USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 914 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 71 SER OG : rot -83:sc= 1.43 USER MOD Set 1.2: A 73 MET CE :methyl -119:sc= -0.0585 (180deg=-0.196) USER MOD Single : A 29 THR OG1 : rot 57:sc= 0.618 USER MOD Single : A 31 GLN : amide:sc= -0.0906 X(o=-0.091,f=-0.58) USER MOD Single : A 34 THR OG1 : rot -174:sc= 1.32 USER MOD Single : A 41 SER OG : rot 58:sc= 0.231 USER MOD Single : A 45 THR OG1 : rot 169:sc= 0.452 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.0149 USER MOD Single : A 53 ASN : amide:sc= 0.65 K(o=0.65,f=-5!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 140:sc= -0.206 USER MOD Single : A 57 GLN : amide:sc= -0.459 X(o=-0.46,f=-0.77) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 150:sc= 0.646 USER MOD Single : A 70 THR OG1 : rot 81:sc= 1.1 USER MOD Single : A 75 MET CE :methyl -166:sc= -0.681 (180deg=-1.05) USER MOD Single : A 76 THR OG1 : rot 72:sc= 1.09 USER MOD Single : A 77 THR OG1 : rot -54:sc= 0.584 USER MOD Single : A 78 THR OG1 : rot 140:sc= 0.546 USER MOD Single : A 79 HIS : no HD1:sc= 0.811 K(o=0.81,f=-3.6!) USER MOD Single : A 80 SER OG : rot -44:sc= 0.787 USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl 180:sc= -0.034 (180deg=-0.034) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl -169:sc= -0.0177 (180deg=-0.208) USER MOD Single : A 93 THR OG1 : rot 57:sc= 0.456 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.865 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= 0.587 K(o=0.59,f=-0.041) USER MOD Single : A 108 HIS : no HD1:sc= -2.2 K(o=-2.2,f=-4.3) USER MOD Single : A 110 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 MET CE :methyl 177:sc= -0.0882 (180deg=-0.0939) USER MOD Single : A 115 LYS NZ :NH3+ -175:sc= 2.37 (180deg=2.18) USER MOD Single : A 119 LYS NZ :NH3+ 177:sc= 0.774 (180deg=0.43) USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.168 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= -0.0246 X(o=-0.025,f=-0.11) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 175:sc= -0.184 (180deg=-0.243) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 369 N VAL A 28 2.919 8.017 -12.012 1.00 10.00 N ATOM 370 CA VAL A 28 3.381 8.585 -10.757 1.00 10.00 C ATOM 371 C VAL A 28 3.516 7.474 -9.720 1.00 10.00 C ATOM 372 O VAL A 28 3.084 7.587 -8.574 1.00 10.00 O ATOM 373 CB VAL A 28 2.357 9.650 -10.314 1.00 10.00 C ATOM 374 CG1 VAL A 28 2.214 10.758 -11.362 1.00 10.00 C ATOM 375 CG2 VAL A 28 0.943 9.083 -10.093 1.00 10.00 C ATOM 0 HA VAL A 28 4.358 9.054 -10.870 1.00 10.00 H new ATOM 0 HB VAL A 28 2.753 10.031 -9.373 1.00 10.00 H new ATOM 0 HG11 VAL A 28 1.485 11.492 -11.018 1.00 10.00 H new ATOM 0 HG12 VAL A 28 3.178 11.246 -11.510 1.00 10.00 H new ATOM 0 HG13 VAL A 28 1.878 10.326 -12.305 1.00 10.00 H new ATOM 0 HG21 VAL A 28 0.274 9.885 -9.783 1.00 10.00 H new ATOM 0 HG22 VAL A 28 0.578 8.644 -11.021 1.00 10.00 H new ATOM 0 HG23 VAL A 28 0.975 8.317 -9.318 1.00 10.00 H new ATOM 385 N THR A 29 4.167 6.391 -10.132 1.00 10.00 N ATOM 386 CA THR A 29 4.120 5.135 -9.415 1.00 10.00 C ATOM 387 C THR A 29 5.355 4.322 -9.774 1.00 10.00 C ATOM 388 O THR A 29 5.291 3.456 -10.645 1.00 10.00 O ATOM 389 CB THR A 29 2.830 4.372 -9.766 1.00 10.00 C ATOM 390 OG1 THR A 29 2.747 4.208 -11.165 1.00 10.00 O ATOM 391 CG2 THR A 29 1.540 5.042 -9.283 1.00 10.00 C ATOM 0 H THR A 29 4.741 6.366 -10.975 1.00 10.00 H new ATOM 0 HA THR A 29 4.113 5.316 -8.340 1.00 10.00 H new ATOM 0 HB THR A 29 2.903 3.419 -9.243 1.00 10.00 H new ATOM 0 HG1 THR A 29 3.544 3.738 -11.487 1.00 10.00 H new ATOM 0 HG21 THR A 29 0.683 4.435 -9.575 1.00 10.00 H new ATOM 0 HG22 THR A 29 1.564 5.138 -8.197 1.00 10.00 H new ATOM 0 HG23 THR A 29 1.453 6.031 -9.733 1.00 10.00 H new ATOM 399 N VAL A 30 6.471 4.606 -9.106 1.00 10.00 N ATOM 400 CA VAL A 30 7.663 3.777 -9.177 1.00 10.00 C ATOM 401 C VAL A 30 8.288 3.755 -7.781 1.00 10.00 C ATOM 402 O VAL A 30 9.454 4.067 -7.564 1.00 10.00 O ATOM 403 CB VAL A 30 8.545 4.259 -10.344 1.00 10.00 C ATOM 404 CG1 VAL A 30 9.038 5.706 -10.198 1.00 10.00 C ATOM 405 CG2 VAL A 30 9.720 3.312 -10.612 1.00 10.00 C ATOM 0 H VAL A 30 6.570 5.420 -8.500 1.00 10.00 H new ATOM 0 HA VAL A 30 7.469 2.733 -9.422 1.00 10.00 H new ATOM 0 HB VAL A 30 7.886 4.244 -11.212 1.00 10.00 H new ATOM 0 HG11 VAL A 30 9.652 5.970 -11.059 1.00 10.00 H new ATOM 0 HG12 VAL A 30 8.182 6.378 -10.143 1.00 10.00 H new ATOM 0 HG13 VAL A 30 9.631 5.798 -9.288 1.00 10.00 H new ATOM 0 HG21 VAL A 30 10.313 3.694 -11.443 1.00 10.00 H new ATOM 0 HG22 VAL A 30 10.345 3.246 -9.721 1.00 10.00 H new ATOM 0 HG23 VAL A 30 9.339 2.322 -10.863 1.00 10.00 H new ATOM 415 N GLN A 31 7.455 3.339 -6.827 1.00 10.00 N ATOM 416 CA GLN A 31 7.811 3.117 -5.440 1.00 10.00 C ATOM 417 C GLN A 31 8.405 1.710 -5.349 1.00 10.00 C ATOM 418 O GLN A 31 7.795 0.763 -5.838 1.00 10.00 O ATOM 419 CB GLN A 31 6.529 3.236 -4.599 1.00 10.00 C ATOM 420 CG GLN A 31 6.809 3.078 -3.102 1.00 10.00 C ATOM 421 CD GLN A 31 5.545 2.972 -2.256 1.00 10.00 C ATOM 422 OE1 GLN A 31 4.432 3.129 -2.744 1.00 10.00 O ATOM 423 NE2 GLN A 31 5.711 2.686 -0.967 1.00 10.00 N ATOM 0 H GLN A 31 6.472 3.141 -7.016 1.00 10.00 H new ATOM 0 HA GLN A 31 8.537 3.841 -5.071 1.00 10.00 H new ATOM 0 HB2 GLN A 31 6.065 4.205 -4.781 1.00 10.00 H new ATOM 0 HB3 GLN A 31 5.815 2.476 -4.917 1.00 10.00 H new ATOM 0 HG2 GLN A 31 7.417 2.187 -2.946 1.00 10.00 H new ATOM 0 HG3 GLN A 31 7.397 3.929 -2.758 1.00 10.00 H new ATOM 0 HE21 GLN A 31 6.650 2.561 -0.589 1.00 10.00 H new ATOM 0 HE22 GLN A 31 4.899 2.592 -0.357 1.00 10.00 H new ATOM 432 N GLY A 32 9.576 1.559 -4.726 1.00 10.00 N ATOM 433 CA GLY A 32 10.207 0.253 -4.574 1.00 10.00 C ATOM 434 C GLY A 32 9.436 -0.638 -3.597 1.00 10.00 C ATOM 435 O GLY A 32 9.310 -1.835 -3.822 1.00 10.00 O ATOM 0 H GLY A 32 10.105 2.330 -4.319 1.00 10.00 H new ATOM 0 HA2 GLY A 32 10.266 -0.238 -5.545 1.00 10.00 H new ATOM 0 HA3 GLY A 32 11.230 0.382 -4.220 1.00 10.00 H new ATOM 439 N ALA A 33 8.934 -0.031 -2.516 1.00 10.00 N ATOM 440 CA ALA A 33 8.281 -0.649 -1.368 1.00 10.00 C ATOM 441 C ALA A 33 9.234 -1.476 -0.501 1.00 10.00 C ATOM 442 O ALA A 33 9.785 -2.486 -0.932 1.00 10.00 O ATOM 443 CB ALA A 33 7.061 -1.468 -1.764 1.00 10.00 C ATOM 0 H ALA A 33 8.980 0.983 -2.418 1.00 10.00 H new ATOM 0 HA ALA A 33 7.939 0.185 -0.755 1.00 10.00 H new ATOM 0 HB1 ALA A 33 6.612 -1.906 -0.873 1.00 10.00 H new ATOM 0 HB2 ALA A 33 6.334 -0.823 -2.257 1.00 10.00 H new ATOM 0 HB3 ALA A 33 7.362 -2.263 -2.447 1.00 10.00 H new ATOM 449 N THR A 34 9.392 -1.035 0.746 1.00 10.00 N ATOM 450 CA THR A 34 10.218 -1.633 1.775 1.00 10.00 C ATOM 451 C THR A 34 9.318 -2.102 2.918 1.00 10.00 C ATOM 452 O THR A 34 9.020 -1.319 3.816 1.00 10.00 O ATOM 453 CB THR A 34 11.159 -0.532 2.286 1.00 10.00 C ATOM 454 OG1 THR A 34 10.439 0.686 2.240 1.00 10.00 O ATOM 455 CG2 THR A 34 12.401 -0.397 1.407 1.00 10.00 C ATOM 0 H THR A 34 8.913 -0.198 1.078 1.00 10.00 H new ATOM 0 HA THR A 34 10.783 -2.483 1.392 1.00 10.00 H new ATOM 0 HB THR A 34 11.489 -0.781 3.295 1.00 10.00 H new ATOM 0 HG1 THR A 34 11.038 1.429 2.463 1.00 10.00 H new ATOM 0 HG21 THR A 34 13.042 0.392 1.801 1.00 10.00 H new ATOM 0 HG22 THR A 34 12.948 -1.340 1.402 1.00 10.00 H new ATOM 0 HG23 THR A 34 12.101 -0.146 0.389 1.00 10.00 H new ATOM 463 N VAL A 35 8.859 -3.353 2.903 1.00 10.00 N ATOM 464 CA VAL A 35 7.892 -3.806 3.892 1.00 10.00 C ATOM 465 C VAL A 35 8.647 -4.212 5.155 1.00 10.00 C ATOM 466 O VAL A 35 9.517 -5.083 5.091 1.00 10.00 O ATOM 467 CB VAL A 35 7.039 -4.962 3.343 1.00 10.00 C ATOM 468 CG1 VAL A 35 5.871 -5.239 4.301 1.00 10.00 C ATOM 469 CG2 VAL A 35 6.501 -4.608 1.951 1.00 10.00 C ATOM 0 H VAL A 35 9.139 -4.061 2.224 1.00 10.00 H new ATOM 0 HA VAL A 35 7.201 -2.998 4.131 1.00 10.00 H new ATOM 0 HB VAL A 35 7.659 -5.855 3.262 1.00 10.00 H new ATOM 0 HG11 VAL A 35 5.267 -6.058 3.911 1.00 10.00 H new ATOM 0 HG12 VAL A 35 6.261 -5.511 5.282 1.00 10.00 H new ATOM 0 HG13 VAL A 35 5.254 -4.345 4.391 1.00 10.00 H new ATOM 0 HG21 VAL A 35 5.899 -5.434 1.573 1.00 10.00 H new ATOM 0 HG22 VAL A 35 5.886 -3.710 2.016 1.00 10.00 H new ATOM 0 HG23 VAL A 35 7.336 -4.428 1.273 1.00 10.00 H new ATOM 479 N ALA A 36 8.324 -3.622 6.310 1.00 10.00 N ATOM 480 CA ALA A 36 9.073 -3.885 7.540 1.00 10.00 C ATOM 481 C ALA A 36 8.704 -5.205 8.222 1.00 10.00 C ATOM 482 O ALA A 36 8.604 -5.268 9.447 1.00 10.00 O ATOM 483 CB ALA A 36 8.958 -2.701 8.493 1.00 10.00 C ATOM 0 H ALA A 36 7.553 -2.963 6.418 1.00 10.00 H new ATOM 0 HA ALA A 36 10.117 -4.004 7.249 1.00 10.00 H new ATOM 0 HB1 ALA A 36 9.520 -2.911 9.403 1.00 10.00 H new ATOM 0 HB2 ALA A 36 9.362 -1.809 8.015 1.00 10.00 H new ATOM 0 HB3 ALA A 36 7.910 -2.536 8.743 1.00 10.00 H new ATOM 489 N ALA A 37 8.549 -6.270 7.430 1.00 10.00 N ATOM 490 CA ALA A 37 8.175 -7.606 7.877 1.00 10.00 C ATOM 491 C ALA A 37 7.054 -7.521 8.922 1.00 10.00 C ATOM 492 O ALA A 37 6.121 -6.745 8.735 1.00 10.00 O ATOM 493 CB ALA A 37 9.429 -8.320 8.391 1.00 10.00 C ATOM 0 H ALA A 37 8.687 -6.218 6.421 1.00 10.00 H new ATOM 0 HA ALA A 37 7.774 -8.194 7.052 1.00 10.00 H new ATOM 0 HB1 ALA A 37 9.164 -9.322 8.729 1.00 10.00 H new ATOM 0 HB2 ALA A 37 10.163 -8.390 7.588 1.00 10.00 H new ATOM 0 HB3 ALA A 37 9.853 -7.757 9.222 1.00 10.00 H new ATOM 499 N VAL A 38 7.171 -8.258 10.032 1.00 10.00 N ATOM 500 CA VAL A 38 6.436 -7.994 11.262 1.00 10.00 C ATOM 501 C VAL A 38 7.435 -7.348 12.236 1.00 10.00 C ATOM 502 O VAL A 38 8.372 -8.026 12.665 1.00 10.00 O ATOM 503 CB VAL A 38 5.839 -9.307 11.807 1.00 10.00 C ATOM 504 CG1 VAL A 38 5.199 -9.112 13.186 1.00 10.00 C ATOM 505 CG2 VAL A 38 4.764 -9.840 10.850 1.00 10.00 C ATOM 0 H VAL A 38 7.790 -9.066 10.096 1.00 10.00 H new ATOM 0 HA VAL A 38 5.593 -7.321 11.105 1.00 10.00 H new ATOM 0 HB VAL A 38 6.661 -10.017 11.894 1.00 10.00 H new ATOM 0 HG11 VAL A 38 4.790 -10.060 13.535 1.00 10.00 H new ATOM 0 HG12 VAL A 38 5.953 -8.761 13.891 1.00 10.00 H new ATOM 0 HG13 VAL A 38 4.398 -8.376 13.115 1.00 10.00 H new ATOM 0 HG21 VAL A 38 4.351 -10.767 11.247 1.00 10.00 H new ATOM 0 HG22 VAL A 38 3.968 -9.102 10.749 1.00 10.00 H new ATOM 0 HG23 VAL A 38 5.208 -10.030 9.873 1.00 10.00 H new ATOM 515 N PRO A 39 7.300 -6.053 12.571 1.00 10.00 N ATOM 516 CA PRO A 39 8.043 -5.431 13.657 1.00 10.00 C ATOM 517 C PRO A 39 7.579 -6.037 14.989 1.00 10.00 C ATOM 518 O PRO A 39 6.582 -6.759 15.020 1.00 10.00 O ATOM 519 CB PRO A 39 7.709 -3.931 13.591 1.00 10.00 C ATOM 520 CG PRO A 39 7.013 -3.740 12.244 1.00 10.00 C ATOM 521 CD PRO A 39 6.373 -5.100 12.000 1.00 10.00 C ATOM 0 HA PRO A 39 9.118 -5.591 13.575 1.00 10.00 H new ATOM 0 HB2 PRO A 39 7.061 -3.634 14.416 1.00 10.00 H new ATOM 0 HB3 PRO A 39 8.611 -3.322 13.659 1.00 10.00 H new ATOM 0 HG2 PRO A 39 6.269 -2.944 12.282 1.00 10.00 H new ATOM 0 HG3 PRO A 39 7.720 -3.478 11.457 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.394 -5.167 12.475 1.00 10.00 H new ATOM 0 HD3 PRO A 39 6.224 -5.282 10.936 1.00 10.00 H new ATOM 529 N PRO A 40 8.240 -5.730 16.114 1.00 10.00 N ATOM 530 CA PRO A 40 7.776 -6.150 17.427 1.00 10.00 C ATOM 531 C PRO A 40 6.573 -5.292 17.856 1.00 10.00 C ATOM 532 O PRO A 40 6.622 -4.610 18.876 1.00 10.00 O ATOM 533 CB PRO A 40 8.999 -5.978 18.336 1.00 10.00 C ATOM 534 CG PRO A 40 9.711 -4.774 17.719 1.00 10.00 C ATOM 535 CD PRO A 40 9.468 -4.958 16.219 1.00 10.00 C ATOM 0 HA PRO A 40 7.417 -7.179 17.460 1.00 10.00 H new ATOM 0 HB2 PRO A 40 8.711 -5.792 19.371 1.00 10.00 H new ATOM 0 HB3 PRO A 40 9.631 -6.866 18.336 1.00 10.00 H new ATOM 0 HG2 PRO A 40 9.299 -3.832 18.082 1.00 10.00 H new ATOM 0 HG3 PRO A 40 10.775 -4.769 17.957 1.00 10.00 H new ATOM 0 HD2 PRO A 40 9.370 -3.996 15.717 1.00 10.00 H new ATOM 0 HD3 PRO A 40 10.301 -5.480 15.748 1.00 10.00 H new ATOM 543 N SER A 41 5.489 -5.313 17.074 1.00 10.00 N ATOM 544 CA SER A 41 4.296 -4.524 17.330 1.00 10.00 C ATOM 545 C SER A 41 3.096 -5.155 16.626 1.00 10.00 C ATOM 546 O SER A 41 2.373 -4.459 15.922 1.00 10.00 O ATOM 547 CB SER A 41 4.522 -3.075 16.870 1.00 10.00 C ATOM 548 OG SER A 41 4.710 -3.014 15.468 1.00 10.00 O ATOM 0 H SER A 41 5.422 -5.889 16.235 1.00 10.00 H new ATOM 0 HA SER A 41 4.087 -4.509 18.400 1.00 10.00 H new ATOM 0 HB2 SER A 41 3.667 -2.462 17.153 1.00 10.00 H new ATOM 0 HB3 SER A 41 5.394 -2.660 17.376 1.00 10.00 H new ATOM 0 HG SER A 41 3.927 -3.392 15.016 1.00 10.00 H new ATOM 554 N ILE A 42 2.877 -6.460 16.825 1.00 10.00 N ATOM 555 CA ILE A 42 1.754 -7.192 16.252 1.00 10.00 C ATOM 556 C ILE A 42 1.887 -7.260 14.721 1.00 10.00 C ATOM 557 O ILE A 42 2.791 -6.678 14.129 1.00 10.00 O ATOM 558 CB ILE A 42 0.412 -6.586 16.729 1.00 10.00 C ATOM 559 CG1 ILE A 42 0.410 -6.189 18.223 1.00 10.00 C ATOM 560 CG2 ILE A 42 -0.772 -7.533 16.489 1.00 10.00 C ATOM 561 CD1 ILE A 42 0.702 -7.357 19.173 1.00 10.00 C