USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 911 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 131 LYS NZ :NH3+ 165:sc= 0 (180deg=0) USER MOD Set 1.2: A 134 LYS NZ :NH3+ -153:sc= -0.206 (180deg=-1.07) USER MOD Set 2.1: A 129 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 85 LYS NZ :NH3+ 161:sc= -0.0343 (180deg=-0.488) USER MOD Set 3.2: A 118 ASN : amide:sc= -0.0479 K(o=-0.082,f=-1.8!) USER MOD Set 4.1: A 87 SER OG : rot 180:sc= 0.334 USER MOD Set 4.2: A 90 ASN : amide:sc= -4.56! K(o=-4.2!,f=-3.2) USER MOD Set 5.1: A 65 ASN : amide:sc= -0.841 K(o=-0.84,f=-2.5!) USER MOD Set 5.2: A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -3.64! C(o=-3.6!,f=-6.3!) USER MOD Single : A 30 MET CE :methyl -143:sc= -0.192 (180deg=-1.36!) USER MOD Single : A 35 LYS NZ :NH3+ -157:sc= -0.0755 (180deg=-0.677) USER MOD Single : A 39 ASN : amide:sc= -3.35! C(o=-3.3!,f=-6.7!) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot -90:sc= -3.49! USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 160:sc= -0.0479 (180deg=-0.503) USER MOD Single : A 51 SER OG : rot -78:sc= 0.974 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 153:sc= -0.886 (180deg=-1.89!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot -52:sc= -1.07! USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 66 HIS : no HD1:sc= -1.21 K(o=-1.2,f=-0.059) USER MOD Single : A 83 ASN : amide:sc= -10.2! C(o=-10!,f=-5.1!) USER MOD Single : A 88 LYS NZ :NH3+ 162:sc= -0.0181 (180deg=-0.428) USER MOD Single : A 97 ASN : amide:sc= -3.94! C(o=-3.9!,f=-2!) USER MOD Single : A 98 LYS NZ :NH3+ -145:sc= -1.13 (180deg=-1.26) USER MOD Single : A 101 LYS NZ :NH3+ 158:sc= -0.104 (180deg=-0.613) USER MOD Single : A 105 LYS NZ :NH3+ -137:sc= -0.857 (180deg=-3.29!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 TYR OH : rot 104:sc= -2.08! USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -1.44 K(o=-1.4,f=-4.3!) USER MOD Single : A 124 HIS : no HD1:sc= -1.49 X(o=-1.5,f=-1.9) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 CYS SG : rot 128:sc= -2.67! USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ -158:sc= -0.0862 (180deg=-0.605) USER MOD ----------------------------------------------------------------- ATOM 409 N ARG A 24 16.676 4.265 2.462 1.00 0.00 N ATOM 410 CA ARG A 24 17.262 3.059 1.888 1.00 0.00 C ATOM 411 C ARG A 24 18.740 2.949 2.250 1.00 0.00 C ATOM 412 O ARG A 24 19.226 1.867 2.580 1.00 0.00 O ATOM 413 CB ARG A 24 17.109 3.078 0.367 1.00 0.00 C ATOM 414 CG ARG A 24 17.660 1.777 -0.218 1.00 0.00 C ATOM 415 CD ARG A 24 19.131 1.968 -0.593 1.00 0.00 C ATOM 416 NE ARG A 24 19.642 0.774 -1.256 1.00 0.00 N ATOM 417 CZ ARG A 24 20.903 0.705 -1.669 1.00 0.00 C ATOM 418 NH1 ARG A 24 21.707 1.716 -1.486 1.00 0.00 N ATOM 419 NH2 ARG A 24 21.337 -0.375 -2.260 1.00 0.00 N ATOM 0 HA ARG A 24 16.737 2.196 2.298 1.00 0.00 H new ATOM 0 HB2 ARG A 24 16.059 3.194 0.098 1.00 0.00 H new ATOM 0 HB3 ARG A 24 17.642 3.932 -0.052 1.00 0.00 H new ATOM 0 HG2 ARG A 24 17.561 0.969 0.507 1.00 0.00 H new ATOM 0 HG3 ARG A 24 17.084 1.489 -1.097 1.00 0.00 H new ATOM 0 HD2 ARG A 24 19.237 2.831 -1.250 1.00 0.00 H new ATOM 0 HD3 ARG A 24 19.718 2.175 0.302 1.00 0.00 H new ATOM 0 HE ARG A 24 19.021 -0.021 -1.405 1.00 0.00 H new ATOM 0 HH11 ARG A 24 21.368 2.561 -1.025 1.00 0.00 H new ATOM 0 HH12 ARG A 24 22.675 1.662 -1.803 1.00 0.00 H new ATOM 0 HH21 ARG A 24 20.708 -1.165 -2.404 1.00 0.00 H new ATOM 0 HH22 ARG A 24 22.305 -0.429 -2.577 1.00 0.00 H new ATOM 433 N GLU A 25 19.451 4.068 2.180 1.00 0.00 N ATOM 434 CA GLU A 25 20.874 4.073 2.498 1.00 0.00 C ATOM 435 C GLU A 25 21.103 3.624 3.937 1.00 0.00 C ATOM 436 O GLU A 25 21.997 2.824 4.213 1.00 0.00 O ATOM 437 CB GLU A 25 21.449 5.477 2.301 1.00 0.00 C ATOM 438 CG GLU A 25 22.941 5.469 2.638 1.00 0.00 C ATOM 439 CD GLU A 25 23.687 4.546 1.679 1.00 0.00 C ATOM 440 OE1 GLU A 25 23.146 4.258 0.625 1.00 0.00 O ATOM 441 OE2 GLU A 25 24.787 4.141 2.015 1.00 0.00 O ATOM 0 H GLU A 25 19.071 4.975 1.909 1.00 0.00 H new ATOM 0 HA GLU A 25 21.379 3.377 1.828 1.00 0.00 H new ATOM 0 HB2 GLU A 25 21.300 5.802 1.271 1.00 0.00 H new ATOM 0 HB3 GLU A 25 20.925 6.189 2.939 1.00 0.00 H new ATOM 0 HG2 GLU A 25 23.343 6.480 2.570 1.00 0.00 H new ATOM 0 HG3 GLU A 25 23.089 5.136 3.665 1.00 0.00 H new ATOM 448 N TYR A 26 20.291 4.137 4.854 1.00 0.00 N ATOM 449 CA TYR A 26 20.422 3.767 6.257 1.00 0.00 C ATOM 450 C TYR A 26 19.999 2.316 6.473 1.00 0.00 C ATOM 451 O TYR A 26 20.620 1.588 7.248 1.00 0.00 O ATOM 452 CB TYR A 26 19.562 4.685 7.126 1.00 0.00 C ATOM 453 CG TYR A 26 20.187 6.058 7.179 1.00 0.00 C ATOM 454 CD1 TYR A 26 19.831 7.028 6.235 1.00 0.00 C ATOM 455 CD2 TYR A 26 21.122 6.360 8.177 1.00 0.00 C ATOM 456 CE1 TYR A 26 20.414 8.301 6.287 1.00 0.00 C ATOM 457 CE2 TYR A 26 21.703 7.633 8.228 1.00 0.00 C ATOM 458 CZ TYR A 26 21.349 8.603 7.284 1.00 0.00 C ATOM 459 OH TYR A 26 21.923 9.857 7.337 1.00 0.00 O ATOM 0 H TYR A 26 19.544 4.802 4.655 1.00 0.00 H new ATOM 0 HA TYR A 26 21.469 3.875 6.542 1.00 0.00 H new ATOM 0 HB2 TYR A 26 18.553 4.749 6.719 1.00 0.00 H new ATOM 0 HB3 TYR A 26 19.475 4.274 8.132 1.00 0.00 H new ATOM 0 HD1 TYR A 26 19.108 6.796 5.467 1.00 0.00 H new ATOM 0 HD2 TYR A 26 21.395 5.612 8.907 1.00 0.00 H new ATOM 0 HE1 TYR A 26 20.142 9.050 5.558 1.00 0.00 H new ATOM 0 HE2 TYR A 26 22.425 7.866 8.997 1.00 0.00 H new ATOM 0 HH TYR A 26 22.549 9.899 8.090 1.00 0.00 H new ATOM 469 N ALA A 27 18.935 1.904 5.789 1.00 0.00 N ATOM 470 CA ALA A 27 18.436 0.538 5.922 1.00 0.00 C ATOM 471 C ALA A 27 19.478 -0.476 5.458 1.00 0.00 C ATOM 472 O ALA A 27 19.700 -1.494 6.114 1.00 0.00 O ATOM 473 CB ALA A 27 17.158 0.369 5.098 1.00 0.00 C ATOM 0 H ALA A 27 18.406 2.490 5.143 1.00 0.00 H new ATOM 0 HA ALA A 27 18.223 0.357 6.975 1.00 0.00 H new ATOM 0 HB1 ALA A 27 16.791 -0.652 5.201 1.00 0.00 H new ATOM 0 HB2 ALA A 27 16.400 1.065 5.456 1.00 0.00 H new ATOM 0 HB3 ALA A 27 17.372 0.573 4.049 1.00 0.00 H new ATOM 479 N GLN A 28 20.119 -0.193 4.328 1.00 0.00 N ATOM 480 CA GLN A 28 21.136 -1.095 3.799 1.00 0.00 C ATOM 481 C GLN A 28 22.411 -1.007 4.630 1.00 0.00 C ATOM 482 O GLN A 28 23.196 -1.953 4.683 1.00 0.00 O ATOM 483 CB GLN A 28 21.443 -0.752 2.338 1.00 0.00 C ATOM 484 CG GLN A 28 22.092 0.629 2.257 1.00 0.00 C ATOM 485 CD GLN A 28 23.574 0.531 2.604 1.00 0.00 C ATOM 486 OE1 GLN A 28 24.196 -0.509 2.388 1.00 0.00 O ATOM 487 NE2 GLN A 28 24.180 1.559 3.131 1.00 0.00 N ATOM 0 H GLN A 28 19.955 0.643 3.767 1.00 0.00 H new ATOM 0 HA GLN A 28 20.752 -2.114 3.851 1.00 0.00 H new ATOM 0 HB2 GLN A 28 22.108 -1.502 1.911 1.00 0.00 H new ATOM 0 HB3 GLN A 28 20.525 -0.768 1.750 1.00 0.00 H new ATOM 0 HG2 GLN A 28 21.971 1.038 1.254 1.00 0.00 H new ATOM 0 HG3 GLN A 28 21.594 1.314 2.943 1.00 0.00 H new ATOM 0 HE21 GLN A 28 23.663 2.420 3.309 1.00 0.00 H new ATOM 0 HE22 GLN A 28 25.171 1.502 3.365 1.00 0.00 H new ATOM 496 N GLU A 29 22.607 0.136 5.280 1.00 0.00 N ATOM 497 CA GLU A 29 23.787 0.338 6.110 1.00 0.00 C ATOM 498 C GLU A 29 23.811 -0.663 7.259 1.00 0.00 C ATOM 499 O GLU A 29 24.854 -1.235 7.575 1.00 0.00 O ATOM 500 CB GLU A 29 23.795 1.761 6.671 1.00 0.00 C ATOM 501 CG GLU A 29 25.036 1.960 7.543 1.00 0.00 C ATOM 502 CD GLU A 29 26.296 1.805 6.699 1.00 0.00 C ATOM 503 OE1 GLU A 29 26.194 1.928 5.490 1.00 0.00 O ATOM 504 OE2 GLU A 29 27.345 1.567 7.274 1.00 0.00 O ATOM 0 H GLU A 29 21.968 0.931 5.248 1.00 0.00 H new ATOM 0 HA GLU A 29 24.672 0.187 5.492 1.00 0.00 H new ATOM 0 HB2 GLU A 29 23.791 2.484 5.856 1.00 0.00 H new ATOM 0 HB3 GLU A 29 22.893 1.937 7.258 1.00 0.00 H new ATOM 0 HG2 GLU A 29 25.014 2.949 8.001 1.00 0.00 H new ATOM 0 HG3 GLU A 29 25.040 1.233 8.355 1.00 0.00 H new ATOM 511 N MET A 30 22.654 -0.871 7.880 1.00 0.00 N ATOM 512 CA MET A 30 22.557 -1.806 8.994 1.00 0.00 C ATOM 513 C MET A 30 22.888 -3.223 8.533 1.00 0.00 C ATOM 514 O MET A 30 23.566 -3.970 9.238 1.00 0.00 O ATOM 515 CB MET A 30 21.144 -1.775 9.579 1.00 0.00 C ATOM 516 CG MET A 30 20.910 -0.433 10.276 1.00 0.00 C ATOM 517 SD MET A 30 22.158 -0.196 11.566 1.00 0.00 S ATOM 518 CE MET A 30 21.665 -1.584 12.617 1.00 0.00 C ATOM 0 H MET A 30 21.779 -0.409 7.633 1.00 0.00 H new ATOM 0 HA MET A 30 23.274 -1.508 9.759 1.00 0.00 H new ATOM 0 HB2 MET A 30 20.408 -1.919 8.788 1.00 0.00 H new ATOM 0 HB3 MET A 30 21.014 -2.593 10.288 1.00 0.00 H new ATOM 0 HG2 MET A 30 20.962 0.379 9.551 1.00 0.00 H new ATOM 0 HG3 MET A 30 19.911 -0.407 10.712 1.00 0.00 H new ATOM 0 HE1 MET A 30 21.776 -1.305 13.665 1.00 0.00 H new ATOM 0 HE2 MET A 30 20.624 -1.839 12.418 1.00 0.00 H new ATOM 0 HE3 MET A 30 22.297 -2.446 12.402 1.00 0.00 H new ATOM 528 N ASP A 31 22.408 -3.584 7.348 1.00 0.00 N ATOM 529 CA ASP A 31 22.666 -4.913 6.808 1.00 0.00 C ATOM 530 C ASP A 31 24.163 -5.124 6.606 1.00 0.00 C ATOM 531 O ASP A 31 24.693 -6.198 6.891 1.00 0.00 O ATOM 532 CB ASP A 31 21.940 -5.087 5.473 1.00 0.00 C ATOM 533 CG ASP A 31 20.437 -5.196 5.707 1.00 0.00 C ATOM 534 OD1 ASP A 31 20.048 -5.385 6.848 1.00 0.00 O ATOM 535 OD2 ASP A 31 19.698 -5.090 4.742 1.00 0.00 O ATOM 0 H ASP A 31 21.844 -2.982 6.749 1.00 0.00 H new ATOM 0 HA ASP A 31 22.297 -5.652 7.519 1.00 0.00 H new ATOM 0 HB2 ASP A 31 22.154 -4.241 4.820 1.00 0.00 H new ATOM 0 HB3 ASP A 31 22.303 -5.981 4.966 1.00 0.00 H new ATOM 540 N ARG A 32 24.839 -4.090 6.119 1.00 0.00 N ATOM 541 CA ARG A 32 26.278 -4.169 5.889 1.00 0.00 C ATOM 542 C ARG A 32 27.013 -4.425 7.200 1.00 0.00 C ATOM 543 O ARG A 32 27.920 -5.255 7.264 1.00 0.00 O ATOM 544 CB ARG A 32 26.779 -2.867 5.263 1.00 0.00 C ATOM 545 CG ARG A 32 28.285 -2.970 5.010 1.00 0.00 C ATOM 546 CD ARG A 32 29.045 -2.403 6.210 1.00 0.00 C ATOM 547 NE ARG A 32 30.481 -2.439 5.960 1.00 0.00 N ATOM 548 CZ ARG A 32 31.093 -1.442 5.328 1.00 0.00 C ATOM 549 NH1 ARG A 32 30.407 -0.410 4.919 1.00 0.00 N ATOM 550 NH2 ARG A 32 32.379 -1.497 5.116 1.00 0.00 N ATOM 0 H ARG A 32 24.418 -3.193 5.877 1.00 0.00 H new ATOM 0 HA ARG A 32 26.476 -4.996 5.207 1.00 0.00 H new ATOM 0 HB2 ARG A 32 26.254 -2.675 4.327 1.00 0.00 H new ATOM 0 HB3 ARG A 32 26.567 -2.027 5.925 1.00 0.00 H new ATOM 0 HG2 ARG A 32 28.567 -4.010 4.847 1.00 0.00 H new ATOM 0 HG3 ARG A 32 28.551 -2.422 4.106 1.00 0.00 H new ATOM 0 HD2 ARG A 32 28.727 -1.378 6.399 1.00 0.00 H new ATOM 0 HD3 ARG A 32 28.810 -2.980 7.104 1.00 0.00 H new ATOM 0 HE ARG A 32 31.025 -3.242 6.275 1.00 0.00 H new ATOM 0 HH11 ARG A 32 29.401 -0.368 5.084 1.00 0.00 H new ATOM 0 HH12 ARG A 32 30.876 0.355 4.434 1.00 0.00 H new ATOM 0 HH21 ARG A 32 32.914 -2.304 5.435 1.00 0.00 H new ATOM 0 HH22 ARG A 32 32.849 -0.733 4.631 1.00 0.00 H new ATOM 564 N LEU A 33 26.613 -3.703 8.242 1.00 0.00 N ATOM 565 CA LEU A 33 27.237 -3.854 9.550 1.00 0.00 C ATOM 566 C LEU A 33 27.048 -5.273 10.075 1.00 0.00 C ATOM 567 O LEU A 33 27.984 -5.886 10.590 1.00 0.00 O ATOM 568 CB LEU A 33 26.626 -2.856 10.535 1.00 0.00 C ATOM 569 CG LEU A 33 27.274 -3.031 11.908 1.00 0.00 C ATOM 570 CD1 LEU A 33 28.775 -2.756 11.802 1.00 0.00 C ATOM 571 CD2 LEU A 33 26.646 -2.047 12.898 1.00 0.00 C ATOM 0 H LEU A 33 25.864 -3.012 8.206 1.00 0.00 H new ATOM 0 HA LEU A 33 28.304 -3.658 9.448 1.00 0.00 H new ATOM 0 HB2 LEU A 33 26.777 -1.837 10.177 1.00 0.00 H new ATOM 0 HB3 LEU A 33 25.550 -3.013 10.607 1.00 0.00 H new ATOM 0 HG LEU A 33 27.114 -4.051 12.257 1.00 0.00 H new ATOM 0 HD11 LEU A 33 29.238 -2.881 12.781 1.00 0.00 H new ATOM 0 HD12 LEU A 33 29.224 -3.455 11.097 1.00 0.00 H new ATOM 0 HD13 LEU A 33 28.934 -1.736 11.453 1.00 0.00 H new ATOM 0 HD21 LEU A 33 27.108 -2.172 13.877 1.00 0.00 H new ATOM 0 HD22 LEU A 33 26.806 -1.027 12.548 1.00 0.00 H new ATOM 0 HD23 LEU A 33 25.576 -2.241 12.974 1.00 0.00 H new ATOM 583 N GLU A 34 25.830 -5.790 9.941 1.00 0.00 N ATOM 584 CA GLU A 34 25.528 -7.139 10.406 1.00 0.00 C ATOM 585 C GLU A 34 26.354 -8.168 9.642 1.00 0.00 C ATOM 586 O GLU A 34 26.836 -9.144 10.218 1.00 0.00 O ATOM 587 CB GLU A 34 24.038 -7.434 10.215 1.00 0.00 C ATOM 588 CG GLU A 34 23.221 -6.600 11.202 1.00 0.00 C ATOM 589 CD GLU A 34 21.733 -6.760 10.912 1.00 0.00 C ATOM 590 OE1 GLU A 34 21.407 -7.310 9.873 1.00 0.00 O ATOM 591 OE2 GLU A 34 20.940 -6.331 11.735 1.00 0.00 O ATOM 0 H GLU A 34 25.042 -5.300 9.518 1.00 0.00 H new ATOM 0 HA GLU A 34 25.780 -7.203 11.465 1.00 0.00 H new ATOM 0 HB2 GLU A 34 23.739 -7.203 9.193 1.00 0.00 H new ATOM 0 HB3 GLU A 34 23.844 -8.495 10.371 1.00 0.00 H new ATOM 0 HG2 GLU A 34 23.437 -6.915 12.223 1.00 0.00 H new ATOM 0 HG3 GLU A 34 23.504 -5.550 11.126 1.00 0.00 H new ATOM 598 N LYS A 35 26.514 -7.943 8.343 1.00 0.00 N ATOM 599 CA LYS A 35 27.283 -8.858 7.506 1.00 0.00 C ATOM 600 C LYS A 35 28.726 -8.950 7.996 1.00 0.00 C ATOM 601 O LYS A 35 29.294 -10.038 8.077 1.00 0.00 O ATOM 602 CB LYS A 35 27.265 -8.375 6.055 1.00 0.00 C ATOM 603 CG LYS A 35 28.047 -9.359 5.180 1.00 0.00 C ATOM 604 CD LYS A 35 28.026 -8.878 3.728 1.00 0.00 C ATOM 605 CE LYS A 35 26.590 -8.900 3.204 1.00 0.00 C ATOM 606 NZ LYS A 35 26.075 -10.298 3.222 1.00 0.00 N ATOM 0 H LYS A 35 26.125 -7.140 7.848 1.00 0.00 H new ATOM 0 HA LYS A 35 26.828 -9.847 7.567 1.00 0.00 H new ATOM 0 HB2 LYS A 35 26.238 -8.293 5.700 1.00 0.00 H new ATOM 0 HB3 LYS A 35 27.706 -7.381 5.986 1.00 0.00 H new ATOM 0 HG2 LYS A 35 29.075 -9.439 5.533 1.00 0.00 H new ATOM 0 HG3 LYS A 35 27.608 -10.354 5.251 1.00 0.00 H new ATOM 0 HD2 LYS A 35 28.433 -7.869 3.662 1.00 0.00 H new ATOM 0 HD3 LYS A 35 28.659 -9.518 3.113 1.00 0.00 H new ATOM 0 HE2 LYS A 35 25.957 -8.260 3.819 1.00 0.00 H new ATOM 0 HE3 LYS A 35 26.556 -8.502 2.