USER MOD reduce.3.24.130724 H: found=0, std=0, add=855, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 858 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 131 THR OG1 : rot 54:sc= 1.8 USER MOD Set 1.2: A 142 SER OG : rot -58:sc= 0.989 USER MOD Set 2.1: A 120 SER OG : rot -72:sc= 1.5 USER MOD Set 2.2: A 122 GLN :FLIP amide:sc= -0.842 F(o=-4.5!,f=0.65) USER MOD Set 3.1: A 88 HIS : no HE2:sc= -10.3! C(o=-9.6!,f=-20!) USER MOD Set 3.2: A 105 SER OG : rot -120:sc= 1.33 USER MOD Set 3.3: A 109 THR OG1 : rot -110:sc= -0.589 USER MOD Set 4.1: A 67 THR OG1 : rot -136:sc= 1.14 USER MOD Set 4.2: A 74 CYS SG : rot -135:sc= 0.383 USER MOD Set 4.3: A 90 GLN : amide:sc= 0.888 K(o=2.4,f=-1.3!) USER MOD Set 5.1: A 38 CYS SG : rot 21:sc= -1.09 USER MOD Set 5.2: A 40 THR OG1 : rot -89:sc= 1.01 USER MOD Set 5.3: A 42 GLN :FLIP amide:sc= -8.4! C(o=-9.3!,f=-8.5!) USER MOD Single : A 31 ASN :FLIP amide:sc= -0.49 F(o=-1.3,f=-0.49) USER MOD Single : A 34 CYS SG : rot 180:sc= -6.13! USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -158:sc= 0.909 (180deg=0.412) USER MOD Single : A 71 ASN : amide:sc= -5.51! C(o=-5.5!,f=-6.2!) USER MOD Single : A 76 TYR OH : rot 130:sc= -1.17 USER MOD Single : A 77 HIS :FLIP no HE2:sc= -1.17 F(o=-3.5!,f=-1.2) USER MOD Single : A 80 ASN :FLIP amide:sc= -0.537! F(o=-1.1,f=-0.54!) USER MOD Single : A 82 SER OG : rot 180:sc= -0.533 USER MOD Single : A 85 SER OG : rot 75:sc= 0.17 USER MOD Single : A 86 ASN : amide:sc= -4.93! C(o=-4.9!,f=-5!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -4.33 K(o=-4.3,f=-15!) USER MOD Single : A 106 THR OG1 : rot 136:sc= 0.286 USER MOD Single : A 107 ASN : amide:sc= -0.0775 X(o=-0.077,f=-0.14) USER MOD Single : A 112 ASN : amide:sc= 0.031 X(o=0.031,f=0) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ -149:sc= -0.113! (180deg=-0.455!) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -4.11! C(o=-4.1!,f=-4.1!) USER MOD Single : A 121 ASN : amide:sc= -4.39! C(o=-4.4!,f=-5!) USER MOD Single : A 125 SER OG : rot 133:sc= 0.668 USER MOD Single : A 126 GLN : amide:sc= -0.595 X(o=-0.6,f=-0.4) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= -0.444 K(o=-0.44,f=-12!) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 457 N GLU A 30 -0.947 9.541 -19.505 1.00 0.00 N ATOM 458 CA GLU A 30 0.079 10.564 -19.328 1.00 0.00 C ATOM 459 C GLU A 30 0.483 10.711 -17.861 1.00 0.00 C ATOM 460 O GLU A 30 1.591 11.154 -17.559 1.00 0.00 O ATOM 461 CB GLU A 30 -0.414 11.909 -19.866 1.00 0.00 C ATOM 462 CG GLU A 30 -1.807 12.284 -19.387 1.00 0.00 C ATOM 463 CD GLU A 30 -2.870 12.043 -20.440 1.00 0.00 C ATOM 464 OE1 GLU A 30 -2.616 11.250 -21.371 1.00 0.00 O ATOM 465 OE2 GLU A 30 -3.958 12.648 -20.335 1.00 0.00 O ATOM 0 HA GLU A 30 0.958 10.247 -19.890 1.00 0.00 H new ATOM 0 HB2 GLU A 30 0.286 12.689 -19.566 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -0.410 11.878 -20.956 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -2.048 11.707 -18.494 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -1.818 13.335 -19.099 1.00 0.00 H new ATOM 472 N ASN A 31 -0.407 10.318 -16.954 1.00 0.00 N ATOM 473 CA ASN A 31 -0.124 10.389 -15.526 1.00 0.00 C ATOM 474 C ASN A 31 0.069 8.986 -14.991 1.00 0.00 C ATOM 475 O ASN A 31 0.566 8.774 -13.886 1.00 0.00 O ATOM 476 CB ASN A 31 -1.267 11.085 -14.789 1.00 0.00 C ATOM 477 CG ASN A 31 -1.704 12.365 -15.473 1.00 0.00 C ATOM 478 OD1 ASN A 31 -2.716 12.264 -16.327 1.00 0.00 O flip ATOM 479 ND2 ASN A 31 -1.138 13.433 -15.238 1.00 0.00 N flip ATOM 0 H ASN A 31 -1.329 9.948 -17.183 1.00 0.00 H new ATOM 0 HA ASN A 31 0.785 10.969 -15.365 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -2.117 10.406 -14.719 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -0.954 11.310 -13.769 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -0.364 13.465 -14.574 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -1.443 14.286 -15.707 1.00 0.00 H new ATOM 486 N ILE A 32 -0.348 8.039 -15.810 1.00 0.00 N ATOM 487 CA ILE A 32 -0.270 6.646 -15.504 1.00 0.00 C ATOM 488 C ILE A 32 1.176 6.148 -15.614 1.00 0.00 C ATOM 489 O ILE A 32 1.723 6.004 -16.707 1.00 0.00 O ATOM 490 CB ILE A 32 -1.235 5.908 -16.459 1.00 0.00 C ATOM 491 CG1 ILE A 32 -2.388 5.286 -15.669 1.00 0.00 C ATOM 492 CG2 ILE A 32 -0.530 4.898 -17.339 1.00 0.00 C ATOM 493 CD1 ILE A 32 -2.258 3.797 -15.420 1.00 0.00 C ATOM 0 H ILE A 32 -0.757 8.234 -16.724 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.571 6.449 -14.475 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.652 6.646 -17.144 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.468 5.795 -14.708 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -3.319 5.470 -16.206 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.257 4.411 -17.988 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.218 5.406 -17.948 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -0.042 4.149 -16.715 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.121 3.446 -14.854 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.212 3.271 -16.374 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.348 3.601 -14.853 1.00 0.00 H new ATOM 505 N VAL A 33 1.789 5.914 -14.457 1.00 0.00 N ATOM 506 CA VAL A 33 3.173 5.454 -14.371 1.00 0.00 C ATOM 507 C VAL A 33 3.490 4.411 -15.443 1.00 0.00 C ATOM 508 O VAL A 33 4.343 4.630 -16.304 1.00 0.00 O ATOM 509 CB VAL A 33 3.454 4.899 -12.944 1.00 0.00 C ATOM 510 CG1 VAL A 33 3.788 3.424 -12.921 1.00 0.00 C ATOM 511 CG2 VAL A 33 4.561 5.686 -12.259 1.00 0.00 C ATOM 0 H VAL A 33 1.339 6.038 -13.550 1.00 0.00 H new ATOM 0 HA VAL A 33 3.830 6.304 -14.555 1.00 0.00 H new ATOM 0 HB VAL A 33 2.520 5.022 -12.395 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.971 3.108 -11.894 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.954 2.856 -13.332 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.680 3.244 -13.521 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.736 5.277 -11.264 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.476 5.614 -12.847 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.265 6.732 -12.174 1.00 0.00 H new ATOM 521 N CYS A 34 2.803 3.280 -15.380 1.00 0.00 N ATOM 522 CA CYS A 34 3.020 2.204 -16.347 1.00 0.00 C ATOM 523 C CYS A 34 1.887 1.180 -16.309 1.00 0.00 C ATOM 524 O CYS A 34 1.101 1.147 -15.368 1.00 0.00 O ATOM 525 CB CYS A 34 4.358 1.513 -16.079 1.00 0.00 C ATOM 526 SG CYS A 34 4.434 0.636 -14.500 1.00 0.00 S ATOM 0 H CYS A 34 2.093 3.080 -14.675 1.00 0.00 H new ATOM 0 HA CYS A 34 3.038 2.650 -17.341 1.00 0.00 H new ATOM 0 HB2 CYS A 34 4.557 0.806 -16.885 1.00 0.00 H new ATOM 0 HB3 CYS A 34 5.152 2.259 -16.106 1.00 0.00 H new ATOM 0 HG CYS A 34 5.603 0.083 -14.366 1.00 0.00 H new ATOM 532 N ARG A 35 1.814 0.340 -17.336 1.00 0.00 N ATOM 533 CA ARG A 35 0.778 -0.685 -17.407 1.00 0.00 C ATOM 534 C ARG A 35 1.384 -2.066 -17.632 1.00 0.00 C ATOM 535 O ARG A 35 2.088 -2.293 -18.614 1.00 0.00 O ATOM 536 CB ARG A 35 -0.212 -0.364 -18.526 1.00 0.00 C ATOM 537 CG ARG A 35 -1.464 -1.222 -18.485 1.00 0.00 C ATOM 538 CD ARG A 35 -2.008 -1.479 -19.879 1.00 0.00 C ATOM 539 NE ARG A 35 -2.794 -0.351 -20.372 1.00 0.00 N ATOM 540 CZ ARG A 35 -3.334 -0.298 -21.586 1.00 0.00 C ATOM 541 NH1 ARG A 35 -3.179 -1.307 -22.435 1.00 0.00 N ATOM 542 NH2 ARG A 35 -4.034 0.767 -21.954 1.00 0.00 N ATOM 0 H ARG A 35 2.457 0.348 -18.128 1.00 0.00 H new ATOM 0 HA ARG A 35 0.251 -0.693 -16.453 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -0.497 0.686 -18.459 1.00 0.00 H new ATOM 0 HB3 ARG A 35 0.282 -0.500 -19.488 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -1.240 -2.172 -18.000 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -2.225 -0.728 -17.881 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -1.181 -1.671 -20.562 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -2.627 -2.376 -19.868 1.00 0.00 H new ATOM 0 HE ARG A 35 -2.937 0.443 -19.748 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -2.643 -2.129 -22.157 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -3.596 -1.260 -23.365 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -4.158 1.545 -21.306 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -4.448 0.808 -22.885 1.00 0.00 H new ATOM 556 N VAL A 36 1.096 -2.988 -16.719 1.00 0.00 N ATOM 557 CA VAL A 36 1.605 -4.351 -16.819 1.00 0.00 C ATOM 558 C VAL A 36 0.603 -5.246 -17.533 1.00 0.00 C ATOM 559 O VAL A 36 -0.559 -5.334 -17.133 1.00 0.00 O ATOM 560 CB VAL A 36 1.909 -4.947 -15.433 1.00 0.00 C ATOM 561 CG1 VAL A 36 2.645 -6.272 -15.573 1.00 0.00 C ATOM 562 CG2 VAL A 36 2.713 -3.969 -14.589 1.00 0.00 C ATOM 0 H VAL A 36 0.512 -2.816 -15.901 1.00 0.00 H new ATOM 0 HA VAL A 36 2.532 -4.304 -17.391 1.00 0.00 H new ATOM 0 HB VAL A 36 0.963 -5.132 -14.924 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.852 -6.679 -14.583 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.027 -6.974 -16.133 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.584 -6.112 -16.103 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.916 -4.412 -13.614 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.655 -3.746 -15.089 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.144 -3.048 -14.458 1.00 0.00 H new ATOM 572 N ILE A 37 1.051 -5.893 -18.600 1.00 0.00 N ATOM 573 CA ILE A 37 0.181 -6.764 -19.375 1.00 0.00 C ATOM 574 C ILE A 37 0.707 -8.193 -19.443 1.00 0.00 C ATOM 575 O ILE A 37 1.678 -8.474 -20.148 1.00 0.00 O ATOM 576 CB ILE A 37 0.035 -6.231 -20.814 1.00 0.00 C ATOM 577 CG1 ILE A 37 -0.340 -4.749 -20.792 1.00 0.00 C ATOM 578 CG2 ILE A 37 -0.995 -7.043 -21.588 1.00 0.00 C ATOM 579 CD1 ILE A 37 -0.477 -4.140 -22.170 1.00 0.00 C ATOM 0 H ILE A 37 2.008 -5.831 -18.947 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.784 -6.772 -18.868 1.00 0.00 H new ATOM 0 HB ILE A 37 0.993 -6.336 -21.323 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.281 -4.629 -20.255 1.00 0.00 H new ATOM 0 HG13 ILE A 37 0.418 -4.199 -20.234 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.082 -6.650 -22.601 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.680 -8.086 -21.629 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.961 -6.976 -21.088 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.744 -3.087 -22.078 1.00 0.00 H new ATOM 0 HD12 ILE A 37 0.470 -4.229 -22.703 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.255 -4.665 -22.724 1.00 0.00 H new ATOM 591 N CYS A 38 0.035 -9.100 -18.743 1.00 0.00 N ATOM 592 CA CYS A 38 0.412 -10.509 -18.766 1.00 0.00 C ATOM 593 C CYS A 38 -0.141 -11.156 -20.034 1.00 0.00 C ATOM 594 O CYS A 38 -1.341 -11.412 -20.137 1.00 0.00 O ATOM 595 CB CYS A 38 -0.126 -11.229 -17.528 1.00 0.00 C ATOM 596 SG CYS A 38 0.592 -12.866 -17.259 1.00 0.00 S ATOM 0 H CYS A 38 -0.770 -8.886 -18.155 1.00 0.00 H new ATOM 0 HA CYS A 38 1.499 -10.589 -18.760 1.00 0.00 H new ATOM 0 HB2 CYS A 38 0.064 -10.612 -16.650 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -1.208 -11.329 -17.620 1.00 0.00 H new ATOM 0 HG CYS A 38 1.724 -12.953 -17.892 1.00 0.00 H new ATOM 602 N THR A 39 0.732 -11.389 -21.012 1.00 0.00 N ATOM 603 CA THR A 39 0.315 -11.971 -22.286 1.00 0.00 C ATOM 604 C THR A 39 0.593 -13.468 -22.361 1.00 0.00 C ATOM 605 O THR A 39 0.690 -14.031 -23.452 1.00 0.00 O ATOM 606 CB THR A 39 1.013 -11.276 -23.472 1.00 0.00 C ATOM 607 OG1 THR A 39 2.327 -11.817 -23.654 1.00 0.00 O ATOM 608 CG2 THR A 39 1.107 -9.774 -23.246 1.00 0.00 C ATOM 0 H THR A 39 1.729 -11.185 -20.947 1.00 0.00 H new ATOM 0 HA THR A 39 -0.762 -11.815 -22.348 1.00 0.00 H new ATOM 0 HB THR A 39 0.417 -11.455 -24.367 1.00 0.00 H new ATOM 0 HG1 THR A 39 2.762 -11.371 -24.410 1.00 0.00 H new ATOM 0 HG21 THR A 39 1.603 -9.308 -24.097 1.00 0.00 H new ATOM 0 HG22 THR A 39 0.105 -9.359 -23.139 1.00 0.00 H new ATOM 0 HG23 THR A 39 1.680 -9.578 -22.340 1.00 0.00 H new ATOM 616 N THR A 40 0.719 -14.113 -21.209 1.00 0.00 N ATOM 617 CA THR A 40 0.981 -15.547 -21.173 1.00 0.00 C ATOM 618 C THR A 40 -0.190 -16.319 -20.568 1.00 0.00 C ATOM 619 O THR A 40 -0.255 -17.544 -20.676 1.00 0.00 O ATOM 620 CB THR A 40 2.257 -15.861 -20.377 1.00 0.00 C ATOM 621 OG1 THR A 40 2.168 -15.297 -19.064 1.00 0.00 O ATOM 622 CG2 THR A 40 3.485 -15.315 -21.092 1.00 0.00 C ATOM 0 H THR A 40 0.645 -13.671 -20.293 1.00 0.00 H new ATOM 0 HA THR A 40 1.116 -15.865 -22.207 1.00 0.00 H new ATOM 0 HB THR A 40 2.354 -16.944 -20.297 1.00 0.00 H new ATOM 0 HG1 THR A 40 2.515 -14.381 -19.077 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.378 -15.548 -20.512 1.00 0.00 H new ATOM 0 HG22 THR A 40 3.564 -15.771 -22.079 1.00 0.00 H new ATOM 0 HG23 THR A 40 3.393 -14.234 -21.198 1.00 0.00 H new ATOM 630 N GLY A 41 -1.113 -15.600 -19.935 1.00 0.00 N ATOM 631 CA GLY A 41 -2.264 -16.244 -19.329 1.00 0.00 C ATOM 632 C GLY A 41 -2.066 -16.522 -17.853 1.00 0.00 C ATOM 633 O GLY A 41 -1.830 -17.662 -17.455 1.00 0.00 O ATOM 0 H GLY A 41 -1.084 -14.586 -19.831 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.141 -15.611 -19.461 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -2.466 -17.181 -19.848 1.00 0.00 H new ATOM 637 N GLN A 42 -2.162 -15.476 -17.040 1.00 0.00 N ATOM 638 CA GLN A 42 -1.991 -15.611 -15.597 1.00 0.00 C ATOM 639 C GLN A 42 -2.799 -14.557 -14.851 1.00 0.00 C ATOM 640 O GLN A 42 -3.617 -14.883 -13.989 1.00 0.00 O ATOM 641 CB GLN A 42 -0.513 -15.485 -15.219 1.00 0.00 C ATOM 642 CG GLN A 42 0.438 -16.038 -16.267 1.00 0.00 C ATOM 643 CD GLN A 42 1.892 -15.882 -15.870 1.00 0.00 C ATOM 644 OE1 GLN A 42 2.223 -16.312 -14.657 1.00 0.00 O flip ATOM 645 NE2 GLN A 42 2.709 -15.385 -16.643 1.00 0.00 N flip ATOM 0 H GLN A 42 -2.357 -14.526 -17.355 1.00 0.00 H new ATOM 0 HA GLN A 42 -2.353 -16.598 -15.310 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -0.280 -14.434 -15.049 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -0.343 -16.006 -14.277 1.00 0.00 H new ATOM 0 HG2 GLN A 42 0.220 -17.094 -16.430 1.00 0.00 H new ATOM 0 HG3 GLN A 42 0.266 -15.527 -17.215 1.00 0.00 H new ATOM 0 HE21 GLN A 42 2.411 -15.068 -17.566 1.00 0.00 H new ATOM 0 HE22 GLN A 42 3.685 -15.290 -16.362 1.00 0.00 H new ATOM 654 N ILE A 43 -2.562 -13.293 -15.183 1.00 0.00 N ATOM 655 CA ILE A 43 -3.260 -12.191 -14.543 1.00 0.00 C ATOM 656 C ILE A 43 -3.738 -11.176 -15.579 1.00 0.00 C ATOM 657 O ILE A 43 -2.968 -10.748 -16.440 1.00 0.00 O ATOM 658 CB ILE A 43 -2.363 -11.465 -13.516 1.00 0.00 C ATOM 659 CG1 ILE A 43 -1.370 -12.438 -12.870 1.00 0.00 C ATOM 660 CG2 ILE A 43 -3.218 -10.791 -12.452 1.00 0.00 C ATOM 661 CD1 ILE A 43 -0.262 -11.747 -12.103 1.00 0.00 C ATOM 0 H ILE A 43 -1.889 -13.008 -15.895 1.00 0.00 H new ATOM 0 HA ILE A 43 -4.116 -12.622 -14.023 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.792 -10.700 -14.042 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.910 -13.101 -12.194 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.929 -13.064 -13.646 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -2.573 -10.283 -11.735 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.879 -10.064 -12.923 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -3.815 -11.542 -11.935 1.00 0.00 H new ATOM 0 HD11 ILE A 43 0.404 -12.495 -11.672 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.303 -11.105 -12.779 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -0.694 -11.143 -11.305 1.00 0.00 H new ATOM 673 N PRO A 44 -5.015 -10.769 -15.510 1.00 0.00 N ATOM 674 CA PRO A 44 -5.584 -9.795 -16.445 1.00 0.00 C ATOM 675 C PRO A 44 -4.830 -8.471 -16.407 1.00 0.00 C ATOM 676 O PRO A 44 -4.315 -8.070 -15.362 1.00 0.00 O ATOM 677 CB PRO A 44 -7.020 -9.599 -15.947 1.00 0.00 C ATOM 678 CG PRO A 44 -7.312 -10.795 -15.108 1.00 0.00 C ATOM 679 CD PRO A 44 -6.000 -11.229 -14.520 1.00 0.00 C ATOM 0 HA PRO A 44 -5.528 -10.142 -17.477 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -7.114 -8.680 -15.368 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -7.718 -9.523 -16.780 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -8.029 -10.554 -14.323 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -7.752 -11.592 -15.707 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.829 -10.778 -13.543 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -5.958 -12.310 -14.384 1.00 0.00 H new ATOM 687 N ILE A 45 -4.756 -7.802 -17.555 1.00 0.00 N ATOM 688 CA ILE A 45 -4.052 -6.527 -17.664 1.00 0.00 C ATOM 689 C ILE A 45 -4.334 -5.613 -16.475 1.00 0.00 C ATOM 690 O ILE A 45 -5.488 -5.366 -16.124 1.00 0.00 O ATOM 691 CB ILE A 45 -4.419 -5.786 -18.965 1.00 0.00 C ATOM 692 CG1 ILE A 45 -4.007 -6.619 -20.176 1.00 0.00 C ATOM 693 CG2 ILE A 45 -3.752 -4.416 -19.013 1.00 0.00 C ATOM 694 CD1 ILE A 45 -4.760 -6.267 -21.440 1.00 0.00 C ATOM 0 H ILE A 45 -5.177 -8.124 -18.427 1.00 0.00 H new ATOM 0 HA ILE A 45 -2.989 -6.770 -17.676 1.00 0.00 H new ATOM 0 HB ILE A 45 -5.499 -5.640 -18.987 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.939 -6.487 -20.351 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -4.165 -7.674 -19.951 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.025 -3.911 -19.940 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -4.084 -3.820 -18.163 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.670 -4.537 -18.971 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -4.414 -6.899 -22.258 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -5.827 -6.427 -21.284 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.582 -5.221 -21.690 1.00 0.00 H new ATOM 706 N ARG A 46 -3.265 -5.106 -15.874 1.00 0.00 N ATOM 707 CA ARG A 46 -3.374 -4.206 -14.736 1.00 0.00 C ATOM 708 C ARG A 46 -2.650 -2.899 -15.036 1.00 0.00 C ATOM 709 O ARG A 46 -1.504 -2.906 -15.483 1.00 0.00 O ATOM 710 CB ARG A 46 -2.785 -4.862 -13.486 1.00 0.00 C ATOM 711 CG ARG A 46 -3.520 -4.512 -12.204 1.00 0.00 C ATOM 712 CD ARG A 46 -5.007 -4.815 -12.308 1.00 0.00 C ATOM 713 NE ARG A 46 -5.611 -5.049 -10.998 1.00 0.00 N ATOM 714 CZ ARG A 46 -5.793 -4.097 -10.085 1.00 0.00 C ATOM 715 NH1 ARG A 46 -5.420 -2.848 -10.334 1.00 0.00 N ATOM 716 NH2 ARG A 46 -6.351 -4.395 -8.919 1.00 0.00 N ATOM 0 H ARG A 46 -2.306 -5.306 -16.160 1.00 0.00 H new ATOM 0 HA ARG A 46 -4.427 -3.992 -14.554 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -2.796 -5.944 -13.616 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -1.741 -4.563 -13.388 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -3.091 -5.073 -11.374 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -3.379 -3.455 -11.980 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -5.513 -3.983 -12.797 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -5.155 -5.692 -12.937 1.00 0.00 H new ATOM 0 HE ARG A 46 -5.911 -5.997 -10.770 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -4.991 -2.613 -11.229 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -5.562 -2.123 -9.630 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -6.640 -5.353 -8.722 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -6.491 -3.666 -8.219 1.00 0.00 H new ATOM 730 N ASP A 47 -3.327 -1.779 -14.807 1.00 0.00 N ATOM 731 CA ASP A 47 -2.737 -0.474 -15.077 1.00 0.00 C ATOM 732 C ASP A 47 -2.104 0.127 -13.827 1.00 0.00 C ATOM 733 O ASP A 47 -2.779 0.372 -12.828 1.00 0.00 O ATOM 734 CB ASP A 47 -3.791 0.486 -15.634 1.00 0.00 C ATOM 735 CG ASP A 47 -4.642 -0.151 -16.716 1.00 0.00 C ATOM 736 OD1 ASP A 47 -4.275 -1.245 -17.195 1.00 0.00 O ATOM 737 OD2 ASP A 47 -5.676 0.445 -17.084 1.00 0.00 O ATOM 0 H ASP A 47 -4.277 -1.748 -14.438 1.00 0.00 H new ATOM 0 HA ASP A 47 -1.952 -0.620 -15.819 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.435 0.825 -14.822 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -3.296 1.369 -16.038 1.00 0.00 H new ATOM 742 N LEU A 48 -0.804 0.383 -13.909 1.00 0.00 N ATOM 743 CA LEU A 48 -0.062 0.981 -12.807 1.00 0.00 C ATOM 744 C LEU A 48 0.003 2.487 -13.001 1.00 0.00 C ATOM 745 O LEU A 48 0.400 2.961 -14.064 1.00 0.00 O ATOM 746 CB LEU A 48 1.352 0.401 -12.739 1.00 0.00 C ATOM 747 CG LEU A 48 1.481 -1.066 -13.155 1.00 0.00 C ATOM 748 CD1 LEU A 48 2.846 -1.606 -12.761 1.00 0.00 C ATOM 749 CD2 LEU A 48 0.369 -1.905 -12.534 1.00 0.00 C ATOM 0 H LEU A 48 -0.239 0.184 -14.734 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.573 0.756 -11.871 1.00 0.00 H new ATOM 0 HB2 LEU A 48 2.003 1.000 -13.376 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.720 0.505 -11.718 1.00 0.00 H new ATOM 0 HG LEU A 48 1.383 -1.128 -14.239 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.925 -2.650 -13.063 1.00 0.00 H new ATOM 0 HD12 LEU A 48 3.624 -1.025 -13.257 1.00 0.00 H new ATOM 0 HD13 LEU A 48 2.969 -1.530 -11.681 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.481 -2.944 -12.844 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.429 -1.842 -11.447 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.599 -1.530 -12.866 1.00 0.00 H new ATOM 761 N SER A 49 -0.404 3.248 -11.994 1.00 0.00 N ATOM 762 CA SER A 49 -0.393 4.702 -12.127 1.00 0.00 C ATOM 763 C SER A 49 0.496 5.388 -11.107 1.00 0.00 C ATOM 764 O SER A 49 0.861 4.828 -10.080 1.00 0.00 O ATOM 765 CB SER A 49 -1.802 5.276 -12.026 1.00 0.00 C ATOM 766 OG SER A 49 -2.776 4.254 -11.898 1.00 0.00 O ATOM 0 H SER A 49 -0.738 2.896 -11.097 1.00 0.00 H new ATOM 0 HA SER A 49 0.019 4.901 -13.116 1.00 0.00 H new ATOM 0 HB2 SER A 49 -1.862 5.945 -11.168 1.00 0.00 H new ATOM 0 HB3 SER A 49 -2.016 5.874 -12.912 1.00 0.00 H new ATOM 0 HG SER A 49 -3.667 4.657 -11.834 1.00 0.00 H new ATOM 772 N ALA A 50 0.825 6.629 -11.415 1.00 0.00 N ATOM 773 CA ALA A 50 1.665 7.444 -10.549 1.00 0.00 C ATOM 774 C ALA A 50 0.900 8.657 -10.029 1.00 0.00 C ATOM 775 O ALA A 50 -0.171 8.990 -10.537 1.00 0.00 O ATOM 776 CB ALA A 50 2.912 7.883 -11.297 1.00 0.00 C ATOM 0 H ALA A 50 0.521 7.101 -12.267 1.00 0.00 H new ATOM 0 HA ALA A 50 1.961 6.841 -9.691 1.00 0.00 H new ATOM 0 HB1 ALA A 50 3.534 8.492 -10.641 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.473 7.005 -11.616 1.00 0.00 H new ATOM 0 HB3 ALA A 50 2.625 8.468 -12.171 1.00 0.00 H new ATOM 782 N ASP A 51 1.456 9.315 -9.017 1.00 0.00 N ATOM 783 CA ASP A 51 0.822 10.493 -8.433 1.00 0.00 C ATOM 784 C ASP A 51 1.525 11.769 -8.891 1.00 0.00 C ATOM 785 O ASP A 51 2.008 12.556 -8.077 1.00 0.00 O ATOM 786 CB ASP A 51 0.820 10.413 -6.899 1.00 0.00 C ATOM 787 CG ASP A 51 1.307 9.075 -6.371 1.00 0.00 C ATOM 788 OD1 ASP A 51 2.455 8.694 -6.686 1.00 0.00 O ATOM 789 OD2 ASP A 51 0.541 8.410 -5.643 1.00 0.00 O ATOM 0 H ASP A 51 2.342 9.054 -8.585 1.00 0.00 H new ATOM 0 HA ASP A 51 -0.211 10.520 -8.778 1.00 0.00 H new ATOM 0 HB2 ASP A 51 1.452 11.206 -6.499 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -0.190 10.595 -6.533 1.00 0.00 H new ATOM 794 N ILE A 52 1.574 11.968 -10.202 1.00 0.00 N ATOM 795 CA ILE A 52 2.212 13.146 -10.773 1.00 0.00 C ATOM 796 C ILE A 52 1.537 14.423 -10.281 1.00 0.00 C ATOM 797 O ILE A 52 2.203 15.399 -9.934 1.00 0.00 O ATOM 798 CB ILE A 52 2.168 13.106 -12.316 1.00 0.00 C ATOM 799 CG1 ILE A 52 3.095 12.007 -12.843 1.00 0.00 C ATOM 800 CG2 ILE A 52 2.552 14.457 -12.905 1.00 0.00 C ATOM 801 CD1 ILE A 52 3.135 11.922 -14.354 1.00 0.00 C ATOM 0 H ILE A 52 1.179 11.327 -10.890 1.00 0.00 H new ATOM 0 HA ILE A 52 3.252 13.144 -10.447 1.00 0.00 H new ATOM 0 HB ILE A 52 1.147 12.881 -12.625 1.00 0.00 H new ATOM 0 HG12 ILE A 52 4.104 12.184 -12.470 1.00 0.00 H new ATOM 0 HG13 ILE A 52 2.771 11.047 -12.442 1.00 0.00 H new ATOM 0 HG21 ILE A 52 2.514 14.404 -13.993 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.855 15.218 -12.554 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.562 14.717 -12.590 1.00 0.00 H new ATOM 0 HD11 ILE A 52 3.811 11.122 -14.656 1.00 0.00 H new ATOM 0 HD12 ILE A 52 2.135 11.714 -14.733 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.488 12.869 -14.762 1.00 0.00 H new ATOM 989 N LYS A 63 6.521 7.943 -4.830 1.00 0.00 N ATOM 990 CA LYS A 63 6.955 6.615 -4.410 1.00 0.00 C ATOM 991 C LYS A 63 5.773 5.653 -4.312 1.00 0.00 C ATOM 992 O LYS A 63 5.044 5.648 -3.320 1.00 0.00 O ATOM 993 CB LYS A 63 7.674 6.694 -3.063 1.00 0.00 C ATOM 994 CG LYS A 63 8.575 5.501 -2.786 1.00 0.00 C ATOM 995 CD LYS A 63 8.976 5.435 -1.320 1.00 0.00 C ATOM 996 CE LYS A 63 9.749 6.673 -0.897 1.00 0.00 C ATOM 997 NZ LYS A 63 10.919 6.330 -0.042 1.00 0.00 N ATOM 0 HA LYS A 63 7.644 6.234 -5.164 1.00 0.00 H new ATOM 0 HB2 LYS A 63 8.271 7.605 -3.032 1.00 0.00 H new ATOM 0 HB3 LYS A 63 6.932 6.771 -2.268 1.00 0.00 H new ATOM 0 HG2 LYS A 63 8.060 4.582 -3.065 1.00 0.00 H new ATOM 0 HG3 LYS A 63 9.469 5.567 -3.406 1.00 0.00 H new ATOM 0 HD2 LYS A 63 8.084 5.333 -0.702 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.586 4.548 -1.148 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.091 7.208 -1.783 1.00 0.00 H new ATOM 0 HE3 LYS A 63 9.087 7.347 -0.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 11.420 7.201 0.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 10.591 5.842 0.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.564 5.708 -0.570 1.00 0.00 H new ATOM 1011 N LYS A 64 5.601 4.834 -5.342 1.00 0.00 N ATOM 1012 CA LYS A 64 4.519 3.856 -5.377 1.00 0.00 C ATOM 1013 C LYS A 64 5.034 2.521 -5.899 1.00 0.00 C ATOM 1014 O LYS A 64 5.764 2.474 -6.889 1.00 0.00 O ATOM 1015 CB LYS A 64 3.373 4.358 -6.256 1.00 0.00 C ATOM 1016 CG LYS A 64 2.019 3.774 -5.880 1.00 0.00 C ATOM 1017 CD LYS A 64 0.924 4.831 -5.877 1.00 0.00 C ATOM 1018 CE LYS A 64 0.991 5.711 -7.113 1.00 0.00 C ATOM 1019 NZ LYS A 64 -0.301 6.402 -7.378 1.00 0.00 N ATOM 0 H LYS A 64 6.199 4.827 -6.168 1.00 0.00 H new ATOM 0 HA LYS A 64 4.144 3.717 -4.363 1.00 0.00 H new ATOM 0 HB2 LYS A 64 3.323 5.445 -6.188 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.589 4.113 -7.296 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.757 2.983 -6.583 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.083 3.315 -4.893 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.051 4.345 -5.828 1.00 0.00 H new ATOM 0 HD3 LYS A 64 1.017 5.449 -4.984 1.00 0.00 H new ATOM 0 HE2 LYS A 64 1.780 6.453 -6.987 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.260 5.103 -7.