USER MOD reduce.3.24.130724 H: found=0, std=0, add=855, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 858 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 131 THR OG1 : rot -70:sc= 0.846 USER MOD Set 1.2: A 142 SER OG : rot 180:sc= 0.831 USER MOD Set 2.1: A 120 SER OG : rot -14:sc= 1.01 USER MOD Set 2.2: A 122 GLN : amide:sc= 0.707 K(o=1.7,f=0.58) USER MOD Set 3.1: A 88 HIS : no HE2:sc= -11.3! C(o=-12!,f=-21!) USER MOD Set 3.2: A 105 SER OG : rot -126:sc= 0.545! USER MOD Set 3.3: A 109 THR OG1 : rot -93:sc= -0.811 USER MOD Set 4.1: A 67 THR OG1 : rot 180:sc= -0.86 USER MOD Set 4.2: A 71 ASN : amide:sc= -0.982 K(o=-5.3,f=-5.9) USER MOD Set 4.3: A 74 CYS SG : rot -129:sc= -1.1 USER MOD Set 4.4: A 90 GLN : amide:sc= -2.35! C(o=-5.3!,f=-11!) USER MOD Single : A 31 ASN : amide:sc= -0.298 X(o=-0.3,f=-0.0047) USER MOD Single : A 34 CYS SG : rot 42:sc= -3.7! USER MOD Single : A 38 CYS SG : rot 180:sc= -4.48! USER MOD Single : A 39 THR OG1 : rot -59:sc= 1.14 USER MOD Single : A 40 THR OG1 : rot -90:sc= 1.02 USER MOD Single : A 42 GLN : amide:sc= -6.61! C(o=-6.6!,f=-13!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0281) USER MOD Single : A 64 LYS NZ :NH3+ -114:sc= -1.31 (180deg=-4.36!) USER MOD Single : A 76 TYR OH : rot 130:sc= -0.402 USER MOD Single : A 77 HIS :FLIP no HE2:sc= -0.927 F(o=-2.8!,f=-0.93) USER MOD Single : A 80 ASN : amide:sc= -1.04 X(o=-1,f=-0.58) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 75:sc= 0.114 USER MOD Single : A 86 ASN : amide:sc= -10.3 K(o=-10,f=-22!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -3.65 K(o=-3.6,f=-14!) USER MOD Single : A 106 THR OG1 : rot 136:sc= 0.987 USER MOD Single : A 107 ASN : amide:sc= -0.058 X(o=-0.058,f=-0.15) USER MOD Single : A 112 ASN : amide:sc= -1.1 K(o=-1.1,f=-4.2!) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ -145:sc= -0.374 (180deg=-1.62!) USER MOD Single : A 118 LYS NZ :NH3+ -165:sc= -0.0354 (180deg=-0.252) USER MOD Single : A 119 ASN :FLIP amide:sc= -1.59 F(o=-2.9,f=-1.6) USER MOD Single : A 121 ASN :FLIP amide:sc= -0.441 F(o=-1.3,f=-0.44) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN :FLIP amide:sc= -0.755 F(o=-1.9,f=-0.75) USER MOD Single : A 138 SER OG : rot -44:sc= 1.07 USER MOD Single : A 148 ASN : amide:sc= -1.26 K(o=-1.3,f=-2.7!) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 457 N GLU A 30 -1.110 9.637 -19.239 1.00 0.00 N ATOM 458 CA GLU A 30 -0.090 10.659 -19.038 1.00 0.00 C ATOM 459 C GLU A 30 0.350 10.728 -17.577 1.00 0.00 C ATOM 460 O GLU A 30 1.455 11.179 -17.275 1.00 0.00 O ATOM 461 CB GLU A 30 -0.615 12.024 -19.488 1.00 0.00 C ATOM 462 CG GLU A 30 0.402 13.145 -19.343 1.00 0.00 C ATOM 463 CD GLU A 30 -0.066 14.441 -19.978 1.00 0.00 C ATOM 464 OE1 GLU A 30 -1.109 14.973 -19.543 1.00 0.00 O ATOM 465 OE2 GLU A 30 0.611 14.922 -20.911 1.00 0.00 O ATOM 0 HA GLU A 30 0.777 10.388 -19.641 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -0.925 11.959 -20.531 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.503 12.272 -18.906 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.603 13.314 -18.285 1.00 0.00 H new ATOM 0 HG3 GLU A 30 1.343 12.839 -19.801 1.00 0.00 H new ATOM 472 N ASN A 31 -0.508 10.259 -16.675 1.00 0.00 N ATOM 473 CA ASN A 31 -0.194 10.250 -15.253 1.00 0.00 C ATOM 474 C ASN A 31 0.033 8.822 -14.804 1.00 0.00 C ATOM 475 O ASN A 31 0.531 8.555 -13.712 1.00 0.00 O ATOM 476 CB ASN A 31 -1.331 10.882 -14.450 1.00 0.00 C ATOM 477 CG ASN A 31 -1.715 12.254 -14.971 1.00 0.00 C ATOM 478 OD1 ASN A 31 -2.786 12.433 -15.550 1.00 0.00 O ATOM 479 ND2 ASN A 31 -0.838 13.231 -14.766 1.00 0.00 N ATOM 0 H ASN A 31 -1.426 9.880 -16.906 1.00 0.00 H new ATOM 0 HA ASN A 31 0.710 10.835 -15.080 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -2.202 10.228 -14.482 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -1.032 10.964 -13.405 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -1.041 14.175 -15.094 1.00 0.00 H new ATOM 0 HD22 ASN A 31 0.038 13.037 -14.281 1.00 0.00 H new ATOM 486 N ILE A 32 -0.368 7.912 -15.675 1.00 0.00 N ATOM 487 CA ILE A 32 -0.267 6.508 -15.443 1.00 0.00 C ATOM 488 C ILE A 32 1.194 6.043 -15.485 1.00 0.00 C ATOM 489 O ILE A 32 1.772 5.808 -16.547 1.00 0.00 O ATOM 490 CB ILE A 32 -1.165 5.796 -16.480 1.00 0.00 C ATOM 491 CG1 ILE A 32 -2.323 5.084 -15.779 1.00 0.00 C ATOM 492 CG2 ILE A 32 -0.393 4.870 -17.392 1.00 0.00 C ATOM 493 CD1 ILE A 32 -2.122 3.598 -15.568 1.00 0.00 C ATOM 0 H ILE A 32 -0.780 8.148 -16.578 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.616 6.252 -14.443 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.581 6.563 -17.133 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.487 5.555 -14.810 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -3.230 5.234 -16.364 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.078 4.400 -18.098 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.357 5.441 -17.940 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.100 4.101 -16.797 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -2.994 3.181 -15.065 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -1.991 3.108 -16.533 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.236 3.434 -14.954 1.00 0.00 H new ATOM 505 N VAL A 33 1.778 5.942 -14.295 1.00 0.00 N ATOM 506 CA VAL A 33 3.164 5.530 -14.110 1.00 0.00 C ATOM 507 C VAL A 33 3.587 4.450 -15.112 1.00 0.00 C ATOM 508 O VAL A 33 4.514 4.650 -15.896 1.00 0.00 O ATOM 509 CB VAL A 33 3.354 5.045 -12.646 1.00 0.00 C ATOM 510 CG1 VAL A 33 3.879 3.629 -12.547 1.00 0.00 C ATOM 511 CG2 VAL A 33 4.261 5.989 -11.877 1.00 0.00 C ATOM 0 H VAL A 33 1.295 6.147 -13.421 1.00 0.00 H new ATOM 0 HA VAL A 33 3.810 6.388 -14.299 1.00 0.00 H new ATOM 0 HB VAL A 33 2.360 5.047 -12.198 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.988 3.354 -11.498 1.00 0.00 H new ATOM 0 HG12 VAL A 33 3.179 2.947 -13.030 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.848 3.565 -13.042 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.379 5.629 -10.855 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.236 6.032 -12.361 1.00 0.00 H new ATOM 0 HG23 VAL A 33 3.820 6.986 -11.862 1.00 0.00 H new ATOM 521 N CYS A 34 2.913 3.307 -15.071 1.00 0.00 N ATOM 522 CA CYS A 34 3.237 2.198 -15.974 1.00 0.00 C ATOM 523 C CYS A 34 2.106 1.173 -16.040 1.00 0.00 C ATOM 524 O CYS A 34 1.208 1.176 -15.204 1.00 0.00 O ATOM 525 CB CYS A 34 4.529 1.514 -15.524 1.00 0.00 C ATOM 526 SG CYS A 34 6.028 2.199 -16.266 1.00 0.00 S ATOM 0 H CYS A 34 2.143 3.120 -14.429 1.00 0.00 H new ATOM 0 HA CYS A 34 3.371 2.615 -16.972 1.00 0.00 H new ATOM 0 HB2 CYS A 34 4.607 1.588 -14.439 1.00 0.00 H new ATOM 0 HB3 CYS A 34 4.469 0.453 -15.767 1.00 0.00 H new ATOM 0 HG CYS A 34 5.944 3.496 -16.294 1.00 0.00 H new ATOM 532 N ARG A 35 2.159 0.295 -17.039 1.00 0.00 N ATOM 533 CA ARG A 35 1.136 -0.734 -17.207 1.00 0.00 C ATOM 534 C ARG A 35 1.765 -2.095 -17.489 1.00 0.00 C ATOM 535 O ARG A 35 2.389 -2.296 -18.529 1.00 0.00 O ATOM 536 CB ARG A 35 0.190 -0.356 -18.348 1.00 0.00 C ATOM 537 CG ARG A 35 -1.093 -1.172 -18.371 1.00 0.00 C ATOM 538 CD ARG A 35 -1.196 -2.021 -19.629 1.00 0.00 C ATOM 539 NE ARG A 35 -1.172 -1.207 -20.842 1.00 0.00 N ATOM 540 CZ ARG A 35 -1.604 -1.632 -22.028 1.00 0.00 C ATOM 541 NH1 ARG A 35 -2.099 -2.856 -22.163 1.00 0.00 N ATOM 542 NH2 ARG A 35 -1.542 -0.830 -23.082 1.00 0.00 N ATOM 0 H ARG A 35 2.897 0.275 -17.743 1.00 0.00 H new ATOM 0 HA ARG A 35 0.572 -0.802 -16.277 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -0.063 0.701 -18.264 1.00 0.00 H new ATOM 0 HB3 ARG A 35 0.710 -0.485 -19.297 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -1.130 -1.816 -17.493 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -1.951 -0.503 -18.312 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -0.371 -2.733 -19.654 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -2.118 -2.602 -19.600 1.00 0.00 H new ATOM 0 HE ARG A 35 -0.803 -0.258 -20.777 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -2.150 -3.477 -21.356 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -2.428 -3.175 -23.074 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -1.164 0.112 -22.984 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -1.873 -1.155 -23.990 1.00 0.00 H new ATOM 556 N VAL A 36 1.584 -3.029 -16.561 1.00 0.00 N ATOM 557 CA VAL A 36 2.121 -4.376 -16.716 1.00 0.00 C ATOM 558 C VAL A 36 1.101 -5.282 -17.385 1.00 0.00 C ATOM 559 O VAL A 36 -0.013 -5.452 -16.888 1.00 0.00 O ATOM 560 CB VAL A 36 2.516 -4.989 -15.359 1.00 0.00 C ATOM 561 CG1 VAL A 36 3.137 -6.365 -15.547 1.00 0.00 C ATOM 562 CG2 VAL A 36 3.463 -4.067 -14.607 1.00 0.00 C ATOM 0 H VAL A 36 1.069 -2.878 -15.693 1.00 0.00 H new ATOM 0 HA VAL A 36 3.012 -4.296 -17.338 1.00 0.00 H new ATOM 0 HB VAL A 36 1.611 -5.106 -14.763 1.00 0.00 H new ATOM 0 HG11 VAL A 36 3.408 -6.778 -14.575 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.419 -7.025 -16.034 1.00 0.00 H new ATOM 0 HG13 VAL A 36 4.030 -6.280 -16.166 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.729 -4.519 -13.652 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.365 -3.911 -15.198 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.974 -3.109 -14.431 1.00 0.00 H new ATOM 572 N ILE A 37 1.484 -5.860 -18.514 1.00 0.00 N ATOM 573 CA ILE A 37 0.596 -6.744 -19.246 1.00 0.00 C ATOM 574 C ILE A 37 1.055 -8.194 -19.165 1.00 0.00 C ATOM 575 O ILE A 37 2.035 -8.584 -19.802 1.00 0.00 O ATOM 576 CB ILE A 37 0.519 -6.334 -20.730 1.00 0.00 C ATOM 577 CG1 ILE A 37 0.245 -4.835 -20.851 1.00 0.00 C ATOM 578 CG2 ILE A 37 -0.549 -7.141 -21.456 1.00 0.00 C ATOM 579 CD1 ILE A 37 0.430 -4.298 -22.253 1.00 0.00 C ATOM 0 H ILE A 37 2.402 -5.732 -18.940 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.388 -6.656 -18.785 1.00 0.00 H new ATOM 0 HB ILE A 37 1.479 -6.547 -21.200 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.775 -4.633 -20.525 1.00 0.00 H new ATOM 0 HG13 ILE A 37 0.908 -4.297 -20.174 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.587 -6.836 -22.502 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.307 -8.202 -21.396 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.519 -6.963 -20.991 1.00 0.00 H new ATOM 0 HD11 ILE A 37 0.219 -3.229 -22.264 1.00 0.00 H new ATOM 0 HD12 ILE A 37 1.457 -4.468 -22.575 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.253 -4.810 -22.932 1.00 0.00 H new ATOM 591 N CYS A 38 0.317 -8.995 -18.408 1.00 0.00 N ATOM 592 CA CYS A 38 0.616 -10.413 -18.273 1.00 0.00 C ATOM 593 C CYS A 38 -0.352 -11.199 -19.151 1.00 0.00 C ATOM 594 O CYS A 38 -1.520 -11.367 -18.801 1.00 0.00 O ATOM 595 CB CYS A 38 0.497 -10.845 -16.809 1.00 0.00 C ATOM 596 SG CYS A 38 1.524 -9.883 -15.672 1.00 0.00 S ATOM 0 H CYS A 38 -0.496 -8.684 -17.876 1.00 0.00 H new ATOM 0 HA CYS A 38 1.639 -10.610 -18.594 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -0.545 -10.762 -16.500 1.00 0.00 H new ATOM 0 HB3 CYS A 38 0.771 -11.897 -16.728 1.00 0.00 H new ATOM 0 HG CYS A 38 1.355 -10.319 -14.459 1.00 0.00 H new ATOM 602 N THR A 39 0.123 -11.640 -20.314 1.00 0.00 N ATOM 603 CA THR A 39 -0.733 -12.360 -21.255 1.00 0.00 C ATOM 604 C THR A 39 -0.248 -13.779 -21.530 1.00 0.00 C ATOM 605 O THR A 39 -0.429 -14.300 -22.631 1.00 0.00 O ATOM 606 CB THR A 39 -0.832 -11.604 -22.592 1.00 0.00 C ATOM 607 OG1 THR A 39 -1.654 -12.335 -23.511 1.00 0.00 O ATOM 608 CG2 THR A 39 0.548 -11.391 -23.196 1.00 0.00 C ATOM 0 H THR A 39 1.086 -11.513 -20.626 1.00 0.00 H new ATOM 0 HA THR A 39 -1.713 -12.422 -20.782 1.00 0.00 H new ATOM 0 HB THR A 39 -1.282 -10.630 -22.400 1.00 0.00 H new ATOM 0 HG1 THR A 39 -1.269 -13.224 -23.659 1.00 0.00 H new ATOM 0 HG21 THR A 39 0.453 -10.855 -24.140 1.00 0.00 H new ATOM 0 HG22 THR A 39 1.160 -10.808 -22.508 1.00 0.00 H new ATOM 0 HG23 THR A 39 1.021 -12.357 -23.373 1.00 0.00 H new ATOM 616 N THR A 40 0.355 -14.408 -20.533 1.00 0.00 N ATOM 617 CA THR A 40 0.842 -15.770 -20.687 1.00 0.00 C ATOM 618 C THR A 40 0.048 -16.742 -19.824 1.00 0.00 C ATOM 619 O THR A 40 0.475 -17.871 -19.585 1.00 0.00 O ATOM 620 CB THR A 40 2.325 -15.862 -20.323 1.00 0.00 C ATOM 621 OG1 THR A 40 2.504 -15.655 -18.915 1.00 0.00 O ATOM 622 CG2 THR A 40 3.118 -14.827 -21.098 1.00 0.00 C ATOM 0 H THR A 40 0.518 -14.000 -19.613 1.00 0.00 H new ATOM 0 HA THR A 40 0.712 -16.044 -21.734 1.00 0.00 H new ATOM 0 HB THR A 40 2.686 -16.857 -20.584 1.00 0.00 H new ATOM 0 HG1 THR A 40 2.637 -14.700 -18.739 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.172 -14.902 -20.831 1.00 0.00 H new ATOM 0 HG22 THR A 40 3.001 -15.005 -22.167 1.00 0.00 H new ATOM 0 HG23 THR A 40 2.751 -13.830 -20.854 1.00 0.00 H new ATOM 630 N GLY A 41 -1.110 -16.290 -19.358 1.00 0.00 N ATOM 631 CA GLY A 41 -1.952 -17.124 -18.523 1.00 0.00 C ATOM 632 C GLY A 41 -1.612 -16.988 -17.054 1.00 0.00 C ATOM 633 O GLY A 41 -1.616 -17.972 -16.315 1.00 0.00 O ATOM 0 H GLY A 41 -1.481 -15.358 -19.544 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.997 -16.855 -18.679 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -1.843 -18.166 -18.825 1.00 0.00 H new ATOM 637 N GLN A 42 -1.306 -15.765 -16.633 1.00 0.00 N ATOM 638 CA GLN A 42 -0.952 -15.504 -15.244 1.00 0.00 C ATOM 639 C GLN A 42 -1.953 -14.563 -14.580 1.00 0.00 C ATOM 640 O GLN A 42 -2.787 -14.994 -13.784 1.00 0.00 O ATOM 641 CB GLN A 42 0.453 -14.907 -15.160 1.00 0.00 C ATOM 642 CG GLN A 42 1.554 -15.888 -15.526 1.00 0.00 C ATOM 643 CD GLN A 42 2.358 -16.340 -14.322 1.00 0.00 C ATOM 644 OE1 GLN A 42 2.588 -17.533 -14.126 1.00 0.00 O ATOM 645 NE2 GLN A 42 2.791 -15.384 -13.507 1.00 0.00 N ATOM 0 H GLN A 42 -1.296 -14.941 -17.234 1.00 0.00 H new ATOM 0 HA GLN A 42 -0.975 -16.455 -14.712 1.00 0.00 H new ATOM 0 HB2 GLN A 42 0.512 -14.044 -15.823 1.00 0.00 H new ATOM 0 HB3 GLN A 42 0.624 -14.543 -14.147 1.00 0.00 H new ATOM 0 HG2 GLN A 42 1.113 -16.759 -16.011 1.00 0.00 H new ATOM 0 HG3 GLN A 42 2.223 -15.424 -16.251 1.00 0.00 H new ATOM 0 HE21 GLN A 42 2.577 -14.407 -13.708 1.00 0.00 H new ATOM 0 HE22 GLN A 42 3.337 -15.627 -12.681 1.00 0.00 H new ATOM 654 N ILE A 43 -1.855 -13.274 -14.897 1.00 0.00 N ATOM 655 CA ILE A 43 -2.738 -12.279 -14.315 1.00 0.00 C ATOM 656 C ILE A 43 -3.264 -11.308 -15.373 1.00 0.00 C ATOM 657 O ILE A 43 -2.535 -10.903 -16.274 1.00 0.00 O ATOM 658 CB ILE A 43 -2.005 -11.476 -13.223 1.00 0.00 C ATOM 659 CG1 ILE A 43 -1.395 -12.422 -12.186 1.00 0.00 C ATOM 660 CG2 ILE A 43 -2.948 -10.486 -12.553 1.00 0.00 C ATOM 661 CD1 ILE A 43 0.091 -12.642 -12.368 1.00 0.00 C ATOM 0 H ILE A 43 -1.171 -12.899 -15.554 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.580 -12.815 -13.878 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.201 -10.911 -13.695 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.575 -12.020 -11.189 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.906 -13.384 -12.239 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -2.408 -9.931 -11.786 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.336 -9.791 -13.298 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -3.776 -11.026 -12.095 1.00 0.00 H new ATOM 0 HD11 ILE A 43 0.455 -13.323 -11.598 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.277 -13.073 -13.351 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.613 -11.689 -12.285 1.00 0.00 H new ATOM 673 N PRO A 44 -4.539 -10.906 -15.264 1.00 0.00 N ATOM 674 CA PRO A 44 -5.145 -9.959 -16.203 1.00 0.00 C ATOM 675 C PRO A 44 -4.392 -8.633 -16.212 1.00 0.00 C ATOM 676 O PRO A 44 -3.851 -8.215 -15.189 1.00 0.00 O ATOM 677 CB PRO A 44 -6.566 -9.755 -15.663 1.00 0.00 C ATOM 678 CG PRO A 44 -6.815 -10.902 -14.742 1.00 0.00 C ATOM 679 CD PRO A 44 -5.474 -11.330 -14.217 1.00 0.00 C ATOM 0 HA PRO A 44 -5.125 -10.329 -17.228 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -6.652 -8.804 -15.137 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -7.294 -9.738 -16.474 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -7.475 -10.607 -13.926 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -7.305 -11.722 -15.268 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.248 -10.855 -13.262 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -5.432 -12.407 -14.055 1.00 0.00 H new ATOM 687 N ILE A 45 -4.348 -7.980 -17.371 1.00 0.00 N ATOM 688 CA ILE A 45 -3.644 -6.704 -17.507 1.00 0.00 C ATOM 689 C ILE A 45 -3.921 -5.774 -16.329 1.00 0.00 C ATOM 690 O ILE A 45 -5.073 -5.525 -15.974 1.00 0.00 O ATOM 691 CB ILE A 45 -4.022 -5.981 -18.816 1.00 0.00 C ATOM 692 CG1 ILE A 45 -3.642 -6.841 -20.020 1.00 0.00 C ATOM 693 CG2 ILE A 45 -3.335 -4.621 -18.895 1.00 0.00 C ATOM 694 CD1 ILE A 45 -4.429 -6.517 -21.270 1.00 0.00 C ATOM 0 H ILE A 45 -4.790 -8.311 -18.229 1.00 0.00 H new ATOM 0 HA ILE A 45 -2.581 -6.946 -17.526 1.00 0.00 H new ATOM 0 HB ILE A 45 -5.100 -5.821 -18.826 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.580 -6.712 -20.227 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.793 -7.891 -19.768 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -3.614 -4.126 -19.825 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -3.646 -4.007 -18.050 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.254 -4.757 -18.866 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -4.105 -7.167 -22.083 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -5.491 -6.673 -21.082 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.259 -5.477 -21.548 1.00 0.00 H new ATOM 706 N ARG A 46 -2.851 -5.261 -15.735 1.00 0.00 N ATOM 707 CA ARG A 46 -2.960 -4.350 -14.603 1.00 0.00 C ATOM 708 C ARG A 46 -2.247 -3.040 -14.910 1.00 0.00 C ATOM 709 O ARG A 46 -1.099 -3.039 -15.355 1.00 0.00 O ATOM 710 CB ARG A 46 -2.363 -4.993 -13.349 1.00 0.00 C ATOM 711 CG ARG A 46 -3.098 -4.640 -12.066 1.00 0.00 C ATOM 712 CD ARG A 46 -4.589 -4.917 -12.175 1.00 0.00 C ATOM 713 NE ARG A 46 -5.365 -3.688 -12.325 1.00 0.00 N ATOM 714 CZ ARG A 46 -5.540 -2.798 -11.351 1.00 0.00 C ATOM 715 NH1 ARG A 46 -4.997 -2.997 -10.156 1.00 0.00 N ATOM 716 NH2 ARG A 46 -6.258 -1.706 -11.571 1.00 0.00 N ATOM 0 H ARG A 46 -1.893 -5.462 -16.021 1.00 0.00 H new ATOM 0 HA ARG A 46 -4.015 -4.141 -14.423 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -2.366 -6.076 -13.472 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -1.321 -4.686 -13.256 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.681 -5.214 -11.239 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -2.940 -3.587 -11.835 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -4.775 -5.569 -13.028 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -4.924 -5.451 -11.286 1.00 0.00 H new ATOM 0 HE ARG A 46 -5.798 -3.501 -13.229 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -4.443 -3.835 -9.981 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -5.134 -2.312 -9.413 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -6.677 -1.547 -12.487 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -6.392 -1.024 -10.824 1.00 0.00 H new ATOM 730 N ASP A 47 -2.931 -1.925 -14.679 1.00 0.00 N ATOM 731 CA ASP A 47 -2.351 -0.615 -14.946 1.00 0.00 C ATOM 732 C ASP A 47 -1.849 0.043 -13.667 1.00 0.00 C ATOM 733 O ASP A 47 -2.621 0.308 -12.744 1.00 0.00 O ATOM 734 CB ASP A 47 -3.376 0.294 -15.628 1.00 0.00 C ATOM 735 CG ASP A 47 -3.958 -0.325 -16.883 1.00 0.00 C ATOM 736 OD1 ASP A 47 -3.692 -1.519 -17.138 1.00 0.00 O ATOM 737 OD2 ASP A 47 -4.682 0.384 -17.614 1.00 0.00 O ATOM 0 H ASP A 47 -3.882 -1.902 -14.310 1.00 0.00 H new ATOM 0 HA ASP A 47 -1.500 -0.761 -15.611 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.182 0.515 -14.929 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -2.903 1.243 -15.881 1.00 0.00 H new ATOM 742 N LEU A 48 -0.553 0.324 -13.633 1.00 0.00 N ATOM 743 CA LEU A 48 0.066 0.977 -12.489 1.00 0.00 C ATOM 744 C LEU A 48 0.105 2.478 -12.726 1.00 0.00 C ATOM 745 O LEU A 48 0.518 2.931 -13.793 1.00 0.00 O ATOM 746 CB LEU A 48 1.483 0.440 -12.272 1.00 0.00 C ATOM 747 CG LEU A 48 1.616 -1.088 -12.178 1.00 0.00 C ATOM 748 CD1 LEU A 48 0.279 -1.751 -11.861 1.00 0.00 C ATOM 749 CD2 LEU A 48 2.191 -1.646 -13.468 1.00 0.00 C ATOM 0 H LEU A 48 0.094 0.107 -14.392 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.522 0.767 -11.595 1.00 0.00 H new ATOM 0 HB2 LEU A 48 2.112 0.790 -13.090 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.880 0.877 -11.355 1.00 0.00 H new ATOM 0 HG LEU A 48 2.298 -1.312 -11.358 1.00 0.00 H new ATOM 0 HD11 LEU A 48 0.413 -2.831 -11.803 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -0.094 -1.380 -10.907 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -0.439 -1.517 -12.647 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.280 -2.729 -13.388 1.00 0.00 H new ATOM 0 HD22 LEU A 48 1.531 -1.397 -14.299 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.176 -1.213 -13.645 1.00 0.00 H new ATOM 761 N SER A 49 -0.341 3.257 -11.750 1.00 0.00 N ATOM 762 CA SER A 49 -0.357 4.702 -11.919 1.00 0.00 C ATOM 763 C SER A 49 0.205 5.449 -10.727 1.00 0.00 C ATOM 764 O SER A 49 0.294 4.930 -9.617 1.00 0.00 O ATOM 765 CB SER A 49 -1.770 5.199 -12.188 1.00 0.00 C ATOM 766 OG SER A 49 -2.688 4.125 -12.295 1.00 0.00 O ATOM 0 H SER A 49 -0.689 2.922 -10.852 1.00 0.00 H new ATOM 0 HA SER A 49 0.287 4.906 -12.775 1.00 0.00 H new ATOM 0 HB2 SER A 49 -2.081 5.866 -11.384 1.00 0.00 H new ATOM 0 HB3 SER A 49 -1.782 5.782 -13.109 1.00 0.00 H new ATOM 0 HG SER A 49 -3.586 4.478 -12.466 1.00 0.00 H new ATOM 772 N ALA A 50 0.557 6.694 -10.980 1.00 0.00 N ATOM 773 CA ALA A 50 1.097 7.567 -9.946 1.00 0.00 C ATOM 774 C ALA A 50 0.891 9.034 -10.309 1.00 0.00 C ATOM 775 O ALA A 50 1.004 9.418 -11.473 1.00 0.00 O ATOM 776 CB ALA A 50 2.570 7.268 -9.723 1.00 0.00 C ATOM 0 H ALA A 50 0.479 7.130 -11.899 1.00 0.00 H new ATOM 0 HA ALA A 50 0.559 7.375 -9.017 1.00 0.00 H new ATOM 0 HB1 ALA A 50 2.962 7.927 -8.948 1.00 0.00 H new ATOM 0 HB2 ALA A 50 2.687 6.230 -9.410 1.00 0.00 H new ATOM 0 HB3 ALA A 50 3.119 7.432 -10.650 1.00 0.00 H new ATOM 782 N ASP A 51 0.583 9.851 -9.306 1.00 0.00 N ATOM 783 CA ASP A 51 0.353 11.275 -9.525 1.00 0.00 C ATOM 784 C ASP A 51 1.650 11.996 -9.880 1.00 0.00 C ATOM 785 O ASP A 51 2.631 11.941 -9.139 1.00 0.00 O ATOM 786 CB ASP A 51 -0.277 11.908 -8.282 1.00 0.00 C ATOM 787 CG ASP A 51 -1.769 12.129 -8.440 1.00 0.00 C ATOM 788 OD1 ASP A 51 -2.522 11.133 -8.419 1.00 0.00 O ATOM 789 OD2 ASP A 51 -2.184 13.299 -8.583 1.00 0.00 O ATOM 0 H ASP A 51 0.487 9.552 -8.336 1.00 0.00 H new ATOM 0 HA ASP A 51 -0.334 11.379 -10.365 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -0.097 11.266 -7.420 1.00 0.00 H new ATOM 0 HB3 ASP A 51 0.209 12.862 -8.077 1.00 0.00 H new ATOM 794 N ILE A 52 1.641 12.675 -11.023 1.00 0.00 N ATOM 795 CA ILE A 52 2.806 13.415 -11.493 1.00 0.00 C ATOM 796 C ILE A 52 3.157 14.553 -10.537 1.00 0.00 C ATOM 797 O ILE A 52 4.330 14.864 -10.326 1.00 0.00 O ATOM 798 CB ILE A 52 2.554 13.992 -12.903 1.00 0.00 C ATOM 799 CG1 ILE A 52 2.699 12.891 -13.954 1.00 0.00 C ATOM 800 CG2 ILE A 52 3.502 15.146 -13.199 1.00 0.00 C ATOM 801 CD1 ILE A 52 2.530 13.381 -15.377 1.00 0.00 C ATOM 0 H ILE A 52 0.834 12.728 -11.644 1.00 0.00 H new ATOM 0 HA ILE A 52 3.642 12.717 -11.533 1.00 0.00 H new ATOM 0 HB ILE A 52 1.536 14.380 -12.939 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.682 12.431 -13.852 1.00 0.00 H new ATOM 0 HG13 ILE A 52 1.961 12.113 -13.757 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.303 15.533 -14.198 1.00 0.00 H new ATOM 0 HG22 ILE A 52 3.351 15.938 -12.466 1.00 0.00 H new ATOM 0 HG23 ILE A 52 4.532 14.794 -13.145 1.00 0.00 H new ATOM 0 HD11 ILE A 52 2.646 12.544 -16.066 1.00 0.00 H new ATOM 0 HD12 ILE A 52 1.537 13.815 -15.497 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.285 14.137 -15.594 1.00 0.00 H new ATOM 989 N LYS A 63 7.116 7.434 -3.548 1.00 0.00 N ATOM 990 CA LYS A 63 7.564 6.083 -3.235 1.00 0.00 C ATOM 991 C LYS A 63 6.399 5.096 -3.279 1.00 0.00 C ATOM 992 O LYS A 63 5.952 4.598 -2.246 1.00 0.00 O ATOM 993 CB LYS A 63 8.236 6.055 -1.858 1.00 0.00 C ATOM 994 CG LYS A 63 9.712 5.699 -1.911 1.00 0.00 C ATOM 995 CD LYS A 63 10.250 5.351 -0.533 1.00 0.00 C ATOM 996 CE LYS A 63 11.752 5.118 -0.563 1.00 0.00 C ATOM 997 NZ LYS A 63 12.508 6.393 -0.706 1.00 0.00 N ATOM 0 HA LYS A 63 8.291 5.781 -3.989 1.00 0.00 H new ATOM 0 HB2 LYS A 63 8.123 7.032 -1.387 1.00 0.00 H new ATOM 0 HB3 LYS A 63 7.719 5.334 -1.225 1.00 0.00 H new ATOM 0 HG2 LYS A 63 9.860 4.855 -2.584 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.275 6.537 -2.322 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.020 6.158 0.163 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.750 4.457 -0.161 1.00 0.00 H new ATOM 0 HE2 LYS A 63 12.060 4.614 0.353 1.00 0.00 H new ATOM 0 HE3 LYS A 63 12.000 4.454 -1.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 13.527 6.204 -0.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 12.310 6.811 -1.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 12.215 7.056 0.040 1.00 0.00 H new ATOM 1011 N LYS A 64 5.917 4.813 -4.485 1.00 0.00 N ATOM 1012 CA LYS A 64 4.811 3.879 -4.667 1.00 0.00 C ATOM 1013 C LYS A 64 5.311 2.580 -5.286 1.00 0.00 C ATOM 1014 O LYS A 64 6.071 2.595 -6.254 1.00 0.00 O ATOM 1015 CB LYS A 64 3.725 4.500 -5.545 1.00 0.00 C ATOM 1016 CG LYS A 64 2.326 4.349 -4.969 1.00 0.00 C ATOM 1017 CD LYS A 64 1.532 5.639 -5.078 1.00 0.00 C ATOM 1018 CE LYS A 64 1.461 6.124 -6.516 1.00 0.00 C ATOM 1019 NZ LYS A 64 0.533 7.280 -6.671 1.00 0.00 N ATOM 0 H LYS A 64 6.275 5.217 -5.351 1.00 0.00 H new ATOM 0 HA LYS A 64 4.382 3.658 -3.690 1.00 0.00 H new ATOM 0 HB2 LYS A 64 3.941 5.559 -5.683 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.756 4.037 -6.531 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.800 3.552 -5.495 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.393 4.050 -3.923 1.00 0.00 H new ATOM 0 HD2 LYS A 64 0.524 5.481 -4.695 1.00 0.00 H new ATOM 0 HD3 LYS A 64 1.993 6.406 -4.456 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.458 6.412 -6.851 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.132 5.307 -7.