USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 981 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 73 TYR OH : rot 16:sc= -1.41! USER MOD Set 1.2: A 90 THR OG1 : rot 111:sc= 0.744 USER MOD Single : A 32 SER OG : rot 103:sc= 1.04 USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 110:sc= -0.235 USER MOD Single : A 46 TYR OH : rot -146:sc= -0.976 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc=-0.00984 X(o=-0.0098,f=-0.29) USER MOD Single : A 51 SER OG : rot 180:sc= -0.185 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= -0.0579 USER MOD Single : A 75 TYR OH : rot 180:sc=-0.000994 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.0194) USER MOD Single : A 80 SER OG : rot -37:sc= 1.4 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ -150:sc= -0.35 (180deg=-1.52!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 HIS : no HD1:sc= -0.728 K(o=-0.73,f=-0.14) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot -98:sc= 0.548 USER MOD Single : A 136 LYS NZ :NH3+ -157:sc= 1.13 (180deg=0.151) USER MOD Single : A 139 SER OG : rot -30:sc= -0.33 USER MOD ----------------------------------------------------------------- ATOM 342 N VAL A 27 135.610 3.711 4.664 1.00 0.00 N ATOM 343 CA VAL A 27 134.293 4.024 4.138 1.00 0.00 C ATOM 344 C VAL A 27 133.612 2.769 3.607 1.00 0.00 C ATOM 345 O VAL A 27 132.393 2.628 3.696 1.00 0.00 O ATOM 346 CB VAL A 27 134.414 5.089 3.027 1.00 0.00 C ATOM 347 CG1 VAL A 27 134.745 4.453 1.655 1.00 0.00 C ATOM 348 CG2 VAL A 27 133.096 5.857 2.920 1.00 0.00 C ATOM 0 HA VAL A 27 133.678 4.423 4.945 1.00 0.00 H new ATOM 0 HB VAL A 27 135.230 5.761 3.293 1.00 0.00 H new ATOM 0 HG11 VAL A 27 134.822 5.236 0.900 1.00 0.00 H new ATOM 0 HG12 VAL A 27 135.693 3.918 1.721 1.00 0.00 H new ATOM 0 HG13 VAL A 27 133.954 3.757 1.376 1.00 0.00 H new ATOM 0 HG21 VAL A 27 133.177 6.610 2.137 1.00 0.00 H new ATOM 0 HG22 VAL A 27 132.290 5.165 2.676 1.00 0.00 H new ATOM 0 HG23 VAL A 27 132.880 6.344 3.871 1.00 0.00 H new ATOM 358 N GLU A 28 134.410 1.883 3.028 1.00 0.00 N ATOM 359 CA GLU A 28 133.885 0.662 2.450 1.00 0.00 C ATOM 360 C GLU A 28 133.309 -0.228 3.534 1.00 0.00 C ATOM 361 O GLU A 28 132.209 -0.759 3.392 1.00 0.00 O ATOM 362 CB GLU A 28 134.998 -0.074 1.696 1.00 0.00 C ATOM 363 CG GLU A 28 134.405 -1.270 0.950 1.00 0.00 C ATOM 364 CD GLU A 28 135.462 -1.915 0.059 1.00 0.00 C ATOM 365 OE1 GLU A 28 136.031 -1.209 -0.760 1.00 0.00 O ATOM 366 OE2 GLU A 28 135.685 -3.105 0.204 1.00 0.00 O ATOM 0 H GLU A 28 135.421 1.990 2.948 1.00 0.00 H new ATOM 0 HA GLU A 28 133.088 0.915 1.751 1.00 0.00 H new ATOM 0 HB2 GLU A 28 135.484 0.602 0.993 1.00 0.00 H new ATOM 0 HB3 GLU A 28 135.764 -0.411 2.395 1.00 0.00 H new ATOM 0 HG2 GLU A 28 134.026 -2.001 1.664 1.00 0.00 H new ATOM 0 HG3 GLU A 28 133.558 -0.946 0.345 1.00 0.00 H new ATOM 373 N LEU A 29 134.056 -0.382 4.616 1.00 0.00 N ATOM 374 CA LEU A 29 133.606 -1.211 5.718 1.00 0.00 C ATOM 375 C LEU A 29 132.382 -0.606 6.389 1.00 0.00 C ATOM 376 O LEU A 29 131.409 -1.302 6.649 1.00 0.00 O ATOM 377 CB LEU A 29 134.732 -1.346 6.745 1.00 0.00 C ATOM 378 CG LEU A 29 135.896 -2.163 6.150 1.00 0.00 C ATOM 379 CD1 LEU A 29 137.195 -1.813 6.882 1.00 0.00 C ATOM 380 CD2 LEU A 29 135.630 -3.668 6.311 1.00 0.00 C ATOM 0 H LEU A 29 134.969 0.053 4.752 1.00 0.00 H new ATOM 0 HA LEU A 29 133.337 -2.192 5.325 1.00 0.00 H new ATOM 0 HB2 LEU A 29 135.085 -0.358 7.041 1.00 0.00 H new ATOM 0 HB3 LEU A 29 134.358 -1.834 7.645 1.00 0.00 H new ATOM 0 HG LEU A 29 135.984 -1.922 5.091 1.00 0.00 H new ATOM 0 HD11 LEU A 29 138.017 -2.391 6.461 1.00 0.00 H new ATOM 0 HD12 LEU A 29 137.403 -0.749 6.766 1.00 0.00 H new ATOM 0 HD13 LEU A 29 137.091 -2.049 7.941 1.00 0.00 H new ATOM 0 HD21 LEU A 29 136.461 -4.232 5.886 1.00 0.00 H new ATOM 0 HD22 LEU A 29 135.532 -3.909 7.369 1.00 0.00 H new ATOM 0 HD23 LEU A 29 134.709 -3.932 5.792 1.00 0.00 H new ATOM 392 N GLY A 30 132.432 0.693 6.660 1.00 0.00 N ATOM 393 CA GLY A 30 131.313 1.364 7.310 1.00 0.00 C ATOM 394 C GLY A 30 130.052 1.280 6.461 1.00 0.00 C ATOM 395 O GLY A 30 128.989 0.894 6.949 1.00 0.00 O ATOM 0 H GLY A 30 133.225 1.296 6.443 1.00 0.00 H new ATOM 0 HA2 GLY A 30 131.130 0.910 8.284 1.00 0.00 H new ATOM 0 HA3 GLY A 30 131.566 2.409 7.488 1.00 0.00 H new ATOM 399 N VAL A 31 130.175 1.636 5.189 1.00 0.00 N ATOM 400 CA VAL A 31 129.034 1.591 4.287 1.00 0.00 C ATOM 401 C VAL A 31 128.534 0.155 4.145 1.00 0.00 C ATOM 402 O VAL A 31 127.332 -0.104 4.199 1.00 0.00 O ATOM 403 CB VAL A 31 129.433 2.151 2.914 1.00 0.00 C ATOM 404 CG1 VAL A 31 128.316 1.888 1.897 1.00 0.00 C ATOM 405 CG2 VAL A 31 129.673 3.664 3.031 1.00 0.00 C ATOM 0 H VAL A 31 131.045 1.956 4.763 1.00 0.00 H new ATOM 0 HA VAL A 31 128.231 2.202 4.699 1.00 0.00 H new ATOM 0 HB VAL A 31 130.346 1.659 2.577 1.00 0.00 H new ATOM 0 HG11 VAL A 31 128.607 2.288 0.926 1.00 0.00 H new ATOM 0 HG12 VAL A 31 128.147 0.815 1.811 1.00 0.00 H new ATOM 0 HG13 VAL A 31 127.399 2.374 2.230 1.00 0.00 H new ATOM 0 HG21 VAL A 31 129.956 4.064 2.057 1.00 0.00 H new ATOM 0 HG22 VAL A 31 128.760 4.152 3.372 1.00 0.00 H new ATOM 0 HG23 VAL A 31 130.473 3.851 3.747 1.00 0.00 H new ATOM 415 N SER A 32 129.466 -0.774 3.966 1.00 0.00 N ATOM 416 CA SER A 32 129.109 -2.178 3.822 1.00 0.00 C ATOM 417 C SER A 32 128.416 -2.687 5.081 1.00 0.00 C ATOM 418 O SER A 32 127.460 -3.458 5.008 1.00 0.00 O ATOM 419 CB SER A 32 130.362 -3.010 3.553 1.00 0.00 C ATOM 420 OG SER A 32 130.987 -2.549 2.362 1.00 0.00 O ATOM 0 H SER A 32 130.467 -0.582 3.918 1.00 0.00 H new ATOM 0 HA SER A 32 128.423 -2.275 2.981 1.00 0.00 H new ATOM 0 HB2 SER A 32 131.052 -2.931 4.393 1.00 0.00 H new ATOM 0 HB3 SER A 32 130.099 -4.063 3.455 1.00 0.00 H new ATOM 0 HG SER A 32 131.767 -2.003 2.592 1.00 0.00 H new ATOM 426 N TYR A 33 128.915 -2.260 6.236 1.00 0.00 N ATOM 427 CA TYR A 33 128.347 -2.686 7.507 1.00 0.00 C ATOM 428 C TYR A 33 126.883 -2.267 7.595 1.00 0.00 C ATOM 429 O TYR A 33 126.031 -3.038 8.035 1.00 0.00 O ATOM 430 CB TYR A 33 129.135 -2.068 8.678 1.00 0.00 C ATOM 431 CG TYR A 33 128.977 -2.918 9.913 1.00 0.00 C ATOM 432 CD1 TYR A 33 127.915 -2.696 10.796 1.00 0.00 C ATOM 433 CD2 TYR A 33 129.900 -3.936 10.167 1.00 0.00 C ATOM 434 CE1 TYR A 33 127.778 -3.496 11.936 1.00 0.00 C ATOM 435 CE2 TYR A 33 129.764 -4.737 11.303 1.00 0.00 C ATOM 436 CZ TYR A 33 128.703 -4.517 12.188 1.00 0.00 C ATOM 437 OH TYR A 33 128.568 -5.308 13.310 1.00 0.00 O ATOM 0 H TYR A 33 129.707 -1.623 6.317 1.00 0.00 H new ATOM 0 HA TYR A 33 128.412 -3.772 7.569 1.00 0.00 H new ATOM 0 HB2 TYR A 33 130.190 -1.987 8.415 1.00 0.00 H new ATOM 0 HB3 TYR A 33 128.777 -1.057 8.874 1.00 0.00 H new ATOM 0 HD1 TYR A 33 127.202 -1.909 10.598 1.00 0.00 H new ATOM 0 HD2 TYR A 33 130.720 -4.104 9.484 1.00 0.00 H new ATOM 0 HE1 TYR A 33 126.960 -3.326 12.621 1.00 0.00 H new ATOM 0 HE2 TYR A 33 130.477 -5.525 11.498 1.00 0.00 H new ATOM 0 HH TYR A 33 129.292 -5.968 13.334 1.00 0.00 H new ATOM 447 N ALA A 34 126.602 -1.037 7.182 1.00 0.00 N ATOM 448 CA ALA A 34 125.240 -0.526 7.232 1.00 0.00 C ATOM 449 C ALA A 34 124.312 -1.379 6.376 1.00 0.00 C ATOM 450 O ALA A 34 123.185 -1.678 6.772 1.00 0.00 O ATOM 451 CB ALA A 34 125.201 0.921 6.736 1.00 0.00 C ATOM 0 H ALA A 34 127.291 -0.382 6.813 1.00 0.00 H new ATOM 0 HA ALA A 34 124.901 -0.565 8.267 1.00 0.00 H new ATOM 0 HB1 ALA A 34 124.177 1.293 6.778 1.00 0.00 H new ATOM 0 HB2 ALA A 34 125.838 1.540 7.368 1.00 0.00 H new ATOM 0 HB3 ALA A 34 125.560 0.963 5.708 1.00 0.00 H new ATOM 457 N ALA A 35 124.793 -1.769 5.200 1.00 0.00 N ATOM 458 CA ALA A 35 123.997 -2.588 4.296 1.00 0.00 C ATOM 459 C ALA A 35 123.707 -3.946 4.919 1.00 0.00 C ATOM 460 O ALA A 35 122.598 -4.467 4.816 1.00 0.00 O ATOM 461 CB ALA A 35 124.749 -2.790 2.979 1.00 0.00 C ATOM 0 H ALA A 35 125.723 -1.533 4.853 1.00 0.00 H new ATOM 0 HA ALA A 35 123.054 -2.074 4.108 1.00 0.00 H new ATOM 0 HB1 ALA A 35 124.148 -3.403 2.307 1.00 0.00 H new ATOM 0 HB2 ALA A 35 124.937 -1.822 2.515 1.00 0.00 H new ATOM 0 HB3 ALA A 35 125.698 -3.289 3.175 1.00 0.00 H new ATOM 467 N LEU A 36 124.714 -4.518 5.562 1.00 0.00 N ATOM 468 CA LEU A 36 124.551 -5.821 6.189 1.00 0.00 C ATOM 469 C LEU A 36 123.528 -5.748 7.314 1.00 0.00 C ATOM 470 O LEU A 36 122.726 -6.663 7.498 1.00 0.00 O ATOM 471 CB LEU A 36 125.892 -6.314 6.753 1.00 0.00 C ATOM 472 CG LEU A 36 125.750 -7.740 7.325 1.00 0.00 C ATOM 473 CD1 LEU A 36 125.525 -8.755 6.192 1.00 0.00 C ATOM 474 CD2 LEU A 36 127.025 -8.105 8.094 1.00 0.00 C ATOM 0 H LEU A 36 125.642 -4.107 5.663 1.00 0.00 H new ATOM 0 HA LEU A 36 124.199 -6.520 5.430 1.00 0.00 H new ATOM 0 HB2 LEU A 36 126.648 -6.305 5.968 1.00 0.00 H new ATOM 0 HB3 LEU A 36 126.235 -5.636 7.534 1.00 0.00 H new ATOM 0 HG LEU A 36 124.891 -7.769 7.995 1.00 0.00 H new ATOM 0 HD11 LEU A 36 125.427 -9.755 6.614 1.00 0.00 H new ATOM 0 HD12 LEU A 36 124.615 -8.499 5.650 1.00 0.00 H new ATOM 0 HD13 LEU A 36 126.374 -8.731 5.508 1.00 0.00 H new ATOM 0 HD21 LEU A 36 126.929 -9.112 8.500 1.00 0.00 H new ATOM 0 HD22 LEU A 36 127.880 -8.065 7.420 1.00 0.00 H new ATOM 0 HD23 LEU A 36 127.173 -7.397 8.910 1.00 0.00 H new ATOM 486 N LEU A 37 123.589 -4.675 8.089 1.00 0.00 N ATOM 487 CA LEU A 37 122.687 -4.524 9.220 1.00 0.00 C ATOM 488 C LEU A 37 121.239 -4.451 8.737 1.00 0.00 C ATOM 489 O LEU A 37 120.338 -5.013 9.347 1.00 0.00 O ATOM 490 CB LEU A 37 123.047 -3.255 10.013 1.00 0.00 C ATOM 491 CG LEU A 37 122.805 -3.469 11.519 1.00 0.00 C ATOM 492 CD1 LEU A 37 121.357 -3.937 11.750 1.00 0.00 C ATOM 493 CD2 LEU A 37 123.808 -4.513 12.079 1.00 0.00 C ATOM 0 H LEU A 37 124.245 -3.905 7.958 1.00 0.00 H new ATOM 0 HA LEU A 37 122.792 -5.391 9.872 1.00 0.00 H new ATOM 0 HB2 LEU A 37 124.092 -2.996 9.840 1.00 0.00 H new ATOM 0 HB3 LEU A 37 122.448 -2.416 9.659 1.00 0.00 H new ATOM 0 HG LEU A 37 122.960 -2.527 12.044 1.00 0.00 H new ATOM 0 HD11 LEU A 37 121.189 -4.088 12.816 1.00 0.00 H new ATOM 0 HD12 LEU A 37 120.666 -3.181 11.377 1.00 0.00 H new ATOM 0 HD13 LEU A 37 121.189 -4.875 11.220 1.00 0.00 H new ATOM 0 HD21 LEU A 37 123.627 -4.656 13.144 1.00 0.00 H new ATOM 0 HD22 LEU A 37 123.675 -5.461 11.558 1.00 0.00 H new ATOM 0 HD23 LEU A 37 124.827 -4.156 11.928 1.00 0.00 H new ATOM 505 N SER A 38 121.021 -3.743 7.647 1.00 0.00 N ATOM 506 CA SER A 38 119.680 -3.609 7.110 1.00 0.00 C ATOM 507 C SER A 38 119.199 -4.934 6.526 1.00 0.00 C ATOM 508 O SER A 38 118.008 -5.240 6.559 1.00 0.00 O ATOM 509 CB SER A 38 119.659 -2.531 6.034 1.00 0.00 C ATOM 510 OG SER A 38 118.332 -2.381 5.548 1.00 0.00 O ATOM 0 H SER A 38 121.746 -3.256 7.120 1.00 0.00 H new ATOM 0 HA SER A 38 119.009 -3.324 7.920 1.00 0.00 H new ATOM 0 HB2 SER A 38 120.019 -1.586 6.442 1.00 0.00 H new ATOM 0 HB3 SER A 38 120.329 -2.802 5.218 1.00 0.00 H new ATOM 0 HG SER A 38 117.970 -1.520 5.845 1.00 0.00 H new ATOM 516 N VAL A 39 120.129 -5.709 5.977 1.00 0.00 N ATOM 517 CA VAL A 39 119.780 -6.993 5.372 1.00 0.00 C ATOM 518 C VAL A 39 119.147 -7.935 6.391 1.00 0.00 C ATOM 519 O VAL A 39 118.066 -8.478 6.158 1.00 0.00 O ATOM 520 CB VAL A 39 121.051 -7.653 4.798 1.00 0.00 C ATOM 521 CG1 VAL A 39 120.816 -9.155 4.565 1.00 0.00 C ATOM 522 CG2 VAL A 39 121.431 -6.984 3.470 1.00 0.00 C ATOM 0 H VAL A 39 121.121 -5.475 5.938 1.00 0.00 H new ATOM 0 HA VAL A 39 119.056 -6.806 4.579 1.00 0.00 H new ATOM 0 HB VAL A 39 121.862 -7.527 5.515 1.00 0.00 H new ATOM 0 HG11 VAL A 39 121.722 -9.606 4.160 1.00 0.00 H new ATOM 0 HG12 VAL A 39 120.563 -9.635 5.511 1.00 0.00 H new ATOM 0 HG13 VAL A 39 119.996 -9.290 3.859 1.00 0.00 H new ATOM 0 HG21 VAL A 39 122.329 -7.454 3.070 1.00 0.00 H new ATOM 0 HG22 VAL A 39 120.614 -7.098 2.758 1.00 0.00 H new ATOM 0 HG23 VAL A 39 121.621 -5.924 3.638 1.00 0.00 H new ATOM 532 N ILE A 40 119.838 -8.147 7.499 1.00 0.00 N ATOM 533 CA ILE A 40 119.340 -9.057 8.513 1.00 0.00 C ATOM 534 C ILE A 40 118.043 -8.524 9.106 1.00 0.00 C ATOM 535 O ILE A 40 117.110 -9.276 9.365 1.00 0.00 O ATOM 536 CB ILE A 40 120.400 -9.251 9.609 1.00 0.00 C ATOM 537 CG1 ILE A 40 120.048 -10.480 10.454 1.00 0.00 C ATOM 538 CG2 ILE A 40 120.447 -8.018 10.515 1.00 0.00 C ATOM 539 CD1 ILE A 40 120.187 -11.776 9.634 1.00 0.00 C ATOM 0 H ILE A 40 120.733 -7.708 7.716 1.00 0.00 H new ATOM 0 HA ILE A 40 119.134 -10.024 8.054 1.00 0.00 H new ATOM 0 HB ILE A 40 121.373 -9.393 9.138 1.00 0.00 H new ATOM 0 HG12 ILE A 40 120.702 -10.525 11.325 1.00 0.00 H new ATOM 0 HG13 ILE A 40 119.027 -10.389 10.826 1.00 0.00 H new ATOM 0 HG21 ILE A 40 121.201 -8.164 11.289 1.00 0.00 H new ATOM 0 HG22 ILE A 40 120.701 -7.140 9.921 1.00 0.00 H new ATOM 0 HG23 ILE A 40 119.472 -7.871 10.981 1.00 0.00 H new ATOM 0 HD11 ILE A 40 119.931 -12.631 10.259 1.00 0.00 H new ATOM 0 HD12 ILE A 40 119.514 -11.738 8.777 1.00 0.00 H new ATOM 0 HD13 ILE A 40 121.214 -11.877 9.284 1.00 0.00 H new ATOM 551 N VAL A 41 117.990 -7.218 9.313 1.00 0.00 N ATOM 552 CA VAL A 41 116.803 -6.602 9.881 1.00 0.00 C ATOM 553 C VAL A 41 115.585 -6.874 9.004 1.00 0.00 C ATOM 554 O VAL A 41 114.508 -7.194 9.509 1.00 0.00 O ATOM 555 CB VAL A 41 117.021 -5.089 10.022 1.00 0.00 C ATOM 556 CG1 VAL A 41 115.688 -4.395 10.328 1.00 0.00 C ATOM 557 CG2 VAL A 41 118.002 -4.824 11.168 1.00 0.00 C ATOM 0 H VAL A 41 118.748 -6.570 9.098 1.00 0.00 H new ATOM 0 HA VAL A 41 116.622 -7.034 10.865 1.00 0.00 H new ATOM 0 HB VAL A 41 117.425 -4.696 9.089 1.00 0.00 H new ATOM 0 HG11 VAL A 41 115.851 -3.322 10.427 1.00 0.00 H new ATOM 0 HG12 VAL A 41 114.985 -4.582 9.516 1.00 0.00 H new ATOM 0 HG13 VAL A 41 115.279 -4.787 11.259 1.00 0.00 H new ATOM 0 HG21 VAL A 41 118.159 -3.750 