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -0.348 6.677 -8.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -1.089 5.760 -7.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.369 7.251 -6.782 1.00 0.00 H new ATOM 1033 N VAL A 65 4.670 1.436 -5.222 1.00 0.00 N ATOM 1034 CA VAL A 65 5.123 0.112 -5.619 1.00 0.00 C ATOM 1035 C VAL A 65 3.958 -0.836 -5.880 1.00 0.00 C ATOM 1036 O VAL A 65 3.013 -0.916 -5.096 1.00 0.00 O ATOM 1037 CB VAL A 65 6.012 -0.511 -4.535 1.00 0.00 C ATOM 1038 CG1 VAL A 65 6.816 -1.674 -5.091 1.00 0.00 C ATOM 1039 CG2 VAL A 65 6.928 0.534 -3.913 1.00 0.00 C ATOM 0 H VAL A 65 4.066 1.449 -4.400 1.00 0.00 H new ATOM 0 HA VAL A 65 5.689 0.246 -6.541 1.00 0.00 H new ATOM 0 HB VAL A 65 5.361 -0.897 -3.751 1.00 0.00 H new ATOM 0 HG11 VAL A 65 7.437 -2.097 -4.302 1.00 0.00 H new ATOM 0 HG12 VAL A 65 6.137 -2.439 -5.467 1.00 0.00 H new ATOM 0 HG13 VAL A 65 7.452 -1.322 -5.903 1.00 0.00 H new ATOM 0 HG21 VAL A 65 7.547 0.066 -3.148 1.00 0.00 H new ATOM 0 HG22 VAL A 65 7.567 0.963 -4.685 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.326 1.322 -3.461 1.00 0.00 H new ATOM 1049 N TRP A 66 4.049 -1.565 -6.984 1.00 0.00 N ATOM 1050 CA TRP A 66 3.016 -2.533 -7.360 1.00 0.00 C ATOM 1051 C TRP A 66 3.427 -3.957 -7.017 1.00 0.00 C ATOM 1052 O TRP A 66 4.569 -4.342 -7.220 1.00 0.00 O ATOM 1053 CB TRP A 66 2.692 -2.440 -8.844 1.00 0.00 C ATOM 1054 CG TRP A 66 1.864 -1.248 -9.157 1.00 0.00 C ATOM 1055 CD1 TRP A 66 0.528 -1.156 -9.440 1.00 0.00 C ATOM 1056 CD2 TRP A 66 2.370 0.054 -9.186 1.00 0.00 C ATOM 1057 NE1 TRP A 66 0.191 0.163 -9.637 1.00 0.00 N ATOM 1058 CE2 TRP A 66 1.320 0.925 -9.484 1.00 0.00 C ATOM 1059 CE3 TRP A 66 3.633 0.546 -8.979 1.00 0.00 C ATOM 1060 CZ2 TRP A 66 1.512 2.295 -9.578 1.00 0.00 C ATOM 1061 CZ3 TRP A 66 3.841 1.893 -9.069 1.00 0.00 C ATOM 1062 CH2 TRP A 66 2.784 2.768 -9.366 1.00 0.00 C ATOM 0 H TRP A 66 4.828 -1.507 -7.640 1.00 0.00 H new ATOM 0 HA TRP A 66 2.125 -2.283 -6.784 1.00 0.00 H new ATOM 0 HB2 TRP A 66 3.619 -2.398 -9.416 1.00 0.00 H new ATOM 0 HB3 TRP A 66 2.164 -3.341 -9.157 1.00 0.00 H new ATOM 0 HD1 TRP A 66 -0.156 -1.990 -9.499 1.00 0.00 H new ATOM 0 HE1 TRP A 66 -0.741 0.514 -9.859 1.00 0.00 H new ATOM 0 HE3 TRP A 66 4.451 -0.121 -8.748 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 0.695 2.963 -9.808 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 4.832 2.290 -8.909 1.00 0.00 H new ATOM 0 HH2 TRP A 66 2.974 3.829 -9.429 1.00 0.00 H new ATOM 1073 N THR A 67 2.487 -4.743 -6.505 1.00 0.00 N ATOM 1074 CA THR A 67 2.778 -6.127 -6.155 1.00 0.00 C ATOM 1075 C THR A 67 1.735 -7.091 -6.697 1.00 0.00 C ATOM 1076 O THR A 67 0.542 -6.944 -6.451 1.00 0.00 O ATOM 1077 CB THR A 67 2.858 -6.339 -4.643 1.00 0.00 C ATOM 1078 OG1 THR A 67 3.404 -5.184 -3.997 1.00 0.00 O ATOM 1079 CG2 THR A 67 3.698 -7.555 -4.334 1.00 0.00 C ATOM 0 H THR A 67 1.527 -4.449 -6.325 1.00 0.00 H new ATOM 0 HA THR A 67 3.747 -6.333 -6.611 1.00 0.00 H new ATOM 0 HB THR A 67 1.849 -6.499 -4.263 1.00 0.00 H new ATOM 0 HG1 THR A 67 4.064 -5.464 -3.329 1.00 0.00 H new ATOM 0 HG21 THR A 67 3.749 -7.697 -3.255 1.00 0.00 H new ATOM 0 HG22 THR A 67 3.249 -8.434 -4.795 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.704 -7.412 -4.729 1.00 0.00 H new ATOM 1087 N PHE A 68 2.206 -8.106 -7.397 1.00 0.00 N ATOM 1088 CA PHE A 68 1.331 -9.129 -7.940 1.00 0.00 C ATOM 1089 C PHE A 68 1.334 -10.336 -7.020 1.00 0.00 C ATOM 1090 O PHE A 68 2.374 -10.969 -6.836 1.00 0.00 O ATOM 1091 CB PHE A 68 1.825 -9.600 -9.309 1.00 0.00 C ATOM 1092 CG PHE A 68 1.754 -8.577 -10.403 1.00 0.00 C ATOM 1093 CD1 PHE A 68 2.825 -7.738 -10.645 1.00 0.00 C ATOM 1094 CD2 PHE A 68 0.633 -8.476 -11.211 1.00 0.00 C ATOM 1095 CE1 PHE A 68 2.781 -6.813 -11.666 1.00 0.00 C ATOM 1096 CE2 PHE A 68 0.584 -7.556 -12.241 1.00 0.00 C ATOM 1097 CZ PHE A 68 1.663 -6.722 -12.468 1.00 0.00 C ATOM 0 H PHE A 68 3.195 -8.245 -7.604 1.00 0.00 H new ATOM 0 HA PHE A 68 0.333 -8.700 -8.032 1.00 0.00 H new ATOM 0 HB2 PHE A 68 2.859 -9.930 -9.210 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.240 -10.469 -9.609 1.00 0.00 H new ATOM 0 HD1 PHE A 68 3.708 -7.808 -10.026 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -0.213 -9.124 -11.034 1.00 0.00 H new ATOM 0 HE1 PHE A 68 3.623 -6.159 -11.838 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.294 -7.489 -12.866 1.00 0.00 H new ATOM 0 HZ PHE A 68 1.630 -6.001 -13.271 1.00 0.00 H new ATOM 1107 N GLY A 69 0.187 -10.675 -6.456 1.00 0.00 N ATOM 1108 CA GLY A 69 0.147 -11.831 -5.589 1.00 0.00 C ATOM 1109 C GLY A 69 -1.025 -11.810 -4.649 1.00 0.00 C ATOM 1110 O GLY A 69 -2.020 -11.132 -4.911 1.00 0.00 O ATOM 0 H GLY A 69 -0.698 -10.184 -6.578 1.00 0.00 H new ATOM 0 HA2 GLY A 69 0.104 -12.735 -6.197 1.00 0.00 H new ATOM 0 HA3 GLY A 69 1.070 -11.879 -5.011 1.00 0.00 H new ATOM 1114 N ARG A 70 -0.926 -12.541 -3.546 1.00 0.00 N ATOM 1115 CA ARG A 70 -2.016 -12.560 -2.604 1.00 0.00 C ATOM 1116 C ARG A 70 -1.993 -11.266 -1.826 1.00 0.00 C ATOM 1117 O ARG A 70 -1.340 -11.125 -0.792 1.00 0.00 O ATOM 1118 CB ARG A 70 -1.898 -13.759 -1.659 1.00 0.00 C ATOM 1119 CG ARG A 70 -0.620 -13.771 -0.838 1.00 0.00 C ATOM 1120 CD ARG A 70 -0.307 -15.166 -0.320 1.00 0.00 C ATOM 1121 NE ARG A 70 -0.979 -15.444 0.946 1.00 0.00 N ATOM 1122 CZ ARG A 70 -1.182 -16.669 1.425 1.00 0.00 C ATOM 1123 NH1 ARG A 70 -0.761 -17.732 0.750 1.00 0.00 N ATOM 1124 NH2 ARG A 70 -1.806 -16.832 2.583 1.00 0.00 N ATOM 0 H ARG A 70 -0.120 -13.112 -3.293 1.00 0.00 H new ATOM 0 HA ARG A 70 -2.962 -12.657 -3.137 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -2.753 -13.762 -0.983 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -1.951 -14.677 -2.244 1.00 0.00 H new ATOM 0 HG2 ARG A 70 0.209 -13.413 -1.448 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -0.719 -13.083 0.002 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -0.611 -15.905 -1.062 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.770 -15.271 -0.189 1.00 0.00 H new ATOM 0 HE ARG A 70 -1.313 -14.652 1.496 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -0.279 -17.612 -0.141 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -0.920 -18.668 1.122 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -2.130 -16.019 3.106 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -1.962 -17.771 2.951 1.00 0.00 H new ATOM 1138 N ASN A 71 -2.738 -10.336 -2.367 1.00 0.00 N ATOM 1139 CA ASN A 71 -2.897 -9.006 -1.816 1.00 0.00 C ATOM 1140 C ASN A 71 -4.278 -8.502 -2.183 1.00 0.00 C ATOM 1141 O ASN A 71 -4.874 -8.997 -3.134 1.00 0.00 O ATOM 1142 CB ASN A 71 -1.816 -8.058 -2.346 1.00 0.00 C ATOM 1143 CG ASN A 71 -1.198 -8.540 -3.646 1.00 0.00 C ATOM 1144 OD1 ASN A 71 -1.679 -8.220 -4.733 1.00 0.00 O ATOM 1145 ND2 ASN A 71 -0.124 -9.313 -3.539 1.00 0.00 N ATOM 0 H ASN A 71 -3.267 -10.483 -3.227 1.00 0.00 H new ATOM 0 HA ASN A 71 -2.789 -9.043 -0.732 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -2.249 -7.070 -2.499 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -1.034 -7.950 -1.595 1.00 0.00 H new ATOM 0 HD21 ASN A 71 0.336 -9.666 -4.378 1.00 0.00 H new ATOM 0 HD22 ASN A 71 0.241 -9.554 -2.618 1.00 0.00 H new ATOM 1152 N PRO A 72 -4.809 -7.499 -1.483 1.00 0.00 N ATOM 1153 CA PRO A 72 -6.120 -6.962 -1.823 1.00 0.00 C ATOM 1154 C PRO A 72 -6.115 -6.354 -3.208 1.00 0.00 C ATOM 1155 O PRO A 72 -7.167 -6.054 -3.770 1.00 0.00 O ATOM 1156 CB PRO A 72 -6.385 -5.910 -0.747 1.00 0.00 C ATOM 1157 CG PRO A 72 -5.038 -5.560 -0.206 1.00 0.00 C ATOM 1158 CD PRO A 72 -4.181 -6.789 -0.363 1.00 0.00 C ATOM 0 HA PRO A 72 -6.895 -7.728 -1.846 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -6.882 -5.034 -1.165 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.035 -6.301 0.036 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -4.610 -4.717 -0.748 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -5.105 -5.265 0.841 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -3.145 -6.531 -0.581 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.175 -7.394 0.544 1.00 0.00 H new ATOM 1166 N ALA A 73 -4.910 -6.211 -3.748 1.00 0.00 N ATOM 1167 CA ALA A 73 -4.677 -5.678 -5.079 1.00 0.00 C ATOM 1168 C ALA A 73 -3.514 -4.745 -5.050 1.00 0.00 C ATOM 1169 O ALA A 73 -3.598 -3.606 -5.511 1.00 0.00 O ATOM 1170 CB ALA A 73 -5.866 -4.968 -5.670 1.00 0.00 C ATOM 0 H ALA A 73 -4.052 -6.469 -3.260 1.00 0.00 H new ATOM 0 HA ALA A 73 -4.477 -6.538 -5.719 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -5.612 -4.599 -6.664 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.704 -5.661 -5.743 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -6.143 -4.129 -5.032 1.00 0.00 H new ATOM 1176 N CYS A 74 -2.418 -5.231 -4.513 1.00 0.00 N ATOM 1177 CA CYS A 74 -1.230 -4.405 -4.452 1.00 0.00 C ATOM 1178 C CYS A 74 -0.990 -3.919 -5.860 1.00 0.00 C ATOM 1179 O CYS A 74 -1.331 -2.788 -6.207 1.00 0.00 O ATOM 1180 CB CYS A 74 -0.084 -5.284 -4.017 1.00 0.00 C ATOM 1181 SG CYS A 74 0.839 -4.680 -2.584 1.00 0.00 S ATOM 0 H CYS A 74 -2.322 -6.168 -4.121 1.00 0.00 H new ATOM 0 HA CYS A 74 -1.329 -3.568 -3.760 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -0.473 -6.276 -3.788 1.00 0.00 H new ATOM 0 HB3 CYS A 74 0.606 -5.397 -4.853 1.00 0.00 H new ATOM 0 HG CYS A 74 2.114 -4.787 -2.813 1.00 0.00 H new ATOM 1187 N ASP A 75 -0.595 -4.847 -6.712 1.00 0.00 N ATOM 1188 CA ASP A 75 -0.543 -4.570 -8.120 1.00 0.00 C ATOM 1189 C ASP A 75 -1.869 -5.048 -8.683 1.00 0.00 C ATOM 1190 O ASP A 75 -2.554 -4.363 -9.441 1.00 0.00 O ATOM 1191 CB ASP A 75 0.609 -5.297 -8.815 1.00 0.00 C ATOM 1192 CG ASP A 75 0.625 -5.034 -10.308 1.00 0.00 C ATOM 1193 OD1 ASP A 75 -0.388 -5.334 -10.974 1.00 0.00 O ATOM 1194 OD2 ASP A 75 1.648 -4.527 -10.814 1.00 0.00 O ATOM 0 H ASP A 75 -0.309 -5.790 -6.448 1.00 0.00 H new ATOM 0 HA ASP A 75 -0.374 -3.506 -8.288 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.556 -4.977 -8.380 1.00 0.00 H new ATOM 0 HB3 ASP A 75 0.522 -6.369 -8.636 1.00 0.00 H new ATOM 1199 N TYR A 76 -2.193 -6.280 -8.254 1.00 0.00 N ATOM 1200 CA TYR A 76 -3.411 -6.988 -8.631 1.00 0.00 C ATOM 1201 C TYR A 76 -3.949 -7.805 -7.454 1.00 0.00 C ATOM 1202 O TYR A 76 -3.165 -8.391 -6.709 1.00 0.00 O ATOM 1203 CB TYR A 76 -3.130 -7.908 -9.818 1.00 0.00 C ATOM 1204 CG TYR A 76 -4.380 -8.452 -10.460 1.00 0.00 C ATOM 1205 CD1 TYR A 76 -5.161 -9.398 -9.810 1.00 0.00 C ATOM 1206 CD2 TYR A 76 -4.786 -8.013 -11.714 1.00 0.00 C ATOM 1207 CE1 TYR A 76 -6.311 -9.895 -10.392 1.00 0.00 C ATOM 1208 CE2 TYR A 76 -5.937 -8.504 -12.302 1.00 0.00 C ATOM 1209 CZ TYR A 76 -6.696 -9.444 -11.637 1.00 0.00 C ATOM 1210 OH TYR A 76 -7.841 -9.934 -12.217 1.00 0.00 O ATOM 0 H TYR A 76 -1.597 -6.816 -7.622 1.00 0.00 H new ATOM 0 HA TYR A 76 -4.165 -6.253 -8.914 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.555 -7.360 -10.565 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -2.509 -8.740 -9.485 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -4.865 -9.751 -8.833 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -4.194 -7.277 -12.237 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -6.906 -10.633 -9.874 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -6.240 -8.153 -13.277 1.00 0.00 H new ATOM 0 HH TYR A 76 -8.397 -9.188 -12.525 1.00 0.00 H new ATOM 1220 N HIS A 77 -5.267 -7.889 -7.292 1.00 0.00 N ATOM 1221 CA HIS A 77 -5.826 -8.692 -6.212 1.00 0.00 C ATOM 1222 C HIS A 77 -5.937 -10.154 -6.641 1.00 0.00 C ATOM 1223 O HIS A 77 -6.706 -10.489 -7.542 1.00 0.00 O ATOM 1224 CB HIS A 77 -7.208 -8.190 -5.800 1.00 0.00 C ATOM 1225 CG HIS A 77 -7.776 -8.963 -4.655 1.00 0.00 C ATOM 1226 ND1 HIS A 77 -7.228 -9.954 -3.913 1.00 0.00 N flip ATOM 1227 CD2 HIS A 77 -9.045 -8.764 -4.155 1.00 0.00 C flip ATOM 1228 CE1 HIS A 77 -8.168 -10.334 -2.986 1.00 0.00 C flip ATOM 1229 NE2 HIS A 77 -9.254 -9.601 -3.152 1.00 0.00 N flip ATOM 0 H HIS A 77 -5.955 -7.421 -7.882 1.00 0.00 H new ATOM 0 HA HIS A 77 -5.153 -8.604 -5.359 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -7.143 -7.137 -5.527 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -7.885 -8.257 -6.652 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -6.292 -10.345 -4.022 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -9.756 -8.040 -4.524 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -8.040 -11.107 -2.242 1.00 0.00 H new ATOM 1238 N LEU A 78 -5.164 -11.022 -5.993 1.00 0.00 N ATOM 1239 CA LEU A 78 -5.181 -12.447 -6.313 1.00 0.00 C ATOM 1240 C LEU A 78 -5.432 -13.287 -5.065 1.00 0.00 C ATOM 1241 O LEU A 78 -5.336 -12.793 -3.941 1.00 0.00 O ATOM 1242 CB LEU A 78 -3.857 -12.861 -6.958 1.00 0.00 C ATOM 1243 CG LEU A 78 -3.616 -12.301 -8.360 1.00 0.00 C ATOM 1244 CD1 LEU A 78 -2.233 -12.687 -8.858 1.00 0.00 C ATOM 1245 CD2 LEU A 78 -4.688 -12.792 -9.321 1.00 0.00 C ATOM 0 H LEU A 78 -4.520 -10.765 -5.245 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.995 -12.623 -7.016 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.040 -12.542 -6.311 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -3.819 -13.949 -7.007 1.00 0.00 H new ATOM 0 HG LEU A 78 -3.671 -11.213 -8.311 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.079 -12.280 -9.857 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.478 -12.285 -8.182 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.149 -13.773 -8.892 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -4.501 -12.384 -10.314 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -4.665 -13.881 -9.366 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -5.667 -12.464 -8.972 1.00 0.00 H new ATOM 1257 N GLY A 79 -5.750 -14.562 -5.271 1.00 0.00 N ATOM 1258 CA GLY A 79 -6.005 -15.454 -4.153 1.00 0.00 C ATOM 1259 C GLY A 79 -4.764 -15.693 -3.316 1.00 0.00 C ATOM 1260 O GLY A 79 -3.770 -14.981 -3.456 1.00 0.00 O ATOM 0 H GLY A 79 -5.836 -14.993 -6.191 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -6.789 -15.031 -3.525 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.377 -16.407 -4.529 1.00 0.00 H new ATOM 1264 N ASN A 80 -4.816 -16.694 -2.442 1.00 0.00 N ATOM 1265 CA ASN A 80 -3.679 -17.010 -1.584 1.00 0.00 C ATOM 1266 C ASN A 80 -3.051 -18.348 -1.968 1.00 0.00 C ATOM 1267 O ASN A 80 -3.533 -19.409 -1.574 1.00 0.00 O ATOM 1268 CB ASN A 80 -4.111 -17.042 -0.115 1.00 0.00 C ATOM 1269 CG ASN A 80 -5.429 -17.764 0.087 1.00 0.00 C ATOM 1270 OD1 ASN A 80 -6.239 -17.270 1.016 1.00 0.00 O flip ATOM 1271 ND2 ASN A 80 -5.718 -18.755 -0.585 1.00 0.00 N flip ATOM 0 H ASN A 80 -5.628 -17.297 -2.310 1.00 0.00 H new ATOM 0 HA ASN A 80 -2.932 -16.228 -1.721 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -3.338 -17.531 0.477 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -4.199 -16.021 0.257 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -5.066 -19.102 -1.289 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -6.609 -19.229 -0.438 1.00 0.00 H new ATOM 1278 N ILE A 81 -1.963 -18.283 -2.728 1.00 0.00 N ATOM 1279 CA ILE A 81 -1.252 -19.480 -3.158 1.00 0.00 C ATOM 1280 C ILE A 81 0.136 -19.540 -2.531 1.00 0.00 C ATOM 1281 O ILE A 81 0.856 -18.547 -2.517 1.00 0.00 O ATOM 1282 CB ILE A 81 -1.109 -19.533 -4.688 1.00 0.00 C ATOM 1283 CG1 ILE A 81 -2.459 -19.273 -5.359 1.00 0.00 C ATOM 1284 CG2 ILE A 81 -0.542 -20.876 -5.122 1.00 0.00 C ATOM 1285 CD1 ILE A 81 -3.553 -20.217 -4.906 1.00 0.00 C ATOM 0 H ILE A 81 -1.553 -17.410 -3.060 1.00 0.00 H new ATOM 0 HA ILE A 81 -1.842 -20.335 -2.828 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.415 -18.752 -5.000 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.767 -18.248 -5.152 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -2.341 -19.359 -6.439 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -0.447 -20.897 -6.208 1.00 0.00 H new ATOM 0 HG22 ILE A 81 0.439 -21.020 -4.669 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -1.211 -21.674 -4.801 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.481 -19.973 -5.423 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.267 -21.243 -5.137 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -3.699 -20.115 -3.831 1.00 0.00 H new ATOM 1297 N SER A 82 0.496 -20.702 -2.005 1.00 0.00 N ATOM 1298 CA SER A 82 1.794 -20.891 -1.363 1.00 0.00 C ATOM 1299 C SER A 82 2.964 -20.790 -2.348 1.00 0.00 C ATOM 1300 O SER A 82 4.005 -20.220 -2.023 1.00 0.00 O ATOM 1301 CB SER A 82 1.835 -22.245 -0.655 1.00 0.00 C ATOM 1302 OG SER A 82 1.274 -23.262 -1.468 1.00 0.00 O ATOM 0 H SER A 82 -0.094 -21.534 -2.009 1.00 0.00 H new ATOM 0 HA SER A 82 1.909 -20.084 -0.639 1.00 0.00 H new ATOM 0 HB2 SER A 82 2.866 -22.499 -0.409 1.00 0.00 H new ATOM 0 HB3 SER A 82 1.288 -22.184 0.286 1.00 0.00 H new ATOM 0 HG SER A 82 1.313 -24.119 -0.994 1.00 0.00 H new ATOM 1308 N ARG A 83 2.810 -21.382 -3.532 1.00 0.00 N ATOM 1309 CA ARG A 83 3.882 -21.390 -4.532 1.00 0.00 C ATOM 1310 C ARG A 83 3.931 -20.104 -5.375 1.00 0.00 C ATOM 1311 O ARG A 83 4.364 -19.058 -4.890 1.00 0.00 O ATOM 1312 CB ARG A 83 3.740 -22.623 -5.429 1.00 0.00 C ATOM 1313 CG ARG A 83 4.190 -23.914 -4.764 1.00 0.00 C ATOM 1314 CD ARG A 83 3.145 -24.432 -3.788 1.00 0.00 C ATOM 1315 NE ARG A 83 3.583 -25.654 -3.116 1.00 0.00 N ATOM 1316 CZ ARG A 83 4.446 -25.672 -2.103 1.00 0.00 C ATOM 1317 NH1 ARG A 83 4.964 -24.541 -1.641 1.00 0.00 N ATOM 1318 NH2 ARG A 83 4.794 -26.827 -1.551 1.00 0.00 N ATOM 0 H ARG A 83 1.958 -21.861 -3.823 1.00 0.00 H new ATOM 0 HA ARG A 83 4.828 -21.433 -3.993 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.698 -22.724 -5.731 1.00 0.00 H new ATOM 0 HB3 ARG A 83 4.322 -22.470 -6.338 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.383 -24.669 -5.526 1.00 0.00 H new ATOM 0 HG3 ARG A 83 5.129 -23.745 -4.237 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.932 -23.665 -3.043 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.214 -24.625 -4.322 1.00 0.00 H new ATOM 0 HE ARG A 83 3.206 -26.544 -3.442 1.00 0.00 H new ATOM 0 HH11 ARG A 83 4.701 -23.650 -2.063 1.00 0.00 H new ATOM 0 HH12 ARG A 83 5.625 -24.563 -0.864 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.400 -27.700 -1.903 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.455 -26.842 -0.775 1.00 0.00 H new ATOM 1332 N LEU A 84 3.489 -20.185 -6.634 1.00 0.00 N ATOM 1333 CA LEU A 84 3.488 -19.045 -7.528 1.00 0.00 C ATOM 1334 C LEU A 84 2.067 -18.574 -7.730 1.00 0.00 C ATOM 1335 O LEU A 84 1.224 -19.282 -8.283 1.00 0.00 O ATOM 1336 CB LEU A 84 4.127 -19.363 -8.886 1.00 0.00 C ATOM 1337 CG LEU A 84 4.953 -20.654 -8.971 1.00 0.00 C ATOM 1338 CD1 LEU A 84 5.937 -20.751 -7.813 1.00 0.00 C ATOM 1339 CD2 LEU A 84 4.043 -21.875 -9.021 1.00 0.00 C ATOM 0 H LEU A 84 3.126 -21.042 -7.051 1.00 0.00 H new ATOM 0 HA LEU A 84 4.089 -18.261 -7.067 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.334 -19.416 -9.632 1.00 0.00 H new ATOM 0 HB3 LEU A 84 4.770 -18.528 -9.164 1.00 0.00 H new ATOM 0 HG LEU A 84 5.530 -20.626 -9.895 1.00 0.00 H new ATOM 0 HD11 LEU A 84 6.509 -21.675 -7.898 1.00 0.00 H new ATOM 0 HD12 LEU A 84 6.617 -19.899 -7.841 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.390 -20.748 -6.870 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.650 -22.779 -9.081 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.430 -21.909 -8.121 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.398 -21.812 -9.897 1.00 0.00 H new ATOM 1351 N SER A 85 1.828 -17.380 -7.252 1.00 0.00 N ATOM 1352 CA SER A 85 0.521 -16.734 -7.312 1.00 0.00 C ATOM 1353 C SER A 85 0.461 -15.703 -6.206 1.00 0.00 C ATOM 1354 O SER A 85 -0.074 -14.614 -6.386 1.00 0.00 O ATOM 1355 CB SER A 85 -0.624 -17.739 -7.170 1.00 0.00 C ATOM 1356 OG SER A 85 -1.261 -17.965 -8.415 1.00 0.00 O ATOM 0 H SER A 85 2.543 -16.810 -6.800 1.00 0.00 H new ATOM 0 HA SER A 85 0.400 -16.262 -8.287 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.239 -18.681 -6.779 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.351 -17.367 -6.448 1.00 0.00 H new ATOM 0 HG SER A 85 -0.694 -18.537 -8.973 1.00 0.00 H new ATOM 1362 N ASN A 86 1.078 -16.042 -5.070 1.00 0.00 N ATOM 1363 CA ASN A 86 1.161 -15.118 -3.945 1.00 0.00 C ATOM 1364 C ASN A 86 1.936 -13.908 -4.410 1.00 0.00 C ATOM 1365 O ASN A 86 2.101 -13.715 -5.612 1.00 0.00 O ATOM 1366 CB ASN A 86 1.892 -15.742 -2.737 1.00 0.00 C ATOM 1367 CG ASN A 86 2.880 -16.837 -3.111 1.00 0.00 C ATOM 1368 OD1 ASN A 86 3.045 -17.816 -2.383 1.00 0.00 O ATOM 1369 ND2 ASN A 86 3.563 -16.666 -4.239 1.00 0.00 N ATOM 0 H ASN A 86 1.524 -16.945 -4.910 1.00 0.00 H new ATOM 0 HA ASN A 86 0.152 -14.861 -3.623 1.00 0.00 H new ATOM 0 HB2 ASN A 86 2.423 -14.956 -2.200 1.00 0.00 H new ATOM 0 HB3 ASN A 86 1.152 -16.153 -2.050 1.00 0.00 H new ATOM 0 HD21 ASN A 86 4.252 -17.360 -4.528 1.00 0.00 H new ATOM 0 HD22 ASN A 86 3.397 -15.841 -4.815 1.00 0.00 H new ATOM 1376 N LYS A 87 2.455 -13.117 -3.481 1.00 0.00 N ATOM 1377 CA LYS A 87 3.269 -11.966 -3.865 1.00 0.00 C ATOM 1378 C LYS A 87 4.379 -12.468 -4.787 1.00 0.00 C ATOM 1379 O LYS A 87 5.532 -12.599 -4.379 1.00 0.00 O ATOM 1380 CB LYS A 87 3.867 -11.288 -2.630 1.00 0.00 C ATOM 1381 CG LYS A 87 4.480 -12.264 -1.638 1.00 0.00 C ATOM 1382 CD LYS A 87 3.549 -12.522 -0.463 1.00 0.00 C ATOM 1383 CE LYS A 87 3.831 -11.575 0.692 1.00 0.00 C ATOM 1384 NZ LYS A 87 2.838 -10.466 0.761 1.00 0.00 N ATOM 0 H LYS A 87 2.333 -13.244 -2.476 1.00 0.00 H new ATOM 0 HA LYS A 87 2.654 -11.226 -4.377 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.631 -10.579 -2.949 1.00 0.00 H new ATOM 0 HB3 LYS A 87 3.088 -10.713 -2.128 1.00 0.00 H new ATOM 0 HG2 LYS A 87 4.702 -13.205 -2.141 1.00 0.00 H new ATOM 0 HG3 LYS A 87 5.427 -11.867 -1.273 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.514 -12.406 -0.785 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.664 -13.552 -0.126 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.818 -12.132 1.629 1.00 0.00 H new ATOM 0 HE3 LYS A 87 4.832 -11.159 0.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 3.067 -9.844 1.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 2.868 -9.918 -0.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 1.885 -10.861 0.891 1.00 0.00 H new ATOM 1398 N HIS A 88 3.996 -12.819 -6.014 1.00 0.00 N ATOM 1399 CA HIS A 88 4.923 -13.387 -6.979 1.00 0.00 C ATOM 1400 C HIS A 88 5.828 -12.364 -7.635 1.00 0.00 C ATOM 1401 O HIS A 88 6.852 -12.726 -8.214 1.00 0.00 O ATOM 1402 CB HIS A 88 4.195 -14.167 -8.053 1.00 0.00 C ATOM 1403 CG HIS A 88 5.183 -14.936 -8.851 1.00 0.00 C ATOM 1404 ND1 HIS A 88 5.525 -16.231 -8.556 1.00 0.00 N ATOM 1405 CD2 HIS A 88 6.020 -14.535 -9.833 1.00 0.00 C ATOM 1406 CE1 HIS A 88 6.539 -16.595 -9.311 1.00 0.00 C ATOM 1407 NE2 HIS A 88 6.861 -15.585 -10.103 1.00 0.00 N ATOM 0 H HIS A 88 3.042 -12.717 -6.360 1.00 0.00 H new ATOM 0 HA HIS A 88 5.557 -14.056 -6.397 1.00 0.00 H new ATOM 0 HB2 HIS A 88 3.470 -14.843 -7.600 1.00 0.00 H new ATOM 0 HB3 HIS A 88 3.638 -13.488 -8.698 1.00 0.00 H new ATOM 0 HD1 HIS A 88 5.066 -16.819 -7.861 1.00 0.00 H new ATOM 0 HD2 HIS A 88 6.026 -13.569 -10.315 1.00 0.00 H new ATOM 0 HE1 HIS A 88 7.027 -17.558 -9.288 1.00 0.00 H new ATOM 1416 N PHE A 89 5.491 -11.104 -7.541 1.00 0.00 N ATOM 1417 CA PHE A 89 6.364 -10.084 -8.122 1.00 0.00 C ATOM 1418 C PHE A 89 5.915 -8.682 -7.792 1.00 0.00 C ATOM 1419 O PHE A 89 4.750 -8.436 -7.479 1.00 0.00 O ATOM 1420 CB PHE A 89 6.551 -10.313 -9.627 1.00 0.00 C ATOM 1421 CG PHE A 89 6.584 -9.085 -10.501 1.00 0.00 C ATOM 1422 CD1 PHE A 89 7.674 -8.232 -10.486 1.00 0.00 C ATOM 1423 CD2 PHE A 89 5.536 -8.810 -11.366 1.00 0.00 C ATOM 1424 CE1 PHE A 89 7.716 -7.123 -11.307 1.00 0.00 C ATOM 1425 CE2 PHE A 89 5.575 -7.703 -12.193 1.00 0.00 C ATOM 1426 CZ PHE A 89 6.666 -6.858 -12.163 1.00 0.00 C ATOM 0 H PHE A 89 4.648 -10.754 -7.085 1.00 0.00 H new ATOM 0 HA PHE A 89 7.345 -10.189 -7.658 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.482 -10.860 -9.775 1.00 0.00 H new ATOM 0 HB3 PHE A 89 5.744 -10.957 -9.976 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.502 -8.437 -9.824 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.680 -9.468 -11.394 1.00 0.00 H new ATOM 0 HE1 PHE A 89 8.570 -6.463 -11.280 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.752 -7.499 -12.862 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.698 -5.992 -12.807 1.00 0.00 H new ATOM 1436 N GLN A 90 6.877 -7.772 -7.816 1.00 0.00 N ATOM 1437 CA GLN A 90 6.598 -6.379 -7.462 1.00 0.00 C ATOM 1438 C GLN A 90 7.246 -5.367 -8.408 1.00 0.00 C ATOM 1439 O GLN A 90 8.252 -5.647 -9.057 1.00 0.00 O ATOM 1440 CB GLN A 90 7.072 -6.110 -6.032 1.00 0.00 C ATOM 1441 CG GLN A 90 6.093 -5.294 -5.205 1.00 0.00 C ATOM 1442 CD GLN A 90 6.429 -5.302 -3.727 1.00 0.00 C ATOM 1443 OE1 GLN A 90 5.589 -5.626 -2.889 1.00 0.00 O ATOM 1444 NE2 GLN A 90 7.666 -4.942 -3.400 1.00 0.00 N ATOM 0 H GLN A 90 7.846 -7.963 -8.072 1.00 0.00 H new ATOM 0 HA GLN A 90 5.520 -6.246 -7.548 1.00 0.00 H new ATOM 0 HB2 GLN A 90 7.249 -7.063 -5.533 1.00 0.00 H new ATOM 0 HB3 GLN A 90 8.027 -5.586 -6.068 1.00 0.00 H new ATOM 0 HG2 GLN A 90 6.087 -4.266 -5.567 1.00 0.00 H new ATOM 0 HG3 GLN A 90 5.087 -5.688 -5.347 1.00 0.00 H new ATOM 0 HE21 GLN A 90 8.331 -4.681 -4.128 1.00 0.00 H new ATOM 0 HE22 GLN A 90 7.951 -4.927 -2.421 1.00 0.00 H new ATOM 1453 N ILE A 91 6.651 -4.177 -8.461 1.00 0.00 N ATOM 1454 