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -0.280 6.997 -7.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 0.198 7.584 -5.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.033 8.067 -7.132 1.00 0.00 H new ATOM 1033 N VAL A 65 4.897 1.455 -4.713 1.00 0.00 N ATOM 1034 CA VAL A 65 5.325 0.154 -5.204 1.00 0.00 C ATOM 1035 C VAL A 65 4.145 -0.766 -5.481 1.00 0.00 C ATOM 1036 O VAL A 65 3.218 -0.874 -4.677 1.00 0.00 O ATOM 1037 CB VAL A 65 6.237 -0.540 -4.182 1.00 0.00 C ATOM 1038 CG1 VAL A 65 6.951 -1.731 -4.802 1.00 0.00 C ATOM 1039 CG2 VAL A 65 7.235 0.444 -3.588 1.00 0.00 C ATOM 0 H VAL A 65 4.268 1.419 -3.911 1.00 0.00 H new ATOM 0 HA VAL A 65 5.864 0.338 -6.134 1.00 0.00 H new ATOM 0 HB VAL A 65 5.608 -0.913 -3.374 1.00 0.00 H new ATOM 0 HG11 VAL A 65 7.589 -2.202 -4.054 1.00 0.00 H new ATOM 0 HG12 VAL A 65 6.215 -2.452 -5.157 1.00 0.00 H new ATOM 0 HG13 VAL A 65 7.561 -1.394 -5.640 1.00 0.00 H new ATOM 0 HG21 VAL A 65 7.869 -0.072 -2.867 1.00 0.00 H new ATOM 0 HG22 VAL A 65 7.853 0.860 -4.383 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.698 1.250 -3.087 1.00 0.00 H new ATOM 1049 N TRP A 66 4.201 -1.440 -6.619 1.00 0.00 N ATOM 1050 CA TRP A 66 3.147 -2.377 -7.013 1.00 0.00 C ATOM 1051 C TRP A 66 3.531 -3.819 -6.711 1.00 0.00 C ATOM 1052 O TRP A 66 4.672 -4.219 -6.909 1.00 0.00 O ATOM 1053 CB TRP A 66 2.814 -2.247 -8.488 1.00 0.00 C ATOM 1054 CG TRP A 66 1.977 -1.056 -8.769 1.00 0.00 C ATOM 1055 CD1 TRP A 66 0.632 -0.967 -8.992 1.00 0.00 C ATOM 1056 CD2 TRP A 66 2.481 0.246 -8.824 1.00 0.00 C ATOM 1057 NE1 TRP A 66 0.286 0.352 -9.188 1.00 0.00 N ATOM 1058 CE2 TRP A 66 1.421 1.117 -9.087 1.00 0.00 C ATOM 1059 CE3 TRP A 66 3.753 0.738 -8.672 1.00 0.00 C ATOM 1060 CZ2 TRP A 66 1.612 2.486 -9.201 1.00 0.00 C ATOM 1061 CZ3 TRP A 66 3.958 2.086 -8.781 1.00 0.00 C ATOM 1062 CH2 TRP A 66 2.891 2.959 -9.045 1.00 0.00 C ATOM 0 H TRP A 66 4.964 -1.359 -7.291 1.00 0.00 H new ATOM 0 HA TRP A 66 2.267 -2.118 -6.424 1.00 0.00 H new ATOM 0 HB2 TRP A 66 3.738 -2.184 -9.063 1.00 0.00 H new ATOM 0 HB3 TRP A 66 2.291 -3.144 -8.821 1.00 0.00 H new ATOM 0 HD1 TRP A 66 -0.054 -1.801 -9.012 1.00 0.00 H new ATOM 0 HE1 TRP A 66 -0.654 0.701 -9.376 1.00 0.00 H new ATOM 0 HE3 TRP A 66 4.579 0.072 -8.470 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 0.787 3.153 -9.404 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 4.955 2.484 -8.662 1.00 0.00 H new ATOM 0 HH2 TRP A 66 3.079 4.019 -9.127 1.00 0.00 H new ATOM 1073 N THR A 67 2.568 -4.601 -6.235 1.00 0.00 N ATOM 1074 CA THR A 67 2.823 -6.002 -5.922 1.00 0.00 C ATOM 1075 C THR A 67 1.767 -6.921 -6.516 1.00 0.00 C ATOM 1076 O THR A 67 0.569 -6.720 -6.342 1.00 0.00 O ATOM 1077 CB THR A 67 2.864 -6.260 -4.415 1.00 0.00 C ATOM 1078 OG1 THR A 67 3.790 -5.373 -3.778 1.00 0.00 O ATOM 1079 CG2 THR A 67 3.241 -7.702 -4.127 1.00 0.00 C ATOM 0 H THR A 67 1.612 -4.292 -6.059 1.00 0.00 H new ATOM 0 HA THR A 67 3.797 -6.219 -6.361 1.00 0.00 H new ATOM 0 HB THR A 67 1.868 -6.075 -4.013 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.803 -5.551 -2.814 1.00 0.00 H new ATOM 0 HG21 THR A 67 3.264 -7.864 -3.049 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.505 -8.368 -4.578 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.225 -7.912 -4.547 1.00 0.00 H new ATOM 1087 N PHE A 68 2.238 -7.959 -7.171 1.00 0.00 N ATOM 1088 CA PHE A 68 1.369 -8.962 -7.762 1.00 0.00 C ATOM 1089 C PHE A 68 1.361 -10.195 -6.880 1.00 0.00 C ATOM 1090 O PHE A 68 2.406 -10.814 -6.677 1.00 0.00 O ATOM 1091 CB PHE A 68 1.881 -9.386 -9.140 1.00 0.00 C ATOM 1092 CG PHE A 68 1.798 -8.334 -10.206 1.00 0.00 C ATOM 1093 CD1 PHE A 68 0.631 -8.147 -10.931 1.00 0.00 C ATOM 1094 CD2 PHE A 68 2.901 -7.557 -10.505 1.00 0.00 C ATOM 1095 CE1 PHE A 68 0.571 -7.199 -11.937 1.00 0.00 C ATOM 1096 CE2 PHE A 68 2.845 -6.607 -11.504 1.00 0.00 C ATOM 1097 CZ PHE A 68 1.681 -6.429 -12.224 1.00 0.00 C ATOM 0 H PHE A 68 3.233 -8.135 -7.311 1.00 0.00 H new ATOM 0 HA PHE A 68 0.372 -8.532 -7.857 1.00 0.00 H new ATOM 0 HB2 PHE A 68 2.920 -9.700 -9.042 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.314 -10.257 -9.468 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -0.239 -8.747 -10.708 1.00 0.00 H new ATOM 0 HD2 PHE A 68 3.817 -7.695 -9.950 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.342 -7.061 -12.497 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.713 -6.002 -11.723 1.00 0.00 H new ATOM 0 HZ PHE A 68 1.638 -5.689 -13.010 1.00 0.00 H new ATOM 1107 N GLY A 69 0.205 -10.565 -6.361 1.00 0.00 N ATOM 1108 CA GLY A 69 0.159 -11.740 -5.522 1.00 0.00 C ATOM 1109 C GLY A 69 -1.037 -11.758 -4.615 1.00 0.00 C ATOM 1110 O GLY A 69 -2.044 -11.111 -4.905 1.00 0.00 O ATOM 0 H GLY A 69 -0.685 -10.086 -6.500 1.00 0.00 H new ATOM 0 HA2 GLY A 69 0.146 -12.630 -6.151 1.00 0.00 H new ATOM 0 HA3 GLY A 69 1.067 -11.788 -4.920 1.00 0.00 H new ATOM 1114 N ARG A 70 -0.951 -12.494 -3.515 1.00 0.00 N ATOM 1115 CA ARG A 70 -2.074 -12.552 -2.613 1.00 0.00 C ATOM 1116 C ARG A 70 -2.134 -11.260 -1.831 1.00 0.00 C ATOM 1117 O ARG A 70 -1.543 -11.103 -0.763 1.00 0.00 O ATOM 1118 CB ARG A 70 -1.956 -13.749 -1.665 1.00 0.00 C ATOM 1119 CG ARG A 70 -0.699 -13.737 -0.809 1.00 0.00 C ATOM 1120 CD ARG A 70 -0.412 -15.109 -0.217 1.00 0.00 C ATOM 1121 NE ARG A 70 -0.541 -15.116 1.238 1.00 0.00 N ATOM 1122 CZ ARG A 70 -0.705 -16.221 1.964 1.00 0.00 C ATOM 1123 NH1 ARG A 70 -0.762 -17.408 1.375 1.00 0.00 N ATOM 1124 NH2 ARG A 70 -0.812 -16.137 3.283 1.00 0.00 N ATOM 0 H ARG A 70 -0.137 -13.042 -3.238 1.00 0.00 H new ATOM 0 HA ARG A 70 -2.992 -12.680 -3.187 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -2.828 -13.770 -1.012 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -1.975 -14.668 -2.252 1.00 0.00 H new ATOM 0 HG2 ARG A 70 0.150 -13.416 -1.412 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -0.812 -13.010 -0.005 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -1.099 -15.839 -0.645 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.596 -15.419 -0.493 1.00 0.00 H new ATOM 0 HE ARG A 70 -0.503 -14.222 1.727 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -0.680 -17.479 0.361 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -0.888 -18.250 1.936 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -0.769 -15.227 3.741 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -0.938 -16.983 3.839 1.00 0.00 H new ATOM 1138 N ASN A 71 -2.891 -10.357 -2.404 1.00 0.00 N ATOM 1139 CA ASN A 71 -3.135 -9.041 -1.852 1.00 0.00 C ATOM 1140 C ASN A 71 -4.513 -8.593 -2.290 1.00 0.00 C ATOM 1141 O ASN A 71 -4.980 -8.998 -3.350 1.00 0.00 O ATOM 1142 CB ASN A 71 -2.075 -8.049 -2.333 1.00 0.00 C ATOM 1143 CG ASN A 71 -0.696 -8.369 -1.790 1.00 0.00 C ATOM 1144 OD1 ASN A 71 -0.036 -9.299 -2.251 1.00 0.00 O ATOM 1145 ND2 ASN A 71 -0.256 -7.598 -0.803 1.00 0.00 N ATOM 0 H ASN A 71 -3.368 -10.518 -3.291 1.00 0.00 H new ATOM 0 HA ASN A 71 -3.081 -9.080 -0.764 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -2.044 -8.054 -3.423 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -2.358 -7.042 -2.027 1.00 0.00 H new ATOM 0 HD21 ASN A 71 0.664 -7.766 -0.396 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -0.838 -6.837 -0.452 1.00 0.00 H new ATOM 1152 N PRO A 72 -5.174 -7.725 -1.528 1.00 0.00 N ATOM 1153 CA PRO A 72 -6.488 -7.224 -1.917 1.00 0.00 C ATOM 1154 C PRO A 72 -6.450 -6.587 -3.292 1.00 0.00 C ATOM 1155 O PRO A 72 -7.490 -6.301 -3.884 1.00 0.00 O ATOM 1156 CB PRO A 72 -6.832 -6.195 -0.839 1.00 0.00 C ATOM 1157 CG PRO A 72 -5.921 -6.498 0.308 1.00 0.00 C ATOM 1158 CD PRO A 72 -4.692 -7.144 -0.275 1.00 0.00 C ATOM 0 HA PRO A 72 -7.231 -8.019 -1.985 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -6.680 -5.179 -1.203 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.878 -6.273 -0.541 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -5.661 -5.587 0.847 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -6.406 -7.163 1.022 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -3.900 -6.416 -0.449 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.285 -7.905 0.390 1.00 0.00 H new ATOM 1166 N ALA A 73 -5.230 -6.395 -3.783 1.00 0.00 N ATOM 1167 CA ALA A 73 -4.958 -5.823 -5.089 1.00 0.00 C ATOM 1168 C ALA A 73 -3.822 -4.866 -4.978 1.00 0.00 C ATOM 1169 O ALA A 73 -3.913 -3.714 -5.408 1.00 0.00 O ATOM 1170 CB ALA A 73 -6.138 -5.123 -5.709 1.00 0.00 C ATOM 0 H ALA A 73 -4.385 -6.640 -3.268 1.00 0.00 H new ATOM 0 HA ALA A 73 -4.714 -6.657 -5.747 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -5.854 -4.723 -6.682 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.957 -5.831 -5.833 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -6.458 -4.307 -5.061 1.00 0.00 H new ATOM 1176 N CYS A 74 -2.740 -5.340 -4.399 1.00 0.00 N ATOM 1177 CA CYS A 74 -1.581 -4.485 -4.252 1.00 0.00 C ATOM 1178 C CYS A 74 -1.296 -3.940 -5.629 1.00 0.00 C ATOM 1179 O CYS A 74 -1.651 -2.803 -5.946 1.00 0.00 O ATOM 1180 CB CYS A 74 -0.427 -5.348 -3.796 1.00 0.00 C ATOM 1181 SG CYS A 74 0.376 -4.798 -2.271 1.00 0.00 S ATOM 0 H CYS A 74 -2.637 -6.286 -4.031 1.00 0.00 H new ATOM 0 HA CYS A 74 -1.734 -3.679 -3.534 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -0.788 -6.367 -3.653 1.00 0.00 H new ATOM 0 HB3 CYS A 74 0.319 -5.383 -4.590 1.00 0.00 H new ATOM 0 HG CYS A 74 1.660 -4.727 -2.458 1.00 0.00 H new ATOM 1187 N ASP A 75 -0.848 -4.825 -6.496 1.00 0.00 N ATOM 1188 CA ASP A 75 -0.749 -4.500 -7.890 1.00 0.00 C ATOM 1189 C ASP A 75 -2.029 -5.015 -8.523 1.00 0.00 C ATOM 1190 O ASP A 75 -2.716 -4.332 -9.283 1.00 0.00 O ATOM 1191 CB ASP A 75 0.469 -5.148 -8.551 1.00 0.00 C ATOM 1192 CG ASP A 75 0.575 -4.795 -10.021 1.00 0.00 C ATOM 1193 OD1 ASP A 75 -0.434 -4.944 -10.742 1.00 0.00 O ATOM 1194 OD2 ASP A 75 1.666 -4.371 -10.454 1.00 0.00 O ATOM 0 H ASP A 75 -0.549 -5.770 -6.254 1.00 0.00 H new ATOM 0 HA ASP A 75 -0.623 -3.426 -8.023 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.374 -4.827 -8.035 1.00 0.00 H new ATOM 0 HB3 ASP A 75 0.407 -6.231 -8.442 1.00 0.00 H new ATOM 1199 N TYR A 76 -2.317 -6.278 -8.152 1.00 0.00 N ATOM 1200 CA TYR A 76 -3.491 -7.018 -8.605 1.00 0.00 C ATOM 1201 C TYR A 76 -4.043 -7.922 -7.495 1.00 0.00 C ATOM 1202 O TYR A 76 -3.267 -8.539 -6.766 1.00 0.00 O ATOM 1203 CB TYR A 76 -3.135 -7.863 -9.830 1.00 0.00 C ATOM 1204 CG TYR A 76 -4.275 -8.729 -10.310 1.00 0.00 C ATOM 1205 CD1 TYR A 76 -4.538 -9.958 -9.718 1.00 0.00 C ATOM 1206 CD2 TYR A 76 -5.097 -8.311 -11.347 1.00 0.00 C ATOM 1207 CE1 TYR A 76 -5.588 -10.746 -10.150 1.00 0.00 C ATOM 1208 CE2 TYR A 76 -6.150 -9.093 -11.783 1.00 0.00 C ATOM 1209 CZ TYR A 76 -6.391 -10.309 -11.182 1.00 0.00 C ATOM 1210 OH TYR A 76 -7.437 -11.091 -11.614 1.00 0.00 O ATOM 0 H TYR A 76 -1.724 -6.814 -7.518 1.00 0.00 H new ATOM 0 HA TYR A 76 -4.262 -6.295 -8.871 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.823 -7.203 -10.640 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -2.282 -8.498 -9.590 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -3.912 -10.303 -8.908 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -4.911 -7.359 -11.821 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -5.779 -11.700 -9.681 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -6.781 -8.752 -12.591 1.00 0.00 H new ATOM 0 HH TYR A 76 -8.254 -10.551 -11.654 1.00 0.00 H new ATOM 1220 N HIS A 77 -5.362 -8.054 -7.392 1.00 0.00 N ATOM 1221 CA HIS A 77 -5.950 -8.945 -6.398 1.00 0.00 C ATOM 1222 C HIS A 77 -6.192 -10.327 -7.006 1.00 0.00 C ATOM 1223 O HIS A 77 -7.075 -10.493 -7.848 1.00 0.00 O ATOM 1224 CB HIS A 77 -7.271 -8.395 -5.874 1.00 0.00 C ATOM 1225 CG HIS A 77 -7.826 -9.207 -4.748 1.00 0.00 C ATOM 1226 ND1 HIS A 77 -7.249 -10.174 -3.999 1.00 0.00 N flip ATOM 1227 CD2 HIS A 77 -9.117 -9.079 -4.281 1.00 0.00 C flip ATOM 1228 CE1 HIS A 77 -8.191 -10.609 -3.101 1.00 0.00 C flip ATOM 1229 NE2 HIS A 77 -9.310 -9.932 -3.292 1.00 0.00 N flip ATOM 0 H HIS A 77 -6.037 -7.562 -7.977 1.00 0.00 H new ATOM 0 HA HIS A 77 -5.248 -9.022 -5.568 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -7.125 -7.368 -5.539 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -7.996 -8.365 -6.687 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -6.292 -10.516 -4.085 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -9.855 -8.389 -4.664 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -8.042 -11.379 -2.359 1.00 0.00 H new ATOM 1238 N LEU A 78 -5.409 -11.316 -6.584 1.00 0.00 N ATOM 1239 CA LEU A 78 -5.555 -12.676 -7.105 1.00 