11.271 1.00 0.00 H new ATOM 0 HG22 VAL A 41 117.593 -5.222 12.097 1.00 0.00 H new ATOM 0 HG23 VAL A 41 118.953 -5.311 10.953 1.00 0.00 H new ATOM 567 N VAL A 42 115.752 -6.734 7.697 1.00 0.00 N ATOM 568 CA VAL A 42 114.645 -6.953 6.774 1.00 0.00 C ATOM 569 C VAL A 42 114.110 -8.381 6.900 1.00 0.00 C ATOM 570 O VAL A 42 112.902 -8.593 6.999 1.00 0.00 O ATOM 571 CB VAL A 42 115.128 -6.697 5.336 1.00 0.00 C ATOM 572 CG1 VAL A 42 114.132 -7.281 4.327 1.00 0.00 C ATOM 573 CG2 VAL A 42 115.264 -5.190 5.097 1.00 0.00 C ATOM 0 H VAL A 42 116.633 -6.473 7.254 1.00 0.00 H new ATOM 0 HA VAL A 42 113.837 -6.264 7.019 1.00 0.00 H new ATOM 0 HB VAL A 42 116.096 -7.180 5.202 1.00 0.00 H new ATOM 0 HG11 VAL A 42 114.487 -7.092 3.314 1.00 0.00 H new ATOM 0 HG12 VAL A 42 114.042 -8.356 4.485 1.00 0.00 H new ATOM 0 HG13 VAL A 42 113.158 -6.811 4.463 1.00 0.00 H new ATOM 0 HG21 VAL A 42 115.606 -5.013 4.077 1.00 0.00 H new ATOM 0 HG22 VAL A 42 114.297 -4.710 5.244 1.00 0.00 H new ATOM 0 HG23 VAL A 42 115.986 -4.774 5.800 1.00 0.00 H new ATOM 583 N VAL A 43 115.014 -9.348 6.890 1.00 0.00 N ATOM 584 CA VAL A 43 114.620 -10.747 6.996 1.00 0.00 C ATOM 585 C VAL A 43 114.064 -11.049 8.380 1.00 0.00 C ATOM 586 O VAL A 43 113.141 -11.852 8.525 1.00 0.00 O ATOM 587 CB VAL A 43 115.807 -11.655 6.696 1.00 0.00 C ATOM 588 CG1 VAL A 43 115.384 -13.114 6.869 1.00 0.00 C ATOM 589 CG2 VAL A 43 116.263 -11.424 5.254 1.00 0.00 C ATOM 0 H VAL A 43 116.019 -9.193 6.810 1.00 0.00 H new ATOM 0 HA VAL A 43 113.836 -10.937 6.263 1.00 0.00 H new ATOM 0 HB VAL A 43 116.626 -11.431 7.380 1.00 0.00 H new ATOM 0 HG11 VAL A 43 116.231 -13.766 6.655 1.00 0.00 H new ATOM 0 HG12 VAL A 43 115.050 -13.277 7.894 1.00 0.00 H new ATOM 0 HG13 VAL A 43 114.569 -13.340 6.182 1.00 0.00 H new ATOM 0 HG21 VAL A 43 117.112 -12.071 5.033 1.00 0.00 H new ATOM 0 HG22 VAL A 43 115.444 -11.654 4.572 1.00 0.00 H new ATOM 0 HG23 VAL A 43 116.558 -10.382 5.128 1.00 0.00 H new ATOM 599 N VAL A 44 114.649 -10.409 9.391 1.00 0.00 N ATOM 600 CA VAL A 44 114.224 -10.613 10.771 1.00 0.00 C ATOM 601 C VAL A 44 112.765 -10.211 10.949 1.00 0.00 C ATOM 602 O VAL A 44 112.061 -10.779 11.774 1.00 0.00 O ATOM 603 CB VAL A 44 115.113 -9.805 11.737 1.00 0.00 C ATOM 604 CG1 VAL A 44 114.451 -9.742 13.126 1.00 0.00 C ATOM 605 CG2 VAL A 44 116.491 -10.486 11.858 1.00 0.00 C ATOM 0 H VAL A 44 115.417 -9.747 9.279 1.00 0.00 H new ATOM 0 HA VAL A 44 114.326 -11.673 11.003 1.00 0.00 H new ATOM 0 HB VAL A 44 115.236 -8.793 11.350 1.00 0.00 H new ATOM 0 HG11 VAL A 44 115.083 -9.170 13.805 1.00 0.00 H new ATOM 0 HG12 VAL A 44 113.477 -9.259 13.043 1.00 0.00 H new ATOM 0 HG13 VAL A 44 114.323 -10.752 13.514 1.00 0.00 H new ATOM 0 HG21 VAL A 44 117.120 -9.915 12.541 1.00 0.00 H new ATOM 0 HG22 VAL A 44 116.364 -11.498 12.242 1.00 0.00 H new ATOM 0 HG23 VAL A 44 116.964 -10.527 10.877 1.00 0.00 H new ATOM 615 N GLU A 45 112.328 -9.204 10.201 1.00 0.00 N ATOM 616 CA GLU A 45 110.958 -8.716 10.327 1.00 0.00 C ATOM 617 C GLU A 45 109.928 -9.802 10.024 1.00 0.00 C ATOM 618 O GLU A 45 109.034 -10.059 10.830 1.00 0.00 O ATOM 619 CB GLU A 45 110.745 -7.548 9.367 1.00 0.00 C ATOM 620 CG GLU A 45 109.357 -6.946 9.593 1.00 0.00 C ATOM 621 CD GLU A 45 109.170 -5.721 8.704 1.00 0.00 C ATOM 622 OE1 GLU A 45 110.158 -5.247 8.169 1.00 0.00 O ATOM 623 OE2 GLU A 45 108.042 -5.276 8.575 1.00 0.00 O ATOM 0 H GLU A 45 112.894 -8.714 9.508 1.00 0.00 H new ATOM 0 HA GLU A 45 110.817 -8.399 11.360 1.00 0.00 H new ATOM 0 HB2 GLU A 45 111.512 -6.790 9.525 1.00 0.00 H new ATOM 0 HB3 GLU A 45 110.841 -7.889 8.336 1.00 0.00 H new ATOM 0 HG2 GLU A 45 108.589 -7.687 9.371 1.00 0.00 H new ATOM 0 HG3 GLU A 45 109.238 -6.667 10.640 1.00 0.00 H new ATOM 630 N TYR A 46 110.031 -10.416 8.851 1.00 0.00 N ATOM 631 CA TYR A 46 109.066 -11.440 8.457 1.00 0.00 C ATOM 632 C TYR A 46 109.207 -12.709 9.296 1.00 0.00 C ATOM 633 O TYR A 46 108.246 -13.167 9.914 1.00 0.00 O ATOM 634 CB TYR A 46 109.274 -11.795 6.985 1.00 0.00 C ATOM 635 CG TYR A 46 109.674 -10.556 6.217 1.00 0.00 C ATOM 636 CD1 TYR A 46 108.811 -9.452 6.160 1.00 0.00 C ATOM 637 CD2 TYR A 46 110.910 -10.513 5.566 1.00 0.00 C ATOM 638 CE1 TYR A 46 109.187 -8.306 5.448 1.00 0.00 C ATOM 639 CE2 TYR A 46 111.283 -9.369 4.852 1.00 0.00 C ATOM 640 CZ TYR A 46 110.424 -8.268 4.791 1.00 0.00 C ATOM 641 OH TYR A 46 110.804 -7.137 4.097 1.00 0.00 O ATOM 0 H TYR A 46 110.761 -10.228 8.164 1.00 0.00 H new ATOM 0 HA TYR A 46 108.068 -11.033 8.619 1.00 0.00 H new ATOM 0 HB2 TYR A 46 110.046 -12.559 6.890 1.00 0.00 H new ATOM 0 HB3 TYR A 46 108.358 -12.214 6.568 1.00 0.00 H new ATOM 0 HD1 TYR A 46 107.857 -9.485 6.665 1.00 0.00 H new ATOM 0 HD2 TYR A 46 111.576 -11.362 5.614 1.00 0.00 H new ATOM 0 HE1 TYR A 46 108.525 -7.454 5.405 1.00 0.00 H new ATOM 0 HE2 TYR A 46 112.237 -9.337 4.347 1.00 0.00 H new ATOM 0 HH TYR A 46 111.333 -7.396 3.314 1.00 0.00 H new ATOM 651 N THR A 47 110.403 -13.277 9.300 1.00 0.00 N ATOM 652 CA THR A 47 110.651 -14.503 10.044 1.00 0.00 C ATOM 653 C THR A 47 110.261 -14.332 11.504 1.00 0.00 C ATOM 654 O THR A 47 109.657 -15.220 12.104 1.00 0.00 O ATOM 655 CB THR A 47 112.131 -14.863 9.931 1.00 0.00 C ATOM 656 OG1 THR A 47 112.347 -16.156 10.475 1.00 0.00 O ATOM 657 CG2 THR A 47 112.976 -13.842 10.689 1.00 0.00 C ATOM 0 H THR A 47 111.213 -12.912 8.800 1.00 0.00 H new ATOM 0 HA THR A 47 110.045 -15.307 9.625 1.00 0.00 H new ATOM 0 HB THR A 47 112.421 -14.856 8.880 1.00 0.00 H new ATOM 0 HG1 THR A 47 113.296 -16.388 10.401 1.00 0.00 H new ATOM 0 HG21 THR A 47 114.030 -14.106 10.603 1.00 0.00 H new ATOM 0 HG22 THR A 47 112.815 -12.850 10.266 1.00 0.00 H new ATOM 0 HG23 THR A 47 112.687 -13.839 11.740 1.00 0.00 H new ATOM 665 N MET A 48 110.605 -13.179 12.070 1.00 0.00 N ATOM 666 CA MET A 48 110.283 -12.880 13.467 1.00 0.00 C ATOM 667 C MET A 48 109.661 -11.492 13.597 1.00 0.00 C ATOM 668 O MET A 48 110.206 -10.502 13.115 1.00 0.00 O ATOM 669 CB MET A 48 111.555 -12.961 14.316 1.00 0.00 C ATOM 670 CG MET A 48 111.906 -14.427 14.576 1.00 0.00 C ATOM 671 SD MET A 48 113.501 -14.523 15.424 1.00 0.00 S ATOM 672 CE MET A 48 113.454 -16.294 15.781 1.00 0.00 C ATOM 0 H MET A 48 111.107 -12.435 11.585 1.00 0.00 H new ATOM 0 HA MET A 48 109.559 -13.614 13.821 1.00 0.00 H new ATOM 0 HB2 MET A 48 112.379 -12.465 13.803 1.00 0.00 H new ATOM 0 HB3 MET A 48 111.407 -12.439 15.261 1.00 0.00 H new ATOM 0 HG2 MET A 48 111.131 -14.896 15.182 1.00 0.00 H new ATOM 0 HG3 MET A 48 111.949 -14.974 13.634 1.00 0.00 H new ATOM 0 HE1 MET A 48 114.361 -16.582 16.313 1.00 0.00 H new ATOM 0 HE2 MET A 48 112.584 -16.518 16.398 1.00 0.00 H new ATOM 0 HE3 MET A 48 113.389 -16.852 14.847 1.00 0.00 H new ATOM 682 N GLN A 49 108.511 -11.426 14.260 1.00 0.00 N ATOM 683 CA GLN A 49 107.820 -10.151 14.452 1.00 0.00 C ATOM 684 C GLN A 49 108.171 -9.541 15.794 1.00 0.00 C ATOM 685 O GLN A 49 107.751 -8.430 16.116 1.00 0.00 O ATOM 686 CB GLN A 49 106.310 -10.357 14.365 1.00 0.00 C ATOM 687 CG GLN A 49 105.901 -11.516 15.276 1.00 0.00 C ATOM 688 CD GLN A 49 104.387 -11.527 15.455 1.00 0.00 C ATOM 689 OE1 GLN A 49 103.793 -10.495 15.768 1.00 0.00 O ATOM 690 NE2 GLN A 49 103.724 -12.635 15.270 1.00 0.00 N ATOM 0 H GLN A 49 108.039 -12.232 14.671 1.00 0.00 H new ATOM 0 HA GLN A 49 108.142 -9.469 13.665 1.00 0.00 H new ATOM 0 HB2 GLN A 49 105.790 -9.446 14.662 1.00 0.00 H new ATOM 0 HB3 GLN A 49 106.020 -10.569 13.336 1.00 0.00 H new ATOM 0 HG2 GLN A 49 106.232 -12.462 14.847 1.00 0.00 H new ATOM 0 HG3 GLN A 49 106.390 -11.418 16.245 1.00 0.00 H new ATOM 0 HE21 GLN A 49 104.219 -13.488 15.011 1.00 0.00 H new ATOM 0 HE22 GLN A 49 102.711 -12.648 15.385 1.00 0.00 H new ATOM 699 N LEU A 50 108.950 -10.276 16.561 1.00 0.00 N ATOM 700 CA LEU A 50 109.374 -9.818 17.880 1.00 0.00 C ATOM 701 C LEU A 50 108.185 -9.258 18.660 1.00 0.00 C ATOM 702 O LEU A 50 107.055 -9.253 18.173 1.00 0.00 O ATOM 703 CB LEU A 50 110.446 -8.735 17.727 1.00 0.00 C ATOM 704 CG LEU A 50 111.736 -9.345 17.147 1.00 0.00 C ATOM 705 CD1 LEU A 50 112.636 -8.221 16.624 1.00 0.00 C ATOM 706 CD2 LEU A 50 112.501 -10.137 18.227 1.00 0.00 C ATOM 0 H LEU A 50 109.306 -11.195 16.298 1.00 0.00 H new ATOM 0 HA LEU A 50 109.785 -10.665 18.430 1.00 0.00 H new ATOM 0 HB2 LEU A 50 110.083 -7.943 17.072 1.00 0.00 H new ATOM 0 HB3 LEU A 50 110.654 -8.279 18.695 1.00 0.00 H new ATOM 0 HG LEU A 50 111.465 -10.023 16.338 1.00 0.00 H new ATOM 0 HD11 LEU A 50 113.550 -8.649 16.213 1.00 0.00 H new ATOM 0 HD12 LEU A 50 112.112 -7.668 15.845 1.00 0.00 H new ATOM 0 HD13 LEU A 50 112.887 -7.546 17.442 1.00 0.00 H new ATOM 0 HD21 LEU A 50 113.408 -10.559 17.795 1.00 0.00 H new ATOM 0 HD22 LEU A 50 112.766 -9.470 19.048 1.00 0.00 H new ATOM 0 HD23 LEU A 50 111.870 -10.942 18.603 1.00 0.00 H new ATOM 718 N SER A 51 108.442 -8.790 19.878 1.00 0.00 N ATOM 719 CA SER A 51 107.386 -8.229 20.713 1.00 0.00 C ATOM 720 C SER A 51 107.220 -6.743 20.434 1.00 0.00 C ATOM 721 O SER A 51 108.099 -6.119 19.856 1.00 0.00 O ATOM 722 CB SER A 51 107.713 -8.444 22.187 1.00 0.00 C ATOM 723 OG SER A 51 109.052 -8.042 22.428 1.00 0.00 O ATOM 0 H SER A 51 109.368 -8.788 20.307 1.00 0.00 H new ATOM 0 HA SER A 51 106.452 -8.738 20.476 1.00 0.00 H new ATOM 0 HB2 SER A 51 107.029 -7.869 22.812 1.00 0.00 H new ATOM 0 HB3 SER A 51 107.582 -9.493 22.452 1.00 0.00 H new ATOM 0 HG SER A 51 109.269 -8.176 23.374 1.00 0.00 H new ATOM 729 N GLY A 52 106.092 -6.183 20.852 1.00 0.00 N ATOM 730 CA GLY A 52 105.829 -4.767 20.626 1.00 0.00 C ATOM 731 C GLY A 52 106.979 -3.902 21.130 1.00 0.00 C ATOM 732 O GLY A 52 107.388 -2.954 20.462 1.00 0.00 O ATOM 0 H GLY A 52 105.351 -6.681 21.345 1.00 0.00 H new ATOM 0 HA2 GLY A 52 105.677 -4.589 19.562 1.00 0.00 H new ATOM 0 HA3 GLY A 52 104.907 -4.481 21.132 1.00 0.00 H new ATOM 736 N GLU A 53 107.501 -4.231 22.306 1.00 0.00 N ATOM 737 CA GLU A 53 108.605 -3.466 22.874 1.00 0.00 C ATOM 738 C GLU A 53 109.837 -3.549 21.968 1.00 0.00 C ATOM 739 O GLU A 53 110.394 -2.527 21.550 1.00 0.00 O ATOM 740 CB GLU A 53 108.944 -4.020 24.263 1.00 0.00 C ATOM 741 CG GLU A 53 109.949 -3.104 24.967 1.00 0.00 C ATOM 742 CD GLU A 53 109.251 -1.825 25.410 1.00 0.00 C ATOM 743 OE1 GLU A 53 108.045 -1.746 25.249 1.00 0.00 O ATOM 744 OE2 GLU A 53 109.933 -0.942 25.903 1.00 0.00 O ATOM 0 H GLU A 53 107.183 -5.012 22.879 1.00 0.00 H new ATOM 0 HA GLU A 53 108.307 -2.421 22.958 1.00 0.00 H new ATOM 0 HB2 GLU A 53 108.036 -4.103 24.861 1.00 0.00 H new ATOM 0 HB3 GLU A 53 109.358 -5.024 24.171 1.00 0.00 H new ATOM 0 HG2 GLU A 53 110.378 -3.613 25.830 1.00 0.00 H new ATOM 0 HG3 GLU A 53 110.773 -2.866 24.294 1.00 0.00 H new ATOM 751 N TYR A 54 110.250 -4.772 21.663 1.00 0.00 N ATOM 752 CA TYR A 54 111.409 -4.985 20.805 1.00 0.00 C ATOM 753 C TYR A 54 111.128 -4.482 19.395 1.00 0.00 C ATOM 754 O TYR A 54 112.031 -4.024 18.695 1.00 0.00 O ATOM 755 CB TYR A 54 111.766 -6.478 20.763 1.00 0.00 C ATOM 756 CG TYR A 54 112.467 -6.869 22.046 1.00 0.00 C ATOM 757 CD1 TYR A 54 111.751 -6.906 23.245 1.00 0.00 C ATOM 758 CD2 TYR A 54 113.828 -7.201 22.035 1.00 0.00 C ATOM 759 CE1 TYR A 54 112.388 -7.268 24.434 1.00 0.00 C ATOM 760 CE2 TYR A 54 114.468 -7.565 23.227 1.00 0.00 C ATOM 761 CZ TYR A 54 113.748 -7.598 24.426 1.00 0.00 C ATOM 762 OH TYR A 54 114.376 -7.955 25.600 1.00 0.00 O ATOM 0 H TYR A 54 109.803 -5.627 21.994 1.00 0.00 H new ATOM 0 HA TYR A 54 112.250 -4.427 21.215 1.00 0.00 H new ATOM 0 HB2 TYR A 54 110.863 -7.075 20.634 1.00 0.00 H new ATOM 0 HB3 TYR A 54 112.409 -6.684 19.908 1.00 0.00 H new ATOM 0 HD1 TYR A 54 110.701 -6.654 23.253 1.00 0.00 H new ATOM 0 HD2 TYR A 54 114.383 -7.176 21.109 1.00 0.00 H new ATOM 0 HE1 TYR A 54 111.831 -7.293 25.359 1.00 0.00 H new ATOM 0 HE2 TYR A 54 115.517 -7.820 23.220 1.00 0.00 H new ATOM 0 HH TYR A 54 115.318 -8.154 25.419 1.00 0.00 H new ATOM 772 N LEU A 55 109.873 -4.585 18.981 1.00 0.00 N ATOM 773 CA LEU A 55 109.486 -4.154 17.645 1.00 0.00 C ATOM 774 C LEU A 55 109.754 -2.666 17.471 1.00 0.00 C ATOM 775 O LEU A 55 110.272 -2.235 16.443 1.00 0.00 O ATOM 776 CB LEU A 55 107.994 -4.427 17.415 1.00 0.00 C ATOM 777 CG LEU A 55 107.643 -4.264 15.921 1.00 0.00 C ATOM 778 CD1 LEU A 55 107.887 -5.594 15.181 1.00 0.00 C ATOM 779 CD2 LEU A 55 106.167 -3.867 15.778 1.00 0.00 C ATOM 0 H LEU A 55 109.111 -4.960 19.546 1.00 0.00 H new ATOM 0 HA LEU A 55 110.076 -4.714 16.919 1.00 0.00 H new ATOM 0 HB2 LEU A 55 107.747 -5.436 17.745 1.00 0.00 H new ATOM 0 HB3 LEU A 55 107.395 -3.740 18.013 1.00 0.00 H new ATOM 0 HG LEU A 55 108.273 -3.487 15.489 1.00 0.00 H new ATOM 0 HD11 LEU A 55 107.638 -5.475 14.127 1.00 0.00 H new ATOM 0 HD12 LEU A 55 108.935 -5.877 15.277 1.00 0.00 H new ATOM 0 HD13 LEU A 55 107.260 -6.373 15.616 1.00 0.00 H new ATOM 0 HD21 LEU A 55 105.922 -3.752 14.722 1.00 0.00 H new ATOM 0 HD22 LEU A 55 105.538 -4.642 16.215 1.00 0.00 H new ATOM 0 HD23 LEU A 55 105.992 -2.924 16.295 1.00 0.00 H new ATOM 791 N VAL A 56 109.404 -1.884 18.485 1.00 0.00 N ATOM 792 CA VAL A 56 109.618 -0.446 18.427 1.00 0.00 C ATOM 793 C VAL A 56 111.106 -0.146 18.314 1.00 0.00 C ATOM 794 O VAL A 56 111.522 0.690 17.510 1.00 0.00 O ATOM 795 CB VAL A 56 109.047 0.222 19.685 1.00 0.00 C ATOM 796 CG1 VAL A 56 109.497 1.689 19.754 1.00 0.00 C ATOM 797 CG2 VAL A 56 107.518 0.157 19.643 1.00 0.00 C ATOM 0 H VAL A 56 108.975 -2.218 19.348 1.00 0.00 H new ATOM 0 HA VAL A 56 109.106 -0.049 17.550 1.00 0.00 H new ATOM 0 HB VAL A 56 109.414 -0.303 20.567 1.00 0.00 H new ATOM 0 HG11 VAL A 56 109.086 2.154 20.650 1.00 0.00 H new ATOM 0 HG12 VAL A 56 110.586 1.734 19.788 1.00 0.00 H new ATOM 