USER MOD reduce.3.24.130724 H: found=0, std=0, add=1073, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1074 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 125 TYR OH : rot 180:sc= -0.0423 USER MOD Set 1.2: A 177 HIS : no HD1:sc= -1.31 K(o=-1.4,f=-2.1!) USER MOD Set 2.1: A 155 HIS : no HD1:sc= -0.326 X(o=0.57,f=0.82) USER MOD Set 2.2: A 159 THR OG1 : rot 67:sc= 0.895 USER MOD Set 3.1: A 148 MET CE :methyl -164:sc= -0.439 (180deg=-0.81) USER MOD Set 3.2: A 156 CYS SG : rot 25:sc= -2.82! USER MOD Set 4.1: A 91 CYS SG : rot -160:sc= -1.02! USER MOD Set 4.2: A 93 THR OG1 : rot 95:sc= -0.227 USER MOD Set 5.1: A 87 TYR OH : rot 123:sc= 0.0156 USER MOD Set 5.2: A 114 HIS : no HE2:sc= -1.61! C(o=-1.6!,f=-7!) USER MOD Set 6.1: A 67 HIS : no HD1:sc= -0.0991 K(o=-0.88,f=-2) USER MOD Set 6.2: A 98 CYS SG : rot -68:sc= -0.545! USER MOD Set 6.3: A 101 CYS SG : rot 164:sc= -0.231 USER MOD Single : A 31 CYS SG : rot 63:sc= 0.0375 USER MOD Single : A 32 TYR OH : rot 80:sc= -1.09 USER MOD Single : A 37 MET CE :methyl 159:sc= -1.66 (180deg=-3.49!) USER MOD Single : A 38 HIS : no HE2:sc= -2.22! C(o=-2.2!,f=-9.1!) USER MOD Single : A 39 ASN : amide:sc= -3.06! C(o=-3.1!,f=-6.4!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.00931 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -6.79! C(o=-6.8!,f=-10!) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= -0.389 USER MOD Single : A 96 SER OG : rot 180:sc= -3.27! USER MOD Single : A 100 SER OG : rot 91:sc= -0.0921! USER MOD Single : A 103 GLN :FLIP amide:sc=-0.00795 F(o=-1.4!,f=-0.008) USER MOD Single : A 105 MET CE :methyl -136:sc= -4.41! (180deg=-10.9!) USER MOD Single : A 107 LYS NZ :NH3+ 158:sc= -0.0376 (180deg=-0.402) USER MOD Single : A 110 SER OG : rot 180:sc= -0.577 USER MOD Single : A 111 LYS NZ :NH3+ -107:sc= -0.299 (180deg=-0.98) USER MOD Single : A 112 ASN : amide:sc= -0.0122 X(o=-0.012,f=-0.27) USER MOD Single : A 113 LYS NZ :NH3+ 150:sc= -0.303 (180deg=-1.83!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 CYS SG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot -170:sc= -0.135 USER MOD Single : A 132 GLN :FLIP amide:sc= -2.85! C(o=-7.2!,f=-2.9!) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ -147:sc= -2.07! (180deg=-2.76!) USER MOD Single : A 146 SER OG : rot 152:sc= -2.67! USER MOD Single : A 149 THR OG1 : rot 180:sc= 0.0575 USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -133:sc= -0.218 (180deg=-1.5!) USER MOD Single : A 163 HIS : no HD1:sc= -4.45! C(o=-4.4!,f=-4.8!) USER MOD Single : A 164 GLN : amide:sc=-0.00377 K(o=-0.0038,f=-0.99) USER MOD Single : A 166 CYS SG : rot 173:sc= 1.11 USER MOD Single : A 169 GLN : amide:sc= -0.0506 K(o=-0.051,f=-2!) USER MOD Single : A 178 SER OG : rot -160:sc= -0.441 USER MOD Single : A 179 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 182 SER OG : rot -63:sc= 0.69 USER MOD Single : A 190 GLN :FLIP amide:sc= -0.0104 F(o=-0.68,f=-0.01) USER MOD Single : A 191 ASN : amide:sc= -6.05! C(o=-6.1!,f=-11!) USER MOD Single : A 192 GLN : amide:sc= -1.41 K(o=-1.4,f=-1.9) USER MOD Single : A 194 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 489 N LEU A 30 3.885 -4.571 -5.266 1.00 0.00 N ATOM 490 CA LEU A 30 3.579 -3.851 -4.034 1.00 0.00 C ATOM 491 C LEU A 30 3.379 -4.833 -2.884 1.00 0.00 C ATOM 492 O LEU A 30 3.059 -5.999 -3.112 1.00 0.00 O ATOM 493 CB LEU A 30 2.306 -3.020 -4.233 1.00 0.00 C ATOM 494 CG LEU A 30 1.066 -3.941 -4.249 1.00 0.00 C ATOM 495 CD1 LEU A 30 0.360 -3.905 -2.885 1.00 0.00 C ATOM 496 CD2 LEU A 30 0.088 -3.472 -5.332 1.00 0.00 C ATOM 0 HA LEU A 30 4.412 -3.192 -3.790 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.213 -2.286 -3.432 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.368 -2.465 -5.169 1.00 0.00 H new ATOM 0 HG LEU A 30 1.391 -4.960 -4.460 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.512 -4.558 -2.909 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.047 -4.246 -2.111 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.044 -2.885 -2.666 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.785 -4.124 -5.340 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -0.225 -2.449 -5.122 1.00 0.00 H new ATOM 0 HD23 LEU A 30 0.578 -3.509 -6.305 1.00 0.00 H new ATOM 508 N CYS A 31 3.552 -4.365 -1.643 1.00 0.00 N ATOM 509 CA CYS A 31 3.366 -5.237 -0.487 1.00 0.00 C ATOM 510 C CYS A 31 2.132 -4.788 0.289 1.00 0.00 C ATOM 511 O CYS A 31 1.807 -3.601 0.307 1.00 0.00 O ATOM 512 CB CYS A 31 4.617 -5.216 0.409 1.00 0.00 C ATOM 513 SG CYS A 31 5.942 -4.306 -0.423 1.00 0.00 S ATOM 0 H CYS A 31 3.815 -3.405 -1.419 1.00 0.00 H new ATOM 0 HA CYS A 31 3.217 -6.262 -0.826 1.00 0.00 H new ATOM 0 HB2 CYS A 31 4.384 -4.747 1.365 1.00 0.00 H new ATOM 0 HB3 CYS A 31 4.940 -6.235 0.624 1.00 0.00 H new ATOM 0 HG CYS A 31 5.581 -3.068 -0.589 1.00 0.00 H new ATOM 519 N TYR A 32 1.438 -5.732 0.919 1.00 0.00 N ATOM 520 CA TYR A 32 0.242 -5.388 1.673 1.00 0.00 C ATOM 521 C TYR A 32 0.086 -6.327 2.863 1.00 0.00 C ATOM 522 O TYR A 32 0.229 -7.542 2.738 1.00 0.00 O ATOM 523 CB TYR A 32 -0.997 -5.437 0.748 1.00 0.00 C ATOM 524 CG TYR A 32 -1.889 -6.612 1.087 1.00 0.00 C ATOM 525 CD1 TYR A 32 -1.534 -7.900 0.677 1.00 0.00 C ATOM 526 CD2 TYR A 32 -3.067 -6.406 1.814 1.00 0.00 C ATOM 527 CE1 TYR A 32 -2.358 -8.986 0.993 1.00 0.00 C ATOM 528 CE2 TYR A 32 -3.891 -7.491 2.130 1.00 0.00 C ATOM 529 CZ TYR A 32 -3.536 -8.783 1.720 1.00 0.00 C ATOM 530 OH TYR A 32 -4.349 -9.855 2.030 1.00 0.00 O ATOM 0 H TYR A 32 1.679 -6.723 0.922 1.00 0.00 H new ATOM 0 HA TYR A 32 0.335 -4.373 2.058 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -1.562 -4.509 0.843 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -0.675 -5.509 -0.291 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -0.624 -8.057 0.117 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -3.340 -5.410 2.131 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -2.084 -9.981 0.676 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -4.801 -7.333 2.690 1.00 0.00 H new ATOM 0 HH TYR A 32 -3.982 -10.331 2.804 1.00 0.00 H new ATOM 540 N GLU A 33 -0.186 -5.742 4.015 1.00 0.00 N ATOM 541 CA GLU A 33 -0.343 -6.499 5.238 1.00 0.00 C ATOM 542 C GLU A 33 -1.694 -6.204 5.874 1.00 0.00 C ATOM 543 O GLU A 33 -2.016 -5.054 6.161 1.00 0.00 O ATOM 544 CB GLU A 33 0.790 -6.096 6.173 1.00 0.00 C ATOM 545 CG GLU A 33 2.100 -6.686 5.644 1.00 0.00 C ATOM 546 CD GLU A 33 3.181 -6.604 6.716 1.00 0.00 C ATOM 547 OE1 GLU A 33 2.976 -7.165 7.781 1.00 0.00 O ATOM 548 OE2 GLU A 33 4.198 -5.980 6.459 1.00 0.00 O ATOM 0 H GLU A 33 -0.303 -4.735 4.127 1.00 0.00 H new ATOM 0 HA GLU A 33 -0.305 -7.569 5.035 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.862 -5.010 6.232 1.00 0.00 H new ATOM 0 HB3 GLU A 33 0.593 -6.458 7.182 1.00 0.00 H new ATOM 0 HG2 GLU A 33 1.947 -7.724 5.349 1.00 0.00 H new ATOM 0 HG3 GLU A 33 2.418 -6.145 4.753 1.00 0.00 H new ATOM 555 N VAL A 34 -2.493 -7.249 6.085 1.00 0.00 N ATOM 556 CA VAL A 34 -3.815 -7.071 6.680 1.00 0.00 C ATOM 557 C VAL A 34 -4.022 -7.993 7.867 1.00 0.00 C ATOM 558 O VAL A 34 -3.384 -9.039 7.978 1.00 0.00 O ATOM 559 CB VAL A 34 -4.909 -7.358 5.649 1.00 0.00 C ATOM 560 CG1 VAL A 34 -4.699 -8.746 5.040 1.00 0.00 C ATOM 561 CG2 VAL A 34 -6.275 -7.308 6.349 1.00 0.00 C ATOM 0 H VAL A 34 -2.253 -8.214 5.857 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.876 -6.036 7.017 1.00 0.00 H new ATOM 0 HB VAL A 34 -4.868 -6.612 4.855 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -5.481 -8.944 4.307 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -3.725 -8.785 4.551 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -4.741 -9.499 5.827 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -7.063 -7.511 5.624 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.307 -8.058 7.139 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -6.426 -6.319 6.782 1.00 0.00 H new ATOM 571 N GLU A 35 -4.944 -7.601 8.741 1.00 0.00 N ATOM 572 CA GLU A 35 -5.269 -8.401 9.910 1.00 0.00 C ATOM 573 C GLU A 35 -6.782 -8.466 10.085 1.00 0.00 C ATOM 574 O GLU A 35 -7.497 -7.522 9.744 1.00 0.00 O ATOM 575 CB GLU A 35 -4.592 -7.820 11.166 1.00 0.00 C ATOM 576 CG GLU A 35 -5.537 -6.846 11.882 1.00 0.00 C ATOM 577 CD GLU A 35 -4.744 -5.908 12.789 1.00 0.00 C ATOM 578 OE1 GLU A 35 -3.545 -5.799 12.595 1.00 0.00 O ATOM 579 OE2 GLU A 35 -5.350 -5.314 13.666 1.00 0.00 O ATOM 0 H GLU A 35 -5.477 -6.735 8.659 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.892 -9.414 9.766 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -4.312 -8.628 11.842 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.673 -7.305 10.886 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -6.097 -6.266 11.148 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -6.266 -7.403 12.471 1.00 0.00 H new ATOM 586 N ARG A 36 -7.265 -9.584 10.609 1.00 0.00 N ATOM 587 CA ARG A 36 -8.697 -9.766 10.815 1.00 0.00 C ATOM 588 C ARG A 36 -9.047 -9.607 12.290 1.00 0.00 C ATOM 589 O ARG A 36 -8.346 -10.116 13.167 1.00 0.00 O ATOM 590 CB ARG A 36 -9.138 -11.158 10.326 1.00 0.00 C ATOM 591 CG ARG A 36 -8.149 -11.690 9.278 1.00 0.00 C ATOM 592 CD ARG A 36 -8.535 -13.121 8.871 1.00 0.00 C ATOM 593 NE ARG A 36 -7.643 -14.078 9.527 1.00 0.00 N ATOM 594 CZ ARG A 36 -8.100 -15.047 10.324 1.00 0.00 C ATOM 595 NH1 ARG A 36 -9.381 -15.191 10.545 1.00 0.00 N ATOM 596 NH2 ARG A 36 -7.255 -15.863 10.892 1.00 0.00 N ATOM 0 H ARG A 36 -6.690 -10.376 10.898 1.00 0.00 H new ATOM 0 HA ARG A 36 -9.223 -9.004 10.240 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -9.192 -11.847 11.169 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -10.138 -11.101 9.897 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -8.150 -11.041 8.402 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -7.137 -11.678 9.682 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -9.569 -13.322 9.151 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -8.470 -13.232 7.789 1.00 0.00 H new ATOM 0 HE ARG A 36 -6.638 -14.002 9.370 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -10.049 -14.557 10.106 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -9.712 -15.937 11.157 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -6.254 -15.758 10.726 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -7.595 -16.606 11.502 1.00 0.00 H new ATOM 610 N MET A 37 -10.140 -8.904 12.557 1.00 0.00 N ATOM 611 CA MET A 37 -10.579 -8.696 13.928 1.00 0.00 C ATOM 612 C MET A 37 -11.684 -9.672 14.276 1.00 0.00 C ATOM 613 O MET A 37 -12.521 -9.988 13.434 1.00 0.00 O ATOM 614 CB MET A 37 -11.099 -7.281 14.125 1.00 0.00 C ATOM 615 CG MET A 37 -9.988 -6.265 13.847 1.00 0.00 C ATOM 616 SD MET A 37 -10.499 -4.634 14.441 1.00 0.00 S ATOM 617 CE MET A 37 -10.670 -5.086 16.182 1.00 0.00 C ATOM 0 H MET A 37 -10.733 -8.472 11.849 1.00 0.00 H new ATOM 0 HA MET A 37 -9.720 -8.856 14.579 1.00 0.00 H new ATOM 0 HB2 MET A 37 -11.942 -7.100 13.459 1.00 0.00 H new ATOM 0 HB3 MET A 37 -11.466 -7.159 15.144 1.00 0.00 H new ATOM 0 HG2 MET A 37 -9.067 -6.572 14.343 1.00 0.00 H new ATOM 0 HG3 MET A 37 -9.776 -6.225 12.778 1.00 0.00 H new ATOM 0 HE1 MET A 37 -10.614 -4.189 16.798 1.00 0.00 H new ATOM 0 HE2 MET A 37 -11.632 -5.574 16.338 1.00 0.00 H new ATOM 0 HE3 MET A 37 -9.867 -5.768 16.461 1.00 0.00 H new ATOM 627 N HIS A 38 -11.694 -10.124 15.527 1.00 0.00 N ATOM 628 CA HIS A 38 -12.715 -11.050 15.995 1.00 0.00 C ATOM 629 C HIS A 38 -13.516 -10.373 17.084 1.00 0.00 C ATOM 630 O HIS A 38 -13.079 -10.287 18.225 1.00 0.00 O ATOM 631 CB HIS A 38 -12.066 -12.324 16.544 1.00 0.00 C ATOM 632 CG HIS A 38 -13.091 -13.127 17.297 1.00 0.00 C ATOM 633 ND1 HIS A 38 -13.723 -12.639 18.430 1.00 0.00 N ATOM 634 CD2 HIS A 38 -13.607 -14.382 17.090 1.00 0.00 C ATOM 635 CE1 HIS A 38 -14.577 -13.587 18.858 1.00 0.00 C ATOM 636 NE2 HIS A 38 -14.545 -14.670 18.076 1.00 0.00 N ATOM 0 H HIS A 38 -11.006 -9.863 16.233 1.00 0.00 H new ATOM 0 HA HIS A 38 -13.367 -11.326 15.166 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -11.654 -12.916 15.727 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -11.235 -12.067 17.202 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -13.569 -11.727 18.861 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.327 -15.045 16.284 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -15.210 -13.485 19.727 1.00 0.00 H new ATOM 645 N ASN A 39 -14.675 -9.862 16.734 1.00 0.00 N ATOM 646 CA ASN A 39 -15.479 -9.173 17.717 1.00 0.00 C ATOM 647 C ASN A 39 -14.758 -7.907 18.156 1.00 0.00 C ATOM 648 O ASN A 39 -13.896 -7.386 17.448 1.00 0.00 O ATOM 649 CB ASN A 39 -15.705 -10.073 18.937 1.00 0.00 C ATOM 650 CG ASN A 39 -16.925 -9.610 19.711 1.00 0.00 C ATOM 651 OD1 ASN A 39 -17.604 -8.665 19.305 1.00 0.00 O ATOM 652 ND2 ASN A 39 -17.248 -10.227 20.809 1.00 0.00 N ATOM 0 H ASN A 39 -15.075 -9.908 15.797 1.00 0.00 H new ATOM 0 HA ASN A 39 -16.443 -8.920 17.276 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -15.839 -11.106 18.616 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -14.826 -10.051 19.582 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -18.067 -9.930 21.339 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -16.682 -11.008 21.140 1.00 0.00 H new ATOM 659 N ASP A 40 -15.122 -7.427 19.326 1.00 0.00 N ATOM 660 CA ASP A 40 -14.528 -6.222 19.883 1.00 0.00 C ATOM 661 C ASP A 40 -13.006 -6.310 19.998 1.00 0.00 C ATOM 662 O ASP A 40 -12.402 -5.455 20.645 1.00 0.00 O ATOM 663 CB ASP A 40 -15.098 -5.975 21.277 1.00 0.00 C ATOM 664 CG ASP A 40 -16.492 -5.368 21.176 1.00 0.00 C ATOM 665 OD1 ASP A 40 -17.042 -5.374 20.087 1.00 0.00 O ATOM 666 OD2 ASP A 40 -16.989 -4.903 22.189 1.00 0.00 O ATOM 0 H ASP A 40 -15.834 -7.855 19.918 1.00 0.00 H new ATOM 0 HA ASP A 40 -14.769 -5.406 19.201 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -15.141 -6.912 21.832 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -14.441 -5.306 21.833 1.00 0.00 H new ATOM 671 N THR A 41 -12.369 -7.338 19.418 1.00 0.00 N ATOM 672 CA THR A 41 -10.925 -7.459 19.548 1.00 0.00 C ATOM 673 C THR A 41 -10.236 -7.715 18.219 1.00 0.00 C ATOM 674 O THR A 41 -10.881 -7.877 17.187 1.00 0.00 O ATOM 675 CB THR A 41 -10.603 -8.542 20.565 1.00 0.00 C ATOM 676 OG1 THR A 41 -9.343 -8.269 21.162 1.00 0.00 O ATOM 677 CG2 THR A 41 -10.568 -9.918 19.902 1.00 0.00 C ATOM 0 H THR A 41 -12.821 -8.072 18.873 1.00 0.00 H new ATOM 0 HA THR A 41 -10.534 -6.505 19.901 1.00 0.00 H new ATOM 0 HB THR A 41 -11.382 -8.546 21.327 1.00 0.00 H new ATOM 0 HG1 THR A 41 -9.135 -8.965 21.819 1.00 0.00 H new ATOM 0 HG21 THR A 41 -10.336 -10.676 20.650 1.00 0.00 H new ATOM 0 HG22 THR A 41 -11.540 -10.132 19.457 1.00 0.00 H new ATOM 0 HG23 THR A 41 -9.803 -9.928 19.125 1.00 0.00 H new ATOM 685 N TRP A 42 -8.912 -7.710 18.270 1.00 0.00 N ATOM 686 CA TRP A 42 -8.090 -7.892 17.069 1.00 0.00 C ATOM 687 C TRP A 42 -7.359 -9.235 17.036 1.00 0.00 C ATOM 688 O TRP A 42 -7.033 -9.809 18.075 1.00 0.00 O ATOM 689 CB TRP A 42 -7.065 -6.753 16.982 1.00 0.00 C ATOM 690 CG TRP A 42 -5.896 -7.034 17.875 1.00 0.00 C ATOM 691 CD1 TRP A 42 -5.964 -7.620 19.094 1.00 0.00 C ATOM 692 CD2 TRP A 42 -4.487 -6.750 17.638 1.00 0.00 C ATOM 693 NE1 TRP A 42 -4.688 -7.708 19.618 1.00 0.00 N ATOM 694 CE2 TRP A 42 -3.747 -7.187 18.760 1.00 0.00 C ATOM 695 CE3 TRP A 42 -3.787 -6.158 16.572 1.00 0.00 C ATOM 696 CZ2 TRP A 42 -2.364 -7.048 18.824 1.00 0.00 C ATOM 697 CZ3 TRP A 42 -2.391 -6.016 16.632 1.00 0.00 C ATOM 698 CH2 TRP A 42 -1.680 -6.460 17.756 1.00 0.00 C ATOM 0 H TRP A 42 -8.377 -7.582 19.129 1.00 0.00 H new ATOM 0 HA TRP A 42 -8.766 -7.878 16.214 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -6.725 -6.639 15.953 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -7.533 -5.811 17.270 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -6.867 -7.962 19.577 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -4.470 -8.110 20.530 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -4.325 -5.811 15.703 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -1.823 -7.392 19.693 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -1.862 -5.562 15.807 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -0.607 -6.348 17.797 1.00 0.00 H new ATOM 709 N VAL A 43 -7.084 -9.710 15.816 1.00 0.00 N ATOM 710 CA VAL A 43 -6.365 -10.966 15.619 1.00 0.00 C ATOM 711 C VAL A 43 -5.233 -10.750 14.615 1.00 0.00 C ATOM 712 O VAL A 43 -5.357 -9.933 13.703 1.00 0.00 O ATOM 713 CB VAL A 43 -7.314 -12.049 15.102 1.00 0.00 C ATOM 714 CG1 VAL A 43 -6.803 -13.426 15.530 1.00 0.00 C ATOM 715 CG2 VAL A 43 -8.712 -11.820 15.682 1.00 0.00 C ATOM 0 H VAL A 43 -7.351 -9.240 14.951 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.952 -11.292 16.574 1.00 0.00 H new ATOM 0 HB VAL A 43 -7.359 -12.002 14.014 