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 25.297 -10.390 2.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 26.841 -10.953 2.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 25.727 -10.528 4.175 1.00 0.00 H new ATOM 620 N ALA A 36 29.310 -7.801 8.318 1.00 0.00 N ATOM 621 CA ALA A 36 30.687 -7.765 8.798 1.00 0.00 C ATOM 622 C ALA A 36 30.824 -8.559 10.092 1.00 0.00 C ATOM 623 O ALA A 36 31.809 -9.269 10.294 1.00 0.00 O ATOM 624 CB ALA A 36 31.117 -6.317 9.037 1.00 0.00 C ATOM 0 H ALA A 36 28.856 -6.889 8.256 1.00 0.00 H new ATOM 0 HA ALA A 36 31.329 -8.215 8.040 1.00 0.00 H new ATOM 0 HB1 ALA A 36 32.146 -6.298 9.395 1.00 0.00 H new ATOM 0 HB2 ALA A 36 31.047 -5.758 8.104 1.00 0.00 H new ATOM 0 HB3 ALA A 36 30.465 -5.862 9.782 1.00 0.00 H new ATOM 630 N PHE A 37 29.829 -8.435 10.965 1.00 0.00 N ATOM 631 CA PHE A 37 29.845 -9.144 12.241 1.00 0.00 C ATOM 632 C PHE A 37 29.754 -10.651 12.031 1.00 0.00 C ATOM 633 O PHE A 37 30.353 -11.427 12.775 1.00 0.00 O ATOM 634 CB PHE A 37 28.686 -8.674 13.120 1.00 0.00 C ATOM 635 CG PHE A 37 29.047 -7.351 13.746 1.00 0.00 C ATOM 636 CD1 PHE A 37 28.423 -6.174 13.316 1.00 0.00 C ATOM 637 CD2 PHE A 37 30.013 -7.301 14.757 1.00 0.00 C ATOM 638 CE1 PHE A 37 28.765 -4.949 13.899 1.00 0.00 C ATOM 639 CE2 PHE A 37 30.356 -6.076 15.338 1.00 0.00 C ATOM 640 CZ PHE A 37 29.732 -4.899 14.910 1.00 0.00 C ATOM 0 H PHE A 37 29.005 -7.853 10.814 1.00 0.00 H new ATOM 0 HA PHE A 37 30.789 -8.921 12.738 1.00 0.00 H new ATOM 0 HB2 PHE A 37 27.779 -8.573 12.524 1.00 0.00 H new ATOM 0 HB3 PHE A 37 28.478 -9.412 13.894 1.00 0.00 H new ATOM 0 HD1 PHE A 37 27.678 -6.212 12.535 1.00 0.00 H new ATOM 0 HD2 PHE A 37 30.494 -8.209 15.089 1.00 0.00 H new ATOM 0 HE1 PHE A 37 28.282 -4.041 13.569 1.00 0.00 H new ATOM 0 HE2 PHE A 37 31.103 -6.038 16.117 1.00 0.00 H new ATOM 0 HZ PHE A 37 29.996 -3.953 15.359 1.00 0.00 H new ATOM 650 N GLU A 38 29.000 -11.060 11.018 1.00 0.00 N ATOM 651 CA GLU A 38 28.841 -12.480 10.729 1.00 0.00 C ATOM 652 C GLU A 38 30.198 -13.110 10.429 1.00 0.00 C ATOM 653 O GLU A 38 30.479 -14.232 10.851 1.00 0.00 O ATOM 654 CB GLU A 38 27.900 -12.669 9.538 1.00 0.00 C ATOM 655 CG GLU A 38 27.542 -14.150 9.398 1.00 0.00 C ATOM 656 CD GLU A 38 28.632 -14.877 8.621 1.00 0.00 C ATOM 657 OE1 GLU A 38 29.278 -14.237 7.810 1.00 0.00 O ATOM 658 OE2 GLU A 38 28.800 -16.065 8.844 1.00 0.00 O ATOM 0 H GLU A 38 28.494 -10.437 10.389 1.00 0.00 H new ATOM 0 HA GLU A 38 28.411 -12.971 11.602 1.00 0.00 H new ATOM 0 HB2 GLU A 38 26.995 -12.077 9.679 1.00 0.00 H new ATOM 0 HB3 GLU A 38 28.376 -12.311 8.625 1.00 0.00 H new ATOM 0 HG2 GLU A 38 27.425 -14.599 10.384 1.00 0.00 H new ATOM 0 HG3 GLU A 38 26.586 -14.255 8.885 1.00 0.00 H new ATOM 665 N ASN A 39 31.040 -12.377 9.706 1.00 0.00 N ATOM 666 CA ASN A 39 32.372 -12.868 9.364 1.00 0.00 C ATOM 667 C ASN A 39 33.415 -12.307 10.326 1.00 0.00 C ATOM 668 O ASN A 39 34.617 -12.469 10.115 1.00 0.00 O ATOM 669 CB ASN A 39 32.731 -12.464 7.932 1.00 0.00 C ATOM 670 CG ASN A 39 31.895 -13.261 6.938 1.00 0.00 C ATOM 671 OD1 ASN A 39 31.420 -14.350 7.260 1.00 0.00 O ATOM 672 ND2 ASN A 39 31.684 -12.782 5.743 1.00 0.00 N ATOM 0 H ASN A 39 30.826 -11.446 9.347 1.00 0.00 H new ATOM 0 HA ASN A 39 32.365 -13.955 9.444 1.00 0.00 H new ATOM 0 HB2 ASN A 39 32.557 -11.397 7.792 1.00 0.00 H new ATOM 0 HB3 ASN A 39 33.791 -12.640 7.751 1.00 0.00 H new ATOM 0 HD21 ASN A 39 31.124 -13.310 5.073 1.00 0.00 H new ATOM 0 HD22 ASN A 39 32.079 -11.879 5.478 1.00 0.00 H new ATOM 679 N LEU A 40 32.949 -11.645 11.381 1.00 0.00 N ATOM 680 CA LEU A 40 33.856 -11.064 12.365 1.00 0.00 C ATOM 681 C LEU A 40 33.874 -11.896 13.642 1.00 0.00 C ATOM 682 O LEU A 40 33.188 -11.579 14.613 1.00 0.00 O ATOM 683 CB LEU A 40 33.421 -9.636 12.698 1.00 0.00 C ATOM 684 CG LEU A 40 34.472 -8.648 12.191 1.00 0.00 C ATOM 685 CD1 LEU A 40 35.836 -9.001 12.787 1.00 0.00 C ATOM 686 CD2 LEU A 40 34.549 -8.726 10.665 1.00 0.00 C ATOM 0 H LEU A 40 31.958 -11.498 11.575 1.00 0.00 H new ATOM 0 HA LEU A 40 34.859 -11.052 11.938 1.00 0.00 H new ATOM 0 HB2 LEU A 40 32.456 -9.423 12.239 1.00 0.00 H new ATOM 0 HB3 LEU A 40 33.293 -9.526 13.775 1.00 0.00 H new ATOM 0 HG LEU A 40 34.195 -7.638 12.492 1.00 0.00 H new ATOM 0 HD11 LEU A 40 36.585 -8.296 12.425 1.00 0.00 H new ATOM 0 HD12 LEU A 40 35.783 -8.947 13.874 1.00 0.00 H new ATOM 0 HD13 LEU A 40 36.114 -10.011 12.487 1.00 0.00 H new ATOM 0 HD21 LEU A 40 35.298 -8.022 10.302 1.00 0.00 H new ATOM 0 HD22 LEU A 40 34.826 -9.737 10.366 1.00 0.00 H new ATOM 0 HD23 LEU A 40 33.578 -8.475 10.238 1.00 0.00 H new ATOM 698 N ASP A 41 34.670 -12.959 13.636 1.00 0.00 N ATOM 699 CA ASP A 41 34.778 -13.827 14.802 1.00 0.00 C ATOM 700 C ASP A 41 35.373 -13.064 15.981 1.00 0.00 C ATOM 701 O ASP A 41 36.280 -12.249 15.810 1.00 0.00 O ATOM 702 CB ASP A 41 35.661 -15.034 14.476 1.00 0.00 C ATOM 703 CG ASP A 41 34.923 -15.980 13.534 1.00 0.00 C ATOM 704 OD1 ASP A 41 33.725 -15.811 13.374 1.00 0.00 O ATOM 705 OD2 ASP A 41 35.566 -16.861 12.986 1.00 0.00 O ATOM 0 H ASP A 41 35.246 -13.239 12.842 1.00 0.00 H new ATOM 0 HA ASP A 41 33.779 -14.171 15.070 1.00 0.00 H new ATOM 0 HB2 ASP A 41 36.591 -14.701 14.015 1.00 0.00 H new ATOM 0 HB3 ASP A 41 35.929 -15.557 15.394 1.00 0.00 H new ATOM 710 N GLY A 42 34.863 -13.334 17.178 1.00 0.00 N ATOM 711 CA GLY A 42 35.359 -12.666 18.377 1.00 0.00 C ATOM 712 C GLY A 42 34.557 -11.406 18.690 1.00 0.00 C ATOM 713 O GLY A 42 34.776 -10.767 19.719 1.00 0.00 O ATOM 0 H GLY A 42 34.113 -14.005 17.344 1.00 0.00 H new ATOM 0 HA2 GLY A 42 35.307 -13.351 19.224 1.00 0.00 H new ATOM 0 HA3 GLY A 42 36.409 -12.406 18.241 1.00 0.00 H new ATOM 717 N TRP A 43 33.623 -11.055 17.811 1.00 0.00 N ATOM 718 CA TRP A 43 32.802 -9.867 18.023 1.00 0.00 C ATOM 719 C TRP A 43 31.337 -10.256 18.179 1.00 0.00 C ATOM 720 O TRP A 43 30.838 -11.132 17.474 1.00 0.00 O ATOM 721 CB TRP A 43 32.944 -8.909 16.840 1.00 0.00 C ATOM 722 CG TRP A 43 34.314 -8.312 16.836 1.00 0.00 C ATOM 723 CD1 TRP A 43 35.376 -8.804 16.159 1.00 0.00 C ATOM 724 CD2 TRP A 43 34.784 -7.117 17.524 1.00 0.00 C ATOM 725 NE1 TRP A 43 36.469 -7.989 16.390 1.00 0.00 N ATOM 726 CE2 TRP A 43 36.155 -6.935 17.225 1.00 0.00 C ATOM 727 CE3 TRP A 43 34.161 -6.182 18.371 1.00 0.00 C ATOM 728 CZ2 TRP A 43 36.883 -5.865 17.747 1.00 0.00 C ATOM 729 CZ3 TRP A 43 34.890 -5.104 18.899 1.00 0.00 C ATOM 730 CH2 TRP A 43 36.248 -4.946 18.587 1.00 0.00 C ATOM 0 H TRP A 43 33.417 -11.569 16.955 1.00 0.00 H new ATOM 0 HA TRP A 43 33.143 -9.374 18.933 1.00 0.00 H new ATOM 0 HB2 TRP A 43 32.766 -9.441 15.906 1.00 0.00 H new ATOM 0 HB3 TRP A 43 32.194 -8.121 16.906 1.00 0.00 H new ATOM 0 HD1 TRP A 43 35.371 -9.689 15.539 1.00 0.00 H new ATOM 0 HE1 TRP A 43 37.395 -8.147 15.992 1.00 0.00 H new ATOM 0 HE3 TRP A 43 33.115 -6.294 18.617 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 37.929 -5.748 17.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 34.402 -4.393 19.549 1.00 0.00 H new ATOM 0 HH2 TRP A 43 36.803 -4.114 18.996 1.00 0.00 H new ATOM 741 N TYR A 44 30.663 -9.613 19.127 1.00 0.00 N ATOM 742 CA TYR A 44 29.262 -9.917 19.386 1.00 0.00 C ATOM 743 C TYR A 44 28.454 -8.634 19.557 1.00 0.00 C ATOM 744 O TYR A 44 28.966 -7.630 20.052 1.00 0.00 O ATOM 745 CB TYR A 44 29.178 -10.759 20.656 1.00 0.00 C ATOM 746 CG TYR A 44 30.031 -11.988 20.469 1.00 0.00 C ATOM 747 CD1 TYR A 44 31.408 -11.915 20.715 1.00 0.00 C ATOM 748 CD2 TYR A 44 29.457 -13.191 20.045 1.00 0.00 C ATOM 749 CE1 TYR A 44 32.213 -13.044 20.538 1.00 0.00 C ATOM 750 CE2 TYR A 44 30.263 -14.324 19.869 1.00 0.00 C ATOM 751 CZ TYR A 44 31.641 -14.250 20.115 1.00 0.00 C ATOM 752 OH TYR A 44 32.434 -15.366 19.938 1.00 0.00 O ATOM 0 H TYR A 44 31.060 -8.886 19.722 1.00 0.00 H new ATOM 0 HA TYR A 44 28.846 -10.466 18.541 1.00 0.00 H new ATOM 0 HB2 TYR A 44 29.524 -10.185 21.515 1.00 0.00 H new ATOM 0 HB3 TYR A 44 28.144 -11.041 20.856 1.00 0.00 H new ATOM 0 HD1 TYR A 44 31.849 -10.985 21.042 1.00 0.00 H new ATOM 0 HD2 TYR A 44 28.396 -13.247 19.854 1.00 0.00 H new ATOM 0 HE1 TYR A 44 33.275 -12.986 20.727 1.00 0.00 H new ATOM 0 HE2 TYR A 44 29.822 -15.255 19.544 1.00 0.00 H new ATOM 0 HH TYR A 44 31.879 -16.118 19.643 1.00 0.00 H new ATOM 762 N LEU A 45 27.191 -8.673 19.148 1.00 0.00 N ATOM 763 CA LEU A 45 26.326 -7.505 19.264 1.00 0.00 C ATOM 764 C LEU A 45 25.115 -7.814 20.139 1.00 0.00 C ATOM 765 O LEU A 45 24.581 -8.923 20.102 1.00 0.00 O ATOM 766 CB LEU A 45 25.856 -7.063 17.879 1.00 0.00 C ATOM 767 CG LEU A 45 27.058 -6.974 16.938 1.00 0.00 C ATOM 768 CD1 LEU A 45 27.200 -8.287 16.165 1.00 0.00 C ATOM 769 CD2 LEU A 45 26.846 -5.821 15.954 1.00 0.00 C ATOM 0 H LEU A 45 26.746 -9.493 18.736 1.00 0.00 H new ATOM 0 HA LEU A 45 26.898 -6.701 19.728 1.00 0.00 H new ATOM 0 HB2 LEU A 45 25.126 -7.771 17.488 1.00 0.00 H new ATOM 0 HB3 LEU A 45 25.359 -6.095 17.944 1.00 0.00 H new ATOM 0 HG LEU A 45 27.964 -6.797 17.518 1.00 0.00 H new ATOM 0 HD11 LEU A 45 28.057 -8.223 15.494 1.00 0.00 H new ATOM 0 HD12 LEU A 45 27.348 -9.108 16.866 1.00 0.00 H new ATOM 0 HD13 LEU A 45 26.296 -8.466 15.583 1.00 0.00 H new ATOM 0 HD21 LEU A 45 27.701 -5.755 15.282 1.00 0.00 H new ATOM 0 HD22 LEU A 45 25.941 -6.000 15.373 1.00 0.00 H new ATOM 0 HD23 LEU A 45 26.745 -4.886 16.505 1.00 0.00 H new ATOM 781 N SER A 46 24.681 -6.828 20.919 1.00 0.00 N ATOM 782 CA SER A 46 23.526 -7.018 21.789 1.00 0.00 C ATOM 783 C SER A 46 22.425 -6.016 21.448 1.00 0.00 C ATOM 784 O SER A 46 22.697 -4.848 21.162 1.00 0.00 O ATOM 785 CB SER A 46 23.940 -6.848 23.250 1.00 0.00 C ATOM 786 OG SER A 46 24.423 -5.528 23.449 1.00 0.00 O ATOM 0 H SER A 46 25.105 -5.902 20.967 1.00 0.00 H new ATOM 0 HA SER A 46 23.142 -8.026 21.636 1.00 0.00 H new ATOM 0 HB2 SER A 46 23.091 -7.040 23.906 1.00 0.00 H new ATOM 0 HB3 SER A 46 24.712 -7.573 23.508 1.00 0.00 H new ATOM 0 HG SER A 46 25.389 -5.505 23.287 1.00 0.00 H new ATOM 792 N SER A 47 21.183 -6.494 21.481 1.00 0.00 N ATOM 793 CA SER A 47 20.024 -5.656 21.178 1.00 0.00 C ATOM 794 C SER A 47 19.804 -4.590 22.248 1.00 0.00 C ATOM 795 O SER A 47 19.425 -3.459 21.940 1.00 0.00 O ATOM 796 CB SER A 47 18.772 -6.527 21.062 1.00 0.00 C ATOM 797 OG SER A 47 18.903 -7.390 19.942 1.00 0.00 O ATOM 0 H SER A 47 20.953 -7.460 21.715 1.00 0.00 H new ATOM 0 HA SER A 47 20.217 -5.151 20.232 1.00 0.00 H new ATOM 0 HB2 SER A 47 18.636 -7.111 21.972 1.00 0.00 H new ATOM 0 HB3 SER A 47 17.888 -5.900 20.951 1.00 0.00 H new ATOM 0 HG SER A 47 18.103 -7.951 19.866 1.00 0.00 H new ATOM 803 N MET A 48 20.015 -4.962 23.507 1.00 0.00 N ATOM 804 CA MET A 48 19.806 -4.033 24.614 1.00 0.00 C ATOM 805 C MET A 48 20.690 -2.800 24.470 1.00 0.00 C ATOM 806 O MET A 48 20.224 -1.672 24.631 1.00 0.00 O ATOM 807 CB MET A 48 20.114 -4.728 25.941 1.00 0.00 C ATOM 808 CG MET A 48 19.869 -3.756 27.096 1.00 0.00 C ATOM 809 SD MET A 48 18.107 -3.342 27.172 1.00 0.00 S ATOM 810 CE MET A 48 18.222 -2.113 28.495 1.00 0.00 C ATOM 0 H MET A 48 20.328 -5.892 23.785 1.00 0.00 H new ATOM 0 HA MET A 48 18.763 -3.715 24.597 1.00 0.00 H new ATOM 0 HB2 MET A 48 19.485 -5.611 26.056 1.00 0.00 H new ATOM 0 HB3 MET A 48 21.149 -5.070 25.953 1.00 0.00 H new ATOM 0 HG2 MET A 48 20.189 -4.204 28.037 1.00 0.00 H new ATOM 0 HG3 MET A 48 20.461 -2.851 26.956 1.00 0.00 H new ATOM 0 HE1 MET A 48 17.230 -1.716 28.711 1.00 0.00 H new ATOM 0 HE2 MET A 48 18.629 -2.581 29.392 1.00 0.00 H new ATOM 0 HE3 MET A 48 18.877 -1.300 28.181 1.00 0.00 H new ATOM 820 N LYS A 49 21.962 -3.015 24.162 1.00 0.00 N ATOM 821 CA LYS A 49 22.889 -1.903 23.998 1.00 0.00 C ATOM 822 C LYS A 49 23.488 -1.920 22.599 1.00 0.00 C ATOM 823 O LYS A 49 24.709 -1.926 22.443 1.00 0.00 O ATOM 824 CB LYS A 49 24.008 -1.987 25.038 1.00 0.00 C ATOM 825 CG LYS A 49 24.555 -3.414 25.089 1.00 0.00 C ATOM 826 CD LYS A 49 25.677 -3.497 26.126 1.00 0.00 C ATOM 827 CE LYS A 49 25.114 -3.194 27.517 1.00 0.00 C ATOM 828 NZ LYS A 49 24.154 -4.264 27.909 1.00 0.00 N ATOM 0 H LYS A 49 22.372 -3.938 24.022 1.00 0.00 H new ATOM 0 HA LYS A 49 22.340 -0.972 24.140 1.00 0.00 H new ATOM 0 HB2 LYS A 49 24.807 -1.290 24.785 1.00 0.00 H new ATOM 0 HB3 LYS A 49 23.630 -1.696 26.018 1.00 0.00 H new ATOM 0 HG2 LYS A 49 23.757 -4.111 25.345 1.00 0.00 H new ATOM 0 HG3 LYS A 49 24.930 -3.706 24.108 1.00 0.00 H new ATOM 0 HD2 LYS A 49 26.126 -4.490 26.113 1.00 0.00 H new ATOM 0 HD3 LYS A 49 26.467 -2.787 25.880 1.00 0.00 H new ATOM 0 HE2 LYS A 49 25.924 -3.134 28.244 1.00 0.00 H new ATOM 0 HE3 LYS A 49 24.614 -2.225 27.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 24.032 -4.259 28.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 23.236 -4.092 27.