USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1031 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 149 THR OG1 : rot 160:sc= 0.034 USER MOD Set 1.2: A 150 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 178 SER OG : rot 171:sc= -3.46! USER MOD Set 2.1: A 94 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 148 MET CE :methyl 146:sc= -7.13! (180deg=-11.3!) USER MOD Set 2.3: A 156 CYS SG : rot 136:sc= 0.00547 USER MOD Set 3.1: A 144 LYS NZ :NH3+ -127:sc= 0.797 (180deg=-0.0302) USER MOD Set 3.2: A 146 SER OG : rot -160:sc= -0.369 USER MOD Set 4.1: A 67 HIS : no HD1:sc= -5.05! C(o=-10!,f=-11!) USER MOD Set 4.2: A 98 CYS SG : rot -41:sc= -3.11! USER MOD Set 4.3: A 101 CYS SG : rot 78:sc= -2.26! USER MOD Set 5.1: A 54 ASN : amide:sc= 0 K(o=0,f=-2!) USER MOD Set 5.2: A 71 CYS SG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 CYS SG : rot -150:sc= -1.56 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 MET CE :methyl 156:sc= -0.349 (180deg=-1.51!) USER MOD Single : A 38 HIS : no HE2:sc= -1.01 K(o=-1,f=-2.8) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 41 THR OG1 : rot -170:sc= -0.653 USER MOD Single : A 55 GLN : amide:sc= -0.247 K(o=-0.25,f=-1.8!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -2.84 K(o=-2.8,f=-5.3!) USER MOD Single : A 87 TYR OH : rot 165:sc= 0.0472 USER MOD Single : A 90 THR OG1 : rot -65:sc= -0.696! USER MOD Single : A 91 CYS SG : rot 126:sc= -5.14! USER MOD Single : A 93 THR OG1 : rot 173:sc= -5.74! USER MOD Single : A 96 SER OG : rot 24:sc= -8.53! USER MOD Single : A 100 SER OG : rot -44:sc= 0.602 USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 MET CE :methyl -137:sc= -11.4! (180deg=-15.1!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= -3.27! USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 HIS : no HD1:sc= -8.13! C(o=-8.1!,f=-13!) USER MOD Single : A 116 SER OG : rot 104:sc= -1.9 USER MOD Single : A 118 CYS SG : rot 178:sc= -3.83! USER MOD Single : A 120 LYS NZ :NH3+ -172:sc= 0.332 (180deg=0.301) USER MOD Single : A 121 THR OG1 : rot -131:sc= -0.587 USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc=-0.00503 USER MOD Single : A 151 SER OG : rot 67:sc= 1.21 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 HIS : no HD1:sc= -0.506 X(o=-0.51,f=-0.013) USER MOD Single : A 159 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 HIS : no HD1:sc= -0.323 K(o=-0.32,f=-1.6) USER MOD Single : A 179 GLN : amide:sc= -0.331 K(o=-0.33,f=-2!) USER MOD Single : A 182 SER OG : rot 180:sc= -1.24 USER MOD Single : A 190 GLN :FLIP amide:sc= 0.0568 F(o=-0.94,f=0.057) USER MOD ----------------------------------------------------------------- ATOM 451 N THR A 28 1.774 9.949 0.063 1.00 0.00 N ATOM 452 CA THR A 28 1.423 8.527 0.172 1.00 0.00 C ATOM 453 C THR A 28 2.246 7.805 1.245 1.00 0.00 C ATOM 454 O THR A 28 3.462 7.974 1.330 1.00 0.00 O ATOM 455 CB THR A 28 1.594 7.832 -1.183 1.00 0.00 C ATOM 456 OG1 THR A 28 0.915 6.590 -1.198 1.00 0.00 O ATOM 457 CG2 THR A 28 3.035 7.570 -1.555 1.00 0.00 C ATOM 0 HA THR A 28 0.378 8.476 0.476 1.00 0.00 H new ATOM 0 HB THR A 28 1.173 8.525 -1.911 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.034 6.162 -2.072 1.00 0.00 H new ATOM 0 HG21 THR A 28 3.076 7.076 -2.526 1.00 0.00 H new ATOM 0 HG22 THR A 28 3.575 8.515 -1.606 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.494 6.929 -0.802 1.00 0.00 H new ATOM 465 N TYR A 29 1.564 7.009 2.064 1.00 0.00 N ATOM 466 CA TYR A 29 2.206 6.260 3.140 1.00 0.00 C ATOM 467 C TYR A 29 1.601 4.869 3.238 1.00 0.00 C ATOM 468 O TYR A 29 0.385 4.730 3.376 1.00 0.00 O ATOM 469 CB TYR A 29 2.008 6.988 4.471 1.00 0.00 C ATOM 470 CG TYR A 29 3.066 6.695 5.513 1.00 0.00 C ATOM 471 CD1 TYR A 29 3.447 5.391 5.803 1.00 0.00 C ATOM 472 CD2 TYR A 29 3.678 7.729 6.214 1.00 0.00 C ATOM 473 CE1 TYR A 29 4.409 5.125 6.759 1.00 0.00 C ATOM 474 CE2 TYR A 29 4.640 7.470 7.171 1.00 0.00 C ATOM 475 CZ TYR A 29 5.002 6.167 7.439 1.00 0.00 C ATOM 476 OH TYR A 29 5.959 5.905 8.392 1.00 0.00 O ATOM 0 H TYR A 29 0.556 6.865 2.001 1.00 0.00 H new ATOM 0 HA TYR A 29 3.271 6.179 2.923 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.989 8.062 4.284 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.033 6.718 4.876 1.00 0.00 H new ATOM 0 HD1 TYR A 29 2.984 4.572 5.273 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.396 8.751 6.007 1.00 0.00 H new ATOM 0 HE1 TYR A 29 4.695 4.106 6.972 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.106 8.284 7.706 1.00 0.00 H new ATOM 0 HH TYR A 29 6.277 6.748 8.777 1.00 0.00 H new ATOM 486 N LEU A 30 2.434 3.835 3.170 1.00 0.00 N ATOM 487 CA LEU A 30 1.922 2.477 3.258 1.00 0.00 C ATOM 488 C LEU A 30 2.585 1.689 4.380 1.00 0.00 C ATOM 489 O LEU A 30 3.815 1.695 4.527 1.00 0.00 O ATOM 490 CB LEU A 30 2.089 1.737 1.925 1.00 0.00 C ATOM 491 CG LEU A 30 3.123 2.325 0.967 1.00 0.00 C ATOM 492 CD1 LEU A 30 4.524 2.013 1.455 1.00 0.00 C ATOM 493 CD2 LEU A 30 2.916 1.786 -0.442 1.00 0.00 C ATOM 0 H LEU A 30 3.445 3.910 3.057 1.00 0.00 H new ATOM 0 HA LEU A 30 0.859 2.555 3.487 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.363 0.703 2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.124 1.714 1.419 1.00 0.00 H new ATOM 0 HG LEU A 30 2.996 3.407 0.940 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.253 2.437 0.764 1.00 0.00 H new ATOM 0 HD12 LEU A 30 4.669 2.445 2.445 1.00 0.00 H new ATOM 0 HD13 LEU A 30 4.659 0.933 1.507 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.662 2.217 -1.110 1.00 0.00 H new ATOM 0 HD22 LEU A 30 3.018 0.701 -0.435 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.919 2.054 -0.791 1.00 0.00 H new ATOM 505 N CYS A 31 1.745 0.995 5.150 1.00 0.00 N ATOM 506 CA CYS A 31 2.201 0.158 6.252 1.00 0.00 C ATOM 507 C CYS A 31 2.487 -1.234 5.716 1.00 0.00 C ATOM 508 O CYS A 31 1.698 -1.766 4.940 1.00 0.00 O ATOM 509 CB CYS A 31 1.141 0.093 7.352 1.00 0.00 C ATOM 510 SG CYS A 31 1.478 1.163 8.767 1.00 0.00 S ATOM 0 H CYS A 31 0.733 1.000 5.025 1.00 0.00 H new ATOM 0 HA CYS A 31 3.107 0.584 6.684 1.00 0.00 H new ATOM 0 HB2 CYS A 31 0.175 0.365 6.927 1.00 0.00 H new ATOM 0 HB3 CYS A 31 1.058 -0.936 7.701 1.00 0.00 H new ATOM 0 HG CYS A 31 0.970 0.635 9.841 1.00 0.00 H new ATOM 516 N TYR A 32 3.623 -1.807 6.084 1.00 0.00 N ATOM 517 CA TYR A 32 4.001 -3.106 5.574 1.00 0.00 C ATOM 518 C TYR A 32 3.760 -4.231 6.570 1.00 0.00 C ATOM 519 O TYR A 32 3.921 -4.074 7.784 1.00 0.00 O ATOM 520 CB TYR A 32 5.470 -3.031 5.156 1.00 0.00 C ATOM 521 CG TYR A 32 6.456 -3.827 6.003 1.00 0.00 C ATOM 522 CD1 TYR A 32 6.493 -3.676 7.384 1.00 0.00 C ATOM 523 CD2 TYR A 32 7.363 -4.702 5.420 1.00 0.00 C ATOM 524 CE1 TYR A 32 7.400 -4.373 8.159 1.00 0.00 C ATOM 525 CE2 TYR A 32 8.272 -5.407 6.191 1.00 0.00 C ATOM 526 CZ TYR A 32 8.286 -5.237 7.558 1.00 0.00 C ATOM 527 OH TYR A 32 9.190 -5.935 8.325 1.00 0.00 O ATOM 0 H TYR A 32 4.293 -1.391 6.731 1.00 0.00 H new ATOM 0 HA TYR A 32 3.371 -3.349 4.719 1.00 0.00 H new ATOM 0 HB2 TYR A 32 5.550 -3.375 4.125 1.00 0.00 H new ATOM 0 HB3 TYR A 32 5.776 -1.985 5.168 1.00 0.00 H new ATOM 0 HD1 TYR A 32 5.799 -3.000 7.861 1.00 0.00 H new ATOM 0 HD2 TYR A 32 7.359 -4.835 4.348 1.00 0.00 H new ATOM 0 HE1 TYR A 32 7.413 -4.240 9.231 1.00 0.00 H new ATOM 0 HE2 TYR A 32 8.967 -6.088 5.722 1.00 0.00 H new ATOM 0 HH TYR A 32 9.742 -6.502 7.746 1.00 0.00 H new ATOM 537 N GLU A 33 3.396 -5.371 6.007 1.00 0.00 N ATOM 538 CA GLU A 33 3.147 -6.589 6.755 1.00 0.00 C ATOM 539 C GLU A 33 3.773 -7.730 5.970 1.00 0.00 C ATOM 540 O GLU A 33 3.354 -8.015 4.850 1.00 0.00 O ATOM 541 CB GLU A 33 1.642 -6.810 6.936 1.00 0.00 C ATOM 542 CG GLU A 33 1.279 -8.192 7.456 1.00 0.00 C ATOM 543 CD GLU A 33 -0.215 -8.450 7.432 1.00 0.00 C ATOM 544 OE1 GLU A 33 -0.969 -7.626 7.991 1.00 0.00 O ATOM 545 OE2 GLU A 33 -0.631 -9.475 6.853 1.00 0.00 O ATOM 0 H GLU A 33 3.263 -5.476 5.001 1.00 0.00 H new ATOM 0 HA GLU A 33 3.582 -6.528 7.752 1.00 0.00 H new ATOM 0 HB2 GLU A 33 1.255 -6.060 7.626 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.144 -6.650 5.980 1.00 0.00 H new ATOM 0 HG2 GLU A 33 1.784 -8.947 6.854 1.00 0.00 H new ATOM 0 HG3 GLU A 33 1.646 -8.300 8.477 1.00 0.00 H new ATOM 552 N VAL A 34 4.816 -8.342 6.515 1.00 0.00 N ATOM 553 CA VAL A 34 5.507 -9.392 5.784 1.00 0.00 C ATOM 554 C VAL A 34 5.616 -10.711 6.535 1.00 0.00 C ATOM 555 O VAL A 34 5.736 -10.749 7.758 1.00 0.00 O ATOM 556 CB VAL A 34 6.921 -8.934 5.388 1.00 0.00 C ATOM 557 CG1 VAL A 34 6.859 -7.649 4.578 1.00 0.00 C ATOM 558 CG2 VAL A 34 7.792 -8.753 6.620 1.00 0.00 C ATOM 0 H VAL A 34 5.194 -8.135 7.439 1.00 0.00 H new ATOM 0 HA VAL A 34 4.892 -9.575 4.903 1.00 0.00 H new ATOM 0 HB VAL A 34 7.370 -9.708 4.766 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.869 -7.341 4.307 1.00 0.00 H new ATOM 0 HG12 VAL A 34 6.276 -7.817 3.673 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.388 -6.866 5.173 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.788 -8.429 6.317 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.348 -8.001 7.272 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.866 -9.699 7.156 1.00 0.00 H new ATOM 568 N GLU A 35 5.609 -11.790 5.759 1.00 0.00 N ATOM 569 CA GLU A 35 5.744 -13.141 6.292 1.00 0.00 C ATOM 570 C GLU A 35 7.122 -13.688 5.924 1.00 0.00 C ATOM 571 O GLU A 35 7.865 -13.041 5.189 1.00 0.00 O ATOM 572 CB GLU A 35 4.646 -14.056 5.742 1.00 0.00 C ATOM 573 CG GLU A 35 3.295 -13.375 5.599 1.00 0.00 C ATOM 574 CD GLU A 35 2.169 -14.359 5.349 1.00 0.00 C ATOM 575 OE1 GLU A 35 2.294 -15.525 5.775 1.00 0.00 O ATOM 576 OE2 GLU A 35 1.161 -13.961 4.728 1.00 0.00 O ATOM 0 H GLU A 35 5.510 -11.753 4.745 1.00 0.00 H new ATOM 0 HA GLU A 35 5.640 -13.108 7.377 1.00 0.00 H new ATOM 0 HB2 GLU A 35 4.956 -14.435 4.768 1.00 0.00 H new ATOM 0 HB3 GLU A 35 4.540 -14.918 6.401 1.00 0.00 H new ATOM 0 HG2 GLU A 35 3.081 -12.807 6.504 1.00 0.00 H new ATOM 0 HG3 GLU A 35 3.338 -12.661 4.777 1.00 0.00 H new ATOM 583 N ARG A 36 7.469 -14.872 6.419 1.00 0.00 N ATOM 584 CA ARG A 36 8.770 -15.458 6.108 1.00 0.00 C ATOM 585 C ARG A 36 8.609 -16.649 5.180 1.00 0.00 C ATOM 586 O ARG A 36 7.994 -17.652 5.540 1.00 0.00 O ATOM 587 CB ARG A 36 9.492 -15.878 7.389 1.00 0.00 C ATOM 588 CG ARG A 36 9.478 -14.811 8.472 1.00 0.00 C ATOM 589 CD ARG A 36 10.169 -15.290 9.740 1.00 0.00 C ATOM 590 NE ARG A 36 11.387 -14.531 10.017 1.00 0.00 N ATOM 591 CZ ARG A 36 12.242 -14.832 10.992 1.00 0.00 C ATOM 592 NH1 ARG A 36 12.017 -15.873 11.783 1.00 0.00 N ATOM 593 NH2 ARG A 36 13.326 -14.090 11.175 1.00 0.00 N ATOM 0 H ARG A 36 6.878 -15.438 7.028 1.00 0.00 H new ATOM 0 HA ARG A 36 9.373 -14.703 5.603 1.00 0.00 H new ATOM 0 HB2 ARG A 36 9.028 -16.785 7.777 1.00 0.00 H new ATOM 0 HB3 ARG A 36 10.526 -16.127 7.149 1.00 0.00 H new ATOM 0 HG2 ARG A 36 9.973 -13.912 8.104 1.00 0.00 H new ATOM 0 HG3 ARG A 36 8.448 -14.537 8.700 1.00 0.00 H new ATOM 0 HD2 ARG A 36 9.484 -15.198 10.583 1.00 0.00 H new ATOM 0 HD3 ARG A 36 10.415 -16.347 9.642 1.00 0.00 H new ATOM 0 HE ARG A 36 11.594 -13.724 9.429 1.00 0.00 H new ATOM 0 HH11 ARG A 36 11.185 -16.448 11.646 1.00 0.00 H new ATOM 0 HH12 ARG A 36 12.676 -16.099 12.528 1.00 0.00 H new ATOM 0 HH21 ARG A 36 13.504 -13.289 10.569 1.00 0.00 H new ATOM 0 HH22 ARG A 36 13.981 -14.320 11.922 1.00 0.00 H new ATOM 607 N MET A 37 9.163 -16.533 3.978 1.00 0.00 N ATOM 608 CA MET A 37 9.067 -17.601 2.999 1.00 0.00 C ATOM 609 C MET A 37 10.321 -18.459 3.006 1.00 0.00 C ATOM 610 O MET A 37 11.400 -18.009 2.620 1.00 0.00 O ATOM 611 CB MET A 37 8.818 -17.026 1.605 1.00 0.00 C ATOM 612 CG MET A 37 7.586 -16.140 1.530 1.00 0.00 C ATOM 613 SD MET A 37 6.661 -16.361 -0.002 1.00 0.00 S ATOM 614 CE MET A 37 6.235 -18.097 0.108 1.00 0.00 C ATOM 0 H MET A 37 9.680 -15.713 3.662 1.00 0.00 H new ATOM 0 HA MET A 37 8.223 -18.235 3.269 1.00 0.00 H new ATOM 0 HB2 MET A 37 9.690 -16.450 1.296 1.00 0.00 H new ATOM 0 HB3 MET A 37 8.710 -17.846 0.895 1.00 0.00 H new ATOM 0 HG2 MET A 37 6.935 -16.357 2.377 1.00 0.00 H new ATOM 0 HG3 MET A 37 7.888 -15.097 1.620 1.00 0.00 H new ATOM 0 HE1 MET A 37 5.347 -18.293 -0.494 1.00 0.00 H new ATOM 0 HE2 MET A 37 7.064 -18.699 -0.262 1.00 0.00 H new ATOM 0 HE3 MET A 37 6.034 -18.357 1.147 1.00 0.00 H new ATOM 624 N HIS A 38 10.167 -19.697 3.452 1.00 0.00 N ATOM 625 CA HIS A 38 11.291 -20.627 3.518 1.00 0.00 C ATOM 626 C HIS A 38 11.131 -21.759 2.507 1.00 0.00 C ATOM 627 O HIS A 38 10.936 -22.917 2.878 1.00 0.00 O ATOM 628 CB HIS A 38 11.433 -21.202 4.930 1.00 0.00 C ATOM 629 CG HIS A 38 11.500 -20.156 6.000 1.00 0.00 C ATOM 630 ND1 HIS A 38 12.640 -19.898 6.728 1.00 0.00 N ATOM 631 CD2 HIS A 38 10.557 -19.303 6.465 1.00 0.00 C ATOM 632 CE1 HIS A 38 12.397 -18.932 7.597 1.00 0.00 C ATOM 633 NE2 HIS A 38 11.140 -18.553 7.457 1.00 0.00 N ATOM 0 H HIS A 38 9.279 -20.082 3.773 1.00 0.00 H new ATOM 0 HA HIS A 38 12.195 -20.071 3.270 1.00 0.00 H new ATOM 0 HB2 HIS A 38 10.589 -21.862 5.131 1.00 0.00 H new ATOM 0 HB3 HIS A 38 12.334 -21.814 4.975 1.00 0.00 H new ATOM 0 HD1 HIS A 38 13.533 -20.378 6.614 1.00 0.00 H new ATOM 0 HD2 HIS A 38 9.536 -19.227 6.120 1.00 0.00 H new ATOM 0 HE1 HIS A 38 13.106 -18.523 8.301 1.00 0.00 H new ATOM 642 N ASN A 39 11.219 -21.416 1.224 1.00 0.00 N ATOM 643 CA ASN A 39 11.090 -22.399 0.152 1.00 0.00 C ATOM 644 C ASN A 39 9.872 -23.294 0.370 1.00 0.00 C ATOM 645 O ASN A 39 9.982 -24.518 0.326 1.00 0.00 O ATOM 646 CB ASN A 39 12.356 -23.252 0.061 1.00 0.00 C ATOM 647 CG ASN A 39 12.724 -23.592 -1.370 1.00 0.00 C ATOM 648 OD1 ASN A 39 11.903 -24.108 -2.127 1.00 0.00 O ATOM 649 ND2 ASN A 39 13.964 -23.304 -1.747 1.00 0.00 N ATOM 0 H ASN A 39 11.380 -20.462 0.901 1.00 0.00 H new ATOM 0 HA ASN A 39 10.954 -21.859 -0.785 1.00 0.00 H new ATOM 0 HB2 ASN A 39 13.184 -22.719 0.529 1.00 0.00 H new ATOM 0 HB3 ASN A 39 12.211 -24.174 0.624 1.00 0.00 H new ATOM 0 HD21 ASN A 39 14.269 -23.511 -2.698 1.00 0.00 H new ATOM 0 HD22 ASN A 39 14.612 -22.876 -1.085 1.00 0.00 H new ATOM 656 N ASP A 40 8.720 -22.656 0.609 1.00 0.00 N ATOM 657 CA ASP A 40 7.444 -23.345 0.848 1.00 0.00 C ATOM 658 C ASP A 40 6.780 -22.812 2.115 1.00 0.00 C ATOM 659 O ASP A 40 5.562 -22.909 2.275 1.00 0.00 O ATOM 660 CB ASP A 40 7.631 -24.862 0.968 1.00 0.00 C ATOM 661 CG ASP A 40 6.355 -25.583 1.364 1.00 0.00 C ATOM 662 OD1 ASP A 40 5.887 -25.380 2.503 1.00 0.00 O ATOM 663 OD2 ASP A 40 5.825 -26.350 0.533 1.00 0.00 O ATOM 0 H ASP A 40 8.645 -21.639 0.642 1.00 0.00 H new ATOM 0 HA ASP A 40 6.804 -23.147 -0.012 1.00 0.00 H new ATOM 0 HB2 ASP A 40 7.985 -25.256 0.015 1.00 0.00 H new ATOM 0 HB3 ASP A 40 8.405 -25.071 1.707 1.00 0.00 H new ATOM 668 N THR A 41 7.583 -22.249 3.014 1.00 0.00 N ATOM 669 CA THR A 41 7.061 -21.704 4.261 1.00 0.00 C ATOM 670 C THR A 41 6.600 -20.266 4.076 1.00 0.00 C ATOM 671 O THR A 41 6.998 -19.595 3.127 1.00 0.00 O ATOM 672 CB THR A 41 8.121 -21.759 5.360 1.00 0.00 C ATOM 673 OG1 THR A 41 8.708 -23.046 5.432 1.00 0.00 O ATOM 674 CG2 THR A 41 7.577 -21.422 6.730 1.00 0.00 C ATOM 0 H THR A 41 8.593 -22.159 2.902 1.00 0.00 H new ATOM 0 HA THR A 41 6.207 -22.314 4.555 1.00 0.00 H new ATOM 0 HB THR A 41 8.861 -21.007 5.085 1.00 0.00 H new ATOM 0 HG1 THR A 41 9.265 -23.107 6.236 1.00 0.00 H new ATOM 0 HG21 THR A 41 8.380 -21.479 7.465 1.00 0.00 H new ATOM 0 HG22 THR A 41 7.166 -20.413 6.720 1.00 0.00 H new ATOM 0 HG23 THR A 41 6.792 -22.131 6.994 1.00 0.00 H new ATOM 682 N TRP A 42 5.778 -19.804 5.009 1.00 0.00 N ATOM 683 CA TRP A 42 5.262 -18.450 5.003 1.00 0.00 C ATOM 684 C TRP A 42 4.903 -18.079 6.430 1.00 0.00 C ATOM 685 O TRP A 