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 -106:sc= -2.01 (180deg=-0.281) USER MOD Set 1.2: A 125 GLN : amide:sc= -3.63 K(o=-5.6,f=-7.4!) USER MOD Set 2.1: A 70 THR OG1 : rot -65:sc= 1.08 USER MOD Set 2.2: A 109 THR OG1 : rot 37:sc= 0.794 USER MOD Set 3.1: A 86 HIS : no HD1:sc= -0.348 X(o=-0.35,f=0.069) USER MOD Set 3.2: A 108 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 36 ASN : amide:sc= -0.967 K(o=-0.91,f=-2.4!) USER MOD Set 4.2: A 77 TYR OH : rot -31:sc= 0.0581 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 90:sc= -2.87! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 111:sc= -2.18! USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.092 USER MOD Single : A 37 ASN : amide:sc= -0.0897 K(o=-0.09,f=0.96) USER MOD Single : A 57 GLN : amide:sc=-0.00534 X(o=-0.0053,f=-0.011) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 17:sc= -3.42 USER MOD Single : A 62 MET CE :methyl -162:sc= -10.1! (180deg=-11.2!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.111 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+ 152:sc= 0.859! (180deg=-0.61!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ -110:sc= -0.322 (180deg=-0.597) USER MOD Single : A 85 THR OG1 : rot 93:sc= 0.816 USER MOD Single : A 88 ASN : amide:sc= -2.81 K(o=-2.8,f=-8.8!) USER MOD Single : A 104 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0408) USER MOD Single : A 110 MET CE :methyl -136:sc= -5.84! (180deg=-6.97!) USER MOD Single : A 111 SER OG : rot -129:sc= -0.18 USER MOD Single : A 114 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.181) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.0216 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -1.09 X(o=-1.1,f=-0.9) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 GLN : amide:sc= -0.0424 K(o=-0.042,f=-0.55) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 88:sc= -0.0384 USER MOD ----------------------------------------------------------------- ATOM 318 N ASP A 21 -4.773 -13.081 -8.455 1.00 0.00 N ATOM 319 CA ASP A 21 -4.683 -14.188 -7.510 1.00 0.00 C ATOM 320 C ASP A 21 -3.765 -13.838 -6.343 1.00 0.00 C ATOM 321 O ASP A 21 -2.577 -13.580 -6.532 1.00 0.00 O ATOM 322 CB ASP A 21 -4.177 -15.449 -8.213 1.00 0.00 C ATOM 323 CG ASP A 21 -5.281 -16.184 -8.946 1.00 0.00 C ATOM 324 OD1 ASP A 21 -5.550 -15.838 -10.116 1.00 0.00 O ATOM 325 OD2 ASP A 21 -5.877 -17.107 -8.352 1.00 0.00 O ATOM 0 HA ASP A 21 -5.682 -14.376 -7.117 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.393 -15.178 -8.920 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.726 -16.116 -7.478 1.00 0.00 H new ATOM 330 N ARG A 22 -4.325 -13.834 -5.137 1.00 0.00 N ATOM 331 CA ARG A 22 -3.568 -13.513 -3.928 1.00 0.00 C ATOM 332 C ARG A 22 -2.219 -14.234 -3.897 1.00 0.00 C ATOM 333 O ARG A 22 -1.264 -13.754 -3.285 1.00 0.00 O ATOM 334 CB ARG A 22 -4.382 -13.883 -2.686 1.00 0.00 C ATOM 335 CG ARG A 22 -4.789 -12.684 -1.845 1.00 0.00 C ATOM 336 CD ARG A 22 -6.221 -12.260 -2.127 1.00 0.00 C ATOM 337 NE ARG A 22 -7.035 -12.236 -0.914 1.00 0.00 N ATOM 338 CZ ARG A 22 -8.329 -11.921 -0.895 1.00 0.00 C ATOM 339 NH1 ARG A 22 -8.958 -11.603 -2.019 1.00 0.00 N ATOM 340 NH2 ARG A 22 -8.995 -11.923 0.251 1.00 0.00 N ATOM 0 H ARG A 22 -5.307 -14.051 -4.969 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.375 -12.440 -3.934 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -5.279 -14.420 -2.996 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.798 -14.567 -2.070 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.683 -12.928 -0.788 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.116 -11.851 -2.049 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -6.223 -11.270 -2.584 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -6.666 -12.945 -2.849 1.00 0.00 H new ATOM 0 HE ARG A 22 -6.586 -12.474 -0.030 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -8.451 -11.599 -2.904 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -9.949 -11.363 -1.998 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.517 -12.166 1.118 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.986 -11.682 0.265 1.00 0.00 H new ATOM 354 N GLU A 23 -2.148 -15.391 -4.547 1.00 0.00 N ATOM 355 CA GLU A 23 -0.917 -16.177 -4.576 1.00 0.00 C ATOM 356 C GLU A 23 -0.168 -16.002 -5.896 1.00 0.00 C ATOM 357 O GLU A 23 1.043 -15.775 -5.906 1.00 0.00 O ATOM 358 CB GLU A 23 -1.232 -17.658 -4.350 1.00 0.00 C ATOM 359 CG GLU A 23 -0.796 -18.170 -2.987 1.00 0.00 C ATOM 360 CD GLU A 23 -1.798 -19.129 -2.375 1.00 0.00 C ATOM 361 OE1 GLU A 23 -2.904 -18.678 -2.010 1.00 0.00 O ATOM 362 OE2 GLU A 23 -1.476 -20.329 -2.261 1.00 0.00 O ATOM 0 H GLU A 23 -2.926 -15.806 -5.060 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.274 -15.814 -3.774 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -2.305 -17.814 -4.462 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.742 -18.248 -5.125 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.168 -18.670 -3.082 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.651 -17.324 -2.315 1.00 0.00 H new ATOM 369 N LYS A 24 -0.888 -16.118 -7.009 1.00 0.00 N ATOM 370 CA LYS A 24 -0.281 -15.982 -8.331 1.00 0.00 C ATOM 371 C LYS A 24 -0.379 -14.549 -8.847 1.00 0.00 C ATOM 372 O LYS A 24 -0.437 -14.319 -10.056 1.00 0.00 O ATOM 373 CB LYS A 24 -0.949 -16.939 -9.320 1.00 0.00 C ATOM 374 CG LYS A 24 -0.283 -18.304 -9.390 1.00 0.00 C ATOM 375 CD LYS A 24 -1.296 -19.428 -9.243 1.00 0.00 C ATOM 376 CE LYS A 24 -0.877 -20.662 -10.028 1.00 0.00 C ATOM 377 NZ LYS A 24 -0.062 -21.596 -9.204 1.00 0.00 N ATOM 0 H LYS A 24 -1.891 -16.305 -7.022 1.00 0.00 H new ATOM 0 HA LYS A 24 0.775 -16.236 -8.239 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.994 -17.068 -9.039 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -0.939 -16.488 -10.312 1.00 0.00 H new ATOM 0 HG2 LYS A 24 0.240 -18.406 -10.341 1.00 0.00 H new ATOM 0 HG3 LYS A 24 0.467 -18.384 -8.604 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -1.405 -19.685 -8.189 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -2.271 -19.088 -9.591 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.765 -21.179 -10.391 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.305 -20.357 -10.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 0.203 -22.423 -9.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 0.798 -21.111 -8.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -0.617 -21.907 -8.381 1.00 0.00 H new ATOM 391 N THR A 25 -0.397 -13.589 -7.930 1.00 0.00 N ATOM 392 CA THR A 25 -0.488 -12.181 -8.300 1.00 0.00 C ATOM 393 C THR A 25 0.848 -11.649 -8.811 1.00 0.00 C ATOM 394 O THR A 25 1.900 -12.238 -8.564 1.00 0.00 O ATOM 395 CB THR A 25 -0.937 -11.341 -7.105 1.00 0.00 C ATOM 396 OG1 THR A 25 -0.815 -9.961 -7.398 1.00 0.00 O ATOM 397 CG2 THR A 25 -0.141 -11.612 -5.844 1.00 0.00 C ATOM 0 H THR A 25 -0.350 -13.759 -6.925 1.00 0.00 H new ATOM 0 HA THR A 25 -1.224 -12.104 -9.101 1.00 0.00 H new ATOM 0 HB THR A 25 -1.974 -11.623 -6.925 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.650 -9.636 -7.796 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.513 -10.982 -5.036 1.00 0.00 H new ATOM 0 HG22 THR A 25 -0.247 -12.660 -5.565 1.00 0.00 H new ATOM 0 HG23 THR A 25 0.911 -11.389 -6.023 1.00 0.00 H new ATOM 405 N SER A 26 0.793 -10.521 -9.512 1.00 0.00 N ATOM 406 CA SER A 26 1.992 -9.889 -10.047 1.00 0.00 C ATOM 407 C SER A 26 2.335 -8.637 -9.240 1.00 0.00 C ATOM 408 O SER A 26 1.453 -7.846 -8.908 1.00 0.00 O ATOM 409 CB SER A 26 1.791 -9.524 -11.520 1.00 0.00 C ATOM 410 OG SER A 26 2.054 -10.633 -12.361 1.00 0.00 O ATOM 0 H SER A 26 -0.073 -10.025 -9.723 1.00 0.00 H new ATOM 0 HA SER A 26 2.819 -10.596 -9.971 1.00 0.00 H new ATOM 0 HB2 SER A 26 0.769 -9.180 -11.676 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.450 -8.698 -11.786 1.00 0.00 H new ATOM 0 HG SER A 26 1.917 -10.374 -13.296 1.00 0.00 H new ATOM 416 N PRO A 27 3.623 -8.440 -8.903 1.00 0.00 N ATOM 417 CA PRO A 27 4.061 -7.279 -8.124 1.00 0.00 C ATOM 418 C PRO A 27 4.084 -5.993 -8.946 1.00 0.00 C ATOM 419 O PRO A 27 4.554 -5.979 -10.085 1.00 0.00 O ATOM 420 CB PRO A 27 5.475 -7.665 -7.692 1.00 0.00 C ATOM 421 CG PRO A 27 5.958 -8.580 -8.763 1.00 0.00 C ATOM 422 CD PRO A 27 4.746 -9.334 -9.246 1.00 0.00 C ATOM 0 HA PRO A 27 3.386 -7.066 -7.295 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.115 -6.788 -7.602 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.472 -8.159 -6.720 1.00 0.00 H new ATOM 0 HG2 PRO A 27 6.418 -8.019 -9.577 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.715 -9.264 -8.379 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.793 -9.525 -10.318 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.653 -10.302 -8.753 1.00 0.00 H new ATOM 430 N LEU A 28 3.580 -4.914 -8.356 1.00 0.00 N ATOM 431 CA LEU A 28 3.546 -3.617 -9.023 1.00 0.00 C ATOM 432 C LEU A 28 4.222 -2.552 -8.164 1.00 0.00 C ATOM 433 O LEU A 28 4.180 -2.615 -6.934 1.00 0.00 O ATOM 434 CB LEU A 28 2.101 -3.210 -9.327 1.00 0.00 C ATOM 435 CG LEU A 28 1.256 -2.848 -8.101 1.00 0.00 C ATOM 436 CD1 LEU A 28 1.010 -1.349 -8.043 1.00 0.00 C ATOM 437 CD2 LEU A 28 -0.064 -3.605 -8.121 1.00 0.00 C ATOM 0 H LEU A 28 3.188 -4.912 -7.414 1.00 0.00 H new ATOM 0 HA LEU A 28 4.092 -3.702 -9.963 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.115 -2.356 -10.004 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.613 -4.028 -9.856 1.00 0.00 H new ATOM 0 HG LEU A 28 1.807 -3.139 -7.207 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.408 -1.113 -7.165 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.964 -0.826 -7.980 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.481 -1.032 -8.942 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.651 -3.336 -7.243 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.619 -3.345 -9.022 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.131 -4.677 -8.112 1.00 0.00 H new ATOM 449 N LEU A 29 4.851 -1.582 -8.818 1.00 0.00 N ATOM 450 CA LEU A 29 5.546 -0.507 -8.116 1.00 0.00 C ATOM 451 C LEU A 29 4.603 0.650 -7.795 1.00 0.00 C ATOM 452 O LEU A 29 4.014 1.253 -8.692 1.00 0.00 O ATOM 453 CB LEU A 29 6.723 -0.008 -8.957 1.00 0.00 C ATOM 454 CG LEU A 29 7.367 1.298 -8.477 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.670 1.230 -6.989 1.00 0.00 C ATOM 456 CD2 LEU A 29 8.636 1.585 -9.267 1.00 0.00 C ATOM 0 H LEU A 29 4.894 -1.517 -9.835 1.00 0.00 H new ATOM 0 HA LEU A 29 5.919 -0.907 -7.173 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.488 -0.784 -8.978 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.382 0.131 -9.983 1.00 0.00 H new ATOM 0 HG LEU A 29 6.662 2.112 -8.646 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.127 2.166 -6.668 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.744 1.069 -6.436 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.357 0.406 -6.795 1.00 0.00 H new ATOM 0 HD21 LEU A 29 9.081 2.515 -8.915 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.344 0.768 -9.128 1.00 0.00 H new ATOM 0 HD23 LEU A 29 8.393 1.677 -10.325 1.00 0.00 H new ATOM 468 N LEU A 30 4.467 0.954 -6.509 1.00 0.00 N ATOM 469 CA LEU A 30 3.602 2.043 -6.064 1.00 0.00 C ATOM 470 C LEU A 30 4.344 2.959 -5.087 1.00 0.00 C ATOM 471 O LEU A 30 5.385 2.584 -4.543 1.00 0.00 O ATOM 472 CB LEU A 30 2.325 1.488 -5.423 1.00 0.00 C ATOM 473 CG LEU A 30 2.434 1.137 -3.939 1.00 0.00 C ATOM 474 CD1 LEU A 30 2.214 2.376 -3.087 1.00 0.00 C ATOM 475 CD2 LEU A 30 1.436 0.048 -3.570 1.00 0.00 C ATOM 0 H LEU A 30 4.945 0.461 -5.755 1.00 0.00 H new ATOM 0 HA LEU A 30 3.319 2.634 -6.935 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.528 2.221 -5.548 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.024 0.594 -5.969 1.00 0.00 H new ATOM 0 HG LEU A 30 3.437 0.758 -3.746 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.294 