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.480 -14.196 15.161 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.808 -13.589 15.117 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.756 -13.475 16.618 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -9.389 -12.591 15.314 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -8.666 -11.866 16.770 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -9.077 -10.840 15.375 1.00 0.00 H new ATOM 1080 N ARG A 66 -6.742 -3.269 -10.749 1.00 0.00 N ATOM 1081 CA ARG A 66 -6.905 -3.111 -9.309 1.00 0.00 C ATOM 1082 C ARG A 66 -5.563 -2.817 -8.648 1.00 0.00 C ATOM 1083 O ARG A 66 -4.642 -3.632 -8.702 1.00 0.00 O ATOM 1084 CB ARG A 66 -7.498 -4.387 -8.708 1.00 0.00 C ATOM 1085 CG ARG A 66 -9.020 -4.362 -8.847 1.00 0.00 C ATOM 1086 CD ARG A 66 -9.574 -5.766 -8.612 1.00 0.00 C ATOM 1087 NE ARG A 66 -8.963 -6.710 -9.538 1.00 0.00 N ATOM 1088 CZ ARG A 66 -9.099 -8.021 -9.370 1.00 0.00 C ATOM 1089 NH1 ARG A 66 -9.775 -8.480 -8.354 1.00 0.00 N ATOM 1090 NH2 ARG A 66 -8.552 -8.849 -10.218 1.00 0.00 N ATOM 0 HA ARG A 66 -7.580 -2.274 -9.129 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -7.091 -5.262 -9.214 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -7.220 -4.469 -7.657 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -9.450 -3.664 -8.129 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -9.300 -4.010 -9.840 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -9.379 -6.075 -7.585 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -10.656 -5.765 -8.744 1.00 0.00 H new ATOM 0 HE ARG A 66 -8.422 -6.359 -10.328 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -10.199 -7.833 -7.689 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -9.880 -9.486 -8.224 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -8.020 -8.490 -11.010 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -8.657 -9.855 -10.088 1.00 0.00 H new ATOM 1104 N HIS A 67 -5.462 -1.652 -8.016 1.00 0.00 N ATOM 1105 CA HIS A 67 -4.232 -1.264 -7.340 1.00 0.00 C ATOM 1106 C HIS A 67 -4.309 -1.646 -5.861 1.00 0.00 C ATOM 1107 O HIS A 67 -5.388 -1.922 -5.341 1.00 0.00 O ATOM 1108 CB HIS A 67 -3.996 0.250 -7.524 1.00 0.00 C ATOM 1109 CG HIS A 67 -3.065 0.459 -8.696 1.00 0.00 C ATOM 1110 ND1 HIS A 67 -3.371 1.277 -9.794 1.00 0.00 N ATOM 1111 CD2 HIS A 67 -1.840 -0.096 -8.968 1.00 0.00 C ATOM 1112 CE1 HIS A 67 -2.335 1.162 -10.653 1.00 0.00 C ATOM 1113 NE2 HIS A 67 -1.386 0.346 -10.199 1.00 0.00 N ATOM 0 H HIS A 67 -6.213 -0.964 -7.959 1.00 0.00 H new ATOM 0 HA HIS A 67 -3.386 -1.794 -7.777 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -4.943 0.761 -7.698 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -3.565 0.678 -6.619 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -1.309 -0.776 -8.319 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -2.282 1.675 -11.602 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -0.510 0.099 -10.660 1.00 0.00 H new ATOM 1121 N ALA A 68 -3.150 -1.694 -5.207 1.00 0.00 N ATOM 1122 CA ALA A 68 -3.075 -2.077 -3.795 1.00 0.00 C ATOM 1123 C ALA A 68 -4.380 -1.772 -3.055 1.00 0.00 C ATOM 1124 O ALA A 68 -4.926 -2.622 -2.342 1.00 0.00 O ATOM 1125 CB ALA A 68 -1.927 -1.329 -3.124 1.00 0.00 C ATOM 0 H ALA A 68 -2.249 -1.473 -5.631 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.904 -3.153 -3.749 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.872 -1.614 -2.073 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -0.989 -1.582 -3.619 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -2.099 -0.255 -3.200 1.00 0.00 H new ATOM 1131 N GLU A 69 -4.864 -0.549 -3.235 1.00 0.00 N ATOM 1132 CA GLU A 69 -6.098 -0.103 -2.592 1.00 0.00 C ATOM 1133 C GLU A 69 -7.204 -1.154 -2.737 1.00 0.00 C ATOM 1134 O GLU A 69 -7.667 -1.731 -1.745 1.00 0.00 O ATOM 1135 CB GLU A 69 -6.551 1.247 -3.200 1.00 0.00 C ATOM 1136 CG GLU A 69 -5.610 1.649 -4.351 1.00 0.00 C ATOM 1137 CD GLU A 69 -4.251 2.061 -3.791 1.00 0.00 C ATOM 1138 OE1 GLU A 69 -4.202 2.456 -2.637 1.00 0.00 O ATOM 1139 OE2 GLU A 69 -3.280 1.978 -4.524 1.00 0.00 O ATOM 0 H GLU A 69 -4.420 0.156 -3.823 1.00 0.00 H new ATOM 0 HA GLU A 69 -5.903 0.034 -1.528 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.574 1.165 -3.568 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.550 2.020 -2.431 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.490 0.815 -5.043 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.045 2.473 -4.917 1.00 0.00 H new ATOM 1146 N LEU A 70 -7.629 -1.395 -3.972 1.00 0.00 N ATOM 1147 CA LEU A 70 -8.685 -2.368 -4.222 1.00 0.00 C ATOM 1148 C LEU A 70 -8.224 -3.766 -3.830 1.00 0.00 C ATOM 1149 O LEU A 70 -9.037 -4.635 -3.516 1.00 0.00 O ATOM 1150 CB LEU A 70 -9.104 -2.354 -5.693 1.00 0.00 C ATOM 1151 CG LEU A 70 -9.253 -0.905 -6.202 1.00 0.00 C ATOM 1152 CD1 LEU A 70 -10.006 -0.043 -5.171 1.00 0.00 C ATOM 1153 CD2 LEU A 70 -7.872 -0.287 -6.482 1.00 0.00 C ATOM 0 H LEU A 70 -7.264 -0.936 -4.807 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.546 -2.093 -3.613 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -8.362 -2.881 -6.293 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -10.048 -2.886 -5.813 1.00 0.00 H new ATOM 0 HG LEU A 70 -9.826 -0.930 -7.129 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -10.101 0.975 -5.548 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -10.998 -0.461 -5.002 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -9.452 -0.032 -4.232 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.997 0.735 -6.840 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.283 -0.281 -5.565 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.356 -0.877 -7.240 1.00 0.00 H new ATOM 1165 N CYS A 71 -6.912 -3.976 -3.858 1.00 0.00 N ATOM 1166 CA CYS A 71 -6.343 -5.279 -3.512 1.00 0.00 C ATOM 1167 C CYS A 71 -6.900 -5.805 -2.184 1.00 0.00 C ATOM 1168 O CYS A 71 -7.525 -6.871 -2.147 1.00 0.00 O ATOM 1169 CB CYS A 71 -4.813 -5.195 -3.450 1.00 0.00 C ATOM 1170 SG CYS A 71 -4.293 -4.353 -1.932 1.00 0.00 S ATOM 0 H CYS A 71 -6.224 -3.268 -4.115 1.00 0.00 H new ATOM 0 HA CYS A 71 -6.630 -5.982 -4.294 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -4.385 -6.197 -3.484 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -4.436 -4.658 -4.320 1.00 0.00 H new ATOM 1176 N PHE A 72 -6.701 -5.073 -1.089 1.00 0.00 N ATOM 1177 CA PHE A 72 -7.234 -5.555 0.181 1.00 0.00 C ATOM 1178 C PHE A 72 -8.742 -5.460 0.132 1.00 0.00 C ATOM 1179 O PHE A 72 -9.451 -6.390 0.498 1.00 0.00 O ATOM 1180 CB PHE A 72 -6.678 -4.788 1.384 1.00 0.00 C ATOM 1181 CG PHE A 72 -6.774 -3.299 1.168 1.00 0.00 C ATOM 1182 CD1 PHE A 72 -8.001 -2.638 1.324 1.00 0.00 C ATOM 1183 CD2 PHE A 72 -5.628 -2.573 0.824 1.00 0.00 C ATOM 1184 CE1 PHE A 72 -8.076 -1.262 1.130 1.00 0.00 C ATOM 1185 CE2 PHE A 72 -5.709 -1.197 0.634 1.00 0.00 C ATOM 1186 CZ PHE A 72 -6.931 -0.546 0.785 1.00 0.00 C ATOM 0 H PHE A 72 -6.199 -4.186 -1.053 1.00 0.00 H new ATOM 0 HA PHE A 72 -6.922 -6.591 0.317 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -7.229 -5.065 2.283 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -5.638 -5.069 1.549 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -8.886 -3.196 1.594 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -4.682 -3.080 0.706 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -9.020 -0.750 1.247 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -4.826 -0.635 0.370 1.00 0.00 H new ATOM 0 HZ PHE A 72 -6.992 0.522 0.634 1.00 0.00 H new ATOM 1196 N LEU A 73 -9.232 -4.348 -0.379 1.00 0.00 N ATOM 1197 CA LEU A 73 -10.658 -4.171 -0.532 1.00 0.00 C ATOM 1198 C LEU A 73 -11.278 -5.483 -1.007 1.00 0.00 C ATOM 1199 O LEU A 73 -12.454 -5.763 -0.772 1.00 0.00 O ATOM 1200 CB LEU A 73 -10.858 -3.092 -1.578 1.00 0.00 C ATOM 1201 CG LEU A 73 -12.139 -2.306 -1.315 1.00 0.00 C ATOM 1202 CD1 LEU A 73 -11.960 -1.398 -0.079 1.00 0.00 C ATOM 1203 CD2 LEU A 73 -12.433 -1.466 -2.560 1.00 0.00 C ATOM 0 H LEU A 73 -8.666 -3.559 -0.693 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.130 -3.887 0.409 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -10.004 -2.414 -1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -10.902 -3.545 -2.569 1.00 0.00 H new ATOM 0 HG LEU A 73 -12.970 -2.982 -1.113 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.880 -0.841 0.100 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.731 -2.011 0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.142 -0.700 -0.256 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.345 -0.891 -2.404 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -11.602 -0.785 -2.744 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.561 -2.123 -3.420 1.00 0.00 H new ATOM 1215 N ASP A 74 -10.451 -6.275 -1.690 1.00 0.00 N ATOM 1216 CA ASP A 74 -10.880 -7.562 -2.224 1.00 0.00 C ATOM 1217 C ASP A 74 -10.564 -8.709 -1.264 1.00 0.00 C ATOM 1218 O ASP A 74 -11.213 -9.750 -1.319 1.00 0.00 O ATOM 1219 CB ASP A 74 -10.195 -7.817 -3.568 1.00 0.00 C ATOM 1220 CG ASP A 74 -10.984 -8.848 -4.368 1.00 0.00 C ATOM 1221 OD1 ASP A 74 -11.190 -9.936 -3.855 1.00 0.00 O ATOM 1222 OD2 ASP A 74 -11.369 -8.536 -5.483 1.00 0.00 O ATOM 0 H ASP A 74 -9.477 -6.044 -1.886 1.00 0.00 H new ATOM 0 HA ASP A 74 -11.961 -7.523 -2.356 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -10.122 -6.886 -4.131 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -9.177 -8.172 -3.405 1.00 0.00 H new ATOM 1227 N VAL A 75 -9.569 -8.540 -0.387 1.00 0.00 N ATOM 1228 CA VAL A 75 -9.238 -9.613 0.538 1.00 0.00 C ATOM 1229 C VAL A 75 -10.276 -9.735 1.665 1.00 0.00 C ATOM 1230 O VAL A 75 -10.749 -10.811 1.969 1.00 0.00 O ATOM 1231 CB VAL A 75 -7.850 -9.424 1.148 1.00 0.00 C ATOM 1232 CG1 VAL A 75 -7.899 -8.450 2.328 1.00 0.00 C ATOM 1233 CG2 VAL A 75 -7.394 -10.782 1.644 1.00 0.00 C ATOM 0 H VAL A 75 -8.999 -7.698 -0.303 1.00 0.00 H new ATOM 0 HA VAL A 75 -9.245 -10.533 -0.046 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.168 -9.015 0.403 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.899 -8.333 2.745 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -8.266 -7.482 1.986 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.568 -8.841 3.095 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.403 -10.693 2.089 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.096 -11.151 2.392 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.355 -11.480 0.808 1.00 0.00 H new ATOM 1243 N ILE A 76 -10.609 -8.629 2.300 1.00 0.00 N ATOM 1244 CA ILE A 76 -11.583 -8.666 3.403 1.00 0.00 C ATOM 1245 C ILE A 76 -12.725 -9.666 3.113 1.00 0.00 C ATOM 1246 O ILE A 76 -12.995 -10.538 3.939 1.00 0.00 O ATOM 1247 CB ILE A 76 -12.169 -7.261 3.693 1.00 0.00 C ATOM 1248 CG1 ILE A 76 -11.264 -6.178 3.106 1.00 0.00 C ATOM 1249 CG2 ILE A 76 -12.289 -7.030 5.199 1.00 0.00 C ATOM 1250 CD1 ILE A 76 -9.922 -6.171 3.843 1.00 0.00 C ATOM 0 H ILE A 76 -10.235 -7.704 2.087 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.045 -9.002 4.289 1.00 0.00 H new ATOM 0 HB ILE A 76 -13.156 -7.209 3.234 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -11.105 -6.360 2.043 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -11.743 -5.203 3.194 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -12.702 -6.038 5.383 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -12.947 -7.784 5.631 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -11.303 -7.103 5.658 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -9.280 -5.398 3.422 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.089 -5.968 4.901 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.441 -7.143 3.732 1.00 0.00 H new ATOM 1262 N PRO A 77 -13.397 -9.577 1.975 1.00 0.00 N ATOM 1263 CA PRO A 77 -14.510 -10.515 1.624 1.00 0.00 C ATOM 1264 C PRO A 77 -13.980 -11.911 1.330 1.00 0.00 C ATOM 1265 O PRO A 77 -14.734 -12.834 1.026 1.00 0.00 O ATOM 1266 CB PRO A 77 -15.127 -9.883 0.375 1.00 0.00 C ATOM 1267 CG PRO A 77 -14.023 -9.127 -0.253 1.00 0.00 C ATOM 1268 CD PRO A 77 -13.183 -8.597 0.900 1.00 0.00 C ATOM 0 HA PRO A 77 -15.229 -10.643 2.433 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -15.519 -10.644 -0.300 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -15.958 -9.227 0.634 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -13.431 -9.768 -0.907 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -14.406 -8.311 -0.867 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -12.130 -8.527 0.628 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -13.502 -7.599 1.200 1.00 0.00 H new ATOM 1276 N PHE A 78 -12.667 -12.033 1.421 1.00 0.00 N ATOM 1277 CA PHE A 78 -11.982 -13.306 1.172 1.00 0.00 C ATOM 1278 C PHE A 78 -12.102 -14.226 2.383 1.00 0.00 C ATOM 1279 O PHE A 78 -12.340 -15.425 2.234 1.00 0.00 O ATOM 1280 CB PHE A 78 -10.507 -13.036 0.865 1.00 0.00 C ATOM 1281 CG PHE A 78 -9.867 -14.205 0.180 1.00 0.00 C ATOM 1282 CD1 PHE A 78 -10.305 -14.590 -1.085 1.00 0.00 C ATOM 1283 CD2 PHE A 78 -8.830 -14.896 0.813 1.00 0.00 C ATOM 1284 CE1 PHE A 78 -9.707 -15.681 -1.728 1.00 0.00 C ATOM 1285 CE2 PHE A 78 -8.228 -15.986 0.173 1.00 0.00 C ATOM 1286 CZ PHE A 78 -8.669 -16.381 -1.098 1.00 0.00 C ATOM 0 H PHE A 78 -12.043 -11.264 1.667 1.00 0.00 H new ATOM 0 HA PHE A 78 -12.449 -13.799 0.319 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -10.421 -12.151 0.234 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -9.975 -12.819 1.791 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -11.104 -14.048 -1.569 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -8.494 -14.590 1.793 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -10.045 -15.983 -2.708 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -7.425 -16.522 0.658 1.00 0.00 H new ATOM 0 HZ PHE A 78 -8.209 -17.224 -1.591 1.00 0.00 H new ATOM 1296 N TRP A 79 -11.951 -13.667 3.585 1.00 0.00 N ATOM 1297 CA TRP A 79 -12.064 -14.474 4.791 1.00 0.00 C ATOM 1298 C TRP A 79 -13.539 -14.693 5.133 1.00 0.00 C ATOM 1299 O TRP A 79 -13.904 -15.671 5.785 1.00 0.00 O ATOM 1300 CB TRP A 79 -11.366 -13.791 5.973 1.00 0.00 C ATOM 1301 CG TRP A 79 -10.305 -12.837 5.514 1.00 0.00 C ATOM 1302 CD1 TRP A 79 -9.422 -13.036 4.507 1.00 0.00 C ATOM 1303 CD2 TRP A 79 -10.007 -11.529 6.065 1.00 0.00 C ATOM 1304 NE1 TRP A 79 -8.597 -11.921 4.414 1.00 0.00 N ATOM 1305 CE2 TRP A 79 -8.926 -10.961 5.357 1.00 0.00 C ATOM 1306 CE3 TRP A 79 -10.577 -10.794 7.108 1.00 0.00 C ATOM 1307 CZ2 TRP A 79 -8.427 -9.691 5.684 1.00 0.00 C ATOM 1308 CZ3 TRP A 79 -10.087 -9.524 7.438 1.00 0.00 C ATOM 1309 CH2 TRP A 79 -9.016 -8.975 6.731 1.00 0.00 C ATOM 0 H TRP A 79 -11.754 -12.679 3.744 1.00 0.00 H new ATOM 0 HA TRP A 79 -11.581 -15.433 4.605 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -12.103 -13.255 6.571 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -10.921 -14.547 6.619 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -9.368 -13.914 3.881 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -7.842 -11.822 3.735 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -11.404 -11.209 7.665 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -7.598 -9.271 5.134 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -10.540 -8.966 8.244 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -8.642 -7.996 6.993 1.00 0.00 H new ATOM 1320 N LYS A 80 -14.378 -13.772 4.668 1.00 0.00 N ATOM 1321 CA LYS A 80 -15.814 -13.839 4.894 1.00 0.00 C ATOM 1322 C LYS A 80 -16.167 -13.966 6.379 1.00 0.00 C ATOM 1323 O LYS A 80 -16.890 -14.880 6.774 1.00 0.00 O ATOM 1324 CB LYS A 80 -16.410 -15.013 4.112 1.00 0.00 C ATOM 1325 CG LYS A 80 -15.484 -15.383 2.956 1.00 0.00 C ATOM 1326 CD LYS A 80 -16.284 -16.131 1.883 1.00 0.00 C ATOM 1327 CE LYS A 80 -15.350 -16.602 0.757 1.00 0.00 C ATOM 1328 NZ LYS A 80 -15.681 -18.010 0.398 1.00 0.00 N ATOM 0 H LYS A 80 -14.080 -12.961 4.126 1.00 0.00 H new ATOM 0 HA LYS A 80 -16.242 -12.901 4.540 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.545 -15.870 4.771 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -17.395 -14.746 3.730 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.037 -14.484 2.532 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -14.666 -16.007 3.316 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.790 -16.988 2.328 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -17.057 -15.480 1.476 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -15.459 -15.957 -0.115 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -14.311 -16.531 1.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -15.050 -18.331 -0.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -15.556 -18.619 1.