42 3.766 -18.269 6.863 1.00 0.00 O ATOM 686 CB TRP A 42 4.032 -18.334 4.096 1.00 0.00 C ATOM 687 CG TRP A 42 3.217 -19.590 4.024 1.00 0.00 C ATOM 688 CD1 TRP A 42 2.419 -20.107 5.004 1.00 0.00 C ATOM 689 CD2 TRP A 42 3.124 -20.489 2.913 1.00 0.00 C ATOM 690 NE1 TRP A 42 1.835 -21.273 4.570 1.00 0.00 N ATOM 691 CE2 TRP A 42 2.251 -21.528 3.290 1.00 0.00 C ATOM 692 CE3 TRP A 42 3.692 -20.517 1.637 1.00 0.00 C ATOM 693 CZ2 TRP A 42 1.935 -22.582 2.436 1.00 0.00 C ATOM 694 CZ3 TRP A 42 3.378 -21.563 0.790 1.00 0.00 C ATOM 695 CH2 TRP A 42 2.507 -22.582 1.192 1.00 0.00 C ATOM 0 H TRP A 42 5.451 -20.366 5.795 1.00 0.00 H new ATOM 0 HA TRP A 42 6.019 -17.770 4.612 1.00 0.00 H new ATOM 0 HB2 TRP A 42 3.401 -17.522 4.457 1.00 0.00 H new ATOM 0 HB3 TRP A 42 4.356 -18.064 3.091 1.00 0.00 H new ATOM 0 HD1 TRP A 42 2.269 -19.664 5.978 1.00 0.00 H new ATOM 0 HE1 TRP A 42 1.196 -21.854 5.113 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.365 -19.735 1.318 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 1.264 -23.370 2.744 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 3.812 -21.595 -0.198 1.00 0.00 H new ATOM 0 HH2 TRP A 42 2.281 -23.385 0.506 1.00 0.00 H new ATOM 842 N GLY A 50 4.857 -1.420 9.557 1.00 0.00 N ATOM 843 CA GLY A 50 4.638 -0.250 8.731 1.00 0.00 C ATOM 844 C GLY A 50 5.644 -0.173 7.607 1.00 0.00 C ATOM 845 O GLY A 50 6.551 -0.989 7.538 1.00 0.00 O ATOM 0 HA2 GLY A 50 3.630 -0.278 8.318 1.00 0.00 H new ATOM 0 HA3 GLY A 50 4.706 0.648 9.345 1.00 0.00 H new ATOM 849 N PHE A 51 5.478 0.786 6.712 1.00 0.00 N ATOM 850 CA PHE A 51 6.394 0.937 5.591 1.00 0.00 C ATOM 851 C PHE A 51 6.700 2.396 5.309 1.00 0.00 C ATOM 852 O PHE A 51 6.578 3.253 6.185 1.00 0.00 O ATOM 853 CB PHE A 51 5.951 0.176 4.329 1.00 0.00 C ATOM 854 CG PHE A 51 6.988 -0.809 3.840 1.00 0.00 C ATOM 855 CD1 PHE A 51 7.836 -1.455 4.735 1.00 0.00 C ATOM 856 CD2 PHE A 51 7.111 -1.093 2.490 1.00 0.00 C ATOM 857 CE1 PHE A 51 8.778 -2.358 4.292 1.00 0.00 C ATOM 858 CE2 PHE A 51 8.055 -2.001 2.044 1.00 0.00 C ATOM 859 CZ PHE A 51 8.888 -2.631 2.947 1.00 0.00 C ATOM 0 H PHE A 51 4.721 1.470 6.738 1.00 0.00 H new ATOM 0 HA PHE A 51 7.326 0.463 5.898 1.00 0.00 H new ATOM 0 HB2 PHE A 51 5.023 -0.356 4.539 1.00 0.00 H new ATOM 0 HB3 PHE A 51 5.736 0.892 3.536 1.00 0.00 H new ATOM 0 HD1 PHE A 51 7.755 -1.246 5.791 1.00 0.00 H new ATOM 0 HD2 PHE A 51 6.464 -0.601 1.779 1.00 0.00 H new ATOM 0 HE1 PHE A 51 9.429 -2.851 4.999 1.00 0.00 H new ATOM 0 HE2 PHE A 51 8.140 -2.217 0.989 1.00 0.00 H new ATOM 0 HZ PHE A 51 9.626 -3.338 2.598 1.00 0.00 H new ATOM 869 N LEU A 52 7.179 2.652 4.110 1.00 0.00 N ATOM 870 CA LEU A 52 7.610 3.982 3.713 1.00 0.00 C ATOM 871 C LEU A 52 6.453 4.867 3.262 1.00 0.00 C ATOM 872 O LEU A 52 5.289 4.464 3.290 1.00 0.00 O ATOM 873 CB LEU A 52 8.589 3.844 2.552 1.00 0.00 C ATOM 874 CG LEU A 52 9.639 2.733 2.682 1.00 0.00 C ATOM 875 CD1 LEU A 52 9.998 2.476 4.140 1.00 0.00 C ATOM 876 CD2 LEU A 52 9.133 1.459 2.015 1.00 0.00 C ATOM 0 H LEU A 52 7.282 1.946 3.381 1.00 0.00 H new ATOM 0 HA LEU A 52 8.068 4.454 4.582 1.00 0.00 H new ATOM 0 HB2 LEU A 52 8.017 3.671 1.640 1.00 0.00 H new ATOM 0 HB3 LEU A 52 9.109 4.794 2.427 1.00 0.00 H new ATOM 0 HG LEU A 52 10.548 3.059 2.176 1.00 0.00 H new ATOM 0 HD11 LEU A 52 10.744 1.683 4.197 1.00 0.00 H new ATOM 0 HD12 LEU A 52 10.402 3.387 4.581 1.00 0.00 H new ATOM 0 HD13 LEU A 52 9.105 2.173 4.687 1.00 0.00 H new ATOM 0 HD21 LEU A 52 9.884 0.675 2.111 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.209 1.138 2.497 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.943 1.652 0.959 1.00 0.00 H new ATOM 888 N ALA A 53 6.801 6.089 2.864 1.00 0.00 N ATOM 889 CA ALA A 53 5.827 7.074 2.421 1.00 0.00 C ATOM 890 C ALA A 53 6.499 8.153 1.581 1.00 0.00 C ATOM 891 O ALA A 53 6.936 9.178 2.106 1.00 0.00 O ATOM 892 CB ALA A 53 5.146 7.702 3.624 1.00 0.00 C ATOM 0 H ALA A 53 7.765 6.420 2.841 1.00 0.00 H new ATOM 0 HA ALA A 53 5.080 6.573 1.806 1.00 0.00 H new ATOM 0 HB1 ALA A 53 4.418 8.439 3.286 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.639 6.928 4.200 1.00 0.00 H new ATOM 0 HB3 ALA A 53 5.892 8.190 4.251 1.00 0.00 H new ATOM 898 N ASN A 54 6.584 7.920 0.278 1.00 0.00 N ATOM 899 CA ASN A 54 7.209 8.877 -0.627 1.00 0.00 C ATOM 900 C ASN A 54 6.218 9.341 -1.684 1.00 0.00 C ATOM 901 O ASN A 54 5.370 8.573 -2.125 1.00 0.00 O ATOM 902 CB ASN A 54 8.434 8.253 -1.297 1.00 0.00 C ATOM 903 CG ASN A 54 9.513 9.276 -1.595 1.00 0.00 C ATOM 904 OD1 ASN A 54 9.265 10.282 -2.260 1.00 0.00 O ATOM 905 ND2 ASN A 54 10.721 9.022 -1.104 1.00 0.00 N ATOM 0 H ASN A 54 6.229 7.078 -0.176 1.00 0.00 H new ATOM 0 HA ASN A 54 7.527 9.742 -0.044 1.00 0.00 H new ATOM 0 HB2 ASN A 54 8.842 7.476 -0.651 1.00 0.00 H new ATOM 0 HB3 ASN A 54 8.130 7.768 -2.225 1.00 0.00 H new ATOM 0 HD21 ASN A 54 11.488 9.673 -1.273 1.00 0.00 H new ATOM 0 HD22 ASN A 54 10.882 8.176 -0.558 1.00 0.00 H new ATOM 912 N GLN A 55 6.321 10.602 -2.082 1.00 0.00 N ATOM 913 CA GLN A 55 5.423 11.154 -3.088 1.00 0.00 C ATOM 914 C GLN A 55 6.190 11.582 -4.333 1.00 0.00 C ATOM 915 O GLN A 55 7.332 12.030 -4.249 1.00 0.00 O ATOM 916 CB GLN A 55 4.649 12.342 -2.514 1.00 0.00 C ATOM 917 CG GLN A 55 3.738 13.026 -3.520 1.00 0.00 C ATOM 918 CD GLN A 55 4.208 14.421 -3.882 1.00 0.00 C ATOM 919 OE1 GLN A 55 4.902 15.075 -3.104 1.00 0.00 O ATOM 920 NE2 GLN A 55 3.832 14.884 -5.068 1.00 0.00 N ATOM 0 H GLN A 55 7.014 11.260 -1.726 1.00 0.00 H new ATOM 0 HA GLN A 55 4.718 10.374 -3.374 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.050 12.000 -1.670 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.359 13.072 -2.126 1.00 0.00 H new ATOM 0 HG2 GLN A 55 3.682 12.420 -4.424 1.00 0.00 H new ATOM 0 HG3 GLN A 55 2.729 13.082 -3.111 1.00 0.00 H new ATOM 0 HE21 GLN A 55 3.256 14.307 -5.681 1.00 0.00 H new ATOM 0 HE22 GLN A 55 4.119 15.816 -5.366 1.00 0.00 H new ATOM 929 N ALA A 56 5.545 11.445 -5.484 1.00 0.00 N ATOM 930 CA ALA A 56 6.157 11.827 -6.751 1.00 0.00 C ATOM 931 C ALA A 56 5.711 13.227 -7.172 1.00 0.00 C ATOM 932 O ALA A 56 4.563 13.425 -7.569 1.00 0.00 O ATOM 933 CB ALA A 56 5.806 10.818 -7.833 1.00 0.00 C ATOM 0 H ALA A 56 4.599 11.073 -5.567 1.00 0.00 H new ATOM 0 HA ALA A 56 7.238 11.838 -6.616 1.00 0.00 H new ATOM 0 HB1 ALA A 56 6.270 11.116 -8.773 1.00 0.00 H new ATOM 0 HB2 ALA A 56 6.172 9.833 -7.544 1.00 0.00 H new ATOM 0 HB3 ALA A 56 4.724 10.780 -7.958 1.00 0.00 H new ATOM 1072 N GLY A 65 10.101 11.430 -9.077 1.00 0.00 N ATOM 1073 CA GLY A 65 8.716 11.001 -9.005 1.00 0.00 C ATOM 1074 C GLY A 65 8.578 9.558 -8.558 1.00 0.00 C ATOM 1075 O GLY A 65 8.260 8.680 -9.360 1.00 0.00 O ATOM 0 HA2 GLY A 65 8.175 11.646 -8.313 1.00 0.00 H new ATOM 0 HA3 GLY A 65 8.250 11.121 -9.983 1.00 0.00 H new ATOM 1079 N ARG A 66 8.817 9.312 -7.274 1.00 0.00 N ATOM 1080 CA ARG A 66 8.717 7.967 -6.721 1.00 0.00 C ATOM 1081 C ARG A 66 7.898 7.964 -5.435 1.00 0.00 C ATOM 1082 O ARG A 66 8.086 8.813 -4.564 1.00 0.00 O ATOM 1083 CB ARG A 66 10.112 7.395 -6.454 1.00 0.00 C ATOM 1084 CG ARG A 66 10.962 8.268 -5.545 1.00 0.00 C ATOM 1085 CD ARG A 66 11.589 9.427 -6.307 1.00 0.00 C ATOM 1086 NE ARG A 66 11.358 10.706 -5.641 1.00 0.00 N ATOM 1087 CZ ARG A 66 12.016 11.106 -4.556 1.00 0.00 C ATOM 1088 NH1 ARG A 66 12.946 10.331 -4.011 1.00 0.00 N ATOM 1089 NH2 ARG A 66 11.745 12.285 -4.012 1.00 0.00 N ATOM 0 H ARG A 66 9.081 10.027 -6.597 1.00 0.00 H new ATOM 0 HA ARG A 66 8.209 7.339 -7.453 1.00 0.00 H new ATOM 0 HB2 ARG A 66 10.011 6.407 -6.005 1.00 0.00 H new ATOM 0 HB3 ARG A 66 10.629 7.262 -7.404 1.00 0.00 H new ATOM 0 HG2 ARG A 66 10.347 8.656 -4.733 1.00 0.00 H new ATOM 0 HG3 ARG A 66 11.747 7.664 -5.090 1.00 0.00 H new ATOM 0 HD2 ARG A 66 12.661 9.258 -6.406 1.00 0.00 H new ATOM 0 HD3 ARG A 66 11.177 9.463 -7.316 1.00 0.00 H new ATOM 0 HE ARG A 66 10.651 11.329 -6.031 1.00 0.00 H new ATOM 0 HH11 ARG A 66 13.160 9.423 -4.424 1.00 0.00 H new ATOM 0 HH12 ARG A 66 13.447 10.643 -3.179 1.00 0.00 H new ATOM 0 HH21 ARG A 66 11.032 12.886 -4.425 1.00 0.00 H new ATOM 0 HH22 ARG A 66 12.250 12.591 -3.180 1.00 0.00 H new ATOM 1103 N HIS A 67 6.978 7.011 -5.330 1.00 0.00 N ATOM 1104 CA HIS A 67 6.119 6.903 -4.159 1.00 0.00 C ATOM 1105 C HIS A 67 6.587 5.819 -3.201 1.00 0.00 C ATOM 1106 O HIS A 67 7.450 5.008 -3.536 1.00 0.00 O ATOM 1107 CB HIS A 67 4.686 6.598 -4.582 1.00 0.00 C ATOM 1108 CG HIS A 67 4.197 7.475 -5.686 1.00 0.00 C ATOM 1109 ND1 HIS A 67 4.809 7.477 -6.912 1.00 0.00 N ATOM 1110 CD2 HIS A 67 3.182 8.372 -5.692 1.00 0.00 C ATOM 1111 CE1 HIS A 67 4.167 8.371 -7.634 1.00 0.00 C ATOM 1112 NE2 HIS A 67 3.168 8.940 -6.939 1.00 0.00 N ATOM 0 H HIS A 67 6.809 6.302 -6.043 1.00 0.00 H new ATOM 0 HA HIS A 67 6.167 7.862 -3.643 1.00 0.00 H new ATOM 0 HB2 HIS A 67 4.622 5.557 -4.899 1.00 0.00 H new ATOM 0 HB3 HIS A 67 4.028 6.710 -3.720 1.00 0.00 H new ATOM 0 HD2 HIS A 67 2.514 8.596 -4.873 1.00 0.00 H new ATOM 0 HE1 HIS A 67 4.413 8.616 -8.657 1.00 0.00 H new ATOM 0 HE2 HIS A 67 2.524 9.656 -7.275 1.00 0.00 H new ATOM 1120 N ALA A 68 5.985 5.802 -2.007 1.00 0.00 N ATOM 1121 CA ALA A 68 6.303 4.806 -0.993 1.00 0.00 C ATOM 1122 C ALA A 68 6.452 3.433 -1.631 1.00 0.00 C ATOM 1123 O ALA A 68 7.282 2.623 -1.216 1.00 0.00 O ATOM 1124 CB ALA A 68 5.212 4.777 0.064 1.00 0.00 C ATOM 0 H ALA A 68 5.271 6.473 -1.724 1.00 0.00 H new ATOM 0 HA ALA A 68 7.248 5.074 -0.520 1.00 0.00 H new ATOM 0 HB1 ALA A 68 5.457 4.030 0.819 1.00 0.00 H new ATOM 0 HB2 ALA A 68 5.135 5.757 0.535 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.260 4.523 -0.402 1.00 0.00 H new ATOM 1130 N GLU A 69 5.649 3.194 -2.663 1.00 0.00 N ATOM 1131 CA GLU A 69 5.690 1.936 -3.392 1.00 0.00 C ATOM 1132 C GLU A 69 7.093 1.699 -3.927 1.00 0.00 C ATOM 1133 O GLU A 69 7.717 0.677 -3.646 1.00 0.00 O ATOM 1134 CB GLU A 69 4.697 1.962 -4.546 1.00 0.00 C ATOM 1135 CG GLU A 69 3.256 1.732 -4.122 1.00 0.00 C ATOM 1136 CD GLU A 69 2.332 2.844 -4.576 1.00 0.00 C ATOM 1137 OE1 GLU A 69 2.769 4.014 -4.586 1.00 0.00 O ATOM 1138 OE2 GLU A 69 1.169 2.546 -4.921 1.00 0.00 O ATOM 0 H GLU A 69 4.960 3.860 -3.013 1.00 0.00 H new ATOM 0 HA GLU A 69 5.420 1.127 -2.714 1.00 0.00 H new ATOM 0 HB2 GLU A 69 4.768 2.925 -5.052 1.00 0.00 H new ATOM 0 HB3 GLU A 69 4.978 1.199 -5.272 1.00 0.00 H new ATOM 0 HG2 GLU A 69 2.907 0.784 -4.532 1.00 0.00 H new ATOM 0 HG3 GLU A 69 3.210 1.646 -3.036 1.00 0.00 H new ATOM 1145 N LEU A 70 7.597 2.670 -4.680 1.00 0.00 N ATOM 1146 CA LEU A 70 8.942 2.577 -5.222 1.00 0.00 C ATOM 1147 C LEU A 70 9.933 2.535 -4.067 1.00 0.00 C ATOM 1148 O LEU A 70 10.984 1.891 -4.144 1.00 0.00 O ATOM 1149 CB LEU A 70 9.236 3.761 -6.149 1.00 0.00 C ATOM 1150 CG LEU A 70 9.564 3.383 -7.596 1.00 0.00 C ATOM 1151 CD1 LEU A 70 8.538 2.400 -8.142 1.00 0.00 C ATOM 1152 CD2 LEU A 70 9.628 4.629 -8.467 1.00 0.00 C ATOM 0 H LEU A 70 7.097 3.524 -4.926 1.00 0.00 H new ATOM 0 HA LEU A 70 9.035 1.667 -5.814 1.00 0.00 H new ATOM 0 HB2 LEU A 70 8.372 4.426 -6.150 1.00 0.00 H new ATOM 0 HB3 LEU A 70 10.073 4.326 -5.738 1.00 0.00 H new ATOM 0 HG LEU A 70 10.540 2.898 -7.612 1.00 0.00 H new ATOM 0 HD11 LEU A 70 8.790 2.145 -9.171 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.540 1.496 -7.533 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.548 2.854 -8.113 1.00 0.00 H new ATOM 0 HD21 LEU A 70 9.862 4.344 -9.493 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.665 5.140 -8.443 1.00 0.00 H new ATOM 0 HD23 LEU A 70 10.403 5.297 -8.090 1.00 0.00 H new ATOM 1164 N CYS A 71 9.560 3.188 -2.966 1.00 0.00 N ATOM 1165 CA CYS A 71 10.397 3.178 -1.774 1.00 0.00 C ATOM 1166 C CYS A 71 10.505 1.746 -1.289 1.00 0.00 C ATOM 1167 O CYS A 71 11.549 1.301 -0.815 1.00 0.00 O ATOM 1168 CB CYS A 71 9.806 4.067 -0.679 1.00 0.00 C ATOM 1169 SG CYS A 71 10.900 5.401 -0.141 1.00 0.00 S ATOM 0 H CYS A 71 8.696 3.722 -2.878 1.00 0.00 H new ATOM 0 HA CYS A 71 11.384 3.573 -2.015 1.00 0.00 H new ATOM 0 HB2 CYS A 71 8.874 4.500 -1.041 1.00 0.00 H new ATOM 0 HB3 CYS A 71 9.556 3.447 0.182 1.00 0.00 H new ATOM 0 HG CYS A 71 10.311 6.098 0.785 1.00 0.00 H new ATOM 1175 N PHE A 72 9.407 1.019 -1.463 1.00 0.00 N ATOM 1176 CA PHE A 72 9.345 -0.379 -1.107 1.00 0.00 C ATOM 1177 C PHE A 72 10.249 -1.157 -2.061 1.00 0.00 C ATOM 1178 O PHE A 72 10.920 -2.113 -1.671 1.00 0.00 O ATOM 1179 CB PHE A 72 7.883 -0.851 -1.176 1.00 0.00 C ATOM 1180 CG PHE A 72 7.676 -2.212 -1.783 1.00 0.00 C ATOM 1181 CD1 PHE A 72 8.338 -3.320 -1.284 1.00 0.00 C ATOM 1182 CD2 PHE A 72 6.808 -2.380 -2.849 1.00 0.00 C ATOM 1183 CE1 PHE A 72 8.142 -4.569 -1.837 1.00 0.00 C ATOM 1184 CE2 PHE A 72 6.609 -3.627 -3.406 1.00 0.00 C ATOM 1185 CZ PHE A 72 7.277 -4.722 -2.898 1.00 0.00 C ATOM 0 H PHE A 72 8.541 1.388 -1.855 1.00 0.00 H new ATOM 0 HA PHE A 72 9.696 -0.548 -0.089 1.00 0.00 H new ATOM 0 HB2 PHE A 72 7.471 -0.855 -0.167 1.00 0.00 H new ATOM 0 HB3 PHE A 72 7.310 -0.124 -1.751 1.00 0.00 H new ATOM 0 HD1 PHE A 72 9.016 -3.206 -0.451 1.00 0.00 H new ATOM 0 HD2 PHE A 72 6.281 -1.526 -3.249 1.00 0.00 H new ATOM 0 HE1 PHE A 72 8.666 -5.425 -1.439 1.00 0.00 H new ATOM 0 HE2 PHE A 72 5.931 -3.745 -4.238 1.00 0.00 H new ATOM 0 HZ PHE A 72 7.122 -5.699 -3.332 1.00 0.00 H new ATOM 1195 N LEU A 73 10.300 -0.697 -3.311 1.00 0.00 N ATOM 1196 CA LEU A 73 11.158 -1.312 -4.314 1.00 0.00 C ATOM 1197 C LEU A 73 12.604 -1.255 -3.844 1.00 0.00 C ATOM 1198 O LEU A 73 13.436 -2.068 -4.242 1.00 0.00 O ATOM 1199 CB LEU A 73 11.011 -0.597 -5.660 1.00 0.00 C ATOM 1200 CG LEU A 73 10.427 -1.452 -6.783 1.00 0.00 C ATOM 1201 CD1 LEU A 73 8.986 -1.816 -6.470 1.00 0.00 C ATOM 1202 CD2 LEU A 73 10.519 -0.721 -8.115 1.00 0.00 C ATOM 0 H LEU A 73 9.757 0.098 -3.649 1.00 0.00 H new ATOM 0 HA LEU A 73 10.860 -2.352 -4.447 1.00 0.00 H new ATOM 0 HB2 LEU A 73 10.376 0.278 -5.522 1.00 0.00 H new ATOM 0 HB3 LEU A 73 11.991 -0.235 -5.971 1.00 0.00 H new ATOM 0 HG LEU A 73 11.008 -2.371 -6.859 1.00 0.00 H new ATOM 0 HD11 LEU A 73 8.581 -2.425 -7.278 1.00 0.00 H new ATOM 0 HD12 LEU A 73 8.947 -2.378 -5.537 1.00 0.00 H new ATOM 0 HD13 LEU A 73 8.394 -0.906 -6.370 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.098 -1.346 -8.903 1.00 0.00 H new ATOM 0 HD22 LEU A 73 9.961 0.214 -8.056 1.00 0.00 H new ATOM 0 HD23 LEU A 73 11.564 -0.507 -8.341 1.00 0.00 H new ATOM 1214 N ASP A 74 12.887 -0.280 -2.984 1.00 0.00 N ATOM 1215 CA ASP A 74 14.221 -0.106 -2.433 1.00 0.00 C ATOM 1216 C ASP A 74 14.428 -1.032 -1.232 1.00 0.00 C ATOM 1217 O ASP A 74 15.522 -1.578 -1.034 1.00 0.00 O ATOM 1218 CB ASP A 74 14.433 1.356 -2.025 1.00 0.00 C ATOM 1219 CG ASP A 74 15.728 1.574 -1.265 1.00 0.00 C ATOM 1220 OD1 ASP A 74 16.793 1.643 -1.913 1.00 0.00 O ATOM 1221 OD2 ASP A 74 15.675 1.677 -0.021 1.00 0.00 O ATOM 0 H ASP A 74 12.204 0.403 -2.655 1.00 0.00 H new ATOM 0 HA ASP A 74 14.953 -0.367 -3.197 1.00 0.00 H new ATOM 0 HB2 ASP A 74 14.432 1.981 -2.918 1.00 0.00 H new ATOM 0 HB3 ASP A 74 13.596 1.681 -1.407 1.00 0.00 H new ATOM 1226 N VAL A 75 13.376 -1.222 -0.430 1.00 0.00 N ATOM 1227 CA VAL A 75 13.483 -2.095 0.735 1.00 0.00 C ATOM 1228 C VAL A 75 14.002 -3.474 0.323 1.00 0.00 C ATOM 1229 O VAL A 75 14.850 -4.029 1.000 1.00 0.00 O ATOM 1230 CB VAL A 75 12.158 -2.220 1.530 1.00 0.00 C ATOM 1231 CG1 VAL A 75 11.553 -0.847 1.794 1.00 0.00 C ATOM 1232 CG2 VAL A 75 11.158 -3.119 0.824 1.00 0.00 C ATOM 0 H VAL A 75 12.461 -0.792 -0.564 1.00 0.00 H new ATOM 0 HA VAL A 75 14.200 -1.628 1.410 1.00 0.00 H new ATOM 0 HB VAL A 75 12.397 -2.684 2.487 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.624 -0.960 2.353 1.00 0.00 H new ATOM 0 HG12 VAL A 75 12.254 -0.246 