2.112 -2.033 1.00 0.00 H new ATOM 0 HD12 LEU A 30 2.968 3.124 -3.332 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.222 2.782 -3.285 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.530 -0.187 -2.510 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.424 0.397 -3.776 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.639 -0.846 -4.159 1.00 0.00 H new ATOM 487 N ARG A 31 3.807 4.161 -4.880 1.00 0.00 N ATOM 488 CA ARG A 31 4.424 5.135 -3.981 1.00 0.00 C ATOM 489 C ARG A 31 3.779 5.116 -2.595 1.00 0.00 C ATOM 490 O ARG A 31 2.553 5.053 -2.464 1.00 0.00 O ATOM 491 CB ARG A 31 4.324 6.540 -4.579 1.00 0.00 C ATOM 492 CG ARG A 31 5.207 6.746 -5.801 1.00 0.00 C ATOM 493 CD ARG A 31 6.478 7.503 -5.448 1.00 0.00 C ATOM 494 NE ARG A 31 7.243 7.870 -6.637 1.00 0.00 N ATOM 495 CZ ARG A 31 8.070 7.041 -7.274 1.00 0.00 C ATOM 496 NH1 ARG A 31 8.239 5.798 -6.841 1.00 0.00 N ATOM 497 NH2 ARG A 31 8.729 7.459 -8.347 1.00 0.00 N ATOM 0 H ARG A 31 2.946 4.483 -5.323 1.00 0.00 H new ATOM 0 HA ARG A 31 5.472 4.859 -3.867 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.287 6.736 -4.853 1.00 0.00 H new ATOM 0 HB3 ARG A 31 4.596 7.270 -3.817 1.00 0.00 H new ATOM 0 HG2 ARG A 31 5.466 5.779 -6.232 1.00 0.00 H new ATOM 0 HG3 ARG A 31 4.654 7.296 -6.562 1.00 0.00 H new ATOM 0 HD2 ARG A 31 6.221 8.403 -4.890 1.00 0.00 H new ATOM 0 HD3 ARG A 31 7.097 6.888 -4.794 1.00 0.00 H new ATOM 0 HE ARG A 31 7.138 8.817 -7.002 1.00 0.00 H new ATOM 0 HH11 ARG A 31 7.735 5.472 -6.016 1.00 0.00 H new ATOM 0 HH12 ARG A 31 8.873 5.168 -7.333 1.00 0.00 H new ATOM 0 HH21 ARG A 31 8.602 8.414 -8.683 1.00 0.00 H new ATOM 0 HH22 ARG A 31 9.362 6.826 -8.835 1.00 0.00 H new ATOM 511 N VAL A 32 4.621 5.177 -1.565 1.00 0.00 N ATOM 512 CA VAL A 32 4.155 5.169 -0.181 1.00 0.00 C ATOM 513 C VAL A 32 4.917 6.185 0.663 1.00 0.00 C ATOM 514 O VAL A 32 6.143 6.249 0.611 1.00 0.00 O ATOM 515 CB VAL A 32 4.323 3.784 0.472 1.00 0.00 C ATOM 516 CG1 VAL A 32 3.140 2.891 0.149 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.628 3.137 0.031 1.00 0.00 C ATOM 0 H VAL A 32 5.635 5.233 -1.665 1.00 0.00 H new ATOM 0 HA VAL A 32 3.097 5.428 -0.215 1.00 0.00 H new ATOM 0 HB VAL A 32 4.360 3.918 1.553 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.279 1.918 0.620 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.225 3.349 0.525 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.064 2.764 -0.931 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.727 2.160 0.503 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.627 3.018 -1.052 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.465 3.769 0.326 1.00 0.00 H new ATOM 527 N PHE A 33 4.188 6.961 1.457 1.00 0.00 N ATOM 528 CA PHE A 33 4.803 7.956 2.327 1.00 0.00 C ATOM 529 C PHE A 33 4.668 7.524 3.780 1.00 0.00 C ATOM 530 O PHE A 33 3.589 7.608 4.365 1.00 0.00 O ATOM 531 CB PHE A 33 4.157 9.324 2.117 1.00 0.00 C ATOM 532 CG PHE A 33 4.016 9.700 0.669 1.00 0.00 C ATOM 533 CD1 PHE A 33 3.120 9.031 -0.147 1.00 0.00 C ATOM 534 CD2 PHE A 33 4.781 10.719 0.126 1.00 0.00 C ATOM 535 CE1 PHE A 33 2.988 9.371 -1.480 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.654 11.064 -1.206 1.00 0.00 C ATOM 537 CZ PHE A 33 3.757 10.389 -2.011 1.00 0.00 C ATOM 0 H PHE A 33 3.171 6.920 1.516 1.00 0.00 H new ATOM 0 HA PHE A 33 5.861 8.036 2.077 1.00 0.00 H new ATOM 0 HB2 PHE A 33 3.172 9.328 2.584 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.754 10.081 2.625 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.517 8.234 0.263 1.00 0.00 H new ATOM 0 HD2 PHE A 33 5.484 11.250 0.750 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.285 8.842 -2.106 1.00 0.00 H new ATOM 0 HE2 PHE A 33 5.256 11.861 -1.617 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.657 10.656 -3.053 1.00 0.00 H new ATOM 547 N THR A 34 5.764 7.037 4.349 1.00 0.00 N ATOM 548 CA THR A 34 5.759 6.564 5.727 1.00 0.00 C ATOM 549 C THR A 34 6.485 7.519 6.664 1.00 0.00 C ATOM 550 O THR A 34 7.671 7.799 6.489 1.00 0.00 O ATOM 551 CB THR A 34 6.407 5.181 5.805 1.00 0.00 C ATOM 552 OG1 THR A 34 7.655 5.176 5.138 1.00 0.00 O ATOM 553 CG2 THR A 34 5.560 4.084 5.200 1.00 0.00 C ATOM 0 H THR A 34 6.666 6.959 3.878 1.00 0.00 H new ATOM 0 HA THR A 34 4.719 6.509 6.048 1.00 0.00 H new ATOM 0 HB THR A 34 6.525 4.979 6.870 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.377 5.084 5.795 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.081 3.131 5.290 1.00 0.00 H new ATOM 0 HG22 THR A 34 4.607 4.028 5.726 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.381 4.301 4.147 1.00 0.00 H new ATOM 561 N THR A 35 5.771 7.987 7.682 1.00 0.00 N ATOM 562 CA THR A 35 6.357 8.880 8.677 1.00 0.00 C ATOM 563 C THR A 35 6.729 8.062 9.915 1.00 0.00 C ATOM 564 O THR A 35 6.306 6.917 10.048 1.00 0.00 O ATOM 565 CB THR A 35 5.398 10.028 9.047 1.00 0.00 C ATOM 566 OG1 THR A 35 5.538 10.387 10.415 1.00 0.00 O ATOM 567 CG2 THR A 35 3.933 9.720 8.792 1.00 0.00 C ATOM 0 H THR A 35 4.788 7.764 7.840 1.00 0.00 H new ATOM 0 HA THR A 35 7.251 9.340 8.256 1.00 0.00 H new ATOM 0 HB THR A 35 5.686 10.850 8.392 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.921 11.118 10.626 1.00 0.00 H new ATOM 0 HG21 THR A 35 3.325 10.578 9.079 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.785 9.508 7.733 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.636 8.852 9.381 1.00 0.00 H new ATOM 575 N ASN A 36 7.532 8.635 10.812 1.00 0.00 N ATOM 576 CA ASN A 36 7.950 7.914 12.011 1.00 0.00 C ATOM 577 C ASN A 36 7.218 8.414 13.251 1.00 0.00 C ATOM 578 O ASN A 36 7.709 8.267 14.372 1.00 0.00 O ATOM 579 CB ASN A 36 9.461 8.044 12.206 1.00 0.00 C ATOM 580 CG ASN A 36 10.060 6.829 12.891 1.00 0.00 C ATOM 581 OD1 ASN A 36 10.490 5.883 12.233 1.00 0.00 O ATOM 582 ND2 ASN A 36 10.089 6.852 14.218 1.00 0.00 N ATOM 0 H ASN A 36 7.901 9.583 10.732 1.00 0.00 H new ATOM 0 HA ASN A 36 7.693 6.864 11.872 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.939 8.185 11.237 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.673 8.934 12.798 1.00 0.00 H new ATOM 0 HD21 ASN A 36 10.480 6.063 14.733 1.00 0.00 H new ATOM 0 HD22 ASN A 36 9.721 7.659 14.722 1.00 0.00 H new ATOM 589 N ASN A 37 6.045 8.997 13.052 1.00 0.00 N ATOM 590 CA ASN A 37 5.246 9.508 14.161 1.00 0.00 C ATOM 591 C ASN A 37 3.772 9.138 13.997 1.00 0.00 C ATOM 592 O ASN A 37 2.917 9.602 14.752 1.00 0.00 O ATOM 593 CB ASN A 37 5.393 11.025 14.261 1.00 0.00 C ATOM 594 CG ASN A 37 5.292 11.523 15.689 1.00 0.00 C ATOM 595 OD1 ASN A 37 4.399 11.123 16.436 1.00 0.00 O ATOM 596 ND2 ASN A 37 6.210 12.401 16.077 1.00 0.00 N ATOM 0 H ASN A 37 5.623 9.129 12.133 1.00 0.00 H new ATOM 0 HA ASN A 37 5.613 9.049 15.079 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.355 11.322 13.843 1.00 0.00 H new ATOM 0 HB3 ASN A 37 4.621 11.503 13.657 1.00 0.00 H new ATOM 0 HD21 ASN A 37 6.192 12.771 17.027 1.00 0.00 H new ATOM 0 HD22 ASN A 37 6.933 12.705 15.425 1.00 0.00 H new ATOM 603 N GLY A 38 3.477 8.305 13.002 1.00 0.00 N ATOM 604 CA GLY A 38 2.105 7.897 12.755 1.00 0.00 C ATOM 605 C GLY A 38 1.177 9.082 12.606 1.00 0.00 C ATOM 606 O GLY A 38 0.169 9.185 13.305 1.00 0.00 O ATOM 0 H GLY A 38 4.164 7.905 12.363 1.00 0.00 H new ATOM 0 HA2 GLY A 38 2.065 7.290 11.851 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.761 7.268 13.576 1.00 0.00 H new ATOM 610 N ARG A 39 1.524 9.987 11.698 1.00 0.00 N ATOM 611 CA ARG A 39 0.724 11.180 11.468 1.00 0.00 C ATOM 612 C ARG A 39 0.210 11.241 10.032 1.00 0.00 C ATOM 613 O ARG A 39 0.971 11.483 9.094 1.00 0.00 O ATOM 614 CB ARG A 39 1.545 12.430 11.783 1.00 0.00 C ATOM 615 CG ARG A 39 0.936 13.302 12.868 1.00 0.00 C ATOM 616 CD ARG A 39 1.467 12.931 14.245 1.00 0.00 C ATOM 617 NE ARG A 39 0.406 12.891 15.247 1.00 0.00 N ATOM 618 CZ ARG A 39 0.626 12.860 16.560 1.00 0.00 C ATOM 619 NH1 ARG A 39 1.868 12.866 17.031 1.00 0.00 N ATOM 620 NH2 ARG A 39 -0.396 12.826 17.402 1.00 0.00 N ATOM 0 H ARG A 39 2.354 9.916 11.110 1.00 0.00 H new ATOM 0 HA ARG A 39 -0.140 11.137 12.132 1.00 0.00 H new ATOM 0 HB2 ARG A 39 2.546 12.129 12.091 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.655 13.021 10.873 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.157 14.349 12.662 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -0.149 13.197 12.855 1.00 0.00 H new ATOM 0 HD2 ARG A 39 1.956 11.958 14.195 1.00 0.00 H new ATOM 0 HD3 ARG A 39 2.225 13.653 14.548 1.00 0.00 H new ATOM 0 HE ARG A 39 -0.561 12.887 14.922 1.00 0.00 H new ATOM 0 HH11 ARG A 39 2.658 12.894 16.386 1.00 0.00 H new ATOM 0 HH12 ARG A 39 2.032 12.842 18.037 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -1.351 12.824 17.045 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -0.228 12.802 18.408 1.00 0.00 H new ATOM 864 N GLU A 55 8.893 9.356 0.774 1.00 0.00 N ATOM 865 CA GLU A 55 8.243 8.362 -0.073 1.00 0.00 C ATOM 866 C GLU A 55 9.181 7.207 -0.413 1.00 0.00 C ATOM 867 O GLU A 55 10.366 7.408 -0.681 1.00 0.00 O ATOM 868 CB GLU A 55 7.734 9.011 -1.362 1.00 0.00 C ATOM 869 CG GLU A 55 8.833 9.630 -2.209 1.00 0.00 C ATOM 870 CD GLU A 55 8.290 10.460 -3.355 1.00 0.00 C ATOM 871 OE1 GLU A 55 7.931 11.633 -3.121 1.00 0.00 O ATOM 872 OE2 GLU A 55 8.221 9.937 -4.487 1.00 0.00 O ATOM 0 HA GLU A 55 7.400 7.958 0.488 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.210 8.260 -1.954 1.00 0.00 H new ATOM 0 HB3 GLU A 55 7.006 9.781 -1.108 1.00 0.00 H new ATOM 0 HG2 GLU A 55 9.463 10.257 -1.578 1.00 0.00 H new ATOM 0 HG3 GLU A 55 9.468 8.839 -2.608 1.00 0.00 H new ATOM 879 N LEU A 56 8.629 5.997 -0.410 1.00 0.00 N ATOM 880 CA LEU A 56 9.392 4.793 -0.726 1.00 0.00 C ATOM 881 C LEU A 56 8.675 3.963 -1.788 1.00 0.00 C ATOM 882 O LEU A 56 7.500 4.187 -2.077 1.00 0.00 O ATOM 883 CB LEU A 56 9.626 3.940 0.530 1.00 0.00 C ATOM 884 CG LEU A 56 8.726 4.256 1.736 1.00 0.00 C ATOM 885 CD1 LEU A 56 7.936 3.023 2.155 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.557 4.783 2.899 1.00 0.00 C ATOM 0 H LEU A 56 7.648 5.824 -0.190 1.00 0.00 H new ATOM 0 HA LEU A 56 10.360 5.109 -1.116 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.489 2.892 0.264 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.665 4.058 0.837 1.00 0.00 H new ATOM 0 HG LEU A 56 8.018 5.030 1.442 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.306 3.268 3.010 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.311 2.692 1.326 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.626 2.225 2.430 1.00 0.00 H new ATOM 0 HD21 LEU A 56 8.904 5.001 3.744 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.290 4.032 3.192 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.073 5.694 2.594 1.00 0.00 H new ATOM 898 N GLN A 57 9.389 3.001 -2.366 1.00 0.00 N ATOM 899 CA GLN A 57 8.816 2.143 -3.396 1.00 0.00 C ATOM 900 C GLN A 57 8.565 0.735 -2.862 1.00 0.00 C ATOM 901 O GLN A 57 9.424 0.147 -2.203 1.00 0.00 O ATOM 902 CB GLN A 57 9.751 2.079 -4.602 1.00 0.00 C ATOM 903 CG GLN A 57 9.788 3.367 -5.411 1.00 0.00 C ATOM 904 CD GLN A 57 10.852 4.332 -4.921 1.00 0.00 C ATOM 905 OE1 GLN A 57 12.047 4.066 -5.035 1.00 0.00 O ATOM 906 NE2 GLN A 57 10.418 5.461 -4.371 1.00 0.00 N ATOM 0 H GLN A 57 10.362 2.797 -2.139 1.00 0.00 H new ATOM 0 HA GLN A 57 7.860 2.570 -3.699 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.759 1.846 -4.258 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.439 1.261 -5.251 1.00 0.00 H new ATOM 0 HG2 GLN A 57 9.973 3.129 -6.458 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.813 3.851 -5.362 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.417 5.640 -4.297 1.00 0.00 H new ATOM 0 HE22 GLN A 57 11.086 6.148 -4.023 1.00 0.00 H new ATOM 915 N ILE A 58 7.384 0.199 -3.154 1.00 0.00 N ATOM 916 CA ILE A 58 7.023 -1.147 -2.710 1.00 0.00 C ATOM 917 C ILE A 58 6.400 -1.949 -3.841 1.00 0.00 C ATOM 918 O ILE A 58 5.448 -1.504 -4.480 1.00 0.00 O ATOM 919 CB