USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 911 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 129 TYR OH : rot 165:sc= 0.89 USER MOD Set 1.2: A 137 LYS NZ :NH3+ 145:sc= 0.868 (180deg=-2.22!) USER MOD Set 2.1: A 83 ASN : amide:sc= -5.13! C(o=-6.8!,f=-11!) USER MOD Set 2.2: A 118 ASN : amide:sc= -1.7! C(o=-6.8!,f=-21!) USER MOD Set 3.1: A 65 ASN : amide:sc= -3.03! C(o=-4.4!,f=-5.7!) USER MOD Set 3.2: A 66 HIS :FLIP no HD1:sc= -2.47 F(o=-7.7,f=-4.4) USER MOD Set 3.3: A 67 SER OG : rot -116:sc= 1.11 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 30 MET CE :methyl -154:sc= -0.312 (180deg=-1.39!) USER MOD Single : A 35 LYS NZ :NH3+ -141:sc=-0.00515 (180deg=-0.672) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 22:sc= 0.102 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl 131:sc= -3.73! (180deg=-5.41!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 178:sc= -5.47! (180deg=-5.8!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot -140:sc= -1.37 USER MOD Single : A 64 SER OG : rot -83:sc= -0.52! USER MOD Single : A 85 LYS NZ :NH3+ -152:sc= -0.0647 (180deg=-0.405) USER MOD Single : A 87 SER OG : rot 180:sc= 0.0211 USER MOD Single : A 88 LYS NZ :NH3+ 156:sc= -6.55! (180deg=-7.87!) USER MOD Single : A 90 ASN : amide:sc= -4.6! C(o=-4.6!,f=-9.2!) USER MOD Single : A 97 ASN :FLIP amide:sc= -8.07! C(o=-9.1!,f=-8.1!) USER MOD Single : A 98 LYS NZ :NH3+ 150:sc= -2.46! (180deg=-3.82!) USER MOD Single : A 101 LYS NZ :NH3+ 159:sc= -0.0937 (180deg=-0.709) USER MOD Single : A 105 LYS NZ :NH3+ 141:sc= -7.5! (180deg=-9.34!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 TYR OH : rot 176:sc= -7.12! USER MOD Single : A 120 THR OG1 : rot -138:sc= -3.74! USER MOD Single : A 121 ASN : amide:sc= -3.94! C(o=-3.9!,f=-4.9!) USER MOD Single : A 124 HIS : no HD1:sc= -0.0588 X(o=-0.059,f=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 CYS SG : rot 180:sc= -5.65! USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 165:sc= -0.982 (180deg=-1.57) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 409 N ARG A 24 17.318 1.949 0.365 1.00 0.00 N ATOM 410 CA ARG A 24 17.699 0.571 0.075 1.00 0.00 C ATOM 411 C ARG A 24 19.190 0.374 0.326 1.00 0.00 C ATOM 412 O ARG A 24 19.612 -0.661 0.844 1.00 0.00 O ATOM 413 CB ARG A 24 17.381 0.236 -1.384 1.00 0.00 C ATOM 414 CG ARG A 24 17.702 -1.236 -1.651 1.00 0.00 C ATOM 415 CD ARG A 24 16.529 -2.108 -1.198 1.00 0.00 C ATOM 416 NE ARG A 24 16.585 -2.327 0.243 1.00 0.00 N ATOM 417 CZ ARG A 24 15.627 -3.001 0.872 1.00 0.00 C ATOM 418 NH1 ARG A 24 14.615 -3.477 0.200 1.00 0.00 N ATOM 419 NH2 ARG A 24 15.698 -3.186 2.162 1.00 0.00 N ATOM 0 HA ARG A 24 17.134 -0.092 0.730 1.00 0.00 H new ATOM 0 HB2 ARG A 24 16.330 0.434 -1.593 1.00 0.00 H new ATOM 0 HB3 ARG A 24 17.963 0.873 -2.050 1.00 0.00 H new ATOM 0 HG2 ARG A 24 17.894 -1.390 -2.713 1.00 0.00 H new ATOM 0 HG3 ARG A 24 18.609 -1.523 -1.118 1.00 0.00 H new ATOM 0 HD2 ARG A 24 15.587 -1.628 -1.463 1.00 0.00 H new ATOM 0 HD3 ARG A 24 16.557 -3.065 -1.719 1.00 0.00 H new ATOM 0 HE ARG A 24 17.372 -1.957 0.777 1.00 0.00 H new ATOM 0 HH11 ARG A 24 14.559 -3.332 -0.808 1.00 0.00 H new ATOM 0 HH12 ARG A 24 13.880 -3.994 0.683 1.00 0.00 H new ATOM 0 HH21 ARG A 24 16.489 -2.813 2.688 1.00 0.00 H new ATOM 0 HH22 ARG A 24 14.963 -3.703 2.644 1.00 0.00 H new ATOM 433 N GLU A 25 19.984 1.372 -0.048 1.00 0.00 N ATOM 434 CA GLU A 25 21.428 1.297 0.134 1.00 0.00 C ATOM 435 C GLU A 25 21.775 1.131 1.611 1.00 0.00 C ATOM 436 O GLU A 25 22.650 0.339 1.964 1.00 0.00 O ATOM 437 CB GLU A 25 22.089 2.567 -0.405 1.00 0.00 C ATOM 438 CG GLU A 25 23.604 2.479 -0.208 1.00 0.00 C ATOM 439 CD GLU A 25 24.167 1.310 -1.009 1.00 0.00 C ATOM 440 OE1 GLU A 25 23.495 0.868 -1.926 1.00 0.00 O ATOM 441 OE2 GLU A 25 25.262 0.874 -0.693 1.00 0.00 O ATOM 0 H GLU A 25 19.654 2.237 -0.476 1.00 0.00 H new ATOM 0 HA GLU A 25 21.799 0.432 -0.415 1.00 0.00 H new ATOM 0 HB2 GLU A 25 21.856 2.690 -1.463 1.00 0.00 H new ATOM 0 HB3 GLU A 25 21.695 3.442 0.112 1.00 0.00 H new ATOM 0 HG2 GLU A 25 24.075 3.409 -0.526 1.00 0.00 H new ATOM 0 HG3 GLU A 25 23.835 2.351 0.850 1.00 0.00 H new ATOM 448 N TYR A 26 21.086 1.874 2.473 1.00 0.00 N ATOM 449 CA TYR A 26 21.342 1.781 3.906 1.00 0.00 C ATOM 450 C TYR A 26 21.029 0.376 4.407 1.00 0.00 C ATOM 451 O TYR A 26 21.767 -0.184 5.219 1.00 0.00 O ATOM 452 CB TYR A 26 20.478 2.793 4.664 1.00 0.00 C ATOM 453 CG TYR A 26 20.992 4.190 4.417 1.00 0.00 C ATOM 454 CD1 TYR A 26 20.495 4.941 3.345 1.00 0.00 C ATOM 455 CD2 TYR A 26 21.963 4.739 5.264 1.00 0.00 C ATOM 456 CE1 TYR A 26 20.969 6.238 3.119 1.00 0.00 C ATOM 457 CE2 TYR A 26 22.438 6.035 5.038 1.00 0.00 C ATOM 458 CZ TYR A 26 21.941 6.786 3.965 1.00 0.00 C ATOM 459 OH TYR A 26 22.408 8.065 3.743 1.00 0.00 O ATOM 0 H TYR A 26 20.357 2.537 2.209 1.00 0.00 H new ATOM 0 HA TYR A 26 22.395 2.001 4.083 1.00 0.00 H new ATOM 0 HB2 TYR A 26 19.440 2.715 4.339 1.00 0.00 H new ATOM 0 HB3 TYR A 26 20.495 2.573 5.731 1.00 0.00 H new ATOM 0 HD1 TYR A 26 19.745 4.519 2.692 1.00 0.00 H new ATOM 0 HD2 TYR A 26 22.345 4.161 6.092 1.00 0.00 H new ATOM 0 HE1 TYR A 26 20.585 6.817 2.292 1.00 0.00 H new ATOM 0 HE2 TYR A 26 23.188 6.457 5.691 1.00 0.00 H new ATOM 0 HH TYR A 26 23.078 8.291 4.422 1.00 0.00 H new ATOM 469 N ALA A 27 19.934 -0.192 3.913 1.00 0.00 N ATOM 470 CA ALA A 27 19.536 -1.537 4.310 1.00 0.00 C ATOM 471 C ALA A 27 20.598 -2.550 3.898 1.00 0.00 C ATOM 472 O ALA A 27 20.913 -3.476 4.645 1.00 0.00 O ATOM 473 CB ALA A 27 18.201 -1.900 3.662 1.00 0.00 C ATOM 0 H ALA A 27 19.310 0.255 3.241 1.00 0.00 H new ATOM 0 HA ALA A 27 19.428 -1.560 5.394 1.00 0.00 H new ATOM 0 HB1 ALA A 27 17.912 -2.906 3.964 1.00 0.00 H new ATOM 0 HB2 ALA A 27 17.437 -1.191 3.981 1.00 0.00 H new ATOM 0 HB3 ALA A 27 18.301 -1.862 2.577 1.00 0.00 H new ATOM 479 N GLN A 28 21.146 -2.366 2.700 1.00 0.00 N ATOM 480 CA GLN A 28 22.172 -3.268 2.192 1.00 0.00 C ATOM 481 C GLN A 28 23.406 -3.227 3.086 1.00 0.00 C ATOM 482 O GLN A 28 24.012 -4.260 3.375 1.00 0.00 O ATOM 483 CB GLN A 28 22.557 -2.869 0.766 1.00 0.00 C ATOM 484 CG GLN A 28 23.556 -3.881 0.204 1.00 0.00 C ATOM 485 CD GLN A 28 23.897 -3.531 -1.240 1.00 0.00 C ATOM 486 OE1 GLN A 28 23.336 -2.589 -1.801 1.00 0.00 O ATOM 487 NE2 GLN A 28 24.789 -4.236 -1.880 1.00 0.00 N ATOM 0 H GLN A 28 20.898 -1.605 2.067 1.00 0.00 H new ATOM 0 HA GLN A 28 21.772 -4.282 2.189 1.00 0.00 H new ATOM 0 HB2 GLN A 28 21.669 -2.831 0.136 1.00 0.00 H new ATOM 0 HB3 GLN A 28 22.994 -1.870 0.762 1.00 0.00 H new ATOM 0 HG2 GLN A 28 24.462 -3.884 0.810 1.00 0.00 H new ATOM 0 HG3 GLN A 28 23.136 -4.885 0.254 1.00 0.00 H new ATOM 0 HE21 GLN A 28 25.253 -5.016 -1.414 1.00 0.00 H new ATOM 0 HE22 GLN A 28 25.023 -4.007 -2.846 1.00 0.00 H new ATOM 496 N GLU A 29 23.772 -2.028 3.523 1.00 0.00 N ATOM 497 CA GLU A 29 24.934 -1.860 4.386 1.00 0.00 C ATOM 498 C GLU A 29 24.728 -2.588 5.710 1.00 0.00 C ATOM 499 O GLU A 29 25.657 -3.191 6.248 1.00 0.00 O ATOM 500 CB GLU A 29 25.180 -0.374 4.655 1.00 0.00 C ATOM 501 CG GLU A 29 25.669 0.302 3.374 1.00 0.00 C ATOM 502 CD GLU A 29 26.954 -0.361 2.891 1.00 0.00 C ATOM 503 OE1 GLU A 29 27.851 -0.528 3.700 1.00 0.00 O ATOM 504 OE2 GLU A 29 27.021 -0.694 1.720 1.00 0.00 O ATOM 0 H GLU A 29 23.284 -1.162 3.295 1.00 0.00 H new ATOM 0 HA GLU A 29 25.800 -2.285 3.879 1.00 0.00 H new ATOM 0 HB2 GLU A 29 24.262 0.101 5.002 1.00 0.00 H new ATOM 0 HB3 GLU A 29 25.919 -0.254 5.447 1.00 0.00 H new ATOM 0 HG2 GLU A 29 24.903 0.234 2.602 1.00 0.00 H new ATOM 0 HG3 GLU A 29 25.844 1.362 3.557 1.00 0.00 H new ATOM 511 N MET A 30 23.508 -2.526 6.232 1.00 0.00 N ATOM 512 CA MET A 30 23.200 -3.182 7.495 1.00 0.00 C ATOM 513 C MET A 30 23.401 -4.689 7.377 1.00 0.00 C ATOM 514 O MET A 30 23.940 -5.323 8.284 1.00 0.00 O ATOM 515 CB MET A 30 21.755 -2.886 7.900 1.00 0.00 C ATOM 516 CG MET A 30 21.622 -1.410 8.276 1.00 0.00 C ATOM 517 SD MET A 30 22.770 -1.025 9.623 1.00 0.00 S ATOM 518 CE MET A 30 22.022 -2.099 10.873 1.00 0.00 C ATOM 0 H MET A 30 22.724 -2.033 5.804 1.00 0.00 H new ATOM 0 HA MET A 30 23.875 -2.796 8.258 1.00 0.00 H new ATOM 0 HB2 MET A 30 21.080 -3.125 7.078 1.00 0.00 H new ATOM 0 HB3 MET A 30 21.467 -3.514 8.743 1.00 0.00 H new ATOM 0 HG2 MET A 30 21.836 -0.782 7.411 1.00 0.00 H new ATOM 0 HG3 MET A 30 20.599 -1.192 8.582 1.00 0.00 H new ATOM 0 HE1 MET A 30 22.243 -1.709 11.867 1.00 0.00 H new ATOM 0 HE2 MET A 30 20.942 -2.130 10.727 1.00 0.00 H new ATOM 0 HE3 MET A 30 22.430 -3.105 10.779 1.00 0.00 H new ATOM 528 N ASP A 31 22.974 -5.257 6.253 1.00 0.00 N ATOM 529 CA ASP A 31 23.129 -6.691 6.038 1.00 0.00 C ATOM 530 C ASP A 31 24.608 -7.058 6.025 1.00 0.00 C ATOM 531 O ASP A 31 25.015 -8.067 6.601 1.00 0.00 O ATOM 532 CB ASP A 31 22.486 -7.095 4.710 1.00 0.00 C ATOM 533 CG ASP A 31 20.967 -7.017 4.822 1.00 0.00 C ATOM 534 OD1 ASP A 31 20.480 -6.913 5.936 1.00 0.00 O ATOM 535 OD2 ASP A 31 20.314 -7.065 3.793 1.00 0.00 O ATOM 0 H ASP A 31 22.524 -4.755 5.488 1.00 0.00 H new ATOM 0 HA ASP A 31 22.635 -7.224 6.850 1.00 0.00 H new ATOM 0 HB2 ASP A 31 22.834 -6.438 3.913 1.00 0.00 H new ATOM 0 HB3 ASP A 31 22.788 -8.108 4.443 1.00 0.00 H new ATOM 540 N ARG A 32 25.407 -6.221 5.371 1.00 0.00 N ATOM 541 CA ARG A 32 26.846 -6.449 5.296 1.00 0.00 C ATOM 542 C ARG A 32 27.464 -6.382 6.687 1.00 0.00 C ATOM 543 O ARG A 32 28.325 -7.189 7.038 1.00 0.00 O ATOM 544 CB ARG A 32 27.495 -5.400 4.392 1.00 0.00 C ATOM 545 CG ARG A 32 28.998 -5.669 4.294 1.00 0.00 C ATOM 546 CD ARG A 32 29.636 -4.659 3.338 1.00 0.00 C ATOM 547 NE ARG A 32 31.070 -4.902 3.231 1.00 0.00 N ATOM 548 CZ ARG A 32 31.919 -4.407 4.125 1.00 0.00 C ATOM 549 NH1 ARG A 32 31.473 -3.692 5.121 1.00 0.00 N ATOM 550 NH2 ARG A 32 33.198 -4.636 4.009 1.00 0.00 N ATOM 0 H ARG A 32 25.085 -5.383 4.888 1.00 0.00 H new ATOM 0 HA ARG A 32 27.021 -7.440 4.878 1.00 0.00 H new ATOM 0 HB2 ARG A 32 27.044 -5.430 3.400 1.00 0.00 H new ATOM 0 HB3 ARG A 32 27.319 -4.401 4.792 1.00 0.00 H new ATOM 0 HG2 ARG A 32 29.457 -5.593 5.280 1.00 0.00 H new ATOM 0 HG3 ARG A 32 29.174 -6.684 3.938 1.00 0.00 H new ATOM 0 HD2 ARG A 32 29.173 -4.736 2.354 1.00 0.00 H new ATOM 0 HD3 ARG A 32 29.457 -3.645 3.696 1.00 0.00 H new ATOM 0 HE ARG A 32 31.427 -5.462 2.457 1.00 0.00 H new ATOM 0 HH11 ARG A 32 30.473 -3.513 5.213 1.00 0.00 H new ATOM 0 HH12 ARG A 32 32.124 -3.312 5.808 1.00 0.00 H new ATOM 0 HH21 ARG A 32 33.547 -5.196 3.231 1.00 0.00 H new ATOM 0 HH22 ARG A 32 33.849 -4.255 4.696 1.00 0.00 H new ATOM 564 N LEU A 33 27.018 -5.406 7.471 1.00 0.00 N ATOM 565 CA LEU A 33 27.530 -5.224 8.823 1.00 0.00 C ATOM 566 C LEU A 33 27.249 -6.462 9.669 1.00 0.00 C ATOM 567 O LEU A 33 28.119 -6.938 10.399 1.00 0.00 O ATOM 568 CB LEU A 33 26.867 -4.006 9.467 1.00 0.00 C ATOM 569 CG LEU A 33 27.418 -3.814 10.878 1.00 0.00 C ATOM 570 CD1 LEU A 33 28.923 -3.551 10.798 1.00 0.00 C ATOM 571 CD2 LEU A 33 26.727 -2.618 11.537 1.00 0.00 C ATOM 0 H LEU A 33 26.305 -4.731 7.194 1.00 0.00 H new ATOM 0 HA LEU A 33 28.608 -5.069 8.770 1.00 0.00 H new ATOM 0 HB2 LEU A 33 27.056 -3.116 8.867 1.00 0.00 H new ATOM 0 HB3 LEU A 33 25.786 -4.143 9.502 1.00 0.00 H new ATOM 0 HG LEU A 33 27.232 -4.711 11.469 1.00 0.00 H new ATOM 0 HD11 LEU A 33 29.322 -3.413 11.803 1.00 0.00 H new ATOM 0 HD12 LEU A 33 29.416 -4.400 10.325 1.00 0.00 H new ATOM 0 HD13 LEU A 33 29.104 -2.652 10.209 1.00 0.00 H new ATOM 0 HD21 LEU A 33 27.120 -2.480 12.544 1.00 0.00 H new ATOM 0 HD22 LEU A 33 26.915 -1.720 10.949 1.00 0.00 H new ATOM 0 HD23 LEU A 33 25.654 -2.801 11.588 1.00 0.00 H new ATOM 583 N GLU A 34 26.032 -6.981 9.559 1.00 0.00 N ATOM 584 CA GLU A 34 25.644 -8.168 10.312 1.00 0.00 C ATOM 585 C GLU A 34 26.516 -9.354 9.916 1.00 0.00 C ATOM 586 O GLU A 34 26.931 -10.145 10.763 1.00 0.00 O ATOM 587 CB GLU A 34 24.174 -8.499 10.046 1.00 0.00 C ATOM 588 CG GLU A 34 23.777 -9.742 10.844 1.00 0.00 C ATOM 589 CD GLU A 34 23.903 -9.464 12.338 1.00 0.00 C ATOM 590 OE1 GLU A 34 23.917 -8.301 12.704 1.00 0.00 O ATOM 591 OE2 GLU A 34 23.983 -10.419 13.094 1.00 0.00 O ATOM 0 H GLU A 34 25.300 -6.601 8.959 1.00 0.00 H new ATOM 0 HA GLU A 34 25.781 -7.966 11.374 1.00 0.00 H new ATOM 0 HB2 GLU A 34 23.544 -7.656 10.329 1.00 0.00 H new ATOM 0 HB3 GLU A 34 24.016 -8.672 8.981 1.00 0.00 H new ATOM 0 HG2 GLU A 34 22.753 -10.027 10.604 1.00 0.00 H new ATOM 0 HG3 GLU A 34 24.415 -10.581 10.567 1.00 0.00 H new ATOM 598 N LYS A 35 26.786 -9.469 8.621 1.00 0.00 N ATOM 599 CA LYS A 35 27.607 -10.561 8.111 1.00 0.00 C ATOM 600 C LYS A 35 29.002 -10.521 8.728 1.00 0.00 C ATOM 601 O LYS A 35 29.559 -11.556 9.091 1.00 0.00 O ATOM 602 CB LYS A 35 27.718 -10.463 6.590 1.00 0.00 C ATOM 603 CG LYS A 35 28.547 -11.635 6.060 1.00 0.00 C ATOM 604 CD LYS A 35 28.479 -11.661 4.533 1.00 0.00 C ATOM 605 CE LYS A 35 29.688 -10.924 3.954 1.00 0.00 C ATOM 606 NZ LYS A 35 29.369 -9.474 3.828 1.00 0.00 N ATOM 0 H LYS A 35 26.450 -8.822 7.907 1.00 0.00 H new ATOM 0 HA LYS A 35 27.131 -11.503 8.382 1.00 0.00 H new ATOM 0 HB2 LYS A 35 26.725 -10.474 6.141 1.00 0.00 H new ATOM 0 HB3 LYS A 35 28.184 -9.518 6.309 1.00 0.00 H new ATOM 0 HG2 LYS A 35 29.582 -11.538 6.387 1.00 0.00 H new ATOM 0 HG3 LYS A 35 28.171 -12.573 6.467 1.00 0.00 H new ATOM 0 HD2 LYS A 35 28.463 -12.691 4.177 1.00 0.00 H new ATOM 0 HD3 LYS A 35 27.556 -11.192 4.192 1.00 0.00 H new ATOM 0 HE2 LYS A 35 30.555 -11.062 4.599 1.00 0.00 H new ATOM 0 HE3 LYS A 35 29.947 -11.337 2.