ATOM 0 H ILE A 42 3.488 -7.041 17.399 1.00 10.00 H new ATOM 0 HA ILE A 42 1.766 -8.222 16.609 1.00 10.00 H new ATOM 0 HB ILE A 42 0.299 -5.684 16.127 1.00 10.00 H new ATOM 0 HG12 ILE A 42 1.153 -5.408 18.383 1.00 10.00 H new ATOM 0 HG13 ILE A 42 -0.561 -5.762 18.475 1.00 10.00 H new ATOM 0 HG21 ILE A 42 -1.691 -7.063 16.840 1.00 10.00 H new ATOM 0 HG22 ILE A 42 -0.858 -7.746 15.423 1.00 10.00 H new ATOM 0 HG23 ILE A 42 -0.610 -8.464 17.033 1.00 10.00 H new ATOM 0 HD11 ILE A 42 0.684 -7.001 20.203 1.00 10.00 H new ATOM 0 HD12 ILE A 42 -0.055 -8.130 19.043 1.00 10.00 H new ATOM 0 HD13 ILE A 42 1.685 -7.771 18.949 1.00 10.00 H new ATOM 573 N ARG A 43 0.996 -7.997 14.058 1.00 10.00 N ATOM 574 CA ARG A 43 1.011 -8.244 12.623 1.00 10.00 C ATOM 575 C ARG A 43 0.692 -7.005 11.760 1.00 10.00 C ATOM 576 O ARG A 43 0.265 -7.182 10.617 1.00 10.00 O ATOM 577 CB ARG A 43 0.005 -9.374 12.327 1.00 10.00 C ATOM 578 CG ARG A 43 0.500 -10.298 11.207 1.00 10.00 C ATOM 579 CD ARG A 43 1.309 -11.478 11.760 1.00 10.00 C ATOM 580 NE ARG A 43 0.438 -12.416 12.492 1.00 10.00 N ATOM 581 CZ ARG A 43 0.858 -13.426 13.271 1.00 10.00 C ATOM 582 NH1 ARG A 43 2.167 -13.661 13.410 1.00 10.00 N ATOM 583 NH2 ARG A 43 -0.034 -14.194 13.908 1.00 10.00 N ATOM 0 H ARG A 43 0.215 -8.455 14.528 1.00 10.00 H new ATOM 0 HA ARG A 43 2.028 -8.524 12.349 1.00 10.00 H new ATOM 0 HB2 ARG A 43 -0.163 -9.958 13.232 1.00 10.00 H new ATOM 0 HB3 ARG A 43 -0.955 -8.941 12.044 1.00 10.00 H new ATOM 0 HG2 ARG A 43 -0.353 -10.675 10.642 1.00 10.00 H new ATOM 0 HG3 ARG A 43 1.116 -9.729 10.511 1.00 10.00 H new ATOM 0 HD2 ARG A 43 1.805 -11.999 10.941 1.00 10.00 H new ATOM 0 HD3 ARG A 43 2.091 -11.109 12.423 1.00 10.00 H new ATOM 0 HE ARG A 43 -0.569 -12.287 12.399 1.00 10.00 H new ATOM 0 HH11 ARG A 43 2.845 -13.073 12.925 1.00 10.00 H new ATOM 0 HH12 ARG A 43 2.488 -14.428 14.001 1.00 10.00 H new ATOM 0 HH21 ARG A 43 -1.032 -14.012 13.802 1.00 10.00 H new ATOM 0 HH22 ARG A 43 0.284 -14.961 14.500 1.00 10.00 H new ATOM 597 N ASP A 44 0.881 -5.777 12.262 1.00 10.00 N ATOM 598 CA ASP A 44 0.832 -4.571 11.444 1.00 10.00 C ATOM 599 C ASP A 44 2.250 -4.231 11.016 1.00 10.00 C ATOM 600 O ASP A 44 3.211 -4.681 11.631 1.00 10.00 O ATOM 601 CB ASP A 44 0.133 -3.405 12.158 1.00 10.00 C ATOM 602 CG ASP A 44 1.066 -2.342 12.725 1.00 10.00 C ATOM 603 OD1 ASP A 44 1.486 -1.425 11.980 1.00 10.00 O ATOM 604 OD2 ASP A 44 1.318 -2.353 13.943 1.00 10.00 O ATOM 0 H ASP A 44 1.072 -5.598 13.248 1.00 10.00 H new ATOM 0 HA ASP A 44 0.224 -4.756 10.559 1.00 10.00 H new ATOM 0 HB2 ASP A 44 -0.552 -2.928 11.457 1.00 10.00 H new ATOM 0 HB3 ASP A 44 -0.471 -3.807 12.971 1.00 10.00 H new ATOM 609 N THR A 45 2.374 -3.478 9.933 1.00 10.00 N ATOM 610 CA THR A 45 3.639 -3.102 9.336 1.00 10.00 C ATOM 611 C THR A 45 3.315 -2.094 8.242 1.00 10.00 C ATOM 612 O THR A 45 2.142 -1.785 8.022 1.00 10.00 O ATOM 613 CB THR A 45 4.371 -4.344 8.804 1.00 10.00 C ATOM 614 OG1 THR A 45 5.675 -4.032 8.367 1.00 10.00 O ATOM 615 CG2 THR A 45 3.618 -5.035 7.672 1.00 10.00 C ATOM 0 H THR A 45 1.569 -3.102 9.432 1.00 10.00 H new ATOM 0 HA THR A 45 4.317 -2.651 10.061 1.00 10.00 H new ATOM 0 HB THR A 45 4.425 -5.033 9.647 1.00 10.00 H new ATOM 0 HG1 THR A 45 6.173 -4.861 8.206 1.00 10.00 H new ATOM 0 HG21 THR A 45 4.183 -5.905 7.337 1.00 10.00 H new ATOM 0 HG22 THR A 45 2.638 -5.354 8.028 1.00 10.00 H new ATOM 0 HG23 THR A 45 3.494 -4.341 6.841 1.00 10.00 H new ATOM 623 N ALA A 46 4.333 -1.593 7.546 1.00 10.00 N ATOM 624 CA ALA A 46 4.146 -0.624 6.488 1.00 10.00 C ATOM 625 C ALA A 46 5.303 -0.662 5.504 1.00 10.00 C ATOM 626 O ALA A 46 6.302 -1.348 5.741 1.00 10.00 O ATOM 627 CB ALA A 46 3.990 0.771 7.101 1.00 10.00 C ATOM 0 H ALA A 46 5.307 -1.852 7.705 1.00 10.00 H new ATOM 0 HA ALA A 46 3.241 -0.872 5.933 1.00 10.00 H new ATOM 0 HB1 ALA A 46 3.849 1.504 6.307 1.00 10.00 H new ATOM 0 HB2 ALA A 46 3.124 0.783 7.763 1.00 10.00 H new ATOM 0 HB3 ALA A 46 4.886 1.021 7.670 1.00 10.00 H new ATOM 633 N ALA A 47 5.134 0.106 4.422 1.00 10.00 N ATOM 634 CA ALA A 47 6.200 0.471 3.502 1.00 10.00 C ATOM 635 C ALA A 47 6.943 1.693 4.056 1.00 10.00 C ATOM 636 O ALA A 47 6.327 2.512 4.736 1.00 10.00 O ATOM 637 CB ALA A 47 5.600 0.783 2.129 1.00 10.00 C ATOM 0 H ALA A 47 4.228 0.497 4.162 1.00 10.00 H new ATOM 0 HA ALA A 47 6.905 -0.354 3.396 1.00 10.00 H new ATOM 0 HB1 ALA A 47 6.397 1.057 1.437 1.00 10.00 H new ATOM 0 HB2 ALA A 47 5.078 -0.096 1.752 1.00 10.00 H new ATOM 0 HB3 ALA A 47 4.897 1.611 2.219 1.00 10.00 H new ATOM 643 N TYR A 48 8.245 1.817 3.772 1.00 10.00 N ATOM 644 CA TYR A 48 9.091 2.921 4.224 1.00 10.00 C ATOM 645 C TYR A 48 9.869 3.454 3.017 1.00 10.00 C ATOM 646 O TYR A 48 11.058 3.179 2.857 1.00 10.00 O ATOM 647 CB TYR A 48 10.032 2.419 5.316 1.00 10.00 C ATOM 648 CG TYR A 48 9.347 2.020 6.607 1.00 10.00 C ATOM 649 CD1 TYR A 48 8.672 0.791 6.713 1.00 10.00 C ATOM 650 CD2 TYR A 48 9.348 2.910 7.695 1.00 10.00 C ATOM 651 CE1 TYR A 48 7.988 0.463 7.896 1.00 10.00 C ATOM 652 CE2 TYR A 48 8.719 2.548 8.896 1.00 10.00 C ATOM 653 CZ TYR A 48 8.087 1.301 9.014 1.00 10.00 C ATOM 654 OH TYR A 48 7.487 0.951 10.187 1.00 10.00 O ATOM 0 H TYR A 48 8.749 1.134 3.207 1.00 10.00 H new ATOM 0 HA TYR A 48 8.491 3.729 4.643 1.00 10.00 H new ATOM 0 HB2 TYR A 48 10.585 1.561 4.934 1.00 10.00 H new ATOM 0 HB3 TYR A 48 10.762 3.198 5.534 1.00 10.00 H new ATOM 0 HD1 TYR A 48 8.679 0.098 5.884 1.00 10.00 H new ATOM 0 HD2 TYR A 48 9.832 3.871 7.607 1.00 10.00 H new ATOM 0 HE1 TYR A 48 7.387 -0.433 7.943 1.00 10.00 H new ATOM 0 HE2 TYR A 48 8.721 3.232 9.732 1.00 10.00 H new ATOM 0 HH TYR A 48 7.655 1.643 10.860 1.00 10.00 H new ATOM 664 N MET A 49 9.168 4.124 2.109 1.00 10.00 N ATOM 665 CA MET A 49 9.586 4.339 0.724 1.00 10.00 C ATOM 666 C MET A 49 8.963 5.634 0.200 1.00 10.00 C ATOM 667 O MET A 49 8.407 6.379 0.994 1.00 10.00 O ATOM 668 CB MET A 49 9.255 3.084 -0.106 1.00 10.00 C ATOM 669 CG MET A 49 10.545 2.397 -0.568 1.00 10.00 C ATOM 670 SD MET A 49 11.310 3.150 -2.025 1.00 10.00 S ATOM 671 CE MET A 49 12.814 2.157 -2.129 1.00 10.00 C ATOM 0 H MET A 49 8.264 4.547 2.321 1.00 10.00 H new ATOM 0 HA MET A 49 10.665 4.476 0.646 1.00 10.00 H new ATOM 0 HB2 MET A 49 8.660 2.392 0.490 1.00 10.00 H new ATOM 0 HB3 MET A 49 8.652 3.360 -0.971 1.00 10.00 H new ATOM 0 HG2 MET A 49 11.263 2.409 0.252 1.00 10.00 H new ATOM 0 HG3 MET A 49 10.328 1.351 -0.786 1.00 10.00 H new ATOM 0 HE1 MET A 49 13.410 2.488 -2.979 1.00 10.00 H new ATOM 0 HE2 MET A 49 13.392 2.275 -1.212 1.00 10.00 H new ATOM 0 HE3 MET A 49 12.549 1.108 -2.258 1.00 10.00 H new ATOM 681 N THR A 50 9.109 5.975 -1.084 1.00 10.00 N ATOM 682 CA THR A 50 8.692 7.256 -1.630 1.00 10.00 C ATOM 683 C THR A 50 7.727 7.028 -2.792 1.00 10.00 C ATOM 684 O THR A 50 7.933 6.116 -3.590 1.00 10.00 O ATOM 685 CB THR A 50 9.940 8.012 -2.104 1.00 10.00 C ATOM 686 OG1 THR A 50 10.789 7.128 -2.813 1.00 10.00 O ATOM 687 CG2 THR A 50 10.720 8.574 -0.913 1.00 10.00 C ATOM 0 H THR A 50 9.527 5.355 -1.778 1.00 10.00 H new ATOM 0 HA THR A 50 8.179 7.845 -0.870 1.00 10.00 H new ATOM 0 HB THR A 50 9.617 8.832 -2.745 1.00 10.00 H new ATOM 0 HG1 THR A 50 11.585 7.612 -3.117 1.00 10.00 H new ATOM 0 HG21 THR A 50 11.601 9.106 -1.273 1.00 10.00 H new ATOM 0 HG22 THR A 50 10.085 9.261 -0.354 1.00 10.00 H new ATOM 0 HG23 THR A 50 11.031 7.756 -0.263 1.00 10.00 H new ATOM 695 N LEU A 51 6.690 7.864 -2.910 1.00 10.00 N ATOM 696 CA LEU A 51 5.959 7.976 -4.161 1.00 10.00 C ATOM 697 C LEU A 51 6.725 8.964 -5.014 1.00 10.00 C ATOM 698 O LEU A 51 7.361 9.864 -4.464 1.00 10.00 O ATOM 699 CB LEU A 51 4.521 8.487 -3.982 1.00 10.00 C ATOM 700 CG LEU A 51 3.576 7.574 -4.776 1.00 10.00 C ATOM 701 CD1 LEU A 51 3.296 6.256 -4.043 1.00 10.00 C ATOM 702 CD2 LEU A 51 2.257 8.288 -5.061 1.00 10.00 C ATOM 0 H LEU A 51 6.347 8.464 -2.160 1.00 10.00 H new ATOM 0 HA LEU A 51 5.879 6.987 -4.612 1.00 10.00 H new ATOM 0 HB2 LEU A 51 4.248 8.488 -2.927 1.00 10.00 H new ATOM 0 HB3 LEU A 51 4.438 9.515 -4.334 1.00 10.00 H new ATOM 0 HG LEU A 51 4.077 7.338 -5.715 1.00 10.00 H new ATOM 0 HD11 LEU A 51 2.623 5.642 -4.642 1.00 10.00 H new ATOM 0 HD12 LEU A 51 4.233 5.721 -3.886 1.00 10.00 H new ATOM 0 HD13 LEU A 51 2.833 6.467 -3.079 1.00 10.00 H new ATOM 0 HD21 LEU A 51 1.599 7.626 -5.625 1.00 10.00 H new ATOM 0 HD22 LEU A 51 1.779 8.559 -4.120 1.00 10.00 H new ATOM 0 HD23 LEU A 51 2.450 9.189 -5.643 1.00 10.00 H new ATOM 714 N THR A 52 6.653 8.796 -6.334 1.00 10.00 N ATOM 715 CA THR A 52 7.427 9.570 -7.288 1.00 10.00 C ATOM 716 C THR A 52 6.588 9.918 -8.514 1.00 10.00 C ATOM 717 O THR A 52 6.202 9.020 -9.259 1.00 10.00 O ATOM 718 CB THR A 52 8.676 8.758 -7.658 1.00 10.00 C ATOM 719 OG1 THR A 52 9.355 8.386 -6.474 1.00 10.00 O ATOM 720 CG2 THR A 52 9.642 9.562 -8.532 1.00 10.00 C ATOM 0 H THR A 52 6.043 8.105 -6.772 1.00 10.00 H new ATOM 0 HA THR A 52 7.733 10.519 -6.847 1.00 10.00 H new ATOM 0 HB THR A 52 8.347 7.883 -8.219 1.00 10.00 H new ATOM 0 HG1 THR A 52 10.153 7.866 -6.704 1.00 10.00 H new ATOM 0 HG21 THR A 52 10.512 8.950 -8.771 1.00 10.00 H new ATOM 0 HG22 THR A 52 9.140 9.855 -9.454 1.00 10.00 H new ATOM 0 HG23 THR A 52 9.963 10.454 -7.994 1.00 10.00 H new ATOM 728 N ASN A 53 6.377 11.215 -8.761 1.00 10.00 N ATOM 729 CA ASN A 53 5.706 11.698 -9.962 1.00 10.00 C ATOM 730 C ASN A 53 6.689 11.662 -11.129 1.00 10.00 C ATOM 731 O ASN A 53 7.815 12.137 -10.985 1.00 10.00 O ATOM 732 CB ASN A 53 5.250 13.157 -9.773 1.00 10.00 C ATOM 733 CG ASN A 53 3.757 13.329 -10.006 1.00 10.00 C ATOM 734 OD1 ASN A 53 3.322 13.761 -11.068 1.00 10.00 O ATOM 735 ND2 ASN A 53 2.966 12.994 -8.995 1.00 10.00 N ATOM 0 H ASN A 53 6.670 11.959 -8.128 1.00 10.00 H new ATOM 0 HA ASN A 53 4.841 11.064 -10.157 1.00 10.00 H new ATOM 0 HB2 ASN A 53 5.498 13.485 -8.764 1.00 10.00 H new ATOM 0 HB3 ASN A 53 5.799 13.799 -10.461 1.00 10.00 H new ATOM 0 HD21 ASN A 53 1.955 13.092 -9.085 1.00 10.00 H new ATOM 0 HD22 ASN A 53 3.369 12.638 -8.128 1.00 10.00 H new ATOM 742 N LYS A 54 6.279 11.129 -12.286 1.00 10.00 N ATOM 743 CA LYS A 54 7.015 11.288 -13.532 1.00 10.00 C ATOM 744 C LYS A 54 6.003 11.591 -14.635 1.00 10.00 C ATOM 745 O LYS A 54 5.910 10.890 -15.640 1.00 10.00 O ATOM 746 CB LYS A 54 7.885 10.051 -13.811 1.00 10.00 C ATOM 747 CG LYS A 54 9.119 10.058 -12.893 1.00 10.00 C ATOM 748 CD LYS A 54 10.128 8.935 -13.164 1.00 10.00 C ATOM 749 CE LYS A 54 10.648 8.945 -14.612 1.00 10.00 C ATOM 750 NZ LYS A 54 11.755 7.989 -14.818 1.00 10.00 N ATOM 0 H LYS A 54 5.427 10.576 -12.378 1.00 10.00 H new ATOM 0 HA LYS A 54 7.716 12.121 -13.476 1.00 10.00 H new ATOM 0 HB2 LYS A 54 7.304 9.143 -13.647 1.00 10.00 H new ATOM 0 HB3 LYS A 54 8.198 10.044 -14.855 1.00 10.00 H new ATOM 0 HG2 LYS A 54 9.627 11.017 -12.998 1.00 10.00 H new ATOM 0 HG3 LYS A 54 8.785 9.985 -11.858 1.00 10.00 H new ATOM 0 HD2 LYS A 54 10.970 9.034 -12.479 1.00 10.00 H new ATOM 0 HD3 LYS A 54 9.660 7.973 -12.956 1.00 10.00 H new ATOM 0 HE2 LYS A 54 9.830 8.702 -15.291 1.00 10.00 H new ATOM 0 HE3 LYS A 54 10.986 9.949 -14.867 1.00 10.00 H new ATOM 0 HZ1 LYS A 54 12.071 8.032 -15.808 1.00 10.00 H new ATOM 0 HZ2 LYS A 54 12.547 8.235 -14.190 1.00 10.00 H new ATOM 0 HZ3 LYS A 54 11.427 7.026 -14.601 1.00 10.00 H new ATOM 764 N SER A 55 5.261 12.680 -14.434 1.00 10.00 N ATOM 765 CA SER A 55 4.229 13.146 -15.344 1.00 10.00 C ATOM 766 C SER A 55 3.874 14.593 -15.017 1.00 10.00 C ATOM 767 O SER A 55 3.785 15.423 -15.920 1.00 10.00 O ATOM 768 CB SER A 55 2.993 12.248 -15.236 1.00 10.00 C ATOM 769 OG SER A 55 2.472 12.280 -13.922 1.00 10.00 O ATOM 0 H SER A 55 5.368 13.274 -13.611 1.00 10.00 H new ATOM 0 HA SER A 55 4.599 13.099 -16.368 1.00 10.00 H new ATOM 0 HB2 SER A 55 2.233 12.579 -15.943 1.00 10.00 H new ATOM 0 HB3 SER A 55 3.255 11.225 -15.505 1.00 10.00 H new ATOM 0 HG SER A 55 1.493 12.299 -13.959 1.00 10.00 H new ATOM 775 N ASP A 56 3.670 14.868 -13.723 1.00 10.00 N ATOM 776 CA ASP A 56 3.212 16.127 -13.172 1.00 10.00 C ATOM 777 C ASP A 56 1.772 16.404 -13.592 1.00 10.00 C ATOM 778 O ASP A 56 1.432 17.464 -14.121 1.00 10.00 O ATOM 779 CB ASP A 56 4.259 17.242 -13.329 1.00 10.00 C ATOM 780 CG ASP A 56 5.493 16.969 -12.465 1.00 10.00 C ATOM 781 OD1 ASP A 56 5.359 16.169 -11.510 1.00 10.00 O ATOM 782 OD2 ASP A 56 6.547 17.588 -12.727 1.00 10.00 O ATOM 0 H ASP A 56 3.833 14.169 -12.998 1.00 10.00 H new ATOM 0 HA ASP A 56 3.136 16.073 -12.086 1.00 10.00 H new ATOM 0 HB2 ASP A 56 4.555 17.322 -14.375 1.00 10.00 H new ATOM 0 HB3 ASP A 56 3.820 18.199 -13.048 1.00 10.00 H new ATOM 787 N GLN A 57 0.909 15.425 -13.288 1.00 10.00 N ATOM 788 CA GLN A 57 -0.544 15.516 -13.309 1.00 10.00 C ATOM 789 C GLN A 57 -1.071 14.946 -11.978 1.00 10.00 C ATOM 790 O GLN A 57 -0.422 14.077 -11.397 1.00 10.00 O ATOM 791 CB GLN A 57 -1.106 14.703 -14.486 1.00 10.00 C ATOM 792 CG GLN A 57 -1.002 