USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 769 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 MET CE :methyl -126:sc= -2.36 (180deg=-1.43) USER MOD Set 1.2: A 125 GLN : amide:sc= -2.94 K(o=-5.3,f=-2.9) USER MOD Set 2.1: A 121 THR OG1 : rot 180:sc= 0.00205 USER MOD Set 2.2: A 123 GLN : amide:sc= -2.24 X(o=-2.2,f=-2.5!) USER MOD Set 3.1: A 70 THR OG1 : rot -77:sc= 1.11 USER MOD Set 3.2: A 109 THR OG1 : rot -129:sc= 0.774! USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 166:sc= -2.89! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 99:sc= -1.02! USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.123 USER MOD Single : A 36 ASN : amide:sc= -1.82 K(o=-1.8,f=-0.83) USER MOD Single : A 37 ASN : amide:sc=-0.00504 K(o=-0.005,f=0.97) USER MOD Single : A 57 GLN : amide:sc= -3.72! C(o=-3.7!,f=-6.8!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 40:sc= -1.62 USER MOD Single : A 62 MET CE :methyl 155:sc= -8.77! (180deg=-10.5!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.109 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+ 180:sc= 0 (180deg=0) 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 109:sc= 1.13 USER MOD Single : A 86 HIS : no HD1:sc= -1.76! K(o=-1.8!,f=-0.75) USER MOD Single : A 88 ASN : amide:sc= -4.55! C(o=-4.5!,f=-4.4!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl -142:sc= -6.6! (180deg=-12.6!) USER MOD Single : A 111 SER OG : rot 155:sc= 0.0664 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.00605 USER MOD Single : A 119 SER OG : rot 180:sc= 0.00313 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 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 91:sc= 0.0901 USER MOD ----------------------------------------------------------------- ATOM 318 N ASP A 21 -5.624 -13.248 -8.404 1.00 0.00 N ATOM 319 CA ASP A 21 -5.257 -14.376 -7.551 1.00 0.00 C ATOM 320 C ASP A 21 -4.225 -13.960 -6.506 1.00 0.00 C ATOM 321 O ASP A 21 -3.142 -13.487 -6.846 1.00 0.00 O ATOM 322 CB ASP A 21 -4.710 -15.525 -8.400 1.00 0.00 C ATOM 323 CG ASP A 21 -5.294 -16.867 -8.000 1.00 0.00 C ATOM 324 OD1 ASP A 21 -6.411 -17.186 -8.460 1.00 0.00 O ATOM 325 OD2 ASP A 21 -4.635 -17.595 -7.229 1.00 0.00 O ATOM 0 HA ASP A 21 -6.154 -14.712 -7.030 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.930 -15.334 -9.450 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.625 -15.560 -8.303 1.00 0.00 H new ATOM 330 N ARG A 22 -4.570 -14.137 -5.234 1.00 0.00 N ATOM 331 CA ARG A 22 -3.682 -13.777 -4.132 1.00 0.00 C ATOM 332 C ARG A 22 -2.340 -14.510 -4.220 1.00 0.00 C ATOM 333 O ARG A 22 -1.353 -14.084 -3.621 1.00 0.00 O ATOM 334 CB ARG A 22 -4.355 -14.093 -2.793 1.00 0.00 C ATOM 335 CG ARG A 22 -4.784 -12.855 -2.021 1.00 0.00 C ATOM 336 CD ARG A 22 -6.262 -12.558 -2.220 1.00 0.00 C ATOM 337 NE ARG A 22 -7.074 -13.042 -1.106 1.00 0.00 N ATOM 338 CZ ARG A 22 -8.310 -12.619 -0.851 1.00 0.00 C ATOM 339 NH1 ARG A 22 -8.881 -11.706 -1.628 1.00 0.00 N ATOM 340 NH2 ARG A 22 -8.979 -13.111 0.183 1.00 0.00 N ATOM 0 H ARG A 22 -5.464 -14.530 -4.939 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.485 -12.707 -4.203 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -5.229 -14.719 -2.974 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.668 -14.674 -2.178 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.580 -12.998 -0.960 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.193 -11.999 -2.346 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -6.404 -11.483 -2.331 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -6.603 -13.022 -3.145 1.00 0.00 H new ATOM 0 HE ARG A 22 -6.670 -13.745 -0.487 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -8.372 -11.325 -2.426 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -9.828 -11.386 -1.427 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.546 -13.813 0.783 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.926 -12.787 0.379 1.00 0.00 H new ATOM 354 N GLU A 23 -2.313 -15.617 -4.954 1.00 0.00 N ATOM 355 CA GLU A 23 -1.092 -16.409 -5.101 1.00 0.00 C ATOM 356 C GLU A 23 -0.399 -16.128 -6.432 1.00 0.00 C ATOM 357 O GLU A 23 0.798 -15.842 -6.470 1.00 0.00 O ATOM 358 CB GLU A 23 -1.410 -17.901 -4.987 1.00 0.00 C ATOM 359 CG GLU A 23 -1.556 -18.383 -3.552 1.00 0.00 C ATOM 360 CD GLU A 23 -2.935 -18.938 -3.258 1.00 0.00 C ATOM 361 OE1 GLU A 23 -3.841 -18.139 -2.936 1.00 0.00 O ATOM 362 OE2 GLU A 23 -3.111 -20.172 -3.349 1.00 0.00 O ATOM 0 H GLU A 23 -3.120 -15.988 -5.456 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.414 -16.121 -4.298 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -2.333 -18.110 -5.528 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.619 -18.471 -5.475 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.810 -19.152 -3.354 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -1.349 -17.556 -2.873 1.00 0.00 H new ATOM 369 N LYS A 24 -1.156 -16.212 -7.522 1.00 0.00 N ATOM 370 CA LYS A 24 -0.613 -15.970 -8.857 1.00 0.00 C ATOM 371 C LYS A 24 -0.714 -14.491 -9.230 1.00 0.00 C ATOM 372 O LYS A 24 -0.852 -14.146 -10.403 1.00 0.00 O ATOM 373 CB LYS A 24 -1.353 -16.822 -9.891 1.00 0.00 C ATOM 374 CG LYS A 24 -0.432 -17.522 -10.875 1.00 0.00 C ATOM 375 CD LYS A 24 -1.114 -17.743 -12.216 1.00 0.00 C ATOM 376 CE LYS A 24 -0.843 -16.595 -13.174 1.00 0.00 C ATOM 377 NZ LYS A 24 0.360 -16.845 -14.015 1.00 0.00 N ATOM 0 H LYS A 24 -2.149 -16.446 -7.508 1.00 0.00 H new ATOM 0 HA LYS A 24 0.440 -16.250 -8.850 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.951 -17.570 -9.371 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -2.046 -16.187 -10.443 1.00 0.00 H new ATOM 0 HG2 LYS A 24 0.470 -16.926 -11.018 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -0.119 -18.481 -10.463 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -0.761 -18.676 -12.655 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -2.189 -17.847 -12.066 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.711 -16.446 -13.817 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.705 -15.674 -12.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 0.510 -16.039 -14.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 1.193 -16.962 -13.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 0.218 -17.710 -14.575 1.00 0.00 H new ATOM 391 N THR A 25 -0.657 -13.627 -8.222 1.00 0.00 N ATOM 392 CA THR A 25 -0.754 -12.188 -8.434 1.00 0.00 C ATOM 393 C THR A 25 0.496 -11.625 -9.101 1.00 0.00 C ATOM 394 O THR A 25 1.576 -12.213 -9.025 1.00 0.00 O ATOM 395 CB THR A 25 -0.971 -11.480 -7.099 1.00 0.00 C ATOM 396 OG1 THR A 25 -1.129 -10.089 -7.296 1.00 0.00 O ATOM 397 CG2 THR A 25 0.172 -11.681 -6.127 1.00 0.00 C ATOM 0 H THR A 25 -0.544 -13.900 -7.246 1.00 0.00 H new ATOM 0 HA THR A 25 -1.601 -12.013 -9.097 1.00 0.00 H new ATOM 0 HB THR A 25 -1.871 -11.924 -6.673 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.486 -9.681 -6.479 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.043 -11.153 -5.198 1.00 0.00 H new ATOM 0 HG22 THR A 25 0.291 -12.745 -5.921 1.00 0.00 H new ATOM 0 HG23 THR A 25 1.092 -11.290 -6.562 1.00 0.00 H new ATOM 405 N SER A 26 0.338 -10.469 -9.738 1.00 0.00 N ATOM 406 CA SER A 26 1.446 -9.794 -10.405 1.00 0.00 C ATOM 407 C SER A 26 1.877 -8.572 -9.594 1.00 0.00 C ATOM 408 O SER A 26 1.055 -7.709 -9.283 1.00 0.00 O ATOM 409 CB SER A 26 1.041 -9.372 -11.817 1.00 0.00 C ATOM 410 OG SER A 26 1.108 -10.465 -12.716 1.00 0.00 O ATOM 0 H SER A 26 -0.553 -9.977 -9.806 1.00 0.00 H new ATOM 0 HA SER A 26 2.285 -10.486 -10.477 1.00 0.00 H new ATOM 0 HB2 SER A 26 0.028 -8.970 -11.803 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.696 -8.572 -12.163 1.00 0.00 H new ATOM 0 HG SER A 26 0.842 -10.169 -13.612 1.00 0.00 H new ATOM 416 N PRO A 27 3.167 -8.479 -9.225 1.00 0.00 N ATOM 417 CA PRO A 27 3.679 -7.353 -8.434 1.00 0.00 C ATOM 418 C PRO A 27 3.692 -6.040 -9.207 1.00 0.00 C ATOM 419 O PRO A 27 3.913 -6.016 -10.418 1.00 0.00 O ATOM 420 CB PRO A 27 5.105 -7.778 -8.084 1.00 0.00 C ATOM 421 CG PRO A 27 5.488 -8.748 -9.149 1.00 0.00 C ATOM 422 CD PRO A 27 4.222 -9.463 -9.533 1.00 0.00 C ATOM 0 HA PRO A 27 3.049 -7.158 -7.566 1.00 0.00 H new ATOM 0 HB2 PRO A 27 5.780 -6.922 -8.068 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.149 -8.237 -7.097 1.00 0.00 H new ATOM 0 HG2 PRO A 27 5.922 -8.234 -10.007 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.238 -9.450 -8.786 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.220 -9.738 -10.588 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.092 -10.383 -8.964 1.00 0.00 H new ATOM 430 N LEU A 28 3.463 -4.945 -8.488 1.00 0.00 N ATOM 431 CA LEU A 28 3.455 -3.613 -9.081 1.00 0.00 C ATOM 432 C LEU A 28 4.119 -2.612 -8.142 1.00 0.00 C ATOM 433 O LEU A 28 3.967 -2.697 -6.920 1.00 0.00 O ATOM 434 CB LEU A 28 2.024 -3.172 -9.404 1.00 0.00 C ATOM 435 CG LEU A 28 1.076 -3.103 -8.203 1.00 0.00 C ATOM 436 CD1 LEU A 28 0.860 -1.660 -7.773 1.00 0.00 C ATOM 437 CD2 LEU A 28 -0.253 -3.767 -8.535 1.00 0.00 C ATOM 0 H LEU A 28 3.279 -4.956 -7.485 1.00 0.00 H new ATOM 0 HA LEU A 28 4.021 -3.648 -10.012 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.061 -2.189 -9.874 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.605 -3.861 -10.138 1.00 0.00 H new ATOM 0 HG LEU A 28 1.533 -3.642 -7.373 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.184 -1.632 -6.919 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.816 -1.217 -7.494 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.425 -1.096 -8.598 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.915 -3.709 -7.671 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.714 -3.256 -9.380 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.083 -4.812 -8.792 1.00 0.00 H new ATOM 449 N LEU A 29 4.868 -1.677 -8.714 1.00 0.00 N ATOM 450 CA LEU A 29 5.570 -0.669 -7.928 1.00 0.00 C ATOM 451 C LEU A 29 4.675 0.532 -7.636 1.00 0.00 C ATOM 452 O LEU A 29 4.118 1.140 -8.549 1.00 0.00 O ATOM 453 CB LEU A 29 6.834 -0.215 -8.668 1.00 0.00 C ATOM 454 CG LEU A 29 7.513 1.033 -8.100 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.765 0.872 -6.609 1.00 0.00 C ATOM 456 CD2 LEU A 29 8.814 1.312 -8.836 1.00 0.00 C ATOM 0 H LEU A 29 5.005 -1.596 -9.721 1.00 0.00 H new ATOM 0 HA LEU A 29 5.850 -1.119 -6.975 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.553 -1.034 -8.661 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.577 -0.026 -9.710 1.00 0.00 H new ATOM 0 HG LEU A 29 6.847 1.884 -8.244 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.248 1.769 -6.223 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.816 0.721 -6.094 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.411 0.011 -6.440 1.00 0.00 H new ATOM 0 HD21 LEU A 29 9.284 2.203 -8.419 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.486 0.461 -8.723 1.00 0.00 H new ATOM 0 HD23 LEU A 29 8.606 1.472 -9.894 1.00 0.00 H new ATOM 468 N LEU A 30 4.547 0.874 -6.355 1.00 0.00 N ATOM 469 CA LEU A 30 3.725 2.011 -5.950 1.00 0.00 C ATOM 470 C LEU A 30 4.474 2.906 -4.959 1.00 0.00 C ATOM 471 O LEU A 30 5.455 2.483 -4.343 1.00 0.00 O ATOM 472 CB LEU A 30 2.399 1.526 -5.356 1.00 0.00 C ATOM 473 CG LEU A 30 2.421 1.201 -3.861 1.00 0.00 C ATOM 474 CD1 LEU A 30 2.237 2.468 -3.043 1.00 0.00 C ATOM 475 CD2 LEU A 30 1.344 0.181 -3.522 1.00 0.00 C ATOM 0 H LEU A 30 5.000 0.383 -5.584 1.00 0.00 H new ATOM 0 HA LEU A 30 3.507 2.608 -6.836 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.642 2.290 -5.532 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.084 0.635 -5.898 1.00 0.00 H new ATOM 0 HG LEU A 30 3.390 0.769 -3.613 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.255 2.221 -1.981 1.00 0.00 H new ATOM 0 HD12 LEU A 30 3.044 3.166 -3.267 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.280 2.927 -3.293 