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 29.776 -9.104 2.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 28.337 -9.346 3.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 29.771 -8.959 4.637 1.00 0.00 H new ATOM 620 N ALA A 36 29.565 -9.321 8.840 1.00 0.00 N ATOM 621 CA ALA A 36 30.898 -9.169 9.411 1.00 0.00 C ATOM 622 C ALA A 36 30.930 -9.680 10.848 1.00 0.00 C ATOM 623 O ALA A 36 31.882 -10.343 11.256 1.00 0.00 O ATOM 624 CB ALA A 36 31.313 -7.697 9.382 1.00 0.00 C ATOM 0 H ALA A 36 29.124 -8.449 8.546 1.00 0.00 H new ATOM 0 HA ALA A 36 31.596 -9.756 8.814 1.00 0.00 H new ATOM 0 HB1 ALA A 36 32.310 -7.591 9.810 1.00 0.00 H new ATOM 0 HB2 ALA A 36 31.321 -7.342 8.352 1.00 0.00 H new ATOM 0 HB3 ALA A 36 30.604 -7.108 9.964 1.00 0.00 H new ATOM 630 N PHE A 37 29.880 -9.378 11.605 1.00 0.00 N ATOM 631 CA PHE A 37 29.796 -9.823 12.994 1.00 0.00 C ATOM 632 C PHE A 37 29.647 -11.338 13.070 1.00 0.00 C ATOM 633 O PHE A 37 30.167 -11.976 13.986 1.00 0.00 O ATOM 634 CB PHE A 37 28.617 -9.151 13.696 1.00 0.00 C ATOM 635 CG PHE A 37 29.018 -7.761 14.124 1.00 0.00 C ATOM 636 CD1 PHE A 37 28.801 -6.670 13.274 1.00 0.00 C ATOM 637 CD2 PHE A 37 29.611 -7.565 15.377 1.00 0.00 C ATOM 638 CE1 PHE A 37 29.176 -5.383 13.679 1.00 0.00 C ATOM 639 CE2 PHE A 37 29.986 -6.279 15.781 1.00 0.00 C ATOM 640 CZ PHE A 37 29.768 -5.188 14.933 1.00 0.00 C ATOM 0 H PHE A 37 29.081 -8.831 11.285 1.00 0.00 H new ATOM 0 HA PHE A 37 30.721 -9.539 13.497 1.00 0.00 H new ATOM 0 HB2 PHE A 37 27.759 -9.104 13.026 1.00 0.00 H new ATOM 0 HB3 PHE A 37 28.313 -9.737 14.563 1.00 0.00 H new ATOM 0 HD1 PHE A 37 28.345 -6.821 12.307 1.00 0.00 H new ATOM 0 HD2 PHE A 37 29.779 -8.407 16.032 1.00 0.00 H new ATOM 0 HE1 PHE A 37 29.009 -4.541 13.024 1.00 0.00 H new ATOM 0 HE2 PHE A 37 30.444 -6.129 16.748 1.00 0.00 H new ATOM 0 HZ PHE A 37 30.056 -4.195 15.245 1.00 0.00 H new ATOM 650 N GLU A 38 28.938 -11.911 12.105 1.00 0.00 N ATOM 651 CA GLU A 38 28.731 -13.353 12.078 1.00 0.00 C ATOM 652 C GLU A 38 30.070 -14.076 11.989 1.00 0.00 C ATOM 653 O GLU A 38 30.284 -15.092 12.650 1.00 0.00 O ATOM 654 CB GLU A 38 27.859 -13.735 10.880 1.00 0.00 C ATOM 655 CG GLU A 38 27.609 -15.244 10.889 1.00 0.00 C ATOM 656 CD GLU A 38 26.704 -15.630 9.725 1.00 0.00 C ATOM 657 OE1 GLU A 38 26.316 -14.742 8.982 1.00 0.00 O ATOM 658 OE2 GLU A 38 26.409 -16.807 9.592 1.00 0.00 O ATOM 0 H GLU A 38 28.500 -11.404 11.336 1.00 0.00 H new ATOM 0 HA GLU A 38 28.227 -13.650 12.998 1.00 0.00 H new ATOM 0 HB2 GLU A 38 26.911 -13.199 10.921 1.00 0.00 H new ATOM 0 HB3 GLU A 38 28.350 -13.443 9.952 1.00 0.00 H new ATOM 0 HG2 GLU A 38 28.556 -15.778 10.816 1.00 0.00 H new ATOM 0 HG3 GLU A 38 27.148 -15.539 11.832 1.00 0.00 H new ATOM 665 N ASN A 39 30.970 -13.542 11.171 1.00 0.00 N ATOM 666 CA ASN A 39 32.289 -14.141 11.006 1.00 0.00 C ATOM 667 C ASN A 39 33.292 -13.488 11.953 1.00 0.00 C ATOM 668 O ASN A 39 34.481 -13.810 11.933 1.00 0.00 O ATOM 669 CB ASN A 39 32.764 -13.970 9.561 1.00 0.00 C ATOM 670 CG ASN A 39 31.796 -14.664 8.610 1.00 0.00 C ATOM 671 OD1 ASN A 39 31.216 -14.022 7.735 1.00 0.00 O ATOM 672 ND2 ASN A 39 31.585 -15.947 8.731 1.00 0.00 N ATOM 0 H ASN A 39 30.812 -12.701 10.615 1.00 0.00 H new ATOM 0 HA ASN A 39 32.219 -15.203 11.241 1.00 0.00 H new ATOM 0 HB2 ASN A 39 32.832 -12.910 9.315 1.00 0.00 H new ATOM 0 HB3 ASN A 39 33.764 -14.389 9.446 1.00 0.00 H new ATOM 0 HD21 ASN A 39 30.938 -16.419 8.099 1.00 0.00 H new ATOM 0 HD22 ASN A 39 32.067 -16.477 9.457 1.00 0.00 H new ATOM 679 N LEU A 40 32.804 -12.571 12.783 1.00 0.00 N ATOM 680 CA LEU A 40 33.665 -11.879 13.736 1.00 0.00 C ATOM 681 C LEU A 40 33.479 -12.443 15.140 1.00 0.00 C ATOM 682 O LEU A 40 32.593 -12.012 15.877 1.00 0.00 O ATOM 683 CB LEU A 40 33.333 -10.385 13.750 1.00 0.00 C ATOM 684 CG LEU A 40 34.453 -9.599 13.068 1.00 0.00 C ATOM 685 CD1 LEU A 40 35.772 -9.844 13.803 1.00 0.00 C ATOM 686 CD2 LEU A 40 34.586 -10.059 11.615 1.00 0.00 C ATOM 0 H LEU A 40 31.824 -12.291 12.815 1.00 0.00 H new ATOM 0 HA LEU A 40 34.700 -12.026 13.428 1.00 0.00 H new ATOM 0 HB2 LEU A 40 32.388 -10.208 13.237 1.00 0.00 H new ATOM 0 HB3 LEU A 40 33.208 -10.041 14.777 1.00 0.00 H new ATOM 0 HG LEU A 40 34.217 -8.535 13.093 1.00 0.00 H new ATOM 0 HD11 LEU A 40 36.570 -9.283 13.316 1.00 0.00 H new ATOM 0 HD12 LEU A 40 35.678 -9.516 14.838 1.00 0.00 H new ATOM 0 HD13 LEU A 40 36.010 -10.908 13.779 1.00 0.00 H new ATOM 0 HD21 LEU A 40 35.384 -9.499 11.128 1.00 0.00 H new ATOM 0 HD22 LEU A 40 34.822 -11.123 11.590 1.00 0.00 H new ATOM 0 HD23 LEU A 40 33.647 -9.883 11.090 1.00 0.00 H new ATOM 698 N ASP A 41 34.320 -13.402 15.508 1.00 0.00 N ATOM 699 CA ASP A 41 34.232 -14.003 16.833 1.00 0.00 C ATOM 700 C ASP A 41 34.524 -12.960 17.904 1.00 0.00 C ATOM 701 O ASP A 41 35.419 -12.129 17.745 1.00 0.00 O ATOM 702 CB ASP A 41 35.229 -15.158 16.952 1.00 0.00 C ATOM 703 CG ASP A 41 34.758 -16.342 16.116 1.00 0.00 C ATOM 704 OD1 ASP A 41 33.613 -16.328 15.696 1.00 0.00 O ATOM 705 OD2 ASP A 41 35.550 -17.247 15.908 1.00 0.00 O ATOM 0 H ASP A 41 35.062 -13.776 14.916 1.00 0.00 H new ATOM 0 HA ASP A 41 33.222 -14.386 16.976 1.00 0.00 H new ATOM 0 HB2 ASP A 41 36.214 -14.835 16.617 1.00 0.00 H new ATOM 0 HB3 ASP A 41 35.330 -15.456 17.996 1.00 0.00 H new ATOM 710 N GLY A 42 33.771 -13.009 18.997 1.00 0.00 N ATOM 711 CA GLY A 42 33.968 -12.060 20.086 1.00 0.00 C ATOM 712 C GLY A 42 33.258 -10.738 19.803 1.00 0.00 C ATOM 713 O GLY A 42 33.381 -9.785 20.572 1.00 0.00 O ATOM 0 H GLY A 42 33.026 -13.688 19.152 1.00 0.00 H new ATOM 0 HA2 GLY A 42 33.591 -12.486 21.016 1.00 0.00 H new ATOM 0 HA3 GLY A 42 35.034 -11.880 20.227 1.00 0.00 H new ATOM 717 N TRP A 43 32.516 -10.688 18.698 1.00 0.00 N ATOM 718 CA TRP A 43 31.795 -9.473 18.327 1.00 0.00 C ATOM 719 C TRP A 43 30.293 -9.746 18.305 1.00 0.00 C ATOM 720 O TRP A 43 29.838 -10.681 17.647 1.00 0.00 O ATOM 721 CB TRP A 43 32.239 -9.022 16.934 1.00 0.00 C ATOM 722 CG TRP A 43 33.709 -8.744 16.937 1.00 0.00 C ATOM 723 CD1 TRP A 43 34.672 -9.691 16.860 1.00 0.00 C ATOM 724 CD2 TRP A 43 34.401 -7.462 16.991 1.00 0.00 C ATOM 725 NE1 TRP A 43 35.910 -9.075 16.883 1.00 0.00 N ATOM 726 CE2 TRP A 43 35.796 -7.702 16.961 1.00 0.00 C ATOM 727 CE3 TRP A 43 33.962 -6.128 17.070 1.00 0.00 C ATOM 728 CZ2 TRP A 43 36.721 -6.659 17.005 1.00 0.00 C ATOM 729 CZ3 TRP A 43 34.890 -5.075 17.113 1.00 0.00 C ATOM 730 CH2 TRP A 43 36.266 -5.340 17.082 1.00 0.00 C ATOM 0 H TRP A 43 32.399 -11.467 18.050 1.00 0.00 H new ATOM 0 HA TRP A 43 32.013 -8.694 19.057 1.00 0.00 H new ATOM 0 HB2 TRP A 43 32.007 -9.794 16.200 1.00 0.00 H new ATOM 0 HB3 TRP A 43 31.691 -8.127 16.639 1.00 0.00 H new ATOM 0 HD1 TRP A 43 34.502 -10.755 16.792 1.00 0.00 H new ATOM 0 HE1 TRP A 43 36.799 -9.574 16.847 1.00 0.00 H new ATOM 0 HE3 TRP A 43 32.904 -5.912 17.098 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 37.780 -6.869 16.980 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 34.541 -4.054 17.170 1.00 0.00 H new ATOM 0 HH2 TRP A 43 36.974 -4.525 17.118 1.00 0.00 H new ATOM 741 N TYR A 44 29.526 -8.940 19.036 1.00 0.00 N ATOM 742 CA TYR A 44 28.080 -9.135 19.088 1.00 0.00 C ATOM 743 C TYR A 44 27.331 -7.804 19.049 1.00 0.00 C ATOM 744 O TYR A 44 27.819 -6.789 19.545 1.00 0.00 O ATOM 745 CB TYR A 44 27.726 -9.890 20.369 1.00 0.00 C ATOM 746 CG TYR A 44 28.449 -11.213 20.362 1.00 0.00 C ATOM 747 CD1 TYR A 44 29.761 -11.289 20.843 1.00 0.00 C ATOM 748 CD2 TYR A 44 27.820 -12.357 19.858 1.00 0.00 C ATOM 749 CE1 TYR A 44 30.444 -12.509 20.825 1.00 0.00 C ATOM 750 CE2 TYR A 44 28.504 -13.579 19.839 1.00 0.00 C ATOM 751 CZ TYR A 44 29.815 -13.655 20.322 1.00 0.00 C ATOM 752 OH TYR A 44 30.489 -14.860 20.303 1.00 0.00 O ATOM 0 H TYR A 44 29.874 -8.159 19.592 1.00 0.00 H new ATOM 0 HA TYR A 44 27.778 -9.710 18.213 1.00 0.00 H new ATOM 0 HB2 TYR A 44 28.013 -9.307 21.244 1.00 0.00 H new ATOM 0 HB3 TYR A 44 26.649 -10.047 20.430 1.00 0.00 H new ATOM 0 HD1 TYR A 44 30.246 -10.405 21.228 1.00 0.00 H new ATOM 0 HD2 TYR A 44 26.808 -12.298 19.484 1.00 0.00 H new ATOM 0 HE1 TYR A 44 31.456 -12.568 21.199 1.00 0.00 H new ATOM 0 HE2 TYR A 44 28.019 -14.463 19.451 1.00 0.00 H new ATOM 0 HH TYR A 44 29.909 -15.553 19.924 1.00 0.00 H new ATOM 762 N LEU A 45 26.134 -7.826 18.465 1.00 0.00 N ATOM 763 CA LEU A 45 25.308 -6.625 18.375 1.00 0.00 C ATOM 764 C LEU A 45 23.910 -6.908 18.916 1.00 0.00 C ATOM 765 O LEU A 45 23.430 -8.039 18.850 1.00 0.00 O ATOM 766 CB LEU A 45 25.200 -6.163 16.921 1.00 0.00 C ATOM 767 CG LEU A 45 26.544 -6.354 16.221 1.00 0.00 C ATOM 768 CD1 LEU A 45 26.662 -7.799 15.736 1.00 0.00 C ATOM 769 CD2 LEU A 45 26.631 -5.404 15.025 1.00 0.00 C ATOM 0 H LEU A 45 25.717 -8.659 18.049 1.00 0.00 H new ATOM 0 HA LEU A 45 25.776 -5.840 18.969 1.00 0.00 H new ATOM 0 HB2 LEU A 45 24.426 -6.731 16.405 1.00 0.00 H new ATOM 0 HB3 LEU A 45 24.905 -5.114 16.883 1.00 0.00 H new ATOM 0 HG LEU A 45 27.354 -6.138 16.917 1.00 0.00 H new ATOM 0 HD11 LEU A 45 27.621 -7.938 15.236 1.00 0.00 H new ATOM 0 HD12 LEU A 45 26.596 -8.475 16.588 1.00 0.00 H new ATOM 0 HD13 LEU A 45 25.854 -8.016 15.038 1.00 0.00 H new ATOM 0 HD21 LEU A 45 27.589 -5.538 14.523 1.00 0.00 H new ATOM 0 HD22 LEU A 45 25.822 -5.622 14.327 1.00 0.00 H new ATOM 0 HD23 LEU A 45 26.543 -4.374 15.371 1.00 0.00 H new ATOM 781 N SER A 46 23.255 -5.878 19.443 1.00 0.00 N ATOM 782 CA SER A 46 21.909 -6.049 19.977 1.00 0.00 C ATOM 783 C SER A 46 20.921 -5.151 19.238 1.00 0.00 C ATOM 784 O SER A 46 21.163 -3.957 19.060 1.00 0.00 O ATOM 785 CB SER A 46 21.891 -5.709 21.468 1.00 0.00 C ATOM 786 OG SER A 46 22.276 -4.352 21.644 1.00 0.00 O ATOM 0 H SER A 46 23.627 -4.931 19.511 1.00 0.00 H new ATOM 0 HA SER A 46 21.613 -7.089 19.838 1.00 0.00 H new ATOM 0 HB2 SER A 46 20.894 -5.873 21.878 1.00 0.00 H new ATOM 0 HB3 SER A 46 22.571 -6.365 22.011 1.00 0.00 H new ATOM 0 HG SER A 46 22.127 -3.859 20.810 1.00 0.00 H new ATOM 792 N SER A 47 19.804 -5.739 18.817 1.00 0.00 N ATOM 793 CA SER A 47 18.776 -4.992 18.101 1.00 0.00 C ATOM 794 C SER A 47 18.169 -3.911 18.991 1.00 0.00 C ATOM 795 O SER A 47 17.942 -2.784 18.551 1.00 0.00 O ATOM 796 CB SER A 47 17.676 -5.943 17.629 1.00 0.00 C ATOM 797 OG SER A 47 16.679 -5.203 16.938 1.00 0.00 O ATOM 0 H SER A 47 19.589 -6.726 18.959 1.00 0.00 H new ATOM 0 HA SER A 47 19.240 -4.512 17.239 1.00 0.00 H new ATOM 0 HB2 SER A 47 18.096 -6.707 16.975 1.00 0.00 H new ATOM 0 HB3 SER A 47 17.236 -6.460 18.482 1.00 0.00 H new ATOM 0 HG SER A 47 15.973 -5.811 16.633 1.00 0.00 H new ATOM 803 N MET A 48 17.895 -4.273 20.239 1.00 0.00 N ATOM 804 CA MET A 48 17.295 -3.341 21.187 1.00 0.00 C ATOM 805 C MET A 48 18.188 -2.122 21.409 1.00 0.00 C ATOM 806 O MET A 48 17.710 -0.988 21.408 1.00 0.00 O ATOM 807 CB MET A 48 17.056 -4.046 22.524 1.00 0.00 C ATOM 808 CG MET A 48 16.421 -3.068 23.514 1.00 0.00 C ATOM 809 SD MET A 48 16.060 -3.931 25.063 1.00 0.00 S ATOM 810 CE MET A 48 17.771 -4.130 25.617 1.00 0.00 C ATOM 0 H MET A 48 18.078 -5.202 20.617 1.00 0.00 H new ATOM 0 HA MET A 48 16.347 -3.001 20.770 1.00 0.00 H new ATOM 0 HB2 MET A 48 16.405 -4.908 22.381 1.00 0.00 H new ATOM 0 HB3 MET A 48 17.999 -4.421 22.922 1.00 0.00 H new ATOM 0 HG2 MET A 48 17.095 -2.232 23.699 1.00 0.00 H new ATOM 0 HG3 MET A 48 15.505 -2.652 23.095 1.00 0.00 H new ATOM 0 HE1 MET A 48 17.858 -3.804 26.654 1.00 0.00 H new ATOM 0 HE2 MET A 48 18.058 -5.179 25.541 1.00 0.00 H new ATOM 0 HE3 MET A 48 18.429 -3.527 24.991 1.00 0.00 H new ATOM 820 N LYS A 49 19.479 -2.359 21.606 1.00 0.00 N ATOM 821 CA LYS A 49 20.413 -1.263 21.837 1.00 0.00 C ATOM 822 C LYS A 49 21.398 -1.131 20.680 1.00 0.00 C ATOM 823 O LYS A 49 22.575 -0.849 20.897 1.00 0.00 O ATOM 824 CB LYS A 49 21.179 -1.498 23.139 1.00 0.00 C ATOM 825 CG LYS A 49 20.204 -1.451 24.318 1.00 0.00 C ATOM 826 CD LYS A 49 20.968 -1.682 25.621 1.00 0.00 C ATOM 827 CE LYS A 49 19.996 -1.638 26.801 1.00 0.00 C ATOM 828 NZ LYS A 49 20.744 -1.869 28.069 1.00 0.00 N ATOM 0 H LYS A 49 19.900 -3.288 21.611 1.00 0.00 H new ATOM 0 HA LYS A 49 19.841 -0.338 21.911 1.00 0.00 H new ATOM 0 HB2 LYS A 49 21.683 -2.464 23.108 1.00 0.00 H new ATOM 0 HB3 LYS A 49 21.952 -0.739 23.261 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.698 -0.486 24.347 1.00 0.00 H new ATOM 0 HG3 LYS A 49 19.433 -2.212 24.196 1.00 0.00 H new ATOM 0 HD2 LYS A 49 21.475 -2.646 25.591 1.00 0.00 H new ATOM 0 HD3 LYS A 49 21.738 -0.920 25.743 1.00 0.00 H new ATOM 0 HE2 LYS A 49 19.491 -0.672 26.835 1.00 0.00 H new ATOM 0 HE3 LYS A 49 19.224 -2.397 26.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 20.084 -1.839 28.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.206 -2.800 28.