0 HG13 VAL A 56 109.139 2.221 18.873 1.00 0.00 H new ATOM 0 HG21 VAL A 56 107.109 0.631 20.535 1.00 0.00 H new ATOM 0 HG22 VAL A 56 107.156 0.678 18.757 1.00 0.00 H new ATOM 0 HG23 VAL A 56 107.199 -0.885 19.607 1.00 0.00 H new ATOM 807 N ARG A 57 111.903 -0.824 19.125 1.00 0.00 N ATOM 808 CA ARG A 57 113.344 -0.606 19.102 1.00 0.00 C ATOM 809 C ARG A 57 113.920 -0.948 17.732 1.00 0.00 C ATOM 810 O ARG A 57 114.763 -0.225 17.199 1.00 0.00 O ATOM 811 CB ARG A 57 114.030 -1.468 20.170 1.00 0.00 C ATOM 812 CG ARG A 57 115.376 -0.837 20.571 1.00 0.00 C ATOM 813 CD ARG A 57 116.281 -1.905 21.182 1.00 0.00 C ATOM 814 NE ARG A 57 116.795 -2.774 20.128 1.00 0.00 N ATOM 815 CZ ARG A 57 117.450 -3.892 20.415 1.00 0.00 C ATOM 816 NH1 ARG A 57 117.621 -4.244 21.657 1.00 0.00 N ATOM 817 NH2 ARG A 57 117.917 -4.640 19.451 1.00 0.00 N ATOM 0 H ARG A 57 111.584 -1.520 19.799 1.00 0.00 H new ATOM 0 HA ARG A 57 113.528 0.448 19.312 1.00 0.00 H new ATOM 0 HB2 ARG A 57 113.386 -1.558 21.045 1.00 0.00 H new ATOM 0 HB3 ARG A 57 114.191 -2.476 19.787 1.00 0.00 H new ATOM 0 HG2 ARG A 57 115.856 -0.395 19.698 1.00 0.00 H new ATOM 0 HG3 ARG A 57 115.213 -0.031 21.287 1.00 0.00 H new ATOM 0 HD2 ARG A 57 117.108 -1.434 21.714 1.00 0.00 H new ATOM 0 HD3 ARG A 57 115.725 -2.493 21.913 1.00 0.00 H new ATOM 0 HE ARG A 57 116.648 -2.517 19.152 1.00 0.00 H new ATOM 0 HH11 ARG A 57 117.252 -3.661 22.408 1.00 0.00 H new ATOM 0 HH12 ARG A 57 118.124 -5.103 21.879 1.00 0.00 H new ATOM 0 HH21 ARG A 57 117.778 -4.365 18.479 1.00 0.00 H new ATOM 0 HH22 ARG A 57 118.421 -5.499 19.671 1.00 0.00 H new ATOM 831 N LEU A 58 113.468 -2.064 17.174 1.00 0.00 N ATOM 832 CA LEU A 58 113.954 -2.506 15.876 1.00 0.00 C ATOM 833 C LEU A 58 113.645 -1.449 14.825 1.00 0.00 C ATOM 834 O LEU A 58 114.467 -1.162 13.957 1.00 0.00 O ATOM 835 CB LEU A 58 113.279 -3.833 15.489 1.00 0.00 C ATOM 836 CG LEU A 58 113.896 -4.401 14.188 1.00 0.00 C ATOM 837 CD1 LEU A 58 115.201 -5.155 14.491 1.00 0.00 C ATOM 838 CD2 LEU A 58 112.896 -5.353 13.510 1.00 0.00 C ATOM 0 H LEU A 58 112.770 -2.675 17.598 1.00 0.00 H new ATOM 0 HA LEU A 58 115.032 -2.656 15.931 1.00 0.00 H new ATOM 0 HB2 LEU A 58 113.394 -4.555 16.298 1.00 0.00 H new ATOM 0 HB3 LEU A 58 112.209 -3.676 15.352 1.00 0.00 H new ATOM 0 HG LEU A 58 114.120 -3.570 13.520 1.00 0.00 H new ATOM 0 HD11 LEU A 58 115.619 -5.546 13.563 1.00 0.00 H new ATOM 0 HD12 LEU A 58 115.916 -4.474 14.952 1.00 0.00 H new ATOM 0 HD13 LEU A 58 114.995 -5.980 15.173 1.00 0.00 H new ATOM 0 HD21 LEU A 58 113.335 -5.750 12.595 1.00 0.00 H new ATOM 0 HD22 LEU A 58 112.661 -6.175 14.186 1.00 0.00 H new ATOM 0 HD23 LEU A 58 111.983 -4.809 13.268 1.00 0.00 H new ATOM 850 N TYR A 59 112.455 -0.876 14.909 1.00 0.00 N ATOM 851 CA TYR A 59 112.051 0.144 13.954 1.00 0.00 C ATOM 852 C TYR A 59 112.992 1.342 14.038 1.00 0.00 C ATOM 853 O TYR A 59 113.391 1.908 13.022 1.00 0.00 O ATOM 854 CB TYR A 59 110.588 0.577 14.239 1.00 0.00 C ATOM 855 CG TYR A 59 109.680 0.142 13.110 1.00 0.00 C ATOM 856 CD1 TYR A 59 109.262 -1.189 13.032 1.00 0.00 C ATOM 857 CD2 TYR A 59 109.273 1.065 12.142 1.00 0.00 C ATOM 858 CE1 TYR A 59 108.434 -1.600 11.985 1.00 0.00 C ATOM 859 CE2 TYR A 59 108.445 0.655 11.092 1.00 0.00 C ATOM 860 CZ TYR A 59 108.025 -0.679 11.014 1.00 0.00 C ATOM 861 OH TYR A 59 107.211 -1.084 9.978 1.00 0.00 O ATOM 0 H TYR A 59 111.758 -1.096 15.621 1.00 0.00 H new ATOM 0 HA TYR A 59 112.105 -0.265 12.945 1.00 0.00 H new ATOM 0 HB2 TYR A 59 110.248 0.138 15.177 1.00 0.00 H new ATOM 0 HB3 TYR A 59 110.539 1.659 14.357 1.00 0.00 H new ATOM 0 HD1 TYR A 59 109.579 -1.900 13.781 1.00 0.00 H new ATOM 0 HD2 TYR A 59 109.598 2.093 12.205 1.00 0.00 H new ATOM 0 HE1 TYR A 59 108.109 -2.628 11.925 1.00 0.00 H new ATOM 0 HE2 TYR A 59 108.130 1.366 10.342 1.00 0.00 H new ATOM 0 HH TYR A 59 106.643 -1.824 10.278 1.00 0.00 H new ATOM 871 N LEU A 60 113.333 1.727 15.254 1.00 0.00 N ATOM 872 CA LEU A 60 114.211 2.867 15.458 1.00 0.00 C ATOM 873 C LEU A 60 115.578 2.617 14.842 1.00 0.00 C ATOM 874 O LEU A 60 116.146 3.491 14.186 1.00 0.00 O ATOM 875 CB LEU A 60 114.369 3.140 16.957 1.00 0.00 C ATOM 876 CG LEU A 60 114.944 4.557 17.177 1.00 0.00 C ATOM 877 CD1 LEU A 60 113.807 5.583 17.264 1.00 0.00 C ATOM 878 CD2 LEU A 60 115.754 4.592 18.480 1.00 0.00 C ATOM 0 H LEU A 60 113.019 1.271 16.111 1.00 0.00 H new ATOM 0 HA LEU A 60 113.763 3.733 14.971 1.00 0.00 H new ATOM 0 HB2 LEU A 60 113.404 3.048 17.456 1.00 0.00 H new ATOM 0 HB3 LEU A 60 115.030 2.397 17.403 1.00 0.00 H new ATOM 0 HG LEU A 60 115.590 4.806 16.335 1.00 0.00 H new ATOM 0 HD11 LEU A 60 114.225 6.577 17.419 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.234 5.571 16.337 1.00 0.00 H new ATOM 0 HD13 LEU A 60 113.152 5.331 18.098 1.00 0.00 H new ATOM 0 HD21 LEU A 60 116.157 5.593 18.631 1.00 0.00 H new ATOM 0 HD22 LEU A 60 115.107 4.331 19.318 1.00 0.00 H new ATOM 0 HD23 LEU A 60 116.574 3.876 18.418 1.00 0.00 H new ATOM 890 N VAL A 61 116.099 1.420 15.059 1.00 0.00 N ATOM 891 CA VAL A 61 117.401 1.061 14.522 1.00 0.00 C ATOM 892 C VAL A 61 117.361 1.106 12.996 1.00 0.00 C ATOM 893 O VAL A 61 118.363 1.370 12.339 1.00 0.00 O ATOM 894 CB VAL A 61 117.783 -0.346 14.996 1.00 0.00 C ATOM 895 CG1 VAL A 61 119.036 -0.827 14.251 1.00 0.00 C ATOM 896 CG2 VAL A 61 118.067 -0.326 16.504 1.00 0.00 C ATOM 0 H VAL A 61 115.643 0.685 15.600 1.00 0.00 H new ATOM 0 HA VAL A 61 118.147 1.772 14.877 1.00 0.00 H new ATOM 0 HB VAL A 61 116.956 -1.025 14.789 1.00 0.00 H new ATOM 0 HG11 VAL A 61 119.301 -1.827 14.593 1.00 0.00 H new ATOM 0 HG12 VAL A 61 118.836 -0.851 13.180 1.00 0.00 H new ATOM 0 HG13 VAL A 61 119.862 -0.144 14.450 1.00 0.00 H new ATOM 0 HG21 VAL A 61 118.338 -1.328 16.837 1.00 0.00 H new ATOM 0 HG22 VAL A 61 118.889 0.360 16.710 1.00 0.00 H new ATOM 0 HG23 VAL A 61 117.176 0.005 17.038 1.00 0.00 H new ATOM 906 N ASP A 62 116.199 0.845 12.431 1.00 0.00 N ATOM 907 CA ASP A 62 116.068 0.873 10.987 1.00 0.00 C ATOM 908 C ASP A 62 116.178 2.306 10.468 1.00 0.00 C ATOM 909 O ASP A 62 116.811 2.567 9.441 1.00 0.00 O ATOM 910 CB ASP A 62 114.725 0.273 10.579 1.00 0.00 C ATOM 911 CG ASP A 62 114.650 0.154 9.062 1.00 0.00 C ATOM 912 OD1 ASP A 62 115.431 0.814 8.397 1.00 0.00 O ATOM 913 OD2 ASP A 62 113.818 -0.599 8.590 1.00 0.00 O ATOM 0 H ASP A 62 115.345 0.615 12.939 1.00 0.00 H new ATOM 0 HA ASP A 62 116.874 0.283 10.550 1.00 0.00 H new ATOM 0 HB2 ASP A 62 114.602 -0.709 11.036 1.00 0.00 H new ATOM 0 HB3 ASP A 62 113.911 0.899 10.944 1.00 0.00 H new ATOM 918 N LEU A 63 115.546 3.232 11.182 1.00 0.00 N ATOM 919 CA LEU A 63 115.562 4.632 10.777 1.00 0.00 C ATOM 920 C LEU A 63 116.973 5.198 10.790 1.00 0.00 C ATOM 921 O LEU A 63 117.424 5.771 9.800 1.00 0.00 O ATOM 922 CB LEU A 63 114.692 5.455 11.727 1.00 0.00 C ATOM 923 CG LEU A 63 113.236 4.982 11.644 1.00 0.00 C ATOM 924 CD1 LEU A 63 112.405 5.714 12.704 1.00 0.00 C ATOM 925 CD2 LEU A 63 112.657 5.259 10.243 1.00 0.00 C ATOM 0 H LEU A 63 115.021 3.041 12.036 1.00 0.00 H new ATOM 0 HA LEU A 63 115.172 4.688 9.761 1.00 0.00 H new ATOM 0 HB2 LEU A 63 115.058 5.354 12.749 1.00 0.00 H new ATOM 0 HB3 LEU A 63 114.755 6.512 11.468 1.00 0.00 H new ATOM 0 HG LEU A 63 113.201 3.908 11.826 1.00 0.00 H new ATOM 0 HD11 LEU A 63 111.369 5.380 12.648 1.00 0.00 H new ATOM 0 HD12 LEU A 63 112.804 5.495 13.694 1.00 0.00 H new ATOM 0 HD13 LEU A 63 112.451 6.788 12.524 1.00 0.00 H new ATOM 0 HD21 LEU A 63 111.623 4.917 10.202 1.00 0.00 H new ATOM 0 HD22 LEU A 63 112.693 6.329 10.039 1.00 0.00 H new ATOM 0 HD23 LEU A 63 113.245 4.727 9.495 1.00 0.00 H new ATOM 937 N ILE A 64 117.669 5.031 11.908 1.00 0.00 N ATOM 938 CA ILE A 64 119.028 5.544 12.026 1.00 0.00 C ATOM 939 C ILE A 64 119.919 4.934 10.949 1.00 0.00 C ATOM 940 O ILE A 64 120.831 5.585 10.437 1.00 0.00 O ATOM 941 CB ILE A 64 119.588 5.235 13.434 1.00 0.00 C ATOM 942 CG1 ILE A 64 120.705 6.227 13.780 1.00 0.00 C ATOM 943 CG2 ILE A 64 120.145 3.811 13.493 1.00 0.00 C ATOM 944 CD1 ILE A 64 121.185 5.978 15.209 1.00 0.00 C ATOM 0 H ILE A 64 117.320 4.550 12.737 1.00 0.00 H new ATOM 0 HA ILE A 64 119.012 6.625 11.886 1.00 0.00 H new ATOM 0 HB ILE A 64 118.775 5.328 14.154 1.00 0.00 H new ATOM 0 HG12 ILE A 64 121.535 6.115 13.082 1.00 0.00 H new ATOM 0 HG13 ILE A 64 120.341 7.250 13.681 1.00 0.00 H new ATOM 0 HG21 ILE A 64 120.534 3.614 14.492 1.00 0.00 H new ATOM 0 HG22 ILE A 64 119.351 3.100 13.266 1.00 0.00 H new ATOM 0 HG23 ILE A 64 120.948 3.704 12.763 1.00 0.00 H new ATOM 0 HD11 ILE A 64 121.979 6.683 15.454 1.00 0.00 H new ATOM 0 HD12 ILE A 64 120.353 6.113 15.901 1.00 0.00 H new ATOM 0 HD13 ILE A 64 121.565 4.960 15.293 1.00 0.00 H new ATOM 956 N LEU A 65 119.649 3.682 10.608 1.00 0.00 N ATOM 957 CA LEU A 65 120.438 3.003 9.593 1.00 0.00 C ATOM 958 C LEU A 65 120.332 3.731 8.261 1.00 0.00 C ATOM 959 O LEU A 65 121.326 3.904 7.552 1.00 0.00 O ATOM 960 CB LEU A 65 119.959 1.537 9.465 1.00 0.00 C ATOM 961 CG LEU A 65 121.054 0.567 9.951 1.00 0.00 C ATOM 962 CD1 LEU A 65 122.283 0.666 9.015 1.00 0.00 C ATOM 963 CD2 LEU A 65 121.450 0.894 11.415 1.00 0.00 C ATOM 0 H LEU A 65 118.899 3.122 11.014 1.00 0.00 H new ATOM 0 HA LEU A 65 121.487 3.005 9.889 1.00 0.00 H new ATOM 0 HB2 LEU A 65 119.051 1.392 10.050 1.00 0.00 H new ATOM 0 HB3 LEU A 65 119.707 1.320 8.427 1.00 0.00 H new ATOM 0 HG LEU A 65 120.672 -0.453 9.924 1.00 0.00 H new ATOM 0 HD11 LEU A 65 123.058 -0.020 9.358 1.00 0.00 H new ATOM 0 HD12 LEU A 65 121.989 0.402 7.999 1.00 0.00 H new ATOM 0 HD13 LEU A 65 122.669 1.685 9.028 1.00 0.00 H new ATOM 0 HD21 LEU A 65 122.224 0.202 11.746 1.00 0.00 H new ATOM 0 HD22 LEU A 65 121.828 1.915 11.470 1.00 0.00 H new ATOM 0 HD23 LEU A 65 120.576 0.796 12.059 1.00 0.00 H new ATOM 975 N VAL A 66 119.132 4.160 7.933 1.00 0.00 N ATOM 976 CA VAL A 66 118.921 4.876 6.691 1.00 0.00 C ATOM 977 C VAL A 66 119.721 6.174 6.693 1.00 0.00 C ATOM 978 O VAL A 66 120.297 6.560 5.680 1.00 0.00 O ATOM 979 CB VAL A 66 117.435 5.172 6.502 1.00 0.00 C ATOM 980 CG1 VAL A 66 117.236 5.993 5.235 1.00 0.00 C ATOM 981 CG2 VAL A 66 116.671 3.854 6.376 1.00 0.00 C ATOM 0 H VAL A 66 118.295 4.028 8.501 1.00 0.00 H new ATOM 0 HA VAL A 66 119.262 4.255 5.863 1.00 0.00 H new ATOM 0 HB VAL A 66 117.063 5.733 7.360 1.00 0.00 H new ATOM 0 HG11 VAL A 66 116.175 6.204 5.101 1.00 0.00 H new ATOM 0 HG12 VAL A 66 117.784 6.931 5.319 1.00 0.00 H new ATOM 0 HG13 VAL A 66 117.606 5.433 4.376 1.00 0.00 H new ATOM 0 HG21 VAL A 66 115.609 4.060 6.241 1.00 0.00 H new ATOM 0 HG22 VAL A 66 117.045 3.298 5.516 1.00 0.00 H new ATOM 0 HG23 VAL A 66 116.813 3.263 7.281 1.00 0.00 H new ATOM 991 N ILE A 67 119.744 6.849 7.835 1.00 0.00 N ATOM 992 CA ILE A 67 120.467 8.114 7.943 1.00 0.00 C ATOM 993 C ILE A 67 121.931 7.926 7.565 1.00 0.00 C ATOM 994 O ILE A 67 122.506 8.748 6.854 1.00 0.00 O ATOM 995 CB ILE A 67 120.379 8.653 9.372 1.00 0.00 C ATOM 996 CG1 ILE A 67 118.914 8.709 9.814 1.00 0.00 C ATOM 997 CG2 ILE A 67 120.988 10.054 9.445 1.00 0.00 C ATOM 998 CD1 ILE A 67 118.068 9.529 8.828 1.00 0.00 C ATOM 0 H ILE A 67 119.277 6.549 8.691 1.00 0.00 H new ATOM 0 HA ILE A 67 120.010 8.827 7.257 1.00 0.00 H new ATOM 0 HB ILE A 67 120.934 7.988 10.034 1.00 0.00 H new ATOM 0 HG12 ILE A 67 118.514 7.698 9.887 1.00 0.00 H new ATOM 0 HG13 ILE A 67 118.848 9.150 10.809 1.00 0.00 H new ATOM 0 HG21 ILE A 67 120.920 10.428 10.467 1.00 0.00 H new ATOM 0 HG22 ILE A 67 122.035 10.012 9.143 1.00 0.00 H new ATOM 0 HG23 ILE A 67 120.444 10.722 8.777 1.00 0.00 H new ATOM 0 HD11 ILE A 67 117.033 9.551 9.168 1.00 0.00 H new ATOM 0 HD12 ILE A 67 118.455 10.547 8.776 1.00 0.00 H new ATOM 0 HD13 ILE A 67 118.116 9.072 7.840 1.00 0.00 H new ATOM 1010 N ILE A 68 122.532 6.845 8.042 1.00 0.00 N ATOM 1011 CA ILE A 68 123.933 6.582 7.738 1.00 0.00 C ATOM 1012 C ILE A 68 124.126 6.424 6.229 1.00 0.00 C ATOM 1013 O ILE A 68 125.050 6.993 5.648 1.00 0.00 O ATOM 1014 CB ILE A 68 124.375 5.300 8.449 1.00 0.00 C ATOM 1015 CG1 ILE A 68 124.385 5.536 9.963 1.00 0.00 C ATOM 1016 CG2 ILE A 68 125.781 4.907 7.987 1.00 0.00 C ATOM 1017 CD1 ILE A 68 124.509 4.193 10.687 1.00 0.00 C ATOM 0 H ILE A 68 122.081 6.146 8.632 1.00 0.00 H new ATOM 0 HA ILE A 68 124.536 7.421 8.084 1.00 0.00 H new ATOM 0 HB ILE A 68 123.679 4.497 8.206 1.00 0.00 H new ATOM 0 HG12 ILE A 68 125.216 6.186 10.235 1.00 0.00 H new ATOM 0 HG13 ILE A 68 123.470 6.043 10.269 1.00 0.00 H new ATOM 0 HG21 ILE A 68 126.090 3.994 8.497 1.00 0.00 H new ATOM 0 HG22 ILE A 68 125.776 4.738 6.910 1.00 0.00 H new ATOM 0 HG23 ILE A 68 126.480 5.709 8.225 1.00 0.00 H new ATOM 0 HD11 ILE A 68 124.516 4.360 11.764 1.00 0.00 H new ATOM 0 HD12 ILE A 68 123.663 3.558 10.424 1.00 0.00 H new ATOM 0 HD13 ILE A 68 125.436 3.703 10.389 1.00 0.00 H new ATOM 1029 N LEU A 69 123.240 5.659 5.601 1.00 0.00 N ATOM 1030 CA LEU A 69 123.314 5.442 4.159 1.00 0.00 C ATOM 1031 C LEU A 69 123.044 6.742 3.406 1.00 0.00 C ATOM 1032 O LEU A 69 123.672 7.035 2.380 1.00 0.00 O ATOM 1033 CB LEU A 69 122.300 4.373 3.747 1.00 0.00 C ATOM 1034 CG LEU A 69 122.759 2.992 4.257 1.00 0.00 C ATOM 1035 CD1 LEU A 69 121.559 2.042 4.309 1.00 0.00 C ATOM 1036 CD2 LEU A 69 123.823 2.390 3.319 1.00 0.00 C ATOM 0 H LEU A 69 122.466 5.181 6.063 1.00 0.00 H new ATOM 0 HA LEU A 69 124.318 5.102 3.905 1.00 0.00 H new ATOM 0 HB2 LEU A 69 121.318 4.614 4.155 1.00 0.00 H new ATOM 0 HB3 LEU A 69 122.198 4.355 2.662 1.00 0.00 H new ATOM 0 HG LEU A 69 123.188 3.119 5.251 1.00 0.00 H new ATOM 0 HD11 LEU A 69 121.883 1.066 4.669 1.00 0.00 H new ATOM 0 HD12 LEU A 69 120.804 2.446 4.984 1.00 0.00 H new ATOM 0 HD13 