2.373 1.00 0.00 H new ATOM 0 HG13 VAL A 75 11.347 -0.351 0.845 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.244 -3.180 1.414 1.00 0.00 H new ATOM 0 HG22 VAL A 75 10.929 -2.707 -0.159 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.583 -4.116 0.709 1.00 0.00 H new ATOM 1242 N ILE A 76 13.503 -4.012 -0.795 1.00 0.00 N ATOM 1243 CA ILE A 76 13.957 -5.316 -1.291 1.00 0.00 C ATOM 1244 C ILE A 76 15.490 -5.356 -1.408 1.00 0.00 C ATOM 1245 O ILE A 76 16.152 -6.102 -0.688 1.00 0.00 O ATOM 1246 CB ILE A 76 13.350 -5.695 -2.676 1.00 0.00 C ATOM 1247 CG1 ILE A 76 12.347 -4.652 -3.185 1.00 0.00 C ATOM 1248 CG2 ILE A 76 12.689 -7.054 -2.602 1.00 0.00 C ATOM 1249 CD1 ILE A 76 11.008 -4.704 -2.481 1.00 0.00 C ATOM 0 H ILE A 76 12.788 -3.567 -1.371 1.00 0.00 H new ATOM 0 HA ILE A 76 13.608 -6.042 -0.557 1.00 0.00 H new ATOM 0 HB ILE A 76 14.175 -5.724 -3.388 1.00 0.00 H new ATOM 0 HG12 ILE A 76 12.775 -3.657 -3.060 1.00 0.00 H new ATOM 0 HG13 ILE A 76 12.192 -4.801 -4.254 1.00 0.00 H new ATOM 0 HG21 ILE A 76 12.269 -7.308 -3.575 1.00 0.00 H new ATOM 0 HG22 ILE A 76 13.428 -7.803 -2.320 1.00 0.00 H new ATOM 0 HG23 ILE A 76 11.893 -7.031 -1.858 1.00 0.00 H new ATOM 0 HD11 ILE A 76 10.350 -3.939 -2.893 1.00 0.00 H new ATOM 0 HD12 ILE A 76 10.558 -5.686 -2.627 1.00 0.00 H new ATOM 0 HD13 ILE A 76 11.150 -4.525 -1.415 1.00 0.00 H new ATOM 1261 N PRO A 77 16.078 -4.553 -2.327 1.00 0.00 N ATOM 1262 CA PRO A 77 17.534 -4.512 -2.531 1.00 0.00 C ATOM 1263 C PRO A 77 18.324 -4.476 -1.226 1.00 0.00 C ATOM 1264 O PRO A 77 19.453 -4.962 -1.161 1.00 0.00 O ATOM 1265 CB PRO A 77 17.741 -3.211 -3.301 1.00 0.00 C ATOM 1266 CG PRO A 77 16.479 -3.016 -4.066 1.00 0.00 C ATOM 1267 CD PRO A 77 15.376 -3.630 -3.243 1.00 0.00 C ATOM 0 HA PRO A 77 17.888 -5.405 -3.046 1.00 0.00 H new ATOM 0 HB2 PRO A 77 17.926 -2.376 -2.625 1.00 0.00 H new ATOM 0 HB3 PRO A 77 18.601 -3.278 -3.967 1.00 0.00 H new ATOM 0 HG2 PRO A 77 16.290 -1.956 -4.238 1.00 0.00 H new ATOM 0 HG3 PRO A 77 16.542 -3.491 -5.045 1.00 0.00 H new ATOM 0 HD2 PRO A 77 14.819 -2.871 -2.694 1.00 0.00 H new ATOM 0 HD3 PRO A 77 14.659 -4.160 -3.870 1.00 0.00 H new ATOM 1275 N PHE A 78 17.728 -3.898 -0.190 1.00 0.00 N ATOM 1276 CA PHE A 78 18.384 -3.804 1.114 1.00 0.00 C ATOM 1277 C PHE A 78 17.923 -4.946 2.008 1.00 0.00 C ATOM 1278 O PHE A 78 18.674 -5.457 2.838 1.00 0.00 O ATOM 1279 CB PHE A 78 18.082 -2.443 1.758 1.00 0.00 C ATOM 1280 CG PHE A 78 17.823 -2.496 3.240 1.00 0.00 C ATOM 1281 CD1 PHE A 78 16.551 -2.761 3.722 1.00 0.00 C ATOM 1282 CD2 PHE A 78 18.850 -2.282 4.145 1.00 0.00 C ATOM 1283 CE1 PHE A 78 16.309 -2.811 5.081 1.00 0.00 C ATOM 1284 CE2 PHE A 78 18.612 -2.331 5.506 1.00 0.00 C ATOM 1285 CZ PHE A 78 17.340 -2.596 5.975 1.00 0.00 C ATOM 0 H PHE A 78 16.795 -3.488 -0.224 1.00 0.00 H new ATOM 0 HA PHE A 78 19.463 -3.885 0.983 1.00 0.00 H new ATOM 0 HB2 PHE A 78 18.922 -1.773 1.573 1.00 0.00 H new ATOM 0 HB3 PHE A 78 17.213 -2.007 1.266 1.00 0.00 H new ATOM 0 HD1 PHE A 78 15.741 -2.930 3.028 1.00 0.00 H new ATOM 0 HD2 PHE A 78 19.846 -2.075 3.784 1.00 0.00 H new ATOM 0 HE1 PHE A 78 15.313 -3.018 5.445 1.00 0.00 H new ATOM 0 HE2 PHE A 78 19.420 -2.162 6.202 1.00 0.00 H new ATOM 0 HZ PHE A 78 17.152 -2.635 7.038 1.00 0.00 H new ATOM 1295 N TRP A 79 16.679 -5.337 1.805 1.00 0.00 N ATOM 1296 CA TRP A 79 16.055 -6.418 2.537 1.00 0.00 C ATOM 1297 C TRP A 79 16.856 -7.697 2.409 1.00 0.00 C ATOM 1298 O TRP A 79 16.739 -8.602 3.234 1.00 0.00 O ATOM 1299 CB TRP A 79 14.681 -6.681 1.923 1.00 0.00 C ATOM 1300 CG TRP A 79 13.546 -6.010 2.605 1.00 0.00 C ATOM 1301 CD1 TRP A 79 13.590 -4.899 3.386 1.00 0.00 C ATOM 1302 CD2 TRP A 79 12.180 -6.416 2.543 1.00 0.00 C ATOM 1303 NE1 TRP A 79 12.328 -4.585 3.817 1.00 0.00 N ATOM 1304 CE2 TRP A 79 11.442 -5.507 3.314 1.00 0.00 C ATOM 1305 CE3 TRP A 79 11.513 -7.466 1.907 1.00 0.00 C ATOM 1306 CZ2 TRP A 79 10.062 -5.618 3.467 1.00 0.00 C ATOM 1307 CZ3 TRP A 79 10.146 -7.573 2.058 1.00 0.00 C ATOM 1308 CH2 TRP A 79 9.434 -6.654 2.832 1.00 0.00 C ATOM 0 H TRP A 79 16.065 -4.904 1.115 1.00 0.00 H new ATOM 0 HA TRP A 79 15.991 -6.133 3.587 1.00 0.00 H new ATOM 0 HB2 TRP A 79 14.699 -6.361 0.881 1.00 0.00 H new ATOM 0 HB3 TRP A 79 14.500 -7.756 1.923 1.00 0.00 H new ATOM 0 HD1 TRP A 79 14.485 -4.346 3.630 1.00 0.00 H new ATOM 0 HE1 TRP A 79 12.085 -3.795 4.415 1.00 0.00 H new ATOM 0 HE3 TRP A 79 12.058 -8.181 1.308 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 9.507 -4.911 4.066 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 9.618 -8.379 1.570 1.00 0.00 H new ATOM 0 HH2 TRP A 79 8.364 -6.764 2.931 1.00 0.00 H new ATOM 1319 N LYS A 80 17.580 -7.808 1.302 1.00 0.00 N ATOM 1320 CA LYS A 80 18.294 -9.030 0.995 1.00 0.00 C ATOM 1321 C LYS A 80 17.221 -10.018 0.577 1.00 0.00 C ATOM 1322 O LYS A 80 17.390 -11.236 0.612 1.00 0.00 O ATOM 1323 CB LYS A 80 19.083 -9.537 2.205 1.00 0.00 C ATOM 1324 CG LYS A 80 19.878 -8.442 2.896 1.00 0.00 C ATOM 1325 CD LYS A 80 21.316 -8.403 2.404 1.00 0.00 C ATOM 1326 CE LYS A 80 21.383 -8.375 0.885 1.00 0.00 C ATOM 1327 NZ LYS A 80 22.786 -8.322 0.389 1.00 0.00 N ATOM 0 H LYS A 80 17.685 -7.068 0.608 1.00 0.00 H new ATOM 0 HA LYS A 80 19.034 -8.880 0.209 1.00 0.00 H new ATOM 0 HB2 LYS A 80 18.393 -9.984 2.921 1.00 0.00 H new ATOM 0 HB3 LYS A 80 19.764 -10.325 1.884 1.00 0.00 H new ATOM 0 HG2 LYS A 80 19.404 -7.477 2.715 1.00 0.00 H new ATOM 0 HG3 LYS A 80 19.865 -8.606 3.973 1.00 0.00 H new ATOM 0 HD2 LYS A 80 21.816 -7.523 2.808 1.00 0.00 H new ATOM 0 HD3 LYS A 80 21.853 -9.275 2.777 1.00 0.00 H new ATOM 0 HE2 LYS A 80 20.890 -9.261 0.484 1.00 0.00 H new ATOM 0 HE3 LYS A 80 20.834 -7.509 0.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 22.786 -8.304 -0.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 23.250 -7.464 0.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 23.303 -9.161 0.721 1.00 0.00 H new ATOM 1341 N LEU A 81 16.085 -9.421 0.207 1.00 0.00 N ATOM 1342 CA LEU A 81 14.897 -10.124 -0.204 1.00 0.00 C ATOM 1343 C LEU A 81 15.193 -11.212 -1.231 1.00 0.00 C ATOM 1344 O LEU A 81 15.725 -10.948 -2.308 1.00 0.00 O ATOM 1345 CB LEU A 81 13.886 -9.106 -0.761 1.00 0.00 C ATOM 1346 CG LEU A 81 12.643 -9.717 -1.414 1.00 0.00 C ATOM 1347 CD1 LEU A 81 12.911 -10.025 -2.876 1.00 0.00 C ATOM 1348 CD2 LEU A 81 12.214 -10.970 -0.670 1.00 0.00 C ATOM 0 H LEU A 81 15.978 -8.407 0.189 1.00 0.00 H new ATOM 0 HA LEU A 81 14.477 -10.630 0.666 1.00 0.00 H new ATOM 0 HB2 LEU A 81 13.567 -8.452 0.051 1.00 0.00 H new ATOM 0 HB3 LEU A 81 14.392 -8.479 -1.495 1.00 0.00 H new ATOM 0 HG LEU A 81 11.830 -8.993 -1.360 1.00 0.00 H new ATOM 0 HD11 LEU A 81 12.018 -10.459 -3.326 1.00 0.00 H new ATOM 0 HD12 LEU A 81 13.171 -9.105 -3.400 1.00 0.00 H new ATOM 0 HD13 LEU A 81 13.737 -10.733 -2.953 1.00 0.00 H new ATOM 0 HD21 LEU A 81 11.329 -11.392 -1.147 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.022 -11.701 -0.693 1.00 0.00 H new ATOM 0 HD23 LEU A 81 11.983 -10.717 0.365 1.00 0.00 H new ATOM 1360 N ASP A 82 14.823 -12.438 -0.869 1.00 0.00 N ATOM 1361 CA ASP A 82 15.009 -13.612 -1.717 1.00 0.00 C ATOM 1362 C ASP A 82 16.437 -14.132 -1.648 1.00 0.00 C ATOM 1363 O ASP A 82 16.675 -15.249 -1.191 1.00 0.00 O ATOM 1364 CB ASP A 82 14.620 -13.308 -3.161 1.00 0.00 C ATOM 1365 CG ASP A 82 14.637 -14.545 -4.038 1.00 0.00 C ATOM 1366 OD1 ASP A 82 13.653 -15.314 -4.001 1.00 0.00 O ATOM 1367 OD2 ASP A 82 15.634 -14.745 -4.763 1.00 0.00 O ATOM 0 H ASP A 82 14.383 -12.646 0.027 1.00 0.00 H new ATOM 0 HA ASP A 82 14.351 -14.394 -1.338 1.00 0.00 H new ATOM 0 HB2 ASP A 82 13.624 -12.866 -3.180 1.00 0.00 H new ATOM 0 HB3 ASP A 82 15.306 -12.566 -3.571 1.00 0.00 H new ATOM 1372 N LEU A 83 17.391 -13.325 -2.100 1.00 0.00 N ATOM 1373 CA LEU A 83 18.792 -13.733 -2.074 1.00 0.00 C ATOM 1374 C LEU A 83 19.175 -14.236 -0.687 1.00 0.00 C ATOM 1375 O LEU A 83 20.036 -15.103 -0.544 1.00 0.00 O ATOM 1376 CB LEU A 83 19.710 -12.580 -2.495 1.00 0.00 C ATOM 1377 CG LEU A 83 19.233 -11.180 -2.103 1.00 0.00 C ATOM 1378 CD1 LEU A 83 20.409 -10.315 -1.679 1.00 0.00 C ATOM 1379 CD2 LEU A 83 18.483 -10.531 -3.257 1.00 0.00 C ATOM 0 H LEU A 83 17.224 -12.395 -2.485 1.00 0.00 H new ATOM 0 HA LEU A 83 18.919 -14.546 -2.789 1.00 0.00 H new ATOM 0 HB2 LEU A 83 20.695 -12.745 -2.058 1.00 0.00 H new ATOM 0 HB3 LEU A 83 19.832 -12.613 -3.578 1.00 0.00 H new ATOM 0 HG LEU A 83 18.552 -11.273 -1.257 1.00 0.00 H new ATOM 0 HD11 LEU A 83 20.051 -9.323 -1.404 1.00 0.00 H new ATOM 0 HD12 LEU A 83 20.906 -10.771 -0.823 1.00 0.00 H new ATOM 0 HD13 LEU A 83 21.114 -10.229 -2.506 1.00 0.00 H new ATOM 0 HD21 LEU A 83 18.151 -9.536 -2.961 1.00 0.00 H new ATOM 0 HD22 LEU A 83 19.143 -10.451 -4.121 1.00 0.00 H new ATOM 0 HD23 LEU A 83 17.617 -11.140 -3.517 1.00 0.00 H new ATOM 1391 N ASP A 84 18.517 -13.691 0.328 1.00 0.00 N ATOM 1392 CA ASP A 84 18.769 -14.083 1.705 1.00 0.00 C ATOM 1393 C ASP A 84 17.520 -14.696 2.330 1.00 0.00 C ATOM 1394 O ASP A 84 17.598 -15.680 3.067 1.00 0.00 O ATOM 1395 CB ASP A 84 19.203 -12.867 2.517 1.00 0.00 C ATOM 1396 CG ASP A 84 20.680 -12.560 2.360 1.00 0.00 C ATOM 1397 OD1 ASP A 84 21.230 -12.828 1.272 1.00 0.00 O ATOM 1398 OD2 ASP A 84 21.287 -12.051 3.327 1.00 0.00 O ATOM 0 H ASP A 84 17.801 -12.972 0.220 1.00 0.00 H new ATOM 0 HA ASP A 84 19.563 -14.829 1.711 1.00 0.00 H new ATOM 0 HB2 ASP A 84 18.620 -12.000 2.206 1.00 0.00 H new ATOM 0 HB3 ASP A 84 18.981 -13.039 3.570 1.00 0.00 H new ATOM 1403 N GLN A 85 16.369 -14.098 2.035 1.00 0.00 N ATOM 1404 CA GLN A 85 15.094 -14.573 2.570 1.00 0.00 C ATOM 1405 C GLN A 85 13.928 -13.908 1.851 1.00 0.00 C ATOM 1406 O GLN A 85 13.905 -12.688 1.686 1.00 0.00 O ATOM 1407 CB GLN A 85 15.010 -14.294 4.074 1.00 0.00 C ATOM 1408 CG GLN A 85 15.678 -12.992 4.495 1.00 0.00 C ATOM 1409 CD GLN A 85 16.951 -13.219 5.287 1.00 0.00 C ATOM 1410 OE1 GLN A 85 17.680 -14.182 5.052 1.00 0.00 O ATOM 1411 NE2 GLN A 85 17.225 -12.329 6.235 1.00 0.00 N ATOM 0 H GLN A 85 16.292 -13.282 1.428 1.00 0.00 H new ATOM 0 HA GLN A 85 15.035 -15.649 2.406 1.00 0.00 H new ATOM 0 HB2 GLN A 85 13.962 -14.266 4.371 1.00 0.00 H new ATOM 0 HB3 GLN A 85 15.473 -15.120 4.614 1.00 0.00 H new ATOM 0 HG2 GLN A 85 15.907 -12.402 3.608 1.00 0.00 H new ATOM 0 HG3 GLN A 85 14.981 -12.408 5.095 1.00 0.00 H new ATOM 0 HE21 GLN A 85 16.593 -11.545 6.397 1.00 0.00 H new ATOM 0 HE22 GLN A 85 18.067 -12.430 6.801 1.00 0.00 H new ATOM 1420 N ASP A 86 12.960 -14.710 1.425 1.00 0.00 N ATOM 1421 CA ASP A 86 11.795 -14.188 0.726 1.00 0.00 C ATOM 1422 C ASP A 86 10.692 -13.833 1.718 1.00 0.00 C ATOM 1423 O ASP A 86 10.240 -14.682 2.487 1.00 0.00 O ATOM 1424 CB ASP A 86 11.289 -15.212 -0.295 1.00 0.00 C ATOM 1425 CG ASP A 86 10.012 -14.769 -0.985 1.00 0.00 C ATOM 1426 OD1 ASP A 86 8.987 -14.608 -0.290 1.00 0.00 O ATOM 1427 OD2 ASP A 86 10.038 -14.584 -2.219 1.00 0.00 O ATOM 0 H ASP A 86 12.959 -15.722 1.551 1.00 0.00 H new ATOM 0 HA ASP A 86 12.084 -13.281 0.196 1.00 0.00 H new ATOM 0 HB2 ASP A 86 12.061 -15.384 -1.045 1.00 0.00 H new ATOM 0 HB3 ASP A 86 11.115 -16.164 0.207 1.00 0.00 H new ATOM 1432 N TYR A 87 10.263 -12.575 1.700 1.00 0.00 N ATOM 1433 CA TYR A 87 9.217 -12.118 2.602 1.00 0.00 C ATOM 1434 C TYR A 87 7.930 -11.841 1.840 1.00 0.00 C ATOM 1435 O TYR A 87 7.956 -11.438 0.677 1.00 0.00 O ATOM 1436 CB TYR A 87 9.655 -10.848 3.337 1.00 0.00 C ATOM 1437 CG TYR A 87 10.329 -11.112 4.665 1.00 0.00 C ATOM 1438 CD1 TYR A 87 11.695 -11.347 4.735 1.00 0.00 C ATOM 1439 CD2 TYR A 87 9.601 -11.120 5.846 1.00 0.00 C ATOM 1440 CE1 TYR A 87 12.317 -11.585 5.946 1.00 0.00 C ATOM 1441 CE2 TYR A 87 10.215 -11.358 7.063 1.00 0.00 C ATOM 1442 CZ TYR A 87 11.573 -11.589 7.106 1.00 0.00 C ATOM 1443 OH TYR A 87 12.188 -11.825 8.315 1.00 0.00 O ATOM 0 H TYR A 87 10.624 -11.857 1.072 1.00 0.00 H new ATOM 0 HA TYR A 87 9.037 -12.909 3.329 1.00 0.00 H new ATOM 0 HB2 TYR A 87 10.338 -10.288 2.699 1.00 0.00 H new ATOM 0 HB3 TYR A 87 8.782 -10.216 3.502 1.00 0.00 H new ATOM 0 HD1 TYR A 87 12.282 -11.344 3.828 1.00 0.00 H new ATOM 0 HD2 TYR A 87 8.537 -10.937 5.815 1.00 0.00 H new ATOM 0 HE1 TYR A 87 13.381 -11.767 5.983 1.00 0.00 H new ATOM 0 HE2 TYR A 87 9.634 -11.363 7.973 1.00 0.00 H new ATOM 0 HH TYR A 87 11.589 -11.561 9.044 1.00 0.00 H new ATOM 1453 N ARG A 88 6.804 -12.032 2.513 1.00 0.00 N ATOM 1454 CA ARG A 88 5.511 -11.772 1.902 1.00 0.00 C ATOM 1455 C ARG A 88 5.055 -10.379 2.296 1.00 0.00 C ATOM 1456 O ARG A 88 4.426 -10.199 3.334 1.00 0.00 O ATOM 1457 CB ARG A 88 4.480 -12.809 2.355 1.00 0.00 C ATOM 1458 CG ARG A 88 3.921 -13.650 1.219 1.00 0.00 C ATOM 1459 CD ARG A 88 2.613 -13.082 0.697 1.00 0.00 C ATOM 1460 NE ARG A 88 1.502 -13.331 1.614 1.00 0.00 N ATOM 1461 CZ ARG A 88 0.867 -14.496 1.709 1.00 0.00 C ATOM 1462 NH1 ARG A 88 1.229 -15.521 0.947 1.00 0.00 N ATOM 1463 NH2 ARG A 88 -0.132 -14.638 2.569 1.00 0.00 N ATOM 0 H ARG A 88 6.761 -12.364 3.476 1.00 0.00 H new ATOM 0 HA ARG A 88 5.605 -11.840 0.818 1.00 0.00 H new ATOM 0 HB2 ARG A 88 4.940 -13.468 3.091 1.00 0.00 H new ATOM 0 HB3 ARG A 88 3.658 -12.297 2.855 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.648 -13.697 0.408 1.00 0.00 H new ATOM 0 HG3 ARG A 88 3.763 -14.672 1.565 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.721 -12.009 0.541 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.388 -13.524 -0.274 1.00 0.00 H new ATOM 0 HE ARG A 88 1.196 -12.567 2.216 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.998 -15.418 0.284 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.739 -16.412 1.024 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.414 -13.854 3.158 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.619 -15.531 2.642 1.00 0.00 H new ATOM 1477 N VAL A 89 5.402 -9.393 1.478 1.00 0.00 N ATOM 1478 CA VAL A 89 5.055 -8.010 1.776 1.00 0.00 C ATOM 1479 C VAL A 89 3.615 -7.674 1.437 1.00 0.00 C ATOM 1480 O VAL A 89 3.121 -7.980 0.351 1.00 0.00 O ATOM 1481 CB VAL A 89 5.981 -7.004 1.059 1.00 0.00 C ATOM 1482 CG1 VAL A 89 6.110 -5.729 1.878 1.00 0.00 C ATOM 1483 CG2 VAL A 89 7.352 -7.610 0.792 1.00 0.00 C ATOM 0 H VAL A 89 5.920 -9.524 0.609 1.00 0.00 H new ATOM 0 HA VAL A 89 5.189 -7.918 2.854 1.00 0.00 H new ATOM 0 HB VAL A 89 5.533 -6.758 0.096 1.00 0.00 H new ATOM 0 HG11 VAL A 89 6.766 -5.029 1.360 1.00 0.00 H new ATOM 0 HG12 VAL A 89 5.126 -5.278 2.006 1.00 0.00 H new ATOM 0 HG13 VAL A 89 6.531 -5.965 2.855 1.00 0.00 H new ATOM 0 HG21 VAL A 89 7.981 -6.878 0.286 1.00 0.00 H new ATOM 0 HG22 VAL A 89 7.814 -7.895 1.737 1.00 0.00 H new ATOM 0 HG23 VAL A 89 7.243 -8.492 0.161 1.00 0.00 H new ATOM 1493 N THR A 90 2.965 -7.005 2.378 1.00 0.00 N ATOM 1494 CA THR A 90 1.588 -6.568 2.208 1.00 0.00 C ATOM 1495 C THR A 90 1.441 -5.166 2.774 1.00 0.00 C ATOM 1496 O THR A 90 1.215 -4.984 3.970 1.00 0.00 O ATOM 1497 CB THR A 90 0.609 -7.526 2.887 1.00 0.00 C ATOM 1498 OG1 THR A 90 1.033 -7.840 4.199 1.00 0.00 O ATOM 1499 CG2 THR A 90 0.435 -8.829 2.138 1.00 0.00 C ATOM 0 H THR A 90 3.375 -6.751 3.277 1.00 0.00 H new ATOM 0 HA THR A 90 1.349 -6.563 1.144 1.00 0.00 H new ATOM 0 HB THR A 90 -0.345 -6.998 2.900 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.874 -8.342 4.160 1.00 0.00 H new ATOM 0 HG21 THR A 90 -0.272 -9.464 2.672 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.055 -8.625 1.137 1.00 0.00 H new ATOM 0 HG23 THR A 90 1.396 -9.338 2.065 1.00 0.00 H new ATOM 1507 N CYS A 91 1.616 -4.180 1.907 1.00 0.00 N ATOM 1508 CA CYS A 91 1.542 -2.787 2.306 1.00 0.00 C ATOM 1509 C CYS A 91 0.116 -2.247 2.233 1.00 0.00 C ATOM 1510 O CYS A 91 -0.711 -2.746 1.471 1.00 0.00 O