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.374 -0.039 -2.455 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.366 0.585 -3.782 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.520 -0.735 -4.086 1.00 0.00 H new ATOM 487 N ARG A 31 4.007 4.150 -4.828 1.00 0.00 N ATOM 488 CA ARG A 31 4.630 5.124 -3.933 1.00 0.00 C ATOM 489 C ARG A 31 3.980 5.121 -2.552 1.00 0.00 C ATOM 490 O ARG A 31 2.753 5.077 -2.427 1.00 0.00 O ATOM 491 CB ARG A 31 4.550 6.529 -4.546 1.00 0.00 C ATOM 492 CG ARG A 31 3.205 6.848 -5.183 1.00 0.00 C ATOM 493 CD ARG A 31 3.214 6.579 -6.681 1.00 0.00 C ATOM 494 NE ARG A 31 4.312 7.268 -7.359 1.00 0.00 N ATOM 495 CZ ARG A 31 4.163 8.361 -8.106 1.00 0.00 C ATOM 496 NH1 ARG A 31 2.967 8.914 -8.267 1.00 0.00 N ATOM 497 NH2 ARG A 31 5.219 8.907 -8.693 1.00 0.00 N ATOM 0 H ARG A 31 3.196 4.506 -5.334 1.00 0.00 H new ATOM 0 HA ARG A 31 5.675 4.838 -3.810 1.00 0.00 H new ATOM 0 HB2 ARG A 31 4.757 7.266 -3.770 1.00 0.00 H new ATOM 0 HB3 ARG A 31 5.331 6.631 -5.299 1.00 0.00 H new ATOM 0 HG2 ARG A 31 2.427 6.249 -4.710 1.00 0.00 H new ATOM 0 HG3 ARG A 31 2.956 7.894 -5.002 1.00 0.00 H new ATOM 0 HD2 ARG A 31 3.298 5.506 -6.855 1.00 0.00 H new ATOM 0 HD3 ARG A 31 2.265 6.899 -7.112 1.00 0.00 H new ATOM 0 HE ARG A 31 5.252 6.887 -7.253 1.00 0.00 H new ATOM 0 HH11 ARG A 31 2.150 8.502 -7.816 1.00 0.00 H new ATOM 0 HH12 ARG A 31 2.865 9.751 -8.841 1.00 0.00 H new ATOM 0 HH21 ARG A 31 6.142 8.490 -8.572 1.00 0.00 H new ATOM 0 HH22 ARG A 31 5.108 9.744 -9.266 1.00 0.00 H new ATOM 511 N VAL A 32 4.817 5.170 -1.515 1.00 0.00 N ATOM 512 CA VAL A 32 4.336 5.168 -0.132 1.00 0.00 C ATOM 513 C VAL A 32 5.074 6.197 0.721 1.00 0.00 C ATOM 514 O VAL A 32 6.294 6.316 0.639 1.00 0.00 O ATOM 515 CB VAL A 32 4.507 3.787 0.527 1.00 0.00 C ATOM 516 CG1 VAL A 32 3.286 2.920 0.278 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.771 3.103 0.026 1.00 0.00 C ATOM 0 H VAL A 32 5.832 5.212 -1.606 1.00 0.00 H new ATOM 0 HA VAL A 32 3.277 5.422 -0.180 1.00 0.00 H new ATOM 0 HB VAL A 32 4.606 3.931 1.603 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.427 1.949 0.752 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.404 3.404 0.698 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.149 2.784 -0.795 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.872 2.129 0.505 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.710 2.972 -1.054 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.638 3.718 0.268 1.00 0.00 H new ATOM 527 N PHE A 33 4.328 6.922 1.549 1.00 0.00 N ATOM 528 CA PHE A 33 4.911 7.925 2.431 1.00 0.00 C ATOM 529 C PHE A 33 4.710 7.511 3.880 1.00 0.00 C ATOM 530 O PHE A 33 3.598 7.563 4.402 1.00 0.00 O ATOM 531 CB PHE A 33 4.278 9.291 2.166 1.00 0.00 C ATOM 532 CG PHE A 33 4.218 9.633 0.706 1.00 0.00 C ATOM 533 CD1 PHE A 33 3.379 8.933 -0.144 1.00 0.00 C ATOM 534 CD2 PHE A 33 5.006 10.645 0.184 1.00 0.00 C ATOM 535 CE1 PHE A 33 3.326 9.234 -1.490 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.959 10.951 -1.162 1.00 0.00 C ATOM 537 CZ PHE A 33 4.118 10.245 -2.001 1.00 0.00 C ATOM 0 H PHE A 33 3.315 6.832 1.627 1.00 0.00 H new ATOM 0 HA PHE A 33 5.980 8.001 2.234 1.00 0.00 H new ATOM 0 HB2 PHE A 33 3.269 9.305 2.579 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.848 10.058 2.691 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.759 8.142 0.251 1.00 0.00 H new ATOM 0 HD2 PHE A 33 5.664 11.201 0.836 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.667 8.681 -2.143 1.00 0.00 H new ATOM 0 HE2 PHE A 33 5.579 11.741 -1.558 1.00 0.00 H new ATOM 0 HZ PHE A 33 4.080 10.483 -3.054 1.00 0.00 H new ATOM 547 N THR A 34 5.789 7.068 4.513 1.00 0.00 N ATOM 548 CA THR A 34 5.726 6.605 5.892 1.00 0.00 C ATOM 549 C THR A 34 6.382 7.585 6.859 1.00 0.00 C ATOM 550 O THR A 34 7.557 7.924 6.722 1.00 0.00 O ATOM 551 CB THR A 34 6.400 5.236 6.013 1.00 0.00 C ATOM 552 OG1 THR A 34 7.217 4.977 4.885 1.00 0.00 O ATOM 553 CG2 THR A 34 5.419 4.093 6.135 1.00 0.00 C ATOM 0 H THR A 34 6.717 7.020 4.093 1.00 0.00 H new ATOM 0 HA THR A 34 4.673 6.529 6.162 1.00 0.00 H new ATOM 0 HB THR A 34 6.990 5.288 6.928 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.151 5.177 5.105 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.964 3.153 6.217 1.00 0.00 H new ATOM 0 HG22 THR A 34 4.804 4.235 7.024 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.780 4.066 5.252 1.00 0.00 H new ATOM 561 N THR A 35 5.616 8.005 7.859 1.00 0.00 N ATOM 562 CA THR A 35 6.125 8.910 8.885 1.00 0.00 C ATOM 563 C THR A 35 6.482 8.095 10.131 1.00 0.00 C ATOM 564 O THR A 35 6.050 6.949 10.252 1.00 0.00 O ATOM 565 CB THR A 35 5.103 10.013 9.220 1.00 0.00 C ATOM 566 OG1 THR A 35 5.217 10.416 10.578 1.00 0.00 O ATOM 567 CG2 THR A 35 3.660 9.615 8.971 1.00 0.00 C ATOM 0 H THR A 35 4.640 7.734 7.982 1.00 0.00 H new ATOM 0 HA THR A 35 7.018 9.410 8.509 1.00 0.00 H new ATOM 0 HB THR A 35 5.347 10.832 8.543 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.560 11.118 10.767 1.00 0.00 H new ATOM 0 HG21 THR A 35 3.003 10.445 9.231 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.528 9.364 7.918 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.410 8.749 9.584 1.00 0.00 H new ATOM 575 N ASN A 36 7.268 8.663 11.047 1.00 0.00 N ATOM 576 CA ASN A 36 7.663 7.936 12.249 1.00 0.00 C ATOM 577 C ASN A 36 6.883 8.411 13.470 1.00 0.00 C ATOM 578 O ASN A 36 7.380 8.344 14.597 1.00 0.00 O ATOM 579 CB ASN A 36 9.164 8.096 12.491 1.00 0.00 C ATOM 580 CG ASN A 36 9.659 7.241 13.641 1.00 0.00 C ATOM 581 OD1 ASN A 36 10.370 7.721 14.527 1.00 0.00 O ATOM 582 ND2 ASN A 36 9.289 5.965 13.637 1.00 0.00 N ATOM 0 H ASN A 36 7.638 9.611 10.980 1.00 0.00 H new ATOM 0 HA ASN A 36 7.433 6.882 12.093 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.706 7.829 11.584 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.386 9.143 12.698 1.00 0.00 H new ATOM 0 HD21 ASN A 36 9.594 5.343 14.386 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.700 5.607 12.885 1.00 0.00 H new ATOM 589 N ASN A 37 5.665 8.883 13.248 1.00 0.00 N ATOM 590 CA ASN A 37 4.825 9.360 14.343 1.00 0.00 C ATOM 591 C ASN A 37 3.366 8.961 14.141 1.00 0.00 C ATOM 592 O ASN A 37 2.481 9.399 14.877 1.00 0.00 O ATOM 593 CB ASN A 37 4.934 10.879 14.472 1.00 0.00 C ATOM 594 CG ASN A 37 4.856 11.343 15.913 1.00 0.00 C ATOM 595 OD1 ASN A 37 3.918 11.008 16.634 1.00 0.00 O ATOM 596 ND2 ASN A 37 5.845 12.120 16.339 1.00 0.00 N ATOM 0 H ASN A 37 5.236 8.947 12.325 1.00 0.00 H new ATOM 0 HA ASN A 37 5.181 8.893 15.261 1.00 0.00 H new ATOM 0 HB2 ASN A 37 5.876 11.211 14.037 1.00 0.00 H new ATOM 0 HB3 ASN A 37 4.135 11.348 13.898 1.00 0.00 H new ATOM 0 HD21 ASN A 37 5.846 12.464 17.299 1.00 0.00 H new ATOM 0 HD22 ASN A 37 6.604 12.373 15.706 1.00 0.00 H new ATOM 603 N GLY A 38 3.114 8.127 13.136 1.00 0.00 N ATOM 604 CA GLY A 38 1.749 7.688 12.860 1.00 0.00 C ATOM 605 C GLY A 38 0.782 8.851 12.790 1.00 0.00 C ATOM 606 O GLY A 38 -0.200 8.896 13.531 1.00 0.00 O ATOM 0 H GLY A 38 3.823 7.747 12.509 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.728 7.142 11.917 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.427 6.995 13.637 1.00 0.00 H new ATOM 610 N ARG A 39 1.070 9.805 11.911 1.00 0.00 N ATOM 611 CA ARG A 39 0.222 10.983 11.768 1.00 0.00 C ATOM 612 C ARG A 39 -0.271 11.165 10.339 1.00 0.00 C ATOM 613 O ARG A 39 0.519 11.274 9.401 1.00 0.00 O ATOM 614 CB ARG A 39 0.981 12.232 12.209 1.00 0.00 C ATOM 615 CG ARG A 39 1.333 12.243 13.686 1.00 0.00 C ATOM 616 CD ARG A 39 0.141 12.642 14.541 1.00 0.00 C ATOM 617 NE ARG A 39 0.085 11.887 15.790 1.00 0.00 N ATOM 618 CZ ARG A 39 -1.005 11.783 16.547 1.00 0.00 C ATOM 619 NH1 ARG A 39 -2.130 12.386 16.186 1.00 0.00 N ATOM 620 NH2 ARG A 39 -0.968 11.076 17.667 1.00 0.00 N ATOM 0 H ARG A 39 1.879 9.786 11.290 1.00 0.00 H new ATOM 0 HA ARG A 39 -0.650 10.833 12.405 1.00 0.00 H new ATOM 0 HB2 ARG A 39 1.898 12.314 11.625 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.379 13.112 11.982 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.682 11.255 13.985 1.00 0.00 H new ATOM 0 HG3 ARG A 39 2.155 12.937 13.860 1.00 0.00 H new ATOM 0 HD2 ARG A 39 0.195 13.708 14.764 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -0.779 12.481 13.979 1.00 0.00 H new ATOM 0 HE ARG A 39 0.932 11.411 16.101 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -2.162 12.932 15.325 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -2.963 12.303 16.769 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -0.105 10.612 17.949 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -1.803 10.996 18.247 1.00 0.00 H new ATOM 864 N GLU A 55 9.288 9.127 1.294 1.00 0.00 N ATOM 865 CA GLU A 55 8.566 8.140 0.500 1.00 0.00 C ATOM 866 C GLU A 55 9.464 6.963 0.122 1.00 0.00 C ATOM 867 O GLU A 55 10.669 7.125 -0.071 1.00 0.00 O ATOM 868 CB GLU A 55 8.001 8.790 -0.763 1.00 0.00 C ATOM 869 CG GLU A 55 9.058 9.451 -1.633 1.00 0.00 C ATOM 870 CD GLU A 55 8.717 9.392 -3.109 1.00 0.00 C ATOM 871 OE1 GLU A 55 7.560 9.702 -3.464 1.00 0.00 O ATOM 872 OE2 GLU A 55 9.607 9.037 -3.911 1.00 0.00 O ATOM 0 HA GLU A 55 7.746 7.758 1.108 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.481 8.033 -1.350 1.00 0.00 H new ATOM 0 HB3 GLU A 55 7.260 9.536 -0.477 1.00 0.00 H new ATOM 0 HG2 GLU A 55 9.173 10.492 -1.331 1.00 0.00 H new ATOM 0 HG3 GLU A 55 10.018 8.963 -1.466 1.00 0.00 H new ATOM 879 N LEU A 56 8.861 5.783 0.008 1.00 0.00 N ATOM 880 CA LEU A 56 9.598 4.577 -0.358 1.00 0.00 C ATOM 881 C LEU A 56 8.888 3.827 -1.480 1.00 0.00 C ATOM 882 O LEU A 56 7.811 4.225 -1.923 1.00 0.00 O ATOM 883 CB LEU A 56 9.789 3.643 0.848 1.00 0.00 C ATOM 884 CG LEU A 56 8.931 3.943 2.084 1.00 0.00 C ATOM 885 CD1 LEU A 56 7.797 2.934 2.211 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.791 3.927 3.337 1.00 0.00 C ATOM 0 H LEU A 56 7.864 5.636 0.164 1.00 0.00 H new ATOM 0 HA LEU A 56 10.581 4.895 -0.706 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.581 2.623 0.527 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.838 3.676 1.143 1.00 0.00 H new ATOM 0 HG LEU A 56 8.496 4.936 1.967 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.201 3.165 3.094 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.165 2.983 1.324 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.212 1.930 2.306 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.170 4.141 4.207 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.249 2.945 3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.571 4.684 3.253 1.00 0.00 H new ATOM 898 N GLN A 57 9.501 2.738 -1.930 1.00 0.00 N ATOM 899 CA GLN A 57 8.936 1.926 -3.000 1.00 0.00 C ATOM 900 C GLN A 57 8.543 0.544 -2.483 1.00 0.00 C ATOM 901 O GLN A 57 9.285 -0.076 -1.721 1.00 0.00 O ATOM 902 CB GLN A 57 9.944 1.787 -4.142 1.00 0.00 C ATOM 903 CG GLN A 57 10.380 3.118 -4.735 1.00 0.00 C ATOM 904 CD GLN A 57 9.263 3.818 -5.484 1.00 0.00 C ATOM 905 OE1 GLN A 57 9.115 3.656 -6.697 1.00 0.00 O ATOM 906 NE2 GLN A 57 8.470 4.603 -4.767 1.00 0.00 N ATOM 0 H GLN A 57 10.392 2.397 -1.569 1.00 0.00 H new ATOM 0 HA GLN A 57 8.040 2.424 -3.370 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.823 1.256 -3.777 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.506 1.174 -4.930 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.739 3.767 -3.936 1.00 0.00 H new ATOM 0 HG3 GLN A 57 11.218 2.953 -5.412 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.628 4.709 -3.765 1.00 0.00 H new ATOM 0 HE22 GLN A 57 7.702 5.101 -5.218 1.00 0.00 H new ATOM 915 N ILE A 58 7.376 0.065 -2.902 1.00 0.00 N ATOM 916 CA ILE A 58 6.891 -1.248 -2.476 1.00 0.00 C ATOM 917 C ILE A 58 6.349 -2.051 -3.652 1.00 0.00 C ATOM 918 O ILE A 58 5.420 -1.620 -4.334 1.00 0.00 O ATOM 919 CB ILE A 58 5.777 -1.141 -1.415 1.00 0.00 C ATOM 920 CG1 ILE A 58 5.006 0.171 -1.553 1.00 0.00 C ATOM 921 CG2 ILE