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 24.523 -5.189 27.608 1.00 0.00 H new ATOM 842 N ASP A 50 22.617 -1.935 21.589 1.00 0.00 N ATOM 843 CA ASP A 50 23.056 -1.958 20.195 1.00 0.00 C ATOM 844 C ASP A 50 24.526 -1.576 20.081 1.00 0.00 C ATOM 845 O ASP A 50 24.862 -0.426 19.801 1.00 0.00 O ATOM 846 CB ASP A 50 22.209 -0.992 19.365 1.00 0.00 C ATOM 847 CG ASP A 50 22.397 0.434 19.871 1.00 0.00 C ATOM 848 OD1 ASP A 50 23.158 0.615 20.807 1.00 0.00 O ATOM 849 OD2 ASP A 50 21.775 1.325 19.315 1.00 0.00 O ATOM 0 H ASP A 50 21.604 -1.932 21.711 1.00 0.00 H new ATOM 0 HA ASP A 50 22.931 -2.972 19.815 1.00 0.00 H new ATOM 0 HB2 ASP A 50 22.495 -1.055 18.315 1.00 0.00 H new ATOM 0 HB3 ASP A 50 21.158 -1.273 19.426 1.00 0.00 H new ATOM 854 N SER A 51 25.398 -2.552 20.311 1.00 0.00 N ATOM 855 CA SER A 51 26.835 -2.311 20.241 1.00 0.00 C ATOM 856 C SER A 51 27.581 -3.606 19.942 1.00 0.00 C ATOM 857 O SER A 51 27.028 -4.696 20.076 1.00 0.00 O ATOM 858 CB SER A 51 27.330 -1.730 21.566 1.00 0.00 C ATOM 859 OG SER A 51 27.197 -2.710 22.587 1.00 0.00 O ATOM 0 H SER A 51 25.138 -3.510 20.546 1.00 0.00 H new ATOM 0 HA SER A 51 27.027 -1.600 19.437 1.00 0.00 H new ATOM 0 HB2 SER A 51 28.372 -1.422 21.475 1.00 0.00 H new ATOM 0 HB3 SER A 51 26.756 -0.840 21.823 1.00 0.00 H new ATOM 0 HG SER A 51 26.262 -2.755 22.877 1.00 0.00 H new ATOM 865 N ALA A 52 28.839 -3.478 19.534 1.00 0.00 N ATOM 866 CA ALA A 52 29.649 -4.650 19.218 1.00 0.00 C ATOM 867 C ALA A 52 30.954 -4.628 20.005 1.00 0.00 C ATOM 868 O ALA A 52 31.550 -3.572 20.200 1.00 0.00 O ATOM 869 CB ALA A 52 29.955 -4.682 17.721 1.00 0.00 C ATOM 0 H ALA A 52 29.317 -2.585 19.415 1.00 0.00 H new ATOM 0 HA ALA A 52 29.087 -5.542 19.494 1.00 0.00 H new ATOM 0 HB1 ALA A 52 30.560 -5.559 17.492 1.00 0.00 H new ATOM 0 HB2 ALA A 52 29.022 -4.728 17.160 1.00 0.00 H new ATOM 0 HB3 ALA A 52 30.502 -3.781 17.442 1.00 0.00 H new ATOM 875 N TYR A 53 31.393 -5.797 20.459 1.00 0.00 N ATOM 876 CA TYR A 53 32.631 -5.882 21.227 1.00 0.00 C ATOM 877 C TYR A 53 33.293 -7.245 21.049 1.00 0.00 C ATOM 878 O TYR A 53 32.648 -8.213 20.648 1.00 0.00 O ATOM 879 CB TYR A 53 32.337 -5.652 22.709 1.00 0.00 C ATOM 880 CG TYR A 53 31.478 -6.779 23.233 1.00 0.00 C ATOM 881 CD1 TYR A 53 32.078 -7.917 23.784 1.00 0.00 C ATOM 882 CD2 TYR A 53 30.083 -6.684 23.168 1.00 0.00 C ATOM 883 CE1 TYR A 53 31.283 -8.962 24.271 1.00 0.00 C ATOM 884 CE2 TYR A 53 29.287 -7.729 23.654 1.00 0.00 C ATOM 885 CZ TYR A 53 29.888 -8.868 24.206 1.00 0.00 C ATOM 886 OH TYR A 53 29.103 -9.897 24.686 1.00 0.00 O ATOM 0 H TYR A 53 30.918 -6.688 20.312 1.00 0.00 H new ATOM 0 HA TYR A 53 33.312 -5.114 20.860 1.00 0.00 H new ATOM 0 HB2 TYR A 53 33.269 -5.599 23.272 1.00 0.00 H new ATOM 0 HB3 TYR A 53 31.827 -4.698 22.846 1.00 0.00 H new ATOM 0 HD1 TYR A 53 33.154 -7.989 23.834 1.00 0.00 H new ATOM 0 HD2 TYR A 53 29.621 -5.805 22.743 1.00 0.00 H new ATOM 0 HE1 TYR A 53 31.746 -9.840 24.697 1.00 0.00 H new ATOM 0 HE2 TYR A 53 28.211 -7.657 23.603 1.00 0.00 H new ATOM 0 HH TYR A 53 28.157 -9.670 24.566 1.00 0.00 H new ATOM 896 N LYS A 54 34.584 -7.312 21.360 1.00 0.00 N ATOM 897 CA LYS A 54 35.326 -8.562 21.244 1.00 0.00 C ATOM 898 C LYS A 54 36.157 -8.813 22.490 1.00 0.00 C ATOM 899 O LYS A 54 36.799 -7.905 23.019 1.00 0.00 O ATOM 900 CB LYS A 54 36.229 -8.546 20.010 1.00 0.00 C ATOM 901 CG LYS A 54 37.180 -9.746 20.059 1.00 0.00 C ATOM 902 CD LYS A 54 37.761 -9.995 18.666 1.00 0.00 C ATOM 903 CE LYS A 54 38.622 -8.802 18.256 1.00 0.00 C ATOM 904 NZ LYS A 54 39.207 -9.051 16.908 1.00 0.00 N ATOM 0 H LYS A 54 35.135 -6.520 21.692 1.00 0.00 H new ATOM 0 HA LYS A 54 34.602 -9.370 21.137 1.00 0.00 H new ATOM 0 HB2 LYS A 54 35.625 -8.584 19.103 1.00 0.00 H new ATOM 0 HB3 LYS A 54 36.799 -7.618 19.975 1.00 0.00 H new ATOM 0 HG2 LYS A 54 37.983 -9.558 20.771 1.00 0.00 H new ATOM 0 HG3 LYS A 54 36.647 -10.631 20.406 1.00 0.00 H new ATOM 0 HD2 LYS A 54 38.359 -10.906 18.667 1.00 0.00 H new ATOM 0 HD3 LYS A 54 36.957 -10.142 17.945 1.00 0.00 H new ATOM 0 HE2 LYS A 54 38.020 -7.894 18.241 1.00 0.00 H new ATOM 0 HE3 LYS A 54 39.416 -8.645 18.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 39.390 -8.143 16.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 40.100 -9.575 17.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 38.540 -9.610 16.338 1.00 0.00 H new ATOM 918 N ASP A 55 36.132 -10.053 22.960 1.00 0.00 N ATOM 919 CA ASP A 55 36.880 -10.421 24.156 1.00 0.00 C ATOM 920 C ASP A 55 38.205 -11.084 23.791 1.00 0.00 C ATOM 921 O ASP A 55 38.243 -12.021 22.993 1.00 0.00 O ATOM 922 CB ASP A 55 36.051 -11.379 25.014 1.00 0.00 C ATOM 923 CG ASP A 55 34.884 -10.630 25.650 1.00 0.00 C ATOM 924 OD1 ASP A 55 34.904 -9.411 25.625 1.00 0.00 O ATOM 925 OD2 ASP A 55 33.988 -11.289 26.152 1.00 0.00 O ATOM 0 H ASP A 55 35.606 -10.817 22.535 1.00 0.00 H new ATOM 0 HA ASP A 55 37.090 -9.511 24.718 1.00 0.00 H new ATOM 0 HB2 ASP A 55 35.677 -12.199 24.401 1.00 0.00 H new ATOM 0 HB3 ASP A 55 36.677 -11.821 25.790 1.00 0.00 H new ATOM 930 N PHE A 56 39.287 -10.597 24.389 1.00 0.00 N ATOM 931 CA PHE A 56 40.610 -11.153 24.131 1.00 0.00 C ATOM 932 C PHE A 56 41.025 -12.072 25.275 1.00 0.00 C ATOM 933 O PHE A 56 42.077 -12.711 25.225 1.00 0.00 O ATOM 934 CB PHE A 56 41.631 -10.023 23.992 1.00 0.00 C ATOM 935 CG PHE A 56 41.273 -9.158 22.809 1.00 0.00 C ATOM 936 CD1 PHE A 56 40.427 -8.056 22.979 1.00 0.00 C ATOM 937 CD2 PHE A 56 41.786 -9.456 21.541 1.00 0.00 C ATOM 938 CE1 PHE A 56 40.096 -7.251 21.883 1.00 0.00 C ATOM 939 CE2 PHE A 56 41.456 -8.650 20.444 1.00 0.00 C ATOM 940 CZ PHE A 56 40.611 -7.547 20.616 1.00 0.00 C ATOM 0 H PHE A 56 39.274 -9.822 25.052 1.00 0.00 H new ATOM 0 HA PHE A 56 40.574 -11.726 23.205 1.00 0.00 H new ATOM 0 HB2 PHE A 56 41.650 -9.423 24.902 1.00 0.00 H new ATOM 0 HB3 PHE A 56 42.631 -10.437 23.863 1.00 0.00 H new ATOM 0 HD1 PHE A 56 40.029 -7.827 23.957 1.00 0.00 H new ATOM 0 HD2 PHE A 56 42.437 -10.308 21.409 1.00 0.00 H new ATOM 0 HE1 PHE A 56 39.443 -6.401 22.015 1.00 0.00 H new ATOM 0 HE2 PHE A 56 41.853 -8.879 19.466 1.00 0.00 H new ATOM 0 HZ PHE A 56 40.357 -6.925 19.771 1.00 0.00 H new ATOM 950 N GLY A 57 40.188 -12.130 26.304 1.00 0.00 N ATOM 951 CA GLY A 57 40.466 -12.968 27.465 1.00 0.00 C ATOM 952 C GLY A 57 41.257 -12.198 28.516 1.00 0.00 C ATOM 953 O GLY A 57 41.416 -12.656 29.647 1.00 0.00 O ATOM 0 H GLY A 57 39.313 -11.608 26.359 1.00 0.00 H new ATOM 0 HA2 GLY A 57 39.529 -13.321 27.896 1.00 0.00 H new ATOM 0 HA3 GLY A 57 41.027 -13.850 27.156 1.00 0.00 H new ATOM 957 N LYS A 58 41.746 -11.020 28.137 1.00 0.00 N ATOM 958 CA LYS A 58 42.514 -10.190 29.059 1.00 0.00 C ATOM 959 C LYS A 58 41.778 -8.885 29.344 1.00 0.00 C ATOM 960 O LYS A 58 41.876 -8.329 30.437 1.00 0.00 O ATOM 961 CB LYS A 58 43.888 -9.883 28.461 1.00 0.00 C ATOM 962 CG LYS A 58 44.661 -11.188 28.259 1.00 0.00 C ATOM 963 CD LYS A 58 46.079 -10.874 27.778 1.00 0.00 C ATOM 964 CE LYS A 58 46.023 -10.309 26.358 1.00 0.00 C ATOM 965 NZ LYS A 58 47.408 -10.069 25.864 1.00 0.00 N ATOM 0 H LYS A 58 41.625 -10.622 27.206 1.00 0.00 H new ATOM 0 HA LYS A 58 42.638 -10.736 29.994 1.00 0.00 H new ATOM 0 HB2 LYS A 58 43.774 -9.364 27.509 1.00 0.00 H new ATOM 0 HB3 LYS A 58 44.443 -9.218 29.122 1.00 0.00 H new ATOM 0 HG2 LYS A 58 44.699 -11.749 29.193 1.00 0.00 H new ATOM 0 HG3 LYS A 58 44.149 -11.817 27.530 1.00 0.00 H new ATOM 0 HD2 LYS A 58 46.551 -10.156 28.448 1.00 0.00 H new ATOM 0 HD3 LYS A 58 46.689 -11.777 27.798 1.00 0.00 H new ATOM 0 HE2 LYS A 58 45.506 -11.006 25.698 1.00 0.00 H new ATOM 0 HE3 LYS A 58 45.455 -9.379 26.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 47.370 -9.685 24.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 47.886 -9.389 26.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 47.935 -10.965 25.860 1.00 0.00 H new ATOM 979 N TYR A 59 41.043 -8.402 28.347 1.00 0.00 N ATOM 980 CA TYR A 59 40.293 -7.159 28.490 1.00 0.00 C ATOM 981 C TYR A 59 39.108 -7.139 27.530 1.00 0.00 C ATOM 982 O TYR A 59 39.068 -7.899 26.563 1.00 0.00 O ATOM 983 CB TYR A 59 41.206 -5.967 28.206 1.00 0.00 C ATOM 984 CG TYR A 59 41.724 -6.057 26.791 1.00 0.00 C ATOM 985 CD1 TYR A 59 40.999 -5.480 25.741 1.00 0.00 C ATOM 986 CD2 TYR A 59 42.929 -6.719 26.527 1.00 0.00 C ATOM 987 CE1 TYR A 59 41.478 -5.566 24.429 1.00 0.00 C ATOM 988 CE2 TYR A 59 43.409 -6.806 25.214 1.00 0.00 C ATOM 989 CZ TYR A 59 42.683 -6.228 24.165 1.00 0.00 C ATOM 990 OH TYR A 59 43.156 -6.313 22.872 1.00 0.00 O ATOM 0 H TYR A 59 40.951 -8.850 27.435 1.00 0.00 H new ATOM 0 HA TYR A 59 39.919 -7.093 29.512 1.00 0.00 H new ATOM 0 HB2 TYR A 59 40.659 -5.035 28.346 1.00 0.00 H new ATOM 0 HB3 TYR A 59 42.038 -5.957 28.910 1.00 0.00 H new ATOM 0 HD1 TYR A 59 40.070 -4.968 25.944 1.00 0.00 H new ATOM 0 HD2 TYR A 59 43.489 -7.163 27.337 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.918 -5.121 23.620 1.00 0.00 H new ATOM 0 HE2 TYR A 59 44.338 -7.318 25.011 1.00 0.00 H new ATOM 0 HH TYR A 59 42.453 -6.669 22.289 1.00 0.00 H new ATOM 1000 N GLU A 60 38.139 -6.270 27.805 1.00 0.00 N ATOM 1001 CA GLU A 60 36.957 -6.170 26.956 1.00 0.00 C ATOM 1002 C GLU A 60 36.903 -4.816 26.252 1.00 0.00 C ATOM 1003 O GLU A 60 37.022 -3.768 26.886 1.00 0.00 O ATOM 1004 CB GLU A 60 35.695 -6.360 27.799 1.00 0.00 C ATOM 1005 CG GLU A 60 34.462 -6.289 26.895 1.00 0.00 C ATOM 1006 CD GLU A 60 33.200 -6.521 27.718 1.00 0.00 C ATOM 1007 OE1 GLU A 60 33.325 -6.716 28.916 1.00 0.00 O ATOM 1008 OE2 GLU A 60 32.127 -6.499 27.138 1.00 0.00 O ATOM 0 H GLU A 60 38.148 -5.632 28.600 1.00 0.00 H new ATOM 0 HA GLU A 60 37.014 -6.952 26.199 1.00 0.00 H new ATOM 0 HB2 GLU A 60 35.728 -7.321 28.312 1.00 0.00 H new ATOM 0 HB3 GLU A 60 35.640 -5.590 28.569 1.00 0.00 H new ATOM 0 HG2 GLU A 60 34.414 -5.316 26.407 1.00 0.00 H new ATOM 0 HG3 GLU A 60 34.535 -7.038 26.106 1.00 0.00 H new ATOM 1015 N ILE A 61 36.715 -4.850 24.936 1.00 0.00 N ATOM 1016 CA ILE A 61 36.635 -3.626 24.144 1.00 0.00 C ATOM 1017 C ILE A 61 35.370 -3.637 23.293 1.00 0.00 C ATOM 1018 O ILE A 61 35.004 -4.667 22.728 1.00 0.00 O ATOM 1019 CB ILE A 61 37.861 -3.497 23.237 1.00 0.00 C ATOM 1020 CG1 ILE A 61 37.900 -4.674 22.260 1.00 0.00 C ATOM 1021 CG2 ILE A 61 39.130 -3.503 24.090 1.00 0.00 C ATOM 1022 CD1 ILE A 61 38.977 -4.422 21.202 1.00 0.00 C ATOM 0 H ILE A 61 36.615 -5.710 24.396 1.00 0.00 H new ATOM 0 HA ILE A 61 36.606 -2.775 24.824 1.00 0.00 H new ATOM 0 HB ILE A 61 37.802 -2.563 22.679 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.111 -5.599 22.796 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.928 -4.797 21.783 1.00 0.00 H new ATOM 0 HG21 ILE A 61 40.003 -3.411 23.444 1.00 0.00 H new ATOM 0 HG22 ILE A 61 39.104 -2.665 24.787 1.00 0.00 H new ATOM 0 HG23 ILE A 61 39.189 -4.437 24.648 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.006 -5.260 20.505 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.746 -3.506 20.658 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.948 -4.321 21.688 1.00 0.00 H new ATOM 1034 N ARG A 62 34.697 -2.493 23.212 1.00 0.00 N ATOM 1035 CA ARG A 62 33.468 -2.406 22.432 1.00 0.00 C ATOM 1036 C ARG A 62 33.407 -1.102 21.645 1.00 0.00 C ATOM 1037 O ARG A 62 34.082 -0.128 21.978 1.00 0.00 O ATOM 1038 CB ARG A 62 32.256 -2.494 23.363 1.00 0.00 C ATOM 1039 CG ARG A 62 32.191 -1.239 24.237 1.00 0.00 C ATOM 1040 CD ARG A 62 31.080 -1.401 25.277 1.00 0.00 C ATOM 1041 NE ARG A 62 31.008 -0.217 26.126 1.00 0.00 N ATOM 1042 CZ ARG A 62 30.319 0.856 25.751 1.00 0.00 C ATOM 1043 NH1 ARG A 62 29.695 0.863 24.606 1.00 0.00 N ATOM 1044 NH2 ARG A 62 30.267 1.902 26.529 1.00 0.00 N ATOM 0 H ARG A 62 34.977 -1.625 23.670 1.00 0.00 H new ATOM 0 HA ARG A 62 33.456 -3.237 21.727 1.00 0.00 H new ATOM 0 HB2 ARG A 62 31.341 -2.591 22.778 1.00 0.00 H new ATOM 0 HB3 ARG A 62 32.329 -3.383 23.990 1.00 0.00 H new ATOM 0 HG2 ARG A 62 33.148 -1.078 24.733 1.00 0.00 H new ATOM 0 HG3 ARG A 62 32.001 -0.361 23.619 1.00 0.00 H new ATOM 0 HD2 ARG A 62 30.124 -1.558 24.777 1.00 0.00 H new ATOM 0 HD3 ARG A 62 31.269 -2.284 25.887 1.00 0.00 H new ATOM 0 HE ARG A 62 31.495 -0.212 27.022 1.00 0.00 H new ATOM 0 HH11 ARG A 62 29.736 0.045 23.998 1.00 0.00 H new ATOM 0 HH12 ARG A 62 29.166 1.686 24.318 1.00 0.00 H new ATOM 0 HH21 ARG A 62 30.755 1.896 27.425 1.00 0.00 H new ATOM 0 HH22 ARG A 62 29.738 2.726 26.242 1.00 0.00 H new ATOM 1058 N LEU A 63 32.588 -1.098 20.598 1.00 0.00 N ATOM 1059 CA LEU A 63 32.428 0.080 19.758 1.00 0.00 C ATOM 1060 C LEU A 63 31.054 0.700 19.978 1.00 0.00 C ATOM 1061 O LEU A 63 30.070 -0.010 20.200 1.00 0.00 O ATOM 1062 CB LEU A 63 32.581 -0.302 18.284 1.00 0.00 C ATOM 1063 CG LEU A 63 33.945 -0.954 18.059 1.00 0.00 C ATOM 1064 CD1 LEU A 63 34.076 -1.364 16.594 1.00 0.00 C ATOM 1065 CD2 LEU A 63 35.050 0.043 18.407 1.00 0.00 C ATOM 0 H LEU A 63 32.025 -1.899 20.312 1.00 0.00 H new ATOM 0 HA LEU A 63 33.197 0.804 20.027 1.00 0.00 H new ATOM 0 HB2 LEU A 63 31.786 -0.989 17.992 1.00 0.00 H new ATOM 0 HB3 LEU A 63 32.483 0.584 17.657 1.00 0.00 H new ATOM 0 HG LEU A 63 34.036 -1.835 