 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.450 0.396 -3.900 1.00 0.00 H new ATOM 0 HG LEU A 30 0.989 0.752 -3.638 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.181 3.003 -2.658 1.00 0.00 H new ATOM 0 HD12 LEU A 30 2.588 1.985 -2.266 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.720 3.241 -3.520 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.041 2.687 -4.771 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.442 2.907 -5.730 1.00 0.00 H new ATOM 0 HD23 LEU A 30 0.464 1.433 -5.928 1.00 0.00 H new ATOM 487 N ARG A 31 3.859 3.870 -4.750 1.00 0.00 N ATOM 488 CA ARG A 31 4.448 4.972 -3.998 1.00 0.00 C ATOM 489 C ARG A 31 3.777 5.108 -2.632 1.00 0.00 C ATOM 490 O ARG A 31 2.589 5.422 -2.540 1.00 0.00 O ATOM 491 CB ARG A 31 4.315 6.282 -4.779 1.00 0.00 C ATOM 492 CG ARG A 31 5.367 6.452 -5.862 1.00 0.00 C ATOM 493 CD ARG A 31 5.321 7.845 -6.469 1.00 0.00 C ATOM 494 NE ARG A 31 5.594 7.827 -7.903 1.00 0.00 N ATOM 495 CZ ARG A 31 5.282 8.821 -8.731 1.00 0.00 C ATOM 496 NH1 ARG A 31 4.686 9.914 -8.271 1.00 0.00 N ATOM 497 NH2 ARG A 31 5.566 8.722 -10.022 1.00 0.00 N ATOM 0 H ARG A 31 2.971 4.095 -5.199 1.00 0.00 H new ATOM 0 HA ARG A 31 5.506 4.757 -3.848 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.326 6.325 -5.235 1.00 0.00 H new ATOM 0 HB3 ARG A 31 4.382 7.119 -4.084 1.00 0.00 H new ATOM 0 HG2 ARG A 31 6.356 6.269 -5.442 1.00 0.00 H new ATOM 0 HG3 ARG A 31 5.210 5.708 -6.643 1.00 0.00 H new ATOM 0 HD2 ARG A 31 4.339 8.285 -6.293 1.00 0.00 H new ATOM 0 HD3 ARG A 31 6.050 8.482 -5.969 1.00 0.00 H new ATOM 0 HE ARG A 31 6.051 7.003 -8.294 1.00 0.00 H new ATOM 0 HH11 ARG A 31 4.465 9.995 -7.279 1.00 0.00 H new ATOM 0 HH12 ARG A 31 4.449 10.673 -8.910 1.00 0.00 H new ATOM 0 HH21 ARG A 31 6.024 7.884 -10.381 1.00 0.00 H new ATOM 0 HH22 ARG A 31 5.327 9.484 -10.657 1.00 0.00 H new ATOM 511 N VAL A 32 4.545 4.861 -1.576 1.00 0.00 N ATOM 512 CA VAL A 32 4.026 4.946 -0.215 1.00 0.00 C ATOM 513 C VAL A 32 4.789 5.972 0.612 1.00 0.00 C ATOM 514 O VAL A 32 6.015 6.031 0.565 1.00 0.00 O ATOM 515 CB VAL A 32 4.109 3.586 0.503 1.00 0.00 C ATOM 516 CG1 VAL A 32 2.922 2.712 0.137 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.417 2.889 0.165 1.00 0.00 C ATOM 0 H VAL A 32 5.529 4.600 -1.636 1.00 0.00 H new ATOM 0 HA VAL A 32 2.984 5.252 -0.303 1.00 0.00 H new ATOM 0 HB VAL A 32 4.080 3.761 1.579 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.000 1.756 0.655 1.00 0.00 H new ATOM 0 HG12 VAL A 32 1.999 3.210 0.432 1.00 0.00 H new ATOM 0 HG13 VAL A 32 2.914 2.542 -0.940 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.461 1.929 0.680 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.475 2.727 -0.911 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.254 3.511 0.484 1.00 0.00 H new ATOM 527 N PHE A 33 4.056 6.767 1.382 1.00 0.00 N ATOM 528 CA PHE A 33 4.663 7.781 2.234 1.00 0.00 C ATOM 529 C PHE A 33 4.608 7.339 3.688 1.00 0.00 C ATOM 530 O PHE A 33 3.528 7.168 4.253 1.00 0.00 O ATOM 531 CB PHE A 33 3.952 9.121 2.047 1.00 0.00 C ATOM 532 CG PHE A 33 3.795 9.502 0.603 1.00 0.00 C ATOM 533 CD1 PHE A 33 2.911 8.816 -0.213 1.00 0.00 C ATOM 534 CD2 PHE A 33 4.540 10.537 0.061 1.00 0.00 C ATOM 535 CE1 PHE A 33 2.771 9.154 -1.545 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.402 10.881 -1.271 1.00 0.00 C ATOM 537 CZ PHE A 33 3.518 10.188 -2.074 1.00 0.00 C ATOM 0 H PHE A 33 3.038 6.728 1.434 1.00 0.00 H new ATOM 0 HA PHE A 33 5.708 7.906 1.951 1.00 0.00 H new ATOM 0 HB2 PHE A 33 2.968 9.073 2.514 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.513 9.900 2.564 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.324 8.007 0.197 1.00 0.00 H new ATOM 0 HD2 PHE A 33 5.235 11.080 0.685 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.079 8.611 -2.171 1.00 0.00 H new ATOM 0 HE2 PHE A 33 4.985 11.691 -1.683 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.411 10.454 -3.115 1.00 0.00 H new ATOM 547 N THR A 34 5.776 7.126 4.286 1.00 0.00 N ATOM 548 CA THR A 34 5.845 6.670 5.667 1.00 0.00 C ATOM 549 C THR A 34 6.434 7.721 6.602 1.00 0.00 C ATOM 550 O THR A 34 7.524 8.243 6.370 1.00 0.00 O ATOM 551 CB THR A 34 6.667 5.384 5.757 1.00 0.00 C ATOM 552 OG1 THR A 34 7.968 5.581 5.234 1.00 0.00 O ATOM 553 CG2 THR A 34 6.044 4.221 5.015 1.00 0.00 C ATOM 0 H THR A 34 6.682 7.261 3.838 1.00 0.00 H new ATOM 0 HA THR A 34 4.821 6.482 5.990 1.00 0.00 H new ATOM 0 HB THR A 34 6.702 5.139 6.819 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.588 4.947 5.651 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.678 3.341 5.120 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.059 4.010 5.431 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.946 4.474 3.959 1.00 0.00 H new ATOM 561 N THR A 35 5.705 7.991 7.679 1.00 0.00 N ATOM 562 CA THR A 35 6.132 8.942 8.696 1.00 0.00 C ATOM 563 C THR A 35 6.333 8.200 10.001 1.00 0.00 C ATOM 564 O THR A 35 5.811 7.098 10.182 1.00 0.00 O ATOM 565 CB THR A 35 5.098 10.063 8.863 1.00 0.00 C ATOM 566 OG1 THR A 35 5.189 10.649 10.151 1.00 0.00 O ATOM 567 CG2 THR A 35 3.669 9.598 8.659 1.00 0.00 C ATOM 0 H THR A 35 4.802 7.557 7.871 1.00 0.00 H new ATOM 0 HA THR A 35 7.070 9.405 8.390 1.00 0.00 H new ATOM 0 HB THR A 35 5.336 10.791 8.087 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.522 11.362 10.234 1.00 0.00 H new ATOM 0 HG21 THR A 35 2.990 10.440 8.792 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.557 9.197 7.652 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.431 8.822 9.387 1.00 0.00 H new ATOM 575 N ASN A 36 7.082 8.773 10.932 1.00 0.00 N ATOM 576 CA ASN A 36 7.329 8.113 12.213 1.00 0.00 C ATOM 577 C ASN A 36 6.558 8.781 13.355 1.00 0.00 C ATOM 578 O ASN A 36 7.035 8.843 14.490 1.00 0.00 O ATOM 579 CB ASN A 36 8.829 8.120 12.539 1.00 0.00 C ATOM 580 CG ASN A 36 9.262 6.881 13.298 1.00 0.00 C ATOM 581 OD1 ASN A 36 9.701 5.896 12.704 1.00 0.00 O ATOM 582 ND2 ASN A 36 9.139 6.924 14.619 1.00 0.00 N ATOM 0 H ASN A 36 7.527 9.685 10.830 1.00 0.00 H new ATOM 0 HA ASN A 36 6.978 7.085 12.119 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.399 8.193 11.613 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.066 9.005 13.129 1.00 0.00 H new ATOM 0 HD21 ASN A 36 9.413 6.120 15.183 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.770 7.761 15.070 1.00 0.00 H new ATOM 589 N ASN A 37 5.366 9.272 13.047 1.00 0.00 N ATOM 590 CA ASN A 37 4.528 9.927 14.049 1.00 0.00 C ATOM 591 C ASN A 37 3.077 9.451 13.971 1.00 0.00 C ATOM 592 O ASN A 37 2.224 9.917 14.727 1.00 0.00 O ATOM 593 CB ASN A 37 4.584 11.444 13.874 1.00 0.00 C ATOM 594 CG ASN A 37 4.674 12.176 15.199 1.00 0.00 C ATOM 595 OD1 ASN A 37 3.796 12.048 16.051 1.00 0.00 O ATOM 596 ND2 ASN A 37 5.740 12.947 15.378 1.00 0.00 N ATOM 0 H ASN A 37 4.955 9.231 12.114 1.00 0.00 H new ATOM 0 HA ASN A 37 4.919 9.658 15.030 1.00 0.00 H new ATOM 0 HB2 ASN A 37 5.445 11.704 13.259 1.00 0.00 H new ATOM 0 HB3 ASN A 37 3.696 11.778 13.337 1.00 0.00 H new ATOM 0 HD21 ASN A 37 5.855 13.463 16.250 1.00 0.00 H new ATOM 0 HD22 ASN A 37 6.443 13.023 14.643 1.00 0.00 H new ATOM 603 N GLY A 38 2.797 8.525 13.058 1.00 0.00 N ATOM 604 CA GLY A 38 1.446 8.012 12.911 1.00 0.00 C ATOM 605 C GLY A 38 0.426 9.111 12.671 1.00 0.00 C ATOM 606 O GLY A 38 -0.614 9.155 13.328 1.00 0.00 O ATOM 0 H GLY A 38 3.481 8.121 12.418 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.418 7.307 12.080 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.172 7.457 13.809 1.00 0.00 H new ATOM 610 N ARG A 39 0.724 9.997 11.726 1.00 0.00 N ATOM 611 CA ARG A 39 -0.176 11.098 11.401 1.00 0.00 C ATOM 612 C ARG A 39 -0.219 11.338 9.895 1.00 0.00 C ATOM 613 O ARG A 39 0.708 10.977 9.173 1.00 0.00 O ATOM 614 CB ARG A 39 0.261 12.373 12.123 1.00 0.00 C ATOM 615 CG ARG A 39 0.104 12.305 13.633 1.00 0.00 C ATOM 616 CD ARG A 39 -1.335 12.552 14.061 1.00 0.00 C ATOM 617 NE ARG A 39 -1.466 13.760 14.872 1.00 0.00 N ATOM 618 CZ ARG A 39 -1.696 14.974 14.373 1.00 0.00 C ATOM 619 NH1 ARG A 39 -1.825 15.151 13.063 1.00 0.00 N ATOM 620 NH2 ARG A 39 -1.797 16.015 15.187 1.00 0.00 N ATOM 0 H ARG A 39 1.580 9.974 11.173 1.00 0.00 H new ATOM 0 HA ARG A 39 -1.177 10.827 11.736 1.00 0.00 H new ATOM 0 HB2 ARG A 39 1.305 12.575 11.884 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -0.321 13.213 11.744 1.00 0.00 H new ATOM 0 HG2 ARG A 39 0.427 11.326 13.989 1.00 0.00 H new ATOM 0 HG3 ARG A 39 0.755 13.044 14.100 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -1.966 12.639 13.177 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -1.697 11.694 14.628 1.00 0.00 H new ATOM 0 HE ARG A 39 -1.376 13.668 15.884 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -1.748 14.354 12.431 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -2.001 16.084 12.689 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -1.699 15.886 16.194 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -1.973 16.945 14.806 1.00 0.00 H new ATOM 864 N GLU A 55 8.394 9.101 -0.056 1.00 0.00 N ATOM 865 CA GLU A 55 7.859 8.017 -0.873 1.00 0.00 C ATOM 866 C GLU A 55 8.862 6.879 -1.036 1.00 0.00 C ATOM 867 O GLU A 55 10.042 7.107 -1.308 1.00 0.00 O ATOM 868 CB GLU A 55 7.452 8.544 -2.250 1.00 0.00 C ATOM 869 CG GLU A 55 8.568 9.281 -2.974 1.00 0.00 C ATOM 870 CD GLU A 55 8.166 10.682 -3.395 1.00 0.00 C ATOM 871 OE1 GLU A 55 8.272 11.605 -2.562 1.00 0.00 O ATOM 872 OE2 GLU A 55 7.743 10.853 -4.558 1.00 0.00 O ATOM 0 HA GLU A 55 6.984 7.623 -0.357 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.120 7.708 -2.866 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.600 9.214 -2.136 1.00 0.00 H new ATOM 0 HG2 GLU A 55 9.442 9.338 -2.325 1.00 0.00 H new ATOM 0 HG3 GLU A 55 8.862 8.711 -3.855 1.00 0.00 H new ATOM 879 N LEU A 56 8.383 5.651 -0.861 1.00 0.00 N ATOM 880 CA LEU A 56 9.233 4.466 -0.997 1.00 0.00 C ATOM 881 C LEU A 56 8.646 3.498 -2.024 1.00 0.00 C ATOM 882 O LEU A 56 7.428 3.357 -2.122 1.00 0.00 O ATOM 883 CB LEU A 56 9.419 3.738 0.345 1.00 0.00 C ATOM 884 CG LEU A 56 8.509 4.186 1.498 1.00 0.00 C ATOM 885 CD1 LEU A 56 7.780 2.991 2.099 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.319 4.905 2.570 1.00 0.00 C ATOM 0 H LEU A 56 7.412 5.447 -0.625 1.00 0.00 H new ATOM 0 HA LEU A 56 10.210 4.811 -1.337 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.261 2.672 0.180 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.455 3.862 0.660 1.00 0.00 