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -16.668 -18.063 0.076 1.00 0.00 H new ATOM 1342 N LEU A 81 -15.681 -13.035 7.200 1.00 0.00 N ATOM 1343 CA LEU A 81 -15.993 -13.069 8.621 1.00 0.00 C ATOM 1344 C LEU A 81 -17.476 -12.888 8.847 1.00 0.00 C ATOM 1345 O LEU A 81 -18.321 -13.306 8.055 1.00 0.00 O ATOM 1346 CB LEU A 81 -15.299 -11.938 9.365 1.00 0.00 C ATOM 1347 CG LEU A 81 -13.897 -11.728 8.807 1.00 0.00 C ATOM 1348 CD1 LEU A 81 -13.941 -10.891 7.512 1.00 0.00 C ATOM 1349 CD2 LEU A 81 -13.063 -11.026 9.881 1.00 0.00 C ATOM 0 H LEU A 81 -15.081 -12.263 6.909 1.00 0.00 H new ATOM 0 HA LEU A 81 -15.654 -14.037 8.990 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -15.878 -11.020 9.269 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -15.245 -12.171 10.428 1.00 0.00 H new ATOM 0 HG LEU A 81 -13.448 -12.688 8.553 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -12.928 -10.754 7.132 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -14.542 -11.409 6.764 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -14.384 -9.918 7.723 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -12.052 -10.863 9.508 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -13.519 -10.067 10.126 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -13.023 -11.648 10.775 1.00 0.00 H new ATOM 1361 N ASP A 82 -17.750 -12.194 9.933 1.00 0.00 N ATOM 1362 CA ASP A 82 -19.093 -11.842 10.321 1.00 0.00 C ATOM 1363 C ASP A 82 -19.174 -10.322 10.365 1.00 0.00 C ATOM 1364 O ASP A 82 -18.290 -9.633 9.857 1.00 0.00 O ATOM 1365 CB ASP A 82 -19.416 -12.434 11.696 1.00 0.00 C ATOM 1366 CG ASP A 82 -20.032 -13.822 11.540 1.00 0.00 C ATOM 1367 OD1 ASP A 82 -21.137 -13.904 11.029 1.00 0.00 O ATOM 1368 OD2 ASP A 82 -19.389 -14.781 11.934 1.00 0.00 O ATOM 0 H ASP A 82 -17.034 -11.856 10.576 1.00 0.00 H new ATOM 0 HA ASP A 82 -19.816 -12.240 9.609 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -18.508 -12.496 12.296 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -20.106 -11.780 12.229 1.00 0.00 H new ATOM 1373 N LEU A 83 -20.219 -9.805 10.970 1.00 0.00 N ATOM 1374 CA LEU A 83 -20.392 -8.360 11.071 1.00 0.00 C ATOM 1375 C LEU A 83 -19.806 -7.842 12.383 1.00 0.00 C ATOM 1376 O LEU A 83 -19.069 -6.856 12.401 1.00 0.00 O ATOM 1377 CB LEU A 83 -21.888 -8.012 10.976 1.00 0.00 C ATOM 1378 CG LEU A 83 -22.129 -6.506 11.144 1.00 0.00 C ATOM 1379 CD1 LEU A 83 -21.948 -6.085 12.610 1.00 0.00 C ATOM 1380 CD2 LEU A 83 -21.158 -5.730 10.255 1.00 0.00 C ATOM 0 H LEU A 83 -20.963 -10.354 11.400 1.00 0.00 H new ATOM 0 HA LEU A 83 -19.861 -7.880 10.249 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -22.278 -8.338 10.012 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -22.438 -8.557 11.743 1.00 0.00 H new ATOM 0 HG LEU A 83 -23.154 -6.281 10.848 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -22.124 -5.013 12.705 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -22.659 -6.626 13.234 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -20.933 -6.316 12.932 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -21.330 -4.660 10.375 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -20.133 -5.967 10.542 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -21.317 -6.008 9.213 1.00 0.00 H new ATOM 1392 N ASP A 84 -20.146 -8.514 13.478 1.00 0.00 N ATOM 1393 CA ASP A 84 -19.660 -8.119 14.799 1.00 0.00 C ATOM 1394 C ASP A 84 -18.136 -8.026 14.813 1.00 0.00 C ATOM 1395 O ASP A 84 -17.547 -7.456 15.731 1.00 0.00 O ATOM 1396 CB ASP A 84 -20.126 -9.138 15.843 1.00 0.00 C ATOM 1397 CG ASP A 84 -19.931 -8.582 17.250 1.00 0.00 C ATOM 1398 OD1 ASP A 84 -19.082 -7.722 17.415 1.00 0.00 O ATOM 1399 OD2 ASP A 84 -20.634 -9.026 18.143 1.00 0.00 O ATOM 0 H ASP A 84 -20.754 -9.333 13.479 1.00 0.00 H new ATOM 0 HA ASP A 84 -20.066 -7.136 15.038 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -21.177 -9.379 15.682 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -19.566 -10.066 15.731 1.00 0.00 H new ATOM 1404 N GLN A 85 -17.504 -8.592 13.792 1.00 0.00 N ATOM 1405 CA GLN A 85 -16.048 -8.571 13.696 1.00 0.00 C ATOM 1406 C GLN A 85 -15.580 -7.323 12.937 1.00 0.00 C ATOM 1407 O GLN A 85 -16.390 -6.455 12.612 1.00 0.00 O ATOM 1408 CB GLN A 85 -15.553 -9.846 12.993 1.00 0.00 C ATOM 1409 CG GLN A 85 -16.677 -10.882 12.938 1.00 0.00 C ATOM 1410 CD GLN A 85 -17.152 -11.213 14.351 1.00 0.00 C ATOM 1411 OE1 GLN A 85 -16.398 -11.056 15.311 1.00 0.00 O ATOM 1412 NE2 GLN A 85 -18.363 -11.663 14.536 1.00 0.00 N ATOM 0 H GLN A 85 -17.973 -9.069 13.022 1.00 0.00 H new ATOM 0 HA GLN A 85 -15.628 -8.537 14.701 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -15.217 -9.608 11.984 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -14.695 -10.256 13.526 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -17.508 -10.498 12.347 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -16.325 -11.787 12.443 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -18.986 -11.792 13.739 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -18.686 -11.885 15.478 1.00 0.00 H new ATOM 1421 N ASP A 86 -14.270 -7.219 12.673 1.00 0.00 N ATOM 1422 CA ASP A 86 -13.740 -6.044 11.970 1.00 0.00 C ATOM 1423 C ASP A 86 -12.483 -6.391 11.156 1.00 0.00 C ATOM 1424 O ASP A 86 -11.985 -7.515 11.214 1.00 0.00 O ATOM 1425 CB ASP A 86 -13.405 -4.949 12.999 1.00 0.00 C ATOM 1426 CG ASP A 86 -14.516 -3.901 13.048 1.00 0.00 C ATOM 1427 OD1 ASP A 86 -15.666 -4.279 12.897 1.00 0.00 O ATOM 1428 OD2 ASP A 86 -14.199 -2.738 13.235 1.00 0.00 O ATOM 0 H ASP A 86 -13.572 -7.917 12.929 1.00 0.00 H new ATOM 0 HA ASP A 86 -14.500 -5.689 11.274 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -13.275 -5.396 13.985 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -12.460 -4.473 12.738 1.00 0.00 H new ATOM 1433 N TYR A 87 -11.966 -5.405 10.413 1.00 0.00 N ATOM 1434 CA TYR A 87 -10.754 -5.606 9.614 1.00 0.00 C ATOM 1435 C TYR A 87 -9.826 -4.399 9.721 1.00 0.00 C ATOM 1436 O TYR A 87 -10.197 -3.284 9.356 1.00 0.00 O ATOM 1437 CB TYR A 87 -11.086 -5.837 8.127 1.00 0.00 C ATOM 1438 CG TYR A 87 -12.565 -6.021 7.935 1.00 0.00 C ATOM 1439 CD1 TYR A 87 -13.150 -7.263 8.170 1.00 0.00 C ATOM 1440 CD2 TYR A 87 -13.344 -4.950 7.491 1.00 0.00 C ATOM 1441 CE1 TYR A 87 -14.520 -7.444 7.963 1.00 0.00 C ATOM 1442 CE2 TYR A 87 -14.716 -5.124 7.284 1.00 0.00 C ATOM 1443 CZ TYR A 87 -15.306 -6.374 7.519 1.00 0.00 C ATOM 1444 OH TYR A 87 -16.660 -6.550 7.314 1.00 0.00 O ATOM 0 H TYR A 87 -12.365 -4.468 10.349 1.00 0.00 H new ATOM 0 HA TYR A 87 -10.259 -6.492 10.012 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -10.740 -4.989 7.536 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -10.555 -6.717 7.763 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -12.543 -8.088 8.513 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -12.887 -3.989 7.308 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -14.972 -8.408 8.145 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -15.321 -4.296 6.943 1.00 0.00 H new ATOM 0 HH TYR A 87 -17.160 -5.906 7.858 1.00 0.00 H new ATOM 1454 N ARG A 88 -8.605 -4.644 10.176 1.00 0.00 N ATOM 1455 CA ARG A 88 -7.607 -3.586 10.272 1.00 0.00 C ATOM 1456 C ARG A 88 -6.556 -3.853 9.205 1.00 0.00 C ATOM 1457 O ARG A 88 -5.638 -4.651 9.404 1.00 0.00 O ATOM 1458 CB ARG A 88 -6.967 -3.573 11.673 1.00 0.00 C ATOM 1459 CG ARG A 88 -7.476 -2.369 12.470 1.00 0.00 C ATOM 1460 CD ARG A 88 -6.957 -2.449 13.906 1.00 0.00 C ATOM 1461 NE ARG A 88 -7.086 -1.152 14.559 1.00 0.00 N ATOM 1462 CZ ARG A 88 -6.112 -0.249 14.498 1.00 0.00 C ATOM 1463 NH1 ARG A 88 -5.009 -0.518 13.853 1.00 0.00 N ATOM 1464 NH2 ARG A 88 -6.260 0.908 15.085 1.00 0.00 N ATOM 0 H ARG A 88 -8.282 -5.561 10.483 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.068 -2.610 10.117 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -7.207 -4.496 12.200 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -5.881 -3.529 11.586 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -7.142 -1.443 12.003 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -8.566 -2.352 12.467 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -7.516 -3.202 14.462 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -5.913 -2.763 13.907 1.00 0.00 H new ATOM 0 HE ARG A 88 -7.940 -0.933 15.072 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -4.894 -1.422 13.395 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -4.263 0.176 13.807 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -7.122 1.118 15.589 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -5.514 1.602 15.039 1.00 0.00 H new ATOM 1478 N VAL A 89 -6.729 -3.221 8.055 1.00 0.00 N ATOM 1479 CA VAL A 89 -5.825 -3.435 6.938 1.00 0.00 C ATOM 1480 C VAL A 89 -4.660 -2.443 6.936 1.00 0.00 C ATOM 1481 O VAL A 89 -4.785 -1.304 7.391 1.00 0.00 O ATOM 1482 CB VAL A 89 -6.616 -3.329 5.635 1.00 0.00 C ATOM 1483 CG1 VAL A 89 -5.988 -4.217 4.550 1.00 0.00 C ATOM 1484 CG2 VAL A 89 -8.069 -3.766 5.882 1.00 0.00 C ATOM 0 H VAL A 89 -7.483 -2.559 7.872 1.00 0.00 H new ATOM 0 HA VAL A 89 -5.390 -4.430 7.036 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.595 -2.294 5.294 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.564 -4.129 3.629 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -4.962 -3.898 4.368 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -5.992 -5.255 4.882 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -8.634 -3.691 4.953 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -8.084 -4.798 6.233 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -8.520 -3.120 6.635 1.00 0.00 H new ATOM 1494 N THR A 90 -3.527 -2.904 6.411 1.00 0.00 N ATOM 1495 CA THR A 90 -2.317 -2.094 6.329 1.00 0.00 C ATOM 1496 C THR A 90 -1.627 -2.348 4.986 1.00 0.00 C ATOM 1497 O THR A 90 -1.209 -3.469 4.702 1.00 0.00 O ATOM 1498 CB THR A 90 -1.389 -2.459 7.505 1.00 0.00 C ATOM 1499 OG1 THR A 90 -1.734 -1.666 8.632 1.00 0.00 O ATOM 1500 CG2 THR A 90 0.081 -2.214 7.148 1.00 0.00 C ATOM 0 H THR A 90 -3.423 -3.845 6.032 1.00 0.00 H new ATOM 0 HA THR A 90 -2.564 -1.034 6.393 1.00 0.00 H new ATOM 0 HB THR A 90 -1.516 -3.518 7.729 1.00 0.00 H new ATOM 0 HG1 THR A 90 -1.149 -1.894 9.384 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.711 -2.480 7.997 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.353 -2.826 6.288 1.00 0.00 H new ATOM 0 HG23 THR A 90 0.226 -1.161 6.905 1.00 0.00 H new ATOM 1508 N CYS A 91 -1.522 -1.311 4.158 1.00 0.00 N ATOM 1509 CA CYS A 91 -0.892 -1.452 2.845 1.00 0.00 C ATOM 1510 C CYS A 91 0.505 -0.839 2.832 1.00 0.00 C ATOM 1511 O CYS A 91 0.712 0.268 3.328 1.00 0.00 O ATOM 1512 CB CYS A 91 -1.751 -0.763 1.779 1.00 0.00 C ATOM 1513 SG CYS A 91 -0.924 -0.881 0.174 1.00 0.00 S ATOM 0 H CYS A 91 -1.861 -0.372 4.369 1.00 0.00 H new ATOM 0 HA CYS A 91 -0.807 -2.517 2.628 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -2.734 -1.231 1.729 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -1.909 0.283 2.043 1.00 0.00 H new ATOM 0 HG CYS A 91 -1.399 0.027 -0.627 1.00 0.00 H new ATOM 1519 N PHE A 92 1.459 -1.561 2.241 1.00 0.00 N ATOM 1520 CA PHE A 92 2.834 -1.073 2.145 1.00 0.00 C ATOM 1521 C PHE A 92 3.262 -0.984 0.688 1.00 0.00 C ATOM 1522 O PHE A 92 3.621 -1.988 0.071 1.00 0.00 O ATOM 1523 CB PHE A 92 3.788 -2.002 2.897 1.00 0.00 C ATOM 1524 CG PHE A 92 3.562 -1.893 4.388 1.00 0.00 C ATOM 1525 CD1 PHE A 92 3.815 -0.689 5.055 1.00 0.00 C ATOM 1526 CD2 PHE A 92 3.113 -3.007 5.106 1.00 0.00 C ATOM 1527 CE1 PHE A 92 3.617 -0.601 6.440 1.00 0.00 C ATOM 1528 CE2 PHE A 92 2.913 -2.919 6.488 1.00 0.00 C ATOM 1529 CZ PHE A 92 3.165 -1.716 7.156 1.00 0.00 C ATOM 0 H PHE A 92 1.305 -2.479 1.825 1.00 0.00 H new ATOM 0 HA PHE A 92 2.874 -0.081 2.595 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.634 -3.031 2.574 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.820 -1.744 2.659 1.00 0.00 H new ATOM 0 HD1 PHE A 92 4.163 0.172 4.503 1.00 0.00 H new ATOM 0 HD2 PHE A 92 2.920 -3.937 4.592 1.00 0.00 H new ATOM 0 HE1 PHE A 92 3.813 0.328 6.955 1.00 0.00 H new ATOM 0 HE2 PHE A 92 2.564 -3.780 7.039 1.00 0.00 H new ATOM 0 HZ PHE A 92 3.011 -1.647 8.223 1.00 0.00 H new ATOM 1539 N THR A 93 3.230 0.228 0.148 1.00 0.00 N ATOM 1540 CA THR A 93 3.625 0.444 -1.238 1.00 0.00 C ATOM 1541 C THR A 93 4.193 1.839 -1.413 1.00 0.00 C ATOM 1542 O THR A 93 3.479 2.827 -1.270 1.00 0.00 O ATOM 1543 CB THR A 93 2.424 0.288 -2.165 1.00 0.00 C ATOM 1544 OG1 THR A 93 1.669 -0.851 -1.780 1.00 0.00 O ATOM 1545 CG2 THR A 93 2.906 0.135 -3.611 1.00 0.00 C ATOM 0 H THR A 93 2.937 1.070 0.644 1.00 0.00 H new ATOM 0 HA THR A 93 4.383 -0.298 -1.490 1.00 0.00 H new ATOM 0 HB THR A 93 1.793 1.174 -2.093 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.942 -0.575 -1.184 1.00 0.00 H new ATOM 0 HG21 THR A 93 2.046 0.024 -4.271 1.00 0.00 H new ATOM 0 HG22 THR A 93 3.474 1.019 -3.901 1.00 0.00 H new ATOM 0 HG23 THR A 93 3.542 -0.747 -3.691 1.00 0.00 H new ATOM 1553 N SER A 94 5.473 1.909 -1.742 1.00 0.00 N ATOM 1554 CA SER A 94 6.130 3.194 -1.950 1.00 0.00 C ATOM 1555 C SER A 94 5.247 4.108 -2.795 1.00 0.00 C ATOM 1556 O SER A 94 5.506 5.305 -2.914 1.00 0.00 O ATOM 1557 CB SER A 94 7.474 2.982 -2.653 1.00 0.00 C ATOM 1558 OG SER A 94 7.649 3.978 -3.651 1.00 0.00 O ATOM 0 H SER A 94 6.077 1.097 -1.871 1.00 0.00 H new ATOM 0 HA SER A 94 6.299 3.663 -0.981 1.00 0.00 H new ATOM 0 HB2 SER A 94 8.287 3.031 -1.929 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.508 1.990 -3.104 1.00 0.00 H new ATOM 0 HG SER A 94 8.510 3.844 -4.100 1.00 0.00 H new ATOM 1564 N TRP A 95 4.205 3.528 -3.385 1.00 0.00 N ATOM 1565 CA TRP A 95 3.285 4.282 -4.226 1.00 0.00 C ATOM 1566 C TRP A 95 1.926 4.457 -3.535 1.00 0.00 C ATOM 1567 O TRP A 95 1.441 3.557 -2.849 1.00 0.00 O ATOM 1568 CB TRP A 95 3.110 3.533 -5.545 1.00 0.00 C ATOM 1569 CG TRP A 95 2.636 4.468 -6.606 1.00 0.00 C ATOM 1570 CD1 TRP A 95 3.369 5.453 -7.172 1.00 0.00 C ATOM 1571 CD2 TRP A 95 1.335 4.509 -7.242 1.00 0.00 C ATOM 1572 NE1 TRP A 95 2.590 6.095 -8.120 1.00 0.00 N ATOM 1573 CE2 TRP A 95 1.331 5.546 -8.197 1.00 0.00 C ATOM 1574 CE3 TRP A 95 0.170 3.749 -7.084 1.00 0.00 C ATOM 1575 CZ2 TRP A 95 0.207 5.820 -8.967 1.00 0.00 C ATOM 1576 CZ3 TRP A 95 -0.963 4.023 -7.858 1.00 0.00 C ATOM 1577 CH2 TRP A 95 -0.944 5.058 -8.801 1.00 0.00 C ATOM 0 H TRP A 95 3.978 2.538 -3.295 1.00 0.00 H new ATOM 0 HA TRP A 95 3.695 5.276 -4.408 1.00 0.00 H new ATOM 0 HB2 TRP A 95 4.056 3.081 -5.844 1.00 0.00 H new ATOM 0 HB3 TRP A 95 2.394 2.721 -5.419 1.00 0.00 H new ATOM 0 HD1 TRP A 95 4.392 5.698 -6.926 1.00 0.00 H new ATOM 0 HE1 TRP A 95 2.910 6.878 -8.690 1.00 0.00 H new ATOM 0 HE3 TRP A 95 0.146 2.947 -6.361 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.228 6.621 -9.691 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -1.858 3.433 -7.727 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -1.821 5.264 -9.397 1.00 0.00 H new ATOM 1588 N SER A 96 1.329 5.632 -3.726 1.00 0.00 N ATOM 1589 CA SER A 96 0.030 5.964 -3.132 1.00 0.00 C ATOM 1590 C SER A 96 -1.115 5.461 -4.040 1.00 0.00 C ATOM 1591 O SER A 96 -0.860 4.677 -4.951 1.00 0.00 O ATOM 1592 CB SER A 96 -0.018 7.473 -2.909 1.00 0.00 C ATOM 1593 OG SER A 96 -0.713 7.753 -1.701 1.00 0.00 O ATOM 0 H SER A 96 1.728 6.380 -4.294 1.00 0.00 H new ATOM 0 HA SER A 96 -0.099 5.468 -2.170 1.00 0.00 H new ATOM 0 HB2 SER A 96 0.993 7.876 -2.861 1.00 0.00 H new ATOM 0 HB3 SER A 96 -0.515 7.959 -3.748 1.00 0.00 H new ATOM 0 HG SER A 96 -0.742 8.722 -1.557 1.00 0.00 H new ATOM 1599 N PRO A 97 -2.370 5.832 -3.808 1.00 0.00 N ATOM 1600 CA PRO A 97 -3.510 5.322 -4.629 1.00 0.00 C ATOM 1601 C PRO A 97 -3.651 6.101 -5.932 1.00 0.00 C ATOM 1602 O PRO A 97 -2.666 6.630 -6.447 1.00 0.00 O ATOM 1603 CB PRO A 97 -4.707 5.539 -3.715 1.00 0.00 C ATOM 1604 CG PRO A 97 -4.379 6.781 -2.972 1.00 0.00 C ATOM 1605 CD PRO A 97 -2.860 6.785 -2.785 1.00 0.00 C ATOM 0 HA PRO A 97 -3.389 4.284 -4.937 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -5.629 5.649 -4.286 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -4.849 4.696 -3.038 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -4.704 7.662 -3.525 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -4.889 6.803 -2.009 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -2.442 7.781 -2.934 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -2.581 6.470 -1.780 1.00 0.00 H new ATOM 1613 N CYS A 98 -4.869 6.184 -6.468 1.00 0.00 N ATOM 1614 CA CYS A 98 -5.069 6.923 -7.711 1.00 0.00 C ATOM 1615 C CYS A 98 -6.439 7.591 -7.765 1.00 0.00 C ATOM 1616 O CYS A 98 -7.359 7.224 -7.041 1.00 0.00 O ATOM 1617 CB CYS A 98 -4.918 5.993 -8.925 1.00 0.00 C ATOM 1618 SG CYS A 98 -4.092 4.462 -8.435 1.00 0.00 S ATOM 0 H CYS A 98 -5.709 5.761 -6.073 1.00 0.00 H new ATOM 0 HA CYS A 98 -4.305 7.699 -7.741 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -5.898 5.768 -9.345 