USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 914 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 123 THR OG1 : rot 13:sc= 0.898 USER MOD Set 1.2: A 141 THR OG1 : rot -58:sc= 0.969 USER MOD Set 2.1: A 101 THR OG1 : rot -170:sc= 0.277 USER MOD Set 2.2: A 103 GLN : amide:sc= 1.32 X(o=1.6,f=2) USER MOD Set 3.1: A 86 MET CE :methyl -170:sc= 0 (180deg=-0.0344) USER MOD Set 3.2: A 110 MET CE :methyl -175:sc= -0.0799 (180deg=-0.132) USER MOD Set 4.1: A 55 SER OG : rot 180:sc= 0.844 USER MOD Set 4.2: A 57 GLN : amide:sc= 1.09 X(o=1.9,f=1.5) USER MOD Single : A 29 THR OG1 : rot 58:sc= 0.349 USER MOD Single : A 31 GLN :FLIP amide:sc= -0.386 F(o=-1.3,f=-0.39) USER MOD Single : A 34 THR OG1 : rot -56:sc= 1.06 USER MOD Single : A 41 SER OG : rot 57:sc= 0.356 USER MOD Single : A 45 THR OG1 : rot 156:sc= 0.946 USER MOD Single : A 48 TYR OH : rot 180:sc= -0.0236 USER MOD Single : A 49 MET CE :methyl -153:sc= -0.683 (180deg=-1.53) USER MOD Single : A 50 THR OG1 : rot 8:sc= 0.417 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0.715 K(o=0.72,f=-6!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 153:sc= 1.01 (180deg=-2.41!) USER MOD Single : A 66 THR OG1 : rot 158:sc= 0.622 USER MOD Single : A 70 THR OG1 : rot 160:sc= 0.745 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -161:sc= -0.789 (180deg=-1.8) USER MOD Single : A 76 THR OG1 : rot -67:sc= 1.7 USER MOD Single : A 77 THR OG1 : rot 80:sc= -0.587 USER MOD Single : A 78 THR OG1 : rot -174:sc= 0.777 USER MOD Single : A 79 HIS : no HD1:sc= -0.0459 X(o=-0.046,f=-0.25) USER MOD Single : A 80 SER OG : rot 180:sc= 0.0543 USER MOD Single : A 83 MET CE :methyl -172:sc= 0 (180deg=-0.0794) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 71:sc= 0.827 USER MOD Single : A 108 HIS : no HE2:sc= -2.06 K(o=-2.1,f=-3.3) USER MOD Single : A 112 MET CE :methyl 173:sc=-0.00691 (180deg=-0.09) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 179:sc= 0.891 (180deg=0.781) USER MOD Single : A 125 ASN : amide:sc=-0.00839 K(o=-0.0084,f=-1.3) USER MOD Single : A 127 THR OG1 : rot 3:sc= 0.327 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 45:sc= 1.22 USER MOD Single : A 137 ASN : amide:sc= 0.315 K(o=0.31,f=-3.5!) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 369 N VAL A 28 -6.027 6.130 -0.114 1.00 10.00 N ATOM 370 CA VAL A 28 -5.186 5.213 -0.883 1.00 10.00 C ATOM 371 C VAL A 28 -3.739 5.259 -0.391 1.00 10.00 C ATOM 372 O VAL A 28 -2.793 5.443 -1.155 1.00 10.00 O ATOM 373 CB VAL A 28 -5.294 5.571 -2.375 1.00 10.00 C ATOM 374 CG1 VAL A 28 -6.739 5.369 -2.834 1.00 10.00 C ATOM 375 CG2 VAL A 28 -4.891 7.016 -2.701 1.00 10.00 C ATOM 0 HA VAL A 28 -5.533 4.189 -0.742 1.00 10.00 H new ATOM 0 HB VAL A 28 -4.597 4.915 -2.896 1.00 10.00 H new ATOM 0 HG11 VAL A 28 -6.824 5.621 -3.891 1.00 10.00 H new ATOM 0 HG12 VAL A 28 -7.026 4.328 -2.685 1.00 10.00 H new ATOM 0 HG13 VAL A 28 -7.399 6.014 -2.253 1.00 10.00 H new ATOM 0 HG21 VAL A 28 -4.994 7.190 -3.772 1.00 10.00 H new ATOM 0 HG22 VAL A 28 -5.537 7.705 -2.157 1.00 10.00 H new ATOM 0 HG23 VAL A 28 -3.855 7.180 -2.405 1.00 10.00 H new ATOM 385 N THR A 29 -3.561 5.057 0.911 1.00 10.00 N ATOM 386 CA THR A 29 -2.341 5.417 1.603 1.00 10.00 C ATOM 387 C THR A 29 -2.192 4.502 2.809 1.00 10.00 C ATOM 388 O THR A 29 -2.153 4.975 3.944 1.00 10.00 O ATOM 389 CB THR A 29 -2.392 6.900 2.019 1.00 10.00 C ATOM 390 OG1 THR A 29 -3.492 7.124 2.875 1.00 10.00 O ATOM 391 CG2 THR A 29 -2.491 7.864 0.834 1.00 10.00 C ATOM 0 H THR A 29 -4.268 4.636 1.514 1.00 10.00 H new ATOM 0 HA THR A 29 -1.476 5.292 0.952 1.00 10.00 H new ATOM 0 HB THR A 29 -1.449 7.102 2.528 1.00 10.00 H new ATOM 0 HG1 THR A 29 -3.420 6.541 3.659 1.00 10.00 