18.694 1.00 0.00 H new ATOM 0 HD11 LEU A 63 35.048 -1.829 16.432 1.00 0.00 H new ATOM 0 HD12 LEU A 63 33.288 -2.074 16.343 1.00 0.00 H new ATOM 0 HD13 LEU A 63 33.986 -0.482 15.960 1.00 0.00 H new ATOM 0 HD21 LEU A 63 36.023 -0.422 18.247 1.00 0.00 H new ATOM 0 HD22 LEU A 63 34.959 0.924 17.771 1.00 0.00 H new ATOM 0 HD23 LEU A 63 34.957 0.339 19.452 1.00 0.00 H new ATOM 1077 N SER A 64 30.993 2.026 19.918 1.00 0.00 N ATOM 1078 CA SER A 64 29.734 2.734 20.118 1.00 0.00 C ATOM 1079 C SER A 64 29.688 4.002 19.273 1.00 0.00 C ATOM 1080 O SER A 64 30.712 4.468 18.774 1.00 0.00 O ATOM 1081 CB SER A 64 29.569 3.099 21.594 1.00 0.00 C ATOM 1082 OG SER A 64 30.579 4.030 21.962 1.00 0.00 O ATOM 0 H SER A 64 31.795 2.629 19.734 1.00 0.00 H new ATOM 0 HA SER A 64 28.920 2.078 19.811 1.00 0.00 H new ATOM 0 HB2 SER A 64 28.582 3.528 21.767 1.00 0.00 H new ATOM 0 HB3 SER A 64 29.640 2.204 22.212 1.00 0.00 H new ATOM 0 HG SER A 64 30.476 4.268 22.907 1.00 0.00 H new ATOM 1088 N ASN A 65 28.488 4.550 19.115 1.00 0.00 N ATOM 1089 CA ASN A 65 28.304 5.762 18.326 1.00 0.00 C ATOM 1090 C ASN A 65 29.174 6.893 18.861 1.00 0.00 C ATOM 1091 O ASN A 65 29.750 6.788 19.945 1.00 0.00 O ATOM 1092 CB ASN A 65 26.837 6.195 18.375 1.00 0.00 C ATOM 1093 CG ASN A 65 26.533 7.141 17.219 1.00 0.00 C ATOM 1094 OD1 ASN A 65 27.076 6.982 16.125 1.00 0.00 O ATOM 1095 ND2 ASN A 65 25.693 8.124 17.396 1.00 0.00 N ATOM 0 H ASN A 65 27.631 4.175 19.522 1.00 0.00 H new ATOM 0 HA ASN A 65 28.595 5.546 17.298 1.00 0.00 H new ATOM 0 HB2 ASN A 65 26.189 5.320 18.320 1.00 0.00 H new ATOM 0 HB3 ASN A 65 26.626 6.688 19.324 1.00 0.00 H new ATOM 0 HD21 ASN A 65 25.485 8.762 16.628 1.00 0.00 H new ATOM 0 HD22 ASN A 65 25.244 8.254 18.303 1.00 0.00 H new ATOM 1102 N HIS A 66 29.260 7.974 18.095 1.00 0.00 N ATOM 1103 CA HIS A 66 30.057 9.123 18.503 1.00 0.00 C ATOM 1104 C HIS A 66 29.511 9.691 19.806 1.00 0.00 C ATOM 1105 O HIS A 66 30.269 10.101 20.684 1.00 0.00 O ATOM 1106 CB HIS A 66 30.020 10.200 17.416 1.00 0.00 C ATOM 1107 CG HIS A 66 30.813 9.738 16.224 1.00 0.00 C ATOM 1108 ND1 HIS A 66 30.798 10.418 15.017 1.00 0.00 N ATOM 1109 CD2 HIS A 66 31.650 8.665 16.038 1.00 0.00 C ATOM 1110 CE1 HIS A 66 31.603 9.755 14.167 1.00 0.00 C ATOM 1111 NE2 HIS A 66 32.147 8.679 14.739 1.00 0.00 N ATOM 0 H HIS A 66 28.791 8.079 17.195 1.00 0.00 H new ATOM 0 HA HIS A 66 31.088 8.804 18.652 1.00 0.00 H new ATOM 0 HB2 HIS A 66 28.989 10.402 17.124 1.00 0.00 H new ATOM 0 HB3 HIS A 66 30.431 11.134 17.800 1.00 0.00 H new ATOM 0 HD2 HIS A 66 31.886 7.923 16.787 1.00 0.00 H new ATOM 0 HE1 HIS A 66 31.787 10.057 13.146 1.00 0.00 H new ATOM 0 HE2 HIS A 66 32.790 8.010 14.315 1.00 0.00 H new ATOM 1119 N SER A 67 28.187 9.700 19.926 1.00 0.00 N ATOM 1120 CA SER A 67 27.544 10.208 21.130 1.00 0.00 C ATOM 1121 C SER A 67 27.830 9.283 22.309 1.00 0.00 C ATOM 1122 O SER A 67 28.126 8.102 22.128 1.00 0.00 O ATOM 1123 CB SER A 67 26.035 10.312 20.913 1.00 0.00 C ATOM 1124 OG SER A 67 25.484 9.005 20.816 1.00 0.00 O ATOM 0 H SER A 67 27.544 9.364 19.209 1.00 0.00 H new ATOM 0 HA SER A 67 27.944 11.198 21.349 1.00 0.00 H new ATOM 0 HB2 SER A 67 25.574 10.853 21.739 1.00 0.00 H new ATOM 0 HB3 SER A 67 25.824 10.876 20.005 1.00 0.00 H new ATOM 0 HG SER A 67 24.516 9.068 20.678 1.00 0.00 H new ATOM 1286 N GLY A 78 33.143 -6.259 35.247 1.00 0.00 N ATOM 1287 CA GLY A 78 34.132 -6.567 36.274 1.00 0.00 C ATOM 1288 C GLY A 78 35.537 -6.516 35.688 1.00 0.00 C ATOM 1289 O GLY A 78 36.522 -6.793 36.372 1.00 0.00 O ATOM 0 HA2 GLY A 78 34.047 -5.855 37.095 1.00 0.00 H new ATOM 0 HA3 GLY A 78 33.939 -7.556 36.689 1.00 0.00 H new ATOM 1293 N ARG A 79 35.617 -6.158 34.411 1.00 0.00 N ATOM 1294 CA ARG A 79 36.898 -6.069 33.722 1.00 0.00 C ATOM 1295 C ARG A 79 37.024 -4.726 33.011 1.00 0.00 C ATOM 1296 O ARG A 79 36.022 -4.094 32.678 1.00 0.00 O ATOM 1297 CB ARG A 79 37.023 -7.203 32.701 1.00 0.00 C ATOM 1298 CG ARG A 79 36.916 -8.550 33.418 1.00 0.00 C ATOM 1299 CD ARG A 79 38.083 -8.703 34.394 1.00 0.00 C ATOM 1300 NE ARG A 79 39.352 -8.641 33.676 1.00 0.00 N ATOM 1301 CZ ARG A 79 39.852 -9.711 33.069 1.00 0.00 C ATOM 1302 NH1 ARG A 79 39.208 -10.846 33.111 1.00 0.00 N ATOM 1303 NH2 ARG A 79 40.985 -9.629 32.427 1.00 0.00 N ATOM 0 H ARG A 79 34.810 -5.925 33.833 1.00 0.00 H new ATOM 0 HA ARG A 79 37.696 -6.157 34.459 1.00 0.00 H new ATOM 0 HB2 ARG A 79 36.240 -7.117 31.948 1.00 0.00 H new ATOM 0 HB3 ARG A 79 37.977 -7.132 32.178 1.00 0.00 H new ATOM 0 HG2 ARG A 79 35.969 -8.614 33.954 1.00 0.00 H new ATOM 0 HG3 ARG A 79 36.927 -9.362 32.691 1.00 0.00 H new ATOM 0 HD2 ARG A 79 38.043 -7.915 35.146 1.00 0.00 H new ATOM 0 HD3 ARG A 79 38.002 -9.653 34.923 1.00 0.00 H new ATOM 0 HE ARG A 79 39.864 -7.760 33.640 1.00 0.00 H new ATOM 0 HH11 ARG A 79 38.321 -10.911 33.610 1.00 0.00 H new ATOM 0 HH12 ARG A 79 39.592 -11.668 32.645 1.00 0.00 H new ATOM 0 HH21 ARG A 79 41.488 -8.742 32.391 1.00 0.00 H new ATOM 0 HH22 ARG A 79 41.368 -10.452 31.961 1.00 0.00 H new ATOM 1317 N LEU A 80 38.258 -4.293 32.784 1.00 0.00 N ATOM 1318 CA LEU A 80 38.495 -3.020 32.115 1.00 0.00 C ATOM 1319 C LEU A 80 37.801 -2.999 30.761 1.00 0.00 C ATOM 1320 O LEU A 80 37.770 -4.004 30.051 1.00 0.00 O ATOM 1321 CB LEU A 80 39.994 -2.801 31.923 1.00 0.00 C ATOM 1322 CG LEU A 80 40.535 -1.969 33.083 1.00 0.00 C ATOM 1323 CD1 LEU A 80 39.865 -0.593 33.081 1.00 0.00 C ATOM 1324 CD2 LEU A 80 40.232 -2.681 34.404 1.00 0.00 C ATOM 0 H LEU A 80 39.103 -4.799 33.050 1.00 0.00 H new ATOM 0 HA LEU A 80 38.090 -2.221 32.736 1.00 0.00 H new ATOM 0 HB2 LEU A 80 40.510 -3.760 31.876 1.00 0.00 H new ATOM 0 HB3 LEU A 80 40.181 -2.292 30.977 1.00 0.00 H new ATOM 0 HG LEU A 80 41.613 -1.848 32.972 1.00 0.00 H new ATOM 0 HD11 LEU A 80 40.251 0.001 33.909 1.00 0.00 H new ATOM 0 HD12 LEU A 80 40.078 -0.086 32.140 1.00 0.00 H new ATOM 0 HD13 LEU A 80 38.787 -0.713 33.192 1.00 0.00 H new ATOM 0 HD21 LEU A 80 40.618 -2.088 35.234 1.00 0.00 H new ATOM 0 HD22 LEU A 80 39.154 -2.801 34.514 1.00 0.00 H new ATOM 0 HD23 LEU A 80 40.708 -3.661 34.406 1.00 0.00 H new ATOM 1336 N ILE A 81 37.236 -1.849 30.410 1.00 0.00 N ATOM 1337 CA ILE A 81 36.537 -1.717 29.140 1.00 0.00 C ATOM 1338 C ILE A 81 36.991 -0.468 28.391 1.00 0.00 C ATOM 1339 O ILE A 81 37.232 0.579 28.993 1.00 0.00 O ATOM 1340 CB ILE A 81 35.029 -1.646 29.380 1.00 0.00 C ATOM 1341 CG1 ILE A 81 34.293 -1.849 28.055 1.00 0.00 C ATOM 1342 CG2 ILE A 81 34.667 -0.276 29.957 1.00 0.00 C ATOM 1343 CD1 ILE A 81 34.551 -3.268 27.544 1.00 0.00 C ATOM 0 H ILE A 81 37.248 -1.004 30.981 1.00 0.00 H new ATOM 0 HA ILE A 81 36.772 -2.591 28.532 1.00 0.00 H new ATOM 0 HB ILE A 81 34.737 -2.426 30.083 1.00 0.00 H new ATOM 0 HG12 ILE A 81 33.224 -1.688 28.192 1.00 0.00 H new ATOM 0 HG13 ILE A 81 34.634 -1.119 27.321 1.00 0.00 H new ATOM 0 HG21 ILE A 81 33.592 -0.226 30.128 1.00 0.00 H new ATOM 0 HG22 ILE A 81 35.192 -0.129 30.901 1.00 0.00 H new ATOM 0 HG23 ILE A 81 34.959 0.504 29.254 1.00 0.00 H new ATOM 0 HD11 ILE A 81 34.027 -3.415 26.599 1.00 0.00 H new ATOM 0 HD12 ILE A 81 35.621 -3.411 27.392 1.00 0.00 H new ATOM 0 HD13 ILE A 81 34.189 -3.990 28.276 1.00 0.00 H new ATOM 1355 N VAL A 82 37.100 -0.592 27.074 1.00 0.00 N ATOM 1356 CA VAL A 82 37.516 0.525 26.237 1.00 0.00 C ATOM 1357 C VAL A 82 36.402 0.899 25.265 1.00 0.00 C ATOM 1358 O VAL A 82 35.911 0.054 24.515 1.00 0.00 O ATOM 1359 CB VAL A 82 38.779 0.149 25.456 1.00 0.00 C ATOM 1360 CG1 VAL A 82 39.162 1.296 24.520 1.00 0.00 C ATOM 1361 CG2 VAL A 82 39.928 -0.111 26.439 1.00 0.00 C ATOM 0 H VAL A 82 36.906 -1.454 26.564 1.00 0.00 H new ATOM 0 HA VAL A 82 37.730 1.382 26.876 1.00 0.00 H new ATOM 0 HB VAL A 82 38.589 -0.750 24.870 1.00 0.00 H new ATOM 0 HG11 VAL A 82 40.061 1.028 23.965 1.00 0.00 H new ATOM 0 HG12 VAL A 82 38.346 1.484 23.822 1.00 0.00 H new ATOM 0 HG13 VAL A 82 39.352 2.195 25.106 1.00 0.00 H new ATOM 0 HG21 VAL A 82 40.828 -0.379 25.885 1.00 0.00 H new ATOM 0 HG22 VAL A 82 40.117 0.789 27.024 1.00 0.00 H new ATOM 0 HG23 VAL A 82 39.657 -0.928 27.107 1.00 0.00 H new ATOM 1371 N ASN A 83 36.003 2.167 25.284 1.00 0.00 N ATOM 1372 CA ASN A 83 34.942 2.637 24.399 1.00 0.00 C ATOM 1373 C ASN A 83 35.527 3.389 23.212 1.00 0.00 C ATOM 1374 O ASN A 83 36.298 4.332 23.382 1.00 0.00 O ATOM 1375 CB ASN A 83 33.990 3.555 25.169 1.00 0.00 C ATOM 1376 CG ASN A 83 33.402 2.812 26.363 1.00 0.00 C ATOM 1377 OD1 ASN A 83 33.576 3.236 27.506 1.00 0.00 O ATOM 1378 ND2 ASN A 83 32.711 1.724 26.166 1.00 0.00 N ATOM 0 H ASN A 83 36.394 2.882 25.897 1.00 0.00 H new ATOM 0 HA ASN A 83 34.393 1.771 24.029 1.00 0.00 H new ATOM 0 HB2 ASN A 83 34.523 4.443 25.509 1.00 0.00 H new ATOM 0 HB3 ASN A 83 33.190 3.896 24.512 1.00 0.00 H new ATOM 0 HD21 ASN A 83 32.313 1.222 26.960 1.00 0.00 H new ATOM 0 HD22 ASN A 83 32.568 1.375 25.218 1.00 0.00 H new ATOM 1385 N ILE A 84 35.157 2.966 22.009 1.00 0.00 N ATOM 1386 CA ILE A 84 35.652 3.607 20.797 1.00 0.00 C ATOM 1387 C ILE A 84 34.495 4.125 19.950 1.00 0.00 C ATOM 1388 O ILE A 84 33.572 3.380 19.624 1.00 0.00 O ATOM 1389 CB ILE A 84 36.474 2.606 19.985 1.00 0.00 C ATOM 1390 CG1 ILE A 84 37.657 2.121 20.826 1.00 0.00 C ATOM 1391 CG2 ILE A 84 36.990 3.282 18.715 1.00 0.00 C ATOM 1392 CD1 ILE A 84 38.327 0.935 20.128 1.00 0.00 C ATOM 0 H ILE A 84 34.520 2.186 21.847 1.00 0.00 H new ATOM 0 HA ILE A 84 36.279 4.451 21.083 1.00 0.00 H new ATOM 0 HB ILE A 84 35.849 1.755 19.713 1.00 0.00 H new ATOM 0 HG12 ILE A 84 38.375 2.929 20.963 1.00 0.00 H new ATOM 0 HG13 ILE A 84 37.315 1.827 21.818 1.00 0.00 H new ATOM 0 HG21 ILE A 84 37.576 2.569 18.136 1.00 0.00 H new ATOM 0 HG22 ILE A 84 36.146 3.628 18.118 1.00 0.00 H new ATOM 0 HG23 ILE A 84 37.616 4.132 18.984 1.00 0.00 H new ATOM 0 HD11 ILE A 84 39.170 0.589 20.727 1.00 0.00 H new ATOM 0 HD12 ILE A 84 37.606 0.125 20.014 1.00 0.00 H new ATOM 0 HD13 ILE A 84 38.683 1.245 19.145 1.00 0.00 H new ATOM 1404 N LYS A 85 34.549 5.406 19.595 1.00 0.00 N ATOM 1405 CA LYS A 85 33.494 6.003 18.785 1.00 0.00 C ATOM 1406 C LYS A 85 33.754 5.762 17.301 1.00 0.00 C ATOM 1407 O LYS A 85 34.856 6.000 16.808 1.00 0.00 O ATOM 1408 CB LYS A 85 33.422 7.507 19.051 1.00 0.00 C ATOM 1409 CG LYS A 85 32.978 7.751 20.495 1.00 0.00 C ATOM 1410 CD LYS A 85 32.901 9.256 20.760 1.00 0.00 C ATOM 1411 CE LYS A 85 32.430 9.498 22.194 1.00 0.00 C ATOM 1412 NZ LYS A 85 33.428 8.930 23.145 1.00 0.00 N ATOM 0 H LYS A 85 35.303 6.043 19.852 1.00 0.00 H new ATOM 0 HA LYS A 85 32.547 5.537 19.057 1.00 0.00 H new ATOM 0 HB2 LYS A 85 34.396 7.965 18.877 1.00 0.00 H new ATOM 0 HB3 LYS A 85 32.721 7.976 18.360 1.00 0.00 H new ATOM 0 HG2 LYS A 85 32.006 7.290 20.670 1.00 0.00 H new ATOM 0 HG3 LYS A 85 33.681 7.285 21.186 1.00 0.00 H new ATOM 0 HD2 LYS A 85 33.878 9.714 20.605 1.00 0.00 H new ATOM 0 HD3 LYS A 85 32.214 9.725 20.056 1.00 0.00 H new ATOM 0 HE2 LYS A 85 32.308 10.566 22.373 1.00 0.00 H new ATOM 0 HE3 LYS A 85 31.456 9.035 22.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 33.294 9.356 24.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 33.298 7.900 23.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 34.389 9.137 22.804 1.00 0.00 H new ATOM 1426 N ALA A 86 32.729 5.297 16.594 1.00 0.00 N ATOM 1427 CA ALA A 86 32.858 5.036 15.164 1.00 0.00 C ATOM 1428 C ALA A 86 31.489 5.044 14.490 1.00 0.00 C ATOM 1429 O ALA A 86 30.515 4.531 15.040 1.00 0.00 O ATOM 1430 CB ALA A 86 33.528 3.679 14.941 1.00 0.00 C ATOM 0 H ALA A 86 31.808 5.095 16.983 1.00 0.00 H new ATOM 0 HA ALA A 86 33.471 5.823 14.725 1.00 0.00 H new ATOM 0 HB1 ALA A 86 33.621 3.491 13.871 1.00 0.00 H new ATOM 0 HB2 ALA A 86 34.518 3.683 15.396 1.00 0.00 H new ATOM 0 HB3 ALA A 86 32.923 2.895 15.396 1.00 0.00 H new ATOM 1436 N SER A 87 31.426 5.618 13.292 1.00 0.00 N ATOM 1437 CA SER A 87 30.171 5.671 12.550 1.00 0.00 C ATOM 1438 C SER A 87 29.836 4.299 11.976 1.00 0.00 C ATOM 1439 O SER A 87 30.713 3.449 11.829 1.00 0.00 O ATOM 1440 CB SER A 87 30.279 6.689 11.415 1.00 0.00 C ATOM 1441 OG SER A 87 31.181 6.202 10.431 1.00 0.00 O ATOM 0 H SER A 87 32.220 6.049 12.819 1.00 0.00 H new ATOM 0 HA SER A 87 29.376 5.973 13.232 1.00 0.00 H new ATOM 0 HB2 SER A 87 29.298 6.862 10.972 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.627 7.647 11.802 1.00 0.00 H new ATOM 0 HG SER A 87 31.251 6.852 9.701 1.00 0.00 H new ATOM 1447 N LYS A 88 28.565 4.088 11.647 1.00 0.00 N ATOM 1448 CA LYS A 88 28.140 2.811 11.086 1.00 0.00 C ATOM 1449 C LYS A 88 28.810 2.565 9.737 1.00 0.00 C ATOM 1450 O LYS A 88 29.229 1.447 9.437 1.00 0.00 O ATOM 1451 CB LYS A 88 26.620 2.797 10.911 1.00 0.00 C ATOM 1452 CG LYS A 88 25.947 2.751 12.284 1.00 0.00 C ATOM 1453 CD LYS A 88 24.427 2.734 12.107 1.00 0.00 C ATOM 1454 CE LYS A 88 23.754 2.618 13.476 1.00 0.00 C ATOM 1455 NZ LYS A 88 24.089 3.815 14.297 1.00 0.00 N ATOM 0 H LYS A 88 27.820 4.776 11.757 1.00 0.00 H new ATOM 0 HA LYS A 88 28.435 2.019 11.775 1.00 0.00 H new ATOM 0 HB2 LYS A 88 26.298 3.685 10.366 1.00 0.00 H new ATOM 0 HB3 LYS A 88 26.320 1.933 10.318 1.00 0.00 H new ATOM 0 HG2 LYS A 88 26.270 1.865 12.830 1.00 0.00 H new ATOM 0 HG3 LYS A 88 26.245 3.616 12.876 1.00 0.00 H new ATOM 0 HD2 LYS A 88 24.099 3.644 11.605 1.00 0.00 H new ATOM 0 HD3 LYS A 88 24.133 1.897 11.474 1.00 0.00 H new ATOM 0 HE2 LYS A 88 22.674 2.537 13.356 1.00 0.00 H new ATOM 0 HE3 LYS A 88 24.088 1.712 13.