LEU A 69 121.134 1.937 3.311 1.00 0.00 H new ATOM 0 HD21 LEU A 69 124.133 1.416 3.698 1.00 0.00 H new ATOM 0 HD22 LEU A 69 123.403 2.274 2.320 1.00 0.00 H new ATOM 0 HD23 LEU A 69 124.687 3.053 3.275 1.00 0.00 H new ATOM 1048 N TRP A 70 122.102 7.516 3.919 1.00 0.00 N ATOM 1049 CA TRP A 70 121.751 8.782 3.299 1.00 0.00 C ATOM 1050 C TRP A 70 122.948 9.722 3.304 1.00 0.00 C ATOM 1051 O TRP A 70 123.048 10.610 2.467 1.00 0.00 O ATOM 1052 CB TRP A 70 120.573 9.432 4.040 1.00 0.00 C ATOM 1053 CG TRP A 70 119.286 8.828 3.577 1.00 0.00 C ATOM 1054 CD1 TRP A 70 119.096 7.519 3.310 1.00 0.00 C ATOM 1055 CD2 TRP A 70 118.021 9.492 3.304 1.00 0.00 C ATOM 1056 NE1 TRP A 70 117.785 7.332 2.917 1.00 0.00 N ATOM 1057 CE2 TRP A 70 117.085 8.520 2.886 1.00 0.00 C ATOM 1058 CE3 TRP A 70 117.597 10.831 3.382 1.00 0.00 C ATOM 1059 CZ2 TRP A 70 115.773 8.860 2.557 1.00 0.00 C ATOM 1060 CZ3 TRP A 70 116.279 11.178 3.049 1.00 0.00 C ATOM 1061 CH2 TRP A 70 115.369 10.195 2.635 1.00 0.00 C ATOM 0 H TRP A 70 121.569 7.291 4.759 1.00 0.00 H new ATOM 0 HA TRP A 70 121.456 8.591 2.267 1.00 0.00 H new ATOM 0 HB2 TRP A 70 120.685 9.291 5.115 1.00 0.00 H new ATOM 0 HB3 TRP A 70 120.566 10.507 3.859 1.00 0.00 H new ATOM 0 HD1 TRP A 70 119.845 6.745 3.390 1.00 0.00 H new ATOM 0 HE1 TRP A 70 117.383 6.425 2.679 1.00 0.00 H new ATOM 0 HE3 TRP A 70 118.290 11.596 3.700 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 115.075 8.097 2.244 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 115.963 12.209 3.112 1.00 0.00 H new ATOM 0 HH2 TRP A 70 114.357 10.470 2.377 1.00 0.00 H new ATOM 1072 N ALA A 71 123.848 9.535 4.258 1.00 0.00 N ATOM 1073 CA ALA A 71 125.020 10.394 4.353 1.00 0.00 C ATOM 1074 C ALA A 71 125.738 10.485 3.010 1.00 0.00 C ATOM 1075 O ALA A 71 126.005 11.578 2.513 1.00 0.00 O ATOM 1076 CB ALA A 71 125.982 9.834 5.399 1.00 0.00 C ATOM 0 H ALA A 71 123.792 8.806 4.969 1.00 0.00 H new ATOM 0 HA ALA A 71 124.691 11.392 4.643 1.00 0.00 H new ATOM 0 HB1 ALA A 71 126.859 10.478 5.469 1.00 0.00 H new ATOM 0 HB2 ALA A 71 125.483 9.794 6.367 1.00 0.00 H new ATOM 0 HB3 ALA A 71 126.292 8.830 5.108 1.00 0.00 H new ATOM 1082 N ASP A 72 126.053 9.333 2.431 1.00 0.00 N ATOM 1083 CA ASP A 72 126.747 9.300 1.150 1.00 0.00 C ATOM 1084 C ASP A 72 125.819 9.692 0.004 1.00 0.00 C ATOM 1085 O ASP A 72 126.184 10.494 -0.857 1.00 0.00 O ATOM 1086 CB ASP A 72 127.300 7.899 0.899 1.00 0.00 C ATOM 1087 CG ASP A 72 128.107 7.880 -0.395 1.00 0.00 C ATOM 1088 OD1 ASP A 72 128.648 8.915 -0.748 1.00 0.00 O ATOM 1089 OD2 ASP A 72 128.170 6.831 -1.014 1.00 0.00 O ATOM 0 H ASP A 72 125.841 8.416 2.824 1.00 0.00 H new ATOM 0 HA ASP A 72 127.563 10.021 1.191 1.00 0.00 H new ATOM 0 HB2 ASP A 72 127.930 7.593 1.734 1.00 0.00 H new ATOM 0 HB3 ASP A 72 126.481 7.182 0.837 1.00 0.00 H new ATOM 1094 N TYR A 73 124.627 9.104 -0.011 1.00 0.00 N ATOM 1095 CA TYR A 73 123.660 9.388 -1.071 1.00 0.00 C ATOM 1096 C TYR A 73 123.221 10.852 -1.040 1.00 0.00 C ATOM 1097 O TYR A 73 123.117 11.504 -2.078 1.00 0.00 O ATOM 1098 CB TYR A 73 122.437 8.485 -0.918 1.00 0.00 C ATOM 1099 CG TYR A 73 121.436 8.797 -2.006 1.00 0.00 C ATOM 1100 CD1 TYR A 73 121.582 8.223 -3.272 1.00 0.00 C ATOM 1101 CD2 TYR A 73 120.361 9.656 -1.748 1.00 0.00 C ATOM 1102 CE1 TYR A 73 120.657 8.507 -4.280 1.00 0.00 C ATOM 1103 CE2 TYR A 73 119.435 9.940 -2.759 1.00 0.00 C ATOM 1104 CZ TYR A 73 119.584 9.366 -4.025 1.00 0.00 C ATOM 1105 OH TYR A 73 118.673 9.646 -5.023 1.00 0.00 O ATOM 0 H TYR A 73 124.308 8.435 0.689 1.00 0.00 H new ATOM 0 HA TYR A 73 124.143 9.193 -2.028 1.00 0.00 H new ATOM 0 HB2 TYR A 73 122.736 7.438 -0.975 1.00 0.00 H new ATOM 0 HB3 TYR A 73 121.983 8.634 0.062 1.00 0.00 H new ATOM 0 HD1 TYR A 73 122.410 7.559 -3.471 1.00 0.00 H new ATOM 0 HD2 TYR A 73 120.246 10.099 -0.770 1.00 0.00 H new ATOM 0 HE1 TYR A 73 120.771 8.062 -5.258 1.00 0.00 H new ATOM 0 HE2 TYR A 73 118.605 10.603 -2.561 1.00 0.00 H new ATOM 0 HH TYR A 73 118.763 8.986 -5.742 1.00 0.00 H new ATOM 1115 N ALA A 74 122.952 11.356 0.158 1.00 0.00 N ATOM 1116 CA ALA A 74 122.509 12.740 0.320 1.00 0.00 C ATOM 1117 C ALA A 74 123.585 13.721 -0.126 1.00 0.00 C ATOM 1118 O ALA A 74 123.288 14.733 -0.757 1.00 0.00 O ATOM 1119 CB ALA A 74 122.157 13.015 1.783 1.00 0.00 C ATOM 0 H ALA A 74 123.032 10.832 1.030 1.00 0.00 H new ATOM 0 HA ALA A 74 121.627 12.879 -0.305 1.00 0.00 H new ATOM 0 HB1 ALA A 74 121.829 14.049 1.890 1.00 0.00 H new ATOM 0 HB2 ALA A 74 121.356 12.346 2.097 1.00 0.00 H new ATOM 0 HB3 ALA A 74 123.035 12.847 2.406 1.00 0.00 H new ATOM 1125 N TYR A 75 124.836 13.423 0.210 1.00 0.00 N ATOM 1126 CA TYR A 75 125.935 14.304 -0.163 1.00 0.00 C ATOM 1127 C TYR A 75 126.003 14.479 -1.680 1.00 0.00 C ATOM 1128 O TYR A 75 125.980 15.599 -2.189 1.00 0.00 O ATOM 1129 CB TYR A 75 127.254 13.710 0.349 1.00 0.00 C ATOM 1130 CG TYR A 75 128.423 14.427 -0.297 1.00 0.00 C ATOM 1131 CD1 TYR A 75 128.631 15.787 -0.046 1.00 0.00 C ATOM 1132 CD2 TYR A 75 129.282 13.734 -1.161 1.00 0.00 C ATOM 1133 CE1 TYR A 75 129.695 16.456 -0.659 1.00 0.00 C ATOM 1134 CE2 TYR A 75 130.349 14.403 -1.770 1.00 0.00 C ATOM 1135 CZ TYR A 75 130.555 15.764 -1.521 1.00 0.00 C ATOM 1136 OH TYR A 75 131.602 16.424 -2.127 1.00 0.00 O ATOM 0 H TYR A 75 125.111 12.591 0.732 1.00 0.00 H new ATOM 0 HA TYR A 75 125.768 15.283 0.286 1.00 0.00 H new ATOM 0 HB2 TYR A 75 127.310 13.806 1.433 1.00 0.00 H new ATOM 0 HB3 TYR A 75 127.297 12.645 0.121 1.00 0.00 H new ATOM 0 HD1 TYR A 75 127.970 16.320 0.621 1.00 0.00 H new ATOM 0 HD2 TYR A 75 129.120 12.684 -1.356 1.00 0.00 H new ATOM 0 HE1 TYR A 75 129.854 17.507 -0.468 1.00 0.00 H new ATOM 0 HE2 TYR A 75 131.014 13.869 -2.432 1.00 0.00 H new ATOM 0 HH TYR A 75 132.101 15.797 -2.692 1.00 0.00 H new ATOM 1146 N ARG A 76 126.089 13.369 -2.396 1.00 0.00 N ATOM 1147 CA ARG A 76 126.166 13.425 -3.847 1.00 0.00 C ATOM 1148 C ARG A 76 124.898 14.043 -4.422 1.00 0.00 C ATOM 1149 O ARG A 76 124.937 14.728 -5.444 1.00 0.00 O ATOM 1150 CB ARG A 76 126.379 12.023 -4.417 1.00 0.00 C ATOM 1151 CG ARG A 76 127.792 11.544 -4.071 1.00 0.00 C ATOM 1152 CD ARG A 76 128.004 10.133 -4.620 1.00 0.00 C ATOM 1153 NE ARG A 76 127.173 9.182 -3.893 1.00 0.00 N ATOM 1154 CZ ARG A 76 127.136 7.900 -4.238 1.00 0.00 C ATOM 1155 NH1 ARG A 76 127.848 7.474 -5.245 1.00 0.00 N ATOM 1156 NH2 ARG A 76 126.386 7.066 -3.570 1.00 0.00 N ATOM 0 H ARG A 76 126.107 12.428 -2.002 1.00 0.00 H new ATOM 0 HA ARG A 76 127.014 14.050 -4.128 1.00 0.00 H new ATOM 0 HB2 ARG A 76 125.639 11.335 -4.007 1.00 0.00 H new ATOM 0 HB3 ARG A 76 126.241 12.033 -5.498 1.00 0.00 H new ATOM 0 HG2 ARG A 76 128.531 12.224 -4.494 1.00 0.00 H new ATOM 0 HG3 ARG A 76 127.934 11.550 -2.990 1.00 0.00 H new ATOM 0 HD2 ARG A 76 127.757 10.107 -5.681 1.00 0.00 H new ATOM 0 HD3 ARG A 76 129.054 9.853 -4.530 1.00 0.00 H new ATOM 0 HE ARG A 76 126.611 9.506 -3.106 1.00 0.00 H new ATOM 0 HH11 ARG A 76 128.433 8.126 -5.768 1.00 0.00 H new ATOM 0 HH12 ARG A 76 127.819 6.489 -5.510 1.00 0.00 H new ATOM 0 HH21 ARG A 76 125.829 7.399 -2.783 1.00 0.00 H new ATOM 0 HH22 ARG A 76 126.357 6.081 -3.835 1.00 0.00 H new ATOM 1170 N ALA A 77 123.773 13.796 -3.760 1.00 0.00 N ATOM 1171 CA ALA A 77 122.499 14.335 -4.216 1.00 0.00 C ATOM 1172 C ALA A 77 122.551 15.861 -4.258 1.00 0.00 C ATOM 1173 O ALA A 77 122.102 16.479 -5.223 1.00 0.00 O ATOM 1174 CB ALA A 77 121.378 13.884 -3.277 1.00 0.00 C ATOM 0 H ALA A 77 123.718 13.231 -2.913 1.00 0.00 H new ATOM 0 HA ALA A 77 122.302 13.961 -5.221 1.00 0.00 H new ATOM 0 HB1 ALA A 77 120.428 14.290 -3.623 1.00 0.00 H new ATOM 0 HB2 ALA A 77 121.326 12.795 -3.269 1.00 0.00 H new ATOM 0 HB3 ALA A 77 121.581 14.245 -2.269 1.00 0.00 H new ATOM 1180 N TYR A 78 123.113 16.456 -3.213 1.00 0.00 N ATOM 1181 CA TYR A 78 123.234 17.910 -3.145 1.00 0.00 C ATOM 1182 C TYR A 78 124.183 18.410 -4.228 1.00 0.00 C ATOM 1183 O TYR A 78 123.986 19.486 -4.792 1.00 0.00 O ATOM 1184 CB TYR A 78 123.743 18.335 -1.748 1.00 0.00 C ATOM 1185 CG TYR A 78 122.568 18.622 -0.834 1.00 0.00 C ATOM 1186 CD1 TYR A 78 121.679 17.595 -0.498 1.00 0.00 C ATOM 1187 CD2 TYR A 78 122.363 19.917 -0.339 1.00 0.00 C ATOM 1188 CE1 TYR A 78 120.587 17.861 0.335 1.00 0.00 C ATOM 1189 CE2 TYR A 78 121.269 20.182 0.492 1.00 0.00 C ATOM 1190 CZ TYR A 78 120.382 19.156 0.829 1.00 0.00 C ATOM 1191 OH TYR A 78 119.303 19.422 1.645 1.00 0.00 O ATOM 0 H TYR A 78 123.490 15.960 -2.406 1.00 0.00 H new ATOM 0 HA TYR A 78 122.252 18.354 -3.310 1.00 0.00 H new ATOM 0 HB2 TYR A 78 124.362 17.546 -1.322 1.00 0.00 H new ATOM 0 HB3 TYR A 78 124.372 19.221 -1.835 1.00 0.00 H new ATOM 0 HD1 TYR A 78 121.836 16.598 -0.881 1.00 0.00 H new ATOM 0 HD2 TYR A 78 123.049 20.710 -0.599 1.00 0.00 H new ATOM 0 HE1 TYR A 78 119.902 17.068 0.597 1.00 0.00 H new ATOM 0 HE2 TYR A 78 121.110 21.180 0.873 1.00 0.00 H new ATOM 0 HH TYR A 78 119.310 20.368 1.899 1.00 0.00 H new ATOM 1201 N LYS A 79 125.211 17.630 -4.507 1.00 0.00 N ATOM 1202 CA LYS A 79 126.184 18.018 -5.513 1.00 0.00 C ATOM 1203 C LYS A 79 125.496 18.250 -6.851 1.00 0.00 C ATOM 1204 O LYS A 79 125.791 19.216 -7.553 1.00 0.00 O ATOM 1205 CB LYS A 79 127.239 16.920 -5.669 1.00 0.00 C ATOM 1206 CG LYS A 79 128.387 17.404 -6.583 1.00 0.00 C ATOM 1207 CD LYS A 79 129.460 18.134 -5.747 1.00 0.00 C ATOM 1208 CE LYS A 79 130.482 17.124 -5.218 1.00 0.00 C ATOM 1209 NZ LYS A 79 131.453 16.808 -6.302 1.00 0.00 N ATOM 0 H LYS A 79 125.394 16.733 -4.057 1.00 0.00 H new ATOM 0 HA LYS A 79 126.665 18.942 -5.193 1.00 0.00 H new ATOM 0 HB2 LYS A 79 127.635 16.645 -4.691 1.00 0.00 H new ATOM 0 HB3 LYS A 79 126.782 16.025 -6.091 1.00 0.00 H new ATOM 0 HG2 LYS A 79 128.833 16.554 -7.100 1.00 0.00 H new ATOM 0 HG3 LYS A 79 127.995 18.073 -7.349 1.00 0.00 H new ATOM 0 HD2 LYS A 79 129.960 18.886 -6.357 1.00 0.00 H new ATOM 0 HD3 LYS A 79 128.991 18.660 -4.915 1.00 0.00 H new ATOM 0 HE2 LYS A 79 131.003 17.533 -4.353 1.00 0.00 H new ATOM 0 HE3 LYS A 79 129.978 16.216 -4.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 131.828 15.848 -6.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 130.974 16.863 -7.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 132.236 17.492 -6.277 1.00 0.00 H new ATOM 1223 N SER A 80 124.584 17.354 -7.204 1.00 0.00 N ATOM 1224 CA SER A 80 123.871 17.467 -8.467 1.00 0.00 C ATOM 1225 C SER A 80 123.081 18.770 -8.516 1.00 0.00 C ATOM 1226 O SER A 80 122.751 19.267 -9.592 1.00 0.00 O ATOM 1227 CB SER A 80 122.921 16.285 -8.637 1.00 0.00 C ATOM 1228 OG SER A 80 121.849 16.413 -7.713 1.00 0.00 O ATOM 0 H SER A 80 124.323 16.547 -6.638 1.00 0.00 H new ATOM 0 HA SER A 80 124.599 17.464 -9.278 1.00 0.00 H new ATOM 0 HB2 SER A 80 122.537 16.255 -9.657 1.00 0.00 H new ATOM 0 HB3 SER A 80 123.452 15.348 -8.469 1.00 0.00 H new ATOM 0 HG SER A 80 122.187 16.774 -6.867 1.00 0.00 H new ATOM 1234 N GLY A 81 122.783 19.318 -7.344 1.00 0.00 N ATOM 1235 CA GLY A 81 122.034 20.565 -7.263 1.00 0.00 C ATOM 1236 C GLY A 81 120.568 20.348 -7.619 1.00 0.00 C ATOM 1237 O GLY A 81 119.778 21.291 -7.650 1.00 0.00 O ATOM 0 H GLY A 81 123.047 18.921 -6.442 1.00 0.00 H new ATOM 0 HA2 GLY A 81 122.110 20.974 -6.255 1.00 0.00 H new ATOM 0 HA3 GLY A 81 122.471 21.300 -7.939 1.00 0.00 H new ATOM 1241 N ASP A 82 120.219 19.096 -7.886 1.00 0.00 N ATOM 1242 CA ASP A 82 118.852 18.739 -8.242 1.00 0.00 C ATOM 1243 C ASP A 82 118.553 17.312 -7.791 1.00 0.00 C ATOM 1244 O ASP A 82 118.568 16.382 -8.598 1.00 0.00 O ATOM 1245 CB ASP A 82 118.657 18.857 -9.755 1.00 0.00 C ATOM 1246 CG ASP A 82 118.859 20.305 -10.189 1.00 0.00 C ATOM 1247 OD1 ASP A 82 120.002 20.708 -10.326 1.00 0.00 O ATOM 1248 OD2 ASP A 82 117.867 20.991 -10.373 1.00 0.00 O ATOM 0 H ASP A 82 120.866 18.308 -7.863 1.00 0.00 H new ATOM 0 HA ASP A 82 118.166 19.423 -7.741 1.00 0.00 H new ATOM 0 HB2 ASP A 82 119.364 18.210 -10.274 1.00 0.00 H new ATOM 0 HB3 ASP A 82 117.657 18.521 -10.030 1.00 0.00 H new ATOM 1253 N PRO A 83 118.292 17.126 -6.520 1.00 0.00 N ATOM 1254 CA PRO A 83 117.992 15.779 -5.949 1.00 0.00 C ATOM 1255 C PRO A 83 116.928 15.039 -6.759 1.00 0.00 C ATOM 1256 O PRO A 83 116.983 13.818 -6.898 1.00 0.00 O ATOM 1257 CB PRO A 83 117.495 16.092 -4.527 1.00 0.00 C ATOM 1258 CG PRO A 83 118.125 17.402 -4.172 1.00 0.00 C ATOM 1259 CD PRO A 83 118.271 18.177 -5.487 1.00 0.00 C ATOM 0 HA PRO A 83 118.860 15.120 -5.962 1.00 0.00 H new ATOM 0 HB2 PRO A 83 116.407 16.156 -4.495 1.00 0.00 H new ATOM 0 HB3 PRO A 83 117.789 15.311 -3.826 1.00 0.00 H new ATOM 0 HG2 PRO A 83 117.506 17.952 -3.463 1.00 0.00 H new ATOM 0 HG3 PRO A 83 119.095 17.252 -3.699 1.00 0.00 H new ATOM 0 HD2 PRO A 83 117.441 18.868 -5.637 1.00 0.00 H new ATOM 0 HD3 PRO A 83 119.186 18.769 -5.502 1.00 0.00 H new ATOM 1267 N ALA A 84 115.969 15.782 -7.293 1.00 0.00 N ATOM 1268 CA ALA A 84 114.911 15.174 -8.084 1.00 0.00 C ATOM 1269 C ALA A 84 115.497 14.461 -9.295 1.00 0.00 C ATOM 1270 O ALA A 84 115.134 13.324 -9.593 1.00 0.00 O ATOM 1271 CB ALA A 84 113.919 16.248 -8.537 1.00 0.00 C ATOM 0 H ALA A 84 115.902 16.795 -7.194 1.00 0.00 H new ATOM 0 HA ALA A 84 114.389 14.441 -7.469 1.00 0.00 H new ATOM 0 HB1 ALA A 84 113.129 15.787 -9.129 1.00 0.00 H new ATOM 0 HB2 ALA A 84 113.482 16.732 -7.663 1.00 0.00 H new ATOM 0 HB3 ALA A 84 114.439 16.991 -9.142 1.00 0.00 H new ATOM 1277 N GLY A 85 116.413 15.132 -9.979 1.00 0.00 N ATOM 1278 CA GLY A 85 117.053 14.548 -11.148 1.00 0.00 C ATOM 1279 C GLY A 85 117.965 13.394 -10.748 1.00 0.00 C ATOM 1280 O GLY A 85 117.959 12.323 -11.367 1.00 0.00 O ATOM 0 H GLY A 85 116.728 16.074 -9.747 1.00 0.00 H new ATOM 0 HA2 GLY A 85 