A 58 6.365 -1.270 -0.021 1.00 0.00 C ATOM 922 CD1 ILE A 58 3.546 0.050 -1.176 1.00 0.00 C ATOM 0 H ILE A 58 6.749 0.563 -3.534 1.00 0.00 H new ATOM 0 HA ILE A 58 7.753 -1.756 -2.043 1.00 0.00 H new ATOM 0 HB ILE A 58 5.075 -1.959 -1.577 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.475 0.928 -0.924 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.080 0.521 -2.582 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.568 -1.193 0.719 1.00 0.00 H new ATOM 0 HG22 ILE A 58 6.859 -2.237 0.077 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.091 -0.473 0.143 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.058 1.017 -1.297 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.063 -0.683 -1.822 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.464 -0.271 -0.138 1.00 0.00 H new ATOM 934 N TYR A 59 6.914 -3.233 -3.862 1.00 0.00 N ATOM 935 CA TYR A 59 6.462 -4.108 -4.932 1.00 0.00 C ATOM 936 C TYR A 59 5.364 -5.018 -4.400 1.00 0.00 C ATOM 937 O TYR A 59 5.613 -6.168 -4.035 1.00 0.00 O ATOM 938 CB TYR A 59 7.625 -4.939 -5.477 1.00 0.00 C ATOM 939 CG TYR A 59 8.410 -4.240 -6.565 1.00 0.00 C ATOM 940 CD1 TYR A 59 9.159 -3.104 -6.286 1.00 0.00 C ATOM 941 CD2 TYR A 59 8.399 -4.716 -7.872 1.00 0.00 C ATOM 942 CE1 TYR A 59 9.877 -2.462 -7.277 1.00 0.00 C ATOM 943 CE2 TYR A 59 9.114 -4.079 -8.868 1.00 0.00 C ATOM 944 CZ TYR A 59 9.851 -2.952 -8.565 1.00 0.00 C ATOM 945 OH TYR A 59 10.565 -2.315 -9.555 1.00 0.00 O ATOM 0 H TYR A 59 7.684 -3.606 -3.306 1.00 0.00 H new ATOM 0 HA TYR A 59 6.070 -3.503 -5.750 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.299 -5.188 -4.657 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.237 -5.880 -5.867 1.00 0.00 H new ATOM 0 HD1 TYR A 59 9.181 -2.716 -5.278 1.00 0.00 H new ATOM 0 HD2 TYR A 59 7.823 -5.597 -8.112 1.00 0.00 H new ATOM 0 HE1 TYR A 59 10.456 -1.581 -7.043 1.00 0.00 H new ATOM 0 HE2 TYR A 59 9.096 -4.461 -9.878 1.00 0.00 H new ATOM 0 HH TYR A 59 10.441 -2.788 -10.404 1.00 0.00 H new ATOM 955 N THR A 60 4.148 -4.487 -4.343 1.00 0.00 N ATOM 956 CA THR A 60 3.008 -5.237 -3.837 1.00 0.00 C ATOM 957 C THR A 60 2.015 -5.543 -4.950 1.00 0.00 C ATOM 958 O THR A 60 2.242 -5.199 -6.110 1.00 0.00 O ATOM 959 CB THR A 60 2.311 -4.452 -2.722 1.00 0.00 C ATOM 960 OG1 THR A 60 1.357 -5.262 -2.060 1.00 0.00 O ATOM 961 CG2 THR A 60 1.597 -3.212 -3.213 1.00 0.00 C ATOM 0 H THR A 60 3.927 -3.537 -4.642 1.00 0.00 H new ATOM 0 HA THR A 60 3.378 -6.181 -3.437 1.00 0.00 H new ATOM 0 HB THR A 60 3.109 -4.146 -2.046 1.00 0.00 H new ATOM 0 HG1 THR A 60 1.716 -6.167 -1.950 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.126 -2.706 -2.370 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.315 -2.541 -3.684 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.834 -3.495 -3.939 1.00 0.00 H new ATOM 969 N TRP A 61 0.904 -6.178 -4.594 1.00 0.00 N ATOM 970 CA TRP A 61 -0.122 -6.507 -5.576 1.00 0.00 C ATOM 971 C TRP A 61 -1.501 -6.023 -5.139 1.00 0.00 C ATOM 972 O TRP A 61 -1.995 -6.373 -4.072 1.00 0.00 O ATOM 973 CB TRP A 61 -0.151 -8.005 -5.880 1.00 0.00 C ATOM 974 CG TRP A 61 -0.274 -8.889 -4.678 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.364 -9.628 -4.317 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.731 -9.142 -3.694 1.00 0.00 C ATOM 977 NE1 TRP A 61 -1.095 -10.331 -3.168 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.184 -10.046 -2.762 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.042 -8.692 -3.506 1.00 0.00 C ATOM 980 CZ2 TRP A 61 0.903 -10.510 -1.665 1.00 0.00 C ATOM 981 CZ3 TRP A 61 2.754 -9.152 -2.415 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.184 -10.054 -1.507 1.00 0.00 C ATOM 0 H TRP A 61 0.692 -6.473 -3.641 1.00 0.00 H new ATOM 0 HA TRP A 61 0.142 -5.981 -6.493 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -0.986 -8.209 -6.550 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.760 -8.270 -6.416 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.300 -9.656 -4.856 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.741 -10.962 -2.694 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.490 -7.997 -4.201 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.466 -11.205 -0.963 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 3.767 -8.811 -2.260 1.00 0.00 H new ATOM 0 HH2 TRP A 61 2.767 -10.397 -0.665 1.00 0.00 H new ATOM 993 N MET A 62 -2.095 -5.198 -5.996 1.00 0.00 N ATOM 994 CA MET A 62 -3.421 -4.607 -5.760 1.00 0.00 C ATOM 995 C MET A 62 -4.340 -5.509 -4.923 1.00 0.00 C ATOM 996 O MET A 62 -5.115 -5.016 -4.102 1.00 0.00 O ATOM 997 CB MET A 62 -4.100 -4.300 -7.098 1.00 0.00 C ATOM 998 CG MET A 62 -4.924 -3.024 -7.085 1.00 0.00 C ATOM 999 SD MET A 62 -4.308 -1.787 -8.246 1.00 0.00 S ATOM 1000 CE MET A 62 -2.956 -1.086 -7.304 1.00 0.00 C ATOM 0 H MET A 62 -1.673 -4.915 -6.880 1.00 0.00 H new ATOM 0 HA MET A 62 -3.258 -3.691 -5.192 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.338 -4.222 -7.873 1.00 0.00 H new ATOM 0 HB3 MET A 62 -4.745 -5.136 -7.368 1.00 0.00 H new ATOM 0 HG2 MET A 62 -5.959 -3.262 -7.329 1.00 0.00 H new ATOM 0 HG3 MET A 62 -4.922 -2.605 -6.079 1.00 0.00 H new ATOM 0 HE1 MET A 62 -2.221 -0.657 -7.986 1.00 0.00 H new ATOM 0 HE2 MET A 62 -3.338 -0.306 -6.645 1.00 0.00 H new ATOM 0 HE3 MET A 62 -2.485 -1.867 -6.707 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.254 -6.818 -5.134 1.00 0.00 N ATOM 1011 CA ASP A 63 -5.086 -7.766 -4.396 1.00 0.00 C ATOM 1012 C ASP A 63 -4.342 -8.348 -3.193 1.00 0.00 C ATOM 1013 O ASP A 63 -4.590 -9.483 -2.789 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.550 -8.891 -5.317 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.830 -9.544 -4.836 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -6.960 -9.765 -3.613 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.704 -9.832 -5.679 1.00 0.00 O ATOM 0 H ASP A 63 -3.619 -7.247 -5.807 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.955 -7.224 -4.024 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -5.703 -8.495 -6.321 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -4.766 -9.645 -5.388 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.427 -7.565 -2.630 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.645 -8.002 -1.479 1.00 0.00 C ATOM 1024 C ALA A 64 -3.326 -7.620 -0.172 1.00 0.00 C ATOM 1025 O ALA A 64 -3.914 -6.544 -0.058 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.248 -7.397 -1.529 1.00 0.00 C ATOM 0 H ALA A 64 -3.209 -6.623 -2.953 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.569 -9.089 -1.521 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.675 -7.732 -0.664 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.746 -7.716 -2.442 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.322 -6.310 -1.517 1.00 0.00 H new ATOM 1032 N THR A 65 -3.234 -8.501 0.818 1.00 0.00 N ATOM 1033 CA THR A 65 -3.832 -8.241 2.119 1.00 0.00 C ATOM 1034 C THR A 65 -2.994 -7.227 2.890 1.00 0.00 C ATOM 1035 O THR A 65 -1.768 -7.200 2.764 1.00 0.00 O ATOM 1036 CB THR A 65 -3.963 -9.537 2.923 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.113 -10.541 2.401 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.373 -10.088 2.938 1.00 0.00 C ATOM 0 H THR A 65 -2.753 -9.397 0.744 1.00 0.00 H new ATOM 0 HA THR A 65 -4.830 -7.830 1.963 1.00 0.00 H new ATOM 0 HB THR A 65 -3.680 -9.276 3.943 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.211 -11.360 2.930 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.398 -11.007 3.524 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.045 -9.355 3.383 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.692 -10.300 1.917 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.660 -6.392 3.687 1.00 0.00 N ATOM 1047 CA LEU A 66 -2.975 -5.371 4.474 1.00 0.00 C ATOM 1048 C LEU A 66 -1.724 -5.940 5.133 1.00 0.00 C ATOM 1049 O LEU A 66 -0.742 -5.227 5.346 1.00 0.00 O ATOM 1050 CB LEU A 66 -3.914 -4.791 5.534 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.752 -3.600 5.066 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -5.706 -3.151 6.163 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -3.849 -2.451 4.635 1.00 0.00 C ATOM 0 H LEU A 66 -4.673 -6.404 3.804 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.673 -4.571 3.798 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.586 -5.579 5.874 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.321 -4.484 6.396 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.345 -3.913 4.207 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.293 -2.303 5.810 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.374 -3.972 6.422 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -5.135 -2.856 7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.461 -1.612 4.305 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.230 -2.140 5.476 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -3.210 -2.779 3.815 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.761 -7.231 5.449 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.622 -7.890 6.075 1.00 0.00 C ATOM 1067 C LYS A 67 0.606 -7.815 5.177 1.00 0.00 C ATOM 1068 O LYS A 67 1.690 -7.429 5.615 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.945 -9.351 6.409 1.00 0.00 C ATOM 1070 CG LYS A 67 -1.778 -10.064 5.354 1.00 0.00 C ATOM 1071 CD LYS A 67 -1.284 -11.483 5.118 1.00 0.00 C ATOM 1072 CE LYS A 67 -2.056 -12.489 5.958 1.00 0.00 C ATOM 1073 NZ LYS A 67 -2.476 -13.674 5.161 1.00 0.00 N ATOM 0 H LYS A 67 -2.564 -7.838 5.283 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.406 -7.366 7.006 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -0.011 -9.895 6.547 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -1.477 -9.385 7.360 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -2.821 -10.089 5.668 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -1.740 -9.504 4.419 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -1.386 -11.734 4.062 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -0.223 -11.545 5.359 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -1.437 -12.815 6.794 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -2.937 -12.007 6.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -2.999 -14.335 5.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -3.088 -13.367 4.