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 23.413 3.897 15.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 25.052 3.717 14.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 24.036 4.668 13.705 1.00 0.00 H new ATOM 1469 N LEU A 89 28.907 3.616 8.929 1.00 0.00 N ATOM 1470 CA LEU A 89 29.528 3.502 7.613 1.00 0.00 C ATOM 1471 C LEU A 89 31.000 3.120 7.741 1.00 0.00 C ATOM 1472 O LEU A 89 31.492 2.254 7.018 1.00 0.00 O ATOM 1473 CB LEU A 89 29.409 4.831 6.864 1.00 0.00 C ATOM 1474 CG LEU A 89 30.056 4.699 5.485 1.00 0.00 C ATOM 1475 CD1 LEU A 89 29.343 5.623 4.495 1.00 0.00 C ATOM 1476 CD2 LEU A 89 31.532 5.093 5.576 1.00 0.00 C ATOM 0 H LEU A 89 28.567 4.550 9.159 1.00 0.00 H new ATOM 0 HA LEU A 89 29.010 2.721 7.056 1.00 0.00 H new ATOM 0 HB2 LEU A 89 28.360 5.109 6.760 1.00 0.00 H new ATOM 0 HB3 LEU A 89 29.895 5.625 7.431 1.00 0.00 H new ATOM 0 HG LEU A 89 29.974 3.667 5.143 1.00 0.00 H new ATOM 0 HD11 LEU A 89 29.805 5.529 3.512 1.00 0.00 H new ATOM 0 HD12 LEU A 89 28.291 5.345 4.430 1.00 0.00 H new ATOM 0 HD13 LEU A 89 29.425 6.655 4.837 1.00 0.00 H new ATOM 0 HD21 LEU A 89 31.995 4.999 4.594 1.00 0.00 H new ATOM 0 HD22 LEU A 89 31.613 6.125 5.918 1.00 0.00 H new ATOM 0 HD23 LEU A 89 32.041 4.436 6.281 1.00 0.00 H new ATOM 1488 N ASN A 90 31.695 3.775 8.665 1.00 0.00 N ATOM 1489 CA ASN A 90 33.110 3.502 8.882 1.00 0.00 C ATOM 1490 C ASN A 90 33.308 2.691 10.157 1.00 0.00 C ATOM 1491 O ASN A 90 34.413 2.620 10.696 1.00 0.00 O ATOM 1492 CB ASN A 90 33.886 4.816 8.984 1.00 0.00 C ATOM 1493 CG ASN A 90 33.736 5.613 7.693 1.00 0.00 C ATOM 1494 OD1 ASN A 90 33.248 6.744 7.713 1.00 0.00 O ATOM 1495 ND2 ASN A 90 34.126 5.088 6.564 1.00 0.00 N ATOM 0 H ASN A 90 31.304 4.495 9.272 1.00 0.00 H new ATOM 0 HA ASN A 90 33.484 2.925 8.036 1.00 0.00 H new ATOM 0 HB2 ASN A 90 33.517 5.401 9.827 1.00 0.00 H new ATOM 0 HB3 ASN A 90 34.940 4.612 9.174 1.00 0.00 H new ATOM 0 HD21 ASN A 90 34.027 5.614 5.696 1.00 0.00 H new ATOM 0 HD22 ASN A 90 34.530 4.151 6.550 1.00 0.00 H new ATOM 1502 N PHE A 91 32.228 2.087 10.642 1.00 0.00 N ATOM 1503 CA PHE A 91 32.295 1.293 11.862 1.00 0.00 C ATOM 1504 C PHE A 91 33.299 0.154 11.704 1.00 0.00 C ATOM 1505 O PHE A 91 34.160 -0.046 12.559 1.00 0.00 O ATOM 1506 CB PHE A 91 30.914 0.716 12.179 1.00 0.00 C ATOM 1507 CG PHE A 91 30.996 -0.148 13.414 1.00 0.00 C ATOM 1508 CD1 PHE A 91 30.961 0.442 14.683 1.00 0.00 C ATOM 1509 CD2 PHE A 91 31.100 -1.538 13.291 1.00 0.00 C ATOM 1510 CE1 PHE A 91 31.032 -0.358 15.830 1.00 0.00 C ATOM 1511 CE2 PHE A 91 31.171 -2.339 14.437 1.00 0.00 C ATOM 1512 CZ PHE A 91 31.137 -1.749 15.707 1.00 0.00 C ATOM 0 H PHE A 91 31.304 2.132 10.213 1.00 0.00 H new ATOM 0 HA PHE A 91 32.619 1.937 12.679 1.00 0.00 H new ATOM 0 HB2 PHE A 91 30.199 1.524 12.335 1.00 0.00 H new ATOM 0 HB3 PHE A 91 30.552 0.128 11.335 1.00 0.00 H new ATOM 0 HD1 PHE A 91 30.879 1.515 14.777 1.00 0.00 H new ATOM 0 HD2 PHE A 91 31.126 -1.993 12.312 1.00 0.00 H new ATOM 0 HE1 PHE A 91 31.006 0.097 16.809 1.00 0.00 H new ATOM 0 HE2 PHE A 91 31.252 -3.412 14.342 1.00 0.00 H new ATOM 0 HZ PHE A 91 31.192 -2.367 16.591 1.00 0.00 H new ATOM 1522 N VAL A 92 33.186 -0.588 10.608 1.00 0.00 N ATOM 1523 CA VAL A 92 34.099 -1.697 10.358 1.00 0.00 C ATOM 1524 C VAL A 92 35.480 -1.181 9.956 1.00 0.00 C ATOM 1525 O VAL A 92 36.502 -1.770 10.309 1.00 0.00 O ATOM 1526 CB VAL A 92 33.542 -2.592 9.250 1.00 0.00 C ATOM 1527 CG1 VAL A 92 32.191 -3.163 9.685 1.00 0.00 C ATOM 1528 CG2 VAL A 92 33.360 -1.770 7.973 1.00 0.00 C ATOM 0 H VAL A 92 32.480 -0.444 9.886 1.00 0.00 H new ATOM 0 HA VAL A 92 34.197 -2.275 11.277 1.00 0.00 H new ATOM 0 HB VAL A 92 34.238 -3.409 9.060 1.00 0.00 H new ATOM 0 HG11 VAL A 92 31.794 -3.801 8.895 1.00 0.00 H new ATOM 0 HG12 VAL A 92 32.320 -3.750 10.595 1.00 0.00 H new ATOM 0 HG13 VAL A 92 31.495 -2.346 9.876 1.00 0.00 H new ATOM 0 HG21 VAL A 92 32.963 -2.408 7.183 1.00 0.00 H new ATOM 0 HG22 VAL A 92 32.665 -0.952 8.163 1.00 0.00 H new ATOM 0 HG23 VAL A 92 34.322 -1.363 7.662 1.00 0.00 H new ATOM 1538 N ASP A 93 35.501 -0.078 9.217 1.00 0.00 N ATOM 1539 CA ASP A 93 36.761 0.505 8.772 1.00 0.00 C ATOM 1540 C ASP A 93 37.610 0.928 9.967 1.00 0.00 C ATOM 1541 O ASP A 93 38.830 0.751 9.971 1.00 0.00 O ATOM 1542 CB ASP A 93 36.492 1.719 7.881 1.00 0.00 C ATOM 1543 CG ASP A 93 35.935 1.265 6.536 1.00 0.00 C ATOM 1544 OD1 ASP A 93 36.011 0.080 6.255 1.00 0.00 O ATOM 1545 OD2 ASP A 93 35.440 2.109 5.806 1.00 0.00 O ATOM 0 H ASP A 93 34.668 0.427 8.915 1.00 0.00 H new ATOM 0 HA ASP A 93 37.305 -0.249 8.203 1.00 0.00 H new ATOM 0 HB2 ASP A 93 35.785 2.389 8.369 1.00 0.00 H new ATOM 0 HB3 ASP A 93 37.413 2.282 7.731 1.00 0.00 H new ATOM 1550 N ILE A 94 36.958 1.489 10.979 1.00 0.00 N ATOM 1551 CA ILE A 94 37.671 1.933 12.168 1.00 0.00 C ATOM 1552 C ILE A 94 38.257 0.740 12.901 1.00 0.00 C ATOM 1553 O ILE A 94 39.262 0.862 13.590 1.00 0.00 O ATOM 1554 CB ILE A 94 36.733 2.665 13.124 1.00 0.00 C ATOM 1555 CG1 ILE A 94 37.525 3.728 13.888 1.00 0.00 C ATOM 1556 CG2 ILE A 94 36.169 1.654 14.127 1.00 0.00 C ATOM 1557 CD1 ILE A 94 36.560 4.634 14.654 1.00 0.00 C ATOM 0 H ILE A 94 35.950 1.645 11.000 1.00 0.00 H new ATOM 0 HA ILE A 94 38.464 2.608 11.845 1.00 0.00 H new ATOM 0 HB ILE A 94 35.924 3.136 12.565 1.00 0.00 H new ATOM 0 HG12 ILE A 94 38.219 3.251 14.580 1.00 0.00 H new ATOM 0 HG13 ILE A 94 38.122 4.320 13.194 1.00 0.00 H new ATOM 0 HG21 ILE A 94 35.496 2.163 14.817 1.00 0.00 H new ATOM 0 HG22 ILE A 94 35.621 0.878 13.592 1.00 0.00 H new ATOM 0 HG23 ILE A 94 36.988 1.201 14.686 1.00 0.00 H new ATOM 0 HD11 ILE A 94 37.125 5.391 15.198 1.00 0.00 H new ATOM 0 HD12 ILE A 94 35.884 5.121 13.952 1.00 0.00 H new ATOM 0 HD13 ILE A 94 35.982 4.037 15.359 1.00 0.00 H new ATOM 1569 N ILE A 95 37.607 -0.410 12.770 1.00 0.00 N ATOM 1570 CA ILE A 95 38.069 -1.609 13.455 1.00 0.00 C ATOM 1571 C ILE A 95 39.508 -1.927 13.062 1.00 0.00 C ATOM 1572 O ILE A 95 40.312 -2.329 13.900 1.00 0.00 O ATOM 1573 CB ILE A 95 37.162 -2.795 13.099 1.00 0.00 C ATOM 1574 CG1 ILE A 95 37.131 -3.786 14.263 1.00 0.00 C ATOM 1575 CG2 ILE A 95 37.705 -3.508 11.858 1.00 0.00 C ATOM 1576 CD1 ILE A 95 36.488 -3.122 15.479 1.00 0.00 C ATOM 0 H ILE A 95 36.769 -0.537 12.203 1.00 0.00 H new ATOM 0 HA ILE A 95 38.030 -1.432 14.530 1.00 0.00 H new ATOM 0 HB ILE A 95 36.156 -2.424 12.901 1.00 0.00 H new ATOM 0 HG12 ILE A 95 36.569 -4.677 13.982 1.00 0.00 H new ATOM 0 HG13 ILE A 95 38.143 -4.111 14.505 1.00 0.00 H new ATOM 0 HG21 ILE A 95 37.058 -4.349 11.609 1.00 0.00 H new ATOM 0 HG22 ILE A 95 37.732 -2.811 11.021 1.00 0.00 H new ATOM 0 HG23 ILE A 95 38.712 -3.872 12.059 1.00 0.00 H new ATOM 0 HD11 ILE A 95 36.465 -3.828 16.309 1.00 0.00 H new ATOM 0 HD12 ILE A 95 37.069 -2.245 15.764 1.00 0.00 H new ATOM 0 HD13 ILE A 95 35.470 -2.819 15.233 1.00 0.00 H new ATOM 1588 N GLU A 96 39.831 -1.746 11.786 1.00 0.00 N ATOM 1589 CA GLU A 96 41.182 -2.025 11.313 1.00 0.00 C ATOM 1590 C GLU A 96 42.211 -1.109 11.976 1.00 0.00 C ATOM 1591 O GLU A 96 43.236 -1.573 12.476 1.00 0.00 O ATOM 1592 CB GLU A 96 41.246 -1.847 9.796 1.00 0.00 C ATOM 1593 CG GLU A 96 42.659 -2.165 9.304 1.00 0.00 C ATOM 1594 CD GLU A 96 42.723 -2.042 7.785 1.00 0.00 C ATOM 1595 OE1 GLU A 96 41.703 -1.730 7.194 1.00 0.00 O ATOM 1596 OE2 GLU A 96 43.790 -2.264 7.238 1.00 0.00 O ATOM 0 H GLU A 96 39.186 -1.412 11.070 1.00 0.00 H new ATOM 0 HA GLU A 96 41.422 -3.054 11.579 1.00 0.00 H new ATOM 0 HB2 GLU A 96 40.524 -2.504 9.311 1.00 0.00 H new ATOM 0 HB3 GLU A 96 40.977 -0.825 9.527 1.00 0.00 H new ATOM 0 HG2 GLU A 96 43.375 -1.483 9.763 1.00 0.00 H new ATOM 0 HG3 GLU A 96 42.940 -3.173 9.608 1.00 0.00 H new ATOM 1603 N ASN A 97 41.937 0.194 11.972 1.00 0.00 N ATOM 1604 CA ASN A 97 42.853 1.162 12.570 1.00 0.00 C ATOM 1605 C ASN A 97 42.863 1.058 14.093 1.00 0.00 C ATOM 1606 O ASN A 97 43.910 1.184 14.728 1.00 0.00 O ATOM 1607 CB ASN A 97 42.455 2.579 12.157 1.00 0.00 C ATOM 1608 CG ASN A 97 42.788 2.805 10.686 1.00 0.00 C ATOM 1609 OD1 ASN A 97 43.608 2.086 10.117 1.00 0.00 O ATOM 1610 ND2 ASN A 97 42.198 3.768 10.033 1.00 0.00 N ATOM 0 H ASN A 97 41.095 0.601 11.565 1.00 0.00 H new ATOM 0 HA ASN A 97 43.856 0.939 12.208 1.00 0.00 H new ATOM 0 HB2 ASN A 97 41.389 2.730 12.325 1.00 0.00 H new ATOM 0 HB3 ASN A 97 42.981 3.308 12.774 1.00 0.00 H new ATOM 0 HD21 ASN A 97 42.416 3.926 9.049 1.00 0.00 H new ATOM 0 HD22 ASN A 97 41.518 4.363 10.506 1.00 0.00 H new ATOM 1617 N LYS A 98 41.688 0.842 14.669 1.00 0.00 N ATOM 1618 CA LYS A 98 41.556 0.740 16.116 1.00 0.00 C ATOM 1619 C LYS A 98 42.248 -0.508 16.642 1.00 0.00 C ATOM 1620 O LYS A 98 42.835 -0.487 17.723 1.00 0.00 O ATOM 1621 CB LYS A 98 40.081 0.719 16.514 1.00 0.00 C ATOM 1622 CG LYS A 98 39.804 1.874 17.479 1.00 0.00 C ATOM 1623 CD LYS A 98 39.704 3.183 16.696 1.00 0.00 C ATOM 1624 CE LYS A 98 40.116 4.351 17.594 1.00 0.00 C ATOM 1625 NZ LYS A 98 41.600 4.380 17.721 1.00 0.00 N ATOM 0 H LYS A 98 40.813 0.734 14.156 1.00 0.00 H new ATOM 0 HA LYS A 98 42.036 1.613 16.558 1.00 0.00 H new ATOM 0 HB2 LYS A 98 39.452 0.810 15.629 1.00 0.00 H new ATOM 0 HB3 LYS A 98 39.833 -0.232 16.985 1.00 0.00 H new ATOM 0 HG2 LYS A 98 38.877 1.692 18.023 1.00 0.00 H new ATOM 0 HG3 LYS A 98 40.601 1.941 18.220 1.00 0.00 H new ATOM 0 HD2 LYS A 98 40.347 3.143 15.817 1.00 0.00 H new ATOM 0 HD3 LYS A 98 38.684 3.328 16.339 1.00 0.00 H new ATOM 0 HE2 LYS A 98 39.758 5.291 17.174 1.00 0.00 H new ATOM 0 HE3 LYS A 98 39.658 4.247 18.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 41.861 4.696 18.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 41.981 3.427 17.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 41.996 5.037 17.019 1.00 0.00 H new ATOM 1639 N LEU A 99 42.188 -1.595 15.880 1.00 0.00 N ATOM 1640 CA LEU A 99 42.834 -2.820 16.316 1.00 0.00 C ATOM 1641 C LEU A 99 44.312 -2.549 16.556 1.00 0.00 C ATOM 1642 O LEU A 99 44.882 -2.975 17.559 1.00 0.00 O ATOM 1643 CB LEU A 99 42.680 -3.924 15.268 1.00 0.00 C ATOM 1644 CG LEU A 99 41.585 -4.898 15.706 1.00 0.00 C ATOM 1645 CD1 LEU A 99 40.219 -4.245 15.523 1.00 0.00 C ATOM 1646 CD2 LEU A 99 41.662 -6.166 14.854 1.00 0.00 C ATOM 0 H LEU A 99 41.711 -1.651 14.980 1.00 0.00 H new ATOM 0 HA LEU A 99 42.359 -3.155 17.238 1.00 0.00 H new ATOM 0 HB2 LEU A 99 42.428 -3.489 14.301 1.00 0.00 H new ATOM 0 HB3 LEU A 99 43.624 -4.455 15.143 1.00 0.00 H new ATOM 0 HG LEU A 99 41.726 -5.155 16.756 1.00 0.00 H new ATOM 0 HD11 LEU A 99 39.439 -4.939 15.835 1.00 0.00 H new ATOM 0 HD12 LEU A 99 40.164 -3.341 16.129 1.00 0.00 H new ATOM 0 HD13 LEU A 99 40.077 -3.987 14.474 1.00 0.00 H new ATOM 0 HD21 LEU A 99 40.882 -6.861 15.165 1.00 0.00 H new ATOM 0 HD22 LEU A 99 41.521 -5.908 13.804 1.00 0.00 H new ATOM 0 HD23 LEU A 99 42.638 -6.633 14.985 1.00 0.00 H new ATOM 1658 N ASP A 100 44.918 -1.816 15.633 1.00 0.00 N ATOM 1659 CA ASP A 100 46.325 -1.459 15.747 1.00 0.00 C ATOM 1660 C ASP A 100 46.549 -0.589 16.977 1.00 0.00 C ATOM 1661 O ASP A 100 47.563 -0.712 17.666 1.00 0.00 O ATOM 1662 CB ASP A 100 46.771 -0.699 14.498 1.00 0.00 C ATOM 1663 CG ASP A 100 46.858 -1.650 13.309 1.00 0.00 C ATOM 1664 OD1 ASP A 100 46.818 -2.849 13.532 1.00 0.00 O ATOM 1665 OD2 ASP A 100 46.962 -1.167 12.195 1.00 0.00 O ATOM 0 H ASP A 100 44.457 -1.457 14.797 1.00 0.00 H new ATOM 0 HA ASP A 100 46.911 -2.373 15.845 1.00 0.00 H new ATOM 0 HB2 ASP A 100 46.067 0.104 14.281 1.00 0.00 H new ATOM 0 HB3 ASP A 100 47.741 -0.234 14.673 1.00 0.00 H new ATOM 1670 N LYS A 101 45.597 0.301 17.235 1.00 0.00 N ATOM 1671 CA LYS A 101 45.689 1.208 18.371 1.00 0.00 C ATOM 1672 C LYS A 101 45.646 0.429 19.678 1.00 0.00 C ATOM 1673 O LYS A 101 46.357 0.751 20.630 1.00 0.00 O ATOM 1674 CB LYS A 101 44.526 2.203 18.328 1.00 0.00 C ATOM 1675 CG LYS A 101 44.636 3.055 17.061 1.00 0.00 C ATOM 1676 CD LYS A 101 45.929 3.871 17.104 1.00 0.00 C ATOM 1677 CE LYS A 101 46.024 4.742 15.849 1.00 0.00 C ATOM 1678 NZ LYS A 101 44.878 5.694 15.817 1.00 0.00 N ATOM 0 H LYS A 101 44.753 0.413 16.673 1.00 0.00 H new ATOM 0 HA LYS A 101 46.635 1.747 18.315 1.00 0.00 H new ATOM 0 HB2 LYS A 101 43.575 1.670 18.340 1.00 0.00 H new ATOM 0 HB3 LYS A 101 44.545 2.841 19.212 1.00 0.00 H new ATOM 0 HG2 LYS A 101 44.626 2.416 16.178 1.00 0.00 H new ATOM 0 HG3 LYS A 101 43.776 3.720 16.982 1.00 0.00 H new ATOM 0 HD2 LYS A 101 45.947 4.497 17.996 1.00 0.00 H new ATOM 0 HD3 LYS A 101 46.790 3.205 17.164 1.00 0.00 H new ATOM 0 HE2 LYS A 101 46.966 5.290 15.844 1.00 0.00 H new ATOM 0 HE3 LYS A 101 46.015 4.116 14.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 45.117 6.505 15.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 44.038 5.214 15.