H new ATOM 0 HG LEU A 56 7.768 4.879 1.100 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.140 3.328 2.914 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.170 2.514 1.332 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.508 2.275 2.481 1.00 0.00 H new ATOM 0 HD21 LEU A 56 8.658 5.215 3.379 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.081 4.232 2.962 1.00 0.00 H new ATOM 0 HD23 LEU A 56 9.798 5.783 2.136 1.00 0.00 H new ATOM 898 N GLN A 57 9.518 2.840 -2.788 1.00 0.00 N ATOM 899 CA GLN A 57 9.077 1.895 -3.800 1.00 0.00 C ATOM 900 C GLN A 57 8.809 0.523 -3.188 1.00 0.00 C ATOM 901 O GLN A 57 9.665 -0.044 -2.511 1.00 0.00 O ATOM 902 CB GLN A 57 10.131 1.780 -4.901 1.00 0.00 C ATOM 903 CG GLN A 57 10.345 3.069 -5.677 1.00 0.00 C ATOM 904 CD GLN A 57 11.236 4.052 -4.943 1.00 0.00 C ATOM 905 OE1 GLN A 57 12.455 3.887 -4.894 1.00 0.00 O ATOM 906 NE2 GLN A 57 10.630 5.083 -4.367 1.00 0.00 N ATOM 0 H GLN A 57 10.530 2.947 -2.722 1.00 0.00 H new ATOM 0 HA GLN A 57 8.146 2.264 -4.230 1.00 0.00 H new ATOM 0 HB2 GLN A 57 11.077 1.473 -4.456 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.835 0.993 -5.595 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.788 2.836 -6.645 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.379 3.536 -5.872 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.617 5.181 -4.433 1.00 0.00 H new ATOM 0 HE22 GLN A 57 11.178 5.777 -3.859 1.00 0.00 H new ATOM 915 N ILE A 58 7.615 -0.001 -3.435 1.00 0.00 N ATOM 916 CA ILE A 58 7.226 -1.309 -2.916 1.00 0.00 C ATOM 917 C ILE A 58 6.561 -2.151 -3.994 1.00 0.00 C ATOM 918 O ILE A 58 5.571 -1.734 -4.597 1.00 0.00 O ATOM 919 CB ILE A 58 6.251 -1.195 -1.724 1.00 0.00 C ATOM 920 CG1 ILE A 58 5.490 0.131 -1.754 1.00 0.00 C ATOM 921 CG2 ILE A 58 7.004 -1.346 -0.415 1.00 0.00 C ATOM 922 CD1 ILE A 58 4.070 0.020 -1.243 1.00 0.00 C ATOM 0 H ILE A 58 6.896 0.460 -3.993 1.00 0.00 H new ATOM 0 HA ILE A 58 8.147 -1.787 -2.581 1.00 0.00 H new ATOM 0 HB ILE A 58 5.520 -2.000 -1.806 1.00 0.00 H new ATOM 0 HG12 ILE A 58 6.028 0.864 -1.153 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.472 0.508 -2.777 1.00 0.00 H new ATOM 0 HG21 ILE A 58 6.306 -1.264 0.418 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.491 -2.321 -0.386 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.757 -0.562 -0.336 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.588 0.997 -1.292 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.516 -0.689 -1.858 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.081 -0.328 -0.210 1.00 0.00 H new ATOM 934 N TYR A 59 7.095 -3.344 -4.221 1.00 0.00 N ATOM 935 CA TYR A 59 6.528 -4.244 -5.211 1.00 0.00 C ATOM 936 C TYR A 59 5.349 -4.989 -4.601 1.00 0.00 C ATOM 937 O TYR A 59 5.478 -6.132 -4.165 1.00 0.00 O ATOM 938 CB TYR A 59 7.585 -5.233 -5.706 1.00 0.00 C ATOM 939 CG TYR A 59 8.660 -4.591 -6.554 1.00 0.00 C ATOM 940 CD1 TYR A 59 8.344 -3.982 -7.763 1.00 0.00 C ATOM 941 CD2 TYR A 59 9.988 -4.593 -6.147 1.00 0.00 C ATOM 942 CE1 TYR A 59 9.323 -3.394 -8.542 1.00 0.00 C ATOM 943 CE2 TYR A 59 10.971 -4.006 -6.921 1.00 0.00 C ATOM 944 CZ TYR A 59 10.634 -3.408 -8.116 1.00 0.00 C ATOM 945 OH TYR A 59 11.611 -2.824 -8.888 1.00 0.00 O ATOM 0 H TYR A 59 7.915 -3.707 -3.735 1.00 0.00 H new ATOM 0 HA TYR A 59 6.183 -3.662 -6.065 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.051 -5.715 -4.847 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.096 -6.016 -6.285 1.00 0.00 H new ATOM 0 HD1 TYR A 59 7.318 -3.968 -8.099 1.00 0.00 H new ATOM 0 HD2 TYR A 59 10.257 -5.061 -5.211 1.00 0.00 H new ATOM 0 HE1 TYR A 59 9.062 -2.926 -9.480 1.00 0.00 H new ATOM 0 HE2 TYR A 59 11.999 -4.016 -6.591 1.00 0.00 H new ATOM 0 HH TYR A 59 12.480 -2.920 -8.444 1.00 0.00 H new ATOM 955 N THR A 60 4.201 -4.321 -4.562 1.00 0.00 N ATOM 956 CA THR A 60 2.994 -4.902 -3.992 1.00 0.00 C ATOM 957 C THR A 60 2.001 -5.266 -5.086 1.00 0.00 C ATOM 958 O THR A 60 2.284 -5.107 -6.272 1.00 0.00 O ATOM 959 CB THR A 60 2.362 -3.921 -2.999 1.00 0.00 C ATOM 960 OG1 THR A 60 1.351 -4.559 -2.239 1.00 0.00 O ATOM 961 CG2 THR A 60 1.742 -2.709 -3.660 1.00 0.00 C ATOM 0 H THR A 60 4.082 -3.373 -4.920 1.00 0.00 H new ATOM 0 HA THR A 60 3.264 -5.816 -3.464 1.00 0.00 H new ATOM 0 HB THR A 60 3.183 -3.586 -2.365 1.00 0.00 H new ATOM 0 HG1 THR A 60 0.473 -4.223 -2.515 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.314 -2.058 -2.898 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.507 -2.165 -4.214 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.958 -3.030 -4.345 1.00 0.00 H new ATOM 969 N TRP A 61 0.836 -5.764 -4.690 1.00 0.00 N ATOM 970 CA TRP A 61 -0.177 -6.146 -5.674 1.00 0.00 C ATOM 971 C TRP A 61 -1.593 -5.698 -5.306 1.00 0.00 C ATOM 972 O TRP A 61 -2.069 -5.907 -4.197 1.00 0.00 O ATOM 973 CB TRP A 61 -0.158 -7.650 -5.939 1.00 0.00 C ATOM 974 CG TRP A 61 -0.209 -8.506 -4.714 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.305 -9.141 -4.203 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.887 -8.844 -3.859 1.00 0.00 C ATOM 977 NE1 TRP A 61 -0.956 -9.860 -3.087 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.384 -9.690 -2.852 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.245 -8.515 -3.848 1.00 0.00 C ATOM 980 CZ2 TRP A 61 1.193 -10.211 -1.847 1.00 0.00 C ATOM 981 CZ3 TRP A 61 3.047 -9.032 -2.847 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.519 -9.873 -1.861 1.00 0.00 C ATOM 0 H TRP A 61 0.570 -5.912 -3.717 1.00 0.00 H new ATOM 0 HA TRP A 61 0.095 -5.615 -6.586 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -1.005 -7.903 -6.576 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.745 -7.894 -6.498 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.301 -9.085 -4.617 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.590 -10.428 -2.525 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.661 -7.869 -4.607 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.789 -10.859 -1.083 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 4.098 -8.783 -2.826 1.00 0.00 H new ATOM 0 HH2 TRP A 61 3.172 -10.264 -1.095 1.00 0.00 H new ATOM 993 N MET A 62 -2.220 -5.057 -6.284 1.00 0.00 N ATOM 994 CA MET A 62 -3.581 -4.510 -6.164 1.00 0.00 C ATOM 995 C MET A 62 -4.456 -5.331 -5.204 1.00 0.00 C ATOM 996 O MET A 62 -5.259 -4.768 -4.458 1.00 0.00 O ATOM 997 CB MET A 62 -4.265 -4.472 -7.540 1.00 0.00 C ATOM 998 CG MET A 62 -3.431 -3.844 -8.650 1.00 0.00 C ATOM 999 SD MET A 62 -3.524 -2.045 -8.663 1.00 0.00 S ATOM 1000 CE MET A 62 -2.384 -1.633 -7.347 1.00 0.00 C ATOM 0 H MET A 62 -1.798 -4.896 -7.199 1.00 0.00 H new ATOM 0 HA MET A 62 -3.478 -3.502 -5.761 1.00 0.00 H new ATOM 0 HB2 MET A 62 -4.523 -5.490 -7.830 1.00 0.00 H new ATOM 0 HB3 MET A 62 -5.200 -3.919 -7.450 1.00 0.00 H new ATOM 0 HG2 MET A 62 -2.391 -4.148 -8.533 1.00 0.00 H new ATOM 0 HG3 MET A 62 -3.769 -4.227 -9.613 1.00 0.00 H new ATOM 0 HE1 MET A 62 -2.893 -1.019 -6.604 1.00 0.00 H new ATOM 0 HE2 MET A 62 -2.024 -2.548 -6.877 1.00 0.00 H new ATOM 0 HE3 MET A 62 -1.539 -1.080 -7.757 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.314 -6.653 -5.240 1.00 0.00 N ATOM 1011 CA ASP A 63 -5.112 -7.536 -4.385 1.00 0.00 C ATOM 1012 C ASP A 63 -4.335 -8.004 -3.155 1.00 0.00 C ATOM 1013 O ASP A 63 -4.559 -9.105 -2.654 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.591 -8.749 -5.185 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.786 -8.428 -6.061 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -6.760 -7.379 -6.740 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.747 -9.226 -6.071 1.00 0.00 O ATOM 0 H ASP A 63 -3.656 -7.139 -5.850 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.969 -6.961 -4.036 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.775 -9.115 -5.808 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.853 -9.554 -4.498 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.417 -7.172 -2.676 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.607 -7.514 -1.511 1.00 0.00 C ATOM 1024 C ALA A 64 -3.327 -7.188 -0.205 1.00 0.00 C ATOM 1025 O ALA A 64 -3.968 -6.145 -0.082 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.273 -6.784 -1.562 1.00 0.00 C ATOM 0 H ALA A 64 -3.215 -6.256 -3.076 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.433 -8.590 -1.539 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.680 -7.049 -0.687 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.735 -7.071 -2.466 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.447 -5.708 -1.570 1.00 0.00 H new ATOM 1032 N THR A 65 -3.198 -8.081 0.773 1.00 0.00 N ATOM 1033 CA THR A 65 -3.817 -7.879 2.079 1.00 0.00 C ATOM 1034 C THR A 65 -2.996 -6.881 2.895 1.00 0.00 C ATOM 1035 O THR A 65 -1.786 -6.767 2.698 1.00 0.00 O ATOM 1036 CB THR A 65 -3.936 -9.206 2.832 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.077 -10.185 2.271 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.342 -9.770 2.827 1.00 0.00 C ATOM 0 H THR A 65 -2.671 -8.950 0.686 1.00 0.00 H new ATOM 0 HA THR A 65 -4.820 -7.479 1.930 1.00 0.00 H new ATOM 0 HB THR A 65 -3.654 -8.980 3.860 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.382 -11.078 2.536 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.359 -10.711 3.377 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.020 -9.061 3.301 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.660 -9.945 1.799 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.654 -6.167 3.809 1.00 0.00 N ATOM 1047 CA LEU A 66 -2.977 -5.181 4.644 1.00 0.00 C ATOM 1048 C LEU A 66 -1.689 -5.752 5.237 1.00 0.00 C ATOM 1049 O LEU A 66 -0.723 -5.022 5.464 1.00 0.00 O ATOM 1050 CB LEU A 66 -3.912 -4.721 5.762 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.678 -3.413 5.502 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -3.925 -2.227 6.084 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -4.928 -3.204 4.014 1.00 0.00 C ATOM 0 H LEU A 66 -4.654 -6.255 3.988 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.711 -4.328 4.020 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.637 -5.512 5.951 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.326 -4.601 6.673 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.645 -3.491 5.998 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.483 -1.311 5.890 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -3.811 -2.361 7.160 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.941 -2.158 5.620 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.471 -2.271 3.864 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.975 -3.157 3.488 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.517 -4.034 3.624 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.685 -7.057 5.486 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.516 -7.716 6.052 1.00 0.00 C ATOM 1067 C LYS A 67 0.678 -7.619 5.102 1.00 0.00 C ATOM 1068 O LYS A 67 1.768 -7.221 5.513 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.823 -9.184 6.360 1.00 0.00 C ATOM 1070 CG LYS A 67 -1.289 -9.975 5.151 1.00 0.00 C ATOM 1071 CD LYS A 67 -2.222 -11.107 5.553 1.00 0.00 C ATOM 1072 CE LYS A 67 -1.461 -12.404 5.767 1.00 0.00 C ATOM 1073 NZ LYS A 67 -1.425 -13.238 4.534 1.00 0.00 N ATOM 0 H LYS A 67 -2.475 -7.676 5.305 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.261 -7.207 6.981 1.00 0.00 H new ATOM 0 HB2 LYS A 67 0.071 -9.655 6.769 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -1.591 -9.231 7.132 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.800 -9.310 4.455 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.425 -10.383 4.626 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -2.750 -10.838 6.468 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -2.977 -11.250 4.780 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -0.442 -12.179 6.083 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -1.927 -12.969 6.