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 21.465 -1.129 28.186 1.00 0.00 H new ATOM 842 N ASP A 50 20.901 -1.336 19.459 1.00 0.00 N ATOM 843 CA ASP A 50 21.731 -1.238 18.256 1.00 0.00 C ATOM 844 C ASP A 50 23.159 -0.830 18.603 1.00 0.00 C ATOM 845 O ASP A 50 23.570 0.303 18.354 1.00 0.00 O ATOM 846 CB ASP A 50 21.130 -0.214 17.291 1.00 0.00 C ATOM 847 CG ASP A 50 21.970 -0.141 16.021 1.00 0.00 C ATOM 848 OD1 ASP A 50 23.011 -0.775 15.986 1.00 0.00 O ATOM 849 OD2 ASP A 50 21.559 0.548 15.101 1.00 0.00 O ATOM 0 H ASP A 50 19.925 -1.572 19.276 1.00 0.00 H new ATOM 0 HA ASP A 50 21.757 -2.220 17.784 1.00 0.00 H new ATOM 0 HB2 ASP A 50 20.105 -0.492 17.044 1.00 0.00 H new ATOM 0 HB3 ASP A 50 21.089 0.766 17.767 1.00 0.00 H new ATOM 854 N SER A 51 23.907 -1.760 19.186 1.00 0.00 N ATOM 855 CA SER A 51 25.287 -1.488 19.571 1.00 0.00 C ATOM 856 C SER A 51 26.124 -2.760 19.486 1.00 0.00 C ATOM 857 O SER A 51 25.618 -3.863 19.693 1.00 0.00 O ATOM 858 CB SER A 51 25.332 -0.940 20.997 1.00 0.00 C ATOM 859 OG SER A 51 26.682 -0.686 21.361 1.00 0.00 O ATOM 0 H SER A 51 23.584 -2.703 19.401 1.00 0.00 H new ATOM 0 HA SER A 51 25.699 -0.748 18.885 1.00 0.00 H new ATOM 0 HB2 SER A 51 24.746 -0.023 21.065 1.00 0.00 H new ATOM 0 HB3 SER A 51 24.886 -1.655 21.688 1.00 0.00 H new ATOM 0 HG SER A 51 26.714 -0.333 22.275 1.00 0.00 H new ATOM 865 N ALA A 52 27.406 -2.599 19.177 1.00 0.00 N ATOM 866 CA ALA A 52 28.301 -3.744 19.064 1.00 0.00 C ATOM 867 C ALA A 52 29.285 -3.775 20.229 1.00 0.00 C ATOM 868 O ALA A 52 29.769 -2.734 20.675 1.00 0.00 O ATOM 869 CB ALA A 52 29.073 -3.676 17.745 1.00 0.00 C ATOM 0 H ALA A 52 27.845 -1.695 19.002 1.00 0.00 H new ATOM 0 HA ALA A 52 27.700 -4.653 19.087 1.00 0.00 H new ATOM 0 HB1 ALA A 52 29.739 -4.535 17.669 1.00 0.00 H new ATOM 0 HB2 ALA A 52 28.371 -3.686 16.911 1.00 0.00 H new ATOM 0 HB3 ALA A 52 29.660 -2.758 17.714 1.00 0.00 H new ATOM 875 N TYR A 53 29.578 -4.976 20.716 1.00 0.00 N ATOM 876 CA TYR A 53 30.506 -5.136 21.829 1.00 0.00 C ATOM 877 C TYR A 53 31.289 -6.436 21.684 1.00 0.00 C ATOM 878 O TYR A 53 30.874 -7.342 20.960 1.00 0.00 O ATOM 879 CB TYR A 53 29.738 -5.146 23.153 1.00 0.00 C ATOM 880 CG TYR A 53 28.858 -6.372 23.215 1.00 0.00 C ATOM 881 CD1 TYR A 53 29.347 -7.555 23.781 1.00 0.00 C ATOM 882 CD2 TYR A 53 27.555 -6.324 22.708 1.00 0.00 C ATOM 883 CE1 TYR A 53 28.532 -8.692 23.839 1.00 0.00 C ATOM 884 CE2 TYR A 53 26.739 -7.460 22.767 1.00 0.00 C ATOM 885 CZ TYR A 53 27.227 -8.645 23.332 1.00 0.00 C ATOM 886 OH TYR A 53 26.424 -9.765 23.390 1.00 0.00 O ATOM 0 H TYR A 53 29.188 -5.849 20.360 1.00 0.00 H new ATOM 0 HA TYR A 53 31.204 -4.299 21.822 1.00 0.00 H new ATOM 0 HB2 TYR A 53 30.436 -5.143 23.990 1.00 0.00 H new ATOM 0 HB3 TYR A 53 29.131 -4.245 23.241 1.00 0.00 H new ATOM 0 HD1 TYR A 53 30.353 -7.591 24.173 1.00 0.00 H new ATOM 0 HD2 TYR A 53 27.179 -5.411 22.271 1.00 0.00 H new ATOM 0 HE1 TYR A 53 28.909 -9.605 24.275 1.00 0.00 H new ATOM 0 HE2 TYR A 53 25.733 -7.423 22.377 1.00 0.00 H new ATOM 0 HH TYR A 53 25.550 -9.562 22.996 1.00 0.00 H new ATOM 896 N LYS A 54 32.424 -6.522 22.368 1.00 0.00 N ATOM 897 CA LYS A 54 33.255 -7.718 22.298 1.00 0.00 C ATOM 898 C LYS A 54 33.932 -7.988 23.638 1.00 0.00 C ATOM 899 O LYS A 54 34.225 -7.064 24.395 1.00 0.00 O ATOM 900 CB LYS A 54 34.310 -7.541 21.205 1.00 0.00 C ATOM 901 CG LYS A 54 34.908 -6.138 21.305 1.00 0.00 C ATOM 902 CD LYS A 54 34.820 -5.452 19.942 1.00 0.00 C ATOM 903 CE LYS A 54 33.377 -5.007 19.697 1.00 0.00 C ATOM 904 NZ LYS A 54 33.006 -3.966 20.694 1.00 0.00 N ATOM 0 H LYS A 54 32.788 -5.785 22.972 1.00 0.00 H new ATOM 0 HA LYS A 54 32.621 -8.572 22.060 1.00 0.00 H new ATOM 0 HB2 LYS A 54 35.093 -8.291 21.314 1.00 0.00 H new ATOM 0 HB3 LYS A 54 33.861 -7.689 20.223 1.00 0.00 H new ATOM 0 HG2 LYS A 54 34.372 -5.555 22.054 1.00 0.00 H new ATOM 0 HG3 LYS A 54 35.947 -6.196 21.629 1.00 0.00 H new ATOM 0 HD2 LYS A 54 35.489 -4.592 19.910 1.00 0.00 H new ATOM 0 HD3 LYS A 54 35.141 -6.135 19.156 1.00 0.00 H new ATOM 0 HE2 LYS A 54 33.273 -4.612 18.686 1.00 0.00 H new ATOM 0 HE3 LYS A 54 32.703 -5.860 19.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 32.037 -3.637 20.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 33.058 -4.368 21.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 33.664 -3.164 20.619 1.00 0.00 H new ATOM 918 N ASP A 55 34.170 -9.265 23.924 1.00 0.00 N ATOM 919 CA ASP A 55 34.807 -9.652 25.180 1.00 0.00 C ATOM 920 C ASP A 55 36.174 -10.288 24.935 1.00 0.00 C ATOM 921 O ASP A 55 36.264 -11.404 24.423 1.00 0.00 O ATOM 922 CB ASP A 55 33.913 -10.641 25.931 1.00 0.00 C ATOM 923 CG ASP A 55 34.561 -11.025 27.257 1.00 0.00 C ATOM 924 OD1 ASP A 55 34.661 -10.165 28.116 1.00 0.00 O ATOM 925 OD2 ASP A 55 34.949 -12.174 27.393 1.00 0.00 O ATOM 0 H ASP A 55 33.934 -10.044 23.309 1.00 0.00 H new ATOM 0 HA ASP A 55 34.949 -8.752 25.778 1.00 0.00 H new ATOM 0 HB2 ASP A 55 32.934 -10.196 26.110 1.00 0.00 H new ATOM 0 HB3 ASP A 55 33.752 -11.532 25.324 1.00 0.00 H new ATOM 930 N PHE A 56 37.234 -9.580 25.315 1.00 0.00 N ATOM 931 CA PHE A 56 38.587 -10.101 25.140 1.00 0.00 C ATOM 932 C PHE A 56 39.013 -10.895 26.372 1.00 0.00 C ATOM 933 O PHE A 56 40.059 -11.543 26.376 1.00 0.00 O ATOM 934 CB PHE A 56 39.570 -8.952 24.910 1.00 0.00 C ATOM 935 CG PHE A 56 39.270 -8.289 23.588 1.00 0.00 C ATOM 936 CD1 PHE A 56 38.405 -7.192 23.538 1.00 0.00 C ATOM 937 CD2 PHE A 56 39.860 -8.772 22.414 1.00 0.00 C ATOM 938 CE1 PHE A 56 38.127 -6.576 22.313 1.00 0.00 C ATOM 939 CE2 PHE A 56 39.582 -8.156 21.188 1.00 0.00 C ATOM 940 CZ PHE A 56 38.715 -7.058 21.137 1.00 0.00 C ATOM 0 H PHE A 56 37.185 -8.655 25.741 1.00 0.00 H new ATOM 0 HA PHE A 56 38.592 -10.759 24.271 1.00 0.00 H new ATOM 0 HB2 PHE A 56 39.492 -8.226 25.719 1.00 0.00 H new ATOM 0 HB3 PHE A 56 40.593 -9.328 24.916 1.00 0.00 H new ATOM 0 HD1 PHE A 56 37.951 -6.820 24.445 1.00 0.00 H new ATOM 0 HD2 PHE A 56 40.529 -9.619 22.454 1.00 0.00 H new ATOM 0 HE1 PHE A 56 37.459 -5.728 22.274 1.00 0.00 H new ATOM 0 HE2 PHE A 56 40.036 -8.528 20.282 1.00 0.00 H new ATOM 0 HZ PHE A 56 38.500 -6.583 20.191 1.00 0.00 H new ATOM 950 N GLY A 57 38.189 -10.841 27.414 1.00 0.00 N ATOM 951 CA GLY A 57 38.479 -11.560 28.649 1.00 0.00 C ATOM 952 C GLY A 57 39.277 -10.693 29.618 1.00 0.00 C ATOM 953 O GLY A 57 39.458 -11.054 30.781 1.00 0.00 O ATOM 0 H GLY A 57 37.319 -10.309 27.428 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.546 -11.871 29.119 1.00 0.00 H new ATOM 0 HA3 GLY A 57 39.040 -12.467 28.422 1.00 0.00 H new ATOM 957 N LYS A 58 39.746 -9.545 29.138 1.00 0.00 N ATOM 958 CA LYS A 58 40.517 -8.637 29.981 1.00 0.00 C ATOM 959 C LYS A 58 39.765 -7.325 30.180 1.00 0.00 C ATOM 960 O LYS A 58 39.814 -6.724 31.253 1.00 0.00 O ATOM 961 CB LYS A 58 41.876 -8.354 29.338 1.00 0.00 C ATOM 962 CG LYS A 58 42.683 -9.652 29.258 1.00 0.00 C ATOM 963 CD LYS A 58 43.991 -9.393 28.506 1.00 0.00 C ATOM 964 CE LYS A 58 44.889 -8.479 29.342 1.00 0.00 C ATOM 965 NZ LYS A 58 46.188 -8.281 28.639 1.00 0.00 N ATOM 0 H LYS A 58 39.608 -9.224 28.180 1.00 0.00 H new ATOM 0 HA LYS A 58 40.666 -9.110 30.952 1.00 0.00 H new ATOM 0 HB2 LYS A 58 41.738 -7.937 28.340 1.00 0.00 H new ATOM 0 HB3 LYS A 58 42.419 -7.611 29.922 1.00 0.00 H new ATOM 0 HG2 LYS A 58 42.895 -10.024 30.261 1.00 0.00 H new ATOM 0 HG3 LYS A 58 42.104 -10.422 28.748 1.00 0.00 H new ATOM 0 HD2 LYS A 58 44.500 -10.336 28.305 1.00 0.00 H new ATOM 0 HD3 LYS A 58 43.783 -8.931 27.541 1.00 0.00 H new ATOM 0 HE2 LYS A 58 44.400 -7.518 29.502 1.00 0.00 H new ATOM 0 HE3 LYS A 58 45.059 -8.918 30.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 46.799 -7.660 29.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 46.656 -9.201 28.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 46.017 -7.844 27.711 1.00 0.00 H new ATOM 979 N TYR A 59 39.071 -6.889 29.136 1.00 0.00 N ATOM 980 CA TYR A 59 38.307 -5.649 29.195 1.00 0.00 C ATOM 981 C TYR A 59 37.194 -5.659 28.152 1.00 0.00 C ATOM 982 O TYR A 59 37.233 -6.438 27.199 1.00 0.00 O ATOM 983 CB TYR A 59 39.234 -4.454 28.961 1.00 0.00 C ATOM 984 CG TYR A 59 39.894 -4.583 27.608 1.00 0.00 C ATOM 985 CD1 TYR A 59 39.279 -4.041 26.473 1.00 0.00 C ATOM 986 CD2 TYR A 59 41.122 -5.245 27.492 1.00 0.00 C ATOM 987 CE1 TYR A 59 39.895 -4.162 25.221 1.00 0.00 C ATOM 988 CE2 TYR A 59 41.737 -5.365 26.241 1.00 0.00 C ATOM 989 CZ TYR A 59 41.123 -4.824 25.105 1.00 0.00 C ATOM 990 OH TYR A 59 41.730 -4.943 23.871 1.00 0.00 O ATOM 0 H TYR A 59 39.021 -7.374 28.240 1.00 0.00 H new ATOM 0 HA TYR A 59 37.856 -5.563 30.184 1.00 0.00 H new ATOM 0 HB2 TYR A 59 38.667 -3.525 29.013 1.00 0.00 H new ATOM 0 HB3 TYR A 59 39.991 -4.409 29.744 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.331 -3.531 26.563 1.00 0.00 H new ATOM 0 HD2 TYR A 59 41.595 -5.663 28.368 1.00 0.00 H new ATOM 0 HE1 TYR A 59 39.422 -3.744 24.344 1.00 0.00 H new ATOM 0 HE2 TYR A 59 42.685 -5.875 26.152 1.00 0.00 H new ATOM 0 HH TYR A 59 42.127 -5.835 23.786 1.00 0.00 H new ATOM 1000 N GLU A 60 36.199 -4.796 28.338 1.00 0.00 N ATOM 1001 CA GLU A 60 35.081 -4.730 27.404 1.00 0.00 C ATOM 1002 C GLU A 60 35.136 -3.451 26.571 1.00 0.00 C ATOM 1003 O GLU A 60 35.267 -2.351 27.108 1.00 0.00 O ATOM 1004 CB GLU A 60 33.758 -4.785 28.167 1.00 0.00 C ATOM 1005 CG GLU A 60 32.595 -4.752 27.173 1.00 0.00 C ATOM 1006 CD GLU A 60 31.270 -4.867 27.918 1.00 0.00 C ATOM 1007 OE1 GLU A 60 31.304 -4.970 29.133 1.00 0.00 O ATOM 1008 OE2 GLU A 60 30.241 -4.849 27.263 1.00 0.00 O ATOM 0 H GLU A 60 36.144 -4.140 29.117 1.00 0.00 H new ATOM 0 HA GLU A 60 35.152 -5.585 26.732 1.00 0.00 H new ATOM 0 HB2 GLU A 60 33.710 -5.692 28.769 1.00 0.00 H new ATOM 0 HB3 GLU A 60 33.687 -3.942 28.855 1.00 0.00 H new ATOM 0 HG2 GLU A 60 32.621 -3.825 26.601 1.00 0.00 H new ATOM 0 HG3 GLU A 60 32.693 -5.570 26.459 1.00 0.00 H new ATOM 1015 N ILE A 61 35.026 -3.610 25.256 1.00 0.00 N ATOM 1016 CA ILE A 61 35.054 -2.471 24.345 1.00 0.00 C ATOM 1017 C ILE A 61 33.823 -2.496 23.448 1.00 0.00 C ATOM 1018 O ILE A 61 33.411 -3.557 22.980 1.00 0.00 O ATOM 1019 CB ILE A 61 36.317 -2.504 23.486 1.00 0.00 C ATOM 1020 CG1 ILE A 61 36.304 -3.755 22.603 1.00 0.00 C ATOM 1021 CG2 ILE A 61 37.547 -2.538 24.392 1.00 0.00 C ATOM 1022 CD1 ILE A 61 37.433 -3.663 21.576 1.00 0.00 C ATOM 0 H ILE A 61 34.917 -4.515 24.798 1.00 0.00 H new ATOM 0 HA ILE A 61 35.055 -1.554 24.935 1.00 0.00 H new ATOM 0 HB ILE A 61 36.350 -1.615 22.857 1.00 0.00 H new ATOM 0 HG12 ILE A 61 36.427 -4.648 23.216 1.00 0.00 H new ATOM 0 HG13 ILE A 61 35.343 -3.846 22.096 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.449 -2.562 23.780 1.00 0.00 H new ATOM 0 HG22 ILE A 61 37.559 -1.649 25.022 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.511 -3.428 25.020 1.00 0.00 H new ATOM 0 HD11 ILE A 61 37.425 -4.553 20.946 1.00 0.00 H new ATOM 0 HD12 ILE A 61 37.289 -2.778 20.956 1.00 0.00 H new ATOM 0 HD13 ILE A 61 38.390 -3.592 22.093 1.00 0.00 H new ATOM 1034 N ARG A 62 33.232 -1.330 23.217 1.00 0.00 N ATOM 1035 CA ARG A 62 32.041 -1.249 22.382 1.00 0.00 C ATOM 1036 C ARG A 62 32.265 -0.307 21.206 1.00 0.00 C ATOM 1037 O ARG A 62 33.063 0.627 21.286 1.00 0.00 O ATOM 1038 CB ARG A 62 30.860 -0.750 23.215 1.00 0.00 C ATOM 1039 CG ARG A 62 31.125 0.690 23.658 1.00 0.00 C ATOM 1040 CD ARG A 62 29.968 1.183 24.529 1.00 0.00 C ATOM 1041 NE ARG A 62 30.209 2.557 24.953 1.00 0.00 N ATOM 1042 CZ ARG A 62 29.348 3.196 25.737 1.00 0.00 C ATOM 1043 NH1 ARG A 62 28.263 2.594 26.141 1.00 0.00 N ATOM 1044 NH2 ARG A 62 29.586 4.425 26.104 1.00 0.00 N ATOM 0 H ARG A 62 33.554 -0.437 23.591 1.00 0.00 H new ATOM 0 HA ARG A 62 31.826 -2.245 21.994 1.00 0.00 H new ATOM 0 HB2 ARG A 62 29.941 -0.799 22.630 1.00 0.00 H new ATOM 0 HB3 ARG A 62 30.718 -1.390 24.086 1.00 0.00 H new ATOM 0 HG2 ARG A 62 32.060 0.743 24.215 1.00 0.00 H new ATOM 0 HG3 ARG A 62 31.236 1.334 22.786 1.00 0.00 H new ATOM 0 HD2 ARG A 62 29.033 1.125 23.972 1.00 0.00 H new ATOM 0 HD3 ARG A 62 29.860 0.539 25.402 1.00 0.00 H new ATOM 0 HE ARG A 62 31.054 3.036 24.642 1.00 0.00 H new ATOM 0 HH11 ARG A 62 28.076 1.633 25.855 1.00 0.00 H new ATOM 0 HH12 ARG A 62 27.602 3.084 26.743 1.00 0.00 H new ATOM 0 HH21 ARG A 62 30.434 4.896 25.789 1.00 0.00 H new ATOM 0 HH22 ARG A 62 28.924 4.915 26.706 1.00 0.00 H new ATOM 1058 N LEU A 63 31.551 -0.560 20.116 1.00 0.00 N ATOM 1059 CA LEU A 63 31.669 0.266 18.922 1.00 0.00 C ATOM 1060 C LEU A 63 30.395 1.081 18.726 1.00 0.00 C ATOM 1061 O LEU A 63 29.289 0.544 18.793 1.00 0.00 O ATOM 1062 CB LEU A 63 31.908 -0.618 17.697 1.00 0.00 C ATOM 1063 CG LEU A 63 32.784 0.126 16.687 1.00 0.00 C ATOM 1064 CD1 LEU A 63 32.986 -0.744 15.446 1.00 0.00 C ATOM 1065 CD2 LEU A 63 32.106 1.437 16.286 1.00 0.00 C ATOM 0 H LEU A 63 30.886 -1.329 20.035 1.00 0.00 H new ATOM 0 HA LEU A 63 32.513 0.944 19.044 1.00 0.00 H new ATOM 0 HB2 LEU A 63 32.391 -1.548 17.996 1.00 0.00 H new ATOM 0 HB3 LEU A 63 30.956 -0.886 17.239 1.00 0.00 H new ATOM 0 HG LEU A 63 33.751 0.343 17.140 1.00 0.00 H new ATOM 0 HD11 LEU A 63 33.610 -0.213 14.727 1.00 0.00 H new ATOM 0 HD12 