CA ILE A 91 7.142 -3.090 -9.295 1.00 0.00 C ATOM 1455 C ILE A 91 7.322 -1.822 -8.459 1.00 0.00 C ATOM 1456 O ILE A 91 6.427 -1.449 -7.708 1.00 0.00 O ATOM 1457 CB ILE A 91 6.151 -2.788 -10.426 1.00 0.00 C ATOM 1458 CG1 ILE A 91 6.046 -3.974 -11.383 1.00 0.00 C ATOM 1459 CG2 ILE A 91 6.553 -1.529 -11.159 1.00 0.00 C ATOM 1460 CD1 ILE A 91 4.702 -4.068 -12.075 1.00 0.00 C ATOM 0 H ILE A 91 5.815 -3.943 -7.926 1.00 0.00 H new ATOM 0 HA ILE A 91 8.098 -3.398 -9.717 1.00 0.00 H new ATOM 0 HB ILE A 91 5.166 -2.624 -9.989 1.00 0.00 H new ATOM 0 HG12 ILE A 91 6.830 -3.895 -12.136 1.00 0.00 H new ATOM 0 HG13 ILE A 91 6.227 -4.896 -10.830 1.00 0.00 H new ATOM 0 HG21 ILE A 91 5.839 -1.330 -11.958 1.00 0.00 H new ATOM 0 HG22 ILE A 91 6.562 -0.690 -10.463 1.00 0.00 H new ATOM 0 HG23 ILE A 91 7.548 -1.658 -11.585 1.00 0.00 H new ATOM 0 HD11 ILE A 91 4.695 -4.932 -12.740 1.00 0.00 H new ATOM 0 HD12 ILE A 91 3.915 -4.178 -11.329 1.00 0.00 H new ATOM 0 HD13 ILE A 91 4.527 -3.162 -12.655 1.00 0.00 H new ATOM 1472 N LEU A 92 8.465 -1.152 -8.589 1.00 0.00 N ATOM 1473 CA LEU A 92 8.704 0.069 -7.826 1.00 0.00 C ATOM 1474 C LEU A 92 8.876 1.275 -8.746 1.00 0.00 C ATOM 1475 O LEU A 92 9.723 1.275 -9.636 1.00 0.00 O ATOM 1476 CB LEU A 92 9.948 -0.089 -6.947 1.00 0.00 C ATOM 1477 CG LEU A 92 10.309 -1.531 -6.577 1.00 0.00 C ATOM 1478 CD1 LEU A 92 11.390 -2.065 -7.505 1.00 0.00 C ATOM 1479 CD2 LEU A 92 10.763 -1.613 -5.126 1.00 0.00 C ATOM 0 H LEU A 92 9.229 -1.429 -9.206 1.00 0.00 H new ATOM 0 HA LEU A 92 7.832 0.240 -7.195 1.00 0.00 H new ATOM 0 HB2 LEU A 92 10.797 0.360 -7.463 1.00 0.00 H new ATOM 0 HB3 LEU A 92 9.798 0.478 -6.028 1.00 0.00 H new ATOM 0 HG LEU A 92 9.419 -2.149 -6.694 1.00 0.00 H new ATOM 0 HD11 LEU A 92 11.634 -3.090 -7.227 1.00 0.00 H new ATOM 0 HD12 LEU A 92 11.030 -2.043 -8.534 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.282 -1.444 -7.420 1.00 0.00 H new ATOM 0 HD21 LEU A 92 11.015 -2.645 -4.881 1.00 0.00 H new ATOM 0 HD22 LEU A 92 11.640 -0.981 -4.983 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.959 -1.271 -4.473 1.00 0.00 H new ATOM 1491 N LEU A 93 8.076 2.310 -8.514 1.00 0.00 N ATOM 1492 CA LEU A 93 8.151 3.529 -9.312 1.00 0.00 C ATOM 1493 C LEU A 93 8.305 4.751 -8.412 1.00 0.00 C ATOM 1494 O LEU A 93 7.679 4.836 -7.355 1.00 0.00 O ATOM 1495 CB LEU A 93 6.909 3.670 -10.196 1.00 0.00 C ATOM 1496 CG LEU A 93 7.144 3.421 -11.687 1.00 0.00 C ATOM 1497 CD1 LEU A 93 7.958 4.552 -12.294 1.00 0.00 C ATOM 1498 CD2 LEU A 93 7.839 2.085 -11.902 1.00 0.00 C ATOM 0 H LEU A 93 7.368 2.330 -7.780 1.00 0.00 H new ATOM 0 HA LEU A 93 9.028 3.463 -9.956 1.00 0.00 H new ATOM 0 HB2 LEU A 93 6.149 2.973 -9.842 1.00 0.00 H new ATOM 0 HB3 LEU A 93 6.504 4.674 -10.070 1.00 0.00 H new ATOM 0 HG LEU A 93 6.176 3.388 -12.188 1.00 0.00 H new ATOM 0 HD11 LEU A 93 8.116 4.358 -13.355 1.00 0.00 H new ATOM 0 HD12 LEU A 93 7.421 5.493 -12.173 1.00 0.00 H new ATOM 0 HD13 LEU A 93 8.922 4.617 -11.790 1.00 0.00 H new ATOM 0 HD21 LEU A 93 7.998 1.925 -12.968 1.00 0.00 H new ATOM 0 HD22 LEU A 93 8.800 2.088 -11.388 1.00 0.00 H new ATOM 0 HD23 LEU A 93 7.217 1.283 -11.503 1.00 0.00 H new ATOM 1510 N GLY A 94 9.139 5.695 -8.834 1.00 0.00 N ATOM 1511 CA GLY A 94 9.354 6.896 -8.048 1.00 0.00 C ATOM 1512 C GLY A 94 10.824 7.177 -7.807 1.00 0.00 C ATOM 1513 O GLY A 94 11.605 7.280 -8.753 1.00 0.00 O ATOM 0 H GLY A 94 9.669 5.651 -9.704 1.00 0.00 H new ATOM 0 HA2 GLY A 94 8.904 7.747 -8.560 1.00 0.00 H new ATOM 0 HA3 GLY A 94 8.845 6.795 -7.090 1.00 0.00 H new ATOM 1565 N LEU A 99 12.219 4.582 -12.358 1.00 0.00 N ATOM 1566 CA LEU A 99 11.354 3.406 -12.384 1.00 0.00 C ATOM 1567 C LEU A 99 12.164 2.139 -12.121 1.00 0.00 C ATOM 1568 O LEU A 99 13.206 1.920 -12.738 1.00 0.00 O ATOM 1569 CB LEU A 99 10.626 3.298 -13.731 1.00 0.00 C ATOM 1570 CG LEU A 99 10.734 4.527 -14.641 1.00 0.00 C ATOM 1571 CD1 LEU A 99 10.048 4.265 -15.972 1.00 0.00 C ATOM 1572 CD2 LEU A 99 10.136 5.750 -13.963 1.00 0.00 C ATOM 0 HA LEU A 99 10.610 3.515 -11.595 1.00 0.00 H new ATOM 0 HB2 LEU A 99 11.019 2.435 -14.268 1.00 0.00 H new ATOM 0 HB3 LEU A 99 9.571 3.101 -13.539 1.00 0.00 H new ATOM 0 HG LEU A 99 11.789 4.723 -14.830 1.00 0.00 H new ATOM 0 HD11 LEU A 99 10.134 5.148 -16.606 1.00 0.00 H new ATOM 0 HD12 LEU A 99 10.522 3.417 -16.465 1.00 0.00 H new ATOM 0 HD13 LEU A 99 8.995 4.043 -15.801 1.00 0.00 H new ATOM 0 HD21 LEU A 99 10.222 6.612 -14.625 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.085 5.566 -13.742 1.00 0.00 H new ATOM 0 HD23 LEU A 99 10.672 5.950 -13.035 1.00 0.00 H new ATOM 1584 N LEU A 100 11.683 1.309 -11.200 1.00 0.00 N ATOM 1585 CA LEU A 100 12.369 0.070 -10.857 1.00 0.00 C ATOM 1586 C LEU A 100 11.391 -1.098 -10.796 1.00 0.00 C ATOM 1587 O LEU A 100 10.228 -0.925 -10.435 1.00 0.00 O ATOM 1588 CB LEU A 100 13.091 0.214 -9.516 1.00 0.00 C ATOM 1589 CG LEU A 100 14.300 1.151 -9.525 1.00 0.00 C ATOM 1590 CD1 LEU A 100 14.429 1.872 -8.193 1.00 0.00 C ATOM 1591 CD2 LEU A 100 15.571 0.376 -9.840 1.00 0.00 C ATOM 0 H LEU A 100 10.822 1.473 -10.679 1.00 0.00 H new ATOM 0 HA LEU A 100 13.102 -0.134 -11.637 1.00 0.00 H new ATOM 0 HB2 LEU A 100 12.378 0.574 -8.774 1.00 0.00 H new ATOM 0 HB3 LEU A 100 13.419 -0.773 -9.190 1.00 0.00 H new ATOM 0 HG LEU A 100 14.150 1.898 -10.304 1.00 0.00 H new ATOM 0 HD11 LEU A 100 15.295 2.534 -8.220 1.00 0.00 H new ATOM 0 HD12 LEU A 100 13.529 2.459 -8.008 1.00 0.00 H new ATOM 0 HD13 LEU A 100 14.555 1.141 -7.394 1.00 0.00 H new ATOM 0 HD21 LEU A 100 16.422 1.058 -9.842 1.00 0.00 H new ATOM 0 HD22 LEU A 100 15.725 -0.394 -9.084 1.00 0.00 H new ATOM 0 HD23 LEU A 100 15.478 -0.092 -10.820 1.00 0.00 H new ATOM 1603 N LEU A 101 11.863 -2.293 -11.134 1.00 0.00 N ATOM 1604 CA LEU A 101 11.011 -3.478 -11.092 1.00 0.00 C ATOM 1605 C LEU A 101 11.551 -4.450 -10.059 1.00 0.00 C ATOM 1606 O LEU A 101 12.737 -4.766 -10.071 1.00 0.00 O ATOM 1607 CB LEU A 101 10.947 -4.147 -12.466 1.00 0.00 C ATOM 1608 CG LEU A 101 10.561 -3.221 -13.621 1.00 0.00 C ATOM 1609 CD1 LEU A 101 10.414 -4.011 -14.911 1.00 0.00 C ATOM 1610 CD2 LEU A 101 9.274 -2.476 -13.300 1.00 0.00 C ATOM 0 H LEU A 101 12.821 -2.467 -11.437 1.00 0.00 H new ATOM 0 HA LEU A 101 10.000 -3.178 -10.815 1.00 0.00 H new ATOM 0 HB2 LEU A 101 11.920 -4.588 -12.684 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.229 -4.966 -12.421 1.00 0.00 H new ATOM 0 HG LEU A 101 11.357 -2.489 -13.756 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.139 -3.336 -15.722 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.360 -4.498 -15.149 1.00 0.00 H new ATOM 0 HD13 LEU A 101 9.638 -4.766 -14.789 1.00 0.00 H new ATOM 0 HD21 LEU A 101 9.015 -1.822 -14.133 1.00 0.00 H new ATOM 0 HD22 LEU A 101 8.469 -3.193 -13.138 1.00 0.00 H new ATOM 0 HD23 LEU A 101 9.415 -1.878 -12.399 1.00 0.00 H new ATOM 1622 N ASN A 102 10.697 -4.933 -9.160 1.00 0.00 N ATOM 1623 CA ASN A 102 11.168 -5.861 -8.151 1.00 0.00 C ATOM 1624 C ASN A 102 10.603 -7.236 -8.407 1.00 0.00 C ATOM 1625 O ASN A 102 9.410 -7.467 -8.227 1.00 0.00 O ATOM 1626 CB ASN A 102 10.757 -5.383 -6.759 1.00 0.00 C ATOM 1627 CG ASN A 102 11.772 -5.745 -5.697 1.00 0.00 C ATOM 1628 OD1 ASN A 102 12.945 -5.965 -5.992 1.00 0.00 O ATOM 1629 ND2 ASN A 102 11.322 -5.807 -4.451 1.00 0.00 N ATOM 0 H ASN A 102 9.705 -4.702 -9.113 1.00 0.00 H new ATOM 0 HA ASN A 102 12.256 -5.908 -8.202 1.00 0.00 H new ATOM 0 HB2 ASN A 102 10.623 -4.301 -6.775 1.00 0.00 H new ATOM 0 HB3 ASN A 102 9.793 -5.820 -6.499 1.00 0.00 H new ATOM 0 HD21 ASN A 102 11.958 -6.045 -3.690 1.00 0.00 H new ATOM 0 HD22 ASN A 102 10.340 -5.616 -4.253 1.00 0.00 H new ATOM 1636 N ASP A 103 11.462 -8.160 -8.801 1.00 0.00 N ATOM 1637 CA ASP A 103 11.001 -9.503 -9.048 1.00 0.00 C ATOM 1638 C ASP A 103 10.954 -10.251 -7.740 1.00 0.00 C ATOM 1639 O ASP A 103 11.990 -10.575 -7.164 1.00 0.00 O ATOM 1640 CB ASP A 103 11.939 -10.209 -10.026 1.00 0.00 C ATOM 1641 CG ASP A 103 11.606 -9.904 -11.472 1.00 0.00 C ATOM 1642 OD1 ASP A 103 10.557 -9.270 -11.721 1.00 0.00 O ATOM 1643 OD2 ASP A 103 12.394 -10.296 -12.358 1.00 0.00 O ATOM 0 H ASP A 103 12.459 -8.005 -8.952 1.00 0.00 H new ATOM 0 HA ASP A 103 10.004 -9.474 -9.489 1.00 0.00 H new ATOM 0 HB2 ASP A 103 12.966 -9.907 -9.822 1.00 0.00 H new ATOM 0 HB3 ASP A 103 11.885 -11.285 -9.863 1.00 0.00 H new ATOM 1648 N ILE A 104 9.753 -10.558 -7.286 1.00 0.00 N ATOM 1649 CA ILE A 104 9.599 -11.306 -6.064 1.00 0.00 C ATOM 1650 C ILE A 104 8.775 -12.546 -6.340 1.00 0.00 C ATOM 1651 O ILE A 104 7.578 -12.485 -6.528 1.00 0.00 O ATOM 1652 CB ILE A 104 8.972 -10.430 -4.933 1.00 0.00 C ATOM 1653 CG1 ILE A 104 7.671 -11.021 -4.382 1.00 0.00 C ATOM 1654 CG2 ILE A 104 8.719 -9.014 -5.430 1.00 0.00 C ATOM 1655 CD1 ILE A 104 7.093 -10.232 -3.228 1.00 0.00 C ATOM 0 H ILE A 104 8.879 -10.301 -7.745 1.00 0.00 H new ATOM 0 HA ILE A 104 10.582 -11.612 -5.705 1.00 0.00 H new ATOM 0 HB ILE A 104 9.696 -10.411 -4.119 1.00 0.00 H new ATOM 0 HG12 ILE A 104 6.935 -11.069 -5.184 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.855 -12.045 -4.056 1.00 0.00 H new ATOM 0 HG21 ILE A 104 8.282 -8.419 -4.628 1.00 0.00 H new ATOM 0 HG22 ILE A 104 9.661 -8.564 -5.743 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.032 -9.043 -6.276 1.00 0.00 H new ATOM 0 HD11 ILE A 104 6.173 -10.707 -2.887 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.812 -10.205 -2.409 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.877 -9.215 -3.555 1.00 0.00 H new ATOM 1667 N SER A 105 9.442 -13.658 -6.327 1.00 0.00 N ATOM 1668 CA SER A 105 8.825 -14.960 -6.560 1.00 0.00 C ATOM 1669 C SER A 105 9.269 -15.922 -5.475 1.00 0.00 C ATOM 1670 O SER A 105 10.127 -15.576 -4.662 1.00 0.00 O ATOM 1671 CB SER A 105 9.226 -15.485 -7.930 1.00 0.00 C ATOM 1672 OG SER A 105 8.865 -14.576 -8.953 1.00 0.00 O ATOM 0 H SER A 105 10.446 -13.705 -6.153 1.00 0.00 H new ATOM 0 HA SER A 105 7.740 -14.863 -6.532 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.302 -15.657 -7.956 1.00 0.00 H new ATOM 0 HB3 SER A 105 8.745 -16.447 -8.109 1.00 0.00 H new ATOM 0 HG SER A 105 8.242 -15.011 -9.572 1.00 0.00 H new ATOM 1678 N THR A 106 8.689 -17.116 -5.427 1.00 0.00 N ATOM 1679 CA THR A 106 9.077 -18.047 -4.385 1.00 0.00 C ATOM 1680 C THR A 106 10.493 -18.572 -4.590 1.00 0.00 C ATOM 1681 O THR A 106 11.371 -18.311 -3.767 1.00 0.00 O ATOM 1682 CB THR A 106 8.115 -19.247 -4.316 1.00 0.00 C ATOM 1683 OG1 THR A 106 6.759 -18.789 -4.284 1.00 0.00 O ATOM 1684 CG2 THR A 106 8.399 -20.094 -3.085 1.00 0.00 C ATOM 0 H THR A 106 7.975 -17.450 -6.074 1.00 0.00 H new ATOM 0 HA THR A 106 9.035 -17.489 -3.450 1.00 0.00 H new ATOM 0 HB THR A 106 8.268 -19.860 -5.204 1.00 0.00 H new ATOM 0 HG1 THR A 106 6.216 -19.333 -4.892 1.00 0.00 H new ATOM 0 HG21 THR A 106 7.708 -20.936 -3.056 1.00 0.00 H new ATOM 0 HG22 THR A 106 9.423 -20.466 -3.127 1.00 0.00 H new ATOM 0 HG23 THR A 106 8.270 -19.488 -2.188 1.00 0.00 H new ATOM 1692 N ASN A 107 10.737 -19.300 -5.685 1.00 0.00 N ATOM 1693 CA ASN A 107 12.083 -19.812 -5.927 1.00 0.00 C ATOM 1694 C ASN A 107 12.800 -19.190 -7.133 1.00 0.00 C ATOM 1695 O ASN A 107 14.027 -19.089 -7.131 1.00 0.00 O ATOM 1696 CB ASN A 107 12.019 -21.328 -6.105 1.00 0.00 C ATOM 1697 CG ASN A 107 10.975 -21.747 -7.103 1.00 0.00 C ATOM 1698 OD1 ASN A 107 11.205 -21.718 -8.312 1.00 0.00 O ATOM 1699 ND2 ASN A 107 9.820 -22.138 -6.607 1.00 0.00 N ATOM 0 H ASN A 107 10.044 -19.540 -6.394 1.00 0.00 H new ATOM 0 HA ASN A 107 12.672 -19.532 -5.054 1.00 0.00 H new ATOM 0 HB2 ASN A 107 12.994 -21.694 -6.428 1.00 0.00 H new ATOM 0 HB3 ASN A 107 11.806 -21.795 -5.143 1.00 0.00 H new ATOM 0 HD21 ASN A 107 9.070 -22.434 -7.232 1.00 0.00 H new ATOM 0 HD22 ASN A 107 9.675 -22.145 -5.597 1.00 0.00 H new ATOM 1706 N GLY A 108 12.057 -18.812 -8.180 1.00 0.00 N ATOM 1707 CA GLY A 108 12.706 -18.265 -9.358 1.00 0.00 C ATOM 1708 C GLY A 108 11.956 -17.174 -10.113 1.00 0.00 C ATOM 1709 O GLY A 108 10.835 -17.392 -10.572 1.00 0.00 O ATOM 0 H GLY A 108 11.040 -18.875 -8.230 1.00 0.00 H new ATOM 0 HA2 GLY A 108 13.674 -17.865 -9.057 1.00 0.00 H new ATOM 0 HA3 GLY A 108 12.900 -19.085 -10.050 1.00 0.00 H new ATOM 1713 N THR A 109 12.616 -16.039 -10.334 1.00 0.00 N ATOM 1714 CA THR A 109 12.047 -14.963 -11.149 1.00 0.00 C ATOM 1715 C THR A 109 12.980 -14.684 -12.324 1.00 0.00 C ATOM 1716 O THR A 109 14.200 -14.689 -12.161 1.00 0.00 O ATOM 1717 CB THR A 109 11.787 -13.656 -10.379 1.00 0.00 C ATOM 1718 OG1 THR A 109 11.254 -13.944 -9.080 1.00 0.00 O ATOM 1719 CG2 THR A 109 10.808 -12.778 -11.163 1.00 0.00 C ATOM 0 H THR A 109 13.544 -15.839 -9.962 1.00 0.00 H new ATOM 0 HA THR A 109 11.071 -15.312 -11.486 1.00 0.00 H new ATOM 0 HB THR A 109 12.730 -13.122 -10.260 1.00 0.00 H new ATOM 0 HG1 THR A 109 10.315 -13.667 -9.043 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.627 -11.854 -10.613 1.00 0.00 H new ATOM 