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -4.344 6.492 -9.706 1.00 0.00 H new ATOM 0 HG CYS A 98 -2.856 4.717 -8.122 1.00 0.00 H new ATOM 1623 N PHE A 99 -6.555 8.567 -8.658 1.00 0.00 N ATOM 1624 CA PHE A 99 -7.800 9.301 -8.851 1.00 0.00 C ATOM 1625 C PHE A 99 -9.011 8.381 -8.777 1.00 0.00 C ATOM 1626 O PHE A 99 -9.964 8.647 -8.044 1.00 0.00 O ATOM 1627 CB PHE A 99 -7.782 9.974 -10.221 1.00 0.00 C ATOM 1628 CG PHE A 99 -7.851 8.922 -11.303 1.00 0.00 C ATOM 1629 CD1 PHE A 99 -6.759 8.074 -11.527 1.00 0.00 C ATOM 1630 CD2 PHE A 99 -9.007 8.795 -12.084 1.00 0.00 C ATOM 1631 CE1 PHE A 99 -6.823 7.101 -12.531 1.00 0.00 C ATOM 1632 CE2 PHE A 99 -9.070 7.822 -13.088 1.00 0.00 C ATOM 1633 CZ PHE A 99 -7.979 6.975 -13.312 1.00 0.00 C ATOM 0 H PHE A 99 -5.794 8.871 -9.265 1.00 0.00 H new ATOM 0 HA PHE A 99 -7.878 10.042 -8.055 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -8.625 10.659 -10.312 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -6.875 10.567 -10.334 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -5.868 8.171 -10.925 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -9.850 9.448 -11.911 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.981 6.447 -12.704 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -9.961 7.725 -13.690 1.00 0.00 H new ATOM 0 HZ PHE A 99 -8.028 6.224 -14.087 1.00 0.00 H new ATOM 1643 N SER A 100 -8.979 7.314 -9.562 1.00 0.00 N ATOM 1644 CA SER A 100 -10.094 6.377 -9.600 1.00 0.00 C ATOM 1645 C SER A 100 -9.941 5.286 -8.544 1.00 0.00 C ATOM 1646 O SER A 100 -10.734 5.205 -7.608 1.00 0.00 O ATOM 1647 CB SER A 100 -10.194 5.741 -10.987 1.00 0.00 C ATOM 1648 OG SER A 100 -10.936 6.601 -11.842 1.00 0.00 O ATOM 0 H SER A 100 -8.201 7.076 -10.177 1.00 0.00 H new ATOM 0 HA SER A 100 -11.006 6.933 -9.385 1.00 0.00 H new ATOM 0 HB2 SER A 100 -9.198 5.573 -11.396 1.00 0.00 H new ATOM 0 HB3 SER A 100 -10.680 4.767 -10.920 1.00 0.00 H new ATOM 0 HG SER A 100 -10.324 7.212 -12.303 1.00 0.00 H new ATOM 1654 N CYS A 101 -8.925 4.440 -8.697 1.00 0.00 N ATOM 1655 CA CYS A 101 -8.707 3.362 -7.734 1.00 0.00 C ATOM 1656 C CYS A 101 -9.006 3.845 -6.328 1.00 0.00 C ATOM 1657 O CYS A 101 -9.383 3.064 -5.455 1.00 0.00 O ATOM 1658 CB CYS A 101 -7.246 2.906 -7.741 1.00 0.00 C ATOM 1659 SG CYS A 101 -6.807 2.049 -9.268 1.00 0.00 S ATOM 0 H CYS A 101 -8.252 4.477 -9.462 1.00 0.00 H new ATOM 0 HA CYS A 101 -9.365 2.542 -8.020 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -6.596 3.772 -7.612 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -7.069 2.246 -6.892 1.00 0.00 H new ATOM 0 HG CYS A 101 -5.513 1.980 -9.370 1.00 0.00 H new ATOM 1664 N ALA A 102 -8.818 5.135 -6.105 1.00 0.00 N ATOM 1665 CA ALA A 102 -9.053 5.683 -4.784 1.00 0.00 C ATOM 1666 C ALA A 102 -10.535 5.763 -4.526 1.00 0.00 C ATOM 1667 O ALA A 102 -11.011 5.446 -3.439 1.00 0.00 O ATOM 1668 CB ALA A 102 -8.415 7.065 -4.650 1.00 0.00 C ATOM 0 H ALA A 102 -8.510 5.808 -6.806 1.00 0.00 H new ATOM 0 HA ALA A 102 -8.595 5.026 -4.044 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -8.604 7.458 -3.651 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -7.340 6.987 -4.812 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -8.846 7.738 -5.391 1.00 0.00 H new ATOM 1674 N GLN A 103 -11.261 6.162 -5.545 1.00 0.00 N ATOM 1675 CA GLN A 103 -12.695 6.250 -5.438 1.00 0.00 C ATOM 1676 C GLN A 103 -13.256 4.886 -5.100 1.00 0.00 C ATOM 1677 O GLN A 103 -13.820 4.690 -4.024 1.00 0.00 O ATOM 1678 CB GLN A 103 -13.271 6.725 -6.759 1.00 0.00 C ATOM 1679 CG GLN A 103 -13.030 8.219 -6.882 1.00 0.00 C ATOM 1680 CD GLN A 103 -13.704 8.759 -8.138 1.00 0.00 C ATOM 1681 OE1 GLN A 103 -14.508 7.988 -8.817 1.00 0.00 O flip ATOM 1682 NE2 GLN A 103 -13.492 9.913 -8.510 1.00 0.00 N flip ATOM 0 H GLN A 103 -10.882 6.429 -6.453 1.00 0.00 H new ATOM 0 HA GLN A 103 -12.962 6.957 -4.653 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -12.802 6.196 -7.589 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -14.338 6.509 -6.806 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -13.420 8.731 -6.002 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -11.959 8.420 -6.920 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -12.863 10.513 -7.977 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -13.946 10.269 -9.351 1.00 0.00 H new ATOM 1691 N GLU A 104 -13.065 3.937 -6.018 1.00 0.00 N ATOM 1692 CA GLU A 104 -13.539 2.574 -5.797 1.00 0.00 C ATOM 1693 C GLU A 104 -13.369 2.221 -4.322 1.00 0.00 C ATOM 1694 O GLU A 104 -14.335 1.908 -3.619 1.00 0.00 O ATOM 1695 CB GLU A 104 -12.739 1.606 -6.673 1.00 0.00 C ATOM 1696 CG GLU A 104 -13.379 1.516 -8.061 1.00 0.00 C ATOM 1697 CD GLU A 104 -12.707 0.414 -8.874 1.00 0.00 C ATOM 1698 OE1 GLU A 104 -13.009 -0.742 -8.631 1.00 0.00 O ATOM 1699 OE2 GLU A 104 -11.899 0.744 -9.727 1.00 0.00 O ATOM 0 H GLU A 104 -12.592 4.086 -6.909 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.593 2.497 -6.064 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -11.707 1.947 -6.759 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -12.711 0.620 -6.210 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -14.445 1.311 -7.966 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -13.283 2.471 -8.578 1.00 0.00 H new ATOM 1706 N MET A 105 -12.134 2.315 -3.855 1.00 0.00 N ATOM 1707 CA MET A 105 -11.835 2.052 -2.469 1.00 0.00 C ATOM 1708 C MET A 105 -12.673 2.979 -1.582 1.00 0.00 C ATOM 1709 O MET A 105 -13.616 2.515 -0.952 1.00 0.00 O ATOM 1710 CB MET A 105 -10.321 2.220 -2.270 1.00 0.00 C ATOM 1711 CG MET A 105 -9.747 1.187 -1.286 1.00 0.00 C ATOM 1712 SD MET A 105 -9.885 1.802 0.408 1.00 0.00 S ATOM 1713 CE MET A 105 -8.658 3.124 0.285 1.00 0.00 C ATOM 0 H MET A 105 -11.326 2.572 -4.422 1.00 0.00 H new ATOM 0 HA MET A 105 -12.098 1.034 -2.182 1.00 0.00 H new ATOM 0 HB2 MET A 105 -9.817 2.123 -3.231 1.00 0.00 H new ATOM 0 HB3 MET A 105 -10.114 3.225 -1.902 1.00 0.00 H new ATOM 0 HG2 MET A 105 -10.283 0.243 -1.384 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.703 0.987 -1.525 1.00 0.00 H new ATOM 0 HE1 MET A 105 -8.025 3.117 1.172 1.00 0.00 H new ATOM 0 HE2 MET A 105 -8.043 2.968 -0.601 1.00 0.00 H new ATOM 0 HE3 MET A 105 -9.166 4.086 0.209 1.00 0.00 H new ATOM 1723 N ALA A 106 -12.362 4.277 -1.546 1.00 0.00 N ATOM 1724 CA ALA A 106 -13.135 5.209 -0.712 1.00 0.00 C ATOM 1725 C ALA A 106 -14.597 4.773 -0.574 1.00 0.00 C ATOM 1726 O ALA A 106 -15.123 4.717 0.523 1.00 0.00 O ATOM 1727 CB ALA A 106 -13.150 6.618 -1.301 1.00 0.00 C ATOM 0 H ALA A 106 -11.598 4.703 -2.071 1.00 0.00 H new ATOM 0 HA ALA A 106 -12.641 5.204 0.260 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -13.731 7.276 -0.655 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -12.129 6.992 -1.376 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -13.600 6.593 -2.293 1.00 0.00 H new ATOM 1733 N LYS A 107 -15.278 4.468 -1.673 1.00 0.00 N ATOM 1734 CA LYS A 107 -16.666 4.052 -1.543 1.00 0.00 C ATOM 1735 C LYS A 107 -16.755 2.993 -0.480 1.00 0.00 C ATOM 1736 O LYS A 107 -17.266 3.212 0.618 1.00 0.00 O ATOM 1737 CB LYS A 107 -17.154 3.439 -2.837 1.00 0.00 C ATOM 1738 CG LYS A 107 -17.493 4.543 -3.857 1.00 0.00 C ATOM 1739 CD LYS A 107 -16.779 4.260 -5.170 1.00 0.00 C ATOM 1740 CE LYS A 107 -17.393 3.026 -5.821 1.00 0.00 C ATOM 1741 NZ LYS A 107 -18.759 3.351 -6.318 1.00 0.00 N ATOM 0 H LYS A 107 -14.911 4.498 -2.624 1.00 0.00 H new ATOM 0 HA LYS A 107 -17.271 4.923 -1.292 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -16.389 2.779 -3.246 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -18.035 2.826 -2.647 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -18.570 4.585 -4.019 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -17.191 5.516 -3.469 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -16.865 5.118 -5.837 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -15.716 4.100 -4.992 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -16.766 2.687 -6.646 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -17.442 2.209 -5.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -19.028 2.675 -7.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -19.438 3.290 -5.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -18.766 4.315 -6.707 1.00 0.00 H new ATOM 1755 N PHE A 108 -16.234 1.841 -0.835 1.00 0.00 N ATOM 1756 CA PHE A 108 -16.226 0.706 0.072 1.00 0.00 C ATOM 1757 C PHE A 108 -16.013 1.180 1.510 1.00 0.00 C ATOM 1758 O PHE A 108 -16.532 0.594 2.460 1.00 0.00 O ATOM 1759 CB PHE A 108 -15.106 -0.237 -0.337 1.00 0.00 C ATOM 1760 CG PHE A 108 -15.620 -1.127 -1.432 1.00 0.00 C ATOM 1761 CD1 PHE A 108 -16.011 -0.577 -2.658 1.00 0.00 C ATOM 1762 CD2 PHE A 108 -15.738 -2.492 -1.206 1.00 0.00 C ATOM 1763 CE1 PHE A 108 -16.519 -1.403 -3.660 1.00 0.00 C ATOM 1764 CE2 PHE A 108 -16.242 -3.325 -2.206 1.00 0.00 C ATOM 1765 CZ PHE A 108 -16.636 -2.782 -3.436 1.00 0.00 C ATOM 0 H PHE A 108 -15.809 1.661 -1.745 1.00 0.00 H new ATOM 0 HA PHE A 108 -17.184 0.188 0.020 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -14.240 0.328 -0.681 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -14.780 -0.833 0.516 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -15.919 0.486 -2.828 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -15.440 -2.909 -0.256 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -16.822 -0.981 -4.607 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -16.328 -4.387 -2.032 1.00 0.00 H new ATOM 0 HZ PHE A 108 -17.029 -3.424 -4.210 1.00 0.00 H new ATOM 1775 N ILE A 109 -15.235 2.249 1.643 1.00 0.00 N ATOM 1776 CA ILE A 109 -14.915 2.834 2.933 1.00 0.00 C ATOM 1777 C ILE A 109 -16.015 3.806 3.374 1.00 0.00 C ATOM 1778 O ILE A 109 -16.776 3.522 4.298 1.00 0.00 O ATOM 1779 CB ILE A 109 -13.584 3.558 2.755 1.00 0.00 C ATOM 1780 CG1 ILE A 109 -12.461 2.559 2.862 1.00 0.00 C ATOM 1781 CG2 ILE A 109 -13.387 4.636 3.789 1.00 0.00 C ATOM 1782 CD1 ILE A 109 -12.723 1.427 1.889 1.00 0.00 C ATOM 0 H ILE A 109 -14.808 2.734 0.853 1.00 0.00 H new ATOM 0 HA ILE A 109 -14.844 2.071 3.708 1.00 0.00 H new ATOM 0 HB ILE A 109 -13.588 4.032 1.773 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -11.507 3.037 2.638 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -12.393 2.174 3.880 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -12.427 5.126 3.626 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -14.188 5.370 3.706 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -13.403 4.193 4.785 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -11.917 0.696 1.956 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -13.670 0.947 2.136 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -12.770 1.823 0.875 1.00 0.00 H new ATOM 1794 N SER A 110 -16.088 4.948 2.697 1.00 0.00 N ATOM 1795 CA SER A 110 -17.087 5.964 2.998 1.00 0.00 C ATOM 1796 C SER A 110 -18.456 5.321 3.169 1.00 0.00 C ATOM 1797 O SER A 110 -19.200 5.643 4.095 1.00 0.00 O ATOM 1798 CB SER A 110 -17.138 6.983 1.853 1.00 0.00 C ATOM 1799 OG SER A 110 -18.398 6.905 1.199 1.00 0.00 O ATOM 0 H SER A 110 -15.461 5.193 1.931 1.00 0.00 H new ATOM 0 HA SER A 110 -16.815 6.467 3.926 1.00 0.00 H new ATOM 0 HB2 SER A 110 -16.980 7.989 2.241 1.00 0.00 H new ATOM 0 HB3 SER A 110 -16.335 6.786 1.142 1.00 0.00 H new ATOM 0 HG SER A 110 -18.429 7.558 0.469 1.00 0.00 H new ATOM 1805 N LYS A 111 -18.770 4.401 2.268 1.00 0.00 N ATOM 1806 CA LYS A 111 -20.039 3.697 2.315 1.00 0.00 C ATOM 1807 C LYS A 111 -20.116 2.870 3.587 1.00 0.00 C ATOM 1808 O LYS A 111 -21.178 2.737 4.196 1.00 0.00 O ATOM 1809 CB LYS A 111 -20.169 2.773 1.107 1.00 0.00 C ATOM 1810 CG LYS A 111 -20.167 3.531 -0.240 1.00 0.00 C ATOM 1811 CD LYS A 111 -20.752 4.951 -0.135 1.00 0.00 C ATOM 1812 CE LYS A 111 -22.228 4.899 0.293 1.00 0.00 C ATOM 1813 NZ LYS A 111 -22.501 6.002 1.256 1.00 0.00 N ATOM 0 H LYS A 111 -18.162 4.126 1.496 1.00 0.00 H new ATOM 0 HA LYS A 111 -20.849 4.426 2.300 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -19.347 2.057 1.115 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -21.092 2.200 1.193 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -19.145 3.592 -0.614 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -20.740 2.961 -0.971 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -20.179 5.534 0.586 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -20.664 5.458 -1.096 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -22.875 4.994 -0.579 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -22.452 3.936 0.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -22.611 5.609 2.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -21.708 6.674 1.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -23.375 6.494 0.981 1.00 0.00 H new ATOM 1827 N ASN A 112 -18.978 2.316 3.982 1.00 0.00 N ATOM 1828 CA ASN A 112 -18.915 1.502 5.187 1.00 0.00 C ATOM 1829 C ASN A 112 -17.587 1.697 5.915 1.00 0.00 C ATOM 1830 O ASN A 112 -16.647 0.924 5.728 1.00 0.00 O ATOM 1831 CB ASN A 112 -19.088 0.025 4.831 1.00 0.00 C ATOM 1832 CG ASN A 112 -20.565 -0.292 4.630 1.00 0.00 C ATOM 1833 OD1 ASN A 112 -21.103 -0.080 3.543 1.00 0.00 O ATOM 1834 ND2 ASN A 112 -21.256 -0.791 5.617 1.00 0.00 N ATOM 0 H ASN A 112 -18.091 2.415 3.489 1.00 0.00 H new ATOM 0 HA ASN A 112 -19.722 1.818 5.848 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -18.531 -0.207 3.923 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -18.678 -0.600 5.625 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -22.245 -1.007 5.490 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -20.808 -0.966 6.516 1.00 0.00 H new ATOM 1841 N LYS A 113 -17.518 2.731 6.750 1.00 0.00 N ATOM 1842 CA LYS A 113 -16.302 3.010 7.505 1.00 0.00 C ATOM 1843 C LYS A 113 -15.822 1.750 8.225 1.00 0.00 C ATOM 1844 O LYS A 113 -14.692 1.688 8.708 1.00 0.00 O ATOM 1845 CB LYS A 113 -16.544 4.115 8.538 1.00 0.00 C ATOM 1846 CG LYS A 113 -17.535 5.156 8.004 1.00 0.00 C ATOM 1847 CD LYS A 113 -16.957 5.831 6.757 1.00 0.00 C ATOM 1848 CE LYS A 113 -17.546 7.238 6.610 1.00 0.00 C ATOM 1849 NZ LYS A 113 -17.307 8.016 7.860 1.00 0.00 N ATOM 0 H LYS A 113 -18.283 3.384 6.919 1.00 0.00 H new ATOM 0 HA LYS A 113 -15.540 3.341 6.799 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -16.930 3.679 9.459 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -15.600 4.600 8.786 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -18.484 4.678 7.763 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -17.740 5.903 8.771 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -15.871 5.887 6.833 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -17.185 5.237 5.872 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -17.090 7.747 5.761 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -18.615 7.176 6.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -17.220 9.026 7.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -18.105 7.878 8.