LEU A 63 33.473 -1.676 15.731 1.00 0.00 H new ATOM 0 HD13 LEU A 63 32.019 -0.964 14.994 1.00 0.00 H new ATOM 0 HD21 LEU A 63 32.732 1.965 15.567 1.00 0.00 H new ATOM 0 HD22 LEU A 63 31.137 1.222 15.835 1.00 0.00 H new ATOM 0 HD23 LEU A 63 31.965 2.059 17.170 1.00 0.00 H new ATOM 1077 N SER A 64 30.553 2.379 18.493 1.00 0.00 N ATOM 1078 CA SER A 64 29.403 3.253 18.300 1.00 0.00 C ATOM 1079 C SER A 64 29.727 4.369 17.312 1.00 0.00 C ATOM 1080 O SER A 64 30.880 4.771 17.171 1.00 0.00 O ATOM 1081 CB SER A 64 28.980 3.861 19.636 1.00 0.00 C ATOM 1082 OG SER A 64 27.855 4.705 19.429 1.00 0.00 O ATOM 0 H SER A 64 31.458 2.846 18.434 1.00 0.00 H new ATOM 0 HA SER A 64 28.586 2.656 17.895 1.00 0.00 H new ATOM 0 HB2 SER A 64 28.732 3.072 20.346 1.00 0.00 H new ATOM 0 HB3 SER A 64 29.803 4.431 20.067 1.00 0.00 H new ATOM 0 HG SER A 64 28.159 5.587 19.128 1.00 0.00 H new ATOM 1088 N ASN A 65 28.699 4.857 16.626 1.00 0.00 N ATOM 1089 CA ASN A 65 28.878 5.923 15.647 1.00 0.00 C ATOM 1090 C ASN A 65 29.559 7.132 16.282 1.00 0.00 C ATOM 1091 O ASN A 65 30.429 6.984 17.141 1.00 0.00 O ATOM 1092 CB ASN A 65 27.523 6.340 15.071 1.00 0.00 C ATOM 1093 CG ASN A 65 27.718 7.027 13.725 1.00 0.00 C ATOM 1094 OD1 ASN A 65 28.607 6.655 12.960 1.00 0.00 O ATOM 1095 ND2 ASN A 65 26.934 8.016 13.388 1.00 0.00 N ATOM 0 H ASN A 65 27.737 4.533 16.729 1.00 0.00 H new ATOM 0 HA ASN A 65 29.512 5.546 14.845 1.00 0.00 H new ATOM 0 HB2 ASN A 65 26.884 5.465 14.953 1.00 0.00 H new ATOM 0 HB3 ASN A 65 27.016 7.013 15.762 1.00 0.00 H new ATOM 0 HD21 ASN A 65 27.058 8.482 12.489 1.00 0.00 H new ATOM 0 HD22 ASN A 65 26.198 8.323 14.024 1.00 0.00 H new ATOM 1102 N HIS A 66 29.168 8.326 15.847 1.00 0.00 N ATOM 1103 CA HIS A 66 29.764 9.550 16.374 1.00 0.00 C ATOM 1104 C HIS A 66 29.580 9.632 17.885 1.00 0.00 C ATOM 1105 O HIS A 66 30.396 10.232 18.586 1.00 0.00 O ATOM 1106 CB HIS A 66 29.118 10.769 15.714 1.00 0.00 C ATOM 1107 CG HIS A 66 27.690 10.889 16.172 1.00 0.00 C ATOM 1108 ND1 HIS A 66 26.511 10.441 15.630 1.00 0.00 N flip ATOM 1109 CD2 HIS A 66 27.342 11.545 17.343 1.00 0.00 C flip ATOM 1110 CE1 HIS A 66 25.448 10.813 16.447 1.00 0.00 C flip ATOM 1111 NE2 HIS A 66 26.003 11.475 17.464 1.00 0.00 N flip ATOM 0 H HIS A 66 28.449 8.472 15.139 1.00 0.00 H new ATOM 0 HA HIS A 66 30.831 9.536 16.151 1.00 0.00 H new ATOM 0 HB2 HIS A 66 29.671 11.672 15.973 1.00 0.00 H new ATOM 0 HB3 HIS A 66 29.156 10.672 14.629 1.00 0.00 H new ATOM 0 HD2 HIS A 66 28.021 12.025 18.032 1.00 0.00 H new ATOM 0 HE1 HIS A 66 24.399 10.610 16.291 1.00 0.00 H new ATOM 0 HE2 HIS A 66 25.477 11.879 18.239 1.00 0.00 H new ATOM 1119 N SER A 67 28.515 9.017 18.387 1.00 0.00 N ATOM 1120 CA SER A 67 28.254 9.022 19.822 1.00 0.00 C ATOM 1121 C SER A 67 27.884 7.622 20.296 1.00 0.00 C ATOM 1122 O SER A 67 27.265 6.852 19.561 1.00 0.00 O ATOM 1123 CB SER A 67 27.117 9.991 20.143 1.00 0.00 C ATOM 1124 OG SER A 67 25.927 9.545 19.507 1.00 0.00 O ATOM 0 H SER A 67 27.825 8.514 17.829 1.00 0.00 H new ATOM 0 HA SER A 67 29.158 9.344 20.339 1.00 0.00 H new ATOM 0 HB2 SER A 67 26.967 10.050 21.221 1.00 0.00 H new ATOM 0 HB3 SER A 67 27.371 10.994 19.802 1.00 0.00 H new ATOM 0 HG SER A 67 25.640 10.210 18.847 1.00 0.00 H new ATOM 1286 N GLY A 78 33.089 -2.916 36.020 1.00 0.00 N ATOM 1287 CA GLY A 78 34.221 -3.210 36.889 1.00 0.00 C ATOM 1288 C GLY A 78 35.494 -3.354 36.064 1.00 0.00 C ATOM 1289 O GLY A 78 36.563 -3.655 36.595 1.00 0.00 O ATOM 0 HA2 GLY A 78 34.342 -2.413 37.622 1.00 0.00 H new ATOM 0 HA3 GLY A 78 34.033 -4.129 37.445 1.00 0.00 H new ATOM 1293 N ARG A 79 35.363 -3.140 34.760 1.00 0.00 N ATOM 1294 CA ARG A 79 36.499 -3.249 33.853 1.00 0.00 C ATOM 1295 C ARG A 79 36.588 -2.013 32.965 1.00 0.00 C ATOM 1296 O ARG A 79 35.601 -1.303 32.772 1.00 0.00 O ATOM 1297 CB ARG A 79 36.351 -4.497 32.981 1.00 0.00 C ATOM 1298 CG ARG A 79 36.233 -5.734 33.873 1.00 0.00 C ATOM 1299 CD ARG A 79 37.488 -5.866 34.737 1.00 0.00 C ATOM 1300 NE ARG A 79 38.659 -6.082 33.895 1.00 0.00 N ATOM 1301 CZ ARG A 79 39.885 -6.079 34.407 1.00 0.00 C ATOM 1302 NH1 ARG A 79 40.057 -5.877 35.685 1.00 0.00 N ATOM 1303 NH2 ARG A 79 40.916 -6.278 33.633 1.00 0.00 N ATOM 0 H ARG A 79 34.483 -2.891 34.308 1.00 0.00 H new ATOM 0 HA ARG A 79 37.411 -3.327 34.445 1.00 0.00 H new ATOM 0 HB2 ARG A 79 35.469 -4.408 32.347 1.00 0.00 H new ATOM 0 HB3 ARG A 79 37.211 -4.594 32.319 1.00 0.00 H new ATOM 0 HG2 ARG A 79 35.350 -5.655 34.507 1.00 0.00 H new ATOM 0 HG3 ARG A 79 36.106 -6.626 33.260 1.00 0.00 H new ATOM 0 HD2 ARG A 79 37.623 -4.965 35.336 1.00 0.00 H new ATOM 0 HD3 ARG A 79 37.373 -6.697 35.433 1.00 0.00 H new ATOM 0 HE ARG A 79 38.535 -6.238 32.895 1.00 0.00 H new ATOM 0 HH11 ARG A 79 39.251 -5.722 36.290 1.00 0.00 H new ATOM 0 HH12 ARG A 79 40.998 -5.875 36.079 1.00 0.00 H new ATOM 0 HH21 ARG A 79 40.781 -6.436 32.634 1.00 0.00 H new ATOM 0 HH22 ARG A 79 41.857 -6.276 34.026 1.00 0.00 H new ATOM 1317 N LEU A 80 37.777 -1.757 32.431 1.00 0.00 N ATOM 1318 CA LEU A 80 37.982 -0.599 31.570 1.00 0.00 C ATOM 1319 C LEU A 80 37.016 -0.624 30.392 1.00 0.00 C ATOM 1320 O LEU A 80 36.730 -1.681 29.831 1.00 0.00 O ATOM 1321 CB LEU A 80 39.417 -0.583 31.049 1.00 0.00 C ATOM 1322 CG LEU A 80 40.241 0.403 31.873 1.00 0.00 C ATOM 1323 CD1 LEU A 80 39.638 1.804 31.738 1.00 0.00 C ATOM 1324 CD2 LEU A 80 40.220 -0.020 33.344 1.00 0.00 C ATOM 0 H LEU A 80 38.607 -2.331 32.578 1.00 0.00 H new ATOM 0 HA LEU A 80 37.796 0.300 32.158 1.00 0.00 H new ATOM 0 HB2 LEU A 80 39.851 -1.581 31.114 1.00 0.00 H new ATOM 0 HB3 LEU A 80 39.431 -0.297 29.997 1.00 0.00 H new ATOM 0 HG LEU A 80 41.269 0.411 31.512 1.00 0.00 H new ATOM 0 HD11 LEU A 80 40.224 2.511 32.325 1.00 0.00 H new ATOM 0 HD12 LEU A 80 39.649 2.106 30.691 1.00 0.00 H new ATOM 0 HD13 LEU A 80 38.611 1.794 32.102 1.00 0.00 H new ATOM 0 HD21 LEU A 80 40.808 0.683 33.933 1.00 0.00 H new ATOM 0 HD22 LEU A 80 39.192 -0.026 33.706 1.00 0.00 H new ATOM 0 HD23 LEU A 80 40.645 -1.019 33.441 1.00 0.00 H new ATOM 1336 N ILE A 81 36.516 0.552 30.023 1.00 0.00 N ATOM 1337 CA ILE A 81 35.581 0.656 28.911 1.00 0.00 C ATOM 1338 C ILE A 81 36.175 1.496 27.785 1.00 0.00 C ATOM 1339 O ILE A 81 36.570 2.645 27.991 1.00 0.00 O ATOM 1340 CB ILE A 81 34.274 1.292 29.387 1.00 0.00 C ATOM 1341 CG1 ILE A 81 33.657 0.424 30.486 1.00 0.00 C ATOM 1342 CG2 ILE A 81 33.300 1.395 28.213 1.00 0.00 C ATOM 1343 CD1 ILE A 81 32.488 1.170 31.131 1.00 0.00 C ATOM 0 H ILE A 81 36.741 1.439 30.474 1.00 0.00 H new ATOM 0 HA ILE A 81 35.383 -0.347 28.534 1.00 0.00 H new ATOM 0 HB ILE A 81 34.476 2.288 29.780 1.00 0.00 H new ATOM 0 HG12 ILE A 81 33.312 -0.521 30.067 1.00 0.00 H new ATOM 0 HG13 ILE A 81 34.408 0.183 31.238 1.00 0.00 H new ATOM 0 HG21 ILE A 81 32.368 1.848 28.552 1.00 0.00 H new ATOM 0 HG22 ILE A 81 33.739 2.012 27.429 1.00 0.00 H new ATOM 0 HG23 ILE A 81 33.097 0.399 27.820 1.00 0.00 H new ATOM 0 HD11 ILE A 81 32.049 0.551 31.914 1.00 0.00 H new ATOM 0 HD12 ILE A 81 32.847 2.103 31.565 1.00 0.00 H new ATOM 0 HD13 ILE A 81 31.734 1.388 30.375 1.00 0.00 H new ATOM 1355 N VAL A 82 36.227 0.914 26.592 1.00 0.00 N ATOM 1356 CA VAL A 82 36.765 1.609 25.429 1.00 0.00 C ATOM 1357 C VAL A 82 35.723 1.663 24.319 1.00 0.00 C ATOM 1358 O VAL A 82 35.167 0.635 23.931 1.00 0.00 O ATOM 1359 CB VAL A 82 38.019 0.893 24.923 1.00 0.00 C ATOM 1360 CG1 VAL A 82 38.532 1.590 23.662 1.00 0.00 C ATOM 1361 CG2 VAL A 82 39.103 0.936 26.003 1.00 0.00 C ATOM 0 H VAL A 82 35.904 -0.035 26.405 1.00 0.00 H new ATOM 0 HA VAL A 82 37.026 2.626 25.722 1.00 0.00 H new ATOM 0 HB VAL A 82 37.775 -0.144 24.692 1.00 0.00 H new ATOM 0 HG11 VAL A 82 39.425 1.080 23.302 1.00 0.00 H new ATOM 0 HG12 VAL A 82 37.762 1.561 22.891 1.00 0.00 H new ATOM 0 HG13 VAL A 82 38.775 2.627 23.893 1.00 0.00 H new ATOM 0 HG21 VAL A 82 39.996 0.426 25.642 1.00 0.00 H new ATOM 0 HG22 VAL A 82 39.346 1.973 26.234 1.00 0.00 H new ATOM 0 HG23 VAL A 82 38.740 0.439 26.903 1.00 0.00 H new ATOM 1371 N ASN A 83 35.460 2.861 23.811 1.00 0.00 N ATOM 1372 CA ASN A 83 34.477 3.020 22.745 1.00 0.00 C ATOM 1373 C ASN A 83 35.153 3.476 21.457 1.00 0.00 C ATOM 1374 O ASN A 83 36.204 4.115 21.489 1.00 0.00 O ATOM 1375 CB ASN A 83 33.418 4.044 23.158 1.00 0.00 C ATOM 1376 CG ASN A 83 34.044 5.431 23.255 1.00 0.00 C ATOM 1377 OD1 ASN A 83 35.187 5.629 22.843 1.00 0.00 O ATOM 1378 ND2 ASN A 83 33.358 6.410 23.777 1.00 0.00 N ATOM 0 H ASN A 83 35.907 3.726 24.114 1.00 0.00 H new ATOM 0 HA ASN A 83 34.000 2.056 22.570 1.00 0.00 H new ATOM 0 HB2 ASN A 83 32.606 4.053 22.431 1.00 0.00 H new ATOM 0 HB3 ASN A 83 32.984 3.764 24.118 1.00 0.00 H new ATOM 0 HD21 ASN A 83 33.769 7.341 23.844 1.00 0.00 H new ATOM 0 HD22 ASN A 83 32.411 6.244 24.118 1.00 0.00 H new ATOM 1385 N ILE A 84 34.543 3.140 20.327 1.00 0.00 N ATOM 1386 CA ILE A 84 35.093 3.517 19.030 1.00 0.00 C ATOM 1387 C ILE A 84 34.064 4.291 18.211 1.00 0.00 C ATOM 1388 O ILE A 84 32.933 3.838 18.033 1.00 0.00 O ATOM 1389 CB ILE A 84 35.519 2.266 18.263 1.00 0.00 C ATOM 1390 CG1 ILE A 84 36.600 1.528 19.056 1.00 0.00 C ATOM 1391 CG2 ILE A 84 36.074 2.668 16.895 1.00 0.00 C ATOM 1392 CD1 ILE A 84 36.852 0.158 18.424 1.00 0.00 C ATOM 0 H ILE A 84 33.672 2.610 20.282 1.00 0.00 H new ATOM 0 HA ILE A 84 35.960 4.156 19.197 1.00 0.00 H new ATOM 0 HB ILE A 84 34.657 1.613 18.126 1.00 0.00 H new ATOM 0 HG12 ILE A 84 37.521 2.111 19.065 1.00 0.00 H new ATOM 0 HG13 ILE A 84 36.288 1.410 20.094 1.00 0.00 H new ATOM 0 HG21 ILE A 84 36.378 1.775 16.349 1.00 0.00 H new ATOM 0 HG22 ILE A 84 35.304 3.195 16.331 1.00 0.00 H new ATOM 0 HG23 ILE A 84 36.936 3.321 17.030 1.00 0.00 H new ATOM 0 HD11 ILE A 84 37.622 -0.367 18.989 1.00 0.00 H new ATOM 0 HD12 ILE A 84 35.931 -0.424 18.438 1.00 0.00 H new ATOM 0 HD13 ILE A 84 37.183 0.288 17.394 1.00 0.00 H new ATOM 1404 N LYS A 85 34.464 5.455 17.708 1.00 0.00 N ATOM 1405 CA LYS A 85 33.561 6.272 16.905 1.00 0.00 C ATOM 1406 C LYS A 85 33.883 6.117 15.422 1.00 0.00 C ATOM 1407 O LYS A 85 34.994 6.413 14.983 1.00 0.00 O ATOM 1408 CB LYS A 85 33.688 7.742 17.306 1.00 0.00 C ATOM 1409 CG LYS A 85 33.255 7.913 18.763 1.00 0.00 C ATOM 1410 CD LYS A 85 33.252 9.399 19.125 1.00 0.00 C ATOM 1411 CE LYS A 85 34.690 9.920 19.155 1.00 0.00 C ATOM 1412 NZ LYS A 85 34.690 11.351 19.574 1.00 0.00 N ATOM 0 H LYS A 85 35.395 5.850 17.840 1.00 0.00 H new ATOM 0 HA LYS A 85 32.539 5.937 17.083 1.00 0.00 H new ATOM 0 HB2 LYS A 85 34.718 8.077 17.180 1.00 0.00 H new ATOM 0 HB3 LYS A 85 33.070 8.362 16.657 1.00 0.00 H new ATOM 0 HG2 LYS A 85 32.261 7.490 18.910 1.00 0.00 H new ATOM 0 HG3 LYS A 85 33.933 7.369 19.421 1.00 0.00 H new ATOM 0 HD2 LYS A 85 32.666 9.960 18.397 1.00 0.00 H new ATOM 0 HD3 LYS A 85 32.780 9.547 20.096 1.00 0.00 H new ATOM 0 HE2 LYS A 85 35.289 9.327 19.846 1.00 0.00 H new ATOM 0 HE3 LYS A 85 35.146 9.818 18.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 35.515 11.833 19.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 33.819 11.811 19.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 34.736 11.409 20.611 1.00 0.00 H new ATOM 1426 N ALA A 86 32.902 5.651 14.654 1.00 0.00 N ATOM 1427 CA ALA A 86 33.092 5.460 13.220 1.00 0.00 C ATOM 1428 C ALA A 86 31.748 5.430 12.498 1.00 0.00 C ATOM 1429 O ALA A 86 30.720 5.108 13.093 1.00 0.00 O ATOM 1430 CB ALA A 86 33.842 4.154 12.962 1.00 0.00 C ATOM 0 H ALA A 86 31.975 5.401 14.997 1.00 0.00 H new ATOM 0 HA ALA A 86 33.677 6.296 12.837 1.00 0.00 H new ATOM 0 HB1 ALA A 86 33.980 4.019 11.889 1.00 0.00 H new ATOM 0 HB2 ALA A 86 34.816 4.191 13.451 1.00 0.00 H new ATOM 0 HB3 ALA A 86 33.267 3.319 13.362 1.00 0.00 H new ATOM 1436 N SER A 87 31.767 5.760 11.210 1.00 0.00 N ATOM 1437 CA SER A 87 30.545 5.760 10.414 1.00 0.00 C ATOM 1438 C SER A 87 30.073 4.332 10.160 1.00 0.00 C ATOM 1439 O SER A 87 30.843 3.381 10.296 1.00 0.00 O ATOM 1440 CB SER A 87 30.791 6.463 9.079 1.00 0.00 C ATOM 1441 OG SER A 87 31.656 5.665 8.282 1.00 0.00 O ATOM 0 H SER A 87 32.608 6.029 10.699 1.00 0.00 H new ATOM 0 HA SER A 87 29.773 6.294 10.968 1.00 0.00 H new ATOM 0 HB2 SER A 87 29.846 6.625 8.560 1.00 0.00 H new ATOM 0 HB3 SER A 87 31.235 7.444 9.248 1.00 0.00 H new ATOM 0 HG SER A 87 31.815 6.111 7.424 1.00 0.00 H new ATOM 1447 N LYS A 88 28.803 4.186 9.794 1.00 0.00 N ATOM 1448 CA LYS A 88 28.244 2.865 9.526 1.00 0.00 C ATOM 1449 C LYS A 88 28.987 2.191 8.376 1.00 0.00 C ATOM 1450 O LYS A 88 29.301 1.003 8.441 1.00 0.00 O ATOM 1451 CB LYS A 88 26.760 2.991 9.177 1.00 0.00 C ATOM 1452 CG LYS A 88 26.179 1.603 8.902 1.00 0.00 C ATOM 1453 CD LYS A 88 24.665 1.712 8.714 1.00 0.00 C ATOM 1454 CE LYS A 88 24.364 2.504 7.441 1.00 0.00 C ATOM 1455 NZ LYS A 88 24.847 1.741 6.255 1.00 0.00 N ATOM 0 H LYS A 88 28.147 4.958 9.677 1.00 0.00 H new ATOM 0 HA LYS A 88 28.356 2.253 10.421 1.00 0.00 H new ATOM 0 HB2 LYS A 88 26.222 3.466 9.998 1.00 0.00 H new ATOM 0 HB3 LYS A 88 26.634 3.629 8.302 1.00 0.00 H new ATOM 0 HG2 LYS A 88 26.637 1.175 8.010 1.00 0.00 H new ATOM 0 HG3 LYS A 88 26.406 0.931 9.730 1.00 0.00 H new ATOM 0 HD2 LYS A 88 24.224 0.718 8.649 1.00 0.00 H new ATOM 0 HD3 LYS A 88 24.215 2.205 9.576 1.00 0.00 H new ATOM 0 HE2 LYS A 88 23.293 2.686 7.358 1.00 0.00 H new ATOM 0 HE3 LYS A 88 24.851 3.479 7.