ATOM 1511 CB CYS A 91 2.479 -1.961 1.431 1.00 0.00 C ATOM 1512 SG CYS A 91 3.959 -1.389 2.293 1.00 0.00 S ATOM 0 H CYS A 91 1.811 -4.323 0.916 1.00 0.00 H new ATOM 0 HA CYS A 91 1.854 -2.712 3.348 1.00 0.00 H new ATOM 0 HB2 CYS A 91 2.779 -2.558 0.570 1.00 0.00 H new ATOM 0 HB3 CYS A 91 1.936 -1.097 1.047 1.00 0.00 H new ATOM 0 HG CYS A 91 5.016 -1.752 1.629 1.00 0.00 H new ATOM 1518 N PHE A 92 -0.166 -1.226 3.039 1.00 0.00 N ATOM 1519 CA PHE A 92 -1.491 -0.617 3.072 1.00 0.00 C ATOM 1520 C PHE A 92 -1.410 0.883 2.797 1.00 0.00 C ATOM 1521 O PHE A 92 -1.063 1.664 3.682 1.00 0.00 O ATOM 1522 CB PHE A 92 -2.153 -0.860 4.429 1.00 0.00 C ATOM 1523 CG PHE A 92 -2.367 -2.312 4.744 1.00 0.00 C ATOM 1524 CD1 PHE A 92 -1.290 -3.171 4.892 1.00 0.00 C ATOM 1525 CD2 PHE A 92 -3.648 -2.818 4.894 1.00 0.00 C ATOM 1526 CE1 PHE A 92 -1.486 -4.508 5.183 1.00 0.00 C ATOM 1527 CE2 PHE A 92 -3.851 -4.153 5.184 1.00 0.00 C ATOM 1528 CZ PHE A 92 -2.769 -5.000 5.330 1.00 0.00 C ATOM 0 H PHE A 92 0.507 -0.803 3.678 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.094 -1.080 2.291 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -1.536 -0.415 5.209 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -3.114 -0.347 4.452 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -0.285 -2.791 4.779 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -4.498 -2.161 4.783 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -0.638 -5.167 5.295 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -4.855 -4.535 5.297 1.00 0.00 H new ATOM 0 HZ PHE A 92 -2.926 -6.044 5.558 1.00 0.00 H new ATOM 1538 N THR A 93 -1.735 1.276 1.567 1.00 0.00 N ATOM 1539 CA THR A 93 -1.698 2.685 1.178 1.00 0.00 C ATOM 1540 C THR A 93 -3.095 3.206 0.863 1.00 0.00 C ATOM 1541 O THR A 93 -4.089 2.509 1.055 1.00 0.00 O ATOM 1542 CB THR A 93 -0.794 2.892 -0.043 1.00 0.00 C ATOM 1543 OG1 THR A 93 -0.289 1.660 -0.529 1.00 0.00 O ATOM 1544 CG2 THR A 93 0.383 3.799 0.237 1.00 0.00 C ATOM 0 H THR A 93 -2.026 0.641 0.824 1.00 0.00 H new ATOM 0 HA THR A 93 -1.294 3.243 2.023 1.00 0.00 H new ATOM 0 HB THR A 93 -1.432 3.365 -0.790 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.189 1.812 -1.371 1.00 0.00 H new ATOM 0 HG21 THR A 93 0.984 3.905 -0.666 1.00 0.00 H new ATOM 0 HG22 THR A 93 0.021 4.779 0.549 1.00 0.00 H new ATOM 0 HG23 THR A 93 0.994 3.368 1.030 1.00 0.00 H new ATOM 1552 N SER A 94 -3.154 4.438 0.369 1.00 0.00 N ATOM 1553 CA SER A 94 -4.422 5.061 0.013 1.00 0.00 C ATOM 1554 C SER A 94 -4.364 5.663 -1.392 1.00 0.00 C ATOM 1555 O SER A 94 -5.306 6.324 -1.831 1.00 0.00 O ATOM 1556 CB SER A 94 -4.782 6.146 1.029 1.00 0.00 C ATOM 1557 OG SER A 94 -4.831 5.618 2.343 1.00 0.00 O ATOM 0 H SER A 94 -2.336 5.025 0.206 1.00 0.00 H new ATOM 0 HA SER A 94 -5.191 4.289 0.024 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.047 6.949 0.984 1.00 0.00 H new ATOM 0 HB3 SER A 94 -5.747 6.583 0.773 1.00 0.00 H new ATOM 0 HG SER A 94 -5.061 6.332 2.974 1.00 0.00 H new ATOM 1563 N TRP A 95 -3.255 5.433 -2.096 1.00 0.00 N ATOM 1564 CA TRP A 95 -3.082 5.957 -3.446 1.00 0.00 C ATOM 1565 C TRP A 95 -2.223 5.020 -4.291 1.00 0.00 C ATOM 1566 O TRP A 95 -1.058 4.779 -3.974 1.00 0.00 O ATOM 1567 CB TRP A 95 -2.433 7.343 -3.402 1.00 0.00 C ATOM 1568 CG TRP A 95 -2.984 8.230 -2.336 1.00 0.00 C ATOM 1569 CD1 TRP A 95 -2.335 8.661 -1.220 1.00 0.00 C ATOM 1570 CD2 TRP A 95 -4.295 8.804 -2.290 1.00 0.00 C ATOM 1571 NE1 TRP A 95 -3.159 9.467 -0.480 1.00 0.00 N ATOM 1572 CE2 TRP A 95 -4.370 9.571 -1.114 1.00 0.00 C ATOM 1573 CE3 TRP A 95 -5.412 8.744 -3.127 1.00 0.00 C ATOM 1574 CZ2 TRP A 95 -5.517 10.274 -0.753 1.00 0.00 C ATOM 1575 CZ3 TRP A 95 -6.551 9.441 -2.769 1.00 0.00 C ATOM 1576 CH2 TRP A 95 -6.595 10.197 -1.591 1.00 0.00 C ATOM 0 H TRP A 95 -2.465 4.887 -1.752 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.069 6.034 -3.902 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -1.360 7.227 -3.247 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -2.565 7.827 -4.370 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -1.319 8.405 -0.957 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -2.911 9.917 0.401 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -5.386 8.164 -4.037 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -5.554 10.858 0.155 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -7.421 9.402 -3.408 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -7.500 10.731 -1.339 1.00 0.00 H new ATOM 1587 N SER A 96 -2.804 4.496 -5.369 1.00 0.00 N ATOM 1588 CA SER A 96 -2.087 3.585 -6.266 1.00 0.00 C ATOM 1589 C SER A 96 -0.692 4.119 -6.596 1.00 0.00 C ATOM 1590 O SER A 96 -0.377 5.273 -6.304 1.00 0.00 O ATOM 1591 CB SER A 96 -2.882 3.378 -7.558 1.00 0.00 C ATOM 1592 OG SER A 96 -4.130 2.760 -7.297 1.00 0.00 O ATOM 0 H SER A 96 -3.768 4.685 -5.644 1.00 0.00 H new ATOM 0 HA SER A 96 -1.977 2.629 -5.754 1.00 0.00 H new ATOM 0 HB2 SER A 96 -3.044 4.339 -8.047 1.00 0.00 H new ATOM 0 HB3 SER A 96 -2.305 2.762 -8.248 1.00 0.00 H new ATOM 0 HG SER A 96 -4.393 2.934 -6.369 1.00 0.00 H new ATOM 1598 N PRO A 97 0.173 3.280 -7.196 1.00 0.00 N ATOM 1599 CA PRO A 97 1.540 3.674 -7.543 1.00 0.00 C ATOM 1600 C PRO A 97 1.601 4.639 -8.725 1.00 0.00 C ATOM 1601 O PRO A 97 1.878 5.821 -8.537 1.00 0.00 O ATOM 1602 CB PRO A 97 2.232 2.345 -7.897 1.00 0.00 C ATOM 1603 CG PRO A 97 1.266 1.267 -7.519 1.00 0.00 C ATOM 1604 CD PRO A 97 -0.099 1.888 -7.564 1.00 0.00 C ATOM 0 HA PRO A 97 2.016 4.210 -6.722 1.00 0.00 H new ATOM 0 HB2 PRO A 97 2.471 2.300 -8.959 1.00 0.00 H new ATOM 0 HB3 PRO A 97 3.171 2.236 -7.354 1.00 0.00 H new ATOM 0 HG2 PRO A 97 1.333 0.426 -8.209 1.00 0.00 H new ATOM 0 HG3 PRO A 97 1.485 0.881 -6.523 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -0.548 1.810 -8.554 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -0.785 1.410 -6.865 1.00 0.00 H new ATOM 1612 N CYS A 98 1.330 4.124 -9.936 1.00 0.00 N ATOM 1613 CA CYS A 98 1.346 4.916 -11.175 1.00 0.00 C ATOM 1614 C CYS A 98 1.932 4.089 -12.318 1.00 0.00 C ATOM 1615 O CYS A 98 2.595 3.078 -12.088 1.00 0.00 O ATOM 1616 CB CYS A 98 2.145 6.223 -11.027 1.00 0.00 C ATOM 1617 SG CYS A 98 3.877 6.003 -10.496 1.00 0.00 S ATOM 0 H CYS A 98 1.093 3.143 -10.082 1.00 0.00 H new ATOM 0 HA CYS A 98 0.313 5.183 -11.396 1.00 0.00 H new ATOM 0 HB2 CYS A 98 2.136 6.748 -11.982 1.00 0.00 H new ATOM 0 HB3 CYS A 98 1.637 6.864 -10.306 1.00 0.00 H new ATOM 0 HG CYS A 98 3.936 5.086 -9.577 1.00 0.00 H new ATOM 1622 N PHE A 99 1.683 4.526 -13.549 1.00 0.00 N ATOM 1623 CA PHE A 99 2.185 3.828 -14.730 1.00 0.00 C ATOM 1624 C PHE A 99 3.705 3.722 -14.695 1.00 0.00 C ATOM 1625 O PHE A 99 4.274 2.664 -14.973 1.00 0.00 O ATOM 1626 CB PHE A 99 1.744 4.543 -16.010 1.00 0.00 C ATOM 1627 CG PHE A 99 1.778 6.042 -15.915 1.00 0.00 C ATOM 1628 CD1 PHE A 99 2.938 6.743 -16.200 1.00 0.00 C ATOM 1629 CD2 PHE A 99 0.647 6.746 -15.540 1.00 0.00 C ATOM 1630 CE1 PHE A 99 2.969 8.122 -16.113 1.00 0.00 C ATOM 1631 CE2 PHE A 99 0.670 8.125 -15.451 1.00 0.00 C ATOM 1632 CZ PHE A 99 1.834 8.814 -15.737 1.00 0.00 C ATOM 0 H PHE A 99 1.136 5.362 -13.756 1.00 0.00 H new ATOM 0 HA PHE A 99 1.765 2.822 -14.725 1.00 0.00 H new ATOM 0 HB2 PHE A 99 2.387 4.226 -16.831 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.731 4.228 -16.259 1.00 0.00 H new ATOM 0 HD1 PHE A 99 3.828 6.206 -16.493 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -0.264 6.212 -15.314 1.00 0.00 H new ATOM 0 HE1 PHE A 99 3.879 8.658 -16.339 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -0.219 8.663 -15.159 1.00 0.00 H new ATOM 0 HZ PHE A 99 1.856 9.891 -15.667 1.00 0.00 H new ATOM 1642 N SER A 100 4.361 4.822 -14.344 1.00 0.00 N ATOM 1643 CA SER A 100 5.815 4.845 -14.264 1.00 0.00 C ATOM 1644 C SER A 100 6.303 3.788 -13.285 1.00 0.00 C ATOM 1645 O SER A 100 7.276 3.078 -13.543 1.00 0.00 O ATOM 1646 CB SER A 100 6.303 6.222 -13.820 1.00 0.00 C ATOM 1647 OG SER A 100 5.321 7.215 -14.060 1.00 0.00 O ATOM 0 H SER A 100 3.910 5.707 -14.111 1.00 0.00 H new ATOM 0 HA SER A 100 6.218 4.630 -15.254 1.00 0.00 H new ATOM 0 HB2 SER A 100 6.549 6.199 -12.758 1.00 0.00 H new ATOM 0 HB3 SER A 100 7.219 6.476 -14.354 1.00 0.00 H new ATOM 0 HG SER A 100 4.936 7.086 -14.952 1.00 0.00 H new ATOM 1653 N CYS A 101 5.593 3.672 -12.171 1.00 0.00 N ATOM 1654 CA CYS A 101 5.920 2.687 -11.160 1.00 0.00 C ATOM 1655 C CYS A 101 5.561 1.310 -11.687 1.00 0.00 C ATOM 1656 O CYS A 101 6.173 0.308 -11.322 1.00 0.00 O ATOM 1657 CB CYS A 101 5.165 2.980 -9.860 1.00 0.00 C ATOM 1658 SG CYS A 101 5.782 4.438 -8.952 1.00 0.00 S ATOM 0 H CYS A 101 4.784 4.252 -11.948 1.00 0.00 H new ATOM 0 HA CYS A 101 6.987 2.728 -10.941 1.00 0.00 H new ATOM 0 HB2 CYS A 101 4.110 3.129 -10.091 1.00 0.00 H new ATOM 0 HB3 CYS A 101 5.229 2.107 -9.211 1.00 0.00 H new ATOM 0 HG CYS A 101 5.343 5.521 -9.521 1.00 0.00 H new ATOM 1663 N ALA A 102 4.569 1.278 -12.576 1.00 0.00 N ATOM 1664 CA ALA A 102 4.132 0.037 -13.182 1.00 0.00 C ATOM 1665 C ALA A 102 5.307 -0.658 -13.853 1.00 0.00 C ATOM 1666 O ALA A 102 5.454 -1.875 -13.770 1.00 0.00 O ATOM 1667 CB ALA A 102 3.025 0.296 -14.190 1.00 0.00 C ATOM 0 H ALA A 102 4.057 2.103 -12.888 1.00 0.00 H new ATOM 0 HA ALA A 102 3.738 -0.613 -12.400 1.00 0.00 H new ATOM 0 HB1 ALA A 102 2.710 -0.648 -14.635 1.00 0.00 H new ATOM 0 HB2 ALA A 102 2.177 0.762 -13.688 1.00 0.00 H new ATOM 0 HB3 ALA A 102 3.393 0.960 -14.972 1.00 0.00 H new ATOM 1673 N GLN A 103 6.143 0.135 -14.517 1.00 0.00 N ATOM 1674 CA GLN A 103 7.313 -0.393 -15.207 1.00 0.00 C ATOM 1675 C GLN A 103 8.429 -0.720 -14.219 1.00 0.00 C ATOM 1676 O GLN A 103 9.154 -1.701 -14.390 1.00 0.00 O ATOM 1677 CB GLN A 103 7.814 0.611 -16.245 1.00 0.00 C ATOM 1678 CG GLN A 103 6.853 0.820 -17.405 1.00 0.00 C ATOM 1679 CD GLN A 103 7.560 1.225 -18.683 1.00 0.00 C ATOM 1680 OE1 GLN A 103 7.789 2.409 -18.930 1.00 0.00 O ATOM 1681 NE2 GLN A 103 7.907 0.241 -19.504 1.00 0.00 N ATOM 0 H GLN A 103 6.031 1.146 -14.591 1.00 0.00 H new ATOM 0 HA GLN A 103 7.020 -1.313 -15.712 1.00 0.00 H new ATOM 0 HB2 GLN A 103 7.993 1.568 -15.755 1.00 0.00 H new ATOM 0 HB3 GLN A 103 8.772 0.269 -16.636 1.00 0.00 H new ATOM 0 HG2 GLN A 103 6.294 -0.100 -17.579 1.00 0.00 H new ATOM 0 HG3 GLN A 103 6.127 1.588 -17.137 1.00 0.00 H new ATOM 0 HE21 GLN A 103 7.697 -0.726 -19.258 1.00 0.00 H new ATOM 0 HE22 GLN A 103 8.384 0.452 -20.381 1.00 0.00 H new ATOM 1690 N GLU A 104 8.565 0.107 -13.187 1.00 0.00 N ATOM 1691 CA GLU A 104 9.597 -0.097 -12.176 1.00 0.00 C ATOM 1692 C GLU A 104 9.304 -1.333 -11.329 1.00 0.00 C ATOM 1693 O GLU A 104 10.122 -2.255 -11.244 1.00 0.00 O ATOM 1694 CB GLU A 104 9.706 1.135 -11.276 1.00 0.00 C ATOM 1695 CG GLU A 104 10.737 2.146 -11.752 1.00 0.00 C ATOM 1696 CD GLU A 104 11.665 2.601 -10.642 1.00 0.00 C ATOM 1697 OE1 GLU A 104 12.201 1.732 -9.924 1.00 0.00 O ATOM 1698 OE2 GLU A 104 11.854 3.825 -10.490 1.00 0.00 O ATOM 0 H GLU A 104 7.975 0.924 -13.029 1.00 0.00 H new ATOM 0 HA GLU A 104 10.545 -0.252 -12.691 1.00 0.00 H new ATOM 0 HB2 GLU A 104 8.732 1.621 -11.219 1.00 0.00 H new ATOM 0 HB3 GLU A 104 9.962 0.815 -10.266 1.00 0.00 H new ATOM 0 HG2 GLU A 104 11.327 1.706 -12.556 1.00 0.00 H new ATOM 0 HG3 GLU A 104 10.224 3.013 -12.170 1.00 0.00 H new ATOM 1705 N MET A 105 8.130 -1.350 -10.706 1.00 0.00 N ATOM 1706 CA MET A 105 7.727 -2.465 -9.866 1.00 0.00 C ATOM 1707 C MET A 105 7.597 -3.730 -10.692 1.00 0.00 C ATOM 1708 O MET A 105 7.805 -4.835 -10.191 1.00 0.00 O ATOM 1709 CB MET A 105 6.402 -2.155 -9.167 1.00 0.00 C ATOM 1710 CG MET A 105 6.383 -0.788 -8.496 1.00 0.00 C ATOM 1711 SD MET A 105 5.366 -0.735 -7.006 1.00 0.00 S ATOM 1712 CE MET A 105 6.039 -2.102 -6.067 1.00 0.00 C ATOM 0 H MET A 105 7.441 -0.600 -10.769 1.00 0.00 H new ATOM 0 HA MET A 105 8.495 -2.620 -9.108 1.00 0.00 H new ATOM 0 HB2 MET A 105 5.593 -2.206 -9.896 1.00 0.00 H new ATOM 0 HB3 MET A 105 6.205 -2.923 -8.419 1.00 0.00 H new ATOM 0 HG2 MET A 105 7.404 -0.503 -8.241 1.00 0.00 H new ATOM 0 HG3 MET A 105 6.013 -0.048 -9.206 1.00 0.00 H new ATOM 0 HE1 MET A 105 5.225 -2.674 -5.623 1.00 0.00 H new ATOM 0 HE2 MET A 105 6.618 -2.747 -6.728 1.00 0.00 H new ATOM 0 HE3 MET A 105 6.685 -1.718 -5.278 1.00 0.00 H new ATOM 1722 N ALA A 106 7.252 -3.568 -11.963 1.00 0.00 N ATOM 1723 CA ALA A 106 7.099 -4.706 -12.839 1.00 0.00 C ATOM 1724 C ALA A 106 8.444 -5.357 -13.119 1.00 0.00 C ATOM 1725 O ALA A 106 8.664 -6.515 -12.796 1.00 0.00 O ATOM 1726 CB ALA A 106 6.418 -4.308 -14.138 1.00 0.00 C ATOM 0 H ALA A 106 7.076 -2.664 -12.401 1.00 0.00 H new ATOM 0 HA ALA A 106 6.464 -5.433 -12.333 1.00 0.00 H new ATOM 0 HB1 ALA A 106 6.316 -5.184 -14.778 1.00 0.00 H new ATOM 0 HB2 ALA A 106 5.431 -3.900 -13.921 1.00 0.00 H new ATOM 0 HB3 ALA A 106 7.018 -3.554 -14.647 1.00 0.00 H new ATOM 1732 N LYS A 107 9.348 -4.603 -13.717 1.00 0.00 N ATOM 1733 CA LYS A 107 10.675 -5.105 -14.040 1.00 0.00 C ATOM 1734 C LYS A 107 11.272 -5.915 -12.883 1.00 0.00 C ATOM 1735 O LYS A 107 11.859 -6.976 -13.097 1.00 0.00 O ATOM 1736 CB LYS A 107 11.593 -3.930 -14.397 1.00 0.00 C ATOM 1737 CG LYS A 107 13.059 -4.154 -14.053 1.00 0.00 C ATOM 1738 CD LYS A 107 13.632 -2.983 -13.278 1.00 0.00 C ATOM 1739 CE LYS A 107 13.283 -3.088 -11.806 1.00 0.00 C ATOM 1740 NZ LYS A 107 14.369 -2.561 -10.935 1.00 0.00 N ATOM 0 H LYS A 107 9.188 -3.634 -13.991 1.00 0.00 H new ATOM 0 HA LYS A 107 10.588 -5.775 -14.895 1.00 0.00 H new ATOM 0 HB2 LYS A 107 11.509 -3.730 -15.465 1.00 0.00 H new ATOM 0 HB3 LYS A 107 11.242 -3.039 -13.877 1.00 0.00 H new ATOM 0 HG2 LYS A 107 13.161 -5.066 -13.465 1.00 0.00 H new ATOM 0 HG3 LYS A 107 13.631 -4.300 -14.969 1.00 0.00 H new ATOM 0 HD2 LYS A 107 14.715 -2.957 -13.398 1.00 0.00 H new ATOM 0 HD3 LYS A 107 13.243 -2.048 -13.683 1.00 0.00 H new ATOM 0 HE2 LYS A 107 12.363 -2.537 -11.612 1.00 0.00 H new ATOM 0 HE3 LYS A 107 13.089 -4.130 -11.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 14.089 -2.652 -9.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 15.241 -3.103 -11.