ILE A 58 6.027 -1.130 -1.529 1.00 0.00 C ATOM 920 CG1 ILE A 58 5.170 0.136 -1.540 1.00 0.00 C ATOM 921 CG2 ILE A 58 6.769 -1.266 -0.215 1.00 0.00 C ATOM 922 CD1 ILE A 58 3.721 -0.122 -1.188 1.00 0.00 C ATOM 0 H ILE A 58 6.661 0.673 -3.695 1.00 0.00 H new ATOM 0 HA ILE A 58 7.953 -1.612 -2.384 1.00 0.00 H new ATOM 0 HB ILE A 58 5.355 -1.981 -1.641 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.586 0.855 -0.834 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.221 0.593 -2.528 1.00 0.00 H new ATOM 0 HG21 ILE A 58 6.055 -1.253 0.609 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.319 -2.207 -0.203 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.467 -0.436 -0.104 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.168 0.817 -1.214 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.290 -0.817 -1.908 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.660 -0.551 -0.188 1.00 0.00 H new ATOM 934 N TYR A 59 6.927 -3.146 -4.068 1.00 0.00 N ATOM 935 CA TYR A 59 6.396 -4.015 -5.104 1.00 0.00 C ATOM 936 C TYR A 59 5.311 -4.903 -4.513 1.00 0.00 C ATOM 937 O TYR A 59 5.553 -6.062 -4.176 1.00 0.00 O ATOM 938 CB TYR A 59 7.511 -4.871 -5.711 1.00 0.00 C ATOM 939 CG TYR A 59 8.133 -4.264 -6.948 1.00 0.00 C ATOM 940 CD1 TYR A 59 8.655 -2.976 -6.927 1.00 0.00 C ATOM 941 CD2 TYR A 59 8.196 -4.976 -8.139 1.00 0.00 C ATOM 942 CE1 TYR A 59 9.221 -2.417 -8.057 1.00 0.00 C ATOM 943 CE2 TYR A 59 8.760 -4.424 -9.273 1.00 0.00 C ATOM 944 CZ TYR A 59 9.272 -3.144 -9.226 1.00 0.00 C ATOM 945 OH TYR A 59 9.835 -2.591 -10.353 1.00 0.00 O ATOM 0 H TYR A 59 7.717 -3.533 -3.551 1.00 0.00 H new ATOM 0 HA TYR A 59 5.968 -3.402 -5.897 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.288 -5.026 -4.962 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.109 -5.853 -5.961 1.00 0.00 H new ATOM 0 HD1 TYR A 59 8.618 -2.403 -6.013 1.00 0.00 H new ATOM 0 HD2 TYR A 59 7.797 -5.979 -8.179 1.00 0.00 H new ATOM 0 HE1 TYR A 59 9.622 -1.415 -8.024 1.00 0.00 H new ATOM 0 HE2 TYR A 59 8.800 -4.991 -10.191 1.00 0.00 H new ATOM 0 HH TYR A 59 9.792 -3.235 -11.090 1.00 0.00 H new ATOM 955 N THR A 60 4.112 -4.343 -4.379 1.00 0.00 N ATOM 956 CA THR A 60 2.983 -5.072 -3.817 1.00 0.00 C ATOM 957 C THR A 60 1.946 -5.371 -4.895 1.00 0.00 C ATOM 958 O THR A 60 2.120 -4.997 -6.053 1.00 0.00 O ATOM 959 CB THR A 60 2.355 -4.267 -2.673 1.00 0.00 C ATOM 960 OG1 THR A 60 1.567 -5.106 -1.845 1.00 0.00 O ATOM 961 CG2 THR A 60 1.479 -3.122 -3.146 1.00 0.00 C ATOM 0 H THR A 60 3.899 -3.384 -4.653 1.00 0.00 H new ATOM 0 HA THR A 60 3.343 -6.021 -3.420 1.00 0.00 H new ATOM 0 HB THR A 60 3.196 -3.846 -2.122 1.00 0.00 H new ATOM 0 HG1 THR A 60 1.802 -6.043 -2.011 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.069 -2.597 -2.283 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.075 -2.430 -3.742 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.663 -3.515 -3.753 1.00 0.00 H new ATOM 969 N TRP A 61 0.868 -6.044 -4.515 1.00 0.00 N ATOM 970 CA TRP A 61 -0.184 -6.377 -5.475 1.00 0.00 C ATOM 971 C TRP A 61 -1.560 -5.920 -5.001 1.00 0.00 C ATOM 972 O TRP A 61 -2.024 -6.308 -3.933 1.00 0.00 O ATOM 973 CB TRP A 61 -0.205 -7.876 -5.772 1.00 0.00 C ATOM 974 CG TRP A 61 -0.255 -8.742 -4.553 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.328 -9.446 -4.094 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.821 -9.010 -3.646 1.00 0.00 C ATOM 977 NE1 TRP A 61 -0.989 -10.138 -2.957 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.326 -9.885 -2.660 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.154 -8.595 -3.571 1.00 0.00 C ATOM 980 CZ2 TRP A 61 1.118 -10.352 -1.612 1.00 0.00 C ATOM 981 CZ3 TRP A 61 2.937 -9.059 -2.531 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.419 -9.930 -1.566 1.00 0.00 C ATOM 0 H TRP A 61 0.697 -6.368 -3.563 1.00 0.00 H new ATOM 0 HA TRP A 61 0.050 -5.838 -6.393 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -1.069 -8.099 -6.398 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.682 -8.133 -6.350 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.304 -9.458 -4.557 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.613 -10.741 -2.421 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.564 -7.925 -4.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.720 -11.022 -0.864 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 3.968 -8.744 -2.462 1.00 0.00 H new ATOM 0 HH2 TRP A 61 3.059 -10.276 -0.768 1.00 0.00 H new ATOM 993 N MET A 62 -2.187 -5.076 -5.815 1.00 0.00 N ATOM 994 CA MET A 62 -3.515 -4.518 -5.526 1.00 0.00 C ATOM 995 C MET A 62 -4.397 -5.484 -4.725 1.00 0.00 C ATOM 996 O MET A 62 -5.160 -5.060 -3.857 1.00 0.00 O ATOM 997 CB MET A 62 -4.221 -4.143 -6.832 1.00 0.00 C ATOM 998 CG MET A 62 -4.318 -2.644 -7.062 1.00 0.00 C ATOM 999 SD MET A 62 -2.957 -2.007 -8.056 1.00 0.00 S ATOM 1000 CE MET A 62 -2.031 -1.100 -6.820 1.00 0.00 C ATOM 0 H MET A 62 -1.791 -4.755 -6.699 1.00 0.00 H new ATOM 0 HA MET A 62 -3.361 -3.630 -4.913 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.687 -4.597 -7.667 1.00 0.00 H new ATOM 0 HB3 MET A 62 -5.225 -4.567 -6.827 1.00 0.00 H new ATOM 0 HG2 MET A 62 -5.262 -2.416 -7.557 1.00 0.00 H new ATOM 0 HG3 MET A 62 -4.331 -2.132 -6.100 1.00 0.00 H new ATOM 0 HE1 MET A 62 -1.358 -0.398 -7.312 1.00 0.00 H new ATOM 0 HE2 MET A 62 -2.721 -0.552 -6.178 1.00 0.00 H new ATOM 0 HE3 MET A 62 -1.450 -1.797 -6.216 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.296 -6.778 -5.023 1.00 0.00 N ATOM 1011 CA ASP A 63 -5.093 -7.788 -4.328 1.00 0.00 C ATOM 1012 C ASP A 63 -4.359 -8.345 -3.108 1.00 0.00 C ATOM 1013 O ASP A 63 -4.557 -9.500 -2.729 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.451 -8.929 -5.280 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.741 -8.668 -6.033 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -6.871 -7.578 -6.630 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.622 -9.554 -6.027 1.00 0.00 O ATOM 0 H ASP A 63 -3.672 -7.151 -5.739 1.00 0.00 H new ATOM 0 HA ASP A 63 -6.006 -7.303 -3.982 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.639 -9.072 -5.993 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.545 -9.856 -4.714 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.512 -7.523 -2.497 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.750 -7.937 -1.325 1.00 0.00 C ATOM 1024 C ALA A 64 -3.463 -7.541 -0.038 1.00 0.00 C ATOM 1025 O ALA A 64 -4.121 -6.503 0.024 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.355 -7.327 -1.358 1.00 0.00 C ATOM 0 H ALA A 64 -3.336 -6.564 -2.795 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.664 -9.023 -1.347 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.798 -7.645 -0.477 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.834 -7.659 -2.256 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.433 -6.240 -1.365 1.00 0.00 H new ATOM 1032 N THR A 65 -3.320 -8.369 0.990 1.00 0.00 N ATOM 1033 CA THR A 65 -3.944 -8.096 2.277 1.00 0.00 C ATOM 1034 C THR A 65 -3.146 -7.043 3.039 1.00 0.00 C ATOM 1035 O THR A 65 -1.940 -6.896 2.822 1.00 0.00 O ATOM 1036 CB THR A 65 -4.051 -9.379 3.105 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.159 -10.367 2.619 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.442 -9.975 3.104 1.00 0.00 C ATOM 0 H THR A 65 -2.779 -9.233 0.957 1.00 0.00 H new ATOM 0 HA THR A 65 -4.949 -7.714 2.098 1.00 0.00 H new ATOM 0 HB THR A 65 -3.798 -9.088 4.124 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.242 -11.178 3.163 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.450 -10.882 3.709 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.147 -9.255 3.520 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.733 -10.218 2.082 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.813 -6.316 3.940 1.00 0.00 N ATOM 1047 CA LEU A 66 -3.152 -5.286 4.732 1.00 0.00 C ATOM 1048 C LEU A 66 -1.849 -5.817 5.319 1.00 0.00 C ATOM 1049 O LEU A 66 -0.895 -5.068 5.530 1.00 0.00 O ATOM 1050 CB LEU A 66 -4.083 -4.811 5.853 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.819 -3.484 5.607 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -4.050 -2.326 6.223 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -5.044 -3.239 4.121 1.00 0.00 C ATOM 0 H LEU A 66 -4.808 -6.425 4.136 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.918 -4.442 4.083 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.827 -5.587 6.033 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.497 -4.714 6.767 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.796 -3.553 6.086 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.586 -1.395 6.039 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -3.954 -2.483 7.297 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.058 -2.269 5.775 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.567 -2.292 3.983 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.083 -3.200 3.609 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.644 -4.049 3.706 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.818 -7.123 5.571 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.635 -7.768 6.122 1.00 0.00 C ATOM 1067 C LYS A 67 0.544 -7.662 5.155 1.00 0.00 C ATOM 1068 O LYS A 67 1.618 -7.198 5.538 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.924 -9.234 6.439 1.00 0.00 C ATOM 1070 CG LYS A 67 -0.445 -9.667 7.815 1.00 0.00 C ATOM 1071 CD LYS A 67 0.922 -10.333 7.747 1.00 0.00 C ATOM 1072 CE LYS A 67 1.292 -10.981 9.071 1.00 0.00 C ATOM 1073 NZ LYS A 67 2.731 -10.787 9.401 1.00 0.00 N ATOM 0 H LYS A 67 -2.601 -7.754 5.401 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.370 -7.254 7.046 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -1.998 -9.407 6.366 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -0.448 -9.860 5.685 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -0.396 -8.800 8.474 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -1.166 -10.358 8.251 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.922 -11.086 6.959 1.00 0.00 H new ATOM 0 HD3 LYS A 67 1.676 -9.592 7.480 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.677 -10.559 9.866 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.070 -12.047 9.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 2.943 -11.244 10.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 3.318 -11.212 8.