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.897 -14.114 4.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -2.396 -13.475 4.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -0.957 -12.709 3.771 1.00 0.00 H new ATOM 1087 N GLU A 68 0.472 -7.980 3.837 1.00 0.00 N ATOM 1088 CA GLU A 68 1.537 -7.927 2.852 1.00 0.00 C ATOM 1089 C GLU A 68 2.173 -6.542 2.810 1.00 0.00 C ATOM 1090 O GLU A 68 3.387 -6.413 2.657 1.00 0.00 O ATOM 1091 CB GLU A 68 0.985 -8.308 1.481 1.00 0.00 C ATOM 1092 CG GLU A 68 0.830 -9.808 1.301 1.00 0.00 C ATOM 1093 CD GLU A 68 -0.560 -10.203 0.835 1.00 0.00 C ATOM 1094 OE1 GLU A 68 -1.145 -9.461 0.020 1.00 0.00 O ATOM 1095 OE2 GLU A 68 -1.061 -11.255 1.287 1.00 0.00 O ATOM 0 H GLU A 68 -0.423 -8.311 3.476 1.00 0.00 H new ATOM 0 HA GLU A 68 2.313 -8.639 3.135 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.017 -7.828 1.339 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.649 -7.921 0.708 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.565 -10.161 0.577 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.047 -10.307 2.245 1.00 0.00 H new ATOM 1102 N LEU A 69 1.350 -5.510 2.955 1.00 0.00 N ATOM 1103 CA LEU A 69 1.849 -4.141 2.940 1.00 0.00 C ATOM 1104 C LEU A 69 2.676 -3.862 4.192 1.00 0.00 C ATOM 1105 O LEU A 69 3.572 -3.018 4.180 1.00 0.00 O ATOM 1106 CB LEU A 69 0.692 -3.143 2.829 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.199 -3.303 1.590 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.620 -3.730 0.381 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.313 -4.302 1.866 1.00 0.00 C ATOM 0 H LEU A 69 0.342 -5.594 3.083 1.00 0.00 H new ATOM 0 HA LEU A 69 2.489 -4.020 2.066 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.068 -3.235 3.718 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.104 -2.134 2.832 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.648 -2.336 1.365 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.035 -3.836 -0.483 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.379 -2.976 0.171 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.105 -4.684 0.588 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.937 -4.405 0.978 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.880 -5.269 2.120 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.921 -3.948 2.698 1.00 0.00 H new ATOM 1121 N THR A 70 2.377 -4.589 5.268 1.00 0.00 N ATOM 1122 CA THR A 70 3.103 -4.432 6.524 1.00 0.00 C ATOM 1123 C THR A 70 4.555 -4.877 6.357 1.00 0.00 C ATOM 1124 O THR A 70 5.462 -4.312 6.972 1.00 0.00 O ATOM 1125 CB THR A 70 2.428 -5.243 7.635 1.00 0.00 C ATOM 1126 OG1 THR A 70 1.109 -4.781 7.863 1.00 0.00 O ATOM 1127 CG2 THR A 70 3.168 -5.189 8.955 1.00 0.00 C ATOM 0 H THR A 70 1.638 -5.291 5.293 1.00 0.00 H new ATOM 0 HA THR A 70 3.089 -3.378 6.802 1.00 0.00 H new ATOM 0 HB THR A 70 2.431 -6.273 7.279 1.00 0.00 H new ATOM 0 HG1 THR A 70 1.138 -3.863 8.205 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.635 -5.785 9.696 1.00 0.00 H new ATOM 0 HG22 THR A 70 4.174 -5.588 8.825 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.229 -4.156 9.296 1.00 0.00 H new ATOM 1135 N SER A 71 4.772 -5.885 5.513 1.00 0.00 N ATOM 1136 CA SER A 71 6.115 -6.390 5.262 1.00 0.00 C ATOM 1137 C SER A 71 6.814 -5.526 4.222 1.00 0.00 C ATOM 1138 O SER A 71 7.979 -5.165 4.377 1.00 0.00 O ATOM 1139 CB SER A 71 6.059 -7.844 4.794 1.00 0.00 C ATOM 1140 OG SER A 71 6.505 -8.727 5.810 1.00 0.00 O ATOM 0 H SER A 71 4.036 -6.364 4.995 1.00 0.00 H new ATOM 0 HA SER A 71 6.683 -6.348 6.191 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.038 -8.098 4.510 1.00 0.00 H new ATOM 0 HB3 SER A 71 6.677 -7.967 3.905 1.00 0.00 H new ATOM 0 HG SER A 71 6.457 -9.650 5.485 1.00 0.00 H new ATOM 1146 N LEU A 72 6.081 -5.189 3.163 1.00 0.00 N ATOM 1147 CA LEU A 72 6.608 -4.353 2.088 1.00 0.00 C ATOM 1148 C LEU A 72 7.321 -3.130 2.660 1.00 0.00 C ATOM 1149 O LEU A 72 8.498 -2.896 2.375 1.00 0.00 O ATOM 1150 CB LEU A 72 5.467 -3.922 1.169 1.00 0.00 C ATOM 1151 CG LEU A 72 5.103 -4.931 0.080 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.622 -4.852 -0.246 1.00 0.00 C ATOM 1153 CD2 LEU A 72 5.939 -4.695 -1.169 1.00 0.00 C ATOM 0 H LEU A 72 5.114 -5.485 3.027 1.00 0.00 H new ATOM 0 HA LEU A 72 7.332 -4.930 1.513 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.583 -3.730 1.777 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.738 -2.979 0.694 1.00 0.00 H new ATOM 0 HG LEU A 72 5.320 -5.932 0.453 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.381 -5.577 -1.023 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.040 -5.073 0.649 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.380 -3.849 -0.598 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.666 -5.423 -1.933 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.756 -3.688 -1.545 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.996 -4.804 -0.925 1.00 0.00 H new ATOM 1165 N VAL A 73 6.614 -2.373 3.496 1.00 0.00 N ATOM 1166 CA VAL A 73 7.195 -1.199 4.124 1.00 0.00 C ATOM 1167 C VAL A 73 8.349 -1.606 5.031 1.00 0.00 C ATOM 1168 O VAL A 73 9.384 -0.949 5.061 1.00 0.00 O ATOM 1169 CB VAL A 73 6.148 -0.425 4.945 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.754 0.836 5.543 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.942 -0.083 4.083 1.00 0.00 C ATOM 0 H VAL A 73 5.643 -2.554 3.750 1.00 0.00 H new ATOM 0 HA VAL A 73 7.562 -0.547 3.331 1.00 0.00 H new ATOM 0 HB VAL A 73 5.817 -1.063 5.764 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.996 1.366 6.119 1.00 0.00 H new ATOM 0 HG12 VAL A 73 7.583 0.566 6.197 1.00 0.00 H new ATOM 0 HG13 VAL A 73 7.118 1.480 4.742 1.00 0.00 H new ATOM 0 HG21 VAL A 73 4.212 0.464 4.679 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.259 0.534 3.242 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.490 -1.002 3.709 1.00 0.00 H new ATOM 1181 N LYS A 74 8.160 -2.692 5.776 1.00 0.00 N ATOM 1182 CA LYS A 74 9.189 -3.178 6.690 1.00 0.00 C ATOM 1183 C LYS A 74 10.488 -3.454 5.963 1.00 0.00 C ATOM 1184 O LYS A 74 11.578 -3.151 6.460 1.00 0.00 O ATOM 1185 CB LYS A 74 8.707 -4.446 7.398 1.00 0.00 C ATOM 1186 CG LYS A 74 7.941 -4.177 8.685 1.00 0.00 C ATOM 1187 CD LYS A 74 7.191 -2.853 8.635 1.00 0.00 C ATOM 1188 CE LYS A 74 5.835 -2.953 9.306 1.00 0.00 C ATOM 1189 NZ LYS A 74 4.814 -2.124 8.608 1.00 0.00 N ATOM 0 H LYS A 74 7.307 -3.250 5.765 1.00 0.00 H new ATOM 0 HA LYS A 74 9.375 -2.399 7.429 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.069 -5.011 6.718 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.568 -5.075 7.623 1.00 0.00 H new ATOM 0 HG2 LYS A 74 7.234 -4.988 8.863 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.635 -4.169 9.525 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.783 -2.080 9.124 1.00 0.00 H new ATOM 0 HD3 LYS A 74 7.062 -2.546 7.597 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.511 -3.994 9.320 1.00 0.00 H new ATOM 0 HE3 LYS A 74 5.918 -2.631 10.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 3.927 -2.136 9.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 5.157 -1.146 8.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 4.643 -2.511 7.658 1.00 0.00 H new ATOM 1203 N GLU A 75 10.398 -4.036 4.764 1.00 0.00 N ATOM 1204 CA GLU A 75 11.577 -4.342 3.981 1.00 0.00 C ATOM 1205 C GLU A 75 12.256 -3.068 3.492 1.00 0.00 C ATOM 1206 O GLU A 75 13.464 -3.051 3.245 1.00 0.00 O ATOM 1207 CB GLU A 75 11.193 -5.223 2.779 1.00 0.00 C ATOM 1208 CG GLU A 75 11.708 -6.652 2.884 1.00 0.00 C ATOM 1209 CD GLU A 75 12.825 -6.946 1.902 1.00 0.00 C ATOM 1210 OE1 GLU A 75 13.987 -6.600 2.203 1.00 0.00 O ATOM 1211 OE2 GLU A 75 12.538 -7.520 0.831 1.00 0.00 O ATOM 0 H GLU A 75 9.517 -4.301 4.323 1.00 0.00 H new ATOM 0 HA GLU A 75 12.279 -4.881 4.618 1.00 0.00 H new ATOM 0 HB2 GLU A 75 10.107 -5.243 2.685 1.00 0.00 H new ATOM 0 HB3 GLU A 75 11.584 -4.771 1.868 1.00 0.00 H new ATOM 0 HG2 GLU A 75 12.065 -6.831 3.898 1.00 0.00 H new ATOM 0 HG3 GLU A 75 10.884 -7.344 2.709 1.00 0.00 H new ATOM 1218 N VAL A 76 11.476 -2.001 3.349 1.00 0.00 N ATOM 1219 CA VAL A 76 12.018 -0.723 2.890 1.00 0.00 C ATOM 1220 C VAL A 76 12.206 0.264 4.047 1.00 0.00 C ATOM 1221 O VAL A 76 12.611 1.409 3.836 1.00 0.00 O ATOM 1222 CB VAL A 76 11.119 -0.082 1.809 1.00 0.00 C ATOM 1223 CG1 VAL A 76 10.538 -1.149 0.896 1.00 0.00 C ATOM 1224 CG2 VAL A 76 10.001 0.751 2.429 1.00 0.00 C ATOM 0 H VAL A 76 10.474 -1.993 3.542 1.00 0.00 H new ATOM 0 HA VAL A 76 12.994 -0.940 2.456 1.00 0.00 H new ATOM 0 HB VAL A 76 11.744 0.587 1.217 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.908 -0.678 0.141 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.348 -1.690 0.407 1.00 0.00 H new ATOM 0 HG13 VAL A 76 9.941 -1.845 1.484 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.390 1.186 1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.380 0.115 3.059 1.00 0.00 H new ATOM 0 HG23 VAL A 76 10.434 1.548 3.033 1.00 