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 14.537 -1.559 -11.157 1.00 0.00 H new ATOM 1754 N PHE A 108 11.150 -5.393 -11.667 1.00 0.00 N ATOM 1755 CA PHE A 108 11.713 -6.053 -10.492 1.00 0.00 C ATOM 1756 C PHE A 108 10.809 -7.152 -9.938 1.00 0.00 C ATOM 1757 O PHE A 108 11.267 -8.253 -9.644 1.00 0.00 O ATOM 1758 CB PHE A 108 11.980 -5.026 -9.391 1.00 0.00 C ATOM 1759 CG PHE A 108 12.822 -5.557 -8.267 1.00 0.00 C ATOM 1760 CD1 PHE A 108 14.184 -5.746 -8.436 1.00 0.00 C ATOM 1761 CD2 PHE A 108 12.253 -5.865 -7.041 1.00 0.00 C ATOM 1762 CE1 PHE A 108 14.964 -6.234 -7.404 1.00 0.00 C ATOM 1763 CE2 PHE A 108 13.028 -6.353 -6.006 1.00 0.00 C ATOM 1764 CZ PHE A 108 14.386 -6.537 -6.188 1.00 0.00 C ATOM 0 H PHE A 108 10.667 -4.517 -11.468 1.00 0.00 H new ATOM 0 HA PHE A 108 12.643 -6.521 -10.814 1.00 0.00 H new ATOM 0 HB2 PHE A 108 12.476 -4.159 -9.827 1.00 0.00 H new ATOM 0 HB3 PHE A 108 11.028 -4.680 -8.989 1.00 0.00 H new ATOM 0 HD1 PHE A 108 14.642 -5.509 -9.385 1.00 0.00 H new ATOM 0 HD2 PHE A 108 11.193 -5.722 -6.893 1.00 0.00 H new ATOM 0 HE1 PHE A 108 16.024 -6.378 -7.549 1.00 0.00 H new ATOM 0 HE2 PHE A 108 12.573 -6.590 -5.056 1.00 0.00 H new ATOM 0 HZ PHE A 108 14.993 -6.917 -5.380 1.00 0.00 H new ATOM 1774 N ILE A 109 9.540 -6.833 -9.750 1.00 0.00 N ATOM 1775 CA ILE A 109 8.592 -7.790 -9.178 1.00 0.00 C ATOM 1776 C ILE A 109 7.813 -8.577 -10.230 1.00 0.00 C ATOM 1777 O ILE A 109 7.482 -9.740 -10.017 1.00 0.00 O ATOM 1778 CB ILE A 109 7.590 -7.084 -8.254 1.00 0.00 C ATOM 1779 CG1 ILE A 109 8.332 -6.259 -7.201 1.00 0.00 C ATOM 1780 CG2 ILE A 109 6.670 -8.100 -7.593 1.00 0.00 C ATOM 1781 CD1 ILE A 109 7.701 -4.910 -6.937 1.00 0.00 C ATOM 0 H ILE A 109 9.138 -5.925 -9.982 1.00 0.00 H new ATOM 0 HA ILE A 109 9.200 -8.497 -8.614 1.00 0.00 H new ATOM 0 HB ILE A 109 6.978 -6.409 -8.852 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.369 -6.823 -6.269 1.00 0.00 H new ATOM 0 HG13 ILE A 109 9.362 -6.112 -7.526 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.966 -7.583 -6.941 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.121 -8.647 -8.360 1.00 0.00 H new ATOM 0 HG23 ILE A 109 7.264 -8.799 -7.004 1.00 0.00 H new ATOM 0 HD11 ILE A 109 8.279 -4.380 -6.180 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.689 -4.328 -7.858 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.680 -5.049 -6.582 1.00 0.00 H new ATOM 1793 N SER A 110 7.496 -7.932 -11.340 1.00 0.00 N ATOM 1794 CA SER A 110 6.727 -8.568 -12.408 1.00 0.00 C ATOM 1795 C SER A 110 7.619 -9.358 -13.359 1.00 0.00 C ATOM 1796 O SER A 110 7.417 -10.551 -13.579 1.00 0.00 O ATOM 1797 CB SER A 110 5.967 -7.514 -13.209 1.00 0.00 C ATOM 1798 OG SER A 110 4.941 -8.103 -13.988 1.00 0.00 O ATOM 0 H SER A 110 7.758 -6.965 -11.530 1.00 0.00 H new ATOM 0 HA SER A 110 6.030 -9.258 -11.933 1.00 0.00 H new ATOM 0 HB2 SER A 110 5.535 -6.779 -12.530 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.659 -6.979 -13.859 1.00 0.00 H new ATOM 0 HG SER A 110 4.469 -7.405 -14.489 1.00 0.00 H new ATOM 1804 N LYS A 111 8.599 -8.671 -13.929 1.00 0.00 N ATOM 1805 CA LYS A 111 9.526 -9.276 -14.868 1.00 0.00 C ATOM 1806 C LYS A 111 10.473 -10.220 -14.148 1.00 0.00 C ATOM 1807 O LYS A 111 10.970 -11.183 -14.731 1.00 0.00 O ATOM 1808 CB LYS A 111 10.317 -8.187 -15.591 1.00 0.00 C ATOM 1809 CG LYS A 111 10.623 -8.519 -17.041 1.00 0.00 C ATOM 1810 CD LYS A 111 10.731 -7.263 -17.890 1.00 0.00 C ATOM 1811 CE LYS A 111 9.387 -6.565 -18.027 1.00 0.00 C ATOM 1812 NZ LYS A 111 9.520 -5.085 -17.945 1.00 0.00 N ATOM 0 H LYS A 111 8.772 -7.681 -13.753 1.00 0.00 H new ATOM 0 HA LYS A 111 8.958 -9.850 -15.600 1.00 0.00 H new ATOM 0 HB2 LYS A 111 9.755 -7.254 -15.551 1.00 0.00 H new ATOM 0 HB3 LYS A 111 11.254 -8.017 -15.060 1.00 0.00 H new ATOM 0 HG2 LYS A 111 11.556 -9.079 -17.098 1.00 0.00 H new ATOM 0 HG3 LYS A 111 9.840 -9.163 -17.441 1.00 0.00 H new ATOM 0 HD2 LYS A 111 11.453 -6.580 -17.441 1.00 0.00 H new ATOM 0 HD3 LYS A 111 11.110 -7.522 -18.879 1.00 0.00 H new ATOM 0 HE2 LYS A 111 8.932 -6.836 -18.980 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.715 -6.913 -17.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 8.582 -4.646 -18.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 9.930 -4.824 -17.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 10.141 -4.749 -18.709 1.00 0.00 H new ATOM 1826 N ASN A 112 10.715 -9.939 -12.874 1.00 0.00 N ATOM 1827 CA ASN A 112 11.603 -10.773 -12.077 1.00 0.00 C ATOM 1828 C ASN A 112 10.797 -11.672 -11.142 1.00 0.00 C ATOM 1829 O ASN A 112 10.845 -12.898 -11.243 1.00 0.00 O ATOM 1830 CB ASN A 112 12.568 -9.900 -11.275 1.00 0.00 C ATOM 1831 CG ASN A 112 14.020 -10.261 -11.526 1.00 0.00 C ATOM 1832 OD1 ASN A 112 14.469 -11.354 -11.179 1.00 0.00 O ATOM 1833 ND2 ASN A 112 14.762 -9.342 -12.131 1.00 0.00 N ATOM 0 H ASN A 112 10.312 -9.146 -12.374 1.00 0.00 H new ATOM 0 HA ASN A 112 12.181 -11.407 -12.750 1.00 0.00 H new ATOM 0 HB2 ASN A 112 12.407 -8.853 -11.533 1.00 0.00 H new ATOM 0 HB3 ASN A 112 12.349 -10.003 -10.212 1.00 0.00 H new ATOM 0 HD21 ASN A 112 15.746 -9.528 -12.326 1.00 0.00 H new ATOM 0 HD22 ASN A 112 14.349 -8.450 -12.401 1.00 0.00 H new ATOM 1840 N LYS A 113 10.052 -11.045 -10.242 1.00 0.00 N ATOM 1841 CA LYS A 113 9.215 -11.762 -9.286 1.00 0.00 C ATOM 1842 C LYS A 113 10.027 -12.658 -8.359 1.00 0.00 C ATOM 1843 O LYS A 113 10.567 -13.682 -8.773 1.00 0.00 O ATOM 1844 CB LYS A 113 8.161 -12.616 -9.992 1.00 0.00 C ATOM 1845 CG LYS A 113 7.667 -12.050 -11.317 1.00 0.00 C ATOM 1846 CD LYS A 113 6.157 -11.867 -11.316 1.00 0.00 C ATOM 1847 CE LYS A 113 5.436 -13.196 -11.159 1.00 0.00 C ATOM 1848 NZ LYS A 113 4.985 -13.742 -12.468 1.00 0.00 N ATOM 0 H LYS A 113 10.010 -10.030 -10.153 1.00 0.00 H new ATOM 0 HA LYS A 113 8.725 -10.993 -8.689 1.00 0.00 H new ATOM 0 HB2 LYS A 113 8.576 -13.608 -10.168 1.00 0.00 H new ATOM 0 HB3 LYS A 113 7.308 -12.741 -9.325 1.00 0.00 H new ATOM 0 HG2 LYS A 113 8.151 -11.092 -11.508 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.953 -12.719 -12.129 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.871 -11.198 -10.504 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.846 -11.391 -12.246 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.099 -13.914 -10.676 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.575 -13.066 -10.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 4.498 -14.649 -12.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.332 -13.069 -12.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 5.809 -13.890 -13.085 1.00 0.00 H new ATOM 1862 N HIS A 114 10.068 -12.271 -7.093 1.00 0.00 N ATOM 1863 CA HIS A 114 10.767 -13.034 -6.070 1.00 0.00 C ATOM 1864 C HIS A 114 10.440 -12.465 -4.689 1.00 0.00 C ATOM 1865 O HIS A 114 11.232 -12.567 -3.752 1.00 0.00 O ATOM 1866 CB HIS A 114 12.277 -13.041 -6.332 1.00 0.00 C ATOM 1867 CG HIS A 114 12.974 -11.764 -5.978 1.00 0.00 C ATOM 1868 ND1 HIS A 114 14.279 -11.725 -5.541 1.00 0.00 N ATOM 1869 CD2 HIS A 114 12.544 -10.481 -5.990 1.00 0.00 C ATOM 1870 CE1 HIS A 114 14.623 -10.476 -5.291 1.00 0.00 C ATOM 1871 NE2 HIS A 114 13.589 -9.699 -5.559 1.00 0.00 N ATOM 0 H HIS A 114 9.620 -11.423 -6.747 1.00 0.00 H new ATOM 0 HA HIS A 114 10.429 -14.070 -6.104 1.00 0.00 H new ATOM 0 HB2 HIS A 114 12.728 -13.856 -5.765 1.00 0.00 H new ATOM 0 HB3 HIS A 114 12.449 -13.254 -7.387 1.00 0.00 H new ATOM 0 HD2 HIS A 114 11.563 -10.136 -6.283 1.00 0.00 H new ATOM 0 HE1 HIS A 114 15.585 -10.145 -4.929 1.00 0.00 H new ATOM 0 HE2 HIS A 114 13.569 -8.684 -5.462 1.00 0.00 H new ATOM 1880 N VAL A 115 9.254 -11.862 -4.587 1.00 0.00 N ATOM 1881 CA VAL A 115 8.779 -11.263 -3.343 1.00 0.00 C ATOM 1882 C VAL A 115 7.268 -11.045 -3.423 1.00 0.00 C ATOM 1883 O VAL A 115 6.705 -11.004 -4.517 1.00 0.00 O ATOM 1884 CB VAL A 115 9.499 -9.921 -3.061 1.00 0.00 C ATOM 1885 CG1 VAL A 115 9.592 -9.086 -4.328 1.00 0.00 C ATOM 1886 CG2 VAL A 115 8.814 -9.136 -1.948 1.00 0.00 C ATOM 0 H VAL A 115 8.599 -11.776 -5.364 1.00 0.00 H new ATOM 0 HA VAL A 115 9.004 -11.944 -2.522 1.00 0.00 H new ATOM 0 HB VAL A 115 10.509 -10.155 -2.723 1.00 0.00 H new ATOM 0 HG11 VAL A 115 10.101 -8.147 -4.109 1.00 0.00 H new ATOM 0 HG12 VAL A 115 10.153 -9.635 -5.085 1.00 0.00 H new ATOM 0 HG13 VAL A 115 8.589 -8.877 -4.700 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.349 -8.201 -1.780 1.00 0.00 H new ATOM 0 HG22 VAL A 115 7.785 -8.919 -2.236 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.818 -9.726 -1.031 1.00 0.00 H new ATOM 1896 N SER A 116 6.607 -10.901 -2.277 1.00 0.00 N ATOM 1897 CA SER A 116 5.164 -10.684 -2.272 1.00 0.00 C ATOM 1898 C SER A 116 4.848 -9.225 -1.971 1.00 0.00 C ATOM 1899 O SER A 116 5.343 -8.665 -0.996 1.00 0.00 O ATOM 1900 CB SER A 116 4.483 -11.596 -1.253 1.00 0.00 C ATOM 1901 OG SER A 116 3.284 -12.139 -1.776 1.00 0.00 O ATOM 0 H SER A 116 7.040 -10.930 -1.354 1.00 0.00 H new ATOM 0 HA SER A 116 4.778 -10.928 -3.262 1.00 0.00 H new ATOM 0 HB2 SER A 116 5.160 -12.403 -0.973 1.00 0.00 H new ATOM 0 HB3 SER A 116 4.265 -11.033 -0.345 1.00 0.00 H new ATOM 0 HG SER A 116 3.431 -13.075 -2.028 1.00 0.00 H new ATOM 1907 N LEU A 117 4.034 -8.609 -2.822 1.00 0.00 N ATOM 1908 CA LEU A 117 3.674 -7.209 -2.643 1.00 0.00 C ATOM 1909 C LEU A 117 2.164 -7.017 -2.716 1.00 0.00 C ATOM 1910 O LEU A 117 1.561 -7.153 -3.780 1.00 0.00 O ATOM 1911 CB LEU A 117 4.366 -6.318 -3.690 1.00 0.00 C ATOM 1912 CG LEU A 117 5.245 -7.036 -4.727 1.00 0.00 C ATOM 1913 CD1 LEU A 117 6.355 -7.829 -4.052 1.00 0.00 C ATOM 1914 CD2 LEU A 117 4.403 -7.937 -5.618 1.00 0.00 C ATOM 0 H LEU A 117 3.614 -9.055 -3.638 1.00 0.00 H new ATOM 0 HA LEU A 117 4.016 -6.911 -1.652 1.00 0.00 H new ATOM 0 HB2 LEU A 117 3.598 -5.758 -4.223 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.984 -5.590 -3.164 1.00 0.00 H new ATOM 0 HG LEU A 117 5.711 -6.275 -5.354 1.00 0.00 H new ATOM 0 HD11 LEU A 117 6.960 -8.326 -4.810 1.00 0.00 H new ATOM 0 HD12 LEU A 117 6.983 -7.154 -3.472 1.00 0.00 H new ATOM 0 HD13 LEU A 117 5.917 -8.576 -3.390 1.00 0.00 H new ATOM 0 HD21 LEU A 117 5.046 -8.435 -6.344 1.00 0.00 H new ATOM 0 HD22 LEU A 117 3.899 -8.685 -5.006 1.00 0.00 H new ATOM 0 HD23 LEU A 117 3.659 -7.337 -6.143 1.00 0.00 H new ATOM 1926 N CYS A 118 1.561 -6.690 -1.578 1.00 0.00 N ATOM 1927 CA CYS A 118 0.123 -6.468 -1.514 1.00 0.00 C ATOM 1928 C CYS A 118 -0.181 -5.062 -1.014 1.00 0.00 C ATOM 1929 O CYS A 118 -0.313 -4.831 0.187 1.00 0.00 O ATOM 1930 CB CYS A 118 -0.543 -7.504 -0.610 1.00 0.00 C ATOM 1931 SG CYS A 118 -0.051 -9.209 -0.958 1.00 0.00 S ATOM 0 H CYS A 118 2.046 -6.573 -0.688 1.00 0.00 H new ATOM 0 HA CYS A 118 -0.281 -6.575 -2.521 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -0.304 -7.272 0.428 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -1.625 -7.420 -0.714 1.00 0.00 H new ATOM 0 HG CYS A 118 -0.632 -10.009 -0.114 1.00 0.00 H new ATOM 1937 N ILE A 119 -0.284 -4.129 -1.951 1.00 0.00 N ATOM 1938 CA ILE A 119 -0.569 -2.740 -1.625 1.00 0.00 C ATOM 1939 C ILE A 119 -2.055 -2.431 -1.796 1.00 0.00 C ATOM 1940 O ILE A 119 -2.515 -2.143 -2.901 1.00 0.00 O ATOM 1941 CB ILE A 119 0.263 -1.781 -2.505 1.00 0.00 C ATOM 1942 CG1 ILE A 119 1.746 -1.873 -2.134 1.00 0.00 C ATOM 1943 CG2 ILE A 119 -0.233 -0.346 -2.364 1.00 0.00 C ATOM 1944 CD1 ILE A 119 2.567 -2.680 -3.117 1.00 0.00 C ATOM 0 H ILE A 119 -0.174 -4.312 -2.948 1.00 0.00 H new ATOM 0 HA ILE A 119 -0.294 -2.588 -0.581 1.00 0.00 H new ATOM 0 HB ILE A 119 0.143 -2.081 -3.546 1.00 0.00 H new ATOM 0 HG12 ILE A 119 2.159 -0.866 -2.069 1.00 0.00 H new ATOM 0 HG13 ILE A 119 1.837 -2.320 -1.144 1.00 0.00 H new ATOM 0 HG21 ILE A 119 0.368 0.310 -2.993 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -1.276 -0.290 -2.674 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.146 -0.031 -1.324 1.00 0.00 H new ATOM 0 HD11 ILE A 119 3.607 -2.702 -2.791 1.00 0.00 H new ATOM 0 HD12 ILE A 119 2.180 -3.698 -3.165 1.00 0.00 H new ATOM 0 HD13 ILE A 119 2.506 -2.222 -4.104 1.00 0.00 H new ATOM 1956 N LYS A 120 -2.797 -2.475 -0.694 1.00 0.00 N ATOM 1957 CA LYS A 120 -4.227 -2.181 -0.728 1.00 0.00 C ATOM 1958 C LYS A 120 -4.454 -0.676 -0.640 1.00 0.00 C ATOM 1959 O LYS A 120 -4.262 -0.069 0.413 1.00 0.00 O ATOM 1960 CB LYS A 120 -4.961 -2.894 0.413 1.00 0.00 C ATOM 1961 CG LYS A 120 -4.220 -2.857 1.741 1.00 0.00 C ATOM 1962 CD LYS A 120 -3.527 -4.180 2.029 1.00 0.00 C ATOM 1963 CE LYS A 120 -4.531 -5.281 2.333 1.00 0.00 C ATOM 1964 NZ LYS A 120 -3.862 -6.584 2.604 1.00 0.00 N ATOM 0 H LYS A 120 -2.435 -2.710 0.230 1.00 0.00 H new ATOM 0 HA LYS A 120 -4.629 -2.548 -1.672 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -5.942 -2.437 0.543 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -5.129 -3.933 0.131 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -3.483 -2.055 1.725 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -4.921 -2.630 2.544 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -2.919 -4.468 1.171 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -2.849 -4.060 2.874 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -5.133 -4.995 3.196 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -5.214 -5.392 1.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -4.579 -7.335 2.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -3.203 -6.804 1.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -3.336 -6.525 3.499 1.00 0.00 H new ATOM 1978 N THR A 121 -4.850 -0.078 -1.758 1.00 0.00 N ATOM 1979 CA THR A 121 -5.089 1.360 -1.813 1.00 0.00 C ATOM 1980 C THR A 121 -6.581 1.670 -1.821 1.00 0.00 C ATOM 1981 O THR A 121 -7.315 1.226 -2.704 1.00 0.00 O ATOM 1982 CB THR A 121 -4.414 1.971 -3.046 1.00 0.00 C ATOM 1983 OG1 THR A 121 -4.988 3.227 -3.366 1.00 0.00 O ATOM 1984 CG2 THR A 121 -4.503 1.098 -4.279 1.00 0.00 C ATOM 0 H THR A 121 -5.012 -0.566 -2.639 1.00 0.00 H new ATOM 0 HA THR A 121 -4.654 1.805 -0.918 1.00 0.00 H new ATOM 0 HB THR A 121 -3.364 2.075 -2.772 1.00 0.00 H new ATOM 0 HG1 THR A 121 -5.206 3.253 -4.321 1.00 0.00 H new ATOM 0 HG21 THR A 121 -4.004 1.593 -5.112 1.00 0.00 H new ATOM 0 HG22 THR A 121 -4.019 0.141 -4.083 1.00 0.00 H new ATOM 0 HG23 THR A 121 -5.550 0.930 -4.531 1.00 0.00 H new ATOM 1992 N ALA A 122 -7.021 2.434 -0.827 1.00 0.00 N ATOM 1993 CA ALA A 122 -8.424 2.807 -0.707 1.00 0.00 C ATOM 1994 C ALA A 122 -8.904 3.580 -1.930 1.00 0.00 C ATOM 1995 O ALA A 122 -10.104 3.638 -2.202 1.00 0.00 O ATOM 1996 CB ALA A 122 -8.644 3.628 0.555 1.00 0.00 C ATOM 0 H ALA A 122 -6.423 2.808 -0.090 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.009 1.889 -0.643 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -9.697 3.900 0.633 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -8.356 3.040 1.426 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -8.037 4.533 0.511 1.00 0.00 H new ATOM 2002 N ARG A 123 -7.971 4.175 -2.668 1.00 0.00 N ATOM 2003 CA ARG A 123 -8.326 4.937 -3.856 1.00 0.00 C ATOM 2004 C ARG A 123 -7.170 4.971 -4.847 1.00 0.00 C ATOM 2005 O ARG A 123 -6.022 5.203 -4.471 1.00 0.00 O ATOM 2006 CB ARG A 123 -8.728 6.362 -3.476 1.00 0.00 C ATOM 2007 CG ARG A 123 -9.173 7.203 -4.662 1.00 0.00 C ATOM 2008 CD ARG A 123 -10.015 8.389 -4.220 1.00 0.00 C ATOM 2009 NE ARG A 123 -10.738 8.993 -5.337 1.00 0.00 N ATOM 2010 CZ ARG A 123 -11.530 10.056 -5.220 1.00 0.00 C ATOM 2011 NH1 ARG A 123 -11.704 10.636 -4.039 1.00 0.00 N ATOM 2012 NH2 ARG A 123 -12.150 10.541 -6.288 1.00 0.00 N ATOM 0 H ARG A 123 -6.972 4.144 -2.465 1.00 0.00 H new ATOM 0 HA ARG A 123 -9.174 4.443 -4.331 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -9.537 6.321 -2.746 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -7.884 6.852 -2.990 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -8.298 7.559 -5.205 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -9.747 6.585 -5.352 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -10.726 8.066 -3.460 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -9.372 9.138 -3.757 1.00 0.00 H new ATOM 0 HE ARG A 123 -10.629 8.575 -6.261 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -11.229 10.267 -3.215 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -12.312 11.451 -3.956 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -12.019 10.099 -7.198 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -12.757 11.356 -6.199 1.00 0.00 H new ATOM 2026 N ILE A 124 -7.482 4.730 -6.114 1.00 0.00 N ATOM 2027 CA ILE A 124 -6.471 4.724 -7.161 1.00 0.00 C ATOM 2028 C ILE A 124 -6.082 6.142 -7.571 1.00 0.00 C ATOM 2029 O ILE A 124 -6.934 6.957 -7.927 1.00 0.00 O ATOM 2030 CB ILE A 124 -6.956 3.939 -8.395 1.00 0.00 C ATOM 2031 CG1 ILE A 124 -7.377 2.529 -7.981 1.00 0.00 C ATOM 2032 CG2 ILE A 124 -5.867 3.885 -9.457 1.00 0.00 C ATOM 2033 CD1 ILE A 124 -8.121 1.772 -9.059 1.00 0.00 C ATOM 0 H ILE A 124 -8.429 4.536 -6.441 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.590 4.229 -6.752 1.00 0.00 H new ATOM 0 HB ILE A 124 -7.818 4.451 -8.822 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.489 1.963 -7.700 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -8.008 2.594 -7.095 