15.395 -15.853 1.00 10.00 C ATOM 793 CD GLN A 57 0.343 15.156 -16.530 1.00 10.00 C ATOM 794 OE1 GLN A 57 0.578 14.087 -17.085 1.00 10.00 O ATOM 795 NE2 GLN A 57 1.237 16.134 -16.488 1.00 10.00 N ATOM 0 H GLN A 57 1.232 14.499 -13.006 1.00 10.00 H new ATOM 0 HA GLN A 57 -0.857 16.553 -13.430 1.00 10.00 H new ATOM 0 HB2 GLN A 57 -0.579 13.750 -14.536 1.00 10.00 H new ATOM 0 HB3 GLN A 57 -2.154 14.478 -14.287 1.00 10.00 H new ATOM 0 HG2 GLN A 57 -1.800 15.033 -16.501 1.00 10.00 H new ATOM 0 HG3 GLN A 57 -1.156 16.467 -15.726 1.00 10.00 H new ATOM 0 HE21 GLN A 57 1.012 17.011 -16.019 1.00 10.00 H new ATOM 0 HE22 GLN A 57 2.150 16.009 -16.925 1.00 10.00 H new ATOM 804 N PRO A 58 -2.228 15.414 -11.479 1.00 10.00 N ATOM 805 CA PRO A 58 -2.807 14.956 -10.221 1.00 10.00 C ATOM 806 C PRO A 58 -3.523 13.611 -10.395 1.00 10.00 C ATOM 807 O PRO A 58 -4.733 13.569 -10.615 1.00 10.00 O ATOM 808 CB PRO A 58 -3.763 16.079 -9.804 1.00 10.00 C ATOM 809 CG PRO A 58 -4.249 16.633 -11.145 1.00 10.00 C ATOM 810 CD PRO A 58 -3.008 16.512 -12.030 1.00 10.00 C ATOM 0 HA PRO A 58 -2.053 14.772 -9.456 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -4.588 15.703 -9.200 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -3.256 16.841 -9.212 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -5.086 16.058 -11.541 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -4.585 17.666 -11.058 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -3.285 16.313 -13.065 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -2.434 17.439 -12.026 1.00 10.00 H new ATOM 818 N ILE A 59 -2.782 12.505 -10.283 1.00 10.00 N ATOM 819 CA ILE A 59 -3.305 11.157 -10.472 1.00 10.00 C ATOM 820 C ILE A 59 -3.324 10.463 -9.114 1.00 10.00 C ATOM 821 O ILE A 59 -2.281 10.285 -8.491 1.00 10.00 O ATOM 822 CB ILE A 59 -2.427 10.388 -11.468 1.00 10.00 C ATOM 823 CG1 ILE A 59 -2.360 11.080 -12.839 1.00 10.00 C ATOM 824 CG2 ILE A 59 -2.895 8.936 -11.649 1.00 10.00 C ATOM 825 CD1 ILE A 59 -0.897 11.170 -13.264 1.00 10.00 C ATOM 0 H ILE A 59 -1.788 12.526 -10.055 1.00 10.00 H new ATOM 0 HA ILE A 59 -4.315 11.192 -10.880 1.00 10.00 H new ATOM 0 HB ILE A 59 -1.427 10.381 -11.035 1.00 10.00 H new ATOM 0 HG12 ILE A 59 -2.935 10.518 -13.575 1.00 10.00 H new ATOM 0 HG13 ILE A 59 -2.800 12.076 -12.783 1.00 10.00 H new ATOM 0 HG21 ILE A 59 -2.244 8.430 -12.363 1.00 10.00 H new ATOM 0 HG22 ILE A 59 -2.854 8.418 -10.691 1.00 10.00 H new ATOM 0 HG23 ILE A 59 -3.919 8.928 -12.022 1.00 10.00 H new ATOM 0 HD11 ILE A 59 -0.830 11.659 -14.236 1.00 10.00 H new ATOM 0 HD12 ILE A 59 -0.339 11.748 -12.528 1.00 10.00 H new ATOM 0 HD13 ILE A 59 -0.476 10.167 -13.332 1.00 10.00 H new ATOM 837 N LYS A 60 -4.508 10.053 -8.661 1.00 10.00 N ATOM 838 CA LYS A 60 -4.658 9.298 -7.428 1.00 10.00 C ATOM 839 C LYS A 60 -4.419 7.811 -7.681 1.00 10.00 C ATOM 840 O LYS A 60 -4.717 7.322 -8.770 1.00 10.00 O ATOM 841 CB LYS A 60 -6.056 9.545 -6.852 1.00 10.00 C ATOM 842 CG LYS A 60 -7.205 9.038 -7.744 1.00 10.00 C ATOM 843 CD LYS A 60 -8.396 10.009 -7.760 1.00 10.00 C ATOM 844 CE LYS A 60 -8.103 11.238 -8.639 1.00 10.00 C ATOM 845 NZ LYS A 60 -9.237 12.186 -8.673 1.00 10.00 N ATOM 0 H LYS A 60 -5.388 10.238 -9.142 1.00 10.00 H new ATOM 0 HA LYS A 60 -3.916 9.631 -6.703 1.00 10.00 H new ATOM 0 HB2 LYS A 60 -6.126 9.061 -5.878 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -6.185 10.615 -6.686 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -6.839 8.897 -8.761 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -7.537 8.063 -7.387 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -9.282 9.495 -8.133 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -8.619 10.331 -6.743 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -7.217 11.748 -8.262 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -7.875 10.911 -9.653 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -8.994 12.997 -9.277 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -10.077 11.708 -9.057 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -9.439 12.520 -7.709 1.00 10.00 H new ATOM 859 N LEU A 61 -3.931 7.085 -6.670 1.00 10.00 N ATOM 860 CA LEU A 61 -3.795 5.638 -6.726 1.00 10.00 C ATOM 861 C LEU A 61 -4.439 5.034 -5.482 1.00 10.00 C ATOM 862 O LEU A 61 -4.414 5.649 -4.419 1.00 10.00 O ATOM 863 CB LEU A 61 -2.343 5.232 -7.035 1.00 10.00 C ATOM 864 CG LEU A 61 -1.345 5.024 -5.884 1.00 10.00 C ATOM 865 CD1 LEU A 61 -1.159 6.270 -5.010 1.00 10.00 C ATOM 866 CD2 LEU A 61 -1.665 3.774 -5.055 1.00 10.00 C ATOM 0 H LEU A 61 -3.620 7.493 -5.788 1.00 10.00 H new ATOM 0 HA LEU A 61 -4.344 5.208 -7.564 1.00 10.00 H new ATOM 0 HB2 LEU A 61 -2.380 4.304 -7.605 1.00 10.00 H new ATOM 0 HB3 LEU A 61 -1.926 5.994 -7.693 1.00 10.00 H new ATOM 0 HG LEU A 61 -0.379 4.850 -6.359 1.00 10.00 H new ATOM 0 HD11 LEU A 61 -0.442 6.055 -4.217 1.00 10.00 H new ATOM 0 HD12 LEU A 61 -0.787 7.092 -5.622 1.00 10.00 H new ATOM 0 HD13 LEU A 61 -2.115 6.551 -4.568 1.00 10.00 H new ATOM 0 HD21 LEU A 61 -0.932 3.671 -4.255 1.00 10.00 H new ATOM 0 HD22 LEU A 61 -2.662 3.868 -4.624 1.00 10.00 H new ATOM 0 HD23 LEU A 61 -1.629 2.893 -5.696 1.00 10.00 H new ATOM 878 N VAL A 62 -5.084 3.874 -5.626 1.00 10.00 N ATOM 879 CA VAL A 62 -5.853 3.241 -4.561 1.00 10.00 C ATOM 880 C VAL A 62 -5.843 1.726 -4.778 1.00 10.00 C ATOM 881 O VAL A 62 -6.883 1.086 -4.891 1.00 10.00 O ATOM 882 CB VAL A 62 -7.261 3.873 -4.473 1.00 10.00 C ATOM 883 CG1 VAL A 62 -8.026 3.886 -5.801 1.00 10.00 C ATOM 884 CG2 VAL A 62 -8.129 3.276 -3.356 1.00 10.00 C ATOM 0 H VAL A 62 -5.085 3.344 -6.498 1.00 10.00 H new ATOM 0 HA VAL A 62 -5.402 3.417 -3.585 1.00 10.00 H new ATOM 0 HB VAL A 62 -7.059 4.912 -4.215 1.00 10.00 H new ATOM 0 HG11 VAL A 62 -9.003 4.345 -5.653 1.00 10.00 H new ATOM 0 HG12 VAL A 62 -7.464 4.458 -6.539 1.00 10.00 H new ATOM 0 HG13 VAL A 62 -8.156 2.864 -6.156 1.00 10.00 H new ATOM 0 HG21 VAL A 62 -9.103 3.765 -3.351 1.00 10.00 H new ATOM 0 HG22 VAL A 62 -8.260 2.208 -3.529 1.00 10.00 H new ATOM 0 HG23 VAL A 62 -7.641 3.430 -2.394 1.00 10.00 H new ATOM 894 N GLY A 63 -4.648 1.136 -4.843 1.00 10.00 N ATOM 895 CA GLY A 63 -4.514 -0.307 -4.806 1.00 10.00 C ATOM 896 C GLY A 63 -3.097 -0.696 -4.405 1.00 10.00 C ATOM 897 O GLY A 63 -2.145 -0.011 -4.771 1.00 10.00 O ATOM 0 H GLY A 63 -3.765 1.641 -4.921 1.00 10.00 H new ATOM 0 HA2 GLY A 63 -5.228 -0.727 -4.098 1.00 10.00 H new ATOM 0 HA3 GLY A 63 -4.751 -0.726 -5.784 1.00 10.00 H new ATOM 901 N ALA A 64 -2.978 -1.801 -3.671 1.00 10.00 N ATOM 902 CA ALA A 64 -1.730 -2.443 -3.292 1.00 10.00 C ATOM 903 C ALA A 64 -2.065 -3.909 -3.014 1.00 10.00 C ATOM 904 O ALA A 64 -2.081 -4.356 -1.870 1.00 10.00 O ATOM 905 CB ALA A 64 -1.121 -1.734 -2.077 1.00 10.00 C ATOM 0 H ALA A 64 -3.794 -2.294 -3.308 1.00 10.00 H new ATOM 0 HA ALA A 64 -0.979 -2.383 -4.080 1.00 10.00 H new ATOM 0 HB1 ALA A 64 -0.187 -2.223 -1.801 1.00 10.00 H new ATOM 0 HB2 ALA A 64 -0.926 -0.691 -2.325 1.00 10.00 H new ATOM 0 HB3 ALA A 64 -1.817 -1.784 -1.240 1.00 10.00 H new ATOM 911 N ALA A 65 -2.399 -4.646 -4.073 1.00 10.00 N ATOM 912 CA ALA A 65 -2.883 -6.012 -3.992 1.00 10.00 C ATOM 913 C ALA A 65 -1.664 -6.920 -3.892 1.00 10.00 C ATOM 914 O ALA A 65 -0.915 -7.066 -4.856 1.00 10.00 O ATOM 915 CB ALA A 65 -3.734 -6.338 -5.223 1.00 10.00 C ATOM 0 H ALA A 65 -2.337 -4.297 -5.029 1.00 10.00 H new ATOM 0 HA ALA A 65 -3.519 -6.157 -3.119 1.00 10.00 H new ATOM 0 HB1 ALA A 65 -4.094 -7.365 -5.155 1.00 10.00 H new ATOM 0 HB2 ALA A 65 -4.585 -5.658 -5.268 1.00 10.00 H new ATOM 0 HB3 ALA A 65 -3.130 -6.224 -6.123 1.00 10.00 H new ATOM 921 N THR A 66 -1.438 -7.479 -2.705 1.00 10.00 N ATOM 922 CA THR A 66 -0.213 -8.179 -2.366 1.00 10.00 C ATOM 923 C THR A 66 -0.524 -9.593 -1.867 1.00 10.00 C ATOM 924 O THR A 66 -1.540 -9.802 -1.193 1.00 10.00 O ATOM 925 CB THR A 66 0.555 -7.354 -1.322 1.00 10.00 C ATOM 926 OG1 THR A 66 1.656 -8.093 -0.833 1.00 10.00 O ATOM 927 CG2 THR A 66 -0.302 -6.925 -0.131 1.00 10.00 C ATOM 0 H THR A 66 -2.116 -7.455 -1.943 1.00 10.00 H new ATOM 0 HA THR A 66 0.414 -8.289 -3.251 1.00 10.00 H new ATOM 0 HB THR A 66 0.881 -6.451 -1.838 1.00 10.00 H new ATOM 0 HG1 THR A 66 2.375 -7.478 -0.578 1.00 10.00 H new ATOM 0 HG21 THR A 66 0.306 -6.347 0.565 1.00 10.00 H new ATOM 0 HG22 THR A 66 -1.133 -6.313 -0.482 1.00 10.00 H new ATOM 0 HG23 THR A 66 -0.691 -7.809 0.375 1.00 10.00 H new ATOM 935 N PRO A 67 0.351 -10.572 -2.148 1.00 10.00 N ATOM 936 CA PRO A 67 0.318 -11.867 -1.497 1.00 10.00 C ATOM 937 C PRO A 67 0.886 -11.781 -0.071 1.00 10.00 C ATOM 938 O PRO A 67 0.699 -12.720 0.699 1.00 10.00 O ATOM 939 CB PRO A 67 1.159 -12.780 -2.389 1.00 10.00 C ATOM 940 CG PRO A 67 2.227 -11.827 -2.916 1.00 10.00 C ATOM 941 CD PRO A 67 1.478 -10.502 -3.070 1.00 10.00 C ATOM 0 HA PRO A 67 -0.698 -12.246 -1.384 1.00 10.00 H new ATOM 0 HB2 PRO A 67 1.594 -13.608 -1.829 1.00 10.00 H new ATOM 0 HB3 PRO A 67 0.569 -13.216 -3.196 1.00 10.00 H new ATOM 0 HG2 PRO A 67 3.063 -11.737 -2.222 1.00 10.00 H new ATOM 0 HG3 PRO A 67 2.637 -12.169 -3.866 1.00 10.00 H new ATOM 0 HD2 PRO A 67 2.125 -9.657 -2.833 1.00 10.00 H new ATOM 0 HD3 PRO A 67 1.136 -10.363 -4.096 1.00 10.00 H new ATOM 949 N LEU A 68 1.546 -10.676 0.308 1.00 10.00 N ATOM 950 CA LEU A 68 2.187 -10.536 1.611 1.00 10.00 C ATOM 951 C LEU A 68 1.175 -10.158 2.697 1.00 10.00 C ATOM 952 O LEU A 68 1.051 -10.878 3.685 1.00 10.00 O ATOM 953 CB LEU A 68 3.354 -9.542 1.513 1.00 10.00 C ATOM 954 CG LEU A 68 4.219 -9.428 2.780 1.00 10.00 C ATOM 955 CD1 LEU A 68 4.691 -10.786 3.319 1.00 10.00 C ATOM 956 CD2 LEU A 68 5.448 -8.573 2.455 1.00 10.00 C ATOM 0 H LEU A 68 1.647 -9.855 -0.288 1.00 10.00 H new ATOM 0 HA LEU A 68 2.598 -11.500 1.911 1.00 10.00 H new ATOM 0 HB2 LEU A 68 3.993 -9.836 0.680 1.00 10.00 H new ATOM 0 HB3 LEU A 68 2.953 -8.557 1.275 1.00 10.00 H new ATOM 0 HG LEU A 68 3.600 -8.975 3.554 1.00 10.00 H new ATOM 0 HD11 LEU A 68 5.296 -10.632 4.213 1.00 10.00 H new ATOM 0 HD12 LEU A 68 3.825 -11.400 3.568 1.00 10.00 H new ATOM 0 HD13 LEU A 68 5.288 -11.291 2.560 1.00 10.00 H new ATOM 0 HD21 LEU A 68 6.073 -8.482 3.343 1.00 10.00 H new ATOM 0 HD22 LEU A 68 6.019 -9.046 1.656 1.00 10.00 H new ATOM 0 HD23 LEU A 68 5.127 -7.582 2.134 1.00 10.00 H new ATOM 968 N ALA A 69 0.454 -9.044 2.525 1.00 10.00 N ATOM 969 CA ALA A 69 -0.445 -8.483 3.538 1.00 10.00 C ATOM 970 C ALA A 69 -1.916 -8.754 3.222 1.00 10.00 C ATOM 971 O ALA A 69 -2.330 -8.691 2.065 1.00 10.00 O ATOM 972 CB ALA A 69 -0.197 -6.983 3.669 1.00 10.00 C ATOM 0 H ALA A 69 0.480 -8.499 1.663 1.00 10.00 H new ATOM 0 HA ALA A 69 -0.227 -8.977 4.485 1.00 10.00 H new ATOM 0 HB1 ALA A 69 -0.866 -6.568 4.423 1.00 10.00 H new ATOM 0 HB2 ALA A 69 0.837 -6.810 3.967 1.00 10.00 H new ATOM 0 HB3 ALA A 69 -0.384 -6.498 2.711 1.00 10.00 H new ATOM 978 N THR A 70 -2.723 -9.080 4.231 1.00 10.00 N ATOM 979 CA THR A 70 -4.155 -9.304 4.065 1.00 10.00 C ATOM 980 C THR A 70 -4.880 -7.972 3.907 1.00 10.00 C ATOM 981 O THR A 70 -5.786 -7.863 3.085 1.00 10.00 O ATOM 982 CB THR A 70 -4.719 -10.111 5.245 1.00 10.00 C ATOM 983 OG1 THR A 70 -4.008 -11.323 5.359 1.00 10.00 O ATOM 984 CG2 THR A 70 -6.196 -10.466 5.044 1.00 10.00 C ATOM 0 H THR A 70 -2.398 -9.196 5.191 1.00 10.00 H new ATOM 0 HA THR A 70 -4.317 -9.888 3.159 1.00 10.00 H new ATOM 0 HB THR A 70 -4.618 -9.493 6.137 1.00 10.00 H new ATOM 0 HG1 THR A 70 -3.164 -11.164 5.830 1.00 10.00 H new ATOM 0 HG21 THR A 70 -6.553 -11.036 5.902 1.00 10.00 H new ATOM 0 HG22 THR A 70 -6.780 -9.551 4.948 1.00 10.00 H new ATOM 0 HG23 THR A 70 -6.307 -11.064 4.139 1.00 10.00 H new ATOM 992 N SER A 71 -4.495 -6.975 4.708 1.00 10.00 N ATOM 993 CA SER A 71 -5.233 -5.734 4.871 1.00 10.00 C ATOM 994 C SER A 71 -4.318 -4.545 4.521 1.00 10.00 C ATOM 995 O SER A 71 -3.703 -3.951 5.407 1.00 10.00 O ATOM 996 CB SER A 71 -5.787 -5.720 6.305 1.00 10.00 C ATOM 997 OG SER A 71 -7.004 -5.007 6.378 1.00 10.00 O ATOM 0 H SER A 71 -3.644 -7.015 5.269 1.00 10.00 H new ATOM 0 HA SER A 71 -6.082 -5.650 4.192 1.00 10.00 H new ATOM 0 HB2 SER A 71 -5.941 -6.743 6.647 1.00 10.00 H new ATOM 0 HB3 SER A 71 -5.057 -5.266 6.975 1.00 10.00 H new ATOM 0 HG SER A 71 -6.817 -4.049 6.463 1.00 10.00 H new ATOM 1003 N PRO A 72 -4.170 -4.226 3.222 1.00 10.00 N ATOM 1004 CA PRO A 72 -3.318 -3.146 2.749 1.00 10.00 C ATOM 1005 C PRO A 72 -4.067 -1.816 2.790 1.00 10.00 C ATOM 1006 O PRO A 72 -4.652 -1.381 1.799 1.00 10.00 O ATOM 1007 CB PRO A 72 -2.933 -3.554 1.324 1.00 10.00 C ATOM 1008 CG PRO A 72 -4.181 -4.286 0.831 1.00 10.00 C ATOM 1009 CD PRO A 72 -4.668 -5.000 2.091 1.00 10.00 C ATOM 0 HA PRO A 72 -2.434 -2.998 3.369 1.00 10.00 H new ATOM 0 HB2 PRO A 72 -2.701 -2.688 0.704 1.00 10.00 H new ATOM 0 HB3 PRO A 72 -2.055 -4.199 1.312 1.00 10.00 H new ATOM 0 HG2 PRO A 72 -4.929 -3.595 0.442 1.00 10.00 H new ATOM 0 HG3 PRO A 72 -3.949 -4.989 0.031 