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 44.678 6.029 16.781 1.00 0.00 H new ATOM 1692 N ILE A 102 44.804 -0.595 19.715 1.00 0.00 N ATOM 1693 CA ILE A 102 44.666 -1.415 20.909 1.00 0.00 C ATOM 1694 C ILE A 102 45.834 -2.389 21.045 1.00 0.00 C ATOM 1695 O ILE A 102 46.296 -2.665 22.151 1.00 0.00 O ATOM 1696 CB ILE A 102 43.353 -2.191 20.843 1.00 0.00 C ATOM 1697 CG1 ILE A 102 43.349 -3.083 19.600 1.00 0.00 C ATOM 1698 CG2 ILE A 102 42.182 -1.209 20.767 1.00 0.00 C ATOM 1699 CD1 ILE A 102 42.153 -4.036 19.659 1.00 0.00 C ATOM 0 H ILE A 102 44.209 -0.876 18.935 1.00 0.00 H new ATOM 0 HA ILE A 102 44.666 -0.760 21.780 1.00 0.00 H new ATOM 0 HB ILE A 102 43.253 -2.809 21.735 1.00 0.00 H new ATOM 0 HG12 ILE A 102 43.295 -2.470 18.700 1.00 0.00 H new ATOM 0 HG13 ILE A 102 44.278 -3.651 19.544 1.00 0.00 H new ATOM 0 HG21 ILE A 102 41.245 -1.763 20.720 1.00 0.00 H new ATOM 0 HG22 ILE A 102 42.183 -0.572 21.652 1.00 0.00 H new ATOM 0 HG23 ILE A 102 42.283 -0.591 19.875 1.00 0.00 H new ATOM 0 HD11 ILE A 102 42.150 -4.671 18.773 1.00 0.00 H new ATOM 0 HD12 ILE A 102 42.227 -4.658 20.551 1.00 0.00 H new ATOM 0 HD13 ILE A 102 41.229 -3.459 19.694 1.00 0.00 H new ATOM 1711 N ILE A 103 46.308 -2.903 19.915 1.00 0.00 N ATOM 1712 CA ILE A 103 47.425 -3.842 19.926 1.00 0.00 C ATOM 1713 C ILE A 103 48.677 -3.186 20.495 1.00 0.00 C ATOM 1714 O ILE A 103 49.370 -3.768 21.330 1.00 0.00 O ATOM 1715 CB ILE A 103 47.703 -4.341 18.508 1.00 0.00 C ATOM 1716 CG1 ILE A 103 46.552 -5.239 18.048 1.00 0.00 C ATOM 1717 CG2 ILE A 103 49.008 -5.140 18.494 1.00 0.00 C ATOM 1718 CD1 ILE A 103 46.678 -5.503 16.546 1.00 0.00 C ATOM 0 H ILE A 103 45.941 -2.688 18.988 1.00 0.00 H new ATOM 0 HA ILE A 103 47.156 -4.687 20.560 1.00 0.00 H new ATOM 0 HB ILE A 103 47.791 -3.488 17.835 1.00 0.00 H new ATOM 0 HG12 ILE A 103 46.570 -6.181 18.596 1.00 0.00 H new ATOM 0 HG13 ILE A 103 45.596 -4.762 18.265 1.00 0.00 H new ATOM 0 HG21 ILE A 103 49.206 -5.496 17.483 1.00 0.00 H new ATOM 0 HG22 ILE A 103 49.829 -4.502 18.821 1.00 0.00 H new ATOM 0 HG23 ILE A 103 48.920 -5.992 19.168 1.00 0.00 H new ATOM 0 HD11 ILE A 103 45.858 -6.143 16.219 1.00 0.00 H new ATOM 0 HD12 ILE A 103 46.638 -4.557 16.006 1.00 0.00 H new ATOM 0 HD13 ILE A 103 47.628 -5.998 16.342 1.00 0.00 H new ATOM 1730 N GLU A 104 48.960 -1.968 20.042 1.00 0.00 N ATOM 1731 CA GLU A 104 50.130 -1.241 20.519 1.00 0.00 C ATOM 1732 C GLU A 104 50.000 -0.964 22.009 1.00 0.00 C ATOM 1733 O GLU A 104 50.960 -1.099 22.767 1.00 0.00 O ATOM 1734 CB GLU A 104 50.272 0.079 19.760 1.00 0.00 C ATOM 1735 CG GLU A 104 51.525 0.812 20.240 1.00 0.00 C ATOM 1736 CD GLU A 104 51.705 2.108 19.456 1.00 0.00 C ATOM 1737 OE1 GLU A 104 50.880 2.378 18.600 1.00 0.00 O ATOM 1738 OE2 GLU A 104 52.664 2.811 19.725 1.00 0.00 O ATOM 0 H GLU A 104 48.400 -1.468 19.351 1.00 0.00 H new ATOM 0 HA GLU A 104 51.017 -1.850 20.345 1.00 0.00 H new ATOM 0 HB2 GLU A 104 50.337 -0.111 18.689 1.00 0.00 H new ATOM 0 HB3 GLU A 104 49.391 0.700 19.921 1.00 0.00 H new ATOM 0 HG2 GLU A 104 51.443 1.030 21.305 1.00 0.00 H new ATOM 0 HG3 GLU A 104 52.400 0.175 20.112 1.00 0.00 H new ATOM 1745 N LYS A 105 48.802 -0.571 22.418 1.00 0.00 N ATOM 1746 CA LYS A 105 48.543 -0.276 23.819 1.00 0.00 C ATOM 1747 C LYS A 105 48.708 -1.526 24.679 1.00 0.00 C ATOM 1748 O LYS A 105 49.240 -1.462 25.786 1.00 0.00 O ATOM 1749 CB LYS A 105 47.121 0.262 23.973 1.00 0.00 C ATOM 1750 CG LYS A 105 47.032 1.665 23.368 1.00 0.00 C ATOM 1751 CD LYS A 105 45.650 2.256 23.655 1.00 0.00 C ATOM 1752 CE LYS A 105 44.591 1.492 22.857 1.00 0.00 C ATOM 1753 NZ LYS A 105 43.255 2.109 23.087 1.00 0.00 N ATOM 0 H LYS A 105 47.998 -0.450 21.802 1.00 0.00 H new ATOM 0 HA LYS A 105 49.263 0.472 24.152 1.00 0.00 H new ATOM 0 HB2 LYS A 105 46.414 -0.404 23.477 1.00 0.00 H new ATOM 0 HB3 LYS A 105 46.845 0.292 25.027 1.00 0.00 H new ATOM 0 HG2 LYS A 105 47.808 2.304 23.789 1.00 0.00 H new ATOM 0 HG3 LYS A 105 47.205 1.621 22.293 1.00 0.00 H new ATOM 0 HD2 LYS A 105 45.431 2.195 24.721 1.00 0.00 H new ATOM 0 HD3 LYS A 105 45.632 3.312 23.386 1.00 0.00 H new ATOM 0 HE2 LYS A 105 44.835 1.513 21.795 1.00 0.00 H new ATOM 0 HE3 LYS A 105 44.577 0.445 23.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 42.546 1.361 23.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 43.292 2.712 23.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 42.992 2.686 22.262 1.00 0.00 H new ATOM 1767 N ILE A 106 48.237 -2.660 24.165 1.00 0.00 N ATOM 1768 CA ILE A 106 48.322 -3.920 24.899 1.00 0.00 C ATOM 1769 C ILE A 106 49.745 -4.466 24.930 1.00 0.00 C ATOM 1770 O ILE A 106 50.212 -4.928 25.972 1.00 0.00 O ATOM 1771 CB ILE A 106 47.400 -4.957 24.263 1.00 0.00 C ATOM 1772 CG1 ILE A 106 46.054 -4.951 24.988 1.00 0.00 C ATOM 1773 CG2 ILE A 106 48.032 -6.346 24.378 1.00 0.00 C ATOM 1774 CD1 ILE A 106 44.961 -4.463 24.036 1.00 0.00 C ATOM 0 H ILE A 106 47.795 -2.732 23.249 1.00 0.00 H new ATOM 0 HA ILE A 106 48.012 -3.720 25.925 1.00 0.00 H new ATOM 0 HB ILE A 106 47.251 -4.713 23.211 1.00 0.00 H new ATOM 0 HG12 ILE A 106 45.818 -5.953 25.346 1.00 0.00 H new ATOM 0 HG13 ILE A 106 46.104 -4.303 25.863 1.00 0.00 H new ATOM 0 HG21 ILE A 106 47.372 -7.085 23.923 1.00 0.00 H new ATOM 0 HG22 ILE A 106 48.993 -6.352 23.863 1.00 0.00 H new ATOM 0 HG23 ILE A 106 48.182 -6.592 25.429 1.00 0.00 H new ATOM 0 HD11 ILE A 106 44.002 -4.459 24.554 1.00 0.00 H new ATOM 0 HD12 ILE A 106 45.196 -3.453 23.700 1.00 0.00 H new ATOM 0 HD13 ILE A 106 44.905 -5.128 23.174 1.00 0.00 H new ATOM 1786 N ASP A 107 50.428 -4.429 23.793 1.00 0.00 N ATOM 1787 CA ASP A 107 51.788 -4.947 23.735 1.00 0.00 C ATOM 1788 C ASP A 107 52.769 -3.950 24.342 1.00 0.00 C ATOM 1789 O ASP A 107 53.959 -4.237 24.479 1.00 0.00 O ATOM 1790 CB ASP A 107 52.179 -5.250 22.286 1.00 0.00 C ATOM 1791 CG ASP A 107 52.229 -3.964 21.472 1.00 0.00 C ATOM 1792 OD1 ASP A 107 52.005 -2.915 22.050 1.00 0.00 O ATOM 1793 OD2 ASP A 107 52.490 -4.047 20.284 1.00 0.00 O ATOM 0 H ASP A 107 50.071 -4.053 22.914 1.00 0.00 H new ATOM 0 HA ASP A 107 51.828 -5.870 24.313 1.00 0.00 H new ATOM 0 HB2 ASP A 107 53.151 -5.743 22.260 1.00 0.00 H new ATOM 0 HB3 ASP A 107 51.460 -5.940 21.845 1.00 0.00 H new ATOM 1798 N LYS A 108 52.259 -2.783 24.724 1.00 0.00 N ATOM 1799 CA LYS A 108 53.095 -1.757 25.339 1.00 0.00 C ATOM 1800 C LYS A 108 52.690 -1.551 26.795 1.00 0.00 C ATOM 1801 O LYS A 108 53.524 -1.238 27.644 1.00 0.00 O ATOM 1802 CB LYS A 108 52.959 -0.435 24.578 1.00 0.00 C ATOM 1803 CG LYS A 108 53.622 -0.552 23.203 1.00 0.00 C ATOM 1804 CD LYS A 108 55.135 -0.722 23.371 1.00 0.00 C ATOM 1805 CE LYS A 108 55.725 0.548 23.987 1.00 0.00 C ATOM 1806 NZ LYS A 108 57.207 0.417 24.073 1.00 0.00 N ATOM 0 H LYS A 108 51.278 -2.525 24.620 1.00 0.00 H new ATOM 0 HA LYS A 108 54.133 -2.088 25.298 1.00 0.00 H new ATOM 0 HB2 LYS A 108 51.906 -0.179 24.462 1.00 0.00 H new ATOM 0 HB3 LYS A 108 53.422 0.371 25.147 1.00 0.00 H new ATOM 0 HG2 LYS A 108 53.209 -1.403 22.661 1.00 0.00 H new ATOM 0 HG3 LYS A 108 53.410 0.338 22.610 1.00 0.00 H new ATOM 0 HD2 LYS A 108 55.347 -1.581 24.008 1.00 0.00 H new ATOM 0 HD3 LYS A 108 55.599 -0.920 22.405 1.00 0.00 H new ATOM 0 HE2 LYS A 108 55.461 1.415 23.382 1.00 0.00 H new ATOM 0 HE3 LYS A 108 55.306 0.712 24.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 57.608 1.280 24.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 57.449 -0.401 24.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 57.599 0.280 23.120 1.00 0.00 H new ATOM 1820 N LEU A 109 51.402 -1.731 27.073 1.00 0.00 N ATOM 1821 CA LEU A 109 50.891 -1.565 28.428 1.00 0.00 C ATOM 1822 C LEU A 109 49.589 -2.339 28.612 1.00 0.00 C ATOM 1823 O LEU A 109 48.683 -2.252 27.784 1.00 0.00 O ATOM 1824 CB LEU A 109 50.652 -0.081 28.712 1.00 0.00 C ATOM 1825 CG LEU A 109 49.931 0.554 27.522 1.00 0.00 C ATOM 1826 CD1 LEU A 109 48.425 0.323 27.649 1.00 0.00 C ATOM 1827 CD2 LEU A 109 50.215 2.058 27.500 1.00 0.00 C ATOM 0 H LEU A 109 50.698 -1.990 26.382 1.00 0.00 H new ATOM 0 HA LEU A 109 51.630 -1.956 29.127 1.00 0.00 H new ATOM 0 HB2 LEU A 109 50.056 0.036 29.617 1.00 0.00 H new ATOM 0 HB3 LEU A 109 51.602 0.424 28.888 1.00 0.00 H new ATOM 0 HG LEU A 109 50.289 0.100 26.598 1.00 0.00 H new ATOM 0 HD11 LEU A 109 47.914 0.777 26.800 1.00 0.00 H new ATOM 0 HD12 LEU A 109 48.221 -0.748 27.665 1.00 0.00 H new ATOM 0 HD13 LEU A 109 48.064 0.775 28.573 1.00 0.00 H new ATOM 0 HD21 LEU A 109 49.702 2.513 26.653 1.00 0.00 H new ATOM 0 HD22 LEU A 109 49.857 2.509 28.425 1.00 0.00 H new ATOM 0 HD23 LEU A 109 51.288 2.224 27.406 1.00 0.00 H new ATOM 1839 N ASP A 110 49.496 -3.091 29.702 1.00 0.00 N ATOM 1840 CA ASP A 110 48.291 -3.865 29.975 1.00 0.00 C ATOM 1841 C ASP A 110 47.135 -2.938 30.338 1.00 0.00 C ATOM 1842 O ASP A 110 47.336 -1.898 30.964 1.00 0.00 O ATOM 1843 CB ASP A 110 48.542 -4.845 31.122 1.00 0.00 C ATOM 1844 CG ASP A 110 49.462 -5.969 30.657 1.00 0.00 C ATOM 1845 OD1 ASP A 110 49.657 -6.090 29.459 1.00 0.00 O ATOM 1846 OD2 ASP A 110 49.956 -6.693 31.505 1.00 0.00 O ATOM 0 H ASP A 110 50.231 -3.181 30.404 1.00 0.00 H new ATOM 0 HA ASP A 110 48.030 -4.424 29.076 1.00 0.00 H new ATOM 0 HB2 ASP A 110 48.991 -4.322 31.966 1.00 0.00 H new ATOM 0 HB3 ASP A 110 47.596 -5.259 31.471 1.00 0.00 H new ATOM 1851 N LEU A 111 45.926 -3.323 29.946 1.00 0.00 N ATOM 1852 CA LEU A 111 44.748 -2.517 30.243 1.00 0.00 C ATOM 1853 C LEU A 111 44.304 -2.742 31.683 1.00 0.00 C ATOM 1854 O LEU A 111 43.490 -1.994 32.219 1.00 0.00 O ATOM 1855 CB LEU A 111 43.610 -2.884 29.291 1.00 0.00 C ATOM 1856 CG LEU A 111 44.030 -2.581 27.854 1.00 0.00 C ATOM 1857 CD1 LEU A 111 42.926 -3.027 26.899 1.00 0.00 C ATOM 1858 CD2 LEU A 111 44.261 -1.076 27.697 1.00 0.00 C ATOM 0 H LEU A 111 45.736 -4.180 29.427 1.00 0.00 H new ATOM 0 HA LEU A 111 45.003 -1.466 30.110 1.00 0.00 H new ATOM 0 HB2 LEU A 111 43.362 -3.941 29.394 1.00 0.00 H new ATOM 0 HB3 LEU A 111 42.713 -2.320 29.545 1.00 0.00 H new ATOM 0 HG LEU A 111 44.951 -3.116 27.623 1.00 0.00 H new ATOM 0 HD11 LEU A 111 43.224 -2.812 25.873 1.00 0.00 H new ATOM 0 HD12 LEU A 111 42.759 -4.098 27.011 1.00 0.00 H new ATOM 0 HD13 LEU A 111 42.006 -2.490 27.130 1.00 0.00 H new ATOM 0 HD21 LEU A 111 44.561 -0.859 26.672 1.00 0.00 H new ATOM 0 HD22 LEU A 111 43.340 -0.541 27.927 1.00 0.00 H new ATOM 0 HD23 LEU A 111 45.047 -0.755 28.381 1.00 0.00 H new ATOM 1870 N ASP A 112 44.855 -3.780 32.301 1.00 0.00 N ATOM 1871 CA ASP A 112 44.524 -4.107 33.682 1.00 0.00 C ATOM 1872 C ASP A 112 44.885 -2.947 34.603 1.00 0.00 C ATOM 1873 O ASP A 112 44.169 -2.653 35.560 1.00 0.00 O ATOM 1874 CB ASP A 112 45.282 -5.362 34.118 1.00 0.00 C ATOM 1875 CG ASP A 112 44.851 -5.769 35.523 1.00 0.00 C ATOM 1876 OD1 ASP A 112 44.143 -4.999 36.150 1.00 0.00 O ATOM 1877 OD2 ASP A 112 45.237 -6.845 35.951 1.00 0.00 O ATOM 0 H ASP A 112 45.532 -4.409 31.868 1.00 0.00 H new ATOM 0 HA ASP A 112 43.452 -4.291 33.747 1.00 0.00 H new ATOM 0 HB2 ASP A 112 45.088 -6.176 33.419 1.00 0.00 H new ATOM 0 HB3 ASP A 112 46.355 -5.174 34.098 1.00 0.00 H new ATOM 1882 N LYS A 113 46.003 -2.295 34.306 1.00 0.00 N ATOM 1883 CA LYS A 113 46.460 -1.169 35.112 1.00 0.00 C ATOM 1884 C LYS A 113 45.471 -0.020 35.030 1.00 0.00 C ATOM 1885 O LYS A 113 45.208 0.664 36.020 1.00 0.00 O ATOM 1886 CB LYS A 113 47.819 -0.689 34.607 1.00 0.00 C ATOM 1887 CG LYS A 113 48.893 -1.720 34.956 1.00 0.00 C ATOM 1888 CD LYS A 113 50.269 -1.176 34.567 1.00 0.00 C ATOM 1889 CE LYS A 113 50.381 -1.119 33.043 1.00 0.00 C ATOM 1890 NZ LYS A 113 51.745 -0.653 32.662 1.00 0.00 N ATOM 0 H LYS A 113 46.607 -2.525 33.517 1.00 0.00 H new ATOM 0 HA LYS A 113 46.543 -1.499 36.147 1.00 0.00 H new ATOM 0 HB2 LYS A 113 47.784 -0.537 33.528 1.00 0.00 H new ATOM 0 HB3 LYS A 113 48.065 0.273 35.056 1.00 0.00 H new ATOM 0 HG2 LYS A 113 48.866 -1.942 36.023 1.00 0.00 H new ATOM 0 HG3 LYS A 113 48.698 -2.655 34.431 1.00 0.00 H new ATOM 0 HD2 LYS A 113 50.412 -0.182 34.990 1.00 0.00 H new ATOM 0 HD3 LYS A 113 51.053 -1.813 34.977 1.00 0.00 H new ATOM 0 HE2 LYS A 113 50.189 -2.104 32.617 1.00 0.00 H new ATOM 0 HE3 LYS A 113 49.628 -0.444 32.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 51.822 -0.614 31.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 51.911 0.294 33.