0 HG22 THR A 109 11.232 -12.543 -12.139 1.00 0.00 H new ATOM 0 HG23 THR A 109 9.867 -13.311 -11.295 1.00 0.00 H new ATOM 1727 N TRP A 110 12.422 -14.477 -13.510 1.00 0.00 N ATOM 1728 CA TRP A 110 13.247 -14.241 -14.695 1.00 0.00 C ATOM 1729 C TRP A 110 12.957 -12.917 -15.377 1.00 0.00 C ATOM 1730 O TRP A 110 11.827 -12.440 -15.391 1.00 0.00 O ATOM 1731 CB TRP A 110 13.039 -15.354 -15.712 1.00 0.00 C ATOM 1732 CG TRP A 110 13.975 -16.484 -15.544 1.00 0.00 C ATOM 1733 CD1 TRP A 110 15.065 -16.756 -16.301 1.00 0.00 C ATOM 1734 CD2 TRP A 110 13.896 -17.501 -14.552 1.00 0.00 C ATOM 1735 NE1 TRP A 110 15.678 -17.885 -15.841 1.00 0.00 N ATOM 1736 CE2 TRP A 110 14.975 -18.370 -14.768 1.00 0.00 C ATOM 1737 CE3 TRP A 110 13.014 -17.759 -13.503 1.00 0.00 C ATOM 1738 CZ2 TRP A 110 15.197 -19.489 -13.968 1.00 0.00 C ATOM 1739 CZ3 TRP A 110 13.234 -18.864 -12.711 1.00 0.00 C ATOM 1740 CH2 TRP A 110 14.318 -19.719 -12.945 1.00 0.00 C ATOM 0 H TRP A 110 11.416 -14.467 -13.680 1.00 0.00 H new ATOM 0 HA TRP A 110 14.277 -14.218 -14.339 1.00 0.00 H new ATOM 0 HB2 TRP A 110 12.017 -15.723 -15.631 1.00 0.00 H new ATOM 0 HB3 TRP A 110 13.152 -14.945 -16.716 1.00 0.00 H new ATOM 0 HD1 TRP A 110 15.399 -16.167 -17.143 1.00 0.00 H new ATOM 0 HE1 TRP A 110 16.523 -18.301 -16.232 1.00 0.00 H new ATOM 0 HE3 TRP A 110 12.175 -17.105 -13.315 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 16.032 -20.150 -14.149 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 12.559 -19.075 -11.895 1.00 0.00 H new ATOM 0 HH2 TRP A 110 14.463 -20.577 -12.305 1.00 0.00 H new ATOM 1751 N LEU A 111 13.993 -12.363 -15.992 1.00 0.00 N ATOM 1752 CA LEU A 111 13.871 -11.128 -16.743 1.00 0.00 C ATOM 1753 C LEU A 111 14.363 -11.361 -18.164 1.00 0.00 C ATOM 1754 O LEU A 111 15.551 -11.594 -18.391 1.00 0.00 O ATOM 1755 CB LEU A 111 14.667 -10.008 -16.077 1.00 0.00 C ATOM 1756 CG LEU A 111 13.881 -9.199 -15.049 1.00 0.00 C ATOM 1757 CD1 LEU A 111 14.775 -8.793 -13.886 1.00 0.00 C ATOM 1758 CD2 LEU A 111 13.258 -7.973 -15.699 1.00 0.00 C ATOM 0 H LEU A 111 14.934 -12.756 -15.983 1.00 0.00 H new ATOM 0 HA LEU A 111 12.825 -10.823 -16.766 1.00 0.00 H new ATOM 0 HB2 LEU A 111 15.541 -10.440 -15.590 1.00 0.00 H new ATOM 0 HB3 LEU A 111 15.035 -9.332 -16.849 1.00 0.00 H new ATOM 0 HG LEU A 111 13.080 -9.827 -14.659 1.00 0.00 H new ATOM 0 HD11 LEU A 111 14.195 -8.217 -13.165 1.00 0.00 H new ATOM 0 HD12 LEU A 111 15.171 -9.686 -13.403 1.00 0.00 H new ATOM 0 HD13 LEU A 111 15.600 -8.185 -14.256 1.00 0.00 H new ATOM 0 HD21 LEU A 111 12.701 -7.408 -14.951 1.00 0.00 H new ATOM 0 HD22 LEU A 111 14.044 -7.344 -16.118 1.00 0.00 H new ATOM 0 HD23 LEU A 111 12.582 -8.287 -16.494 1.00 0.00 H new ATOM 1770 N ASN A 112 13.441 -11.310 -19.115 1.00 0.00 N ATOM 1771 CA ASN A 112 13.768 -11.531 -20.519 1.00 0.00 C ATOM 1772 C ASN A 112 14.580 -12.810 -20.711 1.00 0.00 C ATOM 1773 O ASN A 112 15.459 -12.874 -21.571 1.00 0.00 O ATOM 1774 CB ASN A 112 14.531 -10.333 -21.086 1.00 0.00 C ATOM 1775 CG ASN A 112 13.881 -9.011 -20.729 1.00 0.00 C ATOM 1776 OD1 ASN A 112 13.007 -8.522 -21.447 1.00 0.00 O ATOM 1777 ND2 ASN A 112 14.304 -8.424 -19.616 1.00 0.00 N ATOM 0 H ASN A 112 12.455 -11.117 -18.940 1.00 0.00 H new ATOM 0 HA ASN A 112 12.829 -11.644 -21.062 1.00 0.00 H new ATOM 0 HB2 ASN A 112 15.553 -10.345 -20.708 1.00 0.00 H new ATOM 0 HB3 ASN A 112 14.591 -10.424 -22.171 1.00 0.00 H new ATOM 0 HD21 ASN A 112 13.903 -7.532 -19.325 1.00 0.00 H new ATOM 0 HD22 ASN A 112 15.030 -8.865 -19.051 1.00 0.00 H new ATOM 1784 N GLY A 113 14.274 -13.827 -19.912 1.00 0.00 N ATOM 1785 CA GLY A 113 14.972 -15.087 -20.018 1.00 0.00 C ATOM 1786 C GLY A 113 16.290 -15.087 -19.275 1.00 0.00 C ATOM 1787 O GLY A 113 17.205 -15.837 -19.619 1.00 0.00 O ATOM 0 H GLY A 113 13.552 -13.797 -19.192 1.00 0.00 H new ATOM 0 HA2 GLY A 113 14.339 -15.883 -19.626 1.00 0.00 H new ATOM 0 HA3 GLY A 113 15.152 -15.311 -21.069 1.00 0.00 H new ATOM 1791 N GLN A 114 16.388 -14.248 -18.252 1.00 0.00 N ATOM 1792 CA GLN A 114 17.602 -14.156 -17.456 1.00 0.00 C ATOM 1793 C GLN A 114 17.275 -14.174 -15.971 1.00 0.00 C ATOM 1794 O GLN A 114 16.944 -13.145 -15.382 1.00 0.00 O ATOM 1795 CB GLN A 114 18.374 -12.887 -17.802 1.00 0.00 C ATOM 1796 CG GLN A 114 19.858 -13.122 -18.036 1.00 0.00 C ATOM 1797 CD GLN A 114 20.291 -12.772 -19.446 1.00 0.00 C ATOM 1798 OE1 GLN A 114 20.717 -11.649 -19.718 1.00 0.00 O ATOM 1799 NE2 GLN A 114 20.182 -13.736 -20.354 1.00 0.00 N ATOM 0 H GLN A 114 15.640 -13.621 -17.955 1.00 0.00 H new ATOM 0 HA GLN A 114 18.223 -15.021 -17.687 1.00 0.00 H new ATOM 0 HB2 GLN A 114 17.940 -12.440 -18.696 1.00 0.00 H new ATOM 0 HB3 GLN A 114 18.252 -12.166 -16.994 1.00 0.00 H new ATOM 0 HG2 GLN A 114 20.432 -12.527 -17.326 1.00 0.00 H new ATOM 0 HG3 GLN A 114 20.092 -14.168 -17.838 1.00 0.00 H new ATOM 0 HE21 GLN A 114 19.824 -14.652 -20.085 1.00 0.00 H new ATOM 0 HE22 GLN A 114 20.457 -13.560 -21.320 1.00 0.00 H new ATOM 1808 N LYS A 115 17.376 -15.352 -15.374 1.00 0.00 N ATOM 1809 CA LYS A 115 17.100 -15.527 -13.960 1.00 0.00 C ATOM 1810 C LYS A 115 17.783 -14.441 -13.130 1.00 0.00 C ATOM 1811 O LYS A 115 18.952 -14.117 -13.351 1.00 0.00 O ATOM 1812 CB LYS A 115 17.551 -16.928 -13.536 1.00 0.00 C ATOM 1813 CG LYS A 115 18.103 -17.021 -12.119 1.00 0.00 C ATOM 1814 CD LYS A 115 17.102 -16.504 -11.093 1.00 0.00 C ATOM 1815 CE LYS A 115 16.651 -17.603 -10.140 1.00 0.00 C ATOM 1816 NZ LYS A 115 16.049 -18.757 -10.863 1.00 0.00 N ATOM 0 H LYS A 115 17.650 -16.209 -15.855 1.00 0.00 H new ATOM 0 HA LYS A 115 16.029 -15.431 -13.783 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.705 -17.609 -13.627 1.00 0.00 H new ATOM 0 HB3 LYS A 115 18.315 -17.274 -14.232 1.00 0.00 H new ATOM 0 HG2 LYS A 115 18.354 -18.057 -11.893 1.00 0.00 H new ATOM 0 HG3 LYS A 115 19.027 -16.446 -12.049 1.00 0.00 H new ATOM 0 HD2 LYS A 115 17.552 -15.691 -10.523 1.00 0.00 H new ATOM 0 HD3 LYS A 115 16.235 -16.090 -11.608 1.00 0.00 H new ATOM 0 HE2 LYS A 115 17.503 -17.947 -9.554 1.00 0.00 H new ATOM 0 HE3 LYS A 115 15.924 -17.197 -9.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 15.323 -19.200 -10.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 15.614 -18.424 -11.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 16.789 -19.454 -11.082 1.00 0.00 H new ATOM 1830 N VAL A 116 17.039 -13.873 -12.187 1.00 0.00 N ATOM 1831 CA VAL A 116 17.564 -12.811 -11.334 1.00 0.00 C ATOM 1832 C VAL A 116 17.190 -13.041 -9.871 1.00 0.00 C ATOM 1833 O VAL A 116 16.318 -13.853 -9.564 1.00 0.00 O ATOM 1834 CB VAL A 116 17.036 -11.434 -11.789 1.00 0.00 C ATOM 1835 CG1 VAL A 116 15.530 -11.338 -11.591 1.00 0.00 C ATOM 1836 CG2 VAL A 116 17.750 -10.309 -11.053 1.00 0.00 C ATOM 0 H VAL A 116 16.071 -14.130 -11.993 1.00 0.00 H new ATOM 0 HA VAL A 116 18.650 -12.827 -11.424 1.00 0.00 H new ATOM 0 HB VAL A 116 17.245 -11.328 -12.854 1.00 0.00 H new ATOM 0 HG11 VAL A 116 15.182 -10.359 -11.919 1.00 0.00 H new ATOM 0 HG12 VAL A 116 15.036 -12.114 -12.176 1.00 0.00 H new ATOM 0 HG13 VAL A 116 15.292 -11.473 -10.536 1.00 0.00 H new ATOM 0 HG21 VAL A 116 17.361 -9.349 -11.391 1.00 0.00 H new ATOM 0 HG22 VAL A 116 17.582 -10.412 -9.981 1.00 0.00 H new ATOM 0 HG23 VAL A 116 18.819 -10.360 -11.260 1.00 0.00 H new ATOM 1846 N GLU A 117 17.853 -12.318 -8.972 1.00 0.00 N ATOM 1847 CA GLU A 117 17.586 -12.440 -7.545 1.00 0.00 C ATOM 1848 C GLU A 117 16.215 -11.865 -7.214 1.00 0.00 C ATOM 1849 O GLU A 117 15.795 -10.867 -7.796 1.00 0.00 O ATOM 1850 CB GLU A 117 18.665 -11.713 -6.739 1.00 0.00 C ATOM 1851 CG GLU A 117 19.111 -12.471 -5.499 1.00 0.00 C ATOM 1852 CD GLU A 117 20.616 -12.642 -5.428 1.00 0.00 C ATOM 1853 OE1 GLU A 117 21.201 -13.154 -6.405 1.00 0.00 O ATOM 1854 OE2 GLU A 117 21.209 -12.264 -4.396 1.00 0.00 O ATOM 0 H GLU A 117 18.579 -11.642 -9.209 1.00 0.00 H new ATOM 0 HA GLU A 117 17.599 -13.497 -7.279 1.00 0.00 H new ATOM 0 HB2 GLU A 117 19.530 -11.539 -7.379 1.00 0.00 H new ATOM 0 HB3 GLU A 117 18.287 -10.735 -6.441 1.00 0.00 H new ATOM 0 HG2 GLU A 117 18.767 -11.941 -4.611 1.00 0.00 H new ATOM 0 HG3 GLU A 117 18.637 -13.452 -5.488 1.00 0.00 H new ATOM 1861 N LYS A 118 15.513 -12.504 -6.285 1.00 0.00 N ATOM 1862 CA LYS A 118 14.188 -12.044 -5.898 1.00 0.00 C ATOM 1863 C LYS A 118 14.268 -10.710 -5.161 1.00 0.00 C ATOM 1864 O LYS A 118 15.351 -10.257 -4.795 1.00 0.00 O ATOM 1865 CB LYS A 118 13.482 -13.086 -5.030 1.00 0.00 C ATOM 1866 CG LYS A 118 14.105 -13.268 -3.655 1.00 0.00 C ATOM 1867 CD LYS A 118 13.184 -14.035 -2.714 1.00 0.00 C ATOM 1868 CE LYS A 118 11.770 -13.469 -2.713 1.00 0.00 C ATOM 1869 NZ LYS A 118 11.053 -13.764 -1.442 1.00 0.00 N ATOM 0 H LYS A 118 15.837 -13.335 -5.790 1.00 0.00 H new ATOM 0 HA LYS A 118 13.606 -11.901 -6.809 1.00 0.00 H new ATOM 0 HB2 LYS A 118 12.438 -12.797 -4.909 1.00 0.00 H new ATOM 0 HB3 LYS A 118 13.489 -14.043 -5.551 1.00 0.00 H new ATOM 0 HG2 LYS A 118 15.051 -13.801 -3.752 1.00 0.00 H new ATOM 0 HG3 LYS A 118 14.332 -12.292 -3.226 1.00 0.00 H new ATOM 0 HD2 LYS A 118 13.155 -15.084 -3.010 1.00 0.00 H new ATOM 0 HD3 LYS A 118 13.589 -14.001 -1.703 1.00 0.00 H new ATOM 0 HE2 LYS A 118 11.811 -12.390 -2.864 1.00 0.00 H new ATOM 0 HE3 LYS A 118 11.211 -13.887 -3.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 10.095 -13.362 -1.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 10.991 -14.794 -1.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 11.572 -13.343 -0.645 1.00 0.00 H new ATOM 1883 N ASN A 119 13.105 -10.094 -4.950 1.00 0.00 N ATOM 1884 CA ASN A 119 13.001 -8.813 -4.262 1.00 0.00 C ATOM 1885 C ASN A 119 14.199 -7.910 -4.541 1.00 0.00 C ATOM 1886 O ASN A 119 14.666 -7.184 -3.663 1.00 0.00 O ATOM 1887 CB ASN A 119 12.841 -9.043 -2.764 1.00 0.00 C ATOM 1888 CG ASN A 119 13.937 -9.918 -2.190 1.00 0.00 C ATOM 1889 OD1 ASN A 119 15.123 -9.608 -2.310 1.00 0.00 O ATOM 1890 ND2 ASN A 119 13.544 -11.019 -1.561 1.00 0.00 N ATOM 0 H ASN A 119 12.208 -10.473 -5.253 1.00 0.00 H new ATOM 0 HA ASN A 119 12.120 -8.300 -4.647 1.00 0.00 H new ATOM 0 HB2 ASN A 119 12.842 -8.082 -2.250 1.00 0.00 H new ATOM 0 HB3 ASN A 119 11.873 -9.506 -2.572 1.00 0.00 H new ATOM 0 HD21 ASN A 119 14.236 -11.648 -1.153 1.00 0.00 H new ATOM 0 HD22 ASN A 119 12.550 -11.236 -1.486 1.00 0.00 H new ATOM 1897 N SER A 120 14.680 -7.959 -5.776 1.00 0.00 N ATOM 1898 CA SER A 120 15.814 -7.144 -6.196 1.00 0.00 C ATOM 1899 C SER A 120 15.372 -6.082 -7.200 1.00 0.00 C ATOM 1900 O SER A 120 15.062 -6.399 -8.348 1.00 0.00 O ATOM 1901 CB SER A 120 16.907 -8.026 -6.796 1.00 0.00 C ATOM 1902 OG SER A 120 17.465 -7.449 -7.965 1.00 0.00 O ATOM 0 H SER A 120 14.300 -8.558 -6.509 1.00 0.00 H new ATOM 0 HA SER A 120 16.218 -6.637 -5.320 1.00 0.00 H new ATOM 0 HB2 SER A 120 17.693 -8.184 -6.058 1.00 0.00 H new ATOM 0 HB3 SER A 120 16.493 -9.006 -7.036 1.00 0.00 H new ATOM 0 HG SER A 120 16.817 -7.505 -8.698 1.00 0.00 H new ATOM 1908 N ASN A 121 15.340 -4.824 -6.766 1.00 0.00 N ATOM 1909 CA ASN A 121 14.929 -3.723 -7.639 1.00 0.00 C ATOM 1910 C ASN A 121 15.637 -3.803 -8.988 1.00 0.00 C ATOM 1911 O ASN A 121 16.831 -4.100 -9.053 1.00 0.00 O ATOM 1912 CB ASN A 121 15.223 -2.377 -6.976 1.00 0.00 C ATOM 1913 CG ASN A 121 14.657 -2.288 -5.572 1.00 0.00 C ATOM 1914 OD1 ASN A 121 15.091 -3.003 -4.668 1.00 0.00 O ATOM 1915 ND2 ASN A 121 13.685 -1.404 -5.381 1.00 0.00 N ATOM 0 H ASN A 121 15.592 -4.541 -5.819 1.00 0.00 H new ATOM 0 HA ASN A 121 13.855 -3.810 -7.806 1.00 0.00 H new ATOM 0 HB2 ASN A 121 16.301 -2.220 -6.941 1.00 0.00 H new ATOM 0 HB3 ASN A 121 14.804 -1.576 -7.585 1.00 0.00 H new ATOM 0 HD21 ASN A 121 13.267 -1.297 -4.457 1.00 0.00 H new ATOM 0 HD22 ASN A 121 13.356 -0.832 -6.159 1.00 0.00 H new ATOM 1922 N GLN A 122 14.899 -3.543 -10.063 1.00 0.00 N ATOM 1923 CA GLN A 122 15.471 -3.597 -11.402 1.00 0.00 C ATOM 1924 C GLN A 122 15.221 -2.318 -12.174 1.00 0.00 C ATOM 1925 O GLN A 122 14.199 -1.662 -12.001 1.00 0.00 O ATOM 1926 CB GLN A 122 14.912 -4.779 -12.192 1.00 0.00 C ATOM 1927 CG GLN A 122 15.079 -6.117 -11.495 1.00 0.00 C ATOM 1928 CD GLN A 122 16.521 -6.585 -11.475 1.00 0.00 C ATOM 1929 OE1 GLN A 122 16.881 -7.338 -10.445 1.00 0.00 O flip ATOM 1930 NE2 GLN A 122 17.300 -6.274 -12.376 1.00 0.00 N flip ATOM 0 H GLN A 122 13.910 -3.294 -10.033 1.00 0.00 H new ATOM 0 HA GLN A 122 16.546 -3.722 -11.276 1.00 0.00 H new ATOM 0 HB2 GLN A 122 13.852 -4.609 -12.381 1.00 0.00 H new ATOM 0 HB3 GLN A 122 15.406 -4.821 -13.163 1.00 0.00 H new ATOM 0 HG2 GLN A 122 14.712 -6.038 -10.472 1.00 0.00 H new ATOM 0 HG3 GLN A 122 14.465 -6.864 -11.998 1.00 0.00 H new ATOM 0 HE21 GLN A 122 16.979 -5.692 -13.150 1.00 0.00 H new ATOM 0 HE22 GLN A 122 18.267 -6.598 -12.349 1.00 0.00 H new ATOM 1939 N LEU A 123 16.160 -1.986 -13.046 1.00 0.00 N ATOM 1940 CA LEU A 123 16.045 -0.796 -13.876 1.00 0.00 C ATOM 1941 C LEU A 123 15.016 -1.035 -14.970 1.00 0.00 C ATOM 1942 O LEU A 123 15.225 -1.860 -15.859 1.00 0.00 O ATOM 1943 CB LEU A 123 17.400 -0.436 -14.491 1.00 0.00 C ATOM 1944 CG LEU A 123 17.473 0.952 -15.134 1.00 0.00 C ATOM 1945 CD1 LEU A 123 16.673 0.985 -16.428 1.00 0.00 C ATOM 1946 CD2 LEU A 123 16.972 2.016 -14.169 1.00 0.00 C ATOM 0 H LEU A 123 17.012 -2.525 -13.198 1.00 0.00 H new ATOM 0 HA LEU A 123 15.721 0.039 -13.254 1.00 0.00 H new ATOM 0 HB2 LEU A 123 18.163 -0.500 -13.715 1.00 0.00 H new ATOM 0 HB3 LEU A 123 17.649 -1.182 -15.245 1.00 0.00 H new ATOM 0 HG LEU A 123 18.516 1.166 -15.369 1.00 0.00 H new ATOM 0 HD11 LEU A 123 16.737 1.979 -16.870 1.00 0.00 H new ATOM 0 HD12 LEU A 123 17.078 0.251 -17.125 1.00 0.00 H new ATOM 0 HD13 LEU A 123 15.630 0.748 -16.217 1.00 0.00 H new ATOM 0 HD21 LEU A 123 17.032 2.995 -14.644 1.00 0.00 H new ATOM 0 HD22 LEU A 123 15.937 1.805 -13.901 1.00 0.00 H new ATOM 0 HD23 LEU A 123 17.588 2.011 -13.270 1.00 0.00 H new ATOM 1958 N LEU A 124 13.894 -0.330 -14.889 1.00 0.00 N ATOM 1959 CA LEU A 124 12.825 -0.495 -15.864 1.00 0.00 C ATOM 1960 C LEU A 124 13.347 -0.487 -17.289 1.00 0.00 C ATOM 1961 O LEU A 124 14.303 0.213 -17.626 1.00 0.00 O ATOM 1962 CB LEU A 124 11.765 0.583 -15.709 1.00 0.00 C ATOM 1963 CG LEU A 124 10.585 0.478 -16.677 1.00 0.00 C ATOM 1964 CD1 LEU A 124 9.279 0.793 -15.964 1.00 0.00 C ATOM 1965 CD2 LEU A 124 10.785 1.409 -17.866 1.00 0.00 C ATOM 0 H LEU A 124 13.702 0.358 -14.161 1.00 0.00 H new ATOM 0 HA LEU A 124 12.377 -1.469 -15.667 1.00 0.00 H new ATOM 0 HB2 LEU A 124 11.382 0.550 -14.689 1.00 0.00 H new ATOM 0 HB3 LEU A 124 12.237 1.557 -15.841 1.00 0.00 H new ATOM 0 HG LEU A 124 10.534 -0.546 -17.048 1.00 0.00 H new ATOM 0 HD11 LEU A 124 8.451 0.713 -16.669 1.00 0.00 H new ATOM 0 HD12 LEU A 124 9.130 0.086 -15.148 1.00 0.00 H new ATOM 0 HD13 LEU A 124 9.318 1.806 -15.564 1.00 0.00 H new ATOM 0 HD21 LEU A 124 9.936 1.321 -18.544 1.00 0.00 H new ATOM 0 HD22 LEU A 124 10.863 2.438 -17.514 1.00 0.00 H new ATOM 0 HD23 LEU A 124 11.699 1.136 -18.392 1.00 0.00 H new ATOM 1977 N SER A 125 12.689 -1.277 -18.108 1.00 0.00 N ATOM 1978 CA SER A 125 13.028 -1.406 -19.518 1.00 0.00 C ATOM 1979 C SER A 125 11.799 -1.156 -20.381 1.00 0.00 C ATOM 1980 O SER A 125 10.672 -1.385 -19.943 1.00 0.00 O ATOM 1981 CB SER A 125 13.606 -2.795 -19.808 1.00 0.00 C ATOM 1982 OG SER A 125 13.816 -3.524 -18.612 1.00 0.00 O ATOM 0 H SER A 125 11.899 -1.853 -17.818 1.00 0.00 H new ATOM 0 HA SER A 125 13.785 -0.660 -19.760 1.00 0.00 H new ATOM 0 HB2 SER A 125 12.926 -3.346 -20.458 1.00 0.00 H new ATOM 0 HB3 SER A 125 14.549 -2.694 -20.345 1.00 0.00 H new ATOM 0 HG SER A 125 13.454 -4.429 -18.713 1.00 0.00 H new ATOM 1988 N GLN A 126 12.010 -0.702 -21.610 1.00 0.00 N ATOM 1989 CA GLN A 126 10.896 -0.448 -22.510 1.00 0.00 C ATOM 1990 C GLN A 126 10.289 -1.772 -22.956 1.00 0.00 C ATOM 1991 O GLN A 126 10.932 -2.560 -23.650 1.00 0.00 O ATOM 1992 CB GLN A 126 11.363 0.355 -23.727 1.00 0.00 C ATOM 1993 CG GLN A 126 11.173 1.855 -23.575 1.00 0.00 C ATOM 1994 CD GLN A 126 9.739 2.233 -23.261 1.00 0.00 C ATOM 1995 OE1 GLN A 126 9.478 3.033 -22.362 1.00 0.00 O ATOM 1996 NE2 GLN A 126 8.799 1.657 -24.001 1.00 0.00 N ATOM 0 H GLN A 126 12.931 -0.505 -22.002 1.00 0.00 H new ATOM 0 HA GLN A 126 10.141 0.135 -21.983 1.00 0.00 H new ATOM 0 HB2 GLN A 126 12.418 0.147 -23.906 1.00 0.00 H new ATOM 0 HB3 GLN A 126 10.817 0.015 -24.607 1.00 0.00 H new ATOM 0 HG2 GLN A 126 11.823 2.221 -22.781 1.00 0.00 H new ATOM 0 HG3 GLN A 126 11.483 2.352 -24.495 1.00 0.00 H new ATOM 0 HE21 GLN A 126 9.060 1.000 -24.736 1.00 0.00 H new ATOM 0 HE22 GLN A 126 7.816 1.872 -23.835 1.00 0.00 H new ATOM 2005 N GLY A 127 9.051 -2.019 -22.540 1.00 0.00 N ATOM 2006 CA GLY A 127 8.387 -3.254 -22.890 1.00 0.00 C ATOM 2007 C GLY A 127 9.017 -4.456 -22.210 1.00 0.00 C ATOM 2008 O GLY A 127 8.976 -5.569 -22.735 1.00 0.00 O ATOM 0 H GLY A 127 8.498 -1.383 -21.966 1.00 0.00 H new ATOM 0 HA2 GLY A 127 7.335 -3.191 -22.611 1.00 0.00 H new ATOM 0 HA3 GLY A 127 8.423 -3.390 -23.971 1.00 0.00 H new ATOM 2012 N ASP A 128 9.609 -4.228 -21.038 1.00 0.00 N ATOM 2013 CA ASP A 128 10.259 -5.291 -20.279 1.00 0.00 C ATOM 2014 C ASP A 128 9.306 -6.452 -20.018 1.00 0.00 C ATOM 2015 O ASP A 128 8.087 -6.302 -20.100 1.00 0.00 O ATOM 2016 CB ASP A 128 10.793 -4.747 -18.952 1.00 0.00 C ATOM 2017 CG ASP A 128 11.423 -5.825 -18.087 1.00 0.00 C ATOM 2018 OD1 ASP A 128 10.679 -6.495 -17.340 1.00 0.00 O ATOM 2019 OD2 ASP A 128 12.658 -5.997 -18.159 1.00 0.00 O ATOM 0 H ASP A 128 9.651 -3.311 -20.593 1.00 0.00 H new ATOM 0 HA ASP A 128 11.091 -5.663 -20.876 1.00 0.00 H new ATOM 0 HB2 ASP A 128 11.531 -3.971 -19.153 1.00 0.00 H new ATOM 0 HB3 ASP A 128 9.978 -4.277 -18.403 1.00 0.00 H new ATOM 2024 N GLU A 129 9.876 -7.611 -19.704 1.00 0.00 N ATOM 2025 CA GLU A 129 9.081 -8.803 -19.431 1.00 0.00 C ATOM 2026 C GLU A 129 9.746 -9.682 -18.370 1.00 0.00 C ATOM 2027 O GLU A 129 10.952 -9.927 -18.423 1.00 0.00 O ATOM 2028 CB GLU A 129 8.869 -9.596 -20.730 1.00 0.00 C ATOM 2029 CG GLU A 129 8.459 -11.050 -20.524 1.00 0.00 C ATOM 2030 CD GLU A 129 9.555 -12.024 -20.910 1.00 0.00 C ATOM 2031 OE1 GLU A 129 10.010 -11.976 -22.072 1.00 0.00 O ATOM 2032 OE2 GLU A 129 9.958 -12.835 -20.049 1.00 0.00 O ATOM 0 H GLU A 129 10.884 -7.750 -19.632 1.00 0.00 H new ATOM 0 HA GLU A 129 8.113 -8.489 -19.041 1.00 0.00 H new ATOM 0 HB2 GLU A 129 8.104 -9.097 -21.325 1.00 0.00 H new ATOM 0 HB3 GLU A 129 9.791 -9.571 -21.311 1.00 0.00 H new ATOM 0 HG2 GLU A 129 8.193 -11.204 -19.478 1.00 0.00 H new ATOM 0 HG3 GLU A 129 7.567 -11.259 -21.114 1.00 0.00 H new ATOM 2039 N ILE A 130 8.951 -10.168 -17.419 1.00 0.00 N ATOM 2040 CA ILE A 130 9.461 -11.034 -16.365 1.00 0.00 C ATOM 2041 C ILE A 130 8.899 -12.443 -16.516 1.00 0.00 C ATOM 2042 O ILE A 130 7.689 -12.627 -16.650 1.00 0.00 O ATOM 2043 CB ILE A 130 9.115 -10.501 -14.960 1.00 0.00 C ATOM 2044 CG1 ILE A 130 9.221 -8.976 -14.922 1.00 0.00 C ATOM 2045 CG2 ILE A 130 10.028 -11.126 -13.916 1.00 0.00 C ATOM 2046 CD1 ILE A 130 7.880 -8.277 -14.969 1.00 0.00 C ATOM 0 H ILE A 130 7.951 -9.975 -17.359 1.00 0.00 H new ATOM 0 HA ILE A 130 10.546 -11.052 -16.467 1.00 0.00 H new ATOM 0 HB ILE A 130 8.086 -10.778 -14.730 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.745 -8.679 -14.014 1.00 0.00 H new ATOM 0 HG13 ILE A 130 9.826 -8.641 -15.764 1.00 0.00 H new ATOM 0 HG21 ILE A 130 9.771 -10.740 -12.930 1.00 0.00 H new ATOM 0 HG22 ILE A 130 9.903 -12.209 -13.925 1.00 0.00 H new ATOM 0 HG23 ILE A 130 11.065 -10.878 -14.144 1.00 0.00 H new ATOM 0 HD11 ILE A 130 8.031 -7.198 -14.939 1.00 0.00 H new ATOM 0 HD12 ILE A 130 7.362 -8.545 -15.890 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.280 -8.584 -14.112 1.00 0.00 H new ATOM 2058 N THR A 131 9.781 -13.430 -16.503 1.00 0.00 N ATOM 2059 CA THR A 131 9.374 -14.822 -16.649 1.00 0.00 C ATOM 2060 C THR A 131 9.392 -15.537 -15.301 1.00 0.00 C ATOM 2061 O THR A 131 10.254 -15.284 -14.464 1.00 0.00 O ATOM 2062 CB THR A 131 10.291 -15.563 -17.647 1.00 0.00 C ATOM 2063 OG1 THR A 131 10.017 -15.122 -18.982 1.00 0.00 O ATOM 2064 CG2 THR A 131 10.103 -17.070 -17.562 1.00 0.00 C ATOM 0 H THR A 131 10.786 -13.294 -16.393 1.00 0.00 H new ATOM 0 HA THR A 131 8.356 -14.830 -17.037 1.00 0.00 H new ATOM 0 HB THR A 131 11.324 -15.332 -17.386 1.00 0.00 H new ATOM 0 HG1 THR A 131 10.087 -14.145 -19.025 1.00 0.00 H new ATOM 0 HG21 THR A 131 10.763 -17.560 -18.278 1.00 0.00 H new ATOM 0 HG22 THR A 131 10.343 -17.410 -16.555 1.00 0.00 H new ATOM 0 HG23 THR A 131 9.068 -17.321 -17.793 1.00 0.00 H new ATOM 2072 N VAL A 132 8.417 -16.416 -15.090 1.00 0.00 N ATOM 2073 CA VAL A 132 8.315 -17.146 -13.834 1.00 0.00 C ATOM 2074 C VAL A 132 7.892 -18.600 -14.049 1.00 0.00 C ATOM 2075 O VAL A 132 7.217 -18.924 -15.027 1.00 0.00 O ATOM 2076 CB VAL A 132 7.315 -16.458 -12.884 1.00 0.00 C ATOM 2077 CG1 VAL A 132 7.594 -14.963 -12.815 1.00 0.00 C ATOM 2078 CG2 VAL A 132 5.878 -16.712 -13.326 1.00 0.00 C ATOM 0 H VAL A 132 7.690 -16.638 -15.770 1.00 0.00 H new ATOM 0 HA VAL A 132 9.308 -17.142 -13.385 1.00 0.00 H new ATOM 0 HB VAL A 132 7.443 -16.885 -11.889 1.00 0.00 H new ATOM 0 HG11 VAL A 132 6.880 -14.490 -12.140 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.606 -14.798 -12.445 1.00 0.00 H new ATOM 0 HG13 VAL A 132 7.496 -14.528 -13.810 1.00 0.00 H new ATOM 0 HG21 VAL A 132 5.193 -16.216 -12.639 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.732 -16.318 -14.332 1.00 0.00 H new ATOM 0 HG23 VAL A 132 5.681 -17.784 -13.324 1.00 0.00 H new ATOM 2088 N GLY A 133 8.286 -19.465 -13.119 1.00 0.00 N ATOM 2089 CA GLY A 133 7.937 -20.868 -13.206 1.00 0.00 C ATOM 2090 C GLY A 133 8.759 -21.602 -14.240 1.00 0.00 C ATOM 2091 O GLY A 133 8.259 -22.494 -14.923 1.00 0.00 O ATOM 0 H GLY A 133 8.844 -19.215 -12.303 1.00 0.00 H new ATOM 0 HA2 GLY A 133 8.080 -21.336 -12.232 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.879 -20.962 -13.453 1.00 0.00 H new ATOM 2095 N VAL A 134 10.019 -21.215 -14.362 1.00 0.00 N ATOM 2096 CA VAL A 134 10.913 -21.823 -15.324 1.00 0.00 C ATOM 2097 C VAL A 134 11.308 -23.240 -14.925 1.00 0.00 C ATOM 2098 O VAL A 134 11.265 -23.613 -13.753 1.00 0.00 O ATOM 2099 CB VAL A 134 12.172 -20.961 -15.526 1.00 0.00 C ATOM 2100 CG1 VAL A 134 13.180 -21.658 -16.431 1.00 0.00 C ATOM 2101 CG2 VAL A 134 11.775 -19.612 -16.097 1.00 0.00 C ATOM 0 H VAL A 134 10.444 -20.477 -13.801 1.00 0.00 H new ATOM 0 HA VAL A 134 10.369 -21.883 -16.266 1.00 0.00 H new ATOM 0 HB VAL A 134 12.653 -20.813 -14.559 1.00 0.00 H new ATOM 0 HG11 VAL A 134 14.058 -21.024 -16.554 1.00 0.00 H new ATOM 0 HG12 VAL A 134 13.477 -22.606 -15.982 1.00 0.00 H new ATOM 0 HG13 VAL A 134 12.727 -21.844 -17.405 1.00 0.00 H new ATOM 0 HG21 VAL A 134 12.666 -19.001 -16.240 1.00 0.00 H new ATOM 0 HG22 VAL A 134 11.275 -19.755 -17.055 1.00 0.00 H new ATOM 0 HG23 VAL A 134 11.098 -19.110 -15.406 1.00 0.00 H new ATOM 2111 N GLY A 135 11.678 -24.023 -15.930 1.00 0.00 N ATOM 2112 CA GLY A 135 12.065 -25.398 -15.725 1.00 0.00 C ATOM 2113 C GLY A 135 11.812 -26.216 -16.971 1.00 0.00 C ATOM 2114 O GLY A 135 12.668 -26.981 -17.416 1.00 0.00 O ATOM 0 H GLY A 135 11.716 -23.718 -16.903 1.00 0.00 H new ATOM 0 HA2 GLY A 135 13.121 -25.448 -15.459 1.00 0.00 H new ATOM 0 HA3 GLY A 135 11.506 -25.818 -14.889 1.00 0.00 H new ATOM 2118 N VAL A 136 10.631 -26.022 -17.546 1.00 0.00 N ATOM 2119 CA VAL A 136 10.235 -26.700 -18.761 1.00 0.00 C ATOM 2120 C VAL A 136 9.783 -25.677 -19.798 1.00 0.00 C ATOM 2121 O VAL A 136 9.040 -24.749 -19.480 1.00 0.00 O ATOM 2122 CB VAL A 136 9.101 -27.712 -18.506 1.00 0.00 C ATOM 2123 CG1 VAL A 136 8.728 -28.437 -19.791 1.00 0.00 C ATOM 2124 CG2 VAL A 136 9.505 -28.701 -17.424 1.00 0.00 C ATOM 0 H VAL A 136 9.923 -25.387 -17.177 1.00 0.00 H new ATOM 0 HA VAL A 136 11.100 -27.250 -19.132 1.00 0.00 H new ATOM 0 HB VAL A 136 8.223 -27.166 -18.160 1.00 0.00 H new ATOM 0 HG11 VAL A 136 7.926 -29.147 -19.589 1.00 0.00 H new ATOM 0 HG12 VAL A 136 8.393 -27.713 -20.533 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.598 -28.972 -20.173 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.693 -29.409 -17.256 1.00 0.00 H new ATOM 0 HG22 VAL A 136 10.398 -29.241 -17.740 1.00 0.00 H new ATOM 0 HG23 VAL A 136 9.714 -28.163 -16.499 1.00 0.00 H new ATOM 2134 N GLU A 137 10.240 -25.839 -21.034 1.00 0.00 N ATOM 2135 CA GLU A 137 9.885 -24.911 -22.104 1.00 0.00 C ATOM 2136 C GLU A 137 8.373 -24.709 -22.183 1.00 0.00 C ATOM 2137 O GLU A 137 7.898 -23.621 -22.509 1.00 0.00 O ATOM 2138 CB GLU A 137 10.411 -25.422 -23.446 1.00 0.00 C ATOM 2139 CG GLU A 137 10.239 -24.429 -24.584 1.00 0.00 C ATOM 2140 CD GLU A 137 8.846 -24.461 -25.181 1.00 0.00 C ATOM 2141 OE1 GLU A 137 8.169 -25.502 -25.051 1.00 0.00 O ATOM 2142 OE2 GLU A 137 8.432 -23.445 -25.776 1.00 0.00 O ATOM 0 H GLU A 137 10.855 -26.601 -21.321 1.00 0.00 H new ATOM 0 HA GLU A 137 10.347 -23.950 -21.879 1.00 0.00 H new ATOM 0 HB2 GLU A 137 11.469 -25.665 -23.344 1.00 0.00 H new ATOM 0 HB3 GLU A 137 9.894 -26.347 -23.701 1.00 0.00 H new ATOM 0 HG2 GLU A 137 10.451 -23.424 -24.219 1.00 0.00 H new ATOM 0 HG3 GLU A 137 10.969 -24.646 -25.364 1.00 0.00 H new ATOM 2149 N SER A 138 7.623 -25.766 -21.891 1.00 0.00 N ATOM 2150 CA SER A 138 6.173 -25.708 -21.937 1.00 0.00 C ATOM 2151 C SER A 138 5.567 -25.388 -20.569 1.00 0.00 C ATOM 2152 O SER A 138 4.348 -25.427 -20.407 1.00 0.00 O ATOM 2153 CB SER A 138 5.610 -27.032 -22.455 1.00 0.00 C ATOM 2154 OG SER A 138 5.778 -28.067 -21.501 1.00 0.00 O ATOM 0 H SER A 138 8.000 -26.674 -21.620 1.00 0.00 H new ATOM 0 HA SER A 138 5.901 -24.901 -22.617 1.00 0.00 H new ATOM 0 HB2 SER A 138 4.551 -26.915 -22.686 1.00 0.00 H new ATOM 0 HB3 SER A 138 6.111 -27.305 -23.384 1.00 0.00 H new ATOM 0 HG SER A 138 5.408 -28.902 -21.856 1.00 0.00 H new ATOM 2160 N