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.938 -9.770 9.467 1.00 0.00 H new ATOM 1087 N GLU A 68 0.348 -8.092 3.903 1.00 0.00 N ATOM 1088 CA GLU A 68 1.404 -8.038 2.908 1.00 0.00 C ATOM 1089 C GLU A 68 2.034 -6.652 2.841 1.00 0.00 C ATOM 1090 O GLU A 68 3.251 -6.521 2.717 1.00 0.00 O ATOM 1091 CB GLU A 68 0.836 -8.415 1.542 1.00 0.00 C ATOM 1092 CG GLU A 68 0.343 -9.852 1.465 1.00 0.00 C ATOM 1093 CD GLU A 68 1.471 -10.861 1.547 1.00 0.00 C ATOM 1094 OE1 GLU A 68 2.644 -10.450 1.417 1.00 0.00 O ATOM 1095 OE2 GLU A 68 1.183 -12.059 1.742 1.00 0.00 O ATOM 0 H GLU A 68 -0.533 -8.479 3.564 1.00 0.00 H new ATOM 0 HA GLU A 68 2.181 -8.746 3.195 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.012 -7.743 1.302 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.603 -8.261 0.783 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.362 -10.034 2.276 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.201 -9.996 0.531 1.00 0.00 H new ATOM 1102 N LEU A 69 1.204 -5.618 2.934 1.00 0.00 N ATOM 1103 CA LEU A 69 1.695 -4.250 2.883 1.00 0.00 C ATOM 1104 C LEU A 69 2.490 -3.920 4.143 1.00 0.00 C ATOM 1105 O LEU A 69 3.367 -3.058 4.125 1.00 0.00 O ATOM 1106 CB LEU A 69 0.531 -3.269 2.708 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.408 -3.557 1.526 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.321 -4.299 0.415 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.618 -4.349 1.993 1.00 0.00 C ATOM 0 H LEU A 69 0.194 -5.703 3.044 1.00 0.00 H new ATOM 0 HA LEU A 69 2.358 -4.153 2.024 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.059 -3.265 3.625 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.940 -2.266 2.588 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.749 -2.603 1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.368 -4.489 -0.408 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.154 -3.693 0.058 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.700 -5.247 0.798 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.274 -4.545 1.145 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.290 -5.295 2.424 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.160 -3.776 2.745 1.00 0.00 H new ATOM 1121 N THR A 70 2.184 -4.621 5.234 1.00 0.00 N ATOM 1122 CA THR A 70 2.884 -4.407 6.497 1.00 0.00 C ATOM 1123 C THR A 70 4.353 -4.802 6.363 1.00 0.00 C ATOM 1124 O THR A 70 5.234 -4.171 6.948 1.00 0.00 O ATOM 1125 CB THR A 70 2.226 -5.217 7.618 1.00 0.00 C ATOM 1126 OG1 THR A 70 0.881 -4.814 7.805 1.00 0.00 O ATOM 1127 CG2 THR A 70 2.933 -5.087 8.950 1.00 0.00 C ATOM 0 H THR A 70 1.460 -5.338 5.268 1.00 0.00 H new ATOM 0 HA THR A 70 2.824 -3.348 6.748 1.00 0.00 H new ATOM 0 HB THR A 70 2.287 -6.256 7.294 1.00 0.00 H new ATOM 0 HG1 THR A 70 0.858 -3.888 8.126 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.414 -5.686 9.698 1.00 0.00 H new ATOM 0 HG22 THR A 70 3.960 -5.439 8.853 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.935 -4.042 9.260 1.00 0.00 H new ATOM 1135 N SER A 71 4.613 -5.841 5.572 1.00 0.00 N ATOM 1136 CA SER A 71 5.977 -6.308 5.352 1.00 0.00 C ATOM 1137 C SER A 71 6.674 -5.444 4.307 1.00 0.00 C ATOM 1138 O SER A 71 7.810 -5.012 4.499 1.00 0.00 O ATOM 1139 CB SER A 71 5.973 -7.771 4.907 1.00 0.00 C ATOM 1140 OG SER A 71 5.448 -8.612 5.920 1.00 0.00 O ATOM 0 H SER A 71 3.899 -6.373 5.075 1.00 0.00 H new ATOM 0 HA SER A 71 6.524 -6.229 6.291 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.379 -7.876 3.999 1.00 0.00 H new ATOM 0 HB3 SER A 71 6.988 -8.082 4.662 1.00 0.00 H new ATOM 0 HG SER A 71 5.455 -9.542 5.610 1.00 0.00 H new ATOM 1146 N LEU A 72 5.977 -5.192 3.203 1.00 0.00 N ATOM 1147 CA LEU A 72 6.507 -4.371 2.117 1.00 0.00 C ATOM 1148 C LEU A 72 7.117 -3.080 2.663 1.00 0.00 C ATOM 1149 O LEU A 72 8.254 -2.730 2.335 1.00 0.00 O ATOM 1150 CB LEU A 72 5.390 -4.054 1.124 1.00 0.00 C ATOM 1151 CG LEU A 72 5.228 -5.074 -0.006 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.759 -5.402 -0.225 1.00 0.00 C ATOM 1153 CD2 LEU A 72 5.857 -4.555 -1.290 1.00 0.00 C ATOM 0 H LEU A 72 5.036 -5.548 3.036 1.00 0.00 H new ATOM 0 HA LEU A 72 7.294 -4.926 1.607 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.448 -3.983 1.668 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.580 -3.074 0.686 1.00 0.00 H new ATOM 0 HG LEU A 72 5.744 -5.990 0.283 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.665 -6.129 -1.032 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.339 -5.820 0.690 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.219 -4.493 -0.490 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.732 -5.294 -2.081 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.371 -3.624 -1.583 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.920 -4.374 -1.127 1.00 0.00 H new ATOM 1165 N VAL A 73 6.370 -2.389 3.524 1.00 0.00 N ATOM 1166 CA VAL A 73 6.851 -1.157 4.124 1.00 0.00 C ATOM 1167 C VAL A 73 8.063 -1.427 5.007 1.00 0.00 C ATOM 1168 O VAL A 73 9.064 -0.713 4.938 1.00 0.00 O ATOM 1169 CB VAL A 73 5.752 -0.478 4.965 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.256 0.830 5.555 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.506 -0.247 4.126 1.00 0.00 C ATOM 0 H VAL A 73 5.433 -2.665 3.817 1.00 0.00 H new ATOM 0 HA VAL A 73 7.135 -0.489 3.311 1.00 0.00 H new ATOM 0 HB VAL A 73 5.491 -1.142 5.789 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.464 1.292 6.145 1.00 0.00 H new ATOM 0 HG12 VAL A 73 7.117 0.633 6.194 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.549 1.504 4.750 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.741 0.233 4.736 1.00 0.00 H new ATOM 0 HG22 VAL A 73 4.751 0.395 3.280 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.131 -1.203 3.760 1.00 0.00 H new ATOM 1181 N LYS A 74 7.965 -2.458 5.842 1.00 0.00 N ATOM 1182 CA LYS A 74 9.059 -2.812 6.738 1.00 0.00 C ATOM 1183 C LYS A 74 10.346 -3.060 5.963 1.00 0.00 C ATOM 1184 O LYS A 74 11.434 -2.750 6.448 1.00 0.00 O ATOM 1185 CB LYS A 74 8.686 -4.040 7.572 1.00 0.00 C ATOM 1186 CG LYS A 74 7.760 -3.724 8.741 1.00 0.00 C ATOM 1187 CD LYS A 74 6.995 -2.423 8.522 1.00 0.00 C ATOM 1188 CE LYS A 74 6.092 -2.097 9.698 1.00 0.00 C ATOM 1189 NZ LYS A 74 5.434 -0.771 9.536 1.00 0.00 N ATOM 0 H LYS A 74 7.144 -3.059 5.916 1.00 0.00 H new ATOM 0 HA LYS A 74 9.232 -1.972 7.411 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.205 -4.775 6.927 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.597 -4.500 7.955 1.00 0.00 H new ATOM 0 HG2 LYS A 74 7.053 -4.543 8.877 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.344 -3.652 9.658 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.701 -1.607 8.369 1.00 0.00 H new ATOM 0 HD3 LYS A 74 6.396 -2.501 7.614 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.331 -2.871 9.798 1.00 0.00 H new ATOM 0 HE3 LYS A 74 6.676 -2.103 10.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 4.525 -0.770 10.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 6.049 -0.028 9.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 5.268 -0.587 8.526 1.00 0.00 H new ATOM 1203 N GLU A 75 10.224 -3.599 4.753 1.00 0.00 N ATOM 1204 CA GLU A 75 11.391 -3.852 3.926 1.00 0.00 C ATOM 1205 C GLU A 75 12.021 -2.531 3.507 1.00 0.00 C ATOM 1206 O GLU A 75 13.240 -2.428 3.362 1.00 0.00 O ATOM 1207 CB GLU A 75 11.003 -4.668 2.693 1.00 0.00 C ATOM 1208 CG GLU A 75 12.089 -5.628 2.234 1.00 0.00 C ATOM 1209 CD GLU A 75 11.554 -7.014 1.932 1.00 0.00 C ATOM 1210 OE1 GLU A 75 10.922 -7.187 0.869 1.00 0.00 O ATOM 1211 OE2 GLU A 75 11.769 -7.927 2.757 1.00 0.00 O ATOM 0 H GLU A 75 9.335 -3.866 4.330 1.00 0.00 H new ATOM 0 HA GLU A 75 12.116 -4.425 4.504 1.00 0.00 H new ATOM 0 HB2 GLU A 75 10.098 -5.234 2.912 1.00 0.00 H new ATOM 0 HB3 GLU A 75 10.763 -3.986 1.877 1.00 0.00 H new ATOM 0 HG2 GLU A 75 12.570 -5.226 1.342 1.00 0.00 H new ATOM 0 HG3 GLU A 75 12.856 -5.699 3.006 1.00 0.00 H new ATOM 1218 N VAL A 76 11.177 -1.518 3.322 1.00 0.00 N ATOM 1219 CA VAL A 76 11.648 -0.192 2.928 1.00 0.00 C ATOM 1220 C VAL A 76 11.735 0.743 4.130 1.00 0.00 C ATOM 1221 O VAL A 76 11.927 1.949 3.974 1.00 0.00 O ATOM 1222 CB VAL A 76 10.728 0.460 1.873 1.00 0.00 C ATOM 1223 CG1 VAL A 76 11.541 1.309 0.910 1.00 0.00 C ATOM 1224 CG2 VAL A 76 9.927 -0.592 1.122 1.00 0.00 C ATOM 0 H VAL A 76 10.166 -1.590 3.438 1.00 0.00 H new ATOM 0 HA VAL A 76 12.638 -0.339 2.497 1.00 0.00 H new ATOM 0 HB VAL A 76 10.022 1.109 2.392 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.877 1.761 0.173 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.057 2.094 1.463 1.00 0.00 H new ATOM 0 HG13 VAL A 76 12.274 0.682 0.402 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.288 -0.105 0.385 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.609 -1.276 0.616 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.310 -1.150 1.826 1.00 0.00 H new ATOM 1234 N TYR A 77 11.583 0.189 5.329 1.00 0.00 N ATOM 1235 CA TYR A 77 11.633 0.985 6.548 1.00 0.00 C ATOM 1236 C TYR A 77 12.253 0.192 7.699 1.00 0.00 C ATOM 1237 O TYR A 77 11.685 -0.803 8.150 1.00 0.00 O ATOM 1238 CB TYR A 77 10.225 1.443 6.921 1.00 0.00 C ATOM 1239 CG TYR A 77 10.180 2.809 7.569 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.024 3.126 8.625 1.00 0.00 C ATOM 1241 CD2 TYR A 77 9.293 3.779 7.120 1.00 0.00 C ATOM 1242 CE1 TYR A 77 10.984 4.374 9.218 1.00 0.00 C ATOM 1243 CE2 TYR A 77 9.249 5.030 7.707 1.00 0.00 C ATOM 1244 CZ TYR A 77 10.096 5.322 8.755 1.00 0.00 C ATOM 1245 OH TYR A 77 10.054 6.566 9.342 1.00 0.00 O ATOM 0 H TYR A 77 11.424 -0.807 5.481 1.00 0.00 H new ATOM 0 HA TYR A 77 12.261 1.857 6.365 1.00 0.00 H new ATOM 0 HB2 TYR A 77 9.607 1.456 6.023 1.00 0.00 H new ATOM 0 HB3 TYR A 77 9.784 0.714 7.601 1.00 0.00 H new ATOM 0 HD1 TYR A 77 11.722 2.386 8.988 1.00 0.00 H new ATOM 0 HD2 TYR A 77 8.628 3.553 6.300 1.00 0.00 H new ATOM 0 HE1 TYR A 77 11.645 4.606 10.040 1.00 0.00 H new ATOM 0 HE2 TYR A 77 8.555 5.775 7.346 1.00 0.00 H new ATOM 0 HH TYR A 77 10.290 6.489 10.290 1.00 0.00 H new ATOM 1255 N PRO A 78 13.434 0.618 8.189 1.00 0.00 N ATOM 1256 CA PRO A 78 14.127 -0.066 9.285 1.00 0.00 C ATOM 1257 C PRO A 78 13.409 0.086 10.623 1.00 0.00 C ATOM 1258 O PRO A 78 13.046 -0.904 11.260 1.00 0.00 O ATOM 1259 CB PRO A 78 15.501 0.623 9.342 1.00 0.00 C ATOM 1260 CG PRO A 78 15.598 1.444 8.101 1.00 0.00 C ATOM 1261 CD PRO A 78 14.190 1.784 7.712 1.00 0.00 C ATOM 0 HA PRO A 78 14.180 -1.140 9.109 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.588 1.247 10.231 1.00 0.00 H new ATOM 0 HB3 PRO A 78 16.305 -0.112 9.388 1.00 0.00 H new ATOM 0 HG2 PRO A 78 16.182 2.347 8.277 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.098 0.891 7.306 1.00 0.00 H new ATOM 0 HD2 PRO A 78 13.851 2.707 8.183 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.089 1.920 6.635 1.00 0.00 H new ATOM 1269 N GLU A 79 13.216 1.330 11.050 1.00 0.00 N ATOM 1270 CA GLU A 79 12.550 1.616 12.320 1.00 0.00 C ATOM 1271 C GLU A 79 11.183 0.942 12.401 1.00 0.00 C ATOM 1272 O GLU A 79 10.677 0.675 13.492 1.00 0.00 O ATOM 1273 CB GLU A 79 12.396 3.125 12.509 1.00 0.00 C ATOM 1274 CG GLU A 79 12.271 3.546 13.965 1.00 0.00 C ATOM 1275 CD GLU A 79 13.585 4.031 14.546 1.00 0.00 C ATOM 1276 OE1 GLU A 79 14.377 3.185 15.011 1.00 0.00 O ATOM 1277 OE2 GLU A 79 13.820 5.258 14.538 1.00 0.00 O ATOM 0 H GLU A 79 13.512 2.159 10.535 1.00 0.00 H new ATOM 0 HA GLU A 79 13.174 1.212 13.118 1.00 0.00 H new ATOM 0 HB2 GLU A 79 13.256 3.628 12.067 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.514 3.463 11.965 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.527 4.338 14.048 1.00 0.00 H new ATOM 0 HG3 GLU A 79 11.907 2.704 14.553 1.00 0.00 H new ATOM 1284 N ALA A 80 10.584 0.673 11.244 1.00 0.00 N ATOM 1285 CA ALA A 80 9.275 0.037 11.195 1.00 0.00 C ATOM 1286 C ALA A 80 9.340 -1.410 11.674 1.00 0.00 C ATOM 1287 O ALA A 80 8.410 -1.903 12.315 1.00 0.00 O ATOM 1288 CB ALA A 80 8.712 0.101 9.785 1.00 0.00 C ATOM 0 H ALA A 80 10.985 0.886 10.331 1.00 0.00 H new ATOM 0 HA ALA A 80 8.613 0.582 11.868 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.733 -0.378 9.762 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.614 1.143 9.479 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.385 -0.416 9.101 1.00 0.00 H new ATOM 1294 N ARG A 81 10.439 -2.088 11.358 1.00 0.00 N ATOM 1295 CA ARG A 81 10.624 -3.482 11.754 1.00 0.00 C ATOM 1296 C ARG A 81 10.437 -3.676 13.260 1.00 0.00 C ATOM 1297 O ARG A 81 10.200 -4.792 13.722 1.00 0.00 O ATOM 1298 CB ARG A 81 12.014 -3.969 11.337 1.00 0.00 C ATOM 1299 CG ARG A 81 12.076 -4.473 9.904 1.00 0.00 C ATOM 1300 CD ARG A 81 12.963 -5.703 9.780 1.00 0.00 C ATOM 1301 NE ARG A 81 13.985 -5.541 8.748 1.00 0.00 N ATOM 1302 CZ ARG A 81 13.763 -5.726 7.447 1.00 0.00 C ATOM 1303 NH1 ARG A 81 12.559 -6.076 7.014 1.00 0.00 N ATOM 1304 NH2 ARG A 81 14.751 -5.560 6.578 1.00 0.00 N ATOM 0 H ARG A 81 11.217 -1.695 10.828 1.00 0.00 H new ATOM 0 HA ARG A 81 9.862 -4.071 11.244 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.727 -3.154 11.458 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.327 -4.768 12.009 1.00 0.00 H new ATOM 0 HG2 ARG A 81 11.070 -4.713 9.558 1.00 0.00 H new ATOM 0 HG3 ARG A 81 12.456 -3.683 9.256 1.00 0.00 H new ATOM 0 HD2 ARG A 81 13.444 -5.901 10.738 1.00 0.00 H new ATOM 0 HD3 ARG A 81 12.347 -6.572 9.547 1.00 0.00 H new ATOM 0 HE ARG A 81 14.924 -5.270 9.041 1.00 0.00 H new ATOM 0 HH11 ARG A 81 11.796 -6.205 7.678 1.00 0.00 H new ATOM 0 HH12 ARG A 81 12.396 -6.216 6.017 1.00 0.00 H new ATOM 0 HH21 ARG A 81 15.679 -5.291 6.906 1.00 0.00 H new ATOM 0 HH22 ARG A 81 14.583 -5.701 5.582 1.00 0.00 H new ATOM 1318 N LYS A 82 10.543 -2.591 14.024 1.00 0.00 N ATOM 1319 CA LYS A 82 10.385 -2.656 15.473 1.00 0.00 C ATOM 1320 C LYS A 82 9.069 -3.331 15.851 1.00 0.00 C ATOM 1321 O LYS A 82 8.032 -3.076 15.241 1.00 0.00 O ATOM 1322 CB LYS A 82 10.443 -1.252 16.077 1.00 0.00 C ATOM 1323 CG LYS A 82 11.095 -1.209 17.450 1.00 0.00 C ATOM 1324 CD LYS A 82 12.347 -0.344 17.449 1.00 0.00 C ATOM 1325 CE LYS A 82 13.202 -0.598 18.680 1.00 0.00 C ATOM 1326 NZ LYS A 82 13.687 0.669 19.293 1.00 0.00 N ATOM 0 H LYS A 82 10.738 -1.657 13.663 1.00 0.00 H new ATOM 0 HA LYS A 82 11.205 -3.252 15.874 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.993 -0.597 15.402 1.00 0.00 H new ATOM 0 HB3 LYS A 82 9.431 -0.855 16.152 1.00 0.00 H new ATOM 0 HG2 LYS A 82 10.384 -0.820 18.179 1.00 0.00 H new ATOM 0 HG3 LYS A 82 11.352 -2.221 17.763 1.00 0.00 H new ATOM 0 HD2 LYS A 82 12.931 -0.548 16.551 1.00 0.00 H new ATOM 0 HD3 LYS A 82 12.064 0.708 17.413 1.00 0.00 H new ATOM 0 HE2 LYS A 82 12.623 -1.158 19.414 1.00 0.00 H new ATOM 0 HE3 LYS A 82 14.055 -1.219 18.