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.635 -14.150 4.776 1.00 0.00 H new ATOM 1087 N GLU A 68 0.436 -8.169 3.908 1.00 0.00 N ATOM 1088 CA GLU A 68 1.536 -8.128 2.948 1.00 0.00 C ATOM 1089 C GLU A 68 2.132 -6.727 2.877 1.00 0.00 C ATOM 1090 O GLU A 68 3.343 -6.557 2.731 1.00 0.00 O ATOM 1091 CB GLU A 68 1.045 -8.558 1.566 1.00 0.00 C ATOM 1092 CG GLU A 68 0.583 -10.003 1.515 1.00 0.00 C ATOM 1093 CD GLU A 68 1.739 -10.985 1.505 1.00 0.00 C ATOM 1094 OE1 GLU A 68 2.729 -10.742 2.224 1.00 0.00 O ATOM 1095 OE2 GLU A 68 1.652 -11.996 0.776 1.00 0.00 O ATOM 0 H GLU A 68 -0.452 -8.487 3.519 1.00 0.00 H new ATOM 0 HA GLU A 68 2.310 -8.819 3.281 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.223 -7.910 1.263 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.847 -8.415 0.842 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.055 -10.207 2.375 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.026 -10.155 0.624 1.00 0.00 H new ATOM 1102 N LEU A 69 1.268 -5.726 2.990 1.00 0.00 N ATOM 1103 CA LEU A 69 1.702 -4.336 2.950 1.00 0.00 C ATOM 1104 C LEU A 69 2.424 -3.963 4.243 1.00 0.00 C ATOM 1105 O LEU A 69 3.262 -3.061 4.262 1.00 0.00 O ATOM 1106 CB LEU A 69 0.509 -3.404 2.718 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.274 -3.658 1.425 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.672 -3.851 0.249 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.184 -4.865 1.585 1.00 0.00 C ATOM 0 H LEU A 69 0.263 -5.851 3.110 1.00 0.00 H new ATOM 0 HA LEU A 69 2.397 -4.219 2.119 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.174 -3.497 3.562 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.868 -2.375 2.711 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.892 -2.784 1.221 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.094 -4.030 -0.658 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.280 -2.956 0.121 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.320 -4.706 0.440 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.733 -5.032 0.658 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.584 -5.745 1.815 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.889 -4.684 2.397 1.00 0.00 H new ATOM 1121 N THR A 70 2.100 -4.673 5.320 1.00 0.00 N ATOM 1122 CA THR A 70 2.723 -4.431 6.615 1.00 0.00 C ATOM 1123 C THR A 70 4.195 -4.817 6.573 1.00 0.00 C ATOM 1124 O THR A 70 5.029 -4.190 7.222 1.00 0.00 O ATOM 1125 CB THR A 70 2.005 -5.226 7.706 1.00 0.00 C ATOM 1126 OG1 THR A 70 0.635 -4.874 7.765 1.00 0.00 O ATOM 1127 CG2 THR A 70 2.591 -5.021 9.087 1.00 0.00 C ATOM 0 H THR A 70 1.408 -5.422 5.320 1.00 0.00 H new ATOM 0 HA THR A 70 2.644 -3.368 6.844 1.00 0.00 H new ATOM 0 HB THR A 70 2.134 -6.272 7.428 1.00 0.00 H new ATOM 0 HG1 THR A 70 0.538 -4.012 8.221 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.033 -5.615 9.811 1.00 0.00 H new ATOM 0 HG22 THR A 70 3.635 -5.334 9.089 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.527 -3.967 9.356 1.00 0.00 H new ATOM 1135 N SER A 71 4.506 -5.853 5.799 1.00 0.00 N ATOM 1136 CA SER A 71 5.879 -6.326 5.666 1.00 0.00 C ATOM 1137 C SER A 71 6.635 -5.525 4.610 1.00 0.00 C ATOM 1138 O SER A 71 7.798 -5.176 4.801 1.00 0.00 O ATOM 1139 CB SER A 71 5.896 -7.813 5.305 1.00 0.00 C ATOM 1140 OG SER A 71 6.882 -8.509 6.049 1.00 0.00 O ATOM 0 H SER A 71 3.824 -6.381 5.254 1.00 0.00 H new ATOM 0 HA SER A 71 6.378 -6.186 6.625 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.916 -8.248 5.499 1.00 0.00 H new ATOM 0 HB3 SER A 71 6.091 -7.929 4.239 1.00 0.00 H new ATOM 0 HG SER A 71 6.871 -9.457 5.801 1.00 0.00 H new ATOM 1146 N LEU A 72 5.970 -5.239 3.497 1.00 0.00 N ATOM 1147 CA LEU A 72 6.580 -4.479 2.408 1.00 0.00 C ATOM 1148 C LEU A 72 7.142 -3.146 2.905 1.00 0.00 C ATOM 1149 O LEU A 72 8.286 -2.799 2.604 1.00 0.00 O ATOM 1150 CB LEU A 72 5.553 -4.248 1.300 1.00 0.00 C ATOM 1151 CG LEU A 72 5.191 -5.496 0.493 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.759 -5.413 -0.014 1.00 0.00 C ATOM 1153 CD2 LEU A 72 6.161 -5.677 -0.665 1.00 0.00 C ATOM 0 H LEU A 72 5.006 -5.522 3.323 1.00 0.00 H new ATOM 0 HA LEU A 72 7.413 -5.059 2.010 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.644 -3.843 1.745 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.939 -3.490 0.618 1.00 0.00 H new ATOM 0 HG LEU A 72 5.268 -6.364 1.148 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.523 -6.311 -0.585 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.077 -5.332 0.833 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.650 -4.537 -0.653 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.891 -6.569 -1.230 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.114 -4.806 -1.318 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.174 -5.786 -0.277 1.00 0.00 H new ATOM 1165 N VAL A 73 6.342 -2.405 3.672 1.00 0.00 N ATOM 1166 CA VAL A 73 6.776 -1.118 4.210 1.00 0.00 C ATOM 1167 C VAL A 73 7.777 -1.305 5.348 1.00 0.00 C ATOM 1168 O VAL A 73 8.807 -0.638 5.398 1.00 0.00 O ATOM 1169 CB VAL A 73 5.580 -0.288 4.721 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.046 1.040 5.308 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.579 -0.052 3.600 1.00 0.00 C ATOM 0 H VAL A 73 5.393 -2.674 3.933 1.00 0.00 H new ATOM 0 HA VAL A 73 7.257 -0.581 3.393 1.00 0.00 H new ATOM 0 HB VAL A 73 5.090 -0.854 5.513 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.183 1.605 5.660 1.00 0.00 H new ATOM 0 HG12 VAL A 73 6.722 0.852 6.142 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.567 1.614 4.541 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.742 0.535 3.977 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.064 0.489 2.787 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.213 -1.010 3.231 1.00 0.00 H new ATOM 1181 N LYS A 74 7.463 -2.211 6.268 1.00 0.00 N ATOM 1182 CA LYS A 74 8.332 -2.475 7.409 1.00 0.00 C ATOM 1183 C LYS A 74 9.706 -2.977 6.956 1.00 0.00 C ATOM 1184 O LYS A 74 10.717 -2.704 7.603 1.00 0.00 O ATOM 1185 CB LYS A 74 7.654 -3.487 8.347 1.00 0.00 C ATOM 1186 CG LYS A 74 8.608 -4.357 9.154 1.00 0.00 C ATOM 1187 CD LYS A 74 8.683 -5.764 8.582 1.00 0.00 C ATOM 1188 CE LYS A 74 8.602 -6.817 9.676 1.00 0.00 C ATOM 1189 NZ LYS A 74 9.561 -7.933 9.443 1.00 0.00 N ATOM 0 H LYS A 74 6.613 -2.775 6.246 1.00 0.00 H new ATOM 0 HA LYS A 74 8.494 -1.543 7.951 1.00 0.00 H new ATOM 0 HB2 LYS A 74 7.009 -2.944 9.038 1.00 0.00 H new ATOM 0 HB3 LYS A 74 7.010 -4.135 7.753 1.00 0.00 H new ATOM 0 HG2 LYS A 74 9.601 -3.908 9.155 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.276 -4.400 10.191 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.870 -5.913 7.872 1.00 0.00 H new ATOM 0 HD3 LYS A 74 9.615 -5.884 8.029 1.00 0.00 H new ATOM 0 HE2 LYS A 74 8.810 -6.355 10.641 1.00 0.00 H new ATOM 0 HE3 LYS A 74 7.588 -7.214 9.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 9.475 -8.630 10.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 9.347 -8.390 8.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 10.531 -7.559 9.422 1.00 0.00 H new ATOM 1203 N GLU A 75 9.739 -3.708 5.846 1.00 0.00 N ATOM 1204 CA GLU A 75 10.991 -4.241 5.319 1.00 0.00 C ATOM 1205 C GLU A 75 11.818 -3.136 4.670 1.00 0.00 C ATOM 1206 O GLU A 75 13.048 -3.154 4.715 1.00 0.00 O ATOM 1207 CB GLU A 75 10.719 -5.359 4.311 1.00 0.00 C ATOM 1208 CG GLU A 75 11.895 -6.304 4.119 1.00 0.00 C ATOM 1209 CD GLU A 75 11.490 -7.614 3.471 1.00 0.00 C ATOM 1210 OE1 GLU A 75 10.766 -8.399 4.121 1.00 0.00 O ATOM 1211 OE2 GLU A 75 11.900 -7.858 2.318 1.00 0.00 O ATOM 0 H GLU A 75 8.914 -3.945 5.295 1.00 0.00 H new ATOM 0 HA GLU A 75 11.559 -4.654 6.152 1.00 0.00 H new ATOM 0 HB2 GLU A 75 9.853 -5.932 4.642 1.00 0.00 H new ATOM 0 HB3 GLU A 75 10.459 -4.915 3.350 1.00 0.00 H new ATOM 0 HG2 GLU A 75 12.651 -5.817 3.503 1.00 0.00 H new ATOM 0 HG3 GLU A 75 12.354 -6.508 5.086 1.00 0.00 H new ATOM 1218 N VAL A 76 11.130 -2.167 4.073 1.00 0.00 N ATOM 1219 CA VAL A 76 11.796 -1.043 3.421 1.00 0.00 C ATOM 1220 C VAL A 76 12.152 0.034 4.444 1.00 0.00 C ATOM 1221 O VAL A 76 13.124 0.769 4.275 1.00 0.00 O ATOM 1222 CB VAL A 76 10.903 -0.428 2.322 1.00 0.00 C ATOM 1223 CG1 VAL A 76 9.558 -0.029 2.889 1.00 0.00 C ATOM 1224 CG2 VAL A 76 11.576 0.766 1.666 1.00 0.00 C ATOM 0 H VAL A 76 10.111 -2.137 4.027 1.00 0.00 H new ATOM 0 HA VAL A 76 12.708 -1.423 2.961 1.00 0.00 H new ATOM 0 HB VAL A 76 10.748 -1.189 1.557 1.00 0.00 H new ATOM 0 HG11 VAL A 76 8.943 0.402 2.099 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.060 -0.908 3.297 1.00 0.00 H new ATOM 0 HG13 VAL A 76 9.701 0.707 3.680 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.921 1.176 0.897 1.00 0.00 H new ATOM 0 HG22 VAL A 76 11.775 1.530 2.418 1.00 0.00 H new ATOM 0 HG23 VAL A 76 12.515 0.450 1.212 1.00 0.00 H new ATOM 1234 N TYR A 77 11.355 0.117 5.503 1.00 0.00 N ATOM 1235 CA TYR A 77 11.574 1.098 6.559 1.00 0.00 C ATOM 1236 C TYR A 77 12.250 0.450 7.769 1.00 0.00 C ATOM 1237 O TYR A 77 11.697 -0.464 8.379 1.00 0.00 O ATOM 1238 CB TYR A 77 10.242 1.725 6.971 1.00 0.00 C ATOM 1239 CG TYR A 77 10.329 3.206 7.253 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.317 3.718 8.085 1.00 0.00 C ATOM 1241 CD2 TYR A 77 9.423 4.093 6.686 1.00 0.00 C ATOM 1242 CE1 TYR A 77 11.399 5.073 8.345 1.00 0.00 C ATOM 1243 CE2 TYR A 77 9.500 5.449 6.941 1.00 0.00 C ATOM 1244 CZ TYR A 77 10.489 5.934 7.770 1.00 0.00 C ATOM 1245 OH TYR A 77 10.568 7.284 8.026 1.00 0.00 O ATOM 0 H TYR A 77 10.547 -0.487 5.653 1.00 0.00 H new ATOM 0 HA TYR A 77 12.233 1.878 6.177 1.00 0.00 H new ATOM 0 HB2 TYR A 77 9.512 1.557 6.180 1.00 0.00 H new ATOM 0 HB3 TYR A 77 9.871 1.216 7.861 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.033 3.046 8.536 1.00 0.00 H new ATOM 0 HD2 TYR A 77 8.647 3.717 6.036 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.172 5.455 8.995 1.00 0.00 H new ATOM 0 HE2 TYR A 77 8.788 6.126 6.493 1.00 0.00 H new ATOM 0 HH TYR A 77 9.854 7.751 7.543 1.00 0.00 H new ATOM 1255 N PRO A 78 13.464 0.909 8.125 1.00 0.00 N ATOM 1256 CA PRO A 78 14.214 0.359 9.261 1.00 0.00 C ATOM 1257 C PRO A 78 13.519 0.589 10.600 1.00 0.00 C ATOM 1258 O PRO A 78 13.434 -0.319 11.428 1.00 0.00 O ATOM 1259 CB PRO A 78 15.550 1.115 9.221 1.00 0.00 C ATOM 1260 CG PRO A 78 15.623 1.729 7.864 1.00 0.00 C ATOM 1261 CD PRO A 78 14.205 1.986 7.450 1.00 0.00 C ATOM 0 HA PRO A 78 14.316 -0.723 9.178 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.592 1.877 9.999 1.00 0.00 H new ATOM 0 HB3 PRO A 78 16.388 0.439 9.391 1.00 0.00 H new ATOM 0 HG2 PRO A 78 16.197 2.655 7.885 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.120 1.062 7.160 1.00 0.00 H new ATOM 0 HD2 PRO A 78 13.864 2.971 7.768 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.086 1.941 6.367 1.00 0.00 H new ATOM 1269 N GLU A 79 13.035 1.807 10.813 1.00 0.00 N ATOM 1270 CA GLU A 79 12.360 2.157 12.060 1.00 0.00 C ATOM 1271 C GLU A 79 11.021 1.433 12.206 1.00 0.00 C ATOM 1272 O GLU A 79 10.412 1.458 13.275 1.00 0.00 O ATOM 1273 CB GLU A 79 12.142 3.669 12.136 1.00 0.00 C ATOM 1274 CG GLU A 79 12.306 4.238 13.536 1.00 0.00 C ATOM 1275 CD GLU A 79 13.420 5.263 13.624 1.00 0.00 C ATOM 1276 OE1 GLU A 79 13.333 6.297 12.930 1.00 0.00 O ATOM 1277 OE2 GLU A 79 14.383 5.030 14.387 1.00 0.00 O ATOM 0 H GLU A 79 13.097 2.570 10.139 1.00 0.00 H new ATOM 0 HA GLU A 79 13.003 1.838 12.880 1.00 0.00 H new ATOM 0 HB2 GLU A 79 12.847 4.163 11.467 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.141 3.902 11.773 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.369 4.698 13.849 1.00 0.00 H new ATOM 0 HG3 GLU A 79 12.510 3.425 14.233 1.00 0.00 H new ATOM 1284 N ALA A 80 10.561 0.796 11.132 1.00 0.00 N ATOM 1285 CA ALA A 80 9.292 0.079 11.161 1.00 0.00 C ATOM 1286 C ALA A 80 9.471 -1.364 11.624 1.00 0.00 C ATOM 1287 O ALA A 80 8.602 -1.924 12.292 1.00 0.00 O ATOM 1288 CB ALA A 80 8.640 0.113 9.788 1.00 0.00 C ATOM 0 H ALA A 80 11.046 0.762 10.236 1.00 0.00 H new ATOM 0 HA ALA A 80 8.643 0.580 11.880 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.693 -0.426 9.822 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.459 1.148 9.497 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.300 -0.359 9.060 1.00 0.00 H new ATOM 1294 N ARG A 81 10.601 -1.963 11.260 1.00 0.00 N ATOM 1295 CA ARG A 81 10.892 -3.346 11.632 1.00 0.00 C ATOM 1296 C ARG A 81 10.794 -3.556 13.143 1.00 0.00 C ATOM 1297 O ARG A 81 10.610 -4.683 13.606 1.00 0.00 O ATOM 1298 CB ARG A 81 12.285 -3.744 11.137 1.00 0.00 C ATOM 1299 CG ARG A 81 12.257 -4.713 9.966 1.00 0.00 C ATOM 1300 CD ARG A 81 13.638 -5.277 9.670 1.00 0.00 C ATOM 1301 NE ARG A 81 13.598 -6.711 9.394 1.00 0.00 N ATOM 1302 CZ ARG A 81 13.648 -7.653 10.334 1.00 0.00 C ATOM 1303 NH1 ARG A 81 13.738 -7.320 11.615 1.00 0.00 N ATOM 1304 NH2 ARG A 81 13.606 -8.934 9.990 1.00 0.00 N ATOM 0 H ARG A 81 11.331 -1.513 10.708 1.00 0.00 H new ATOM 0 HA ARG A 81 10.144 -3.981 11.157 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.828 -2.846 10.843 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.839 -4.196 11.960 1.00 0.00 H new ATOM 0 HG2 ARG A 81 11.570 -5.530 10.186 1.00 0.00 H new ATOM 0 HG3 ARG A 81 11.874 -4.204 9.081 1.00 0.00 H new ATOM 0 HD2 ARG A 81 14.066 -4.755 8.814 1.00 0.00 H new ATOM 0 HD3 ARG A 81 14.295 -5.090 10.519 1.00 0.00 H new ATOM 0 HE ARG A 81 13.527 -7.009 8.421 1.00 0.00 H new ATOM 0 HH11 ARG A 81 13.769 -6.337 11.885 1.00 0.00 H new ATOM 0 HH12 ARG A 81 13.776 -8.047 12.329 1.00 0.00 H new ATOM 0 HH21 ARG A 81 13.536 -9.196 9.007 1.00 0.00 H new ATOM 0 HH22 ARG A 81 13.644 -9.657 10.709 1.00 0.00 H new ATOM 1318 N LYS A 82 10.918 -2.475 13.907 1.00 0.00 N ATOM 1319 CA LYS A 82 10.842 -2.557 15.363 1.00 0.00 C ATOM 1320 C LYS A 82 9.528 -3.191 15.810 1.00 0.00 C ATOM 1321 O LYS A 82 8.459 -2.843 15.309 1.00 0.00 O ATOM 1322 CB LYS A 82 10.988 -1.164 15.980 1.00 0.00 C ATOM 1323 CG LYS A 82 12.424 -0.797 16.320 1.00 0.00 C ATOM 1324 CD LYS A 82 12.517 0.599 16.916 1.00 0.00 C ATOM 1325 CE LYS A 82 13.156 1.579 15.944 1.00 0.00 C ATOM 1326 NZ LYS A 82 14.616 1.736 16.193 1.00 0.00 N ATOM 0 H LYS A 82 11.071 -1.534 13.544 1.00 0.00 H new ATOM 0 HA LYS A 82 11.660 -3.189 15.708 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.587 -0.425 15.287 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.384 -1.112 16.886 1.00 0.00 H new ATOM 0 HG2 LYS A 82 12.829 -1.523 17.026 1.00 0.00 H new ATOM 0 HG3 LYS A 82 13.037 -0.851 15.420 1.00 0.00 H new ATOM 0 HD2 LYS A 82 11.520 0.949 17.184 1.00 0.00 H new ATOM 0 HD3 LYS A 82 13.101 0.565 17.836 1.00 0.00 H new ATOM 0 HE2 LYS A 82 12.997 1.233 14.923 1.00 0.00 H new ATOM 0 HE3 LYS A 82 12.666 2.549 16.