0.00 C ATOM 1240 C LEU A 78 -5.800 -13.683 -5.983 1.00 0.00 C ATOM 1241 O LEU A 78 -5.771 -13.334 -4.802 1.00 0.00 O ATOM 1242 CB LEU A 78 -4.311 -13.076 -7.900 1.00 0.00 C ATOM 1243 CG LEU A 78 -2.995 -13.004 -7.121 1.00 0.00 C ATOM 1244 CD1 LEU A 78 -2.459 -14.400 -6.846 1.00 0.00 C ATOM 1245 CD2 LEU A 78 -1.970 -12.174 -7.882 1.00 0.00 C ATOM 0 H LEU A 78 -4.672 -11.205 -5.888 1.00 0.00 H new ATOM 0 HA LEU A 78 -6.423 -12.686 -7.764 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -4.444 -14.094 -8.266 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.234 -12.430 -8.775 1.00 0.00 H new ATOM 0 HG LEU A 78 -3.187 -12.518 -6.164 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.523 -14.328 -6.292 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -3.187 -14.960 -6.259 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.282 -14.914 -7.791 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.041 -12.133 -7.314 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.782 -12.630 -8.854 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -2.353 -11.163 -8.024 1.00 0.00 H new ATOM 1257 N GLY A 79 -6.043 -14.935 -6.366 1.00 0.00 N ATOM 1258 CA GLY A 79 -6.293 -15.982 -5.388 1.00 0.00 C ATOM 1259 C GLY A 79 -5.102 -16.227 -4.482 1.00 0.00 C ATOM 1260 O GLY A 79 -4.137 -15.464 -4.498 1.00 0.00 O ATOM 0 H GLY A 79 -6.071 -15.243 -7.338 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.157 -15.709 -4.782 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.547 -16.906 -5.907 1.00 0.00 H new ATOM 1264 N ASN A 80 -5.171 -17.291 -3.683 1.00 0.00 N ATOM 1265 CA ASN A 80 -4.084 -17.617 -2.765 1.00 0.00 C ATOM 1266 C ASN A 80 -3.365 -18.901 -3.175 1.00 0.00 C ATOM 1267 O ASN A 80 -3.812 -20.005 -2.865 1.00 0.00 O ATOM 1268 CB ASN A 80 -4.623 -17.757 -1.340 1.00 0.00 C ATOM 1269 CG ASN A 80 -5.868 -18.619 -1.273 1.00 0.00 C ATOM 1270 OD1 ASN A 80 -6.987 -18.127 -1.424 1.00 0.00 O ATOM 1271 ND2 ASN A 80 -5.681 -19.914 -1.047 1.00 0.00 N ATOM 0 H ASN A 80 -5.961 -17.936 -3.653 1.00 0.00 H new ATOM 0 HA ASN A 80 -3.363 -16.801 -2.804 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -3.851 -18.189 -0.704 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -4.848 -16.768 -0.941 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -6.482 -20.543 -0.993 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -4.736 -20.280 -0.928 1.00 0.00 H new ATOM 1278 N ILE A 81 -2.232 -18.741 -3.853 1.00 0.00 N ATOM 1279 CA ILE A 81 -1.420 -19.871 -4.290 1.00 0.00 C ATOM 1280 C ILE A 81 -0.073 -19.870 -3.568 1.00 0.00 C ATOM 1281 O ILE A 81 0.756 -18.987 -3.787 1.00 0.00 O ATOM 1282 CB ILE A 81 -1.179 -19.839 -5.809 1.00 0.00 C ATOM 1283 CG1 ILE A 81 -2.509 -19.757 -6.561 1.00 0.00 C ATOM 1284 CG2 ILE A 81 -0.391 -21.064 -6.251 1.00 0.00 C ATOM 1285 CD1 ILE A 81 -3.154 -18.389 -6.505 1.00 0.00 C ATOM 0 H ILE A 81 -1.853 -17.830 -4.113 1.00 0.00 H new ATOM 0 HA ILE A 81 -1.969 -20.780 -4.044 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.594 -18.950 -6.046 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.345 -20.029 -7.604 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.198 -20.492 -6.144 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -0.230 -21.024 -7.328 1.00 0.00 H new ATOM 0 HG22 ILE A 81 0.572 -21.081 -5.741 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.950 -21.966 -6.001 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.092 -18.406 -7.059 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.351 -18.122 -5.467 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.484 -17.652 -6.949 1.00 0.00 H new ATOM 1297 N SER A 82 0.133 -20.854 -2.704 1.00 0.00 N ATOM 1298 CA SER A 82 1.371 -20.959 -1.937 1.00 0.00 C ATOM 1299 C SER A 82 2.611 -20.979 -2.835 1.00 0.00 C ATOM 1300 O SER A 82 3.708 -20.642 -2.387 1.00 0.00 O ATOM 1301 CB SER A 82 1.345 -22.217 -1.067 1.00 0.00 C ATOM 1302 OG SER A 82 2.546 -22.351 -0.328 1.00 0.00 O ATOM 0 H SER A 82 -0.542 -21.594 -2.515 1.00 0.00 H new ATOM 0 HA SER A 82 1.435 -20.072 -1.306 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.497 -22.173 -0.384 1.00 0.00 H new ATOM 0 HB3 SER A 82 1.202 -23.095 -1.696 1.00 0.00 H new ATOM 0 HG SER A 82 2.504 -23.162 0.221 1.00 0.00 H new ATOM 1308 N ARG A 83 2.448 -21.393 -4.087 1.00 0.00 N ATOM 1309 CA ARG A 83 3.577 -21.471 -5.013 1.00 0.00 C ATOM 1310 C ARG A 83 3.801 -20.151 -5.771 1.00 0.00 C ATOM 1311 O ARG A 83 4.229 -19.160 -5.180 1.00 0.00 O ATOM 1312 CB ARG A 83 3.379 -22.636 -5.987 1.00 0.00 C ATOM 1313 CG ARG A 83 3.582 -24.002 -5.348 1.00 0.00 C ATOM 1314 CD ARG A 83 2.256 -24.672 -5.023 1.00 0.00 C ATOM 1315 NE ARG A 83 2.200 -25.129 -3.637 1.00 0.00 N ATOM 1316 CZ ARG A 83 2.896 -26.163 -3.167 1.00 0.00 C ATOM 1317 NH1 ARG A 83 3.699 -26.851 -3.970 1.00 0.00 N ATOM 1318 NH2 ARG A 83 2.789 -26.510 -1.893 1.00 0.00 N ATOM 0 H ARG A 83 1.553 -21.678 -4.484 1.00 0.00 H new ATOM 0 HA ARG A 83 4.476 -21.650 -4.424 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.373 -22.584 -6.403 1.00 0.00 H new ATOM 0 HB3 ARG A 83 4.074 -22.526 -6.819 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.156 -24.638 -6.022 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.169 -23.894 -4.436 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.441 -23.972 -5.207 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.105 -25.520 -5.691 1.00 0.00 H new ATOM 0 HE ARG A 83 1.592 -24.627 -2.990 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.785 -26.589 -4.952 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.230 -27.642 -3.605 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.173 -25.985 -1.271 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.322 -27.302 -1.534 1.00 0.00 H new ATOM 1332 N LEU A 84 3.508 -20.139 -7.075 1.00 0.00 N ATOM 1333 CA LEU A 84 3.675 -18.955 -7.891 1.00 0.00 C ATOM 1334 C LEU A 84 2.319 -18.395 -8.259 1.00 0.00 C ATOM 1335 O LEU A 84 1.555 -19.003 -9.011 1.00 0.00 O ATOM 1336 CB LEU A 84 4.486 -19.231 -9.166 1.00 0.00 C ATOM 1337 CG LEU A 84 5.082 -20.638 -9.317 1.00 0.00 C ATOM 1338 CD1 LEU A 84 5.944 -20.996 -8.114 1.00 0.00 C ATOM 1339 CD2 LEU A 84 3.983 -21.672 -9.532 1.00 0.00 C ATOM 0 H LEU A 84 3.151 -20.949 -7.582 1.00 0.00 H new ATOM 0 HA LEU A 84 4.235 -18.229 -7.301 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.843 -19.041 -10.025 1.00 0.00 H new ATOM 0 HB3 LEU A 84 5.302 -18.510 -9.212 1.00 0.00 H new ATOM 0 HG LEU A 84 5.723 -20.641 -10.199 1.00 0.00 H new ATOM 0 HD11 LEU A 84 6.354 -21.997 -8.245 1.00 0.00 H new ATOM 0 HD12 LEU A 84 6.760 -20.278 -8.024 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.336 -20.969 -7.210 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.429 -22.661 -9.636 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.307 -21.667 -8.677 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.426 -21.428 -10.437 1.00 0.00 H new ATOM 1351 N SER A 85 2.039 -17.236 -7.714 1.00 0.00 N ATOM 1352 CA SER A 85 0.778 -16.537 -7.940 1.00 0.00 C ATOM 1353 C SER A 85 0.581 -15.494 -6.857 1.00 0.00 C ATOM 1354 O SER A 85 0.245 -14.351 -7.148 1.00 0.00 O ATOM 1355 CB SER A 85 -0.405 -17.505 -7.968 1.00 0.00 C ATOM 1356 OG SER A 85 -0.930 -17.627 -9.279 1.00 0.00 O ATOM 0 H SER A 85 2.679 -16.740 -7.094 1.00 0.00 H new ATOM 0 HA SER A 85 0.823 -16.051 -8.915 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.088 -18.483 -7.607 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.184 -17.153 -7.292 1.00 0.00 H new ATOM 0 HG SER A 85 -0.328 -18.178 -9.822 1.00 0.00 H new ATOM 1362 N ASN A 86 0.836 -15.884 -5.605 1.00 0.00 N ATOM 1363 CA ASN A 86 0.729 -14.954 -4.487 1.00 0.00 C ATOM 1364 C ASN A 86 1.781 -13.872 -4.680 1.00 0.00 C ATOM 1365 O ASN A 86 2.117 -13.564 -5.821 1.00 0.00 O ATOM 1366 CB ASN A 86 0.925 -15.679 -3.151 1.00 0.00 C ATOM 1367 CG ASN A 86 -0.232 -16.593 -2.823 1.00 0.00 C ATOM 1368 OD1 ASN A 86 -1.305 -16.482 -3.411 1.00 0.00 O ATOM 1369 ND2 ASN A 86 -0.025 -17.498 -1.873 1.00 0.00 N ATOM 0 H ASN A 86 1.115 -16.830 -5.345 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.266 -14.509 -4.463 1.00 0.00 H new ATOM 0 HB2 ASN A 86 1.846 -16.260 -3.187 1.00 0.00 H new ATOM 0 HB3 ASN A 86 1.042 -14.944 -2.355 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -0.774 -18.137 -1.605 1.00 0.00 H new ATOM 0 HD22 ASN A 86 0.883 -17.554 -1.411 1.00 0.00 H new ATOM 1376 N LYS A 87 2.317 -13.293 -3.602 1.00 0.00 N ATOM 1377 CA LYS A 87 3.346 -12.263 -3.748 1.00 0.00 C ATOM 1378 C LYS A 87 4.421 -12.772 -4.701 1.00 0.00 C ATOM 1379 O LYS A 87 5.513 -13.158 -4.282 1.00 0.00 O ATOM 1380 CB LYS A 87 3.958 -11.917 -2.387 1.00 0.00 C ATOM 1381 CG LYS A 87 3.481 -10.587 -1.828 1.00 0.00 C ATOM 1382 CD LYS A 87 4.169 -10.257 -0.513 1.00 0.00 C ATOM 1383 CE LYS A 87 3.787 -8.871 -0.015 1.00 0.00 C ATOM 1384 NZ LYS A 87 4.980 -8.074 0.381 1.00 0.00 N ATOM 0 H LYS A 87 2.062 -13.514 -2.639 1.00 0.00 H new ATOM 0 HA LYS A 87 2.897 -11.356 -4.153 1.00 0.00 H new ATOM 0 HB2 LYS A 87 3.716 -12.708 -1.677 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.044 -11.894 -2.481 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.677 -9.796 -2.551 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.402 -10.620 -1.677 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.899 -11.001 0.237 1.00 0.00 H new ATOM 0 HD3 LYS A 87 5.250 -10.313 -0.643 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.241 -8.343 -0.796 1.00 0.00 H new ATOM 0 HE3 LYS A 87 3.114 -8.964 0.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 4.676 -7.137 0.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 5.488 -8.565 1.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 5.611 -7.962 -0.438 1.00 0.00 H new ATOM 1398 N HIS A 88 4.069 -12.829 -5.983 1.00 0.00 N ATOM 1399 CA HIS A 88 4.962 -13.358 -6.995 1.00 0.00 C ATOM 1400 C HIS A 88 5.851 -12.313 -7.641 1.00 0.00 C ATOM 1401 O HIS A 88 6.864 -12.657 -8.252 1.00 0.00 O ATOM 1402 CB HIS A 88 4.194 -14.086 -8.074 1.00 0.00 C ATOM 1403 CG HIS A 88 5.156 -14.814 -8.943 1.00 0.00 C ATOM 1404 ND1 HIS A 88 5.528 -16.112 -8.706 1.00 0.00 N ATOM 1405 CD2 HIS A 88 5.946 -14.367 -9.942 1.00 0.00 C ATOM 1406 CE1 HIS A 88 6.517 -16.433 -9.512 1.00 0.00 C ATOM 1407 NE2 HIS A 88 6.792 -15.395 -10.281 1.00 0.00 N ATOM 0 H HIS A 88 3.168 -12.513 -6.340 1.00 0.00 H new ATOM 0 HA HIS A 88 5.613 -14.050 -6.461 1.00 0.00 H new ATOM 0 HB2 HIS A 88 3.487 -14.785 -7.627 1.00 0.00 H new ATOM 0 HB3 HIS A 88 3.613 -13.379 -8.665 1.00 0.00 H new ATOM 0 HD1 HIS A 88 5.105 -16.731 -8.014 1.00 0.00 H new ATOM 0 HD2 HIS A 88 5.918 -13.385 -10.391 1.00 0.00 H new ATOM 0 HE1 HIS A 88 7.021 -17.388 -9.540 1.00 0.00 H new ATOM 1416 N PHE A 89 5.514 -11.053 -7.509 1.00 0.00 N ATOM 1417 CA PHE A 89 6.374 -10.019 -8.084 1.00 0.00 C ATOM 1418 C PHE A 89 5.921 -8.624 -7.732 1.00 0.00 C ATOM 1419 O PHE A 89 4.753 -8.381 -7.433 1.00 0.00 O ATOM 1420 CB PHE A 89 6.548 -10.225 -9.592 1.00 0.00 C ATOM 1421 CG PHE A 89 6.621 -8.980 -10.438 1.00 0.00 C ATOM 1422 CD1 PHE A 89 7.731 -8.156 -10.396 1.00 0.00 C ATOM 1423 CD2 PHE A 89 5.586 -8.656 -11.300 1.00 0.00 C ATOM 1424 CE1 PHE A 89 7.810 -7.032 -11.193 1.00 0.00 C ATOM 1425 CE2 PHE A 89 5.655 -7.530 -12.098 1.00 0.00 C ATOM 1426 CZ PHE A 89 6.770 -6.717 -12.044 1.00 0.00 C ATOM 0 H PHE A 89 4.681 -10.715 -7.027 1.00 0.00 H new ATOM 0 HA PHE A 89 7.359 -10.125 -7.629 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.459 -10.801 -9.754 1.00 0.00 H new ATOM 0 HB3 PHE A 89 5.718 -10.833 -9.951 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.547 -8.395 -9.730 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.714 -9.292 -11.349 1.00 0.00 H new ATOM 0 HE1 PHE A 89 8.685 -6.400 -11.151 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.839 -7.286 -12.762 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.828 -5.836 -12.666 1.00 0.00 H new ATOM 1436 N GLN A 90 6.885 -7.718 -7.729 1.00 0.00 N ATOM 1437 CA GLN A 90 6.608 -6.330 -7.356 1.00 0.00 C ATOM 1438 C GLN A 90 7.276 -5.304 -8.268 1.00 0.00 C ATOM 1439 O GLN A 90 8.269 -5.583 -8.935 1.00 0.00 O ATOM 1440 CB GLN A 90 7.062 -6.086 -5.916 1.00 0.00 C ATOM 1441 CG GLN A 90 6.259 -6.856 -4.884 1.00 0.00 C ATOM 1442 CD GLN A 90 6.627 -6.482 -3.461 1.00 0.00 C ATOM 1443 OE1 GLN A 90 7.048 -7.328 -2.674 1.00 0.00 O ATOM 1444 NE2 GLN A 90 6.468 -5.208 -3.125 1.00 0.00 N ATOM 0 H GLN A 90 7.856 -7.909 -7.976 1.00 0.00 H new ATOM 0 HA GLN A 90 5.532 -6.194 -7.460 1.00 0.00 H new ATOM 0 HB2 GLN A 90 8.113 -6.361 -5.824 1.00 0.00 H new ATOM 0 HB3 GLN A 90 6.991 -5.020 -5.698 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.197 -6.669 -5.042 1.00 0.00 H new ATOM 0 HG3 GLN A 90 6.419 -7.925 -5.028 1.00 0.00 H new ATOM 0 HE21 GLN A 90 6.116 -4.540 -3.810 1.00 0.00 H new ATOM 0 HE22 GLN A 90 6.698 -4.897 -2.181 1.00 0.00 H new ATOM 1453 N