USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 915 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 123 THR OG1 : rot 139:sc= 2.04 USER MOD Set 1.2: A 133 THR OG1 : rot -78:sc= 0.991 USER MOD Single : A 25 SER OG : rot 6:sc= -1.35! USER MOD Single : A 27 THR OG1 : rot -84:sc= 1.26 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 178:sc= 0.357 USER MOD Single : A 44 LYS NZ :NH3+ 159:sc= 1.25 (180deg=1.07) USER MOD Single : A 46 SER OG : rot 7:sc= 0.00966 USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.181 USER MOD Single : A 49 ASN : amide:sc= -0.792 K(o=-0.79,f=-7.5!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot -42:sc= 0.741 USER MOD Single : A 53 HIS : no HD1:sc= -0.173 X(o=-0.17,f=-0.64) USER MOD Single : A 54 SER OG : rot -54:sc= 1.28 USER MOD Single : A 58 CYS SG : rot -17:sc= -0.186 USER MOD Single : A 61 SER OG : rot -55:sc= 0.28 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 HIS :FLIP no HD1:sc= -1.06 F(o=-3.1!,f=-1.1) USER MOD Single : A 66 SER OG : rot 158:sc= -1.65 USER MOD Single : A 73 LYS NZ :NH3+ 135:sc= 0.441 (180deg=-0.168) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 26:sc= 0.638 USER MOD Single : A 83 LYS NZ :NH3+ -151:sc= 0.967 (180deg=0.447) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 MET CE :methyl 161:sc= -0.122 (180deg=-0.579) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0.626 K(o=0.63,f=-0.015) USER MOD Single : A 116 TYR OH : rot 175:sc= -0.975 USER MOD Single : A 119 GLN :FLIP amide:sc= -1.73! C(o=-6.1!,f=-1.7!) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 175:sc= 0.713 (180deg=0.695) USER MOD Single : A 143 LYS NZ :NH3+ 154:sc= -0.153 (180deg=-0.749) USER MOD ----------------------------------------------------------------- ATOM 364 N GLY A 24 8.622 -0.324 -4.362 1.00 0.54 N ATOM 365 CA GLY A 24 7.192 -0.304 -4.262 1.00 0.46 C ATOM 366 C GLY A 24 6.622 -1.447 -3.460 1.00 0.33 C ATOM 367 O GLY A 24 7.361 -2.242 -2.894 1.00 0.39 O ATOM 0 HA2 GLY A 24 6.882 0.637 -3.807 1.00 0.46 H new ATOM 0 HA3 GLY A 24 6.767 -0.329 -5.265 1.00 0.46 H new ATOM 371 N SER A 25 5.300 -1.480 -3.399 1.00 0.28 N ATOM 372 CA SER A 25 4.527 -2.516 -2.727 1.00 0.30 C ATOM 373 C SER A 25 3.071 -2.327 -3.113 1.00 0.32 C ATOM 374 O SER A 25 2.151 -2.548 -2.331 1.00 0.39 O ATOM 375 CB SER A 25 4.657 -2.440 -1.212 1.00 0.37 C ATOM 376 OG SER A 25 5.935 -2.862 -0.770 1.00 1.20 O ATOM 0 H SER A 25 4.715 -0.764 -3.830 1.00 0.28 H new ATOM 0 HA SER A 25 4.905 -3.491 -3.035 1.00 0.30 H new ATOM 0 HB2 SER A 25 4.479 -1.416 -0.883 1.00 0.37 H new ATOM 0 HB3 SER A 25 3.890 -3.061 -0.750 1.00 0.37 H new ATOM 0 HG SER A 25 6.511 -3.028 -1.545 1.00 1.20 H new ATOM 382 N VAL A 26 2.888 -1.898 -4.338 1.00 0.28 N ATOM 383 CA VAL A 26 1.582 -1.538 -4.850 1.00 0.30 C ATOM 384 C VAL A 26 1.383 -2.149 -6.227 1.00 0.30 C ATOM 385 O VAL A 26 2.355 -2.482 -6.902 1.00 0.30 O ATOM 386 CB VAL A 26 1.424 0.001 -4.946 1.00 0.33 C ATOM 387 CG1 VAL A 26 1.592 0.655 -3.585 1.00 0.93 C ATOM 388 CG2 VAL A 26 2.419 0.569 -5.939 1.00 0.88 C ATOM 0 H VAL A 26 3.644 -1.787 -5.014 1.00 0.28 H new ATOM 0 HA VAL A 26 0.831 -1.922 -4.160 1.00 0.30 H new ATOM 0 HB VAL A 26 0.416 0.219 -5.297 1.00 0.33 H new ATOM 0 HG11 VAL A 26 1.476 1.734 -3.683 1.00 0.93 H new ATOM 0 HG12 VAL A 26 0.836 0.270 -2.900 1.00 0.93 H new ATOM 0 HG13 VAL A 26 2.584 0.431 -3.194 1.00 0.93 H new ATOM 0 HG21 VAL A 26 2.298 1.651 -5.997 1.00 0.88 H new ATOM 0 HG22 VAL A 26 3.432 0.334 -5.613 1.00 0.88 H new ATOM 0 HG23 VAL A 26 2.243 0.131 -6.921 1.00 0.88 H new ATOM 398 N THR A 27 0.139 -2.350 -6.605 1.00 0.33 N ATOM 399 CA THR A 27 -0.215 -2.658 -7.974 1.00 0.36 C ATOM 400 C THR A 27 -1.717 -2.471 -8.168 1.00 0.38 C ATOM 401 O THR A 27 -2.147 -1.768 -9.085 1.00 0.48 O ATOM 402 CB THR A 27 0.227 -4.083 -8.380 1.00 0.39 C ATOM 403 OG1 THR A 27 -0.393 -4.477 -9.610 1.00 0.47 O ATOM 404 CG2 THR A 27 -0.101 -5.080 -7.290 1.00 0.39 C ATOM 0 H THR A 27 -0.658 -2.304 -5.970 1.00 0.33 H new ATOM 0 HA THR A 27 0.319 -1.969 -8.628 1.00 0.36 H new ATOM 0 HB THR A 27 1.307 -4.069 -8.524 1.00 0.39 H new ATOM 0 HG1 THR A 27 -1.289 -4.830 -9.427 1.00 0.47 H new ATOM 0 HG21 THR A 27 0.219 -6.075 -7.599 1.00 0.39 H new ATOM 0 HG22 THR A 27 0.417 -4.800 -6.373 1.00 0.39 H new ATOM 0 HG23 THR A 27 -1.176 -5.084 -7.112 1.00 0.39 H new ATOM 412 N ASP A 28 -2.517 -3.051 -7.268 1.00 0.35 N ATOM 413 CA ASP A 28 -3.962 -2.946 -7.374 1.00 0.42 C ATOM 414 C ASP A 28 -4.674 -3.413 -6.122 1.00 0.35 C ATOM 415 O ASP A 28 -4.108 -4.103 -5.283 1.00 0.37 O ATOM 416 CB ASP A 28 -4.503 -3.741 -8.554 1.00 0.57 C ATOM 417 CG ASP A 28 -4.013 -5.168 -8.637 1.00 1.08 C ATOM 418 OD1 ASP A 28 -2.853 -5.387 -9.046 1.00 1.69 O ATOM 419 OD2 ASP A 28 -4.810 -6.084 -8.345 1.00 1.44 O ATOM 0 H ASP A 28 -2.186 -3.591 -6.469 1.00 0.35 H new ATOM 0 HA ASP A 28 -4.161 -1.884 -7.521 1.00 0.42 H new ATOM 0 HB2 ASP A 28 -5.592 -3.748 -8.500 1.00 0.57 H new ATOM 0 HB3 ASP A 28 -4.233 -3.225 -9.475 1.00 0.57 H new ATOM 424 N VAL A 29 -5.935 -3.020 -6.020 1.00 0.39 N ATOM 425 CA VAL A 29 -6.796 -3.423 -4.923 1.00 0.41 C ATOM 426 C VAL A 29 -8.191 -3.739 -5.466 1.00 0.37 C ATOM 427 O VAL A 29 -8.740 -2.980 -6.264 1.00 0.42 O ATOM 428 CB VAL A 29 -6.888 -2.319 -3.843 1.00 0.60 C ATOM 429 CG1 VAL A 29 -7.749 -2.772 -2.676 1.00 1.13 C ATOM 430 CG2 VAL A 29 -5.504 -1.924 -3.349 1.00 1.14 C ATOM 0 H VAL A 29 -6.390 -2.410 -6.700 1.00 0.39 H new ATOM 0 HA VAL A 29 -6.368 -4.310 -4.456 1.00 0.41 H new ATOM 0 HB VAL A 29 -7.355 -1.447 -4.301 1.00 0.60 H new ATOM 0 HG11 VAL A 29 -7.798 -1.978 -1.930 1.00 1.13 H new ATOM 0 HG12 VAL A 29 -8.754 -2.998 -3.032 1.00 1.13 H new ATOM 0 HG13 VAL A 29 -7.313 -3.665 -2.227 1.00 1.13 H new ATOM 0 HG21 VAL A 29 -5.597 -1.147 -2.591 1.00 1.14 H new ATOM 0 HG22 VAL A 29 -5.009 -2.794 -2.918 1.00 1.14 H new ATOM 0 HG23 VAL A 29 -4.913 -1.548 -4.184 1.00 1.14 H new ATOM 440 N ASP A 30 -8.745 -4.865 -5.049 1.00 0.37 N ATOM 441 CA ASP A 30 -10.014 -5.357 -5.583 1.00 0.38 C ATOM 442 C ASP A 30 -11.061 -5.474 -4.474 1.00 0.42 C ATOM 443 O ASP A 30 -10.758 -5.929 -3.374 1.00 0.54 O ATOM 444 CB ASP A 30 -9.779 -6.718 -6.245 1.00 0.51 C ATOM 445 CG ASP A 30 -11.044 -7.360 -6.781 1.00 1.00 C ATOM 446 OD1 ASP A 30 -11.436 -7.052 -7.925 1.00 1.16 O ATOM 447 OD2 ASP A 30 -11.673 -8.150 -6.046 1.00 1.83 O ATOM 0 H ASP A 30 -8.334 -5.465 -4.334 1.00 0.37 H new ATOM 0 HA ASP A 30 -10.392 -4.651 -6.322 1.00 0.38 H new ATOM 0 HB2 ASP A 30 -9.069 -6.597 -7.063 1.00 0.51 H new ATOM 0 HB3 ASP A 30 -9.319 -7.390 -5.521 1.00 0.51 H new ATOM 452 N LEU A 31 -12.289 -5.071 -4.767 1.00 0.47 N ATOM 453 CA LEU A 31 -13.344 -5.030 -3.755 1.00 0.57 C ATOM 454 C LEU A 31 -14.177 -6.306 -3.779 1.00 0.58 C ATOM 455 O LEU A 31 -14.510 -6.813 -4.850 1.00 0.67 O ATOM 456 CB LEU A 31 -14.243 -3.804 -3.993 1.00 0.71 C ATOM 457 CG LEU A 31 -15.269 -3.493 -2.892 1.00 0.85 C ATOM 458 CD1 LEU A 31 -16.516 -4.359 -3.030 1.00 0.94 C ATOM 459 CD2 LEU A 31 -14.635 -3.693 -1.526 1.00 0.86 C ATOM 0 H LEU A 31 -12.583 -4.767 -5.695 1.00 0.47 H new ATOM 0 HA LEU A 31 -12.878 -4.952 -2.773 1.00 0.57 H new ATOM 0 HB2 LEU A 31 -13.604 -2.930 -4.123 1.00 0.71 H new ATOM 0 HB3 LEU A 31 -14.780 -3.949 -4.931 1.00 0.71 H new ATOM 0 HG LEU A 31 -15.577 -2.453 -2.998 1.00 0.85 H new ATOM 0 HD11 LEU A 31 -17.220 -4.112 -2.235 1.00 0.94 H new ATOM 0 HD12 LEU A 31 -16.982 -4.174 -3.998 1.00 0.94 H new ATOM 0 HD13 LEU A 31 -16.239 -5.411 -2.956 1.00 0.94 H new ATOM 0 HD21 LEU A 31 -15.367 -3.471 -0.749 1.00 0.86 H new ATOM 0 HD22 LEU A 31 -14.303 -4.726 -1.427 1.00 0.86 H new ATOM 0 HD23 LEU A 31 -13.780 -3.025 -1.420 1.00 0.86 H new ATOM 471 N LYS A 32 -14.527 -6.821 -2.597 1.00 0.56 N ATOM 472 CA LYS A 32 -15.369 -8.005 -2.521 1.00 0.60 C ATOM 473 C LYS A 32 -16.336 -8.011 -1.335 1.00 0.82 C ATOM 474 O LYS A 32 -17.388 -7.395 -1.375 1.00 1.33 O ATOM 475 CB LYS A 32 -14.510 -9.260 -2.507 1.00 0.62 C ATOM 476 CG LYS A 32 -13.259 -9.168 -1.646 1.00 0.65 C ATOM 477 CD LYS A 32 -12.371 -10.367 -1.884 1.00 0.90 C ATOM 478 CE LYS A 32 -11.775 -10.330 -3.279 1.00 1.10 C ATOM 479 NZ LYS A 32 -11.309 -11.669 -3.727 1.00 1.32 N ATOM 0 H LYS A 32 -14.242 -6.439 -1.695 1.00 0.56 H new ATOM 0 HA LYS A 32 -15.993 -7.986 -3.414 1.00 0.60 H new ATOM 0 HB2 LYS A 32 -15.116 -10.094 -2.154 1.00 0.62 H new ATOM 0 HB3 LYS A 32 -14.214 -9.492 -3.530 1.00 0.62 H new ATOM 0 HG2 LYS A 32 -12.716 -8.252 -1.879 1.00 0.65 H new ATOM 0 HG3 LYS A 32 -13.537 -9.115 -0.593 1.00 0.65 H new ATOM 0 HD2 LYS A 32 -11.572 -10.386 -1.143 1.00 0.90 H new ATOM 0 HD3 LYS A 32 -12.947 -11.283 -1.754 1.00 0.90 H new ATOM 0 HE2 LYS A 32 -12.519 -9.953 -3.980 1.00 1.10 H new ATOM 0 HE3 LYS A 32 -10.938 -9.632 -3.296 1.00 1.10 H new ATOM 0 HZ1 LYS A 32 -10.910 -11.595 -4.684 1.00 1.32 H new ATOM 0 HZ2 LYS A 32 -10.579 -12.019 -3.074 1.00 1.32 H new ATOM 0 HZ3 LYS A 32 -12.111 -12.331 -3.737 1.00 1.32 H new ATOM 493 N ASP A 33 -15.927 -8.590 -0.232 1.00 0.60 N ATOM 494 CA ASP A 33 -16.888 -9.121 0.742 1.00 0.94 C ATOM 495 C ASP A 33 -17.272 -8.075 1.757 1.00 0.53 C ATOM 496 O ASP A 33 -16.855 -6.952 1.634 1.00 1.46 O ATOM 497 CB ASP A 33 -16.258 -10.285 1.476 1.00 2.08 C ATOM 498 CG ASP A 33 -17.224 -11.428 1.698 1.00 2.37 C ATOM 499 OD1 ASP A 33 -18.088 -11.314 2.588 1.00 2.32 O ATOM 500 OD2 ASP A 33 -17.127 -12.445 0.977 1.00 2.85 O ATOM 0 H ASP A 33 -14.947 -8.712 0.025 1.00 0.60 H new ATOM 0 HA ASP A 33 -17.781 -9.435 0.201 1.00 0.94 H new ATOM 0 HB2 ASP A 33 -15.400 -10.645 0.909 1.00 2.08 H new ATOM 0 HB3 ASP A 33 -15.882 -9.941 2.439 1.00 2.08 H new ATOM 571 N SER A 38 -18.004 -6.011 7.877 1.00 0.54 N ATOM 572 CA SER A 38 -16.762 -5.521 7.288 1.00 0.48 C ATOM 573 C SER A 38 -16.594 -5.950 5.838 1.00 0.50 C ATOM 574 O SER A 38 -16.652 -7.141 5.502 1.00 0.94 O ATOM 575 CB SER A 38 -15.577 -6.026 8.091 1.00 0.55 C ATOM 576 OG SER A 38 -14.355 -5.468 7.624 1.00 0.76 O ATOM 0 HA SER A 38 -16.808 -4.432 7.311 1.00 0.48 H new ATOM 0 HB2 SER A 38 -15.715 -5.774 9.142 1.00 0.55 H new ATOM 0 HB3 SER A 38 -15.530 -7.113 8.027 1.00 0.55 H new ATOM 0 HG SER A 38 -13.612 -5.811 8.162 1.00 0.76 H new ATOM 582 N VAL A 39 -16.331 -4.970 4.994 1.00 0.33 N ATOM 583 CA VAL A 39 -16.114 -5.211 3.587 1.00 0.35 C ATOM 584 C VAL A 39 -14.693 -5.725 3.379 1.00 0.31 C ATOM 585 O VAL A 39 -13.822 -5.486 4.219 1.00 0.34 O ATOM 586 CB VAL A 39 -16.366 -3.923 2.773 1.00 0.43 C ATOM 587 CG1 VAL A 39 -16.300 -4.183 1.280 1.00 0.86 C ATOM 588 CG2 VAL A 39 -17.709 -3.330 3.149 1.00 0.86 C ATOM 0 H VAL A 39 -16.263 -3.990 5.267 1.00 0.33 H new ATOM 0 HA VAL A 39 -16.817 -5.966 3.233 1.00 0.35 H new ATOM 0 HB VAL A 39 -15.578 -3.210 3.016 1.00 0.43 H new ATOM 0 HG11 VAL A 39 -16.482 -3.254 0.740 1.00 0.86 H new ATOM 0 HG12 VAL A 39 -15.313 -4.566 1.021 1.00 0.86 H new ATOM 0 HG13 VAL A 39 -17.057 -4.917 1.005 1.00 0.86 H new ATOM 0 HG21 VAL A 39 -17.880 -2.422 2.571 1.00 0.86 H new ATOM 0 HG22 VAL A 39 -18.498 -4.051 2.934 1.00 0.86 H new ATOM 0 HG23 VAL A 39 -17.716 -3.090 4.212 1.00 0.86 H new ATOM 598 N GLU A 40 -14.440 -6.461 2.306 1.00 0.33 N ATOM 599 CA GLU A 40 -13.118 -7.009 2.130 1.00 0.36 C ATOM 600 C GLU A 40 -12.448 -6.476 0.880 1.00 0.38 C ATOM 601 O GLU A 40 -13.042 -6.441 -0.197 1.00 0.50 O ATOM 602 CB GLU A 40 -13.191 -8.528 2.157 1.00 0.52 C ATOM 603 CG GLU A 40 -13.242 -9.063 3.578 1.00 0.62 C ATOM 604 CD GLU A 40 -13.625 -10.528 3.657 1.00 0.89 C ATOM 605 OE1 GLU A 40 -12.952 -11.360 3.018 1.00 1.16 O ATOM 606 OE2 GLU A 40 -14.596 -10.852 4.375 1.00 1.19 O ATOM 0 H GLU A 40 -15.112 -6.683 1.571 1.00 0.33 H new ATOM 0 HA GLU A 40 -12.487 -6.687 2.958 1.00 0.36 H new ATOM 0 HB2 GLU A 40 -14.074 -8.860 1.611 1.00 0.52 H new ATOM 0 HB3 GLU A 40 -12.324 -8.943 1.643 1.00 0.52 H new ATOM 0 HG2 GLU A 40 -12.267 -8.924 4.046 1.00 0.62 H new ATOM 0 HG3 GLU A 40 -13.958 -8.476 4.154 1.00 0.62 H new ATOM 613 N TYR A 41 -11.208 -6.037 1.049 1.00 0.37 N ATOM 614 CA TYR A 41 -10.453 -5.423 -0.040 1.00 0.56 C ATOM 615 C TYR A 41 -9.216 -6.243 -0.358 1.00 0.43 C ATOM 616 O TYR A 41 -8.235 -6.197 0.388 1.00 0.40 O ATOM 617 CB TYR A 41 -10.012 -4.012 0.354 1.00 0.89 C ATOM 618 CG TYR A 41 -10.567 -2.898 -0.511 1.00 0.86 C ATOM 619 CD1 TYR A 41 -11.033 -3.165 -1.793 1.00 1.65 C ATOM 620 CD2 TYR A 41 -10.630 -1.588 -0.054 1.00 1.30 C ATOM 621 CE1 TYR A 41 -11.546 -2.160 -2.592 1.00 2.63 C ATOM 622 CE2 TYR A 41 -11.142 -0.579 -0.848 1.00 2.04 C ATOM 623 CZ TYR A 41 -11.577 -0.836 -2.086 1.00 2.72 C ATOM 624 OH TYR A 41 -12.106 0.136 -2.905 1.00 3.73 O ATOM 0 H TYR A 41 -10.701 -6.094 1.932 1.00 0.37 H new ATOM 0 HA TYR A 41 -11.100 -5.381 -0.916 1.00 0.56 H new ATOM 0 HB2 TYR A 41 -10.309 -3.831 1.387 1.00 0.89 H new ATOM 0 HB3 TYR A 41 -8.923 -3.967 0.323 1.00 0.89 H new ATOM 0 HD1 TYR A 41 -10.994 -4.176 -2.172 1.00 1.65 H new ATOM 0 HD2 TYR A 41 -10.273 -1.354 0.938 1.00 1.30 H new ATOM 0 HE1 TYR A 41 -11.916 -2.379 -3.583 1.00 2.63 H new ATOM 0 HE2 TYR A 41 -11.191 0.429 -0.464 1.00 2.04 H new ATOM 0 HH TYR A 41 -12.103 0.996 -2.436 1.00 3.73 H new ATOM 634 N LEU A 42 -9.252 -6.975 -1.459 1.00 0.41 N ATOM 635 CA LEU A 42 -8.104 -7.765 -1.868 1.00 0.38 C ATOM 636 C LEU A 42 -7.040 -6.813 -2.376 1.00 0.34 C ATOM 637 O LEU A 42 -7.193 -6.209 -3.431 1.00 0.38 O ATOM 638 CB LEU A 42 -8.499 -8.764 -2.971 1.00 0.49 C ATOM 639 CG LEU A 42 -7.597 -10.006 -3.136 1.00 0.55 C ATOM 640 CD1 LEU A 42 -6.138 -9.627 -3.356 1.00 0.71 C ATOM 641 CD2 LEU A 42 -7.726 -10.928 -1.933 1.00 0.81 C ATOM 0 H LEU A 42 -10.058 -7.038 -2.081 1.00 0.41 H new ATOM 0 HA LEU A 42 -7.725 -8.340 -1.023 1.00 0.38 H new ATOM 0 HB2 LEU A 42 -9.515 -9.105 -2.773 1.00 0.49 H new ATOM 0 HB3 LEU A 42 -8.521 -8.231 -3.921 1.00 0.49 H new ATOM 0 HG LEU A 42 -7.938 -10.534 -4.026 1.00 0.55 H new ATOM 0 HD11 LEU A 42 -5.540 -10.531 -3.467 1.00 0.71 H new ATOM 0 HD12 LEU A 42 -6.051 -9.022 -4.258 1.00 0.71 H new ATOM 0 HD13 LEU A 42 -5.777 -9.056 -2.500 1.00 0.71 H new ATOM 0 HD21 LEU A 42 -7.082 -11.797 -2.070 1.00 0.81 H new ATOM 0 HD22 LEU A 42 -7.427 -10.393 -1.031 1.00 0.81 H new ATOM 0 HD23 LEU A 42 -8.761 -11.255 -1.835 1.00 0.81 H new ATOM 653 N ALA A 43 -5.971 -6.675 -1.629 1.00 0.33 N ATOM 654 CA ALA A 43 -4.925 -5.751 -1.999 1.00 0.36 C ATOM 655 C ALA A 43 -3.746 -6.501 -2.565 1.00 0.35 C ATOM 656 O ALA A 43 -3.005 -7.181 -1.849 1.00 0.37 O ATOM 657 CB ALA A 43 -4.508 -4.901 -0.810 1.00 0.42 C ATOM 0 H ALA A 43 -5.802 -7.189 -0.764 1.00 0.33 H new ATOM 0 HA ALA A 43 -5.310 -5.081 -2.768 1.00 0.36 H new ATOM 0 HB1 ALA A 43 -3.719 -4.213 -1.114 1.00 0.42 H new ATOM 0 HB2 ALA A 43 -5.366 -4.333 -0.450 1.00 0.42 H new ATOM 0 HB3 ALA A 43 -4.140 -5.546 -0.013 1.00 0.42 H new ATOM 663 N LYS A 44 -3.582 -6.379 -3.859 1.00 0.38 N ATOM 664 CA LYS A 44 -2.464 -6.975 -4.528 1.00 0.39 C ATOM 665 C LYS A 44 -1.286 -6.034 -4.393 1.00 0.36 C ATOM 666 O LYS A 44 -1.384 -4.842 -4.691 1.00 0.47 O ATOM 667 CB LYS A 44 -2.803 -7.238 -5.994 1.00 0.53 C ATOM 668 CG LYS A 44 -1.745 -8.028 -6.749 1.00 0.95 C ATOM 669 CD LYS A 44 -2.171 -8.272 -8.188 1.00 1.58 C ATOM 670 CE LYS A 44 -3.518 -8.970 -8.257 1.00 1.61 C ATOM 671 NZ LYS A 44 -4.329 -8.485 -9.401 1.00 2.63 N ATOM 0 H LYS A 44 -4.218 -5.866 -4.470 1.00 0.38 H new ATOM 0 HA LYS A 44 -2.215 -7.937 -4.079 1.00 0.39 H new ATOM 0 HB2 LYS A 44 -3.748 -7.778 -6.045 1.00 0.53 H new ATOM 0 HB3 LYS A 44 -2.954 -6.283 -6.497 1.00 0.53 H new ATOM 0 HG2 LYS A 44 -0.800 -7.485 -6.733 1.00 0.95 H new ATOM 0 HG3 LYS A 44 -1.573 -8.982 -6.250 1.00 0.95 H new ATOM 0 HD2 LYS A 44 -2.224 -7.322 -8.719 1.00 1.58 H new ATOM 0 HD3 LYS A 44 -1.419 -8.878 -8.694 1.00 1.58 H new ATOM 0 HE2 LYS A 44 -3.366 -10.046 -8.348 1.00 1.61 H new ATOM 0 HE3 LYS A 44 -4.063 -8.803 -7.328 1.00 1.61 H new ATOM 0 HZ1 LYS A 44 -5.054 -9.192 -9.637 1.00 2.63 H new ATOM 0 HZ2 LYS A 44 -4.790 -7.589 -9.144 1.00 2.63 H new ATOM 0 HZ3 LYS A 44 -3.712 -8.333 -10.224 1.00 2.63 H new ATOM 685 N VAL A 45 -0.197 -6.557 -3.895 1.00 0.31 N ATOM 686 CA VAL A 45 0.985 -5.767 -3.645 1.00 0.33 C ATOM 687 C VAL A 45 2.081 -6.167 -4.598 1.00 0.28 C ATOM 688 O VAL A 45 2.219 -7.335 -4.941 1.00 0.30 O ATOM 689 CB VAL A 45 1.463 -5.971 -2.196 1.00 0.44 C ATOM 690 CG1 VAL A 45 2.859 -5.410 -1.973 1.00 0.82 C ATOM 691 CG2 VAL A 45 0.475 -5.346 -1.228 1.00 0.51 C ATOM 0 H VAL A 45 -0.102 -7.543 -3.650 1.00 0.31 H new ATOM 0 HA VAL A 45 0.741 -4.715 -3.796 1.00 0.33 H new ATOM 0 HB VAL A 45 1.514 -7.044 -2.012 1.00 0.44 H new ATOM 0 HG11 VAL A 45 3.157 -5.575 -0.938 1.00 0.82 H new ATOM 0 HG12 VAL A 45 3.563 -5.911 -2.637 1.00 0.82 H new ATOM 0 HG13 VAL A 45 2.859 -4.341 -2.184 1.00 0.82 H new ATOM 0 HG21 VAL A 45 0.823 -5.496 -0.206 1.00 0.51 H new ATOM 0 HG22 VAL A 45 0.393 -4.278 -1.430 1.00 0.51 H new ATOM 0 HG23 VAL A 45 -0.501 -5.814 -1.352 1.00 0.51 H new ATOM 701 N SER A 46 2.831 -5.206 -5.067 1.00 0.25 N ATOM 702 CA SER A 46 4.009 -5.512 -5.822 1.00 0.25 C ATOM 703 C SER A 46 5.206 -4.759 -5.258 1.00 0.24 C ATOM 704 O SER A 46 5.392 -3.574 -5.529 1.00 0.26 O ATOM 705 CB SER A 46 3.765 -5.195 -7.291 1.00 0.28 C ATOM 706 OG SER A 46 2.910 -6.162 -7.878 1.00 0.72 O ATOM 0 H SER A 46 2.646 -4.211 -4.939 1.00 0.25 H new ATOM 0 HA SER A 46 4.237 -6.575 -5.744 1.00 0.25 H new ATOM 0 HB2 SER A 46 3.320 -4.204 -7.385 1.00 0.28 H new ATOM 0 HB3 SER A 46 4.715 -5.170 -7.825 1.00 0.28 H new ATOM 0 HG SER A 46 2.567 -6.761 -7.182 1.00 0.72 H new ATOM 712 N VAL A 47 6.001 -5.461 -4.454 1.00 0.25 N ATOM 713 CA VAL A 47 7.158 -4.867 -3.803 1.00 0.28 C ATOM 714 C VAL A 47 8.328 -4.830 -4.770 1.00 0.28 C ATOM 715 O VAL A 47 8.736 -5.858 -5.312 1.00 0.30 O ATOM 716 CB VAL A 47 7.608 -5.632 -2.524 1.00 0.41 C ATOM 717 CG1 VAL A 47 8.780 -4.910 -1.870 1.00 1.14 C ATOM 718 CG2 VAL A 47 6.471 -5.805 -1.516 1.00 1.05 C ATOM 0 H VAL A 47 5.861 -6.448 -4.239 1.00 0.25 H new ATOM 0 HA VAL A 47 6.855 -3.864 -3.502 1.00 0.28 H new ATOM 0 HB VAL A 47 7.917 -6.630 -2.836 1.00 0.41 H new ATOM 0 HG11 VAL A 47 9.088 -5.452 -0.976 1.00 1.14 H new ATOM 0 HG12 VAL A 47 9.614 -4.861 -2.570 1.00 1.14 H new ATOM 0 HG13 VAL A 47 8.477 -3.900 -1.595 1.00 1.14 H new ATOM 0 HG21 VAL A 47 6.838 -6.344 -0.643 1.00 1.05 H new ATOM 0 HG22 VAL A 47 6.104 -4.825 -1.210 1.00 1.05 H new ATOM 0 HG23 VAL A 47 5.659 -6.369 -1.976 1.00 1.05 H new ATOM 728 N THR A 48 8.846 -3.639 -4.993 1.00 0.30 N ATOM 729 CA THR A 48 9.969 -3.460 -5.882 1.00 0.31 C ATOM 730 C THR A 48 11.243 -3.299 -5.086 1.00 0.34 C ATOM 731 O THR A 48 11.378 -2.346 -4.341 1.00 0.37 O ATOM 732 CB THR A 48 9.799 -2.222 -6.773 1.00 0.36 C ATOM 733 OG1 THR A 48 8.499 -2.234 -7.383 1.00 0.41 O ATOM 734 CG2 THR A 48 10.885 -2.199 -7.838 1.00 0.41 C ATOM 0 H THR A 48 8.503 -2.778 -4.567 1.00 0.30 H new ATOM 0 HA THR A 48 10.020 -4.347 -6.514 1.00 0.31 H new ATOM 0 HB THR A 48 9.889 -1.324 -6.162 1.00 0.36 H new ATOM 0 HG1 THR A 48 8.396 -1.441 -7.949 1.00 0.41 H new ATOM 0 HG21 THR A 48 10.759 -1.318 -8.467 1.00 0.41 H new ATOM 0 HG22 THR A 48 11.864 -2.166 -7.359 1.00 0.41 H new ATOM 0 HG23 THR A 48 10.812 -3.097 -8.452 1.00 0.41 H new ATOM 742 N ASN A 49 12.158 -4.234 -5.251 1.00 0.38 N ATOM 743 CA ASN A 49 13.461 -4.176 -4.602 1.00 0.44 C ATOM 744 C ASN A 49 14.439 -3.444 -5.511 1.00 0.42 C ATOM 745 O ASN A 49 14.569 -3.795 -6.673 1.00 0.46 O ATOM 746 CB ASN A 49 13.928 -5.607 -4.324 1.00 0.59 C ATOM 747 CG ASN A 49 15.374 -5.736 -3.893 1.00 0.73 C ATOM 748 OD1 ASN A 49 15.969 -4.825 -3.324 1.00 1.48 O ATOM 749 ND2 ASN A 49 15.945 -6.901 -4.159 1.00 0.76 N ATOM 0 H ASN A 49 12.023 -5.057 -5.838 1.00 0.38 H new ATOM 0 HA ASN A 49 13.403 -3.634 -3.658 1.00 0.44 H new ATOM 0 HB2 ASN A 49 13.294 -6.036 -3.548 1.00 0.59 H new ATOM 0 HB3 ASN A 49 13.778 -6.203 -5.224 1.00 0.59 H new ATOM 0 HD21 ASN A 49 16.915 -7.067 -3.889 1.00 0.76 H new ATOM 0 HD22 ASN A 49 15.415 -7.632 -4.634 1.00 0.76 H new ATOM 756 N PRO A 50 15.109 -2.398 -5.004 1.00 0.46 N ATOM 757 CA PRO A 50 16.035 -1.582 -5.789 1.00 0.51 C ATOM 758 C PRO A 50 17.487 -2.060 -5.725 1.00 0.53 C ATOM 759 O PRO A 50 18.407 -1.333 -6.104 1.00 0.65 O ATOM 760 CB PRO A 50 15.901 -0.225 -5.115 1.00 0.64 C ATOM 761 CG PRO A 50 15.683 -0.549 -3.673 1.00 0.73 C ATOM 762 CD PRO A 50 14.987 -1.890 -3.627 1.00 0.55 C ATOM 0 HA PRO A 50 15.798 -1.605 -6.853 1.00 0.51 H new ATOM 0 HB2 PRO A 50 16.797 0.379 -5.256 1.00 0.64 H new ATOM 0 HB3 PRO A 50 15.066 0.343 -5.526 1.00 0.64 H new ATOM 0 HG2 PRO A 50 16.632 -0.587 -3.138 1.00 0.73 H new ATOM 0 HG3 PRO A 50 15.076 0.218 -3.192 1.00 0.73 H new ATOM 0 HD2 PRO A 50 15.459 -2.561 -2.910 1.00 0.55 H new ATOM 0 HD3 PRO A 50 13.943 -1.789 -3.329 1.00 0.55 H new ATOM 770 N TYR A 51 17.692 -3.280 -5.255 1.00 0.53 N ATOM 771 CA TYR A 51 19.025 -3.837 -5.145 1.00 0.68 C ATOM 772 C TYR A 51 19.018 -5.227 -5.753 1.00 0.88 C ATOM 773 O TYR A 51 18.025 -5.935 -5.652 1.00 1.88 O ATOM 774 CB TYR A 51 19.464 -3.894 -3.682 1.00 0.74 C ATOM 775 CG TYR A 51 20.963 -3.816 -3.495 1.00 0.88 C ATOM 776 CD1 TYR A 51 21.734 -4.969 -3.505 1.00 1.06 C ATOM 777 CD2 TYR A 51 21.608 -2.598 -3.309 1.00 1.22 C ATOM 778 CE1 TYR A 51 23.101 -4.917 -3.335 1.00 1.36 C ATOM 779 CE2 TYR A 51 22.980 -2.537 -3.139 1.00 1.63 C ATOM 780 CZ TYR A 51 23.717 -3.643 -3.149 1.00 1.64 C ATOM 781 OH TYR A 51 25.086 -3.653 -2.986 1.00 2.08 O ATOM 0 H TYR A 51 16.947 -3.903 -4.943 1.00 0.53 H new ATOM 0 HA TYR A 51 19.734 -3.204 -5.679 1.00 0.68 H new ATOM 0 HB2 TYR A 51 18.996 -3.073 -3.139 1.00 0.74 H new ATOM 0 HB3 TYR A 51 19.099 -4.820 -3.238 1.00 0.74 H new ATOM 0 HD1 TYR A 51 21.254 -5.926 -3.649 1.00 1.06 H new ATOM 0 HD2 TYR A 51 21.029 -1.686 -3.297 1.00 1.22 H new ATOM 0 HE1 TYR A 51 23.693 -5.820 -3.342 1.00 1.36 H new ATOM 0 HE2 TYR A 51 23.458 -1.579 -2.996 1.00 1.63 H new ATOM 0 HH TYR A 51 25.408 -2.735 -2.868 1.00 2.08 H new ATOM 791 N SER A 52 20.118 -5.633 -6.360 1.00 0.69 N ATOM 792 CA SER A 52 20.136 -6.851 -7.161 1.00 0.66 C ATOM 793 C SER A 52 20.281 -8.106 -6.285 1.00 0.65 C ATOM 794 O SER A 52 20.884 -9.094 -6.693 1.00 0.77 O ATOM 795 CB SER A 52 21.267 -6.749 -8.189 1.00 0.80 C ATOM 796 OG SER A 52 21.300 -7.868 -9.061 1.00 1.51 O ATOM 0 H SER A 52 21.010 -5.141 -6.316 1.00 0.69 H new ATOM 0 HA SER A 52 19.183 -6.951 -7.681 1.00 0.66 H new ATOM 0 HB2 SER A 52 21.143 -5.838 -8.774 1.00 0.80 H new ATOM 0 HB3 SER A 52 22.222 -6.667 -7.670 1.00 0.80 H new ATOM 0 HG SER A 52 21.152 -8.689 -8.546 1.00 1.51 H new ATOM 802 N HIS A 53 19.690 -8.073 -5.090 1.00 0.58 N ATOM 803 CA HIS A 53 19.699 -9.222 -4.188 1.00 0.66 C ATOM 804 C HIS A 53 18.398 -9.303 -3.403 1.00 0.65 C ATOM 805 O HIS A 53 17.909 -8.293 -2.897 1.00 1.08 O ATOM 806 CB HIS A 53 20.885 -9.164 -3.215 1.00 0.74 C ATOM 807 CG HIS A 53 22.204 -9.361 -3.886 1.00 0.95 C ATOM 808 ND1 HIS A 53 23.215 -8.426 -3.851 1.00 1.06 N ATOM 809 CD2 HIS A 53 22.664 -10.379 -4.647 1.00 1.41 C ATOM 810 CE1 HIS A 53 24.232 -8.854 -4.571 1.00 1.43 C ATOM 811 NE2 HIS A 53 23.923 -10.036 -5.063 1.00 1.67 N ATOM 0 H HIS A 53 19.197 -7.258 -4.724 1.00 0.58 H new ATOM 0 HA HIS A 53 19.802 -10.115 -4.804 1.00 0.66 H new ATOM 0 HB2 HIS A 53 20.883 -8.200 -2.707 1.00 0.74 H new ATOM 0 HB3 HIS A 53 20.756 -9.928 -2.449 1.00 0.74 H new ATOM 0 HD2 HIS A 53 22.137 -11.292 -4.883 1.00 1.41 H new ATOM 0 HE1 HIS A 53 25.160 -8.326 -4.731 1.00 1.43 H new ATOM 0 HE2 HIS A 53 24.525 -10.605 -5.658 1.00 1.67 H new ATOM 820 N SER A 54 17.835 -10.503 -3.362 1.00 0.55 N ATOM 821 CA SER A 54 16.645 -10.828 -2.590 1.00 0.51 C ATOM 822 C SER A 54 16.685 -10.272 -1.169 1.00 0.47 C ATOM 823 O SER A 54 17.251 -10.897 -0.292 1.00 0.51 O ATOM 824 CB SER A 54 16.544 -12.354 -2.509 1.00 0.61 C ATOM 825 OG SER A 54 16.795 -12.943 -3.776 1.00 1.39 O ATOM 0 H SER A 54 18.205 -11.300 -3.880 1.00 0.55 H new ATOM 0 HA SER A 54 15.787 -10.377 -3.090 1.00 0.51 H new ATOM 0 HB2 SER A 54 17.259 -12.732 -1.779 1.00 0.61 H new ATOM 0 HB3 SER A 54 15.552 -12.639 -2.160 1.00 0.61 H new ATOM 0 HG SER A 54 16.197 -12.548 -4.445 1.00 1.39 H new ATOM 831 N ILE A 55 16.002 -9.164 -0.915 1.00 0.44 N ATOM 832 CA ILE A 55 16.043 -8.555 0.410 1.00 0.49 C ATOM 833 C ILE A 55 15.157 -9.334 1.340 1.00 0.58 C ATOM 834 O ILE A 55 14.002 -9.528 1.050 1.00 1.03 O ATOM 835 CB ILE A 55 15.549 -7.107 0.402 1.00 0.49 C ATOM 836 CG1 ILE A 55 14.301 -6.978 -0.471 1.00 0.47 C ATOM 837 CG2 ILE A 55 16.654 -6.175 -0.053 1.00 0.48 C ATOM 838 CD1 ILE A 55 13.713 -5.591 -0.495 1.00 0.56 C ATOM 0 H ILE A 55 15.421 -8.674 -1.596 1.00 0.44 H new ATOM 0 HA ILE A 55 17.083 -8.567 0.736 1.00 0.49 H new ATOM 0 HB ILE A 55 15.273 -6.818 1.416 1.00 0.49 H new ATOM 0 HG12 ILE A 55 14.550 -7.274 -1.490 1.00 0.47 H new ATOM 0 HG13 ILE A 55 13.545 -7.676 -0.112 1.00 0.47 H new ATOM 0 HG21 ILE A 55 16.287 -5.149 -0.053 1.00 0.48 H new ATOM 0 HG22 ILE A 55 17.502 -6.257 0.627 1.00 0.48 H new ATOM 0 HG23 ILE A 55 16.969 -6.448 -1.060 1.00 0.48 H new ATOM 0 HD11 ILE A 55 12.831 -5.581 -1.136 1.00 0.56 H new ATOM 0 HD12 ILE A 55 13.430 -5.298 0.516 1.00 0.56 H new ATOM 0 HD13 ILE A 55 14.451 -4.889 -0.883 1.00 0.56 H new ATOM 850 N PRO A 56 15.672 -9.742 2.492 1.00 0.35 N ATOM 851 CA PRO A 56 15.080 -10.827 3.259 1.00 0.34 C ATOM 852 C PRO A 56 13.653 -10.552 3.705 1.00 0.30 C ATOM 853 O PRO A 56 12.765 -11.376 3.490 1.00 0.32 O ATOM 854 CB PRO A 56 16.003 -10.971 4.464 1.00 0.37 C ATOM 855 CG PRO A 56 16.719 -9.669 4.573 1.00 0.35 C ATOM 856 CD PRO A 56 16.814 -9.128 3.177 1.00 0.35 C ATOM 0 HA PRO A 56 15.000 -11.731 2.655 1.00 0.34 H new ATOM 0 HB2 PRO A 56 15.436 -11.184 5.370 1.00 0.37 H new ATOM 0 HB3 PRO A 56 16.704 -11.794 4.326 1.00 0.37 H new ATOM 0 HG2 PRO A 56 16.178 -8.980 5.222 1.00 0.35 H new ATOM 0 HG3 PRO A 56 17.710 -9.804 5.007 1.00 0.35 H new ATOM 0 HD2 PRO A 56 16.752 -8.040 3.163 1.00 0.35 H new ATOM 0 HD3 PRO A 56 17.758 -9.400 2.705 1.00 0.35 H new ATOM 864 N ILE A 57 