ASP A 139 6.410 -25.082 -19.583 1.00 0.00 N ATOM 2161 CA ASP A 139 5.922 -24.776 -18.247 1.00 0.00 C ATOM 2162 C ASP A 139 6.439 -23.443 -17.736 1.00 0.00 C ATOM 2163 O ASP A 139 6.613 -23.248 -16.535 1.00 0.00 O ATOM 2164 CB ASP A 139 6.305 -25.881 -17.277 1.00 0.00 C ATOM 2165 CG ASP A 139 5.446 -25.875 -16.027 1.00 0.00 C ATOM 2166 OD1 ASP A 139 4.355 -26.484 -16.053 1.00 0.00 O ATOM 2167 OD2 ASP A 139 5.864 -25.262 -15.022 1.00 0.00 O ATOM 0 H ASP A 139 7.424 -25.041 -19.686 1.00 0.00 H new ATOM 0 HA ASP A 139 4.836 -24.706 -18.313 1.00 0.00 H new ATOM 0 HB2 ASP A 139 6.211 -26.846 -17.775 1.00 0.00 H new ATOM 0 HB3 ASP A 139 7.352 -25.767 -16.996 1.00 0.00 H new ATOM 2172 N ILE A 140 6.664 -22.531 -18.656 1.00 0.00 N ATOM 2173 CA ILE A 140 7.143 -21.204 -18.322 1.00 0.00 C ATOM 2174 C ILE A 140 6.045 -20.162 -18.486 1.00 0.00 C ATOM 2175 O ILE A 140 5.248 -20.209 -19.423 1.00 0.00 O ATOM 2176 CB ILE A 140 8.362 -20.780 -19.160 1.00 0.00 C ATOM 2177 CG1 ILE A 140 9.549 -21.706 -18.894 1.00 0.00 C ATOM 2178 CG2 ILE A 140 8.746 -19.339 -18.854 1.00 0.00 C ATOM 2179 CD1 ILE A 140 10.478 -21.856 -20.078 1.00 0.00 C ATOM 0 H ILE A 140 6.521 -22.686 -19.654 1.00 0.00 H new ATOM 0 HA ILE A 140 7.450 -21.257 -17.277 1.00 0.00 H new ATOM 0 HB ILE A 140 8.091 -20.855 -20.213 1.00 0.00 H new ATOM 0 HG12 ILE A 140 10.115 -21.322 -18.045 1.00 0.00 H new ATOM 0 HG13 ILE A 140 9.175 -22.690 -18.609 1.00 0.00 H new ATOM 0 HG21 ILE A 140 9.610 -19.057 -19.456 1.00 0.00 H new ATOM 0 HG22 ILE A 140 7.909 -18.682 -19.090 1.00 0.00 H new ATOM 0 HG23 ILE A 140 8.994 -19.245 -17.797 1.00 0.00 H new ATOM 0 HD11 ILE A 140 11.296 -22.527 -19.816 1.00 0.00 H new ATOM 0 HD12 ILE A 140 9.927 -22.269 -20.923 1.00 0.00 H new ATOM 0 HD13 ILE A 140 10.881 -20.881 -20.350 1.00 0.00 H new ATOM 2191 N LEU A 141 6.028 -19.224 -17.560 1.00 0.00 N ATOM 2192 CA LEU A 141 5.052 -18.140 -17.557 1.00 0.00 C ATOM 2193 C LEU A 141 5.766 -16.795 -17.636 1.00 0.00 C ATOM 2194 O LEU A 141 6.769 -16.582 -16.958 1.00 0.00 O ATOM 2195 CB LEU A 141 4.190 -18.205 -16.295 1.00 0.00 C ATOM 2196 CG LEU A 141 2.887 -18.994 -16.440 1.00 0.00 C ATOM 2197 CD1 LEU A 141 2.082 -18.483 -17.625 1.00 0.00 C ATOM 2198 CD2 LEU A 141 3.179 -20.478 -16.592 1.00 0.00 C ATOM 0 H LEU A 141 6.690 -19.187 -16.785 1.00 0.00 H new ATOM 0 HA LEU A 141 4.405 -18.249 -18.427 1.00 0.00 H new ATOM 0 HB2 LEU A 141 4.779 -18.651 -15.494 1.00 0.00 H new ATOM 0 HB3 LEU A 141 3.949 -17.188 -15.986 1.00 0.00 H new ATOM 0 HG LEU A 141 2.294 -18.850 -15.536 1.00 0.00 H new ATOM 0 HD11 LEU A 141 1.159 -19.056 -17.712 1.00 0.00 H new ATOM 0 HD12 LEU A 141 1.843 -17.430 -17.475 1.00 0.00 H new ATOM 0 HD13 LEU A 141 2.667 -18.596 -18.538 1.00 0.00 H new ATOM 0 HD21 LEU A 141 2.242 -21.025 -16.694 1.00 0.00 H new ATOM 0 HD22 LEU A 141 3.791 -20.639 -17.479 1.00 0.00 H new ATOM 0 HD23 LEU A 141 3.714 -20.836 -15.712 1.00 0.00 H new ATOM 2210 N SER A 142 5.270 -15.896 -18.478 1.00 0.00 N ATOM 2211 CA SER A 142 5.901 -14.591 -18.639 1.00 0.00 C ATOM 2212 C SER A 142 4.942 -13.432 -18.410 1.00 0.00 C ATOM 2213 O SER A 142 3.738 -13.533 -18.633 1.00 0.00 O ATOM 2214 CB SER A 142 6.521 -14.459 -20.015 1.00 0.00 C ATOM 2215 OG SER A 142 7.799 -15.066 -20.070 1.00 0.00 O ATOM 0 H SER A 142 4.442 -16.044 -19.054 1.00 0.00 H new ATOM 0 HA SER A 142 6.674 -14.537 -17.873 1.00 0.00 H new ATOM 0 HB2 SER A 142 5.867 -14.919 -20.755 1.00 0.00 H new ATOM 0 HB3 SER A 142 6.607 -13.404 -20.277 1.00 0.00 H new ATOM 0 HG SER A 142 8.382 -14.662 -19.394 1.00 0.00 H new ATOM 2221 N LEU A 143 5.520 -12.324 -17.982 1.00 0.00 N ATOM 2222 CA LEU A 143 4.785 -11.093 -17.725 1.00 0.00 C ATOM 2223 C LEU A 143 5.426 -9.958 -18.513 1.00 0.00 C ATOM 2224 O LEU A 143 6.639 -9.954 -18.709 1.00 0.00 O ATOM 2225 CB LEU A 143 4.801 -10.764 -16.230 1.00 0.00 C ATOM 2226 CG LEU A 143 3.774 -11.512 -15.377 1.00 0.00 C ATOM 2227 CD1 LEU A 143 3.782 -12.998 -15.699 1.00 0.00 C ATOM 2228 CD2 LEU A 143 4.056 -11.289 -13.902 1.00 0.00 C ATOM 0 H LEU A 143 6.521 -12.250 -17.801 1.00 0.00 H new ATOM 0 HA LEU A 143 3.749 -11.220 -18.038 1.00 0.00 H new ATOM 0 HB2 LEU A 143 5.796 -10.978 -15.840 1.00 0.00 H new ATOM 0 HB3 LEU A 143 4.635 -9.693 -16.110 1.00 0.00 H new ATOM 0 HG LEU A 143 2.784 -11.120 -15.609 1.00 0.00 H new ATOM 0 HD11 LEU A 143 3.044 -13.508 -15.080 1.00 0.00 H new ATOM 0 HD12 LEU A 143 3.537 -13.144 -16.751 1.00 0.00 H new ATOM 0 HD13 LEU A 143 4.771 -13.409 -15.497 1.00 0.00 H new ATOM 0 HD21 LEU A 143 3.319 -11.826 -13.305 1.00 0.00 H new ATOM 0 HD22 LEU A 143 5.054 -11.657 -13.663 1.00 0.00 H new ATOM 0 HD23 LEU A 143 3.998 -10.224 -13.677 1.00 0.00 H new ATOM 2240 N VAL A 144 4.627 -9.007 -18.980 1.00 0.00 N ATOM 2241 CA VAL A 144 5.161 -7.900 -19.759 1.00 0.00 C ATOM 2242 C VAL A 144 4.656 -6.557 -19.252 1.00 0.00 C ATOM 2243 O VAL A 144 3.489 -6.418 -18.891 1.00 0.00 O ATOM 2244 CB VAL A 144 4.790 -8.046 -21.243 1.00 0.00 C ATOM 2245 CG1 VAL A 144 5.507 -7.000 -22.082 1.00 0.00 C ATOM 2246 CG2 VAL A 144 5.110 -9.450 -21.738 1.00 0.00 C ATOM 0 H VAL A 144 3.618 -8.980 -18.835 1.00 0.00 H new ATOM 0 HA VAL A 144 6.245 -7.931 -19.647 1.00 0.00 H new ATOM 0 HB VAL A 144 3.717 -7.884 -21.346 1.00 0.00 H new ATOM 0 HG11 VAL A 144 5.230 -7.121 -23.129 1.00 0.00 H new ATOM 0 HG12 VAL A 144 5.221 -6.004 -21.744 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.585 -7.124 -21.975 1.00 0.00 H new ATOM 0 HG21 VAL A 144 4.841 -9.535 -22.791 1.00 0.00 H new ATOM 0 HG22 VAL A 144 6.176 -9.643 -21.619 1.00 0.00 H new ATOM 0 HG23 VAL A 144 4.543 -10.178 -21.159 1.00 0.00 H new ATOM 2256 N ILE A 145 5.542 -5.567 -19.235 1.00 0.00 N ATOM 2257 CA ILE A 145 5.185 -4.230 -18.782 1.00 0.00 C ATOM 2258 C ILE A 145 5.187 -3.245 -19.949 1.00 0.00 C ATOM 2259 O ILE A 145 6.059 -3.292 -20.815 1.00 0.00 O ATOM 2260 CB ILE A 145 6.135 -3.735 -17.664 1.00 0.00 C ATOM 2261 CG1 ILE A 145 5.327 -3.134 -16.513 1.00 0.00 C ATOM 2262 CG2 ILE A 145 7.138 -2.720 -18.195 1.00 0.00 C ATOM 2263 CD1 ILE A 145 6.097 -3.052 -15.212 1.00 0.00 C ATOM 0 H ILE A 145 6.513 -5.667 -19.530 1.00 0.00 H new ATOM 0 HA ILE A 145 4.178 -4.284 -18.368 1.00 0.00 H new ATOM 0 HB ILE A 145 6.696 -4.594 -17.295 1.00 0.00 H new ATOM 0 HG12 ILE A 145 4.997 -2.134 -16.794 1.00 0.00 H new ATOM 0 HG13 ILE A 145 4.430 -3.733 -16.358 1.00 0.00 H new ATOM 0 HG21 ILE A 145 7.789 -2.393 -17.384 1.00 0.00 H new ATOM 0 HG22 ILE A 145 7.739 -3.179 -18.980 1.00 0.00 H new ATOM 0 HG23 ILE A 145 6.605 -1.860 -18.601 1.00 0.00 H new ATOM 0 HD11 ILE A 145 5.462 -2.616 -14.440 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.404 -4.053 -14.907 1.00 0.00 H new ATOM 0 HD13 ILE A 145 6.980 -2.428 -15.351 1.00 0.00 H new ATOM 2275 N PHE A 146 4.204 -2.354 -19.960 1.00 0.00 N ATOM 2276 CA PHE A 146 4.086 -1.355 -21.016 1.00 0.00 C ATOM 2277 C PHE A 146 4.176 0.053 -20.438 1.00 0.00 C ATOM 2278 O PHE A 146 3.226 0.549 -19.833 1.00 0.00 O ATOM 2279 CB PHE A 146 2.764 -1.527 -21.765 1.00 0.00 C ATOM 2280 CG PHE A 146 2.602 -0.581 -22.920 1.00 0.00 C ATOM 2281 CD1 PHE A 146 3.505 -0.588 -23.972 1.00 0.00 C ATOM 2282 CD2 PHE A 146 1.546 0.316 -22.955 1.00 0.00 C ATOM 2283 CE1 PHE A 146 3.359 0.281 -25.035 1.00 0.00 C ATOM 2284 CE2 PHE A 146 1.395 1.189 -24.016 1.00 0.00 C ATOM 2285 CZ PHE A 146 2.303 1.170 -25.058 1.00 0.00 C ATOM 0 H PHE A 146 3.475 -2.302 -19.248 1.00 0.00 H new ATOM 0 HA PHE A 146 4.911 -1.498 -21.714 1.00 0.00 H new ATOM 0 HB2 PHE A 146 2.694 -2.551 -22.132 1.00 0.00 H new ATOM 0 HB3 PHE A 146 1.939 -1.381 -21.068 1.00 0.00 H new ATOM 0 HD1 PHE A 146 4.333 -1.282 -23.960 1.00 0.00 H new ATOM 0 HD2 PHE A 146 0.833 0.333 -22.144 1.00 0.00 H new ATOM 0 HE1 PHE A 146 4.070 0.265 -25.848 1.00 0.00 H new ATOM 0 HE2 PHE A 146 0.569 1.885 -24.031 1.00 0.00 H new ATOM 0 HZ PHE A 146 2.187 1.850 -25.889 1.00 0.00 H new ATOM 2295 N ILE A 147 5.325 0.689 -20.628 1.00 0.00 N ATOM 2296 CA ILE A 147 5.544 2.038 -20.126 1.00 0.00 C ATOM 2297 C ILE A 147 5.321 3.077 -21.219 1.00 0.00 C ATOM 2298 O ILE A 147 5.866 2.964 -22.316 1.00 0.00 O ATOM 2299 CB ILE A 147 6.960 2.204 -19.563 1.00 0.00 C ATOM 2300 CG1 ILE A 147 7.368 0.969 -18.754 1.00 0.00 C ATOM 2301 CG2 ILE A 147 7.050 3.460 -18.712 1.00 0.00 C ATOM 2302 CD1 ILE A 147 8.505 0.189 -19.377 1.00 0.00 C ATOM 0 H ILE A 147 6.120 0.291 -21.127 1.00 0.00 H new ATOM 0 HA ILE A 147 4.821 2.196 -19.325 1.00 0.00 H new ATOM 0 HB ILE A 147 7.653 2.306 -20.398 1.00 0.00 H new ATOM 0 HG12 ILE A 147 7.659 1.281 -17.751 1.00 0.00 H new ATOM 0 HG13 ILE A 147 6.504 0.313 -18.646 1.00 0.00 H new ATOM 0 HG21 ILE A 147 8.062 3.562 -18.320 1.00 0.00 H new ATOM 0 HG22 ILE A 147 6.807 4.331 -19.321 1.00 0.00 H new ATOM 0 HG23 ILE A 147 6.346 3.389 -17.883 1.00 0.00 H new ATOM 0 HD11 ILE A 147 8.741 -0.672 -18.751 1.00 0.00 H new ATOM 0 HD12 ILE A 147 8.211 -0.153 -20.369 1.00 0.00 H new ATOM 0 HD13 ILE A 147 9.383 0.829 -19.460 1.00 0.00 H new ATOM 2314 N ASN A 148 4.517 4.088 -20.911 1.00 0.00 N ATOM 2315 CA ASN A 148 4.224 5.147 -21.872 1.00 0.00 C ATOM 2316 C ASN A 148 5.321 6.207 -21.867 1.00 0.00 C ATOM 2317 O ASN A 148 5.749 6.667 -20.809 1.00 0.00 O ATOM 2318 CB ASN A 148 2.872 5.792 -21.559 1.00 0.00 C ATOM 2319 CG ASN A 148 2.865 6.507 -20.222 1.00 0.00 C ATOM 2320 OD1 ASN A 148 3.397 7.609 -20.092 1.00 0.00 O ATOM 2321 ND2 ASN A 148 2.260 5.881 -19.220 1.00 0.00 N ATOM 0 H ASN A 148 4.057 4.198 -20.007 1.00 0.00 H new ATOM 0 HA ASN A 148 4.182 4.699 -22.865 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.620 6.501 -22.348 1.00 0.00 H new ATOM 0 HB3 ASN A 148 2.098 5.025 -21.561 1.00 0.00 H new ATOM 0 HD21 ASN A 148 2.223 6.313 -18.297 1.00 0.00 H new ATOM 0 HD22 ASN A 148 1.832 4.968 -19.373 1.00 0.00 H new ATOM 2328 N ASP A 149 5.772 6.590 -23.057 1.00 0.00 N ATOM 2329 CA ASP A 149 6.819 7.597 -23.190 1.00 0.00 C ATOM 2330 C ASP A 149 6.321 8.970 -22.748 1.00 0.00 C ATOM 2331 O ASP A 149 7.116 9.852 -22.423 1.00 0.00 O ATOM 2332 CB ASP A 149 7.313 7.660 -24.638 1.00 0.00 C ATOM 2333 CG ASP A 149 8.622 6.921 -24.834 1.00 0.00 C ATOM 2334 OD1 ASP A 149 9.543 7.115 -24.011 1.00 0.00 O ATOM 2335 OD2 ASP A 149 8.728 6.149 -25.809 1.00 0.00 O ATOM 0 H ASP A 149 5.429 6.219 -23.943 1.00 0.00 H new ATOM 0 HA ASP A 149 7.647 7.309 -22.542 1.00 0.00 H new ATOM 0 HB2 ASP A 149 6.556 7.234 -25.296 1.00 0.00 H new ATOM 0 HB3 ASP A 149 7.440 8.702 -24.931 1.00 0.00 H new ATOM 2340 N LYS A 150 5.001 9.146 -22.735 1.00 0.00 N ATOM 2341 CA LYS A 150 4.405 10.411 -22.331 1.00 0.00 C ATOM 2342 C LYS A 150 4.840 10.782 -20.919 1.00 0.00 C ATOM 2343 O LYS A 150 5.171 11.935 -20.641 1.00 0.00 O ATOM 2344 CB LYS A 150 2.878 10.325 -22.405 1.00 0.00 C ATOM 2345 CG LYS A 150 2.291 11.000 -23.635 1.00 0.00 C ATOM 2346 CD LYS A 150 2.447 10.133 -24.875 1.00 0.00 C ATOM 2347 CE LYS A 150 1.164 10.091 -25.691 1.00 0.00 C ATOM 2348 NZ LYS A 150 0.369 8.864 -25.412 1.00 0.00 N ATOM 0 H LYS A 150 4.327 8.427 -23.000 1.00 0.00 H new ATOM 0 HA LYS A 150 4.749 11.187 -23.015 1.00 0.00 H new ATOM 0 HB2 LYS A 150 2.580 9.276 -22.399 1.00 0.00 H new ATOM 0 HB3 LYS A 150 2.453 10.782 -21.512 1.00 0.00 H new ATOM 0 HG2 LYS A 150 1.235 11.210 -23.467 1.00 0.00 H new ATOM 0 HG3 LYS A 150 2.784 11.959 -23.796 1.00 0.00 H new ATOM 0 HD2 LYS A 150 3.259 10.520 -25.491 1.00 0.00 H new ATOM 0 HD3 LYS A 150 2.725 9.121 -24.580 1.00 0.00 H new ATOM 0 HE2 LYS A 150 0.562 10.972 -25.467 1.00 0.00 H new ATOM 0 HE3 LYS A 150 1.407 10.132 -26.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -0.497 8.873 -25.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 0.933 8.023 -25.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 0.115 8.837 -24.404 1.00 0.00 H new ATOM 2362 N PHE A 151 4.838 9.794 -20.031 1.00 0.00 N ATOM 2363 CA PHE A 151 5.234 10.009 -18.647 1.00 0.00 C ATOM 2364 C PHE A 151 6.668 10.521 -18.567 1.00 0.00 C ATOM 2365 O PHE A 151 6.965 11.455 -17.821 1.00 0.00 O ATOM 2366 CB PHE A 151 5.099 8.711 -17.850 1.00 0.00 C ATOM 2367 CG PHE A 151 5.144 8.912 -16.362 1.00 0.00 C ATOM 2368 CD1 PHE A 151 6.339 9.204 -15.725 1.00 0.00 C ATOM 2369 CD2 PHE A 151 3.990 8.809 -15.602 1.00 0.00 C ATOM 2370 CE1 PHE A 151 6.382 9.390 -14.356 1.00 0.00 C ATOM 2371 CE2 PHE A 151 4.028 8.993 -14.233 1.00 0.00 C ATOM 2372 CZ PHE A 151 5.225 9.284 -13.609 1.00 0.00 C ATOM 0 H PHE A 151 4.566 8.835 -20.247 1.00 0.00 H new ATOM 0 HA PHE A 151 4.573 10.762 -18.217 1.00 0.00 H new ATOM 0 HB2 PHE A 151 4.158 8.228 -18.115 1.00 0.00 H new ATOM 0 HB3 PHE A 151 5.900 8.031 -18.141 1.00 0.00 H new ATOM 0 HD1 PHE A 151 7.247 9.287 -16.304 1.00 0.00 H new ATOM 0 HD2 PHE A 151 3.051 8.582 -16.085 1.00 0.00 H new ATOM 0 HE1 PHE A 151 7.320 9.618 -13.871 1.00 0.00 H new ATOM 0 HE2 PHE A 151 3.122 8.909 -13.651 1.00 0.00 H new ATOM 0 HZ PHE A 151 5.256 9.428 -12.539 1.00 0.00 H new