ILE A 91 6.716 -4.097 -8.257 1.00 0.00 N ATOM 1454 CA ILE A 91 7.230 -2.985 -9.040 1.00 0.00 C ATOM 1455 C ILE A 91 7.443 -1.769 -8.139 1.00 0.00 C ATOM 1456 O ILE A 91 6.558 -1.410 -7.371 1.00 0.00 O ATOM 1457 CB ILE A 91 6.245 -2.602 -10.153 1.00 0.00 C ATOM 1458 CG1 ILE A 91 6.103 -3.733 -11.169 1.00 0.00 C ATOM 1459 CG2 ILE A 91 6.681 -1.322 -10.827 1.00 0.00 C ATOM 1460 CD1 ILE A 91 4.699 -3.866 -11.718 1.00 0.00 C ATOM 0 H ILE A 91 5.892 -3.866 -7.703 1.00 0.00 H new ATOM 0 HA ILE A 91 8.176 -3.295 -9.485 1.00 0.00 H new ATOM 0 HB ILE A 91 5.267 -2.435 -9.702 1.00 0.00 H new ATOM 0 HG12 ILE A 91 6.794 -3.561 -11.994 1.00 0.00 H new ATOM 0 HG13 ILE A 91 6.394 -4.673 -10.700 1.00 0.00 H new ATOM 0 HG21 ILE A 91 5.971 -1.065 -11.614 1.00 0.00 H new ATOM 0 HG22 ILE A 91 6.716 -0.517 -10.092 1.00 0.00 H new ATOM 0 HG23 ILE A 91 7.671 -1.459 -11.262 1.00 0.00 H new ATOM 0 HD11 ILE A 91 4.665 -4.687 -12.434 1.00 0.00 H new ATOM 0 HD12 ILE A 91 4.006 -4.068 -10.901 1.00 0.00 H new ATOM 0 HD13 ILE A 91 4.413 -2.939 -12.215 1.00 0.00 H new ATOM 1472 N LEU A 92 8.606 -1.131 -8.227 1.00 0.00 N ATOM 1473 CA LEU A 92 8.883 0.035 -7.400 1.00 0.00 C ATOM 1474 C LEU A 92 8.955 1.303 -8.250 1.00 0.00 C ATOM 1475 O LEU A 92 9.541 1.305 -9.333 1.00 0.00 O ATOM 1476 CB LEU A 92 10.187 -0.185 -6.618 1.00 0.00 C ATOM 1477 CG LEU A 92 11.072 1.050 -6.441 1.00 0.00 C ATOM 1478 CD1 LEU A 92 10.428 2.036 -5.479 1.00 0.00 C ATOM 1479 CD2 LEU A 92 12.455 0.648 -5.951 1.00 0.00 C ATOM 0 H LEU A 92 9.363 -1.399 -8.856 1.00 0.00 H new ATOM 0 HA LEU A 92 8.067 0.167 -6.689 1.00 0.00 H new ATOM 0 HB2 LEU A 92 9.936 -0.573 -5.631 1.00 0.00 H new ATOM 0 HB3 LEU A 92 10.768 -0.955 -7.125 1.00 0.00 H new ATOM 0 HG LEU A 92 11.179 1.539 -7.409 1.00 0.00 H new ATOM 0 HD11 LEU A 92 11.072 2.908 -5.366 1.00 0.00 H new ATOM 0 HD12 LEU A 92 9.460 2.348 -5.872 1.00 0.00 H new ATOM 0 HD13 LEU A 92 10.289 1.559 -4.509 1.00 0.00 H new ATOM 0 HD21 LEU A 92 13.071 1.539 -5.831 1.00 0.00 H new ATOM 0 HD22 LEU A 92 12.367 0.135 -4.993 1.00 0.00 H new ATOM 0 HD23 LEU A 92 12.919 -0.019 -6.678 1.00 0.00 H new ATOM 1491 N LEU A 93 8.358 2.379 -7.748 1.00 0.00 N ATOM 1492 CA LEU A 93 8.356 3.655 -8.455 1.00 0.00 C ATOM 1493 C LEU A 93 8.938 4.760 -7.579 1.00 0.00 C ATOM 1494 O LEU A 93 8.525 4.940 -6.433 1.00 0.00 O ATOM 1495 CB LEU A 93 6.932 4.020 -8.892 1.00 0.00 C ATOM 1496 CG LEU A 93 6.740 5.454 -9.401 1.00 0.00 C ATOM 1497 CD1 LEU A 93 6.556 6.414 -8.236 1.00 0.00 C ATOM 1498 CD2 LEU A 93 7.914 5.885 -10.270 1.00 0.00 C ATOM 0 H LEU A 93 7.869 2.393 -6.853 1.00 0.00 H new ATOM 0 HA LEU A 93 8.981 3.555 -9.342 1.00 0.00 H new ATOM 0 HB2 LEU A 93 6.625 3.331 -9.679 1.00 0.00 H new ATOM 0 HB3 LEU A 93 6.261 3.860 -8.048 1.00 0.00 H new ATOM 0 HG LEU A 93 5.839 5.478 -10.014 1.00 0.00 H new ATOM 0 HD11 LEU A 93 6.421 7.426 -8.617 1.00 0.00 H new ATOM 0 HD12 LEU A 93 5.678 6.123 -7.660 1.00 0.00 H new ATOM 0 HD13 LEU A 93 7.437 6.382 -7.595 1.00 0.00 H new ATOM 0 HD21 LEU A 93 7.754 6.905 -10.618 1.00 0.00 H new ATOM 0 HD22 LEU A 93 8.834 5.841 -9.687 1.00 0.00 H new ATOM 0 HD23 LEU A 93 7.996 5.217 -11.128 1.00 0.00 H new ATOM 1510 N GLY A 94 9.896 5.500 -8.128 1.00 0.00 N ATOM 1511 CA GLY A 94 10.519 6.580 -7.385 1.00 0.00 C ATOM 1512 C GLY A 94 12.024 6.606 -7.557 1.00 0.00 C ATOM 1513 O GLY A 94 12.527 6.589 -8.680 1.00 0.00 O ATOM 0 H GLY A 94 10.252 5.371 -9.075 1.00 0.00 H new ATOM 0 HA2 GLY A 94 10.102 7.532 -7.714 1.00 0.00 H new ATOM 0 HA3 GLY A 94 10.279 6.475 -6.327 1.00 0.00 H new ATOM 1565 N LEU A 99 11.751 4.626 -12.396 1.00 0.00 N ATOM 1566 CA LEU A 99 10.956 3.409 -12.285 1.00 0.00 C ATOM 1567 C LEU A 99 11.850 2.199 -12.024 1.00 0.00 C ATOM 1568 O LEU A 99 12.844 1.988 -12.718 1.00 0.00 O ATOM 1569 CB LEU A 99 10.138 3.191 -13.563 1.00 0.00 C ATOM 1570 CG LEU A 99 8.664 3.588 -13.465 1.00 0.00 C ATOM 1571 CD1 LEU A 99 7.961 2.774 -12.390 1.00 0.00 C ATOM 1572 CD2 LEU A 99 8.530 5.078 -13.183 1.00 0.00 C ATOM 0 HA LEU A 99 10.275 3.523 -11.442 1.00 0.00 H new ATOM 0 HB2 LEU A 99 10.598 3.759 -14.372 1.00 0.00 H new ATOM 0 HB3 LEU A 99 10.197 2.138 -13.839 1.00 0.00 H new ATOM 0 HG LEU A 99 8.187 3.376 -14.422 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.914 3.071 -12.335 1.00 0.00 H new ATOM 0 HD12 LEU A 99 8.025 1.714 -12.636 1.00 0.00 H new ATOM 0 HD13 LEU A 99 8.439 2.953 -11.427 1.00 0.00 H new ATOM 0 HD21 LEU A 99 7.475 5.342 -13.117 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.024 5.316 -12.241 1.00 0.00 H new ATOM 0 HD23 LEU A 99 8.996 5.644 -13.990 1.00 0.00 H new ATOM 1584 N LEU A 100 11.486 1.407 -11.021 1.00 0.00 N ATOM 1585 CA LEU A 100 12.248 0.216 -10.666 1.00 0.00 C ATOM 1586 C LEU A 100 11.332 -1.001 -10.613 1.00 0.00 C ATOM 1587 O LEU A 100 10.157 -0.883 -10.267 1.00 0.00 O ATOM 1588 CB LEU A 100 12.943 0.410 -9.316 1.00 0.00 C ATOM 1589 CG LEU A 100 14.352 1.005 -9.382 1.00 0.00 C ATOM 1590 CD1 LEU A 100 15.341 -0.017 -9.920 1.00 0.00 C ATOM 1591 CD2 LEU A 100 14.364 2.262 -10.239 1.00 0.00 C ATOM 0 H LEU A 100 10.665 1.570 -10.438 1.00 0.00 H new ATOM 0 HA LEU A 100 13.008 0.051 -11.430 1.00 0.00 H new ATOM 0 HB2 LEU A 100 12.322 1.058 -8.697 1.00 0.00 H new ATOM 0 HB3 LEU A 100 12.998 -0.555 -8.813 1.00 0.00 H new ATOM 0 HG LEU A 100 14.655 1.276 -8.371 1.00 0.00 H new ATOM 0 HD11 LEU A 100 16.336 0.425 -9.959 1.00 0.00 H new ATOM 0 HD12 LEU A 100 15.357 -0.888 -9.265 1.00 0.00 H new ATOM 0 HD13 LEU A 100 15.040 -0.322 -10.922 1.00 0.00 H new ATOM 0 HD21 LEU A 100 15.374 2.669 -10.273 1.00 0.00 H new ATOM 0 HD22 LEU A 100 14.037 2.017 -11.250 1.00 0.00 H new ATOM 0 HD23 LEU A 100 13.689 3.002 -9.809 1.00 0.00 H new ATOM 1603 N LEU A 101 11.863 -2.172 -10.951 1.00 0.00 N ATOM 1604 CA LEU A 101 11.061 -3.392 -10.927 1.00 0.00 C ATOM 1605 C LEU A 101 11.607 -4.355 -9.889 1.00 0.00 C ATOM 1606 O LEU A 101 12.802 -4.639 -9.879 1.00 0.00 O ATOM 1607 CB LEU A 101 11.054 -4.056 -12.305 1.00 0.00 C ATOM 1608 CG LEU A 101 10.665 -3.137 -13.464 1.00 0.00 C ATOM 1609 CD1 LEU A 101 10.698 -3.896 -14.782 1.00 0.00 C ATOM 1610 CD2 LEU A 101 9.286 -2.537 -13.227 1.00 0.00 C ATOM 0 H LEU A 101 12.832 -2.303 -11.241 1.00 0.00 H new ATOM 0 HA LEU A 101 10.037 -3.128 -10.663 1.00 0.00 H new ATOM 0 HB2 LEU A 101 12.046 -4.462 -12.501 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.363 -4.899 -12.282 1.00 0.00 H new ATOM 0 HG LEU A 101 11.390 -2.325 -13.518 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.418 -3.226 -15.595 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.704 -4.278 -14.957 1.00 0.00 H new ATOM 0 HD13 LEU A 101 9.996 -4.728 -14.740 1.00 0.00 H new ATOM 0 HD21 LEU A 101 9.024 -1.886 -14.061 1.00 0.00 H new ATOM 0 HD22 LEU A 101 8.550 -3.337 -13.147 1.00 0.00 H new ATOM 0 HD23 LEU A 101 9.295 -1.958 -12.303 1.00 0.00 H new ATOM 1622 N ASN A 102 10.747 -4.872 -9.015 1.00 0.00 N ATOM 1623 CA ASN A 102 11.216 -5.800 -8.006 1.00 0.00 C ATOM 1624 C ASN A 102 10.635 -7.170 -8.259 1.00 0.00 C ATOM 1625 O ASN A 102 9.436 -7.385 -8.093 1.00 0.00 O ATOM 1626 CB ASN A 102 10.820 -5.311 -6.613 1.00 0.00 C ATOM 1627 CG ASN A 102 11.801 -5.744 -5.548 1.00 0.00 C ATOM 1628 OD1 ASN A 102 12.964 -6.026 -5.834 1.00 0.00 O ATOM 1629 ND2 ASN A 102 11.336 -5.797 -4.308 1.00 0.00 N ATOM 0 H ASN A 102 9.748 -4.667 -8.988 1.00 0.00 H new ATOM 0 HA ASN A 102 12.303 -5.859 -8.059 1.00 0.00 H new ATOM 0 HB2 ASN A 102 10.752 -4.223 -6.619 1.00 0.00 H new ATOM 0 HB3 ASN A 102 9.829 -5.691 -6.366 1.00 0.00 H new ATOM 0 HD21 ASN A 102 11.950 -6.081 -3.545 1.00 0.00 H new ATOM 0 HD22 ASN A 102 10.364 -5.554 -4.117 1.00 0.00 H new ATOM 1636 N ASP A 103 11.483 -8.107 -8.648 1.00 0.00 N ATOM 1637 CA ASP A 103 11.007 -9.444 -8.903 1.00 0.00 C ATOM 1638 C ASP A 103 10.932 -10.211 -7.606 1.00 0.00 C ATOM 1639 O ASP A 103 11.954 -10.550 -7.011 1.00 0.00 O ATOM 1640 CB ASP A 103 11.935 -10.161 -9.882 1.00 0.00 C ATOM 1641 CG ASP A 103 11.649 -9.793 -11.325 1.00 0.00 C ATOM 1642 OD1 ASP A 103 10.601 -9.163 -11.582 1.00 0.00 O ATOM 1643 OD2 ASP A 103 12.473 -10.136 -12.199 1.00 0.00 O ATOM 0 H ASP A 103 12.483 -7.966 -8.790 1.00 0.00 H new ATOM 0 HA ASP A 103 10.013 -9.387 -9.346 1.00 0.00 H new ATOM 0 HB2 ASP A 103 12.970 -9.913 -9.645 1.00 0.00 H new ATOM 0 HB3 ASP A 103 11.828 -11.239 -9.757 1.00 0.00 H new ATOM 1648 N ILE A 104 9.717 -10.524 -7.190 1.00 0.00 N ATOM 1649 CA ILE A 104 9.527 -11.297 -5.990 1.00 0.00 C ATOM 1650 C ILE A 104 8.727 -12.536 -6.326 1.00 0.00 C ATOM 1651 O ILE A 104 7.539 -12.481 -6.562 1.00 0.00 O ATOM 1652 CB ILE A 104 8.847 -10.461 -4.857 1.00 0.00 C ATOM 1653 CG1 ILE A 104 7.487 -11.036 -4.442 1.00 0.00 C ATOM 1654 CG2 ILE A 104 8.685 -9.008 -5.282 1.00 0.00 C ATOM 1655 CD1 ILE A 104 6.876 -10.330 -3.251 1.00 0.00 C ATOM 0 H ILE A 104 8.857 -10.254 -7.667 1.00 0.00 H new ATOM 0 HA ILE A 104 10.502 -11.593 -5.602 1.00 0.00 H new ATOM 0 HB ILE A 104 9.507 -10.514 -3.991 1.00 0.00 H new ATOM 0 HG12 ILE A 104 6.800 -10.971 -5.286 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.604 -12.094 -4.207 1.00 0.00 H new ATOM 0 HG21 ILE A 104 8.210 -8.445 -4.479 1.00 0.00 H new ATOM 0 HG22 ILE A 104 9.664 -8.580 -5.495 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.064 -8.958 -6.177 1.00 0.00 H new ATOM 0 HD11 ILE A 104 5.916 -10.786 -3.011 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.544 -10.417 -2.394 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.728 -9.277 -3.489 1.00 0.00 H new ATOM 1667 N SER A 105 9.400 -13.642 -6.311 1.00 0.00 N ATOM 1668 CA SER A 105 8.798 -14.942 -6.598 1.00 0.00 C ATOM 1669 C SER A 105 9.152 -15.913 -5.490 1.00 0.00 C ATOM 1670 O SER A 105 9.991 -15.599 -4.644 1.00 0.00 O ATOM 1671 CB SER A 105 9.301 -15.468 -7.935 1.00 0.00 C ATOM 1672 OG SER A 105 8.844 -14.662 -9.007 1.00 0.00 O ATOM 0 H SER A 105 10.397 -13.688 -6.099 1.00 0.00 H new ATOM 0 HA SER A 105 7.715 -14.835 -6.653 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.391 -15.491 -7.933 1.00 0.00 H new ATOM 0 HB3 SER A 105 8.960 -16.494 -8.077 1.00 0.00 H new ATOM 0 HG SER A 105 8.392 -15.225 -9.670 1.00 0.00 H new ATOM 1678 N THR A 106 8.524 -17.082 -5.467 1.00 0.00 N ATOM 1679 CA THR A 106 8.831 -18.025 -4.412 1.00 0.00 C ATOM 1680 C THR A 106 10.240 -18.584 -4.570 1.00 0.00 C ATOM 1681 O THR A 106 11.091 -18.358 -3.710 1.00 0.00 O ATOM 1682 CB THR A 106 7.828 -19.193 -4.388 1.00 0.00 C ATOM 1683 OG1 THR A 106 6.489 -18.688 -4.344 1.00 0.00 O ATOM 1684 CG2 THR A 106 8.074 -20.094 -3.188 1.00 0.00 C ATOM 0 H THR A 106 7.824 -17.388 -6.143 1.00 0.00 H new ATOM 0 HA THR A 106 8.761 -17.479 -3.471 1.00 0.00 H new ATOM 0 HB THR A 106 7.966 -19.779 -5.297 1.00 0.00 H new ATOM 0 HG1 THR A 106 5.930 -19.188 -4.975 1.00 0.00 H new ATOM 0 HG21 THR A 106 7.353 -20.912 -3.193 1.00 0.00 H new ATOM 0 HG22 THR A 106 9.084 -20.501 -3.239 1.00 0.00 H new ATOM 0 HG23 THR A 106 7.961 -19.517 -2.270 1.00 0.00 H new ATOM 1692 N ASN A 107 10.508 -19.293 -5.670 1.00 0.00 N ATOM 1693 CA ASN A 107 11.850 -19.826 -5.874 1.00 0.00 C ATOM 1694 C ASN A 107 12.619 -19.177 -7.035 1.00 0.00 C ATOM 1695 O ASN A 107 13.845 -19.071 -6.976 1.00 0.00 O ATOM 1696 CB ASN A 107 11.761 -21.333 -6.105 1.00 0.00 C ATOM 1697 CG ASN A 107 10.780 -21.693 -7.186 1.00 0.00 C ATOM 1698 OD1 ASN A 107 11.106 -21.666 -8.373 1.00 0.00 O ATOM 1699 ND2 ASN A 107 9.570 -22.032 -6.788 1.00 0.00 N ATOM 0 H ASN A 107 9.837 -19.504 -6.408 1.00 0.00 H new ATOM 0 HA ASN A 107 12.413 -19.592 -4.971 1.00 0.00 H new ATOM 0 HB2 ASN A 107 12.746 -21.715 -6.371 1.00 0.00 H new ATOM 0 HB3 ASN A 107 11.469 -21.823 -5.176 1.00 0.00 H new ATOM 0 HD21 ASN A 107 8.860 -22.286 -7.475 1.00 0.00 H new ATOM 0 HD22 ASN A 107 9.344 -22.041 -5.793 1.00 0.00 H new ATOM 1706 N GLY A 108 11.919 -18.774 -8.105 1.00 0.00 N ATOM 1707 CA GLY A 108 12.614 -18.192 -9.240 1.00 0.00 C ATOM 1708 C GLY A 108 11.875 -17.108 -10.020 1.00 0.00 C ATOM 1709 O GLY A 108 10.748 -17.323 -10.465 1.00 0.00 O ATOM 0 H GLY A 108 10.906 -18.840 -8.200 1.00 0.00 H new ATOM 0 HA2 GLY A 108 13.554 -17.772 -8.883 1.00 0.00 H new ATOM 0 HA3 GLY A 108 12.866 -18.996 -9.932 1.00 0.00 H new ATOM 1713 N THR A 109 12.552 -15.989 -10.284 1.00 0.00 N ATOM 1714 CA THR A 109 11.992 -14.929 -11.131 1.00 0.00 C ATOM 1715 C THR A 109 12.919 -14.706 -12.320 1.00 0.00 C ATOM 1716 O THR A 109 14.140 -14.719 -12.164 1.00 0.00 O ATOM 1717 CB THR A 109 11.765 -13.586 -10.414 1.00 0.00 C ATOM 1718 OG1 THR A 109 11.144 -13.799 -9.142 1.00 0.00 O ATOM 1719 CG2 THR A 109 10.885 -12.675 -11.278 1.00 0.00 C ATOM 0 H THR A 109 13.486 -15.792 -9.926 1.00 0.00 H new ATOM 0 HA THR A 109 11.006 -15.276 -11.439 1.00 0.00 H new ATOM 0 HB THR A 109 12.731 -13.106 -10.256 1.00 0.00 H new ATOM 0 HG1 THR A 109 10.171 -13.733 -9.238 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.729 -11.726 -10.764 1.00 0.00 H new ATOM 0 HG22 THR