13.423 -9.415 4.342 1.00 0.29 N ATOM 865 CA ILE A 57 12.103 -9.165 4.924 1.00 0.30 C ATOM 866 C ILE A 57 11.618 -7.735 4.701 1.00 0.27 C ATOM 867 O ILE A 57 12.409 -6.831 4.438 1.00 0.30 O ATOM 868 CB ILE A 57 12.118 -9.525 6.435 1.00 0.38 C ATOM 869 CG1 ILE A 57 12.297 -11.035 6.588 1.00 0.58 C ATOM 870 CG2 ILE A 57 10.858 -9.069 7.164 1.00 0.38 C ATOM 871 CD1 ILE A 57 12.396 -11.490 8.018 1.00 1.23 C ATOM 0 H ILE A 57 14.106 -8.668 4.470 1.00 0.29 H new ATOM 0 HA ILE A 57 11.389 -9.807 4.408 1.00 0.30 H new ATOM 0 HB ILE A 57 12.952 -8.994 6.893 1.00 0.38 H new ATOM 0 HG12 ILE A 57 11.457 -11.542 6.112 1.00 0.58 H new ATOM 0 HG13 ILE A 57 13.197 -11.341 6.055 1.00 0.58 H new ATOM 0 HG21 ILE A 57 10.925 -9.348 8.216 1.00 0.38 H new ATOM 0 HG22 ILE A 57 10.761 -7.986 7.081 1.00 0.38 H new ATOM 0 HG23 ILE A 57 9.986 -9.547 6.717 1.00 0.38 H new ATOM 0 HD11 ILE A 57 12.522 -12.572 8.048 1.00 1.23 H new ATOM 0 HD12 ILE A 57 13.253 -11.012 8.493 1.00 1.23 H new ATOM 0 HD13 ILE A 57 11.486 -11.216 8.551 1.00 1.23 H new ATOM 883 N CYS A 58 10.299 -7.551 4.771 1.00 0.26 N ATOM 884 CA CYS A 58 9.702 -6.249 4.617 1.00 0.24 C ATOM 885 C CYS A 58 8.552 -6.024 5.588 1.00 0.23 C ATOM 886 O CYS A 58 8.053 -6.937 6.248 1.00 0.25 O ATOM 887 CB CYS A 58 9.200 -6.040 3.193 1.00 0.26 C ATOM 888 SG CYS A 58 7.996 -7.265 2.639 1.00 1.15 S ATOM 0 H CYS A 58 9.629 -8.303 4.935 1.00 0.26 H new ATOM 0 HA CYS A 58 10.486 -5.525 4.838 1.00 0.24 H new ATOM 0 HB2 CYS A 58 8.751 -5.049 3.121 1.00 0.26 H new ATOM 0 HB3 CYS A 58 10.053 -6.054 2.514 1.00 0.26 H new ATOM 0 HG CYS A 58 8.041 -8.302 3.421 1.00 1.15 H new ATOM 894 N GLU A 59 8.162 -4.774 5.634 1.00 0.25 N ATOM 895 CA GLU A 59 7.069 -4.315 6.456 1.00 0.27 C ATOM 896 C GLU A 59 5.994 -3.687 5.593 1.00 0.29 C ATOM 897 O GLU A 59 6.240 -2.725 4.869 1.00 0.32 O ATOM 898 CB GLU A 59 7.553 -3.319 7.507 1.00 0.32 C ATOM 899 CG GLU A 59 6.446 -2.776 8.397 1.00 0.39 C ATOM 900 CD GLU A 59 6.940 -1.706 9.341 1.00 0.67 C ATOM 901 OE1 GLU A 59 7.120 -0.553 8.897 1.00 1.04 O ATOM 902 OE2 GLU A 59 7.153 -2.005 10.530 1.00 1.36 O ATOM 0 H GLU A 59 8.604 -4.033 5.091 1.00 0.25 H new ATOM 0 HA GLU A 59 6.649 -5.177 6.975 1.00 0.27 H new ATOM 0 HB2 GLU A 59 8.304 -3.802 8.132 1.00 0.32 H new ATOM 0 HB3 GLU A 59 8.044 -2.485 7.005 1.00 0.32 H new ATOM 0 HG2 GLU A 59 5.650 -2.368 7.774 1.00 0.39 H new ATOM 0 HG3 GLU A 59 6.013 -3.593 8.973 1.00 0.39 H new ATOM 909 N ILE A 60 4.823 -4.277 5.661 1.00 0.32 N ATOM 910 CA ILE A 60 3.642 -3.728 5.043 1.00 0.34 C ATOM 911 C ILE A 60 2.856 -2.906 6.046 1.00 0.31 C ATOM 912 O ILE A 60 2.299 -3.437 6.985 1.00 0.36 O ATOM 913 CB ILE A 60 2.736 -4.862 4.518 1.00 0.48 C ATOM 914 CG1 ILE A 60 3.363 -5.507 3.299 1.00 0.33 C ATOM 915 CG2 ILE A 60 1.351 -4.341 4.175 1.00 0.99 C ATOM 916 CD1 ILE A 60 3.473 -4.534 2.162 1.00 1.05 C ATOM 0 H ILE A 60 4.664 -5.158 6.151 1.00 0.32 H new ATOM 0 HA ILE A 60 3.958 -3.094 4.214 1.00 0.34 H new ATOM 0 HB ILE A 60 2.634 -5.607 5.307 1.00 0.48 H new ATOM 0 HG12 ILE A 60 4.353 -5.885 3.554 1.00 0.33 H new ATOM 0 HG13 ILE A 60 2.764 -6.364 2.990 1.00 0.33 H new ATOM 0 HG21 ILE A 60 0.734 -5.161 3.808 1.00 0.99 H new ATOM 0 HG22 ILE A 60 0.892 -3.913 5.066 1.00 0.99 H new ATOM 0 HG23 ILE A 60 1.431 -3.574 3.404 1.00 0.99 H new ATOM 0 HD11 ILE A 60 3.927 -5.028 1.303 1.00 1.05 H new ATOM 0 HD12 ILE A 60 2.479 -4.176 1.892 1.00 1.05 H new ATOM 0 HD13 ILE A 60 4.093 -3.690 2.464 1.00 1.05 H new ATOM 928 N SER A 61 2.844 -1.609 5.850 1.00 0.26 N ATOM 929 CA SER A 61 1.981 -0.752 6.635 1.00 0.25 C ATOM 930 C SER A 61 1.052 -0.001 5.703 1.00 0.24 C ATOM 931 O SER A 61 1.439 0.969 5.064 1.00 0.24 O ATOM 932 CB SER A 61 2.796 0.202 7.513 1.00 0.29 C ATOM 933 OG SER A 61 3.683 0.988 6.741 1.00 0.83 O ATOM 0 H SER A 61 3.417 -1.124 5.159 1.00 0.26 H new ATOM 0 HA SER A 61 1.384 -1.363 7.312 1.00 0.25 H new ATOM 0 HB2 SER A 61 2.121 0.853 8.068 1.00 0.29 H new ATOM 0 HB3 SER A 61 3.362 -0.372 8.247 1.00 0.29 H new ATOM 0 HG SER A 61 4.253 0.402 6.200 1.00 0.83 H new ATOM 939 N PHE A 62 -0.181 -0.447 5.625 1.00 0.24 N ATOM 940 CA PHE A 62 -1.100 0.076 4.642 1.00 0.25 C ATOM 941 C PHE A 62 -2.123 0.961 5.304 1.00 0.26 C ATOM 942 O PHE A 62 -2.643 0.653 6.369 1.00 0.30 O ATOM 943 CB PHE A 62 -1.797 -1.061 3.889 1.00 0.27 C ATOM 944 CG PHE A 62 -2.315 -2.156 4.786 1.00 0.29 C ATOM 945 CD1 PHE A 62 -1.515 -3.232 5.134 1.00 0.34 C ATOM 946 CD2 PHE A 62 -3.611 -2.112 5.267 1.00 0.31 C ATOM 947 CE1 PHE A 62 -2.002 -4.238 5.945 1.00 0.40 C ATOM 948 CE2 PHE A 62 -4.105 -3.115 6.074 1.00 0.37 C ATOM 949 CZ PHE A 62 -3.240 -4.168 6.462 1.00 0.40 C ATOM 0 H PHE A 62 -0.570 -1.170 6.230 1.00 0.24 H new ATOM 0 HA PHE A 62 -0.531 0.667 3.924 1.00 0.25 H new ATOM 0 HB2 PHE A 62 -2.628 -0.649 3.316 1.00 0.27 H new ATOM 0 HB3 PHE A 62 -1.098 -1.492 3.172 1.00 0.27 H new ATOM 0 HD1 PHE A 62 -0.500 -3.285 4.767 1.00 0.34 H new ATOM 0 HD2 PHE A 62 -4.246 -1.279 5.006 1.00 0.31 H new ATOM 0 HE1 PHE A 62 -1.379 -5.092 6.167 1.00 0.40 H new ATOM 0 HE2 PHE A 62 -5.133 -3.098 6.404 1.00 0.37 H new ATOM 0 HZ PHE A 62 -3.575 -4.911 7.170 1.00 0.40 H new ATOM 959 N THR A 63 -2.351 2.081 4.681 1.00 0.25 N ATOM 960 CA THR A 63 -3.368 3.004 5.100 1.00 0.27 C ATOM 961 C THR A 63 -4.207 3.387 3.892 1.00 0.25 C ATOM 962 O THR A 63 -3.769 4.143 3.035 1.00 0.27 O ATOM 963 CB THR A 63 -2.750 4.267 5.728 1.00 0.32 C ATOM 964 OG1 THR A 63 -1.738 3.888 6.673 1.00 0.36 O ATOM 965 CG2 THR A 63 -3.815 5.098 6.424 1.00 0.38 C ATOM 0 H THR A 63 -1.830 2.383 3.858 1.00 0.25 H new ATOM 0 HA THR A 63 -3.990 2.525 5.857 1.00 0.27 H new ATOM 0 HB THR A 63 -2.305 4.868 4.935 1.00 0.32 H new ATOM 0 HG1 THR A 63 -1.344 4.692 7.071 1.00 0.36 H new ATOM 0 HG21 THR A 63 -3.357 5.985 6.861 1.00 0.38 H new ATOM 0 HG22 THR A 63 -4.572 5.400 5.700 1.00 0.38 H new ATOM 0 HG23 THR A 63 -4.282 4.506 7.211 1.00 0.38 H new ATOM 973 N PHE A 64 -5.406 2.862 3.822 1.00 0.24 N ATOM 974 CA PHE A 64 -6.264 3.103 2.683 1.00 0.24 C ATOM 975 C PHE A 64 -7.215 4.239 2.998 1.00 0.22 C ATOM 976 O PHE A 64 -7.679 4.371 4.126 1.00 0.23 O ATOM 977 CB PHE A 64 -7.069 1.857 2.331 1.00 0.27 C ATOM 978 CG PHE A 64 -6.255 0.708 1.821 1.00 0.43 C ATOM 979 CD1 PHE A 64 -5.970 0.595 0.472 1.00 0.58 C ATOM 980 CD2 PHE A 64 -5.764 -0.251 2.691 1.00 0.65 C ATOM 981 CE1 PHE A 64 -5.214 -0.457 -0.001 1.00 0.84 C ATOM 982 CE2 PHE A 64 -5.006 -1.303 2.221 1.00 0.90 C ATOM 983 CZ PHE A 64 -4.766 -1.431 0.878 1.00 0.96 C ATOM 0 H PHE A 64 -5.812 2.263 4.541 1.00 0.24 H new ATOM 0 HA PHE A 64 -5.637 3.364 1.831 1.00 0.24 H new ATOM 0 HB2 PHE A 64 -7.616 1.532 3.216 1.00 0.27 H new ATOM 0 HB3 PHE A 64 -7.811 2.121 1.578 1.00 0.27 H new ATOM 0 HD1 PHE A 64 -6.343 1.338 -0.217 1.00 0.58 H new ATOM 0 HD2 PHE A 64 -5.977 -0.174 3.747 1.00 0.65 H new ATOM 0 HE1 PHE A 64 -4.972 -0.522 -1.052 1.00 0.84 H new ATOM 0 HE2 PHE A 64 -4.601 -2.027 2.913 1.00 0.90 H new ATOM 0 HZ PHE A 64 -4.228 -2.290 0.505 1.00 0.96 H new ATOM 993 N HIS A 65 -7.455 5.084 2.013 1.00 0.24 N ATOM 994 CA HIS A 65 -8.391 6.194 2.132 1.00 0.26 C ATOM 995 C HIS A 65 -9.365 6.119 0.991 1.00 0.24 C ATOM 996 O HIS A 65 -9.019 5.679 -0.094 1.00 0.36 O ATOM 997 CB HIS A 65 -7.709 7.573 2.089 1.00 0.42 C ATOM 998 CG HIS A 65 -6.515 7.770 2.982 1.00 0.51 C ATOM 999 ND1 HIS A 65 -5.764 6.898 3.695 1.00 1.02 N flip ATOM 1000 CD2 HIS A 65 -5.949 9.008 3.192 1.00 0.53 C flip ATOM 1001 CE1 HIS A 65 -4.774 7.619 4.315 1.00 1.29 C flip ATOM 1002 NE2 HIS A 65 -4.909 8.888 3.990 1.00 1.02 N flip ATOM 0 H HIS A 65 -7.004 5.022 1.100 1.00 0.24 H new ATOM 0 HA HIS A 65 -8.879 6.100 3.102 1.00 0.26 H new ATOM 0 HB2 HIS A 65 -7.400 7.767 1.062 1.00 0.42 H new ATOM 0 HB3 HIS A 65 -8.453 8.327 2.346 1.00 0.42 H new ATOM 0 HD2 HIS A 65 -6.304 9.935 2.767 1.00 0.53 H new ATOM 0 HE1 HIS A 65 -4.011 7.213 4.962 1.00 1.29 H new ATOM 0 HE2 HIS A 65 -4.308 9.650 4.304 1.00 1.02 H new ATOM 1011 N SER A 66 -10.595 6.482 1.248 1.00 0.22 N ATOM 1012 CA SER A 66 -11.592 6.508 0.223 1.00 0.25 C ATOM 1013 C SER A 66 -11.786 7.912 -0.329 1.00 0.24 C ATOM 1014 O SER A 66 -10.894 8.461 -0.976 1.00 0.30 O ATOM 1015 CB SER A 66 -12.871 6.005 0.837 1.00 0.38 C ATOM 1016 OG SER A 66 -12.807 6.073 2.253 1.00 1.27 O ATOM 0 H SER A 66 -10.927 6.765 2.170 1.00 0.22 H new ATOM 0 HA SER A 66 -11.284 5.881 -0.614 1.00 0.25 H new ATOM 0 HB2 SER A 66 -13.711 6.598 0.477 1.00 0.38 H new ATOM 0 HB3 SER A 66 -13.050 4.976 0.525 1.00 0.38 H new ATOM 0 HG SER A 66 -13.715 6.089 2.621 1.00 1.27 H new ATOM 1022 N ALA A 67 -12.936 8.508 -0.021 1.00 0.24 N ATOM 1023 CA ALA A 67 -13.265 9.825 -0.522 1.00 0.28 C ATOM 1024 C ALA A 67 -12.277 10.815 0.040 1.00 0.30 C ATOM 1025 O ALA A 67 -11.628 11.557 -0.697 1.00 0.36 O ATOM 1026 CB ALA A 67 -14.679 10.201 -0.130 1.00 0.32 C ATOM 0 H ALA A 67 -13.652 8.092 0.575 1.00 0.24 H new ATOM 0 HA ALA A 67 -13.209 9.831 -1.611 1.00 0.28 H new ATOM 0 HB1 ALA A 67 -14.911 11.194 -0.514 1.00 0.32 H new ATOM 0 HB2 ALA A 67 -15.378 9.477 -0.550 1.00 0.32 H new ATOM 0 HB3 ALA A 67 -14.767 10.203 0.956 1.00 0.32 H new ATOM 1032 N GLY A 68 -12.161 10.821 1.359 1.00 0.29 N ATOM 1033 CA GLY A 68 -11.093 11.509 2.019 1.00 0.32 C ATOM 1034 C GLY A 68 -10.966 10.962 3.422 1.00 0.34 C ATOM 1035 O GLY A 68 -10.335 11.564 4.289 1.00 0.39 O ATOM 0 H GLY A 68 -12.808 10.347 1.989 1.00 0.29 H new ATOM 0 HA2 GLY A 68 -10.160 11.372 1.473 1.00 0.32 H new ATOM 0 HA3 GLY A 68 -11.292 12.580 2.047 1.00 0.32 H new ATOM 1039 N ARG A 69 -11.582 9.792 3.643 1.00 0.36 N ATOM 1040 CA ARG A 69 -11.573 9.159 4.947 1.00 0.46 C ATOM 1041 C ARG A 69 -10.744 7.893 4.857 1.00 0.52 C ATOM 1042 O ARG A 69 -10.139 7.640 3.826 1.00 1.08 O ATOM 1043 CB ARG A 69 -12.996 8.872 5.455 1.00 0.48 C ATOM 1044 CG ARG A 69 -13.782 7.822 4.672 1.00 0.47 C ATOM 1045 CD ARG A 69 -14.757 8.437 3.673 1.00 0.58 C ATOM 1046 NE ARG A 69 -15.576 9.496 4.276 1.00 0.55 N ATOM 1047 CZ ARG A 69 -16.405 10.297 3.605 1.00 1.05 C ATOM 1048 NH1 ARG A 69 -16.583 10.140 2.304 1.00 1.97 N ATOM 1049 NH2 ARG A 69 -17.067 11.250 4.251 1.00 1.04 N ATOM 0 H ARG A 69 -12.090 9.273 2.927 1.00 0.36 H new ATOM 0 HA ARG A 69 -11.127 9.837 5.675 1.00 0.46 H new ATOM 0 HB2 ARG A 69 -12.932 8.550 6.495 1.00 0.48 H new ATOM 0 HB3 ARG A 69 -13.561 9.804 5.444 1.00 0.48 H new ATOM 0 HG2 ARG A 69 -13.085 7.174 4.141 1.00 0.47 H new ATOM 0 HG3 ARG A 69 -14.333 7.192 5.370 1.00 0.47 H new ATOM 0 HD2 ARG A 69 -14.200 8.846 2.830 1.00 0.58 H new ATOM 0 HD3 ARG A 69 -15.408 7.658 3.277 1.00 0.58 H new ATOM 0 HE ARG A 69 -15.506 9.629 5.285 1.00 0.55 H new ATOM 0 HH11 ARG A 69 -16.085 9.402 1.806 1.00 1.97 H new ATOM 0 HH12 ARG A 69 -17.219 10.757 1.798 1.00 1.97 H new ATOM 0 HH21 ARG A 69 -16.940 11.367 5.256 1.00 1.04 H new ATOM 0 HH22 ARG A 69 -17.702 11.865 3.742 1.00 1.04 H new ATOM 1063 N GLU A 70 -10.750 7.070 5.884 1.00 0.52 N ATOM 1064 CA GLU A 70 -9.743 6.045 6.007 1.00 0.52 C ATOM 1065 C GLU A 70 -10.330 4.669 5.762 1.00 0.67 C ATOM 1066 O GLU A 70 -10.821 4.016 6.677 1.00 1.28 O ATOM 1067 CB GLU A 70 -9.075 6.129 7.380 1.00 0.66 C ATOM 1068 CG GLU A 70 -10.060 6.204 8.538 1.00 1.35 C ATOM 1069 CD GLU A 70 -9.396 6.598 9.837 1.00 1.91 C ATOM 1070 OE1 GLU A 70 -8.671 5.756 10.415 1.00 2.61 O ATOM 1071 OE2 GLU A 70 -9.609 7.736 10.300 1.00 2.12 O ATOM 0 H GLU A 70 -11.436 7.092 6.639 1.00 0.52 H new ATOM 0 HA GLU A 70 -8.983 6.211 5.244 1.00 0.52 H new ATOM 0 HB2 GLU A 70 -8.434 5.258 7.516 1.00 0.66 H new ATOM 0 HB3 GLU A 70 -8.429 7.007 7.407 1.00 0.66 H new ATOM 0 HG2 GLU A 70 -10.842 6.925 8.300 1.00 1.35 H new ATOM 0 HG3 GLU A 70 -10.546 5.236 8.661 1.00 1.35 H new ATOM 1078 N ILE A 71 -10.282 4.255 4.501 1.00 0.28 N ATOM 1079 CA ILE A 71 -10.788 2.957 4.075 1.00 0.28 C ATOM 1080 C ILE A 71 -10.297 1.834 4.976 1.00 0.29 C ATOM 1081 O ILE A 71 -11.058 0.946 5.340 1.00 0.33 O ATOM 1082 CB ILE A 71 -10.389 2.661 2.612 1.00 0.31 C ATOM 1083 CG1 ILE A 71 -11.425 3.207 1.647 1.00 0.37 C ATOM 1084 CG2 ILE A 71 -10.211 1.177 2.391 1.00 0.30 C ATOM 1085 CD1 ILE A 71 -12.793 2.607 1.845 1.00 0.40 C ATOM 0 H ILE A 71 -9.889 4.813 3.743 1.00 0.28 H new ATOM 0 HA ILE A 71 -11.875 3.002 4.148 1.00 0.28 H new ATOM 0 HB ILE A 71 -9.438 3.159 2.422 1.00 0.31 H new ATOM 0 HG12 ILE A 71 -11.489 4.289 1.766 1.00 0.37 H new ATOM 0 HG13 ILE A 71 -11.096 3.017 0.625 1.00 0.37 H new ATOM 0 HG21 ILE A 71 -9.930 0.995 1.354 1.00 0.30 H new ATOM 0 HG22 ILE A 71 -9.428 0.802 3.050 1.00 0.30 H new ATOM 0 HG23 ILE A 71 -11.146 0.662 2.610 1.00 0.30 H new ATOM 0 HD11 ILE A 71 -13.488 3.039 1.125 1.00 0.40 H new ATOM 0 HD12 ILE A 71 -12.742 1.528 1.698 1.00 0.40 H new ATOM 0 HD13 ILE A 71 -13.140 2.819 2.856 1.00 0.40 H new ATOM 1097 N GLY A 72 -9.032 1.890 5.344 1.00 0.29 N ATOM 1098 CA GLY A 72 -8.473 0.837 6.163 1.00 0.36 C ATOM 1099 C GLY A 72 -7.051 1.134 6.549 1.00 0.34 C ATOM 1100 O GLY A 72 -6.454 2.060 6.013 1.00 0.49 O ATOM 0 H GLY A 72 -8.385 