116.293 14.192 -11.844 1.00 0.00 H new ATOM 0 HA3 GLY A 85 117.632 15.310 -11.670 1.00 0.00 H new ATOM 1284 N TYR A 86 118.746 13.617 -9.702 1.00 0.00 N ATOM 1285 CA TYR A 86 119.665 12.600 -9.225 1.00 0.00 C ATOM 1286 C TYR A 86 118.890 11.348 -8.850 1.00 0.00 C ATOM 1287 O TYR A 86 119.311 10.234 -9.143 1.00 0.00 O ATOM 1288 CB TYR A 86 120.451 13.121 -8.008 1.00 0.00 C ATOM 1289 CG TYR A 86 121.726 12.323 -7.837 1.00 0.00 C ATOM 1290 CD1 TYR A 86 122.813 12.573 -8.683 1.00 0.00 C ATOM 1291 CD2 TYR A 86 121.822 11.341 -6.843 1.00 0.00 C ATOM 1292 CE1 TYR A 86 123.996 11.841 -8.538 1.00 0.00 C ATOM 1293 CE2 TYR A 86 123.008 10.608 -6.697 1.00 0.00 C ATOM 1294 CZ TYR A 86 124.095 10.859 -7.546 1.00 0.00 C ATOM 1295 OH TYR A 86 125.263 10.138 -7.405 1.00 0.00 O ATOM 0 H TYR A 86 118.761 14.488 -9.171 1.00 0.00 H new ATOM 0 HA TYR A 86 120.373 12.359 -10.018 1.00 0.00 H new ATOM 0 HB2 TYR A 86 120.688 14.177 -8.142 1.00 0.00 H new ATOM 0 HB3 TYR A 86 119.840 13.043 -7.109 1.00 0.00 H new ATOM 0 HD1 TYR A 86 122.738 13.332 -9.448 1.00 0.00 H new ATOM 0 HD2 TYR A 86 120.984 11.149 -6.190 1.00 0.00 H new ATOM 0 HE1 TYR A 86 124.834 12.034 -9.192 1.00 0.00 H new ATOM 0 HE2 TYR A 86 123.084 9.850 -5.931 1.00 0.00 H new ATOM 0 HH TYR A 86 125.165 9.498 -6.670 1.00 0.00 H new ATOM 1305 N VAL A 87 117.751 11.527 -8.201 1.00 0.00 N ATOM 1306 CA VAL A 87 116.953 10.381 -7.811 1.00 0.00 C ATOM 1307 C VAL A 87 116.441 9.628 -9.035 1.00 0.00 C ATOM 1308 O VAL A 87 116.554 8.404 -9.116 1.00 0.00 O ATOM 1309 CB VAL A 87 115.765 10.848 -6.956 1.00 0.00 C ATOM 1310 CG1 VAL A 87 114.713 9.729 -6.838 1.00 0.00 C ATOM 1311 CG2 VAL A 87 116.263 11.247 -5.557 1.00 0.00 C ATOM 0 H VAL A 87 117.366 12.434 -7.939 1.00 0.00 H new ATOM 0 HA VAL A 87 117.582 9.705 -7.232 1.00 0.00 H new ATOM 0 HB VAL A 87 115.302 11.710 -7.437 1.00 0.00 H new ATOM 0 HG11 VAL A 87 113.879 10.077 -6.229 1.00 0.00 H new ATOM 0 HG12 VAL A 87 114.351 9.463 -7.831 1.00 0.00 H new ATOM 0 HG13 VAL A 87 115.164 8.854 -6.370 1.00 0.00 H new ATOM 0 HG21 VAL A 87 115.419 11.578 -4.951 1.00 0.00 H new ATOM 0 HG22 VAL A 87 116.737 10.389 -5.081 1.00 0.00 H new ATOM 0 HG23 VAL A 87 116.986 12.058 -5.646 1.00 0.00 H new ATOM 1321 N LYS A 88 115.880 10.370 -9.977 1.00 0.00 N ATOM 1322 CA LYS A 88 115.346 9.768 -11.187 1.00 0.00 C ATOM 1323 C LYS A 88 116.417 8.933 -11.851 1.00 0.00 C ATOM 1324 O LYS A 88 116.122 8.088 -12.686 1.00 0.00 O ATOM 1325 CB LYS A 88 114.841 10.862 -12.150 1.00 0.00 C ATOM 1326 CG LYS A 88 113.308 10.961 -12.084 1.00 0.00 C ATOM 1327 CD LYS A 88 112.819 12.133 -12.943 1.00 0.00 C ATOM 1328 CE LYS A 88 112.985 13.457 -12.188 1.00 0.00 C ATOM 1329 NZ LYS A 88 112.362 14.551 -12.978 1.00 0.00 N ATOM 0 H LYS A 88 115.783 11.384 -9.927 1.00 0.00 H new ATOM 0 HA LYS A 88 114.504 9.126 -10.927 1.00 0.00 H new ATOM 0 HB2 LYS A 88 115.286 11.822 -11.887 1.00 0.00 H new ATOM 0 HB3 LYS A 88 115.154 10.633 -13.169 1.00 0.00 H new ATOM 0 HG2 LYS A 88 112.860 10.031 -12.435 1.00 0.00 H new ATOM 0 HG3 LYS A 88 112.989 11.099 -11.051 1.00 0.00 H new ATOM 0 HD2 LYS A 88 113.381 12.167 -13.876 1.00 0.00 H new ATOM 0 HD3 LYS A 88 111.772 11.986 -13.206 1.00 0.00 H new ATOM 0 HE2 LYS A 88 112.518 13.390 -11.205 1.00 0.00 H new ATOM 0 HE3 LYS A 88 114.042 13.666 -12.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 112.472 15.452 -12.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 112.827 14.618 -13.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 111.350 14.350 -13.112 1.00 0.00 H new ATOM 1343 N LYS A 89 117.661 9.194 -11.496 1.00 0.00 N ATOM 1344 CA LYS A 89 118.773 8.458 -12.080 1.00 0.00 C ATOM 1345 C LYS A 89 119.137 7.241 -11.229 1.00 0.00 C ATOM 1346 O LYS A 89 119.628 6.238 -11.749 1.00 0.00 O ATOM 1347 CB LYS A 89 119.985 9.376 -12.196 1.00 0.00 C ATOM 1348 CG LYS A 89 121.168 8.624 -12.861 1.00 0.00 C ATOM 1349 CD LYS A 89 122.189 8.177 -11.800 1.00 0.00 C ATOM 1350 CE LYS A 89 123.071 9.357 -11.387 1.00 0.00 C ATOM 1351 NZ LYS A 89 123.737 9.913 -12.598 1.00 0.00 N ATOM 0 H LYS A 89 117.928 9.903 -10.813 1.00 0.00 H new ATOM 0 HA LYS A 89 118.472 8.109 -13.068 1.00 0.00 H new ATOM 0 HB2 LYS A 89 119.728 10.257 -12.785 1.00 0.00 H new ATOM 0 HB3 LYS A 89 120.279 9.728 -11.207 1.00 0.00 H new ATOM 0 HG2 LYS A 89 120.795 7.755 -13.404 1.00 0.00 H new ATOM 0 HG3 LYS A 89 121.654 9.272 -13.591 1.00 0.00 H new ATOM 0 HD2 LYS A 89 121.669 7.780 -10.928 1.00 0.00 H new ATOM 0 HD3 LYS A 89 122.808 7.372 -12.196 1.00 0.00 H new ATOM 0 HE2 LYS A 89 122.469 10.126 -10.902 1.00 0.00 H new ATOM 0 HE3 LYS A 89 123.818 9.033 -10.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 124.656 10.320 -12.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 123.883 9.154 -13.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 123.138 10.654 -13.015 1.00 0.00 H new ATOM 1365 N THR A 90 118.914 7.347 -9.917 1.00 0.00 N ATOM 1366 CA THR A 90 119.239 6.261 -8.978 1.00 0.00 C ATOM 1367 C THR A 90 117.975 5.568 -8.494 1.00 0.00 C ATOM 1368 O THR A 90 117.863 5.207 -7.324 1.00 0.00 O ATOM 1369 CB THR A 90 119.992 6.819 -7.767 1.00 0.00 C ATOM 1370 OG1 THR A 90 119.110 7.616 -6.989 1.00 0.00 O ATOM 1371 CG2 THR A 90 121.159 7.676 -8.240 1.00 0.00 C ATOM 0 H THR A 90 118.509 8.173 -9.477 1.00 0.00 H new ATOM 0 HA THR A 90 119.864 5.540 -9.504 1.00 0.00 H new ATOM 0 HB THR A 90 120.369 5.993 -7.164 1.00 0.00 H new ATOM 0 HG1 THR A 90 118.928 7.166 -6.138 1.00 0.00 H new ATOM 0 HG21 THR A 90 121.693 8.072 -7.376 1.00 0.00 H new ATOM 0 HG22 THR A 90 121.837 7.068 -8.839 1.00 0.00 H new ATOM 0 HG23 THR A 90 120.783 8.502 -8.844 1.00 0.00 H new ATOM 1379 N LEU A 91 117.027 5.397 -9.402 1.00 0.00 N ATOM 1380 CA LEU A 91 115.756 4.760 -9.069 1.00 0.00 C ATOM 1381 C LEU A 91 116.003 3.355 -8.526 1.00 0.00 C ATOM 1382 O LEU A 91 115.138 2.776 -7.874 1.00 0.00 O ATOM 1383 CB LEU A 91 114.851 4.685 -10.320 1.00 0.00 C ATOM 1384 CG LEU A 91 115.265 5.762 -11.346 1.00 0.00 C ATOM 1385 CD1 LEU A 91 116.423 5.226 -12.226 1.00 0.00 C ATOM 1386 CD2 LEU A 91 114.050 6.122 -12.220 1.00 0.00 C ATOM 0 H LEU A 91 117.111 5.689 -10.376 1.00 0.00 H new ATOM 0 HA LEU A 91 115.256 5.356 -8.306 1.00 0.00 H new ATOM 0 HB2 LEU A 91 114.924 3.696 -10.771 1.00 0.00 H new ATOM 0 HB3 LEU A 91 113.809 4.828 -10.033 1.00 0.00 H new ATOM 0 HG LEU A 91 115.608 6.656 -10.826 1.00 0.00 H new ATOM 0 HD11 LEU A 91 116.713 5.988 -12.949 1.00 0.00 H new ATOM 0 HD12 LEU A 91 117.277 4.981 -11.594 1.00 0.00 H new ATOM 0 HD13 LEU A 91 116.094 4.331 -12.754 1.00 0.00 H new ATOM 0 HD21 LEU A 91 114.337 6.882 -12.946 1.00 0.00 H new ATOM 0 HD22 LEU A 91 113.703 5.232 -12.744 1.00 0.00 H new ATOM 0 HD23 LEU A 91 113.249 6.507 -11.589 1.00 0.00 H new ATOM 1398 N TYR A 92 117.175 2.808 -8.827 1.00 0.00 N ATOM 1399 CA TYR A 92 117.520 1.465 -8.377 1.00 0.00 C ATOM 1400 C TYR A 92 118.044 1.497 -6.941 1.00 0.00 C ATOM 1401 O TYR A 92 118.155 0.460 -6.289 1.00 0.00 O ATOM 1402 CB TYR A 92 118.586 0.865 -9.301 1.00 0.00 C ATOM 1403 CG TYR A 92 119.910 1.560 -9.073 1.00 0.00 C ATOM 1404 CD1 TYR A 92 120.795 1.070 -8.106 1.00 0.00 C ATOM 1405 CD2 TYR A 92 120.249 2.691 -9.824 1.00 0.00 C ATOM 1406 CE1 TYR A 92 122.021 1.712 -7.888 1.00 0.00 C ATOM 1407 CE2 TYR A 92 121.475 3.333 -9.608 1.00 0.00 C ATOM 1408 CZ TYR A 92 122.361 2.843 -8.640 1.00 0.00 C ATOM 1409 OH TYR A 92 123.567 3.476 -8.425 1.00 0.00 O ATOM 0 H TYR A 92 117.899 3.271 -9.377 1.00 0.00 H new ATOM 0 HA TYR A 92 116.622 0.848 -8.408 1.00 0.00 H new ATOM 0 HB2 TYR A 92 118.688 -0.203 -9.109 1.00 0.00 H new ATOM 0 HB3 TYR A 92 118.282 0.974 -10.342 1.00 0.00 H new ATOM 0 HD1 TYR A 92 120.533 0.197 -7.528 1.00 0.00 H new ATOM 0 HD2 TYR A 92 119.566 3.069 -10.570 1.00 0.00 H new ATOM 0 HE1 TYR A 92 122.703 1.335 -7.141 1.00 0.00 H new ATOM 0 HE2 TYR A 92 121.737 4.206 -10.188 1.00 0.00 H new ATOM 0 HH TYR A 92 123.647 4.242 -9.031 1.00 0.00 H new ATOM 1419 N GLU A 93 118.382 2.695 -6.459 1.00 0.00 N ATOM 1420 CA GLU A 93 118.910 2.852 -5.101 1.00 0.00 C ATOM 1421 C GLU A 93 117.799 3.245 -4.134 1.00 0.00 C ATOM 1422 O GLU A 93 117.788 2.816 -2.984 1.00 0.00 O ATOM 1423 CB GLU A 93 120.003 3.921 -5.089 1.00 0.00 C ATOM 1424 CG GLU A 93 120.702 3.923 -3.727 1.00 0.00 C ATOM 1425 CD GLU A 93 121.547 2.663 -3.579 1.00 0.00 C ATOM 1426 OE1 GLU A 93 121.717 1.969 -4.569 1.00 0.00 O ATOM 1427 OE2 GLU A 93 122.021 2.415 -2.484 1.00 0.00 O ATOM 0 H GLU A 93 118.301 3.566 -6.984 1.00 0.00 H new ATOM 0 HA GLU A 93 119.330 1.898 -4.782 1.00 0.00 H new ATOM 0 HB2 GLU A 93 120.726 3.725 -5.880 1.00 0.00 H new ATOM 0 HB3 GLU A 93 119.570 4.901 -5.289 1.00 0.00 H new ATOM 0 HG2 GLU A 93 121.332 4.808 -3.632 1.00 0.00 H new ATOM 0 HG3 GLU A 93 119.962 3.972 -2.928 1.00 0.00 H new ATOM 1434 N ILE A 94 116.858 4.041 -4.619 1.00 0.00 N ATOM 1435 CA ILE A 94 115.726 4.470 -3.804 1.00 0.00 C ATOM 1436 C ILE A 94 115.073 3.265 -3.124 1.00 0.00 C ATOM 1437 O ILE A 94 114.886 3.262 -1.906 1.00 0.00 O ATOM 1438 CB ILE A 94 114.684 5.215 -4.685 1.00 0.00 C ATOM 1439 CG1 ILE A 94 115.008 6.718 -4.725 1.00 0.00 C ATOM 1440 CG2 ILE A 94 113.253 5.037 -4.127 1.00 0.00 C ATOM 1441 CD1 ILE A 94 116.375 6.954 -5.381 1.00 0.00 C ATOM 0 H ILE A 94 116.854 4.404 -5.572 1.00 0.00 H new ATOM 0 HA ILE A 94 116.089 5.151 -3.034 1.00 0.00 H new ATOM 0 HB ILE A 94 114.734 4.789 -5.687 1.00 0.00 H new ATOM 0 HG12 ILE A 94 114.235 7.248 -5.281 1.00 0.00 H new ATOM 0 HG13 ILE A 94 115.008 7.123 -3.713 1.00 0.00 H new ATOM 0 HG21 ILE A 94 112.546 5.569 -4.763 1.00 0.00 H new ATOM 0 HG22 ILE A 94 112.999 3.977 -4.109 1.00 0.00 H new ATOM 0 HG23 ILE A 94 113.204 5.439 -3.115 1.00 0.00 H new ATOM 0 HD11 ILE A 94 116.589 8.023 -5.401 1.00 0.00 H new ATOM 0 HD12 ILE A 94 117.147 6.440 -4.808 1.00 0.00 H new ATOM 0 HD13 ILE A 94 116.361 6.567 -6.400 1.00 0.00 H new ATOM 1453 N PRO A 95 114.700 2.261 -3.883 1.00 0.00 N ATOM 1454 CA PRO A 95 114.030 1.049 -3.337 1.00 0.00 C ATOM 1455 C PRO A 95 114.759 0.504 -2.111 1.00 0.00 C ATOM 1456 O PRO A 95 114.154 -0.130 -1.249 1.00 0.00 O ATOM 1457 CB PRO A 95 114.062 0.039 -4.516 1.00 0.00 C ATOM 1458 CG PRO A 95 114.950 0.653 -5.553 1.00 0.00 C ATOM 1459 CD PRO A 95 114.851 2.153 -5.341 1.00 0.00 C ATOM 0 HA PRO A 95 113.017 1.255 -2.992 1.00 0.00 H new ATOM 0 HB2 PRO A 95 114.448 -0.928 -4.193 1.00 0.00 H new ATOM 0 HB3 PRO A 95 113.061 -0.134 -4.911 1.00 0.00 H new ATOM 0 HG2 PRO A 95 115.978 0.309 -5.442 1.00 0.00 H new ATOM 0 HG3 PRO A 95 114.628 0.377 -6.557 1.00 0.00 H new ATOM 0 HD2 PRO A 95 115.741 2.672 -5.696 1.00 0.00 H new ATOM 0 HD3 PRO A 95 114.000 2.582 -5.870 1.00 0.00 H new ATOM 1467 N ALA A 96 116.059 0.757 -2.040 1.00 0.00 N ATOM 1468 CA ALA A 96 116.861 0.285 -0.920 1.00 0.00 C ATOM 1469 C ALA A 96 116.770 1.245 0.259 1.00 0.00 C ATOM 1470 O ALA A 96 117.032 0.865 1.401 1.00 0.00 O ATOM 1471 CB ALA A 96 118.317 0.146 -1.355 1.00 0.00 C ATOM 0 H ALA A 96 116.579 1.284 -2.742 1.00 0.00 H new ATOM 0 HA ALA A 96 116.475 -0.685 -0.605 1.00 0.00 H new ATOM 0 HB1 ALA A 96 118.915 -0.207 -0.515 1.00 0.00 H new ATOM 0 HB2 ALA A 96 118.385 -0.569 -2.175 1.00 0.00 H new ATOM 0 HB3 ALA A 96 118.692 1.115 -1.686 1.00 0.00 H new ATOM 1477 N LEU A 97 116.403 2.491 -0.023 1.00 0.00 N ATOM 1478 CA LEU A 97 116.286 3.505 1.024 1.00 0.00 C ATOM 1479 C LEU A 97 114.851 3.599 1.511 1.00 0.00 C ATOM 1480 O LEU A 97 114.572 4.248 2.519 1.00 0.00 O ATOM 1481 CB LEU A 97 116.726 4.864 0.478 1.00 0.00 C ATOM 1482 CG LEU A 97 118.092 4.726 -0.201 1.00 0.00 C ATOM 1483 CD1 LEU A 97 118.495 6.070 -0.811 1.00 0.00 C ATOM 1484 CD2 LEU A 97 119.149 4.289 0.822 1.00 0.00 C ATOM 0 H LEU A 97 116.182 2.824 -0.962 1.00 0.00 H new ATOM 0 HA LEU A 97 116.927 3.220 1.859 1.00 0.00 H new ATOM 0 HB2 LEU A 97 115.990 5.237 -0.235 1.00 0.00 H new ATOM 0 HB3 LEU A 97 116.783 5.592 1.288 1.00 0.00 H new ATOM 0 HG LEU A 97 118.025 3.972 -0.985 1.00 0.00 H new ATOM 0 HD11 LEU A 97 119.467 5.973 -1.295 1.00 0.00 H new ATOM 0 HD12 LEU A 97 117.751 6.373 -1.548 1.00 0.00 H new ATOM 0 HD13 LEU A 97 118.554 6.823 -0.025 1.00 0.00 H new ATOM 0 HD21 LEU A 97 120.116 4.194 0.328 1.00 0.00 H new ATOM 0 HD22 LEU A 97 119.218 5.034 1.615 1.00 0.00 H new ATOM 0 HD23 LEU A 97 118.865 3.328 1.251 1.00 0.00 H new ATOM 1496 N VAL A 98 113.939 2.946 0.792 1.00 0.00 N ATOM 1497 CA VAL A 98 112.526 2.966 1.165 1.00 0.00 C ATOM 1498 C VAL A 98 112.373 2.871 2.694 1.00 0.00 C ATOM 1499 O VAL A 98 112.538 1.793 3.264 1.00 0.00 O ATOM 1500 CB VAL A 98 111.770 1.810 0.479 1.00 0.00 C ATOM 1501 CG1 VAL A 98 110.443 1.535 1.211 1.00 0.00 C ATOM 1502 CG2 VAL A 98 111.470 2.211 -0.973 1.00 0.00 C ATOM 0 H VAL A 98 114.150 2.402 -0.044 1.00 0.00 H new ATOM 0 HA VAL A 98 112.095 3.909 0.830 1.00 0.00 H new ATOM 0 HB VAL A 98 112.383 0.909 0.506 1.00 0.00 H new ATOM 0 HG11 VAL A 98 109.918 0.717 0.718 1.00 0.00 H new ATOM 0 HG12 VAL A 98 110.648 1.263 2.246 1.00 0.00 H new ATOM 0 HG13 VAL A 98 109.822 2.431 1.188 1.00 0.00 H new ATOM 0 HG21 VAL A 98 110.935 1.402 -1.471 1.00 0.00 H new ATOM 0 HG22 VAL A 98 110.856 3.112 -0.982 1.00 0.00 H new ATOM 0 HG23 VAL A 98 112.406 2.404 -1.498 1.00 0.00 H new ATOM 1512 N PRO A 99 112.056 3.959 3.364 1.00 0.00 N ATOM 1513 CA PRO A 99 111.875 3.951 4.846 1.00 0.00 C ATOM 1514 C PRO A 99 110.853 2.903 5.294 1.00 0.00 C ATOM 1515 O PRO A 99 109.827 2.705 4.643 1.00 0.00 O ATOM 1516 CB PRO A 99 111.376 5.376 5.162 1.00 0.00 C ATOM 1517 CG PRO A 99 111.827 6.221 4.015 1.00 0.00 C ATOM 1518 CD PRO A 99 111.848 5.306 2.796 1.00 0.00 C ATOM 0 HA PRO A 99 112.795 3.692 5.370 1.00 