A 109 11.377 -12.493 -12.233 1.00 0.00 H new ATOM 0 HG23 THR A 109 9.923 -13.157 -11.451 1.00 0.00 H new ATOM 1727 N TRP A 110 12.357 -14.529 -13.509 1.00 0.00 N ATOM 1728 CA TRP A 110 13.179 -14.340 -14.703 1.00 0.00 C ATOM 1729 C TRP A 110 12.939 -13.015 -15.400 1.00 0.00 C ATOM 1730 O TRP A 110 11.831 -12.485 -15.410 1.00 0.00 O ATOM 1731 CB TRP A 110 12.933 -15.465 -15.698 1.00 0.00 C ATOM 1732 CG TRP A 110 13.867 -16.595 -15.528 1.00 0.00 C ATOM 1733 CD1 TRP A 110 14.936 -16.892 -16.308 1.00 0.00 C ATOM 1734 CD2 TRP A 110 13.813 -17.580 -14.505 1.00 0.00 C ATOM 1735 NE1 TRP A 110 15.560 -18.008 -15.830 1.00 0.00 N ATOM 1736 CE2 TRP A 110 14.883 -18.459 -14.724 1.00 0.00 C ATOM 1737 CE3 TRP A 110 12.959 -17.803 -13.425 1.00 0.00 C ATOM 1738 CZ2 TRP A 110 15.125 -19.552 -13.897 1.00 0.00 C ATOM 1739 CZ3 TRP A 110 13.197 -18.884 -12.605 1.00 0.00 C ATOM 1740 CH2 TRP A 110 14.273 -19.750 -12.844 1.00 0.00 C ATOM 0 H TRP A 110 11.351 -14.512 -13.674 1.00 0.00 H new ATOM 0 HA TRP A 110 14.212 -14.346 -14.356 1.00 0.00 H new ATOM 0 HB2 TRP A 110 11.910 -15.825 -15.586 1.00 0.00 H new ATOM 0 HB3 TRP A 110 13.024 -15.074 -16.711 1.00 0.00 H new ATOM 0 HD1 TRP A 110 15.247 -16.330 -17.176 1.00 0.00 H new ATOM 0 HE1 TRP A 110 16.394 -18.437 -16.230 1.00 0.00 H new ATOM 0 HE3 TRP A 110 12.127 -17.141 -13.235 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 15.954 -20.219 -14.079 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 12.544 -19.067 -11.764 1.00 0.00 H new ATOM 0 HH2 TRP A 110 14.433 -20.590 -12.184 1.00 0.00 H new ATOM 1751 N LEU A 111 13.996 -12.517 -16.029 1.00 0.00 N ATOM 1752 CA LEU A 111 13.930 -11.287 -16.789 1.00 0.00 C ATOM 1753 C LEU A 111 14.387 -11.574 -18.219 1.00 0.00 C ATOM 1754 O LEU A 111 15.555 -11.879 -18.459 1.00 0.00 O ATOM 1755 CB LEU A 111 14.801 -10.207 -16.130 1.00 0.00 C ATOM 1756 CG LEU A 111 15.620 -9.336 -17.086 1.00 0.00 C ATOM 1757 CD1 LEU A 111 14.706 -8.597 -18.053 1.00 0.00 C ATOM 1758 CD2 LEU A 111 16.482 -8.354 -16.306 1.00 0.00 C ATOM 0 H LEU A 111 14.917 -12.956 -16.024 1.00 0.00 H new ATOM 0 HA LEU A 111 12.907 -10.912 -16.810 1.00 0.00 H new ATOM 0 HB2 LEU A 111 14.155 -9.557 -15.539 1.00 0.00 H new ATOM 0 HB3 LEU A 111 15.486 -10.693 -15.435 1.00 0.00 H new ATOM 0 HG LEU A 111 16.277 -9.985 -17.665 1.00 0.00 H new ATOM 0 HD11 LEU A 111 15.307 -7.983 -18.724 1.00 0.00 H new ATOM 0 HD12 LEU A 111 14.133 -9.318 -18.636 1.00 0.00 H new ATOM 0 HD13 LEU A 111 14.023 -7.959 -17.492 1.00 0.00 H new ATOM 0 HD21 LEU A 111 17.057 -7.743 -17.001 1.00 0.00 H new ATOM 0 HD22 LEU A 111 15.844 -7.711 -15.700 1.00 0.00 H new ATOM 0 HD23 LEU A 111 17.163 -8.904 -15.657 1.00 0.00 H new ATOM 1770 N ASN A 112 13.455 -11.484 -19.158 1.00 0.00 N ATOM 1771 CA ASN A 112 13.747 -11.742 -20.565 1.00 0.00 C ATOM 1772 C ASN A 112 14.546 -13.034 -20.763 1.00 0.00 C ATOM 1773 O ASN A 112 15.483 -13.075 -21.560 1.00 0.00 O ATOM 1774 CB ASN A 112 14.506 -10.561 -21.172 1.00 0.00 C ATOM 1775 CG ASN A 112 13.585 -9.429 -21.583 1.00 0.00 C ATOM 1776 OD1 ASN A 112 12.371 -9.610 -21.691 1.00 0.00 O ATOM 1777 ND2 ASN A 112 14.157 -8.254 -21.813 1.00 0.00 N ATOM 0 H ASN A 112 12.484 -11.233 -18.971 1.00 0.00 H new ATOM 0 HA ASN A 112 12.792 -11.865 -21.076 1.00 0.00 H new ATOM 0 HB2 ASN A 112 15.232 -10.190 -20.449 1.00 0.00 H new ATOM 0 HB3 ASN A 112 15.068 -10.902 -22.042 1.00 0.00 H new ATOM 0 HD21 ASN A 112 13.587 -7.455 -22.091 1.00 0.00 H new ATOM 0 HD22 ASN A 112 15.167 -8.150 -21.711 1.00 0.00 H new ATOM 1784 N GLY A 113 14.163 -14.092 -20.050 1.00 0.00 N ATOM 1785 CA GLY A 113 14.845 -15.359 -20.183 1.00 0.00 C ATOM 1786 C GLY A 113 16.089 -15.461 -19.326 1.00 0.00 C ATOM 1787 O GLY A 113 16.729 -16.512 -19.276 1.00 0.00 O ATOM 0 H GLY A 113 13.391 -14.089 -19.383 1.00 0.00 H new ATOM 0 HA2 GLY A 113 14.160 -16.163 -19.914 1.00 0.00 H new ATOM 0 HA3 GLY A 113 15.118 -15.509 -21.227 1.00 0.00 H new ATOM 1791 N GLN A 114 16.437 -14.375 -18.645 1.00 0.00 N ATOM 1792 CA GLN A 114 17.611 -14.364 -17.785 1.00 0.00 C ATOM 1793 C GLN A 114 17.208 -14.265 -16.321 1.00 0.00 C ATOM 1794 O GLN A 114 16.863 -13.189 -15.831 1.00 0.00 O ATOM 1795 CB GLN A 114 18.532 -13.203 -18.155 1.00 0.00 C ATOM 1796 CG GLN A 114 19.926 -13.641 -18.576 1.00 0.00 C ATOM 1797 CD GLN A 114 20.668 -12.566 -19.345 1.00 0.00 C ATOM 1798 OE1 GLN A 114 20.938 -11.486 -18.821 1.00 0.00 O ATOM 1799 NE2 GLN A 114 21.001 -12.858 -20.596 1.00 0.00 N ATOM 0 H GLN A 114 15.924 -13.494 -18.672 1.00 0.00 H new ATOM 0 HA GLN A 114 18.148 -15.301 -17.933 1.00 0.00 H new ATOM 0 HB2 GLN A 114 18.078 -12.635 -18.967 1.00 0.00 H new ATOM 0 HB3 GLN A 114 18.614 -12.529 -17.302 1.00 0.00 H new ATOM 0 HG2 GLN A 114 20.501 -13.911 -17.690 1.00 0.00 H new ATOM 0 HG3 GLN A 114 19.851 -14.537 -19.192 1.00 0.00 H new ATOM 0 HE21 GLN A 114 20.757 -13.767 -20.990 1.00 0.00 H new ATOM 0 HE22 GLN A 114 21.501 -12.174 -21.164 1.00 0.00 H new ATOM 1808 N LYS A 115 17.261 -15.396 -15.628 1.00 0.00 N ATOM 1809 CA LYS A 115 16.910 -15.462 -14.219 1.00 0.00 C ATOM 1810 C LYS A 115 17.515 -14.286 -13.449 1.00 0.00 C ATOM 1811 O LYS A 115 18.672 -13.921 -13.659 1.00 0.00 O ATOM 1812 CB LYS A 115 17.375 -16.811 -13.662 1.00 0.00 C ATOM 1813 CG LYS A 115 17.911 -16.772 -12.235 1.00 0.00 C ATOM 1814 CD LYS A 115 17.630 -18.073 -11.500 1.00 0.00 C ATOM 1815 CE LYS A 115 16.285 -18.034 -10.792 1.00 0.00 C ATOM 1816 NZ LYS A 115 16.161 -16.848 -9.900 1.00 0.00 N ATOM 0 H LYS A 115 17.548 -16.290 -16.028 1.00 0.00 H new ATOM 0 HA LYS A 115 15.829 -15.385 -14.101 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.539 -17.510 -13.701 1.00 0.00 H new ATOM 0 HB3 LYS A 115 18.153 -17.207 -14.315 1.00 0.00 H new ATOM 0 HG2 LYS A 115 18.985 -16.588 -12.253 1.00 0.00 H new ATOM 0 HG3 LYS A 115 17.454 -15.942 -11.696 1.00 0.00 H new ATOM 0 HD2 LYS A 115 17.646 -18.902 -12.207 1.00 0.00 H new ATOM 0 HD3 LYS A 115 18.420 -18.259 -10.772 1.00 0.00 H new ATOM 0 HE2 LYS A 115 15.485 -18.016 -11.533 1.00 0.00 H new ATOM 0 HE3 LYS A 115 16.157 -18.944 -10.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 15.609 -17.104 -9.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 17.108 -16.531 -9.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 15.679 -16.080 -10.409 1.00 0.00 H new ATOM 1830 N VAL A 116 16.713 -13.690 -12.570 1.00 0.00 N ATOM 1831 CA VAL A 116 17.158 -12.543 -11.783 1.00 0.00 C ATOM 1832 C VAL A 116 16.995 -12.789 -10.285 1.00 0.00 C ATOM 1833 O VAL A 116 16.274 -13.697 -9.869 1.00 0.00 O ATOM 1834 CB VAL A 116 16.377 -11.271 -12.177 1.00 0.00 C ATOM 1835 CG1 VAL A 116 14.896 -11.427 -11.860 1.00 0.00 C ATOM 1836 CG2 VAL A 116 16.954 -10.045 -11.485 1.00 0.00 C ATOM 0 H VAL A 116 15.753 -13.982 -12.385 1.00 0.00 H new ATOM 0 HA VAL A 116 18.217 -12.402 -11.999 1.00 0.00 H new ATOM 0 HB VAL A 116 16.480 -11.130 -13.253 1.00 0.00 H new ATOM 0 HG11 VAL A 116 14.365 -10.519 -12.146 1.00 0.00 H new ATOM 0 HG12 VAL A 116 14.492 -12.273 -12.415 1.00 0.00 H new ATOM 0 HG13 VAL A 116 14.769 -11.600 -10.791 1.00 0.00 H new ATOM 0 HG21 VAL A 116 16.387 -9.161 -11.778 1.00 0.00 H new ATOM 0 HG22 VAL A 116 16.892 -10.174 -10.404 1.00 0.00 H new ATOM 0 HG23 VAL A 116 17.997 -9.920 -11.776 1.00 0.00 H new ATOM 1846 N GLU A 117 17.672 -11.973 -9.480 1.00 0.00 N ATOM 1847 CA GLU A 117 17.608 -12.094 -8.028 1.00 0.00 C ATOM 1848 C GLU A 117 16.239 -11.674 -7.504 1.00 0.00 C ATOM 1849 O GLU A 117 15.641 -10.720 -7.999 1.00 0.00 O ATOM 1850 CB GLU A 117 18.693 -11.230 -7.379 1.00 0.00 C ATOM 1851 CG GLU A 117 18.747 -11.357 -5.865 1.00 0.00 C ATOM 1852 CD GLU A 117 18.980 -12.785 -5.409 1.00 0.00 C ATOM 1853 OE1 GLU A 117 19.793 -13.486 -6.046 1.00 0.00 O ATOM 1854 OE2 GLU A 117 18.348 -13.200 -4.415 1.00 0.00 O ATOM 0 H GLU A 117 18.273 -11.219 -9.812 1.00 0.00 H new ATOM 0 HA GLU A 117 17.773 -13.140 -7.769 1.00 0.00 H new ATOM 0 HB2 GLU A 117 19.662 -11.507 -7.793 1.00 0.00 H new ATOM 0 HB3 GLU A 117 18.520 -10.186 -7.642 1.00 0.00 H new ATOM 0 HG2 GLU A 117 19.544 -10.721 -5.479 1.00 0.00 H new ATOM 0 HG3 GLU A 117 17.813 -10.991 -5.440 1.00 0.00 H new ATOM 1861 N LYS A 118 15.751 -12.388 -6.494 1.00 0.00 N ATOM 1862 CA LYS A 118 14.455 -12.080 -5.901 1.00 0.00 C ATOM 1863 C LYS A 118 14.514 -10.755 -5.156 1.00 0.00 C ATOM 1864 O LYS A 118 15.596 -10.261 -4.839 1.00 0.00 O ATOM 1865 CB LYS A 118 14.019 -13.195 -4.950 1.00 0.00 C ATOM 1866 CG LYS A 118 12.666 -12.954 -4.302 1.00 0.00 C ATOM 1867 CD LYS A 118 12.242 -14.133 -3.443 1.00 0.00 C ATOM 1868 CE LYS A 118 10.929 -13.855 -2.729 1.00 0.00 C ATOM 1869 NZ LYS A 118 11.048 -12.722 -1.770 1.00 0.00 N ATOM 0 H LYS A 118 16.232 -13.181 -6.071 1.00 0.00 H new ATOM 0 HA LYS A 118 13.723 -12.001 -6.705 1.00 0.00 H new ATOM 0 HB2 LYS A 118 13.986 -14.136 -5.499 1.00 0.00 H new ATOM 0 HB3 LYS A 118 14.771 -13.308 -4.169 1.00 0.00 H new ATOM 0 HG2 LYS A 118 12.710 -12.053 -3.689 1.00 0.00 H new ATOM 0 HG3 LYS A 118 11.918 -12.778 -5.075 1.00 0.00 H new ATOM 0 HD2 LYS A 118 12.138 -15.021 -4.067 1.00 0.00 H new ATOM 0 HD3 LYS A 118 13.019 -14.348 -2.709 1.00 0.00 H new ATOM 0 HE2 LYS A 118 10.157 -13.629 -3.464 1.00 0.00 H new ATOM 0 HE3 LYS A 118 10.609 -14.750 -2.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 10.230 -12.723 -1.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 11.922 -12.826 -1.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 11.075 -11.824 -2.295 1.00 0.00 H new ATOM 1883 N ASN A 119 13.342 -10.187 -4.879 1.00 0.00 N ATOM 1884 CA ASN A 119 13.239 -8.914 -4.172 1.00 0.00 C ATOM 1885 C ASN A 119 14.381 -7.975 -4.547 1.00 0.00 C ATOM 1886 O ASN A 119 14.917 -7.252 -3.708 1.00 0.00 O ATOM 1887 CB ASN A 119 13.213 -9.158 -2.663 1.00 0.00 C ATOM 1888 CG ASN A 119 14.569 -9.554 -2.108 1.00 0.00 C ATOM 1889 OD1 ASN A 119 14.936 -10.818 -2.287 1.00 0.00 O flip ATOM 1890 ND2 ASN A 119 15.278 -8.732 -1.527 1.00 0.00 N flip ATOM 0 H ASN A 119 12.443 -10.594 -5.137 1.00 0.00 H new ATOM 0 HA ASN A 119 12.308 -8.431 -4.470 1.00 0.00 H new ATOM 0 HB2 ASN A 119 12.869 -8.255 -2.159 1.00 0.00 H new ATOM 0 HB3 ASN A 119 12.490 -9.943 -2.439 1.00 0.00 H new ATOM 0 HD21 ASN A 119 14.956 -7.771 -1.412 1.00 0.00 H new ATOM 0 HD22 ASN A 119 16.188 -9.012 -1.160 1.00 0.00 H new ATOM 1897 N SER A 120 14.747 -8.009 -5.821 1.00 0.00 N ATOM 1898 CA SER A 120 15.830 -7.182 -6.339 1.00 0.00 C ATOM 1899 C SER A 120 15.295 -6.107 -7.283 1.00 0.00 C ATOM 1900 O SER A 120 14.852 -6.407 -8.391 1.00 0.00 O ATOM 1901 CB SER A 120 16.852 -8.064 -7.065 1.00 0.00 C ATOM 1902 OG SER A 120 16.479 -8.276 -8.415 1.00 0.00 O ATOM 0 H SER A 120 14.306 -8.606 -6.521 1.00 0.00 H new ATOM 0 HA SER A 120 16.315 -6.682 -5.501 1.00 0.00 H new ATOM 0 HB2 SER A 120 17.835 -7.594 -7.026 1.00 0.00 H new ATOM 0 HB3 SER A 120 16.937 -9.023 -6.554 1.00 0.00 H new ATOM 0 HG SER A 120 15.546 -8.006 -8.543 1.00 0.00 H new ATOM 1908 N ASN A 121 15.342 -4.851 -6.840 1.00 0.00 N ATOM 1909 CA ASN A 121 14.864 -3.737 -7.656 1.00 0.00 C ATOM 1910 C ASN A 121 15.636 -3.667 -8.969 1.00 0.00 C ATOM 1911 O ASN A 121 16.850 -3.875 -8.995 1.00 0.00 O ATOM 1912 CB ASN A 121 15.008 -2.417 -6.894 1.00 0.00 C ATOM 1913 CG ASN A 121 14.045 -2.314 -5.727 1.00 0.00 C ATOM 1914 OD1 ASN A 121 12.752 -2.353 -6.024 1.00 0.00 O flip ATOM 1915 ND2 ASN A 121 14.460 -2.203 -4.573 1.00 0.00 N flip ATOM 0 H ASN A 121 15.704 -4.581 -5.926 1.00 0.00 H new ATOM 0 HA ASN A 121 13.810 -3.903 -7.878 1.00 0.00 H new ATOM 0 HB2 ASN A 121 16.030 -2.322 -6.527 1.00 0.00 H new ATOM 0 HB3 ASN A 121 14.836 -1.586 -7.578 1.00 0.00 H new ATOM 0 HD21 ASN A 121 15.464 -2.177 -4.392 1.00 0.00 H new ATOM 0 HD22 ASN A 121 13.800 -2.137 -3.798 1.00 0.00 H new ATOM 1922 N GLN A 122 14.932 -3.385 -10.063 1.00 0.00 N ATOM 1923 CA GLN A 122 15.570 -3.308 -11.370 1.00 0.00 C ATOM 1924 C GLN A 122 15.213 -2.029 -12.106 1.00 0.00 C ATOM 1925 O GLN A 122 14.115 -1.501 -11.962 1.00 0.00 O ATOM 1926 CB GLN A 122 15.194 -4.516 -12.228 1.00 0.00 C ATOM 1927 CG GLN A 122 15.389 -5.849 -11.525 1.00 0.00 C ATOM 1928 CD GLN A 122 16.833 -6.306 -11.537 1.00 0.00 C ATOM 1929 OE1 GLN A 122 17.552 -6.110 -12.518 1.00 0.00 O ATOM 1930 NE2 GLN A 122 17.268 -6.922 -10.443 1.00 0.00 N ATOM 0 H GLN A 122 13.928 -3.208 -10.069 1.00 0.00 H new ATOM 0 HA GLN A 122 16.646 -3.307 -11.196 1.00 0.00 H new ATOM 0 HB2 GLN A 122 14.151 -4.424 -12.531 1.00 0.00 H new ATOM 0 HB3 GLN A 122 15.793 -4.504 -13.139 1.00 0.00 H new ATOM 0 HG2 GLN A 122 15.046 -5.766 -10.494 1.00 0.00 H new ATOM 0 HG3 GLN A 122 14.768 -6.604 -12.007 1.00 0.00 H new ATOM 0 HE21 GLN A 122 16.639 -7.064 -9.653 1.00 0.00 H new ATOM 0 HE22 GLN A 122 18.231 -7.253 -10.393 1.00 0.00 H new ATOM 1939 N LEU A 123 16.151 -1.551 -12.915 1.00 0.00 N ATOM 1940 CA LEU A 123 15.939 -0.342 -13.697 1.00 0.00 C ATOM 1941 C LEU A 123 14.963 -0.634 -14.827 1.00 0.00 C ATOM 