1.00 10.00 H new ATOM 0 HD2 PRO A 72 -5.756 -5.057 2.109 1.00 10.00 H new ATOM 0 HD3 PRO A 72 -4.294 -6.023 2.126 1.00 10.00 H new ATOM 1017 N MET A 73 -4.035 -1.153 3.941 1.00 10.00 N ATOM 1018 CA MET A 73 -4.658 0.146 4.122 1.00 10.00 C ATOM 1019 C MET A 73 -3.690 1.224 3.650 1.00 10.00 C ATOM 1020 O MET A 73 -2.559 1.293 4.116 1.00 10.00 O ATOM 1021 CB MET A 73 -4.958 0.352 5.604 1.00 10.00 C ATOM 1022 CG MET A 73 -6.295 -0.224 6.082 1.00 10.00 C ATOM 1023 SD MET A 73 -6.556 -2.008 5.948 1.00 10.00 S ATOM 1024 CE MET A 73 -7.371 -2.142 4.339 1.00 10.00 C ATOM 0 H MET A 73 -3.572 -1.507 4.778 1.00 10.00 H new ATOM 0 HA MET A 73 -5.584 0.202 3.549 1.00 10.00 H new ATOM 0 HB2 MET A 73 -4.156 -0.100 6.188 1.00 10.00 H new ATOM 0 HB3 MET A 73 -4.944 1.421 5.817 1.00 10.00 H new ATOM 0 HG2 MET A 73 -6.421 0.053 7.129 1.00 10.00 H new ATOM 0 HG3 MET A 73 -7.089 0.271 5.523 1.00 10.00 H new ATOM 0 HE1 MET A 73 -8.362 -2.576 4.468 1.00 10.00 H new ATOM 0 HE2 MET A 73 -7.464 -1.151 3.895 1.00 10.00 H new ATOM 0 HE3 MET A 73 -6.779 -2.780 3.683 1.00 10.00 H new ATOM 1034 N LEU A 74 -4.148 2.106 2.772 1.00 10.00 N ATOM 1035 CA LEU A 74 -3.438 3.330 2.428 1.00 10.00 C ATOM 1036 C LEU A 74 -3.776 4.376 3.496 1.00 10.00 C ATOM 1037 O LEU A 74 -4.903 4.401 3.990 1.00 10.00 O ATOM 1038 CB LEU A 74 -3.904 3.766 1.033 1.00 10.00 C ATOM 1039 CG LEU A 74 -3.299 2.885 -0.071 1.00 10.00 C ATOM 1040 CD1 LEU A 74 -4.163 2.953 -1.330 1.00 10.00 C ATOM 1041 CD2 LEU A 74 -1.887 3.357 -0.425 1.00 10.00 C ATOM 0 H LEU A 74 -5.031 1.991 2.274 1.00 10.00 H new ATOM 0 HA LEU A 74 -2.357 3.195 2.403 1.00 10.00 H new ATOM 0 HB2 LEU A 74 -4.992 3.718 0.981 1.00 10.00 H new ATOM 0 HB3 LEU A 74 -3.623 4.805 0.864 1.00 10.00 H new ATOM 0 HG LEU A 74 -3.259 1.861 0.301 1.00 10.00 H new ATOM 0 HD11 LEU A 74 -3.725 2.325 -2.106 1.00 10.00 H new ATOM 0 HD12 LEU A 74 -5.168 2.599 -1.101 1.00 10.00 H new ATOM 0 HD13 LEU A 74 -4.213 3.983 -1.682 1.00 10.00 H new ATOM 0 HD21 LEU A 74 -1.476 2.720 -1.208 1.00 10.00 H new ATOM 0 HD22 LEU A 74 -1.926 4.388 -0.778 1.00 10.00 H new ATOM 0 HD23 LEU A 74 -1.252 3.300 0.459 1.00 10.00 H new ATOM 1053 N MET A 75 -2.803 5.199 3.898 1.00 10.00 N ATOM 1054 CA MET A 75 -2.941 6.131 5.011 1.00 10.00 C ATOM 1055 C MET A 75 -2.085 7.371 4.765 1.00 10.00 C ATOM 1056 O MET A 75 -1.165 7.312 3.958 1.00 10.00 O ATOM 1057 CB MET A 75 -2.557 5.413 6.308 1.00 10.00 C ATOM 1058 CG MET A 75 -3.171 6.117 7.520 1.00 10.00 C ATOM 1059 SD MET A 75 -3.437 5.148 9.025 1.00 10.00 S ATOM 1060 CE MET A 75 -4.366 3.721 8.412 1.00 10.00 C ATOM 0 H MET A 75 -1.887 5.234 3.451 1.00 10.00 H new ATOM 0 HA MET A 75 -3.974 6.468 5.099 1.00 10.00 H new ATOM 0 HB2 MET A 75 -2.898 4.378 6.271 1.00 10.00 H new ATOM 0 HB3 MET A 75 -1.472 5.387 6.408 1.00 10.00 H new ATOM 0 HG2 MET A 75 -2.530 6.961 7.776 1.00 10.00 H new ATOM 0 HG3 MET A 75 -4.133 6.529 7.214 1.00 10.00 H new ATOM 0 HE1 MET A 75 -4.803 3.183 9.253 1.00 10.00 H new ATOM 0 HE2 MET A 75 -5.160 4.062 7.748 1.00 10.00 H new ATOM 0 HE3 MET A 75 -3.695 3.058 7.866 1.00 10.00 H new ATOM 1070 N THR A 76 -2.403 8.504 5.408 1.00 10.00 N ATOM 1071 CA THR A 76 -1.969 9.793 4.878 1.00 10.00 C ATOM 1072 C THR A 76 -1.864 10.876 5.970 1.00 10.00 C ATOM 1073 O THR A 76 -2.865 11.416 6.440 1.00 10.00 O ATOM 1074 CB THR A 76 -2.855 10.116 3.661 1.00 10.00 C ATOM 1075 OG1 THR A 76 -2.330 11.158 2.877 1.00 10.00 O ATOM 1076 CG2 THR A 76 -4.306 10.387 4.048 1.00 10.00 C ATOM 0 H THR A 76 -2.944 8.550 6.271 1.00 10.00 H new ATOM 0 HA THR A 76 -0.941 9.756 4.519 1.00 10.00 H new ATOM 0 HB THR A 76 -2.853 9.217 3.044 1.00 10.00 H new ATOM 0 HG1 THR A 76 -1.539 10.838 2.395 1.00 10.00 H new ATOM 0 HG21 THR A 76 -4.886 10.609 3.152 1.00 10.00 H new ATOM 0 HG22 THR A 76 -4.721 9.508 4.541 1.00 10.00 H new ATOM 0 HG23 THR A 76 -4.348 11.238 4.728 1.00 10.00 H new ATOM 1084 N THR A 77 -0.640 11.186 6.422 1.00 10.00 N ATOM 1085 CA THR A 77 -0.419 12.359 7.265 1.00 10.00 C ATOM 1086 C THR A 77 0.985 12.964 7.102 1.00 10.00 C ATOM 1087 O THR A 77 1.661 13.248 8.090 1.00 10.00 O ATOM 1088 CB THR A 77 -0.766 12.041 8.730 1.00 10.00 C ATOM 1089 OG1 THR A 77 -0.614 13.190 9.536 1.00 10.00 O ATOM 1090 CG2 THR A 77 0.076 10.909 9.313 1.00 10.00 C ATOM 0 H THR A 77 0.200 10.645 6.218 1.00 10.00 H new ATOM 0 HA THR A 77 -1.099 13.140 6.924 1.00 10.00 H new ATOM 0 HB THR A 77 -1.806 11.713 8.729 1.00 10.00 H new ATOM 0 HG1 THR A 77 0.288 13.555 9.418 1.00 10.00 H new ATOM 0 HG21 THR A 77 -0.217 10.733 10.348 1.00 10.00 H new ATOM 0 HG22 THR A 77 -0.083 10.001 8.732 1.00 10.00 H new ATOM 0 HG23 THR A 77 1.130 11.183 9.276 1.00 10.00 H new ATOM 1098 N THR A 78 1.357 13.272 5.863 1.00 10.00 N ATOM 1099 CA THR A 78 2.486 14.136 5.518 1.00 10.00 C ATOM 1100 C THR A 78 1.962 15.379 4.802 1.00 10.00 C ATOM 1101 O THR A 78 1.703 15.349 3.599 1.00 10.00 O ATOM 1102 CB THR A 78 3.533 13.370 4.693 1.00 10.00 C ATOM 1103 OG1 THR A 78 4.206 12.509 5.579 1.00 10.00 O ATOM 1104 CG2 THR A 78 4.611 14.271 4.077 1.00 10.00 C ATOM 0 H THR A 78 0.866 12.916 5.043 1.00 10.00 H new ATOM 0 HA THR A 78 2.997 14.460 6.425 1.00 10.00 H new ATOM 0 HB THR A 78 3.003 12.868 3.883 1.00 10.00 H new ATOM 0 HG1 THR A 78 4.365 11.647 5.140 1.00 10.00 H new ATOM 0 HG21 THR A 78 5.314 13.661 3.510 1.00 10.00 H new ATOM 0 HG22 THR A 78 4.142 14.997 3.413 1.00 10.00 H new ATOM 0 HG23 THR A 78 5.143 14.796 4.870 1.00 10.00 H new ATOM 1112 N HIS A 79 1.861 16.483 5.545 1.00 10.00 N ATOM 1113 CA HIS A 79 1.301 17.761 5.117 1.00 10.00 C ATOM 1114 C HIS A 79 1.833 18.186 3.750 1.00 10.00 C ATOM 1115 O HIS A 79 1.072 18.607 2.883 1.00 10.00 O ATOM 1116 CB HIS A 79 1.593 18.824 6.188 1.00 10.00 C ATOM 1117 CG HIS A 79 1.283 18.353 7.588 1.00 10.00 C ATOM 1118 ND1 HIS A 79 1.983 17.336 8.242 1.00 10.00 N ATOM 1119 CD2 HIS A 79 0.222 18.738 8.355 1.00 10.00 C ATOM 1120 CE1 HIS A 79 1.335 17.143 9.400 1.00 10.00 C ATOM 1121 NE2 HIS A 79 0.280 17.971 9.497 1.00 10.00 N ATOM 0 H HIS A 79 2.185 16.508 6.512 1.00 10.00 H new ATOM 0 HA HIS A 79 0.222 17.651 5.006 1.00 10.00 H new ATOM 0 HB2 HIS A 79 2.643 19.110 6.131 1.00 10.00 H new ATOM 0 HB3 HIS A 79 1.007 19.718 5.974 1.00 10.00 H new ATOM 0 HD2 HIS A 79 -0.514 19.491 8.115 1.00 10.00 H new ATOM 0 HE1 HIS A 79 1.621 16.422 10.151 1.00 10.00 H new ATOM 0 HE2 HIS A 79 -0.368 18.022 10.283 1.00 10.00 H new ATOM 1129 N SER A 80 3.148 18.054 3.548 1.00 10.00 N ATOM 1130 CA SER A 80 3.810 18.460 2.314 1.00 10.00 C ATOM 1131 C SER A 80 3.716 17.393 1.210 1.00 10.00 C ATOM 1132 O SER A 80 4.560 17.388 0.315 1.00 10.00 O ATOM 1133 CB SER A 80 5.270 18.822 2.628 1.00 10.00 C ATOM 1134 OG SER A 80 5.893 19.407 1.502 1.00 10.00 O ATOM 0 H SER A 80 3.782 17.660 4.243 1.00 10.00 H new ATOM 0 HA SER A 80 3.293 19.335 1.919 1.00 10.00 H new ATOM 0 HB2 SER A 80 5.305 19.514 3.470 1.00 10.00 H new ATOM 0 HB3 SER A 80 5.815 17.927 2.928 1.00 10.00 H new ATOM 0 HG SER A 80 5.660 18.898 0.698 1.00 10.00 H new ATOM 1140 N GLY A 81 2.730 16.490 1.248 1.00 10.00 N ATOM 1141 CA GLY A 81 2.560 15.485 0.211 1.00 10.00 C ATOM 1142 C GLY A 81 1.156 14.888 0.249 1.00 10.00 C ATOM 1143 O GLY A 81 0.372 15.079 -0.678 1.00 10.00 O ATOM 0 H GLY A 81 2.037 16.441 1.995 1.00 10.00 H new ATOM 0 HA2 GLY A 81 2.742 15.932 -0.766 1.00 10.00 H new ATOM 0 HA3 GLY A 81 3.298 14.694 0.342 1.00 10.00 H new ATOM 1147 N GLY A 82 0.863 14.154 1.322 1.00 10.00 N ATOM 1148 CA GLY A 82 -0.398 13.467 1.554 1.00 10.00 C ATOM 1149 C GLY A 82 -0.991 13.815 2.923 1.00 10.00 C ATOM 1150 O GLY A 82 -0.643 13.197 3.930 1.00 10.00 O ATOM 0 H GLY A 82 1.529 14.019 2.083 1.00 10.00 H new ATOM 0 HA2 GLY A 82 -1.108 13.735 0.771 1.00 10.00 H new ATOM 0 HA3 GLY A 82 -0.243 12.390 1.488 1.00 10.00 H new ATOM 1154 N MET A 83 -1.918 14.781 2.930 1.00 10.00 N ATOM 1155 CA MET A 83 -2.853 15.075 4.016 1.00 10.00 C ATOM 1156 C MET A 83 -2.181 15.253 5.391 1.00 10.00 C ATOM 1157 O MET A 83 -1.005 15.588 5.477 1.00 10.00 O ATOM 1158 CB MET A 83 -3.999 14.043 4.001 1.00 10.00 C ATOM 1159 CG MET A 83 -5.391 14.671 3.839 1.00 10.00 C ATOM 1160 SD MET A 83 -5.930 15.812 5.139 1.00 10.00 S ATOM 1161 CE MET A 83 -7.617 16.147 4.591 1.00 10.00 C ATOM 0 H MET A 83 -2.040 15.409 2.136 1.00 10.00 H new ATOM 0 HA MET A 83 -3.286 16.058 3.833 1.00 10.00 H new ATOM 0 HB2 MET A 83 -3.831 13.338 3.187 1.00 10.00 H new ATOM 0 HB3 MET A 83 -3.974 13.471 4.928 1.00 10.00 H new ATOM 0 HG2 MET A 83 -5.415 15.204 2.888 1.00 10.00 H new ATOM 0 HG3 MET A 83 -6.121 13.865 3.771 1.00 10.00 H new ATOM 0 HE1 MET A 83 -8.095 16.838 5.286 1.00 10.00 H new ATOM 0 HE2 MET A 83 -7.595 16.591 3.596 1.00 10.00 H new ATOM 0 HE3 MET A 83 -8.181 15.215 4.560 1.00 10.00 H new ATOM 1171 N ALA A 84 -2.943 15.104 6.480 1.00 10.00 N ATOM 1172 CA ALA A 84 -2.535 15.508 7.817 1.00 10.00 C ATOM 1173 C ALA A 84 -3.418 14.811 8.854 1.00 10.00 C ATOM 1174 O ALA A 84 -3.830 15.429 9.834 1.00 10.00 O ATOM 1175 CB ALA A 84 -2.664 17.033 7.925 1.00 10.00 C ATOM 0 H ALA A 84 -3.875 14.692 6.449 1.00 10.00 H new ATOM 0 HA ALA A 84 -1.500 15.221 8.005 1.00 10.00 H new ATOM 0 HB1 ALA A 84 -2.362 17.354 8.922 1.00 10.00 H new ATOM 0 HB2 ALA A 84 -2.022 17.506 7.182 1.00 10.00 H new ATOM 0 HB3 ALA A 84 -3.699 17.324 7.748 1.00 10.00 H new ATOM 1181 N GLY A 85 -3.759 13.539 8.625 1.00 10.00 N ATOM 1182 CA GLY A 85 -4.625 12.807 9.534 1.00 10.00 C ATOM 1183 C GLY A 85 -4.464 11.310 9.312 1.00 10.00 C ATOM 1184 O GLY A 85 -4.950 10.792 8.310 1.00 10.00 O ATOM 0 H GLY A 85 -3.445 13.002 7.817 1.00 10.00 H new ATOM 0 HA2 GLY A 85 -4.379 13.059 10.566 1.00 10.00 H new ATOM 0 HA3 GLY A 85 -5.663 13.097 9.374 1.00 10.00 H new ATOM 1188 N MET A 86 -3.782 10.615 10.231 1.00 10.00 N ATOM 1189 CA MET A 86 -3.362 9.223 10.068 1.00 10.00 C ATOM 1190 C MET A 86 -4.547 8.262 10.295 1.00 10.00 C ATOM 1191 O MET A 86 -4.502 7.380 11.149 1.00 10.00 O ATOM 1192 CB MET A 86 -2.228 8.939 11.068 1.00 10.00 C ATOM 1193 CG MET A 86 -1.274 7.809 10.650 1.00 10.00 C ATOM 1194 SD MET A 86 -1.491 6.189 11.458 1.00 10.00 S ATOM 1195 CE MET A 86 0.120 5.999 12.249 1.00 10.00 C ATOM 0 H MET A 86 -3.502 11.016 11.126 1.00 10.00 H new ATOM 0 HA MET A 86 -3.006 9.062 9.051 1.00 10.00 H new ATOM 0 HB2 MET A 86 -1.649 9.852 11.209 1.00 10.00 H new ATOM 0 HB3 MET A 86 -2.667 8.687 12.033 1.00 10.00 H new ATOM 0 HG2 MET A 86 -1.373 7.665 9.574 1.00 10.00 H new ATOM 0 HG3 MET A 86 -0.253 8.144 10.835 1.00 10.00 H new ATOM 0 HE1 MET A 86 0.151 5.052 12.788 1.00 10.00 H new ATOM 0 HE2 MET A 86 0.902 6.010 11.490 1.00 10.00 H new ATOM 0 HE3 MET A 86 0.281 6.820 12.948 1.00 10.00 H new ATOM 1205 N LYS A 87 -5.624 8.467 9.547 1.00 10.00 N ATOM 1206 CA LYS A 87 -6.912 7.798 9.669 1.00 10.00 C ATOM 1207 C LYS A 87 -7.128 6.890 8.460 1.00 10.00 C ATOM 1208 O LYS A 87 -6.447 7.045 7.447 1.00 10.00 O ATOM 1209 CB LYS A 87 -8.012 8.866 9.782 1.00 10.00 C ATOM 1210 CG LYS A 87 -8.202 9.648 8.471 1.00 10.00 C ATOM 1211 CD LYS A 87 -8.779 11.050 8.687 1.00 10.00 C ATOM 1212 CE LYS A 87 -10.188 11.001 9.298 1.00 10.00 C ATOM 1213 NZ LYS A 87 -10.776 12.349 9.447 1.00 10.00 N ATOM 0 H LYS A 87 -5.620 9.150 8.789 1.00 10.00 H new ATOM 0 HA LYS A 87 -6.942 7.174 10.563 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -8.952 8.388 10.057 1.00 10.00 H new ATOM 0 HB3 LYS A 87 -7.760 9.560 10.584 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -7.242 9.731 7.962 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -8.864 9.086 7.812 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -8.118 11.618 9.342 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -8.814 11.579 7.735 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -10.835 10.391 8.668 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -10.143 10.516 10.273 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -11.726 12.269 9.863 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -10.173 12.924 10.069 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -10.843 12.803 8.514 1.00 10.00 H new ATOM 1227 N MET A 88 -8.099 5.976 8.525 1.00 10.00 N ATOM 1228 CA MET A 88 -8.300 4.988 7.473 1.00 10.00 C ATOM 1229 C MET A 88 -9.102 5.597 6.316 1.00 10.00 C ATOM 1230 O MET A 88 -10.263 5.272 6.079 1.00 10.00 O ATOM 1231 CB MET A 88 -8.918 3.718 8.072 1.00 10.00 C ATOM 1232 CG MET A 88 -8.696 2.531 7.127 1.00 10.00 C ATOM 1233 SD MET A 88 -9.387 0.942 7.663 1.00 10.00 S ATOM 1234 CE MET A 88 -8.546 0.700 9.245 1.00 10.00 C ATOM 0 H MET A 88 -8.758 5.903 9.300 1.00 10.00 H new ATOM 0 HA MET A 88 -7.346 4.689 7.039 1.00 10.00 H new ATOM 0 HB2 MET A 88 -8.470 3.509 9.043 1.00 10.00 H new ATOM 0 HB3 MET A 88 -9.985 3.866 8.238 1.00 10.00 H new ATOM 0 HG2 MET A 88 -9.124 2.781 6.156 1.00 10.00 H new ATOM 0 HG3 MET A 88 -7.623 2.406 6.980 1.00 10.00 H new ATOM 0 HE1 MET A 88 -8.718 -0.317 9.597 