0.00 H new ATOM 0 HB2 PRO A 99 110.291 5.398 5.263 1.00 0.00 H new ATOM 0 HB3 PRO A 99 111.791 5.738 6.103 1.00 0.00 H new ATOM 0 HG2 PRO A 99 111.150 7.061 3.860 1.00 0.00 H new ATOM 0 HG3 PRO A 99 112.815 6.640 4.205 1.00 0.00 H new ATOM 0 HD2 PRO A 99 110.914 5.364 2.237 1.00 0.00 H new ATOM 0 HD3 PRO A 99 112.648 5.577 2.107 1.00 0.00 H new ATOM 1526 N ALA A 100 111.140 2.244 6.413 1.00 0.00 N ATOM 1527 CA ALA A 100 110.241 1.226 6.947 1.00 0.00 C ATOM 1528 C ALA A 100 108.897 1.841 7.303 1.00 0.00 C ATOM 1529 O ALA A 100 107.857 1.204 7.174 1.00 0.00 O ATOM 1530 CB ALA A 100 110.854 0.587 8.192 1.00 0.00 C ATOM 0 H ALA A 100 111.984 2.396 6.965 1.00 0.00 H new ATOM 0 HA ALA A 100 110.092 0.462 6.184 1.00 0.00 H new ATOM 0 HB1 ALA A 100 110.176 -0.171 8.583 1.00 0.00 H new ATOM 0 HB2 ALA A 100 111.806 0.123 7.932 1.00 0.00 H new ATOM 0 HB3 ALA A 100 111.019 1.352 8.950 1.00 0.00 H new ATOM 1536 N GLY A 101 108.923 3.082 7.759 1.00 0.00 N ATOM 1537 CA GLY A 101 107.694 3.760 8.125 1.00 0.00 C ATOM 1538 C GLY A 101 106.812 3.985 6.900 1.00 0.00 C ATOM 1539 O GLY A 101 105.592 3.931 6.984 1.00 0.00 O ATOM 0 H GLY A 101 109.772 3.634 7.883 1.00 0.00 H new ATOM 0 HA2 GLY A 101 107.153 3.168 8.864 1.00 0.00 H new ATOM 0 HA3 GLY A 101 107.927 4.717 8.592 1.00 0.00 H new ATOM 1543 N LEU A 102 107.433 4.254 5.763 1.00 0.00 N ATOM 1544 CA LEU A 102 106.674 4.512 4.544 1.00 0.00 C ATOM 1545 C LEU A 102 105.556 3.483 4.350 1.00 0.00 C ATOM 1546 O LEU A 102 104.368 3.826 4.343 1.00 0.00 O ATOM 1547 CB LEU A 102 107.617 4.482 3.335 1.00 0.00 C ATOM 1548 CG LEU A 102 106.846 4.805 2.043 1.00 0.00 C ATOM 1549 CD1 LEU A 102 106.242 6.218 2.127 1.00 0.00 C ATOM 1550 CD2 LEU A 102 107.804 4.714 0.846 1.00 0.00 C ATOM 0 H LEU A 102 108.446 4.300 5.656 1.00 0.00 H new ATOM 0 HA LEU A 102 106.215 5.496 4.634 1.00 0.00 H new ATOM 0 HB2 LEU A 102 108.422 5.204 3.476 1.00 0.00 H new ATOM 0 HB3 LEU A 102 108.081 3.499 3.253 1.00 0.00 H new ATOM 0 HG LEU A 102 106.036 4.087 1.916 1.00 0.00 H new ATOM 0 HD11 LEU A 102 105.699 6.437 1.208 1.00 0.00 H new ATOM 0 HD12 LEU A 102 105.558 6.272 2.974 1.00 0.00 H new ATOM 0 HD13 LEU A 102 107.041 6.948 2.259 1.00 0.00 H new ATOM 0 HD21 LEU A 102 107.262 4.942 -0.072 1.00 0.00 H new ATOM 0 HD22 LEU A 102 108.616 5.429 0.975 1.00 0.00 H new ATOM 0 HD23 LEU A 102 108.214 3.706 0.784 1.00 0.00 H new ATOM 1562 N LEU A 103 105.943 2.226 4.186 1.00 0.00 N ATOM 1563 CA LEU A 103 104.972 1.159 3.982 1.00 0.00 C ATOM 1564 C LEU A 103 104.143 0.944 5.245 1.00 0.00 C ATOM 1565 O LEU A 103 102.964 0.601 5.170 1.00 0.00 O ATOM 1566 CB LEU A 103 105.695 -0.147 3.596 1.00 0.00 C ATOM 1567 CG LEU A 103 107.086 -0.202 4.277 1.00 0.00 C ATOM 1568 CD1 LEU A 103 107.444 -1.644 4.634 1.00 0.00 C ATOM 1569 CD2 LEU A 103 108.160 0.361 3.335 1.00 0.00 C ATOM 0 H LEU A 103 106.916 1.920 4.190 1.00 0.00 H new ATOM 0 HA LEU A 103 104.303 1.448 3.171 1.00 0.00 H new ATOM 0 HB2 LEU A 103 105.098 -1.007 3.900 1.00 0.00 H new ATOM 0 HB3 LEU A 103 105.808 -0.204 2.513 1.00 0.00 H new ATOM 0 HG LEU A 103 107.046 0.399 5.186 1.00 0.00 H new ATOM 0 HD11 LEU A 103 108.423 -1.668 5.112 1.00 0.00 H new ATOM 0 HD12 LEU A 103 106.697 -2.046 5.318 1.00 0.00 H new ATOM 0 HD13 LEU A 103 107.468 -2.248 3.727 1.00 0.00 H new ATOM 0 HD21 LEU A 103 109.133 0.317 3.825 1.00 0.00 H new ATOM 0 HD22 LEU A 103 108.187 -0.230 2.420 1.00 0.00 H new ATOM 0 HD23 LEU A 103 107.923 1.397 3.091 1.00 0.00 H new ATOM 1581 N ALA A 104 104.773 1.122 6.401 1.00 0.00 N ATOM 1582 CA ALA A 104 104.083 0.920 7.668 1.00 0.00 C ATOM 1583 C ALA A 104 102.807 1.756 7.725 1.00 0.00 C ATOM 1584 O ALA A 104 101.729 1.238 8.013 1.00 0.00 O ATOM 1585 CB ALA A 104 105.003 1.306 8.832 1.00 0.00 C ATOM 0 H ALA A 104 105.750 1.403 6.487 1.00 0.00 H new ATOM 0 HA ALA A 104 103.816 -0.134 7.750 1.00 0.00 H new ATOM 0 HB1 ALA A 104 104.480 1.152 9.776 1.00 0.00 H new ATOM 0 HB2 ALA A 104 105.899 0.686 8.809 1.00 0.00 H new ATOM 0 HB3 ALA A 104 105.285 2.355 8.740 1.00 0.00 H new ATOM 1591 N LEU A 105 102.937 3.046 7.439 1.00 0.00 N ATOM 1592 CA LEU A 105 101.785 3.939 7.453 1.00 0.00 C ATOM 1593 C LEU A 105 100.783 3.531 6.380 1.00 0.00 C ATOM 1594 O LEU A 105 99.574 3.538 6.613 1.00 0.00 O ATOM 1595 CB LEU A 105 102.247 5.392 7.233 1.00 0.00 C ATOM 1596 CG LEU A 105 102.619 6.042 8.575 1.00 0.00 C ATOM 1597 CD1 LEU A 105 103.650 5.184 9.310 1.00 0.00 C ATOM 1598 CD2 LEU A 105 103.203 7.431 8.312 1.00 0.00 C ATOM 0 H LEU A 105 103.821 3.494 7.197 1.00 0.00 H new ATOM 0 HA LEU A 105 101.295 3.868 8.424 1.00 0.00 H new ATOM 0 HB2 LEU A 105 103.106 5.410 6.562 1.00 0.00 H new ATOM 0 HB3 LEU A 105 101.454 5.964 6.751 1.00 0.00 H new ATOM 0 HG LEU A 105 101.726 6.125 9.195 1.00 0.00 H new ATOM 0 HD11 LEU A 105 103.905 5.655 10.259 1.00 0.00 H new ATOM 0 HD12 LEU A 105 103.233 4.194 9.497 1.00 0.00 H new ATOM 0 HD13 LEU A 105 104.547 5.090 8.699 1.00 0.00 H new ATOM 0 HD21 LEU A 105 103.470 7.899 9.260 1.00 0.00 H new ATOM 0 HD22 LEU A 105 104.093 7.340 7.689 1.00 0.00 H new ATOM 0 HD23 LEU A 105 102.463 8.046 7.799 1.00 0.00 H new ATOM 1610 N ILE A 106 101.288 3.179 5.206 1.00 0.00 N ATOM 1611 CA ILE A 106 100.411 2.780 4.114 1.00 0.00 C ATOM 1612 C ILE A 106 99.636 1.517 4.487 1.00 0.00 C ATOM 1613 O ILE A 106 98.433 1.421 4.238 1.00 0.00 O ATOM 1614 CB ILE A 106 101.238 2.522 2.849 1.00 0.00 C ATOM 1615 CG1 ILE A 106 101.829 3.848 2.350 1.00 0.00 C ATOM 1616 CG2 ILE A 106 100.349 1.912 1.759 1.00 0.00 C ATOM 1617 CD1 ILE A 106 102.833 3.591 1.217 1.00 0.00 C ATOM 0 H ILE A 106 102.284 3.161 4.987 1.00 0.00 H new ATOM 0 HA ILE A 106 99.702 3.586 3.925 1.00 0.00 H new ATOM 0 HB ILE A 106 102.044 1.826 3.081 1.00 0.00 H new ATOM 0 HG12 ILE A 106 101.030 4.500 1.996 1.00 0.00 H new ATOM 0 HG13 ILE A 106 102.323 4.366 3.172 1.00 0.00 H new ATOM 0 HG21 ILE A 106 100.943 1.732 0.863 1.00 0.00 H new ATOM 0 HG22 ILE A 106 99.933 0.969 2.114 1.00 0.00 H new ATOM 0 HG23 ILE A 106 99.538 2.601 1.523 1.00 0.00 H new ATOM 0 HD11 ILE A 106 103.244 4.540 0.873 1.00 0.00 H new ATOM 0 HD12 ILE A 106 103.641 2.957 1.583 1.00 0.00 H new ATOM 0 HD13 ILE A 106 102.328 3.093 0.389 1.00 0.00 H new ATOM 1629 N GLU A 107 100.336 0.554 5.075 1.00 0.00 N ATOM 1630 CA GLU A 107 99.709 -0.703 5.465 1.00 0.00 C ATOM 1631 C GLU A 107 98.713 -0.479 6.596 1.00 0.00 C ATOM 1632 O GLU A 107 97.654 -1.102 6.636 1.00 0.00 O ATOM 1633 CB GLU A 107 100.779 -1.703 5.908 1.00 0.00 C ATOM 1634 CG GLU A 107 100.134 -3.070 6.136 1.00 0.00 C ATOM 1635 CD GLU A 107 101.197 -4.096 6.514 1.00 0.00 C ATOM 1636 OE1 GLU A 107 102.307 -3.687 6.810 1.00 0.00 O ATOM 1637 OE2 GLU A 107 100.885 -5.275 6.499 1.00 0.00 O ATOM 0 H GLU A 107 101.331 0.618 5.291 1.00 0.00 H new ATOM 0 HA GLU A 107 99.173 -1.104 4.604 1.00 0.00 H new ATOM 0 HB2 GLU A 107 101.558 -1.778 5.149 1.00 0.00 H new ATOM 0 HB3 GLU A 107 101.258 -1.358 6.824 1.00 0.00 H new ATOM 0 HG2 GLU A 107 99.387 -3.001 6.927 1.00 0.00 H new ATOM 0 HG3 GLU A 107 99.614 -3.390 5.233 1.00 0.00 H new ATOM 1644 N GLY A 108 99.064 0.412 7.519 1.00 0.00 N ATOM 1645 CA GLY A 108 98.194 0.704 8.650 1.00 0.00 C ATOM 1646 C GLY A 108 96.857 1.274 8.185 1.00 0.00 C ATOM 1647 O GLY A 108 95.804 0.897 8.696 1.00 0.00 O ATOM 0 H GLY A 108 99.937 0.939 7.506 1.00 0.00 H new ATOM 0 HA2 GLY A 108 98.024 -0.206 9.226 1.00 0.00 H new ATOM 0 HA3 GLY A 108 98.684 1.415 9.315 1.00 0.00 H new ATOM 1651 N HIS A 109 96.904 2.181 7.217 1.00 0.00 N ATOM 1652 CA HIS A 109 95.684 2.791 6.703 1.00 0.00 C ATOM 1653 C HIS A 109 94.778 1.733 6.071 1.00 0.00 C ATOM 1654 O HIS A 109 93.577 1.669 6.351 1.00 0.00 O ATOM 1655 CB HIS A 109 96.041 3.851 5.657 1.00 0.00 C ATOM 1656 CG HIS A 109 94.807 4.624 5.282 1.00 0.00 C ATOM 1657 ND1 HIS A 109 94.130 4.408 4.091 1.00 0.00 N ATOM 1658 CD2 HIS A 109 94.119 5.618 5.931 1.00 0.00 C ATOM 1659 CE1 HIS A 109 93.085 5.256 4.061 1.00 0.00 C ATOM 1660 NE2 HIS A 109 93.032 6.015 5.160 1.00 0.00 N ATOM 0 H HIS A 109 97.764 2.508 6.776 1.00 0.00 H new ATOM 0 HA HIS A 109 95.151 3.257 7.532 1.00 0.00 H new ATOM 0 HB2 HIS A 109 96.799 4.526 6.053 1.00 0.00 H new ATOM 0 HB3 HIS A 109 96.467 3.376 4.774 1.00 0.00 H new ATOM 0 HD2 HIS A 109 94.382 6.030 6.894 1.00 0.00 H new ATOM 0 HE1 HIS A 109 92.376 5.316 3.248 1.00 0.00 H new ATOM 0 HE2 HIS A 109 92.342 6.732 5.385 1.00 0.00 H new ATOM 1668 N LEU A 110 95.363 0.900 5.219 1.00 0.00 N ATOM 1669 CA LEU A 110 94.603 -0.150 4.552 1.00 0.00 C ATOM 1670 C LEU A 110 94.051 -1.135 5.575 1.00 0.00 C ATOM 1671 O LEU A 110 92.908 -1.582 5.469 1.00 0.00 O ATOM 1672 CB LEU A 110 95.499 -0.887 3.559 1.00 0.00 C ATOM 1673 CG LEU A 110 95.902 0.066 2.421 1.00 0.00 C ATOM 1674 CD1 LEU A 110 96.969 -0.607 1.550 1.00 0.00 C ATOM 1675 CD2 LEU A 110 94.672 0.443 1.562 1.00 0.00 C ATOM 0 H LEU A 110 96.353 0.930 4.975 1.00 0.00 H new ATOM 0 HA LEU A 110 93.770 0.307 4.017 1.00 0.00 H new ATOM 0 HB2 LEU A 110 96.389 -1.262 4.065 1.00 0.00 H new ATOM 0 HB3 LEU A 110 94.975 -1.752 3.154 1.00 0.00 H new ATOM 0 HG LEU A 110 96.308 0.981 2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 110 97.257 0.066 0.742 1.00 0.00 H new ATOM 0 HD12 LEU A 110 97.843 -0.838 2.159 1.00 0.00 H new ATOM 0 HD13 LEU A 110 96.567 -1.528 1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 110 94.979 1.118 0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 110 94.240 -0.459 1.129 1.00 0.00 H new ATOM 0 HD23 LEU A 110 93.929 0.937 2.188 1.00 0.00 H new ATOM 1687 N ALA A 111 94.870 -1.469 6.566 1.00 0.00 N ATOM 1688 CA ALA A 111 94.457 -2.403 7.604 1.00 0.00 C ATOM 1689 C ALA A 111 93.209 -1.895 8.319 1.00 0.00 C ATOM 1690 O ALA A 111 92.270 -2.652 8.561 1.00 0.00 O ATOM 1691 CB ALA A 111 95.586 -2.584 8.620 1.00 0.00 C ATOM 0 H ALA A 111 95.818 -1.109 6.672 1.00 0.00 H new ATOM 0 HA ALA A 111 94.229 -3.360 7.134 1.00 0.00 H new ATOM 0 HB1 ALA A 111 95.270 -3.284 9.394 1.00 0.00 H new ATOM 0 HB2 ALA A 111 96.470 -2.975 8.116 1.00 0.00 H new ATOM 0 HB3 ALA A 111 95.823 -1.623 9.075 1.00 0.00 H new ATOM 1697 N GLY A 112 93.196 -0.608 8.646 1.00 0.00 N ATOM 1698 CA GLY A 112 92.051 -0.019 9.328 1.00 0.00 C ATOM 1699 C GLY A 112 90.793 -0.142 8.477 1.00 0.00 C ATOM 1700 O GLY A 112 89.700 -0.367 8.997 1.00 0.00 O ATOM 0 H GLY A 112 93.958 0.042 8.452 1.00 0.00 H new ATOM 0 HA2 GLY A 112 91.898 -0.516 10.286 1.00 0.00 H new ATOM 0 HA3 GLY A 112 92.250 1.031 9.542 1.00 0.00 H new ATOM 1704 N LEU A 113 90.956 0.002 7.167 1.00 0.00 N ATOM 1705 CA LEU A 113 89.820 -0.096 6.255 1.00 0.00 C ATOM 1706 C LEU A 113 89.317 -1.533 6.178 1.00 0.00 C ATOM 1707 O LEU A 113 88.262 -1.801 5.603 1.00 0.00 O ATOM 1708 CB LEU A 113 90.230 0.376 4.858 1.00 0.00 C ATOM 1709 CG LEU A 113 90.531 1.883 4.883 1.00 0.00 C ATOM 1710 CD1 LEU A 113 91.172 2.289 3.552 1.00 0.00 C ATOM 1711 CD2 LEU A 113 89.235 2.693 5.109 1.00 0.00 C ATOM 0 H LEU A 113 91.852 0.185 6.715 1.00 0.00 H new ATOM 0 HA LEU A 113 89.019 0.539 6.634 1.00 0.00 H new ATOM 0 HB2 LEU A 113 91.109 -0.174 4.522 1.00 0.00 H new ATOM 0 HB3 LEU A 113 89.432 0.167 4.145 1.00 0.00 H new ATOM 0 HG LEU A 113 91.216 2.095 5.704 1.00 0.00 H new ATOM 0 HD11 LEU A 113 91.388 3.357 3.563 1.00 0.00 H new ATOM 0 HD12 LEU A 113 92.099 1.733 3.410 1.00 0.00 H new ATOM 0 HD13 LEU A 113 90.486 2.066 2.735 1.00 0.00 H new ATOM 0 HD21 LEU A 113 89.469 3.757 5.124 1.00 0.00 H new ATOM 0 HD22 LEU A 113 88.532 2.487 4.302 1.00 0.00 H new ATOM 0 HD23 LEU A 113 88.788 2.407 6.061 1.00 0.00 H new ATOM 1723 N GLY A 114 90.071 -2.453 6.769 1.00 0.00 N ATOM 1724 CA GLY A 114 89.685 -3.857 6.767 1.00 0.00 C ATOM 1725 C GLY A 114 90.087 -4.526 5.460 1.00 0.00 C ATOM 1726 O GLY A 114 89.617 -5.618 5.142 1.00 0.00 O ATOM 0 H GLY A 114 90.947 -2.253 7.252 1.00 0.00 H new ATOM 0 HA2 GLY A 114 90.158 -4.370 7.604 1.00 0.00 H new ATOM 0 HA3 GLY A 114 88.608 -3.943 6.908 1.00 0.00 H new ATOM 1730 N LEU A 115 90.962 -3.865 4.705 1.00 0.00 N ATOM 1731 CA LEU A 115 91.430 -4.401 3.427 1.00 0.00 C ATOM 1732 C LEU A 115 92.811 -5.019 3.589 1.00 0.00 C ATOM 1733 O LEU A 115 93.799 -4.315 3.795 1.00 0.00 O ATOM 1734 CB LEU A 115 91.494 -3.277 2.392 1.00 0.00 C ATOM 1735 CG LEU A 115 90.077 -2.754 2.107 1.00 0.00 C ATOM 1736 CD1 LEU A 115 90.170 -1.423 1.357 1.00 0.00 C ATOM 1737 CD2 LEU A 115 89.282 -3.767 1.258 1.00 0.00 C ATOM 0 H LEU A 115 91.361 -2.960 4.954 1.00 0.00 H new ATOM 0 HA LEU A 115 90.734 -5.170 3.092 1.00 0.00 H new ATOM 0 HB2 LEU A 115 92.124 -2.467 2.759 1.00 0.00 H new ATOM 0 HB3 LEU A 115 91.949 -3.643 1.472 1.00 0.00 H new ATOM 0 HG LEU A 115 89.559 -2.613 3.055 1.00 0.00 H new ATOM 0 HD11 LEU A 115 89.167 -1.049 1.153 1.00 0.00 H new ATOM 0 HD12 LEU A 115 90.710 -0.699 1.967 1.00 0.00 H new ATOM 0 HD13 LEU A 115 90.700 -1.572 0.416 1.00 0.00 H new ATOM 0 HD21 LEU A 115 88.282 -3.377 1.068 1.00 0.00 H new ATOM 0 HD22 LEU A 115 89.795 -3.929 0.310 1.00 0.00 H new ATOM 0 HD23 LEU A 115 89.207 -4.712 1.795 1.00 0.00 H new ATOM 1749 N PHE A 116 92.870 -6.345 3.499 1.00 0.00 N ATOM 1750 CA PHE A 116 94.135 -7.065 3.638 1.00 0.00 C ATOM 1751 C PHE A 116 94.604 -7.574 2.280 1.00 0.00 C ATOM 1752 O PHE A 116 95.694 -8.130 2.156 1.00 0.00 O ATOM 1753 CB PHE A 116 93.951 -8.249 4.590 1.00 0.00 C ATOM 1754 CG PHE A 116 93.207 -7.791 5.824 1.00 0.00 C ATOM 1755 CD1 PHE A 116 93.881 -7.094 6.834 1.00 0.00 C ATOM 1756 CD2 PHE A 116 91.839 -8.063 5.956 1.00 0.00 C ATOM 1757 CE1 PHE A 116 93.188 -6.668 7.974 1.00 0.00 C ATOM 1758 CE2 PHE A 116 91.147 -7.639 7.097 1.00 0.00 C ATOM 1759 CZ PHE A 116 91.822 -6.942 8.106 1.00 0.00 C ATOM 0 H PHE A 116 