2.638 5.094 1.00 0.29 H new ATOM 0 HA2 GLY A 72 -9.077 0.715 7.062 1.00 0.36 H new ATOM 0 HA3 GLY A 72 -8.514 -0.108 5.621 1.00 0.36 H new ATOM 1104 N LYS A 73 -6.509 0.386 7.494 1.00 0.36 N ATOM 1105 CA LYS A 73 -5.111 0.540 7.854 1.00 0.35 C ATOM 1106 C LYS A 73 -4.629 -0.621 8.716 1.00 0.39 C ATOM 1107 O LYS A 73 -5.413 -1.276 9.407 1.00 0.47 O ATOM 1108 CB LYS A 73 -4.863 1.871 8.580 1.00 0.44 C ATOM 1109 CG LYS A 73 -5.283 1.888 10.043 1.00 0.61 C ATOM 1110 CD LYS A 73 -6.795 1.785 10.239 1.00 0.68 C ATOM 1111 CE LYS A 73 -7.538 2.949 9.603 1.00 1.26 C ATOM 1112 NZ LYS A 73 -8.999 2.899 9.888 1.00 1.81 N ATOM 0 H LYS A 73 -7.011 -0.328 8.022 1.00 0.36 H new ATOM 0 HA LYS A 73 -4.541 0.542 6.925 1.00 0.35 H new ATOM 0 HB2 LYS A 73 -3.801 2.110 8.519 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -5.398 2.661 8.054 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -4.799 1.061 10.562 1.00 0.61 H new ATOM 0 HG3 LYS A 73 -4.925 2.808 10.506 1.00 0.61 H new ATOM 0 HD2 LYS A 73 -7.152 0.850 9.809 1.00 0.68 H new ATOM 0 HD3 LYS A 73 -7.020 1.752 11.305 1.00 0.68 H new ATOM 0 HE2 LYS A 73 -7.128 3.888 9.975 1.00 1.26 H new ATOM 0 HE3 LYS A 73 -7.378 2.936 8.525 1.00 1.26 H new ATOM 0 HZ1 LYS A 73 -9.332 3.845 10.162 1.00 1.81 H new ATOM 0 HZ2 LYS A 73 -9.508 2.586 9.037 1.00 1.81 H new ATOM 0 HZ3 LYS A 73 -9.179 2.231 10.664 1.00 1.81 H new ATOM 1126 N GLY A 74 -3.336 -0.876 8.654 1.00 0.39 N ATOM 1127 CA GLY A 74 -2.735 -1.927 9.439 1.00 0.43 C ATOM 1128 C GLY A 74 -1.325 -2.203 8.978 1.00 0.34 C ATOM 1129 O GLY A 74 -0.836 -1.549 8.059 1.00 0.32 O ATOM 0 H GLY A 74 -2.681 -0.364 8.063 1.00 0.39 H new ATOM 0 HA2 GLY A 74 -2.729 -1.643 10.491 1.00 0.43 H new ATOM 0 HA3 GLY A 74 -3.333 -2.835 9.358 1.00 0.43 H new ATOM 1133 N LYS A 75 -0.667 -3.161 9.605 1.00 0.37 N ATOM 1134 CA LYS A 75 0.698 -3.498 9.242 1.00 0.37 C ATOM 1135 C LYS A 75 0.934 -5.001 9.308 1.00 0.39 C ATOM 1136 O LYS A 75 0.555 -5.655 10.279 1.00 0.50 O ATOM 1137 CB LYS A 75 1.729 -2.759 10.114 1.00 0.56 C ATOM 1138 CG LYS A 75 1.277 -2.457 11.538 1.00 0.84 C ATOM 1139 CD LYS A 75 0.566 -1.111 11.632 1.00 0.90 C ATOM 1140 CE LYS A 75 1.400 0.000 11.006 1.00 1.17 C ATOM 1141 NZ LYS A 75 0.733 1.326 11.092 1.00 1.72 N ATOM 0 H LYS A 75 -1.054 -3.718 10.366 1.00 0.37 H new ATOM 0 HA LYS A 75 0.836 -3.169 8.212 1.00 0.37 H new ATOM 0 HB2 LYS A 75 2.639 -3.357 10.158 1.00 0.56 H new ATOM 0 HB3 LYS A 75 1.988 -1.820 9.625 1.00 0.56 H new ATOM 0 HG2 LYS A 75 0.609 -3.246 11.882 1.00 0.84 H new ATOM 0 HG3 LYS A 75 2.141 -2.459 12.202 1.00 0.84 H new ATOM 0 HD2 LYS A 75 -0.399 -1.171 11.129 1.00 0.90 H new ATOM 0 HD3 LYS A 75 0.367 -0.875 12.677 1.00 0.90 H new ATOM 0 HE2 LYS A 75 2.368 0.050 11.506 1.00 1.17 H new ATOM 0 HE3 LYS A 75 1.593 -0.239 9.960 1.00 1.17 H new ATOM 0 HZ1 LYS A 75 1.339 2.048 10.653 1.00 1.72 H new ATOM 0 HZ2 LYS A 75 -0.179 1.289 10.593 1.00 1.72 H new ATOM 0 HZ3 LYS A 75 0.572 1.569 12.090 1.00 1.72 H new ATOM 1155 N ILE A 76 1.555 -5.540 8.261 1.00 0.35 N ATOM 1156 CA ILE A 76 1.862 -6.955 8.191 1.00 0.39 C ATOM 1157 C ILE A 76 3.323 -7.150 7.796 1.00 0.34 C ATOM 1158 O ILE A 76 3.713 -6.851 6.668 1.00 0.35 O ATOM 1159 CB ILE A 76 0.953 -7.676 7.169 1.00 0.45 C ATOM 1160 CG1 ILE A 76 -0.514 -7.590 7.601 1.00 0.51 C ATOM 1161 CG2 ILE A 76 1.376 -9.130 7.008 1.00 0.56 C ATOM 1162 CD1 ILE A 76 -1.481 -8.214 6.618 1.00 0.73 C ATOM 0 H ILE A 76 1.855 -5.007 7.445 1.00 0.35 H new ATOM 0 HA ILE A 76 1.684 -7.387 9.176 1.00 0.39 H new ATOM 0 HB ILE A 76 1.059 -7.178 6.205 1.00 0.45 H new ATOM 0 HG12 ILE A 76 -0.627 -8.081 8.568 1.00 0.51 H new ATOM 0 HG13 ILE A 76 -0.780 -6.542 7.742 1.00 0.51 H new ATOM 0 HG21 ILE A 76 0.724 -9.621 6.285 1.00 0.56 H new ATOM 0 HG22 ILE A 76 2.406 -9.172 6.655 1.00 0.56 H new ATOM 0 HG23 ILE A 76 1.300 -9.639 7.969 1.00 0.56 H new ATOM 0 HD11 ILE A 76 -2.499 -8.113 6.995 1.00 0.73 H new ATOM 0 HD12 ILE A 76 -1.398 -7.709 5.656 1.00 0.73 H new ATOM 0 HD13 ILE A 76 -1.243 -9.271 6.494 1.00 0.73 H new ATOM 1174 N PRO A 77 4.162 -7.605 8.734 1.00 0.34 N ATOM 1175 CA PRO A 77 5.549 -7.958 8.437 1.00 0.32 C ATOM 1176 C PRO A 77 5.606 -9.232 7.607 1.00 0.33 C ATOM 1177 O PRO A 77 4.997 -10.240 7.972 1.00 0.44 O ATOM 1178 CB PRO A 77 6.183 -8.180 9.817 1.00 0.40 C ATOM 1179 CG PRO A 77 5.183 -7.668 10.806 1.00 0.57 C ATOM 1180 CD PRO A 77 3.842 -7.803 10.150 1.00 0.42 C ATOM 0 HA PRO A 77 6.065 -7.191 7.860 1.00 0.32 H new ATOM 0 HB2 PRO A 77 6.396 -9.236 9.985 1.00 0.40 H new ATOM 0 HB3 PRO A 77 7.129 -7.646 9.904 1.00 0.40 H new ATOM 0 HG2 PRO A 77 5.223 -8.241 11.733 1.00 0.57 H new ATOM 0 HG3 PRO A 77 5.387 -6.629 11.065 1.00 0.57 H new ATOM 0 HD2 PRO A 77 3.397 -8.781 10.333 1.00 0.42 H new ATOM 0 HD3 PRO A 77 3.135 -7.058 10.515 1.00 0.42 H new ATOM 1188 N ASP A 78 6.320 -9.192 6.493 1.00 0.30 N ATOM 1189 CA ASP A 78 6.327 -10.320 5.572 1.00 0.35 C ATOM 1190 C ASP A 78 7.736 -10.559 5.047 1.00 0.32 C ATOM 1191 O ASP A 78 8.503 -9.609 4.893 1.00 0.28 O ATOM 1192 CB ASP A 78 5.366 -10.037 4.408 1.00 0.39 C ATOM 1193 CG ASP A 78 5.001 -11.281 3.619 1.00 0.52 C ATOM 1194 OD1 ASP A 78 5.724 -11.610 2.650 1.00 0.52 O ATOM 1195 OD2 ASP A 78 4.002 -11.947 3.960 1.00 0.79 O ATOM 0 H ASP A 78 6.896 -8.401 6.206 1.00 0.30 H new ATOM 0 HA ASP A 78 5.997 -11.216 6.098 1.00 0.35 H new ATOM 0 HB2 ASP A 78 4.456 -9.582 4.799 1.00 0.39 H new ATOM 0 HB3 ASP A 78 5.823 -9.310 3.737 1.00 0.39 H new ATOM 1200 N PRO A 79 8.122 -11.827 4.820 1.00 0.39 N ATOM 1201 CA PRO A 79 9.386 -12.160 4.163 1.00 0.40 C ATOM 1202 C PRO A 79 9.488 -11.515 2.781 1.00 0.38 C ATOM 1203 O PRO A 79 9.063 -12.081 1.775 1.00 0.47 O ATOM 1204 CB PRO A 79 9.353 -13.688 4.050 1.00 0.52 C ATOM 1205 CG PRO A 79 8.404 -14.126 5.110 1.00 0.58 C ATOM 1206 CD PRO A 79 7.375 -13.034 5.216 1.00 0.49 C ATOM 0 HA PRO A 79 10.248 -11.794 4.720 1.00 0.40 H new ATOM 0 HB2 PRO A 79 9.017 -14.005 3.063 1.00 0.52 H new ATOM 0 HB3 PRO A 79 10.343 -14.118 4.203 1.00 0.52 H new ATOM 0 HG2 PRO A 79 7.939 -15.077 4.850 1.00 0.58 H new ATOM 0 HG3 PRO A 79 8.919 -14.272 6.060 1.00 0.58 H new ATOM 0 HD2 PRO A 79 6.526 -13.216 4.557 1.00 0.49 H new ATOM 0 HD3 PRO A 79 6.981 -12.949 6.229 1.00 0.49 H new ATOM 1214 N GLY A 80 10.043 -10.312 2.760 1.00 0.34 N ATOM 1215 CA GLY A 80 10.164 -9.536 1.546 1.00 0.40 C ATOM 1216 C GLY A 80 11.263 -10.021 0.625 1.00 0.35 C ATOM 1217 O GLY A 80 11.628 -9.332 -0.326 1.00 0.40 O ATOM 0 H GLY A 80 10.421 -9.851 3.588 1.00 0.34 H new ATOM 0 HA2 GLY A 80 9.215 -9.563 1.011 1.00 0.40 H new ATOM 0 HA3 GLY A 80 10.353 -8.495 1.807 1.00 0.40 H new ATOM 1221 N SER A 81 11.765 -11.217 0.893 1.00 0.34 N ATOM 1222 CA SER A 81 12.870 -11.784 0.145 1.00 0.36 C ATOM 1223 C SER A 81 12.405 -12.132 -1.264 1.00 0.37 C ATOM 1224 O SER A 81 11.509 -12.959 -1.447 1.00 0.43 O ATOM 1225 CB SER A 81 13.382 -13.021 0.887 1.00 0.41 C ATOM 1226 OG SER A 81 12.413 -14.060 0.881 1.00 0.62 O ATOM 0 H SER A 81 11.415 -11.820 1.637 1.00 0.34 H new ATOM 0 HA SER A 81 13.685 -11.066 0.060 1.00 0.36 H new ATOM 0 HB2 SER A 81 14.301 -13.374 0.420 1.00 0.41 H new ATOM 0 HB3 SER A 81 13.629 -12.756 1.915 1.00 0.41 H new ATOM 0 HG SER A 81 11.831 -13.960 0.099 1.00 0.62 H new ATOM 1232 N LEU A 82 13.007 -11.495 -2.263 1.00 0.37 N ATOM 1233 CA LEU A 82 12.396 -11.486 -3.603 1.00 0.39 C ATOM 1234 C LEU A 82 13.431 -11.552 -4.720 1.00 0.49 C ATOM 1235 O LEU A 82 14.594 -11.817 -4.467 1.00 0.82 O ATOM 1236 CB LEU A 82 11.522 -10.234 -3.785 1.00 0.36 C ATOM 1237 CG LEU A 82 12.265 -8.939 -4.130 1.00 0.52 C ATOM 1238 CD1 LEU A 82 11.286 -7.790 -4.301 1.00 1.10 C ATOM 1239 CD2 LEU A 82 13.290 -8.604 -3.067 1.00 1.08 C ATOM 0 H LEU A 82 13.890 -10.991 -2.184 1.00 0.37 H new ATOM 0 HA LEU A 82 11.780 -12.383 -3.672 1.00 0.39 H new ATOM 0 HB2 LEU A 82 10.796 -10.434 -4.573 1.00 0.36 H new ATOM 0 HB3 LEU A 82 10.958 -10.072 -2.866 1.00 0.36 H new ATOM 0 HG LEU A 82 12.789 -9.092 -5.073 1.00 0.52 H new ATOM 0 HD11 LEU A 82 11.833 -6.879 -4.546 1.00 1.10 H new ATOM 0 HD12 LEU A 82 10.589 -8.022 -5.106 1.00 1.10 H new ATOM 0 HD13 LEU A 82 10.732 -7.643 -3.374 1.00 1.10 H new ATOM 0 HD21 LEU A 82 13.804 -7.681 -3.335 1.00 1.08 H new ATOM 0 HD22 LEU A 82 12.790 -8.475 -2.107 1.00 1.08 H new ATOM 0 HD23 LEU A 82 14.015 -9.414 -2.993 1.00 1.08 H new ATOM 1251 N LYS A 83 12.978 -11.281 -5.948 1.00 0.40 N ATOM 1252 CA LYS A 83 13.801 -11.402 -7.153 1.00 0.46 C ATOM 1253 C LYS A 83 15.195 -10.789 -6.992 1.00 0.47 C ATOM 1254 O LYS A 83 16.117 -11.441 -6.496 1.00 0.63 O ATOM 1255 CB LYS A 83 13.115 -10.722 -8.338 1.00 0.52 C ATOM 1256 CG LYS A 83 11.709 -11.214 -8.637 1.00 0.58 C ATOM 1257 CD LYS A 83 11.199 -10.586 -9.920 1.00 0.68 C ATOM 1258 CE LYS A 83 9.762 -10.962 -10.229 1.00 1.08 C ATOM 1259 NZ LYS A 83 9.305 -10.332 -11.498 1.00 1.84 N ATOM 0 H LYS A 83 12.025 -10.970 -6.134 1.00 0.40 H new ATOM 0 HA LYS A 83 13.917 -12.471 -7.329 1.00 0.46 H new ATOM 0 HB2 LYS A 83 13.075 -9.649 -8.148 1.00 0.52 H new ATOM 0 HB3 LYS A 83 13.730 -10.866 -9.226 1.00 0.52 H new ATOM 0 HG2 LYS A 83 11.707 -12.300 -8.729 1.00 0.58 H new ATOM 0 HG3 LYS A 83 11.044 -10.963 -7.811 1.00 0.58 H new ATOM 0 HD2 LYS A 83 11.278 -9.501 -9.844 1.00 0.68 H new ATOM 0 HD3 LYS A 83 11.837 -10.895 -10.748 1.00 0.68 H new ATOM 0 HE2 LYS A 83 9.675 -12.046 -10.305 1.00 1.08 H new ATOM 0 HE3 LYS A 83 9.116 -10.647 -9.410 1.00 1.08 H new ATOM 0 HZ1 LYS A 83 8.278 -10.173 -11.457 1.00 1.84 H new ATOM 0 HZ2 LYS A 83 9.791 -9.422 -11.629 1.00 1.84 H new ATOM 0 HZ3 LYS A 83 9.526 -10.960 -12.297 1.00 1.84 H new ATOM 1273 N ALA A 84 15.327 -9.522 -7.397 1.00 0.47 N ATOM 1274 CA ALA A 84 16.611 -8.840 -7.473 1.00 0.50 C ATOM 1275 C ALA A 84 16.445 -7.610 -8.336 1.00 0.58 C ATOM 1276 O ALA A 84 16.288 -7.727 -9.553 1.00 0.99 O ATOM 1277 CB ALA A 84 17.703 -9.730 -8.064 1.00 0.56 C ATOM 0 H ALA A 84 14.538 -8.942 -7.682 1.00 0.47 H new ATOM 0 HA ALA A 84 16.920 -8.575 -6.462 1.00 0.50 H new ATOM 0 HB1 ALA A 84 18.642 -9.178 -8.101 1.00 0.56 H new ATOM 0 HB2 ALA A 84 17.827 -10.616 -7.441 1.00 0.56 H new ATOM 0 HB3 ALA A 84 17.420 -10.032 -9.072 1.00 0.56 H new ATOM 1283 N LYS A 85 16.452 -6.450 -7.693 1.00 0.49 N ATOM 1284 CA LYS A 85 16.233 -5.164 -8.347 1.00 0.54 C ATOM 1285 C LYS A 85 15.041 -5.229 -9.312 1.00 0.53 C ATOM 1286 O LYS A 85 15.094 -4.743 -10.442 1.00 0.61 O ATOM 1287 CB LYS A 85 17.525 -4.663 -9.024 1.00 0.65 C ATOM 1288 CG LYS A 85 17.946 -5.422 -10.271 1.00 1.07 C ATOM 1289 CD LYS A 85 19.413 -5.186 -10.598 1.00 1.25 C ATOM 1290 CE LYS A 85 19.789 -3.715 -10.510 1.00 1.60 C ATOM 1291 NZ LYS A 85 21.084 -3.429 -11.185 1.00 1.84 N ATOM 0 H LYS A 85 16.612 -6.373 -6.689 1.00 0.49 H new ATOM 0 HA LYS A 85 15.973 -4.428 -7.586 1.00 0.54 H new ATOM 0 HB2 LYS A 85 17.394 -3.613 -9.286 1.00 0.65 H new ATOM 0 HB3 LYS A 85 18.337 -4.712 -8.299 1.00 0.65 H new ATOM 0 HG2 LYS A 85 17.771 -6.488 -10.126 1.00 1.07 H new ATOM 0 HG3 LYS A 85 17.329 -5.110 -11.114 1.00 1.07 H new ATOM 0 HD2 LYS A 85 20.034 -5.760 -9.911 1.00 1.25 H new ATOM 0 HD3 LYS A 85 19.624 -5.554 -11.602 1.00 1.25 H new ATOM 0 HE2 LYS A 85 19.003 -3.112 -10.964 1.00 1.60 H new ATOM 0 HE3 LYS A 85 19.853 -3.419 -9.463 1.00 1.60 H new ATOM 0 HZ1 LYS A 85 21.303 -2.416 -11.102 1.00 1.84 H new ATOM 0 HZ2 LYS A 85 21.840 -3.984 -10.736 1.00 1.84 H new ATOM 0 HZ3 LYS A 85 21.016 -3.687 -12.190 1.00 1.84 H new ATOM 1305 N ASP A 86 13.938 -5.792 -8.816 1.00 0.48 N ATOM 1306 CA ASP A 86 12.768 -6.053 -9.644 1.00 0.46 C ATOM 1307 C ASP A 86 11.506 -5.983 -8.782 1.00 0.40 C ATOM 1308 O ASP A 86 11.572 -5.597 -7.613 1.00 0.38 O ATOM 1309 CB ASP A 86 12.893 -7.429 -10.315 1.00 0.49 C ATOM 1310 CG ASP A 86 12.047 -7.551 -11.571 1.00 0.53 C ATOM 1311 OD1 ASP A 86 10.860 -7.910 -11.456 1.00 0.55 O ATOM 1312 OD2 ASP A 86 12.566 -7.285 -12.677 1.00 0.64 O ATOM 0 H ASP A 86 13.834 -6.075 -7.842 1.00 0.48 H new ATOM 0 HA ASP A 86 12.701 -5.297 -10.427 1.00 0.46 H new ATOM 0 HB2 ASP A 86 13.938 -7.612 -10.567 1.00 0.49 H new ATOM 0 HB3 ASP A 86 12.596 -8.202 -9.606 1.00 0.49 H new ATOM 1317 N MET A 87 10.381 -6.395 -9.339 1.00 0.39 N ATOM 1318 CA MET A 87 9.091 -6.216 -8.686 1.00 0.35 C ATOM 1319 C MET A 87 8.423 -7.563 -8.423 1.00 0.34 C ATOM 1320 O MET A 87 8.144 -8.324 -9.350 1.00 0.37 O ATOM 1321 CB MET A 87 8.187 -5.325 -9.540 1.00 0.35 C ATOM 1322 CG MET A 87 6.962 -4.814 -8.800 1.00 0.35 C ATOM 1323 SD MET A 87 5.922 -3.746 -9.817 1.00 0.41 S ATOM 1324 CE MET A 87 5.402 -4.892 -11.094 1.00 1.35 C ATOM 0 H MET A 87 10.332 -6.858 -10.246 1.00 0.39 H new ATOM 0 HA MET A 87 9.256 -5.729 -7.725 1.00 0.35 H new ATOM 0 HB2 MET A 87 8.765 -4.474 -9.900 1.00 0.35 H new ATOM 0 HB3 MET A 87 7.864 -5.885 -10.418 1.00 0.35 H new ATOM 0 HG2 MET A 87 6.373 -5.663 -8.453 1.00 0.35 H new ATOM 0 HG3 MET A 87 7.282 -4.265 -7.914 1.00 0.35 H new ATOM 0 HE1 MET A 87 4.514 -4.503 -11.593 1.00 1.35 H new ATOM 0 HE2 MET A 87 