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 24.315 2.037 5.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 25.859 1.929 6.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 24.704 0.723 6.415 1.00 0.00 H new ATOM 1469 N LEU A 89 29.268 2.958 7.328 1.00 0.00 N ATOM 1470 CA LEU A 89 29.981 2.423 6.173 1.00 0.00 C ATOM 1471 C LEU A 89 31.378 1.965 6.578 1.00 0.00 C ATOM 1472 O LEU A 89 31.843 0.905 6.160 1.00 0.00 O ATOM 1473 CB LEU A 89 30.087 3.492 5.083 1.00 0.00 C ATOM 1474 CG LEU A 89 30.810 2.912 3.868 1.00 0.00 C ATOM 1475 CD1 LEU A 89 30.313 3.605 2.598 1.00 0.00 C ATOM 1476 CD2 LEU A 89 32.317 3.139 4.015 1.00 0.00 C ATOM 0 H LEU A 89 29.016 3.944 7.254 1.00 0.00 H new ATOM 0 HA LEU A 89 29.426 1.568 5.787 1.00 0.00 H new ATOM 0 HB2 LEU A 89 29.093 3.835 4.798 1.00 0.00 H new ATOM 0 HB3 LEU A 89 30.628 4.360 5.461 1.00 0.00 H new ATOM 0 HG LEU A 89 30.607 1.843 3.802 1.00 0.00 H new ATOM 0 HD11 LEU A 89 30.829 3.191 1.732 1.00 0.00 H new ATOM 0 HD12 LEU A 89 29.240 3.445 2.492 1.00 0.00 H new ATOM 0 HD13 LEU A 89 30.515 4.674 2.664 1.00 0.00 H new ATOM 0 HD21 LEU A 89 32.833 2.726 3.149 1.00 0.00 H new ATOM 0 HD22 LEU A 89 32.519 4.208 4.082 1.00 0.00 H new ATOM 0 HD23 LEU A 89 32.673 2.645 4.919 1.00 0.00 H new ATOM 1488 N ASN A 90 32.039 2.778 7.395 1.00 0.00 N ATOM 1489 CA ASN A 90 33.384 2.462 7.860 1.00 0.00 C ATOM 1490 C ASN A 90 33.337 1.908 9.280 1.00 0.00 C ATOM 1491 O ASN A 90 34.351 1.866 9.976 1.00 0.00 O ATOM 1492 CB ASN A 90 34.258 3.717 7.827 1.00 0.00 C ATOM 1493 CG ASN A 90 34.546 4.112 6.382 1.00 0.00 C ATOM 1494 OD1 ASN A 90 34.434 3.285 5.477 1.00 0.00 O ATOM 1495 ND2 ASN A 90 34.912 5.335 6.111 1.00 0.00 N ATOM 0 H ASN A 90 31.666 3.659 7.748 1.00 0.00 H new ATOM 0 HA ASN A 90 33.812 1.708 7.199 1.00 0.00 H new ATOM 0 HB2 ASN A 90 33.755 4.535 8.343 1.00 0.00 H new ATOM 0 HB3 ASN A 90 35.193 3.533 8.356 1.00 0.00 H new ATOM 0 HD21 ASN A 90 35.106 5.608 5.147 1.00 0.00 H new ATOM 0 HD22 ASN A 90 35.004 6.018 6.863 1.00 0.00 H new ATOM 1502 N PHE A 91 32.147 1.494 9.704 1.00 0.00 N ATOM 1503 CA PHE A 91 31.970 0.955 11.047 1.00 0.00 C ATOM 1504 C PHE A 91 32.876 -0.254 11.264 1.00 0.00 C ATOM 1505 O PHE A 91 33.595 -0.330 12.261 1.00 0.00 O ATOM 1506 CB PHE A 91 30.511 0.538 11.236 1.00 0.00 C ATOM 1507 CG PHE A 91 30.324 -0.061 12.609 1.00 0.00 C ATOM 1508 CD1 PHE A 91 30.062 0.767 13.706 1.00 0.00 C ATOM 1509 CD2 PHE A 91 30.414 -1.446 12.783 1.00 0.00 C ATOM 1510 CE1 PHE A 91 29.887 0.208 14.977 1.00 0.00 C ATOM 1511 CE2 PHE A 91 30.241 -2.004 14.052 1.00 0.00 C ATOM 1512 CZ PHE A 91 29.977 -1.178 15.150 1.00 0.00 C ATOM 0 H PHE A 91 31.297 1.521 9.141 1.00 0.00 H new ATOM 0 HA PHE A 91 32.235 1.724 11.772 1.00 0.00 H new ATOM 0 HB2 PHE A 91 29.858 1.402 11.114 1.00 0.00 H new ATOM 0 HB3 PHE A 91 30.228 -0.186 10.472 1.00 0.00 H new ATOM 0 HD1 PHE A 91 29.995 1.837 13.572 1.00 0.00 H new ATOM 0 HD2 PHE A 91 30.617 -2.084 11.936 1.00 0.00 H new ATOM 0 HE1 PHE A 91 29.683 0.846 15.824 1.00 0.00 H new ATOM 0 HE2 PHE A 91 30.311 -3.073 14.186 1.00 0.00 H new ATOM 0 HZ PHE A 91 29.843 -1.610 16.131 1.00 0.00 H new ATOM 1522 N VAL A 92 32.848 -1.194 10.325 1.00 0.00 N ATOM 1523 CA VAL A 92 33.686 -2.383 10.433 1.00 0.00 C ATOM 1524 C VAL A 92 35.150 -2.010 10.224 1.00 0.00 C ATOM 1525 O VAL A 92 36.046 -2.600 10.827 1.00 0.00 O ATOM 1526 CB VAL A 92 33.266 -3.423 9.393 1.00 0.00 C ATOM 1527 CG1 VAL A 92 33.697 -2.959 8.001 1.00 0.00 C ATOM 1528 CG2 VAL A 92 33.935 -4.761 9.713 1.00 0.00 C ATOM 0 H VAL A 92 32.262 -1.158 9.491 1.00 0.00 H new ATOM 0 HA VAL A 92 33.562 -2.808 11.429 1.00 0.00 H new ATOM 0 HB VAL A 92 32.183 -3.541 9.416 1.00 0.00 H new ATOM 0 HG11 VAL A 92 33.397 -3.701 7.261 1.00 0.00 H new ATOM 0 HG12 VAL A 92 33.221 -2.005 7.772 1.00 0.00 H new ATOM 0 HG13 VAL A 92 34.780 -2.839 7.976 1.00 0.00 H new ATOM 0 HG21 VAL A 92 33.637 -5.503 8.973 1.00 0.00 H new ATOM 0 HG22 VAL A 92 35.018 -4.641 9.690 1.00 0.00 H new ATOM 0 HG23 VAL A 92 33.628 -5.094 10.704 1.00 0.00 H new ATOM 1538 N ASP A 93 35.380 -1.021 9.366 1.00 0.00 N ATOM 1539 CA ASP A 93 36.735 -0.564 9.079 1.00 0.00 C ATOM 1540 C ASP A 93 37.397 -0.021 10.341 1.00 0.00 C ATOM 1541 O ASP A 93 38.571 -0.286 10.599 1.00 0.00 O ATOM 1542 CB ASP A 93 36.701 0.528 8.009 1.00 0.00 C ATOM 1543 CG ASP A 93 38.123 0.941 7.641 1.00 0.00 C ATOM 1544 OD1 ASP A 93 39.039 0.499 8.314 1.00 0.00 O ATOM 1545 OD2 ASP A 93 38.273 1.693 6.693 1.00 0.00 O ATOM 0 H ASP A 93 34.649 -0.522 8.859 1.00 0.00 H new ATOM 0 HA ASP A 93 37.315 -1.412 8.715 1.00 0.00 H new ATOM 0 HB2 ASP A 93 36.178 0.166 7.124 1.00 0.00 H new ATOM 0 HB3 ASP A 93 36.146 1.391 8.376 1.00 0.00 H new ATOM 1550 N ILE A 94 36.638 0.742 11.121 1.00 0.00 N ATOM 1551 CA ILE A 94 37.166 1.319 12.352 1.00 0.00 C ATOM 1552 C ILE A 94 37.621 0.214 13.292 1.00 0.00 C ATOM 1553 O ILE A 94 38.530 0.404 14.094 1.00 0.00 O ATOM 1554 CB ILE A 94 36.088 2.139 13.055 1.00 0.00 C ATOM 1555 CG1 ILE A 94 36.740 3.289 13.827 1.00 0.00 C ATOM 1556 CG2 ILE A 94 35.350 1.236 14.046 1.00 0.00 C ATOM 1557 CD1 ILE A 94 37.546 4.161 12.863 1.00 0.00 C ATOM 0 H ILE A 94 35.664 0.974 10.925 1.00 0.00 H new ATOM 0 HA ILE A 94 38.009 1.960 12.095 1.00 0.00 H new ATOM 0 HB ILE A 94 35.394 2.541 12.317 1.00 0.00 H new ATOM 0 HG12 ILE A 94 35.976 3.888 14.322 1.00 0.00 H new ATOM 0 HG13 ILE A 94 37.391 2.894 14.607 1.00 0.00 H new ATOM 0 HG21 ILE A 94 34.576 1.811 14.555 1.00 0.00 H new ATOM 0 HG22 ILE A 94 34.891 0.406 13.509 1.00 0.00 H new ATOM 0 HG23 ILE A 94 36.056 0.848 14.780 1.00 0.00 H new ATOM 0 HD11 ILE A 94 38.010 4.979 13.414 1.00 0.00 H new ATOM 0 HD12 ILE A 94 38.320 3.558 12.388 1.00 0.00 H new ATOM 0 HD13 ILE A 94 36.883 4.567 12.099 1.00 0.00 H new ATOM 1569 N ILE A 95 36.968 -0.936 13.193 1.00 0.00 N ATOM 1570 CA ILE A 95 37.299 -2.065 14.050 1.00 0.00 C ATOM 1571 C ILE A 95 38.742 -2.511 13.844 1.00 0.00 C ATOM 1572 O ILE A 95 39.466 -2.745 14.808 1.00 0.00 O ATOM 1573 CB ILE A 95 36.357 -3.232 13.749 1.00 0.00 C ATOM 1574 CG1 ILE A 95 34.946 -2.881 14.222 1.00 0.00 C ATOM 1575 CG2 ILE A 95 36.843 -4.482 14.481 1.00 0.00 C ATOM 1576 CD1 ILE A 95 33.954 -3.910 13.678 1.00 0.00 C ATOM 0 H ILE A 95 36.211 -1.111 12.532 1.00 0.00 H new ATOM 0 HA ILE A 95 37.183 -1.750 15.087 1.00 0.00 H new ATOM 0 HB ILE A 95 36.345 -3.422 12.676 1.00 0.00 H new ATOM 0 HG12 ILE A 95 34.910 -2.866 15.311 1.00 0.00 H new ATOM 0 HG13 ILE A 95 34.674 -1.882 13.880 1.00 0.00 H new ATOM 0 HG21 ILE A 95 36.172 -5.313 14.266 1.00 0.00 H new ATOM 0 HG22 ILE A 95 37.849 -4.732 14.145 1.00 0.00 H new ATOM 0 HG23 ILE A 95 36.855 -4.293 15.554 1.00 0.00 H new ATOM 0 HD11 ILE A 95 32.948 -3.660 14.015 1.00 0.00 H new ATOM 0 HD12 ILE A 95 33.983 -3.903 12.588 1.00 0.00 H new ATOM 0 HD13 ILE A 95 34.222 -4.902 14.042 1.00 0.00 H new ATOM 1588 N GLU A 96 39.153 -2.641 12.591 1.00 0.00 N ATOM 1589 CA GLU A 96 40.514 -3.075 12.294 1.00 0.00 C ATOM 1590 C GLU A 96 41.553 -2.069 12.793 1.00 0.00 C ATOM 1591 O GLU A 96 42.551 -2.451 13.403 1.00 0.00 O ATOM 1592 CB GLU A 96 40.674 -3.265 10.784 1.00 0.00 C ATOM 1593 CG GLU A 96 42.064 -3.831 10.484 1.00 0.00 C ATOM 1594 CD GLU A 96 43.088 -2.703 10.445 1.00 0.00 C ATOM 1595 OE1 GLU A 96 42.695 -1.581 10.171 1.00 0.00 O ATOM 1596 OE2 GLU A 96 44.251 -2.976 10.692 1.00 0.00 O ATOM 0 H GLU A 96 38.574 -2.455 11.772 1.00 0.00 H new ATOM 0 HA GLU A 96 40.683 -4.018 12.813 1.00 0.00 H new ATOM 0 HB2 GLU A 96 39.906 -3.941 10.409 1.00 0.00 H new ATOM 0 HB3 GLU A 96 40.539 -2.313 10.271 1.00 0.00 H new ATOM 0 HG2 GLU A 96 42.342 -4.559 11.246 1.00 0.00 H new ATOM 0 HG3 GLU A 96 42.053 -4.357 9.529 1.00 0.00 H new ATOM 1603 N ASN A 97 41.324 -0.788 12.517 1.00 0.00 N ATOM 1604 CA ASN A 97 42.260 0.253 12.927 1.00 0.00 C ATOM 1605 C ASN A 97 42.256 0.470 14.439 1.00 0.00 C ATOM 1606 O ASN A 97 43.307 0.646 15.044 1.00 0.00 O ATOM 1607 CB ASN A 97 41.905 1.564 12.225 1.00 0.00 C ATOM 1608 CG ASN A 97 42.248 1.469 10.742 1.00 0.00 C ATOM 1609 OD1 ASN A 97 41.660 2.265 9.892 1.00 0.00 O flip ATOM 1610 ND2 ASN A 97 43.070 0.642 10.348 1.00 0.00 N flip ATOM 0 H ASN A 97 40.504 -0.448 12.015 1.00 0.00 H new ATOM 0 HA ASN A 97 43.260 -0.073 12.642 1.00 0.00 H new ATOM 0 HB2 ASN A 97 40.843 1.777 12.349 1.00 0.00 H new ATOM 0 HB3 ASN A 97 42.451 2.390 12.681 1.00 0.00 H new ATOM 0 HD21 ASN A 97 43.528 0.021 11.015 1.00 0.00 H new ATOM 0 HD22 ASN A 97 43.293 0.578 9.355 1.00 0.00 H new ATOM 1617 N LYS A 98 41.074 0.467 15.043 1.00 0.00 N ATOM 1618 CA LYS A 98 40.968 0.683 16.483 1.00 0.00 C ATOM 1619 C LYS A 98 41.423 -0.543 17.261 1.00 0.00 C ATOM 1620 O LYS A 98 42.109 -0.424 18.276 1.00 0.00 O ATOM 1621 CB LYS A 98 39.530 1.031 16.860 1.00 0.00 C ATOM 1622 CG LYS A 98 39.398 2.549 16.995 1.00 0.00 C ATOM 1623 CD LYS A 98 39.808 3.214 15.679 1.00 0.00 C ATOM 1624 CE LYS A 98 39.583 4.724 15.779 1.00 0.00 C ATOM 1625 NZ LYS A 98 39.993 5.373 14.502 1.00 0.00 N ATOM 0 H LYS A 98 40.184 0.319 14.566 1.00 0.00 H new ATOM 0 HA LYS A 98 41.622 1.515 16.745 1.00 0.00 H new ATOM 0 HB2 LYS A 98 38.842 0.660 16.100 1.00 0.00 H new ATOM 0 HB3 LYS A 98 39.260 0.546 17.798 1.00 0.00 H new ATOM 0 HG2 LYS A 98 38.371 2.815 17.245 1.00 0.00 H new ATOM 0 HG3 LYS A 98 40.028 2.909 17.809 1.00 0.00 H new ATOM 0 HD2 LYS A 98 40.856 3.005 15.465 1.00 0.00 H new ATOM 0 HD3 LYS A 98 39.226 2.803 14.854 1.00 0.00 H new ATOM 0 HE2 LYS A 98 38.533 4.933 15.985 1.00 0.00 H new ATOM 0 HE3 LYS A 98 40.159 5.134 16.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 39.419 6.226 14.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 40.998 5.637 14.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 39.849 4.710 13.714 1.00 0.00 H new ATOM 1639 N LEU A 99 41.042 -1.719 16.784 1.00 0.00 N ATOM 1640 CA LEU A 99 41.427 -2.949 17.456 1.00 0.00 C ATOM 1641 C LEU A 99 42.946 -3.080 17.471 1.00 0.00 C ATOM 1642 O LEU A 99 43.541 -3.450 18.481 1.00 0.00 O ATOM 1643 CB LEU A 99 40.809 -4.155 16.747 1.00 0.00 C ATOM 1644 CG LEU A 99 39.357 -4.326 17.198 1.00 0.00 C ATOM 1645 CD1 LEU A 99 39.309 -5.224 18.435 1.00 0.00 C ATOM 1646 CD2 LEU A 99 38.763 -2.957 17.541 1.00 0.00 C ATOM 0 H LEU A 99 40.475 -1.846 15.946 1.00 0.00 H new ATOM 0 HA LEU A 99 41.060 -2.917 18.482 1.00 0.00 H new ATOM 0 HB2 LEU A 99 40.851 -4.016 15.667 1.00 0.00 H new ATOM 0 HB3 LEU A 99 41.380 -5.055 16.975 1.00 0.00 H new ATOM 0 HG LEU A 99 38.780 -4.782 16.394 1.00 0.00 H new ATOM 0 HD11 LEU A 99 38.275 -5.346 18.756 1.00 0.00 H new ATOM 0 HD12 LEU A 99 39.731 -6.199 18.193 1.00 0.00 H new ATOM 0 HD13 LEU A 99 39.887 -4.768 19.239 1.00 0.00 H new ATOM 0 HD21 LEU A 99 37.729 -3.079 17.862 1.00 0.00 H new ATOM 0 HD22 LEU A 99 39.341 -2.501 18.345 1.00 0.00 H new ATOM 0 HD23 LEU A 99 38.796 -2.315 16.661 1.00 0.00 H new ATOM 1658 N ASP A 100 43.569 -2.760 16.343 1.00 0.00 N ATOM 1659 CA ASP A 100 45.019 -2.828 16.236 1.00 0.00 C ATOM 1660 C ASP A 100 45.675 -1.837 17.193 1.00 0.00 C ATOM 1661 O ASP A 100 46.701 -2.132 17.805 1.00 0.00 O ATOM 1662 CB ASP A 100 45.452 -2.512 14.804 1.00 0.00 C ATOM 1663 CG ASP A 100 45.087 -3.670 13.881 1.00 0.00 C ATOM 1664 OD1 ASP A 100 44.753 -4.727 14.394 1.00 0.00 O ATOM 1665 OD2 ASP A 100 45.144 -3.484 12.678 1.00 0.00 O ATOM 0 H ASP A 100 43.095 -2.452 15.494 1.00 0.00 H new ATOM 0 HA ASP A 100 45.335 -3.837 16.500 1.00 0.00 H new ATOM 0 HB2 ASP A 100 44.968 -1.597 14.462 1.00 0.00 H new ATOM 0 HB3 ASP A 100 46.527 -2.335 14.771 1.00 0.00 H new ATOM 1670 N LYS A 101 45.074 -0.657 17.309 1.00 0.00 N ATOM 1671 CA LYS A 101 45.603 0.381 18.183 1.00 0.00 C ATOM 1672 C LYS A 101 45.545 -0.060 19.639 1.00 0.00 C ATOM 1673 O LYS A 101 46.463 0.203 20.416 1.00 0.00 O ATOM 1674 CB LYS A 101 44.796 1.669 18.002 1.00 0.00 C ATOM 1675 CG LYS A 101 45.051 2.238 16.605 1.00 0.00 C ATOM 1676 CD LYS A 101 46.484 2.765 16.521 1.00 0.00 C ATOM 1677 CE LYS A 101 46.724 3.374 15.138 1.00 0.00 C ATOM 1678 NZ LYS A 101 45.803 4.529 14.938 1.00 0.00 N ATOM 0 H LYS A 101 44.223 -0.397 16.810 1.00 0.00 H new ATOM 0 HA LYS A 101 46.644 0.561 17.916 1.00 0.00 H new ATOM 0 HB2 LYS A 101 43.733 1.467 18.136 1.00 0.00 H new ATOM 0 HB3 LYS A 101 45.080 2.398 18.761 1.00 0.00 H new ATOM 0 HG2 LYS A 101 44.892 1.466 15.852 1.00 0.00 H new ATOM 0 HG3 LYS A 101 44.344 3.040 16.393 1.00 0.00 H new ATOM 0 HD2 LYS A 101 46.653 3.514 17.294 1.00 0.00 H new ATOM 0 HD3 LYS A 101 47.192 1.956 16.701 1.00 0.00 H new ATOM 0 HE2 LYS A 101 47.760 3.701 15.047 1.00 0.00 H new ATOM 0 HE3 LYS A 101 46.558 2.624 14.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 46.181 5.150 14.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 44.865 4.180 14.