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -16.429 7.687 8.311 1.00 0.00 H new ATOM 1863 N HIS A 114 -16.700 0.753 8.297 1.00 0.00 N ATOM 1864 CA HIS A 114 -16.380 -0.507 8.965 1.00 0.00 C ATOM 1865 C HIS A 114 -14.975 -0.987 8.606 1.00 0.00 C ATOM 1866 O HIS A 114 -14.442 -1.900 9.237 1.00 0.00 O ATOM 1867 CB HIS A 114 -17.403 -1.570 8.561 1.00 0.00 C ATOM 1868 CG HIS A 114 -17.398 -2.687 9.568 1.00 0.00 C ATOM 1869 ND1 HIS A 114 -16.814 -3.915 9.303 1.00 0.00 N ATOM 1870 CD2 HIS A 114 -17.908 -2.780 10.840 1.00 0.00 C ATOM 1871 CE1 HIS A 114 -16.983 -4.688 10.390 1.00 0.00 C ATOM 1872 NE2 HIS A 114 -17.644 -4.045 11.357 1.00 0.00 N ATOM 0 H HIS A 114 -17.639 0.793 7.901 1.00 0.00 H new ATOM 0 HA HIS A 114 -16.416 -0.341 10.042 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -18.397 -1.127 8.500 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -17.166 -1.959 7.571 1.00 0.00 H new ATOM 0 HD1 HIS A 114 -16.342 -4.184 8.440 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -18.433 -1.992 11.359 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -16.628 -5.705 10.472 1.00 0.00 H new ATOM 1881 N VAL A 115 -14.382 -0.372 7.590 1.00 0.00 N ATOM 1882 CA VAL A 115 -13.043 -0.740 7.146 1.00 0.00 C ATOM 1883 C VAL A 115 -12.029 0.308 7.608 1.00 0.00 C ATOM 1884 O VAL A 115 -12.356 1.489 7.721 1.00 0.00 O ATOM 1885 CB VAL A 115 -13.057 -0.867 5.606 1.00 0.00 C ATOM 1886 CG1 VAL A 115 -11.756 -0.363 5.002 1.00 0.00 C ATOM 1887 CG2 VAL A 115 -13.228 -2.330 5.202 1.00 0.00 C ATOM 0 H VAL A 115 -14.808 0.386 7.057 1.00 0.00 H new ATOM 0 HA VAL A 115 -12.748 -1.695 7.581 1.00 0.00 H new ATOM 0 HB VAL A 115 -13.888 -0.266 5.236 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -11.795 -0.465 3.917 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -11.616 0.686 5.263 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -10.923 -0.948 5.392 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -13.237 -2.409 4.115 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -12.401 -2.917 5.602 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -14.169 -2.710 5.601 1.00 0.00 H new ATOM 1897 N SER A 116 -10.793 -0.127 7.858 1.00 0.00 N ATOM 1898 CA SER A 116 -9.747 0.797 8.287 1.00 0.00 C ATOM 1899 C SER A 116 -8.450 0.533 7.527 1.00 0.00 C ATOM 1900 O SER A 116 -7.717 -0.404 7.846 1.00 0.00 O ATOM 1901 CB SER A 116 -9.497 0.647 9.785 1.00 0.00 C ATOM 1902 OG SER A 116 -10.678 0.991 10.496 1.00 0.00 O ATOM 0 H SER A 116 -10.496 -1.099 7.772 1.00 0.00 H new ATOM 0 HA SER A 116 -10.081 1.812 8.074 1.00 0.00 H new ATOM 0 HB2 SER A 116 -9.206 -0.378 10.016 1.00 0.00 H new ATOM 0 HB3 SER A 116 -8.673 1.290 10.094 1.00 0.00 H new ATOM 0 HG SER A 116 -10.520 0.894 11.458 1.00 0.00 H new ATOM 1908 N LEU A 117 -8.162 1.367 6.529 1.00 0.00 N ATOM 1909 CA LEU A 117 -6.943 1.207 5.751 1.00 0.00 C ATOM 1910 C LEU A 117 -5.845 2.100 6.292 1.00 0.00 C ATOM 1911 O LEU A 117 -6.064 3.285 6.541 1.00 0.00 O ATOM 1912 CB LEU A 117 -7.137 1.608 4.287 1.00 0.00 C ATOM 1913 CG LEU A 117 -8.334 0.913 3.624 1.00 0.00 C ATOM 1914 CD1 LEU A 117 -8.548 -0.510 4.145 1.00 0.00 C ATOM 1915 CD2 LEU A 117 -9.585 1.731 3.857 1.00 0.00 C ATOM 0 H LEU A 117 -8.751 2.150 6.245 1.00 0.00 H new ATOM 0 HA LEU A 117 -6.680 0.152 5.822 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -7.273 2.688 4.228 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -6.232 1.370 3.729 1.00 0.00 H new ATOM 0 HG LEU A 117 -8.119 0.840 2.558 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -9.407 -0.956 3.643 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -7.659 -1.108 3.944 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -8.730 -0.481 5.219 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -10.435 1.238 3.386 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -9.766 1.822 4.928 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -9.457 2.723 3.425 1.00 0.00 H new ATOM 1927 N CYS A 118 -4.654 1.545 6.420 1.00 0.00 N ATOM 1928 CA CYS A 118 -3.515 2.317 6.871 1.00 0.00 C ATOM 1929 C CYS A 118 -2.427 2.213 5.816 1.00 0.00 C ATOM 1930 O CYS A 118 -1.625 1.277 5.825 1.00 0.00 O ATOM 1931 CB CYS A 118 -3.009 1.771 8.200 1.00 0.00 C ATOM 1932 SG CYS A 118 -4.331 1.861 9.436 1.00 0.00 S ATOM 0 H CYS A 118 -4.452 0.566 6.218 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.799 3.359 7.016 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -2.680 0.739 8.079 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -2.144 2.344 8.535 1.00 0.00 H new ATOM 0 HG CYS A 118 -3.898 1.393 10.569 1.00 0.00 H new ATOM 1938 N ILE A 119 -2.431 3.155 4.879 1.00 0.00 N ATOM 1939 CA ILE A 119 -1.479 3.142 3.800 1.00 0.00 C ATOM 1940 C ILE A 119 -0.193 3.866 4.140 1.00 0.00 C ATOM 1941 O ILE A 119 -0.199 5.020 4.570 1.00 0.00 O ATOM 1942 CB ILE A 119 -2.120 3.786 2.593 1.00 0.00 C ATOM 1943 CG1 ILE A 119 -3.578 3.297 2.519 1.00 0.00 C ATOM 1944 CG2 ILE A 119 -1.328 3.389 1.344 1.00 0.00 C ATOM 1945 CD1 ILE A 119 -4.099 3.394 1.097 1.00 0.00 C ATOM 0 H ILE A 119 -3.089 3.934 4.854 1.00 0.00 H new ATOM 0 HA ILE A 119 -1.210 2.105 3.601 1.00 0.00 H new ATOM 0 HB ILE A 119 -2.114 4.874 2.663 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -3.640 2.266 2.866 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -4.202 3.895 3.183 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.781 3.848 0.465 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -0.298 3.732 1.442 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -1.341 2.305 1.235 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -5.131 3.044 1.063 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -4.056 4.431 0.764 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.485 2.776 0.442 1.00 0.00 H new ATOM 1957 N PHE A 120 0.912 3.181 3.897 1.00 0.00 N ATOM 1958 CA PHE A 120 2.227 3.746 4.121 1.00 0.00 C ATOM 1959 C PHE A 120 2.931 3.774 2.778 1.00 0.00 C ATOM 1960 O PHE A 120 3.385 2.744 2.279 1.00 0.00 O ATOM 1961 CB PHE A 120 3.004 2.880 5.114 1.00 0.00 C ATOM 1962 CG PHE A 120 2.690 3.312 6.530 1.00 0.00 C ATOM 1963 CD1 PHE A 120 1.399 3.742 6.869 1.00 0.00 C ATOM 1964 CD2 PHE A 120 3.692 3.274 7.508 1.00 0.00 C ATOM 1965 CE1 PHE A 120 1.114 4.134 8.182 1.00 0.00 C ATOM 1966 CE2 PHE A 120 3.404 3.665 8.822 1.00 0.00 C ATOM 1967 CZ PHE A 120 2.115 4.095 9.159 1.00 0.00 C ATOM 0 H PHE A 120 0.921 2.225 3.542 1.00 0.00 H new ATOM 0 HA PHE A 120 2.158 4.750 4.540 1.00 0.00 H new ATOM 0 HB2 PHE A 120 2.741 1.831 4.978 1.00 0.00 H new ATOM 0 HB3 PHE A 120 4.074 2.968 4.927 1.00 0.00 H new ATOM 0 HD1 PHE A 120 0.625 3.771 6.117 1.00 0.00 H new ATOM 0 HD2 PHE A 120 4.687 2.943 7.249 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.120 4.467 8.442 1.00 0.00 H new ATOM 0 HE2 PHE A 120 4.177 3.635 9.576 1.00 0.00 H new ATOM 0 HZ PHE A 120 1.893 4.396 10.172 1.00 0.00 H new ATOM 1977 N THR A 121 2.966 4.950 2.170 1.00 0.00 N ATOM 1978 CA THR A 121 3.554 5.100 0.845 1.00 0.00 C ATOM 1979 C THR A 121 4.789 6.002 0.878 1.00 0.00 C ATOM 1980 O THR A 121 4.986 6.773 1.818 1.00 0.00 O ATOM 1981 CB THR A 121 2.484 5.656 -0.119 1.00 0.00 C ATOM 1982 OG1 THR A 121 2.953 6.857 -0.710 1.00 0.00 O ATOM 1983 CG2 THR A 121 1.178 5.932 0.643 1.00 0.00 C ATOM 0 H THR A 121 2.596 5.812 2.570 1.00 0.00 H new ATOM 0 HA THR A 121 3.887 4.124 0.492 1.00 0.00 H new ATOM 0 HB THR A 121 2.291 4.918 -0.898 1.00 0.00 H new ATOM 0 HG1 THR A 121 2.220 7.291 -1.195 1.00 0.00 H new ATOM 0 HG21 THR A 121 0.430 6.324 -0.047 1.00 0.00 H new ATOM 0 HG22 THR A 121 0.813 5.006 1.086 1.00 0.00 H new ATOM 0 HG23 THR A 121 1.364 6.663 1.430 1.00 0.00 H new ATOM 1991 N ALA A 122 5.637 5.865 -0.145 1.00 0.00 N ATOM 1992 CA ALA A 122 6.878 6.637 -0.217 1.00 0.00 C ATOM 1993 C ALA A 122 6.729 7.905 -1.050 1.00 0.00 C ATOM 1994 O ALA A 122 6.856 9.011 -0.524 1.00 0.00 O ATOM 1995 CB ALA A 122 7.991 5.772 -0.809 1.00 0.00 C ATOM 0 H ALA A 122 5.487 5.231 -0.930 1.00 0.00 H new ATOM 0 HA ALA A 122 7.129 6.938 0.800 1.00 0.00 H new ATOM 0 HB1 ALA A 122 8.913 6.351 -0.861 1.00 0.00 H new ATOM 0 HB2 ALA A 122 8.147 4.897 -0.178 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.708 5.450 -1.811 1.00 0.00 H new ATOM 2001 N ARG A 123 6.493 7.757 -2.352 1.00 0.00 N ATOM 2002 CA ARG A 123 6.368 8.932 -3.209 1.00 0.00 C ATOM 2003 C ARG A 123 5.615 8.631 -4.500 1.00 0.00 C ATOM 2004 O ARG A 123 5.644 7.513 -5.013 1.00 0.00 O ATOM 2005 CB ARG A 123 7.760 9.470 -3.549 1.00 0.00 C ATOM 2006 CG ARG A 123 8.709 8.297 -3.797 1.00 0.00 C ATOM 2007 CD ARG A 123 9.875 8.753 -4.675 1.00 0.00 C ATOM 2008 NE ARG A 123 10.873 7.694 -4.778 1.00 0.00 N ATOM 2009 CZ ARG A 123 10.785 6.756 -5.715 1.00 0.00 C ATOM 2010 NH1 ARG A 123 9.796 6.776 -6.568 1.00 0.00 N ATOM 2011 NH2 ARG A 123 11.688 5.816 -5.785 1.00 0.00 N ATOM 0 H ARG A 123 6.387 6.860 -2.826 1.00 0.00 H new ATOM 0 HA ARG A 123 5.794 9.677 -2.658 1.00 0.00 H new ATOM 0 HB2 ARG A 123 7.711 10.106 -4.433 1.00 0.00 H new ATOM 0 HB3 ARG A 123 8.133 10.088 -2.732 1.00 0.00 H new ATOM 0 HG2 ARG A 123 9.084 7.914 -2.848 1.00 0.00 H new ATOM 0 HG3 ARG A 123 8.174 7.480 -4.282 1.00 0.00 H new ATOM 0 HD2 ARG A 123 9.511 9.017 -5.668 1.00 0.00 H new ATOM 0 HD3 ARG A 123 10.328 9.650 -4.253 1.00 0.00 H new ATOM 0 HE ARG A 123 11.652 7.673 -4.119 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.091 7.512 -6.515 1.00 0.00 H new ATOM 0 HH12 ARG A 123 9.728 6.056 -7.287 1.00 0.00 H new ATOM 0 HH21 ARG A 123 12.461 5.801 -5.120 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.620 5.096 -6.504 1.00 0.00 H new ATOM 2025 N ILE A 124 4.944 9.659 -5.011 1.00 0.00 N ATOM 2026 CA ILE A 124 4.174 9.549 -6.244 1.00 0.00 C ATOM 2027 C ILE A 124 4.444 10.759 -7.132 1.00 0.00 C ATOM 2028 O ILE A 124 4.675 11.860 -6.635 1.00 0.00 O ATOM 2029 CB ILE A 124 2.686 9.498 -5.908 1.00 0.00 C ATOM 2030 CG1 ILE A 124 2.319 10.765 -5.097 1.00 0.00 C ATOM 2031 CG2 ILE A 124 2.402 8.224 -5.104 1.00 0.00 C ATOM 2032 CD1 ILE A 124 1.214 10.468 -4.081 1.00 0.00 C ATOM 0 H ILE A 124 4.919 10.585 -4.585 1.00 0.00 H new ATOM 0 HA ILE A 124 4.467 8.640 -6.770 1.00 0.00 H new ATOM 0 HB ILE A 124 2.081 9.475 -6.814 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.203 11.138 -4.579 1.00 0.00 H new ATOM 0 HG13 ILE A 124 1.991 11.553 -5.776 1.00 0.00 H new ATOM 0 HG21 ILE A 124 1.341 8.178 -4.859 1.00 0.00 H new ATOM 0 HG22 ILE A 124 2.676 7.351 -5.697 1.00 0.00 H new ATOM 0 HG23 ILE A 124 2.987 8.236 -4.184 1.00 0.00 H new ATOM 0 HD11 ILE A 124 0.977 11.376 -3.526 1.00 0.00 H new ATOM 0 HD12 ILE A 124 0.323 10.119 -4.604 1.00 0.00 H new ATOM 0 HD13 ILE A 124 1.554 9.698 -3.389 1.00 0.00 H new ATOM 2044 N TYR A 125 4.409 10.556 -8.445 1.00 0.00 N ATOM 2045 CA TYR A 125 4.650 11.653 -9.379 1.00 0.00 C ATOM 2046 C TYR A 125 3.664 11.602 -10.542 1.00 0.00 C ATOM 2047 O TYR A 125 3.701 10.685 -11.363 1.00 0.00 O ATOM 2048 CB TYR A 125 6.085 11.584 -9.904 1.00 0.00 C ATOM 2049 CG TYR A 125 7.023 12.144 -8.860 1.00 0.00 C ATOM 2050 CD1 TYR A 125 7.580 11.300 -7.893 1.00 0.00 C ATOM 2051 CD2 TYR A 125 7.334 13.510 -8.861 1.00 0.00 C ATOM 2052 CE1 TYR A 125 8.448 11.821 -6.925 1.00 0.00 C ATOM 2053 CE2 TYR A 125 8.202 14.030 -7.893 1.00 0.00 C ATOM 2054 CZ TYR A 125 8.759 13.186 -6.926 1.00 0.00 C ATOM 2055 OH TYR A 125 9.615 13.699 -5.973 1.00 0.00 O ATOM 0 H TYR A 125 4.219 9.655 -8.883 1.00 0.00 H new ATOM 0 HA TYR A 125 4.506 12.595 -8.850 1.00 0.00 H new ATOM 0 HB2 TYR A 125 6.352 10.552 -10.134 1.00 0.00 H new ATOM 0 HB3 TYR A 125 6.173 12.150 -10.831 1.00 0.00 H new ATOM 0 HD1 TYR A 125 7.341 10.247 -7.893 1.00 0.00 H new ATOM 0 HD2 TYR A 125 6.905 14.161 -9.608 1.00 0.00 H new ATOM 0 HE1 TYR A 125 8.877 11.170 -6.178 1.00 0.00 H new ATOM 0 HE2 TYR A 125 8.442 15.083 -7.893 1.00 0.00 H new ATOM 0 HH TYR A 125 9.725 14.662 -6.117 1.00 0.00 H new ATOM 2065 N ASP A 126 2.783 12.597 -10.605 1.00 0.00 N ATOM 2066 CA ASP A 126 1.785 12.668 -11.668 1.00 0.00 C ATOM 2067 C ASP A 126 1.605 14.109 -12.134 1.00 0.00 C ATOM 2068 O ASP A 126 1.994 15.048 -11.439 1.00 0.00 O ATOM 2069 CB ASP A 126 0.448 12.119 -11.168 1.00 0.00 C ATOM 2070 CG ASP A 126 -0.411 11.683 -12.350 1.00 0.00 C ATOM 2071 OD1 ASP A 126 -0.070 12.038 -13.467 1.00 0.00 O ATOM 2072 OD2 ASP A 126 -1.397 11.002 -12.122 1.00 0.00 O ATOM 0 H ASP A 126 2.740 13.364 -9.934 1.00 0.00 H new ATOM 0 HA ASP A 126 2.131 12.066 -12.508 1.00 0.00 H new ATOM 0 HB2 ASP A 126 0.619 11.274 -10.501 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -0.074 12.881 -10.590 1.00 0.00 H new ATOM 2148 N GLN A 132 -7.237 14.274 -8.751 1.00 0.00 N ATOM 2149 CA GLN A 132 -6.965 14.023 -7.341 1.00 0.00 C ATOM 2150 C GLN A 132 -8.256 13.761 -6.561 1.00 0.00 C ATOM 2151 O GLN A 132 -8.213 13.360 -5.396 1.00 0.00 O ATOM 2152 CB GLN A 132 -6.231 15.222 -6.737 1.00 0.00 C ATOM 2153 CG GLN A 132 -4.812 15.286 -7.308 1.00 0.00 C ATOM 2154 CD GLN A 132 -4.198 16.654 -7.032 1.00 0.00 C ATOM 2155 OE1 GLN A 132 -2.931 16.741 -6.733 1.00 0.00 O flip ATOM 2156 NE2 GLN A 132 -4.892 17.671 -7.089 1.00 0.00 N flip ATOM 0 HA GLN A 132 -6.341 13.132 -7.270 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -6.768 16.143 -6.963 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -6.195 15.132 -5.651 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -4.196 14.505 -6.861 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -4.835 15.099 -8.382 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -5.882 17.600 -7.323 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -4.476 18.583 -6.902 1.00 0.00 H new ATOM 2165 N GLU A 133 -9.401 14.010 -7.199 1.00 0.00 N ATOM 2166 CA GLU A 133 -10.689 13.815 -6.539 1.00 0.00 C ATOM 2167 C GLU A 133 -10.646 12.628 -5.574 1.00 0.00 C ATOM 2168 O GLU A 133 -10.712 12.806 -4.359 1.00 0.00 O ATOM 2169 CB GLU A 133 -11.805 13.613 -7.577 1.00 0.00 C ATOM 2170 CG GLU A 133 -11.243 12.991 -8.846 1.00 0.00 C ATOM 2171 CD GLU A 133 -12.368 12.737 -9.844 1.00 0.00 C ATOM 2172 OE1 GLU A 133 -13.426 13.318 -9.673 1.00 0.00 O ATOM 2173 OE2 GLU A 133 -12.154 11.965 -10.763 1.00 0.00 O ATOM 0 H GLU A 133 -9.461 14.343 -8.161 1.00 0.00 H new ATOM 0 HA GLU A 133 -10.903 14.714 -5.962 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -12.583 12.971 -7.164 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.272 14.570 -7.809 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -10.498 13.653 -9.286 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -10.737 12.055 -8.609 1.00 0.00 H new ATOM 2180 N GLY A 134 -10.537 11.422 -6.113 1.00 0.00 N ATOM 2181 CA GLY A 134 -10.493 10.233 -5.278 1.00 0.00 C ATOM 2182 C GLY A 134 -9.460 10.383 -4.165 1.00 0.00 C ATOM 2183 O GLY A 134 -9.762 10.186 -2.990 1.00 0.00 O ATOM 0 H GLY A 134 -10.478 11.243 -7.115 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -11.476 10.053 -4.844 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -10.250 9.364 -5.889 1.00 0.00 H new ATOM 2187 N LEU A 135 -8.240 10.732 -4.551 1.00 0.00 N ATOM 2188 CA LEU A 135 -7.155 10.908 -3.592 1.00 0.00 C ATOM 2189 C LEU A 135 -7.669 11.464 -2.265 1.00 0.00 C ATOM 2190 O LEU A 135 -7.620 10.787 -1.240 1.00 0.00 O ATOM 2191 CB LEU A 135 -6.102 11.856 -4.186 1.00 0.00 C ATOM 2192 CG LEU A 135 -4.692 11.396 -3.793 1.00 0.00 C ATOM 2193 CD1 LEU A 135 -3.645 12.328 -4.426 1.00 0.00 C ATOM 2194 CD2 LEU A 135 -4.555 11.416 -2.265 1.00 0.00 C ATOM 0 H LEU A 135 -7.976 10.899 -5.522 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.708 9.934 -3.393 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -6.195 11.880 -5.272 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.274 12.871 -3.829 1.00 0.00 H new ATOM 0 HG LEU A 135 -4.528 10.381 -4.155 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -2.645 11.997 -4.144 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -3.743 12.302 -5.511 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -3.803 13.347 -4.072 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -3.553 11.089 -1.985 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.722 12.429 -1.898 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.292 10.744 -1.825 1.00 0.00 H new ATOM 2206 N ARG A 136 -8.141 12.704 -2.279 1.00 0.00 N ATOM 2207 CA ARG A 136 -8.632 13.320 -1.055 1.00 0.00 C ATOM 2208 C ARG A 136 -9.926 12.662 -0.579 1.00 0.00 C ATOM 2209 O ARG A 136 -10.338 12.847 0.567 1.00 0.00 O ATOM 2210 CB ARG A 136 -8.855 14.817 -1.271 1.00 0.00 C ATOM 2211 CG ARG A 136 -9.571 15.041 -2.596 1.00 0.00 C ATOM 2212 CD ARG A 136 -10.180 16.445 -2.618 1.00 0.00 C ATOM 2213 NE ARG A 136 -11.441 16.456 -1.885 1.00 0.00 N ATOM 2214 CZ ARG A 136 -12.035 17.597 -1.554 1.00 0.00 C ATOM 2215 NH1 ARG A 136 -11.493 18.737 -1.886 1.00 0.00 N ATOM 2216 NH2 ARG A 136 -13.161 17.579 -0.893 1.00 0.00 N ATOM 0 H ARG A 136 -8.194 13.294 -3.109 1.00 0.00 H new ATOM 0 HA ARG A 136 -7.877 13.176 -0.282 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -9.446 15.229 -0.453 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.899 15.341 -1.269 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -8.871 14.924 -3.424 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -10.352 14.292 -2.730 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -9.486 17.158 -2.173 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -10.346 16.762 -3.648 1.00 0.00 H new ATOM 0 HE ARG A 136 -11.875 15.571 -1.622 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -10.612 18.752 -2.400 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -11.950 19.612 -1.631 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -13.584 16.689 -0.631 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -13.617 18.455 -0.639 1.00 0.00 H new ATOM 2230 N THR A 137 -10.566 11.900 -1.459 1.00 0.00 N ATOM 2231 CA THR A 137 -11.814 11.233 -1.104 1.00 0.00 C ATOM 2232 C THR A 137 -11.553 9.963 -0.291 1.00 0.00 C ATOM 2233 O THR A 137 -12.061 9.844 0.813 1.00 0.00 O ATOM 2234 CB THR A 137 -12.641 10.990 -2.386 1.00 0.00 C ATOM 2235 OG1 THR A 137 -13.940 11.533 -2.205 1.00 0.00 O ATOM 2236 CG2 THR A 137 -12.769 9.508 -2.726 1.00 0.00 C ATOM 0 H THR A 137 -10.246 11.730 -2.413 1.00 0.00 H new ATOM 0 HA THR A 137 -12.406 11.873 -0.450 1.00 0.00 H new ATOM 0 HB THR A 137 -12.120 11.475 -3.212 1.00 0.00 H new ATOM 0 HG1 THR A 137 -14.472 11.385 -3.015 1.00 0.00 H new ATOM 0 HG21 THR A 137 -13.359 9.393 -3.635 1.00 0.00 H new ATOM 0 HG22 THR A 137 -11.777 9.083 -2.881 1.00 0.00 H new ATOM 0 HG23 THR A 137 -13.262 8.988 -1.905 1.00 0.00 H new ATOM 2244 N LEU A 138 -10.754 9.033 -0.796 1.00 0.00 N ATOM 2245 CA LEU A 138 -10.470 7.821 -0.031 