6.204 -5.013 -11.822 1.00 1.35 H new ATOM 0 HE3 MET A 87 5.171 -5.858 -10.644 1.00 1.35 H new ATOM 1334 N THR A 88 8.177 -7.847 -7.155 1.00 0.31 N ATOM 1335 CA THR A 88 7.593 -9.114 -6.743 1.00 0.30 C ATOM 1336 C THR A 88 6.143 -8.918 -6.308 1.00 0.27 C ATOM 1337 O THR A 88 5.792 -7.881 -5.747 1.00 0.27 O ATOM 1338 CB THR A 88 8.393 -9.754 -5.590 1.00 0.32 C ATOM 1339 OG1 THR A 88 8.042 -11.137 -5.466 1.00 0.77 O ATOM 1340 CG2 THR A 88 8.113 -9.045 -4.269 1.00 0.54 C ATOM 0 H THR A 88 8.375 -7.209 -6.384 1.00 0.31 H new ATOM 0 HA THR A 88 7.627 -9.784 -7.602 1.00 0.30 H new ATOM 0 HB THR A 88 9.454 -9.658 -5.820 1.00 0.32 H new ATOM 0 HG1 THR A 88 8.554 -11.540 -4.734 1.00 0.77 H new ATOM 0 HG21 THR A 88 8.690 -9.517 -3.473 1.00 0.54 H new ATOM 0 HG22 THR A 88 8.398 -7.996 -4.351 1.00 0.54 H new ATOM 0 HG23 THR A 88 7.050 -9.115 -4.037 1.00 0.54 H new ATOM 1348 N ALA A 89 5.292 -9.892 -6.585 1.00 0.27 N ATOM 1349 CA ALA A 89 3.894 -9.784 -6.208 1.00 0.28 C ATOM 1350 C ALA A 89 3.663 -10.345 -4.805 1.00 0.29 C ATOM 1351 O ALA A 89 3.798 -11.545 -4.561 1.00 0.48 O ATOM 1352 CB ALA A 89 3.005 -10.467 -7.230 1.00 0.31 C ATOM 0 H ALA A 89 5.541 -10.757 -7.064 1.00 0.27 H new ATOM 0 HA ALA A 89 3.627 -8.727 -6.190 1.00 0.28 H new ATOM 0 HB1 ALA A 89 1.962 -10.373 -6.926 1.00 0.31 H new ATOM 0 HB2 ALA A 89 3.143 -9.997 -8.204 1.00 0.31 H new ATOM 0 HB3 ALA A 89 3.270 -11.522 -7.295 1.00 0.31 H new ATOM 1358 N LEU A 90 3.326 -9.451 -3.891 1.00 0.27 N ATOM 1359 CA LEU A 90 3.044 -9.789 -2.506 1.00 0.30 C ATOM 1360 C LEU A 90 1.528 -9.782 -2.289 1.00 0.29 C ATOM 1361 O LEU A 90 0.786 -9.271 -3.132 1.00 0.32 O ATOM 1362 CB LEU A 90 3.770 -8.782 -1.596 1.00 0.35 C ATOM 1363 CG LEU A 90 3.512 -8.894 -0.090 1.00 0.40 C ATOM 1364 CD1 LEU A 90 4.809 -8.726 0.681 1.00 0.77 C ATOM 1365 CD2 LEU A 90 2.511 -7.840 0.352 1.00 0.72 C ATOM 0 H LEU A 90 3.239 -8.455 -4.093 1.00 0.27 H new ATOM 0 HA LEU A 90 3.407 -10.787 -2.260 1.00 0.30 H new ATOM 0 HB2 LEU A 90 4.842 -8.885 -1.765 1.00 0.35 H new ATOM 0 HB3 LEU A 90 3.492 -7.777 -1.913 1.00 0.35 H new ATOM 0 HG LEU A 90 3.102 -9.882 0.118 1.00 0.40 H new ATOM 0 HD11 LEU A 90 4.610 -8.808 1.750 1.00 0.77 H new ATOM 0 HD12 LEU A 90 5.513 -9.503 0.382 1.00 0.77 H new ATOM 0 HD13 LEU A 90 5.236 -7.747 0.465 1.00 0.77 H new ATOM 0 HD21 LEU A 90 2.337 -7.931 1.424 1.00 0.72 H new ATOM 0 HD22 LEU A 90 2.906 -6.848 0.131 1.00 0.72 H new ATOM 0 HD23 LEU A 90 1.572 -7.984 -0.182 1.00 0.72 H new ATOM 1377 N ASP A 91 1.059 -10.330 -1.178 1.00 0.35 N ATOM 1378 CA ASP A 91 -0.372 -10.539 -1.006 1.00 0.43 C ATOM 1379 C ASP A 91 -0.884 -9.977 0.316 1.00 0.43 C ATOM 1380 O ASP A 91 -0.458 -10.402 1.393 1.00 0.52 O ATOM 1381 CB ASP A 91 -0.686 -12.034 -1.095 1.00 0.63 C ATOM 1382 CG ASP A 91 -2.174 -12.332 -1.062 1.00 1.07 C ATOM 1383 OD1 ASP A 91 -2.816 -12.281 -2.135 1.00 1.67 O ATOM 1384 OD2 ASP A 91 -2.698 -12.658 0.023 1.00 1.81 O ATOM 0 H ASP A 91 1.636 -10.634 -0.394 1.00 0.35 H new ATOM 0 HA ASP A 91 -0.883 -10.001 -1.805 1.00 0.43 H new ATOM 0 HB2 ASP A 91 -0.262 -12.434 -2.016 1.00 0.63 H new ATOM 0 HB3 ASP A 91 -0.199 -12.551 -0.268 1.00 0.63 H new ATOM 1389 N ILE A 92 -1.784 -9.006 0.220 1.00 0.39 N ATOM 1390 CA ILE A 92 -2.502 -8.497 1.380 1.00 0.38 C ATOM 1391 C ILE A 92 -3.962 -8.912 1.272 1.00 0.38 C ATOM 1392 O ILE A 92 -4.619 -8.595 0.283 1.00 0.54 O ATOM 1393 CB ILE A 92 -2.406 -6.957 1.493 1.00 0.43 C ATOM 1394 CG1 ILE A 92 -0.949 -6.521 1.641 1.00 0.52 C ATOM 1395 CG2 ILE A 92 -3.236 -6.439 2.664 1.00 0.52 C ATOM 1396 CD1 ILE A 92 -0.248 -7.116 2.843 1.00 0.65 C ATOM 0 H ILE A 92 -2.035 -8.552 -0.658 1.00 0.39 H new ATOM 0 HA ILE A 92 -2.046 -8.918 2.276 1.00 0.38 H new ATOM 0 HB ILE A 92 -2.809 -6.527 0.576 1.00 0.43 H new ATOM 0 HG12 ILE A 92 -0.403 -6.801 0.740 1.00 0.52 H new ATOM 0 HG13 ILE A 92 -0.911 -5.434 1.712 1.00 0.52 H new ATOM 0 HG21 ILE A 92 -3.150 -5.354 2.719 1.00 0.52 H new ATOM 0 HG22 ILE A 92 -4.281 -6.713 2.519 1.00 0.52 H new ATOM 0 HG23 ILE A 92 -2.871 -6.880 3.592 1.00 0.52 H new ATOM 0 HD11 ILE A 92 0.781 -6.759 2.878 1.00 0.65 H new ATOM 0 HD12 ILE A 92 -0.768 -6.815 3.753 1.00 0.65 H new ATOM 0 HD13 ILE A 92 -0.252 -8.203 2.765 1.00 0.65 H new ATOM 1408 N PRO A 93 -4.471 -9.632 2.291 1.00 0.41 N ATOM 1409 CA PRO A 93 -5.799 -10.263 2.267 1.00 0.55 C ATOM 1410 C PRO A 93 -6.932 -9.361 1.768 1.00 0.61 C ATOM 1411 O PRO A 93 -7.119 -9.212 0.566 1.00 1.07 O ATOM 1412 CB PRO A 93 -6.020 -10.672 3.723 1.00 0.67 C ATOM 1413 CG PRO A 93 -4.649 -10.912 4.244 1.00 0.70 C ATOM 1414 CD PRO A 93 -3.767 -9.906 3.558 1.00 0.52 C ATOM 0 HA PRO A 93 -5.820 -11.090 1.558 1.00 0.55 H new ATOM 0 HB2 PRO A 93 -6.528 -9.888 4.285 1.00 0.67 H new ATOM 0 HB3 PRO A 93 -6.637 -11.568 3.796 1.00 0.67 H new ATOM 0 HG2 PRO A 93 -4.615 -10.788 5.326 1.00 0.70 H new ATOM 0 HG3 PRO A 93 -4.322 -11.929 4.029 1.00 0.70 H new ATOM 0 HD2 PRO A 93 -3.651 -9.002 4.155 1.00 0.52 H new ATOM 0 HD3 PRO A 93 -2.767 -10.303 3.383 1.00 0.52 H new ATOM 1422 N VAL A 94 -7.692 -8.760 2.682 1.00 0.38 N ATOM 1423 CA VAL A 94 -8.920 -8.066 2.305 1.00 0.34 C ATOM 1424 C VAL A 94 -9.397 -7.105 3.396 1.00 0.34 C ATOM 1425 O VAL A 94 -10.158 -7.492 4.267 1.00 0.36 O ATOM 1426 CB VAL A 94 -10.054 -9.082 2.022 1.00 0.36 C ATOM 1427 CG1 VAL A 94 -10.035 -9.566 0.581 1.00 0.42 C ATOM 1428 CG2 VAL A 94 -9.961 -10.271 2.974 1.00 0.46 C ATOM 0 H VAL A 94 -7.481 -8.740 3.680 1.00 0.38 H new ATOM 0 HA VAL A 94 -8.689 -7.493 1.407 1.00 0.34 H new ATOM 0 HB VAL A 94 -10.999 -8.564 2.188 1.00 0.36 H new ATOM 0 HG11 VAL A 94 -10.846 -10.277 0.425 1.00 0.42 H new ATOM 0 HG12 VAL A 94 -10.163 -8.716 -0.090 1.00 0.42 H new ATOM 0 HG13 VAL A 94 -9.082 -10.052 0.373 1.00 0.42 H new ATOM 0 HG21 VAL A 94 -10.766 -10.973 2.759 1.00 0.46 H new ATOM 0 HG22 VAL A 94 -9.000 -10.769 2.842 1.00 0.46 H new ATOM 0 HG23 VAL A 94 -10.050 -9.921 4.003 1.00 0.46 H new ATOM 1438 N VAL A 95 -9.034 -5.833 3.309 1.00 0.35 N ATOM 1439 CA VAL A 95 -9.330 -4.912 4.408 1.00 0.35 C ATOM 1440 C VAL A 95 -10.065 -3.634 3.976 1.00 0.36 C ATOM 1441 O VAL A 95 -9.484 -2.733 3.371 1.00 0.44 O ATOM 1442 CB VAL A 95 -8.037 -4.533 5.163 1.00 0.42 C ATOM 1443 CG1 VAL A 95 -7.019 -3.912 4.217 1.00 0.48 C ATOM 1444 CG2 VAL A 95 -8.347 -3.599 6.322 1.00 0.45 C ATOM 0 H VAL A 95 -8.547 -5.419 2.514 1.00 0.35 H new ATOM 0 HA VAL A 95 -10.009 -5.455 5.065 1.00 0.35 H new ATOM 0 HB VAL A 95 -7.600 -5.444 5.571 1.00 0.42 H new ATOM 0 HG11 VAL A 95 -6.117 -3.654 4.772 1.00 0.48 H new ATOM 0 HG12 VAL A 95 -6.770 -4.625 3.431 1.00 0.48 H new ATOM 0 HG13 VAL A 95 -7.440 -3.012 3.769 1.00 0.48 H new ATOM 0 HG21 VAL A 95 -7.423 -3.344 6.841 1.00 0.45 H new ATOM 0 HG22 VAL A 95 -8.813 -2.690 5.942 1.00 0.45 H new ATOM 0 HG23 VAL A 95 -9.028 -4.093 7.015 1.00 0.45 H new ATOM 1454 N VAL A 96 -11.361 -3.585 4.243 1.00 0.34 N ATOM 1455 CA VAL A 96 -12.091 -2.326 4.249 1.00 0.34 C ATOM 1456 C VAL A 96 -13.291 -2.400 5.192 1.00 0.36 C ATOM 1457 O VAL A 96 -14.337 -2.939 4.838 1.00 0.47 O ATOM 1458 CB VAL A 96 -12.520 -1.874 2.834 1.00 0.45 C ATOM 1459 CG1 VAL A 96 -13.137 -3.013 2.047 1.00 1.02 C ATOM 1460 CG2 VAL A 96 -13.478 -0.692 2.910 1.00 1.07 C ATOM 0 H VAL A 96 -11.930 -4.404 4.459 1.00 0.34 H new ATOM 0 HA VAL A 96 -11.404 -1.565 4.619 1.00 0.34 H new ATOM 0 HB VAL A 96 -11.621 -1.556 2.306 1.00 0.45 H new ATOM 0 HG11 VAL A 96 -13.426 -2.657 1.058 1.00 1.02 H new ATOM 0 HG12 VAL A 96 -12.411 -3.820 1.945 1.00 1.02 H new ATOM 0 HG13 VAL A 96 -14.018 -3.382 2.572 1.00 1.02 H new ATOM 0 HG21 VAL A 96 -13.766 -0.392 1.903 1.00 1.07 H new ATOM 0 HG22 VAL A 96 -14.367 -0.980 3.471 1.00 1.07 H new ATOM 0 HG23 VAL A 96 -12.987 0.142 3.411 1.00 1.07 H new ATOM 1470 N PRO A 97 -13.158 -1.890 6.421 1.00 0.34 N ATOM 1471 CA PRO A 97 -14.268 -1.856 7.366 1.00 0.36 C ATOM 1472 C PRO A 97 -15.522 -1.231 6.758 1.00 0.33 C ATOM 1473 O PRO A 97 -15.457 -0.202 6.078 1.00 0.34 O ATOM 1474 CB PRO A 97 -13.734 -1.012 8.521 1.00 0.41 C ATOM 1475 CG PRO A 97 -12.255 -1.182 8.457 1.00 0.48 C ATOM 1476 CD PRO A 97 -11.921 -1.334 6.998 1.00 0.36 C ATOM 0 HA PRO A 97 -14.577 -2.855 7.674 1.00 0.36 H new ATOM 0 HB2 PRO A 97 -14.018 0.035 8.412 1.00 0.41 H new ATOM 0 HB3 PRO A 97 -14.131 -1.352 9.477 1.00 0.41 H new ATOM 0 HG2 PRO A 97 -11.744 -0.321 8.887 1.00 0.48 H new ATOM 0 HG3 PRO A 97 -11.937 -2.057 9.024 1.00 0.48 H new ATOM 0 HD2 PRO A 97 -11.660 -0.378 6.544 1.00 0.36 H new ATOM 0 HD3 PRO A 97 -11.072 -2.001 6.847 1.00 0.36 H new ATOM 1484 N TYR A 98 -16.659 -1.873 7.010 1.00 0.35 N ATOM 1485 CA TYR A 98 -17.945 -1.467 6.446 1.00 0.37 C ATOM 1486 C TYR A 98 -18.256 -0.004 6.779 1.00 0.36 C ATOM 1487 O TYR A 98 -18.879 0.699 5.989 1.00 0.39 O ATOM 1488 CB TYR A 98 -19.033 -2.438 6.957 1.00 0.47 C ATOM 1489 CG TYR A 98 -20.478 -2.033 6.713 1.00 0.60 C ATOM 1490 CD1 TYR A 98 -20.829 -1.402 5.525 1.00 1.04 C ATOM 1491 CD2 TYR A 98 -21.479 -2.274 7.644 1.00 0.90 C ATOM 1492 CE1 TYR A 98 -22.132 -1.030 5.269 1.00 1.23 C ATOM 1493 CE2 TYR A 98 -22.788 -1.902 7.395 1.00 1.06 C ATOM 1494 CZ TYR A 98 -23.134 -1.305 6.323 1.00 1.08 C ATOM 1495 OH TYR A 98 -24.409 -0.910 5.948 1.00 1.31 O ATOM 0 H TYR A 98 -16.716 -2.693 7.614 1.00 0.35 H new ATOM 0 HA TYR A 98 -17.913 -1.524 5.358 1.00 0.37 H new ATOM 0 HB2 TYR A 98 -18.868 -3.409 6.491 1.00 0.47 H new ATOM 0 HB3 TYR A 98 -18.893 -2.572 8.030 1.00 0.47 H new ATOM 0 HD1 TYR A 98 -20.066 -1.199 4.788 1.00 1.04 H new ATOM 0 HD2 TYR A 98 -21.232 -2.759 8.577 1.00 0.90 H new ATOM 0 HE1 TYR A 98 -22.410 -0.558 4.338 1.00 1.23 H new ATOM 0 HE2 TYR A 98 -23.543 -2.125 8.134 1.00 1.06 H new ATOM 0 HH TYR A 98 -25.039 -1.110 6.671 1.00 1.31 H new ATOM 1505 N SER A 99 -17.774 0.451 7.926 1.00 0.37 N ATOM 1506 CA SER A 99 -17.961 1.828 8.361 1.00 0.41 C ATOM 1507 C SER A 99 -17.434 2.840 7.338 1.00 0.38 C ATOM 1508 O SER A 99 -17.984 3.931 7.188 1.00 0.39 O ATOM 1509 CB SER A 99 -17.247 2.033 9.693 1.00 0.50 C ATOM 1510 OG SER A 99 -17.747 1.142 10.678 1.00 1.20 O ATOM 0 H SER A 99 -17.243 -0.123 8.581 1.00 0.37 H new ATOM 0 HA SER A 99 -19.032 2.000 8.467 1.00 0.41 H new ATOM 0 HB2 SER A 99 -16.176 1.875 9.564 1.00 0.50 H new ATOM 0 HB3 SER A 99 -17.380 3.062 10.027 1.00 0.50 H new ATOM 0 HG SER A 99 -17.274 1.290 11.523 1.00 1.20 H new ATOM 1516 N ILE A 100 -16.367 2.495 6.639 1.00 0.36 N ATOM 1517 CA ILE A 100 -15.736 3.442 5.735 1.00 0.37 C ATOM 1518 C ILE A 100 -16.498 3.564 4.418 1.00 0.34 C ATOM 1519 O ILE A 100 -16.834 4.669 3.986 1.00 0.36 O ATOM 1520 CB ILE A 100 -14.281 3.070 5.450 1.00 0.41 C ATOM 1521 CG1 ILE A 100 -13.593 2.579 6.731 1.00 0.45 C ATOM 1522 CG2 ILE A 100 -13.566 4.278 4.884 1.00 0.48 C ATOM 1523 CD1 ILE A 100 -13.669 3.557 7.888 1.00 0.51 C ATOM 0 H ILE A 100 -15.923 1.578 6.678 1.00 0.36 H new ATOM 0 HA ILE A 100 -15.758 4.407 6.241 1.00 0.37 H new ATOM 0 HB ILE A 100 -14.246 2.259 4.723 1.00 0.41 H new ATOM 0 HG12 ILE A 100 -14.047 1.636 7.036 1.00 0.45 H new ATOM 0 HG13 ILE A 100 -12.545 2.373 6.512 1.00 0.45 H new ATOM 0 HG21 ILE A 100 -12.527 4.022 4.677 1.00 0.48 H new ATOM 0 HG22 ILE A 100 -14.053 4.590 3.960 1.00 0.48 H new ATOM 0 HG23 ILE A 100 -13.602 5.094 5.606 1.00 0.48 H new ATOM 0 HD11 ILE A 100 -13.160 3.136 8.755 1.00 0.51 H new ATOM 0 HD12 ILE A 100 -13.189 4.494 7.605 1.00 0.51 H new ATOM 0 HD13 ILE A 100 -14.713 3.746 8.137 1.00 0.51 H new ATOM 1535 N LEU A 101 -16.731 2.421 3.769 1.00 0.33 N ATOM 1536 CA LEU A 101 -17.630 2.356 2.606 1.00 0.34 C ATOM 1537 C LEU A 101 -18.965 3.016 2.937 1.00 0.34 C ATOM 1538 O LEU A 101 -19.637 3.567 2.076 1.00 0.36 O ATOM 1539 CB LEU A 101 -17.883 0.916 2.147 1.00 0.35 C ATOM 1540 CG LEU A 101 -16.715 0.205 1.449 1.00 0.41 C ATOM 1541 CD1 LEU A 101 -17.214 -1.039 0.747 1.00 0.89 C ATOM 1542 CD2 LEU A 101 -16.027 1.110 0.448 1.00 1.00 C ATOM 0 H LEU A 101 -16.312 1.527 4.026 1.00 0.33 H new ATOM 0 HA LEU A 101 -17.137 2.888 1.792 1.00 0.34 H new ATOM 0 HB2 LEU A 101 -18.171 0.326 3.017 1.00 0.35 H new ATOM 0 HB3 LEU A 101 -18.736 0.919 1.468 1.00 0.35 H new ATOM 0 HG LEU A 101 -15.988 -0.067 2.214 1.00 0.41 H new ATOM 0 HD11 LEU A 101 -16.380 -1.538 0.254 1.00 0.89 H new ATOM 0 HD12 LEU A 101 -17.661 -1.714 1.477 1.00 0.89 H new ATOM 0 HD13 LEU A 101 -17.962 -0.762 0.004 1.00 0.89 H new ATOM 0 HD21 LEU A 101 -15.206 0.571 -0.025 1.00 1.00 H new ATOM 0 HD22 LEU A 101 -16.743 1.422 -0.313 1.00 1.00 H new ATOM 0 HD23 LEU A 101 -15.636 1.989 0.961 1.00 1.00 H new ATOM 1554 N PHE A 102 -19.287 2.985 4.215 1.00 0.34 N ATOM 1555 CA PHE A 102 -20.527 3.544 4.723 1.00 0.36 C ATOM 1556 C PHE A 102 -20.520 5.054 4.474 1.00 0.35 C ATOM 1557 O PHE A 102 -21.507 5.638 4.038 1.00 0.36 O ATOM 1558 CB PHE A 102 -20.644 3.219 6.219 1.00 0.42 C ATOM 1559 CG PHE A 102 -21.991 3.452 6.846 1.00 0.57 C ATOM 1560 CD1 PHE A 102 -22.315 4.689 7.380 1.00 0.80 C ATOM 1561 CD2 PHE A 102 -22.942 2.445 6.872 1.00 0.74 C ATOM 1562 CE1 PHE A 102 -23.562 