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 15.014 2.412 15.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 14.767 2.090 17.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 15.088 0.816 16.084 1.00 0.00 H new ATOM 1340 N LYS A 83 9.616 -4.121 16.757 1.00 0.00 N ATOM 1341 CA LYS A 83 8.434 -4.801 17.273 1.00 0.00 C ATOM 1342 C LYS A 83 7.580 -3.850 18.105 1.00 0.00 C ATOM 1343 O LYS A 83 8.102 -2.997 18.821 1.00 0.00 O ATOM 1344 CB LYS A 83 8.842 -6.010 18.118 1.00 0.00 C ATOM 1345 CG LYS A 83 9.642 -7.047 17.346 1.00 0.00 C ATOM 1346 CD LYS A 83 8.761 -8.194 16.878 1.00 0.00 C ATOM 1347 CE LYS A 83 9.575 -9.450 16.611 1.00 0.00 C ATOM 1348 NZ LYS A 83 10.487 -9.285 15.447 1.00 0.00 N ATOM 0 H LYS A 83 10.494 -4.420 17.182 1.00 0.00 H new ATOM 0 HA LYS A 83 7.843 -5.144 16.424 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.432 -5.667 18.968 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.945 -6.481 18.521 1.00 0.00 H new ATOM 0 HG2 LYS A 83 10.116 -6.576 16.485 1.00 0.00 H new ATOM 0 HG3 LYS A 83 10.442 -7.435 17.977 1.00 0.00 H new ATOM 0 HD2 LYS A 83 8.004 -8.404 17.633 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.233 -7.902 15.970 1.00 0.00 H new ATOM 0 HE2 LYS A 83 10.159 -9.699 17.497 1.00 0.00 H new ATOM 0 HE3 LYS A 83 8.901 -10.287 16.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.023 -10.164 15.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 9.929 -9.073 14.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.147 -8.503 15.632 1.00 0.00 H new ATOM 1362 N GLY A 84 6.263 -3.999 17.999 1.00 0.00 N ATOM 1363 CA GLY A 84 5.360 -3.141 18.743 1.00 0.00 C ATOM 1364 C GLY A 84 4.941 -1.912 17.956 1.00 0.00 C ATOM 1365 O GLY A 84 4.122 -1.120 18.421 1.00 0.00 O ATOM 0 H GLY A 84 5.806 -4.697 17.412 1.00 0.00 H new ATOM 0 HA2 GLY A 84 4.473 -3.709 19.022 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.842 -2.828 19.669 1.00 0.00 H new ATOM 1369 N THR A 85 5.506 -1.750 16.761 1.00 0.00 N ATOM 1370 CA THR A 85 5.188 -0.610 15.911 1.00 0.00 C ATOM 1371 C THR A 85 3.791 -0.741 15.312 1.00 0.00 C ATOM 1372 O THR A 85 3.413 -1.805 14.822 1.00 0.00 O ATOM 1373 CB THR A 85 6.225 -0.484 14.795 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.538 -0.518 15.326 1.00 0.00 O ATOM 1375 CG2 THR A 85 6.086 0.790 13.993 1.00 0.00 C ATOM 0 H THR A 85 6.187 -2.396 16.361 1.00 0.00 H new ATOM 0 HA THR A 85 5.210 0.288 16.528 1.00 0.00 H new ATOM 0 HB THR A 85 6.045 -1.332 14.134 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.968 -1.364 15.082 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.852 0.817 13.218 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.100 0.823 13.530 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.206 1.650 14.652 1.00 0.00 H new ATOM 1383 N HIS A 86 3.030 0.347 15.354 1.00 0.00 N ATOM 1384 CA HIS A 86 1.673 0.361 14.815 1.00 0.00 C ATOM 1385 C HIS A 86 1.532 1.428 13.734 1.00 0.00 C ATOM 1386 O HIS A 86 1.633 2.623 14.014 1.00 0.00 O ATOM 1387 CB HIS A 86 0.664 0.614 15.938 1.00 0.00 C ATOM 1388 CG HIS A 86 -0.619 -0.138 15.776 1.00 0.00 C ATOM 1389 ND1 HIS A 86 -1.674 0.325 15.017 1.00 0.00 N ATOM 1390 CD2 HIS A 86 -1.017 -1.329 16.285 1.00 0.00 C ATOM 1391 CE1 HIS A 86 -2.665 -0.547 15.068 1.00 0.00 C ATOM 1392 NE2 HIS A 86 -2.293 -1.559 15.829 1.00 0.00 N ATOM 0 H HIS A 86 3.330 1.234 15.757 1.00 0.00 H new ATOM 0 HA HIS A 86 1.471 -0.612 14.367 1.00 0.00 H new ATOM 0 HB2 HIS A 86 1.118 0.340 16.890 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.446 1.681 15.985 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -0.440 -1.976 16.928 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -3.619 -0.448 14.571 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -2.860 -2.379 16.044 1.00 0.00 H new ATOM 1400 N PHE A 87 1.304 0.994 12.496 1.00 0.00 N ATOM 1401 CA PHE A 87 1.160 1.921 11.375 1.00 0.00 C ATOM 1402 C PHE A 87 -0.251 1.881 10.800 1.00 0.00 C ATOM 1403 O PHE A 87 -0.963 0.886 10.941 1.00 0.00 O ATOM 1404 CB PHE A 87 2.178 1.610 10.265 1.00 0.00 C ATOM 1405 CG PHE A 87 2.904 0.305 10.436 1.00 0.00 C ATOM 1406 CD1 PHE A 87 3.732 0.094 11.525 1.00 0.00 C ATOM 1407 CD2 PHE A 87 2.757 -0.710 9.505 1.00 0.00 C ATOM 1408 CE1 PHE A 87 4.400 -1.105 11.683 1.00 0.00 C ATOM 1409 CE2 PHE A 87 3.422 -1.911 9.658 1.00 0.00 C ATOM 1410 CZ PHE A 87 4.245 -2.109 10.748 1.00 0.00 C ATOM 0 H PHE A 87 1.215 0.010 12.244 1.00 0.00 H new ATOM 0 HA PHE A 87 1.352 2.922 11.761 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.660 1.601 9.306 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.910 2.416 10.224 1.00 0.00 H new ATOM 0 HD1 PHE A 87 3.857 0.876 12.260 1.00 0.00 H new ATOM 0 HD2 PHE A 87 2.115 -0.561 8.649 1.00 0.00 H new ATOM 0 HE1 PHE A 87 5.043 -1.257 12.537 1.00 0.00 H new ATOM 0 HE2 PHE A 87 3.298 -2.695 8.925 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.766 -3.047 10.869 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.645 2.968 10.140 1.00 0.00 N ATOM 1421 CA ASN A 88 -1.967 3.055 9.532 1.00 0.00 C ATOM 1422 C ASN A 88 -1.865 3.404 8.051 1.00 0.00 C ATOM 1423 O ASN A 88 -0.965 4.132 7.633 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.829 4.091 10.260 1.00 0.00 C ATOM 1425 CG ASN A 88 -2.085 5.384 10.529 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -1.278 5.466 11.455 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -2.356 6.401 9.721 1.00 0.00 N ATOM 0 H ASN A 88 -0.067 3.799 10.014 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.442 2.078 9.623 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.716 4.304 9.663 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.174 3.671 11.205 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -1.888 7.297 9.855 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.033 6.287 8.966 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.792 2.872 7.262 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.811 3.115 5.825 1.00 0.00 C ATOM 1436 C PHE A 89 -3.907 4.104 5.441 1.00 0.00 C ATOM 1437 O PHE A 89 -5.077 3.923 5.794 1.00 0.00 O ATOM 1438 CB PHE A 89 -3.020 1.804 5.065 1.00 0.00 C ATOM 1439 CG PHE A 89 -2.141 0.684 5.542 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -0.832 0.579 5.106 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -2.626 -0.260 6.430 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -0.021 -0.449 5.548 1.00 0.00 C ATOM 1443 CE2 PHE A 89 -1.823 -1.289 6.877 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.517 -1.385 6.435 1.00 0.00 C ATOM 0 H PHE A 89 -3.543 2.267 7.595 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.847 3.545 5.553 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -4.063 1.501 5.160 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.833 1.975 4.005 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.440 1.308 4.413 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.646 -0.190 6.778 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.999 -0.521 5.201 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.214 -2.018 7.571 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.114 -2.190 6.782 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.516 5.142 4.707 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.448 6.164 4.252 1.00 0.00 C ATOM 1456 C ALA A 90 -4.084 6.634 2.852 1.00 0.00 C ATOM 1457 O ALA A 90 -2.910 6.680 2.493 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.461 7.345 5.213 1.00 0.00 C ATOM 0 H ALA A 90 -2.551 5.296 4.414 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.446 5.726 4.225 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.164 8.098 4.855 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.766 7.005 6.203 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.463 7.779 5.270 1.00 0.00 H new ATOM 1464 N ILE A 91 -5.091 6.984 2.066 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.859 7.458 0.707 1.00 0.00 C ATOM 1466 C ILE A 91 -4.773 8.977 0.690 1.00 0.00 C ATOM 1467 O ILE A 91 -5.739 9.659 1.024 1.00 0.00 O ATOM 1468 CB ILE A 91 -5.966 7.007 -0.276 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -6.771 5.833 0.291 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.356 6.632 -1.618 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -5.932 4.613 0.605 1.00 0.00 C ATOM 0 H ILE A 91 -6.072 6.950 2.342 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.917 7.018 0.378 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.651 7.843 -0.418 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.278 6.157 1.200 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.545 5.556 -0.425 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.145 6.316 -2.301 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -4.838 7.495 -2.036 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.647 5.815 -1.480 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -6.571 3.824 1.002 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.445 4.262 -0.305 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -5.174 4.873 1.344 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.612 9.502 0.310 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.409 10.948 0.265 1.00 0.00 C ATOM 1485 C VAL A 92 -2.740 11.358 -1.047 1.00 0.00 C ATOM 1486 O VAL A 92 -2.071 10.550 -1.688 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.570 11.453 1.472 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -2.711 10.521 2.671 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -1.102 11.620 1.100 1.00 0.00 C ATOM 0 H VAL A 92 -2.800 8.952 0.030 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.393 11.413 0.325 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.962 12.431 1.750 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.113 10.901 3.499 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.757 10.471 2.972 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.364 9.524 2.400 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.545 11.974 1.967 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.697 10.661 0.776 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.012 12.344 0.290 1.00 0.00 H new ATOM 1673 N VAL A 103 -8.800 12.349 0.621 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.681 11.771 1.353 1.00 0.00 C ATOM 1675 C VAL A 103 -8.103 11.359 2.764 1.00 0.00 C ATOM 1676 O VAL A 103 -8.448 12.203 3.591 1.00 0.00 O ATOM 1677 CB VAL A 103 -6.491 12.760 1.418 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -6.978 14.171 