1.00 0.00 C ATOM 2246 C LEU A 138 -9.597 8.148 1.182 1.00 0.00 C ATOM 2247 O LEU A 138 -9.579 7.403 2.159 1.00 0.00 O ATOM 2248 CB LEU A 138 -9.841 6.742 -0.952 1.00 0.00 C ATOM 2249 CG LEU A 138 -8.379 6.514 -0.616 1.00 0.00 C ATOM 2250 CD1 LEU A 138 -7.762 5.483 -1.574 1.00 0.00 C ATOM 2251 CD2 LEU A 138 -7.597 7.837 -0.714 1.00 0.00 C ATOM 0 H LEU A 138 -10.300 9.088 -1.708 1.00 0.00 H new ATOM 0 HA LEU A 138 -11.401 7.406 0.355 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -10.390 5.806 -0.847 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -9.933 7.051 -1.993 1.00 0.00 H new ATOM 0 HG LEU A 138 -8.318 6.134 0.404 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -6.713 5.331 -1.319 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -8.297 4.538 -1.485 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.837 5.848 -2.598 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -6.549 7.659 -0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.672 8.230 -1.728 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.015 8.559 -0.013 1.00 0.00 H new ATOM 2263 N ALA A 139 -8.888 9.269 1.120 1.00 0.00 N ATOM 2264 CA ALA A 139 -8.033 9.671 2.224 1.00 0.00 C ATOM 2265 C ALA A 139 -8.880 10.182 3.386 1.00 0.00 C ATOM 2266 O ALA A 139 -8.655 9.815 4.538 1.00 0.00 O ATOM 2267 CB ALA A 139 -7.060 10.757 1.755 1.00 0.00 C ATOM 0 H ALA A 139 -8.889 9.908 0.325 1.00 0.00 H new ATOM 0 HA ALA A 139 -7.462 8.808 2.566 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -6.421 11.056 2.586 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -6.444 10.368 0.944 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -7.622 11.621 1.401 1.00 0.00 H new ATOM 2273 N GLU A 140 -9.856 11.031 3.075 1.00 0.00 N ATOM 2274 CA GLU A 140 -10.730 11.583 4.100 1.00 0.00 C ATOM 2275 C GLU A 140 -11.906 10.680 4.365 1.00 0.00 C ATOM 2276 O GLU A 140 -12.371 10.552 5.497 1.00 0.00 O ATOM 2277 CB GLU A 140 -11.264 12.920 3.636 1.00 0.00 C ATOM 2278 CG GLU A 140 -10.142 13.941 3.661 1.00 0.00 C ATOM 2279 CD GLU A 140 -9.976 14.510 5.066 1.00 0.00 C ATOM 2280 OE1 GLU A 140 -10.833 15.272 5.481 1.00 0.00 O ATOM 2281 OE2 GLU A 140 -8.992 14.176 5.706 1.00 0.00 O ATOM 0 H GLU A 140 -10.059 11.349 2.127 1.00 0.00 H new ATOM 0 HA GLU A 140 -10.146 11.687 5.014 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -11.670 12.833 2.628 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -12.080 13.243 4.282 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -9.211 13.476 3.337 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -10.358 14.746 2.958 1.00 0.00 H new ATOM 2288 N ALA A 141 -12.405 10.083 3.308 1.00 0.00 N ATOM 2289 CA ALA A 141 -13.555 9.221 3.431 1.00 0.00 C ATOM 2290 C ALA A 141 -13.313 8.149 4.479 1.00 0.00 C ATOM 2291 O ALA A 141 -14.262 7.657 5.091 1.00 0.00 O ATOM 2292 CB ALA A 141 -13.901 8.601 2.086 1.00 0.00 C ATOM 0 H ALA A 141 -12.036 10.177 2.362 1.00 0.00 H new ATOM 0 HA ALA A 141 -14.404 9.822 3.757 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -14.771 7.954 2.197 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -14.125 9.390 1.368 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -13.055 8.014 1.728 1.00 0.00 H new ATOM 2298 N GLY A 142 -12.050 7.805 4.728 1.00 0.00 N ATOM 2299 CA GLY A 142 -11.779 6.810 5.761 1.00 0.00 C ATOM 2300 C GLY A 142 -10.424 6.122 5.617 1.00 0.00 C ATOM 2301 O GLY A 142 -10.017 5.387 6.517 1.00 0.00 O ATOM 0 H GLY A 142 -11.231 8.182 4.251 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -11.829 7.292 6.738 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -12.564 6.054 5.738 1.00 0.00 H new ATOM 2305 N ALA A 143 -9.711 6.346 4.519 1.00 0.00 N ATOM 2306 CA ALA A 143 -8.406 5.702 4.377 1.00 0.00 C ATOM 2307 C ALA A 143 -7.321 6.573 4.987 1.00 0.00 C ATOM 2308 O ALA A 143 -7.171 7.739 4.619 1.00 0.00 O ATOM 2309 CB ALA A 143 -8.076 5.439 2.909 1.00 0.00 C ATOM 0 H ALA A 143 -9.996 6.943 3.742 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.449 4.747 4.902 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -7.100 4.960 2.836 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.834 4.786 2.477 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -8.058 6.384 2.365 1.00 0.00 H new ATOM 2315 N LYS A 144 -6.555 6.005 5.911 1.00 0.00 N ATOM 2316 CA LYS A 144 -5.478 6.744 6.544 1.00 0.00 C ATOM 2317 C LYS A 144 -4.196 6.598 5.747 1.00 0.00 C ATOM 2318 O LYS A 144 -3.585 5.529 5.713 1.00 0.00 O ATOM 2319 CB LYS A 144 -5.255 6.233 7.950 1.00 0.00 C ATOM 2320 CG LYS A 144 -6.572 6.251 8.715 1.00 0.00 C ATOM 2321 CD LYS A 144 -7.139 7.676 8.852 1.00 0.00 C ATOM 2322 CE LYS A 144 -6.061 8.644 9.355 1.00 0.00 C ATOM 2323 NZ LYS A 144 -5.256 7.987 10.423 1.00 0.00 N ATOM 0 H LYS A 144 -6.661 5.043 6.234 1.00 0.00 H new ATOM 0 HA LYS A 144 -5.758 7.797 6.580 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -4.854 5.220 7.920 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -4.518 6.853 8.460 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -7.298 5.620 8.203 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -6.421 5.824 9.706 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -7.518 8.016 7.888 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -7.982 7.672 9.543 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -5.414 8.943 8.531 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -6.525 9.551 9.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -4.952 8.700 11.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -5.834 7.265 10.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -4.419 7.537 10.000 1.00 0.00 H new ATOM 2337 N ILE A 145 -3.795 7.684 5.109 1.00 0.00 N ATOM 2338 CA ILE A 145 -2.580 7.686 4.308 1.00 0.00 C ATOM 2339 C ILE A 145 -1.431 8.292 5.105 1.00 0.00 C ATOM 2340 O ILE A 145 -1.637 9.179 5.934 1.00 0.00 O ATOM 2341 CB ILE A 145 -2.782 8.497 3.020 1.00 0.00 C ATOM 2342 CG1 ILE A 145 -4.245 8.462 2.565 1.00 0.00 C ATOM 2343 CG2 ILE A 145 -1.908 7.930 1.905 1.00 0.00 C ATOM 2344 CD1 ILE A 145 -4.801 7.034 2.613 1.00 0.00 C ATOM 0 H ILE A 145 -4.291 8.575 5.129 1.00 0.00 H new ATOM 0 HA ILE A 145 -2.343 6.655 4.046 1.00 0.00 H new ATOM 0 HB ILE A 145 -2.502 9.529 3.231 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -4.844 9.111 3.204 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -4.324 8.853 1.551 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -2.057 8.511 0.995 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -0.860 7.983 2.201 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -2.181 6.891 1.721 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -5.841 7.037 2.285 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -4.215 6.393 1.954 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -4.743 6.655 3.633 1.00 0.00 H new ATOM 2356 N SER A 146 -0.221 7.812 4.846 1.00 0.00 N ATOM 2357 CA SER A 146 0.953 8.315 5.536 1.00 0.00 C ATOM 2358 C SER A 146 2.122 8.455 4.568 1.00 0.00 C ATOM 2359 O SER A 146 2.393 7.562 3.765 1.00 0.00 O ATOM 2360 CB SER A 146 1.323 7.360 6.675 1.00 0.00 C ATOM 2361 OG SER A 146 0.602 6.146 6.519 1.00 0.00 O ATOM 0 H SER A 146 -0.030 7.077 4.165 1.00 0.00 H new ATOM 0 HA SER A 146 0.729 9.299 5.947 1.00 0.00 H new ATOM 0 HB2 SER A 146 2.395 7.164 6.667 1.00 0.00 H new ATOM 0 HB3 SER A 146 1.089 7.815 7.638 1.00 0.00 H new ATOM 0 HG SER A 146 1.110 5.410 6.920 1.00 0.00 H new ATOM 2367 N ILE A 147 2.813 9.581 4.663 1.00 0.00 N ATOM 2368 CA ILE A 147 3.957 9.838 3.809 1.00 0.00 C ATOM 2369 C ILE A 147 5.203 9.253 4.468 1.00 0.00 C ATOM 2370 O ILE A 147 5.726 9.802 5.439 1.00 0.00 O ATOM 2371 CB ILE A 147 4.144 11.353 3.590 1.00 0.00 C ATOM 2372 CG1 ILE A 147 2.924 12.032 2.877 1.00 0.00 C ATOM 2373 CG2 ILE A 147 5.407 11.591 2.749 1.00 0.00 C ATOM 2374 CD1 ILE A 147 1.742 11.083 2.640 1.00 0.00 C ATOM 0 H ILE A 147 2.600 10.329 5.323 1.00 0.00 H new ATOM 0 HA ILE A 147 3.792 9.372 2.838 1.00 0.00 H new ATOM 0 HB ILE A 147 4.233 11.806 4.578 1.00 0.00 H new ATOM 0 HG12 ILE A 147 2.586 12.876 3.479 1.00 0.00 H new ATOM 0 HG13 ILE A 147 3.253 12.435 1.919 1.00 0.00 H new ATOM 0 HG21 ILE A 147 5.543 12.661 2.592 1.00 0.00 H new ATOM 0 HG22 ILE A 147 6.274 11.188 3.272 1.00 0.00 H new ATOM 0 HG23 ILE A 147 5.301 11.093 1.785 1.00 0.00 H new ATOM 0 HD11 ILE A 147 0.936 11.623 2.143 1.00 0.00 H new ATOM 0 HD12 ILE A 147 2.063 10.252 2.012 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.386 10.699 3.596 1.00 0.00 H new ATOM 2386 N MET A 148 5.654 8.120 3.941 1.00 0.00 N ATOM 2387 CA MET A 148 6.820 7.434 4.485 1.00 0.00 C ATOM 2388 C MET A 148 8.102 8.231 4.242 1.00 0.00 C ATOM 2389 O MET A 148 8.684 8.173 3.159 1.00 0.00 O ATOM 2390 CB MET A 148 6.937 6.049 3.842 1.00 0.00 C ATOM 2391 CG MET A 148 7.796 5.135 4.712 1.00 0.00 C ATOM 2392 SD MET A 148 8.643 3.941 3.649 1.00 0.00 S ATOM 2393 CE MET A 148 7.165 3.077 3.062 1.00 0.00 C ATOM 0 H MET A 148 5.230 7.657 3.137 1.00 0.00 H new ATOM 0 HA MET A 148 6.690 7.335 5.563 1.00 0.00 H new ATOM 0 HB2 MET A 148 5.946 5.615 3.714 1.00 0.00 H new ATOM 0 HB3 MET A 148 7.377 6.137 2.849 1.00 0.00 H new ATOM 0 HG2 MET A 148 8.523 5.722 5.273 1.00 0.00 H new ATOM 0 HG3 MET A 148 7.175 4.616 5.442 1.00 0.00 H new ATOM 0 HE1 MET A 148 7.453 2.125 2.617 1.00 0.00 H new ATOM 0 HE2 MET A 148 6.492 2.897 3.900 1.00 0.00 H new ATOM 0 HE3 MET A 148 6.659 3.688 2.315 1.00 0.00 H new ATOM 2403 N THR A 149 8.536 8.965 5.264 1.00 0.00 N ATOM 2404 CA THR A 149 9.754 9.764 5.164 1.00 0.00 C ATOM 2405 C THR A 149 10.947 8.988 5.723 1.00 0.00 C ATOM 2406 O THR A 149 10.798 7.858 6.181 1.00 0.00 O ATOM 2407 CB THR A 149 9.583 11.080 5.937 1.00 0.00 C ATOM 2408 OG1 THR A 149 8.740 10.859 7.058 1.00 0.00 O ATOM 2409 CG2 THR A 149 8.956 12.148 5.029 1.00 0.00 C ATOM 0 H THR A 149 8.065 9.023 6.167 1.00 0.00 H new ATOM 0 HA THR A 149 9.939 9.986 4.113 1.00 0.00 H new ATOM 0 HB THR A 149 10.560 11.428 6.272 1.00 0.00 H new ATOM 0 HG1 THR A 149 8.630 11.697 7.555 1.00 0.00 H new ATOM 0 HG21 THR A 149 8.839 13.077 5.587 1.00 0.00 H new ATOM 0 HG22 THR A 149 9.603 12.320 4.169 1.00 0.00 H new ATOM 0 HG23 THR A 149 7.980 11.806 4.685 1.00 0.00 H new ATOM 2417 N TYR A 150 12.127 9.601 5.671 1.00 0.00 N ATOM 2418 CA TYR A 150 13.342 8.957 6.165 1.00 0.00 C ATOM 2419 C TYR A 150 13.050 8.060 7.373 1.00 0.00 C ATOM 2420 O TYR A 150 13.278 6.851 7.322 1.00 0.00 O ATOM 2421 CB TYR A 150 14.391 10.023 6.517 1.00 0.00 C ATOM 2422 CG TYR A 150 14.158 10.568 7.903 1.00 0.00 C ATOM 2423 CD1 TYR A 150 13.156 11.519 8.121 1.00 0.00 C ATOM 2424 CD2 TYR A 150 14.951 10.126 8.967 1.00 0.00 C ATOM 2425 CE1 TYR A 150 12.944 12.029 9.409 1.00 0.00 C ATOM 2426 CE2 TYR A 150 14.741 10.635 10.254 1.00 0.00 C ATOM 2427 CZ TYR A 150 13.738 11.587 10.475 1.00 0.00 C ATOM 2428 OH TYR A 150 13.529 12.088 11.743 1.00 0.00 O ATOM 0 H TYR A 150 12.268 10.538 5.294 1.00 0.00 H new ATOM 0 HA TYR A 150 13.737 8.318 5.375 1.00 0.00 H new ATOM 0 HB2 TYR A 150 15.390 9.591 6.455 1.00 0.00 H new ATOM 0 HB3 TYR A 150 14.349 10.835 5.791 1.00 0.00 H new ATOM 0 HD1 TYR A 150 12.546 11.860 7.297 1.00 0.00 H new ATOM 0 HD2 TYR A 150 15.725 9.392 8.796 1.00 0.00 H new ATOM 0 HE1 TYR A 150 12.169 12.762 9.580 1.00 0.00 H new ATOM 0 HE2 TYR A 150 15.352 10.294 11.076 1.00 0.00 H new ATOM 0 HH TYR A 150 14.164 11.676 12.366 1.00 0.00 H new ATOM 2438 N SER A 151 12.552 8.650 8.455 1.00 0.00 N ATOM 2439 CA SER A 151 12.244 7.885 9.660 1.00 0.00 C ATOM 2440 C SER A 151 11.323 6.717 9.337 1.00 0.00 C ATOM 2441 O SER A 151 11.631 5.558 9.628 1.00 0.00 O ATOM 2442 CB SER A 151 11.565 8.786 10.692 1.00 0.00 C ATOM 2443 OG SER A 151 11.780 8.253 11.993 1.00 0.00 O ATOM 0 H SER A 151 12.354 9.648 8.523 1.00 0.00 H new ATOM 0 HA SER A 151 13.180 7.499 10.065 1.00 0.00 H new ATOM 0 HB2 SER A 151 11.967 9.797 10.630 1.00 0.00 H new ATOM 0 HB3 SER A 151 10.497 8.854 10.486 1.00 0.00 H new ATOM 0 HG SER A 151 11.348 8.829 12.658 1.00 0.00 H new ATOM 2449 N GLU A 152 10.190 7.033 8.733 1.00 0.00 N ATOM 2450 CA GLU A 152 9.221 6.013 8.373 1.00 0.00 C ATOM 2451 C GLU A 152 9.813 5.073 7.336 1.00 0.00 C ATOM 2452 O GLU A 152 9.289 3.983 7.100 1.00 0.00 O ATOM 2453 CB GLU A 152 7.954 6.669 7.823 1.00 0.00 C ATOM 2454 CG GLU A 152 7.079 7.143 8.987 1.00 0.00 C ATOM 2455 CD GLU A 152 7.800 8.229 9.777 1.00 0.00 C ATOM 2456 OE1 GLU A 152 7.758 9.371 9.350 1.00 0.00 O ATOM 2457 OE2 GLU A 152 8.384 7.905 10.797 1.00 0.00 O ATOM 0 H GLU A 152 9.920 7.984 8.483 1.00 0.00 H new ATOM 0 HA GLU A 152 8.965 5.438 9.263 1.00 0.00 H new ATOM 0 HB2 GLU A 152 8.216 7.512 7.184 1.00 0.00 H new ATOM 0 HB3 GLU A 152 7.403 5.960 7.205 1.00 0.00 H new ATOM 0 HG2 GLU A 152 6.132 7.527 8.607 1.00 0.00 H new ATOM 0 HG3 GLU A 152 6.843 6.303 9.640 1.00 0.00 H new ATOM 2464 N PHE A 153 10.916 5.495 6.727 1.00 0.00 N ATOM 2465 CA PHE A 153 11.576 4.673 5.728 1.00 0.00 C ATOM 2466 C PHE A 153 12.300 3.524 6.425 1.00 0.00 C ATOM 2467 O PHE A 153 11.825 2.391 6.439 1.00 0.00 O ATOM 2468 CB PHE A 153 12.577 5.536 4.933 1.00 0.00 C ATOM 2469 CG PHE A 153 12.527 5.185 3.464 1.00 0.00 C ATOM 2470 CD1 PHE A 153 11.390 5.492 2.706 1.00 0.00 C ATOM 2471 CD2 PHE A 153 13.620 4.556 2.860 1.00 0.00 C ATOM 2472 CE1 PHE A 153 11.348 5.168 1.345 1.00 0.00 C ATOM 2473 CE2 PHE A 153 13.578 4.231 1.499 1.00 0.00 C ATOM 2474 CZ PHE A 153 12.442 4.536 0.741 1.00 0.00 C ATOM 0 H PHE A 153 11.366 6.393 6.907 1.00 0.00 H new ATOM 0 HA PHE A 153 10.840 4.263 5.036 1.00 0.00 H new ATOM 0 HB2 PHE A 153 12.344 6.592 5.069 1.00 0.00 H new ATOM 0 HB3 PHE A 153 13.585 5.380 5.316 1.00 0.00 H new ATOM 0 HD1 PHE A 153 10.546 5.979 3.172 1.00 0.00 H new ATOM 0 HD2 PHE A 153 14.497 4.321 3.444 1.00 0.00 H new ATOM 0 HE1 PHE A 153 10.472 5.406 0.760 1.00 0.00 H new ATOM 0 HE2 PHE A 153 14.423 3.745 1.034 1.00 0.00 H new ATOM 0 HZ PHE A 153 12.409 4.284 -0.309 1.00 0.00 H new ATOM 2484 N LYS A 154 13.428 3.830 7.052 1.00 0.00 N ATOM 2485 CA LYS A 154 14.163 2.801 7.773 1.00 0.00 C ATOM 2486 C LYS A 154 13.180 1.971 8.584 1.00 0.00 C ATOM 2487 O LYS A 154 13.443 0.813 8.918 1.00 0.00 O ATOM 2488 CB LYS A 154 15.226 3.419 8.698 1.00 0.00 C ATOM 2489 CG LYS A 154 14.714 4.732 9.333 1.00 0.00 C ATOM 2490 CD LYS A 154 15.630 5.902 8.947 1.00 0.00 C ATOM 2491 CE LYS A 154 16.940 5.809 9.731 1.00 0.00 C ATOM 2492 NZ LYS A 154 18.020 6.511 8.982 1.00 0.00 N ATOM 0 H LYS A 154 13.846 4.760 7.077 1.00 0.00 H new ATOM 0 HA LYS A 154 14.681 2.167 7.053 1.00 0.00 H new ATOM 0 HB2 LYS A 154 15.487 2.709 9.483 1.00 0.00 H new ATOM 0 HB3 LYS A 154 16.136 3.616 8.131 1.00 0.00 H new ATOM 0 HG2 LYS A 154 13.696 4.933 8.999 1.00 0.00 H new ATOM 0 HG3 LYS A 154 14.680 4.630 10.418 1.00 0.00 H new ATOM 0 HD2 LYS A 154 15.833 5.880 7.876 1.00 0.00 H new ATOM 0 HD3 LYS A 154 15.135 6.850 9.158 1.00 0.00 H new ATOM 0 HE2 LYS A 154 16.818 6.256 10.718 1.00 0.00 H new ATOM 0 HE3 LYS A 154 17.210 4.764 9.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 18.868 5.909 8.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 17.699 6.708 8.