92.060 -6.942 3.331 1.00 0.00 H new ATOM 0 HA PHE A 116 94.885 -6.384 4.041 1.00 0.00 H new ATOM 0 HB2 PHE A 116 93.398 -9.046 4.094 1.00 0.00 H new ATOM 0 HB3 PHE A 116 94.921 -8.660 4.869 1.00 0.00 H new ATOM 0 HD1 PHE A 116 94.936 -6.885 6.734 1.00 0.00 H new ATOM 0 HD2 PHE A 116 91.318 -8.600 5.177 1.00 0.00 H new ATOM 0 HE1 PHE A 116 93.708 -6.128 8.751 1.00 0.00 H new ATOM 0 HE2 PHE A 116 90.093 -7.850 7.199 1.00 0.00 H new ATOM 0 HZ PHE A 116 91.288 -6.616 8.986 1.00 0.00 H new ATOM 1769 N ARG A 117 93.778 -7.389 1.260 1.00 0.00 N ATOM 1770 CA ARG A 117 94.135 -7.847 -0.074 1.00 0.00 C ATOM 1771 C ARG A 117 95.383 -7.134 -0.580 1.00 0.00 C ATOM 1772 O ARG A 117 96.374 -7.770 -0.939 1.00 0.00 O ATOM 1773 CB ARG A 117 92.967 -7.583 -1.035 1.00 0.00 C ATOM 1774 CG ARG A 117 91.796 -8.555 -0.749 1.00 0.00 C ATOM 1775 CD ARG A 117 91.872 -9.775 -1.675 1.00 0.00 C ATOM 1776 NE ARG A 117 93.088 -10.532 -1.415 1.00 0.00 N ATOM 1777 CZ ARG A 117 93.527 -11.444 -2.272 1.00 0.00 C ATOM 1778 NH1 ARG A 117 92.859 -11.682 -3.367 1.00 0.00 N ATOM 1779 NH2 ARG A 117 94.623 -12.103 -2.019 1.00 0.00 N ATOM 0 H ARG A 117 92.869 -6.932 1.328 1.00 0.00 H new ATOM 0 HA ARG A 117 94.344 -8.916 -0.028 1.00 0.00 H new ATOM 0 HB2 ARG A 117 92.626 -6.553 -0.928 1.00 0.00 H new ATOM 0 HB3 ARG A 117 93.302 -7.702 -2.065 1.00 0.00 H new ATOM 0 HG2 ARG A 117 91.830 -8.878 0.291 1.00 0.00 H new ATOM 0 HG3 ARG A 117 90.846 -8.041 -0.892 1.00 0.00 H new ATOM 0 HD2 ARG A 117 91.000 -10.411 -1.522 1.00 0.00 H new ATOM 0 HD3 ARG A 117 91.852 -9.452 -2.716 1.00 0.00 H new ATOM 0 HE ARG A 117 93.612 -10.358 -0.558 1.00 0.00 H new ATOM 0 HH11 ARG A 117 92.001 -11.167 -3.563 1.00 0.00 H new ATOM 0 HH12 ARG A 117 93.195 -12.383 -4.027 1.00 0.00 H new ATOM 0 HH21 ARG A 117 95.143 -11.917 -1.162 1.00 0.00 H new ATOM 0 HH22 ARG A 117 94.960 -12.804 -2.678 1.00 0.00 H new ATOM 1793 N LEU A 118 95.333 -5.811 -0.584 1.00 0.00 N ATOM 1794 CA LEU A 118 96.460 -5.011 -1.042 1.00 0.00 C ATOM 1795 C LEU A 118 97.675 -5.260 -0.160 1.00 0.00 C ATOM 1796 O LEU A 118 98.816 -5.183 -0.614 1.00 0.00 O ATOM 1797 CB LEU A 118 96.081 -3.534 -1.004 1.00 0.00 C ATOM 1798 CG LEU A 118 94.986 -3.243 -2.045 1.00 0.00 C ATOM 1799 CD1 LEU A 118 94.386 -1.862 -1.765 1.00 0.00 C ATOM 1800 CD2 LEU A 118 95.561 -3.274 -3.477 1.00 0.00 C ATOM 0 H LEU A 118 94.526 -5.269 -0.276 1.00 0.00 H new ATOM 0 HA LEU A 118 96.709 -5.295 -2.064 1.00 0.00 H new ATOM 0 HB2 LEU A 118 95.727 -3.267 -0.008 1.00 0.00 H new ATOM 0 HB3 LEU A 118 96.959 -2.920 -1.206 1.00 0.00 H new ATOM 0 HG LEU A 118 94.217 -4.012 -1.969 1.00 0.00 H new ATOM 0 HD11 LEU A 118 93.609 -1.647 -2.498 1.00 0.00 H new ATOM 0 HD12 LEU A 118 93.954 -1.849 -0.764 1.00 0.00 H new ATOM 0 HD13 LEU A 118 95.168 -1.105 -1.833 1.00 0.00 H new ATOM 0 HD21 LEU A 118 94.766 -3.065 -4.193 1.00 0.00 H new ATOM 0 HD22 LEU A 118 96.342 -2.520 -3.572 1.00 0.00 H new ATOM 0 HD23 LEU A 118 95.982 -4.259 -3.679 1.00 0.00 H new ATOM 1812 N VAL A 119 97.417 -5.563 1.102 1.00 0.00 N ATOM 1813 CA VAL A 119 98.489 -5.827 2.048 1.00 0.00 C ATOM 1814 C VAL A 119 99.302 -7.044 1.612 1.00 0.00 C ATOM 1815 O VAL A 119 100.524 -7.065 1.752 1.00 0.00 O ATOM 1816 CB VAL A 119 97.915 -6.071 3.444 1.00 0.00 C ATOM 1817 CG1 VAL A 119 99.051 -6.410 4.412 1.00 0.00 C ATOM 1818 CG2 VAL A 119 97.188 -4.813 3.922 1.00 0.00 C ATOM 0 H VAL A 119 96.478 -5.632 1.494 1.00 0.00 H new ATOM 0 HA VAL A 119 99.142 -4.955 2.074 1.00 0.00 H new ATOM 0 HB VAL A 119 97.212 -6.903 3.409 1.00 0.00 H new ATOM 0 HG11 VAL A 119 98.641 -6.584 5.407 1.00 0.00 H new ATOM 0 HG12 VAL A 119 99.565 -7.308 4.069 1.00 0.00 H new ATOM 0 HG13 VAL A 119 99.757 -5.580 4.450 1.00 0.00 H new ATOM 0 HG21 VAL A 119 96.778 -4.986 4.917 1.00 0.00 H new ATOM 0 HG22 VAL A 119 97.889 -3.979 3.958 1.00 0.00 H new ATOM 0 HG23 VAL A 119 96.378 -4.577 3.232 1.00 0.00 H new ATOM 1828 N ARG A 120 98.619 -8.064 1.103 1.00 0.00 N ATOM 1829 CA ARG A 120 99.294 -9.284 0.679 1.00 0.00 C ATOM 1830 C ARG A 120 100.344 -8.970 -0.385 1.00 0.00 C ATOM 1831 O ARG A 120 101.470 -9.478 -0.339 1.00 0.00 O ATOM 1832 CB ARG A 120 98.263 -10.267 0.112 1.00 0.00 C ATOM 1833 CG ARG A 120 98.939 -11.605 -0.199 1.00 0.00 C ATOM 1834 CD ARG A 120 97.925 -12.560 -0.831 1.00 0.00 C ATOM 1835 NE ARG A 120 96.815 -12.788 0.088 1.00 0.00 N ATOM 1836 CZ ARG A 120 96.923 -13.640 1.101 1.00 0.00 C ATOM 1837 NH1 ARG A 120 98.043 -14.279 1.302 1.00 0.00 N ATOM 1838 NH2 ARG A 120 95.910 -13.830 1.903 1.00 0.00 N ATOM 0 H ARG A 120 97.607 -8.070 0.975 1.00 0.00 H new ATOM 0 HA ARG A 120 99.792 -9.730 1.540 1.00 0.00 H new ATOM 0 HB2 ARG A 120 97.455 -10.415 0.829 1.00 0.00 H new ATOM 0 HB3 ARG A 120 97.815 -9.857 -0.793 1.00 0.00 H new ATOM 0 HG2 ARG A 120 99.779 -11.450 -0.876 1.00 0.00 H new ATOM 0 HG3 ARG A 120 99.343 -12.041 0.715 1.00 0.00 H new ATOM 0 HD2 ARG A 120 97.553 -12.142 -1.767 1.00 0.00 H new ATOM 0 HD3 ARG A 120 98.407 -13.507 -1.074 1.00 0.00 H new ATOM 0 HE ARG A 120 95.939 -12.283 -0.050 1.00 0.00 H new ATOM 0 HH11 ARG A 120 98.837 -14.124 0.681 1.00 0.00 H new ATOM 0 HH12 ARG A 120 98.124 -14.933 2.080 1.00 0.00 H new ATOM 0 HH21 ARG A 120 95.037 -13.324 1.751 1.00 0.00 H new ATOM 0 HH22 ARG A 120 95.991 -14.484 2.681 1.00 0.00 H new ATOM 1852 N LEU A 121 99.968 -8.131 -1.342 1.00 0.00 N ATOM 1853 CA LEU A 121 100.882 -7.759 -2.413 1.00 0.00 C ATOM 1854 C LEU A 121 102.093 -7.037 -1.837 1.00 0.00 C ATOM 1855 O LEU A 121 103.227 -7.301 -2.228 1.00 0.00 O ATOM 1856 CB LEU A 121 100.160 -6.852 -3.422 1.00 0.00 C ATOM 1857 CG LEU A 121 99.306 -7.706 -4.363 1.00 0.00 C ATOM 1858 CD1 LEU A 121 98.339 -8.562 -3.540 1.00 0.00 C ATOM 1859 CD2 LEU A 121 98.508 -6.790 -5.295 1.00 0.00 C ATOM 0 H LEU A 121 99.046 -7.699 -1.398 1.00 0.00 H new ATOM 0 HA LEU A 121 101.219 -8.661 -2.923 1.00 0.00 H new ATOM 0 HB2 LEU A 121 99.531 -6.134 -2.895 1.00 0.00 H new ATOM 0 HB3 LEU A 121 100.888 -6.278 -3.996 1.00 0.00 H new ATOM 0 HG LEU A 121 99.953 -8.355 -4.954 1.00 0.00 H new ATOM 0 HD11 LEU A 121 97.731 -9.170 -4.210 1.00 0.00 H new ATOM 0 HD12 LEU A 121 98.906 -9.212 -2.874 1.00 0.00 H new ATOM 0 HD13 LEU A 121 97.691 -7.914 -2.950 1.00 0.00 H new ATOM 0 HD21 LEU A 121 97.899 -7.395 -5.966 1.00 0.00 H new ATOM 0 HD22 LEU A 121 97.861 -6.143 -4.703 1.00 0.00 H new ATOM 0 HD23 LEU A 121 99.195 -6.179 -5.880 1.00 0.00 H new ATOM 1871 N LEU A 122 101.847 -6.142 -0.892 1.00 0.00 N ATOM 1872 CA LEU A 122 102.933 -5.403 -0.263 1.00 0.00 C ATOM 1873 C LEU A 122 103.880 -6.352 0.449 1.00 0.00 C ATOM 1874 O LEU A 122 105.097 -6.165 0.421 1.00 0.00 O ATOM 1875 CB LEU A 122 102.365 -4.376 0.735 1.00 0.00 C ATOM 1876 CG LEU A 122 102.067 -3.049 0.019 1.00 0.00 C ATOM 1877 CD1 LEU A 122 101.252 -2.151 0.953 1.00 0.00 C ATOM 1878 CD2 LEU A 122 103.392 -2.347 -0.382 1.00 0.00 C ATOM 0 H LEU A 122 100.916 -5.911 -0.546 1.00 0.00 H new ATOM 0 HA LEU A 122 103.488 -4.875 -1.039 1.00 0.00 H new ATOM 0 HB2 LEU A 122 101.454 -4.765 1.189 1.00 0.00 H new ATOM 0 HB3 LEU A 122 103.078 -4.210 1.542 1.00 0.00 H new ATOM 0 HG LEU A 122 101.495 -3.244 -0.888 1.00 0.00 H new ATOM 0 HD11 LEU A 122 101.036 -1.207 0.453 1.00 0.00 H new ATOM 0 HD12 LEU A 122 100.317 -2.648 1.211 1.00 0.00 H new ATOM 0 HD13 LEU A 122 101.822 -1.958 1.862 1.00 0.00 H new ATOM 0 HD21 LEU A 122 103.168 -1.408 -0.888 1.00 0.00 H new ATOM 0 HD22 LEU A 122 103.982 -2.145 0.512 1.00 0.00 H new ATOM 0 HD23 LEU A 122 103.958 -2.994 -1.052 1.00 0.00 H new ATOM 1890 N ARG A 123 103.325 -7.358 1.096 1.00 0.00 N ATOM 1891 CA ARG A 123 104.154 -8.302 1.817 1.00 0.00 C ATOM 1892 C ARG A 123 105.201 -8.921 0.893 1.00 0.00 C ATOM 1893 O ARG A 123 106.377 -9.039 1.257 1.00 0.00 O ATOM 1894 CB ARG A 123 103.277 -9.395 2.424 1.00 0.00 C ATOM 1895 CG ARG A 123 104.144 -10.387 3.207 1.00 0.00 C ATOM 1896 CD ARG A 123 103.263 -11.226 4.138 1.00 0.00 C ATOM 1897 NE ARG A 123 102.975 -10.474 5.355 1.00 0.00 N ATOM 1898 CZ ARG A 123 102.066 -10.893 6.226 1.00 0.00 C ATOM 1899 NH1 ARG A 123 101.402 -11.992 5.999 1.00 0.00 N ATOM 1900 NH2 ARG A 123 101.837 -10.204 7.312 1.00 0.00 N ATOM 0 H ARG A 123 102.322 -7.541 1.138 1.00 0.00 H new ATOM 0 HA ARG A 123 104.675 -7.772 2.614 1.00 0.00 H new ATOM 0 HB2 ARG A 123 102.532 -8.951 3.084 1.00 0.00 H new ATOM 0 HB3 ARG A 123 102.734 -9.917 1.636 1.00 0.00 H new ATOM 0 HG2 ARG A 123 104.682 -11.037 2.517 1.00 0.00 H new ATOM 0 HG3 ARG A 123 104.893 -9.849 3.788 1.00 0.00 H new ATOM 0 HD2 ARG A 123 102.333 -11.490 3.634 1.00 0.00 H new ATOM 0 HD3 ARG A 123 103.767 -12.160 4.387 1.00 0.00 H new ATOM 0 HE ARG A 123 103.483 -9.609 5.540 1.00 0.00 H new ATOM 0 HH11 ARG A 123 101.581 -12.530 5.151 1.00 0.00 H new ATOM 0 HH12 ARG A 123 100.703 -12.313 6.669 1.00 0.00 H new ATOM 0 HH21 ARG A 123 102.357 -9.345 7.490 1.00 0.00 H new ATOM 0 HH22 ARG A 123 101.138 -10.525 7.982 1.00 0.00 H new ATOM 1914 N PHE A 124 104.770 -9.308 -0.301 1.00 0.00 N ATOM 1915 CA PHE A 124 105.685 -9.908 -1.267 1.00 0.00 C ATOM 1916 C PHE A 124 106.765 -8.909 -1.684 1.00 0.00 C ATOM 1917 O PHE A 124 107.941 -9.258 -1.775 1.00 0.00 O ATOM 1918 CB PHE A 124 104.891 -10.395 -2.504 1.00 0.00 C ATOM 1919 CG PHE A 124 104.754 -11.902 -2.469 1.00 0.00 C ATOM 1920 CD1 PHE A 124 105.902 -12.700 -2.528 1.00 0.00 C ATOM 1921 CD2 PHE A 124 103.489 -12.496 -2.377 1.00 0.00 C ATOM 1922 CE1 PHE A 124 105.787 -14.092 -2.495 1.00 0.00 C ATOM 1923 CE2 PHE A 124 103.375 -13.889 -2.342 1.00 0.00 C ATOM 1924 CZ PHE A 124 104.523 -14.688 -2.402 1.00 0.00 C ATOM 0 H PHE A 124 103.806 -9.220 -0.622 1.00 0.00 H new ATOM 0 HA PHE A 124 106.178 -10.761 -0.801 1.00 0.00 H new ATOM 0 HB2 PHE A 124 103.904 -9.932 -2.519 1.00 0.00 H new ATOM 0 HB3 PHE A 124 105.401 -10.089 -3.418 1.00 0.00 H new ATOM 0 HD1 PHE A 124 106.877 -12.240 -2.599 1.00 0.00 H new ATOM 0 HD2 PHE A 124 102.603 -11.879 -2.333 1.00 0.00 H new ATOM 0 HE1 PHE A 124 106.673 -14.708 -2.541 1.00 0.00 H new ATOM 0 HE2 PHE A 124 102.401 -14.349 -2.269 1.00 0.00 H new ATOM 0 HZ PHE A 124 104.434 -15.764 -2.377 1.00 0.00 H new ATOM 1934 N LEU A 125 106.360 -7.671 -1.931 1.00 0.00 N ATOM 1935 CA LEU A 125 107.309 -6.641 -2.338 1.00 0.00 C ATOM 1936 C LEU A 125 108.360 -6.417 -1.257 1.00 0.00 C ATOM 1937 O LEU A 125 109.541 -6.245 -1.556 1.00 0.00 O ATOM 1938 CB LEU A 125 106.560 -5.323 -2.636 1.00 0.00 C ATOM 1939 CG LEU A 125 106.194 -5.230 -4.126 1.00 0.00 C ATOM 1940 CD1 LEU A 125 105.267 -6.375 -4.526 1.00 0.00 C ATOM 1941 CD2 LEU A 125 105.494 -3.895 -4.382 1.00 0.00 C ATOM 0 H LEU A 125 105.392 -7.356 -1.858 1.00 0.00 H new ATOM 0 HA LEU A 125 107.816 -6.975 -3.243 1.00 0.00 H new ATOM 0 HB2 LEU A 125 105.655 -5.268 -2.030 1.00 0.00 H new ATOM 0 HB3 LEU A 125 107.183 -4.474 -2.356 1.00 0.00 H new ATOM 0 HG LEU A 125 107.105 -5.299 -4.721 1.00 0.00 H new ATOM 0 HD11 LEU A 125 105.020 -6.290 -5.584 1.00 0.00 H new ATOM 0 HD12 LEU A 125 105.766 -7.327 -4.345 1.00 0.00 H new ATOM 0 HD13 LEU A 125 104.352 -6.326 -3.935 1.00 0.00 H new ATOM 0 HD21 LEU A 125 105.230 -3.819 -5.437 1.00 0.00 H new ATOM 0 HD22 LEU A 125 104.590 -3.836 -3.776 1.00 0.00 H new ATOM 0 HD23 LEU A 125 106.163 -3.077 -4.115 1.00 0.00 H new ATOM 1953 N ARG A 126 107.933 -6.418 -0.007 1.00 0.00 N ATOM 1954 CA ARG A 126 108.866 -6.205 1.083 1.00 0.00 C ATOM 1955 C ARG A 126 109.974 -7.254 1.052 1.00 0.00 C ATOM 1956 O ARG A 126 111.156 -6.919 1.126 1.00 0.00 O ATOM 1957 CB ARG A 126 108.125 -6.283 2.417 1.00 0.00 C ATOM 1958 CG ARG A 126 107.286 -5.024 2.639 1.00 0.00 C ATOM 1959 CD ARG A 126 106.745 -5.037 4.071 1.00 0.00 C ATOM 1960 NE ARG A 126 105.927 -6.215 4.295 1.00 0.00 N ATOM 1961 CZ ARG A 126 105.487 -6.518 5.509 1.00 0.00 C ATOM 1962 NH1 ARG A 126 105.795 -5.753 6.523 1.00 0.00 N ATOM 1963 NH2 ARG A 126 104.751 -7.578 5.690 1.00 0.00 N ATOM 0 H ARG A 126 106.963 -6.561 0.275 1.00 0.00 H new ATOM 0 HA ARG A 126 109.314 -5.218 0.970 1.00 0.00 H new ATOM 0 HB2 ARG A 126 107.482 -7.163 2.431 1.00 0.00 H new ATOM 0 HB3 ARG A 126 108.841 -6.398 3.231 1.00 0.00 H new ATOM 0 HG2 ARG A 126 107.891 -4.133 2.472 1.00 0.00 H new ATOM 0 HG3 ARG A 126 106.463 -4.988 1.925 1.00 0.00 H new ATOM 0 HD2 ARG A 126 107.574 -5.022 4.779 1.00 0.00 H new ATOM 0 HD3 ARG A 126 106.156 -4.138 4.251 1.00 0.00 H new ATOM 0 HE ARG A 126 105.687 -6.818 3.508 1.00 0.00 H new ATOM 0 HH11 ARG A 126 106.373 -4.925 6.380 1.00 0.00 H new ATOM 0 HH12 ARG A 126 105.458 -5.984 7.457 1.00 0.00 H new ATOM 0 HH21 ARG A 126 104.513 -8.175 4.898 1.00 0.00 H new ATOM 0 HH22 ARG A 126 104.413 -7.811 6.624 1.00 0.00 H new ATOM 1977 N ILE A 127 109.591 -8.519 0.932 1.00 0.00 N ATOM 1978 CA ILE A 127 110.577 -9.594 0.885 1.00 0.00 C ATOM 1979 C ILE A 127 111.383 -9.535 -0.407 1.00 0.00 C ATOM 1980 O ILE A 127 112.600 -9.722 -0.402 1.00 0.00 O ATOM 1981 CB ILE A 127 109.884 -10.949 0.991 1.00 0.00 C ATOM 1982 CG1 ILE A 127 109.036 -10.979 2.265 1.00 0.00 C ATOM 1983 CG2 ILE A 127 110.937 -12.064 1.043 1.00 0.00 C ATOM 1984 CD1 ILE A 127 108.254 -12.291 2.330 1.00 0.00 C ATOM 0 H ILE A 127 108.620 -8.824 0.866 1.00 0.00 H new ATOM 0 HA ILE A 127 111.256 -9.466 1.728 1.00 0.00 H new ATOM 0 HB ILE A 127 109.244 -11.104 0.122 1.00 0.00 H new ATOM 0 HG12 ILE A 127 109.676 -10.881 3.142 1.00 0.00 H new ATOM 0 HG13 ILE A 127 108.348 -10.133 2.276 1.00 0.00 H new ATOM 0 HG21 ILE A 127 110.440 -13.031 1.119 1.00 0.00 H new ATOM 0 HG22 ILE A 127 111.541 -12.037 0.136 1.00 0.00 H new ATOM 0 HG23 ILE A 127 111.579 -11.918 1.911 1.00 0.00 H new ATOM 0 HD11 ILE A 127 107.651 -12.311 3.238 1.00 0.00 H new ATOM 0 HD12 ILE A 127 