1.711 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.453 12.320 2.446 1.00 0.00 C ATOM 0 HA VAL A 103 -7.360 10.879 0.815 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.007 12.759 0.441 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -6.125 14.849 1.752 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.659 14.492 0.923 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.499 14.185 2.668 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.632 13.037 2.464 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.915 12.272 3.432 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.069 11.336 2.177 1.00 0.00 H new ATOM 1689 N LYS A 104 -8.074 10.054 3.027 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.455 9.526 4.334 1.00 0.00 C ATOM 1691 C LYS A 104 -7.860 8.137 4.563 1.00 0.00 C ATOM 1692 O LYS A 104 -7.312 7.528 3.646 1.00 0.00 O ATOM 1693 CB LYS A 104 -9.979 9.467 4.457 1.00 0.00 C ATOM 1694 CG LYS A 104 -10.633 8.524 3.461 1.00 0.00 C ATOM 1695 CD LYS A 104 -10.871 9.204 2.124 1.00 0.00 C ATOM 1696 CE LYS A 104 -10.590 8.263 0.963 1.00 0.00 C ATOM 1697 NZ LYS A 104 -11.830 7.601 0.472 1.00 0.00 N ATOM 0 H LYS A 104 -7.791 9.344 2.352 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.059 10.197 5.096 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.242 9.154 5.468 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.386 10.469 4.317 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -10.000 7.649 3.317 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -11.582 8.169 3.864 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -11.902 9.552 2.070 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -10.233 10.084 2.043 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -10.129 8.820 0.148 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -9.873 7.504 1.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -11.596 6.968 -0.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -12.257 7.048 1.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -12.505 8.324 0.149 1.00 0.00 H new ATOM 1711 N GLU A 105 -7.976 7.643 5.795 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.454 6.325 6.146 1.00 0.00 C ATOM 1713 C GLU A 105 -8.514 5.247 5.934 1.00 0.00 C ATOM 1714 O GLU A 105 -9.708 5.489 6.114 1.00 0.00 O ATOM 1715 CB GLU A 105 -6.957 6.321 7.596 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.572 4.946 8.123 1.00 0.00 C ATOM 1717 CD GLU A 105 -6.628 4.865 9.636 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -5.825 5.557 10.297 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -7.474 4.112 10.161 1.00 0.00 O ATOM 0 H GLU A 105 -8.427 8.136 6.566 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.612 6.101 5.490 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.093 6.982 7.673 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.735 6.737 8.236 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.241 4.198 7.698 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.565 4.701 7.787 1.00 0.00 H new ATOM 1726 N ILE A 106 -8.066 4.056 5.542 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.974 2.938 5.294 1.00 0.00 C ATOM 1728 C ILE A 106 -8.723 1.777 6.255 1.00 0.00 C ATOM 1729 O ILE A 106 -9.590 0.923 6.442 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.862 2.423 3.841 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -7.449 2.642 3.288 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -9.890 3.113 2.955 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.402 1.754 3.926 1.00 0.00 C ATOM 0 H ILE A 106 -7.081 3.840 5.389 1.00 0.00 H new ATOM 0 HA ILE A 106 -9.980 3.323 5.460 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.063 1.352 3.844 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.458 2.464 2.213 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.168 3.685 3.436 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.799 2.740 1.935 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.892 2.904 3.330 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.716 4.189 2.965 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.428 1.965 3.485 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.365 1.948 4.998 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.659 0.708 3.755 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.539 1.743 6.860 1.00 0.00 N ATOM 1746 CA GLY A 107 -7.218 0.671 7.790 1.00 0.00 C ATOM 1747 C GLY A 107 -5.784 0.735 8.266 1.00 0.00 C ATOM 1748 O GLY A 107 -4.928 1.287 7.581 1.00 0.00 O ATOM 0 H GLY A 107 -6.800 2.433 6.725 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.887 0.726 8.649 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.396 -0.290 7.308 1.00 0.00 H new ATOM 1752 N SER A 108 -5.525 0.227 9.472 1.00 0.00 N ATOM 1753 CA SER A 108 -4.184 0.278 10.037 1.00 0.00 C ATOM 1754 C SER A 108 -3.747 -1.077 10.584 1.00 0.00 C ATOM 1755 O SER A 108 -4.550 -1.829 11.137 1.00 0.00 O ATOM 1756 CB SER A 108 -4.121 1.325 11.154 1.00 0.00 C ATOM 1757 OG SER A 108 -4.898 0.928 12.273 1.00 0.00 O ATOM 0 H SER A 108 -6.222 -0.220 10.068 1.00 0.00 H new ATOM 0 HA SER A 108 -3.502 0.554 9.233 1.00 0.00 H new ATOM 0 HB2 SER A 108 -3.085 1.472 11.461 1.00 0.00 H new ATOM 0 HB3 SER A 108 -4.481 2.283 10.779 1.00 0.00 H new ATOM 0 HG SER A 108 -4.839 1.613 12.972 1.00 0.00 H new ATOM 1763 N THR A 109 -2.459 -1.368 10.436 1.00 0.00 N ATOM 1764 CA THR A 109 -1.881 -2.615 10.920 1.00 0.00 C ATOM 1765 C THR A 109 -0.701 -2.321 11.840 1.00 0.00 C ATOM 1766 O THR A 109 -0.483 -1.174 12.228 1.00 0.00 O ATOM 1767 CB THR A 109 -1.431 -3.487 9.745 1.00 0.00 C ATOM 1768 OG1 THR A 109 -0.594 -2.755 8.868 1.00 0.00 O ATOM 1769 CG2 THR A 109 -2.584 -4.033 8.933 1.00 0.00 C ATOM 0 H THR A 109 -1.789 -0.749 9.979 1.00 0.00 H new ATOM 0 HA THR A 109 -2.641 -3.157 11.482 1.00 0.00 H new ATOM 0 HB THR A 109 -0.894 -4.323 10.193 1.00 0.00 H new ATOM 0 HG1 THR A 109 -0.927 -2.841 7.950 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.197 -4.642 8.116 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.221 -4.645 9.572 1.00 0.00 H new ATOM 0 HG23 THR A 109 -3.166 -3.206 8.525 1.00 0.00 H new ATOM 1777 N MET A 110 0.063 -3.352 12.188 1.00 0.00 N ATOM 1778 CA MET A 110 1.215 -3.169 13.062 1.00 0.00 C ATOM 1779 C MET A 110 2.345 -4.128 12.693 1.00 0.00 C ATOM 1780 O MET A 110 2.154 -5.053 11.903 1.00 0.00 O ATOM 1781 CB MET A 110 0.796 -3.324 14.533 1.00 0.00 C ATOM 1782 CG MET A 110 0.870 -4.742 15.086 1.00 0.00 C ATOM 1783 SD MET A 110 1.385 -4.770 16.814 1.00 0.00 S ATOM 1784 CE MET A 110 2.933 -3.876 16.714 1.00 0.00 C ATOM 0 H MET A 110 -0.093 -4.312 11.882 1.00 0.00 H new ATOM 0 HA MET A 110 1.598 -2.158 12.925 1.00 0.00 H new ATOM 0 HB2 MET A 110 1.429 -2.680 15.144 1.00 0.00 H new ATOM 0 HB3 MET A 110 -0.226 -2.962 14.642 1.00 0.00 H new ATOM 0 HG2 MET A 110 -0.105 -5.219 14.991 1.00 0.00 H new ATOM 0 HG3 MET A 110 1.570 -5.327 14.490 1.00 0.00 H new ATOM 0 HE1 MET A 110 3.658 -4.327 17.391 1.00 0.00 H new ATOM 0 HE2 MET A 110 3.313 -3.920 15.693 1.00 0.00 H new ATOM 0 HE3 MET A 110 2.771 -2.836 16.996 1.00 0.00 H new ATOM 1794 N SER A 111 3.524 -3.889 13.257 1.00 0.00 N ATOM 1795 CA SER A 111 4.690 -4.719 12.977 1.00 0.00 C ATOM 1796 C SER A 111 4.719 -5.973 13.844 1.00 0.00 C ATOM 1797 O SER A 111 4.865 -5.892 15.065 1.00 0.00 O ATOM 1798 CB SER A 111 5.973 -3.915 13.193 1.00 0.00 C ATOM 1799 OG SER A 111 7.113 -4.652 12.789 1.00 0.00 O ATOM 0 H SER A 111 3.698 -3.126 13.912 1.00 0.00 H new ATOM 0 HA SER A 111 4.623 -5.034 11.936 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.921 -2.983 12.630 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.064 -3.647 14.245 1.00 0.00 H new ATOM 0 HG SER A 111 7.837 -4.034 12.557 1.00 0.00 H new ATOM 1805 N GLY A 112 4.599 -7.134 13.205 1.00 0.00 N ATOM 1806 CA GLY A 112 4.637 -8.390 13.932 1.00 0.00 C ATOM 1807 C GLY A 112 3.290 -8.816 14.481 1.00 0.00 C ATOM 1808 O GLY A 112 3.227 -9.581 15.444 1.00 0.00 O ATOM 0 H GLY A 112 4.476 -7.227 12.197 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.014 -9.171 13.271 1.00 0.00 H new ATOM 0 HA3 GLY A 112 5.344 -8.301 14.757 1.00 0.00 H new ATOM 1812 N ARG A 113 2.208 -8.331 13.882 1.00 0.00 N ATOM 1813 CA ARG A 113 0.870 -8.689 14.343 1.00 0.00 C ATOM 1814 C ARG A 113 -0.173 -8.459 13.256 1.00 0.00 C ATOM 1815 O ARG A 113 -0.005 -7.604 12.386 1.00 0.00 O ATOM 1816 CB ARG A 113 0.513 -7.886 15.595 1.00 0.00 C ATOM 1817 CG ARG A 113 0.453 -8.729 16.860 1.00 0.00 C ATOM 1818 CD ARG A 113 1.429 -8.228 17.916 1.00 0.00 C ATOM 1819 NE ARG A 113 2.123 -9.326 18.584 1.00 0.00 N ATOM 1820 CZ ARG A 113 3.167 -9.160 19.393 1.00 0.00 C ATOM 1821 NH1 ARG A 113 3.637 -7.944 19.638 1.00 0.00 N ATOM 1822 NH2 ARG A 113 3.739 -10.213 19.962 1.00 0.00 N ATOM 0 H ARG A 113 2.229 -7.696 13.084 1.00 0.00 H new ATOM 0 HA ARG A 113 0.871 -9.752 14.586 1.00 0.00 H new ATOM 0 HB2 ARG A 113 1.249 -7.093 15.731 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.452 -7.403 15.444 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -0.560 -8.710 17.262 1.00 0.00 H new ATOM 0 HG3 ARG A 113 0.681 -9.767 16.617 1.00 0.00 H new ATOM 0 HD2 ARG A 113 2.160 -7.567 17.450 1.00 0.00 H new ATOM 0 HD3 ARG A 113 0.890 -7.636 18.656 1.00 0.00 H new ATOM 0 HE ARG A 113 1.788 -10.276 18.421 1.00 0.00 H new ATOM 0 HH11 ARG A 113 3.198 -7.131 19.206 1.00 0.00 H new ATOM 0 HH12 ARG A 113 4.437 -7.822 20.259 1.00 0.00 H new ATOM 0 HH21 ARG A 113 3.379 -11.150 19.780 1.00 0.00 H new ATOM 0 HH22 ARG A 113 4.539 -10.086 20.582 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.252 -9.233 13.315 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.328 -9.121 12.339 1.00 0.00 C ATOM 1838 C LYS A 114 -3.535 -8.408 12.939 1.00 0.00 C ATOM 1839 O LYS A 114 -4.340 -9.015 13.647 1.00 0.00 O ATOM 1840 CB LYS A 114 -2.738 -10.506 11.839 1.00 0.00 C ATOM 1841 CG LYS A 114 -1.726 -11.138 10.895 1.00 0.00 C ATOM 1842 CD LYS A 114 -1.570 -12.626 11.159 1.00 0.00 C ATOM 1843 CE LYS A 114 -2.895 -13.359 11.029 1.00 0.00 C ATOM 1844 NZ LYS A 114 -2.835 -14.731 11.607 1.00 0.00 N ATOM 0 H LYS A 114 -1.404 -9.945 14.029 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.961 -8.532 11.498 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.883 -11.164 12.696 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.699 -10.429 11.330 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.042 -10.982 9.864 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -0.761 -10.644 11.011 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.850 -13.047 10.457 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.166 -12.778 12.160 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.676 -12.788 11.532 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.173 -13.421 9.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -3.759 -15.195 11.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -2.108 -15.285 11.