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 14.266 0.451 20.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 14.261 1.192 18.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 12.873 1.251 19.578 1.00 0.00 H new ATOM 1340 N LYS A 83 9.123 -4.195 16.859 1.00 0.00 N ATOM 1341 CA LYS A 83 7.938 -4.910 17.319 1.00 0.00 C ATOM 1342 C LYS A 83 7.029 -3.994 18.133 1.00 0.00 C ATOM 1343 O LYS A 83 7.492 -3.255 19.002 1.00 0.00 O ATOM 1344 CB LYS A 83 8.342 -6.125 18.157 1.00 0.00 C ATOM 1345 CG LYS A 83 8.332 -7.431 17.379 1.00 0.00 C ATOM 1346 CD LYS A 83 7.368 -8.437 17.988 1.00 0.00 C ATOM 1347 CE LYS A 83 7.287 -9.706 17.154 1.00 0.00 C ATOM 1348 NZ LYS A 83 6.107 -9.699 16.245 1.00 0.00 N ATOM 0 H LYS A 83 9.975 -4.417 17.373 1.00 0.00 H new ATOM 0 HA LYS A 83 7.387 -5.250 16.442 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.340 -5.961 18.562 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.664 -6.212 19.006 1.00 0.00 H new ATOM 0 HG2 LYS A 83 8.050 -7.237 16.344 1.00 0.00 H new ATOM 0 HG3 LYS A 83 9.337 -7.853 17.362 1.00 0.00 H new ATOM 0 HD2 LYS A 83 7.690 -8.685 18.999 1.00 0.00 H new ATOM 0 HD3 LYS A 83 6.377 -7.990 18.069 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.198 -9.812 16.565 1.00 0.00 H new ATOM 0 HE3 LYS A 83 7.231 -10.571 17.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.411 -10.399 16.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 5.674 -8.753 16.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.411 -9.940 15.280 1.00 0.00 H new ATOM 1362 N GLY A 84 5.731 -4.051 17.847 1.00 0.00 N ATOM 1363 CA GLY A 84 4.776 -3.224 18.564 1.00 0.00 C ATOM 1364 C GLY A 84 4.477 -1.916 17.854 1.00 0.00 C ATOM 1365 O GLY A 84 3.735 -1.082 18.372 1.00 0.00 O ATOM 0 H GLY A 84 5.324 -4.654 17.132 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.848 -3.780 18.696 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.164 -3.011 19.560 1.00 0.00 H new ATOM 1369 N THR A 85 5.055 -1.730 16.670 1.00 0.00 N ATOM 1370 CA THR A 85 4.840 -0.508 15.902 1.00 0.00 C ATOM 1371 C THR A 85 3.436 -0.476 15.300 1.00 0.00 C ATOM 1372 O THR A 85 3.057 -1.359 14.531 1.00 0.00 O ATOM 1373 CB THR A 85 5.890 -0.390 14.798 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.196 -0.398 15.347 1.00 0.00 O ATOM 1375 CG2 THR A 85 5.750 0.868 13.968 1.00 0.00 C ATOM 0 H THR A 85 5.673 -2.407 16.223 1.00 0.00 H new ATOM 0 HA THR A 85 4.937 0.340 16.579 1.00 0.00 H new ATOM 0 HB THR A 85 5.726 -1.252 14.151 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.542 -1.315 15.355 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.527 0.888 13.203 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.770 0.882 13.491 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.852 1.742 14.612 1.00 0.00 H new ATOM 1383 N HIS A 86 2.672 0.551 15.658 1.00 0.00 N ATOM 1384 CA HIS A 86 1.309 0.714 15.161 1.00 0.00 C ATOM 1385 C HIS A 86 1.269 1.701 13.998 1.00 0.00 C ATOM 1386 O HIS A 86 1.529 2.892 14.177 1.00 0.00 O ATOM 1387 CB HIS A 86 0.397 1.201 16.290 1.00 0.00 C ATOM 1388 CG HIS A 86 -1.062 1.028 16.003 1.00 0.00 C ATOM 1389 ND1 HIS A 86 -1.854 2.034 15.491 1.00 0.00 N ATOM 1390 CD2 HIS A 86 -1.874 -0.042 16.167 1.00 0.00 C ATOM 1391 CE1 HIS A 86 -3.091 1.590 15.352 1.00 0.00 C ATOM 1392 NE2 HIS A 86 -3.129 0.333 15.754 1.00 0.00 N ATOM 0 H HIS A 86 2.976 1.288 16.295 1.00 0.00 H new ATOM 0 HA HIS A 86 0.956 -0.253 14.803 1.00 0.00 H new ATOM 0 HB2 HIS A 86 0.645 0.661 17.204 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.599 2.256 16.478 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.588 -1.010 16.551 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -3.928 2.158 14.974 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -3.957 -0.263 15.757 1.00 0.00 H new ATOM 1400 N PHE A 87 0.944 1.206 12.806 1.00 0.00 N ATOM 1401 CA PHE A 87 0.878 2.059 11.619 1.00 0.00 C ATOM 1402 C PHE A 87 -0.505 2.021 10.979 1.00 0.00 C ATOM 1403 O PHE A 87 -1.203 1.009 11.038 1.00 0.00 O ATOM 1404 CB PHE A 87 1.933 1.643 10.586 1.00 0.00 C ATOM 1405 CG PHE A 87 2.438 0.243 10.763 1.00 0.00 C ATOM 1406 CD1 PHE A 87 3.332 -0.060 11.775 1.00 0.00 C ATOM 1407 CD2 PHE A 87 2.016 -0.769 9.918 1.00 0.00 C ATOM 1408 CE1 PHE A 87 3.798 -1.347 11.940 1.00 0.00 C ATOM 1409 CE2 PHE A 87 2.478 -2.059 10.080 1.00 0.00 C ATOM 1410 CZ PHE A 87 3.371 -2.349 11.093 1.00 0.00 C ATOM 0 H PHE A 87 0.723 0.225 12.635 1.00 0.00 H new ATOM 0 HA PHE A 87 1.080 3.079 11.946 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.508 1.742 9.587 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.775 2.333 10.644 1.00 0.00 H new ATOM 0 HD1 PHE A 87 3.668 0.720 12.442 1.00 0.00 H new ATOM 0 HD2 PHE A 87 1.318 -0.547 9.124 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.497 -1.571 12.732 1.00 0.00 H new ATOM 0 HE2 PHE A 87 2.142 -2.841 9.415 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.734 -3.358 11.222 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.886 3.133 10.360 1.00 0.00 N ATOM 1421 CA ASN A 88 -2.179 3.241 9.697 1.00 0.00 C ATOM 1422 C ASN A 88 -2.003 3.462 8.199 1.00 0.00 C ATOM 1423 O ASN A 88 -1.031 4.081 7.761 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.991 4.389 10.302 1.00 0.00 C ATOM 1425 CG ASN A 88 -4.486 4.176 10.165 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -4.983 3.849 9.087 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -5.213 4.359 11.261 1.00 0.00 N ATOM 0 H ASN A 88 -0.314 3.976 10.304 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.717 2.305 9.848 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -2.737 4.493 11.357 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -2.714 5.323 9.813 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -6.224 4.229 11.230 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.760 4.630 12.134 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.950 2.955 7.419 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.907 3.096 5.969 1.00 0.00 C ATOM 1436 C PHE A 89 -3.989 4.053 5.492 1.00 0.00 C ATOM 1437 O PHE A 89 -5.156 3.937 5.884 1.00 0.00 O ATOM 1438 CB PHE A 89 -3.070 1.734 5.291 1.00 0.00 C ATOM 1439 CG PHE A 89 -2.066 0.717 5.752 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -2.291 -0.020 6.901 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -0.896 0.498 5.040 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -1.378 -0.953 7.334 1.00 0.00 C ATOM 1443 CE2 PHE A 89 0.027 -0.437 5.471 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.215 -1.165 6.622 1.00 0.00 C ATOM 0 H PHE A 89 -3.759 2.441 7.768 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.935 3.506 5.696 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -4.074 1.357 5.485 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.980 1.860 4.212 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.197 0.140 7.466 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.704 1.063 4.140 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.571 -1.520 8.232 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.935 -0.599 4.910 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.503 -1.896 6.962 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.591 4.987 4.630 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.505 5.975 4.079 1.00 0.00 C ATOM 1456 C ALA A 90 -4.161 6.304 2.635 1.00 0.00 C ATOM 1457 O ALA A 90 -3.044 6.076 2.186 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.470 7.245 4.921 1.00 0.00 C ATOM 0 H ALA A 90 -2.631 5.077 4.298 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.509 5.551 4.100 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.157 7.979 4.501 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.768 7.012 5.943 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.459 7.653 4.922 1.00 0.00 H new ATOM 1464 N ILE A 91 -5.131 6.858 1.920 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.932 7.244 0.532 1.00 0.00 C ATOM 1466 C ILE A 91 -4.826 8.759 0.431 1.00 0.00 C ATOM 1467 O ILE A 91 -5.829 9.466 0.553 1.00 0.00 O ATOM 1468 CB ILE A 91 -6.079 6.757 -0.382 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -6.870 5.624 0.280 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.526 6.303 -1.725 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -6.054 4.371 0.513 1.00 0.00 C ATOM 0 H ILE A 91 -6.066 7.050 2.281 1.00 0.00 H new ATOM 0 HA ILE A 91 -4.010 6.771 0.194 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.760 7.592 -0.545 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.262 5.975 1.235 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.728 5.378 -0.345 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.345 5.962 -2.359 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.015 7.136 -2.208 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.822 5.485 -1.571 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -6.679 3.612 0.984 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.684 3.995 -0.441 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -5.211 4.602 1.164 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.604 9.251 0.227 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.363 10.688 0.125 1.00 0.00 C ATOM 1485 C VAL A 92 -2.431 11.006 -1.044 1.00 0.00 C ATOM 1486 O VAL A 92 -1.440 10.313 -1.261 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.776 11.272 1.445 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -3.059 10.351 2.627 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -1.280 11.543 1.327 1.00 0.00 C ATOM 0 H VAL A 92 -2.767 8.676 0.129 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.329 11.160 -0.054 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.274 12.225 1.623 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.638 10.784 3.534 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.136 10.233 2.747 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.606 9.376 2.446 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.909 11.949 2.268 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.758 10.613 1.102 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.102 12.261 0.526 1.00 0.00 H new ATOM 1673 N VAL A 103 -8.060 13.081 1.472 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.340 11.859 1.813 1.00 0.00 C ATOM 1675 C VAL A 103 -7.863 11.272 3.124 1.00 0.00 C ATOM 1676 O VAL A 103 -8.335 12.004 3.993 1.00 0.00 O ATOM 1677 CB VAL A 103 -5.810 12.117 1.885 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -5.418 13.207 0.894 