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 52.455 -1.314 33.037 1.00 0.00 H new ATOM 1904 N TYR A 114 44.936 0.190 33.840 1.00 0.00 N ATOM 1905 CA TYR A 114 43.985 1.264 33.621 1.00 0.00 C ATOM 1906 C TYR A 114 42.604 0.867 34.124 1.00 0.00 C ATOM 1907 O TYR A 114 42.243 -0.307 34.110 1.00 0.00 O ATOM 1908 CB TYR A 114 43.899 1.576 32.133 1.00 0.00 C ATOM 1909 CG TYR A 114 45.244 2.031 31.629 1.00 0.00 C ATOM 1910 CD1 TYR A 114 46.047 1.148 30.902 1.00 0.00 C ATOM 1911 CD2 TYR A 114 45.686 3.333 31.885 1.00 0.00 C ATOM 1912 CE1 TYR A 114 47.294 1.565 30.430 1.00 0.00 C ATOM 1913 CE2 TYR A 114 46.935 3.752 31.413 1.00 0.00 C ATOM 1914 CZ TYR A 114 47.740 2.867 30.685 1.00 0.00 C ATOM 1915 OH TYR A 114 48.972 3.278 30.221 1.00 0.00 O ATOM 0 H TYR A 114 45.144 -0.368 33.012 1.00 0.00 H new ATOM 0 HA TYR A 114 44.325 2.143 34.169 1.00 0.00 H new ATOM 0 HB2 TYR A 114 43.575 0.691 31.585 1.00 0.00 H new ATOM 0 HB3 TYR A 114 43.153 2.351 31.957 1.00 0.00 H new ATOM 0 HD1 TYR A 114 45.704 0.143 30.705 1.00 0.00 H new ATOM 0 HD2 TYR A 114 45.064 4.014 32.446 1.00 0.00 H new ATOM 0 HE1 TYR A 114 47.914 0.882 29.868 1.00 0.00 H new ATOM 0 HE2 TYR A 114 47.278 4.757 31.610 1.00 0.00 H new ATOM 0 HH TYR A 114 48.851 3.854 29.437 1.00 0.00 H new ATOM 1925 N ARG A 115 41.830 1.853 34.560 1.00 0.00 N ATOM 1926 CA ARG A 115 40.486 1.584 35.052 1.00 0.00 C ATOM 1927 C ARG A 115 39.449 2.009 34.015 1.00 0.00 C ATOM 1928 O ARG A 115 38.363 1.435 33.941 1.00 0.00 O ATOM 1929 CB ARG A 115 40.240 2.339 36.358 1.00 0.00 C ATOM 1930 CG ARG A 115 41.274 1.910 37.401 1.00 0.00 C ATOM 1931 CD ARG A 115 41.078 0.431 37.739 1.00 0.00 C ATOM 1932 NE ARG A 115 41.971 0.037 38.823 1.00 0.00 N ATOM 1933 CZ ARG A 115 42.013 -1.220 39.254 1.00 0.00 C ATOM 1934 NH1 ARG A 115 41.244 -2.122 38.709 1.00 0.00 N ATOM 1935 NH2 ARG A 115 42.822 -1.551 40.223 1.00 0.00 N ATOM 0 H ARG A 115 42.106 2.835 34.583 1.00 0.00 H new ATOM 0 HA ARG A 115 40.393 0.513 35.234 1.00 0.00 H new ATOM 0 HB2 ARG A 115 40.306 3.413 36.187 1.00 0.00 H new ATOM 0 HB3 ARG A 115 39.234 2.135 36.724 1.00 0.00 H new ATOM 0 HG2 ARG A 115 42.281 2.076 37.019 1.00 0.00 H new ATOM 0 HG3 ARG A 115 41.171 2.516 38.301 1.00 0.00 H new ATOM 0 HD2 ARG A 115 40.043 0.251 38.028 1.00 0.00 H new ATOM 0 HD3 ARG A 115 41.273 -0.180 36.857 1.00 0.00 H new ATOM 0 HE ARG A 115 42.573 0.737 39.257 1.00 0.00 H new ATOM 0 HH11 ARG A 115 40.611 -1.863 37.952 1.00 0.00 H new ATOM 0 HH12 ARG A 115 41.276 -3.086 39.039 1.00 0.00 H new ATOM 0 HH21 ARG A 115 43.422 -0.845 40.650 1.00 0.00 H new ATOM 0 HH22 ARG A 115 42.854 -2.515 40.554 1.00 0.00 H new ATOM 1949 N PHE A 116 39.790 3.019 33.216 1.00 0.00 N ATOM 1950 CA PHE A 116 38.872 3.507 32.191 1.00 0.00 C ATOM 1951 C PHE A 116 39.628 4.018 30.971 1.00 0.00 C ATOM 1952 O PHE A 116 40.521 4.858 31.088 1.00 0.00 O ATOM 1953 CB PHE A 116 38.004 4.632 32.759 1.00 0.00 C ATOM 1954 CG PHE A 116 37.075 5.145 31.684 1.00 0.00 C ATOM 1955 CD1 PHE A 116 35.907 4.438 31.373 1.00 0.00 C ATOM 1956 CD2 PHE A 116 37.382 6.327 31.000 1.00 0.00 C ATOM 1957 CE1 PHE A 116 35.046 4.914 30.376 1.00 0.00 C ATOM 1958 CE2 PHE A 116 36.521 6.803 30.003 1.00 0.00 C ATOM 1959 CZ PHE A 116 35.353 6.096 29.692 1.00 0.00 C ATOM 0 H PHE A 116 40.683 3.509 33.258 1.00 0.00 H new ATOM 0 HA PHE A 116 38.241 2.674 31.883 1.00 0.00 H new ATOM 0 HB2 PHE A 116 37.427 4.267 33.609 1.00 0.00 H new ATOM 0 HB3 PHE A 116 38.634 5.442 33.126 1.00 0.00 H new ATOM 0 HD1 PHE A 116 35.670 3.526 31.901 1.00 0.00 H new ATOM 0 HD2 PHE A 116 38.283 6.872 31.241 1.00 0.00 H new ATOM 0 HE1 PHE A 116 34.145 4.369 30.135 1.00 0.00 H new ATOM 0 HE2 PHE A 116 36.758 7.715 29.475 1.00 0.00 H new ATOM 0 HZ PHE A 116 34.689 6.463 28.924 1.00 0.00 H new ATOM 1969 N ILE A 117 39.247 3.521 29.800 1.00 0.00 N ATOM 1970 CA ILE A 117 39.875 3.949 28.561 1.00 0.00 C ATOM 1971 C ILE A 117 38.822 4.419 27.581 1.00 0.00 C ATOM 1972 O ILE A 117 37.757 3.814 27.458 1.00 0.00 O ATOM 1973 CB ILE A 117 40.682 2.818 27.934 1.00 0.00 C ATOM 1974 CG1 ILE A 117 42.101 2.877 28.480 1.00 0.00 C ATOM 1975 CG2 ILE A 117 40.716 2.996 26.416 1.00 0.00 C ATOM 1976 CD1 ILE A 117 42.117 2.343 29.910 1.00 0.00 C ATOM 0 H ILE A 117 38.510 2.825 29.685 1.00 0.00 H new ATOM 0 HA ILE A 117 40.552 4.770 28.795 1.00 0.00 H new ATOM 0 HB ILE A 117 40.226 1.857 28.173 1.00 0.00 H new ATOM 0 HG12 ILE A 117 42.769 2.287 27.852 1.00 0.00 H new ATOM 0 HG13 ILE A 117 42.468 3.903 28.459 1.00 0.00 H new ATOM 0 HG21 ILE A 117 41.293 2.187 25.968 1.00 0.00 H new ATOM 0 HG22 ILE A 117 39.699 2.976 26.024 1.00 0.00 H new ATOM 0 HG23 ILE A 117 41.180 3.952 26.172 1.00 0.00 H new ATOM 0 HD11 ILE A 117 43.133 2.385 30.303 1.00 0.00 H new ATOM 0 HD12 ILE A 117 41.462 2.952 30.533 1.00 0.00 H new ATOM 0 HD13 ILE A 117 41.767 1.311 29.917 1.00 0.00 H new ATOM 1988 N ASN A 118 39.118 5.508 26.898 1.00 0.00 N ATOM 1989 CA ASN A 118 38.180 6.061 25.946 1.00 0.00 C ATOM 1990 C ASN A 118 38.903 6.496 24.677 1.00 0.00 C ATOM 1991 O ASN A 118 39.678 7.452 24.688 1.00 0.00 O ATOM 1992 CB ASN A 118 37.475 7.244 26.594 1.00 0.00 C ATOM 1993 CG ASN A 118 36.267 7.661 25.761 1.00 0.00 C ATOM 1994 OD1 ASN A 118 35.595 6.813 25.174 1.00 0.00 O ATOM 1995 ND2 ASN A 118 35.950 8.924 25.673 1.00 0.00 N ATOM 0 H ASN A 118 39.994 6.023 26.985 1.00 0.00 H new ATOM 0 HA ASN A 118 37.447 5.305 25.667 1.00 0.00 H new ATOM 0 HB2 ASN A 118 37.156 6.979 27.602 1.00 0.00 H new ATOM 0 HB3 ASN A 118 38.167 8.081 26.689 1.00 0.00 H new ATOM 0 HD21 ASN A 118 35.144 9.210 25.117 1.00 0.00 H new ATOM 0 HD22 ASN A 118 36.508 9.625 26.160 1.00 0.00 H new ATOM 2002 N ALA A 119 38.647 5.781 23.588 1.00 0.00 N ATOM 2003 CA ALA A 119 39.280 6.094 22.316 1.00 0.00 C ATOM 2004 C ALA A 119 38.322 6.859 21.413 1.00 0.00 C ATOM 2005 O ALA A 119 37.161 6.482 21.254 1.00 0.00 O ATOM 2006 CB ALA A 119 39.724 4.807 21.620 1.00 0.00 C ATOM 0 H ALA A 119 38.009 4.985 23.561 1.00 0.00 H new ATOM 0 HA ALA A 119 40.152 6.718 22.512 1.00 0.00 H new ATOM 0 HB1 ALA A 119 40.197 5.052 20.669 1.00 0.00 H new ATOM 0 HB2 ALA A 119 40.436 4.278 22.253 1.00 0.00 H new ATOM 0 HB3 ALA A 119 38.856 4.172 21.441 1.00 0.00 H new ATOM 2012 N THR A 120 38.823 7.936 20.829 1.00 0.00 N ATOM 2013 CA THR A 120 38.023 8.765 19.940 1.00 0.00 C ATOM 2014 C THR A 120 38.288 8.383 18.486 1.00 0.00 C ATOM 2015 O THR A 120 39.275 7.712 18.185 1.00 0.00 O ATOM 2016 CB THR A 120 38.345 10.241 20.172 1.00 0.00 C ATOM 2017 OG1 THR A 120 38.318 10.513 21.566 1.00 0.00 O ATOM 2018 CG2 THR A 120 37.299 11.108 19.468 1.00 0.00 C ATOM 0 H THR A 120 39.783 8.258 20.955 1.00 0.00 H new ATOM 0 HA THR A 120 36.967 8.600 20.155 1.00 0.00 H new ATOM 0 HB THR A 120 39.334 10.466 19.772 1.00 0.00 H new ATOM 0 HG1 THR A 120 38.526 11.458 21.719 1.00 0.00 H new ATOM 0 HG21 THR A 120 37.528 12.161 19.633 1.00 0.00 H new ATOM 0 HG22 THR A 120 37.312 10.897 18.399 1.00 0.00 H new ATOM 0 HG23 THR A 120 36.311 10.884 19.870 1.00 0.00 H new ATOM 2026 N ASN A 121 37.386 8.790 17.596 1.00 0.00 N ATOM 2027 CA ASN A 121 37.511 8.467 16.174 1.00 0.00 C ATOM 2028 C ASN A 121 38.967 8.522 15.708 1.00 0.00 C ATOM 2029 O ASN A 121 39.863 8.910 16.458 1.00 0.00 O ATOM 2030 CB ASN A 121 36.678 9.447 15.347 1.00 0.00 C ATOM 2031 CG ASN A 121 36.383 8.852 13.974 1.00 0.00 C ATOM 2032 OD1 ASN A 121 36.195 7.641 13.849 1.00 0.00 O ATOM 2033 ND2 ASN A 121 36.330 9.635 12.932 1.00 0.00 N ATOM 0 H ASN A 121 36.562 9.343 17.832 1.00 0.00 H new ATOM 0 HA ASN A 121 37.146 7.450 16.031 1.00 0.00 H new ATOM 0 HB2 ASN A 121 35.745 9.670 15.864 1.00 0.00 H new ATOM 0 HB3 ASN A 121 37.214 10.390 15.236 1.00 0.00 H new ATOM 0 HD21 ASN A 121 36.132 9.245 12.010 1.00 0.00 H new ATOM 0 HD22 ASN A 121 36.486 10.637 13.039 1.00 0.00 H new ATOM 2040 N LEU A 122 39.190 8.113 14.462 1.00 0.00 N ATOM 2041 CA LEU A 122 40.535 8.087 13.893 1.00 0.00 C ATOM 2042 C LEU A 122 41.160 9.478 13.876 1.00 0.00 C ATOM 2043 O LEU A 122 42.350 9.631 14.147 1.00 0.00 O ATOM 2044 CB LEU A 122 40.477 7.540 12.466 1.00 0.00 C ATOM 2045 CG LEU A 122 40.128 6.052 12.504 1.00 0.00 C ATOM 2046 CD1 LEU A 122 39.825 5.564 11.086 1.00 0.00 C ATOM 2047 CD2 LEU A 122 41.312 5.263 13.069 1.00 0.00 C ATOM 0 H LEU A 122 38.458 7.795 13.827 1.00 0.00 H new ATOM 0 HA LEU A 122 41.153 7.442 14.518 1.00 0.00 H new ATOM 0 HB2 LEU A 122 39.732 8.085 11.886 1.00 0.00 H new ATOM 0 HB3 LEU A 122 41.436 7.687 11.970 1.00 0.00 H new ATOM 0 HG LEU A 122 39.254 5.901 13.138 1.00 0.00 H new ATOM 0 HD11 LEU A 122 39.576 4.503 11.112 1.00 0.00 H new ATOM 0 HD12 LEU A 122 38.983 6.125 10.680 1.00 0.00 H new ATOM 0 HD13 LEU A 122 40.700 5.716 10.454 1.00 0.00 H new ATOM 0 HD21 LEU A 122 41.063 4.202 13.096 1.00 0.00 H new ATOM 0 HD22 LEU A 122 42.186 5.414 12.435 1.00 0.00 H new ATOM 0 HD23 LEU A 122 41.532 5.610 14.079 1.00 0.00 H new ATOM 2059 N GLU A 123 40.361 10.488 13.562 1.00 0.00 N ATOM 2060 CA GLU A 123 40.869 11.854 13.526 1.00 0.00 C ATOM 2061 C GLU A 123 41.287 12.279 14.929 1.00 0.00 C ATOM 2062 O GLU A 123 42.243 13.032 15.108 1.00 0.00 O ATOM 2063 CB GLU A 123 39.790 12.803 12.999 1.00 0.00 C ATOM 2064 CG GLU A 123 39.558 12.539 11.510 1.00 0.00 C ATOM 2065 CD GLU A 123 38.377 13.364 11.013 1.00 0.00 C ATOM 2066 OE1 GLU A 123 37.677 13.920 11.843 1.00 0.00 O ATOM 2067 OE2 GLU A 123 38.187 13.426 9.809 1.00 0.00 O ATOM 0 H GLU A 123 39.372 10.392 13.331 1.00 0.00 H new ATOM 0 HA GLU A 123 41.732 11.896 12.861 1.00 0.00 H new ATOM 0 HB2 GLU A 123 38.862 12.659 13.553 1.00 0.00 H new ATOM 0 HB3 GLU A 123 40.095 13.838 13.152 1.00 0.00 H new ATOM 0 HG2 GLU A 123 40.454 12.793 10.943 1.00 0.00 H new ATOM 0 HG3 GLU A 123 39.366 11.479 11.346 1.00 0.00 H new ATOM 2074 N HIS A 124 40.556 11.778 15.916 1.00 0.00 N ATOM 2075 CA HIS A 124 40.836 12.087 17.311 1.00 0.00 C ATOM 2076 C HIS A 124 41.820 11.078 17.901 1.00 0.00 C ATOM 2077 O HIS A 124 42.062 10.020 17.320 1.00 0.00 O ATOM 2078 CB HIS A 124 39.537 12.064 18.111 1.00 0.00 C ATOM 2079 CG HIS A 124 38.651 13.192 17.661 1.00 0.00 C ATOM 2080 ND1 HIS A 124 37.846 13.096 16.536 1.00 0.00 N ATOM 2081 CD2 HIS A 124 38.434 14.449 18.170 1.00 0.00 C ATOM 2082 CE1 HIS A 124 37.188 14.262 16.407 1.00 0.00 C ATOM 2083 NE2 HIS A 124 37.509 15.122 17.377 1.00 0.00 N ATOM 0 H HIS A 124 39.762 11.154 15.775 1.00 0.00 H new ATOM 0 HA HIS A 124 41.283 13.080 17.364 1.00 0.00 H new ATOM 0 HB2 HIS A 124 39.028 11.110 17.971 1.00 0.00 H new ATOM 0 HB3 HIS A 124 39.751 12.158 19.176 1.00 0.00 H new ATOM 0 HD2 HIS A 124 38.909 14.854 19.052 1.00 0.00 H new ATOM 0 HE1 HIS A 124 36.486 14.477 15.615 1.00 0.00 H new ATOM 0 HE2 HIS A 124 37.153 16.069 17.508 1.00 0.00 H new ATOM 2091 N ASP A 125 42.388 11.417 19.053 1.00 0.00 N ATOM 2092 CA ASP A 125 43.352 10.542 19.714 1.00 0.00 C ATOM 2093 C ASP A 125 42.676 9.725 20.813 1.00 0.00 C ATOM 2094 O ASP A 125 41.515 9.959 21.151 1.00 0.00 O ATOM 2095 CB ASP A 125 44.482 11.376 20.320 1.00 0.00 C ATOM 2096 CG ASP A 125 45.175 12.184 19.228 1.00 0.00 C ATOM 2097 OD1 ASP A 125 45.472 11.612 18.193 1.00 0.00 O ATOM 2098 OD2 ASP A 125 45.396 13.365 19.444 1.00 0.00 O ATOM 0 H ASP A 125 42.199 12.289 19.548 1.00 0.00 H new ATOM 0 HA ASP A 125 43.761 9.858 18.970 1.00 0.00 H new ATOM 0 HB2 ASP A 125 44.083 12.046 21.082 1.00 0.00 H new ATOM 0 HB3 ASP A 125 45.202 10.724 20.814 1.00 0.00 H new ATOM 2103 N ILE A 126 43.409 8.759 21.362 1.00 0.00 N ATOM 2104 CA ILE A 126 42.871 7.903 22.416 1.00 0.00 C ATOM 2105 C ILE A 126 43.513 8.256 23.753 1.00 0.00 C ATOM 2106 O ILE A 126 44.719 8.491 23.833 1.00 0.00 O ATOM 2107 CB ILE A 126 43.139 6.431 22.072 1.00 0.00 C ATOM 2108 CG1 ILE A 126 43.028 5.556 23.330 1.00 0.00 C ATOM 2109 CG2 ILE A 126 44.544 6.295 21.481 1.00 0.00 C ATOM 2110 CD1 ILE A 126 44.293 5.699 24.180 1.00 0.00 C ATOM 0 H ILE A 126 44.371 8.550 21.096 1.00 0.00 H new ATOM 0 HA ILE A 126 41.795 8.061 22.493 1.00 0.00 H new ATOM 0 HB ILE A 126 42.397 6.099 21.346 1.00 0.00 H new ATOM 0 HG12 ILE A 126 42.154 5.850 23.911 1.00 0.00 H new ATOM 0 HG13 ILE A 126 42.886 4.513 23.046 1.00 0.00 H new ATOM 0 HG21 ILE A 126 44.736 5.250 21.236 1.00 0.00 H new ATOM 0 HG22 ILE A 126 44.618 6.899 20.577 1.00 0.00 H new ATOM 0 HG23 ILE A 126 45.280 6.638 22.208 1.00 0.00 H new ATOM 0 HD11 ILE A 126 44.206 5.075 25.070 1.00 0.00 H new ATOM 0 HD12 ILE A 126 45.159 5.383 23.599 1.00 0.00 H new ATOM 0 HD13 ILE A 126 44.416 6.740 24.477 1.00 0.00 H new ATOM 2122 N LYS A 127 42.692 8.315 24.795 1.00 0.00 N ATOM 2123 CA LYS A 127 43.180 8.665 26.124 1.00 0.00 C ATOM 2124 C LYS A 127 42.789 7.599 27.141 1.00 0.00 C ATOM 2125 O LYS A 127 41.765 6.931 26.992 1.00 0.00 O ATOM 2126 CB LYS A 127 42.589 10.011 26.548 1.00 0.00 C ATOM 2127 CG LYS A 127 43.073 11.104 25.594 1.00 0.00 C ATOM 2128 CD LYS A 127 42.479 12.449 26.016 1.00 0.00 C ATOM 2129 CE LYS A 127 42.960 13.543 25.060 1.00 0.00 C ATOM 2130 NZ LYS A 127 42.374 14.850 25.468 1.00 0.00 N ATOM 0 H LYS A 127 41.691 8.126 24.746 1.00 0.00 H new ATOM 0 HA LYS A 127 44.267 8.731 26.087 1.00 0.00 H new ATOM 0 HB2 LYS A 127 41.500 9.961 26.539 1.00 0.00 H new ATOM 0 HB3 LYS A 127 42.888 10.246 27.569 1.00 0.00 H new ATOM 0 HG2 LYS A 127 44.162 11.156 25.605 1.00 0.00 H new ATOM 0 HG3 LYS A 127 42.776 10.868 24.572 1.00 0.00 H new ATOM 0 HD2 LYS A 127 41.390 12.396 26.007 1.00 0.00 H new ATOM 0 HD3 LYS A 127 42.778 12.686 27.037 1.00 0.00 H new ATOM 0 HE2 LYS A 127 44.048 13.600 25.073 1.00 0.00 H new ATOM 0 HE3 LYS A 127 42.666 13.303 24.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 42.700 15.594 24.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 41.336 14.791 25.