0.00 H new ATOM 1234 N TYR A 77 11.899 -0.177 5.261 1.00 0.00 N ATOM 1235 CA TYR A 77 12.021 0.675 6.435 1.00 0.00 C ATOM 1236 C TYR A 77 12.355 -0.149 7.680 1.00 0.00 C ATOM 1237 O TYR A 77 11.536 -0.945 8.141 1.00 0.00 O ATOM 1238 CB TYR A 77 10.719 1.448 6.645 1.00 0.00 C ATOM 1239 CG TYR A 77 10.913 2.942 6.762 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.601 3.491 7.837 1.00 0.00 C ATOM 1241 CD2 TYR A 77 10.410 3.802 5.796 1.00 0.00 C ATOM 1242 CE1 TYR A 77 11.783 4.857 7.943 1.00 0.00 C ATOM 1243 CE2 TYR A 77 10.588 5.169 5.895 1.00 0.00 C ATOM 1244 CZ TYR A 77 11.275 5.692 6.970 1.00 0.00 C ATOM 1245 OH TYR A 77 11.453 7.052 7.072 1.00 0.00 O ATOM 0 H TYR A 77 11.564 -1.120 5.457 1.00 0.00 H new ATOM 0 HA TYR A 77 12.837 1.378 6.270 1.00 0.00 H new ATOM 0 HB2 TYR A 77 10.046 1.242 5.813 1.00 0.00 H new ATOM 0 HB3 TYR A 77 10.231 1.082 7.548 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.000 2.840 8.601 1.00 0.00 H new ATOM 0 HD2 TYR A 77 9.871 3.396 4.953 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.321 5.269 8.784 1.00 0.00 H new ATOM 0 HE2 TYR A 77 10.191 5.824 5.134 1.00 0.00 H new ATOM 0 HH TYR A 77 11.035 7.495 6.304 1.00 0.00 H new ATOM 1255 N PRO A 78 13.566 0.026 8.244 1.00 0.00 N ATOM 1256 CA PRO A 78 13.996 -0.710 9.436 1.00 0.00 C ATOM 1257 C PRO A 78 13.295 -0.231 10.706 1.00 0.00 C ATOM 1258 O PRO A 78 12.926 -1.033 11.563 1.00 0.00 O ATOM 1259 CB PRO A 78 15.506 -0.426 9.525 1.00 0.00 C ATOM 1260 CG PRO A 78 15.868 0.285 8.262 1.00 0.00 C ATOM 1261 CD PRO A 78 14.611 0.941 7.770 1.00 0.00 C ATOM 0 HA PRO A 78 13.754 -1.770 9.356 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.737 0.186 10.397 1.00 0.00 H new ATOM 0 HB3 PRO A 78 16.072 -1.352 9.627 1.00 0.00 H new ATOM 0 HG2 PRO A 78 16.647 1.025 8.443 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.257 -0.413 7.521 1.00 0.00 H new ATOM 0 HD2 PRO A 78 14.489 1.943 8.181 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.603 1.038 6.684 1.00 0.00 H new ATOM 1269 N GLU A 79 13.126 1.082 10.822 1.00 0.00 N ATOM 1270 CA GLU A 79 12.482 1.673 11.992 1.00 0.00 C ATOM 1271 C GLU A 79 11.056 1.154 12.175 1.00 0.00 C ATOM 1272 O GLU A 79 10.488 1.253 13.262 1.00 0.00 O ATOM 1273 CB GLU A 79 12.465 3.198 11.871 1.00 0.00 C ATOM 1274 CG GLU A 79 12.494 3.915 13.211 1.00 0.00 C ATOM 1275 CD GLU A 79 13.897 4.305 13.634 1.00 0.00 C ATOM 1276 OE1 GLU A 79 14.606 3.448 14.200 1.00 0.00 O ATOM 1277 OE2 GLU A 79 14.286 5.468 13.399 1.00 0.00 O ATOM 0 H GLU A 79 13.426 1.758 10.120 1.00 0.00 H new ATOM 0 HA GLU A 79 13.062 1.382 12.868 1.00 0.00 H new ATOM 0 HB2 GLU A 79 13.323 3.517 11.279 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.571 3.501 11.326 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.874 4.810 13.154 1.00 0.00 H new ATOM 0 HG3 GLU A 79 12.055 3.271 13.973 1.00 0.00 H new ATOM 1284 N ALA A 80 10.477 0.609 11.108 1.00 0.00 N ATOM 1285 CA ALA A 80 9.115 0.088 11.167 1.00 0.00 C ATOM 1286 C ALA A 80 9.087 -1.355 11.663 1.00 0.00 C ATOM 1287 O ALA A 80 8.115 -1.788 12.282 1.00 0.00 O ATOM 1288 CB ALA A 80 8.455 0.190 9.801 1.00 0.00 C ATOM 0 H ALA A 80 10.927 0.517 10.197 1.00 0.00 H new ATOM 0 HA ALA A 80 8.556 0.694 11.880 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.439 -0.202 9.857 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.425 1.234 9.489 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.027 -0.389 9.076 1.00 0.00 H new ATOM 1294 N ARG A 81 10.153 -2.098 11.383 1.00 0.00 N ATOM 1295 CA ARG A 81 10.244 -3.496 11.797 1.00 0.00 C ATOM 1296 C ARG A 81 10.135 -3.650 13.315 1.00 0.00 C ATOM 1297 O ARG A 81 9.889 -4.749 13.815 1.00 0.00 O ATOM 1298 CB ARG A 81 11.556 -4.110 11.301 1.00 0.00 C ATOM 1299 CG ARG A 81 11.357 -5.188 10.248 1.00 0.00 C ATOM 1300 CD ARG A 81 12.498 -6.192 10.252 1.00 0.00 C ATOM 1301 NE ARG A 81 13.670 -5.691 9.535 1.00 0.00 N ATOM 1302 CZ ARG A 81 14.509 -6.461 8.843 1.00 0.00 C ATOM 1303 NH1 ARG A 81 14.320 -7.774 8.778 1.00 0.00 N ATOM 1304 NH2 ARG A 81 15.541 -5.916 8.217 1.00 0.00 N ATOM 0 H ARG A 81 10.967 -1.756 10.871 1.00 0.00 H new ATOM 0 HA ARG A 81 9.403 -4.025 11.349 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.185 -3.321 10.888 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.093 -4.535 12.149 1.00 0.00 H new ATOM 0 HG2 ARG A 81 10.415 -5.706 10.430 1.00 0.00 H new ATOM 0 HG3 ARG A 81 11.281 -4.726 9.264 1.00 0.00 H new ATOM 0 HD2 ARG A 81 12.774 -6.423 11.281 1.00 0.00 H new ATOM 0 HD3 ARG A 81 12.163 -7.123 9.794 1.00 0.00 H new ATOM 0 HE ARG A 81 13.857 -4.689 9.567 1.00 0.00 H new ATOM 0 HH11 ARG A 81 13.528 -8.200 9.260 1.00 0.00 H new ATOM 0 HH12 ARG A 81 14.967 -8.357 8.246 1.00 0.00 H new ATOM 0 HH21 ARG A 81 15.693 -4.908 8.265 1.00 0.00 H new ATOM 0 HH22 ARG A 81 16.184 -6.504 7.687 1.00 0.00 H new ATOM 1318 N LYS A 82 10.319 -2.555 14.049 1.00 0.00 N ATOM 1319 CA LYS A 82 10.239 -2.592 15.506 1.00 0.00 C ATOM 1320 C LYS A 82 8.899 -3.159 15.965 1.00 0.00 C ATOM 1321 O LYS A 82 7.846 -2.785 15.450 1.00 0.00 O ATOM 1322 CB LYS A 82 10.438 -1.190 16.085 1.00 0.00 C ATOM 1323 CG LYS A 82 10.925 -1.192 17.526 1.00 0.00 C ATOM 1324 CD LYS A 82 12.441 -1.096 17.604 1.00 0.00 C ATOM 1325 CE LYS A 82 13.021 -2.123 18.565 1.00 0.00 C ATOM 1326 NZ LYS A 82 14.142 -2.887 17.952 1.00 0.00 N ATOM 0 H LYS A 82 10.524 -1.635 13.660 1.00 0.00 H new ATOM 0 HA LYS A 82 11.032 -3.244 15.871 1.00 0.00 H new ATOM 0 HB2 LYS A 82 11.156 -0.649 15.468 1.00 0.00 H new ATOM 0 HB3 LYS A 82 9.496 -0.645 16.029 1.00 0.00 H new ATOM 0 HG2 LYS A 82 10.479 -0.355 18.063 1.00 0.00 H new ATOM 0 HG3 LYS A 82 10.591 -2.103 18.022 1.00 0.00 H new ATOM 0 HD2 LYS A 82 12.867 -1.245 16.612 1.00 0.00 H new ATOM 0 HD3 LYS A 82 12.726 -0.094 17.926 1.00 0.00 H new ATOM 0 HE2 LYS A 82 13.374 -1.619 19.465 1.00 0.00 H new ATOM 0 HE3 LYS A 82 12.237 -2.814 18.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 14.509 -3.576 18.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 13.799 -3.389 17.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 14.902 -2.231 17.680 1.00 0.00 H new ATOM 1340 N LYS A 83 8.948 -4.066 16.936 1.00 0.00 N ATOM 1341 CA LYS A 83 7.739 -4.686 17.463 1.00 0.00 C ATOM 1342 C LYS A 83 6.875 -3.662 18.192 1.00 0.00 C ATOM 1343 O LYS A 83 7.377 -2.856 18.976 1.00 0.00 O ATOM 1344 CB LYS A 83 8.100 -5.838 18.406 1.00 0.00 C ATOM 1345 CG LYS A 83 7.613 -7.193 17.923 1.00 0.00 C ATOM 1346 CD LYS A 83 8.193 -8.324 18.757 1.00 0.00 C ATOM 1347 CE LYS A 83 7.521 -9.652 18.445 1.00 0.00 C ATOM 1348 NZ LYS A 83 8.510 -10.752 18.286 1.00 0.00 N ATOM 0 H LYS A 83 9.812 -4.387 17.373 1.00 0.00 H new ATOM 0 HA LYS A 83 7.167 -5.081 16.624 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.183 -5.872 18.527 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.676 -5.638 19.390 1.00 0.00 H new ATOM 0 HG2 LYS A 83 6.525 -7.227 17.969 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.892 -7.330 16.878 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.263 -8.404 18.568 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.073 -8.095 19.816 1.00 0.00 H new ATOM 0 HE2 LYS A 83 6.825 -9.903 19.245 1.00 0.00 H new ATOM 0 HE3 LYS A 83 6.935 -9.556 17.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.011 -11.640 18.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 9.159 -10.525 17.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 9.052 -10.861 19.167 1.00 0.00 H new ATOM 1362 N GLY A 84 5.573 -3.700 17.928 1.00 0.00 N ATOM 1363 CA GLY A 84 4.658 -2.772 18.567 1.00 0.00 C ATOM 1364 C GLY A 84 4.461 -1.498 17.766 1.00 0.00 C ATOM 1365 O GLY A 84 3.909 -0.521 18.272 1.00 0.00 O ATOM 0 H GLY A 84 5.135 -4.357 17.283 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.694 -3.259 18.710 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.037 -2.519 19.557 1.00 0.00 H new ATOM 1369 N THR A 85 4.913 -1.505 16.515 1.00 0.00 N ATOM 1370 CA THR A 85 4.782 -0.337 15.651 1.00 0.00 C ATOM 1371 C THR A 85 3.412 -0.300 14.979 1.00 0.00 C ATOM 1372 O THR A 85 3.111 -1.118 14.110 1.00 0.00 O ATOM 1373 CB THR A 85 5.882 -0.340 14.590 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.162 -0.408 15.193 1.00 0.00 O ATOM 1375 CG2 THR A 85 5.859 0.883 13.701 1.00 0.00 C ATOM 0 H THR A 85 5.372 -2.304 16.078 1.00 0.00 H new ATOM 0 HA THR A 85 4.883 0.554 16.271 1.00 0.00 H new ATOM 0 HB THR A 85 5.688 -1.220 13.976 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.609 -1.236 14.919 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.665 0.817 12.971 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.902 0.937 13.181 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.993 1.778 14.309 1.00 0.00 H new ATOM 1383 N HIS A 86 2.585 0.657 15.389 1.00 0.00 N ATOM 1384 CA HIS A 86 1.245 0.809 14.830 1.00 0.00 C ATOM 1385 C HIS A 86 1.258 1.774 13.648 1.00 0.00 C ATOM 1386 O HIS A 86 1.502 2.968 13.816 1.00 0.00 O ATOM 1387 CB HIS A 86 0.279 1.316 15.902 1.00 0.00 C ATOM 1388 CG HIS A 86 -1.159 1.046 15.588 1.00 0.00 C ATOM 1389 ND1 HIS A 86 -2.017 2.009 15.101 1.00 0.00 N ATOM 1390 CD2 HIS A 86 -1.890 -0.088 15.696 1.00 0.00 C ATOM 1391 CE1 HIS A 86 -3.215 1.479 14.923 1.00 0.00 C ATOM 1392 NE2 HIS A 86 -3.164 0.208 15.277 1.00 0.00 N ATOM 0 H HIS A 86 2.820 1.341 16.108 1.00 0.00 H new ATOM 0 HA HIS A 86 0.910 -0.167 14.479 1.00 0.00 H new ATOM 0 HB2 HIS A 86 0.528 0.848 16.854 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.420 2.390 16.028 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.537 -1.047 16.046 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -4.087 1.997 14.551 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -3.944 -0.448 15.245 1.00 0.00 H new ATOM 1400 N PHE A 87 0.997 1.251 12.453 1.00 0.00 N ATOM 1401 CA PHE A 87 0.985 2.077 11.248 1.00 0.00 C ATOM 1402 C PHE A 87 -0.398 2.091 10.605 1.00 0.00 C ATOM 1403 O PHE A 87 -1.057 1.056 10.504 1.00 0.00 O ATOM 1404 CB PHE A 87 2.026 1.580 10.238 1.00 0.00 C ATOM 1405 CG PHE A 87 2.598 0.234 10.573 1.00 0.00 C ATOM 1406 CD1 PHE A 87 1.881 -0.921 10.310 1.00 0.00 C ATOM 1407 CD2 PHE A 87 3.849 0.127 11.157 1.00 0.00 C ATOM 1408 CE1 PHE A 87 2.403 -2.160 10.621 1.00 0.00 C ATOM 1409 CE2 PHE A 87 4.376 -1.110 11.471 1.00 0.00 C ATOM 1410 CZ PHE A 87 3.653 -2.255 11.202 1.00 0.00 C ATOM 0 H PHE A 87 0.792 0.265 12.293 1.00 0.00 H new ATOM 0 HA PHE A 87 1.239 3.095 11.543 