1.00 10.00 H new ATOM 0 HE2 MET A 88 -7.476 0.863 9.117 1.00 10.00 H new ATOM 0 HE3 MET A 88 -8.936 1.408 9.976 1.00 10.00 H new ATOM 1244 N VAL A 89 -8.441 6.511 5.611 1.00 10.00 N ATOM 1245 CA VAL A 89 -8.889 7.144 4.380 1.00 10.00 C ATOM 1246 C VAL A 89 -9.127 6.114 3.264 1.00 10.00 C ATOM 1247 O VAL A 89 -8.618 4.997 3.340 1.00 10.00 O ATOM 1248 CB VAL A 89 -7.811 8.150 3.931 1.00 10.00 C ATOM 1249 CG1 VAL A 89 -7.740 9.348 4.882 1.00 10.00 C ATOM 1250 CG2 VAL A 89 -6.429 7.485 3.833 1.00 10.00 C ATOM 0 H VAL A 89 -7.524 6.848 5.904 1.00 10.00 H new ATOM 0 HA VAL A 89 -9.837 7.647 4.570 1.00 10.00 H new ATOM 0 HB VAL A 89 -8.098 8.504 2.941 1.00 10.00 H new ATOM 0 HG11 VAL A 89 -6.971 10.040 4.539 1.00 10.00 H new ATOM 0 HG12 VAL A 89 -8.704 9.857 4.899 1.00 10.00 H new ATOM 0 HG13 VAL A 89 -7.495 9.002 5.886 1.00 10.00 H new ATOM 0 HG21 VAL A 89 -5.692 8.222 3.514 1.00 10.00 H new ATOM 0 HG22 VAL A 89 -6.146 7.088 4.808 1.00 10.00 H new ATOM 0 HG23 VAL A 89 -6.467 6.672 3.107 1.00 10.00 H new ATOM 1260 N PRO A 90 -9.826 6.504 2.183 1.00 10.00 N ATOM 1261 CA PRO A 90 -9.855 5.754 0.936 1.00 10.00 C ATOM 1262 C PRO A 90 -8.461 5.381 0.411 1.00 10.00 C ATOM 1263 O PRO A 90 -8.302 4.298 -0.147 1.00 10.00 O ATOM 1264 CB PRO A 90 -10.660 6.594 -0.058 1.00 10.00 C ATOM 1265 CG PRO A 90 -11.537 7.464 0.841 1.00 10.00 C ATOM 1266 CD PRO A 90 -10.668 7.687 2.079 1.00 10.00 C ATOM 0 HA PRO A 90 -10.329 4.785 1.095 1.00 10.00 H new ATOM 0 HB2 PRO A 90 -10.011 7.198 -0.692 1.00 10.00 H new ATOM 0 HB3 PRO A 90 -11.259 5.969 -0.720 1.00 10.00 H new ATOM 0 HG2 PRO A 90 -11.797 8.406 0.358 1.00 10.00 H new ATOM 0 HG3 PRO A 90 -12.473 6.966 1.092 1.00 10.00 H new ATOM 0 HD2 PRO A 90 -10.065 8.590 1.978 1.00 10.00 H new ATOM 0 HD3 PRO A 90 -11.281 7.812 2.971 1.00 10.00 H new ATOM 1274 N TRP A 91 -7.473 6.280 0.539 1.00 10.00 N ATOM 1275 CA TRP A 91 -6.228 6.269 -0.222 1.00 10.00 C ATOM 1276 C TRP A 91 -5.335 7.470 0.098 1.00 10.00 C ATOM 1277 O TRP A 91 -5.606 8.216 1.033 1.00 10.00 O ATOM 1278 CB TRP A 91 -6.534 6.263 -1.717 1.00 10.00 C ATOM 1279 CG TRP A 91 -7.097 7.492 -2.352 1.00 10.00 C ATOM 1280 CD1 TRP A 91 -7.024 7.684 -3.679 1.00 10.00 C ATOM 1281 CD2 TRP A 91 -7.967 8.555 -1.846 1.00 10.00 C ATOM 1282 NE1 TRP A 91 -7.932 8.642 -4.051 1.00 10.00 N ATOM 1283 CE2 TRP A 91 -8.629 9.123 -2.965 1.00 10.00 C ATOM 1284 CE3 TRP A 91 -8.306 9.100 -0.586 1.00 10.00 C ATOM 1285 CZ2 TRP A 91 -9.702 10.006 -2.826 1.00 10.00 C ATOM 1286 CZ3 TRP A 91 -9.304 10.080 -0.445 1.00 10.00 C ATOM 1287 CH2 TRP A 91 -10.050 10.489 -1.558 1.00 10.00 C ATOM 0 H TRP A 91 -7.527 7.057 1.198 1.00 10.00 H new ATOM 0 HA TRP A 91 -5.689 5.366 0.063 1.00 10.00 H new ATOM 0 HB2 TRP A 91 -5.609 6.018 -2.240 1.00 10.00 H new ATOM 0 HB3 TRP A 91 -7.232 5.447 -1.905 1.00 10.00 H new ATOM 0 HD1 TRP A 91 -6.355 7.165 -4.349 1.00 10.00 H new ATOM 0 HE1 TRP A 91 -8.073 8.958 -5.010 1.00 10.00 H new ATOM 0 HE3 TRP A 91 -7.783 8.753 0.293 1.00 10.00 H new ATOM 0 HZ2 TRP A 91 -10.263 10.316 -3.695 1.00 10.00 H new ATOM 0 HZ3 TRP A 91 -9.496 10.518 0.523 1.00 10.00 H new ATOM 0 HH2 TRP A 91 -10.882 11.167 -1.440 1.00 10.00 H new ATOM 1298 N LEU A 92 -4.327 7.703 -0.747 1.00 10.00 N ATOM 1299 CA LEU A 92 -3.638 8.973 -0.894 1.00 10.00 C ATOM 1300 C LEU A 92 -3.806 9.439 -2.348 1.00 10.00 C ATOM 1301 O LEU A 92 -3.338 8.780 -3.275 1.00 10.00 O ATOM 1302 CB LEU A 92 -2.165 8.857 -0.457 1.00 10.00 C ATOM 1303 CG LEU A 92 -1.425 7.570 -0.887 1.00 10.00 C ATOM 1304 CD1 LEU A 92 -0.205 7.892 -1.752 1.00 10.00 C ATOM 1305 CD2 LEU A 92 -0.959 6.798 0.355 1.00 10.00 C ATOM 0 H LEU A 92 -3.960 6.981 -1.367 1.00 10.00 H new ATOM 0 HA LEU A 92 -4.072 9.728 -0.238 1.00 10.00 H new ATOM 0 HB2 LEU A 92 -1.621 9.714 -0.855 1.00 10.00 H new ATOM 0 HB3 LEU A 92 -2.123 8.929 0.630 1.00 10.00 H new ATOM 0 HG LEU A 92 -2.120 6.966 -1.470 1.00 10.00 H new ATOM 0 HD11 LEU A 92 0.293 6.966 -2.038 1.00 10.00 H new ATOM 0 HD12 LEU A 92 -0.525 8.423 -2.648 1.00 10.00 H new ATOM 0 HD13 LEU A 92 0.487 8.517 -1.187 1.00 10.00 H new ATOM 0 HD21 LEU A 92 -0.438 5.892 0.046 1.00 10.00 H new ATOM 0 HD22 LEU A 92 -0.284 7.423 0.940 1.00 10.00 H new ATOM 0 HD23 LEU A 92 -1.823 6.530 0.963 1.00 10.00 H new ATOM 1317 N THR A 93 -4.488 10.573 -2.550 1.00 10.00 N ATOM 1318 CA THR A 93 -4.440 11.320 -3.804 1.00 10.00 C ATOM 1319 C THR A 93 -3.195 12.190 -3.738 1.00 10.00 C ATOM 1320 O THR A 93 -2.926 12.775 -2.691 1.00 10.00 O ATOM 1321 CB THR A 93 -5.696 12.191 -3.952 1.00 10.00 C ATOM 1322 OG1 THR A 93 -6.809 11.349 -4.145 1.00 10.00 O ATOM 1323 CG2 THR A 93 -5.614 13.162 -5.136 1.00 10.00 C ATOM 0 H THR A 93 -5.089 10.996 -1.843 1.00 10.00 H new ATOM 0 HA THR A 93 -4.406 10.650 -4.663 1.00 10.00 H new ATOM 0 HB THR A 93 -5.787 12.786 -3.043 1.00 10.00 H new ATOM 0 HG1 THR A 93 -6.879 10.722 -3.395 1.00 10.00 H new ATOM 0 HG21 THR A 93 -6.530 13.750 -5.189 1.00 10.00 H new ATOM 0 HG22 THR A 93 -4.762 13.829 -5.001 1.00 10.00 H new ATOM 0 HG23 THR A 93 -5.491 12.598 -6.061 1.00 10.00 H new ATOM 1331 N ILE A 94 -2.437 12.262 -4.834 1.00 10.00 N ATOM 1332 CA ILE A 94 -1.168 12.961 -4.878 1.00 10.00 C ATOM 1333 C ILE A 94 -1.177 13.844 -6.128 1.00 10.00 C ATOM 1334 O ILE A 94 -1.756 13.449 -7.142 1.00 10.00 O ATOM 1335 CB ILE A 94 -0.021 11.938 -4.817 1.00 10.00 C ATOM 1336 CG1 ILE A 94 -0.017 10.948 -5.992 1.00 10.00 C ATOM 1337 CG2 ILE A 94 -0.132 11.132 -3.516 1.00 10.00 C ATOM 1338 CD1 ILE A 94 0.971 11.367 -7.075 1.00 10.00 C ATOM 0 H ILE A 94 -2.697 11.830 -5.721 1.00 10.00 H new ATOM 0 HA ILE A 94 -1.012 13.616 -4.021 1.00 10.00 H new ATOM 0 HB ILE A 94 0.905 12.511 -4.866 1.00 10.00 H new ATOM 0 HG12 ILE A 94 0.240 9.953 -5.629 1.00 10.00 H new ATOM 0 HG13 ILE A 94 -1.018 10.883 -6.417 1.00 10.00 H new ATOM 0 HG21 ILE A 94 0.679 10.405 -3.468 1.00 10.00 H new ATOM 0 HG22 ILE A 94 -0.065 11.807 -2.663 1.00 10.00 H new ATOM 0 HG23 ILE A 94 -1.089 10.610 -3.492 1.00 10.00 H new ATOM 0 HD11 ILE A 94 0.946 10.643 -7.890 1.00 10.00 H new ATOM 0 HD12 ILE A 94 0.698 12.351 -7.455 1.00 10.00 H new ATOM 0 HD13 ILE A 94 1.976 11.406 -6.655 1.00 10.00 H new ATOM 1350 N PRO A 95 -0.642 15.070 -6.048 1.00 10.00 N ATOM 1351 CA PRO A 95 -0.786 16.051 -7.108 1.00 10.00 C ATOM 1352 C PRO A 95 0.191 15.782 -8.257 1.00 10.00 C ATOM 1353 O PRO A 95 1.000 14.854 -8.218 1.00 10.00 O ATOM 1354 CB PRO A 95 -0.506 17.397 -6.425 1.00 10.00 C ATOM 1355 CG PRO A 95 0.505 17.025 -5.341 1.00 10.00 C ATOM 1356 CD PRO A 95 -0.009 15.664 -4.879 1.00 10.00 C ATOM 0 HA PRO A 95 -1.775 16.024 -7.565 1.00 10.00 H new ATOM 0 HB2 PRO A 95 -0.099 18.128 -7.124 1.00 10.00 H new ATOM 0 HB3 PRO A 95 -1.411 17.831 -6.001 1.00 10.00 H new ATOM 0 HG2 PRO A 95 1.520 16.966 -5.733 1.00 10.00 H new ATOM 0 HG3 PRO A 95 0.519 17.753 -4.529 1.00 10.00 H new ATOM 0 HD2 PRO A 95 0.807 15.040 -4.515 1.00 10.00 H new ATOM 0 HD3 PRO A 95 -0.720 15.770 -4.059 1.00 10.00 H new ATOM 1364 N ALA A 96 0.158 16.658 -9.265 1.00 10.00 N ATOM 1365 CA ALA A 96 1.339 16.930 -10.068 1.00 10.00 C ATOM 1366 C ALA A 96 2.505 17.230 -9.121 1.00 10.00 C ATOM 1367 O ALA A 96 2.290 17.872 -8.094 1.00 10.00 O ATOM 1368 CB ALA A 96 1.062 18.139 -10.963 1.00 10.00 C ATOM 0 H ALA A 96 -0.671 17.185 -9.538 1.00 10.00 H new ATOM 0 HA ALA A 96 1.588 16.074 -10.695 1.00 10.00 H new ATOM 0 HB1 ALA A 96 1.942 18.352 -11.570 1.00 10.00 H new ATOM 0 HB2 ALA A 96 0.215 17.923 -11.615 1.00 10.00 H new ATOM 0 HB3 ALA A 96 0.831 19.005 -10.343 1.00 10.00 H new ATOM 1374 N ARG A 97 3.719 16.742 -9.398 1.00 10.00 N ATOM 1375 CA ARG A 97 4.817 16.806 -8.443 1.00 10.00 C ATOM 1376 C ARG A 97 4.522 16.105 -7.113 1.00 10.00 C ATOM 1377 O ARG A 97 5.256 16.281 -6.142 1.00 10.00 O ATOM 1378 CB ARG A 97 5.306 18.258 -8.281 1.00 10.00 C ATOM 1379 CG ARG A 97 6.455 18.494 -9.257 1.00 10.00 C ATOM 1380 CD ARG A 97 7.755 17.948 -8.663 1.00 10.00 C ATOM 1381 NE ARG A 97 8.789 17.865 -9.704 1.00 10.00 N ATOM 1382 CZ ARG A 97 10.102 17.732 -9.466 1.00 10.00 C ATOM 1383 NH1 ARG A 97 10.542 17.615 -8.206 1.00 10.00 N ATOM 1384 NH2 ARG A 97 10.969 17.718 -10.484 1.00 10.00 N ATOM 0 H ARG A 97 3.961 16.297 -10.283 1.00 10.00 H new ATOM 0 HA ARG A 97 5.642 16.228 -8.859 1.00 10.00 H new ATOM 0 HB2 ARG A 97 4.492 18.956 -8.478 1.00 10.00 H new ATOM 0 HB3 ARG A 97 5.636 18.434 -7.257 1.00 10.00 H new ATOM 0 HG2 ARG A 97 6.244 18.004 -10.208 1.00 10.00 H new ATOM 0 HG3 ARG A 97 6.557 19.559 -9.463 1.00 10.00 H new ATOM 0 HD2 ARG A 97 8.094 18.594 -7.853 1.00 10.00 H new ATOM 0 HD3 ARG A 97 7.581 16.962 -8.232 1.00 10.00 H new ATOM 0 HE ARG A 97 8.486 17.912 -10.677 1.00 10.00 H new ATOM 0 HH11 ARG A 97 9.879 17.627 -7.431 1.00 10.00 H new ATOM 0 HH12 ARG A 97 11.540 17.514 -8.022 1.00 10.00 H new ATOM 0 HH21 ARG A 97 10.632 17.809 -11.442 1.00 10.00 H new ATOM 0 HH22 ARG A 97 11.968 17.617 -10.302 1.00 10.00 H new ATOM 1398 N GLY A 98 3.508 15.239 -7.078 1.00 10.00 N ATOM 1399 CA GLY A 98 3.299 14.309 -5.995 1.00 10.00 C ATOM 1400 C GLY A 98 4.457 13.320 -5.958 1.00 10.00 C ATOM 1401 O GLY A 98 4.480 12.342 -6.707 1.00 10.00 O ATOM 0 H GLY A 98 2.807 15.172 -7.816 1.00 10.00 H new ATOM 0 HA2 GLY A 98 3.231 14.844 -5.048 1.00 10.00 H new ATOM 0 HA3 GLY A 98 2.356 13.779 -6.131 1.00 10.00 H new ATOM 1405 N THR A 99 5.417 13.603 -5.087 1.00 10.00 N ATOM 1406 CA THR A 99 6.588 12.798 -4.839 1.00 10.00 C ATOM 1407 C THR A 99 6.766 12.823 -3.332 1.00 10.00 C ATOM 1408 O THR A 99 7.516 13.641 -2.804 1.00 10.00 O ATOM 1409 CB THR A 99 7.780 13.353 -5.641 1.00 10.00 C ATOM 1410 OG1 THR A 99 7.522 13.171 -7.023 1.00 10.00 O ATOM 1411 CG2 THR A 99 9.121 12.686 -5.308 1.00 10.00 C ATOM 0 H THR A 99 5.391 14.444 -4.510 1.00 10.00 H new ATOM 0 HA THR A 99 6.500 11.764 -5.171 1.00 10.00 H new ATOM 0 HB THR A 99 7.873 14.405 -5.371 1.00 10.00 H new ATOM 0 HG1 THR A 99 8.273 13.522 -7.545 1.00 10.00 H new ATOM 0 HG21 THR A 99 9.910 13.132 -5.914 1.00 10.00 H new ATOM 0 HG22 THR A 99 9.348 12.833 -4.252 1.00 10.00 H new ATOM 0 HG23 THR A 99 9.059 11.619 -5.521 1.00 10.00 H new ATOM 1419 N LEU A 100 5.971 11.999 -2.644 1.00 10.00 N ATOM 1420 CA LEU A 100 5.858 12.050 -1.198 1.00 10.00 C ATOM 1421 C LEU A 100 6.642 10.909 -0.561 1.00 10.00 C ATOM 1422 O LEU A 100 7.330 10.149 -1.240 1.00 10.00 O ATOM 1423 CB LEU A 100 4.388 12.187 -0.761 1.00 10.00 C ATOM 1424 CG LEU A 100 3.416 11.053 -1.125 1.00 10.00 C ATOM 1425 CD1 LEU A 100 3.718 9.743 -0.390 1.00 10.00 C ATOM 1426 CD2 LEU A 100 2.007 11.504 -0.721 1.00 10.00 C ATOM 0 H LEU A 100 5.392 11.282 -3.080 1.00 10.00 H new ATOM 0 HA LEU A 100 6.330 12.955 -0.815 1.00 10.00 H new ATOM 0 HB2 LEU A 100 4.372 12.305 0.322 1.00 10.00 H new ATOM 0 HB3 LEU A 100 3.998 13.111 -1.188 1.00 10.00 H new ATOM 0 HG LEU A 100 3.513 10.860 -2.193 1.00 10.00 H new ATOM 0 HD11 LEU A 100 2.997 8.983 -0.690 1.00 10.00 H new ATOM 0 HD12 LEU A 100 4.724 9.408 -0.642 1.00 10.00 H new ATOM 0 HD13 LEU A 100 3.648 9.905 0.686 1.00 10.00 H new ATOM 0 HD21 LEU A 100 1.290 10.720 -0.966 1.00 10.00 H new ATOM 0 HD22 LEU A 100 1.980 11.698 0.351 1.00 10.00 H new ATOM 0 HD23 LEU A 100 1.748 12.415 -1.261 1.00 10.00 H new ATOM 1438 N THR A 101 6.556 10.824 0.760 1.00 10.00 N ATOM 1439 CA THR A 101 7.420 10.038 1.617 1.00 10.00 C ATOM 1440 C THR A 101 6.515 9.116 2.429 1.00 10.00 C ATOM 1441 O THR A 101 5.930 9.543 3.417 1.00 10.00 O ATOM 1442 CB THR A 101 8.260 10.988 2.503 1.00 10.00 C ATOM 1443 OG1 THR A 101 8.027 12.350 2.181 1.00 10.00 O ATOM 1444 CG2 THR A 101 9.758 10.716 2.348 1.00 10.00 C ATOM 0 H THR A 101 5.843 11.330 1.286 1.00 10.00 H new ATOM 0 HA THR A 101 8.129 9.432 1.054 1.00 10.00 H new ATOM 0 HB THR A 101 7.950 10.796 3.530 1.00 10.00 H new ATOM 0 HG1 THR A 101 8.572 12.921 2.761 1.00 10.00 H new ATOM 0 HG21 THR A 101 10.320 11.400 2.984 1.00 10.00 H new ATOM 0 HG22 THR A 101 9.974 9.689 2.641 1.00 10.00 H new ATOM 0 HG23 THR A 101 10.049 10.865 1.308 1.00 10.00 H new ATOM 1452 N LEU A 102 6.402 7.860 2.004 1.00 10.00 N ATOM 1453 CA LEU A 102 5.568 6.864 2.643 1.00 10.00 C ATOM 1454 C LEU A 102 6.324 6.332 3.862 1.00 10.00 C ATOM 1455 O LEU A 102 7.146 5.430 3.718 1.00 10.00 O ATOM 1456 CB LEU A 102 5.206 5.722 1.676 1.00 10.00 C ATOM 1457 CG LEU A 102 4.254 6.201 0.567 1.00 10.00 C ATOM 1458 CD1 LEU A 102 5.058 6.515 -0.693 1.00 10.00 C ATOM 1459 CD2 LEU A 102 3.190 5.155 0.222 1.00 10.00 C ATOM 0 H LEU A 102 6.901 7.506 1.188 1.00 10.00 H new ATOM 0 HA LEU A 102 4.626 7.317 2.951 1.00 10.00 H new ATOM 0 HB2 LEU A 102 6.115 5.322 1.228 1.00 10.00 H new ATOM 0 HB3 LEU A 102 4.739 4.908 2.231 1.00 10.00 H new ATOM 0 HG LEU A 102 3.746 7.091 0.938 1.00 10.00 H new ATOM 0 HD11 LEU A 102 4.384 6.855 -1.479 1.00 10.00 H new ATOM 0 HD12 LEU A 102 5.785 7.297 -0.475 1.00 10.00 H new ATOM 0 HD13 LEU A 102 5.580 5.617 -1.025 1.00 10.00 H new ATOM 