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 42.676 15.079 26.437 1.00 0.00 H new ATOM 2144 N CYS A 128 43.609 7.444 28.176 1.00 0.00 N ATOM 2145 CA CYS A 128 43.333 6.453 29.209 1.00 0.00 C ATOM 2146 C CYS A 128 43.566 7.037 30.599 1.00 0.00 C ATOM 2147 O CYS A 128 44.335 7.985 30.765 1.00 0.00 O ATOM 2148 CB CYS A 128 44.241 5.239 29.012 1.00 0.00 C ATOM 2149 SG CYS A 128 45.969 5.740 29.219 1.00 0.00 S ATOM 0 H CYS A 128 44.461 7.986 28.321 1.00 0.00 H new ATOM 0 HA CYS A 128 42.288 6.153 29.127 1.00 0.00 H new ATOM 0 HB2 CYS A 128 43.988 4.461 29.732 1.00 0.00 H new ATOM 0 HB3 CYS A 128 44.090 4.816 28.019 1.00 0.00 H new ATOM 0 HG CYS A 128 46.549 4.953 30.076 1.00 0.00 H new ATOM 2155 N TYR A 129 42.909 6.452 31.595 1.00 0.00 N ATOM 2156 CA TYR A 129 43.060 6.907 32.973 1.00 0.00 C ATOM 2157 C TYR A 129 43.640 5.788 33.832 1.00 0.00 C ATOM 2158 O TYR A 129 43.186 4.643 33.759 1.00 0.00 O ATOM 2159 CB TYR A 129 41.704 7.339 33.535 1.00 0.00 C ATOM 2160 CG TYR A 129 41.182 8.515 32.744 1.00 0.00 C ATOM 2161 CD1 TYR A 129 40.334 8.303 31.652 1.00 0.00 C ATOM 2162 CD2 TYR A 129 41.546 9.818 33.106 1.00 0.00 C ATOM 2163 CE1 TYR A 129 39.850 9.394 30.918 1.00 0.00 C ATOM 2164 CE2 TYR A 129 41.062 10.909 32.373 1.00 0.00 C ATOM 2165 CZ TYR A 129 40.214 10.696 31.280 1.00 0.00 C ATOM 2166 OH TYR A 129 39.737 11.772 30.557 1.00 0.00 O ATOM 0 H TYR A 129 42.270 5.666 31.475 1.00 0.00 H new ATOM 0 HA TYR A 129 43.740 7.759 32.989 1.00 0.00 H new ATOM 0 HB2 TYR A 129 40.997 6.511 33.485 1.00 0.00 H new ATOM 0 HB3 TYR A 129 41.804 7.610 34.586 1.00 0.00 H new ATOM 0 HD1 TYR A 129 40.052 7.298 31.375 1.00 0.00 H new ATOM 0 HD2 TYR A 129 42.200 9.982 33.950 1.00 0.00 H new ATOM 0 HE1 TYR A 129 39.197 9.230 30.074 1.00 0.00 H new ATOM 0 HE2 TYR A 129 41.343 11.914 32.651 1.00 0.00 H new ATOM 0 HH TYR A 129 40.084 12.604 30.941 1.00 0.00 H new ATOM 2176 N TYR A 130 44.646 6.120 34.640 1.00 0.00 N ATOM 2177 CA TYR A 130 45.276 5.120 35.497 1.00 0.00 C ATOM 2178 C TYR A 130 44.256 4.514 36.460 1.00 0.00 C ATOM 2179 O TYR A 130 44.154 3.293 36.579 1.00 0.00 O ATOM 2180 CB TYR A 130 46.429 5.756 36.280 1.00 0.00 C ATOM 2181 CG TYR A 130 47.053 4.724 37.188 1.00 0.00 C ATOM 2182 CD1 TYR A 130 47.787 3.666 36.641 1.00 0.00 C ATOM 2183 CD2 TYR A 130 46.893 4.822 38.575 1.00 0.00 C ATOM 2184 CE1 TYR A 130 48.364 2.707 37.481 1.00 0.00 C ATOM 2185 CE2 TYR A 130 47.469 3.862 39.415 1.00 0.00 C ATOM 2186 CZ TYR A 130 48.205 2.803 38.869 1.00 0.00 C ATOM 2187 OH TYR A 130 48.772 1.857 39.697 1.00 0.00 O ATOM 0 H TYR A 130 45.037 7.059 34.718 1.00 0.00 H new ATOM 0 HA TYR A 130 45.669 4.321 34.868 1.00 0.00 H new ATOM 0 HB2 TYR A 130 47.177 6.149 35.591 1.00 0.00 H new ATOM 0 HB3 TYR A 130 46.063 6.598 36.867 1.00 0.00 H new ATOM 0 HD1 TYR A 130 47.908 3.589 35.571 1.00 0.00 H new ATOM 0 HD2 TYR A 130 46.325 5.638 38.997 1.00 0.00 H new ATOM 0 HE1 TYR A 130 48.933 1.892 37.058 1.00 0.00 H new ATOM 0 HE2 TYR A 130 47.346 3.938 40.485 1.00 0.00 H new ATOM 0 HH TYR A 130 48.566 2.074 40.630 1.00 0.00 H new ATOM 2197 N LYS A 131 43.496 5.371 37.135 1.00 0.00 N ATOM 2198 CA LYS A 131 42.474 4.903 38.071 1.00 0.00 C ATOM 2199 C LYS A 131 41.089 5.070 37.460 1.00 0.00 C ATOM 2200 O LYS A 131 40.073 4.883 38.131 1.00 0.00 O ATOM 2201 CB LYS A 131 42.548 5.692 39.380 1.00 0.00 C ATOM 2202 CG LYS A 131 43.889 5.429 40.065 1.00 0.00 C ATOM 2203 CD LYS A 131 43.950 6.211 41.379 1.00 0.00 C ATOM 2204 CE LYS A 131 45.294 5.957 42.063 1.00 0.00 C ATOM 2205 NZ LYS A 131 45.355 6.725 43.338 1.00 0.00 N ATOM 0 H LYS A 131 43.566 6.385 37.054 1.00 0.00 H new ATOM 0 HA LYS A 131 42.655 3.848 38.278 1.00 0.00 H new ATOM 0 HB2 LYS A 131 42.433 6.757 39.181 1.00 0.00 H new ATOM 0 HB3 LYS A 131 41.729 5.401 40.038 1.00 0.00 H new ATOM 0 HG2 LYS A 131 44.009 4.363 40.258 1.00 0.00 H new ATOM 0 HG3 LYS A 131 44.709 5.729 39.412 1.00 0.00 H new ATOM 0 HD2 LYS A 131 43.824 7.276 41.186 1.00 0.00 H new ATOM 0 HD3 LYS A 131 43.134 5.906 42.034 1.00 0.00 H new ATOM 0 HE2 LYS A 131 45.418 4.892 42.261 1.00 0.00 H new ATOM 0 HE3 LYS A 131 46.111 6.256 41.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 46.138 6.367 43.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 45.511 7.732 43.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 44.459 6.613 43.854 1.00 0.00 H new ATOM 2219 N GLY A 132 41.060 5.446 36.187 1.00 0.00 N ATOM 2220 CA GLY A 132 39.802 5.666 35.486 1.00 0.00 C ATOM 2221 C GLY A 132 39.437 7.140 35.545 1.00 0.00 C ATOM 2222 O GLY A 132 38.602 7.624 34.781 1.00 0.00 O ATOM 0 H GLY A 132 41.893 5.605 35.620 1.00 0.00 H new ATOM 0 HA2 GLY A 132 39.891 5.344 34.448 1.00 0.00 H new ATOM 0 HA3 GLY A 132 39.012 5.067 35.939 1.00 0.00 H new ATOM 2226 N PHE A 133 40.101 7.850 36.449 1.00 0.00 N ATOM 2227 CA PHE A 133 39.885 9.279 36.609 1.00 0.00 C ATOM 2228 C PHE A 133 41.074 9.886 37.345 1.00 0.00 C ATOM 2229 O PHE A 133 41.325 9.556 38.505 1.00 0.00 O ATOM 2230 CB PHE A 133 38.599 9.533 37.395 1.00 0.00 C ATOM 2231 CG PHE A 133 38.354 11.019 37.486 1.00 0.00 C ATOM 2232 CD1 PHE A 133 37.823 11.705 36.390 1.00 0.00 C ATOM 2233 CD2 PHE A 133 38.658 11.708 38.666 1.00 0.00 C ATOM 2234 CE1 PHE A 133 37.594 13.083 36.470 1.00 0.00 C ATOM 2235 CE2 PHE A 133 38.428 13.088 38.747 1.00 0.00 C ATOM 2236 CZ PHE A 133 37.897 13.775 37.650 1.00 0.00 C ATOM 0 H PHE A 133 40.796 7.456 37.084 1.00 0.00 H new ATOM 0 HA PHE A 133 39.789 9.742 35.627 1.00 0.00 H new ATOM 0 HB2 PHE A 133 37.757 9.044 36.905 1.00 0.00 H new ATOM 0 HB3 PHE A 133 38.679 9.104 38.394 1.00 0.00 H new ATOM 0 HD1 PHE A 133 37.589 11.171 35.481 1.00 0.00 H new ATOM 0 HD2 PHE A 133 39.069 11.177 39.512 1.00 0.00 H new ATOM 0 HE1 PHE A 133 37.184 13.613 35.623 1.00 0.00 H new ATOM 0 HE2 PHE A 133 38.661 13.621 39.657 1.00 0.00 H new ATOM 0 HZ PHE A 133 37.721 14.839 37.713 1.00 0.00 H new ATOM 2246 N LYS A 134 41.807 10.762 36.668 1.00 0.00 N ATOM 2247 CA LYS A 134 42.974 11.392 37.275 1.00 0.00 C ATOM 2248 C LYS A 134 43.728 12.224 36.246 1.00 0.00 C ATOM 2249 O LYS A 134 43.518 12.081 35.042 1.00 0.00 O ATOM 2250 CB LYS A 134 43.915 10.324 37.844 1.00 0.00 C ATOM 2251 CG LYS A 134 44.963 10.988 38.740 1.00 0.00 C ATOM 2252 CD LYS A 134 45.901 9.922 39.308 1.00 0.00 C ATOM 2253 CE LYS A 134 45.103 8.956 40.186 1.00 0.00 C ATOM 2254 NZ LYS A 134 44.512 9.701 41.333 1.00 0.00 N ATOM 0 H LYS A 134 41.617 11.050 35.708 1.00 0.00 H new ATOM 0 HA LYS A 134 42.629 12.042 38.079 1.00 0.00 H new ATOM 0 HB2 LYS A 134 43.346 9.590 38.415 1.00 0.00 H new ATOM 0 HB3 LYS A 134 44.404 9.786 37.032 1.00 0.00 H new ATOM 0 HG2 LYS A 134 45.533 11.721 38.169 1.00 0.00 H new ATOM 0 HG3 LYS A 134 44.474 11.526 39.552 1.00 0.00 H new ATOM 0 HD2 LYS A 134 46.384 9.378 38.497 1.00 0.00 H new ATOM 0 HD3 LYS A 134 46.692 10.392 39.892 1.00 0.00 H new ATOM 0 HE2 LYS A 134 44.315 8.483 39.601 1.00 0.00 H new ATOM 0 HE3 LYS A 134 45.751 8.159 40.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 44.378 9.053 42.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 45.152 10.472 41.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 43.593 10.098 41.052 1.00 0.00 H new ATOM 2268 N THR A 135 44.616 13.085 36.728 1.00 0.00 N ATOM 2269 CA THR A 135 45.406 13.924 35.839 1.00 0.00 C ATOM 2270 C THR A 135 46.358 13.063 35.015 1.00 0.00 C ATOM 2271 O THR A 135 46.546 13.296 33.821 1.00 0.00 O ATOM 2272 CB THR A 135 46.206 14.943 36.653 1.00 0.00 C ATOM 2273 OG1 THR A 135 45.312 15.766 37.388 1.00 0.00 O ATOM 2274 CG2 THR A 135 47.042 15.810 35.710 1.00 0.00 C ATOM 0 H THR A 135 44.805 13.219 37.721 1.00 0.00 H new ATOM 0 HA THR A 135 44.732 14.454 35.166 1.00 0.00 H new ATOM 0 HB THR A 135 46.868 14.418 37.342 1.00 0.00 H new ATOM 0 HG1 THR A 135 45.823 16.418 37.911 1.00 0.00 H new ATOM 0 HG21 THR A 135 47.611 16.535 36.291 1.00 0.00 H new ATOM 0 HG22 THR A 135 47.728 15.178 35.147 1.00 0.00 H new ATOM 0 HG23 THR A 135 46.383 16.336 35.019 1.00 0.00 H new ATOM 2282 N LYS A 136 46.958 12.064 35.660 1.00 0.00 N ATOM 2283 CA LYS A 136 47.889 11.176 34.973 1.00 0.00 C ATOM 2284 C LYS A 136 47.155 10.295 33.965 1.00 0.00 C ATOM 2285 O LYS A 136 46.252 9.535 34.324 1.00 0.00 O ATOM 2286 CB LYS A 136 48.612 10.289 35.988 1.00 0.00 C ATOM 2287 CG LYS A 136 49.706 9.490 35.277 1.00 0.00 C ATOM 2288 CD LYS A 136 50.426 8.596 36.289 1.00 0.00 C ATOM 2289 CE LYS A 136 51.150 9.468 37.317 1.00 0.00 C ATOM 2290 NZ LYS A 136 52.186 10.290 36.629 1.00 0.00 N ATOM 0 H LYS A 136 46.817 11.852 36.648 1.00 0.00 H new ATOM 0 HA LYS A 136 48.614 11.791 34.441 1.00 0.00 H new ATOM 0 HB2 LYS A 136 49.048 10.902 36.777 1.00 0.00 H new ATOM 0 HB3 LYS A 136 47.904 9.612 36.465 1.00 0.00 H new ATOM 0 HG2 LYS A 136 49.270 8.882 34.484 1.00 0.00 H new ATOM 0 HG3 LYS A 136 50.417 10.168 34.804 1.00 0.00 H new ATOM 0 HD2 LYS A 136 49.709 7.945 36.789 1.00 0.00 H new ATOM 0 HD3 LYS A 136 51.140 7.951 35.777 1.00 0.00 H new ATOM 0 HE2 LYS A 136 50.437 10.115 37.828 1.00 0.00 H new ATOM 0 HE3 LYS A 136 51.614 8.842 38.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 52.907 10.587 37.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 52.635 9.726 35.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 51.740 11.131 36.210 1.00 0.00 H new ATOM 2304 N LYS A 137 47.558 10.400 32.703 1.00 0.00 N ATOM 2305 CA LYS A 137 46.946 9.609 31.643 1.00 0.00 C ATOM 2306 C LYS A 137 47.949 9.354 30.523 1.00 0.00 C ATOM 2307 O LYS A 137 48.929 10.084 30.378 1.00 0.00 O ATOM 2308 CB LYS A 137 45.726 10.343 31.081 1.00 0.00 C ATOM 2309 CG LYS A 137 46.159 11.697 30.518 1.00 0.00 C ATOM 2310 CD LYS A 137 44.955 12.396 29.885 1.00 0.00 C ATOM 2311 CE LYS A 137 43.961 12.790 30.980 1.00 0.00 C ATOM 2312 NZ LYS A 137 42.819 13.529 30.370 1.00 0.00 N ATOM 0 H LYS A 137 48.303 11.023 32.391 1.00 0.00 H new ATOM 0 HA LYS A 137 46.632 8.653 32.062 1.00 0.00 H new ATOM 0 HB2 LYS A 137 45.257 9.745 30.299 1.00 0.00 H new ATOM 0 HB3 LYS A 137 44.981 10.484 31.864 1.00 0.00 H new ATOM 0 HG2 LYS A 137 46.576 12.316 31.312 1.00 0.00 H new ATOM 0 HG3 LYS A 137 46.945 11.559 29.775 1.00 0.00 H new ATOM 0 HD2 LYS A 137 45.281 13.281 29.339 1.00 0.00 H new ATOM 0 HD3 LYS A 137 44.475 11.735 29.164 1.00 0.00 H new ATOM 0 HE2 LYS A 137 43.599 11.900 31.495 1.00 0.00 H new ATOM 0 HE3 LYS A 137 44.454 13.412 31.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 42.143 13.797 31.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 43.172 14.386 29.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 42.344 12.920 29.673 1.00 0.00 H new ATOM 2326 N GLU A 138 47.692 8.322 29.727 1.00 0.00 N ATOM 2327 CA GLU A 138 48.574 7.993 28.617 1.00 0.00 C ATOM 2328 C GLU A 138 47.819 8.117 27.301 1.00 0.00 C ATOM 2329 O GLU A 138 46.746 7.538 27.132 1.00 0.00 O ATOM 2330 CB GLU A 138 49.117 6.570 28.768 1.00 0.00 C ATOM 2331 CG GLU A 138 50.066 6.265 27.608 1.00 0.00 C ATOM 2332 CD GLU A 138 50.674 4.878 27.778 1.00 0.00 C ATOM 2333 OE1 GLU A 138 50.357 4.231 28.763 1.00 0.00 O ATOM 2334 OE2 GLU A 138 51.447 4.481 26.923 1.00 0.00 O ATOM 0 H GLU A 138 46.887 7.704 29.829 1.00 0.00 H new ATOM 0 HA GLU A 138 49.412 8.690 28.621 1.00 0.00 H new ATOM 0 HB2 GLU A 138 49.641 6.467 29.718 1.00 0.00 H new ATOM 0 HB3 GLU A 138 48.295 5.854 28.778 1.00 0.00 H new ATOM 0 HG2 GLU A 138 49.526 6.320 26.663 1.00 0.00 H new ATOM 0 HG3 GLU A 138 50.856 7.014 27.568 1.00 0.00 H new ATOM 2341 N VAL A 139 48.379 8.886 26.376 1.00 0.00 N ATOM 2342 CA VAL A 139 47.741 9.089 25.083 1.00 0.00 C ATOM 2343 C VAL A 139 48.640 8.604 23.951 1.00 0.00 C ATOM 2344 O VAL A 139 49.807 8.987 23.862 1.00 0.00 O ATOM 2345 CB VAL A 139 47.431 10.573 24.896 1.00 0.00 C ATOM 2346 CG1 VAL A 139 46.811 10.797 23.516 1.00 0.00 C ATOM 2347 CG2 VAL A 139 46.446 11.026 25.975 1.00 0.00 C ATOM 0 H VAL A 139 49.266 9.375 26.496 1.00 0.00 H new ATOM 0 HA VAL A 139 46.816 8.513 25.057 1.00 0.00 H new ATOM 0 HB VAL A 139 48.353 11.149 24.977 1.00 0.00 H new ATOM 0 HG11 VAL A 139 46.590 11.856 23.384 1.00 0.00 H new ATOM 0 HG12 VAL A 139 47.511 10.473 22.746 1.00 0.00 H new ATOM 0 HG13 VAL A 139 45.889 10.221 23.433 1.00 0.00 H new ATOM 0 HG21 VAL A 139 46.224 12.085 25.843 1.00 0.00 H new ATOM 0 HG22 VAL A 139 45.525 10.449 25.892 1.00 0.00 H new ATOM 0 HG23 VAL A 139 46.886 10.868 26.959 1.00 0.00 H new ATOM 2357 N ILE A 140 48.086 7.760 23.087 1.00 0.00 N ATOM 2358 CA ILE A 140 48.842 7.225 21.961 1.00 0.00 C ATOM 2359 C ILE A 140 48.127 7.522 20.648 1.00 0.00 C ATOM 2360 O ILE A 140 48.113 6.650 19.794 1.00 0.00 O ATOM 2361 CB ILE A 140 49.016 5.714 22.120 1.00 0.00 C ATOM 2362 CG1 ILE A 140 48.678 5.312 23.557 1.00 0.00 C ATOM 2363 CG2 ILE A 140 50.464 5.331 21.810 1.00 0.00 C ATOM 2364 CD1 ILE A 140 47.181 5.019 23.667 1.00 0.00 C ATOM 2365 OXT ILE A 140 47.605 8.616 20.514 1.00 0.00 O ATOM 0 H ILE A 140 47.121 7.433 23.144 1.00 0.00 H new ATOM 0 HA ILE A 140 49.822 7.703 21.944 1.00 0.00 H new ATOM 0 HB ILE A 140 48.349 5.196 21.431 1.00 0.00 H new ATOM 0 HG12 ILE A 140 49.254 4.432 23.844 1.00 0.00 H new ATOM 0 HG13 ILE A 140 48.954 6.112 24.244 1.00 0.00 H new ATOM 0 HG21 ILE A 140 50.588 4.254 21.923 1.00 0.00 H new ATOM 0 HG22 ILE A 140 50.705 5.618 20.787 1.00 0.00 H new ATOM 0 HG23 ILE A 140 51.132 5.848 22.499 1.00 0.00 H new ATOM 0 HD11 ILE A 140 46.941 4.733 24.691 1.00 0.00 H new ATOM 0 HD12 ILE A 140 46.615 5.911 23.397 1.00 0.00 H new ATOM 0 HD13 ILE A 140 46.919 4.205 22.991 1.00 0.00 H new