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.568 1.534 9.250 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.838 2.305 10.180 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.903 -0.851 9.857 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.418 1.020 11.369 1.00 0.00 H new ATOM 0 HE1 PHE A 87 1.835 -3.054 10.411 1.00 0.00 H new ATOM 0 HE2 PHE A 87 5.353 -1.182 11.926 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.064 -3.224 11.445 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.833 3.272 10.174 1.00 0.00 N ATOM 1421 CA ASN A 88 -2.142 3.423 9.547 1.00 0.00 C ATOM 1422 C ASN A 88 -2.021 3.713 8.054 1.00 0.00 C ATOM 1423 O ASN A 88 -1.333 4.647 7.644 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.927 4.547 10.228 1.00 0.00 C ATOM 1425 CG ASN A 88 -3.188 4.267 11.695 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -2.258 4.062 12.476 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -4.460 4.256 12.078 1.00 0.00 N ATOM 0 H ASN A 88 -0.298 4.138 10.248 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.675 2.480 9.667 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -2.374 5.481 10.133 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.878 4.685 9.713 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.698 4.073 13.053 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -5.199 4.431 11.397 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.712 2.912 7.248 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.704 3.085 5.800 1.00 0.00 C ATOM 1436 C PHE A 89 -3.807 4.051 5.377 1.00 0.00 C ATOM 1437 O PHE A 89 -4.966 3.897 5.778 1.00 0.00 O ATOM 1438 CB PHE A 89 -2.894 1.742 5.095 1.00 0.00 C ATOM 1439 CG PHE A 89 -1.915 0.688 5.524 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -2.075 0.029 6.730 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -0.837 0.353 4.720 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -1.187 -0.943 7.130 1.00 0.00 C ATOM 1443 CE2 PHE A 89 0.061 -0.622 5.115 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.115 -1.271 6.323 1.00 0.00 C ATOM 0 H PHE A 89 -3.286 2.135 7.575 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.737 3.498 5.511 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.906 1.383 5.284 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.804 1.891 4.019 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.910 0.281 7.367 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.697 0.858 3.776 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.328 -1.449 8.074 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.898 -0.876 4.481 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.584 -2.033 6.635 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.439 5.044 4.572 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.392 6.040 4.096 1.00 0.00 C ATOM 1456 C ALA A 90 -4.096 6.441 2.657 1.00 0.00 C ATOM 1457 O ALA A 90 -3.112 5.999 2.066 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.374 7.270 4.997 1.00 0.00 C ATOM 0 H ALA A 90 -2.486 5.180 4.236 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.385 5.593 4.128 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.091 8.003 4.627 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.642 6.981 6.013 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.375 7.707 4.996 1.00 0.00 H new ATOM 1464 N ILE A 91 -4.953 7.293 2.108 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.792 7.773 0.743 1.00 0.00 C ATOM 1466 C ILE A 91 -4.787 9.297 0.713 1.00 0.00 C ATOM 1467 O ILE A 91 -5.782 9.935 1.062 1.00 0.00 O ATOM 1468 CB ILE A 91 -5.915 7.255 -0.174 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -6.052 5.737 -0.044 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.647 7.647 -1.621 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -7.428 5.221 -0.405 1.00 0.00 C ATOM 0 H ILE A 91 -5.770 7.667 2.591 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.839 7.393 0.376 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.854 7.714 0.136 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -5.313 5.257 -0.686 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -5.821 5.446 0.981 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.451 7.272 -2.254 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.598 8.733 -1.701 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.699 7.217 -1.945 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -7.452 4.137 -0.290 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -8.170 5.672 0.253 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -7.654 5.481 -1.439 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.658 9.871 0.303 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.518 11.323 0.235 1.00 0.00 C ATOM 1485 C VAL A 92 -3.032 11.762 -1.146 1.00 0.00 C ATOM 1486 O VAL A 92 -2.514 10.958 -1.916 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.555 11.871 1.330 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -2.189 10.801 2.347 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -1.291 12.464 0.718 1.00 0.00 C ATOM 0 H VAL A 92 -2.828 9.353 0.013 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.508 11.742 0.416 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.093 12.664 1.849 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.516 11.223 3.093 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.093 10.440 2.837 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.695 9.972 1.841 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.643 12.836 1.511 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.766 11.695 0.151 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.559 13.285 0.053 1.00 0.00 H new ATOM 1673 N VAL A 103 -8.383 13.357 2.078 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.526 12.249 2.473 1.00 0.00 C ATOM 1675 C VAL A 103 -8.167 11.453 3.606 1.00 0.00 C ATOM 1676 O VAL A 103 -8.815 12.023 4.484 1.00 0.00 O ATOM 1677 CB VAL A 103 -6.142 12.767 2.921 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -6.294 13.805 4.021 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.241 11.625 3.372 1.00 0.00 C ATOM 0 HA VAL A 103 -7.398 11.597 1.609 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.666 13.241 2.062 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.309 14.160 4.325 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.883 14.644 3.651 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -6.799 13.357 4.877 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.275 12.024 3.681 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.704 11.106 4.211 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.098 10.927 2.547 1.00 0.00 H new ATOM 1689 N LYS A 104 -7.992 10.134 3.580 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.570 9.279 4.613 1.00 0.00 C ATOM 1691 C LYS A 104 -7.791 7.975 4.767 1.00 0.00 C ATOM 1692 O LYS A 104 -6.990 7.609 3.907 1.00 0.00 O ATOM 1693 CB LYS A 104 -10.035 8.976 4.285 1.00 0.00 C ATOM 1694 CG LYS A 104 -11.020 9.653 5.226 1.00 0.00 C ATOM 1695 CD LYS A 104 -11.928 8.642 5.910 1.00 0.00 C ATOM 1696 CE LYS A 104 -13.139 8.313 5.053 1.00 0.00 C ATOM 1697 NZ LYS A 104 -14.162 9.394 5.097 1.00 0.00 N ATOM 0 H LYS A 104 -7.461 9.639 2.864 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.512 9.817 5.559 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.244 9.294 3.263 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.192 7.898 4.322 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -10.473 10.220 5.980 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -11.625 10.367 4.667 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -11.368 7.730 6.117 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -12.257 9.038 6.871 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -12.822 8.155 4.022 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -13.583 7.379 5.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -15.025 9.075 4.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -14.385 9.621 6.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -13.792 10.242 4.622 1.00 0.00 H new ATOM 1711 N GLU A 105 -8.043 7.280 5.873 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.381 6.012 6.160 1.00 0.00 C ATOM 1713 C GLU A 105 -8.353 4.849 5.969 1.00 0.00 C ATOM 1714 O GLU A 105 -9.547 4.977 6.239 1.00 0.00 O ATOM 1715 CB GLU A 105 -6.816 6.028 7.586 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.361 4.670 8.101 1.00 0.00 C ATOM 1717 CD GLU A 105 -7.107 4.236 9.348 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -7.061 4.975 10.354 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -7.738 3.158 9.317 1.00 0.00 O ATOM 0 H GLU A 105 -8.706 7.577 6.589 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.554 5.876 5.463 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.972 6.717 7.621 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.577 6.422 8.260 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.503 3.924 7.319 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.293 4.707 8.316 1.00 0.00 H new ATOM 1726 N ILE A 106 -7.838 3.719 5.491 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.670 2.542 5.255 1.00 0.00 C ATOM 1728 C ILE A 106 -8.389 1.431 6.263 1.00 0.00 C ATOM 1729 O ILE A 106 -9.229 0.555 6.470 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.487 1.986 3.825 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -7.011 1.988 3.421 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -9.314 2.791 2.834 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.180 0.950 4.145 1.00 0.00 C ATOM 0 H ILE A 106 -6.852 3.593 5.260 1.00 0.00 H new ATOM 0 HA ILE A 106 -9.701 2.875 5.377 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.838 0.954 3.813 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -6.937 1.815 2.347 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.592 2.975 3.614 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.175 2.387 1.831 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.368 2.731 3.106 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -8.993 3.832 2.854 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.146 1.012 3.807 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.222 1.134 5.218 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.573 -0.044 3.932 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.216 