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 45.719 5.064 15.826 1.00 0.00 H new ATOM 1692 N ILE A 102 44.458 -0.730 20.002 1.00 0.00 N ATOM 1693 CA ILE A 102 44.288 -1.200 21.368 1.00 0.00 C ATOM 1694 C ILE A 102 45.204 -2.386 21.653 1.00 0.00 C ATOM 1695 O ILE A 102 45.735 -2.518 22.755 1.00 0.00 O ATOM 1696 CB ILE A 102 42.832 -1.598 21.601 1.00 0.00 C ATOM 1697 CG1 ILE A 102 42.430 -2.680 20.599 1.00 0.00 C ATOM 1698 CG2 ILE A 102 41.933 -0.375 21.419 1.00 0.00 C ATOM 1699 CD1 ILE A 102 41.068 -3.257 20.989 1.00 0.00 C ATOM 0 H ILE A 102 43.687 -0.958 19.374 1.00 0.00 H new ATOM 0 HA ILE A 102 44.555 -0.390 22.047 1.00 0.00 H new ATOM 0 HB ILE A 102 42.720 -1.984 22.614 1.00 0.00 H new ATOM 0 HG12 ILE A 102 42.385 -2.261 19.594 1.00 0.00 H new ATOM 0 HG13 ILE A 102 43.180 -3.471 20.581 1.00 0.00 H new ATOM 0 HG21 ILE A 102 40.894 -0.659 21.585 1.00 0.00 H new ATOM 0 HG22 ILE A 102 42.218 0.396 22.135 1.00 0.00 H new ATOM 0 HG23 ILE A 102 42.046 0.012 20.406 1.00 0.00 H new ATOM 0 HD11 ILE A 102 40.782 -4.029 20.274 1.00 0.00 H new ATOM 0 HD12 ILE A 102 41.129 -3.691 21.987 1.00 0.00 H new ATOM 0 HD13 ILE A 102 40.321 -2.463 20.984 1.00 0.00 H new ATOM 1711 N ILE A 103 45.399 -3.239 20.653 1.00 0.00 N ATOM 1712 CA ILE A 103 46.271 -4.397 20.818 1.00 0.00 C ATOM 1713 C ILE A 103 47.695 -3.942 21.115 1.00 0.00 C ATOM 1714 O ILE A 103 48.352 -4.466 22.014 1.00 0.00 O ATOM 1715 CB ILE A 103 46.256 -5.258 19.554 1.00 0.00 C ATOM 1716 CG1 ILE A 103 44.887 -5.927 19.408 1.00 0.00 C ATOM 1717 CG2 ILE A 103 47.339 -6.333 19.655 1.00 0.00 C ATOM 1718 CD1 ILE A 103 44.641 -6.852 20.600 1.00 0.00 C ATOM 0 H ILE A 103 44.971 -3.153 19.731 1.00 0.00 H new ATOM 0 HA ILE A 103 45.904 -4.992 21.655 1.00 0.00 H new ATOM 0 HB ILE A 103 46.448 -4.629 18.685 1.00 0.00 H new ATOM 0 HG12 ILE A 103 44.105 -5.170 19.354 1.00 0.00 H new ATOM 0 HG13 ILE A 103 44.845 -6.495 18.479 1.00 0.00 H new ATOM 0 HG21 ILE A 103 47.328 -6.946 18.754 1.00 0.00 H new ATOM 0 HG22 ILE A 103 48.315 -5.858 19.759 1.00 0.00 H new ATOM 0 HG23 ILE A 103 47.147 -6.962 20.524 1.00 0.00 H new ATOM 0 HD11 ILE A 103 43.666 -7.328 20.496 1.00 0.00 H new ATOM 0 HD12 ILE A 103 45.417 -7.617 20.633 1.00 0.00 H new ATOM 0 HD13 ILE A 103 44.664 -6.271 21.522 1.00 0.00 H new ATOM 1730 N GLU A 104 48.161 -2.956 20.355 1.00 0.00 N ATOM 1731 CA GLU A 104 49.506 -2.426 20.545 1.00 0.00 C ATOM 1732 C GLU A 104 49.645 -1.820 21.938 1.00 0.00 C ATOM 1733 O GLU A 104 50.658 -2.012 22.612 1.00 0.00 O ATOM 1734 CB GLU A 104 49.801 -1.360 19.490 1.00 0.00 C ATOM 1735 CG GLU A 104 51.230 -0.842 19.673 1.00 0.00 C ATOM 1736 CD GLU A 104 51.552 0.191 18.599 1.00 0.00 C ATOM 1737 OE1 GLU A 104 50.685 0.459 17.783 1.00 0.00 O ATOM 1738 OE2 GLU A 104 52.660 0.702 18.609 1.00 0.00 O ATOM 0 H GLU A 104 47.631 -2.510 19.606 1.00 0.00 H new ATOM 0 HA GLU A 104 50.220 -3.243 20.441 1.00 0.00 H new ATOM 0 HB2 GLU A 104 49.680 -1.779 18.491 1.00 0.00 H new ATOM 0 HB3 GLU A 104 49.091 -0.538 19.580 1.00 0.00 H new ATOM 0 HG2 GLU A 104 51.340 -0.397 20.662 1.00 0.00 H new ATOM 0 HG3 GLU A 104 51.936 -1.670 19.616 1.00 0.00 H new ATOM 1745 N LYS A 105 48.618 -1.090 22.364 1.00 0.00 N ATOM 1746 CA LYS A 105 48.635 -0.462 23.678 1.00 0.00 C ATOM 1747 C LYS A 105 48.764 -1.523 24.766 1.00 0.00 C ATOM 1748 O LYS A 105 49.556 -1.379 25.695 1.00 0.00 O ATOM 1749 CB LYS A 105 47.346 0.337 23.890 1.00 0.00 C ATOM 1750 CG LYS A 105 47.373 1.002 25.267 1.00 0.00 C ATOM 1751 CD LYS A 105 48.539 1.990 25.334 1.00 0.00 C ATOM 1752 CE LYS A 105 48.313 3.115 24.323 1.00 0.00 C ATOM 1753 NZ LYS A 105 49.412 4.116 24.439 1.00 0.00 N ATOM 0 H LYS A 105 47.771 -0.921 21.822 1.00 0.00 H new ATOM 0 HA LYS A 105 49.490 0.211 23.734 1.00 0.00 H new ATOM 0 HB2 LYS A 105 47.243 1.093 23.112 1.00 0.00 H new ATOM 0 HB3 LYS A 105 46.481 -0.322 23.810 1.00 0.00 H new ATOM 0 HG2 LYS A 105 46.432 1.521 25.451 1.00 0.00 H new ATOM 0 HG3 LYS A 105 47.478 0.246 26.046 1.00 0.00 H new ATOM 0 HD2 LYS A 105 48.623 2.402 26.340 1.00 0.00 H new ATOM 0 HD3 LYS A 105 49.477 1.477 25.120 1.00 0.00 H new ATOM 0 HE2 LYS A 105 48.282 2.709 23.312 1.00 0.00 H new ATOM 0 HE3 LYS A 105 47.350 3.593 24.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 49.678 4.451 23.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 49.089 4.921 25.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 50.237 3.675 24.894 1.00 0.00 H new ATOM 1767 N ILE A 106 47.984 -2.590 24.632 1.00 0.00 N ATOM 1768 CA ILE A 106 48.017 -3.685 25.598 1.00 0.00 C ATOM 1769 C ILE A 106 49.384 -4.339 25.650 1.00 0.00 C ATOM 1770 O ILE A 106 49.895 -4.647 26.728 1.00 0.00 O ATOM 1771 CB ILE A 106 46.980 -4.743 25.229 1.00 0.00 C ATOM 1772 CG1 ILE A 106 45.586 -4.192 25.491 1.00 0.00 C ATOM 1773 CG2 ILE A 106 47.201 -5.994 26.079 1.00 0.00 C ATOM 1774 CD1 ILE A 106 44.542 -5.109 24.851 1.00 0.00 C ATOM 0 H ILE A 106 47.323 -2.721 23.867 1.00 0.00 H new ATOM 0 HA ILE A 106 47.792 -3.263 26.577 1.00 0.00 H new ATOM 0 HB ILE A 106 47.080 -5.000 24.175 1.00 0.00 H new ATOM 0 HG12 ILE A 106 45.410 -4.117 26.564 1.00 0.00 H new ATOM 0 HG13 ILE A 106 45.499 -3.185 25.083 1.00 0.00 H new ATOM 0 HG21 ILE A 106 46.460 -6.749 25.815 1.00 0.00 H new ATOM 0 HG22 ILE A 106 48.201 -6.387 25.895 1.00 0.00 H new ATOM 0 HG23 ILE A 106 47.100 -5.740 27.134 1.00 0.00 H new ATOM 0 HD11 ILE A 106 43.545 -4.712 25.040 1.00 0.00 H new ATOM 0 HD12 ILE A 106 44.714 -5.161 23.776 1.00 0.00 H new ATOM 0 HD13 ILE A 106 44.623 -6.108 25.280 1.00 0.00 H new ATOM 1786 N ASP A 107 49.960 -4.580 24.485 1.00 0.00 N ATOM 1787 CA ASP A 107 51.252 -5.236 24.422 1.00 0.00 C ATOM 1788 C ASP A 107 52.324 -4.422 25.143 1.00 0.00 C ATOM 1789 O ASP A 107 53.175 -4.982 25.835 1.00 0.00 O ATOM 1790 CB ASP A 107 51.662 -5.449 22.964 1.00 0.00 C ATOM 1791 CG ASP A 107 50.800 -6.536 22.333 1.00 0.00 C ATOM 1792 OD1 ASP A 107 50.123 -7.233 23.073 1.00 0.00 O ATOM 1793 OD2 ASP A 107 50.826 -6.657 21.120 1.00 0.00 O ATOM 0 H ASP A 107 49.558 -4.334 23.580 1.00 0.00 H new ATOM 0 HA ASP A 107 51.162 -6.201 24.921 1.00 0.00 H new ATOM 0 HB2 ASP A 107 51.553 -4.518 22.407 1.00 0.00 H new ATOM 0 HB3 ASP A 107 52.714 -5.731 22.911 1.00 0.00 H new ATOM 1798 N LYS A 108 52.279 -3.101 24.990 1.00 0.00 N ATOM 1799 CA LYS A 108 53.257 -2.242 25.645 1.00 0.00 C ATOM 1800 C LYS A 108 52.816 -1.949 27.072 1.00 0.00 C ATOM 1801 O LYS A 108 53.640 -1.824 27.978 1.00 0.00 O ATOM 1802 CB LYS A 108 53.407 -0.931 24.870 1.00 0.00 C ATOM 1803 CG LYS A 108 53.859 -1.232 23.439 1.00 0.00 C ATOM 1804 CD LYS A 108 55.232 -1.907 23.468 1.00 0.00 C ATOM 1805 CE LYS A 108 55.699 -2.172 22.036 1.00 0.00 C ATOM 1806 NZ LYS A 108 57.029 -2.842 22.063 1.00 0.00 N ATOM 0 H LYS A 108 51.586 -2.609 24.426 1.00 0.00 H new ATOM 0 HA LYS A 108 54.219 -2.754 25.665 1.00 0.00 H new ATOM 0 HB2 LYS A 108 52.459 -0.393 24.858 1.00 0.00 H new ATOM 0 HB3 LYS A 108 54.133 -0.285 25.364 1.00 0.00 H new ATOM 0 HG2 LYS A 108 53.134 -1.880 22.946 1.00 0.00 H new ATOM 0 HG3 LYS A 108 53.908 -0.310 22.860 1.00 0.00 H new ATOM 0 HD2 LYS A 108 55.951 -1.271 23.985 1.00 0.00 H new ATOM 0 HD3 LYS A 108 55.177 -2.843 24.023 1.00 0.00 H new ATOM 0 HE2 LYS A 108 54.975 -2.799 21.516 1.00 0.00 H new ATOM 0 HE3 LYS A 108 55.763 -1.234 21.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 57.347 -3.022 21.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 57.717 -2.228 22.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 56.953 -3.744 22.575 1.00 0.00 H new ATOM 1820 N LEU A 109 51.506 -1.850 27.259 1.00 0.00 N ATOM 1821 CA LEU A 109 50.945 -1.581 28.575 1.00 0.00 C ATOM 1822 C LEU A 109 49.498 -2.063 28.640 1.00 0.00 C ATOM 1823 O LEU A 109 48.735 -1.886 27.692 1.00 0.00 O ATOM 1824 CB LEU A 109 51.008 -0.085 28.873 1.00 0.00 C ATOM 1825 CG LEU A 109 50.345 0.696 27.738 1.00 0.00 C ATOM 1826 CD1 LEU A 109 50.064 2.127 28.200 1.00 0.00 C ATOM 1827 CD2 LEU A 109 51.281 0.729 26.529 1.00 0.00 C ATOM 0 H LEU A 109 50.814 -1.952 26.517 1.00 0.00 H new ATOM 0 HA LEU A 109 51.529 -2.118 29.322 1.00 0.00 H new ATOM 0 HB2 LEU A 109 50.506 0.129 29.816 1.00 0.00 H new ATOM 0 HB3 LEU A 109 52.045 0.230 28.986 1.00 0.00 H new ATOM 0 HG LEU A 109 49.408 0.211 27.462 1.00 0.00 H new ATOM 0 HD11 LEU A 109 49.591 2.684 27.391 1.00 0.00 H new ATOM 0 HD12 LEU A 109 49.399 2.107 29.064 1.00 0.00 H new ATOM 0 HD13 LEU A 109 51.001 2.611 28.475 1.00 0.00 H new ATOM 0 HD21 LEU A 109 50.810 1.286 25.719 1.00 0.00 H new ATOM 0 HD22 LEU A 109 52.217 1.215 26.806 1.00 0.00 H new ATOM 0 HD23 LEU A 109 51.485 -0.290 26.199 1.00 0.00 H new ATOM 1839 N ASP A 110 49.126 -2.674 29.758 1.00 0.00 N ATOM 1840 CA ASP A 110 47.767 -3.177 29.919 1.00 0.00 C ATOM 1841 C ASP A 110 46.753 -2.038 29.872 1.00 0.00 C ATOM 1842 O ASP A 110 46.986 -0.962 30.423 1.00 0.00 O ATOM 1843 CB ASP A 110 47.640 -3.919 31.250 1.00 0.00 C ATOM 1844 CG ASP A 110 48.393 -5.243 31.184 1.00 0.00 C ATOM 1845 OD1 ASP A 110 48.752 -5.644 30.089 1.00 0.00 O ATOM 1846 OD2 ASP A 110 48.599 -5.838 32.229 1.00 0.00 O ATOM 0 H ASP A 110 49.738 -2.832 30.558 1.00 0.00 H new ATOM 0 HA ASP A 110 47.559 -3.861 29.096 1.00 0.00 H new ATOM 0 HB2 ASP A 110 48.038 -3.305 32.057 1.00 0.00 H new ATOM 0 HB3 ASP A 110 46.589 -4.100 31.476 1.00 0.00 H new ATOM 1851 N LEU A 111 45.622 -2.291 29.220 1.00 0.00 N ATOM 1852 CA LEU A 111 44.566 -1.290 29.114 1.00 0.00 C ATOM 1853 C LEU A 111 43.907 -1.084 30.472 1.00 0.00 C ATOM 1854 O LEU A 111 43.301 -0.045 30.734 1.00 0.00 O ATOM 1855 CB LEU A 111 43.517 -1.733 28.094 1.00 0.00 C ATOM 1856 CG LEU A 111 44.129 -1.712 26.693 1.00 0.00 C ATOM 1857 CD1 LEU A 111 43.153 -2.345 25.699 1.00 0.00 C ATOM 1858 CD2 LEU A 111 44.408 -0.265 26.282 1.00 0.00 C ATOM 0 H LEU A 111 45.414 -3.177 28.759 1.00 0.00 H new ATOM 0 HA LEU A 111 45.007 -0.350 28.782 1.00 0.00 H new ATOM 0 HB2 LEU A 111 43.163 -2.736 28.333 1.00 0.00 H new ATOM 0 HB3 LEU A 111 42.652 -1.071 28.135 1.00 0.00 H new ATOM 0 HG LEU A 111 45.061 -2.277 26.695 1.00 0.00 H new ATOM 0 HD11 LEU A 111 43.590 -2.330 24.700 1.00 0.00 H new ATOM 0 HD12 LEU A 111 42.953 -3.376 25.992 1.00 0.00 H new ATOM 0 HD13 LEU A 111 42.220 -1.781 25.696 1.00 0.00 H new ATOM 0 HD21 LEU A 111 44.844 -0.248 25.283 1.00 0.00 H new ATOM 0 HD22 LEU A 111 43.475 0.299 26.280 1.00 0.00 H new ATOM 0 HD23 LEU A 111 45.103 0.187 26.990 1.00 0.00 H new ATOM 1870 N ASP A 112 44.031 -2.090 31.330 1.00 0.00 N ATOM 1871 CA ASP A 112 43.447 -2.030 32.664 1.00 0.00 C ATOM 1872 C ASP A 112 44.050 -0.875 33.457 1.00 0.00 C ATOM 1873 O ASP A 112 43.445 -0.377 34.405 1.00 0.00 O ATOM 1874 CB ASP A 112 43.700 -3.345 33.402 1.00 0.00 C ATOM 1875 CG ASP A 112 42.844 -4.454 32.799 1.00 0.00 C ATOM 1876 OD1 ASP A 112 41.937 -4.132 32.048 1.00 0.00 O ATOM 1877 OD2 ASP A 112 43.110 -5.606 33.096 1.00 0.00 O ATOM 0 H ASP A 112 44.530 -2.956 31.126 1.00 0.00 H new ATOM 0 HA ASP A 112 42.373 -1.869 32.567 1.00 0.00 H new ATOM 0 HB2 ASP A 112 44.755 -3.612 33.336 1.00 0.00 H new ATOM 0 HB3 ASP A 112 43.466 -3.229 34.460 1.00 0.00 H new ATOM 1882 N LYS A 113 45.243 -0.449 33.055 1.00 0.00 N ATOM 1883 CA LYS A 113 45.916 0.654 33.728 1.00 0.00 C ATOM 1884 C LYS A 113 45.109 1.931 33.566 1.00 0.00 C ATOM 1885 O LYS A 113 44.990 2.731 34.493 1.00 0.00 O ATOM 1886 CB LYS A 113 47.305 0.862 33.126 1.00 0.00 C ATOM 1887 CG LYS A 113 48.226 -0.283 33.553 1.00 0.00 C ATOM 1888 CD LYS A 113 49.560 -0.166 32.813 1.00 0.00 C ATOM 1889 CE LYS A 113 50.291 1.095 33.277 1.00 0.00 C ATOM 1890 NZ LYS A 113 51.617 1.177 32.600 1.00 0.00 N ATOM 0 H LYS A 113 45.760 -0.848 32.272 1.00 0.00 H new ATOM 0 HA LYS A 113 46.009 0.412 34.787 1.00 0.00 H new ATOM 0 HB2 LYS A 113 47.239 0.903 32.039 1.00 0.00 H new ATOM 0 HB3 LYS A 113 47.717 1.816 33.456 1.00 0.00 H new ATOM 0 HG2 LYS A 113 48.391 -0.249 34.630 1.00 0.00 H new ATOM 0 HG3 LYS A 113 47.758 -1.242 33.332 1.00 0.00 H new ATOM 0 HD2 LYS A 113 50.173 -1.046 33.005 1.00 0.00 H new ATOM 0 HD3 LYS A 113 49.389 -0.125 31.737 1.00 0.00 H new ATOM 0 HE2 LYS A 113 49.697 1.979 33.045 1.00 0.00 H new ATOM 0 HE3 LYS A 113 50.423 1.075 34.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 52.115 2.034 32.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 52.183 0.339 32.