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.352 12.489 3.292 1.00 0.00 C ATOM 0 HA VAL A 103 -7.516 11.129 1.023 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.308 11.186 1.620 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.344 13.381 0.951 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.681 12.892 -0.116 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.948 14.128 1.137 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.275 12.660 3.291 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.863 13.397 3.613 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.590 11.677 3.979 1.00 0.00 H new ATOM 1689 N LYS A 104 -7.794 9.948 3.258 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.289 9.288 4.471 1.00 0.00 C ATOM 1691 C LYS A 104 -7.658 7.910 4.665 1.00 0.00 C ATOM 1692 O LYS A 104 -7.019 7.375 3.762 1.00 0.00 O ATOM 1693 CB LYS A 104 -9.812 9.153 4.407 1.00 0.00 C ATOM 1694 CG LYS A 104 -10.491 9.239 5.763 1.00 0.00 C ATOM 1695 CD LYS A 104 -12.004 9.272 5.626 1.00 0.00 C ATOM 1696 CE LYS A 104 -12.590 7.869 5.578 1.00 0.00 C ATOM 1697 NZ LYS A 104 -12.608 7.228 6.921 1.00 0.00 N ATOM 0 H LYS A 104 -7.407 9.318 2.556 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.008 9.908 5.322 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.210 9.935 3.761 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.064 8.199 3.944 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -10.198 8.384 6.373 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -10.152 10.134 6.285 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -12.435 9.819 6.465 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -12.277 9.813 4.720 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -13.605 7.913 5.183 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -12.007 7.256 4.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -13.149 6.341 6.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -11.633 7.024 7.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -13.054 7.871 7.606 1.00 0.00 H new ATOM 1711 N GLU A 105 -7.847 7.339 5.858 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.298 6.021 6.172 1.00 0.00 C ATOM 1713 C GLU A 105 -8.317 4.919 5.921 1.00 0.00 C ATOM 1714 O GLU A 105 -9.526 5.156 5.923 1.00 0.00 O ATOM 1715 CB GLU A 105 -6.816 5.959 7.624 1.00 0.00 C ATOM 1716 CG GLU A 105 -5.709 6.949 7.954 1.00 0.00 C ATOM 1717 CD GLU A 105 -6.158 8.393 7.837 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -6.892 8.861 8.732 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -5.772 9.057 6.850 1.00 0.00 O ATOM 0 H GLU A 105 -8.374 7.768 6.618 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.447 5.861 5.510 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -7.663 6.144 8.285 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.461 4.950 7.835 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -5.353 6.765 8.968 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -4.865 6.780 7.285 1.00 0.00 H new ATOM 1726 N ILE A 106 -7.814 3.707 5.701 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.670 2.555 5.445 1.00 0.00 C ATOM 1728 C ILE A 106 -8.459 1.458 6.487 1.00 0.00 C ATOM 1729 O ILE A 106 -9.331 0.613 6.692 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.426 1.967 4.041 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -6.935 1.702 3.817 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -8.970 2.906 2.972 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.454 0.400 4.420 1.00 0.00 C ATOM 0 H ILE A 106 -6.816 3.498 5.695 1.00 0.00 H new ATOM 0 HA ILE A 106 -9.697 2.915 5.507 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.955 1.016 3.969 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -6.733 1.693 2.746 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.360 2.524 4.243 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -8.790 2.478 1.986 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.041 3.043 3.119 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -8.468 3.871 3.045 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.389 0.279 4.222 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.624 0.413 5.497 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -7.002 -0.431 3.976 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.304 1.478 7.154 1.00 0.00 N ATOM 1746 CA GLY A 107 -7.021 0.476 8.169 1.00 0.00 C ATOM 1747 C GLY A 107 -5.587 0.542 8.645 1.00 0.00 C ATOM 1748 O GLY A 107 -4.729 1.051 7.936 1.00 0.00 O ATOM 0 H GLY A 107 -6.565 2.166 7.010 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.691 0.619 9.017 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.224 -0.516 7.766 1.00 0.00 H new ATOM 1752 N SER A 108 -5.325 0.051 9.858 1.00 0.00 N ATOM 1753 CA SER A 108 -3.979 0.084 10.422 1.00 0.00 C ATOM 1754 C SER A 108 -3.509 -1.308 10.839 1.00 0.00 C ATOM 1755 O SER A 108 -4.271 -2.086 11.410 1.00 0.00 O ATOM 1756 CB SER A 108 -3.947 1.018 11.631 1.00 0.00 C ATOM 1757 OG SER A 108 -5.066 0.800 12.472 1.00 0.00 O ATOM 0 H SER A 108 -6.027 -0.373 10.465 1.00 0.00 H new ATOM 0 HA SER A 108 -3.303 0.452 9.650 1.00 0.00 H new ATOM 0 HB2 SER A 108 -3.028 0.858 12.194 1.00 0.00 H new ATOM 0 HB3 SER A 108 -3.938 2.055 11.294 1.00 0.00 H new ATOM 0 HG SER A 108 -5.022 1.408 13.239 1.00 0.00 H new ATOM 1763 N THR A 109 -2.245 -1.613 10.547 1.00 0.00 N ATOM 1764 CA THR A 109 -1.667 -2.907 10.896 1.00 0.00 C ATOM 1765 C THR A 109 -0.585 -2.737 11.958 1.00 0.00 C ATOM 1766 O THR A 109 -0.453 -1.667 12.551 1.00 0.00 O ATOM 1767 CB THR A 109 -1.090 -3.596 9.655 1.00 0.00 C ATOM 1768 OG1 THR A 109 -0.035 -2.835 9.091 1.00 0.00 O ATOM 1769 CG2 THR A 109 -2.119 -3.831 8.571 1.00 0.00 C ATOM 0 H THR A 109 -1.603 -0.980 10.070 1.00 0.00 H new ATOM 0 HA THR A 109 -2.459 -3.537 11.301 1.00 0.00 H new ATOM 0 HB THR A 109 -0.727 -4.561 10.008 1.00 0.00 H new ATOM 0 HG1 THR A 109 0.486 -2.417 9.808 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.646 -4.322 7.720 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.917 -4.465 8.958 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.537 -2.876 8.253 1.00 0.00 H new ATOM 1777 N MET A 110 0.181 -3.794 12.204 1.00 0.00 N ATOM 1778 CA MET A 110 1.239 -3.745 13.206 1.00 0.00 C ATOM 1779 C MET A 110 2.438 -4.592 12.793 1.00 0.00 C ATOM 1780 O MET A 110 2.317 -5.510 11.984 1.00 0.00 O ATOM 1781 CB MET A 110 0.710 -4.227 14.555 1.00 0.00 C ATOM 1782 CG MET A 110 -0.317 -3.295 15.176 1.00 0.00 C ATOM 1783 SD MET A 110 -0.093 -3.111 16.954 1.00 0.00 S ATOM 1784 CE MET A 110 1.635 -2.644 17.023 1.00 0.00 C ATOM 0 H MET A 110 0.090 -4.691 11.726 1.00 0.00 H new ATOM 0 HA MET A 110 1.566 -2.709 13.292 1.00 0.00 H new ATOM 0 HB2 MET A 110 0.263 -5.213 14.429 1.00 0.00 H new ATOM 0 HB3 MET A 110 1.547 -4.342 15.244 1.00 0.00 H new ATOM 0 HG2 MET A 110 -0.249 -2.316 14.701 1.00 0.00 H new ATOM 0 HG3 MET A 110 -1.318 -3.677 14.977 1.00 0.00 H new ATOM 0 HE1 MET A 110 2.130 -3.197 17.822 1.00 0.00 H new ATOM 0 HE2 MET A 110 2.113 -2.876 16.071 1.00 0.00 H new ATOM 0 HE3 MET A 110 1.715 -1.575 17.218 1.00 0.00 H new ATOM 1794 N SER A 111 3.599 -4.267 13.358 1.00 0.00 N ATOM 1795 CA SER A 111 4.831 -4.988 13.054 1.00 0.00 C ATOM 1796 C SER A 111 4.820 -6.381 13.676 1.00 0.00 C ATOM 1797 O SER A 111 5.544 -6.648 14.636 1.00 0.00 O ATOM 1798 CB SER A 111 6.044 -4.202 13.558 1.00 0.00 C ATOM 1799 OG SER A 111 6.211 -2.991 12.837 1.00 0.00 O ATOM 0 H SER A 111 3.711 -3.508 14.030 1.00 0.00 H new ATOM 0 HA SER A 111 4.898 -5.096 11.971 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.922 -3.982 14.619 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.942 -4.813 13.460 1.00 0.00 H new ATOM 0 HG SER A 111 7.136 -2.924 12.521 1.00 0.00 H new ATOM 1805 N GLY A 112 3.997 -7.266 13.124 1.00 0.00 N ATOM 1806 CA GLY A 112 3.915 -8.621 13.638 1.00 0.00 C ATOM 1807 C GLY A 112 2.639 -8.879 14.419 1.00 0.00 C ATOM 1808 O GLY A 112 2.545 -9.861 15.156 1.00 0.00 O ATOM 0 H GLY A 112 3.386 -7.070 12.331 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.975 -9.324 12.807 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.774 -8.813 14.281 1.00 0.00 H new ATOM 1812 N ARG A 113 1.652 -8.001 14.257 1.00 0.00 N ATOM 1813 CA ARG A 113 0.378 -8.151 14.953 1.00 0.00 C ATOM 1814 C ARG A 113 -0.782 -8.130 13.963 1.00 0.00 C ATOM 1815 O ARG A 113 -0.998 -7.140 13.263 1.00 0.00 O ATOM 1816 CB ARG A 113 0.207 -7.046 15.997 1.00 0.00 C ATOM 1817 CG ARG A 113 0.092 -7.572 17.420 1.00 0.00 C ATOM 1818 CD ARG A 113 0.197 -6.450 18.442 1.00 0.00 C ATOM 1819 NE ARG A 113 1.246 -6.704 19.428 1.00 0.00 N ATOM 1820 CZ ARG A 113 2.534 -6.434 19.228 1.00 0.00 C ATOM 1821 NH1 ARG A 113 2.940 -5.905 18.081 1.00 0.00 N ATOM 1822 NH2 ARG A 113 3.420 -6.696 20.180 1.00 0.00 N ATOM 0 H ARG A 113 1.710 -7.182 13.652 1.00 0.00 H new ATOM 0 HA ARG A 113 0.377 -9.115 15.462 1.00 0.00 H new ATOM 0 HB2 ARG A 113 1.056 -6.365 15.937 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.685 -6.466 15.759 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -0.860 -8.088 17.542 1.00 0.00 H new ATOM 0 HG3 ARG A 113 0.878 -8.305 17.602 1.00 0.00 H new ATOM 0 HD2 ARG A 113 0.401 -5.510 17.929 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -0.759 -6.333 18.952 1.00 0.00 H new ATOM 0 HE ARG A 113 0.975 -7.112 20.322 1.00 0.00 H new ATOM 0 HH11 ARG A 113 2.263 -5.702 17.345 1.00 0.00 H new ATOM 0 HH12 ARG A 113 3.929 -5.701 17.935 1.00 0.00 H new ATOM 0 HH21 ARG A 113 3.114 -7.104 21.063 1.00 0.00 H new ATOM 0 HH22 ARG A 113 4.407 -6.490 20.029 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.525 -9.231 13.906 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.660 -9.343 12.998 1.00 0.00 C ATOM 1838 C LYS A 114 -3.879 -8.605 13.543 1.00 0.00 C ATOM 1839 O LYS A 114 -4.542 -9.077 14.467 1.00 0.00 O ATOM 1840 CB LYS A 114 -3.006 -10.814 12.763 1.00 0.00 C ATOM 1841 CG LYS A 114 -3.510 -11.104 11.358 1.00 0.00 C ATOM 1842 CD LYS A 114 -5.029 -11.155 11.309 1.00 0.00 C ATOM 1843 CE LYS A 114 -5.536 -12.582 11.167 1.00 0.00 C ATOM 1844 NZ LYS A 114 -6.962 -12.623 10.736 1.00 0.00 N ATOM 0 H LYS A 114 -1.361 -10.059 14.479 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.377 -8.883 12.051 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.122 -11.422 12.955 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.766 -11.119 13.483 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.149 -10.335 10.675 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.102 -12.054 11.013 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.438 -10.711 12.217 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.387 -10.556 10.472 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.922 -13.115 10.442 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -5.429 -13.102 12.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -7.374 -13.545 10.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -7.491 -11.866 11.