1.465 6.893 1.00 0.00 N ATOM 1746 CA GLY A 107 -6.880 0.444 7.867 1.00 0.00 C ATOM 1747 C GLY A 107 -5.443 0.546 8.335 1.00 0.00 C ATOM 1748 O GLY A 107 -4.591 1.038 7.601 1.00 0.00 O ATOM 0 H GLY A 107 -6.499 2.176 6.747 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.546 0.531 8.725 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.049 -0.541 7.431 1.00 0.00 H new ATOM 1752 N SER A 108 -5.180 0.095 9.560 1.00 0.00 N ATOM 1753 CA SER A 108 -3.839 0.152 10.133 1.00 0.00 C ATOM 1754 C SER A 108 -3.374 -1.227 10.601 1.00 0.00 C ATOM 1755 O SER A 108 -4.147 -1.987 11.185 1.00 0.00 O ATOM 1756 CB SER A 108 -3.824 1.123 11.314 1.00 0.00 C ATOM 1757 OG SER A 108 -4.718 0.701 12.330 1.00 0.00 O ATOM 0 H SER A 108 -5.882 -0.315 10.176 1.00 0.00 H new ATOM 0 HA SER A 108 -3.155 0.498 9.358 1.00 0.00 H new ATOM 0 HB2 SER A 108 -2.814 1.193 11.719 1.00 0.00 H new ATOM 0 HB3 SER A 108 -4.100 2.121 10.973 1.00 0.00 H new ATOM 0 HG SER A 108 -5.060 1.484 12.811 1.00 0.00 H new ATOM 1763 N THR A 109 -2.109 -1.544 10.336 1.00 0.00 N ATOM 1764 CA THR A 109 -1.539 -2.830 10.732 1.00 0.00 C ATOM 1765 C THR A 109 -0.497 -2.647 11.831 1.00 0.00 C ATOM 1766 O THR A 109 -0.368 -1.565 12.404 1.00 0.00 O ATOM 1767 CB THR A 109 -0.910 -3.534 9.529 1.00 0.00 C ATOM 1768 OG1 THR A 109 0.150 -2.764 8.990 1.00 0.00 O ATOM 1769 CG2 THR A 109 -1.895 -3.804 8.415 1.00 0.00 C ATOM 0 H THR A 109 -1.459 -0.928 9.848 1.00 0.00 H new ATOM 0 HA THR A 109 -2.348 -3.450 11.119 1.00 0.00 H new ATOM 0 HB THR A 109 -0.546 -4.488 9.911 1.00 0.00 H new ATOM 0 HG1 THR A 109 -0.076 -2.490 8.077 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.385 -4.305 7.592 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.698 -4.441 8.786 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.313 -2.861 8.063 1.00 0.00 H new ATOM 1777 N MET A 110 0.243 -3.711 12.122 1.00 0.00 N ATOM 1778 CA MET A 110 1.272 -3.666 13.154 1.00 0.00 C ATOM 1779 C MET A 110 2.482 -4.503 12.755 1.00 0.00 C ATOM 1780 O MET A 110 2.421 -5.292 11.813 1.00 0.00 O ATOM 1781 CB MET A 110 0.709 -4.169 14.481 1.00 0.00 C ATOM 1782 CG MET A 110 -0.332 -3.245 15.092 1.00 0.00 C ATOM 1783 SD MET A 110 -0.182 -3.124 16.884 1.00 0.00 S ATOM 1784 CE MET A 110 1.542 -2.671 17.044 1.00 0.00 C ATOM 0 H MET A 110 0.150 -4.615 11.658 1.00 0.00 H new ATOM 0 HA MET A 110 1.592 -2.630 13.268 1.00 0.00 H new ATOM 0 HB2 MET A 110 0.264 -5.152 14.328 1.00 0.00 H new ATOM 0 HB3 MET A 110 1.528 -4.297 15.188 1.00 0.00 H new ATOM 0 HG2 MET A 110 -0.233 -2.252 14.655 1.00 0.00 H new ATOM 0 HG3 MET A 110 -1.328 -3.607 14.838 1.00 0.00 H new ATOM 0 HE1 MET A 110 1.663 -1.992 17.888 1.00 0.00 H new ATOM 0 HE2 MET A 110 2.140 -3.567 17.211 1.00 0.00 H new ATOM 0 HE3 MET A 110 1.875 -2.178 16.131 1.00 0.00 H new ATOM 1794 N SER A 111 3.582 -4.321 13.479 1.00 0.00 N ATOM 1795 CA SER A 111 4.812 -5.055 13.200 1.00 0.00 C ATOM 1796 C SER A 111 4.749 -6.472 13.762 1.00 0.00 C ATOM 1797 O SER A 111 5.424 -6.793 14.740 1.00 0.00 O ATOM 1798 CB SER A 111 6.015 -4.313 13.788 1.00 0.00 C ATOM 1799 OG SER A 111 7.204 -4.630 13.084 1.00 0.00 O ATOM 0 H SER A 111 3.647 -3.672 14.263 1.00 0.00 H new ATOM 0 HA SER A 111 4.925 -5.123 12.118 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.839 -3.238 13.746 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.130 -4.576 14.839 1.00 0.00 H new ATOM 0 HG SER A 111 7.551 -3.824 12.649 1.00 0.00 H new ATOM 1805 N GLY A 112 3.939 -7.318 13.135 1.00 0.00 N ATOM 1806 CA GLY A 112 3.812 -8.692 13.585 1.00 0.00 C ATOM 1807 C GLY A 112 2.502 -8.968 14.299 1.00 0.00 C ATOM 1808 O GLY A 112 2.328 -10.034 14.890 1.00 0.00 O ATOM 0 H GLY A 112 3.369 -7.077 12.324 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.898 -9.358 12.727 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.640 -8.926 14.254 1.00 0.00 H new ATOM 1812 N ARG A 113 1.574 -8.016 14.247 1.00 0.00 N ATOM 1813 CA ARG A 113 0.279 -8.184 14.897 1.00 0.00 C ATOM 1814 C ARG A 113 -0.842 -8.239 13.864 1.00 0.00 C ATOM 1815 O ARG A 113 -0.959 -7.358 13.012 1.00 0.00 O ATOM 1816 CB ARG A 113 0.021 -7.052 15.892 1.00 0.00 C ATOM 1817 CG ARG A 113 -0.532 -7.533 17.224 1.00 0.00 C ATOM 1818 CD ARG A 113 -0.233 -6.550 18.343 1.00 0.00 C ATOM 1819 NE ARG A 113 1.035 -6.845 19.006 1.00 0.00 N ATOM 1820 CZ ARG A 113 1.215 -7.868 19.840 1.00 0.00 C ATOM 1821 NH1 ARG A 113 0.213 -8.695 20.113 1.00 0.00 N ATOM 1822 NH2 ARG A 113 2.400 -8.063 20.401 1.00 0.00 N ATOM 0 H ARG A 113 1.694 -7.126 13.764 1.00 0.00 H new ATOM 0 HA ARG A 113 0.297 -9.128 15.441 1.00 0.00 H new ATOM 0 HB2 ARG A 113 0.952 -6.513 16.067 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.680 -6.343 15.451 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -1.610 -7.674 17.141 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -0.101 -8.504 17.468 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -0.204 -5.538 17.939 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -1.040 -6.578 19.075 1.00 0.00 H new ATOM 0 HE ARG A 113 1.829 -6.232 18.819 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -0.700 -8.549 19.683 1.00 0.00 H new ATOM 0 HH12 ARG A 113 0.357 -9.477 20.752 1.00 0.00 H new ATOM 0 HH21 ARG A 113 3.173 -7.430 20.194 1.00 0.00 H new ATOM 0 HH22 ARG A 113 2.539 -8.846 21.040 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.660 -9.283 13.943 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.769 -9.458 13.013 1.00 0.00 C ATOM 1838 C LYS A 114 -4.003 -8.693 13.476 1.00 0.00 C ATOM 1839 O LYS A 114 -4.781 -9.187 14.293 1.00 0.00 O ATOM 1840 CB LYS A 114 -3.104 -10.942 12.862 1.00 0.00 C ATOM 1841 CG LYS A 114 -3.905 -11.261 11.609 1.00 0.00 C ATOM 1842 CD LYS A 114 -5.025 -12.248 11.898 1.00 0.00 C ATOM 1843 CE LYS A 114 -6.225 -11.559 12.528 1.00 0.00 C ATOM 1844 NZ LYS A 114 -7.153 -12.532 13.165 1.00 0.00 N ATOM 0 H LYS A 114 -1.576 -10.021 14.642 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.462 -9.058 12.047 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.177 -11.515 12.846 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.667 -11.270 13.736 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.325 -10.342 11.201 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.243 -11.674 10.848 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.329 -12.736 10.972 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.660 -13.029 12.565 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.882 -10.843 13.275 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.760 -10.993 11.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -7.958 -12.022 13.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -7.501 -13.200 12.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.650 -13.055 13.910 1.00 0.00 H new ATOM 1858 N GLY A 115 -4.179 -7.486 12.948 1.00 0.00 N ATOM 1859 CA GLY A 115 -5.321 -6.676 13.319 1.00 0.00 C ATOM 1860 C GLY A 115 -6.571 -7.079 12.571 1.00 0.00 C ATOM 1861 O GLY A 115 -6.653 -8.184 12.030 1.00 0.00 O ATOM 0 H GLY A 115 -3.550 -7.056 12.270 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -5.496 -6.766 14.391 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -5.101 -5.627 13.119 1.00 0.00 H new ATOM 1865 N THR A 116 -7.568 -6.179 12.515 1.00 0.00 N ATOM 1866 CA THR A 116 -8.803 -6.461 11.818 1.00 0.00 C ATOM 1867 C THR A 116 -8.686 -6.109 10.340 1.00 0.00 C ATOM 1868 O THR A 116 -9.294 -6.756 9.487 1.00 0.00 O ATOM 1869 CB THR A 116 -9.949 -5.667 12.452 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.880 -5.717 13.865 1.00 0.00 O ATOM 1871 CG2 THR A 116 -11.321 -6.167 12.044 1.00 0.00 C ATOM 0 H THR A 116 -7.528 -5.256 12.948 1.00 0.00 H new ATOM 0 HA THR A 116 -9.009 -7.528 11.901 1.00 0.00 H new ATOM 0 HB THR A 116 -9.824 -4.647 12.088 1.00 0.00 H new ATOM 0 HG1 THR A 116 -10.621 -5.202 14.247 1.00 0.00 H new ATOM 0 HG21 THR A 116 -12.088 -5.562 12.528 1.00 0.00 H new ATOM 0 HG22 THR A 116 -11.429 -6.092 10.962 1.00 0.00 H new ATOM 0 HG23 THR A 116 -11.434 -7.207 12.349 1.00 0.00 H new ATOM 1879 N ASP A 117 -7.908 -5.072 10.042 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.711 -4.631 8.666 1.00 0.00 C ATOM 1881 C ASP A 117 -6.660 -5.486 7.959 1.00 0.00 C ATOM 1882 O ASP A 117 -6.649 -5.578 6.732 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.290 -3.161 8.637 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.293 -2.259 9.325 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -9.339 -1.958 8.714 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -8.032 -1.852 10.478 1.00 0.00 O ATOM 0 H ASP A 117 -7.403 -4.521 10.737 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.658 -4.745 8.138 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.319 -3.055 9.120 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.168 -2.841 7.602 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.778 -6.105 8.739 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.718 -6.949 8.189 1.00 0.00 C ATOM 1893 C ASP A 118 -5.257 -7.917 7.137 1.00 0.00 C ATOM 1894 O ASP A 118 -4.696 -8.038 6.048 1.00 0.00 O ATOM 1895 CB ASP A 118 -4.034 -7.731 9.311 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.564 -7.981 9.031 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -1.889 -7.053 8.536 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -2.089 -9.102 9.306 1.00 0.00 O ATOM 0 H ASP A 118 -5.775 -6.038 9.757 1.00 0.00 H new ATOM 0 HA ASP A 118 -3.993 -6.296 7.704 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.134 -7.181 10.247 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.542 -8.686 9.447 1.00 0.00 H new ATOM 1903 N SER A 119 -6.344 -8.606 7.470 1.00 0.00 N ATOM 1904 CA SER A 119 -6.952 -9.567 6.553 1.00 0.00 C ATOM 1905 C SER A 119 -7.645 -8.869 5.384 1.00 0.00 C ATOM 1906 O SER A 119 -8.045 -9.515 4.415 1.00 0.00 O ATOM 1907 CB SER A 119 -7.954 -10.450 7.300 1.00 0.00 C ATOM 1908 OG SER A 119 -7.770 -11.817 6.976 1.00 0.00 O ATOM 0 H SER A 119 -6.822 -8.518 8.367 1.00 0.00 H new ATOM 0 HA SER A 119 -6.153 -10.188 6.148 1.00 0.00 H new ATOM 0 HB2 SER A 119 -7.837 -10.309 8.375 1.00 0.00 H new ATOM 0 HB3 SER A 119 -8.970 -10.147 7.047 1.00 0.00 H new ATOM 0 HG SER A 119 -8.421 -12.360 7.467 1.00 0.00 H new ATOM 1914 N MET A 120 -7.769 -7.549 5.466 1.00 0.00 N ATOM 1915 CA MET A 120 -8.404 -6.776 4.406 1.00 0.00 C ATOM 1916 C MET A 120 -7.471 -6.651 3.210 1.00 0.00 C ATOM 