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 51.479 1.215 31.570 1.00 0.00 H new ATOM 1904 N TYR A 114 44.556 2.104 32.377 1.00 0.00 N ATOM 1905 CA TYR A 114 43.754 3.277 32.081 1.00 0.00 C ATOM 1906 C TYR A 114 42.365 3.128 32.687 1.00 0.00 C ATOM 1907 O TYR A 114 41.875 2.014 32.857 1.00 0.00 O ATOM 1908 CB TYR A 114 43.627 3.442 30.571 1.00 0.00 C ATOM 1909 CG TYR A 114 44.988 3.663 29.961 1.00 0.00 C ATOM 1910 CD1 TYR A 114 45.591 2.644 29.217 1.00 0.00 C ATOM 1911 CD2 TYR A 114 45.644 4.888 30.134 1.00 0.00 C ATOM 1912 CE1 TYR A 114 46.851 2.847 28.647 1.00 0.00 C ATOM 1913 CE2 TYR A 114 46.905 5.091 29.564 1.00 0.00 C ATOM 1914 CZ TYR A 114 47.509 4.070 28.820 1.00 0.00 C ATOM 1915 OH TYR A 114 48.751 4.271 28.256 1.00 0.00 O ATOM 0 H TYR A 114 44.648 1.447 31.602 1.00 0.00 H new ATOM 0 HA TYR A 114 44.241 4.154 32.508 1.00 0.00 H new ATOM 0 HB2 TYR A 114 43.165 2.555 30.137 1.00 0.00 H new ATOM 0 HB3 TYR A 114 42.975 4.285 30.342 1.00 0.00 H new ATOM 0 HD1 TYR A 114 45.083 1.700 29.083 1.00 0.00 H new ATOM 0 HD2 TYR A 114 45.177 5.675 30.707 1.00 0.00 H new ATOM 0 HE1 TYR A 114 47.317 2.060 28.073 1.00 0.00 H new ATOM 0 HE2 TYR A 114 47.413 6.035 29.698 1.00 0.00 H new ATOM 0 HH TYR A 114 49.038 5.194 28.417 1.00 0.00 H new ATOM 1925 N ARG A 115 41.734 4.248 33.014 1.00 0.00 N ATOM 1926 CA ARG A 115 40.399 4.206 33.599 1.00 0.00 C ATOM 1927 C ARG A 115 39.347 4.630 32.577 1.00 0.00 C ATOM 1928 O ARG A 115 38.186 4.234 32.671 1.00 0.00 O ATOM 1929 CB ARG A 115 40.331 5.122 34.819 1.00 0.00 C ATOM 1930 CG ARG A 115 41.370 4.678 35.851 1.00 0.00 C ATOM 1931 CD ARG A 115 41.022 3.277 36.354 1.00 0.00 C ATOM 1932 NE ARG A 115 41.938 2.880 37.418 1.00 0.00 N ATOM 1933 CZ ARG A 115 41.872 1.671 37.966 1.00 0.00 C ATOM 1934 NH1 ARG A 115 40.977 0.815 37.552 1.00 0.00 N ATOM 1935 NH2 ARG A 115 42.701 1.339 38.918 1.00 0.00 N ATOM 0 H ARG A 115 42.117 5.185 32.887 1.00 0.00 H new ATOM 0 HA ARG A 115 40.193 3.181 33.906 1.00 0.00 H new ATOM 0 HB2 ARG A 115 40.516 6.154 34.522 1.00 0.00 H new ATOM 0 HB3 ARG A 115 39.333 5.090 35.256 1.00 0.00 H new ATOM 0 HG2 ARG A 115 42.365 4.679 35.405 1.00 0.00 H new ATOM 0 HG3 ARG A 115 41.393 5.380 36.685 1.00 0.00 H new ATOM 0 HD2 ARG A 115 39.996 3.260 36.722 1.00 0.00 H new ATOM 0 HD3 ARG A 115 41.078 2.564 35.532 1.00 0.00 H new ATOM 0 HE ARG A 115 42.641 3.542 37.747 1.00 0.00 H new ATOM 0 HH11 ARG A 115 40.329 1.074 36.808 1.00 0.00 H new ATOM 0 HH12 ARG A 115 40.926 -0.113 37.972 1.00 0.00 H new ATOM 0 HH21 ARG A 115 43.400 2.008 39.242 1.00 0.00 H new ATOM 0 HH22 ARG A 115 42.650 0.411 39.338 1.00 0.00 H new ATOM 1949 N PHE A 116 39.758 5.436 31.598 1.00 0.00 N ATOM 1950 CA PHE A 116 38.827 5.898 30.568 1.00 0.00 C ATOM 1951 C PHE A 116 39.518 6.018 29.218 1.00 0.00 C ATOM 1952 O PHE A 116 40.546 6.682 29.090 1.00 0.00 O ATOM 1953 CB PHE A 116 38.241 7.254 30.962 1.00 0.00 C ATOM 1954 CG PHE A 116 37.291 7.722 29.885 1.00 0.00 C ATOM 1955 CD1 PHE A 116 35.995 7.197 29.818 1.00 0.00 C ATOM 1956 CD2 PHE A 116 37.707 8.682 28.955 1.00 0.00 C ATOM 1957 CE1 PHE A 116 35.115 7.630 28.819 1.00 0.00 C ATOM 1958 CE2 PHE A 116 36.827 9.116 27.956 1.00 0.00 C ATOM 1959 CZ PHE A 116 35.531 8.591 27.888 1.00 0.00 C ATOM 0 H PHE A 116 40.713 5.778 31.496 1.00 0.00 H new ATOM 0 HA PHE A 116 38.027 5.163 30.484 1.00 0.00 H new ATOM 0 HB2 PHE A 116 37.717 7.173 31.914 1.00 0.00 H new ATOM 0 HB3 PHE A 116 39.040 7.982 31.099 1.00 0.00 H new ATOM 0 HD1 PHE A 116 35.674 6.458 30.537 1.00 0.00 H new ATOM 0 HD2 PHE A 116 38.706 9.088 29.008 1.00 0.00 H new ATOM 0 HE1 PHE A 116 34.116 7.223 28.766 1.00 0.00 H new ATOM 0 HE2 PHE A 116 37.148 9.856 27.238 1.00 0.00 H new ATOM 0 HZ PHE A 116 34.852 8.927 27.118 1.00 0.00 H new ATOM 1969 N ILE A 117 38.932 5.381 28.211 1.00 0.00 N ATOM 1970 CA ILE A 117 39.485 5.433 26.867 1.00 0.00 C ATOM 1971 C ILE A 117 38.404 5.779 25.863 1.00 0.00 C ATOM 1972 O ILE A 117 37.293 5.251 25.919 1.00 0.00 O ATOM 1973 CB ILE A 117 40.129 4.103 26.504 1.00 0.00 C ATOM 1974 CG1 ILE A 117 41.606 4.172 26.873 1.00 0.00 C ATOM 1975 CG2 ILE A 117 39.987 3.858 25.001 1.00 0.00 C ATOM 1976 CD1 ILE A 117 41.762 3.994 28.381 1.00 0.00 C ATOM 0 H ILE A 117 38.080 4.827 28.300 1.00 0.00 H new ATOM 0 HA ILE A 117 40.249 6.210 26.841 1.00 0.00 H new ATOM 0 HB ILE A 117 39.643 3.289 27.042 1.00 0.00 H new ATOM 0 HG12 ILE A 117 42.160 3.396 26.345 1.00 0.00 H new ATOM 0 HG13 ILE A 117 42.025 5.130 26.564 1.00 0.00 H new ATOM 0 HG21 ILE A 117 40.449 2.905 24.742 1.00 0.00 H new ATOM 0 HG22 ILE A 117 38.930 3.833 24.735 1.00 0.00 H new ATOM 0 HG23 ILE A 117 40.481 4.661 24.453 1.00 0.00 H new ATOM 0 HD11 ILE A 117 42.818 4.043 28.646 1.00 0.00 H new ATOM 0 HD12 ILE A 117 41.221 4.786 28.899 1.00 0.00 H new ATOM 0 HD13 ILE A 117 41.359 3.026 28.677 1.00 0.00 H new ATOM 1988 N ASN A 118 38.730 6.683 24.954 1.00 0.00 N ATOM 1989 CA ASN A 118 37.771 7.112 23.956 1.00 0.00 C ATOM 1990 C ASN A 118 38.411 7.168 22.572 1.00 0.00 C ATOM 1991 O ASN A 118 39.257 8.021 22.301 1.00 0.00 O ATOM 1992 CB ASN A 118 37.252 8.488 24.350 1.00 0.00 C ATOM 1993 CG ASN A 118 36.046 8.866 23.498 1.00 0.00 C ATOM 1994 OD1 ASN A 118 35.191 8.025 23.221 1.00 0.00 O ATOM 1995 ND2 ASN A 118 35.931 10.089 23.058 1.00 0.00 N ATOM 0 H ASN A 118 39.645 7.130 24.888 1.00 0.00 H new ATOM 0 HA ASN A 118 36.950 6.397 23.911 1.00 0.00 H new ATOM 0 HB2 ASN A 118 36.975 8.491 25.404 1.00 0.00 H new ATOM 0 HB3 ASN A 118 38.040 9.230 24.225 1.00 0.00 H new ATOM 0 HD21 ASN A 118 35.131 10.351 22.482 1.00 0.00 H new ATOM 0 HD22 ASN A 118 36.641 10.783 23.290 1.00 0.00 H new ATOM 2002 N ALA A 119 37.995 6.252 21.701 1.00 0.00 N ATOM 2003 CA ALA A 119 38.523 6.198 20.344 1.00 0.00 C ATOM 2004 C ALA A 119 37.776 7.175 19.441 1.00 0.00 C ATOM 2005 O ALA A 119 36.594 7.445 19.648 1.00 0.00 O ATOM 2006 CB ALA A 119 38.393 4.780 19.785 1.00 0.00 C ATOM 0 H ALA A 119 37.296 5.540 21.912 1.00 0.00 H new ATOM 0 HA ALA A 119 39.576 6.478 20.373 1.00 0.00 H new ATOM 0 HB1 ALA A 119 38.791 4.751 18.770 1.00 0.00 H new ATOM 0 HB2 ALA A 119 38.953 4.088 20.414 1.00 0.00 H new ATOM 0 HB3 ALA A 119 37.343 4.489 19.772 1.00 0.00 H new ATOM 2012 N THR A 120 38.475 7.698 18.441 1.00 0.00 N ATOM 2013 CA THR A 120 37.867 8.643 17.513 1.00 0.00 C ATOM 2014 C THR A 120 38.119 8.213 16.071 1.00 0.00 C ATOM 2015 O THR A 120 39.014 7.411 15.800 1.00 0.00 O ATOM 2016 CB THR A 120 38.438 10.044 17.744 1.00 0.00 C ATOM 2017 OG1 THR A 120 39.830 10.039 17.461 1.00 0.00 O ATOM 2018 CG2 THR A 120 38.216 10.452 19.201 1.00 0.00 C ATOM 0 H THR A 120 39.455 7.486 18.253 1.00 0.00 H new ATOM 0 HA THR A 120 36.792 8.660 17.690 1.00 0.00 H new ATOM 0 HB THR A 120 37.935 10.754 17.088 1.00 0.00 H new ATOM 0 HG1 THR A 120 40.305 10.555 18.145 1.00 0.00 H new ATOM 0 HG21 THR A 120 38.623 11.450 19.365 1.00 0.00 H new ATOM 0 HG22 THR A 120 37.148 10.455 19.419 1.00 0.00 H new ATOM 0 HG23 THR A 120 38.719 9.742 19.858 1.00 0.00 H new ATOM 2026 N ASN A 121 37.321 8.744 15.151 1.00 0.00 N ATOM 2027 CA ASN A 121 37.460 8.403 13.739 1.00 0.00 C ATOM 2028 C ASN A 121 38.933 8.353 13.341 1.00 0.00 C ATOM 2029 O ASN A 121 39.813 8.675 14.141 1.00 0.00 O ATOM 2030 CB ASN A 121 36.730 9.434 12.877 1.00 0.00 C ATOM 2031 CG ASN A 121 36.420 8.840 11.507 1.00 0.00 C ATOM 2032 OD1 ASN A 121 36.150 7.644 11.395 1.00 0.00 O ATOM 2033 ND2 ASN A 121 36.439 9.610 10.454 1.00 0.00 N ATOM 0 H ASN A 121 36.575 9.409 15.355 1.00 0.00 H new ATOM 0 HA ASN A 121 37.019 7.419 13.578 1.00 0.00 H new ATOM 0 HB2 ASN A 121 35.806 9.742 13.367 1.00 0.00 H new ATOM 0 HB3 ASN A 121 37.344 10.327 12.765 1.00 0.00 H new ATOM 0 HD21 ASN A 121 36.230 9.222 9.534 1.00 0.00 H new ATOM 0 HD22 ASN A 121 36.663 10.600 10.550 1.00 0.00 H new ATOM 2040 N LEU A 122 39.196 7.936 12.106 1.00 0.00 N ATOM 2041 CA LEU A 122 40.568 7.836 11.621 1.00 0.00 C ATOM 2042 C LEU A 122 41.248 9.201 11.637 1.00 0.00 C ATOM 2043 O LEU A 122 42.418 9.315 12.001 1.00 0.00 O ATOM 2044 CB LEU A 122 40.578 7.277 10.197 1.00 0.00 C ATOM 2045 CG LEU A 122 40.162 5.805 10.228 1.00 0.00 C ATOM 2046 CD1 LEU A 122 39.957 5.303 8.798 1.00 0.00 C ATOM 2047 CD2 LEU A 122 41.260 4.982 10.905 1.00 0.00 C ATOM 0 H LEU A 122 38.484 7.664 11.428 1.00 0.00 H new ATOM 0 HA LEU A 122 41.116 7.164 12.281 1.00 0.00 H new ATOM 0 HB2 LEU A 122 39.896 7.846 9.566 1.00 0.00 H new ATOM 0 HB3 LEU A 122 41.572 7.377 9.762 1.00 0.00 H new ATOM 0 HG LEU A 122 39.231 5.701 10.786 1.00 0.00 H new ATOM 0 HD11 LEU A 122 39.661 4.254 8.820 1.00 0.00 H new ATOM 0 HD12 LEU A 122 39.177 5.891 8.314 1.00 0.00 H new ATOM 0 HD13 LEU A 122 40.887 5.406 8.239 1.00 0.00 H new ATOM 0 HD21 LEU A 122 40.966 3.933 10.928 1.00 0.00 H new ATOM 0 HD22 LEU A 122 42.190 5.086 10.346 1.00 0.00 H new ATOM 0 HD23 LEU A 122 41.407 5.340 11.924 1.00 0.00 H new ATOM 2059 N GLU A 123 40.509 10.236 11.253 1.00 0.00 N ATOM 2060 CA GLU A 123 41.062 11.584 11.244 1.00 0.00 C ATOM 2061 C GLU A 123 41.357 12.033 12.671 1.00 0.00 C ATOM 2062 O GLU A 123 42.327 12.747 12.924 1.00 0.00 O ATOM 2063 CB GLU A 123 40.076 12.554 10.592 1.00 0.00 C ATOM 2064 CG GLU A 123 39.985 12.260 9.093 1.00 0.00 C ATOM 2065 CD GLU A 123 39.025 11.101 8.845 1.00 0.00 C ATOM 2066 OE1 GLU A 123 38.478 10.595 9.810 1.00 0.00 O ATOM 2067 OE2 GLU A 123 38.853 10.737 7.694 1.00 0.00 O ATOM 0 H GLU A 123 39.538 10.169 10.948 1.00 0.00 H new ATOM 0 HA GLU A 123 41.988 11.580 10.669 1.00 0.00 H new ATOM 0 HB2 GLU A 123 39.093 12.455 11.053 1.00 0.00 H new ATOM 0 HB3 GLU A 123 40.401 13.582 10.753 1.00 0.00 H new ATOM 0 HG2 GLU A 123 39.642 13.147 8.560 1.00 0.00 H new ATOM 0 HG3 GLU A 123 40.972 12.015 8.702 1.00 0.00 H new ATOM 2074 N HIS A 124 40.511 11.598 13.598 1.00 0.00 N ATOM 2075 CA HIS A 124 40.679 11.945 15.003 1.00 0.00 C ATOM 2076 C HIS A 124 41.583 10.932 15.700 1.00 0.00 C ATOM 2077 O HIS A 124 41.685 9.780 15.277 1.00 0.00 O ATOM 2078 CB HIS A 124 39.318 11.983 15.696 1.00 0.00 C ATOM 2079 CG HIS A 124 38.528 13.157 15.185 1.00 0.00 C ATOM 2080 ND1 HIS A 124 37.186 13.333 15.485 1.00 0.00 N ATOM 2081 CD2 HIS A 124 38.878 14.224 14.396 1.00 0.00 C ATOM 2082 CE1 HIS A 124 36.781 14.467 14.885 1.00 0.00 C ATOM 2083 NE2 HIS A 124 37.773 15.050 14.207 1.00 0.00 N ATOM 0 H HIS A 124 39.704 11.006 13.402 1.00 0.00 H new ATOM 0 HA HIS A 124 41.143 12.929 15.064 1.00 0.00 H new ATOM 0 HB2 HIS A 124 38.776 11.056 15.507 1.00 0.00 H new ATOM 0 HB3 HIS A 124 39.449 12.061 16.775 1.00 0.00 H new ATOM 0 HD2 HIS A 124 39.861 14.397 13.984 1.00 0.00 H new ATOM 0 HE1 HIS A 124 35.776 14.858 14.944 1.00 0.00 H new ATOM 0 HE2 HIS A 124 37.730 15.914 13.667 1.00 0.00 H new ATOM 2091 N ASP A 125 42.240 11.370 16.769 1.00 0.00 N ATOM 2092 CA ASP A 125 43.138 10.497 17.518 1.00 0.00 C ATOM 2093 C ASP A 125 42.449 9.950 18.765 1.00 0.00 C ATOM 2094 O ASP A 125 41.414 10.463 19.192 1.00 0.00 O ATOM 2095 CB ASP A 125 44.395 11.269 17.924 1.00 0.00 C ATOM 2096 CG ASP A 125 45.259 11.540 16.697 1.00 0.00 C ATOM 2097 OD1 ASP A 125 45.003 10.932 15.671 1.00 0.00 O ATOM 2098 OD2 ASP A 125 46.164 12.350 16.802 1.00 0.00 O ATOM 0 H ASP A 125 42.169 12.319 17.135 1.00 0.00 H new ATOM 0 HA ASP A 125 43.414 9.659 16.877 1.00 0.00 H new ATOM 0 HB2 ASP A 125 44.117 12.210 18.398 1.00 0.00 H new ATOM 0 HB3 ASP A 125 44.962 10.697 18.659 1.00 0.00 H new ATOM 2103 N ILE A 126 43.037 8.908 19.347 1.00 0.00 N ATOM 2104 CA ILE A 126 42.480 8.295 20.549 1.00 0.00 C ATOM 2105 C ILE A 126 43.375 8.599 21.745 1.00 0.00 C ATOM 2106 O ILE A 126 44.600 8.618 21.624 1.00 0.00 O ATOM 2107 CB ILE A 126 42.370 6.780 20.362 1.00 0.00 C ATOM 2108 CG1 ILE A 126 41.645 6.166 21.563 1.00 0.00 C ATOM 2109 CG2 ILE A 126 43.772 6.176 20.253 1.00 0.00 C ATOM 2110 CD1 ILE A 126 41.248 4.724 21.238 1.00 0.00 C ATOM 0 H ILE A 126 43.895 8.472 19.008 1.00 0.00 H new ATOM 0 HA ILE A 126 41.486 8.706 20.727 1.00 0.00 H new ATOM 0 HB ILE A 126 41.809 6.568 19.452 1.00 0.00 H new ATOM 0 HG12 ILE A 126 42.291 6.187 22.441 1.00 0.00 H new ATOM 0 HG13 ILE A 126 40.759 6.753 21.805 1.00 0.00 H new ATOM 0 HG21 ILE A 126 43.694 5.097 20.120 1.00 0.00 H new ATOM 0 HG22 ILE A 126 44.290 6.611 19.398 1.00 0.00 H new ATOM 0 HG23 ILE A 126 44.332 6.390 21.163 1.00 0.00 H new ATOM 0 HD11 ILE A 126 40.732 4.287 22.093 1.00 0.00 H new ATOM 0 HD12 ILE A 126 40.587 4.715 20.372 1.00 0.00 H new ATOM 0 HD13 ILE A 126 42.142 4.141 21.018 1.00 0.00 H new ATOM 2122 N LYS A 127 42.760 8.855 22.895 1.00 0.00 N ATOM 2123 CA LYS A 127 43.525 9.176 24.095 1.00 0.00 C ATOM 2124 C LYS A 127 43.089 8.319 25.276 1.00 0.00 C ATOM 2125 O LYS A 127 41.946 7.865 25.345 1.00 0.00 O ATOM 2126 CB LYS A 127 43.336 10.653 24.444 1.00 0.00 C ATOM 2127 CG LYS A 127 41.867 11.036 24.258 1.00 0.00 C ATOM 2128 CD LYS A 127 41.647 11.538 22.829 1.00 0.00 C ATOM 2129 CE LYS A 127 42.336 12.892 22.651 1.00 0.00 C ATOM 2130 NZ LYS A 127 42.055 13.417 21.285 1.00 0.00 N ATOM 0 H LYS A 127 41.748 8.847 23.022 1.00 0.00 H new ATOM 0 HA LYS A 127 44.576 8.970 23.891 1.00 0.00 H new ATOM 0 HB2 LYS A 127 43.643 10.837 25.473 1.00 0.00 H new ATOM 0 HB3 LYS A 127 43.968 11.272 23.807 1.00 0.00 H new ATOM 0 HG2 LYS A 127 41.228 10.175 24.455 1.00 0.00 H new ATOM 0 HG3 LYS A 127 41.589 11.810 24.973 1.00 0.00 H new ATOM 0 HD2 LYS A 127 42.046 10.818 22.114 1.00 0.00 H new ATOM 0 HD3 LYS A 127 40.580 11.631 22.625 1.00 0.00 H new ATOM 0 HE2 LYS A 127 41.979 13.595 23.403 1.00 0.00 H new ATOM 0 HE3 LYS A 127 43.411 12.787 22.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 42.523 14.338 21.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 42.416 12.748 20.