107.602 -12.370 1.460 1.00 0.00 H new ATOM 0 HD13 ILE A 127 108.950 -13.130 2.339 1.00 0.00 H new ATOM 1996 N LEU A 128 110.690 -9.298 -1.510 1.00 0.00 N ATOM 1997 CA LEU A 128 111.342 -9.247 -2.809 1.00 0.00 C ATOM 1998 C LEU A 128 112.444 -8.197 -2.808 1.00 0.00 C ATOM 1999 O LEU A 128 113.381 -8.269 -3.600 1.00 0.00 O ATOM 2000 CB LEU A 128 110.309 -8.914 -3.905 1.00 0.00 C ATOM 2001 CG LEU A 128 110.760 -9.506 -5.260 1.00 0.00 C ATOM 2002 CD1 LEU A 128 110.286 -10.965 -5.370 1.00 0.00 C ATOM 2003 CD2 LEU A 128 110.161 -8.689 -6.412 1.00 0.00 C ATOM 0 H LEU A 128 109.683 -9.139 -1.532 1.00 0.00 H new ATOM 0 HA LEU A 128 111.783 -10.222 -3.014 1.00 0.00 H new ATOM 0 HB2 LEU A 128 109.334 -9.316 -3.630 1.00 0.00 H new ATOM 0 HB3 LEU A 128 110.195 -7.833 -3.992 1.00 0.00 H new ATOM 0 HG LEU A 128 111.848 -9.470 -5.319 1.00 0.00 H new ATOM 0 HD11 LEU A 128 110.605 -11.380 -6.326 1.00 0.00 H new ATOM 0 HD12 LEU A 128 110.718 -11.550 -4.558 1.00 0.00 H new ATOM 0 HD13 LEU A 128 109.199 -11.000 -5.304 1.00 0.00 H new ATOM 0 HD21 LEU A 128 110.483 -9.112 -7.364 1.00 0.00 H new ATOM 0 HD22 LEU A 128 109.073 -8.718 -6.351 1.00 0.00 H new ATOM 0 HD23 LEU A 128 110.501 -7.656 -6.340 1.00 0.00 H new ATOM 2015 N LEU A 129 112.320 -7.221 -1.924 1.00 0.00 N ATOM 2016 CA LEU A 129 113.302 -6.152 -1.838 1.00 0.00 C ATOM 2017 C LEU A 129 114.699 -6.720 -1.595 1.00 0.00 C ATOM 2018 O LEU A 129 115.706 -6.089 -1.928 1.00 0.00 O ATOM 2019 CB LEU A 129 112.931 -5.197 -0.696 1.00 0.00 C ATOM 2020 CG LEU A 129 113.619 -3.831 -0.904 1.00 0.00 C ATOM 2021 CD1 LEU A 129 112.742 -2.933 -1.787 1.00 0.00 C ATOM 2022 CD2 LEU A 129 113.843 -3.145 0.451 1.00 0.00 C ATOM 0 H LEU A 129 111.552 -7.146 -1.257 1.00 0.00 H new ATOM 0 HA LEU A 129 113.305 -5.609 -2.783 1.00 0.00 H new ATOM 0 HB2 LEU A 129 111.850 -5.066 -0.657 1.00 0.00 H new ATOM 0 HB3 LEU A 129 113.235 -5.625 0.260 1.00 0.00 H new ATOM 0 HG LEU A 129 114.580 -3.993 -1.392 1.00 0.00 H new ATOM 0 HD11 LEU A 129 113.234 -1.971 -1.929 1.00 0.00 H new ATOM 0 HD12 LEU A 129 112.591 -3.410 -2.755 1.00 0.00 H new ATOM 0 HD13 LEU A 129 111.777 -2.779 -1.304 1.00 0.00 H new ATOM 0 HD21 LEU A 129 114.329 -2.182 0.295 1.00 0.00 H new ATOM 0 HD22 LEU A 129 112.883 -2.992 0.944 1.00 0.00 H new ATOM 0 HD23 LEU A 129 114.476 -3.774 1.077 1.00 0.00 H new ATOM 2034 N ILE A 130 114.748 -7.906 -1.007 1.00 0.00 N ATOM 2035 CA ILE A 130 116.020 -8.548 -0.714 1.00 0.00 C ATOM 2036 C ILE A 130 116.882 -8.630 -1.963 1.00 0.00 C ATOM 2037 O ILE A 130 118.107 -8.543 -1.898 1.00 0.00 O ATOM 2038 CB ILE A 130 115.774 -9.953 -0.172 1.00 0.00 C ATOM 2039 CG1 ILE A 130 117.091 -10.530 0.384 1.00 0.00 C ATOM 2040 CG2 ILE A 130 115.239 -10.865 -1.287 1.00 0.00 C ATOM 2041 CD1 ILE A 130 117.545 -9.762 1.639 1.00 0.00 C ATOM 0 H ILE A 130 113.926 -8.441 -0.725 1.00 0.00 H new ATOM 0 HA ILE A 130 116.544 -7.952 0.033 1.00 0.00 H new ATOM 0 HB ILE A 130 115.034 -9.901 0.627 1.00 0.00 H new ATOM 0 HG12 ILE A 130 116.956 -11.584 0.627 1.00 0.00 H new ATOM 0 HG13 ILE A 130 117.867 -10.476 -0.380 1.00 0.00 H new ATOM 0 HG21 ILE A 130 115.067 -11.865 -0.888 1.00 0.00 H new ATOM 0 HG22 ILE A 130 114.302 -10.461 -1.669 1.00 0.00 H new ATOM 0 HG23 ILE A 130 115.968 -10.917 -2.096 1.00 0.00 H new ATOM 0 HD11 ILE A 130 118.476 -10.190 2.010 1.00 0.00 H new ATOM 0 HD12 ILE A 130 117.703 -8.713 1.387 1.00 0.00 H new ATOM 0 HD13 ILE A 130 116.778 -9.838 2.410 1.00 0.00 H new ATOM 2053 N ILE A 131 116.228 -8.809 -3.097 1.00 0.00 N ATOM 2054 CA ILE A 131 116.941 -8.918 -4.365 1.00 0.00 C ATOM 2055 C ILE A 131 117.907 -7.749 -4.535 1.00 0.00 C ATOM 2056 O ILE A 131 119.053 -7.933 -4.950 1.00 0.00 O ATOM 2057 CB ILE A 131 115.941 -8.921 -5.531 1.00 0.00 C ATOM 2058 CG1 ILE A 131 116.670 -9.297 -6.827 1.00 0.00 C ATOM 2059 CG2 ILE A 131 115.317 -7.528 -5.689 1.00 0.00 C ATOM 2060 CD1 ILE A 131 115.666 -9.350 -7.985 1.00 0.00 C ATOM 0 H ILE A 131 115.213 -8.882 -3.170 1.00 0.00 H new ATOM 0 HA ILE A 131 117.505 -9.851 -4.364 1.00 0.00 H new ATOM 0 HB ILE A 131 115.155 -9.647 -5.325 1.00 0.00 H new ATOM 0 HG12 ILE A 131 117.450 -8.567 -7.042 1.00 0.00 H new ATOM 0 HG13 ILE A 131 117.160 -10.264 -6.713 1.00 0.00 H new ATOM 0 HG21 ILE A 131 114.609 -7.538 -6.518 1.00 0.00 H new ATOM 0 HG22 ILE A 131 114.797 -7.256 -4.771 1.00 0.00 H new ATOM 0 HG23 ILE A 131 116.101 -6.799 -5.891 1.00 0.00 H new ATOM 0 HD11 ILE A 131 116.186 -9.617 -8.905 1.00 0.00 H new ATOM 0 HD12 ILE A 131 114.902 -10.097 -7.770 1.00 0.00 H new ATOM 0 HD13 ILE A 131 115.196 -8.374 -8.104 1.00 0.00 H new ATOM 2072 N SER A 132 117.439 -6.549 -4.211 1.00 0.00 N ATOM 2073 CA SER A 132 118.269 -5.357 -4.327 1.00 0.00 C ATOM 2074 C SER A 132 119.343 -5.334 -3.248 1.00 0.00 C ATOM 2075 O SER A 132 120.509 -5.054 -3.521 1.00 0.00 O ATOM 2076 CB SER A 132 117.399 -4.104 -4.213 1.00 0.00 C ATOM 2077 OG SER A 132 118.110 -2.993 -4.743 1.00 0.00 O ATOM 0 H SER A 132 116.494 -6.377 -3.868 1.00 0.00 H new ATOM 0 HA SER A 132 118.758 -5.375 -5.301 1.00 0.00 H new ATOM 0 HB2 SER A 132 116.464 -4.245 -4.755 1.00 0.00 H new ATOM 0 HB3 SER A 132 117.139 -3.921 -3.171 1.00 0.00 H new ATOM 0 HG SER A 132 117.556 -2.187 -4.674 1.00 0.00 H new ATOM 2083 N ARG A 133 118.939 -5.629 -2.018 1.00 0.00 N ATOM 2084 CA ARG A 133 119.872 -5.631 -0.897 1.00 0.00 C ATOM 2085 C ARG A 133 120.965 -6.672 -1.103 1.00 0.00 C ATOM 2086 O ARG A 133 122.119 -6.460 -0.728 1.00 0.00 O ATOM 2087 CB ARG A 133 119.121 -5.922 0.399 1.00 0.00 C ATOM 2088 CG ARG A 133 118.169 -4.765 0.730 1.00 0.00 C ATOM 2089 CD ARG A 133 118.962 -3.503 1.111 1.00 0.00 C ATOM 2090 NE ARG A 133 118.164 -2.649 1.977 1.00 0.00 N ATOM 2091 CZ ARG A 133 118.680 -1.545 2.501 1.00 0.00 C ATOM 2092 NH1 ARG A 133 119.917 -1.220 2.241 1.00 0.00 N ATOM 2093 NH2 ARG A 133 117.953 -0.789 3.274 1.00 0.00 N ATOM 0 H ARG A 133 117.978 -5.868 -1.772 1.00 0.00 H new ATOM 0 HA ARG A 133 120.339 -4.648 -0.836 1.00 0.00 H new ATOM 0 HB2 ARG A 133 118.557 -6.850 0.301 1.00 0.00 H new ATOM 0 HB3 ARG A 133 119.830 -6.064 1.215 1.00 0.00 H new ATOM 0 HG2 ARG A 133 117.531 -4.555 -0.129 1.00 0.00 H new ATOM 0 HG3 ARG A 133 117.513 -5.051 1.552 1.00 0.00 H new ATOM 0 HD2 ARG A 133 119.886 -3.784 1.617 1.00 0.00 H new ATOM 0 HD3 ARG A 133 119.245 -2.957 0.211 1.00 0.00 H new ATOM 0 HE ARG A 133 117.198 -2.902 2.183 1.00 0.00 H new ATOM 0 HH11 ARG A 133 120.484 -1.814 1.636 1.00 0.00 H new ATOM 0 HH12 ARG A 133 120.317 -0.372 2.642 1.00 0.00 H new ATOM 0 HH21 ARG A 133 116.987 -1.046 3.476 1.00 0.00 H new ATOM 0 HH22 ARG A 133 118.350 0.060 3.677 1.00 0.00 H new ATOM 2107 N GLY A 134 120.596 -7.794 -1.697 1.00 0.00 N ATOM 2108 CA GLY A 134 121.554 -8.859 -1.948 1.00 0.00 C ATOM 2109 C GLY A 134 122.672 -8.379 -2.869 1.00 0.00 C ATOM 2110 O GLY A 134 123.811 -8.831 -2.760 1.00 0.00 O ATOM 0 H GLY A 134 119.646 -7.991 -2.013 1.00 0.00 H new ATOM 0 HA2 GLY A 134 121.977 -9.203 -1.004 1.00 0.00 H new ATOM 0 HA3 GLY A 134 121.046 -9.712 -2.399 1.00 0.00 H new ATOM 2114 N SER A 135 122.340 -7.469 -3.783 1.00 0.00 N ATOM 2115 CA SER A 135 123.330 -6.949 -4.722 1.00 0.00 C ATOM 2116 C SER A 135 124.476 -6.266 -3.980 1.00 0.00 C ATOM 2117 O SER A 135 125.647 -6.487 -4.286 1.00 0.00 O ATOM 2118 CB SER A 135 122.667 -5.943 -5.663 1.00 0.00 C ATOM 2119 OG SER A 135 122.372 -4.751 -4.946 1.00 0.00 O ATOM 0 H SER A 135 121.403 -7.080 -3.893 1.00 0.00 H new ATOM 0 HA SER A 135 123.732 -7.785 -5.295 1.00 0.00 H new ATOM 0 HB2 SER A 135 123.328 -5.722 -6.502 1.00 0.00 H new ATOM 0 HB3 SER A 135 121.753 -6.366 -6.080 1.00 0.00 H new ATOM 0 HG SER A 135 121.434 -4.763 -4.664 1.00 0.00 H new ATOM 2125 N LYS A 136 124.127 -5.445 -2.998 1.00 0.00 N ATOM 2126 CA LYS A 136 125.124 -4.739 -2.206 1.00 0.00 C ATOM 2127 C LYS A 136 125.975 -5.726 -1.420 1.00 0.00 C ATOM 2128 O LYS A 136 127.190 -5.563 -1.311 1.00 0.00 O ATOM 2129 CB LYS A 136 124.434 -3.769 -1.245 1.00 0.00 C ATOM 2130 CG LYS A 136 123.826 -2.609 -2.036 1.00 0.00 C ATOM 2131 CD LYS A 136 122.996 -1.730 -1.097 1.00 0.00 C ATOM 2132 CE LYS A 136 122.542 -0.473 -1.840 1.00 0.00 C ATOM 2133 NZ LYS A 136 123.734 0.364 -2.155 1.00 0.00 N ATOM 0 H LYS A 136 123.162 -5.252 -2.731 1.00 0.00 H new ATOM 0 HA LYS A 136 125.771 -4.178 -2.880 1.00 0.00 H new ATOM 0 HB2 LYS A 136 123.656 -4.288 -0.685 1.00 0.00 H new ATOM 0 HB3 LYS A 136 125.152 -3.390 -0.517 1.00 0.00 H new ATOM 0 HG2 LYS A 136 124.616 -2.019 -2.501 1.00 0.00 H new ATOM 0 HG3 LYS A 136 123.199 -2.993 -2.841 1.00 0.00 H new ATOM 0 HD2 LYS A 136 122.130 -2.284 -0.735 1.00 0.00 H new ATOM 0 HD3 LYS A 136 123.586 -1.455 -0.223 1.00 0.00 H new ATOM 0 HE2 LYS A 136 122.021 -0.746 -2.758 1.00 0.00 H new ATOM 0 HE3 LYS A 136 121.837 0.091 -1.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 123.438 1.352 -2.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 124.412 0.312 -1.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 124.184 0.014 -3.024 1.00 0.00 H new ATOM 2147 N PHE A 137 125.328 -6.750 -0.871 1.00 0.00 N ATOM 2148 CA PHE A 137 126.035 -7.760 -0.093 1.00 0.00 C ATOM 2149 C PHE A 137 127.082 -8.464 -0.947 1.00 0.00 C ATOM 2150 O PHE A 137 128.235 -8.587 -0.545 1.00 0.00 O ATOM 2151 CB PHE A 137 125.038 -8.791 0.439 1.00 0.00 C ATOM 2152 CG PHE A 137 125.783 -9.872 1.192 1.00 0.00 C ATOM 2153 CD1 PHE A 137 126.421 -9.567 2.400 1.00 0.00 C ATOM 2154 CD2 PHE A 137 125.841 -11.178 0.682 1.00 0.00 C ATOM 2155 CE1 PHE A 137 127.114 -10.562 3.098 1.00 0.00 C ATOM 2156 CE2 PHE A 137 126.535 -12.173 1.382 1.00 0.00 C ATOM 2157 CZ PHE A 137 127.171 -11.865 2.589 1.00 0.00 C ATOM 0 H PHE A 137 124.322 -6.901 -0.950 1.00 0.00 H new ATOM 0 HA PHE A 137 126.536 -7.266 0.739 1.00 0.00 H new ATOM 0 HB2 PHE A 137 124.315 -8.308 1.096 1.00 0.00 H new ATOM 0 HB3 PHE A 137 124.476 -9.229 -0.386 1.00 0.00 H new ATOM 0 HD1 PHE A 137 126.378 -8.562 2.794 1.00 0.00 H new ATOM 0 HD2 PHE A 137 125.350 -11.416 -0.250 1.00 0.00 H new ATOM 0 HE1 PHE A 137 127.605 -10.325 4.030 1.00 0.00 H new ATOM 0 HE2 PHE A 137 126.579 -13.178 0.990 1.00 0.00 H new ATOM 0 HZ PHE A 137 127.706 -12.632 3.128 1.00 0.00 H new ATOM 2167 N LEU A 138 126.674 -8.922 -2.123 1.00 0.00 N ATOM 2168 CA LEU A 138 127.590 -9.616 -3.021 1.00 0.00 C ATOM 2169 C LEU A 138 128.685 -8.672 -3.508 1.00 0.00 C ATOM 2170 O LEU A 138 129.844 -9.057 -3.630 1.00 0.00 O ATOM 2171 CB LEU A 138 126.819 -10.168 -4.221 1.00 0.00 C ATOM 2172 CG LEU A 138 125.799 -11.216 -3.746 1.00 0.00 C ATOM 2173 CD1 LEU A 138 124.939 -11.658 -4.936 1.00 0.00 C ATOM 2174 CD2 LEU A 138 126.518 -12.436 -3.130 1.00 0.00 C ATOM 0 H LEU A 138 125.722 -8.827 -2.476 1.00 0.00 H new ATOM 0 HA LEU A 138 128.054 -10.437 -2.475 1.00 0.00 H new ATOM 0 HB2 LEU A 138 126.307 -9.358 -4.740 1.00 0.00 H new ATOM 0 HB3 LEU A 138 127.510 -10.617 -4.934 1.00 0.00 H new ATOM 0 HG LEU A 138 125.164 -10.773 -2.979 1.00 0.00 H new ATOM 0 HD11 LEU A 138 124.214 -12.401 -4.605 1.00 0.00 H new ATOM 0 HD12 LEU A 138 124.413 -10.795 -5.345 1.00 0.00 H new ATOM 0 HD13 LEU A 138 125.578 -12.092 -5.705 1.00 0.00 H new ATOM 0 HD21 LEU A 138 125.779 -13.166 -2.800 1.00 0.00 H new ATOM 0 HD22 LEU A 138 127.168 -12.891 -3.877 1.00 0.00 H new ATOM 0 HD23 LEU A 138 127.115 -12.114 -2.277 1.00 0.00 H new ATOM 2186 N SER A 139 128.316 -7.436 -3.807 1.00 0.00 N ATOM 2187 CA SER A 139 129.297 -6.475 -4.291 1.00 0.00 C ATOM 2188 C SER A 139 130.315 -6.137 -3.201 1.00 0.00 C ATOM 2189 O SER A 139 131.522 -6.063 -3.460 1.00 0.00 O ATOM 2190 CB SER A 139 128.585 -5.204 -4.738 1.00 0.00 C ATOM 2191 OG SER A 139 127.954 -4.603 -3.616 1.00 0.00 O ATOM 0 H SER A 139 127.364 -7.079 -3.726 1.00 0.00 H new ATOM 0 HA SER A 139 129.829 -6.917 -5.133 1.00 0.00 H new ATOM 0 HB2 SER A 139 129.298 -4.511 -5.184 1.00 0.00 H new ATOM 0 HB3 SER A 139 127.846 -5.437 -5.504 1.00 0.00 H new ATOM 0 HG SER A 139 127.700 -5.297 -2.973 1.00 0.00 H new ATOM 2197 N ALA A 140 129.819 -5.929 -1.984 1.00 0.00 N ATOM 2198 CA ALA A 140 130.683 -5.587 -0.860 1.00 0.00 C ATOM 2199 C ALA A 140 131.561 -6.761 -0.454 1.00 0.00 C ATOM 2200 O ALA A 140 132.763 -6.603 -0.239 1.00 0.00 O ATOM 2201 CB ALA A 140 129.834 -5.158 0.336 1.00 0.00 C ATOM 0 H ALA A 140 128.828 -5.991 -1.753 1.00 0.00 H new ATOM 0 HA ALA A 140 131.328 -4.767 -1.175 1.00 0.00 H new ATOM 0 HB1 ALA A 140 130.485 -4.904 1.172 1.00 0.00 H new ATOM 0 HB2 ALA A 140 129.236 -4.288 0.064 1.00 0.00 H new ATOM 0 HB3 ALA A 140 129.174 -5.976 0.626 1.00 0.00 H new ATOM 2207 N ILE A 141 130.955 -7.936 -0.340 1.00 0.00 N ATOM 2208 CA ILE A 141 131.697 -9.125 0.059 1.00 0.00 C ATOM 2209 C ILE A 141 132.770 -9.443 -0.978 1.00 0.00 C ATOM 2210 O ILE A 141 133.806 -10.023 -0.656 1.00 0.00 O ATOM 2211 CB ILE A 141 130.723 -10.323 0.230 1.00 0.00 C ATOM 2212 CG1 ILE A 141 131.242 -11.290 1.317 1.00 0.00 C ATOM 2213 CG2 ILE A 141 130.566 -11.090 -1.096 1.00 0.00 C ATOM 2214 CD1 ILE A 141 130.765 -10.817 2.697 1.00 0.00 C ATOM 0 H ILE A 141 129.962 -8.091 -0.516 1.00 0.00 H new ATOM 0 HA ILE A 141 132.187 -8.940 1.015 1.00 0.00 H new ATOM 0 HB ILE A 141 129.754 -9.926 0.531 1.00 0.00 H new ATOM 0 HG12 ILE A 141 130.880 -12.300 1.122 1.00 0.00 H new ATOM 0 HG13 ILE A 141 132.331 -11.331 1.292 1.00 0.00 H new ATOM 0 HG21 ILE A 141 129.880 -11.925 -0.954 1.00 0.00 H new ATOM 0 HG22 ILE A 141 130.170 -10.420 -1.859 1.00 0.00 H new ATOM 0 HG23 ILE A 141 131.537 -11.469 -1.415 1.00 0.00 H new ATOM 0 HD11 ILE A 141 131.132 -11.500 3.463 1.00 0.00 H new ATOM 0 HD12 ILE A 141 131.148 -9.815 2.891 1.00 0.00 H new ATOM 0 HD13 ILE A 141 129.675 -10.799 2.719 1.00 0.00 H new