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 18.249 7.406 9.460 1.00 0.00 H new ATOM 2506 N HIS A 155 12.026 2.568 8.872 1.00 0.00 N ATOM 2507 CA HIS A 155 10.989 1.876 9.617 1.00 0.00 C ATOM 2508 C HIS A 155 10.284 0.893 8.695 1.00 0.00 C ATOM 2509 O HIS A 155 10.058 -0.263 9.050 1.00 0.00 O ATOM 2510 CB HIS A 155 9.977 2.883 10.164 1.00 0.00 C ATOM 2511 CG HIS A 155 9.224 2.270 11.313 1.00 0.00 C ATOM 2512 ND1 HIS A 155 9.027 2.943 12.508 1.00 0.00 N ATOM 2513 CD2 HIS A 155 8.608 1.052 11.463 1.00 0.00 C ATOM 2514 CE1 HIS A 155 8.319 2.134 13.318 1.00 0.00 C ATOM 2515 NE2 HIS A 155 8.037 0.969 12.729 1.00 0.00 N ATOM 0 H HIS A 155 11.791 3.523 8.601 1.00 0.00 H new ATOM 0 HA HIS A 155 11.440 1.340 10.452 1.00 0.00 H new ATOM 0 HB2 HIS A 155 10.490 3.787 10.493 1.00 0.00 H new ATOM 0 HB3 HIS A 155 9.282 3.179 9.378 1.00 0.00 H new ATOM 0 HD2 HIS A 155 8.572 0.276 10.712 1.00 0.00 H new ATOM 0 HE1 HIS A 155 8.016 2.395 14.321 1.00 0.00 H new ATOM 0 HE2 HIS A 155 7.515 0.186 13.123 1.00 0.00 H new ATOM 2524 N CYS A 156 9.953 1.369 7.500 1.00 0.00 N ATOM 2525 CA CYS A 156 9.285 0.533 6.514 1.00 0.00 C ATOM 2526 C CYS A 156 9.989 -0.816 6.416 1.00 0.00 C ATOM 2527 O CYS A 156 9.343 -1.843 6.204 1.00 0.00 O ATOM 2528 CB CYS A 156 9.262 1.249 5.154 1.00 0.00 C ATOM 2529 SG CYS A 156 9.456 0.061 3.795 1.00 0.00 S ATOM 0 H CYS A 156 10.136 2.324 7.193 1.00 0.00 H new ATOM 0 HA CYS A 156 8.255 0.356 6.823 1.00 0.00 H new ATOM 0 HB2 CYS A 156 8.323 1.790 5.039 1.00 0.00 H new ATOM 0 HB3 CYS A 156 10.062 1.988 5.114 1.00 0.00 H new ATOM 0 HG CYS A 156 9.049 -1.111 4.182 1.00 0.00 H new ATOM 2535 N TRP A 157 11.308 -0.823 6.608 1.00 0.00 N ATOM 2536 CA TRP A 157 12.045 -2.075 6.572 1.00 0.00 C ATOM 2537 C TRP A 157 11.758 -2.809 7.870 1.00 0.00 C ATOM 2538 O TRP A 157 11.336 -3.965 7.889 1.00 0.00 O ATOM 2539 CB TRP A 157 13.557 -1.814 6.470 1.00 0.00 C ATOM 2540 CG TRP A 157 13.984 -1.689 5.039 1.00 0.00 C ATOM 2541 CD1 TRP A 157 14.769 -2.577 4.392 1.00 0.00 C ATOM 2542 CD2 TRP A 157 13.696 -0.631 4.082 1.00 0.00 C ATOM 2543 NE1 TRP A 157 14.963 -2.144 3.093 1.00 0.00 N ATOM 2544 CE2 TRP A 157 14.325 -0.950 2.855 1.00 0.00 C ATOM 2545 CE3 TRP A 157 12.954 0.557 4.153 1.00 0.00 C ATOM 2546 CZ2 TRP A 157 14.223 -0.121 1.744 1.00 0.00 C ATOM 2547 CZ3 TRP A 157 12.848 1.400 3.034 1.00 0.00 C ATOM 2548 CH2 TRP A 157 13.484 1.059 1.831 1.00 0.00 C ATOM 0 H TRP A 157 11.873 0.007 6.786 1.00 0.00 H new ATOM 0 HA TRP A 157 11.739 -2.659 5.704 1.00 0.00 H new ATOM 0 HB2 TRP A 157 13.810 -0.901 7.010 1.00 0.00 H new ATOM 0 HB3 TRP A 157 14.103 -2.628 6.947 1.00 0.00 H new ATOM 0 HD1 TRP A 157 15.179 -3.480 4.820 1.00 0.00 H new ATOM 0 HE1 TRP A 157 15.512 -2.649 2.397 1.00 0.00 H new ATOM 0 HE3 TRP A 157 12.460 0.826 5.075 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 14.713 -0.389 0.819 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 12.275 2.313 3.100 1.00 0.00 H new ATOM 0 HH2 TRP A 157 13.402 1.710 0.973 1.00 0.00 H new ATOM 2559 N ASP A 158 11.995 -2.089 8.949 1.00 0.00 N ATOM 2560 CA ASP A 158 11.791 -2.591 10.295 1.00 0.00 C ATOM 2561 C ASP A 158 10.392 -3.180 10.488 1.00 0.00 C ATOM 2562 O ASP A 158 10.074 -3.712 11.549 1.00 0.00 O ATOM 2563 CB ASP A 158 11.982 -1.416 11.252 1.00 0.00 C ATOM 2564 CG ASP A 158 12.145 -1.894 12.692 1.00 0.00 C ATOM 2565 OD1 ASP A 158 11.632 -2.952 13.011 1.00 0.00 O ATOM 2566 OD2 ASP A 158 12.775 -1.185 13.459 1.00 0.00 O ATOM 0 H ASP A 158 12.338 -1.129 8.916 1.00 0.00 H new ATOM 0 HA ASP A 158 12.503 -3.393 10.487 1.00 0.00 H new ATOM 0 HB2 ASP A 158 12.860 -0.842 10.956 1.00 0.00 H new ATOM 0 HB3 ASP A 158 11.125 -0.746 11.184 1.00 0.00 H new ATOM 2571 N THR A 159 9.549 -3.051 9.477 1.00 0.00 N ATOM 2572 CA THR A 159 8.172 -3.539 9.577 1.00 0.00 C ATOM 2573 C THR A 159 7.999 -4.966 9.052 1.00 0.00 C ATOM 2574 O THR A 159 7.383 -5.802 9.714 1.00 0.00 O ATOM 2575 CB THR A 159 7.246 -2.594 8.800 1.00 0.00 C ATOM 2576 OG1 THR A 159 7.432 -1.271 9.283 1.00 0.00 O ATOM 2577 CG2 THR A 159 5.772 -3.000 8.986 1.00 0.00 C ATOM 0 H THR A 159 9.785 -2.618 8.584 1.00 0.00 H new ATOM 0 HA THR A 159 7.914 -3.558 10.636 1.00 0.00 H new ATOM 0 HB THR A 159 7.490 -2.651 7.739 1.00 0.00 H new ATOM 0 HG1 THR A 159 8.332 -0.961 9.049 1.00 0.00 H new ATOM 0 HG21 THR A 159 5.133 -2.317 8.427 1.00 0.00 H new ATOM 0 HG22 THR A 159 5.625 -4.016 8.619 1.00 0.00 H new ATOM 0 HG23 THR A 159 5.513 -2.955 10.044 1.00 0.00 H new ATOM 2585 N PHE A 160 8.496 -5.232 7.848 1.00 0.00 N ATOM 2586 CA PHE A 160 8.335 -6.557 7.237 1.00 0.00 C ATOM 2587 C PHE A 160 9.662 -7.302 7.114 1.00 0.00 C ATOM 2588 O PHE A 160 9.696 -8.532 7.113 1.00 0.00 O ATOM 2589 CB PHE A 160 7.707 -6.385 5.846 1.00 0.00 C ATOM 2590 CG PHE A 160 8.000 -4.993 5.327 1.00 0.00 C ATOM 2591 CD1 PHE A 160 7.339 -3.889 5.882 1.00 0.00 C ATOM 2592 CD2 PHE A 160 8.929 -4.806 4.297 1.00 0.00 C ATOM 2593 CE1 PHE A 160 7.608 -2.599 5.404 1.00 0.00 C ATOM 2594 CE2 PHE A 160 9.195 -3.515 3.820 1.00 0.00 C ATOM 2595 CZ PHE A 160 8.536 -2.413 4.374 1.00 0.00 C ATOM 0 H PHE A 160 9.009 -4.560 7.278 1.00 0.00 H new ATOM 0 HA PHE A 160 7.690 -7.153 7.882 1.00 0.00 H new ATOM 0 HB2 PHE A 160 8.107 -7.132 5.160 1.00 0.00 H new ATOM 0 HB3 PHE A 160 6.630 -6.545 5.899 1.00 0.00 H new ATOM 0 HD1 PHE A 160 6.623 -4.032 6.678 1.00 0.00 H new ATOM 0 HD2 PHE A 160 9.441 -5.656 3.870 1.00 0.00 H new ATOM 0 HE1 PHE A 160 7.098 -1.748 5.831 1.00 0.00 H new ATOM 0 HE2 PHE A 160 9.910 -3.371 3.023 1.00 0.00 H new ATOM 0 HZ PHE A 160 8.743 -1.419 4.007 1.00 0.00 H new ATOM 2605 N VAL A 161 10.741 -6.556 6.984 1.00 0.00 N ATOM 2606 CA VAL A 161 12.056 -7.152 6.832 1.00 0.00 C ATOM 2607 C VAL A 161 12.448 -7.970 8.067 1.00 0.00 C ATOM 2608 O VAL A 161 12.171 -7.575 9.200 1.00 0.00 O ATOM 2609 CB VAL A 161 13.061 -6.037 6.589 1.00 0.00 C ATOM 2610 CG1 VAL A 161 14.460 -6.623 6.444 1.00 0.00 C ATOM 2611 CG2 VAL A 161 12.671 -5.291 5.310 1.00 0.00 C ATOM 0 H VAL A 161 10.735 -5.536 6.980 1.00 0.00 H new ATOM 0 HA VAL A 161 12.044 -7.839 5.986 1.00 0.00 H new ATOM 0 HB VAL A 161 13.058 -5.347 7.433 1.00 0.00 H new ATOM 0 HG11 VAL A 161 15.175 -5.819 6.270 1.00 0.00 H new ATOM 0 HG12 VAL A 161 14.728 -7.156 7.357 1.00 0.00 H new ATOM 0 HG13 VAL A 161 14.479 -7.314 5.601 1.00 0.00 H new ATOM 0 HG21 VAL A 161 13.385 -4.488 5.125 1.00 0.00 H new ATOM 0 HG22 VAL A 161 12.678 -5.984 4.468 1.00 0.00 H new ATOM 0 HG23 VAL A 161 11.673 -4.869 5.425 1.00 0.00 H new ATOM 2621 N ASP A 162 13.084 -9.121 7.827 1.00 0.00 N ATOM 2622 CA ASP A 162 13.500 -10.009 8.914 1.00 0.00 C ATOM 2623 C ASP A 162 14.652 -9.413 9.713 1.00 0.00 C ATOM 2624 O ASP A 162 15.576 -10.117 10.120 1.00 0.00 O ATOM 2625 CB ASP A 162 13.931 -11.361 8.354 1.00 0.00 C ATOM 2626 CG ASP A 162 13.857 -12.421 9.449 1.00 0.00 C ATOM 2627 OD1 ASP A 162 13.375 -12.101 10.522 1.00 0.00 O ATOM 2628 OD2 ASP A 162 14.284 -13.536 9.200 1.00 0.00 O ATOM 0 H ASP A 162 13.321 -9.457 6.894 1.00 0.00 H new ATOM 0 HA ASP A 162 12.644 -10.135 9.577 1.00 0.00 H new ATOM 0 HB2 ASP A 162 13.288 -11.641 7.520 1.00 0.00 H new ATOM 0 HB3 ASP A 162 14.947 -11.297 7.965 1.00 0.00 H new ATOM 2633 N HIS A 163 14.579 -8.119 9.937 1.00 0.00 N ATOM 2634 CA HIS A 163 15.603 -7.415 10.697 1.00 0.00 C ATOM 2635 C HIS A 163 15.066 -6.075 11.143 1.00 0.00 C ATOM 2636 O HIS A 163 15.212 -5.070 10.447 1.00 0.00 O ATOM 2637 CB HIS A 163 16.840 -7.183 9.848 1.00 0.00 C ATOM 2638 CG HIS A 163 17.419 -8.497 9.410 1.00 0.00 C ATOM 2639 ND1 HIS A 163 17.229 -9.006 8.134 1.00 0.00 N ATOM 2640 CD2 HIS A 163 18.198 -9.414 10.069 1.00 0.00 C ATOM 2641 CE1 HIS A 163 17.881 -10.180 8.068 1.00 0.00 C ATOM 2642 NE2 HIS A 163 18.489 -10.476 9.219 1.00 0.00 N ATOM 0 H HIS A 163 13.819 -7.526 9.604 1.00 0.00 H new ATOM 0 HA HIS A 163 15.870 -8.026 11.559 1.00 0.00 H new ATOM 0 HB2 HIS A 163 16.584 -6.581 8.976 1.00 0.00 H new ATOM 0 HB3 HIS A 163 17.581 -6.622 10.417 1.00 0.00 H new ATOM 0 HD2 HIS A 163 18.534 -9.325 11.092 1.00 0.00 H new ATOM 0 HE1 HIS A 163 17.909 -10.808 7.190 1.00 0.00 H new ATOM 0 HE2 HIS A 163 19.047 -11.303 9.430 1.00 0.00 H new ATOM 2651 N GLN A 164 14.449 -6.069 12.301 1.00 0.00 N ATOM 2652 CA GLN A 164 13.888 -4.846 12.844 1.00 0.00 C ATOM 2653 C GLN A 164 14.921 -3.721 12.777 1.00 0.00 C ATOM 2654 O GLN A 164 14.612 -2.558 13.039 1.00 0.00 O ATOM 2655 CB GLN A 164 13.438 -5.078 14.287 1.00 0.00 C ATOM 2656 CG GLN A 164 12.158 -5.920 14.288 1.00 0.00 C ATOM 2657 CD GLN A 164 11.543 -5.937 15.682 1.00 0.00 C ATOM 2658 OE1 GLN A 164 11.561 -4.924 16.381 1.00 0.00 O ATOM 2659 NE2 GLN A 164 10.995 -7.033 16.130 1.00 0.00 N ATOM 0 H GLN A 164 14.321 -6.894 12.887 1.00 0.00 H new ATOM 0 HA GLN A 164 13.021 -4.554 12.251 1.00 0.00 H new ATOM 0 HB2 GLN A 164 14.222 -5.587 14.847 1.00 0.00 H new ATOM 0 HB3 GLN A 164 13.260 -4.124 14.783 1.00 0.00 H new ATOM 0 HG2 GLN A 164 11.444 -5.512 13.572 1.00 0.00 H new ATOM 0 HG3 GLN A 164 12.383 -6.938 13.969 1.00 0.00 H new ATOM 0 HE21 GLN A 164 10.981 -7.871 15.549 1.00 0.00 H new ATOM 0 HE22 GLN A 164 10.580 -7.052 17.062 1.00 0.00 H new ATOM 2668 N GLY A 165 16.149 -4.082 12.406 1.00 0.00 N ATOM 2669 CA GLY A 165 17.229 -3.112 12.278 1.00 0.00 C ATOM 2670 C GLY A 165 17.982 -3.331 10.970 1.00 0.00 C ATOM 2671 O GLY A 165 19.212 -3.365 10.944 1.00 0.00 O ATOM 0 H GLY A 165 16.418 -5.042 12.189 1.00 0.00 H new ATOM 0 HA2 GLY A 165 16.824 -2.100 12.308 1.00 0.00 H new ATOM 0 HA3 GLY A 165 17.914 -3.206 13.121 1.00 0.00 H new ATOM 2675 N CYS A 166 17.228 -3.491 9.885 1.00 0.00 N ATOM 2676 CA CYS A 166 17.822 -3.722 8.568 1.00 0.00 C ATOM 2677 C CYS A 166 19.001 -2.770 8.337 1.00 0.00 C ATOM 2678 O CYS A 166 19.163 -1.797 9.072 1.00 0.00 O ATOM 2679 CB CYS A 166 16.757 -3.533 7.478 1.00 0.00 C ATOM 2680 SG CYS A 166 16.736 -1.810 6.915 1.00 0.00 S ATOM 0 H CYS A 166 16.208 -3.465 9.890 1.00 0.00 H new ATOM 0 HA CYS A 166 18.197 -4.745 8.523 1.00 0.00 H new ATOM 0 HB2 CYS A 166 16.965 -4.195 6.638 1.00 0.00 H new ATOM 0 HB3 CYS A 166 15.776 -3.808 7.866 1.00 0.00 H new ATOM 0 HG CYS A 166 15.933 -1.695 5.899 1.00 0.00 H new ATOM 2686 N PRO A 167 19.830 -3.024 7.345 1.00 0.00 N ATOM 2687 CA PRO A 167 21.004 -2.165 7.048 1.00 0.00 C ATOM 2688 C PRO A 167 20.704 -1.056 6.035 1.00 0.00 C ATOM 2689 O PRO A 167 21.621 -0.385 5.562 1.00 0.00 O ATOM 2690 CB PRO A 167 21.996 -3.163 6.473 1.00 0.00 C ATOM 2691 CG PRO A 167 21.156 -4.156 5.732 1.00 0.00 C ATOM 2692 CD PRO A 167 19.765 -4.150 6.393 1.00 0.00 C ATOM 0 HA PRO A 167 21.355 -1.628 7.930 1.00 0.00 H new ATOM 0 HB2 PRO A 167 22.708 -2.674 5.809 1.00 0.00 H new ATOM 0 HB3 PRO A 167 22.574 -3.645 7.262 1.00 0.00 H new ATOM 0 HG2 PRO A 167 21.083 -3.889 4.678 1.00 0.00 H new ATOM 0 HG3 PRO A 167 21.601 -5.150 5.779 1.00 0.00 H new ATOM 0 HD2 PRO A 167 18.974 -4.006 5.657 1.00 0.00 H new ATOM 0 HD3 PRO A 167 19.560 -5.092 6.902 1.00 0.00 H new ATOM 2700 N PHE A 168 19.431 -0.859 5.701 1.00 0.00 N ATOM 2701 CA PHE A 168 19.072 0.185 4.743 1.00 0.00 C ATOM 2702 C PHE A 168 19.418 1.554 5.314 1.00 0.00 C ATOM 2703 O PHE A 168 19.532 1.717 6.528 1.00 0.00 O ATOM 2704 CB PHE A 168 17.578 0.134 4.411 1.00 0.00 C ATOM 2705 CG PHE A 168 17.311 0.931 3.158 1.00 0.00 C ATOM 2706 CD1 PHE A 168 17.376 0.310 1.905 1.00 0.00 C ATOM 2707 CD2 PHE A 168 16.993 2.290 3.250 1.00 0.00 C ATOM 2708 CE1 PHE A 168 17.124 1.050 0.745 1.00 0.00 C ATOM 2709 CE2 PHE A 168 16.740 3.030 2.090 1.00 0.00 C ATOM 2710 CZ PHE A 168 16.807 2.411 0.837 1.00 0.00 C ATOM 0 H PHE A 168 18.645 -1.395 6.070 1.00 0.00 H new ATOM 0 HA PHE A 168 19.638 0.015 3.827 1.00 0.00 H new ATOM 0 HB2 PHE A 168 17.261 -0.900 4.271 1.00 0.00 H new ATOM 0 HB3 PHE A 168 16.997 0.536 5.241 1.00 0.00 H new ATOM 0 HD1 PHE A 168 17.621 -0.740 1.834 1.00 0.00 H new ATOM 0 HD2 PHE A 168 16.943 2.768 4.217 1.00 0.00 H new ATOM 0 HE1 PHE A 168 17.174 0.572 -0.222 1.00 0.00 H new ATOM 0 HE2 PHE A 168 16.493 4.079 2.162 1.00 0.00 H new ATOM 0 HZ PHE A 168 16.614 2.983 -0.059 1.00 0.00 H new ATOM 2720 N GLN A 169 19.598 2.534 4.434 1.00 0.00 N ATOM 2721 CA GLN A 169 19.946 3.882 4.871 1.00 0.00 C ATOM 2722 C GLN A 169 19.258 4.946 4.014 1.00 0.00 C ATOM 2723 O GLN A 169 18.852 4.681 2.882 1.00 0.00 O ATOM 2724 CB GLN A 169 21.465 4.068 4.814 1.00 0.00 C ATOM 2725 CG GLN A 169 22.058 3.831 6.201 1.00 0.00 C ATOM 2726 CD GLN A 169 23.566 3.622 6.101 1.00 0.00 C ATOM 2727 OE1 GLN A 169 24.118 3.583 5.002 1.00 0.00 O ATOM 2728 NE2 GLN A 169 24.266 3.483 7.193 1.00 0.00 N ATOM 0 H GLN A 169 19.510 2.423 3.424 1.00 0.00 H new ATOM 0 HA GLN A 169 19.599 4.004 5.897 1.00 0.00 H new ATOM 0 HB2 GLN A 169 21.901 3.373 4.097 1.00 0.00 H new ATOM 0 HB3 GLN A 169 21.707 5.074 4.470 1.00 0.00 H new ATOM 0 HG2 GLN A 169 21.844 4.683 6.846 1.00 0.00 H new ATOM 0 HG3 GLN A 169 21.592 2.959 6.659 1.00 0.00 H new ATOM 0 HE21 GLN A 169 23.805 3.516 8.102 1.00 0.00 H new ATOM 0 HE22 GLN A 169 25.275 3.341 7.138 1.00 0.00 H new ATOM 2737 N PRO A 170 19.124 6.142 4.540 1.00 0.00 N ATOM 2738 CA PRO A 170 18.477 7.281 3.834 1.00 0.00 C ATOM 2739 C PRO A 170 19.454 8.076 2.966 1.00 0.00 C ATOM 2740 O PRO A 170 20.622 8.235 3.320 1.00 0.00 O ATOM 2741 CB PRO A 170 18.002 8.134 5.002 1.00 0.00 C ATOM 2742 CG PRO A 170 19.083 7.992 6.012 1.00 0.00 C ATOM 2743 CD PRO A 170 19.573 6.553 5.888 1.00 0.00 C ATOM 0 HA PRO A 170 17.697 6.959 3.144 1.00 0.00 H new ATOM 0 HB2 PRO A 170 17.865 9.174 4.707 1.00 0.00 H new ATOM 0 HB3 PRO A 170 17.045 7.784 5.389 1.00 0.00 H new ATOM 0 HG2 PRO A 170 19.891 8.699 5.824 1.00 0.00 H new ATOM 0 HG3 PRO A 170 18.710 8.194 7.016 1.00 0.00 H new ATOM 0 HD2 PRO A 170 20.657 6.490 5.985 1.00 0.00 H new ATOM 0 HD3 PRO A 170 19.146 5.917 6.663 1.00 0.00 H new ATOM 2751 N TRP A 171 18.963 8.587 1.837 1.00 0.00 N ATOM 2752 CA TRP A 171 19.794 9.380 0.936 1.00 0.00 C ATOM 2753 C TRP A 171 19.354 10.846 0.965 1.00 0.00 C ATOM 2754 O TRP A 171 18.201 11.150 1.277 1.00 0.00 O ATOM 2755 CB TRP A 171 19.680 8.830 -0.482 1.00 0.00 C ATOM 2756 CG TRP A 171 18.284 9.001 -0.971 1.00 0.00 C ATOM 2757 CD1 TRP A 171 17.884 9.898 -1.896 1.00 0.00 C ATOM 2758 CD2 TRP A 171 17.103 8.264 -0.576 1.00 0.00 C ATOM 2759 NE1 TRP A 171 16.515 9.765 -2.082 1.00 0.00 N ATOM 2760 CE2 TRP A 171 15.994 8.760 -1.294 1.00 0.00 C ATOM 2761 CE3 TRP A 171 16.895 7.222 0.331 1.00 0.00 C ATOM 2762 CZ2 TRP A 171 14.718 8.231 -1.112 1.00 0.00 C ATOM 2763 CZ3 TRP A 171 15.622 6.688 0.518 1.00 0.00 C ATOM 2764 CH2 TRP A 171 14.535 7.187 -0.200 1.00 0.00 C ATOM 0 H TRP A 171 17.999 8.466 1.527 1.00 0.00 H new ATOM 0 HA TRP A 171 20.832 9.320 1.263 1.00 0.00 H new ATOM 0 HB2 TRP A 171 20.374 9.350 -1.142 1.00 0.00 H new ATOM 0 HB3 TRP A 171 19.955 7.775 -0.498 1.00 0.00 H new ATOM 0 HD1 TRP A 171 18.523 10.603 -2.407 1.00 0.00 H new ATOM 0 HE1 TRP A 171 15.964 10.338 -2.721 1.00 0.00 H new ATOM 0 HE3 TRP A 171 17.729 6.827 0.892 1.00 0.00 H new ATOM 0 HZ2 TRP A 171 13.880 8.623 -1.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 171 15.476 5.883 1.223 1.00 0.00 H new ATOM 0 HH2 TRP A 171 13.551 6.767 -0.051 1.00 0.00 H new ATOM 2775 N ASP A 172 20.283 11.749 0.652 1.00 0.00 N ATOM 2776 CA ASP A 172 19.985 13.182 0.661 1.00 0.00 C ATOM 2777 C ASP A 172 19.025 13.565 -0.460 1.00 0.00 C ATOM 2778 O ASP A 172 19.196 14.591 -1.120 1.00 0.00 O ATOM 2779 CB ASP A 172 21.276 13.981 0.516 1.00 0.00 C ATOM 2780 CG ASP A 172 21.999 14.055 1.857 1.00 0.00 C ATOM 2781 OD1 ASP A 172 21.569 13.378 2.777 1.00 0.00 O ATOM 2782 OD2 ASP A 172 22.970 14.788 1.945 1.00 0.00 O ATOM 0 H ASP A 172 21.241 11.517 0.391 1.00 0.00 H new ATOM 0 HA ASP A 172 19.507 13.414 1.613 1.00 0.00 H new ATOM 0 HB2 ASP A 172 21.921 13.514 -0.228 1.00 0.00 H new ATOM 0 HB3 ASP A 172 21.053 14.986 0.158 1.00 0.00 H new ATOM 2787 N GLY A 173 18.008 12.745 -0.653 1.00 0.00 N ATOM 2788 CA GLY A 173 16.998 13.003 -1.678 1.00 0.00 C ATOM 2789 C GLY A 173 15.605 12.914 -1.074 1.00 0.00 C ATOM 2790 O GLY A 173 14.692 13.635 -1.483 1.00 0.00 O ATOM 0 H GLY A 173 17.854 11.892 -0.115 1.00 0.00 H new ATOM 0 HA2 GLY A 173 17.152 13.991 -2.111 1.00 0.00 H new ATOM 0 HA3 GLY A 173 17.098 12.281 -2.488 1.00 0.00 H new ATOM 2794 N LEU A 174 15.451 12.033 -0.085 1.00 0.00 N ATOM 2795 CA LEU A 174 14.180 11.865 0.582 1.00 0.00 C ATOM 2796 C LEU A 174 13.489 13.210 0.730 1.00 0.00 C ATOM 2797 O LEU A 174 12.264 13.301 0.818 1.00 0.00 O ATOM 2798 CB LEU A 174 14.422 11.278 1.958 1.00 0.00 C ATOM 2799 CG LEU A 174 14.664 9.779 1.825 1.00 0.00 C ATOM 2800 CD1 LEU A 174 15.351 9.275 3.079 1.00 0.00 C ATOM 2801 CD2 LEU A 174 13.339 9.037 1.641 1.00 0.00 C ATOM 0 H LEU A 174 16.196 11.430 0.264 1.00 0.00 H new ATOM 0 HA LEU A 174 13.548 11.200 -0.007 1.00 0.00 H new ATOM 0 HB2 LEU A 174 15.282 11.758 2.426 1.00 0.00 H new ATOM 0 HB3 LEU A 174 13.563 11.465 2.603 1.00 0.00 H new ATOM 0 HG LEU A 174 15.292 9.597 0.953 1.00 0.00 H new ATOM 0 HD11 LEU A 174 15.528 8.203 2.991 1.00 0.00 H new ATOM 0 HD12 LEU A 174 16.303 9.790 3.204 1.00 0.00 H new ATOM 0 HD13 LEU A 174 14.717 9.469 3.944 1.00 0.00 H new ATOM 0 HD21 LEU A 174 13.531 7.968 1.548 1.00 0.00 H new ATOM 0 HD22 LEU A 174 12.698 9.217 2.504 1.00 0.00 H new ATOM 0 HD23 LEU A 174 12.843 9.397 0.740 1.00 0.00 H new ATOM 2813 N ASP A 175 14.307 14.249 0.758 1.00 0.00 N ATOM 2814 CA ASP A 175 13.826 15.611 0.898 1.00 0.00 C ATOM 2815 C ASP A 175 12.861 15.946 -0.222 1.00 0.00 C ATOM 2816 O ASP A 175 11.670 16.163 0.001 1.00 0.00 O ATOM 2817 CB ASP A 175 15.014 16.568 0.830 1.00 0.00 C ATOM 2818 CG ASP A 175 15.957 16.139 -0.289 1.00 0.00 C ATOM 2819 OD1 ASP A 175 16.638 15.143 -0.114 1.00 0.00 O ATOM 2820 OD2 ASP A 175 15.984 16.814 -1.306 1.00 0.00 O ATOM 0 H ASP A 175 15.321 14.171 0.684 1.00 0.00 H new ATOM 0 HA ASP A 175 13.312 15.710 1.854 1.00 0.00 H new ATOM 0 HB2 ASP A 175 14.664 17.585 0.654 1.00 0.00 H new ATOM 0 HB3 ASP A 175 15.544 16.574 1.783 1.00 0.00 H new ATOM 2825 N GLU A 176 13.399 15.983 -1.428 1.00 0.00 N ATOM 2826 CA GLU A 176 12.602 16.290 -2.606 1.00 0.00 C ATOM 2827 C GLU A 176 11.423 15.338 -2.707 1.00 0.00 C ATOM 2828 O GLU A 176 10.282 15.758 -2.899 1.00 0.00 O ATOM 2829 CB GLU A 176 13.458 16.173 -3.857 1.00 0.00 C ATOM 2830 CG GLU A 176 12.774 16.898 -5.016 1.00 0.00 C ATOM 2831 CD GLU A 176 13.645 16.831 -6.265 1.00 0.00 C ATOM 2832 OE1 GLU A 176 14.695 17.451 -6.266 1.00 0.00 O ATOM 2833 OE2 GLU A 176 13.249 16.158 -7.204 1.00 0.00 O ATOM 0 H GLU A 176 14.385 15.804 -1.619 1.00 0.00 H new ATOM 0 HA GLU