1917 O MET A 120 -6.248 -6.668 3.356 1.00 0.00 O ATOM 1918 CB MET A 120 -8.797 -5.389 4.922 1.00 0.00 C ATOM 1919 CG MET A 120 -10.208 -4.972 4.536 1.00 0.00 C ATOM 1920 SD MET A 120 -10.864 -3.678 5.607 1.00 0.00 S ATOM 1921 CE MET A 120 -9.528 -2.486 5.550 1.00 0.00 C ATOM 0 H MET A 120 -7.439 -6.993 6.255 1.00 0.00 H new ATOM 0 HA MET A 120 -9.307 -7.298 4.089 1.00 0.00 H new ATOM 0 HB2 MET A 120 -8.708 -5.376 6.008 1.00 0.00 H new ATOM 0 HB3 MET A 120 -8.091 -4.654 4.536 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.210 -4.621 3.504 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.864 -5.841 4.578 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.071 -2.404 6.536 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.779 -2.813 4.829 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.920 -1.514 5.250 1.00 0.00 H new ATOM 1931 N THR A 121 -8.053 -6.514 2.028 1.00 0.00 N ATOM 1932 CA THR A 121 -7.270 -6.379 0.803 1.00 0.00 C ATOM 1933 C THR A 121 -7.245 -4.930 0.328 1.00 0.00 C ATOM 1934 O THR A 121 -8.191 -4.180 0.551 1.00 0.00 O ATOM 1935 CB THR A 121 -7.832 -7.284 -0.297 1.00 0.00 C ATOM 1936 OG1 THR A 121 -9.246 -7.301 -0.260 1.00 0.00 O ATOM 1937 CG2 THR A 121 -7.350 -8.717 -0.193 1.00 0.00 C ATOM 0 H THR A 121 -9.063 -6.493 1.888 1.00 0.00 H new ATOM 0 HA THR A 121 -6.248 -6.686 1.023 1.00 0.00 H new ATOM 0 HB THR A 121 -7.470 -6.861 -1.234 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.585 -7.883 -0.972 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.784 -9.306 -1.001 1.00 0.00 H new ATOM 0 HG22 THR A 121 -6.263 -8.742 -0.269 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.656 -9.135 0.766 1.00 0.00 H new ATOM 1945 N LEU A 122 -6.153 -4.542 -0.323 1.00 0.00 N ATOM 1946 CA LEU A 122 -6.009 -3.179 -0.818 1.00 0.00 C ATOM 1947 C LEU A 122 -7.118 -2.829 -1.809 1.00 0.00 C ATOM 1948 O LEU A 122 -7.703 -1.749 -1.742 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.645 -3.000 -1.483 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.520 -2.564 -0.545 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -2.166 -2.779 -1.203 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -3.695 -1.106 -0.145 1.00 0.00 C ATOM 0 H LEU A 122 -5.358 -5.150 -0.519 1.00 0.00 H new ATOM 0 HA LEU A 122 -6.087 -2.504 0.034 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.361 -3.941 -1.953 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.740 -2.262 -2.279 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.565 -3.175 0.356 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.376 -2.463 -0.521 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -2.040 -3.835 -1.440 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.110 -2.192 -2.120 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.885 -0.812 0.523 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.675 -0.479 -1.037 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.650 -0.981 0.365 1.00 0.00 H new ATOM 1964 N GLN A 123 -7.391 -3.744 -2.735 1.00 0.00 N ATOM 1965 CA GLN A 123 -8.419 -3.532 -3.755 1.00 0.00 C ATOM 1966 C GLN A 123 -9.706 -2.955 -3.164 1.00 0.00 C ATOM 1967 O GLN A 123 -10.310 -2.051 -3.743 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.725 -4.845 -4.480 1.00 0.00 C ATOM 1969 CG GLN A 123 -9.168 -5.968 -3.555 1.00 0.00 C ATOM 1970 CD GLN A 123 -9.625 -7.199 -4.313 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -10.358 -7.100 -5.297 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -9.195 -8.369 -3.856 1.00 0.00 N ATOM 0 H GLN A 123 -6.914 -4.643 -2.802 1.00 0.00 H new ATOM 0 HA GLN A 123 -8.024 -2.805 -4.464 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -9.505 -4.667 -5.220 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -7.836 -5.164 -5.024 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -8.343 -6.237 -2.895 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -9.981 -5.613 -2.921 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.588 -8.405 -3.037 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -9.471 -9.232 -4.324 1.00 0.00 H new ATOM 1981 N SER A 124 -10.129 -3.480 -2.017 1.00 0.00 N ATOM 1982 CA SER A 124 -11.351 -3.007 -1.372 1.00 0.00 C ATOM 1983 C SER A 124 -11.199 -1.572 -0.873 1.00 0.00 C ATOM 1984 O SER A 124 -12.191 -0.876 -0.655 1.00 0.00 O ATOM 1985 CB SER A 124 -11.736 -3.927 -0.210 1.00 0.00 C ATOM 1986 OG SER A 124 -10.607 -4.262 0.577 1.00 0.00 O ATOM 0 H SER A 124 -9.648 -4.228 -1.518 1.00 0.00 H new ATOM 0 HA SER A 124 -12.145 -3.025 -2.119 1.00 0.00 H new ATOM 0 HB2 SER A 124 -12.484 -3.436 0.413 1.00 0.00 H new ATOM 0 HB3 SER A 124 -12.193 -4.837 -0.600 1.00 0.00 H new ATOM 0 HG SER A 124 -9.881 -3.631 0.392 1.00 0.00 H new ATOM 1992 N GLN A 125 -9.957 -1.130 -0.701 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.689 0.228 -0.236 1.00 0.00 C ATOM 1994 C GLN A 125 -9.539 1.192 -1.412 1.00 0.00 C ATOM 1995 O GLN A 125 -9.077 2.321 -1.244 1.00 0.00 O ATOM 1996 CB GLN A 125 -8.423 0.251 0.625 1.00 0.00 C ATOM 1997 CG GLN A 125 -8.349 -0.886 1.632 1.00 0.00 C ATOM 1998 CD GLN A 125 -9.651 -1.092 2.383 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -10.389 -0.141 2.642 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -9.940 -2.339 2.734 1.00 0.00 N ATOM 0 H GLN A 125 -9.122 -1.690 -0.876 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.538 0.553 0.366 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.550 0.205 -0.026 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -8.374 1.201 1.158 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.084 -1.808 1.114 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -7.551 -0.681 2.346 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -9.299 -3.097 2.498 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -10.803 -2.540 3.239 1.00 0.00 H new ATOM 2009 N LYS A 126 -9.931 0.738 -2.602 1.00 0.00 N ATOM 2010 CA LYS A 126 -9.840 1.553 -3.808 1.00 0.00 C ATOM 2011 C LYS A 126 -8.387 1.839 -4.171 1.00 0.00 C ATOM 2012 O LYS A 126 -8.082 2.852 -4.800 1.00 0.00 O ATOM 2013 CB LYS A 126 -10.606 2.868 -3.630 1.00 0.00 C ATOM 2014 CG LYS A 126 -12.099 2.678 -3.409 1.00 0.00 C ATOM 2015 CD LYS A 126 -12.620 3.587 -2.308 1.00 0.00 C ATOM 2016 CE LYS A 126 -12.697 2.860 -0.976 1.00 0.00 C ATOM 2017 NZ LYS A 126 -13.845 1.912 -0.926 1.00 0.00 N ATOM 0 H LYS A 126 -10.316 -0.194 -2.754 1.00 0.00 H new ATOM 0 HA LYS A 126 -10.292 0.989 -4.624 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -10.188 3.410 -2.782 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -10.454 3.490 -4.512 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -12.634 2.884 -4.336 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -12.300 1.639 -3.149 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -11.968 4.455 -2.213 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -13.608 3.959 -2.579 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -11.769 2.315 -0.806 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -12.792 3.588 -0.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -14.456 2.150 -0.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -14.392 1.983 -1.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -13.489 0.941 -0.816 1.00 0.00 H new ATOM 2031 N PHE A 127 -7.494 0.936 -3.777 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.074 1.084 -4.066 1.00 0.00 C ATOM 2033 C PHE A 127 -5.752 0.519 -5.447 1.00 0.00 C ATOM 2034 O PHE A 127 -5.951 -0.669 -5.703 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.247 0.371 -2.988 1.00 0.00 C ATOM 2036 CG PHE A 127 -3.818 0.112 -3.380 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -2.839 1.062 -3.144 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.458 -1.082 -3.982 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -1.525 0.825 -3.503 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -2.147 -1.326 -4.341 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.180 -0.371 -4.102 1.00 0.00 C ATOM 0 H PHE A 127 -7.731 0.092 -3.255 1.00 0.00 H new ATOM 0 HA PHE A 127 -5.819 2.144 -4.062 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -5.260 0.972 -2.079 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.724 -0.579 -2.748 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -3.104 1.998 -2.675 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -4.212 -1.832 -4.173 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -0.770 1.574 -3.315 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.879 -2.262 -4.808 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.154 -0.558 -4.383 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.255 1.376 -6.334 1.00 0.00 N ATOM 2052 CA GLN A 128 -4.909 0.957 -7.688 1.00 0.00 C ATOM 2053 C GLN A 128 -3.487 1.377 -8.045 1.00 0.00 C ATOM 2054 O GLN A 128 -2.795 2.004 -7.244 1.00 0.00 O ATOM 2055 CB GLN A 128 -5.898 1.545 -8.697 1.00 0.00 C ATOM 2056 CG GLN A 128 -6.099 3.045 -8.553 1.00 0.00 C ATOM 2057 CD GLN A 128 -7.564 3.433 -8.495 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -8.303 3.258 -9.463 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -7.990 3.966 -7.356 1.00 0.00 N ATOM 0 H GLN A 128 -5.083 2.363 -6.140 1.00 0.00 H new ATOM 0 HA GLN A 128 -4.965 -0.131 -7.728 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -5.545 1.330 -9.706 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -6.860 1.046 -8.582 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -5.599 3.390 -7.648 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -5.625 3.554 -9.392 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -7.342 4.093 -6.579 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -8.965 4.249 -7.258 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.056 1.030 -9.256 1.00 0.00 N ATOM 2069 CA ILE A 129 -1.715 1.377 -9.714 1.00 0.00 C ATOM 2070 C ILE A 129 -1.560 2.888 -9.841 1.00 0.00 C ATOM 2071 O ILE A 129 -2.389 3.557 -10.457 1.00 0.00 O ATOM 2072 CB ILE A 129 -1.390 0.724 -11.072 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -1.722 -0.770 -11.037 1.00 0.00 C ATOM 2074 CG2 ILE A 129 0.075 0.943 -11.424 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.272 -1.524 -12.271 1.00 0.00 C ATOM 0 H ILE A 129 -3.614 0.511 -9.934 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.018 0.998 -8.967 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.002 1.192 -11.843 