1942 O LEU A 123 15.270 -1.398 -15.742 1.00 0.00 O ATOM 1943 CB LEU A 123 17.268 0.168 -14.262 1.00 0.00 C ATOM 1944 CG LEU A 123 17.203 1.526 -14.969 1.00 0.00 C ATOM 1945 CD1 LEU A 123 16.563 1.387 -16.343 1.00 0.00 C ATOM 1946 CD2 LEU A 123 16.442 2.536 -14.121 1.00 0.00 C ATOM 0 H LEU A 123 17.066 -1.983 -13.046 1.00 0.00 H new ATOM 0 HA LEU A 123 15.522 0.432 -13.053 1.00 0.00 H new ATOM 0 HB2 LEU A 123 17.988 0.236 -13.446 1.00 0.00 H new ATOM 0 HB3 LEU A 123 17.652 -0.571 -14.965 1.00 0.00 H new ATOM 0 HG LEU A 123 18.221 1.890 -15.103 1.00 0.00 H new ATOM 0 HD11 LEU A 123 16.527 2.363 -16.828 1.00 0.00 H new ATOM 0 HD12 LEU A 123 17.153 0.701 -16.951 1.00 0.00 H new ATOM 0 HD13 LEU A 123 15.551 0.997 -16.235 1.00 0.00 H new ATOM 0 HD21 LEU A 123 16.407 3.494 -14.640 1.00 0.00 H new ATOM 0 HD22 LEU A 123 15.427 2.177 -13.952 1.00 0.00 H new ATOM 0 HD23 LEU A 123 16.947 2.661 -13.163 1.00 0.00 H new ATOM 1958 N LEU A 124 13.776 -0.043 -14.741 1.00 0.00 N ATOM 1959 CA LEU A 124 12.739 -0.262 -15.743 1.00 0.00 C ATOM 1960 C LEU A 124 13.291 -0.232 -17.158 1.00 0.00 C ATOM 1961 O LEU A 124 14.236 0.493 -17.469 1.00 0.00 O ATOM 1962 CB LEU A 124 11.626 0.766 -15.610 1.00 0.00 C ATOM 1963 CG LEU A 124 10.520 0.664 -16.659 1.00 0.00 C ATOM 1964 CD1 LEU A 124 9.175 1.037 -16.053 1.00 0.00 C ATOM 1965 CD2 LEU A 124 10.839 1.552 -17.853 1.00 0.00 C ATOM 0 H LEU A 124 13.508 0.591 -13.988 1.00 0.00 H new ATOM 0 HA LEU A 124 12.336 -1.258 -15.558 1.00 0.00 H new ATOM 0 HB2 LEU A 124 11.178 0.667 -14.621 1.00 0.00 H new ATOM 0 HB3 LEU A 124 12.065 1.762 -15.663 1.00 0.00 H new ATOM 0 HG LEU A 124 10.463 -0.368 -17.005 1.00 0.00 H new ATOM 0 HD11 LEU A 124 8.399 0.959 -16.814 1.00 0.00 H new ATOM 0 HD12 LEU A 124 8.946 0.359 -15.230 1.00 0.00 H new ATOM 0 HD13 LEU A 124 9.215 2.060 -15.680 1.00 0.00 H new ATOM 0 HD21 LEU A 124 10.042 1.469 -18.592 1.00 0.00 H new ATOM 0 HD22 LEU A 124 10.922 2.588 -17.524 1.00 0.00 H new ATOM 0 HD23 LEU A 124 11.782 1.236 -18.299 1.00 0.00 H new ATOM 1977 N SER A 125 12.671 -1.033 -17.999 1.00 0.00 N ATOM 1978 CA SER A 125 13.047 -1.144 -19.402 1.00 0.00 C ATOM 1979 C SER A 125 11.835 -0.917 -20.297 1.00 0.00 C ATOM 1980 O SER A 125 10.702 -1.174 -19.893 1.00 0.00 O ATOM 1981 CB SER A 125 13.663 -2.515 -19.684 1.00 0.00 C ATOM 1982 OG SER A 125 15.063 -2.414 -19.884 1.00 0.00 O ATOM 0 H SER A 125 11.888 -1.630 -17.732 1.00 0.00 H new ATOM 0 HA SER A 125 13.790 -0.377 -19.620 1.00 0.00 H new ATOM 0 HB2 SER A 125 13.459 -3.187 -18.850 1.00 0.00 H new ATOM 0 HB3 SER A 125 13.197 -2.952 -20.567 1.00 0.00 H new ATOM 0 HG SER A 125 15.433 -3.304 -20.061 1.00 0.00 H new ATOM 1988 N GLN A 126 12.073 -0.448 -21.517 1.00 0.00 N ATOM 1989 CA GLN A 126 10.983 -0.210 -22.451 1.00 0.00 C ATOM 1990 C GLN A 126 10.421 -1.542 -22.937 1.00 0.00 C ATOM 1991 O GLN A 126 11.107 -2.306 -23.616 1.00 0.00 O ATOM 1992 CB GLN A 126 11.468 0.621 -23.640 1.00 0.00 C ATOM 1993 CG GLN A 126 10.398 1.525 -24.228 1.00 0.00 C ATOM 1994 CD GLN A 126 9.170 0.757 -24.679 1.00 0.00 C ATOM 1995 OE1 GLN A 126 8.251 0.513 -23.752 1.00 0.00 O flip ATOM 1996 NE2 GLN A 126 9.049 0.387 -25.847 1.00 0.00 N flip ATOM 0 H GLN A 126 13.001 -0.228 -21.878 1.00 0.00 H new ATOM 0 HA GLN A 126 10.197 0.346 -21.940 1.00 0.00 H new ATOM 0 HB2 GLN A 126 12.314 1.231 -23.325 1.00 0.00 H new ATOM 0 HB3 GLN A 126 11.832 -0.051 -24.418 1.00 0.00 H new ATOM 0 HG2 GLN A 126 10.106 2.267 -23.485 1.00 0.00 H new ATOM 0 HG3 GLN A 126 10.813 2.070 -25.076 1.00 0.00 H new ATOM 0 HE21 GLN A 126 9.780 0.596 -26.527 1.00 0.00 H new ATOM 0 HE22 GLN A 126 8.218 -0.129 -26.135 1.00 0.00 H new ATOM 2005 N GLY A 127 9.175 -1.820 -22.569 1.00 0.00 N ATOM 2006 CA GLY A 127 8.550 -3.064 -22.959 1.00 0.00 C ATOM 2007 C GLY A 127 9.184 -4.263 -22.277 1.00 0.00 C ATOM 2008 O GLY A 127 9.165 -5.372 -22.809 1.00 0.00 O ATOM 0 H GLY A 127 8.588 -1.203 -22.007 1.00 0.00 H new ATOM 0 HA2 GLY A 127 7.489 -3.028 -22.714 1.00 0.00 H new ATOM 0 HA3 GLY A 127 8.623 -3.182 -24.040 1.00 0.00 H new ATOM 2012 N ASP A 128 9.751 -4.033 -21.093 1.00 0.00 N ATOM 2013 CA ASP A 128 10.402 -5.092 -20.329 1.00 0.00 C ATOM 2014 C ASP A 128 9.472 -6.284 -20.130 1.00 0.00 C ATOM 2015 O ASP A 128 8.255 -6.167 -20.270 1.00 0.00 O ATOM 2016 CB ASP A 128 10.865 -4.558 -18.971 1.00 0.00 C ATOM 2017 CG ASP A 128 11.473 -5.635 -18.092 1.00 0.00 C ATOM 2018 OD1 ASP A 128 10.708 -6.338 -17.400 1.00 0.00 O ATOM 2019 OD2 ASP A 128 12.714 -5.772 -18.096 1.00 0.00 O ATOM 0 H ASP A 128 9.771 -3.118 -20.642 1.00 0.00 H new ATOM 0 HA ASP A 128 11.269 -5.429 -20.897 1.00 0.00 H new ATOM 0 HB2 ASP A 128 11.598 -3.767 -19.128 1.00 0.00 H new ATOM 0 HB3 ASP A 128 10.017 -4.109 -18.454 1.00 0.00 H new ATOM 2024 N GLU A 129 10.057 -7.430 -19.803 1.00 0.00 N ATOM 2025 CA GLU A 129 9.284 -8.647 -19.586 1.00 0.00 C ATOM 2026 C GLU A 129 9.918 -9.519 -18.501 1.00 0.00 C ATOM 2027 O GLU A 129 11.129 -9.743 -18.501 1.00 0.00 O ATOM 2028 CB GLU A 129 9.176 -9.430 -20.902 1.00 0.00 C ATOM 2029 CG GLU A 129 8.631 -10.847 -20.751 1.00 0.00 C ATOM 2030 CD GLU A 129 9.525 -11.887 -21.397 1.00 0.00 C ATOM 2031 OE1 GLU A 129 9.493 -12.008 -22.639 1.00 0.00 O ATOM 2032 OE2 GLU A 129 10.257 -12.580 -20.659 1.00 0.00 O ATOM 0 H GLU A 129 11.064 -7.542 -19.682 1.00 0.00 H new ATOM 0 HA GLU A 129 8.286 -8.367 -19.247 1.00 0.00 H new ATOM 0 HB2 GLU A 129 8.533 -8.878 -21.587 1.00 0.00 H new ATOM 0 HB3 GLU A 129 10.163 -9.481 -21.362 1.00 0.00 H new ATOM 0 HG2 GLU A 129 8.518 -11.078 -19.692 1.00 0.00 H new ATOM 0 HG3 GLU A 129 7.638 -10.900 -21.197 1.00 0.00 H new ATOM 2039 N ILE A 130 9.087 -10.025 -17.592 1.00 0.00 N ATOM 2040 CA ILE A 130 9.559 -10.891 -16.521 1.00 0.00 C ATOM 2041 C ILE A 130 8.951 -12.276 -16.677 1.00 0.00 C ATOM 2042 O ILE A 130 7.737 -12.418 -16.815 1.00 0.00 O ATOM 2043 CB ILE A 130 9.199 -10.338 -15.129 1.00 0.00 C ATOM 2044 CG1 ILE A 130 9.270 -8.811 -15.121 1.00 0.00 C ATOM 2045 CG2 ILE A 130 10.114 -10.918 -14.066 1.00 0.00 C ATOM 2046 CD1 ILE A 130 8.817 -8.191 -13.819 1.00 0.00 C ATOM 0 H ILE A 130 8.083 -9.848 -17.578 1.00 0.00 H new ATOM 0 HA ILE A 130 10.645 -10.940 -16.595 1.00 0.00 H new ATOM 0 HB ILE A 130 8.176 -10.637 -14.900 1.00 0.00 H new ATOM 0 HG12 ILE A 130 10.296 -8.502 -15.323 1.00 0.00 H new ATOM 0 HG13 ILE A 130 8.654 -8.423 -15.932 1.00 0.00 H new ATOM 0 HG21 ILE A 130 9.841 -10.514 -13.091 1.00 0.00 H new ATOM 0 HG22 ILE A 130 10.011 -12.003 -14.050 1.00 0.00 H new ATOM 0 HG23 ILE A 130 11.147 -10.655 -14.292 1.00 0.00 H new ATOM 0 HD11 ILE A 130 8.895 -7.106 -13.886 1.00 0.00 H new ATOM 0 HD12 ILE A 130 7.781 -8.469 -13.624 1.00 0.00 H new ATOM 0 HD13 ILE A 130 9.448 -8.550 -13.006 1.00 0.00 H new ATOM 2058 N THR A 131 9.796 -13.292 -16.660 1.00 0.00 N ATOM 2059 CA THR A 131 9.333 -14.664 -16.806 1.00 0.00 C ATOM 2060 C THR A 131 9.320 -15.371 -15.459 1.00 0.00 C ATOM 2061 O THR A 131 10.176 -15.125 -14.612 1.00 0.00 O ATOM 2062 CB THR A 131 10.214 -15.450 -17.796 1.00 0.00 C ATOM 2063 OG1 THR A 131 10.294 -14.748 -19.042 1.00 0.00 O ATOM 2064 CG2 THR A 131 9.655 -16.842 -18.031 1.00 0.00 C ATOM 0 H THR A 131 10.805 -13.195 -16.547 1.00 0.00 H new ATOM 0 HA THR A 131 8.318 -14.627 -17.201 1.00 0.00 H new ATOM 0 HB THR A 131 11.211 -15.544 -17.365 1.00 0.00 H new ATOM 0 HG1 THR A 131 9.428 -14.792 -19.498 1.00 0.00 H new ATOM 0 HG21 THR A 131 10.294 -17.377 -18.733 1.00 0.00 H new ATOM 0 HG22 THR A 131 9.620 -17.384 -17.086 1.00 0.00 H new ATOM 0 HG23 THR A 131 8.649 -16.765 -18.443 1.00 0.00 H new ATOM 2072 N VAL A 132 8.327 -16.224 -15.248 1.00 0.00 N ATOM 2073 CA VAL A 132 8.201 -16.931 -13.982 1.00 0.00 C ATOM 2074 C VAL A 132 7.755 -18.379 -14.166 1.00 0.00 C ATOM 2075 O VAL A 132 7.160 -18.737 -15.183 1.00 0.00 O ATOM 2076 CB VAL A 132 7.208 -16.207 -13.056 1.00 0.00 C ATOM 2077 CG1 VAL A 132 7.555 -14.726 -12.964 1.00 0.00 C ATOM 2078 CG2 VAL A 132 5.776 -16.390 -13.543 1.00 0.00 C ATOM 0 H VAL A 132 7.602 -16.442 -15.932 1.00 0.00 H new ATOM 0 HA VAL A 132 9.192 -16.940 -13.529 1.00 0.00 H new ATOM 0 HB VAL A 132 7.285 -16.647 -12.062 1.00 0.00 H new ATOM 0 HG11 VAL A 132 6.844 -14.226 -12.306 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.562 -14.613 -12.564 1.00 0.00 H new ATOM 0 HG13 VAL A 132 7.507 -14.279 -13.957 1.00 0.00 H new ATOM 0 HG21 VAL A 132 5.094 -15.869 -12.871 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.679 -15.981 -14.549 1.00 0.00 H new ATOM 0 HG23 VAL A 132 5.530 -17.452 -13.558 1.00 0.00 H new ATOM 2088 N GLY A 133 8.042 -19.203 -13.161 1.00 0.00 N ATOM 2089 CA GLY A 133 7.663 -20.597 -13.204 1.00 0.00 C ATOM 2090 C GLY A 133 8.510 -21.391 -14.170 1.00 0.00 C ATOM 2091 O GLY A 133 7.997 -22.193 -14.946 1.00 0.00 O ATOM 0 H GLY A 133 8.535 -18.923 -12.313 1.00 0.00 H new ATOM 0 HA2 GLY A 133 7.754 -21.027 -12.206 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.615 -20.678 -13.492 1.00 0.00 H new ATOM 2095 N VAL A 134 9.813 -21.154 -14.130 1.00 0.00 N ATOM 2096 CA VAL A 134 10.732 -21.836 -15.015 1.00 0.00 C ATOM 2097 C VAL A 134 11.096 -23.225 -14.506 1.00 0.00 C ATOM 2098 O VAL A 134 11.037 -23.506 -13.309 1.00 0.00 O ATOM 2099 CB VAL A 134 12.006 -21.003 -15.238 1.00 0.00 C ATOM 2100 CG1 VAL A 134 13.027 -21.771 -16.068 1.00 0.00 C ATOM 2101 CG2 VAL A 134 11.642 -19.691 -15.907 1.00 0.00 C ATOM 0 H VAL A 134 10.254 -20.492 -13.491 1.00 0.00 H new ATOM 0 HA VAL A 134 10.218 -21.956 -15.969 1.00 0.00 H new ATOM 0 HB VAL A 134 12.464 -20.795 -14.271 1.00 0.00 H new ATOM 0 HG11 VAL A 134 13.917 -21.157 -16.209 1.00 0.00 H new ATOM 0 HG12 VAL A 134 13.299 -22.691 -15.550 1.00 0.00 H new ATOM 0 HG13 VAL A 134 12.597 -22.015 -17.039 1.00 0.00 H new ATOM 0 HG21 VAL A 134 12.544 -19.101 -16.065 1.00 0.00 H new ATOM 0 HG22 VAL A 134 11.167 -19.892 -16.867 1.00 0.00 H new ATOM 0 HG23 VAL A 134 10.953 -19.137 -15.270 1.00 0.00 H new ATOM 2111 N GLY A 135 11.457 -24.087 -15.445 1.00 0.00 N ATOM 2112 CA GLY A 135 11.814 -25.448 -15.134 1.00 0.00 C ATOM 2113 C GLY A 135 11.535 -26.353 -16.313 1.00 0.00 C ATOM 2114 O GLY A 135 12.352 -27.199 -16.675 1.00 0.00 O ATOM 0 H GLY A 135 11.508 -23.857 -16.437 1.00 0.00 H new ATOM 0 HA2 GLY A 135 12.870 -25.501 -14.869 1.00 0.00 H new ATOM 0 HA3 GLY A 135 11.250 -25.788 -14.266 1.00 0.00 H new ATOM 2118 N VAL A 136 10.375 -26.142 -16.924 1.00 0.00 N ATOM 2119 CA VAL A 136 9.959 -26.896 -18.085 1.00 0.00 C ATOM 2120 C VAL A 136 9.581 -25.939 -19.212 1.00 0.00 C ATOM 2121 O VAL A 136 8.861 -24.965 -18.992 1.00 0.00 O ATOM 2122 CB VAL A 136 8.766 -27.814 -17.767 1.00 0.00 C ATOM 2123 CG1 VAL A 136 8.408 -28.668 -18.975 1.00 0.00 C ATOM 2124 CG2 VAL A 136 9.072 -28.687 -16.561 1.00 0.00 C ATOM 0 H VAL A 136 9.700 -25.440 -16.622 1.00 0.00 H new ATOM 0 HA VAL A 136 10.795 -27.524 -18.394 1.00 0.00 H new ATOM 0 HB VAL A 136 7.906 -27.189 -17.527 1.00 0.00 H new ATOM 0 HG11 VAL A 136 7.562 -29.310 -18.729 1.00 0.00 H new ATOM 0 HG12 VAL A 136 8.142 -28.022 -19.811 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.263 -29.285 -19.251 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.217 -29.330 -16.351 1.00 0.00 H new ATOM 0 HG22 VAL A 136 9.946 -29.303 -16.770 1.00 0.00 H new ATOM 0 HG23 VAL A 136 9.272 -28.055 -15.696 1.00 0.00 H new ATOM 2134 N GLU A 137 10.080 -26.206 -20.412 1.00 0.00 N ATOM 2135 CA GLU A 137 9.802 -25.351 -21.562 1.00 0.00 C ATOM 2136 C GLU A 137 8.304 -25.104 -21.725 1.00 0.00 C ATOM 2137 O GLU A 137 7.886 -24.027 -22.151 1.00 0.00 O ATOM 2138 CB GLU A 137 10.364 -25.982 -22.837 1.00 0.00 C ATOM 2139 CG GLU A 137 10.196 -25.113 -24.073 1.00 0.00 C ATOM 2140 CD GLU A 137 10.823 -23.743 -23.911 1.00 0.00 C ATOM 2141 OE1 GLU A 137 11.836 -23.635 -23.189 1.00 0.00 O ATOM 2142 OE2 GLU A 137 10.301 -22.777 -24.507 1.00 0.00 O ATOM 0 H GLU A 137 10.679 -27.006 -20.616 1.00 0.00 H new ATOM 0 HA GLU A 137 10.288 -24.391 -21.387 1.00 0.00 H new ATOM 0 HB2 GLU A 137 11.424 -26.191 -22.692 1.00 0.00 H new ATOM 0 HB3 GLU A 137 9.871 -26.939 -23.006 1.00 0.00 H new ATOM 0 HG2 GLU A 137 10.645 -25.615 -24.930 1.00 0.00 H new ATOM 0 HG3 GLU A 137 9.134 -24.999 -24.291 1.00 0.00 H new ATOM 2149 N SER A 138 7.502 -26.108 -21.395 1.00 0.00 N ATOM 2150 CA SER A 138 6.058 -26.005 -21.516 1.00 0.00 C ATOM 2151 C SER A 138 5.395 -25.570 -20.208 1.00 0.00 C ATOM 2152 O SER A 138 4.167 -25.566 -20.110 1.00 0.00 O ATOM 2153 CB SER A 138 5.472 -27.342 -21.974 1.00 0.00 C ATOM 2154 OG SER A 138 4.062 -27.266 -22.091 1.00 0.00 O ATOM 0 H SER A 138 7.831 -27.006 -21.040 1.00 0.00 H new ATOM 0 HA SER A 138 5.851 -25.236 -22.260 1.00 0.00 H new ATOM 0 HB2 SER A 138 5.905 -27.623 -22.934 1.00 0.00 H new ATOM 0 HB3 SER A 138 5.740 -28.123 -21.262 1.00 0.00 H new ATOM 0 HG SER A 138 3.694 -26.802 -21.311 1.00 0.00 H new ATOM 2160 N ASP A 139 6.192 -25.219 -19.199 1.00 0.00 N ATOM 2161 CA ASP A 139 5.639 -24.809 -17.917 1.00 0.00 C ATOM 2162 C ASP A 139 6.158 -23.454 -17.465 1.00 0.00 C ATOM 2163 O ASP A 139 6.247 -23.176 -16.270 1.00 0.00 O ATOM 2164 CB ASP A 139 5.939 -25.854 -16.854 1.00 0.00 C ATOM 2165 CG ASP A 139 4.904 -25.867 -15.747 1.00 0.00 C ATOM 2166 OD1 ASP A 139 3.899 -26.596 -15.880 1.00 0.00 O ATOM 2167 OD2 ASP A 139 5.097 -25.147 -14.744 1.00 0.00 O ATOM 0 H ASP A 139 7.211 -25.211 -19.247 1.00 0.00 H new ATOM 0 HA ASP A 139 4.561 -24.718 -18.052 1.00 0.00 H new ATOM 0 HB2 ASP A 139 5.982 -26.839 -17.319 1.00 0.00 H new ATOM 0 HB3 ASP A 139 6.922 -25.660 -16.426 1.00 0.00 H new ATOM 2172 N ILE A 140 6.477 -22.617 -18.427 1.00 0.00 N ATOM 2173 CA ILE A 140 6.970 -21.279 -18.152 1.00 0.00 C ATOM 2174 C ILE A 140 5.922 -20.223 -18.480 1.00 0.00 C ATOM 2175 O ILE A 140 5.200 -20.324 -19.472 1.00 0.00 O ATOM 2176 CB ILE A 140 8.261 -20.950 -18.922 1.00 0.00 C ATOM 2177 CG1 ILE A 140 9.378 -21.924 -18.547 1.00 0.00 C ATOM 2178 CG2 ILE A 140 8.697 -19.521 -18.641 1.00 0.00 C ATOM 2179 CD1 ILE A 140 10.311 -22.245 -19.693 1.00 0.00 C ATOM 0 H ILE A 140 6.404 -22.840 -19.420 1.00 0.00 H new ATOM 0 HA ILE A 140 7.192 -21.262 -17.085 1.00 0.00 H new ATOM 0 HB ILE A 140 8.057 -21.052 -19.988 1.00 0.00 H new ATOM 0 HG12 ILE A 140 9.957 -21.501 -17.726 1.00 0.00 H new ATOM 0 HG13 ILE A 140 8.934 -22.850 -18.181 1.00 0.00 H new ATOM 0 HG21 ILE A 140 9.611 -19.304 -19.193 1.00 0.00 H new ATOM 0 HG22 ILE A 140 7.912 -18.833 -18.955 1.00 0.00 H new ATOM 0 HG23 ILE A 140 8.880 -19.400 -17.573 1.00 0.00 H new ATOM 0 HD11 ILE A 140 11.078 -22.941 -19.354 1.00 0.00 H new ATOM 0 HD12 ILE A 140 9.745 -22.697 -20.507 1.00 0.00 H new ATOM 0 HD13 ILE A 140 10.784 -21.328 -20.045 1.00 0.00 H new ATOM 2191 N LEU A 141 5.860 -19.211 -17.633 1.00 0.00 N ATOM 2192 CA LEU A 141 4.916 -18.109 -17.800 1.00 0.00 C ATOM 2193 C LEU A 141 5.661 -16.778 -17.864 1.00 0.00 C ATOM 2194 O LEU A 141 6.571 -16.529 -17.076 1.00 0.00 O ATOM 2195 CB LEU A 141 3.908 -18.094 -16.651 1.00 0.00 C ATOM 2196 CG LEU A 141 3.096 -19.383 -16.489 1.00 0.00 C ATOM 2197 CD1 LEU A 141 3.378 -20.033 -15.142 1.00 0.00 C ATOM 2198 CD2 LEU A 141 1.609 -19.102 -16.647 1.00 0.00 C ATOM 0 H LEU A 141 6.458 -19.125 -16.811 1.00 0.00 H new ATOM 0 HA LEU A 141 4.377 -18.253 -18.736 1.00 0.00 H new ATOM 0 HB2 LEU A 141 4.442 -17.899 -15.721 1.00 0.00 H new ATOM 0 HB3 LEU A 141 3.218 -17.264 -16.803 1.00 0.00 H new ATOM 0 HG LEU A 141 3.400 -20.078 -17.272 1.00 0.00 H new ATOM 0 HD11 LEU A 141 2.791 -20.947 -15.049 1.00 0.00 H new ATOM 0 HD12 LEU A 141 4.438 -20.274 -15.069 1.00 0.00 H new ATOM 0 HD13 LEU A 141 3.107 -19.344 -14.342 1.00 0.00 H new ATOM 0 HD21 LEU A 141 1.049 -20.030 -16.529 1.00 0.00 H new ATOM 0 HD22 LEU A 141 1.291 -18.387 -15.888 1.00 0.00 H new ATOM 0 HD23 LEU A 141 1.420 -18.688 -17.637 1.00 0.00 H new ATOM 2210 N SER A 142 5.282 -15.931 -18.818 1.00 0.00 N ATOM 2211 CA SER A 142 5.935 -14.636 -18.989 1.00 0.00 C ATOM 2212 C SER A 142 5.018 -13.466 -18.660 1.00 0.00 C ATOM 2213 O SER A 142 3.793 -13.553 -18.749 1.00 0.00 O ATOM 2214 CB SER A 142 6.476 -14.475 -20.397 1.00 0.00 C ATOM 2215 OG SER A 142 7.841 -14.848 -20.470 1.00 0.00 O ATOM 0 H SER A 142 4.530 -16.117 -19.481 1.00 0.00 H new ATOM 0 HA SER A 142 6.762 -14.621 -18.279 1.00 0.00 H new ATOM 0 HB2 SER A 142 5.892 -15.087 -21.085 1.00 0.00 H new ATOM 0 HB3 SER A 142 6.362 -13.439 -20.716 1.00 0.00 H new ATOM 0 HG SER A 142 8.162 -14.735 -21.389 1.00 0.00 H new ATOM 2221 N LEU A 143 5.655 -12.371 -18.290 1.00 0.00 N ATOM 2222 CA LEU A 143 4.975 -11.128 -17.943 1.00 0.00 C ATOM 2223 C LEU A 143 5.616 -9.975 -18.709 1.00 0.00 C ATOM 2224 O LEU A 143 6.824 -9.975 -18.933 1.00 0.00 O ATOM 2225 CB LEU A 143 5.071 -10.872 -16.433 1.00 0.00 C ATOM 2226 CG LEU A 143 4.510 -11.981 -15.530 1.00 0.00 C ATOM 2227 CD1 LEU A 143 3.213 -12.546 -16.093 1.00 0.00 C ATOM 2228 CD2 LEU A 143 5.540 -13.086 -15.342 1.00 0.00 C ATOM 0 H LEU A 143 6.671 -12.314 -18.220 1.00 0.00 H new ATOM 0 HA LEU A 143 3.922 -11.206 -18.214 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.119 -10.715 -16.176 1.00 0.00 H new ATOM 0 HB3 LEU A 143 4.545 -9.944 -16.207 1.00 0.00 H new ATOM 0 HG LEU A 143 4.288 -11.543 -14.557 1.00 0.00 H new ATOM 0 HD11 LEU A 143 2.840 -13.329 -15.432 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.472 -11.750 -16.168 1.00 0.00 H new ATOM 0 HD13 LEU A 143 3.397 -12.964 -17.083 1.00 0.00 H new ATOM 0 HD21 LEU A 143 5.126 -13.864 -14.700 1.00 0.00 H new ATOM 0 HD22 LEU A 143 5.796 -13.514 -16.311 1.00 0.00 H new ATOM 0 HD23 LEU A 143 6.437 -12.673 -14.880 1.00 0.00 H new ATOM 2240 N VAL A 144 4.814 -9.001 -19.129 1.00 0.00 N ATOM 2241 CA VAL A 144 5.339 -7.873 -19.889 1.00 0.00 C ATOM 2242 C VAL A 144 4.999 -6.539 -19.236 1.00 0.00 C ATOM 2243 O VAL A 144 3.903 -6.352 -18.717 1.00 0.00 O ATOM 2244 CB VAL A 144 4.797 -7.877 -21.327 1.00 0.00 C ATOM 2245 CG1 VAL A 144 5.493 -6.814 -22.162 1.00 0.00 C ATOM 2246 CG2 VAL A 144 4.963 -9.251 -21.957 1.00 0.00 C ATOM 0 H VAL A 144 3.809 -8.970 -18.958 1.00 0.00 H new ATOM 0 HA VAL A 144 6.423 -7.988 -19.905 1.00 0.00 H new ATOM 0 HB VAL A 144 3.733 -7.643 -21.295 1.00 0.00 H new ATOM 0 HG11 VAL A 144 5.097 -6.831 -23.177 1.00 0.00 H new ATOM 0 HG12 VAL A 144 5.318 -5.833 -21.721 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.564 -7.015 -22.187 1.00 0.00 H new ATOM 0 HG21 VAL A 144 4.573 -9.234 -22.975 1.00 0.00 H new ATOM 0 HG22 VAL A 144 6.020 -9.517 -21.977 1.00 0.00 H new ATOM 0 HG23 VAL A 144 4.415 -9.989 -21.371 1.00 0.00 H new ATOM 2256 N ILE A 145 5.951 -5.613 -19.272 1.00 0.00 N ATOM 2257 CA ILE A 145 5.755 -4.290 -18.694 1.00 0.00 C ATOM 2258 C ILE A 145 5.656 -3.231 -19.790 1.00 0.00 C ATOM 2259 O ILE A 145 6.475 -3.194 -20.709 1.00 0.00 O ATOM 2260 CB ILE A 145 6.899 -3.936 -17.705 1.00 0.00 C ATOM 2261 CG1 ILE A 145 6.341 -3.746 -16.292 1.00 0.00 C ATOM 2262 CG2 ILE A 145 7.660 -2.690 -18.148 1.00 0.00 C ATOM 2263 CD1 ILE A 145 7.100 -4.518 -15.235 1.00 0.00 C ATOM 0 H ILE A 145 6.868 -5.755 -19.696 1.00 0.00 H new ATOM 0 HA ILE A 145 4.817 -4.305 -18.139 1.00 0.00 H new ATOM 0 HB ILE A 145 7.602 -4.769 -17.700 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.362 -2.685 -16.041 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.296 -4.057 -16.278 1.00 0.00 H new ATOM 0 HG21 ILE A 145 8.452 -2.474 -17.431 1.00 0.00 H new ATOM 0 HG22 ILE A 145 8.097 -2.861 -19.132 1.00 0.00 H new ATOM 0 HG23 ILE A 145 6.975 -1.844 -18.198 1.00 0.00 H new ATOM 0 HD11 ILE A 145 6.650 -4.337 -14.259 1.00 0.00 H new ATOM 0 HD12 ILE A 145 7.058 -5.583 -15.462 1.00 0.00 H new ATOM 0 HD13 ILE A 145 8.140 -4.191 -15.222 1.00 0.00 H new ATOM 2275 N PHE A 146 4.648 -2.376 -19.683 1.00 0.00 N ATOM 2276 CA PHE A 146 4.436 -1.315 -20.659 1.00 0.00 C ATOM 2277 C PHE A 146 4.541 0.053 -19.998 1.00 0.00 C ATOM 2278 O PHE A 146 3.853 0.335 -19.017 1.00 0.00 O ATOM 2279 CB PHE A 146 3.068 -1.470 -21.327 1.00 0.00 C ATOM 2280 CG PHE A 146 2.953 -0.741 -22.635 1.00 0.00 C ATOM 2281 CD1 PHE A 146 3.928 -0.883 -23.609 1.00 0.00 C ATOM 2282 CD2 PHE A 146 1.872 0.088 -22.889 1.00 0.00 C ATOM 2283 CE1 PHE A 146 3.826 -0.213 -24.813 1.00 0.00 C ATOM 2284 CE2 PHE A 146 1.765 0.760 -24.092 1.00 0.00 C ATOM 2285 CZ PHE A 146 2.743 0.609 -25.055 1.00 0.00 C ATOM 0 H PHE A 146 3.962 -2.396 -18.928 1.00 0.00 H new ATOM 0 HA PHE A 146 5.212 -1.394 -21.421 1.00 0.00 H new ATOM 0 HB2 PHE A 146 2.871 -2.529 -21.492 1.00 0.00 H new ATOM 0 HB3 PHE A 146 2.298 -1.105 -20.648 1.00 0.00 H new ATOM 0 HD1 PHE A 146 4.777 -1.525 -23.425 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.105 0.210 -22.139 1.00 0.00 H new ATOM 0 HE1 PHE A 146 4.593 -0.332 -25.564 1.00 0.00 H new ATOM 0 HE2 PHE A 146 0.917 1.403 -24.279 1.00 0.00 H new ATOM 0 HZ PHE A 146 2.661 1.133 -25.996 1.00 0.00 H new ATOM 2295 N ILE A 147 5.411 0.898 -20.538 1.00 0.00 N ATOM 2296 CA ILE A 147 5.613 2.234 -19.997 1.00 0.00 C ATOM 2297 C ILE A 147 5.059 3.303 -20.930 1.00 0.00 C ATOM 2298 O ILE A 147 5.294 3.271 -22.138 1.00 0.00 O ATOM 2299 CB ILE A 147 7.096 2.512 -19.746 1.00 0.00 C ATOM 2300 CG1 ILE A 147 7.724 1.363 -18.956 1.00 0.00 C ATOM 2301 CG2 ILE A 147 7.279 3.834 -19.014 1.00 0.00 C ATOM 2302 CD1 ILE A 147 8.404 0.331 -19.828 1.00 0.00 C ATOM 0 H ILE A 147 5.988 0.680 -21.351 1.00 0.00 H new ATOM 0 HA ILE A 147 5.074 2.274 -19.050 1.00 0.00 H new ATOM 0 HB ILE A 147 7.603 2.587 -20.708 1.00 0.00 H new ATOM 0 HG12 ILE A 147 8.452 1.770 -18.254 1.00 0.00 H new ATOM 0 HG13 ILE A 147 6.950 0.874 -18.364 1.00 0.00 H new ATOM 0 HG21 ILE A 147 8.341 4.013 -18.845 1.00 0.00 H new ATOM 0 HG22 ILE A 147 6.866 4.643 -19.616 1.00 0.00 H new ATOM 0 HG23 ILE A 147 6.761 3.794 -18.056 1.00 0.00 H new ATOM 0 HD11 ILE A 147 8.827 -0.454 -19.201 1.00 0.00 H new ATOM 0 HD12 ILE A 147 7.676 -0.104 -20.512 1.00 0.00 H new ATOM 0 HD13 ILE A 147 9.201 0.806 -20.400 1.00 0.00 H new ATOM 2314 N ASN A 148 4.324 4.249 -20.359 1.00 0.00 N ATOM 2315 CA ASN A 148 3.736 5.331 -21.138 1.00 0.00 C ATOM 2316 C ASN A 148 4.776 6.398 -21.461 1.00 0.00 C ATOM 2317 O ASN A 148 5.331 7.031 -20.564 1.00 0.00 O ATOM 2318 CB ASN A 148 2.567 5.954 -20.375 1.00 0.00 C ATOM 2319 CG ASN A 148 1.365 5.035 -20.314 1.00 0.00 C ATOM 2320 OD1 ASN A 148 1.505 3.815 -20.221 1.00 0.00 O ATOM 2321 ND2 ASN A 148 0.175 5.618 -20.368 1.00 0.00 N ATOM 0 H ASN A 148 4.121 4.289 -19.360 1.00 0.00 H new ATOM 0 HA ASN A 148 3.370 4.914 -22.076 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.886 6.198 -19.362 1.00 0.00 H new ATOM 0 HB3 ASN A 148 2.281 6.891 -20.854 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -0.673 5.052 -20.333 1.00 0.00 H new ATOM 0 HD22 ASN A 148 0.107 6.633 -20.445 1.00 0.00 H new ATOM 2328 N ASP A 149 5.032 6.594 -22.751 1.00 0.00 N ATOM 2329 CA ASP A 149 6.004 7.586 -23.195 1.00 0.00 C ATOM 2330 C ASP A 149 5.544 8.997 -22.841 1.00 0.00 C ATOM 2331 O ASP A 149 6.363 9.897 -22.653 1.00 0.00 O ATOM 2332 CB ASP A 149 6.226 7.474 -24.703 1.00 0.00 C ATOM 2333 CG ASP A 149 6.751 6.111 -25.111 1.00 0.00 C ATOM 2334 OD1 ASP A 149 7.961 5.861 -24.927 1.00 0.00 O ATOM 2335 OD2 ASP A 149 5.952 5.293 -25.614 1.00 0.00 O ATOM 0 H ASP A 149 4.580 6.079 -23.506 1.00 0.00 H new ATOM 0 HA ASP A 149 6.945 7.390 -22.680 1.00 0.00 H new ATOM 0 HB2 ASP A 149 5.287 7.668 -25.221 1.00 0.00 H new ATOM 0 HB3 ASP A 149 6.931 8.242 -25.022 1.00 0.00 H new ATOM 2340 N LYS A 150 4.230 9.185 -22.751 1.00 0.00 N ATOM 2341 CA LYS A 150 3.667 10.483 -22.419 1.00 0.00 C ATOM 2342 C LYS A 150 4.161 10.951 -21.056 1.00 0.00 C ATOM 2343 O LYS A 150 4.567 12.101 -20.888 1.00 0.00 O ATOM 2344 CB LYS A 150 2.137 10.420 -22.435 1.00 0.00 C ATOM 2345 CG LYS A 150 1.501 11.335 -23.470 1.00 0.00 C ATOM 2346 CD LYS A 150 0.983 12.619 -22.838 1.00 0.00 C ATOM 2347 CE LYS A 150 1.520 13.852 -23.548 1.00 0.00 C ATOM 2348 NZ LYS A 150 0.482 14.504 -24.393 1.00 0.00 N ATOM 0 H LYS A 150 3.538 8.452 -22.904 1.00 0.00 H new ATOM 0 HA LYS A 150 3.996 11.201 -23.170 1.00 0.00 H new ATOM 0 HB2 LYS A 150 1.826 9.394 -22.630 1.00 0.00 H new ATOM 0 HB3 LYS A 150 1.760 10.685 -21.447 1.00 0.00 H new ATOM 0 HG2 LYS A 150 2.232 11.577 -24.241 1.00 0.00 H new ATOM 0 HG3 LYS A 150 0.680 10.814 -23.962 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -0.107 12.626 -22.870 1.00 0.00 H new ATOM 0 HD3 LYS A 150 1.271 12.650 -21.787 1.00 0.00 H new ATOM 0 HE2 LYS A 150 1.887 14.565 -22.810 1.00 0.00 H new ATOM 0 HE3 LYS A 150 2.370 13.571 -24.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 0.889 15.340 -24.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 0.150 13.833 -25.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -0.318 14.796 -23.796 1.00 0.00 H new ATOM 2362 N PHE A 151 4.124 10.045 -20.084 1.00 0.00 N ATOM 2363 CA PHE A 151 4.568 10.355 -18.732 1.00 0.00 C ATOM 2364 C PHE A 151 6.017 10.831 -18.728 1.00 0.00 C ATOM 2365 O PHE A 151 6.360 11.808 -18.063 1.00 0.00 O ATOM 2366 CB PHE A 151 4.424 9.126 -17.834 1.00 0.00 C ATOM 2367 CG PHE A 151 4.533 9.436 -16.368 1.00 0.00 C ATOM 2368 CD1 PHE A 151 5.754 9.778 -15.810 1.00 0.00 C ATOM 2369 CD2 PHE A 151 3.416 9.385 -15.550 1.00 0.00 C ATOM 2370 CE1 PHE A 151 5.859 10.065 -14.462 1.00 0.00 C ATOM 2371 CE2 PHE A 151 3.515 9.671 -14.201 1.00 0.00 C ATOM 2372 CZ PHE A 151 4.737 10.010 -13.656 1.00 0.00 C ATOM 0 H PHE A 151 3.790 9.089 -20.209 1.00 0.00 H new ATOM 0 HA PHE A 151 3.940 11.158 -18.346 1.00 0.00 H new ATOM 0 HB2 PHE A 151 3.459 8.657 -18.027 1.00 0.00 H new ATOM 0 HB3 PHE A 151 5.191 8.399 -18.101 1.00 0.00 H new ATOM 0 HD1 PHE A 151 6.634 9.821 -16.435 1.00 0.00 H new ATOM 0 HD2 PHE A 151 2.458 9.119 -15.971 1.00 0.00 H new ATOM 0 HE1 PHE A 151 6.816 10.332 -14.039 1.00 0.00 H new ATOM 0 HE2 PHE A 151 2.637 9.629 -13.574 1.00 0.00 H new ATOM 0 HZ PHE A 151 4.817 10.232 -12.602 1.00 0.00 H new