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -2.595 -14.672 12.617 1.00 0.00 H new ATOM 1858 N GLY A 115 -3.652 -7.119 12.649 1.00 0.00 N ATOM 1859 CA GLY A 115 -4.763 -6.340 13.166 1.00 0.00 C ATOM 1860 C GLY A 115 -6.100 -6.810 12.625 1.00 0.00 C ATOM 1861 O GLY A 115 -6.240 -7.962 12.214 1.00 0.00 O ATOM 0 H GLY A 115 -2.998 -6.598 12.065 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -4.772 -6.403 14.254 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -4.618 -5.291 12.909 1.00 0.00 H new ATOM 1865 N THR A 116 -7.084 -5.918 12.628 1.00 0.00 N ATOM 1866 CA THR A 116 -8.416 -6.247 12.134 1.00 0.00 C ATOM 1867 C THR A 116 -8.503 -6.040 10.626 1.00 0.00 C ATOM 1868 O THR A 116 -9.176 -6.795 9.923 1.00 0.00 O ATOM 1869 CB THR A 116 -9.470 -5.393 12.840 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.127 -4.020 12.777 1.00 0.00 O ATOM 1871 CG2 THR A 116 -9.653 -5.753 14.300 1.00 0.00 C ATOM 0 H THR A 116 -6.985 -4.961 12.967 1.00 0.00 H new ATOM 0 HA THR A 116 -8.607 -7.298 12.350 1.00 0.00 H new ATOM 0 HB THR A 116 -10.403 -5.592 12.313 1.00 0.00 H new ATOM 0 HG1 THR A 116 -9.814 -3.490 13.232 1.00 0.00 H new ATOM 0 HG21 THR A 116 -10.415 -5.110 14.741 1.00 0.00 H new ATOM 0 HG22 THR A 116 -9.966 -6.794 14.382 1.00 0.00 H new ATOM 0 HG23 THR A 116 -8.710 -5.615 14.830 1.00 0.00 H new ATOM 1879 N ASP A 117 -7.818 -5.013 10.135 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.814 -4.706 8.709 1.00 0.00 C ATOM 1881 C ASP A 117 -6.739 -5.507 7.973 1.00 0.00 C ATOM 1882 O ASP A 117 -6.766 -5.617 6.748 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.592 -3.208 8.489 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.459 -2.355 9.397 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -8.066 -2.140 10.563 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -9.531 -1.903 8.941 1.00 0.00 O ATOM 0 H ASP A 117 -7.258 -4.378 10.704 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.786 -4.987 8.304 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.543 -2.969 8.664 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.806 -2.961 7.449 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.792 -6.059 8.729 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.705 -6.846 8.153 1.00 0.00 C ATOM 1893 C ASP A 118 -5.234 -7.904 7.184 1.00 0.00 C ATOM 1894 O ASP A 118 -4.583 -8.229 6.190 1.00 0.00 O ATOM 1895 CB ASP A 118 -3.901 -7.522 9.265 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.415 -7.555 8.967 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -1.912 -6.589 8.357 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -1.756 -8.546 9.341 1.00 0.00 O ATOM 0 H ASP A 118 -5.756 -5.975 9.745 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.060 -6.166 7.596 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.069 -6.993 10.203 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.263 -8.541 9.404 1.00 0.00 H new ATOM 1903 N SER A 119 -6.415 -8.441 7.483 1.00 0.00 N ATOM 1904 CA SER A 119 -7.027 -9.466 6.642 1.00 0.00 C ATOM 1905 C SER A 119 -7.669 -8.861 5.392 1.00 0.00 C ATOM 1906 O SER A 119 -8.069 -9.586 4.481 1.00 0.00 O ATOM 1907 CB SER A 119 -8.077 -10.243 7.436 1.00 0.00 C ATOM 1908 OG SER A 119 -9.009 -9.364 8.044 1.00 0.00 O ATOM 0 H SER A 119 -6.967 -8.183 8.301 1.00 0.00 H new ATOM 0 HA SER A 119 -6.236 -10.144 6.322 1.00 0.00 H new ATOM 0 HB2 SER A 119 -8.601 -10.933 6.775 1.00 0.00 H new ATOM 0 HB3 SER A 119 -7.587 -10.845 8.201 1.00 0.00 H new ATOM 0 HG SER A 119 -9.671 -9.885 8.545 1.00 0.00 H new ATOM 1914 N MET A 120 -7.763 -7.532 5.350 1.00 0.00 N ATOM 1915 CA MET A 120 -8.349 -6.849 4.205 1.00 0.00 C ATOM 1916 C MET A 120 -7.331 -6.729 3.077 1.00 0.00 C ATOM 1917 O MET A 120 -6.130 -6.845 3.304 1.00 0.00 O ATOM 1918 CB MET A 120 -8.841 -5.458 4.614 1.00 0.00 C ATOM 1919 CG MET A 120 -9.774 -4.821 3.596 1.00 0.00 C ATOM 1920 SD MET A 120 -10.632 -3.374 4.250 1.00 0.00 S ATOM 1921 CE MET A 120 -9.247 -2.360 4.762 1.00 0.00 C ATOM 0 H MET A 120 -7.441 -6.912 6.094 1.00 0.00 H new ATOM 0 HA MET A 120 -9.197 -7.436 3.850 1.00 0.00 H new ATOM 0 HB2 MET A 120 -9.356 -5.531 5.572 1.00 0.00 H new ATOM 0 HB3 MET A 120 -7.980 -4.806 4.764 1.00 0.00 H new ATOM 0 HG2 MET A 120 -9.201 -4.532 2.715 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.508 -5.558 3.271 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.369 -2.079 5.808 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.321 -2.922 4.642 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.208 -1.461 4.147 1.00 0.00 H new ATOM 1931 N THR A 121 -7.815 -6.494 1.862 1.00 0.00 N ATOM 1932 CA THR A 121 -6.935 -6.358 0.703 1.00 0.00 C ATOM 1933 C THR A 121 -6.903 -4.916 0.214 1.00 0.00 C ATOM 1934 O THR A 121 -7.833 -4.150 0.467 1.00 0.00 O ATOM 1935 CB THR A 121 -7.397 -7.284 -0.423 1.00 0.00 C ATOM 1936 OG1 THR A 121 -8.812 -7.298 -0.515 1.00 0.00 O ATOM 1937 CG2 THR A 121 -6.934 -8.714 -0.250 1.00 0.00 C ATOM 0 H THR A 121 -8.808 -6.394 1.653 1.00 0.00 H new ATOM 0 HA THR A 121 -5.927 -6.641 1.005 1.00 0.00 H new ATOM 0 HB THR A 121 -6.947 -6.881 -1.330 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.087 -7.895 -1.242 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.296 -9.317 -1.083 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.845 -8.744 -0.227 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.327 -9.113 0.685 1.00 0.00 H new ATOM 1945 N LEU A 122 -5.829 -4.541 -0.484 1.00 0.00 N ATOM 1946 CA LEU A 122 -5.695 -3.186 -0.997 1.00 0.00 C ATOM 1947 C LEU A 122 -6.841 -2.853 -1.946 1.00 0.00 C ATOM 1948 O LEU A 122 -7.461 -1.796 -1.840 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.350 -3.024 -1.708 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.333 -2.144 -0.976 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -1.964 -2.256 -1.629 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -3.801 -0.697 -0.955 1.00 0.00 C ATOM 0 H LEU A 122 -5.046 -5.157 -0.703 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.735 -2.492 -0.157 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.913 -4.012 -1.856 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.527 -2.602 -2.697 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.250 -2.493 0.053 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.254 -1.624 -1.096 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.627 -3.292 -1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.029 -1.932 -2.668 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.067 -0.085 -0.431 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.912 -0.336 -1.977 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.760 -0.632 -0.441 1.00 0.00 H new ATOM 1964 N GLN A 123 -7.103 -3.751 -2.890 1.00 0.00 N ATOM 1965 CA GLN A 123 -8.167 -3.553 -3.875 1.00 0.00 C ATOM 1966 C GLN A 123 -9.465 -3.094 -3.213 1.00 0.00 C ATOM 1967 O GLN A 123 -10.243 -2.348 -3.805 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.411 -4.844 -4.656 1.00 0.00 C ATOM 1969 CG GLN A 123 -8.727 -6.039 -3.771 1.00 0.00 C ATOM 1970 CD GLN A 123 -9.404 -7.164 -4.529 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -10.012 -6.945 -5.577 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -9.300 -8.379 -4.003 1.00 0.00 N ATOM 0 H GLN A 123 -6.592 -4.627 -2.996 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.842 -2.771 -4.561 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -9.236 -4.688 -5.351 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -7.529 -5.069 -5.255 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.804 -6.410 -3.325 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -9.371 -5.719 -2.952 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.787 -8.516 -3.132 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -9.734 -9.176 -4.470 1.00 0.00 H new ATOM 1981 N SER A 124 -9.695 -3.548 -1.985 1.00 0.00 N ATOM 1982 CA SER A 124 -10.904 -3.186 -1.248 1.00 0.00 C ATOM 1983 C SER A 124 -10.808 -1.770 -0.681 1.00 0.00 C ATOM 1984 O SER A 124 -11.817 -1.175 -0.305 1.00 0.00 O ATOM 1985 CB SER A 124 -11.152 -4.184 -0.117 1.00 0.00 C ATOM 1986 OG SER A 124 -12.033 -5.215 -0.528 1.00 0.00 O ATOM 0 H SER A 124 -9.062 -4.167 -1.478 1.00 0.00 H new ATOM 0 HA SER A 124 -11.741 -3.216 -1.946 1.00 0.00 H new ATOM 0 HB2 SER A 124 -10.205 -4.618 0.203 1.00 0.00 H new ATOM 0 HB3 SER A 124 -11.572 -3.665 0.744 1.00 0.00 H new ATOM 0 HG SER A 124 -12.173 -5.840 0.213 1.00 0.00 H new ATOM 1992 N GLN A 125 -9.591 -1.238 -0.619 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.370 0.105 -0.095 1.00 0.00 C ATOM 1994 C GLN A 125 -9.455 1.161 -1.198 1.00 0.00 C ATOM 1995 O GLN A 125 -9.063 2.310 -0.996 1.00 0.00 O ATOM 1996 CB GLN A 125 -8.005 0.181 0.589 1.00 0.00 C ATOM 1997 CG GLN A 125 -7.974 -0.496 1.949 1.00 0.00 C ATOM 1998 CD GLN A 125 -6.787 -1.425 2.113 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -5.637 -1.016 1.949 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -7.062 -2.681 2.435 1.00 0.00 N ATOM 0 H GLN A 125 -8.744 -1.716 -0.925 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.156 0.312 0.631 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.257 -0.281 -0.056 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -7.723 1.227 0.706 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.945 0.265 2.729 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.895 -1.062 2.090 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.031 -2.975 2.561 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -6.305 -3.354 2.557 1.00 0.00 H new ATOM 2009 N LYS A 126 -9.971 0.767 -2.362 1.00 0.00 N ATOM 2010 CA LYS A 126 -10.111 1.678 -3.496 1.00 0.00 C ATOM 2011 C LYS A 126 -8.757 2.019 -4.122 1.00 0.00 C ATOM 2012 O LYS A 126 -8.682 2.852 -5.027 1.00 0.00 O ATOM 2013 CB LYS A 126 -10.826 2.964 -3.070 1.00 0.00 C ATOM 2014 CG LYS A 126 -12.121 2.718 -2.310 1.00 0.00 C ATOM 2015 CD LYS A 126 -11.977 3.054 -0.835 1.00 0.00 C ATOM 2016 CE LYS A 126 -13.315 3.424 -0.214 1.00 0.00 C ATOM 2017 NZ LYS A 126 -14.076 2.221 0.220 1.00 0.00 N ATOM 0 H LYS A 126 -10.300 -0.181 -2.544 1.00 0.00 H new ATOM 0 HA LYS A 126 -10.711 1.166 -4.249 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -10.154 3.553 -2.446 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -11.042 3.560 -3.956 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -12.919 3.320 -2.745 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -12.415 1.674 -2.419 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -11.553 2.200 -0.306 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -11.278 3.882 -0.716 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -13.150 4.078 0.642 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -13.907 3.987 -0.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -14.982 2.515 0.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -14.256 1.609 -0.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -13.523 1.697 0.927 1.00 0.00 H new ATOM 2031 N PHE A 127 -7.692 1.375 -3.649 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.358 1.624 -4.183 1.00 0.00 C ATOM 2033 C PHE A 127 -6.232 1.077 -5.601 1.00 0.00 C ATOM 2034 O PHE A 127 -6.694 -0.026 -5.896 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.300 0.985 -3.282 1.00 0.00 C ATOM 2036 CG PHE A 127 -3.891 1.256 -3.727 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -3.350 2.527 -3.624 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.108 0.239 -4.251 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -2.054 2.780 -4.032 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -1.811 0.485 -4.662 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.284 1.758 -4.553 1.00 0.00 C ATOM 0 H PHE A 127 -7.727 0.682 -2.902 1.00 0.00 H new ATOM 0 HA PHE A 127 -6.198 2.702 -4.212 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -5.429 1.355 -2.265 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.462 -0.092 -3.252 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -3.948 3.330 -3.220 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -3.516 -0.757 -4.339 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.644 3.775 -3.944 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.211 -0.316 -5.067 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.272 1.954 -4.875 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.608 1.856 -6.480 1.00 0.00 N ATOM 2052 CA GLN A 128 -5.426 1.450 -7.870 1.00 0.00 C ATOM 2053 C GLN A 128 -3.960 1.558 -8.282 1.00 0.00 C ATOM 2054 O GLN A 128 -3.112 1.969 -7.491 1.00 0.00 O ATOM 2055 CB GLN A 128 -6.295 2.308 -8.791 1.00 0.00 C ATOM 2056 CG GLN A 128 -7.034 1.506 -9.849 1.00 0.00 C ATOM 2057 CD