4.916 7.929 1.00 0.96 C ATOM 1563 CE2 PHE A 102 -24.189 2.665 7.425 1.00 0.90 C ATOM 1564 CZ PHE A 102 -24.460 3.860 8.056 1.00 0.94 C ATOM 0 H PHE A 102 -18.695 2.570 4.934 1.00 0.34 H new ATOM 0 HA PHE A 102 -21.390 3.114 4.214 1.00 0.36 H new ATOM 0 HB2 PHE A 102 -20.375 2.173 6.364 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -19.908 3.815 6.758 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -21.584 5.484 7.367 1.00 0.80 H new ATOM 0 HD2 PHE A 102 -22.706 1.477 6.455 1.00 0.74 H new ATOM 0 HE1 PHE A 102 -23.839 5.907 8.258 1.00 0.96 H new ATOM 0 HE2 PHE A 102 -24.950 1.902 7.363 1.00 0.90 H new ATOM 0 HZ PHE A 102 -25.359 3.976 8.643 1.00 0.94 H new ATOM 1574 N ASN A 103 -19.371 5.672 4.717 1.00 0.36 N ATOM 1575 CA ASN A 103 -19.211 7.104 4.496 1.00 0.38 C ATOM 1576 C ASN A 103 -19.117 7.446 3.009 1.00 0.36 C ATOM 1577 O ASN A 103 -19.918 8.229 2.503 1.00 0.38 O ATOM 1578 CB ASN A 103 -17.947 7.601 5.197 1.00 0.43 C ATOM 1579 CG ASN A 103 -18.103 7.741 6.700 1.00 0.49 C ATOM 1580 OD1 ASN A 103 -18.465 8.805 7.198 1.00 0.82 O ATOM 1581 ND2 ASN A 103 -17.824 6.681 7.435 1.00 0.49 N ATOM 0 H ASN A 103 -18.535 5.204 5.067 1.00 0.36 H new ATOM 0 HA ASN A 103 -20.093 7.595 4.907 1.00 0.38 H new ATOM 0 HB2 ASN A 103 -17.130 6.911 4.987 1.00 0.43 H new ATOM 0 HB3 ASN A 103 -17.664 8.567 4.778 1.00 0.43 H new ATOM 0 HD21 ASN A 103 -17.906 6.729 8.451 1.00 0.49 H new ATOM 0 HD22 ASN A 103 -17.526 5.814 6.987 1.00 0.49 H new ATOM 1588 N LEU A 104 -18.139 6.866 2.310 1.00 0.36 N ATOM 1589 CA LEU A 104 -17.941 7.145 0.884 1.00 0.39 C ATOM 1590 C LEU A 104 -19.173 6.823 0.027 1.00 0.37 C ATOM 1591 O LEU A 104 -19.613 7.666 -0.739 1.00 0.40 O ATOM 1592 CB LEU A 104 -16.715 6.397 0.359 1.00 0.45 C ATOM 1593 CG LEU A 104 -16.811 4.876 0.393 1.00 0.51 C ATOM 1594 CD1 LEU A 104 -17.236 4.330 -0.960 1.00 0.55 C ATOM 1595 CD2 LEU A 104 -15.492 4.283 0.817 1.00 0.65 C ATOM 0 H LEU A 104 -17.473 6.202 2.706 1.00 0.36 H new ATOM 0 HA LEU A 104 -17.777 8.219 0.799 1.00 0.39 H new ATOM 0 HB2 LEU A 104 -16.533 6.709 -0.669 1.00 0.45 H new ATOM 0 HB3 LEU A 104 -15.847 6.702 0.943 1.00 0.45 H new ATOM 0 HG LEU A 104 -17.571 4.593 1.121 1.00 0.51 H new ATOM 0 HD11 LEU A 104 -17.297 3.243 -0.911 1.00 0.55 H new ATOM 0 HD12 LEU A 104 -18.211 4.737 -1.226 1.00 0.55 H new ATOM 0 HD13 LEU A 104 -16.504 4.618 -1.715 1.00 0.55 H new ATOM 0 HD21 LEU A 104 -15.572 3.196 0.838 1.00 0.65 H new ATOM 0 HD22 LEU A 104 -14.717 4.576 0.109 1.00 0.65 H new ATOM 0 HD23 LEU A 104 -15.232 4.647 1.811 1.00 0.65 H new ATOM 1607 N ALA A 105 -19.717 5.614 0.146 1.00 0.35 N ATOM 1608 CA ALA A 105 -20.881 5.218 -0.656 1.00 0.38 C ATOM 1609 C ALA A 105 -22.074 6.100 -0.333 1.00 0.37 C ATOM 1610 O ALA A 105 -22.960 6.300 -1.151 1.00 0.39 O ATOM 1611 CB ALA A 105 -21.228 3.751 -0.436 1.00 0.43 C ATOM 0 H ALA A 105 -19.377 4.894 0.783 1.00 0.35 H new ATOM 0 HA ALA A 105 -20.624 5.349 -1.707 1.00 0.38 H new ATOM 0 HB1 ALA A 105 -22.094 3.487 -1.043 1.00 0.43 H new ATOM 0 HB2 ALA A 105 -20.380 3.129 -0.724 1.00 0.43 H new ATOM 0 HB3 ALA A 105 -21.459 3.586 0.616 1.00 0.43 H new ATOM 1617 N ARG A 106 -22.079 6.624 0.868 1.00 0.36 N ATOM 1618 CA ARG A 106 -23.109 7.562 1.262 1.00 0.40 C ATOM 1619 C ARG A 106 -22.888 8.921 0.614 1.00 0.38 C ATOM 1620 O ARG A 106 -23.779 9.450 -0.036 1.00 0.40 O ATOM 1621 CB ARG A 106 -23.160 7.693 2.766 1.00 0.48 C ATOM 1622 CG ARG A 106 -23.996 8.857 3.263 1.00 0.53 C ATOM 1623 CD ARG A 106 -24.042 8.857 4.773 1.00 0.73 C ATOM 1624 NE ARG A 106 -22.912 8.117 5.323 1.00 0.91 N ATOM 1625 CZ ARG A 106 -22.347 8.371 6.497 1.00 1.38 C ATOM 1626 NH1 ARG A 106 -22.789 9.364 7.261 1.00 1.52 N ATOM 1627 NH2 ARG A 106 -21.328 7.633 6.902 1.00 1.81 N ATOM 0 H ARG A 106 -21.387 6.420 1.589 1.00 0.36 H new ATOM 0 HA ARG A 106 -24.067 7.175 0.915 1.00 0.40 H new ATOM 0 HB2 ARG A 106 -23.558 6.769 3.186 1.00 0.48 H new ATOM 0 HB3 ARG A 106 -22.144 7.803 3.144 1.00 0.48 H new ATOM 0 HG2 ARG A 106 -23.575 9.796 2.904 1.00 0.53 H new ATOM 0 HG3 ARG A 106 -25.007 8.787 2.861 1.00 0.53 H new ATOM 0 HD2 ARG A 106 -24.026 9.882 5.142 1.00 0.73 H new ATOM 0 HD3 ARG A 106 -24.976 8.410 5.113 1.00 0.73 H new ATOM 0 HE ARG A 106 -22.530 7.352 4.767 1.00 0.91 H new ATOM 0 HH11 ARG A 106 -23.570 9.940 6.947 1.00 1.52 H new ATOM 0 HH12 ARG A 106 -22.347 9.550 8.161 1.00 1.52 H new ATOM 0 HH21 ARG A 106 -20.982 6.875 6.314 1.00 1.81 H new ATOM 0 HH22 ARG A 106 -20.888 7.821 7.803 1.00 1.81 H new ATOM 1641 N ASP A 107 -21.695 9.466 0.764 1.00 0.37 N ATOM 1642 CA ASP A 107 -21.419 10.823 0.304 1.00 0.41 C ATOM 1643 C ASP A 107 -21.148 10.852 -1.201 1.00 0.38 C ATOM 1644 O ASP A 107 -21.782 11.587 -1.962 1.00 0.41 O ATOM 1645 CB ASP A 107 -20.205 11.373 1.062 1.00 0.46 C ATOM 1646 CG ASP A 107 -19.846 12.795 0.670 1.00 0.57 C ATOM 1647 OD1 ASP A 107 -19.323 12.997 -0.447 1.00 0.68 O ATOM 1648 OD2 ASP A 107 -20.046 13.710 1.495 1.00 0.80 O ATOM 0 H ASP A 107 -20.901 8.995 1.199 1.00 0.37 H new ATOM 0 HA ASP A 107 -22.294 11.443 0.500 1.00 0.41 H new ATOM 0 HB2 ASP A 107 -20.408 11.339 2.132 1.00 0.46 H new ATOM 0 HB3 ASP A 107 -19.347 10.726 0.879 1.00 0.46 H new ATOM 1653 N VAL A 108 -20.231 10.021 -1.642 1.00 0.34 N ATOM 1654 CA VAL A 108 -19.864 9.998 -3.038 1.00 0.33 C ATOM 1655 C VAL A 108 -20.695 8.966 -3.794 1.00 0.32 C ATOM 1656 O VAL A 108 -20.740 8.986 -5.007 1.00 0.37 O ATOM 1657 CB VAL A 108 -18.364 9.708 -3.229 1.00 0.32 C ATOM 1658 CG1 VAL A 108 -17.888 10.244 -4.570 1.00 0.77 C ATOM 1659 CG2 VAL A 108 -17.546 10.298 -2.091 1.00 0.88 C ATOM 0 H VAL A 108 -19.728 9.355 -1.056 1.00 0.34 H new ATOM 0 HA VAL A 108 -20.069 10.989 -3.443 1.00 0.33 H new ATOM 0 HB VAL A 108 -18.221 8.628 -3.218 1.00 0.32 H new ATOM 0 HG11 VAL A 108 -16.826 10.031 -4.690 1.00 0.77 H new ATOM 0 HG12 VAL A 108 -18.447 9.764 -5.373 1.00 0.77 H new ATOM 0 HG13 VAL A 108 -18.049 11.321 -4.609 1.00 0.77 H new ATOM 0 HG21 VAL A 108 -16.490 10.079 -2.250 1.00 0.88 H new ATOM 0 HG22 VAL A 108 -17.692 11.378 -2.060 1.00 0.88 H new ATOM 0 HG23 VAL A 108 -17.869 9.861 -1.146 1.00 0.88 H new ATOM 1669 N GLY A 109 -21.301 8.028 -3.069 1.00 0.29 N ATOM 1670 CA GLY A 109 -22.324 7.182 -3.670 1.00 0.30 C ATOM 1671 C GLY A 109 -23.610 7.947 -3.864 1.00 0.33 C ATOM 1672 O GLY A 109 -24.494 7.541 -4.623 1.00 0.38 O ATOM 0 H GLY A 109 -21.106 7.838 -2.086 1.00 0.29 H new ATOM 0 HA2 GLY A 109 -21.972 6.805 -4.630 1.00 0.30 H new ATOM 0 HA3 GLY A 109 -22.504 6.315 -3.034 1.00 0.30 H new ATOM 1676 N VAL A 110 -23.702 9.039 -3.126 1.00 0.37 N ATOM 1677 CA VAL A 110 -24.692 10.060 -3.404 1.00 0.46 C ATOM 1678 C VAL A 110 -24.505 10.454 -4.863 1.00 0.47 C ATOM 1679 O VAL A 110 -25.461 10.521 -5.639 1.00 0.54 O ATOM 1680 CB VAL A 110 -24.549 11.281 -2.465 1.00 0.56 C ATOM 1681 CG1 VAL A 110 -24.537 12.595 -3.223 1.00 1.09 C ATOM 1682 CG2 VAL A 110 -25.662 11.287 -1.433 1.00 0.78 C ATOM 0 H VAL A 110 -23.100 9.240 -2.327 1.00 0.37 H new ATOM 0 HA VAL A 110 -25.696 9.676 -3.226 1.00 0.46 H new ATOM 0 HB VAL A 110 -23.586 11.186 -1.963 1.00 0.56 H new ATOM 0 HG11 VAL A 110 -24.435 13.420 -2.519 1.00 1.09 H new ATOM 0 HG12 VAL A 110 -23.698 12.606 -3.919 1.00 1.09 H new ATOM 0 HG13 VAL A 110 -25.469 12.704 -3.777 1.00 1.09 H new ATOM 0 HG21 VAL A 110 -25.548 12.152 -0.780 1.00 0.78 H new ATOM 0 HG22 VAL A 110 -26.626 11.339 -1.938 1.00 0.78 H new ATOM 0 HG23 VAL A 110 -25.612 10.375 -0.839 1.00 0.78 H new ATOM 1692 N ASP A 111 -23.254 10.734 -5.213 1.00 0.45 N ATOM 1693 CA ASP A 111 -22.843 10.757 -6.614 1.00 0.52 C ATOM 1694 C ASP A 111 -22.923 9.341 -7.206 1.00 0.59 C ATOM 1695 O ASP A 111 -24.012 8.849 -7.507 1.00 1.05 O ATOM 1696 CB ASP A 111 -21.422 11.316 -6.758 1.00 0.60 C ATOM 1697 CG ASP A 111 -21.297 12.756 -6.298 1.00 1.30 C ATOM 1698 OD1 ASP A 111 -21.417 13.006 -5.079 1.00 1.87 O ATOM 1699 OD2 ASP A 111 -21.079 13.647 -7.146 1.00 1.86 O ATOM 0 H ASP A 111 -22.509 10.947 -4.550 1.00 0.45 H new ATOM 0 HA ASP A 111 -23.520 11.411 -7.163 1.00 0.52 H new ATOM 0 HB2 ASP A 111 -20.735 10.696 -6.182 1.00 0.60 H new ATOM 0 HB3 ASP A 111 -21.115 11.247 -7.802 1.00 0.60 H new ATOM 1704 N TRP A 112 -21.765 8.691 -7.348 1.00 0.43 N ATOM 1705 CA TRP A 112 -21.685 7.296 -7.809 1.00 0.45 C ATOM 1706 C TRP A 112 -20.232 6.796 -7.878 1.00 0.42 C ATOM 1707 O TRP A 112 -19.919 5.714 -7.392 1.00 0.43 O ATOM 1708 CB TRP A 112 -22.382 7.111 -9.175 1.00 0.57 C ATOM 1709 CG TRP A 112 -21.803 7.909 -10.310 1.00 0.64 C ATOM 1710 CD1 TRP A 112 -21.474 9.236 -10.315 1.00 0.72 C ATOM 1711 CD2 TRP A 112 -21.518 7.424 -11.624 1.00 0.78 C ATOM 1712 NE1 TRP A 112 -20.981 9.595 -11.545 1.00 0.83 N ATOM 1713 CE2 TRP A 112 -21.003 8.502 -12.369 1.00 0.86 C ATOM 1714 CE3 TRP A 112 -21.645 6.179 -12.240 1.00 0.96 C ATOM 1715 CZ2 TRP A 112 -20.613 8.368 -13.698 1.00 1.04 C ATOM 1716 CZ3 TRP A 112 -21.260 6.047 -13.560 1.00 1.16 C ATOM 1717 CH2 TRP A 112 -20.748 7.136 -14.277 1.00 1.17 C ATOM 0 H TRP A 112 -20.858 9.112 -7.148 1.00 0.43 H new ATOM 0 HA TRP A 112 -22.212 6.692 -7.070 1.00 0.45 H new ATOM 0 HB2 TRP A 112 -22.347 6.055 -9.441 1.00 0.57 H new ATOM 0 HB3 TRP A 112 -23.433 7.377 -9.066 1.00 0.57 H new ATOM 0 HD1 TRP A 112 -21.586 9.904 -9.474 1.00 0.72 H new ATOM 0 HE1 TRP A 112 -20.652 10.525 -11.803 1.00 0.83 H new ATOM 0 HE3 TRP A 112 -22.037 5.333 -11.695 1.00 0.96 H new ATOM 0 HZ2 TRP A 112 -20.218 9.206 -14.252 1.00 1.04 H new ATOM 0 HZ3 TRP A 112 -21.355 5.088 -14.047 1.00 1.16 H new ATOM 0 HH2 TRP A 112 -20.454 7.000 -15.307 1.00 1.17 H new ATOM 1728 N ASP A 113 -19.369 7.582 -8.502 1.00 0.42 N ATOM 1729 CA ASP A 113 -17.949 7.226 -8.643 1.00 0.42 C ATOM 1730 C ASP A 113 -17.131 7.864 -7.514 1.00 0.40 C ATOM 1731 O ASP A 113 -17.154 9.085 -7.349 1.00 0.50 O ATOM 1732 CB ASP A 113 -17.443 7.716 -10.005 1.00 0.51 C ATOM 1733 CG ASP A 113 -16.270 6.913 -10.535 1.00 1.26 C ATOM 1734 OD1 ASP A 113 -16.494 5.857 -11.161 1.00 2.15 O ATOM 1735 OD2 ASP A 113 -15.112 7.319 -10.287 1.00 1.61 O ATOM 0 H ASP A 113 -19.620 8.476 -8.924 1.00 0.42 H new ATOM 0 HA ASP A 113 -17.836 6.144 -8.581 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -18.260 7.671 -10.725 1.00 0.51 H new ATOM 0 HB3 ASP A 113 -17.149 8.762 -9.920 1.00 0.51 H new ATOM 1740 N ILE A 114 -16.402 7.044 -6.743 1.00 0.32 N ATOM 1741 CA ILE A 114 -15.695 7.533 -5.547 1.00 0.32 C ATOM 1742 C ILE A 114 -14.180 7.456 -5.747 1.00 0.32 C ATOM 1743 O ILE A 114 -13.689 6.677 -6.564 1.00 0.33 O ATOM 1744 CB ILE A 114 -16.074 6.744 -4.241 1.00 0.31 C ATOM 1745 CG1 ILE A 114 -17.584 6.589 -4.108 1.00 0.39 C ATOM 1746 CG2 ILE A 114 -15.518 7.431 -2.999 1.00 0.33 C ATOM 1747 CD1 ILE A 114 -18.123 5.403 -4.868 1.00 0.38 C ATOM 0 H ILE A 114 -16.286 6.047 -6.923 1.00 0.32 H new ATOM 0 HA ILE A 114 -16.010 8.568 -5.416 1.00 0.32 H new ATOM 0 HB ILE A 114 -15.626 5.754 -4.324 1.00 0.31 H new ATOM 0 HG12 ILE A 114 -17.842 6.486 -3.054 1.00 0.39 H new ATOM 0 HG13 ILE A 114 -18.070 7.496 -4.468 1.00 0.39 H new ATOM 0 HG21 ILE A 114 -15.797 6.861 -2.113 1.00 0.33 H new ATOM 0 HG22 ILE A 114 -14.432 7.485 -3.069 1.00 0.33 H new ATOM 0 HG23 ILE A 114 -15.927 8.439 -2.927 1.00 0.33 H new ATOM 0 HD11 ILE A 114 -19.203 5.346 -4.735 1.00 0.38 H new ATOM 0 HD12 ILE A 114 -17.894 5.515 -5.928 1.00 0.38 H new ATOM 0 HD13 ILE A 114 -17.662 4.490 -4.492 1.00 0.38 H new ATOM 1759 N ASP A 115 -13.457 8.271 -4.988 1.00 0.35 N ATOM 1760 CA ASP A 115 -12.000 8.261 -4.992 1.00 0.38 C ATOM 1761 C ASP A 115 -11.501 7.257 -3.968 1.00 0.34 C ATOM 1762 O ASP A 115 -12.204 6.967 -2.999 1.00 0.31 O ATOM 1763 CB ASP A 115 -11.437 9.639 -4.630 1.00 0.46 C ATOM 1764 CG ASP A 115 -11.691 10.709 -5.673 1.00 1.27 C ATOM 1765 OD1 ASP A 115 -12.841 11.184 -5.780 1.00 2.11 O ATOM 1766 OD2 ASP A 115 -10.729 11.121 -6.358 1.00 1.36 O ATOM 0 H ASP A 115 -13.865 8.957 -4.353 1.00 0.35 H new ATOM 0 HA ASP A 115 -11.667 7.992 -5.994 1.00 0.38 H new ATOM 0 HB2 ASP A 115 -11.873 9.960 -3.684 1.00 0.46 H new ATOM 0 HB3 ASP A 115 -10.362 9.550 -4.472 1.00 0.46 H new ATOM 1771 N TYR A 116 -10.314 6.703 -4.187 1.00 0.37 N ATOM 1772 CA TYR A 116 -9.676 5.833 -3.202 1.00 0.37 C ATOM 1773 C TYR A 116 -8.168 6.045 -3.250 1.00 0.40 C ATOM 1774 O TYR A 116 -7.647 6.540 -4.244 1.00 0.62 O ATOM 1775 CB TYR A 116 -9.992 4.352 -3.455 1.00 0.38 C ATOM 1776 CG TYR A 116 -11.464 4.023 -3.423 1.00 0.37 C ATOM 1777 CD1 TYR A 116 -12.269 4.239 -4.532 1.00 0.37 C ATOM 1778 CD2 TYR A 116 -12.046 3.487 -2.285 1.00 0.40 C ATOM 1779 CE1 TYR A 116 -13.614 3.933 -4.503 1.00 0.39 C ATOM 1780 CE2 TYR A 116 -13.385 3.176 -2.248 1.00 0.42 C ATOM 1781 CZ TYR A 116 -14.175 3.437 -3.371 1.00 0.41 C ATOM 1782 OH TYR A 116 -15.508 3.094 -3.314 1.00 0.45 O ATOM 0 H TYR A 116 -9.772 6.840 -5.040 1.00 0.37 H new ATOM 0 HA TYR A 116 -10.068 6.093 -2.219 1.00 0.37 H new ATOM 0 HB2 TYR A 116 -9.588 4.066 -4.426 1.00 0.38 H new ATOM 0 HB3 TYR A 116 -9.479 3.749 -2.706 1.00 0.38 H new ATOM 0 HD1 