0 HD21 LEU A 102 2.543 5.541 -0.566 1.00 10.00 H new ATOM 0 HD22 LEU A 102 3.676 4.242 -0.122 1.00 10.00 H new ATOM 0 HD23 LEU A 102 2.593 4.937 1.108 1.00 10.00 H new ATOM 1471 N GLN A 103 6.073 6.919 5.037 1.00 10.00 N ATOM 1472 CA GLN A 103 6.654 6.573 6.327 1.00 10.00 C ATOM 1473 C GLN A 103 5.520 6.149 7.266 1.00 10.00 C ATOM 1474 O GLN A 103 4.451 6.753 7.267 1.00 10.00 O ATOM 1475 CB GLN A 103 7.343 7.796 6.936 1.00 10.00 C ATOM 1476 CG GLN A 103 8.303 8.539 5.995 1.00 10.00 C ATOM 1477 CD GLN A 103 8.191 10.039 6.229 1.00 10.00 C ATOM 1478 OE1 GLN A 103 9.141 10.684 6.659 1.00 10.00 O ATOM 1479 NE2 GLN A 103 7.020 10.606 5.950 1.00 10.00 N ATOM 0 H GLN A 103 5.417 7.696 5.111 1.00 10.00 H new ATOM 0 HA GLN A 103 7.381 5.771 6.195 1.00 10.00 H new ATOM 0 HB2 GLN A 103 6.577 8.494 7.274 1.00 10.00 H new ATOM 0 HB3 GLN A 103 7.898 7.479 7.819 1.00 10.00 H new ATOM 0 HG2 GLN A 103 9.327 8.209 6.170 1.00 10.00 H new ATOM 0 HG3 GLN A 103 8.065 8.304 4.957 1.00 10.00 H new ATOM 0 HE21 GLN A 103 6.251 10.039 5.594 1.00 10.00 H new ATOM 0 HE22 GLN A 103 6.892 11.608 6.093 1.00 10.00 H new ATOM 1488 N ARG A 104 5.746 5.116 8.077 1.00 10.00 N ATOM 1489 CA ARG A 104 4.696 4.426 8.834 1.00 10.00 C ATOM 1490 C ARG A 104 3.863 5.354 9.728 1.00 10.00 C ATOM 1491 O ARG A 104 2.740 5.004 10.091 1.00 10.00 O ATOM 1492 CB ARG A 104 5.310 3.252 9.605 1.00 10.00 C ATOM 1493 CG ARG A 104 4.293 2.252 10.191 1.00 10.00 C ATOM 1494 CD ARG A 104 4.074 2.440 11.696 1.00 10.00 C ATOM 1495 NE ARG A 104 3.255 1.354 12.269 1.00 10.00 N ATOM 1496 CZ ARG A 104 3.010 1.209 13.580 1.00 10.00 C ATOM 1497 NH1 ARG A 104 3.439 2.134 14.445 1.00 10.00 N ATOM 1498 NH2 ARG A 104 2.343 0.145 14.016 1.00 10.00 N ATOM 0 H ARG A 104 6.677 4.727 8.230 1.00 10.00 H new ATOM 0 HA ARG A 104 3.974 4.036 8.117 1.00 10.00 H new ATOM 0 HB2 ARG A 104 5.984 2.713 8.939 1.00 10.00 H new ATOM 0 HB3 ARG A 104 5.916 3.649 10.419 1.00 10.00 H new ATOM 0 HG2 ARG A 104 3.340 2.364 9.673 1.00 10.00 H new ATOM 0 HG3 ARG A 104 4.640 1.236 10.003 1.00 10.00 H new ATOM 0 HD2 ARG A 104 5.039 2.474 12.202 1.00 10.00 H new ATOM 0 HD3 ARG A 104 3.585 3.398 11.876 1.00 10.00 H new ATOM 0 HE ARG A 104 2.850 0.671 11.628 1.00 10.00 H new ATOM 0 HH11 ARG A 104 3.952 2.949 14.108 1.00 10.00 H new ATOM 0 HH12 ARG A 104 3.253 2.025 15.442 1.00 10.00 H new ATOM 0 HH21 ARG A 104 2.018 -0.560 13.354 1.00 10.00 H new ATOM 0 HH22 ARG A 104 2.156 0.033 15.012 1.00 10.00 H new ATOM 1512 N ASP A 105 4.393 6.526 10.078 1.00 10.00 N ATOM 1513 CA ASP A 105 3.658 7.657 10.608 1.00 10.00 C ATOM 1514 C ASP A 105 3.192 8.562 9.453 1.00 10.00 C ATOM 1515 O ASP A 105 2.002 8.620 9.140 1.00 10.00 O ATOM 1516 CB ASP A 105 4.540 8.397 11.634 1.00 10.00 C ATOM 1517 CG ASP A 105 5.935 8.784 11.141 1.00 10.00 C ATOM 1518 OD1 ASP A 105 6.301 8.330 10.030 1.00 10.00 O ATOM 1519 OD2 ASP A 105 6.605 9.528 11.884 1.00 10.00 O ATOM 0 H ASP A 105 5.392 6.714 9.993 1.00 10.00 H new ATOM 0 HA ASP A 105 2.760 7.325 11.129 1.00 10.00 H new ATOM 0 HB2 ASP A 105 4.020 9.302 11.949 1.00 10.00 H new ATOM 0 HB3 ASP A 105 4.647 7.767 12.517 1.00 10.00 H new ATOM 1524 N GLY A 106 4.116 9.278 8.820 1.00 10.00 N ATOM 1525 CA GLY A 106 3.856 10.368 7.905 1.00 10.00 C ATOM 1526 C GLY A 106 3.495 9.860 6.523 1.00 10.00 C ATOM 1527 O GLY A 106 4.353 9.889 5.645 1.00 10.00 O ATOM 0 H GLY A 106 5.113 9.100 8.942 1.00 10.00 H new ATOM 0 HA2 GLY A 106 3.043 10.983 8.292 1.00 10.00 H new ATOM 0 HA3 GLY A 106 4.736 11.008 7.840 1.00 10.00 H new ATOM 1531 N ASP A 107 2.226 9.463 6.341 1.00 10.00 N ATOM 1532 CA ASP A 107 1.646 8.976 5.083 1.00 10.00 C ATOM 1533 C ASP A 107 2.310 7.675 4.663 1.00 10.00 C ATOM 1534 O ASP A 107 3.506 7.538 4.827 1.00 10.00 O ATOM 1535 CB ASP A 107 1.709 10.045 3.975 1.00 10.00 C ATOM 1536 CG ASP A 107 1.106 9.568 2.659 1.00 10.00 C ATOM 1537 OD1 ASP A 107 1.751 8.717 2.013 1.00 10.00 O ATOM 1538 OD2 ASP A 107 0.019 10.082 2.316 1.00 10.00 O ATOM 0 H ASP A 107 1.547 9.474 7.102 1.00 10.00 H new ATOM 0 HA ASP A 107 0.589 8.771 5.251 1.00 10.00 H new ATOM 0 HB2 ASP A 107 1.181 10.939 4.308 1.00 10.00 H new ATOM 0 HB3 ASP A 107 2.748 10.331 3.811 1.00 10.00 H new ATOM 1543 N HIS A 108 1.557 6.654 4.265 1.00 10.00 N ATOM 1544 CA HIS A 108 2.127 5.330 4.064 1.00 10.00 C ATOM 1545 C HIS A 108 1.082 4.338 3.566 1.00 10.00 C ATOM 1546 O HIS A 108 -0.103 4.652 3.473 1.00 10.00 O ATOM 1547 CB HIS A 108 2.741 4.806 5.375 1.00 10.00 C ATOM 1548 CG HIS A 108 1.856 5.031 6.577 1.00 10.00 C ATOM 1549 ND1 HIS A 108 1.660 6.206 7.265 1.00 10.00 N ATOM 1550 CD2 HIS A 108 1.031 4.097 7.127 1.00 10.00 C ATOM 1551 CE1 HIS A 108 0.753 5.965 8.217 1.00 10.00 C ATOM 1552 NE2 HIS A 108 0.320 4.691 8.182 1.00 10.00 N ATOM 0 H HIS A 108 0.557 6.719 4.077 1.00 10.00 H new ATOM 0 HA HIS A 108 2.904 5.423 3.305 1.00 10.00 H new ATOM 0 HB2 HIS A 108 2.942 3.739 5.274 1.00 10.00 H new ATOM 0 HB3 HIS A 108 3.700 5.296 5.541 1.00 10.00 H new ATOM 0 HD2 HIS A 108 0.939 3.070 6.805 1.00 10.00 H new ATOM 0 HE1 HIS A 108 0.410 6.702 8.927 1.00 10.00 H new ATOM 0 HE2 HIS A 108 -0.373 4.253 8.789 1.00 10.00 H new ATOM 1560 N VAL A 109 1.529 3.103 3.325 1.00 10.00 N ATOM 1561 CA VAL A 109 0.672 1.940 3.204 1.00 10.00 C ATOM 1562 C VAL A 109 0.875 1.137 4.488 1.00 10.00 C ATOM 1563 O VAL A 109 1.991 0.672 4.718 1.00 10.00 O ATOM 1564 CB VAL A 109 1.054 1.106 1.963 1.00 10.00 C ATOM 1565 CG1 VAL A 109 -0.137 0.234 1.548 1.00 10.00 C ATOM 1566 CG2 VAL A 109 1.507 1.979 0.785 1.00 10.00 C ATOM 0 H VAL A 109 2.519 2.888 3.207 1.00 10.00 H new ATOM 0 HA VAL A 109 -0.373 2.224 3.075 1.00 10.00 H new ATOM 0 HB VAL A 109 1.902 0.477 2.235 1.00 10.00 H new ATOM 0 HG11 VAL A 109 0.132 -0.356 0.671 1.00 10.00 H new ATOM 0 HG12 VAL A 109 -0.402 -0.434 2.367 1.00 10.00 H new ATOM 0 HG13 VAL A 109 -0.989 0.871 1.310 1.00 10.00 H new ATOM 0 HG21 VAL A 109 1.764 1.343 -0.062 1.00 10.00 H new ATOM 0 HG22 VAL A 109 0.699 2.653 0.500 1.00 10.00 H new ATOM 0 HG23 VAL A 109 2.380 2.562 1.079 1.00 10.00 H new ATOM 1576 N MET A 110 -0.163 0.974 5.315 1.00 10.00 N ATOM 1577 CA MET A 110 -0.169 0.005 6.397 1.00 10.00 C ATOM 1578 C MET A 110 -0.534 -1.340 5.769 1.00 10.00 C ATOM 1579 O MET A 110 -1.700 -1.644 5.517 1.00 10.00 O ATOM 1580 CB MET A 110 -1.155 0.368 7.521 1.00 10.00 C ATOM 1581 CG MET A 110 -0.874 1.735 8.139 1.00 10.00 C ATOM 1582 SD MET A 110 -1.726 2.114 9.691 1.00 10.00 S ATOM 1583 CE MET A 110 -0.660 1.244 10.865 1.00 10.00 C ATOM 0 H MET A 110 -1.023 1.517 5.246 1.00 10.00 H new ATOM 0 HA MET A 110 0.811 -0.021 6.873 1.00 10.00 H new ATOM 0 HB2 MET A 110 -2.170 0.356 7.125 1.00 10.00 H new ATOM 0 HB3 MET A 110 -1.107 -0.394 8.299 1.00 10.00 H new ATOM 0 HG2 MET A 110 0.199 1.817 8.311 1.00 10.00 H new ATOM 0 HG3 MET A 110 -1.139 2.500 7.409 1.00 10.00 H new ATOM 0 HE1 MET A 110 -1.047 1.377 11.875 1.00 10.00 H new ATOM 0 HE2 MET A 110 -0.641 0.182 10.621 1.00 10.00 H new ATOM 0 HE3 MET A 110 0.351 1.648 10.807 1.00 10.00 H new ATOM 1593 N LEU A 111 0.491 -2.137 5.498 1.00 10.00 N ATOM 1594 CA LEU A 111 0.383 -3.457 4.903 1.00 10.00 C ATOM 1595 C LEU A 111 0.068 -4.460 6.012 1.00 10.00 C ATOM 1596 O LEU A 111 0.904 -5.293 6.346 1.00 10.00 O ATOM 1597 CB LEU A 111 1.711 -3.761 4.187 1.00 10.00 C ATOM 1598 CG LEU A 111 1.825 -3.008 2.853 1.00 10.00 C ATOM 1599 CD1 LEU A 111 3.295 -2.897 2.444 1.00 10.00 C ATOM 1600 CD2 LEU A 111 1.061 -3.760 1.756 1.00 10.00 C ATOM 0 H LEU A 111 1.455 -1.869 5.695 1.00 10.00 H new ATOM 0 HA LEU A 111 -0.419 -3.518 4.168 1.00 10.00 H new ATOM 0 HB2 LEU A 111 2.544 -3.484 4.833 1.00 10.00 H new ATOM 0 HB3 LEU A 111 1.790 -4.833 4.007 1.00 10.00 H new ATOM 0 HG LEU A 111 1.399 -2.013 2.978 1.00 10.00 H new ATOM 0 HD11 LEU A 111 3.370 -2.362 1.497 1.00 10.00 H new ATOM 0 HD12 LEU A 111 3.846 -2.354 3.212 1.00 10.00 H new ATOM 0 HD13 LEU A 111 3.718 -3.895 2.331 1.00 10.00 H new ATOM 0 HD21 LEU A 111 1.148 -3.218 0.815 1.00 10.00 H new ATOM 0 HD22 LEU A 111 1.481 -4.759 1.639 1.00 10.00 H new ATOM 0 HD23 LEU A 111 0.010 -3.839 2.033 1.00 10.00 H new ATOM 1612 N MET A 112 -1.124 -4.378 6.610 1.00 10.00 N ATOM 1613 CA MET A 112 -1.400 -5.087 7.850 1.00 10.00 C ATOM 1614 C MET A 112 -1.826 -6.534 7.589 1.00 10.00 C ATOM 1615 O MET A 112 -2.350 -6.878 6.527 1.00 10.00 O ATOM 1616 CB MET A 112 -2.480 -4.359 8.664 1.00 10.00 C ATOM 1617 CG MET A 112 -2.214 -2.862 8.852 1.00 10.00 C ATOM 1618 SD MET A 112 -3.539 -1.902 9.634 1.00 10.00 S ATOM 1619 CE MET A 112 -3.725 -2.739 11.224 1.00 10.00 C ATOM 0 H MET A 112 -1.906 -3.829 6.253 1.00 10.00 H new ATOM 0 HA MET A 112 -0.475 -5.106 8.426 1.00 10.00 H new ATOM 0 HB2 MET A 112 -3.442 -4.487 8.169 1.00 10.00 H new ATOM 0 HB3 MET A 112 -2.561 -4.829 9.644 1.00 10.00 H new ATOM 0 HG2 MET A 112 -1.310 -2.748 9.450 1.00 10.00 H new ATOM 0 HG3 MET A 112 -2.007 -2.426 7.875 1.00 10.00 H new ATOM 0 HE1 MET A 112 -4.470 -2.217 11.825 1.00 10.00 H new ATOM 0 HE2 MET A 112 -4.047 -3.767 11.059 1.00 10.00 H new ATOM 0 HE3 MET A 112 -2.770 -2.738 11.749 1.00 10.00 H new ATOM 1629 N GLY A 113 -1.646 -7.386 8.598 1.00 10.00 N ATOM 1630 CA GLY A 113 -2.180 -8.733 8.600 1.00 10.00 C ATOM 1631 C GLY A 113 -1.400 -9.619 7.637 1.00 10.00 C ATOM 1632 O GLY A 113 -1.965 -10.131 6.674 1.00 10.00 O ATOM 0 H GLY A 113 -1.120 -7.152 9.440 1.00 10.00 H new ATOM 0 HA2 GLY A 113 -2.130 -9.148 9.607 1.00 10.00 H new ATOM 0 HA3 GLY A 113 -3.232 -8.714 8.315 1.00 10.00 H new ATOM 1636 N LEU A 114 -0.098 -9.786 7.868 1.00 10.00 N ATOM 1637 CA LEU A 114 0.731 -10.610 6.993 1.00 10.00 C ATOM 1638 C LEU A 114 0.242 -12.062 6.943 1.00 10.00 C ATOM 1639 O LEU A 114 0.003 -12.667 7.987 1.00 10.00 O ATOM 1640 CB LEU A 114 2.217 -10.494 7.357 1.00 10.00 C ATOM 1641 CG LEU A 114 2.879 -9.372 6.542 1.00 10.00 C ATOM 1642 CD1 LEU A 114 2.235 -8.005 6.781 1.00 10.00 C ATOM 1643 CD2 LEU A 114 4.373 -9.290 6.859 1.00 10.00 C ATOM 0 H LEU A 114 0.402 -9.363 8.650 1.00 10.00 H new ATOM 0 HA LEU A 114 0.628 -10.223 5.979 1.00 10.00 H new ATOM 0 HB2 LEU A 114 2.323 -10.290 8.422 1.00 10.00 H new ATOM 0 HB3 LEU A 114 2.721 -11.441 7.162 1.00 10.00 H new ATOM 0 HG LEU A 114 2.732 -9.627 5.492 1.00 10.00 H new ATOM 0 HD11 LEU A 114 2.744 -7.253 6.179 1.00 10.00 H new ATOM 0 HD12 LEU A 114 1.183 -8.044 6.499 1.00 10.00 H new ATOM 0 HD13 LEU A 114 2.318 -7.743 7.836 1.00 10.00 H new ATOM 0 HD21 LEU A 114 4.826 -8.490 6.273 1.00 10.00 H new ATOM 0 HD22 LEU A 114 4.509 -9.084 7.921 1.00 10.00 H new ATOM 0 HD23 LEU A 114 4.850 -10.238 6.610 1.00 10.00 H new ATOM 1655 N LYS A 115 0.079 -12.590 5.722 1.00 10.00 N ATOM 1656 CA LYS A 115 -0.427 -13.930 5.439 1.00 10.00 C ATOM 1657 C LYS A 115 0.709 -14.861 5.008 1.00 10.00 C ATOM 1658 O LYS A 115 0.972 -15.867 5.662 1.00 10.00 O ATOM 1659 CB LYS A 115 -1.598 -13.873 4.439 1.00 10.00 C ATOM 1660 CG LYS A 115 -1.328 -13.233 3.067 1.00 10.00 C ATOM 1661 CD LYS A 115 -2.478 -12.321 2.614 1.00 10.00 C ATOM 1662 CE LYS A 115 -2.152 -11.756 1.225 1.00 10.00 C ATOM 1663 NZ LYS A 115 -3.140 -10.793 0.700 1.00 10.00 N ATOM 0 H LYS A 115 0.307 -12.070 4.874 1.00 10.00 H new ATOM 0 HA LYS A 115 -0.835 -14.360 6.354 1.00 10.00 H new ATOM 0 HB2 LYS A 115 -1.948 -14.892 4.272 1.00 10.00 H new ATOM 0 HB3 LYS A 115 -2.416 -13.328 4.910 1.00 10.00 H new ATOM 0 HG2 LYS A 115 -0.405 -12.655 3.113 1.00 10.00 H new ATOM 0 HG3 LYS A 115 -1.176 -14.018 2.326 1.00 10.00 H new ATOM 0 HD2 LYS A 115 -3.412 -12.881 2.582 1.00 10.00 H new ATOM 0 HD3 LYS A 115 -2.617 -11.509 3.327 1.00 10.00 H new ATOM 0 HE2 LYS A 115 -1.178 -11.269 1.266 1.00 10.00 H new ATOM 0 HE3 LYS A 115 -2.065 -12.585 0.523 1.00 10.00 H new ATOM 0 HZ1 LYS A 115 -2.885 -10.529 -0.273 1.00 10.00 H new ATOM 0 HZ2 LYS A 115 -4.085 -11.228 0.704 1.00 10.00 H new ATOM 0 HZ3 LYS A 115 -3.148 -9.942 1.298 1.00 10.00 H new ATOM 1677 N ARG A 116 1.407 -14.525 3.919 1.00 10.00 N ATOM 1678 CA ARG A 116 2.672 -15.179 3.592 1.00 10.00 C ATOM 1679 C ARG A 116 3.653 -14.949 4.753 1.00 10.00 C ATOM 1680 O ARG A 116 3.654 -13.860 5.330 1.00 10.00 O ATOM 1681 CB ARG A 116 3.255 -14.616 2.280 1.00 10.00 C ATOM 1682 CG ARG A 116 3.264 -15.604 1.106 1.00 10.00 C ATOM 1683 CD ARG A 116 1.861 -16.001 0.634 1.00 10.00 C ATOM 1684 NE ARG A 116 1.944 -16.845 -0.570 1.00 10.00 N ATOM 1685 CZ ARG A 116 0.896 -17.239 -1.312 1.00 10.00 C ATOM 1686 NH1 ARG A 116 -0.343 -16.889 -0.948 1.00 10.00 N ATOM 1687 NH2 ARG A 116 1.091 -17.976 -2.411 1.00 10.00 N ATOM 0 H ARG A 116 1.117 -13.808 3.254 1.00 10.00 H new ATOM 0 HA ARG A 116 2.505 -16.247 3.450 1.00 10.00 H new ATOM 0 HB2 ARG A 116 2.681 -13.735 1.992 1.00 10.00 H new ATOM 0 HB3 ARG A 116 4.276 -14.284 2.465 1.00 10.00 H new ATOM 0 HG2 ARG A 116 3.808 -15.161 0.272 1.00 10.00 H new ATOM 0 HG3 ARG A 116 3.808 -16.502 1.400 1.00 10.00 H new ATOM 0 HD2 ARG A 116 1.342 -16.539 1.428 