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -7.018 -12.487 9.706 1.00 0.00 H new ATOM 1858 N GLY A 115 -4.172 -7.448 12.959 1.00 0.00 N ATOM 1859 CA GLY A 115 -5.314 -6.666 13.393 1.00 0.00 C ATOM 1860 C GLY A 115 -6.598 -7.095 12.707 1.00 0.00 C ATOM 1861 O GLY A 115 -6.694 -8.214 12.204 1.00 0.00 O ATOM 0 H GLY A 115 -3.638 -7.038 12.192 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -5.430 -6.765 14.472 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -5.129 -5.612 13.187 1.00 0.00 H new ATOM 1865 N THR A 116 -7.585 -6.206 12.688 1.00 0.00 N ATOM 1866 CA THR A 116 -8.866 -6.502 12.058 1.00 0.00 C ATOM 1867 C THR A 116 -8.829 -6.183 10.566 1.00 0.00 C ATOM 1868 O THR A 116 -9.508 -6.827 9.767 1.00 0.00 O ATOM 1869 CB THR A 116 -9.986 -5.709 12.732 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.611 -4.352 12.898 1.00 0.00 O ATOM 1871 CG2 THR A 116 -10.369 -6.251 14.093 1.00 0.00 C ATOM 0 H THR A 116 -7.523 -5.276 13.101 1.00 0.00 H new ATOM 0 HA THR A 116 -9.061 -7.568 12.178 1.00 0.00 H new ATOM 0 HB THR A 116 -10.845 -5.802 12.068 1.00 0.00 H new ATOM 0 HG1 THR A 116 -10.341 -3.861 13.329 1.00 0.00 H new ATOM 0 HG21 THR A 116 -11.169 -5.642 14.515 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.712 -7.281 13.991 1.00 0.00 H new ATOM 0 HG23 THR A 116 -9.503 -6.221 14.754 1.00 0.00 H new ATOM 1879 N ASP A 117 -8.033 -5.183 10.200 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.910 -4.774 8.804 1.00 0.00 C ATOM 1881 C ASP A 117 -6.853 -5.603 8.077 1.00 0.00 C ATOM 1882 O ASP A 117 -6.867 -5.699 6.850 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.559 -3.289 8.714 1.00 0.00 C ATOM 1884 CG ASP A 117 -6.386 -2.916 9.600 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -5.232 -3.155 9.188 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -6.624 -2.384 10.705 1.00 0.00 O ATOM 0 H ASP A 117 -7.464 -4.641 10.850 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.872 -4.945 8.320 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -7.324 -3.036 7.680 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -8.428 -2.695 8.998 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.937 -6.195 8.838 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.868 -7.014 8.268 1.00 0.00 C ATOM 1893 C ASP A 118 -5.413 -8.021 7.256 1.00 0.00 C ATOM 1894 O ASP A 118 -4.822 -8.229 6.195 1.00 0.00 O ATOM 1895 CB ASP A 118 -4.116 -7.747 9.379 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.893 -6.985 9.848 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -3.058 -6.005 10.606 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -1.770 -7.366 9.458 1.00 0.00 O ATOM 0 H ASP A 118 -5.913 -6.123 9.855 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.182 -6.348 7.745 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.787 -7.908 10.223 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.813 -8.731 9.021 1.00 0.00 H new ATOM 1903 N SER A 119 -6.536 -8.648 7.590 1.00 0.00 N ATOM 1904 CA SER A 119 -7.152 -9.635 6.708 1.00 0.00 C ATOM 1905 C SER A 119 -7.811 -8.976 5.497 1.00 0.00 C ATOM 1906 O SER A 119 -8.233 -9.659 4.564 1.00 0.00 O ATOM 1907 CB SER A 119 -8.186 -10.460 7.477 1.00 0.00 C ATOM 1908 OG SER A 119 -9.171 -9.627 8.063 1.00 0.00 O ATOM 0 H SER A 119 -7.038 -8.491 8.464 1.00 0.00 H new ATOM 0 HA SER A 119 -6.361 -10.291 6.345 1.00 0.00 H new ATOM 0 HB2 SER A 119 -8.662 -11.172 6.803 1.00 0.00 H new ATOM 0 HB3 SER A 119 -7.688 -11.041 8.253 1.00 0.00 H new ATOM 0 HG SER A 119 -9.820 -10.179 8.547 1.00 0.00 H new ATOM 1914 N MET A 120 -7.895 -7.648 5.513 1.00 0.00 N ATOM 1915 CA MET A 120 -8.500 -6.908 4.414 1.00 0.00 C ATOM 1916 C MET A 120 -7.518 -6.771 3.255 1.00 0.00 C ATOM 1917 O MET A 120 -6.307 -6.880 3.437 1.00 0.00 O ATOM 1918 CB MET A 120 -8.949 -5.526 4.889 1.00 0.00 C ATOM 1919 CG MET A 120 -10.252 -5.058 4.261 1.00 0.00 C ATOM 1920 SD MET A 120 -11.020 -3.711 5.181 1.00 0.00 S ATOM 1921 CE MET A 120 -9.685 -2.519 5.213 1.00 0.00 C ATOM 0 H MET A 120 -7.551 -7.064 6.276 1.00 0.00 H new ATOM 0 HA MET A 120 -9.372 -7.461 4.066 1.00 0.00 H new ATOM 0 HB2 MET A 120 -9.064 -5.544 5.973 1.00 0.00 H new ATOM 0 HB3 MET A 120 -8.166 -4.802 4.663 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.062 -4.733 3.238 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.946 -5.897 4.205 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.249 -2.488 6.211 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.921 -2.809 4.492 1.00 0.00 H new ATOM 0 HE3 MET A 120 -10.071 -1.533 4.955 1.00 0.00 H new ATOM 1931 N THR A 121 -8.050 -6.522 2.066 1.00 0.00 N ATOM 1932 CA THR A 121 -7.220 -6.364 0.871 1.00 0.00 C ATOM 1933 C THR A 121 -7.175 -4.906 0.428 1.00 0.00 C ATOM 1934 O THR A 121 -8.076 -4.128 0.735 1.00 0.00 O ATOM 1935 CB THR A 121 -7.743 -7.243 -0.267 1.00 0.00 C ATOM 1936 OG1 THR A 121 -9.158 -7.249 -0.286 1.00 0.00 O ATOM 1937 CG2 THR A 121 -7.278 -8.681 -0.172 1.00 0.00 C ATOM 0 H THR A 121 -9.052 -6.424 1.899 1.00 0.00 H new ATOM 0 HA THR A 121 -6.207 -6.679 1.122 1.00 0.00 H new ATOM 0 HB THR A 121 -7.339 -6.806 -1.180 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.473 -7.815 -1.021 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.684 -9.251 -1.008 1.00 0.00 H new ATOM 0 HG22 THR A 121 -6.189 -8.714 -0.205 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.626 -9.115 0.765 1.00 0.00 H new ATOM 1945 N LEU A 122 -6.114 -4.538 -0.289 1.00 0.00 N ATOM 1946 CA LEU A 122 -5.952 -3.170 -0.766 1.00 0.00 C ATOM 1947 C LEU A 122 -7.038 -2.806 -1.777 1.00 0.00 C ATOM 1948 O LEU A 122 -7.669 -1.756 -1.669 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.569 -2.991 -1.397 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.593 -2.139 -0.586 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -2.209 -2.165 -1.218 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -4.102 -0.710 -0.473 1.00 0.00 C ATOM 0 H LEU A 122 -5.356 -5.169 -0.551 1.00 0.00 H new ATOM 0 HA LEU A 122 -6.045 -2.502 0.090 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.127 -3.975 -1.551 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.691 -2.539 -2.381 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.520 -2.559 0.417 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.528 -1.553 -0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.842 -3.191 -1.248 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.265 -1.770 -2.232 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.395 -0.117 0.107 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.204 -0.280 -1.469 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.072 -0.708 0.024 1.00 0.00 H new ATOM 1964 N GLN A 123 -7.242 -3.678 -2.760 1.00 0.00 N ATOM 1965 CA GLN A 123 -8.244 -3.450 -3.801 1.00 0.00 C ATOM 1966 C GLN A 123 -9.573 -2.969 -3.216 1.00 0.00 C ATOM 1967 O GLN A 123 -10.267 -2.152 -3.822 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.470 -4.732 -4.605 1.00 0.00 C ATOM 1969 CG GLN A 123 -8.910 -5.913 -3.755 1.00 0.00 C ATOM 1970 CD GLN A 123 -9.474 -7.051 -4.585 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -10.196 -6.828 -5.555 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -9.144 -8.279 -4.204 1.00 0.00 N ATOM 0 H GLN A 123 -6.726 -4.552 -2.859 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.862 -2.667 -4.456 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -9.224 -4.544 -5.369 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -7.548 -4.992 -5.125 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -8.060 -6.276 -3.177 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -9.663 -5.581 -3.041 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.542 -8.417 -3.392 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -9.493 -9.085 -4.723 1.00 0.00 H new ATOM 1981 N SER A 124 -9.924 -3.481 -2.041 1.00 0.00 N ATOM 1982 CA SER A 124 -11.172 -3.104 -1.384 1.00 0.00 C ATOM 1983 C SER A 124 -11.146 -1.644 -0.935 1.00 0.00 C ATOM 1984 O SER A 124 -12.195 -1.030 -0.737 1.00 0.00 O ATOM 1985 CB SER A 124 -11.438 -4.015 -0.186 1.00 0.00 C ATOM 1986 OG SER A 124 -12.828 -4.215 0.005 1.00 0.00 O ATOM 0 H SER A 124 -9.363 -4.158 -1.524 1.00 0.00 H new ATOM 0 HA SER A 124 -11.978 -3.221 -2.109 1.00 0.00 H new ATOM 0 HB2 SER A 124 -10.947 -4.976 -0.340 1.00 0.00 H new ATOM 0 HB3 SER A 124 -11.004 -3.576 0.712 1.00 0.00 H new ATOM 0 HG SER A 124 -12.971 -4.802 0.776 1.00 0.00 H new ATOM 1992 N GLN A 125 -9.948 -1.093 -0.776 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.794 0.294 -0.350 1.00 0.00 C ATOM 1994 C GLN A 125 -9.770 1.245 -1.547 1.00 0.00 C ATOM 1995 O GLN A 125 -9.437 2.422 -1.405 1.00 0.00 O ATOM 1996 CB GLN A 125 -8.513 0.459 0.473 1.00 0.00 C ATOM 1997 CG GLN A 125 -8.244 -0.693 1.431 1.00 0.00 C ATOM 1998 CD GLN A 125 -9.483 -1.125 2.194 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -10.231 -0.294 2.709 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -9.704 -2.431 2.269 1.00 0.00 N ATOM 0 H GLN A 125 -9.069 -1.585 -0.936 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.654 0.548 0.269 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.667 0.559 -0.206 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -8.576 1.386 1.043 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.854 -1.542 0.870 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -7.471 -0.397 2.140 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -9.057 -3.084 1.827 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -10.521 -2.782 2.769 1.00 0.00 H new ATOM 2009 N LYS A 126 -10.125 0.729 -2.724 1.00 0.00 N ATOM 2010 CA LYS A 126 -10.151 1.526 -3.949 1.00 0.00 C ATOM 2011 C LYS A 126 -8.745 1.777 -4.500 1.00 0.00 C ATOM 2012 O LYS A 126 -8.591 2.397 -5.551 1.00 0.00 O ATOM 2013 CB LYS A 126 -10.864 2.862 -3.714 1.00 0.00 C ATOM 2014 CG LYS A 126 -12.208 2.721 -3.019 1.00 0.00 C ATOM 2015 CD LYS A 126 -12.513 3.925 -2.139 1.00 0.00 C ATOM 2016 CE LYS A 126 -12.571 3.540 -0.668 1.00 0.00 C ATOM 2017 NZ LYS A 126 -13.610 4.314 0.070 1.00 0.00 N ATOM 0 H LYS A 126 -10.400 -0.245 -2.854 1.00 0.00 H new ATOM 0 HA LYS A 126 -10.704 0.950 -4.691 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -10.221 3.507 -3.115 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -11.011 3.359 -4.673 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -12.994 2.607 -3.765 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -12.211 1.816 -2.412 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -11.749 4.688 -2.287 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -13.464 4.365 -2.439 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -12.782 2.474 -0.580 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -11.597 3.711 -0.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -13.617 4.022 1.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -13.395 5.330 0.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -14.543 4.131 -0.351 1.00 0.00 H new ATOM 2031 N PHE A 127 -7.721 1.294 -3.797 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.343 1.477 -4.240 1.00 0.00 C ATOM 2033 C PHE A 127 -6.105 0.778 -5.575 1.00 0.00 C ATOM 2034 O PHE A 127 -6.631 -0.309 -5.821 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.374 0.938 -3.187 1.00 0.00 C ATOM 2036 CG PHE A 127 -3.929 1.158 -3.528 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -3.411 2.443 -3.609 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.087 0.085 -3.765 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -2.081 2.648 -3.921 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -1.756 0.286 -4.078 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.253 1.569 -4.156 1.00 0.00 C ATOM 0 H PHE A 127 -7.820 0.776 -2.924 1.00 0.00 H new ATOM 0 HA PHE A 127 -6.166 2.544 -4.374 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -5.589 1.414 -2.230 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.549 -0.130 -3.058 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -4.054 3.291 -3.426 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -3.475 -0.921 -3.705 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.689 3.653 -3.981 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.110 -0.560 -4.261 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.213 1.728 -4.401 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.310 1.406 -6.436 1.00 0.00 N ATOM 2052 CA GLN A 128 -5.005 0.840 -7.746 1.00 0.00 C ATOM 2053 C GLN A 128 -3.553 1.111 -8.134 1.00 0.00 C ATOM 2054 O GLN A 128 -2.774 1.629 -7.335 1.00 0.00 O ATOM 2055 CB GLN A 128 -5.946 1.418 -8.803 1.00 0.00 C ATOM 2056 CG GLN A 128 -7.415 1.146 -8.522 1.00 0.00 C ATOM 2057 CD GLN A 128 -7.792 -0.305 -8.745 