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.228 3.327 -10.321 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -5.607 4.898 -9.763 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -4.985 3.391 -9.049 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -8.386 0.781 -8.691 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -9.028 2.315 -9.325 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -7.486 1.674 -9.939 1.00 0.00 H new ATOM 2138 N ALA A 131 -2.988 5.763 -14.391 1.00 0.00 N ATOM 2139 CA ALA A 131 -3.041 5.004 -13.138 1.00 0.00 C ATOM 2140 C ALA A 131 -3.566 3.591 -13.373 1.00 0.00 C ATOM 2141 O ALA A 131 -2.970 2.612 -12.916 1.00 0.00 O ATOM 2142 CB ALA A 131 -3.892 5.721 -12.098 1.00 0.00 C ATOM 0 HA ALA A 131 -2.023 4.931 -12.755 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.914 5.135 -11.179 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.465 6.703 -11.893 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.907 5.839 -12.477 1.00 0.00 H new ATOM 2148 N GLN A 132 -4.682 3.489 -14.090 1.00 0.00 N ATOM 2149 CA GLN A 132 -5.291 2.198 -14.397 1.00 0.00 C ATOM 2150 C GLN A 132 -4.238 1.195 -14.863 1.00 0.00 C ATOM 2151 O GLN A 132 -4.296 0.011 -14.527 1.00 0.00 O ATOM 2152 CB GLN A 132 -6.364 2.366 -15.479 1.00 0.00 C ATOM 2153 CG GLN A 132 -5.943 3.271 -16.627 1.00 0.00 C ATOM 2154 CD GLN A 132 -7.032 4.246 -17.030 1.00 0.00 C ATOM 2155 OE1 GLN A 132 -8.078 3.847 -17.542 1.00 0.00 O ATOM 2156 NE2 GLN A 132 -6.791 5.531 -16.802 1.00 0.00 N ATOM 0 H GLN A 132 -5.185 4.290 -14.471 1.00 0.00 H new ATOM 0 HA GLN A 132 -5.753 1.815 -13.487 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -6.621 1.385 -15.878 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.267 2.771 -15.022 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -5.051 3.827 -16.338 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -5.672 2.659 -17.487 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -5.910 5.817 -16.375 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -7.487 6.233 -17.053 1.00 0.00 H new ATOM 2165 N GLU A 133 -3.275 1.687 -15.632 1.00 0.00 N ATOM 2166 CA GLU A 133 -2.198 0.852 -16.146 1.00 0.00 C ATOM 2167 C GLU A 133 -1.187 0.547 -15.048 1.00 0.00 C ATOM 2168 O GLU A 133 -0.599 -0.534 -15.015 1.00 0.00 O ATOM 2169 CB GLU A 133 -1.503 1.534 -17.329 1.00 0.00 C ATOM 2170 CG GLU A 133 -1.235 3.015 -17.118 1.00 0.00 C ATOM 2171 CD GLU A 133 -2.307 3.895 -17.732 1.00 0.00 C ATOM 2172 OE1 GLU A 133 -3.429 3.393 -17.959 1.00 0.00 O ATOM 2173 OE2 GLU A 133 -2.027 5.085 -17.985 1.00 0.00 O ATOM 0 H GLU A 133 -3.218 2.665 -15.914 1.00 0.00 H new ATOM 0 HA GLU A 133 -2.631 -0.086 -16.492 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -0.557 1.028 -17.522 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -2.119 1.410 -18.220 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -1.170 3.220 -16.049 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -0.268 3.271 -17.551 1.00 0.00 H new ATOM 2180 N GLY A 134 -0.991 1.506 -14.146 1.00 0.00 N ATOM 2181 CA GLY A 134 -0.058 1.320 -13.057 1.00 0.00 C ATOM 2182 C GLY A 134 -0.330 0.056 -12.261 1.00 0.00 C ATOM 2183 O GLY A 134 0.571 -0.755 -12.032 1.00 0.00 O ATOM 0 H GLY A 134 -1.465 2.409 -14.154 1.00 0.00 H new ATOM 0 HA2 GLY A 134 0.956 1.282 -13.455 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -0.107 2.181 -12.391 1.00 0.00 H new ATOM 2187 N LEU A 135 -1.582 -0.123 -11.856 1.00 0.00 N ATOM 2188 CA LEU A 135 -1.967 -1.304 -11.088 1.00 0.00 C ATOM 2189 C LEU A 135 -2.149 -2.489 -12.015 1.00 0.00 C ATOM 2190 O LEU A 135 -1.978 -3.637 -11.617 1.00 0.00 O ATOM 2191 CB LEU A 135 -3.255 -1.064 -10.289 1.00 0.00 C ATOM 2192 CG LEU A 135 -3.692 0.396 -10.147 1.00 0.00 C ATOM 2193 CD1 LEU A 135 -4.575 0.812 -11.316 1.00 0.00 C ATOM 2194 CD2 LEU A 135 -4.427 0.598 -8.834 1.00 0.00 C ATOM 0 H LEU A 135 -2.344 0.529 -12.044 1.00 0.00 H new ATOM 0 HA LEU A 135 -1.167 -1.515 -10.379 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -4.063 -1.620 -10.764 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -3.124 -1.482 -9.291 1.00 0.00 H new ATOM 0 HG LEU A 135 -2.801 1.023 -10.152 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -4.874 1.853 -11.194 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -4.021 0.700 -12.248 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -5.463 0.181 -11.344 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -4.733 1.640 -8.745 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -5.309 -0.042 -8.808 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -3.768 0.341 -8.005 1.00 0.00 H new ATOM 2206 N ARG A 136 -2.495 -2.200 -13.258 1.00 0.00 N ATOM 2207 CA ARG A 136 -2.696 -3.235 -14.252 1.00 0.00 C ATOM 2208 C ARG A 136 -1.503 -4.175 -14.301 1.00 0.00 C ATOM 2209 O ARG A 136 -1.623 -5.363 -14.002 1.00 0.00 O ATOM 2210 CB ARG A 136 -2.956 -2.580 -15.613 1.00 0.00 C ATOM 2211 CG ARG A 136 -1.906 -2.827 -16.687 1.00 0.00 C ATOM 2212 CD ARG A 136 -2.457 -2.548 -18.076 1.00 0.00 C ATOM 2213 NE ARG A 136 -1.836 -3.395 -19.092 1.00 0.00 N ATOM 2214 CZ ARG A 136 -2.361 -3.616 -20.295 1.00 0.00 C ATOM 2215 NH1 ARG A 136 -3.514 -3.056 -20.638 1.00 0.00 N ATOM 2216 NH2 ARG A 136 -1.730 -4.400 -21.159 1.00 0.00 N ATOM 0 H ARG A 136 -2.643 -1.251 -13.602 1.00 0.00 H new ATOM 0 HA ARG A 136 -3.564 -3.837 -13.982 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.917 -2.933 -15.986 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.048 -1.504 -15.464 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -1.039 -2.192 -16.503 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -1.562 -3.860 -16.631 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -3.535 -2.711 -18.078 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -2.292 -1.500 -18.328 1.00 0.00 H new ATOM 0 HE ARG A 136 -0.948 -3.843 -18.866 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -4.004 -2.452 -19.978 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -3.911 -3.230 -21.562 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -0.843 -4.833 -20.901 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -2.132 -4.570 -22.081 1.00 0.00 H new ATOM 2230 N THR A 137 -0.353 -3.642 -14.680 1.00 0.00 N ATOM 2231 CA THR A 137 0.841 -4.447 -14.775 1.00 0.00 C ATOM 2232 C THR A 137 1.318 -4.864 -13.396 1.00 0.00 C ATOM 2233 O THR A 137 1.858 -5.957 -13.214 1.00 0.00 O ATOM 2234 CB THR A 137 1.947 -3.690 -15.505 1.00 0.00 C ATOM 2235 OG1 THR A 137 1.403 -2.835 -16.495 1.00 0.00 O ATOM 2236 CG2 THR A 137 2.939 -4.607 -16.181 1.00 0.00 C ATOM 0 H THR A 137 -0.227 -2.660 -14.925 1.00 0.00 H new ATOM 0 HA THR A 137 0.598 -5.343 -15.346 1.00 0.00 H new ATOM 0 HB THR A 137 2.466 -3.116 -14.738 1.00 0.00 H new ATOM 0 HG1 THR A 137 2.128 -2.358 -16.950 1.00 0.00 H new ATOM 0 HG21 THR A 137 3.701 -4.011 -16.683 1.00 0.00 H new ATOM 0 HG22 THR A 137 3.411 -5.246 -15.435 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.421 -5.226 -16.914 1.00 0.00 H new ATOM 2244 N LEU A 138 1.121 -3.985 -12.425 1.00 0.00 N ATOM 2245 CA LEU A 138 1.542 -4.265 -11.064 1.00 0.00 C ATOM 2246 C LEU A 138 0.701 -5.349 -10.447 1.00 0.00 C ATOM 2247 O LEU A 138 1.174 -6.460 -10.210 1.00 0.00 O ATOM 2248 CB LEU A 138 1.462 -2.995 -10.231 1.00 0.00 C ATOM 2249 CG LEU A 138 2.642 -2.040 -10.425 1.00 0.00 C ATOM 2250 CD1 LEU A 138 3.341 -1.780 -9.113 1.00 0.00 C ATOM 2251 CD2 LEU A 138 3.622 -2.615 -11.435 1.00 0.00 C ATOM 0 H LEU A 138 0.675 -3.077 -12.555 1.00 0.00 H new ATOM 0 HA LEU A 138 2.573 -4.617 -11.087 1.00 0.00 H new ATOM 0 HB2 LEU A 138 0.540 -2.469 -10.479 1.00 0.00 H new ATOM 0 HB3 LEU A 138 1.400 -3.268 -9.178 1.00 0.00 H new ATOM 0 HG LEU A 138 2.258 -1.093 -10.804 1.00 0.00 H new ATOM 0 HD11 LEU A 138 4.176 -1.099 -9.275 1.00 0.00 H new ATOM 0 HD12 LEU A 138 2.639 -1.333 -8.409 1.00 0.00 H new ATOM 0 HD13 LEU A 138 3.713 -2.720 -8.706 1.00 0.00 H new ATOM 0 HD21 LEU A 138 4.457 -1.926 -11.564 1.00 0.00 H new ATOM 0 HD22 LEU A 138 3.995 -3.574 -11.075 1.00 0.00 H new ATOM 0 HD23 LEU A 138 3.118 -2.757 -12.391 1.00 0.00 H new ATOM 2263 N ALA A 139 -0.550 -5.027 -10.198 1.00 0.00 N ATOM 2264 CA ALA A 139 -1.473 -5.985 -9.617 1.00 0.00 C ATOM 2265 C ALA A 139 -1.397 -7.311 -10.364 1.00 0.00 C ATOM 2266 O ALA A 139 -1.706 -8.367 -9.815 1.00 0.00 O ATOM 2267 CB ALA A 139 -2.885 -5.436 -9.641 1.00 0.00 C ATOM 0 H ALA A 139 -0.954 -4.110 -10.388 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.191 -6.159 -8.579 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -3.566 -6.165 -9.202 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -2.925 -4.510 -9.067 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -3.181 -5.237 -10.671 1.00 0.00 H new ATOM 2273 N GLU A 140 -0.975 -7.241 -11.626 1.00 0.00 N ATOM 2274 CA GLU A 140 -0.849 -8.427 -12.453 1.00 0.00 C ATOM 2275 C GLU A 140 0.397 -9.227 -12.080 1.00 0.00 C ATOM 2276 O GLU A 140 0.407 -10.452 -12.197 1.00 0.00 O ATOM 2277 CB GLU A 140 -0.811 -8.042 -13.933 1.00 0.00 C ATOM 2278 CG GLU A 140 -2.193 -7.862 -14.545 1.00 0.00 C ATOM 2279 CD GLU A 140 -2.906 -9.180 -14.776 1.00 0.00 C ATOM 2280 OE1 GLU A 140 -3.454 -9.736 -13.801 1.00 0.00 O ATOM 2281 OE2 GLU A 140 -2.917 -9.655 -15.931 1.00 0.00 O ATOM 0 H GLU A 140 -0.716 -6.372 -12.093 1.00 0.00 H new ATOM 0 HA GLU A 140 -1.721 -9.057 -12.276 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -0.248 -7.115 -14.046 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -0.273 -8.811 -14.487 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -2.798 -7.236 -13.889 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -2.100 -7.333 -15.493 1.00 0.00 H new ATOM 2288 N ALA A 141 1.452 -8.540 -11.630 1.00 0.00 N ATOM 2289 CA ALA A 141 2.681 -9.238 -11.252 1.00 0.00 C ATOM 2290 C ALA A 141 3.723 -8.333 -10.577 1.00 0.00 C ATOM 2291 O ALA A 141 4.537 -8.815 -9.787 1.00 0.00 O ATOM 2292 CB ALA A 141 3.286 -9.911 -12.474 1.00 0.00 C ATOM 0 H ALA A 141 1.480 -7.526 -11.521 1.00 0.00 H new ATOM 0 HA ALA A 141 2.399 -9.983 -10.508 1.00 0.00 H new ATOM 0 HB1 ALA A 141 4.201 -10.430 -12.188 1.00 0.00 H new ATOM 0 HB2 ALA A 141 2.575 -10.629 -12.884 1.00 0.00 H new ATOM 0 HB3 ALA A 141 3.516 -9.158 -13.228 1.00 0.00 H new ATOM 2298 N GLY A 142 3.723 -7.038 -10.891 1.00 0.00 N ATOM 2299 CA GLY A 142 4.702 -6.137 -10.300 1.00 0.00 C ATOM 2300 C GLY A 142 4.352 -5.694 -8.889 1.00 0.00 C ATOM 2301 O GLY A 142 5.221 -5.251 -8.140 1.00 0.00 O ATOM 0 H GLY A 142 3.069 -6.599 -11.539 1.00 0.00 H new ATOM 0 HA2 GLY A 142 5.674 -6.630 -10.286 1.00 0.00 H new ATOM 0 HA3 GLY A 142 4.801 -5.256 -10.934 1.00 0.00 H new ATOM 2305 N ALA A 143 3.081 -5.819 -8.531 1.00 0.00 N ATOM 2306 CA ALA A 143 2.597 -5.437 -7.207 1.00 0.00 C ATOM 2307 C ALA A 143 1.089 -5.586 -7.156 1.00 0.00 C ATOM 2308 O ALA A 143 0.365 -4.871 -7.846 1.00 0.00 O ATOM 2309 CB ALA A 143 2.996 -4.009 -6.862 1.00 0.00 C ATOM 0 H ALA A 143 2.356 -6.187 -9.147 1.00 0.00 H new ATOM 0 HA ALA A 143 3.055 -6.097 -6.470 1.00 0.00 H new ATOM 0 HB1 ALA A 143 2.621 -3.756 -5.871 1.00 0.00 H new ATOM 0 HB2 ALA A 143 4.083 -3.922 -6.872 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.571 -3.325 -7.597 1.00 0.00 H new ATOM 2315 N LYS A 144 0.616 -6.522 -6.351 1.00 0.00 N ATOM 2316 CA LYS A 144 -0.800 -6.774 -6.239 1.00 0.00 C ATOM 2317 C LYS A 144 -1.511 -5.583 -5.590 1.00 0.00 C ATOM 2318 O LYS A 144 -1.565 -5.466 -4.365 1.00 0.00 O ATOM 2319 CB LYS A 144 -1.009 -8.082 -5.452 1.00 0.00 C ATOM 2320 CG LYS A 144 -2.146 -8.060 -4.448 1.00 0.00 C ATOM 2321 CD LYS A 144 -2.965 -9.340 -4.499 1.00 0.00 C ATOM 2322 CE LYS A 144 -4.388 -9.112 -4.014 1.00 0.00 C ATOM 2323 NZ LYS A 144 -5.216 -8.410 -5.033 1.00 0.00 N ATOM 0 H LYS A 144 1.199 -7.119 -5.765 1.00 0.00 H new ATOM 0 HA LYS A 144 -1.241 -6.893 -7.229 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -1.189 -8.889 -6.162 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -0.085 -8.321 -4.925 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -1.743 -7.926 -3.444 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -2.793 -7.206 -4.649 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -2.984 -9.720 -5.520 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -2.488 -10.103 -3.884 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -4.847 -10.070 -3.771 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -4.369 -8.526 -3.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -5.659 -7.573 -4.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -4.613 -8.114 -5.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -5.956 -9.052 -5.382 1.00 0.00 H new ATOM 2337 N ILE A 145 -2.056 -4.695 -6.427 1.00 0.00 N ATOM 2338 CA ILE A 145 -2.764 -3.521 -5.934 1.00 0.00 C ATOM 2339 C ILE A 145 -4.202 -3.875 -5.569 1.00 0.00 C ATOM 2340 O ILE A 145 -5.063 -3.993 -6.440 1.00 0.00 O ATOM 2341 CB ILE A 145 -2.776 -2.388 -6.977 1.00 0.00 C ATOM 2342 CG1 ILE A 145 -1.348 -2.060 -7.424 1.00 0.00 C ATOM 2343 CG2 ILE A 145 -3.468 -1.152 -6.414 1.00 0.00 C ATOM 2344 CD1 ILE A 145 -0.552 -1.281 -6.398 1.00 0.00 C ATOM 0 H ILE A 145 -2.018 -4.770 -7.444 1.00 0.00 H new ATOM 0 HA ILE A 145 -2.233 -3.176 -5.047 1.00 0.00 H new ATOM 0 HB ILE A 145 -3.338 -2.722 -7.849 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -0.824 -2.989 -7.648 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -1.389 -1.487 -8.350 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -3.467 -0.361 -7.164 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -4.496 -1.400 -6.149 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -2.936 -0.810 -5.526 1.00 0.00 H new ATOM 0 HD11 ILE A 145 0.448 -1.086 -6.785 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -1.052 -0.335 -6.191 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -0.478 -1.861 -5.478 1.00 0.00 H new ATOM 2356 N SER A 146 -4.454 -4.049 -4.278 1.00 0.00 N ATOM 2357 CA SER A 146 -5.786 -4.395 -3.799 1.00 0.00 C ATOM 2358 C SER A 146 -6.586 -3.144 -3.454 1.00 0.00 C ATOM 2359 O SER A 146 -6.030 -2.054 -3.324 1.00 0.00 O ATOM 2360 CB SER A 146 -5.687 -5.304 -2.574 1.00 0.00 C ATOM 2361 OG SER A 146 -5.607 -6.666 -2.954 1.00 0.00 O ATOM 0 H SER A 146 -3.753 -3.956 -3.543 1.00 0.00 H new ATOM 0 HA SER A 146 -6.305 -4.925 -4.598 1.00 0.00 H new ATOM 0 HB2 SER A 146 -4.808 -5.035 -1.988 1.00 0.00 H new ATOM 0 HB3 SER A 146 -6.556 -5.152 -1.934 1.00 0.00 H new ATOM 0 HG SER A 146 -5.861 -7.233 -2.196 1.00 0.00 H new ATOM 2367 N ILE A 147 -7.895 -3.314 -3.302 1.00 0.00 N ATOM 2368 CA ILE A 147 -8.775 -2.206 -2.965 1.00 0.00 C ATOM 2369 C ILE A 147 -8.903 -2.062 -1.456 1.00 0.00 C ATOM 2370 O ILE A 147 -9.387 -2.970 -0.779 1.00 0.00 O ATOM 2371 CB ILE A 147 -10.180 -2.399 -3.567 1.00 0.00 C ATOM 2372 CG1 ILE A 147 -10.081 -2.937 -4.997 1.00 0.00 C ATOM 2373 CG2 ILE A 147 -10.947 -1.090 -3.537 1.00 0.00 C ATOM 2374 CD1 ILE A 147 -10.375 -4.419 -5.105 1.00 0.00 C ATOM 0 H ILE A 147 -8.369 -4.211 -3.408 1.00 0.00 H new ATOM 0 HA ILE A 147 -8.330 -1.304 -3.386 1.00 0.00 H new ATOM 0 HB ILE A 147 -10.721 -3.130 -2.966 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -10.777 -2.389 -5.632 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -9.079 -2.744 -5.381 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -11.938 -1.239 -3.965 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -11.044 -0.749 -2.506 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -10.410 -0.340 -4.118 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -10.287 -4.733 -6.145 