A 176 12.229 17.310 -2.517 1.00 0.00 H new ATOM 0 HB2 GLU A 176 14.443 16.603 -3.677 1.00 0.00 H new ATOM 0 HB3 GLU A 176 13.609 15.124 -4.110 1.00 0.00 H new ATOM 0 HG2 GLU A 176 11.803 16.445 -5.216 1.00 0.00 H new ATOM 0 HG3 GLU A 176 12.591 17.938 -4.747 1.00 0.00 H new ATOM 2840 N HIS A 177 11.713 14.053 -2.571 1.00 0.00 N ATOM 2841 CA HIS A 177 10.672 13.033 -2.644 1.00 0.00 C ATOM 2842 C HIS A 177 9.559 13.342 -1.646 1.00 0.00 C ATOM 2843 O HIS A 177 8.446 13.704 -2.031 1.00 0.00 O ATOM 2844 CB HIS A 177 11.269 11.657 -2.346 1.00 0.00 C ATOM 2845 CG HIS A 177 12.290 11.318 -3.399 1.00 0.00 C ATOM 2846 ND1 HIS A 177 11.992 11.343 -4.753 1.00 0.00 N ATOM 2847 CD2 HIS A 177 13.610 10.948 -3.313 1.00 0.00 C ATOM 2848 CE1 HIS A 177 13.108 10.996 -5.420 1.00 0.00 C ATOM 2849 NE2 HIS A 177 14.124 10.746 -4.590 1.00 0.00 N ATOM 0 H HIS A 177 12.653 13.691 -2.411 1.00 0.00 H new ATOM 0 HA HIS A 177 10.253 13.031 -3.650 1.00 0.00 H new ATOM 0 HB2 HIS A 177 11.733 11.655 -1.360 1.00 0.00 H new ATOM 0 HB3 HIS A 177 10.482 10.903 -2.330 1.00 0.00 H new ATOM 0 HD2 HIS A 177 14.165 10.832 -2.394 1.00 0.00 H new ATOM 0 HE1 HIS A 177 13.174 10.928 -6.496 1.00 0.00 H new ATOM 0 HE2 HIS A 177 15.073 10.467 -4.839 1.00 0.00 H new ATOM 2858 N SER A 178 9.874 13.206 -0.363 1.00 0.00 N ATOM 2859 CA SER A 178 8.903 13.484 0.689 1.00 0.00 C ATOM 2860 C SER A 178 8.092 14.728 0.343 1.00 0.00 C ATOM 2861 O SER A 178 6.870 14.672 0.213 1.00 0.00 O ATOM 2862 CB SER A 178 9.630 13.702 2.012 1.00 0.00 C ATOM 2863 OG SER A 178 8.715 14.215 2.971 1.00 0.00 O ATOM 0 H SER A 178 10.789 12.906 -0.027 1.00 0.00 H new ATOM 0 HA SER A 178 8.227 12.634 0.779 1.00 0.00 H new ATOM 0 HB2 SER A 178 10.056 12.763 2.365 1.00 0.00 H new ATOM 0 HB3 SER A 178 10.459 14.397 1.875 1.00 0.00 H new ATOM 0 HG SER A 178 9.211 14.648 3.697 1.00 0.00 H new ATOM 2869 N GLN A 179 8.789 15.847 0.188 1.00 0.00 N ATOM 2870 CA GLN A 179 8.140 17.108 -0.152 1.00 0.00 C ATOM 2871 C GLN A 179 7.015 16.880 -1.148 1.00 0.00 C ATOM 2872 O GLN A 179 5.874 17.290 -0.931 1.00 0.00 O ATOM 2873 CB GLN A 179 9.162 18.050 -0.786 1.00 0.00 C ATOM 2874 CG GLN A 179 8.601 19.474 -0.808 1.00 0.00 C ATOM 2875 CD GLN A 179 9.505 20.377 -1.642 1.00 0.00 C ATOM 2876 OE1 GLN A 179 9.331 20.478 -2.857 1.00 0.00 O ATOM 2877 NE2 GLN A 179 10.465 21.044 -1.060 1.00 0.00 N ATOM 0 H GLN A 179 9.802 15.908 0.292 1.00 0.00 H new ATOM 0 HA GLN A 179 7.732 17.542 0.761 1.00 0.00 H new ATOM 0 HB2 GLN A 179 10.095 18.024 -0.222 1.00 0.00 H new ATOM 0 HB3 GLN A 179 9.393 17.723 -1.800 1.00 0.00 H new ATOM 0 HG2 GLN A 179 7.593 19.471 -1.223 1.00 0.00 H new ATOM 0 HG3 GLN A 179 8.525 19.860 0.209 1.00 0.00 H new ATOM 0 HE21 GLN A 179 10.608 20.959 -0.054 1.00 0.00 H new ATOM 0 HE22 GLN A 179 11.072 21.650 -1.612 1.00 0.00 H new ATOM 2886 N ASP A 180 7.365 16.239 -2.250 1.00 0.00 N ATOM 2887 CA ASP A 180 6.419 15.961 -3.312 1.00 0.00 C ATOM 2888 C ASP A 180 5.163 15.272 -2.786 1.00 0.00 C ATOM 2889 O ASP A 180 4.064 15.820 -2.885 1.00 0.00 O ATOM 2890 CB ASP A 180 7.108 15.090 -4.355 1.00 0.00 C ATOM 2891 CG ASP A 180 6.408 15.228 -5.703 1.00 0.00 C ATOM 2892 OD1 ASP A 180 6.449 16.313 -6.261 1.00 0.00 O ATOM 2893 OD2 ASP A 180 5.842 14.248 -6.158 1.00 0.00 O ATOM 0 H ASP A 180 8.309 15.899 -2.431 1.00 0.00 H new ATOM 0 HA ASP A 180 6.099 16.903 -3.757 1.00 0.00 H new ATOM 0 HB2 ASP A 180 8.154 15.381 -4.449 1.00 0.00 H new ATOM 0 HB3 ASP A 180 7.095 14.048 -4.035 1.00 0.00 H new ATOM 2898 N LEU A 181 5.316 14.074 -2.229 1.00 0.00 N ATOM 2899 CA LEU A 181 4.170 13.348 -1.711 1.00 0.00 C ATOM 2900 C LEU A 181 3.468 14.165 -0.635 1.00 0.00 C ATOM 2901 O LEU A 181 2.268 14.414 -0.708 1.00 0.00 O ATOM 2902 CB LEU A 181 4.633 12.024 -1.109 1.00 0.00 C ATOM 2903 CG LEU A 181 3.524 10.945 -1.134 1.00 0.00 C ATOM 2904 CD1 LEU A 181 3.758 9.967 0.015 1.00 0.00 C ATOM 2905 CD2 LEU A 181 2.114 11.535 -0.951 1.00 0.00 C ATOM 0 H LEU A 181 6.210 13.594 -2.127 1.00 0.00 H new ATOM 0 HA LEU A 181 3.475 13.162 -2.530 1.00 0.00 H new ATOM 0 HB2 LEU A 181 5.501 11.662 -1.659 1.00 0.00 H new ATOM 0 HB3 LEU A 181 4.953 12.188 -0.080 1.00 0.00 H new ATOM 0 HG LEU A 181 3.575 10.461 -2.110 1.00 0.00 H new ATOM 0 HD11 LEU A 181 2.981 9.202 0.006 1.00 0.00 H new ATOM 0 HD12 LEU A 181 4.733 9.495 -0.102 1.00 0.00 H new ATOM 0 HD13 LEU A 181 3.727 10.505 0.963 1.00 0.00 H new ATOM 0 HD21 LEU A 181 1.377 10.732 -0.977 1.00 0.00 H new ATOM 0 HD22 LEU A 181 2.056 12.049 0.008 1.00 0.00 H new ATOM 0 HD23 LEU A 181 1.908 12.242 -1.755 1.00 0.00 H new ATOM 2917 N SER A 182 4.219 14.551 0.384 1.00 0.00 N ATOM 2918 CA SER A 182 3.644 15.309 1.476 1.00 0.00 C ATOM 2919 C SER A 182 2.951 16.564 0.955 1.00 0.00 C ATOM 2920 O SER A 182 1.731 16.668 0.976 1.00 0.00 O ATOM 2921 CB SER A 182 4.736 15.702 2.471 1.00 0.00 C ATOM 2922 OG SER A 182 5.684 16.538 1.821 1.00 0.00 O ATOM 0 H SER A 182 5.216 14.354 0.475 1.00 0.00 H new ATOM 0 HA SER A 182 2.905 14.683 1.976 1.00 0.00 H new ATOM 0 HB2 SER A 182 4.298 16.223 3.322 1.00 0.00 H new ATOM 0 HB3 SER A 182 5.227 14.810 2.861 1.00 0.00 H new ATOM 0 HG SER A 182 6.122 16.038 1.101 1.00 0.00 H new ATOM 2928 N GLY A 183 3.729 17.513 0.466 1.00 0.00 N ATOM 2929 CA GLY A 183 3.150 18.745 -0.051 1.00 0.00 C ATOM 2930 C GLY A 183 1.864 18.450 -0.799 1.00 0.00 C ATOM 2931 O GLY A 183 0.932 19.252 -0.790 1.00 0.00 O ATOM 0 H GLY A 183 4.746 17.459 0.415 1.00 0.00 H new ATOM 0 HA2 GLY A 183 2.951 19.434 0.770 1.00 0.00 H new ATOM 0 HA3 GLY A 183 3.860 19.238 -0.715 1.00 0.00 H new ATOM 2935 N ARG A 184 1.813 17.287 -1.436 1.00 0.00 N ATOM 2936 CA ARG A 184 0.624 16.905 -2.170 1.00 0.00 C ATOM 2937 C ARG A 184 -0.472 16.430 -1.225 1.00 0.00 C ATOM 2938 O ARG A 184 -1.471 17.121 -1.040 1.00 0.00 O ATOM 2939 CB ARG A 184 0.932 15.801 -3.172 1.00 0.00 C ATOM 2940 CG ARG A 184 1.609 16.400 -4.411 1.00 0.00 C ATOM 2941 CD ARG A 184 0.562 16.741 -5.475 1.00 0.00 C ATOM 2942 NE ARG A 184 1.217 17.096 -6.729 1.00 0.00 N ATOM 2943 CZ ARG A 184 0.517 17.535 -7.770 1.00 0.00 C ATOM 2944 NH1 ARG A 184 -0.777 17.664 -7.677 1.00 0.00 N ATOM 2945 NH2 ARG A 184 1.125 17.840 -8.884 1.00 0.00 N ATOM 0 H ARG A 184 2.571 16.605 -1.457 1.00 0.00 H new ATOM 0 HA ARG A 184 0.277 17.789 -2.706 1.00 0.00 H new ATOM 0 HB2 ARG A 184 1.582 15.054 -2.716 1.00 0.00 H new ATOM 0 HB3 ARG A 184 0.013 15.291 -3.459 1.00 0.00 H new ATOM 0 HG2 ARG A 184 2.162 17.298 -4.134 1.00 0.00 H new ATOM 0 HG3 ARG A 184 2.333 15.693 -4.816 1.00 0.00 H new ATOM 0 HD2 ARG A 184 -0.100 15.889 -5.630 1.00 0.00 H new ATOM 0 HD3 ARG A 184 -0.059 17.569 -5.133 1.00 0.00 H new ATOM 0 HE ARG A 184 2.230 17.006 -6.808 1.00 0.00 H new ATOM 0 HH11 ARG A 184 -1.252 17.428 -6.806 1.00 0.00 H new ATOM 0 HH12 ARG A 184 -1.315 18.001 -8.476 1.00 0.00 H new ATOM 0 HH21 ARG A 184 2.138 17.741 -8.956 1.00 0.00 H new ATOM 0 HH22 ARG A 184 0.587 18.177 -9.683 1.00 0.00 H new ATOM 2959 N LEU A 185 -0.275 15.251 -0.622 1.00 0.00 N ATOM 2960 CA LEU A 185 -1.266 14.700 0.305 1.00 0.00 C ATOM 2961 C LEU A 185 -1.875 15.827 1.109 1.00 0.00 C ATOM 2962 O LEU A 185 -3.088 15.939 1.255 1.00 0.00 O ATOM 2963 CB LEU A 185 -0.631 13.682 1.236 1.00 0.00 C ATOM 2964 CG LEU A 185 -1.744 12.910 1.980 1.00 0.00 C ATOM 2965 CD1 LEU A 185 -1.805 11.466 1.477 1.00 0.00 C ATOM 2966 CD2 LEU A 185 -1.464 12.917 3.488 1.00 0.00 C ATOM 0 H LEU A 185 0.551 14.668 -0.758 1.00 0.00 H new ATOM 0 HA LEU A 185 -2.042 14.194 -0.269 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -0.009 12.990 0.668 1.00 0.00 H new ATOM 0 HB3 LEU A 185 0.021 14.183 1.951 1.00 0.00 H new ATOM 0 HG LEU A 185 -2.700 13.397 1.788 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -2.592 10.929 2.007 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -2.019 11.462 0.408 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -0.848 10.977 1.657 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -2.252 12.371 4.007 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -0.504 12.439 3.682 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -1.437 13.945 3.848 1.00 0.00 H new ATOM 2978 N ARG A 186 -1.013 16.696 1.576 1.00 0.00 N ATOM 2979 CA ARG A 186 -1.443 17.859 2.299 1.00 0.00 C ATOM 2980 C ARG A 186 -2.397 18.614 1.437 1.00 0.00 C ATOM 2981 O ARG A 186 -3.577 18.747 1.721 1.00 0.00 O ATOM 2982 CB ARG A 186 -0.216 18.709 2.519 1.00 0.00 C ATOM 2983 CG ARG A 186 0.792 18.010 3.452 1.00 0.00 C ATOM 2984 CD ARG A 186 0.576 16.486 3.615 1.00 0.00 C ATOM 2985 NE ARG A 186 1.371 15.992 4.733 1.00 0.00 N ATOM 2986 CZ ARG A 186 0.847 15.847 5.946 1.00 0.00 C ATOM 2987 NH1 ARG A 186 -0.400 16.164 6.165 1.00 0.00 N ATOM 2988 NH2 ARG A 186 1.582 15.387 6.921 1.00 0.00 N ATOM 0 H ARG A 186 -0.002 16.615 1.465 1.00 0.00 H new ATOM 0 HA ARG A 186 -1.920 17.597 3.243 1.00 0.00 H new ATOM 0 HB2 ARG A 186 0.259 18.920 1.561 1.00 0.00 H new ATOM 0 HB3 ARG A 186 -0.508 19.667 2.948 1.00 0.00 H new ATOM 0 HG2 ARG A 186 1.798 18.181 3.070 1.00 0.00 H new ATOM 0 HG3 ARG A 186 0.740 18.477 4.435 1.00 0.00 H new ATOM 0 HD2 ARG A 186 -0.480 16.275 3.786 1.00 0.00 H new ATOM 0 HD3 ARG A 186 0.860 15.969 2.698 1.00 0.00 H new ATOM 0 HE ARG A 186 2.351 15.752 4.581 1.00 0.00 H new ATOM 0 HH11 ARG A 186 -0.976 16.524 5.404 1.00 0.00 H new ATOM 0 HH12 ARG A 186 -0.799 16.051 7.097 1.00 0.00 H new ATOM 0 HH21 ARG A 186 2.557 15.139 6.752 1.00 0.00 H new ATOM 0 HH22 ARG A 186 1.182 15.275 7.852 1.00 0.00 H new ATOM 3002 N ALA A 187 -1.830 19.093 0.373 1.00 0.00 N ATOM 3003 CA ALA A 187 -2.559 19.879 -0.614 1.00 0.00 C ATOM 3004 C ALA A 187 -3.898 19.262 -0.999 1.00 0.00 C ATOM 3005 O ALA A 187 -4.949 19.861 -0.768 1.00 0.00 O ATOM 3006 CB ALA A 187 -1.727 20.016 -1.875 1.00 0.00 C ATOM 0 H ALA A 187 -0.844 18.957 0.150 1.00 0.00 H new ATOM 0 HA ALA A 187 -2.752 20.848 -0.153 1.00 0.00 H new ATOM 0 HB1 ALA A 187 -2.275 20.604 -2.611 1.00 0.00 H new ATOM 0 HB2 ALA A 187 -0.787 20.515 -1.639 1.00 0.00 H new ATOM 0 HB3 ALA A 187 -1.519 19.027 -2.283 1.00 0.00 H new ATOM 3012 N ILE A 188 -3.864 18.093 -1.637 1.00 0.00 N ATOM 3013 CA ILE A 188 -5.097 17.475 -2.091 1.00 0.00 C ATOM 3014 C ILE A 188 -6.186 17.577 -1.021 1.00 0.00 C ATOM 3015 O ILE A 188 -7.331 17.908 -1.329 1.00 0.00 O ATOM 3016 CB ILE A 188 -4.897 16.002 -2.511 1.00 0.00 C ATOM 3017 CG1 ILE A 188 -3.960 15.269 -1.526 1.00 0.00 C ATOM 3018 CG2 ILE A 188 -4.290 15.933 -3.918 1.00 0.00 C ATOM 3019 CD1 ILE A 188 -4.756 14.446 -0.511 1.00 0.00 C ATOM 0 H ILE A 188 -3.014 17.569 -1.845 1.00 0.00 H new ATOM 0 HA ILE A 188 -5.416 18.026 -2.976 1.00 0.00 H new ATOM 0 HB ILE A 188 -5.873 15.517 -2.502 1.00 0.00 H new ATOM 0 HG12 ILE A 188 -3.286 14.615 -2.080 1.00 0.00 H new ATOM 0 HG13 ILE A 188 -3.339 15.996 -1.002 1.00 0.00 H new ATOM 0 HG21 ILE A 188 -4.153 14.890 -4.204 1.00 0.00 H new ATOM 0 HG22 ILE A 188 -4.960 16.419 -4.627 1.00 0.00 H new ATOM 0 HG23 ILE A 188 -3.325 16.440 -3.923 1.00 0.00 H new ATOM 0 HD11 ILE A 188 -4.068 13.942 0.168 1.00 0.00 H new ATOM 0 HD12 ILE A 188 -5.411 15.105 0.059 1.00 0.00 H new ATOM 0 HD13 ILE A 188 -5.357 13.703 -1.036 1.00 0.00 H new ATOM 3031 N LEU A 189 -5.831 17.305 0.235 1.00 0.00 N ATOM 3032 CA LEU A 189 -6.809 17.390 1.321 1.00 0.00 C ATOM 3033 C LEU A 189 -7.045 18.858 1.687 1.00 0.00 C ATOM 3034 O LEU A 189 -8.173 19.349 1.647 1.00 0.00 O ATOM 3035 CB LEU A 189 -6.295 16.608 2.546 1.00 0.00 C ATOM 3036 CG LEU A 189 -7.301 15.518 2.963 1.00 0.00 C ATOM 3037 CD1 LEU A 189 -7.572 14.560 1.788 1.00 0.00 C ATOM 3038 CD2 LEU A 189 -6.727 14.740 4.158 1.00 0.00 C ATOM 0 H LEU A 189 -4.892 17.029 0.523 1.00 0.00 H new ATOM 0 HA LEU A 189 -7.753 16.952 0.996 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -5.333 16.151 2.314 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -6.130 17.294 3.377 1.00 0.00 H new ATOM 0 HG LEU A 189 -8.244 15.985 3.247 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -8.285 13.796 2.099 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -7.984 15.121 0.949 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -6.640 14.084 1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -7.432 13.966 4.461 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -5.782 14.278 3.872 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -6.559 15.423 4.990 1.00 0.00 H new ATOM 3050 N GLN A 190 -5.964 19.544 2.039 1.00 0.00 N ATOM 3051 CA GLN A 190 -6.020 20.947 2.411 1.00 0.00 C ATOM 3052 C GLN A 190 -6.407 21.820 1.229 1.00 0.00 C ATOM 3053 O GLN A 190 -6.226 23.038 1.258 1.00 0.00 O ATOM 3054 CB GLN A 190 -4.662 21.383 2.982 1.00 0.00 C ATOM 3055 CG GLN A 190 -4.687 21.297 4.508 1.00 0.00 C ATOM 3056 CD GLN A 190 -3.410 21.900 5.087 1.00 0.00 C ATOM 3057 OE1 GLN A 190 -2.930 23.000 4.576 1.00 0.00 O flip ATOM 3058 NE2 GLN A 190 -2.836 21.353 6.027 1.00 0.00 N flip ATOM 0 H GLN A 190 -5.027 19.142 2.074 1.00 0.00 H new ATOM 0 HA GLN A 190 -6.789 21.071 3.174 1.00 0.00 H new ATOM 0 HB2 GLN A 190 -3.870 20.747 2.586 1.00 0.00 H new ATOM 0 HB3 GLN A 190 -4.437 22.403 2.670 1.00 0.00 H new ATOM 0 HG2 GLN A 190 -5.557 21.827 4.896 1.00 0.00 H new ATOM 0 HG3 GLN A 190 -4.782 20.257 4.820 1.00 0.00 H new ATOM 0 HE21 GLN A 190 -3.214 20.493 6.424 1.00 0.00 H new ATOM 0 HE22 GLN A 190 -1.982 21.759 6.409 1.00 0.00 H new ATOM 3067 N ASN A 191 -6.954 21.181 0.210 1.00 0.00 N ATOM 3068 CA ASN A 191 -7.403 21.868 -0.989 1.00 0.00 C ATOM 3069 C ASN A 191 -6.647 23.179 -1.211 1.00 0.00 C ATOM 3070 O ASN A 191 -7.245 24.250 -1.309 1.00 0.00 O ATOM 3071 CB ASN A 191 -8.903 22.125 -0.874 1.00 0.00 C ATOM 3072 CG ASN A 191 -9.188 23.313 0.028 1.00 0.00 C ATOM 3073 OD1 ASN A 191 -8.290 23.833 0.688 1.00 0.00 O ATOM 3074 ND2 ASN A 191 -10.402 23.773 0.096 1.00 0.00 N ATOM 0 H ASN A 191 -7.100 20.172 0.190 1.00 0.00 H new ATOM 0 HA ASN A 191 -7.198 21.236 -1.853 1.00 0.00 H new ATOM 0 HB2 ASN A 191 -9.320 22.308 -1.864 1.00 0.00 H new ATOM 0 HB3 ASN A 191 -9.398 21.238 -0.479 1.00 0.00 H new ATOM 0 HD21 ASN A 191 -10.613 24.568 0.699 1.00 0.00 H new ATOM 0 HD22 ASN A 191 -11.144 23.338 -0.453 1.00 0.00 H new ATOM 3081 N GLN A 192 -5.326 23.080 -1.297 1.00 0.00 N ATOM 3082 CA GLN A 192 -4.489 24.245 -1.511 1.00 0.00 C ATOM 3083 C GLN A 192 -5.035 25.103 -2.649 1.00 0.00 C ATOM 3084 O GLN A 192 -4.895 24.757 -3.823 1.00 0.00 O ATOM 3085 CB GLN A 192 -3.076 23.770 -1.842 1.00 0.00 C ATOM 3086 CG GLN A 192 -2.055 24.807 -1.384 1.00 0.00 C ATOM 3087 CD GLN A 192 -2.223 26.097 -2.179 1.00 0.00 C ATOM 3088 OE1 GLN A 192 -1.779 26.184 -3.324 1.00 0.00 O ATOM 3089 NE2 GLN A 192 -2.838 27.112 -1.636 1.00 0.00 N ATOM 0 H GLN A 192 -4.814 22.201 -1.221 1.00 0.00 H new ATOM 0 HA GLN A 192 -4.478 24.856 -0.609 1.00 0.00 H new ATOM 0 HB2 GLN A 192 -2.881 22.815 -1.353 1.00 0.00 H new ATOM 0 HB3 GLN A 192 -2.981 23.604 -2.915 1.00 0.00 H new ATOM 0 HG2 GLN A 192 -2.182 25.008 -0.320 1.00 0.00 H new ATOM 0 HG3 GLN A 192 -1.046 24.418 -1.517 1.00 0.00 H new ATOM 0 HE21 GLN A 192 -3.205 27.038 -0.687 1.00 0.00 H new ATOM 0 HE22 GLN A 192 -2.952 27.979 -2.160 1.00 0.00 H new ATOM 3098 N GLU A 193 -5.658 26.223 -2.294 1.00 0.00 N ATOM 3099 CA GLU A 193 -6.222 27.123 -3.294 1.00 0.00 C ATOM 3100 C GLU A 193 -5.222 27.380 -4.416 1.00 0.00 C ATOM 3101 O GLU A 193 -4.110 26.852 -4.405 1.00 0.00 O ATOM 3102 CB GLU A 193 -6.609 28.452 -2.642 1.00 0.00 C ATOM 3103 CG GLU A 193 -7.958 28.301 -1.935 1.00 0.00 C ATOM 3104 CD GLU A 193 -8.434 29.657 -1.424 1.00 0.00 C ATOM 3105 OE1 GLU A 193 -8.197 30.641 -2.105 1.00 0.00 O ATOM 3106 OE2 GLU A 193 -9.029 29.691 -0.359 1.00 0.00 O ATOM 0 H GLU A 193 -5.784 26.527 -1.329 1.00 0.00 H new ATOM 0 HA GLU A 193 -7.109 26.651 -3.716 1.00 0.00 H new ATOM 0 HB2 GLU A 193 -5.844 28.755 -1.927 1.00 0.00 H new ATOM 0 HB3 GLU A 193 -6.668 29.236 -3.397 1.00 0.00 H new ATOM 0 HG2 GLU A 193 -8.694 27.884 -2.623 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -7.866 27.602 -1.104 1.00 0.00 H new ATOM 3113 N ASN A 194 -5.627 28.197 -5.383 1.00 0.00 N ATOM 3114 CA ASN A 194 -4.764 28.522 -6.511 1.00 0.00 C ATOM 3115 C ASN A 194 -3.362 28.884 -6.031 1.00 0.00 C ATOM 3116 O ASN A 194 -2.477 28.057 -6.173 1.00 0.00 O ATOM 3117 CB ASN A 194 -5.353 29.688 -7.294 1.00 0.00 C ATOM 3118 CG ASN A 194 -4.602 29.872 -8.608 1.00 0.00 C ATOM 3119 OD1 ASN A 194 -4.808 29.111 -9.554 1.00 0.00 O ATOM 3120 ND2 ASN A 194 -3.738 30.843 -8.725 1.00 0.00 N ATOM 3121 OXT ASN A 194 -3.194 29.983 -5.529 1.00 0.00 O ATOM 0 H ASN A 194 -6.543 28.644 -5.408 1.00 0.00 H new ATOM 0 HA ASN A 194 -4.697 27.646 -7.156 1.00 0.00 H new ATOM 0 HB2 ASN A 194 -6.409 29.506 -7.493 1.00 0.00 H new ATOM 0 HB3 ASN A 194 -5.293 30.601 -6.701 1.00 0.00 H new ATOM 0 HD21 ASN A 194 -3.232 30.973 -9.601 1.00 0.00 H new ATOM 0 HD22 ASN A 194 -3.569 31.472 -7.940 1.00 0.00 H new