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -7.350 -0.932 -9.708 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -8.615 -0.847 -7.854 1.00 0.00 N ATOM 0 H GLN A 128 -4.866 2.305 -6.251 1.00 0.00 H new ATOM 0 HA GLN A 128 -5.149 -0.239 -7.691 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -5.790 2.495 -8.867 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.687 1.000 -9.776 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -7.641 1.422 -7.492 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -8.027 1.779 -9.164 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -8.957 -0.290 -7.071 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -8.905 -1.820 -7.953 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.195 0.756 -9.364 1.00 0.00 N ATOM 2069 CA ILE A 129 -1.836 0.960 -9.853 1.00 0.00 C ATOM 2070 C ILE A 129 -1.558 2.440 -10.096 1.00 0.00 C ATOM 2071 O ILE A 129 -2.326 3.125 -10.770 1.00 0.00 O ATOM 2072 CB ILE A 129 -1.583 0.181 -11.160 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -1.964 -1.291 -10.983 1.00 0.00 C ATOM 2074 CG2 ILE A 129 -0.127 0.310 -11.582 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.741 -2.127 -12.225 1.00 0.00 C ATOM 0 H ILE A 129 -3.827 0.326 -10.040 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.163 0.586 -9.081 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.207 0.607 -11.946 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -1.383 -1.712 -10.162 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -3.014 -1.354 -10.696 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.035 -0.245 -12.506 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.113 1.361 -11.744 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.516 -0.093 -10.799 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -2.032 -3.158 -12.026 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -2.343 -1.731 -13.043 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.687 -2.094 -12.501 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.450 2.926 -9.542 1.00 0.00 N ATOM 2088 CA GLY A 130 -0.087 4.321 -9.711 1.00 0.00 C ATOM 2089 C GLY A 130 -0.719 5.224 -8.666 1.00 0.00 C ATOM 2090 O GLY A 130 -0.383 6.405 -8.580 1.00 0.00 O ATOM 0 H GLY A 130 0.202 2.379 -8.980 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.997 4.418 -9.661 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.391 4.653 -10.704 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.638 4.675 -7.876 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.313 5.450 -6.843 1.00 0.00 C ATOM 2096 C ASP A 131 -1.314 6.014 -5.841 1.00 0.00 C ATOM 2097 O ASP A 131 -0.106 5.805 -5.955 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.354 4.591 -6.121 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.760 5.139 -6.273 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -5.369 4.926 -7.344 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -5.253 5.783 -5.322 1.00 0.00 O ATOM 0 H ASP A 131 -1.931 3.699 -7.932 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.820 6.284 -7.328 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.318 3.575 -6.514 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -3.102 4.533 -5.062 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.832 6.751 -4.870 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.994 7.377 -3.848 1.00 0.00 C ATOM 2108 C TYR A 132 -1.421 6.975 -2.436 1.00 0.00 C ATOM 2109 O TYR A 132 -2.457 7.421 -1.937 1.00 0.00 O ATOM 2110 CB TYR A 132 -1.044 8.898 -3.998 1.00 0.00 C ATOM 2111 CG TYR A 132 -2.352 9.409 -4.561 1.00 0.00 C ATOM 2112 CD1 TYR A 132 -3.453 9.611 -3.740 1.00 0.00 C ATOM 2113 CD2 TYR A 132 -2.487 9.681 -5.917 1.00 0.00 C ATOM 2114 CE1 TYR A 132 -4.651 10.073 -4.252 1.00 0.00 C ATOM 2115 CE2 TYR A 132 -3.680 10.142 -6.438 1.00 0.00 C ATOM 2116 CZ TYR A 132 -4.760 10.336 -5.601 1.00 0.00 C ATOM 2117 OH TYR A 132 -5.950 10.796 -6.115 1.00 0.00 O ATOM 0 H TYR A 132 -2.830 6.933 -4.765 1.00 0.00 H new ATOM 0 HA TYR A 132 0.028 7.026 -3.994 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -0.874 9.356 -3.024 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -0.229 9.218 -4.648 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -3.372 9.404 -2.683 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -1.644 9.529 -6.575 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -5.497 10.227 -3.599 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -3.767 10.349 -7.494 1.00 0.00 H new ATOM 0 HH TYR A 132 -5.858 10.932 -7.081 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.608 6.139 -1.795 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.890 5.683 -0.437 1.00 0.00 C ATOM 2129 C LEU A 133 0.026 6.385 0.564 1.00 0.00 C ATOM 2130 O LEU A 133 1.232 6.466 0.348 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.677 4.165 -0.330 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.925 3.288 -0.461 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.630 1.890 0.058 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -3.105 3.884 0.292 1.00 0.00 C ATOM 0 H LEU A 133 0.252 5.763 -2.195 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.928 5.924 -0.208 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.033 3.865 -1.101 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.211 3.953 0.632 1.00 0.00 H new ATOM 0 HG LEU A 133 -2.192 3.237 -1.516 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.522 1.271 -0.038 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.819 1.450 -0.522 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.338 1.945 1.107 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -3.974 3.236 0.178 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -2.855 3.973 1.349 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.333 4.871 -0.111 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.542 6.879 1.667 1.00 0.00 N ATOM 2147 CA ASP A 134 0.241 7.549 2.691 1.00 0.00 C ATOM 2148 C ASP A 134 0.156 6.774 4.001 1.00 0.00 C ATOM 2149 O ASP A 134 -0.905 6.708 4.624 1.00 0.00 O ATOM 2150 CB ASP A 134 -0.265 8.978 2.894 1.00 0.00 C ATOM 2151 CG ASP A 134 0.863 9.981 3.028 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.379 10.148 4.154 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.230 10.602 2.009 1.00 0.00 O ATOM 0 H ASP A 134 -1.541 6.824 1.868 1.00 0.00 H new ATOM 0 HA ASP A 134 1.281 7.589 2.368 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.898 9.259 2.052 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -0.888 9.016 3.788 1.00 0.00 H new ATOM 2158 N ILE A 135 1.269 6.175 4.409 1.00 0.00 N ATOM 2159 CA ILE A 135 1.305 5.398 5.641 1.00 0.00 C ATOM 2160 C ILE A 135 1.874 6.205 6.806 1.00 0.00 C ATOM 2161 O ILE A 135 2.758 7.044 6.632 1.00 0.00 O ATOM 2162 CB ILE A 135 2.136 4.108 5.463 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.502 3.210 4.397 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.265 3.359 6.785 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.476 2.754 3.335 1.00 0.00 C ATOM 0 H ILE A 135 2.156 6.213 3.906 1.00 0.00 H new ATOM 0 HA ILE A 135 0.273 5.134 5.872 1.00 0.00 H new ATOM 0 HB ILE A 135 3.136 4.388 5.133 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.069 2.335 4.881 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.683 3.748 3.920 1.00 0.00 H new ATOM 0 HG21 ILE A 135 2.854 2.454 6.635 1.00 0.00 H new ATOM 0 HG22 ILE A 135 2.760 3.997 7.518 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.273 3.090 7.149 1.00 0.00 H new ATOM 0 HD11 ILE A 135 1.958 2.122 2.614 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.891 3.623 2.824 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.283 2.188 3.800 1.00 0.00 H new ATOM 2177 N ALA A 136 1.357 5.930 7.997 1.00 0.00 N ATOM 2178 CA ALA A 136 1.804 6.608 9.204 1.00 0.00 C ATOM 2179 C ALA A 136 2.303 5.592 10.224 1.00 0.00 C ATOM 2180 O ALA A 136 1.513 4.880 10.840 1.00 0.00 O ATOM 2181 CB ALA A 136 0.677 7.445 9.790 1.00 0.00 C ATOM 0 H ALA A 136 0.624 5.238 8.152 1.00 0.00 H new ATOM 0 HA ALA A 136 2.628 7.274 8.947 1.00 0.00 H new ATOM 0 HB1 ALA A 136 1.027 7.946 10.693 1.00 0.00 H new ATOM 0 HB2 ALA A 136 0.360 8.191 9.061 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.165 6.799 10.037 1.00 0.00 H new ATOM 2187 N ILE A 137 3.619 5.521 10.390 1.00 0.00 N ATOM 2188 CA ILE A 137 4.220 4.578 11.327 1.00 0.00 C ATOM 2189 C ILE A 137 4.465 5.214 12.692 1.00 0.00 C ATOM 2190 O ILE A 137 5.078 6.276 12.797 1.00 0.00 O ATOM 2191 CB ILE A 137 5.548 4.019 10.778 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.348 3.478 9.362 1.00 0.00 C ATOM 2193 CG2 ILE A 137 6.090 2.933 11.696 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.641 3.088 8.677 1.00 0.00 C ATOM 0 H ILE A 137 4.289 6.104 9.889 1.00 0.00 H new ATOM 0 HA ILE A 137 3.509 3.761 11.448 1.00 0.00 H new ATOM 0 HB ILE A 137 6.278 4.828 10.740 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.691 2.609 9.403 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.841 4.233 8.761 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.027 2.550 11.293 1.00 0.00 H new ATOM 0 HG22 ILE A 137 6.265 3.349 12.688 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.366 2.121 11.766 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.424 2.713 7.677 1.00 0.00 H new ATOM 0 HD12 ILE A 137 7.292 3.960 8.604 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.139 2.310 9.256 1.00 0.00 H new ATOM 2206 N THR A 138 3.977 4.549 13.730 1.00 0.00 N ATOM 2207 CA THR A 138 4.132 5.032 15.101 1.00 0.00 C ATOM 2208 C THR A 138 5.026 4.088 15.910 1.00 0.00 C ATOM 2209 O THR A 138 4.627 2.968 16.224 1.00 0.00 O ATOM 2210 CB THR A 138 2.768 5.154 15.781 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.764 5.479 14.836 1.00 0.00 O ATOM 2212 CG2 THR A 138 2.732 6.205 16.869 1.00 0.00 C ATOM 0 H THR A 138 3.468 3.669 13.651 1.00 0.00 H new ATOM 0 HA THR A 138 4.602 6.015 15.061 1.00 0.00 H new ATOM 0 HB THR A 138 2.584 4.180 16.234 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.399 4.655 14.450 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.735 6.239 17.309 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.461 5.956 17.640 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.973 7.179 16.443 1.00 0.00 H new ATOM 2220 N PRO A 139 6.250 4.528 16.256 1.00 0.00 N ATOM 2221 CA PRO A 139 7.186 3.707 17.028 1.00 0.00 C ATOM 2222 C PRO A 139 6.789 3.613 18.500 1.00 0.00 C ATOM 2223 O PRO A 139 6.445 4.620 19.122 1.00 0.00 O ATOM 2224 CB PRO A 139 8.509 4.456 16.877 1.00 0.00 C ATOM 2225 CG PRO A 139 8.110 5.879 16.698 1.00 0.00 C ATOM 2226 CD PRO A 139 6.817 5.851 15.928 1.00 0.00 C ATOM 0 HA PRO A 139 7.220 2.676 16.676 1.00 0.00 H new ATOM 0 HB2 PRO A 139 9.141 4.328 17.756 1.00 0.00 H new ATOM 0 HB3 PRO A 139 9.077 4.092 16.021 1.00 0.00 H new ATOM 0 HG2 PRO A 139 7.980 6.372 17.661 1.00 0.00 H new ATOM 0 HG3 PRO A 139 8.876 6.434 16.156 1.00 0.00 H new ATOM 0 HD2 PRO A 139 6.152 6.659 16.231 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.985 5.961 14.857 1.00 0.00 H new ATOM 2234 N PRO A 140 6.822 2.400 19.082 1.00 0.00 N ATOM 2235 CA PRO A 140 6.457 2.186 20.480 1.00 0.00 C ATOM 2236 C PRO A 140 7.620 2.413 21.441 1.00 0.00 C ATOM 2237 O PRO A 140 7.836 1.626 22.365 1.00 0.00 O ATOM 2238 CB PRO A 140 6.037 0.720 20.488 1.00 0.00 C ATOM 2239 CG PRO A 140 6.908 0.078 19.459 1.00 0.00 C ATOM 2240 CD PRO A 140 7.208 1.137 18.422 1.00 0.00 C ATOM 0 HA PRO A 140 5.688 2.881 20.816 1.00 0.00 H new ATOM 0 HB2 PRO A 140 6.184 0.270 21.470 1.00 0.00 H new ATOM 0 HB3 PRO A 140 4.981 0.608 20.241 1.00 0.00 H new ATOM 0 HG2 PRO A 140 7.828 -0.295 19.909 1.00 0.00 H new ATOM 0 HG3 PRO A 140 6.406 -0.777 19.005 1.00 0.00 H new ATOM 0 HD2 PRO A 140 8.262 1.137 18.145 1.00 0.00 H new ATOM 0 HD3 PRO A 140 6.638 0.974 17.508 1.00 0.00 H new