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 41.029 13.532 21.162 1.00 0.00 H new ATOM 2144 N CYS A 128 44.015 8.105 26.207 1.00 0.00 N ATOM 2145 CA CYS A 128 43.733 7.306 27.392 1.00 0.00 C ATOM 2146 C CYS A 128 44.023 8.113 28.655 1.00 0.00 C ATOM 2147 O CYS A 128 44.924 8.952 28.669 1.00 0.00 O ATOM 2148 CB CYS A 128 44.600 6.044 27.385 1.00 0.00 C ATOM 2149 SG CYS A 128 44.251 5.075 25.897 1.00 0.00 S ATOM 0 H CYS A 128 44.965 8.474 26.162 1.00 0.00 H new ATOM 0 HA CYS A 128 42.680 7.026 27.382 1.00 0.00 H new ATOM 0 HB2 CYS A 128 45.655 6.316 27.415 1.00 0.00 H new ATOM 0 HB3 CYS A 128 44.399 5.448 28.275 1.00 0.00 H new ATOM 0 HG CYS A 128 44.990 4.005 25.892 1.00 0.00 H new ATOM 2155 N TYR A 129 43.266 7.850 29.715 1.00 0.00 N ATOM 2156 CA TYR A 129 43.466 8.557 30.975 1.00 0.00 C ATOM 2157 C TYR A 129 43.876 7.576 32.067 1.00 0.00 C ATOM 2158 O TYR A 129 43.287 6.502 32.197 1.00 0.00 O ATOM 2159 CB TYR A 129 42.178 9.275 31.385 1.00 0.00 C ATOM 2160 CG TYR A 129 41.830 10.315 30.347 1.00 0.00 C ATOM 2161 CD1 TYR A 129 40.979 9.987 29.285 1.00 0.00 C ATOM 2162 CD2 TYR A 129 42.359 11.608 30.447 1.00 0.00 C ATOM 2163 CE1 TYR A 129 40.657 10.952 28.323 1.00 0.00 C ATOM 2164 CE2 TYR A 129 42.038 12.572 29.483 1.00 0.00 C ATOM 2165 CZ TYR A 129 41.187 12.244 28.422 1.00 0.00 C ATOM 2166 OH TYR A 129 40.869 13.194 27.473 1.00 0.00 O ATOM 0 H TYR A 129 42.515 7.159 29.728 1.00 0.00 H new ATOM 0 HA TYR A 129 44.258 9.293 30.840 1.00 0.00 H new ATOM 0 HB2 TYR A 129 41.364 8.557 31.483 1.00 0.00 H new ATOM 0 HB3 TYR A 129 42.306 9.747 32.359 1.00 0.00 H new ATOM 0 HD1 TYR A 129 40.571 8.990 29.208 1.00 0.00 H new ATOM 0 HD2 TYR A 129 43.014 11.862 31.267 1.00 0.00 H new ATOM 0 HE1 TYR A 129 39.999 10.700 27.504 1.00 0.00 H new ATOM 0 HE2 TYR A 129 42.447 13.569 29.559 1.00 0.00 H new ATOM 0 HH TYR A 129 41.113 14.083 27.806 1.00 0.00 H new ATOM 2176 N TYR A 130 44.891 7.945 32.847 1.00 0.00 N ATOM 2177 CA TYR A 130 45.366 7.069 33.917 1.00 0.00 C ATOM 2178 C TYR A 130 44.288 6.864 34.980 1.00 0.00 C ATOM 2179 O TYR A 130 44.097 5.752 35.474 1.00 0.00 O ATOM 2180 CB TYR A 130 46.615 7.668 34.566 1.00 0.00 C ATOM 2181 CG TYR A 130 47.778 7.567 33.608 1.00 0.00 C ATOM 2182 CD1 TYR A 130 48.042 8.613 32.716 1.00 0.00 C ATOM 2183 CD2 TYR A 130 48.591 6.427 33.611 1.00 0.00 C ATOM 2184 CE1 TYR A 130 49.120 8.520 31.828 1.00 0.00 C ATOM 2185 CE2 TYR A 130 49.669 6.334 32.723 1.00 0.00 C ATOM 2186 CZ TYR A 130 49.934 7.381 31.831 1.00 0.00 C ATOM 2187 OH TYR A 130 50.996 7.290 30.955 1.00 0.00 O ATOM 0 H TYR A 130 45.393 8.829 32.761 1.00 0.00 H new ATOM 0 HA TYR A 130 45.608 6.101 33.478 1.00 0.00 H new ATOM 0 HB2 TYR A 130 46.437 8.711 34.829 1.00 0.00 H new ATOM 0 HB3 TYR A 130 46.846 7.140 35.492 1.00 0.00 H new ATOM 0 HD1 TYR A 130 47.414 9.492 32.713 1.00 0.00 H new ATOM 0 HD2 TYR A 130 48.386 5.620 34.298 1.00 0.00 H new ATOM 0 HE1 TYR A 130 49.324 9.327 31.140 1.00 0.00 H new ATOM 0 HE2 TYR A 130 50.296 5.455 32.726 1.00 0.00 H new ATOM 0 HH TYR A 130 51.458 6.436 31.089 1.00 0.00 H new ATOM 2197 N LYS A 131 43.584 7.937 35.324 1.00 0.00 N ATOM 2198 CA LYS A 131 42.526 7.855 36.327 1.00 0.00 C ATOM 2199 C LYS A 131 41.162 8.075 35.681 1.00 0.00 C ATOM 2200 O LYS A 131 40.143 8.157 36.366 1.00 0.00 O ATOM 2201 CB LYS A 131 42.753 8.911 37.411 1.00 0.00 C ATOM 2202 CG LYS A 131 44.134 8.711 38.041 1.00 0.00 C ATOM 2203 CD LYS A 131 44.195 7.339 38.715 1.00 0.00 C ATOM 2204 CE LYS A 131 45.563 7.157 39.375 1.00 0.00 C ATOM 2205 NZ LYS A 131 45.629 5.816 40.021 1.00 0.00 N ATOM 0 H LYS A 131 43.724 8.866 34.928 1.00 0.00 H new ATOM 0 HA LYS A 131 42.550 6.862 36.775 1.00 0.00 H new ATOM 0 HB2 LYS A 131 42.679 9.910 36.981 1.00 0.00 H new ATOM 0 HB3 LYS A 131 41.979 8.835 38.175 1.00 0.00 H new ATOM 0 HG2 LYS A 131 44.908 8.787 37.277 1.00 0.00 H new ATOM 0 HG3 LYS A 131 44.329 9.496 38.772 1.00 0.00 H new ATOM 0 HD2 LYS A 131 43.405 7.253 39.461 1.00 0.00 H new ATOM 0 HD3 LYS A 131 44.026 6.552 37.979 1.00 0.00 H new ATOM 0 HE2 LYS A 131 46.353 7.253 38.631 1.00 0.00 H new ATOM 0 HE3 LYS A 131 45.727 7.938 40.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 46.559 5.692 40.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 44.884 5.741 40.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 45.490 5.077 39.302 1.00 0.00 H new ATOM 2219 N GLY A 132 41.159 8.187 34.359 1.00 0.00 N ATOM 2220 CA GLY A 132 39.926 8.418 33.617 1.00 0.00 C ATOM 2221 C GLY A 132 39.717 9.913 33.438 1.00 0.00 C ATOM 2222 O GLY A 132 38.916 10.355 32.615 1.00 0.00 O ATOM 0 H GLY A 132 41.995 8.122 33.779 1.00 0.00 H new ATOM 0 HA2 GLY A 132 39.976 7.928 32.645 1.00 0.00 H new ATOM 0 HA3 GLY A 132 39.081 7.983 34.150 1.00 0.00 H new ATOM 2226 N PHE A 133 40.476 10.678 34.209 1.00 0.00 N ATOM 2227 CA PHE A 133 40.424 12.128 34.145 1.00 0.00 C ATOM 2228 C PHE A 133 41.676 12.694 34.799 1.00 0.00 C ATOM 2229 O PHE A 133 41.891 12.513 35.998 1.00 0.00 O ATOM 2230 CB PHE A 133 39.178 12.644 34.868 1.00 0.00 C ATOM 2231 CG PHE A 133 39.101 14.143 34.724 1.00 0.00 C ATOM 2232 CD1 PHE A 133 38.639 14.703 33.528 1.00 0.00 C ATOM 2233 CD2 PHE A 133 39.488 14.972 35.782 1.00 0.00 C ATOM 2234 CE1 PHE A 133 38.564 16.094 33.389 1.00 0.00 C ATOM 2235 CE2 PHE A 133 39.414 16.363 35.645 1.00 0.00 C ATOM 2236 CZ PHE A 133 38.952 16.924 34.448 1.00 0.00 C ATOM 0 H PHE A 133 41.140 10.313 34.891 1.00 0.00 H new ATOM 0 HA PHE A 133 40.375 12.446 33.104 1.00 0.00 H new ATOM 0 HB2 PHE A 133 38.284 12.181 34.451 1.00 0.00 H new ATOM 0 HB3 PHE A 133 39.216 12.370 35.922 1.00 0.00 H new ATOM 0 HD1 PHE A 133 38.340 14.062 32.712 1.00 0.00 H new ATOM 0 HD2 PHE A 133 39.844 14.539 36.705 1.00 0.00 H new ATOM 0 HE1 PHE A 133 38.207 16.527 32.466 1.00 0.00 H new ATOM 0 HE2 PHE A 133 39.713 17.003 36.462 1.00 0.00 H new ATOM 0 HZ PHE A 133 38.895 17.997 34.342 1.00 0.00 H new ATOM 2246 N LYS A 134 42.508 13.363 34.012 1.00 0.00 N ATOM 2247 CA LYS A 134 43.744 13.926 34.540 1.00 0.00 C ATOM 2248 C LYS A 134 44.582 14.525 33.418 1.00 0.00 C ATOM 2249 O LYS A 134 44.347 14.255 32.241 1.00 0.00 O ATOM 2250 CB LYS A 134 44.552 12.833 35.247 1.00 0.00 C ATOM 2251 CG LYS A 134 45.671 13.469 36.073 1.00 0.00 C ATOM 2252 CD LYS A 134 46.493 12.369 36.748 1.00 0.00 C ATOM 2253 CE LYS A 134 45.647 11.689 37.826 1.00 0.00 C ATOM 2254 NZ LYS A 134 46.470 10.667 38.532 1.00 0.00 N ATOM 0 H LYS A 134 42.353 13.528 33.017 1.00 0.00 H new ATOM 0 HA LYS A 134 43.489 14.713 35.250 1.00 0.00 H new ATOM 0 HB2 LYS A 134 43.899 12.246 35.893 1.00 0.00 H new ATOM 0 HB3 LYS A 134 44.974 12.147 34.512 1.00 0.00 H new ATOM 0 HG2 LYS A 134 46.311 14.075 35.432 1.00 0.00 H new ATOM 0 HG3 LYS A 134 45.249 14.136 36.825 1.00 0.00 H new ATOM 0 HD2 LYS A 134 46.817 11.636 36.009 1.00 0.00 H new ATOM 0 HD3 LYS A 134 47.394 12.793 37.191 1.00 0.00 H new ATOM 0 HE2 LYS A 134 45.280 12.430 38.536 1.00 0.00 H new ATOM 0 HE3 LYS A 134 44.773 11.219 37.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 45.995 10.387 39.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 46.586 9.833 37.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 47.404 11.066 38.754 1.00 0.00 H new ATOM 2268 N THR A 135 45.565 15.332 33.793 1.00 0.00 N ATOM 2269 CA THR A 135 46.440 15.957 32.813 1.00 0.00 C ATOM 2270 C THR A 135 47.285 14.897 32.111 1.00 0.00 C ATOM 2271 O THR A 135 47.508 14.969 30.902 1.00 0.00 O ATOM 2272 CB THR A 135 47.356 16.972 33.500 1.00 0.00 C ATOM 2273 OG1 THR A 135 46.566 17.977 34.119 1.00 0.00 O ATOM 2274 CG2 THR A 135 48.280 17.611 32.463 1.00 0.00 C ATOM 0 H THR A 135 45.775 15.568 34.763 1.00 0.00 H new ATOM 0 HA THR A 135 45.826 16.471 32.074 1.00 0.00 H new ATOM 0 HB THR A 135 47.958 16.467 34.256 1.00 0.00 H new ATOM 0 HG1 THR A 135 47.151 18.627 34.561 1.00 0.00 H new ATOM 0 HG21 THR A 135 48.932 18.334 32.953 1.00 0.00 H new ATOM 0 HG22 THR A 135 48.886 16.838 31.990 1.00 0.00 H new ATOM 0 HG23 THR A 135 47.682 18.117 31.705 1.00 0.00 H new ATOM 2282 N LYS A 136 47.757 13.915 32.877 1.00 0.00 N ATOM 2283 CA LYS A 136 48.581 12.853 32.312 1.00 0.00 C ATOM 2284 C LYS A 136 47.731 11.856 31.526 1.00 0.00 C ATOM 2285 O LYS A 136 46.842 11.198 32.075 1.00 0.00 O ATOM 2286 CB LYS A 136 49.323 12.118 33.431 1.00 0.00 C ATOM 2287 CG LYS A 136 50.181 13.114 34.214 1.00 0.00 C ATOM 2288 CD LYS A 136 51.236 13.719 33.286 1.00 0.00 C ATOM 2289 CE LYS A 136 52.118 14.685 34.077 1.00 0.00 C ATOM 2290 NZ LYS A 136 53.137 15.285 33.170 1.00 0.00 N ATOM 0 H LYS A 136 47.585 13.834 33.879 1.00 0.00 H new ATOM 0 HA LYS A 136 49.299 13.309 31.631 1.00 0.00 H new ATOM 0 HB2 LYS A 136 48.610 11.633 34.098 1.00 0.00 H new ATOM 0 HB3 LYS A 136 49.951 11.332 33.011 1.00 0.00 H new ATOM 0 HG2 LYS A 136 49.553 13.902 34.631 1.00 0.00 H new ATOM 0 HG3 LYS A 136 50.664 12.613 35.053 1.00 0.00 H new ATOM 0 HD2 LYS A 136 51.846 12.929 32.848 1.00 0.00 H new ATOM 0 HD3 LYS A 136 50.753 14.243 32.462 1.00 0.00 H new ATOM 0 HE2 LYS A 136 51.507 15.469 34.524 1.00 0.00 H new ATOM 0 HE3 LYS A 136 52.609 14.159 34.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 53.737 15.942 33.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 53.727 14.531 32.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 52.659 15.801 32.404 1.00 0.00 H new ATOM 2304 N LYS A 137 48.026 11.747 30.235 1.00 0.00 N ATOM 2305 CA LYS A 137 47.305 10.831 29.361 1.00 0.00 C ATOM 2306 C LYS A 137 48.209 10.371 28.221 1.00 0.00 C ATOM 2307 O LYS A 137 49.190 11.037 27.892 1.00 0.00 O ATOM 2308 CB LYS A 137 46.066 11.522 28.789 1.00 0.00 C ATOM 2309 CG LYS A 137 46.493 12.758 27.995 1.00 0.00 C ATOM 2310 CD LYS A 137 45.251 13.537 27.555 1.00 0.00 C ATOM 2311 CE LYS A 137 44.474 12.719 26.523 1.00 0.00 C ATOM 2312 NZ LYS A 137 43.300 13.505 26.048 1.00 0.00 N ATOM 0 H LYS A 137 48.760 12.282 29.771 1.00 0.00 H new ATOM 0 HA LYS A 137 46.996 9.962 29.942 1.00 0.00 H new ATOM 0 HB2 LYS A 137 45.518 10.834 28.145 1.00 0.00 H new ATOM 0 HB3 LYS A 137 45.392 11.810 29.596 1.00 0.00 H new ATOM 0 HG2 LYS A 137 47.135 13.392 28.606 1.00 0.00 H new ATOM 0 HG3 LYS A 137 47.076 12.460 27.124 1.00 0.00 H new ATOM 0 HD2 LYS A 137 44.618 13.750 28.417 1.00 0.00 H new ATOM 0 HD3 LYS A 137 45.543 14.497 27.129 1.00 0.00 H new ATOM 0 HE2 LYS A 137 45.120 12.466 25.682 1.00 0.00 H new ATOM 0 HE3 LYS A 137 44.142 11.779 26.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 43.131 13.303 25.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 42.459 13.241 26.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 43.489 14.520 26.170 1.00 0.00 H new ATOM 2326 N GLU A 138 47.873 9.237 27.617 1.00 0.00 N ATOM 2327 CA GLU A 138 48.667 8.712 26.512 1.00 0.00 C ATOM 2328 C GLU A 138 47.814 8.590 25.254 1.00 0.00 C ATOM 2329 O GLU A 138 46.708 8.053 25.293 1.00 0.00 O ATOM 2330 CB GLU A 138 49.247 7.345 26.878 1.00 0.00 C ATOM 2331 CG GLU A 138 50.110 6.834 25.722 1.00 0.00 C ATOM 2332 CD GLU A 138 50.766 5.511 26.101 1.00 0.00 C ATOM 2333 OE1 GLU A 138 50.558 5.069 27.219 1.00 0.00 O ATOM 2334 OE2 GLU A 138 51.470 4.961 25.270 1.00 0.00 O ATOM 0 H GLU A 138 47.065 8.668 27.870 1.00 0.00 H new ATOM 0 HA GLU A 138 49.485 9.405 26.318 1.00 0.00 H new ATOM 0 HB2 GLU A 138 49.845 7.422 27.786 1.00 0.00 H new ATOM 0 HB3 GLU A 138 48.442 6.640 27.085 1.00 0.00 H new ATOM 0 HG2 GLU A 138 49.496 6.702 24.831 1.00 0.00 H new ATOM 0 HG3 GLU A 138 50.875 7.571 25.476 1.00 0.00 H new ATOM 2341 N VAL A 139 48.332 9.097 24.140 1.00 0.00 N ATOM 2342 CA VAL A 139 47.604 9.044 22.878 1.00 0.00 C ATOM 2343 C VAL A 139 48.501 8.523 21.760 1.00 0.00 C ATOM 2344 O VAL A 139 49.683 8.858 21.691 1.00 0.00 O ATOM 2345 CB VAL A 139 47.091 10.438 22.514 1.00 0.00 C ATOM 2346 CG1 VAL A 139 48.273 11.400 22.386 1.00 0.00 C ATOM 2347 CG2 VAL A 139 46.344 10.372 21.180 1.00 0.00 C ATOM 0 H VAL A 139 49.246 9.546 24.085 1.00 0.00 H new ATOM 0 HA VAL A 139 46.760 8.364 22.996 1.00 0.00 H new ATOM 0 HB VAL A 139 46.417 10.792 23.294 1.00 0.00 H new ATOM 0 HG11 VAL A 139 47.907 12.393 22.127 1.00 0.00 H new ATOM 0 HG12 VAL A 139 48.808 11.447 23.334 1.00 0.00 H new ATOM 0 HG13 VAL A 139 48.947 11.046 21.606 1.00 0.00 H new ATOM 0 HG21 VAL A 139 45.977 11.365 20.919 1.00 0.00 H new ATOM 0 HG22 VAL A 139 47.020 10.018 20.402 1.00 0.00 H new ATOM 0 HG23 VAL A 139 45.502 9.686 21.268 1.00 0.00 H new ATOM 2357 N ILE A 140 47.927 7.701 20.886 1.00 0.00 N ATOM 2358 CA ILE A 140 48.681 7.137 19.772 1.00 0.00 C ATOM 2359 C ILE A 140 48.456 7.954 18.504 1.00 0.00 C ATOM 2360 O ILE A 140 49.406 8.127 17.759 1.00 0.00 O ATOM 2361 CB ILE A 140 48.251 5.689 19.532 1.00 0.00 C ATOM 2362 CG1 ILE A 140 48.726 4.817 20.697 1.00 0.00 C ATOM 2363 CG2 ILE A 140 48.869 5.180 18.230 1.00 0.00 C ATOM 2364 CD1 ILE A 140 48.067 3.439 20.607 1.00 0.00 C ATOM 2365 OXT ILE A 140 47.337 8.393 18.297 1.00 0.00 O ATOM 0 H ILE A 140 46.949 7.413 20.927 1.00 0.00 H new ATOM 0 HA ILE A 140 49.741 7.164 20.024 1.00 0.00 H new ATOM 0 HB ILE A 140 47.164 5.641 19.460 1.00 0.00 H new ATOM 0 HG12 ILE A 140 49.811 4.715 20.670 1.00 0.00 H new ATOM 0 HG13 ILE A 140 48.474 5.291 21.646 1.00 0.00 H new ATOM 0 HG21 ILE A 140 48.562 4.148 18.060 1.00 0.00 H new ATOM 0 HG22 ILE A 140 48.531 5.800 17.400 1.00 0.00 H new ATOM 0 HG23 ILE A 140 49.956 5.228 18.300 1.00 0.00 H new ATOM 0 HD11 ILE A 140 48.406 2.819 21.437 1.00 0.00 H new ATOM 0 HD12 ILE A 140 46.984 3.550 20.655 1.00 0.00 H new ATOM 0 HD13 ILE A 140 48.341 2.965 19.664 1.00 0.00 H new