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -1.255 -1.216 -10.159 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -2.799 -0.891 -10.921 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.292 0.477 -12.385 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.279 2.012 -11.485 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.705 0.497 -10.654 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -1.542 -2.576 -12.173 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -1.759 -1.105 -13.151 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.191 -1.435 -12.378 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.498 3.421 -9.249 1.00 0.00 N ATOM 2088 CA GLY A 130 -0.260 4.850 -9.304 1.00 0.00 C ATOM 2089 C GLY A 130 -0.854 5.583 -8.117 1.00 0.00 C ATOM 2090 O GLY A 130 -0.494 6.728 -7.843 1.00 0.00 O ATOM 0 H GLY A 130 0.202 2.889 -8.732 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.813 5.035 -9.341 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.685 5.251 -10.224 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.766 4.923 -7.408 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.409 5.522 -6.243 1.00 0.00 C ATOM 2096 C ASP A 131 -1.376 5.913 -5.182 1.00 0.00 C ATOM 2097 O ASP A 131 -0.329 5.280 -5.066 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.429 4.551 -5.642 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.676 5.257 -5.144 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -5.545 5.585 -5.979 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -4.784 5.478 -3.919 1.00 0.00 O ATOM 0 H ASP A 131 -2.076 3.975 -7.620 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.923 6.425 -6.571 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.709 3.812 -6.392 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -2.968 4.009 -4.817 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.683 6.968 -4.448 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.783 7.467 -3.407 1.00 0.00 C ATOM 2108 C TYR A 132 -1.246 7.026 -2.025 1.00 0.00 C ATOM 2109 O TYR A 132 -2.227 7.547 -1.494 1.00 0.00 O ATOM 2110 CB TYR A 132 -0.679 8.987 -3.468 1.00 0.00 C ATOM 2111 CG TYR A 132 -0.697 9.551 -4.874 1.00 0.00 C ATOM 2112 CD1 TYR A 132 0.297 9.226 -5.789 1.00 0.00 C ATOM 2113 CD2 TYR A 132 -1.710 10.410 -5.282 1.00 0.00 C ATOM 2114 CE1 TYR A 132 0.282 9.742 -7.071 1.00 0.00 C ATOM 2115 CE2 TYR A 132 -1.731 10.930 -6.563 1.00 0.00 C ATOM 2116 CZ TYR A 132 -0.734 10.592 -7.453 1.00 0.00 C ATOM 2117 OH TYR A 132 -0.752 11.107 -8.728 1.00 0.00 O ATOM 0 H TYR A 132 -2.547 7.500 -4.549 1.00 0.00 H new ATOM 0 HA TYR A 132 0.204 7.042 -3.588 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.505 9.420 -2.903 1.00 0.00 H new ATOM 0 HB3 TYR A 132 0.242 9.298 -2.975 1.00 0.00 H new ATOM 0 HD1 TYR A 132 1.094 8.560 -5.494 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -2.493 10.676 -4.588 1.00 0.00 H new ATOM 0 HE1 TYR A 132 1.062 9.481 -7.770 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -2.524 11.598 -6.865 1.00 0.00 H new ATOM 0 HH TYR A 132 -1.535 11.687 -8.836 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.528 6.070 -1.445 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.858 5.566 -0.115 1.00 0.00 C ATOM 2129 C LEU A 133 0.073 6.176 0.929 1.00 0.00 C ATOM 2130 O LEU A 133 1.291 6.142 0.767 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.725 4.040 -0.076 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.950 3.238 -0.526 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.815 1.795 -0.073 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -3.239 3.841 0.016 1.00 0.00 C ATOM 0 H LEU A 133 0.285 5.628 -1.874 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.887 5.846 0.110 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.120 3.755 -0.703 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.479 3.744 0.944 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.998 3.273 -1.614 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.689 1.229 -0.396 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.918 1.358 -0.512 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.741 1.760 1.014 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -4.089 3.248 -0.322 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.209 3.844 1.106 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.343 4.864 -0.347 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.493 6.732 2.002 1.00 0.00 N ATOM 2147 CA ASP A 134 0.315 7.335 3.049 1.00 0.00 C ATOM 2148 C ASP A 134 0.219 6.531 4.339 1.00 0.00 C ATOM 2149 O ASP A 134 -0.780 6.606 5.056 1.00 0.00 O ATOM 2150 CB ASP A 134 -0.132 8.773 3.297 1.00 0.00 C ATOM 2151 CG ASP A 134 0.746 9.484 4.305 1.00 0.00 C ATOM 2152 OD1 ASP A 134 0.537 9.284 5.520 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.643 10.242 3.880 1.00 0.00 O ATOM 0 H ASP A 134 -1.499 6.774 2.163 1.00 0.00 H new ATOM 0 HA ASP A 134 1.354 7.336 2.720 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.118 9.322 2.356 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -1.163 8.774 3.652 1.00 0.00 H new ATOM 2158 N ILE A 135 1.263 5.764 4.629 1.00 0.00 N ATOM 2159 CA ILE A 135 1.302 4.947 5.837 1.00 0.00 C ATOM 2160 C ILE A 135 1.878 5.732 7.015 1.00 0.00 C ATOM 2161 O ILE A 135 3.033 6.152 6.989 1.00 0.00 O ATOM 2162 CB ILE A 135 2.147 3.671 5.620 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.486 2.768 4.574 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.340 2.920 6.933 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.304 2.609 3.311 1.00 0.00 C ATOM 0 H ILE A 135 2.095 5.690 4.044 1.00 0.00 H new ATOM 0 HA ILE A 135 0.274 4.663 6.063 1.00 0.00 H new ATOM 0 HB ILE A 135 3.130 3.967 5.252 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.313 1.785 5.012 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.510 3.178 4.316 1.00 0.00 H new ATOM 0 HG21 ILE A 135 2.937 2.026 6.756 1.00 0.00 H new ATOM 0 HG22 ILE A 135 2.853 3.563 7.648 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.368 2.633 7.335 1.00 0.00 H new ATOM 0 HD11 ILE A 135 1.776 1.957 2.615 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.455 3.585 2.850 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.271 2.170 3.557 1.00 0.00 H new ATOM 2177 N ALA A 136 1.067 5.916 8.049 1.00 0.00 N ATOM 2178 CA ALA A 136 1.499 6.636 9.240 1.00 0.00 C ATOM 2179 C ALA A 136 2.050 5.652 10.267 1.00 0.00 C ATOM 2180 O ALA A 136 1.287 4.994 10.970 1.00 0.00 O ATOM 2181 CB ALA A 136 0.343 7.436 9.819 1.00 0.00 C ATOM 0 H ALA A 136 0.106 5.576 8.087 1.00 0.00 H new ATOM 0 HA ALA A 136 2.291 7.334 8.970 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.679 7.969 10.708 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -0.011 8.153 9.078 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.469 6.760 10.086 1.00 0.00 H new ATOM 2187 N ILE A 137 3.375 5.580 10.369 1.00 0.00 N ATOM 2188 CA ILE A 137 4.019 4.683 11.321 1.00 0.00 C ATOM 2189 C ILE A 137 4.127 5.327 12.703 1.00 0.00 C ATOM 2190 O ILE A 137 4.663 6.425 12.852 1.00 0.00 O ATOM 2191 CB ILE A 137 5.423 4.267 10.841 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.354 3.725 9.412 1.00 0.00 C ATOM 2193 CG2 ILE A 137 6.025 3.232 11.777 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.711 3.557 8.763 1.00 0.00 C ATOM 0 H ILE A 137 4.021 6.131 9.805 1.00 0.00 H new ATOM 0 HA ILE A 137 3.393 3.794 11.391 1.00 0.00 H new ATOM 0 HB ILE A 137 6.067 5.147 10.849 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.843 2.762 9.421 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.751 4.400 8.805 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.016 2.952 11.420 1.00 0.00 H new ATOM 0 HG22 ILE A 137 6.105 3.651 12.780 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.386 2.349 11.803 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.585 3.169 7.752 1.00 0.00 H new ATOM 0 HD12 ILE A 137 7.216 4.522 8.721 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.310 2.859 9.348 1.00 0.00 H new ATOM 2206 N THR A 138 3.608 4.631 13.712 1.00 0.00 N ATOM 2207 CA THR A 138 3.635 5.124 15.085 1.00 0.00 C ATOM 2208 C THR A 138 4.475 4.213 15.980 1.00 0.00 C ATOM 2209 O THR A 138 4.088 3.077 16.253 1.00 0.00 O ATOM 2210 CB THR A 138 2.212 5.218 15.638 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.277 5.409 14.592 1.00 0.00 O ATOM 2212 CG2 THR A 138 2.029 6.345 16.631 1.00 0.00 C ATOM 0 H THR A 138 3.162 3.720 13.603 1.00 0.00 H new ATOM 0 HA THR A 138 4.089 6.115 15.078 1.00 0.00 H new ATOM 0 HB THR A 138 2.040 4.272 16.151 1.00 0.00 H new ATOM 0 HG1 THR A 138 0.997 4.538 14.241 1.00 0.00 H new ATOM 0 HG21 THR A 138 0.998 6.355 16.984 1.00 0.00 H new ATOM 0 HG22 THR A 138 2.700 6.197 17.477 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.257 7.296 16.149 1.00 0.00 H new ATOM 2220 N PRO A 139 5.636 4.697 16.456 1.00 0.00 N ATOM 2221 CA PRO A 139 6.517 3.912 17.327 1.00 0.00 C ATOM 2222 C PRO A 139 5.948 3.767 18.737 1.00 0.00 C ATOM 2223 O PRO A 139 5.280 4.671 19.239 1.00 0.00 O ATOM 2224 CB PRO A 139 7.805 4.734 17.352 1.00 0.00 C ATOM 2225 CG PRO A 139 7.352 6.134 17.134 1.00 0.00 C ATOM 2226 CD PRO A 139 6.181 6.044 16.193 1.00 0.00 C ATOM 0 HA PRO A 139 6.653 2.892 16.967 1.00 0.00 H new ATOM 0 HB2 PRO A 139 8.326 4.628 18.304 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.496 4.414 16.573 1.00 0.00 H new ATOM 0 HG2 PRO A 139 7.063 6.602 18.075 1.00 0.00 H new ATOM 0 HG3 PRO A 139 8.150 6.742 16.708 1.00 0.00 H new ATOM 0 HD2 PRO A 139 5.444 6.822 16.392 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.490 6.157 15.154 1.00 0.00 H new ATOM 2234 N PRO A 140 6.200 2.623 19.397 1.00 0.00 N ATOM 2235 CA PRO A 140 5.702 2.370 20.751 1.00 0.00 C ATOM 2236 C PRO A 140 6.515 3.090 21.821 1.00 0.00 C ATOM 2237 O PRO A 140 7.370 2.495 22.476 1.00 0.00 O ATOM 2238 CB PRO A 140 5.844 0.856 20.893 1.00 0.00 C ATOM 2239 CG PRO A 140 7.004 0.508 20.025 1.00 0.00 C ATOM 2240 CD PRO A 140 6.982 1.484 18.876 1.00 0.00 C ATOM 0 HA PRO A 140 4.684 2.735 20.888 1.00 0.00 H new ATOM 0 HB2 PRO A 140 6.023 0.569 21.929 1.00 0.00 H new ATOM 0 HB3 PRO A 140 4.939 0.340 20.572 1.00 0.00 H new ATOM 0 HG2 PRO A 140 7.940 0.581 20.579 1.00 0.00 H new ATOM 0 HG3 PRO A 140 6.926 -0.518 19.665 1.00 0.00 H new ATOM 0 HD2 PRO A 140 7.989 1.788 18.590 1.00 0.00 H new ATOM 0 HD3 PRO A 140 6.516 1.050 17.991 1.00 0.00 H new