TYR A 116 -11.837 4.653 -5.431 1.00 0.37 H new ATOM 0 HD2 TYR A 116 -11.437 3.310 -1.411 1.00 0.40 H new ATOM 0 HE1 TYR A 116 -14.221 4.088 -5.382 1.00 0.39 H new ATOM 0 HE2 TYR A 116 -13.820 2.736 -1.363 1.00 0.42 H new ATOM 0 HH TYR A 116 -15.702 2.680 -2.447 1.00 0.45 H new ATOM 1792 N GLU A 117 -7.474 5.667 -2.186 1.00 0.27 N ATOM 1793 CA GLU A 117 -6.031 5.824 -2.099 1.00 0.28 C ATOM 1794 C GLU A 117 -5.449 4.795 -1.144 1.00 0.28 C ATOM 1795 O GLU A 117 -5.998 4.549 -0.077 1.00 0.31 O ATOM 1796 CB GLU A 117 -5.656 7.232 -1.613 1.00 0.31 C ATOM 1797 CG GLU A 117 -4.170 7.404 -1.325 1.00 0.39 C ATOM 1798 CD GLU A 117 -3.843 8.733 -0.670 1.00 0.51 C ATOM 1799 OE1 GLU A 117 -4.091 8.876 0.543 1.00 0.80 O ATOM 1800 OE2 GLU A 117 -3.329 9.635 -1.367 1.00 0.66 O ATOM 0 H GLU A 117 -7.896 5.243 -1.360 1.00 0.27 H new ATOM 0 HA GLU A 117 -5.619 5.676 -3.097 1.00 0.28 H new ATOM 0 HB2 GLU A 117 -5.958 7.959 -2.367 1.00 0.31 H new ATOM 0 HB3 GLU A 117 -6.221 7.457 -0.708 1.00 0.31 H new ATOM 0 HG2 GLU A 117 -3.835 6.594 -0.677 1.00 0.39 H new ATOM 0 HG3 GLU A 117 -3.612 7.318 -2.258 1.00 0.39 H new ATOM 1807 N LEU A 118 -4.356 4.186 -1.541 1.00 0.29 N ATOM 1808 CA LEU A 118 -3.614 3.306 -0.659 1.00 0.28 C ATOM 1809 C LEU A 118 -2.317 3.987 -0.257 1.00 0.28 C ATOM 1810 O LEU A 118 -1.603 4.506 -1.101 1.00 0.32 O ATOM 1811 CB LEU A 118 -3.380 1.947 -1.355 1.00 0.35 C ATOM 1812 CG LEU A 118 -2.314 0.995 -0.768 1.00 0.40 C ATOM 1813 CD1 LEU A 118 -0.918 1.382 -1.229 1.00 1.24 C ATOM 1814 CD2 LEU A 118 -2.380 0.956 0.751 1.00 1.25 C ATOM 0 H LEU A 118 -3.956 4.283 -2.474 1.00 0.29 H new ATOM 0 HA LEU A 118 -4.180 3.105 0.251 1.00 0.28 H new ATOM 0 HB2 LEU A 118 -4.330 1.413 -1.369 1.00 0.35 H new ATOM 0 HB3 LEU A 118 -3.111 2.147 -2.392 1.00 0.35 H new ATOM 0 HG LEU A 118 -2.533 -0.005 -1.142 1.00 0.40 H new ATOM 0 HD11 LEU A 118 -0.189 0.694 -0.800 1.00 1.24 H new ATOM 0 HD12 LEU A 118 -0.867 1.332 -2.317 1.00 1.24 H new ATOM 0 HD13 LEU A 118 -0.695 2.397 -0.901 1.00 1.24 H new ATOM 0 HD21 LEU A 118 -1.617 0.277 1.131 1.00 1.25 H new ATOM 0 HD22 LEU A 118 -2.206 1.956 1.149 1.00 1.25 H new ATOM 0 HD23 LEU A 118 -3.364 0.607 1.064 1.00 1.25 H new ATOM 1826 N GLN A 119 -2.047 4.009 1.034 1.00 0.26 N ATOM 1827 CA GLN A 119 -0.807 4.555 1.555 1.00 0.27 C ATOM 1828 C GLN A 119 -0.052 3.465 2.283 1.00 0.26 C ATOM 1829 O GLN A 119 -0.362 3.143 3.421 1.00 0.27 O ATOM 1830 CB GLN A 119 -1.096 5.685 2.533 1.00 0.30 C ATOM 1831 CG GLN A 119 0.139 6.458 2.964 1.00 0.37 C ATOM 1832 CD GLN A 119 0.514 7.562 1.994 1.00 0.46 C ATOM 1833 OE1 GLN A 119 0.202 7.377 0.723 1.00 0.63 O flip ATOM 1834 NE2 GLN A 119 1.078 8.579 2.390 1.00 0.51 N flip ATOM 0 H GLN A 119 -2.679 3.650 1.750 1.00 0.26 H new ATOM 0 HA GLN A 119 -0.215 4.940 0.724 1.00 0.27 H new ATOM 0 HB2 GLN A 119 -1.804 6.376 2.075 1.00 0.30 H new ATOM 0 HB3 GLN A 119 -1.581 5.272 3.417 1.00 0.30 H new ATOM 0 HG2 GLN A 119 -0.035 6.891 3.949 1.00 0.37 H new ATOM 0 HG3 GLN A 119 0.977 5.768 3.063 1.00 0.37 H new ATOM 0 HE21 GLN A 119 1.302 8.685 3.379 1.00 0.51 H new ATOM 0 HE22 GLN A 119 1.322 9.317 1.730 1.00 0.51 H new ATOM 1843 N ILE A 120 0.917 2.890 1.628 1.00 0.26 N ATOM 1844 CA ILE A 120 1.638 1.786 2.212 1.00 0.26 C ATOM 1845 C ILE A 120 3.083 2.196 2.521 1.00 0.23 C ATOM 1846 O ILE A 120 3.799 2.713 1.664 1.00 0.24 O ATOM 1847 CB ILE A 120 1.525 0.545 1.283 1.00 0.31 C ATOM 1848 CG1 ILE A 120 1.791 -0.775 2.034 1.00 0.45 C ATOM 1849 CG2 ILE A 120 2.416 0.680 0.062 1.00 0.36 C ATOM 1850 CD1 ILE A 120 3.220 -0.984 2.481 1.00 0.81 C ATOM 0 H ILE A 120 1.227 3.162 0.695 1.00 0.26 H new ATOM 0 HA ILE A 120 1.197 1.506 3.169 1.00 0.26 H new ATOM 0 HB ILE A 120 0.493 0.506 0.935 1.00 0.31 H new ATOM 0 HG12 ILE A 120 1.144 -0.813 2.910 1.00 0.45 H new ATOM 0 HG13 ILE A 120 1.504 -1.606 1.389 1.00 0.45 H new ATOM 0 HG21 ILE A 120 2.311 -0.206 -0.565 1.00 0.36 H new ATOM 0 HG22 ILE A 120 2.123 1.563 -0.506 1.00 0.36 H new ATOM 0 HG23 ILE A 120 3.454 0.780 0.378 1.00 0.36 H new ATOM 0 HD11 ILE A 120 3.303 -1.940 2.999 1.00 0.81 H new ATOM 0 HD12 ILE A 120 3.877 -0.984 1.611 1.00 0.81 H new ATOM 0 HD13 ILE A 120 3.512 -0.179 3.156 1.00 0.81 H new ATOM 1862 N GLY A 121 3.465 2.044 3.784 1.00 0.23 N ATOM 1863 CA GLY A 121 4.810 2.352 4.213 1.00 0.23 C ATOM 1864 C GLY A 121 5.731 1.173 4.036 1.00 0.22 C ATOM 1865 O GLY A 121 5.483 0.096 4.574 1.00 0.26 O ATOM 0 H GLY A 121 2.853 1.707 4.527 1.00 0.23 H new ATOM 0 HA2 GLY A 121 5.189 3.200 3.643 1.00 0.23 H new ATOM 0 HA3 GLY A 121 4.799 2.652 5.261 1.00 0.23 H new ATOM 1869 N LEU A 122 6.795 1.379 3.291 1.00 0.23 N ATOM 1870 CA LEU A 122 7.695 0.307 2.923 1.00 0.25 C ATOM 1871 C LEU A 122 8.885 0.262 3.854 1.00 0.23 C ATOM 1872 O LEU A 122 9.637 1.222 3.956 1.00 0.30 O ATOM 1873 CB LEU A 122 8.177 0.503 1.485 1.00 0.30 C ATOM 1874 CG LEU A 122 7.241 -0.002 0.386 1.00 0.45 C ATOM 1875 CD1 LEU A 122 5.788 0.221 0.752 1.00 1.20 C ATOM 1876 CD2 LEU A 122 7.561 0.694 -0.916 1.00 1.00 C ATOM 0 H LEU A 122 7.061 2.293 2.924 1.00 0.23 H new ATOM 0 HA LEU A 122 7.155 -0.636 3.002 1.00 0.25 H new ATOM 0 HB2 LEU A 122 8.352 1.567 1.324 1.00 0.30 H new ATOM 0 HB3 LEU A 122 9.138 0.001 1.374 1.00 0.30 H new ATOM 0 HG LEU A 122 7.396 -1.075 0.274 1.00 0.45 H new ATOM 0 HD11 LEU A 122 5.150 -0.149 -0.050 1.00 1.20 H new ATOM 0 HD12 LEU A 122 5.559 -0.314 1.674 1.00 1.20 H new ATOM 0 HD13 LEU A 122 5.609 1.286 0.896 1.00 1.20 H new ATOM 0 HD21 LEU A 122 6.892 0.331 -1.696 1.00 1.00 H new ATOM 0 HD22 LEU A 122 7.429 1.769 -0.796 1.00 1.00 H new ATOM 0 HD23 LEU A 122 8.593 0.484 -1.197 1.00 1.00 H new ATOM 1888 N THR A 123 9.023 -0.847 4.546 1.00 0.22 N ATOM 1889 CA THR A 123 10.191 -1.100 5.360 1.00 0.21 C ATOM 1890 C THR A 123 10.821 -2.415 4.947 1.00 0.23 C ATOM 1891 O THR A 123 10.403 -3.479 5.386 1.00 0.32 O ATOM 1892 CB THR A 123 9.840 -1.176 6.849 1.00 0.24 C ATOM 1893 OG1 THR A 123 9.264 0.057 7.297 1.00 0.26 O ATOM 1894 CG2 THR A 123 11.070 -1.511 7.678 1.00 0.26 C ATOM 0 H THR A 123 8.331 -1.597 4.561 1.00 0.22 H new ATOM 0 HA THR A 123 10.884 -0.272 5.208 1.00 0.21 H new ATOM 0 HB THR A 123 9.107 -1.972 6.981 1.00 0.24 H new ATOM 0 HG1 THR A 123 8.512 -0.132 7.897 1.00 0.26 H new ATOM 0 HG21 THR A 123 10.796 -1.560 8.732 1.00 0.26 H new ATOM 0 HG22 THR A 123 11.470 -2.474 7.362 1.00 0.26 H new ATOM 0 HG23 THR A 123 11.826 -0.739 7.535 1.00 0.26 H new ATOM 1902 N ILE A 124 11.808 -2.353 4.094 1.00 0.20 N ATOM 1903 CA ILE A 124 12.451 -3.561 3.622 1.00 0.21 C ATOM 1904 C ILE A 124 13.859 -3.657 4.167 1.00 0.24 C ATOM 1905 O ILE A 124 14.532 -2.639 4.336 1.00 0.32 O ATOM 1906 CB ILE A 124 12.465 -3.618 2.087 1.00 0.23 C ATOM 1907 CG1 ILE A 124 13.016 -2.311 1.511 1.00 0.25 C ATOM 1908 CG2 ILE A 124 11.059 -3.894 1.568 1.00 0.25 C ATOM 1909 CD1 ILE A 124 13.057 -2.282 0.003 1.00 0.98 C ATOM 0 H ILE A 124 12.186 -1.487 3.710 1.00 0.20 H new ATOM 0 HA ILE A 124 11.876 -4.413 3.985 1.00 0.21 H new ATOM 0 HB ILE A 124 13.118 -4.429 1.764 1.00 0.23 H new ATOM 0 HG12 ILE A 124 12.404 -1.482 1.865 1.00 0.25 H new ATOM 0 HG13 ILE A 124 14.023 -2.151 1.896 1.00 0.25 H new ATOM 0 HG21 ILE A 124 11.074 -3.933 0.479 1.00 0.25 H new ATOM 0 HG22 ILE A 124 10.707 -4.848 1.961 1.00 0.25 H new ATOM 0 HG23 ILE A 124 10.389 -3.098 1.893 1.00 0.25 H new ATOM 0 HD11 ILE A 124 13.459 -1.326 -0.332 1.00 0.98 H new ATOM 0 HD12 ILE A 124 13.693 -3.089 -0.359 1.00 0.98 H new ATOM 0 HD13 ILE A 124 12.049 -2.410 -0.391 1.00 0.98 H new ATOM 1921 N ASP A 125 14.298 -4.869 4.469 1.00 0.25 N ATOM 1922 CA ASP A 125 15.627 -5.059 4.993 1.00 0.30 C ATOM 1923 C ASP A 125 16.571 -5.160 3.829 1.00 0.30 C ATOM 1924 O ASP A 125 16.620 -6.189 3.154 1.00 0.31 O ATOM 1925 CB ASP A 125 15.715 -6.318 5.867 1.00 0.37 C ATOM 1926 CG ASP A 125 14.853 -6.238 7.113 1.00 0.91 C ATOM 1927 OD1 ASP A 125 15.290 -5.624 8.108 1.00 1.44 O ATOM 1928 OD2 ASP A 125 13.730 -6.774 7.102 1.00 1.52 O ATOM 0 H ASP A 125 13.753 -5.724 4.359 1.00 0.25 H new ATOM 0 HA ASP A 125 15.891 -4.214 5.629 1.00 0.30 H new ATOM 0 HB2 ASP A 125 15.413 -7.184 5.278 1.00 0.37 H new ATOM 0 HB3 ASP A 125 16.753 -6.478 6.160 1.00 0.37 H new ATOM 1933 N LEU A 126 17.313 -4.081 3.625 1.00 0.32 N ATOM 1934 CA LEU A 126 18.199 -3.923 2.482 1.00 0.33 C ATOM 1935 C LEU A 126 19.640 -4.165 2.898 1.00 0.37 C ATOM 1936 O LEU A 126 19.935 -4.246 4.082 1.00 0.55 O ATOM 1937 CB LEU A 126 18.059 -2.504 1.919 1.00 0.42 C ATOM 1938 CG LEU A 126 16.740 -2.201 1.205 1.00 0.38 C ATOM 1939 CD1 LEU A 126 16.494 -0.703 1.170 1.00 1.26 C ATOM 1940 CD2 LEU A 126 16.769 -2.755 -0.209 1.00 1.28 C ATOM 0 H LEU A 126 17.316 -3.281 4.257 1.00 0.32 H new ATOM 0 HA LEU A 126 17.925 -4.650 1.717 1.00 0.33 H new ATOM 0 HB2 LEU A 126 18.179 -1.795 2.738 1.00 0.42 H new ATOM 0 HB3 LEU A 126 18.878 -2.327 1.221 1.00 0.42 H new ATOM 0 HG LEU A 126 15.929 -2.679 1.755 1.00 0.38 H new ATOM 0 HD11 LEU A 126 15.552 -0.501 0.659 1.00 1.26 H new ATOM 0 HD12 LEU A 126 16.444 -0.319 2.189 1.00 1.26 H new ATOM 0 HD13 LEU A 126 17.309 -0.213 0.637 1.00 1.26 H new ATOM 0 HD21 LEU A 126 15.825 -2.533 -0.706 1.00 1.28 H new ATOM 0 HD22 LEU A 126 17.588 -2.296 -0.763 1.00 1.28 H new ATOM 0 HD23 LEU A 126 16.915 -3.835 -0.174 1.00 1.28 H new ATOM 1952 N PRO A 127 20.555 -4.316 1.943 1.00 0.43 N ATOM 1953 CA PRO A 127 21.979 -4.428 2.251 1.00 0.52 C ATOM 1954 C PRO A 127 22.612 -3.083 2.611 1.00 0.60 C ATOM 1955 O PRO A 127 23.558 -3.024 3.390 1.00 0.74 O ATOM 1956 CB PRO A 127 22.595 -4.971 0.954 1.00 0.60 C ATOM 1957 CG PRO A 127 21.442 -5.327 0.068 1.00 0.73 C ATOM 1958 CD PRO A 127 20.292 -4.472 0.509 1.00 0.55 C ATOM 0 HA PRO A 127 22.148 -5.065 3.119 1.00 0.52 H new ATOM 0 HB2 PRO A 127 23.233 -4.224 0.482 1.00 0.60 H new ATOM 0 HB3 PRO A 127 23.218 -5.843 1.153 1.00 0.60 H new ATOM 0 HG2 PRO A 127 21.685 -5.143 -0.979 1.00 0.73 H new ATOM 0 HG3 PRO A 127 21.196 -6.385 0.156 1.00 0.73 H new ATOM 0 HD2 PRO A 127 20.276 -3.513 -0.009 1.00 0.55 H new ATOM 0 HD3 PRO A 127 19.332 -4.952 0.321 1.00 0.55 H new ATOM 1966 N VAL A 128 22.072 -2.004 2.050 1.00 0.60 N ATOM 1967 CA VAL A 128 22.692 -0.686 2.183 1.00 0.72 C ATOM 1968 C VAL A 128 22.502 -0.086 3.579 1.00 0.71 C ATOM 1969 O VAL A 128 23.476 0.190 4.272 1.00 0.82 O ATOM 1970 CB VAL A 128 22.140 0.297 1.132 1.00 0.83 C ATOM 1971 CG1 VAL A 128 22.863 1.635 1.206 1.00 1.12 C ATOM 1972 CG2 VAL A 128 22.252 -0.302 -0.260 1.00 1.02 C ATOM 0 H VAL A 128 21.212 -2.014 1.502 1.00 0.60 H new ATOM 0 HA VAL A 128 23.759 -0.837 2.020 1.00 0.72 H new ATOM 0 HB VAL A 128 21.086 0.475 1.348 1.00 0.83 H new ATOM 0 HG11 VAL A 128 22.455 2.311 0.454 1.00 1.12 H new ATOM 0 HG12 VAL A 128 22.726 2.068 2.197 1.00 1.12 H new ATOM 0 HG13 VAL A 128 23.926 1.485 1.020 1.00 1.12 H new ATOM 0 HG21 VAL A 128 21.858 0.403 -0.992 1.00 1.02 H new ATOM 0 HG22 VAL A 128 23.298 -0.511 -0.483 1.00 1.02 H new ATOM 0 HG23 VAL A 128 21.680 -1.229 -0.305 1.00 1.02 H new ATOM 1982 N VAL A 129 21.254 0.093 4.000 1.00 0.62 N ATOM 1983 CA VAL A 129 20.980 0.685 5.311 1.00 0.63 C ATOM 1984 C VAL A 129 20.509 -0.403 6.271 1.00 0.55 C ATOM 1985 O VAL A 129 20.188 -0.165 7.434 1.00 0.55 O ATOM 1986 CB VAL A 129 19.927 1.810 5.217 1.00 0.69 C ATOM 1987 CG1 VAL A 129 19.712 2.507 6.556 1.00 1.35 C ATOM 1988 CG2 VAL A 129 20.351 2.819 4.182 1.00 1.26 C ATOM 0 H VAL A 129 20.424 -0.159 3.463 1.00 0.62 H new ATOM 0 HA VAL A 129 21.901 1.131 5.686 1.00 0.63 H new ATOM 0 HB VAL A 129 18.981 1.352 4.927 1.00 0.69 H new ATOM 0 HG11 VAL A 129 18.963 3.291 6.442 1.00 1.35 H new ATOM 0 HG12 VAL A 129 19.368 1.781 7.293 1.00 1.35 H new ATOM 0 HG13 VAL A 129 20.651 2.948 6.892 1.00 1.35 H new ATOM 0 HG21 VAL A 129 19.605 3.611 4.119 1.00 1.26 H new ATOM 0 HG22 VAL A 129 21.313 3.248 4.464 1.00 1.26 H new ATOM 0 HG23 VAL A 129 20.443 2.329 3.213 1.00 1.26 H new ATOM 1998 N GLY A 130 20.508 -1.616 5.755 1.00 0.53 N ATOM 1999 CA GLY A 130 19.950 -2.745 6.478 1.00 0.55 C ATOM 2000 C GLY A 130 18.440 -2.717 6.490 1.00 0.58 C ATOM 2001 O GLY A 130 17.795 -3.750 6.626 1.00 1.05 O ATOM 0 H GLY A 130 20.887 -1.847 4.837 1.00 0.53 H new ATOM 0 HA2 GLY A 130 20.292 -3.673 6.021 1.00 0.55 H new ATOM 0 HA3 GLY A 130 20.321 -2.739 7.503 1.00 0.55 H new ATOM 2005 N GLU A 131 17.886 -1.530 6.339 1.00 0.49 N ATOM 2006 CA GLU A 131 16.460 -1.330 6.300 1.00 0.46 C ATOM 2007 C GLU A 131 16.173 -0.001 5.616 1.00 0.49 C ATOM 2008 O GLU A 131 17.095 0.765 5.346 1.00 0.75 O ATOM 2009 CB GLU A 131 15.900 -1.321 7.720 1.00 0.59 C ATOM 2010 CG GLU A 131 16.349 -0.116 8.536 1.00 0.73 C ATOM 2011 CD GLU A 131 15.816 -0.126 9.950 1.00 0.93 C ATOM 2012 OE1 GLU A 131 14.684 0.360 10.161 1.00 1.16 O ATOM 2013 OE2 GLU A 131 16.518 -0.628 10.855 1.00 1.01 O ATOM 0 H GLU A 131 18.425 -0.670 6.239 1.00 0.49 H new ATOM 0 HA GLU A 131 15.985 -2.139 5.745 1.00 0.46 H new ATOM 0 HB2 GLU A 131 14.811 -1.335 7.674 1.00 0.59 H new ATOM 0 HB3 GLU A 131 16.209 -2.233 