GLN A 128 -8.284 0.840 -9.309 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -8.273 -0.342 -8.963 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -9.372 1.599 -9.231 1.00 0.00 N ATOM 0 H GLN A 128 -5.220 2.772 -6.254 1.00 0.00 H new ATOM 0 HA GLN A 128 -5.732 0.408 -7.962 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -7.021 2.854 -8.188 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.666 3.050 -9.283 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -7.305 2.164 -10.675 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -6.367 0.745 -10.254 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -9.336 2.574 -9.529 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -10.243 1.207 -8.873 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.670 1.188 -9.526 1.00 0.00 N ATOM 2069 CA ILE A 129 -2.307 1.247 -10.041 1.00 0.00 C ATOM 2070 C ILE A 129 -1.843 2.693 -10.183 1.00 0.00 C ATOM 2071 O ILE A 129 -2.386 3.455 -10.984 1.00 0.00 O ATOM 2072 CB ILE A 129 -2.186 0.544 -11.408 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -2.755 -0.876 -11.330 1.00 0.00 C ATOM 2074 CG2 ILE A 129 -0.734 0.516 -11.868 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.913 -1.824 -10.502 1.00 0.00 C ATOM 0 H ILE A 129 -4.360 0.845 -10.195 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.673 0.728 -9.322 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.765 1.107 -12.140 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -3.759 -0.833 -10.908 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -2.850 -1.276 -12.340 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -0.668 0.016 -12.834 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -0.362 1.536 -11.961 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -0.131 -0.025 -11.138 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -2.378 -2.810 -10.492 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -0.915 -1.898 -10.935 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -1.839 -1.448 -9.482 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.837 3.065 -9.400 1.00 0.00 N ATOM 2088 CA GLY A 130 -0.319 4.420 -9.453 1.00 0.00 C ATOM 2089 C GLY A 130 -0.858 5.300 -8.339 1.00 0.00 C ATOM 2090 O GLY A 130 -0.393 6.423 -8.151 1.00 0.00 O ATOM 0 H GLY A 130 -0.371 2.453 -8.730 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.769 4.391 -9.393 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.573 4.864 -10.416 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.841 4.789 -7.598 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.435 5.543 -6.501 1.00 0.00 C ATOM 2096 C ASP A 131 -1.380 5.935 -5.472 1.00 0.00 C ATOM 2097 O ASP A 131 -0.376 5.243 -5.302 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.541 4.722 -5.831 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.927 5.187 -6.234 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -5.455 6.113 -5.583 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -5.484 4.625 -7.200 1.00 0.00 O ATOM 0 H ASP A 131 -2.239 3.861 -7.738 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.867 6.455 -6.913 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.421 3.671 -6.095 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -3.437 4.792 -4.748 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.613 7.051 -4.793 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.685 7.542 -3.783 1.00 0.00 C ATOM 2108 C TYR A 132 -1.125 7.119 -2.384 1.00 0.00 C ATOM 2109 O TYR A 132 -2.126 7.611 -1.861 1.00 0.00 O ATOM 2110 CB TYR A 132 -0.584 9.066 -3.856 1.00 0.00 C ATOM 2111 CG TYR A 132 -0.439 9.602 -5.263 1.00 0.00 C ATOM 2112 CD1 TYR A 132 -1.539 9.694 -6.108 1.00 0.00 C ATOM 2113 CD2 TYR A 132 0.795 10.017 -5.745 1.00 0.00 C ATOM 2114 CE1 TYR A 132 -1.410 10.183 -7.394 1.00 0.00 C ATOM 2115 CE2 TYR A 132 0.932 10.508 -7.029 1.00 0.00 C ATOM 2116 CZ TYR A 132 -0.175 10.590 -7.849 1.00 0.00 C ATOM 2117 OH TYR A 132 -0.044 11.079 -9.128 1.00 0.00 O ATOM 0 H TYR A 132 -2.439 7.635 -4.924 1.00 0.00 H new ATOM 0 HA TYR A 132 0.294 7.106 -3.983 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.474 9.502 -3.401 1.00 0.00 H new ATOM 0 HB3 TYR A 132 0.270 9.393 -3.263 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -2.509 9.378 -5.754 1.00 0.00 H new ATOM 0 HD2 TYR A 132 1.663 9.955 -5.105 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.274 10.246 -8.040 1.00 0.00 H new ATOM 0 HE2 TYR A 132 1.899 10.826 -7.389 1.00 0.00 H new ATOM 0 HH TYR A 132 0.891 11.323 -9.291 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.370 6.206 -1.780 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.685 5.720 -0.442 1.00 0.00 C ATOM 2129 C LEU A 133 0.222 6.387 0.593 1.00 0.00 C ATOM 2130 O LEU A 133 1.438 6.401 0.439 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.505 4.201 -0.370 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.774 3.360 -0.551 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.519 1.929 -0.108 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -2.940 3.951 0.227 1.00 0.00 C ATOM 0 H LEU A 133 0.463 5.789 -2.196 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.724 5.969 -0.225 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.214 3.905 -1.133 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.065 3.953 0.596 1.00 0.00 H new ATOM 0 HG LEU A 133 -2.037 3.365 -1.609 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.426 1.340 -0.241 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.717 1.500 -0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.231 1.919 0.943 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -3.826 3.333 0.080 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -2.691 3.982 1.288 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.139 4.962 -0.128 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.373 6.933 1.641 1.00 0.00 N ATOM 2147 CA ASP A 134 0.397 7.594 2.696 1.00 0.00 C ATOM 2148 C ASP A 134 0.265 6.831 4.008 1.00 0.00 C ATOM 2149 O ASP A 134 -0.787 6.861 4.649 1.00 0.00 O ATOM 2150 CB ASP A 134 -0.086 9.029 2.881 1.00 0.00 C ATOM 2151 CG ASP A 134 1.021 9.965 3.321 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.429 9.889 4.497 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.481 10.773 2.486 1.00 0.00 O ATOM 0 H ASP A 134 -1.382 6.935 1.789 1.00 0.00 H new ATOM 0 HA ASP A 134 1.446 7.607 2.400 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.510 9.389 1.944 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -0.887 9.046 3.621 1.00 0.00 H new ATOM 2158 N ILE A 135 1.325 6.135 4.397 1.00 0.00 N ATOM 2159 CA ILE A 135 1.319 5.356 5.630 1.00 0.00 C ATOM 2160 C ILE A 135 1.832 6.176 6.809 1.00 0.00 C ATOM 2161 O ILE A 135 2.679 7.058 6.652 1.00 0.00 O ATOM 2162 CB ILE A 135 2.174 4.078 5.488 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.577 3.151 4.427 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.289 3.353 6.827 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.576 2.707 3.383 1.00 0.00 C ATOM 0 H ILE A 135 2.201 6.093 3.877 1.00 0.00 H new ATOM 0 HA ILE A 135 0.284 5.073 5.820 1.00 0.00 H new ATOM 0 HB ILE A 135 3.175 4.370 5.170 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.161 2.271 4.917 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.750 3.662 3.933 1.00 0.00 H new ATOM 0 HG21 ILE A 135 2.895 2.456 6.704 1.00 0.00 H new ATOM 0 HG22 ILE A 135 2.759 4.011 7.558 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.295 3.074 7.176 1.00 0.00 H new ATOM 0 HD11 ILE A 135 2.084 2.053 2.664 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.974 3.580 2.866 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.391 2.168 3.866 1.00 0.00 H new ATOM 2177 N ALA A 136 1.320 5.867 7.992 1.00 0.00 N ATOM 2178 CA ALA A 136 1.726 6.554 9.209 1.00 0.00 C ATOM 2179 C ALA A 136 2.172 5.547 10.260 1.00 0.00 C ATOM 2180 O ALA A 136 1.347 4.864 10.864 1.00 0.00 O ATOM 2181 CB ALA A 136 0.587 7.414 9.736 1.00 0.00 C ATOM 0 H ALA A 136 0.618 5.140 8.135 1.00 0.00 H new ATOM 0 HA ALA A 136 2.569 7.206 8.979 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.906 7.922 10.646 1.00 0.00 H new ATOM 0 HB2 ALA A 136 0.313 8.155 8.985 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.274 6.783 9.955 1.00 0.00 H new ATOM 2187 N ILE A 137 3.481 5.451 10.466 1.00 0.00 N ATOM 2188 CA ILE A 137 4.038 4.519 11.436 1.00 0.00 C ATOM 2189 C ILE A 137 4.158 5.148 12.819 1.00 0.00 C ATOM 2190 O ILE A 137 4.803 6.184 12.991 1.00 0.00 O ATOM 2191 CB ILE A 137 5.420 4.011 10.982 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.332 3.412 9.577 1.00 0.00 C ATOM 2193 CG2 ILE A 137 5.969 2.989 11.965 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.682 3.129 8.957 1.00 0.00 C ATOM 0 H ILE A 137 4.177 6.010 9.972 1.00 0.00 H new ATOM 0 HA ILE A 137 3.348 3.678 11.498 1.00 0.00 H new ATOM 0 HB ILE A 137 6.105 4.858 10.956 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.760 2.485 9.621 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.781 4.097 8.932 1.00 0.00 H new ATOM 0 HG21 ILE A 137 6.945 2.644 11.624 1.00 0.00 H new ATOM 0 HG22 ILE A 137 6.069 3.448 12.949 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.287 2.141 12.028 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.544 2.706 7.962 1.00 0.00 H new ATOM 0 HD12 ILE A 137 7.249 4.057 8.881 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.227 2.420 9.580 1.00 0.00 H new ATOM 2206 N THR A 138 3.535 4.507 13.804 1.00 0.00 N ATOM 2207 CA THR A 138 3.566 4.988 15.180 1.00 0.00 C ATOM 2208 C THR A 138 4.473 4.106 16.038 1.00 0.00 C ATOM 2209 O THR A 138 4.152 2.945 16.295 1.00 0.00 O ATOM 2210 CB THR A 138 2.154 5.003 15.767 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.184 5.096 14.739 1.00 0.00 O ATOM 2212 CG2 THR A 138 1.915 6.148 16.728 1.00 0.00 C ATOM 0 H THR A 138 3.000 3.649 13.672 1.00 0.00 H new ATOM 0 HA THR A 138 3.963 6.003 15.178 1.00 0.00 H new ATOM 0 HB THR A 138 2.061 4.065 16.315 1.00 0.00 H new ATOM 0 HG1 THR A 138 0.912 4.196 14.463 1.00 0.00 H new ATOM 0 HG21 THR A 138 0.894 6.098 17.107 1.00 0.00 H new ATOM 0 HG22 THR A 138 2.615 6.076 17.561 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.064 7.095 16.210 1.00 0.00 H new ATOM 2220 N PRO A 139 5.622 4.637 16.495 1.00 0.00 N ATOM 2221 CA PRO A 139 6.565 3.877 17.324 1.00 0.00 C ATOM 2222 C PRO A 139 5.919 3.354 18.604 1.00 0.00 C ATOM 2223 O PRO A 139 4.926 3.907 19.078 1.00 0.00 O ATOM 2224 CB PRO A 139 7.672 4.888 17.652 1.00 0.00 C ATOM 2225 CG PRO A 139 7.085 6.227 17.354 1.00 0.00 C ATOM 2226 CD PRO A 139 6.097 6.008 16.246 1.00 0.00 C ATOM 0 HA PRO A 139 6.931 2.991 16.806 1.00 0.00 H new ATOM 0 HB2 PRO A 139 7.974 4.815 18.697 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.562 4.706 17.049 1.00 0.00 H new ATOM 0 HG2 PRO A 139 6.597 6.644 18.235 1.00 0.00 H new ATOM 0 HG3 PRO A 139 7.858 6.934 17.053 1.00 0.00 H new ATOM 0 HD2 PRO A 139 5.282 6.731 16.283 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.563 6.102 15.265 1.00 0.00 H new ATOM 2234 N PRO A 140 6.478 2.276 19.182 1.00 0.00 N ATOM 2235 CA PRO A 140 5.950 1.677 20.414 1.00 0.00 C ATOM 2236 C PRO A 140 6.249 2.515 21.655 1.00 0.00 C ATOM 2237 O PRO A 140 5.799 2.191 22.754 1.00 0.00 O ATOM 2238 CB PRO A 140 6.677 0.334 20.487 1.00 0.00 C ATOM 2239 CG PRO A 140 7.964 0.564 19.773 1.00 0.00 C ATOM 2240 CD PRO A 140 7.663 1.556 18.680 1.00 0.00 C ATOM 0 HA PRO A 140 4.863 1.594 20.392 1.00 0.00 H new ATOM 0 HB2 PRO A 140 6.846 0.030 21.520 1.00 0.00 H new ATOM 0 HB3 PRO A 140 6.096 -0.457 20.013 1.00 0.00 H new ATOM 0 HG2 PRO A 140 8.723 0.951 20.453 1.00 0.00 H new ATOM 0 HG3 PRO A 140 8.352 -0.367 19.359 1.00 0.00 H new ATOM 0 HD2 PRO A 140 8.501 2.232 18.510 1.00 0.00 H new ATOM 0 HD3 PRO A 140 7.458 1.058 17.732 1.00 0.00 H new