1.00 10.00 H new ATOM 0 HD3 ARG A 116 1.276 -15.107 0.419 1.00 10.00 H new ATOM 0 HE ARG A 116 2.870 -17.155 -0.864 1.00 10.00 H new ATOM 0 HH11 ARG A 116 -0.488 -16.325 -0.110 1.00 10.00 H new ATOM 0 HH12 ARG A 116 -1.142 -17.186 -1.508 1.00 10.00 H new ATOM 0 HH21 ARG A 116 2.037 -18.240 -2.687 1.00 10.00 H new ATOM 0 HH22 ARG A 116 0.294 -18.274 -2.973 1.00 10.00 H new ATOM 1701 N PRO A 117 4.491 -15.938 5.104 1.00 10.00 N ATOM 1702 CA PRO A 117 5.492 -15.769 6.140 1.00 10.00 C ATOM 1703 C PRO A 117 6.525 -14.735 5.689 1.00 10.00 C ATOM 1704 O PRO A 117 7.011 -14.783 4.561 1.00 10.00 O ATOM 1705 CB PRO A 117 6.114 -17.153 6.344 1.00 10.00 C ATOM 1706 CG PRO A 117 5.929 -17.826 4.985 1.00 10.00 C ATOM 1707 CD PRO A 117 4.599 -17.253 4.494 1.00 10.00 C ATOM 0 HA PRO A 117 5.073 -15.401 7.077 1.00 10.00 H new ATOM 0 HB2 PRO A 117 7.167 -17.084 6.619 1.00 10.00 H new ATOM 0 HB3 PRO A 117 5.613 -17.706 7.138 1.00 10.00 H new ATOM 0 HG2 PRO A 117 6.746 -17.590 4.303 1.00 10.00 H new ATOM 0 HG3 PRO A 117 5.892 -18.912 5.074 1.00 10.00 H new ATOM 0 HD2 PRO A 117 4.580 -17.183 3.406 1.00 10.00 H new ATOM 0 HD3 PRO A 117 3.765 -17.891 4.787 1.00 10.00 H new ATOM 1715 N LEU A 118 6.847 -13.789 6.572 1.00 10.00 N ATOM 1716 CA LEU A 118 7.883 -12.801 6.333 1.00 10.00 C ATOM 1717 C LEU A 118 9.274 -13.438 6.321 1.00 10.00 C ATOM 1718 O LEU A 118 9.472 -14.532 6.849 1.00 10.00 O ATOM 1719 CB LEU A 118 7.761 -11.648 7.342 1.00 10.00 C ATOM 1720 CG LEU A 118 8.021 -11.916 8.842 1.00 10.00 C ATOM 1721 CD1 LEU A 118 7.131 -12.987 9.483 1.00 10.00 C ATOM 1722 CD2 LEU A 118 9.492 -12.186 9.186 1.00 10.00 C ATOM 0 H LEU A 118 6.389 -13.692 7.478 1.00 10.00 H new ATOM 0 HA LEU A 118 7.741 -12.377 5.339 1.00 10.00 H new ATOM 0 HB2 LEU A 118 8.450 -10.864 7.027 1.00 10.00 H new ATOM 0 HB3 LEU A 118 6.753 -11.242 7.253 1.00 10.00 H new ATOM 0 HG LEU A 118 7.736 -10.963 9.288 1.00 10.00 H new ATOM 0 HD11 LEU A 118 7.395 -13.097 10.535 1.00 10.00 H new ATOM 0 HD12 LEU A 118 6.086 -12.689 9.400 1.00 10.00 H new ATOM 0 HD13 LEU A 118 7.279 -13.937 8.970 1.00 10.00 H new ATOM 0 HD21 LEU A 118 9.588 -12.364 10.257 1.00 10.00 H new ATOM 0 HD22 LEU A 118 9.838 -13.063 8.640 1.00 10.00 H new ATOM 0 HD23 LEU A 118 10.096 -11.323 8.906 1.00 10.00 H new ATOM 1734 N LYS A 119 10.247 -12.731 5.739 1.00 10.00 N ATOM 1735 CA LYS A 119 11.643 -13.129 5.701 1.00 10.00 C ATOM 1736 C LYS A 119 12.426 -11.844 5.443 1.00 10.00 C ATOM 1737 O LYS A 119 12.185 -11.170 4.445 1.00 10.00 O ATOM 1738 CB LYS A 119 11.843 -14.183 4.595 1.00 10.00 C ATOM 1739 CG LYS A 119 13.217 -14.875 4.557 1.00 10.00 C ATOM 1740 CD LYS A 119 14.387 -13.912 4.299 1.00 10.00 C ATOM 1741 CE LYS A 119 15.589 -14.578 3.613 1.00 10.00 C ATOM 1742 NZ LYS A 119 15.401 -14.676 2.151 1.00 10.00 N ATOM 0 H LYS A 119 10.072 -11.842 5.270 1.00 10.00 H new ATOM 0 HA LYS A 119 11.986 -13.593 6.626 1.00 10.00 H new ATOM 0 HB2 LYS A 119 11.076 -14.949 4.709 1.00 10.00 H new ATOM 0 HB3 LYS A 119 11.674 -13.704 3.631 1.00 10.00 H new ATOM 0 HG2 LYS A 119 13.382 -15.388 5.505 1.00 10.00 H new ATOM 0 HG3 LYS A 119 13.208 -15.638 3.779 1.00 10.00 H new ATOM 0 HD2 LYS A 119 14.037 -13.086 3.680 1.00 10.00 H new ATOM 0 HD3 LYS A 119 14.711 -13.484 5.248 1.00 10.00 H new ATOM 0 HE2 LYS A 119 16.492 -14.006 3.826 1.00 10.00 H new ATOM 0 HE3 LYS A 119 15.738 -15.575 4.028 1.00 10.00 H new ATOM 0 HZ1 LYS A 119 16.254 -15.084 1.718 1.00 10.00 H new ATOM 0 HZ2 LYS A 119 14.583 -15.285 1.946 1.00 10.00 H new ATOM 0 HZ3 LYS A 119 15.233 -13.728 1.758 1.00 10.00 H new ATOM 1756 N VAL A 120 13.325 -11.469 6.354 1.00 10.00 N ATOM 1757 CA VAL A 120 14.122 -10.259 6.206 1.00 10.00 C ATOM 1758 C VAL A 120 15.094 -10.463 5.043 1.00 10.00 C ATOM 1759 O VAL A 120 15.941 -11.351 5.111 1.00 10.00 O ATOM 1760 CB VAL A 120 14.869 -9.956 7.516 1.00 10.00 C ATOM 1761 CG1 VAL A 120 15.565 -8.591 7.427 1.00 10.00 C ATOM 1762 CG2 VAL A 120 13.910 -9.957 8.712 1.00 10.00 C ATOM 0 H VAL A 120 13.517 -11.993 7.207 1.00 10.00 H new ATOM 0 HA VAL A 120 13.482 -9.403 5.991 1.00 10.00 H new ATOM 0 HB VAL A 120 15.613 -10.739 7.663 1.00 10.00 H new ATOM 0 HG11 VAL A 120 16.090 -8.389 8.361 1.00 10.00 H new ATOM 0 HG12 VAL A 120 16.279 -8.600 6.604 1.00 10.00 H new ATOM 0 HG13 VAL A 120 14.821 -7.814 7.253 1.00 10.00 H new ATOM 0 HG21 VAL A 120 14.466 -9.740 9.624 1.00 10.00 H new ATOM 0 HG22 VAL A 120 13.144 -9.196 8.564 1.00 10.00 H new ATOM 0 HG23 VAL A 120 13.438 -10.936 8.799 1.00 10.00 H new ATOM 1772 N GLY A 121 14.972 -9.675 3.974 1.00 10.00 N ATOM 1773 CA GLY A 121 15.760 -9.893 2.777 1.00 10.00 C ATOM 1774 C GLY A 121 15.055 -10.940 1.928 1.00 10.00 C ATOM 1775 O GLY A 121 15.586 -12.025 1.685 1.00 10.00 O ATOM 0 H GLY A 121 14.333 -8.882 3.920 1.00 10.00 H new ATOM 0 HA2 GLY A 121 15.870 -8.963 2.220 1.00 10.00 H new ATOM 0 HA3 GLY A 121 16.764 -10.228 3.038 1.00 10.00 H new ATOM 1779 N GLU A 122 13.845 -10.595 1.489 1.00 10.00 N ATOM 1780 CA GLU A 122 13.182 -11.217 0.365 1.00 10.00 C ATOM 1781 C GLU A 122 12.635 -10.094 -0.497 1.00 10.00 C ATOM 1782 O GLU A 122 12.872 -8.907 -0.248 1.00 10.00 O ATOM 1783 CB GLU A 122 12.040 -12.129 0.834 1.00 10.00 C ATOM 1784 CG GLU A 122 11.927 -13.441 0.039 1.00 10.00 C ATOM 1785 CD GLU A 122 13.072 -14.374 0.390 1.00 10.00 C ATOM 1786 OE1 GLU A 122 12.930 -15.144 1.364 1.00 10.00 O ATOM 1787 OE2 GLU A 122 14.164 -14.235 -0.195 1.00 10.00 O ATOM 0 H GLU A 122 13.292 -9.855 1.923 1.00 10.00 H new ATOM 0 HA GLU A 122 13.881 -11.840 -0.193 1.00 10.00 H new ATOM 0 HB2 GLU A 122 12.186 -12.365 1.888 1.00 10.00 H new ATOM 0 HB3 GLU A 122 11.098 -11.586 0.756 1.00 10.00 H new ATOM 0 HG2 GLU A 122 10.975 -13.925 0.258 1.00 10.00 H new ATOM 0 HG3 GLU A 122 11.938 -13.228 -1.030 1.00 10.00 H new ATOM 1794 N THR A 123 11.869 -10.497 -1.498 1.00 10.00 N ATOM 1795 CA THR A 123 11.309 -9.629 -2.512 1.00 10.00 C ATOM 1796 C THR A 123 10.023 -10.271 -3.020 1.00 10.00 C ATOM 1797 O THR A 123 10.041 -11.429 -3.432 1.00 10.00 O ATOM 1798 CB THR A 123 12.346 -9.391 -3.618 1.00 10.00 C ATOM 1799 OG1 THR A 123 13.539 -8.885 -3.050 1.00 10.00 O ATOM 1800 CG2 THR A 123 11.834 -8.382 -4.647 1.00 10.00 C ATOM 0 H THR A 123 11.613 -11.476 -1.628 1.00 10.00 H new ATOM 0 HA THR A 123 11.060 -8.646 -2.111 1.00 10.00 H new ATOM 0 HB THR A 123 12.531 -10.344 -4.114 1.00 10.00 H new ATOM 0 HG1 THR A 123 14.200 -8.735 -3.758 1.00 10.00 H new ATOM 0 HG21 THR A 123 12.590 -8.233 -5.418 1.00 10.00 H new ATOM 0 HG22 THR A 123 10.919 -8.760 -5.103 1.00 10.00 H new ATOM 0 HG23 THR A 123 11.627 -7.432 -4.154 1.00 10.00 H new ATOM 1808 N VAL A 124 8.906 -9.546 -2.934 1.00 10.00 N ATOM 1809 CA VAL A 124 7.571 -10.062 -3.182 1.00 10.00 C ATOM 1810 C VAL A 124 6.873 -9.142 -4.182 1.00 10.00 C ATOM 1811 O VAL A 124 6.812 -7.933 -3.972 1.00 10.00 O ATOM 1812 CB VAL A 124 6.807 -10.143 -1.848 1.00 10.00 C ATOM 1813 CG1 VAL A 124 5.414 -10.734 -2.075 1.00 10.00 C ATOM 1814 CG2 VAL A 124 7.553 -11.016 -0.828 1.00 10.00 C ATOM 0 H VAL A 124 8.912 -8.557 -2.683 1.00 10.00 H new ATOM 0 HA VAL A 124 7.609 -11.065 -3.606 1.00 10.00 H new ATOM 0 HB VAL A 124 6.727 -9.130 -1.454 1.00 10.00 H new ATOM 0 HG11 VAL A 124 4.882 -10.787 -1.125 1.00 10.00 H new ATOM 0 HG12 VAL A 124 4.859 -10.101 -2.767 1.00 10.00 H new ATOM 0 HG13 VAL A 124 5.508 -11.736 -2.495 1.00 10.00 H new ATOM 0 HG21 VAL A 124 6.987 -11.052 0.103 1.00 10.00 H new ATOM 0 HG22 VAL A 124 7.664 -12.025 -1.225 1.00 10.00 H new ATOM 0 HG23 VAL A 124 8.538 -10.591 -0.637 1.00 10.00 H new ATOM 1824 N ASN A 125 6.349 -9.700 -5.276 1.00 10.00 N ATOM 1825 CA ASN A 125 5.604 -8.915 -6.251 1.00 10.00 C ATOM 1826 C ASN A 125 4.260 -8.499 -5.657 1.00 10.00 C ATOM 1827 O ASN A 125 3.512 -9.349 -5.175 1.00 10.00 O ATOM 1828 CB ASN A 125 5.400 -9.690 -7.559 1.00 10.00 C ATOM 1829 CG ASN A 125 6.649 -9.653 -8.434 1.00 10.00 C ATOM 1830 OD1 ASN A 125 6.878 -8.684 -9.151 1.00 10.00 O ATOM 1831 ND2 ASN A 125 7.467 -10.701 -8.391 1.00 10.00 N ATOM 0 H ASN A 125 6.429 -10.691 -5.505 1.00 10.00 H new ATOM 0 HA ASN A 125 6.184 -8.023 -6.489 1.00 10.00 H new ATOM 0 HB2 ASN A 125 5.144 -10.725 -7.333 1.00 10.00 H new ATOM 0 HB3 ASN A 125 4.559 -9.266 -8.107 1.00 10.00 H new ATOM 0 HD21 ASN A 125 8.311 -10.713 -8.964 1.00 10.00 H new ATOM 0 HD22 ASN A 125 7.250 -11.492 -7.785 1.00 10.00 H new ATOM 1838 N ILE A 126 3.951 -7.203 -5.715 1.00 10.00 N ATOM 1839 CA ILE A 126 2.644 -6.639 -5.425 1.00 10.00 C ATOM 1840 C ILE A 126 2.093 -6.046 -6.717 1.00 10.00 C ATOM 1841 O ILE A 126 2.873 -5.575 -7.548 1.00 10.00 O ATOM 1842 CB ILE A 126 2.732 -5.598 -4.299 1.00 10.00 C ATOM 1843 CG1 ILE A 126 3.519 -4.335 -4.676 1.00 10.00 C ATOM 1844 CG2 ILE A 126 3.333 -6.260 -3.054 1.00 10.00 C ATOM 1845 CD1 ILE A 126 3.435 -3.284 -3.571 1.00 10.00 C ATOM 0 H ILE A 126 4.636 -6.494 -5.976 1.00 10.00 H new ATOM 0 HA ILE A 126 1.965 -7.413 -5.067 1.00 10.00 H new ATOM 0 HB ILE A 126 1.717 -5.254 -4.100 1.00 10.00 H new ATOM 0 HG12 ILE A 126 4.562 -4.594 -4.858 1.00 10.00 H new ATOM 0 HG13 ILE A 126 3.127 -3.922 -5.605 1.00 10.00 H new ATOM 0 HG21 ILE A 126 3.399 -5.528 -2.249 1.00 10.00 H new ATOM 0 HG22 ILE A 126 2.698 -7.088 -2.740 1.00 10.00 H new ATOM 0 HG23 ILE A 126 4.330 -6.635 -3.287 1.00 10.00 H new ATOM 0 HD11 ILE A 126 4.001 -2.401 -3.865 1.00 10.00 H new ATOM 0 HD12 ILE A 126 2.393 -3.009 -3.409 1.00 10.00 H new ATOM 0 HD13 ILE A 126 3.851 -3.691 -2.649 1.00 10.00 H new ATOM 1857 N THR A 127 0.771 -6.072 -6.892 1.00 10.00 N ATOM 1858 CA THR A 127 0.093 -5.511 -8.049 1.00 10.00 C ATOM 1859 C THR A 127 -0.689 -4.270 -7.618 1.00 10.00 C ATOM 1860 O THR A 127 -1.395 -4.291 -6.612 1.00 10.00 O ATOM 1861 CB THR A 127 -0.818 -6.566 -8.694 1.00 10.00 C ATOM 1862 OG1 THR A 127 -0.177 -7.827 -8.690 1.00 10.00 O ATOM 1863 CG2 THR A 127 -1.145 -6.198 -10.146 1.00 10.00 C ATOM 0 H THR A 127 0.134 -6.494 -6.216 1.00 10.00 H new ATOM 0 HA THR A 127 0.823 -5.212 -8.801 1.00 10.00 H new ATOM 0 HB THR A 127 -1.740 -6.605 -8.114 1.00 10.00 H new ATOM 0 HG1 THR A 127 -0.765 -8.494 -9.101 1.00 10.00 H new ATOM 0 HG21 THR A 127 -1.791 -6.962 -10.578 1.00 10.00 H new ATOM 0 HG22 THR A 127 -1.655 -5.235 -10.171 1.00 10.00 H new ATOM 0 HG23 THR A 127 -0.222 -6.135 -10.722 1.00 10.00 H new ATOM 1871 N LEU A 128 -0.574 -3.183 -8.374 1.00 10.00 N ATOM 1872 CA LEU A 128 -1.360 -1.979 -8.189 1.00 10.00 C ATOM 1873 C LEU A 128 -2.693 -2.198 -8.912 1.00 10.00 C ATOM 1874 O LEU A 128 -2.757 -3.007 -9.835 1.00 10.00 O ATOM 1875 CB LEU A 128 -0.554 -0.820 -8.798 1.00 10.00 C ATOM 1876 CG LEU A 128 -0.651 0.497 -8.020 1.00 10.00 C ATOM 1877 CD1 LEU A 128 0.371 1.490 -8.580 1.00 10.00 C ATOM 1878 CD2 LEU A 128 -2.050 1.101 -8.120 1.00 10.00 C ATOM 0 H LEU A 128 0.085 -3.118 -9.149 1.00 10.00 H new ATOM 0 HA LEU A 128 -1.566 -1.748 -7.144 1.00 10.00 H new ATOM 0 HB2 LEU A 128 0.493 -1.115 -8.860 1.00 10.00 H new ATOM 0 HB3 LEU A 128 -0.898 -0.651 -9.818 1.00 10.00 H new ATOM 0 HG LEU A 128 -0.444 0.290 -6.970 1.00 10.00 H new ATOM 0 HD11 LEU A 128 0.306 2.429 -8.030 1.00 10.00 H new ATOM 0 HD12 LEU A 128 1.374 1.077 -8.476 1.00 10.00 H new ATOM 0 HD13 LEU A 128 0.161 1.672 -9.634 1.00 10.00 H new ATOM 0 HD21 LEU A 128 -2.085 2.034 -7.557 1.00 10.00 H new ATOM 0 HD22 LEU A 128 -2.287 1.299 -9.165 1.00 10.00 H new ATOM 0 HD23 LEU A 128 -2.778 0.402 -7.709 1.00 10.00 H new ATOM 1890 N LYS A 129 -3.757 -1.501 -8.510 1.00 10.00 N ATOM 1891 CA LYS A 129 -5.011 -1.432 -9.248 1.00 10.00 C ATOM 1892 C LYS A 129 -5.712 -0.133 -8.850 1.00 10.00 C ATOM 1893 O LYS A 129 -6.530 -0.124 -7.935 1.00 10.00 O ATOM 1894 CB LYS A 129 -5.862 -2.678 -8.957 1.00 10.00 C ATOM 1895 CG LYS A 129 -7.101 -2.781 -9.858 1.00 10.00 C ATOM 1896 CD LYS A 129 -7.939 -4.007 -9.464 1.00 10.00 C ATOM 1897 CE LYS A 129 -9.104 -4.210 -10.446 1.00 10.00 C ATOM 1898 NZ LYS A 129 -10.037 -5.272 -10.012 1.00 10.00 N ATOM 0 H LYS A 129 -3.767 -0.960 -7.645 1.00 10.00 H new ATOM 0 HA LYS A 129 -4.841 -1.422 -10.325 1.00 10.00 H new ATOM 0 HB2 LYS A 129 -5.249 -3.569 -9.089 1.00 10.00 H new ATOM 0 HB3 LYS A 129 -6.178 -2.660 -7.914 1.00 10.00 H new ATOM 0 HG2 LYS A 129 -7.702 -1.876 -9.768 1.00 10.00 H new ATOM 0 HG3 LYS A 129 -6.796 -2.859 -10.902 1.00 10.00 H new ATOM 0 HD2 LYS A 129 -7.308 -4.896 -9.452 1.00 10.00 H new ATOM 0 HD3 LYS A 129 -8.327 -3.878 -8.454 1.00 10.00 H new ATOM 0 HE2 LYS A 129 -9.651 -3.273 -10.553 1.00 10.00 H new ATOM 0 HE3 LYS A 129 -8.706 -4.461 -11.429 1.00 10.00 H new ATOM 0 HZ1 LYS A 129 -10.803 -5.367 -10.709 1.00 10.00 H new ATOM 0 HZ2 LYS A 129 -9.525 -6.174 -9.935 1.00 10.00 H new ATOM 0 HZ3 LYS A 129 -10.440 -5.023 -9.086 1.00 10.00 H new ATOM 1912 N ALA A 130 -5.386 0.974 -9.518 1.00 10.00 N ATOM 1913 CA ALA A 130 -5.961 2.269 -9.181 1.00 10.00 C ATOM 1914 C ALA A 130 -7.355 2.400 -9.796 1.00 10.00 C