8.231 1.00 0.59 H new ATOM 0 HG2 GLU A 131 17.438 -0.090 8.565 1.00 0.73 H new ATOM 0 HG3 GLU A 131 16.021 0.796 8.037 1.00 0.73 H new ATOM 2020 N PHE A 132 14.914 0.262 5.324 1.00 0.39 N ATOM 2021 CA PHE A 132 14.511 1.551 4.787 1.00 0.48 C ATOM 2022 C PHE A 132 13.008 1.692 4.940 1.00 0.35 C ATOM 2023 O PHE A 132 12.274 0.753 4.643 1.00 0.33 O ATOM 2024 CB PHE A 132 14.919 1.677 3.313 1.00 0.69 C ATOM 2025 CG PHE A 132 14.928 3.092 2.805 1.00 1.02 C ATOM 2026 CD1 PHE A 132 15.562 4.094 3.525 1.00 1.22 C ATOM 2027 CD2 PHE A 132 14.313 3.420 1.610 1.00 1.31 C ATOM 2028 CE1 PHE A 132 15.580 5.396 3.061 1.00 1.66 C ATOM 2029 CE2 PHE A 132 14.331 4.719 1.140 1.00 1.74 C ATOM 2030 CZ PHE A 132 14.964 5.708 1.866 1.00 1.91 C ATOM 0 H PHE A 132 14.149 -0.401 5.449 1.00 0.39 H new ATOM 0 HA PHE A 132 15.012 2.348 5.336 1.00 0.48 H new ATOM 0 HB2 PHE A 132 15.912 1.248 3.183 1.00 0.69 H new ATOM 0 HB3 PHE A 132 14.234 1.087 2.704 1.00 0.69 H new ATOM 0 HD1 PHE A 132 16.047 3.854 4.459 1.00 1.22 H new ATOM 0 HD2 PHE A 132 13.813 2.652 1.038 1.00 1.31 H new ATOM 0 HE1 PHE A 132 16.075 6.167 3.632 1.00 1.66 H new ATOM 0 HE2 PHE A 132 13.850 4.961 0.204 1.00 1.74 H new ATOM 0 HZ PHE A 132 14.977 6.724 1.500 1.00 1.91 H new ATOM 2040 N THR A 133 12.555 2.834 5.441 1.00 0.37 N ATOM 2041 CA THR A 133 11.135 3.045 5.674 1.00 0.32 C ATOM 2042 C THR A 133 10.628 4.285 4.940 1.00 0.31 C ATOM 2043 O THR A 133 10.767 5.414 5.417 1.00 0.36 O ATOM 2044 CB THR A 133 10.823 3.169 7.179 1.00 0.44 C ATOM 2045 OG1 THR A 133 11.255 1.983 7.863 1.00 1.19 O ATOM 2046 CG2 THR A 133 9.333 3.375 7.421 1.00 1.17 C ATOM 0 H THR A 133 13.149 3.624 5.692 1.00 0.37 H new ATOM 0 HA THR A 133 10.617 2.170 5.281 1.00 0.32 H new ATOM 0 HB THR A 133 11.358 4.038 7.563 1.00 0.44 H new ATOM 0 HG1 THR A 133 10.606 1.264 7.712 1.00 1.19 H new ATOM 0 HG21 THR A 133 9.146 3.459 8.492 1.00 1.17 H new ATOM 0 HG22 THR A 133 9.006 4.288 6.923 1.00 1.17 H new ATOM 0 HG23 THR A 133 8.779 2.526 7.021 1.00 1.17 H new ATOM 2054 N ILE A 134 10.077 4.062 3.756 1.00 0.28 N ATOM 2055 CA ILE A 134 9.454 5.122 2.975 1.00 0.31 C ATOM 2056 C ILE A 134 8.047 4.715 2.566 1.00 0.28 C ATOM 2057 O ILE A 134 7.810 3.563 2.226 1.00 0.26 O ATOM 2058 CB ILE A 134 10.280 5.465 1.716 1.00 0.36 C ATOM 2059 CG1 ILE A 134 10.666 4.190 0.954 1.00 0.41 C ATOM 2060 CG2 ILE A 134 11.507 6.274 2.093 1.00 0.41 C ATOM 2061 CD1 ILE A 134 9.733 3.855 -0.191 1.00 0.50 C ATOM 0 H ILE A 134 10.049 3.145 3.310 1.00 0.28 H new ATOM 0 HA ILE A 134 9.411 6.011 3.605 1.00 0.31 H new ATOM 0 HB ILE A 134 9.665 6.073 1.052 1.00 0.36 H new ATOM 0 HG12 ILE A 134 11.678 4.303 0.565 1.00 0.41 H new ATOM 0 HG13 ILE A 134 10.685 3.353 1.652 1.00 0.41 H new ATOM 0 HG21 ILE A 134 12.079 6.508 1.195 1.00 0.41 H new ATOM 0 HG22 ILE A 134 11.197 7.200 2.577 1.00 0.41 H new ATOM 0 HG23 ILE A 134 12.128 5.696 2.778 1.00 0.41 H new ATOM 0 HD11 ILE A 134 10.071 2.942 -0.681 1.00 0.50 H new ATOM 0 HD12 ILE A 134 8.724 3.708 0.193 1.00 0.50 H new ATOM 0 HD13 ILE A 134 9.732 4.673 -0.911 1.00 0.50 H new ATOM 2073 N PRO A 135 7.080 5.629 2.620 1.00 0.30 N ATOM 2074 CA PRO A 135 5.724 5.332 2.200 1.00 0.29 C ATOM 2075 C PRO A 135 5.496 5.603 0.717 1.00 0.28 C ATOM 2076 O PRO A 135 6.261 6.323 0.076 1.00 0.31 O ATOM 2077 CB PRO A 135 4.895 6.280 3.063 1.00 0.35 C ATOM 2078 CG PRO A 135 5.778 7.472 3.284 1.00 0.45 C ATOM 2079 CD PRO A 135 7.210 7.009 3.118 1.00 0.39 C ATOM 0 HA PRO A 135 5.470 4.279 2.324 1.00 0.29 H new ATOM 0 HB2 PRO A 135 3.969 6.562 2.562 1.00 0.35 H new ATOM 0 HB3 PRO A 135 4.617 5.813 4.008 1.00 0.35 H new ATOM 0 HG2 PRO A 135 5.544 8.261 2.569 1.00 0.45 H new ATOM 0 HG3 PRO A 135 5.621 7.887 4.280 1.00 0.45 H new ATOM 0 HD2 PRO A 135 7.754 7.638 2.414 1.00 0.39 H new ATOM 0 HD3 PRO A 135 7.753 7.044 4.062 1.00 0.39 H new ATOM 2087 N ILE A 136 4.435 5.024 0.187 1.00 0.26 N ATOM 2088 CA ILE A 136 4.073 5.190 -1.206 1.00 0.27 C ATOM 2089 C ILE A 136 2.559 5.010 -1.336 1.00 0.26 C ATOM 2090 O ILE A 136 1.909 4.540 -0.400 1.00 0.26 O ATOM 2091 CB ILE A 136 4.858 4.199 -2.113 1.00 0.28 C ATOM 2092 CG1 ILE A 136 4.701 4.558 -3.606 1.00 0.44 C ATOM 2093 CG2 ILE A 136 4.433 2.762 -1.838 1.00 0.33 C ATOM 2094 CD1 ILE A 136 3.809 3.622 -4.401 1.00 0.32 C ATOM 0 H ILE A 136 3.799 4.424 0.713 1.00 0.26 H new ATOM 0 HA ILE A 136 4.344 6.190 -1.544 1.00 0.27 H new ATOM 0 HB ILE A 136 5.917 4.287 -1.869 1.00 0.28 H new ATOM 0 HG12 ILE A 136 4.300 5.569 -3.681 1.00 0.44 H new ATOM 0 HG13 ILE A 136 5.689 4.572 -4.066 1.00 0.44 H new ATOM 0 HG21 ILE A 136 4.995 2.087 -2.483 1.00 0.33 H new ATOM 0 HG22 ILE A 136 4.633 2.517 -0.795 1.00 0.33 H new ATOM 0 HG23 ILE A 136 3.367 2.653 -2.039 1.00 0.33 H new ATOM 0 HD11 ILE A 136 3.762 3.957 -5.437 1.00 0.32 H new ATOM 0 HD12 ILE A 136 4.217 2.612 -4.365 1.00 0.32 H new ATOM 0 HD13 ILE A 136 2.807 3.624 -3.973 1.00 0.32 H new ATOM 2106 N SER A 137 1.996 5.376 -2.470 1.00 0.28 N ATOM 2107 CA SER A 137 0.557 5.394 -2.610 1.00 0.30 C ATOM 2108 C SER A 137 0.109 4.837 -3.941 1.00 0.30 C ATOM 2109 O SER A 137 0.828 4.906 -4.940 1.00 0.32 O ATOM 2110 CB SER A 137 0.018 6.813 -2.429 1.00 0.34 C ATOM 2111 OG SER A 137 0.841 7.773 -3.071 1.00 0.88 O ATOM 0 H SER A 137 2.511 5.663 -3.302 1.00 0.28 H new ATOM 0 HA SER A 137 0.151 4.752 -1.829 1.00 0.30 H new ATOM 0 HB2 SER A 137 -0.993 6.872 -2.832 1.00 0.34 H new ATOM 0 HB3 SER A 137 -0.049 7.044 -1.366 1.00 0.34 H new ATOM 0 HG SER A 137 0.466 8.668 -2.936 1.00 0.88 H new ATOM 2117 N SER A 138 -1.081 4.272 -3.945 1.00 0.31 N ATOM 2118 CA SER A 138 -1.713 3.827 -5.157 1.00 0.34 C ATOM 2119 C SER A 138 -3.185 4.178 -5.053 1.00 0.34 C ATOM 2120 O SER A 138 -3.933 3.544 -4.310 1.00 0.35 O ATOM 2121 CB SER A 138 -1.514 2.322 -5.346 1.00 0.40 C ATOM 2122 OG SER A 138 -1.935 1.902 -6.633 1.00 0.96 O ATOM 0 H SER A 138 -1.633 4.111 -3.103 1.00 0.31 H new ATOM 0 HA SER A 138 -1.271 4.315 -6.026 1.00 0.34 H new ATOM 0 HB2 SER A 138 -0.462 2.072 -5.206 1.00 0.40 H new ATOM 0 HB3 SER A 138 -2.074 1.781 -4.584 1.00 0.40 H new ATOM 0 HG SER A 138 -1.794 0.937 -6.724 1.00 0.96 H new ATOM 2128 N LYS A 139 -3.583 5.226 -5.744 1.00 0.36 N ATOM 2129 CA LYS A 139 -4.939 5.725 -5.639 1.00 0.38 C ATOM 2130 C LYS A 139 -5.675 5.506 -6.944 1.00 0.41 C ATOM 2131 O LYS A 139 -5.054 5.426 -8.004 1.00 0.47 O ATOM 2132 CB LYS A 139 -4.958 7.212 -5.254 1.00 0.44 C ATOM 2133 CG LYS A 139 -4.130 8.124 -6.150 1.00 0.57 C ATOM 2134 CD LYS A 139 -2.672 8.187 -5.717 1.00 0.92 C ATOM 2135 CE LYS A 139 -2.531 8.682 -4.284 1.00 1.35 C ATOM 2136 NZ LYS A 139 -3.090 10.049 -4.098 1.00 1.76 N ATOM 0 H LYS A 139 -2.987 5.749 -6.385 1.00 0.36 H new ATOM 0 HA LYS A 139 -5.445 5.171 -4.848 1.00 0.38 H new ATOM 0 HB2 LYS A 139 -5.991 7.560 -5.263 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -4.598 7.310 -4.230 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -4.187 7.768 -7.179 1.00 0.57 H new ATOM 0 HG3 LYS A 139 -4.555 9.128 -6.136 1.00 0.57 H new ATOM 0 HD2 LYS A 139 -2.223 7.198 -5.806 1.00 0.92 H new ATOM 0 HD3 LYS A 139 -2.122 8.848 -6.386 1.00 0.92 H new ATOM 0 HE2 LYS A 139 -3.039 7.990 -3.612 1.00 1.35 H new ATOM 0 HE3 LYS A 139 -1.477 8.682 -4.005 1.00 1.35 H new ATOM 0 HZ1 LYS A 139 -3.047 10.308 -3.092 1.00 1.76 H new ATOM 0 HZ2 LYS A 139 -2.534 10.730 -4.654 1.00 1.76 H new ATOM 0 HZ3 LYS A 139 -4.079 10.066 -4.418 1.00 1.76 H new ATOM 2150 N GLY A 140 -6.989 5.370 -6.871 1.00 0.42 N ATOM 2151 CA GLY A 140 -7.766 5.188 -8.063 1.00 0.50 C ATOM 2152 C GLY A 140 -9.235 5.404 -7.805 1.00 0.46 C ATOM 2153 O GLY A 140 -9.758 5.047 -6.750 1.00 0.47 O ATOM 0 H GLY A 140 -7.526 5.383 -6.004 1.00 0.42 H new ATOM 0 HA2 GLY A 140 -7.425 5.883 -8.830 1.00 0.50 H new ATOM 0 HA3 GLY A 140 -7.608 4.182 -8.451 1.00 0.50 H new ATOM 2157 N GLU A 141 -9.877 6.012 -8.768 1.00 0.44 N ATOM 2158 CA GLU A 141 -11.289 6.317 -8.676 1.00 0.42 C ATOM 2159 C GLU A 141 -12.058 5.393 -9.593 1.00 0.43 C ATOM 2160 O GLU A 141 -11.774 5.338 -10.793 1.00 0.48 O ATOM 2161 CB GLU A 141 -11.546 7.778 -9.042 1.00 0.45 C ATOM 2162 CG GLU A 141 -10.573 8.751 -8.388 1.00 0.52 C ATOM 2163 CD GLU A 141 -9.282 8.915 -9.165 1.00 1.24 C ATOM 2164 OE1 GLU A 141 -9.327 9.483 -10.277 1.00 1.51 O ATOM 2165 OE2 GLU A 141 -8.220 8.500 -8.664 1.00 2.10 O ATOM 0 H GLU A 141 -9.440 6.311 -9.640 1.00 0.44 H new ATOM 0 HA GLU A 141 -11.626 6.166 -7.650 1.00 0.42 H new ATOM 0 HB2 GLU A 141 -11.485 7.889 -10.125 1.00 0.45 H new ATOM 0 HB3 GLU A 141 -12.562 8.043 -8.751 1.00 0.45 H new ATOM 0 HG2 GLU A 141 -11.055 9.724 -8.286 1.00 0.52 H new ATOM 0 HG3 GLU A 141 -10.342 8.403 -7.381 1.00 0.52 H new ATOM 2172 N ILE A 142 -13.026 4.661 -9.047 1.00 0.42 N ATOM 2173 CA ILE A 142 -13.732 3.641 -9.804 1.00 0.47 C ATOM 2174 C ILE A 142 -15.180 3.597 -9.325 1.00 0.46 C ATOM 2175 O ILE A 142 -15.543 4.298 -8.375 1.00 0.42 O ATOM 2176 CB ILE A 142 -13.105 2.210 -9.707 1.00 0.54 C ATOM 2177 CG1 ILE A 142 -13.513 1.477 -8.418 1.00 0.76 C ATOM 2178 CG2 ILE A 142 -11.587 2.258 -9.822 1.00 0.60 C ATOM 2179 CD1 ILE A 142 -13.035 2.129 -7.145 1.00 0.67 C ATOM 0 H ILE A 142 -13.337 4.759 -8.080 1.00 0.42 H new ATOM 0 HA ILE A 142 -13.659 3.923 -10.854 1.00 0.47 H new ATOM 0 HB ILE A 142 -13.503 1.646 -10.550 1.00 0.54 H new ATOM 0 HG12 ILE A 142 -14.600 1.403 -8.387 1.00 0.76 H new ATOM 0 HG13 ILE A 142 -13.125 0.459 -8.457 1.00 0.76 H new ATOM 0 HG21 ILE A 142 -11.185 1.248 -9.751 1.00 0.60 H new ATOM 0 HG22 ILE A 142 -11.308 2.693 -10.782 1.00 0.60 H new ATOM 0 HG23 ILE A 142 -11.180 2.868 -9.016 1.00 0.60 H new ATOM 0 HD11 ILE A 142 -13.369 1.543 -6.289 1.00 0.67 H new ATOM 0 HD12 ILE A 142 -11.946 2.178 -7.148 1.00 0.67 H new ATOM 0 HD13 ILE A 142 -13.444 3.137 -7.077 1.00 0.67 H new ATOM 2191 N LYS A 143 -15.992 2.797 -9.994 1.00 0.53 N ATOM 2192 CA LYS A 143 -17.421 2.720 -9.722 1.00 0.57 C ATOM 2193 C LYS A 143 -17.732 2.360 -8.262 1.00 0.54 C ATOM 2194 O LYS A 143 -16.893 1.805 -7.543 1.00 0.57 O ATOM 2195 CB LYS A 143 -18.047 1.694 -10.665 1.00 0.70 C ATOM 2196 CG LYS A 143 -19.557 1.796 -10.785 1.00 1.44 C ATOM 2197 CD LYS A 143 -20.108 0.737 -11.721 1.00 2.04 C ATOM 2198 CE LYS A 143 -21.515 1.080 -12.169 1.00 2.74 C ATOM 2199 NZ LYS A 143 -21.543 2.355 -12.930 1.00 3.53 N ATOM 0 H LYS A 143 -15.680 2.180 -10.744 1.00 0.53 H new ATOM 0 HA LYS A 143 -17.848 3.708 -9.892 1.00 0.57 H new ATOM 0 HB2 LYS A 143 -17.607 1.812 -11.655 1.00 0.70 H new ATOM 0 HB3 LYS A 143 -17.788 0.694 -10.318 1.00 0.70 H new ATOM 0 HG2 LYS A 143 -20.011 1.685 -9.800 1.00 1.44 H new ATOM 0 HG3 LYS A 143 -19.829 2.786 -11.152 1.00 1.44 H new ATOM 0 HD2 LYS A 143 -19.459 0.644 -12.592 1.00 2.04 H new ATOM 0 HD3 LYS A 143 -20.109 -0.231 -11.219 1.00 2.04 H new ATOM 0 HE2 LYS A 143 -21.908 0.275 -12.790 1.00 2.74 H new ATOM 0 HE3 LYS A 143 -22.167 1.159 -11.299 1.00 2.74 H new ATOM 0 HZ1 LYS A 143 -22.357 2.355 -13.577 1.00 3.53 H new ATOM 0 HZ2 LYS A 143 -21.626 3.153 -12.268 1.00 3.53 H new ATOM 0 HZ3 LYS A 143 -20.665 2.451 -13.479 1.00 3.53 H new ATOM 2213 N LEU A 144 -18.963 2.670 -7.858 1.00 0.60 N ATOM 2214 CA LEU A 144 -19.445 2.464 -6.495 1.00 0.66 C ATOM 2215 C LEU A 144 -19.287 1.005 -6.056 1.00 0.60 C ATOM 2216 O LEU A 144 -19.528 0.080 -6.837 1.00 0.63 O ATOM 2217 CB LEU A 144 -20.930 2.870 -6.434 1.00 0.83 C ATOM 2218 CG LEU A 144 -21.571 2.937 -5.042 1.00 0.69 C ATOM 2219 CD1 LEU A 144 -21.097 4.165 -4.279 1.00 1.21 C ATOM 2220 CD2 LEU A 144 -23.087 2.944 -5.157 1.00 1.23 C ATOM 0 H LEU A 144 -19.663 3.077 -8.478 1.00 0.60 H new ATOM 0 HA LEU A 144 -18.852 3.077 -5.816 1.00 0.66 H new ATOM 0 HB2 LEU A 144 -21.035 3.848 -6.904 1.00 0.83 H new ATOM 0 HB3 LEU A 144 -21.501 2.164 -7.037 1.00 0.83 H new ATOM 0 HG LEU A 144 -21.262 2.051 -4.487 1.00 0.69 H new ATOM 0 HD11 LEU A 144 -21.567 4.187 -3.296 1.00 1.21 H new ATOM 0 HD12 LEU A 144 -20.014 4.125 -4.162 1.00 1.21 H new ATOM 0 HD13 LEU A 144 -21.369 5.064 -4.831 1.00 1.21 H new ATOM 0 HD21 LEU A 144 -23.527 2.992 -4.161 1.00 1.23 H new ATOM 0 HD22 LEU A 144 -23.404 3.812 -5.736 1.00 1.23 H new ATOM 0 HD23 LEU A 144 -23.418 2.034 -5.657 1.00 1.23 H new ATOM 2232 N PRO A 145 -18.861 0.792 -4.796 1.00 0.61 N ATOM 2233 CA PRO A 145 -18.731 -0.547 -4.203 1.00 0.64 C ATOM 2234 C PRO A 145 -20.078 -1.255 -4.095 1.00 0.66 C ATOM 2235 O PRO A 145 -21.117 -0.669 -4.399 1.00 0.65 O ATOM 2236 CB PRO A 145 -18.165 -0.272 -2.805 1.00 0.71 C ATOM 2237 CG PRO A 145 -18.532 1.142 -2.520 1.00 0.69 C ATOM 2238 CD PRO A 145 -18.476 1.844 -3.844 1.00 0.67 C ATOM 0 HA PRO A 145 -18.102 -1.201 -4.808 1.00 0.64 H new ATOM 0 HB2 PRO A 145 -18.592 -0.949 -2.065 1.00 0.71 H new ATOM 0 HB3 PRO A 145 -17.084 -0.413 -2.780 1.00 0.71 H new ATOM 0 HG2 PRO A 145 -19.528 1.209 -2.082 1.00 0.69 H new ATOM 0 HG3 PRO A 145 -17.840 1.591 -1.808 1.00 0.69 H new ATOM 0 HD2 PRO A 145 -19.161 2.691 -3.880 1.00 0.67 H new ATOM 0 HD3 PRO A 145 -17.479 2.231 -4.053 1.00 0.67 H new