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -9.663 -4.976 -4.496 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -11.387 -4.616 -4.751 1.00 0.00 H new ATOM 2386 N MET A 148 -8.473 -0.921 -0.925 1.00 0.00 N ATOM 2387 CA MET A 148 -8.557 -0.691 0.510 1.00 0.00 C ATOM 2388 C MET A 148 -9.923 -0.131 0.880 1.00 0.00 C ATOM 2389 O MET A 148 -10.076 1.065 1.127 1.00 0.00 O ATOM 2390 CB MET A 148 -7.447 0.247 0.986 1.00 0.00 C ATOM 2391 CG MET A 148 -6.834 -0.182 2.311 1.00 0.00 C ATOM 2392 SD MET A 148 -5.625 0.997 2.943 1.00 0.00 S ATOM 2393 CE MET A 148 -6.512 2.539 2.743 1.00 0.00 C ATOM 0 H MET A 148 -8.069 -0.152 -1.460 1.00 0.00 H new ATOM 0 HA MET A 148 -8.424 -1.649 1.012 1.00 0.00 H new ATOM 0 HB2 MET A 148 -6.665 0.290 0.227 1.00 0.00 H new ATOM 0 HB3 MET A 148 -7.849 1.255 1.087 1.00 0.00 H new ATOM 0 HG2 MET A 148 -7.627 -0.310 3.047 1.00 0.00 H new ATOM 0 HG3 MET A 148 -6.355 -1.153 2.186 1.00 0.00 H new ATOM 0 HE1 MET A 148 -6.247 3.219 3.553 1.00 0.00 H new ATOM 0 HE2 MET A 148 -6.245 2.991 1.788 1.00 0.00 H new ATOM 0 HE3 MET A 148 -7.585 2.347 2.766 1.00 0.00 H new ATOM 2403 N THR A 149 -10.916 -1.011 0.904 1.00 0.00 N ATOM 2404 CA THR A 149 -12.281 -0.618 1.227 1.00 0.00 C ATOM 2405 C THR A 149 -12.608 -0.883 2.693 1.00 0.00 C ATOM 2406 O THR A 149 -11.735 -1.237 3.469 1.00 0.00 O ATOM 2407 CB THR A 149 -13.265 -1.351 0.321 1.00 0.00 C ATOM 2408 OG1 THR A 149 -13.076 -2.753 0.402 1.00 0.00 O ATOM 2409 CG2 THR A 149 -13.130 -0.951 -1.129 1.00 0.00 C ATOM 0 H THR A 149 -10.801 -2.004 0.703 1.00 0.00 H new ATOM 0 HA THR A 149 -12.371 0.455 1.058 1.00 0.00 H new ATOM 0 HB THR A 149 -14.258 -1.072 0.674 1.00 0.00 H new ATOM 0 HG1 THR A 149 -13.884 -3.211 0.089 1.00 0.00 H new ATOM 0 HG21 THR A 149 -13.854 -1.503 -1.728 1.00 0.00 H new ATOM 0 HG22 THR A 149 -13.316 0.118 -1.230 1.00 0.00 H new ATOM 0 HG23 THR A 149 -12.122 -1.179 -1.477 1.00 0.00 H new ATOM 2417 N TYR A 150 -13.876 -0.693 3.051 1.00 0.00 N ATOM 2418 CA TYR A 150 -14.359 -0.880 4.422 1.00 0.00 C ATOM 2419 C TYR A 150 -13.666 -2.025 5.155 1.00 0.00 C ATOM 2420 O TYR A 150 -13.274 -1.884 6.313 1.00 0.00 O ATOM 2421 CB TYR A 150 -15.864 -1.140 4.417 1.00 0.00 C ATOM 2422 CG TYR A 150 -16.341 -1.969 3.244 1.00 0.00 C ATOM 2423 CD1 TYR A 150 -16.240 -3.353 3.265 1.00 0.00 C ATOM 2424 CD2 TYR A 150 -16.891 -1.368 2.119 1.00 0.00 C ATOM 2425 CE1 TYR A 150 -16.674 -4.117 2.199 1.00 0.00 C ATOM 2426 CE2 TYR A 150 -17.327 -2.125 1.048 1.00 0.00 C ATOM 2427 CZ TYR A 150 -17.217 -3.499 1.093 1.00 0.00 C ATOM 2428 OH TYR A 150 -17.651 -4.256 0.029 1.00 0.00 O ATOM 0 H TYR A 150 -14.603 -0.403 2.397 1.00 0.00 H new ATOM 0 HA TYR A 150 -14.125 0.042 4.955 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -16.138 -1.647 5.342 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -16.388 -0.184 4.410 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -15.815 -3.841 4.130 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -16.979 -0.292 2.081 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -16.588 -5.193 2.232 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -17.752 -1.643 0.180 1.00 0.00 H new ATOM 0 HH TYR A 150 -18.007 -3.667 -0.668 1.00 0.00 H new ATOM 2438 N SER A 151 -13.534 -3.160 4.487 1.00 0.00 N ATOM 2439 CA SER A 151 -12.908 -4.324 5.094 1.00 0.00 C ATOM 2440 C SER A 151 -11.412 -4.110 5.236 1.00 0.00 C ATOM 2441 O SER A 151 -10.844 -4.217 6.327 1.00 0.00 O ATOM 2442 CB SER A 151 -13.175 -5.570 4.251 1.00 0.00 C ATOM 2443 OG SER A 151 -14.544 -5.664 3.896 1.00 0.00 O ATOM 0 H SER A 151 -13.851 -3.300 3.528 1.00 0.00 H new ATOM 0 HA SER A 151 -13.339 -4.466 6.085 1.00 0.00 H new ATOM 0 HB2 SER A 151 -12.564 -5.540 3.349 1.00 0.00 H new ATOM 0 HB3 SER A 151 -12.879 -6.459 4.807 1.00 0.00 H new ATOM 0 HG SER A 151 -14.776 -4.929 3.290 1.00 0.00 H new ATOM 2449 N GLU A 152 -10.786 -3.777 4.124 1.00 0.00 N ATOM 2450 CA GLU A 152 -9.360 -3.518 4.116 1.00 0.00 C ATOM 2451 C GLU A 152 -9.068 -2.251 4.905 1.00 0.00 C ATOM 2452 O GLU A 152 -7.922 -1.976 5.260 1.00 0.00 O ATOM 2453 CB GLU A 152 -8.853 -3.377 2.683 1.00 0.00 C ATOM 2454 CG GLU A 152 -7.720 -4.330 2.339 1.00 0.00 C ATOM 2455 CD GLU A 152 -8.068 -5.777 2.629 1.00 0.00 C ATOM 2456 OE1 GLU A 152 -8.858 -6.364 1.859 1.00 0.00 O ATOM 2457 OE2 GLU A 152 -7.551 -6.324 3.626 1.00 0.00 O ATOM 0 H GLU A 152 -11.241 -3.680 3.216 1.00 0.00 H new ATOM 0 HA GLU A 152 -8.843 -4.357 4.582 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -9.681 -3.548 1.995 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -8.515 -2.353 2.526 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -7.469 -4.225 1.283 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -6.832 -4.053 2.907 1.00 0.00 H new ATOM 2464 N PHE A 153 -10.120 -1.482 5.179 1.00 0.00 N ATOM 2465 CA PHE A 153 -9.981 -0.252 5.924 1.00 0.00 C ATOM 2466 C PHE A 153 -9.810 -0.555 7.399 1.00 0.00 C ATOM 2467 O PHE A 153 -8.835 -0.134 8.012 1.00 0.00 O ATOM 2468 CB PHE A 153 -11.189 0.653 5.707 1.00 0.00 C ATOM 2469 CG PHE A 153 -10.829 2.061 5.302 1.00 0.00 C ATOM 2470 CD1 PHE A 153 -9.654 2.329 4.612 1.00 0.00 C ATOM 2471 CD2 PHE A 153 -11.674 3.117 5.607 1.00 0.00 C ATOM 2472 CE1 PHE A 153 -9.332 3.620 4.237 1.00 0.00 C ATOM 2473 CE2 PHE A 153 -11.355 4.408 5.232 1.00 0.00 C ATOM 2474 CZ PHE A 153 -10.184 4.660 4.547 1.00 0.00 C ATOM 0 H PHE A 153 -11.075 -1.697 4.892 1.00 0.00 H new ATOM 0 HA PHE A 153 -9.095 0.271 5.564 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -11.826 0.215 4.938 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -11.775 0.687 6.625 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -8.984 1.519 4.365 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -12.592 2.928 6.144 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -8.414 3.814 3.702 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -12.023 5.221 5.475 1.00 0.00 H new ATOM 0 HZ PHE A 153 -9.935 5.669 4.254 1.00 0.00 H new ATOM 2484 N LYS A 154 -10.750 -1.317 7.967 1.00 0.00 N ATOM 2485 CA LYS A 154 -10.656 -1.693 9.371 1.00 0.00 C ATOM 2486 C LYS A 154 -9.269 -2.261 9.623 1.00 0.00 C ATOM 2487 O LYS A 154 -8.658 -2.025 10.667 1.00 0.00 O ATOM 2488 CB LYS A 154 -11.735 -2.714 9.743 1.00 0.00 C ATOM 2489 CG LYS A 154 -11.756 -3.939 8.846 1.00 0.00 C ATOM 2490 CD LYS A 154 -12.442 -5.114 9.524 1.00 0.00 C ATOM 2491 CE LYS A 154 -11.479 -5.886 10.411 1.00 0.00 C ATOM 2492 NZ LYS A 154 -12.103 -7.117 10.969 1.00 0.00 N ATOM 0 H LYS A 154 -11.571 -1.678 7.481 1.00 0.00 H new ATOM 0 HA LYS A 154 -10.817 -0.814 9.995 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -11.580 -3.033 10.774 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -12.710 -2.229 9.702 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -12.273 -3.702 7.916 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -10.735 -4.215 8.582 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -13.279 -4.752 10.122 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -12.856 -5.781 8.768 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -10.593 -6.157 9.836 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -11.145 -5.246 11.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -11.414 -7.615 11.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -12.933 -6.858 11.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -12.398 -7.740 10.190 1.00 0.00 H new ATOM 2506 N HIS A 155 -8.760 -2.977 8.621 1.00 0.00 N ATOM 2507 CA HIS A 155 -7.424 -3.538 8.701 1.00 0.00 C ATOM 2508 C HIS A 155 -6.409 -2.401 8.742 1.00 0.00 C ATOM 2509 O HIS A 155 -5.484 -2.406 9.557 1.00 0.00 O ATOM 2510 CB HIS A 155 -7.152 -4.452 7.503 1.00 0.00 C ATOM 2511 CG HIS A 155 -7.231 -5.910 7.834 1.00 0.00 C ATOM 2512 ND1 HIS A 155 -6.501 -6.873 7.170 1.00 0.00 N ATOM 2513 CD2 HIS A 155 -7.961 -6.569 8.765 1.00 0.00 C ATOM 2514 CE1 HIS A 155 -6.779 -8.061 7.679 1.00 0.00 C ATOM 2515 NE2 HIS A 155 -7.661 -7.903 8.648 1.00 0.00 N ATOM 0 H HIS A 155 -9.254 -3.178 7.752 1.00 0.00 H new ATOM 0 HA HIS A 155 -7.338 -4.137 9.608 1.00 0.00 H new ATOM 0 HB2 HIS A 155 -7.870 -4.227 6.714 1.00 0.00 H new ATOM 0 HB3 HIS A 155 -6.162 -4.231 7.105 1.00 0.00 H new ATOM 0 HD2 HIS A 155 -8.651 -6.127 9.469 1.00 0.00 H new ATOM 0 HE1 HIS A 155 -6.356 -9.001 7.357 1.00 0.00 H new ATOM 0 HE2 HIS A 155 -8.056 -8.651 9.218 1.00 0.00 H new ATOM 2524 N CYS A 156 -6.609 -1.401 7.877 1.00 0.00 N ATOM 2525 CA CYS A 156 -5.723 -0.246 7.844 1.00 0.00 C ATOM 2526 C CYS A 156 -5.784 0.475 9.185 1.00 0.00 C ATOM 2527 O CYS A 156 -4.761 0.863 9.753 1.00 0.00 O ATOM 2528 CB CYS A 156 -6.128 0.707 6.717 1.00 0.00 C ATOM 2529 SG CYS A 156 -5.009 2.110 6.500 1.00 0.00 S ATOM 0 H CYS A 156 -7.370 -1.373 7.199 1.00 0.00 H new ATOM 0 HA CYS A 156 -4.703 -0.584 7.658 1.00 0.00 H new ATOM 0 HB2 CYS A 156 -6.178 0.148 5.783 1.00 0.00 H new ATOM 0 HB3 CYS A 156 -7.131 1.084 6.917 1.00 0.00 H new ATOM 0 HG CYS A 156 -4.775 2.287 5.233 1.00 0.00 H new ATOM 2535 N TRP A 157 -7.007 0.625 9.688 1.00 0.00 N ATOM 2536 CA TRP A 157 -7.262 1.275 10.968 1.00 0.00 C ATOM 2537 C TRP A 157 -6.252 0.836 12.018 1.00 0.00 C ATOM 2538 O TRP A 157 -5.393 1.612 12.431 1.00 0.00 O ATOM 2539 CB TRP A 157 -8.678 0.939 11.435 1.00 0.00 C ATOM 2540 CG TRP A 157 -9.105 1.698 12.648 1.00 0.00 C ATOM 2541 CD1 TRP A 157 -9.377 1.186 13.880 1.00 0.00 C ATOM 2542 CD2 TRP A 157 -9.311 3.109 12.742 1.00 0.00 C ATOM 2543 NE1 TRP A 157 -9.739 2.192 14.739 1.00 0.00 N ATOM 2544 CE2 TRP A 157 -9.703 3.385 14.063 1.00 0.00 C ATOM 2545 CE3 TRP A 157 -9.200 4.163 11.836 1.00 0.00 C ATOM 2546 CZ2 TRP A 157 -9.982 4.678 14.500 1.00 0.00 C ATOM 2547 CZ3 TRP A 157 -9.479 5.445 12.268 1.00 0.00 C ATOM 2548 CH2 TRP A 157 -9.865 5.693 13.591 1.00 0.00 C ATOM 0 H TRP A 157 -7.850 0.298 9.217 1.00 0.00 H new ATOM 0 HA TRP A 157 -7.163 2.352 10.835 1.00 0.00 H new ATOM 0 HB2 TRP A 157 -9.377 1.144 10.624 1.00 0.00 H new ATOM 0 HB3 TRP A 157 -8.738 -0.129 11.645 1.00 0.00 H new ATOM 0 HD1 TRP A 157 -9.317 0.140 14.143 1.00 0.00 H new ATOM 0 HE1 TRP A 157 -9.993 2.073 15.720 1.00 0.00 H new ATOM 0 HE3 TRP A 157 -8.901 3.980 10.814 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 -10.280 4.872 15.520 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 -9.398 6.269 11.575 1.00 0.00 H new ATOM 0 HH2 TRP A 157 -10.075 6.706 13.900 1.00 0.00 H new ATOM 2559 N ASP A 158 -6.362 -0.416 12.445 1.00 0.00 N ATOM 2560 CA ASP A 158 -5.453 -0.959 13.447 1.00 0.00 C ATOM 2561 C ASP A 158 -4.050 -1.162 12.876 1.00 0.00 C ATOM 2562 O ASP A 158 -3.120 -1.483 13.615 1.00 0.00 O ATOM 2563 CB ASP A 158 -5.993 -2.284 13.989 1.00 0.00 C ATOM 2564 CG ASP A 158 -5.740 -2.446 15.475 1.00 0.00 C ATOM 2565 OD1 ASP A 158 -4.595 -2.774 15.851 1.00 0.00 O ATOM 2566 OD2 ASP A 158 -6.687 -2.245 16.265 1.00 0.00 O ATOM 0 H ASP A 158 -7.069 -1.073 12.114 1.00 0.00 H new ATOM 0 HA ASP A 158 -5.386 -0.237 14.261 1.00 0.00 H new ATOM 0 HB2 ASP A 158 -7.064 -2.342 13.797 1.00 0.00 H new ATOM 0 HB3 ASP A 158 -5.527 -3.110 13.452 1.00 0.00 H new ATOM 2571 N THR A 159 -3.887 -0.964 11.564 1.00 0.00 N ATOM 2572 CA THR A 159 -2.580 -1.121 10.945 1.00 0.00 C ATOM 2573 C THR A 159 -1.643 -0.053 11.482 1.00 0.00 C ATOM 2574 O THR A 159 -0.465 -0.305 11.737 1.00 0.00 O ATOM 2575 CB THR A 159 -2.690 -1.044 9.413 1.00 0.00 C ATOM 2576 OG1 THR A 159 -1.944 -2.085 8.809 1.00 0.00 O ATOM 2577 CG2 THR A 159 -2.208 0.266 8.811 1.00 0.00 C ATOM 0 H THR A 159 -4.635 -0.699 10.924 1.00 0.00 H new ATOM 0 HA THR A 159 -2.177 -2.103 11.193 1.00 0.00 H new ATOM 0 HB THR A 159 -3.757 -1.133 9.211 1.00 0.00 H new ATOM 0 HG1 THR A 159 -2.026 -2.023 7.834 1.00 0.00 H new ATOM 0 HG21 THR A 159 -2.322 0.232 7.728 1.00 0.00 H new ATOM 0 HG22 THR A 159 -2.798 1.090 9.212 1.00 0.00 H new ATOM 0 HG23 THR A 159 -1.158 0.417 9.061 1.00 0.00 H new ATOM 2736 N PRO A 170 -15.086 3.018 9.395 1.00 0.00 N ATOM 2737 CA PRO A 170 -16.317 2.960 8.615 1.00 0.00 C ATOM 2738 C PRO A 170 -16.219 3.707 7.283 1.00 0.00 C ATOM 2739 O PRO A 170 -16.162 3.086 6.221 1.00 0.00 O ATOM 2740 CB PRO A 170 -17.341 3.624 9.536 1.00 0.00 C ATOM 2741 CG PRO A 170 -16.560 4.528 10.442 1.00 0.00 C ATOM 2742 CD PRO A 170 -15.106 4.125 10.363 1.00 0.00 C ATOM 0 HA PRO A 170 -16.570 1.938 8.332 1.00 0.00 H new ATOM 0 HB2 PRO A 170 -18.075 4.188 8.960 1.00 0.00 H new ATOM 0 HB3 PRO A 170 -17.891 2.878 10.109 1.00 0.00 H new ATOM 0 HG2 PRO A 170 -16.684 5.568 10.141 1.00 0.00 H new ATOM 0 HG3 PRO A 170 -16.923 4.447 11.467 1.00 0.00 H new ATOM 0 HD2 PRO A 170 -14.481 4.954 10.031 1.00 0.00 H new ATOM 0 HD3 PRO A 170 -14.728 3.810 11.335 1.00 0.00 H new ATOM 2750 N TRP A 171 -16.208 5.039 7.344 1.00 0.00 N ATOM 2751 CA TRP A 171 -16.127 5.870 6.144 1.00 0.00 C ATOM 2752 C TRP A 171 -17.380 5.717 5.283 1.00 0.00 C ATOM 2753 O TRP A 171 -18.202 6.629 5.208 1.00 0.00 O ATOM 2754 CB TRP A 171 -14.887 5.524 5.335 1.00 0.00 C ATOM 2755 CG TRP A 171 -14.735 6.368 4.111 1.00 0.00 C ATOM 2756 CD1 TRP A 171 -13.941 6.094 3.046 1.00 0.00 C ATOM 2757 CD2 TRP A 171 -15.388 7.620 3.816 1.00 0.00 C ATOM 2758 NE1 TRP A 171 -14.063 7.075 2.103 1.00 0.00 N ATOM 2759 CE2 TRP A 171 -14.939 8.023 2.546 1.00 0.00 C ATOM 2760 CE3 TRP A 171 -16.306 8.436 4.488 1.00 0.00 C ATOM 2761 CZ2 TRP A 171 -15.373 9.198 1.936 1.00 0.00 C ATOM 2762 CZ3 TRP A 171 -16.734 9.602 3.881 1.00 0.00 C ATOM 2763 CH2 TRP A 171 -16.269 9.972 2.616 1.00 0.00 C ATOM 0 H TRP A 171 -16.254 5.567 8.216 1.00 0.00 H new ATOM 0 HA TRP A 171 -16.057 6.910 6.463 1.00 0.00 H new ATOM 0 HB2 TRP A 171 -14.005 5.643 5.964 1.00 0.00 H new ATOM 0 HB3 TRP A 171 -14.931 4.475 5.043 1.00 0.00 H new ATOM 0 HD1 TRP A 171 -13.305 5.226 2.956 1.00 0.00 H new ATOM 0 HE1 TRP A 171 -13.575 7.096 1.207 1.00 0.00 H new ATOM 0 HE3 TRP A 171 -16.674 8.159 5.465 1.00 0.00 H new ATOM 0 HZ2 TRP A 171 -15.013 9.487 0.959 1.00 0.00 H new ATOM 0 HZ3 TRP A 171 -17.440 10.238 4.393 1.00 0.00 H new ATOM 0 HH2 TRP A 171 -16.625 10.888 2.168 1.00 0.00 H new ATOM 2774 N ASP A 172 -17.516 4.553 4.642 1.00 0.00 N ATOM 2775 CA ASP A 172 -18.666 4.247 3.782 1.00 0.00 C ATOM 2776 C ASP A 172 -18.359 4.532 2.312 1.00 0.00 C ATOM 2777 O ASP A 172 -18.491 3.652 1.463 1.00 0.00 O ATOM 2778 CB ASP A 172 -19.915 5.024 4.214 1.00 0.00 C ATOM 2779 CG ASP A 172 -21.199 4.312 3.833 1.00 0.00 C ATOM 2780 OD1 ASP A 172 -21.547 3.317 4.504 1.00 0.00 O ATOM 2781 OD2 ASP A 172 -21.856 4.750 2.865 1.00 0.00 O ATOM 0 H ASP A 172 -16.834 3.797 4.703 1.00 0.00 H new ATOM 0 HA ASP A 172 -18.866 3.181 3.893 1.00 0.00 H new ATOM 0 HB2 ASP A 172 -19.892 5.173 5.294 1.00 0.00 H new ATOM 0 HB3 ASP A 172 -19.901 6.013 3.756 1.00 0.00 H new ATOM 2786 N GLY A 173 -17.955 5.767 2.014 1.00 0.00 N ATOM 2787 CA GLY A 173 -17.643 6.142 0.644 1.00 0.00 C ATOM 2788 C GLY A 173 -16.762 5.126 -0.057 1.00 0.00 C ATOM 2789 O GLY A 173 -16.995 4.788 -1.218 1.00 0.00 O ATOM 0 H GLY A 173 -17.838 6.514 2.698 1.00 0.00 H new ATOM 0 HA2 GLY A 173 -18.571 6.259 0.084 1.00 0.00 H new ATOM 0 HA3 GLY A 173 -17.144 7.111 0.642 1.00 0.00 H new ATOM 2793 N LEU A 174 -15.750 4.632 0.648 1.00 0.00 N ATOM 2794 CA LEU A 174 -14.846 3.643 0.076 1.00 0.00 C ATOM 2795 C LEU A 174 -15.616 2.415 -0.402 1.00 0.00 C ATOM 2796 O LEU A 174 -15.139 1.666 -1.254 1.00 0.00 O ATOM 2797 CB LEU A 174 -13.747 3.263 1.074 1.00 0.00 C ATOM 2798 CG LEU A 174 -14.087 2.201 2.130 1.00 0.00 C ATOM 2799 CD1 LEU A 174 -13.167 2.358 3.325 1.00 0.00 C ATOM 2800 CD2 LEU A 174 -15.538 2.278 2.586 1.00 0.00 C ATOM 0 H LEU A 174 -15.537 4.898 1.609 1.00 0.00 H new ATOM 0 HA LEU A 174 -14.361 4.087 -0.793 1.00 0.00 H new ATOM 0 HB2 LEU A 174 -12.885 2.911 0.508 1.00 0.00 H new ATOM 0 HB3 LEU A 174 -13.437 4.169 1.595 1.00 0.00 H new ATOM 0 HG LEU A 174 -13.943 1.224 1.668 1.00 0.00 H new ATOM 0 HD11 LEU A 174 -13.410 1.603 4.073 1.00 0.00 H new ATOM 0 HD12 LEU A 174 -12.132 2.233 3.006 1.00 0.00 H new ATOM 0 HD13 LEU A 174 -13.296 3.351 3.756 1.00 0.00 H new ATOM 0 HD21 LEU A 174 -15.726 1.506 3.332 1.00 0.00 H new ATOM 0 HD22 LEU A 174 -15.731 3.258 3.021 1.00 0.00 H new ATOM 0 HD23 LEU A 174 -16.197 2.125 1.731 1.00 0.00 H new ATOM 2812 N ASP A 175 -16.827 2.233 0.125 1.00 0.00 N ATOM 2813 CA ASP A 175 -17.672 1.121 -0.285 1.00 0.00 C ATOM 2814 C ASP A 175 -18.046 1.316 -1.746 1.00 0.00 C ATOM 2815 O ASP A 175 -18.030 0.379 -2.551 1.00 0.00 O ATOM 2816 CB ASP A 175 -18.931 1.054 0.583 1.00 0.00 C ATOM 2817 CG ASP A 175 -19.759 -0.184 0.307 1.00 0.00 C ATOM 2818 OD1 ASP A 175 -20.051 -0.453 -0.877 1.00 0.00 O ATOM 2819 OD2 ASP A 175 -20.116 -0.887 1.276 1.00 0.00 O ATOM 0 H ASP A 175 -17.240 2.840 0.833 1.00 0.00 H new ATOM 0 HA ASP A 175 -17.132 0.182 -0.161 1.00 0.00 H new ATOM 0 HB2 ASP A 175 -18.645 1.069 1.635 1.00 0.00 H new ATOM 0 HB3 ASP A 175 -19.539 1.941 0.405 1.00 0.00 H new ATOM 2824 N GLU A 176 -18.338 2.569 -2.080 1.00 0.00 N ATOM 2825 CA GLU A 176 -18.674 2.948 -3.441 1.00 0.00 C ATOM 2826 C GLU A 176 -17.471 2.667 -4.331 1.00 0.00 C ATOM 2827 O GLU A 176 -17.606 2.160 -5.445 1.00 0.00 O ATOM 2828 CB GLU A 176 -19.075 4.433 -3.487 1.00 0.00 C ATOM 2829 CG GLU A 176 -18.581 5.183 -4.715 1.00 0.00 C ATOM 2830 CD GLU A 176 -19.022 6.633 -4.730 1.00 0.00 C ATOM 2831 OE1 GLU A 176 -18.390 7.453 -4.030 1.00 0.00 O ATOM 2832 OE2 GLU A 176 -20.000 6.949 -5.440 1.00 0.00 O ATOM 0 H GLU A 176 -18.348 3.344 -1.417 1.00 0.00 H new ATOM 0 HA GLU A 176 -19.524 2.368 -3.801 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -20.162 4.504 -3.447 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -18.690 4.928 -2.595 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -17.492 5.138 -4.750 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -18.950 4.686 -5.612 1.00 0.00 H new ATOM 2839 N HIS A 177 -16.287 2.970 -3.805 1.00 0.00 N ATOM 2840 CA HIS A 177 -15.049 2.718 -4.517 1.00 0.00 C ATOM 2841 C HIS A 177 -14.755 1.223 -4.510 1.00 0.00 C ATOM 2842 O HIS A 177 -14.030 0.716 -5.357 1.00 0.00 O ATOM 2843 CB HIS A 177 -13.892 3.486 -3.873 1.00 0.00 C ATOM 2844 CG HIS A 177 -13.992 4.970 -4.040 1.00 0.00 C ATOM 2845 ND1 HIS A 177 -15.138 5.685 -3.763 1.00 0.00 N ATOM 2846 CD2 HIS A 177 -13.078 5.879 -4.461 1.00 0.00 C ATOM 2847 CE1 HIS A 177 -14.926 6.967 -4.005 1.00 0.00 C ATOM 2848 NE2 HIS A 177 -13.684 7.110 -4.430 1.00 0.00 N ATOM 0 H HIS A 177 -16.165 3.392 -2.884 1.00 0.00 H new ATOM 0 HA HIS A 177 -15.156 3.061 -5.546 1.00 0.00 H new ATOM 0 HB2 HIS A 177 -13.857 3.250 -2.809 1.00 0.00 H new ATOM 0 HB3 HIS A 177 -12.953 3.142 -4.306 1.00 0.00 H new ATOM 0 HD2 HIS A 177 -12.062 5.673 -4.764 1.00 0.00 H new ATOM 0 HE1 HIS A 177 -15.646 7.762 -3.877 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -13.246 7.993 -4.693 1.00 0.00 H new ATOM 2857 N SER A 178 -15.343 0.514 -3.550 1.00 0.00 N ATOM 2858 CA SER A 178 -15.161 -0.925 -3.445 1.00 0.00 C ATOM 2859 C SER A 178 -15.604 -1.596 -4.731 1.00 0.00 C ATOM 2860 O SER A 178 -14.851 -2.346 -5.348 1.00 0.00 O ATOM 2861 CB SER A 178 -15.967 -1.471 -2.266 1.00 0.00 C ATOM 2862 OG SER A 178 -15.269 -2.513 -1.604 1.00 0.00 O ATOM 0 H SER A 178 -15.949 0.916 -2.835 1.00 0.00 H new ATOM 0 HA SER A 178 -14.105 -1.137 -3.278 1.00 0.00 H new ATOM 0 HB2 SER A 178 -16.176 -0.666 -1.562 1.00 0.00 H new ATOM 0 HB3 SER A 178 -16.928 -1.842 -2.621 1.00 0.00 H new ATOM 0 HG SER A 178 -15.734 -2.741 -0.772 1.00 0.00 H new ATOM 2868 N GLN A 179 -16.832 -1.307 -5.132 1.00 0.00 N ATOM 2869 CA GLN A 179 -17.382 -1.872 -6.354 1.00 0.00 C ATOM 2870 C GLN A 179 -16.739 -1.230 -7.583 1.00 0.00 C ATOM 2871 O GLN A 179 -16.582 -1.870 -8.624 1.00 0.00 O ATOM 2872 CB GLN A 179 -18.899 -1.672 -6.379 1.00 0.00 C ATOM 2873 CG GLN A 179 -19.327 -0.221 -6.542 1.00 0.00 C ATOM 2874 CD GLN A 179 -20.043 0.033 -7.855 1.00 0.00 C ATOM 2875 OE1 GLN A 179 -19.987 -0.785 -8.774 1.00 0.00 O ATOM 2876 NE2 GLN A 179 -20.721 1.170 -7.949 1.00 0.00 N ATOM 0 H GLN A 179 -17.466 -0.685 -4.630 1.00 0.00 H new ATOM 0 HA GLN A 179 -17.163 -2.940 -6.377 1.00 0.00 H new ATOM 0 HB2 GLN A 179 -19.320 -2.259 -7.196 1.00 0.00 H new ATOM 0 HB3 GLN A 179 -19.323 -2.064 -5.454 1.00 0.00 H new ATOM 0 HG2 GLN A 179 -19.982 0.055 -5.716 1.00 0.00 H new ATOM 0 HG3 GLN A 179 -18.449 0.422 -6.481 1.00 0.00 H new ATOM 0 HE21 GLN A 179 -20.740 1.819 -7.162 1.00 0.00 H new ATOM 0 HE22 GLN A 179 -21.223 1.395 -8.808 1.00 0.00 H new ATOM 2885 N ASP A 180 -16.359 0.038 -7.448 1.00 0.00 N ATOM 2886 CA ASP A 180 -15.731 0.772 -8.542 1.00 0.00 C ATOM 2887 C ASP A 180 -14.254 0.418 -8.653 1.00 0.00 C ATOM 2888 O ASP A 180 -13.828 -0.245 -9.600 1.00 0.00 O ATOM 2889 CB ASP A 180 -15.890 2.279 -8.318 1.00 0.00 C ATOM 2890 CG ASP A 180 -17.110 2.842 -9.021 1.00 0.00 C ATOM 2891 OD1 ASP A 180 -18.235 2.417 -8.688 1.00 0.00 O ATOM 2892 OD2 ASP A 180 -16.939 3.709 -9.905 1.00 0.00 O ATOM 0 H ASP A 180 -16.475 0.579 -6.591 1.00 0.00 H new ATOM 0 HA ASP A 180 -16.224 0.491 -9.473 1.00 0.00 H new ATOM 0 HB2 ASP A 180 -15.965 2.479 -7.249 1.00 0.00 H new ATOM 0 HB3 ASP A 180 -14.998 2.793 -8.676 1.00 0.00 H new ATOM 2897 N LEU A 181 -13.485 0.858 -7.666 1.00 0.00 N ATOM 2898 CA LEU A 181 -12.052 0.593 -7.613 1.00 0.00 C ATOM 2899 C LEU A 181 -11.757 -0.871 -7.922 1.00 0.00 C ATOM 2900 O LEU A 181 -10.948 -1.181 -8.796 1.00 0.00 O ATOM 2901 CB LEU A 181 -11.524 0.948 -6.223 1.00 0.00 C ATOM 2902 CG LEU A 181 -10.044 1.312 -6.151 1.00 0.00 C ATOM 2903 CD1 LEU A 181 -9.692 1.808 -4.756 1.00 0.00 C ATOM 2904 CD2 LEU A 181 -9.179 0.118 -6.533 1.00 0.00 C ATOM 0 H LEU A 181 -13.835 1.407 -6.881 1.00 0.00 H new ATOM 0 HA LEU A 181 -11.554 1.205 -8.365 1.00 0.00 H new ATOM 0 HB2 LEU A 181 -12.105 1.786 -5.837 1.00 0.00 H new ATOM 0 HB3 LEU A 181 -11.704 0.102 -5.559 1.00 0.00 H new ATOM 0 HG LEU A 181 -9.847 2.114 -6.863 1.00 0.00 H new ATOM 0 HD11 LEU A 181 -8.633 2.065 -4.717 1.00 0.00 H new ATOM 0 HD12 LEU A 181 -10.288 2.690 -4.522 1.00 0.00 H new ATOM 0 HD13 LEU A 181 -9.902 1.025 -4.028 1.00 0.00 H new ATOM 0 HD21 LEU A 181 -8.127 0.398 -6.476 1.00 0.00 H new ATOM 0 HD22 LEU A 181 -9.373 -0.706 -5.847 1.00 0.00 H new ATOM 0 HD23 LEU A 181 -9.417 -0.193 -7.550 1.00 0.00 H new ATOM 2916 N SER A 182 -12.422 -1.771 -7.202 1.00 0.00 N ATOM 2917 CA SER A 182 -12.230 -3.202 -7.409 1.00 0.00 C ATOM 2918 C SER A 182 -12.592 -3.587 -8.836 1.00 0.00 C ATOM 2919 O SER A 182 -11.849 -4.312 -9.498 1.00 0.00 O ATOM 2920 CB SER A 182 -13.067 -4.010 -6.417 1.00 0.00 C ATOM 2921 OG SER A 182 -12.672 -5.371 -6.407 1.00 0.00 O ATOM 0 H SER A 182 -13.096 -1.535 -6.473 1.00 0.00 H new ATOM 0 HA SER A 182 -11.178 -3.431 -7.240 1.00 0.00 H new ATOM 0 HB2 SER A 182 -12.959 -3.589 -5.417 1.00 0.00 H new ATOM 0 HB3 SER A 182 -14.122 -3.936 -6.681 1.00 0.00 H new ATOM 0 HG SER A 182 -13.221 -5.866 -5.764 1.00 0.00 H new ATOM 2927 N GLY A 183 -13.727 -3.082 -9.320 1.00 0.00 N ATOM 2928 CA GLY A 183 -14.137 -3.377 -10.677 1.00 0.00 C ATOM 2929 C GLY A 183 -13.039 -3.044 -11.663 1.00 0.00 C ATOM 2930 O GLY A 183 -12.908 -3.683 -12.710 1.00 0.00 O ATOM 0 H GLY A 183 -14.363 -2.479 -8.798 1.00 0.00 H new ATOM 0 HA2 GLY A 183 -14.397 -4.432 -10.760 1.00 0.00 H new ATOM 0 HA3 GLY A 183 -15.034 -2.808 -10.921 1.00 0.00 H new ATOM 2934 N ARG A 184 -12.230 -2.051 -11.309 1.00 0.00 N ATOM 2935 CA ARG A 184 -11.120 -1.640 -12.149 1.00 0.00 C ATOM 2936 C ARG A 184 -9.979 -2.634 -12.024 1.00 0.00 C ATOM 2937 O ARG A 184 -9.430 -3.075 -13.022 1.00 0.00 O ATOM 2938 CB ARG A 184 -10.633 -0.248 -11.768 1.00 0.00 C ATOM 2939 CG ARG A 184 -11.376 0.874 -12.473 1.00 0.00 C ATOM 2940 CD ARG A 184 -10.774 2.231 -12.146 1.00 0.00 C ATOM 2941 NE ARG A 184 -11.341 3.295 -12.972 1.00 0.00 N ATOM 2942 CZ ARG A 184 -12.546 3.825 -12.774 1.00 0.00 C ATOM 2943 NH1 ARG A 184 -13.315 3.391 -11.782 1.00 0.00 N ATOM 2944 NH2 ARG A 184 -12.985 4.791 -13.570 1.00 0.00 N ATOM 0 H ARG A 184 -12.326 -1.518 -10.445 1.00 0.00 H new ATOM 0 HA ARG A 184 -11.467 -1.613 -13.182 1.00 0.00 H new ATOM 0 HB2 ARG A 184 -10.736 -0.119 -10.691 1.00 0.00 H new ATOM 0 HB3 ARG A 184 -9.571 -0.169 -11.998 1.00 0.00 H new ATOM 0 HG2 ARG A 184 -11.346 0.711 -13.550 1.00 0.00 H new ATOM 0 HG3 ARG A 184 -12.425 0.859 -12.178 1.00 0.00 H new ATOM 0 HD2 ARG A 184 -10.944 2.459 -11.094 1.00 0.00 H new ATOM 0 HD3 ARG A 184 -9.695 2.194 -12.293 1.00 0.00 H new ATOM 0 HE ARG A 184 -10.781 3.652 -13.746 1.00 0.00 H new ATOM 0 HH11 ARG A 184 -12.983 2.648 -11.167 1.00 0.00 H new ATOM 0 HH12 ARG A 184 -14.237 3.801 -11.635 1.00 0.00 H new ATOM 0 HH21 ARG A 184 -12.399 5.128 -14.334 1.00 0.00 H new ATOM 0 HH22 ARG A 184 -13.908 5.197 -13.418 1.00 0.00 H new ATOM 2958 N LEU A 185 -9.639 -2.998 -10.790 1.00 0.00 N ATOM 2959 CA LEU A 185 -8.572 -3.962 -10.548 1.00 0.00 C ATOM 2960 C LEU A 185 -8.735 -5.161 -11.470 1.00 0.00 C ATOM 2961 O LEU A 185 -7.766 -5.695 -12.004 1.00 0.00 O ATOM 2962 CB LEU A 185 -8.600 -4.425 -9.087 1.00 0.00 C ATOM 2963 CG LEU A 185 -7.389 -4.011 -8.251 1.00 0.00 C ATOM 2964 CD1 LEU A 185 -6.096 -4.409 -8.950 1.00 0.00 C ATOM 2965 CD2 LEU A 185 -7.423 -2.515 -7.984 1.00 0.00 C ATOM 0 H LEU A 185 -10.086 -2.641 -9.946 1.00 0.00 H new ATOM 0 HA LEU A 185 -7.614 -3.483 -10.750 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -9.500 -4.031 -8.615 1.00 0.00 H new ATOM 0 HB3 LEU A 185 -8.680 -5.512 -9.068 1.00 0.00 H new ATOM 0 HG LEU A 185 -7.429 -4.532 -7.294 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -5.245 -4.106 -8.340 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -6.076 -5.490 -9.090 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -6.041 -3.916 -9.921 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -6.556 -2.232 -7.388 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -7.404 -1.976 -8.931 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -8.334 -2.263 -7.441 1.00 0.00 H new ATOM 2977 N ARG A 186 -9.981 -5.568 -11.651 1.00 0.00 N ATOM 2978 CA ARG A 186 -10.306 -6.699 -12.505 1.00 0.00 C ATOM 2979 C ARG A 186 -10.376 -6.287 -13.974 1.00 0.00 C ATOM 2980 O ARG A 186 -10.201 -7.115 -14.865 1.00 0.00 O ATOM 2981 CB ARG A 186 -11.640 -7.311 -12.073 1.00 0.00 C ATOM 2982 CG ARG A 186 -11.562 -8.070 -10.758 1.00 0.00 C ATOM 2983 CD ARG A 186 -11.660 -7.132 -9.565 1.00 0.00 C ATOM 2984 NE ARG A 186 -11.473 -7.835 -8.299 1.00 0.00 N ATOM 2985 CZ ARG A 186 -10.285 -8.193 -7.817 1.00 0.00 C ATOM 2986 NH1 ARG A 186 -9.176 -7.915 -8.493 1.00 0.00 N ATOM 2987 NH2 ARG A 186 -10.204 -8.829 -6.657 1.00 0.00 N ATOM 0 H ARG A 186 -10.790 -5.127 -11.214 1.00 0.00 H new ATOM 0 HA ARG A 186 -9.513 -7.439 -12.400 1.00 0.00 H new ATOM 0 HB2 ARG A 186 -12.382 -6.518 -11.982 1.00 0.00 H new ATOM 0 HB3 ARG A 186 -11.990 -7.987 -12.853 1.00 0.00 H new ATOM 0 HG2 ARG A 186 -12.367 -8.804 -10.712 1.00 0.00 H new ATOM 0 HG3 ARG A 186 -10.624 -8.623 -10.711 1.00 0.00 H new ATOM 0 HD2 ARG A 186 -10.909 -6.347 -9.658 1.00 0.00 H new ATOM 0 HD3 ARG A 186 -12.634 -6.643 -9.568 1.00 0.00 H new ATOM 0 HE ARG A 186 -12.302 -8.065 -7.751 1.00 0.00 H new ATOM 0 HH11 ARG A 186 -9.232 -7.425 -9.386 1.00 0.00 H new ATOM 0 HH12 ARG A 186 -8.268 -8.191 -8.119 1.00 0.00 H new ATOM 0 HH21 ARG A 186 -11.052 -9.044 -6.133 1.00 0.00 H new ATOM 0 HH22 ARG A 186 -9.293 -9.103 -6.288 1.00 0.00 H new ATOM 3001 N ALA A 187 -10.652 -5.008 -14.224 1.00 0.00 N ATOM 3002 CA ALA A 187 -10.763 -4.507 -15.590 1.00 0.00 C ATOM 3003 C ALA A 187 -9.426 -4.021 -16.150 1.00 0.00 C ATOM 3004 O ALA A 187 -9.229 -4.006 -17.365 1.00 0.00 O ATOM 3005 CB ALA A 187 -11.795 -3.392 -15.654 1.00 0.00 C ATOM 0 H ALA A 187 -10.802 -4.304 -13.501 1.00 0.00 H new ATOM 0 HA ALA A 187 -11.084 -5.342 -16.213 1.00 0.00 H new ATOM 0 HB1 ALA A 187 -11.871 -3.025 -16.677 1.00 0.00 H new ATOM 0 HB2 ALA A 187 -12.764 -3.774 -15.333 1.00 0.00 H new ATOM 0 HB3 ALA A 187 -11.491 -2.577 -14.997 1.00 0.00 H new ATOM 3011 N ILE A 188 -8.510 -3.619 -15.273 1.00 0.00 N ATOM 3012 CA ILE A 188 -7.207 -3.133 -15.709 1.00 0.00 C ATOM 3013 C ILE A 188 -6.184 -4.260 -15.727 1.00 0.00 C ATOM 3014 O ILE A 188 -5.337 -4.332 -16.617 1.00 0.00 O ATOM 3015 CB ILE A 188 -6.687 -1.994 -14.803 1.00 0.00 C ATOM 3016 CG1 ILE A 188 -6.830 -2.370 -13.326 1.00 0.00 C ATOM 3017 CG2 ILE A 188 -7.428 -0.701 -15.090 1.00 0.00 C ATOM 3018 CD1 ILE A 188 -5.567 -2.155 -12.528 1.00 0.00 C ATOM 0 H ILE A 188 -8.646 -3.620 -14.262 1.00 0.00 H new ATOM 0 HA ILE A 188 -7.339 -2.744 -16.718 1.00 0.00 H new ATOM 0 HB ILE A 188 -5.630 -1.844 -15.021 1.00 0.00 H new ATOM 0 HG12 ILE A 188 -7.634 -1.781 -12.885 1.00 0.00 H new ATOM 0 HG13 ILE A 188 -7.124 -3.417 -13.252 1.00 0.00 H new ATOM 0 HG21 ILE A 188 -7.047 0.088 -14.442 1.00 0.00 H new ATOM 0 HG22 ILE A 188 -7.277 -0.419 -16.132 1.00 0.00 H new ATOM 0 HG23 ILE A 188 -8.492 -0.842 -14.902 1.00 0.00 H new ATOM 0 HD11 ILE A 188 -5.739 -2.441 -11.490 1.00 0.00 H new ATOM 0 HD12 ILE A 188 -4.765 -2.765 -12.945 1.00 0.00 H new ATOM 0 HD13 ILE A 188 -5.283 -1.103 -12.572 1.00 0.00 H new ATOM 3030 N LEU A 189 -6.268 -5.136 -14.733 1.00 0.00 N ATOM 3031 CA LEU A 189 -5.345 -6.257 -14.619 1.00 0.00 C ATOM 3032 C LEU A 189 -5.271 -7.061 -15.909 1.00 0.00 C ATOM 3033 O LEU A 189 -4.182 -7.364 -16.396 1.00 0.00 O ATOM 3034 CB LEU A 189 -5.762 -7.161 -13.459 1.00 0.00 C ATOM 3035 CG LEU A 189 -5.291 -6.702 -12.074 1.00 0.00 C ATOM 3036 CD1 LEU A 189 -4.085 -7.509 -11.629 1.00 0.00 C ATOM 3037 CD2 LEU A 189 -4.955 -5.219 -12.079 1.00 0.00 C ATOM 0 H LEU A 189 -6.968 -5.091 -13.993 1.00 0.00 H new ATOM 0 HA LEU A 189 -4.352 -5.852 -14.426 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -6.849 -7.235 -13.450 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -5.376 -8.163 -13.643 1.00 0.00 H new ATOM 0 HG LEU A 189 -6.105 -6.868 -11.369 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -3.764 -7.170 -10.644 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -4.352 -8.565 -11.580 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -3.272 -7.372 -12.343 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -4.623 -4.918 -11.085 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -4.160 -5.028 -12.800 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -5.840 -4.646 -12.355 1.00 0.00 H new ATOM 3049 N GLN A 190 -6.425 -7.409 -16.463 1.00 0.00 N ATOM 3050 CA GLN A 190 -6.458 -8.179 -17.695 1.00 0.00 C ATOM 3051 C GLN A 190 -7.221 -7.438 -18.787 1.00 0.00 C ATOM 3052 O GLN A 190 -7.849 -8.057 -19.646 1.00 0.00 O ATOM 3053 CB GLN A 190 -7.093 -9.550 -17.449 1.00 0.00 C ATOM 3054 CG GLN A 190 -6.372 -10.688 -18.154 1.00 0.00 C ATOM 3055 CD GLN A 190 -5.687 -11.634 -17.188 1.00 0.00 C ATOM 3056 OE1 GLN A 190 -6.168 -12.871 -17.129 1.00 0.00 O flip ATOM 3057 NE2 GLN A 190 -4.737 -11.260 -16.501 1.00 0.00 N flip ATOM 0 H GLN A 190 -7.341 -7.172 -16.082 1.00 0.00 H new ATOM 0 HA GLN A 190 -5.430 -8.318 -18.031 1.00 0.00 H new ATOM 0 HB2 GLN A 190 -7.107 -9.748 -16.377 1.00 0.00 H new ATOM 0 HB3 GLN A 190 -8.131 -9.526 -17.782 1.00 0.00 H new ATOM 0 HG2 GLN A 190 -7.087 -11.247 -18.758 1.00 0.00 H new ATOM 0 HG3 GLN A 190 -5.631 -10.275 -18.838 1.00 0.00 H new ATOM 0 HE21 GLN A 190 -4.399 -10.301 -16.577 1.00 0.00 H new ATOM 0 HE22 GLN A 190 -4.288 -11.909 -15.855 1.00 0.00 H new