ATOM 1915 O ALA A 130 -7.663 1.735 -10.782 1.00 10.00 O ATOM 1916 CB ALA A 130 -5.044 3.376 -9.705 1.00 10.00 C ATOM 0 H ALA A 130 -4.726 0.996 -10.295 1.00 10.00 H new ATOM 0 HA ALA A 130 -6.053 2.358 -8.098 1.00 10.00 H new ATOM 0 HB1 ALA A 130 -5.469 4.349 -9.456 1.00 10.00 H new ATOM 0 HB2 ALA A 130 -4.060 3.281 -9.246 1.00 10.00 H new ATOM 0 HB3 ALA A 130 -4.949 3.288 -10.787 1.00 10.00 H new ATOM 1922 N THR A 131 -8.184 3.284 -9.228 1.00 10.00 N ATOM 1923 CA THR A 131 -9.536 3.587 -9.703 1.00 10.00 C ATOM 1924 C THR A 131 -9.551 3.989 -11.177 1.00 10.00 C ATOM 1925 O THR A 131 -10.498 3.681 -11.896 1.00 10.00 O ATOM 1926 CB THR A 131 -10.192 4.633 -8.782 1.00 10.00 C ATOM 1927 OG1 THR A 131 -11.513 4.919 -9.186 1.00 10.00 O ATOM 1928 CG2 THR A 131 -9.423 5.959 -8.725 1.00 10.00 C ATOM 0 H THR A 131 -7.924 3.823 -8.402 1.00 10.00 H new ATOM 0 HA THR A 131 -10.137 2.680 -9.651 1.00 10.00 H new ATOM 0 HB THR A 131 -10.181 4.179 -7.791 1.00 10.00 H new ATOM 0 HG1 THR A 131 -11.903 5.585 -8.582 1.00 10.00 H new ATOM 0 HG21 THR A 131 -9.939 6.651 -8.059 1.00 10.00 H new ATOM 0 HG22 THR A 131 -8.415 5.779 -8.351 1.00 10.00 H new ATOM 0 HG23 THR A 131 -9.368 6.391 -9.724 1.00 10.00 H new ATOM 1936 N ASP A 132 -8.469 4.625 -11.626 1.00 10.00 N ATOM 1937 CA ASP A 132 -8.208 4.926 -13.022 1.00 10.00 C ATOM 1938 C ASP A 132 -8.378 3.703 -13.940 1.00 10.00 C ATOM 1939 O ASP A 132 -8.779 3.835 -15.094 1.00 10.00 O ATOM 1940 CB ASP A 132 -6.782 5.491 -13.094 1.00 10.00 C ATOM 1941 CG ASP A 132 -6.224 5.511 -14.509 1.00 10.00 C ATOM 1942 OD1 ASP A 132 -5.665 4.463 -14.898 1.00 10.00 O ATOM 1943 OD2 ASP A 132 -6.330 6.576 -15.150 1.00 10.00 O ATOM 0 H ASP A 132 -7.730 4.953 -11.003 1.00 10.00 H new ATOM 0 HA ASP A 132 -8.937 5.650 -13.385 1.00 10.00 H new ATOM 0 HB2 ASP A 132 -6.777 6.504 -12.693 1.00 10.00 H new ATOM 0 HB3 ASP A 132 -6.127 4.894 -12.459 1.00 10.00 H new ATOM 1948 N GLY A 133 -8.063 2.516 -13.417 1.00 10.00 N ATOM 1949 CA GLY A 133 -7.843 1.299 -14.180 1.00 10.00 C ATOM 1950 C GLY A 133 -6.345 0.996 -14.264 1.00 10.00 C ATOM 1951 O GLY A 133 -5.932 0.082 -14.980 1.00 10.00 O ATOM 0 H GLY A 133 -7.952 2.378 -12.413 1.00 10.00 H new ATOM 0 HA2 GLY A 133 -8.365 0.466 -13.709 1.00 10.00 H new ATOM 0 HA3 GLY A 133 -8.257 1.409 -15.182 1.00 10.00 H new ATOM 1955 N ARG A 134 -5.515 1.735 -13.518 1.00 10.00 N ATOM 1956 CA ARG A 134 -4.076 1.622 -13.633 1.00 10.00 C ATOM 1957 C ARG A 134 -3.623 0.455 -12.773 1.00 10.00 C ATOM 1958 O ARG A 134 -3.405 0.598 -11.570 1.00 10.00 O ATOM 1959 CB ARG A 134 -3.346 2.936 -13.296 1.00 10.00 C ATOM 1960 CG ARG A 134 -2.661 3.555 -14.525 1.00 10.00 C ATOM 1961 CD ARG A 134 -1.318 2.903 -14.912 1.00 10.00 C ATOM 1962 NE ARG A 134 -1.401 1.471 -15.252 1.00 10.00 N ATOM 1963 CZ ARG A 134 -1.952 0.935 -16.353 1.00 10.00 C ATOM 1964 NH1 ARG A 134 -2.592 1.687 -17.251 1.00 10.00 N ATOM 1965 NH2 ARG A 134 -1.885 -0.383 -16.525 1.00 10.00 N ATOM 0 H ARG A 134 -5.828 2.418 -12.828 1.00 10.00 H new ATOM 0 HA ARG A 134 -3.810 1.427 -14.672 1.00 10.00 H new ATOM 0 HB2 ARG A 134 -4.059 3.649 -12.883 1.00 10.00 H new ATOM 0 HB3 ARG A 134 -2.600 2.747 -12.524 1.00 10.00 H new ATOM 0 HG2 ARG A 134 -3.340 3.487 -15.375 1.00 10.00 H new ATOM 0 HG3 ARG A 134 -2.493 4.615 -14.335 1.00 10.00 H new ATOM 0 HD2 ARG A 134 -0.901 3.441 -15.764 1.00 10.00 H new ATOM 0 HD3 ARG A 134 -0.619 3.026 -14.085 1.00 10.00 H new ATOM 0 HE ARG A 134 -0.997 0.818 -14.580 1.00 10.00 H new ATOM 0 HH11 ARG A 134 -2.671 2.694 -17.109 1.00 10.00 H new ATOM 0 HH12 ARG A 134 -3.002 1.255 -18.079 1.00 10.00 H new ATOM 0 HH21 ARG A 134 -1.422 -0.965 -15.828 1.00 10.00 H new ATOM 0 HH22 ARG A 134 -2.297 -0.811 -17.354 1.00 10.00 H new ATOM 1979 N THR A 135 -3.482 -0.700 -13.418 1.00 10.00 N ATOM 1980 CA THR A 135 -2.760 -1.828 -12.869 1.00 10.00 C ATOM 1981 C THR A 135 -1.271 -1.639 -13.160 1.00 10.00 C ATOM 1982 O THR A 135 -0.901 -1.002 -14.153 1.00 10.00 O ATOM 1983 CB THR A 135 -3.341 -3.164 -13.360 1.00 10.00 C ATOM 1984 OG1 THR A 135 -2.504 -4.221 -12.940 1.00 10.00 O ATOM 1985 CG2 THR A 135 -3.508 -3.239 -14.881 1.00 10.00 C ATOM 0 H THR A 135 -3.872 -0.874 -14.344 1.00 10.00 H new ATOM 0 HA THR A 135 -2.878 -1.869 -11.786 1.00 10.00 H new ATOM 0 HB THR A 135 -4.337 -3.247 -12.925 1.00 10.00 H new ATOM 0 HG1 THR A 135 -2.873 -5.074 -13.250 1.00 10.00 H new ATOM 0 HG21 THR A 135 -3.922 -4.209 -15.154 1.00 10.00 H new ATOM 0 HG22 THR A 135 -4.183 -2.450 -15.212 1.00 10.00 H new ATOM 0 HG23 THR A 135 -2.537 -3.111 -15.360 1.00 10.00 H new ATOM 1993 N LEU A 136 -0.425 -2.127 -12.258 1.00 10.00 N ATOM 1994 CA LEU A 136 1.024 -2.050 -12.332 1.00 10.00 C ATOM 1995 C LEU A 136 1.552 -3.186 -11.460 1.00 10.00 C ATOM 1996 O LEU A 136 0.755 -3.824 -10.774 1.00 10.00 O ATOM 1997 CB LEU A 136 1.495 -0.690 -11.796 1.00 10.00 C ATOM 1998 CG LEU A 136 2.754 -0.170 -12.508 1.00 10.00 C ATOM 1999 CD1 LEU A 136 2.387 0.496 -13.840 1.00 10.00 C ATOM 2000 CD2 LEU A 136 3.460 0.844 -11.605 1.00 10.00 C ATOM 0 H LEU A 136 -0.749 -2.608 -11.419 1.00 10.00 H new ATOM 0 HA LEU A 136 1.387 -2.143 -13.355 1.00 10.00 H new ATOM 0 HB2 LEU A 136 0.692 0.038 -11.911 1.00 10.00 H new ATOM 0 HB3 LEU A 136 1.697 -0.776 -10.728 1.00 10.00 H new ATOM 0 HG LEU A 136 3.416 -1.011 -12.713 1.00 10.00 H new ATOM 0 HD11 LEU A 136 3.292 0.857 -14.328 1.00 10.00 H new ATOM 0 HD12 LEU A 136 1.892 -0.230 -14.485 1.00 10.00 H new ATOM 0 HD13 LEU A 136 1.716 1.334 -13.655 1.00 10.00 H new ATOM 0 HD21 LEU A 136 4.354 1.216 -12.105 1.00 10.00 H new ATOM 0 HD22 LEU A 136 2.787 1.676 -11.397 1.00 10.00 H new ATOM 0 HD23 LEU A 136 3.742 0.363 -10.669 1.00 10.00 H new ATOM 2012 N ASN A 137 2.865 -3.413 -11.429 1.00 10.00 N ATOM 2013 CA ASN A 137 3.511 -4.409 -10.608 1.00 10.00 C ATOM 2014 C ASN A 137 4.721 -3.737 -9.976 1.00 10.00 C ATOM 2015 O ASN A 137 5.391 -2.949 -10.640 1.00 10.00 O ATOM 2016 CB ASN A 137 3.928 -5.605 -11.466 1.00 10.00 C ATOM 2017 CG ASN A 137 5.037 -5.265 -12.461 1.00 10.00 C ATOM 2018 OD1 ASN A 137 4.806 -4.556 -13.435 1.00 10.00 O ATOM 2019 ND2 ASN A 137 6.248 -5.769 -12.233 1.00 10.00 N ATOM 0 H ASN A 137 3.523 -2.883 -12.000 1.00 10.00 H new ATOM 0 HA ASN A 137 2.841 -4.787 -9.836 1.00 10.00 H new ATOM 0 HB2 ASN A 137 4.265 -6.412 -10.816 1.00 10.00 H new ATOM 0 HB3 ASN A 137 3.059 -5.976 -12.010 1.00 10.00 H new ATOM 0 HD21 ASN A 137 7.013 -5.569 -12.877 1.00 10.00 H new ATOM 0 HD22 ASN A 137 6.410 -6.356 -11.414 1.00 10.00 H new ATOM 2026 N VAL A 138 4.975 -4.018 -8.701 1.00 10.00 N ATOM 2027 CA VAL A 138 6.126 -3.520 -7.965 1.00 10.00 C ATOM 2028 C VAL A 138 6.722 -4.711 -7.217 1.00 10.00 C ATOM 2029 O VAL A 138 5.976 -5.546 -6.712 1.00 10.00 O ATOM 2030 CB VAL A 138 5.661 -2.387 -7.033 1.00 10.00 C ATOM 2031 CG1 VAL A 138 6.613 -2.149 -5.852 1.00 10.00 C ATOM 2032 CG2 VAL A 138 5.497 -1.083 -7.822 1.00 10.00 C ATOM 0 H VAL A 138 4.368 -4.615 -8.139 1.00 10.00 H new ATOM 0 HA VAL A 138 6.896 -3.097 -8.610 1.00 10.00 H new ATOM 0 HB VAL A 138 4.703 -2.704 -6.620 1.00 10.00 H new ATOM 0 HG11 VAL A 138 6.229 -1.338 -5.233 1.00 10.00 H new ATOM 0 HG12 VAL A 138 6.686 -3.058 -5.255 1.00 10.00 H new ATOM 0 HG13 VAL A 138 7.600 -1.882 -6.229 1.00 10.00 H new ATOM 0 HG21 VAL A 138 5.168 -0.290 -7.150 1.00 10.00 H new ATOM 0 HG22 VAL A 138 6.451 -0.806 -8.270 1.00 10.00 H new ATOM 0 HG23 VAL A 138 4.755 -1.224 -8.608 1.00 10.00 H new ATOM 2042 N ALA A 139 8.052 -4.809 -7.164 1.00 10.00 N ATOM 2043 CA ALA A 139 8.750 -5.861 -6.441 1.00 10.00 C ATOM 2044 C ALA A 139 9.163 -5.324 -5.076 1.00 10.00 C ATOM 2045 O ALA A 139 10.166 -4.626 -4.957 1.00 10.00 O ATOM 2046 CB ALA A 139 9.953 -6.331 -7.251 1.00 10.00 C ATOM 0 H ALA A 139 8.677 -4.150 -7.629 1.00 10.00 H new ATOM 0 HA ALA A 139 8.099 -6.722 -6.292 1.00 10.00 H new ATOM 0 HB1 ALA A 139 10.473 -7.119 -6.706 1.00 10.00 H new ATOM 0 HB2 ALA A 139 9.616 -6.717 -8.213 1.00 10.00 H new ATOM 0 HB3 ALA A 139 10.632 -5.494 -7.414 1.00 10.00 H new ATOM 2052 N ALA A 140 8.370 -5.644 -4.057 1.00 10.00 N ATOM 2053 CA ALA A 140 8.493 -5.079 -2.725 1.00 10.00 C ATOM 2054 C ALA A 140 9.540 -5.836 -1.924 1.00 10.00 C ATOM 2055 O ALA A 140 9.406 -7.045 -1.741 1.00 10.00 O ATOM 2056 CB ALA A 140 7.145 -5.163 -2.012 1.00 10.00 C ATOM 0 H ALA A 140 7.609 -6.318 -4.141 1.00 10.00 H new ATOM 0 HA ALA A 140 8.801 -4.037 -2.810 1.00 10.00 H new ATOM 0 HB1 ALA A 140 7.235 -4.739 -1.012 1.00 10.00 H new ATOM 0 HB2 ALA A 140 6.399 -4.604 -2.577 1.00 10.00 H new ATOM 0 HB3 ALA A 140 6.837 -6.206 -1.938 1.00 10.00 H new ATOM 2062 N THR A 141 10.554 -5.140 -1.416 1.00 10.00 N ATOM 2063 CA THR A 141 11.615 -5.751 -0.633 1.00 10.00 C ATOM 2064 C THR A 141 11.137 -5.868 0.816 1.00 10.00 C ATOM 2065 O THR A 141 10.536 -4.931 1.338 1.00 10.00 O ATOM 2066 CB THR A 141 12.888 -4.898 -0.735 1.00 10.00 C ATOM 2067 OG1 THR A 141 13.024 -4.393 -2.048 1.00 10.00 O ATOM 2068 CG2 THR A 141 14.130 -5.736 -0.416 1.00 10.00 C ATOM 0 H THR A 141 10.660 -4.133 -1.539 1.00 10.00 H new ATOM 0 HA THR A 141 11.851 -6.746 -1.011 1.00 10.00 H new ATOM 0 HB THR A 141 12.802 -4.081 -0.018 1.00 10.00 H new ATOM 0 HG1 THR A 141 13.837 -3.848 -2.106 1.00 10.00 H new ATOM 0 HG21 THR A 141 15.020 -5.112 -0.494 1.00 10.00 H new ATOM 0 HG22 THR A 141 14.052 -6.131 0.597 1.00 10.00 H new ATOM 0 HG23 THR A 141 14.203 -6.562 -1.123 1.00 10.00 H new ATOM 2076 N VAL A 142 11.395 -6.996 1.483 1.00 10.00 N ATOM 2077 CA VAL A 142 11.023 -7.166 2.883 1.00 10.00 C ATOM 2078 C VAL A 142 12.247 -6.811 3.731 1.00 10.00 C ATOM 2079 O VAL A 142 13.256 -7.510 3.652 1.00 10.00 O ATOM 2080 CB VAL A 142 10.528 -8.600 3.122 1.00 10.00 C ATOM 2081 CG1 VAL A 142 10.103 -8.786 4.585 1.00 10.00 C ATOM 2082 CG2 VAL A 142 9.334 -8.924 2.213 1.00 10.00 C ATOM 0 H VAL A 142 11.861 -7.805 1.072 1.00 10.00 H new ATOM 0 HA VAL A 142 10.200 -6.509 3.164 1.00 10.00 H new ATOM 0 HB VAL A 142 11.351 -9.276 2.891 1.00 10.00 H new ATOM 0 HG11 VAL A 142 9.755 -9.808 4.736 1.00 10.00 H new ATOM 0 HG12 VAL A 142 10.954 -8.592 5.238 1.00 10.00 H new ATOM 0 HG13 VAL A 142 9.298 -8.090 4.821 1.00 10.00 H new ATOM 0 HG21 VAL A 142 9.001 -9.945 2.400 1.00 10.00 H new ATOM 0 HG22 VAL A 142 8.519 -8.232 2.423 1.00 10.00 H new ATOM 0 HG23 VAL A 142 9.634 -8.826 1.170 1.00 10.00 H new ATOM 2092 N LYS A 143 12.198 -5.713 4.494 1.00 10.00 N ATOM 2093 CA LYS A 143 13.330 -5.198 5.262 1.00 10.00 C ATOM 2094 C LYS A 143 12.819 -4.510 6.530 1.00 10.00 C ATOM 2095 O LYS A 143 12.257 -3.422 6.439 1.00 10.00 O ATOM 2096 CB LYS A 143 14.120 -4.166 4.437 1.00 10.00 C ATOM 2097 CG LYS A 143 14.819 -4.686 3.173 1.00 10.00 C ATOM 2098 CD LYS A 143 16.067 -5.539 3.456 1.00 10.00 C ATOM 2099 CE LYS A 143 17.372 -4.722 3.452 1.00 10.00 C ATOM 2100 NZ LYS A 143 17.371 -3.614 4.428 1.00 10.00 N ATOM 0 H LYS A 143 11.354 -5.150 4.595 1.00 10.00 H new ATOM 0 HA LYS A 143 13.979 -6.036 5.516 1.00 10.00 H new ATOM 0 HB2 LYS A 143 13.437 -3.368 4.145 1.00 10.00 H new ATOM 0 HB3 LYS A 143 14.875 -3.718 5.084 1.00 10.00 H new ATOM 0 HG2 LYS A 143 14.110 -5.279 2.595 1.00 10.00 H new ATOM 0 HG3 LYS A 143 15.105 -3.837 2.552 1.00 10.00 H new ATOM 0 HD2 LYS A 143 15.954 -6.027 4.424 1.00 10.00 H new ATOM 0 HD3 LYS A 143 16.137 -6.328 2.708 1.00 10.00 H new ATOM 0 HE2 LYS A 143 18.209 -5.386 3.668 1.00 10.00 H new ATOM 0 HE3 LYS A 143 17.536 -4.317 2.453 1.00 10.00 H new ATOM 0 HZ1 LYS A 143 18.305 -3.157 4.436 1.00 10.00 H new ATOM 0 HZ2 LYS A 143 16.647 -2.917 4.161 1.00 10.00 H new ATOM 0 HZ3 LYS A 143 17.160 -3.986 5.376 1.00 10.00 H new ATOM 2114 N LYS A 144 13.011 -5.131 7.700 1.00 10.00 N ATOM 2115 CA LYS A 144 12.526 -4.619 8.980 1.00 10.00 C ATOM 2116 C LYS A 144 13.609 -3.903 9.786 1.00 10.00 C ATOM 2117 O LYS A 144 14.754 -3.808 9.353 1.00 10.00 O ATOM 2118 CB LYS A 144 11.905 -5.773 9.786 1.00 10.00 C ATOM 2119 CG LYS A 144 12.944 -6.784 10.310 1.00 10.00 C ATOM 2120 CD LYS A 144 12.320 -7.941 11.111 1.00 10.00 C ATOM 2121 CE LYS A 144 11.655 -7.525 12.433 1.00 10.00 C ATOM 2122 NZ LYS A 144 12.632 -7.035 13.429 1.00 10.00 N ATOM 0 H LYS A 144 13.514 -6.014 7.782 1.00 10.00 H new ATOM 0 HA LYS A 144 11.767 -3.866 8.771 1.00 10.00 H new ATOM 0 HB2 LYS A 144 11.353 -5.360 10.630 1.00 10.00 H new ATOM 0 HB3 LYS A 144 11.184 -6.297 9.159 1.00 10.00 H new ATOM 0 HG2 LYS A 144 13.499 -7.194 9.466 1.00 10.00 H new ATOM 0 HG3 LYS A 144 13.663 -6.261 10.941 1.00 10.00 H new ATOM 0 HD2 LYS A 144 11.577 -8.437 10.487 1.00 10.00 H new ATOM 0 HD3 LYS A 144 13.096 -8.675 11.326 1.00 10.00 H new ATOM 0 HE2 LYS A 144 10.919 -6.745 12.236 1.00 10.00 H new ATOM 0 HE3 LYS A 144 11.114 -8.376 12.847 1.00 10.00 H new ATOM 0 HZ1 LYS A 144 12.134 -6.767 14.302 1.00 10.00 H new ATOM 0 HZ2 LYS A 144 13.320 -7.786 13.639 1.00 10.00 H new ATOM 0 HZ3 LYS A 144 13.131 -6.206 13.047 1.00 10.00 H new