H new ATOM 0 HG21 THR A 29 -2.523 8.890 1.201 1.00 10.00 H new ATOM 0 HG22 THR A 29 -1.623 7.737 0.188 1.00 10.00 H new ATOM 0 HG23 THR A 29 -3.398 7.653 0.268 1.00 10.00 H new ATOM 399 N VAL A 30 -2.128 3.195 2.555 1.00 10.00 N ATOM 400 CA VAL A 30 -1.892 2.195 3.584 1.00 10.00 C ATOM 401 C VAL A 30 -0.630 1.413 3.211 1.00 10.00 C ATOM 402 O VAL A 30 -0.622 0.187 3.146 1.00 10.00 O ATOM 403 CB VAL A 30 -3.184 1.376 3.803 1.00 10.00 C ATOM 404 CG1 VAL A 30 -3.676 0.641 2.548 1.00 10.00 C ATOM 405 CG2 VAL A 30 -3.076 0.408 4.989 1.00 10.00 C ATOM 0 H VAL A 30 -2.240 2.802 1.620 1.00 10.00 H new ATOM 0 HA VAL A 30 -1.681 2.623 4.564 1.00 10.00 H new ATOM 0 HB VAL A 30 -3.940 2.124 4.043 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.586 0.089 2.783 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -3.884 1.365 1.760 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -2.908 -0.054 2.209 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.011 -0.141 5.097 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -2.261 -0.294 4.813 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -2.879 0.971 5.901 1.00 10.00 H new ATOM 415 N GLN A 31 0.465 2.154 3.009 1.00 10.00 N ATOM 416 CA GLN A 31 1.814 1.618 2.942 1.00 10.00 C ATOM 417 C GLN A 31 2.499 1.857 4.291 1.00 10.00 C ATOM 418 O GLN A 31 2.348 2.934 4.863 1.00 10.00 O ATOM 419 CB GLN A 31 2.567 2.251 1.756 1.00 10.00 C ATOM 420 CG GLN A 31 3.200 3.638 1.989 1.00 10.00 C ATOM 421 CD GLN A 31 2.212 4.760 2.295 1.00 10.00 C ATOM 422 OE1 GLN A 31 1.099 4.823 1.571 1.00 10.00 O flip ATOM 423 NE2 GLN A 31 2.450 5.596 3.159 1.00 10.00 N flip ATOM 0 H GLN A 31 0.429 3.166 2.886 1.00 10.00 H new ATOM 0 HA GLN A 31 1.805 0.543 2.761 1.00 10.00 H new ATOM 0 HB2 GLN A 31 3.357 1.565 1.451 1.00 10.00 H new ATOM 0 HB3 GLN A 31 1.874 2.331 0.919 1.00 10.00 H new ATOM 0 HG2 GLN A 31 3.907 3.563 2.815 1.00 10.00 H new ATOM 0 HG3 GLN A 31 3.773 3.912 1.103 1.00 10.00 H new ATOM 0 HE21 GLN A 31 3.309 5.534 3.706 1.00 10.00 H new ATOM 0 HE22 GLN A 31 1.789 6.354 3.331 1.00 10.00 H new ATOM 432 N GLY A 32 3.247 0.873 4.799 1.00 10.00 N ATOM 433 CA GLY A 32 4.212 1.101 5.869 1.00 10.00 C ATOM 434 C GLY A 32 5.529 1.532 5.226 1.00 10.00 C ATOM 435 O GLY A 32 5.520 2.282 4.251 1.00 10.00 O ATOM 0 H GLY A 32 3.199 -0.095 4.481 1.00 10.00 H new ATOM 0 HA2 GLY A 32 3.851 1.870 6.552 1.00 10.00 H new ATOM 0 HA3 GLY A 32 4.353 0.194 6.456 1.00 10.00 H new ATOM 439 N ALA A 33 6.658 0.989 5.686 1.00 10.00 N ATOM 440 CA ALA A 33 7.896 1.028 4.925 1.00 10.00 C ATOM 441 C ALA A 33 8.845 -0.054 5.427 1.00 10.00 C ATOM 442 O ALA A 33 8.916 -0.329 6.625 1.00 10.00 O ATOM 443 CB ALA A 33 8.528 2.423 4.992 1.00 10.00 C ATOM 0 H ALA A 33 6.734 0.516 6.587 1.00 10.00 H new ATOM 0 HA ALA A 33 7.682 0.825 3.876 1.00 10.00 H new ATOM 0 HB1 ALA A 33 9.453 2.431 4.416 1.00 10.00 H new ATOM 0 HB2 ALA A 33 7.836 3.156 4.577 1.00 10.00 H new ATOM 0 HB3 ALA A 33 8.744 2.675 6.030 1.00 10.00 H new ATOM 449 N THR A 34 9.593 -0.653 4.503 1.00 10.00 N ATOM 450 CA THR A 34 10.786 -1.409 4.817 1.00 10.00 C ATOM 451 C THR A 34 11.854 -0.947 3.828 1.00 10.00 C ATOM 452 O THR A 34 11.489 -0.460 2.757 1.00 10.00 O ATOM 453 CB THR A 34 10.519 -2.918 4.751 1.00 10.00 C ATOM 454 OG1 THR A 34 10.334 -3.363 3.425 1.00 10.00 O ATOM 455 CG2 THR A 34 9.301 -3.345 5.575 1.00 10.00 C ATOM 0 H THR A 34 9.379 -0.622 3.506 1.00 10.00 H new ATOM 0 HA THR A 34 11.123 -1.230 5.838 1.00 10.00 H new ATOM 0 HB THR A 34 11.410 -3.379 5.176 1.00 10.00 H new ATOM 0 HG1 THR A 34 9.612 -2.850 3.006 1.00 10.00 H new ATOM 0 HG21 THR A 34 9.163 -4.423 5.489 1.00 10.00 H new ATOM 0 HG22 THR A 34 9.459 -3.082 6.621 1.00 10.00 H new ATOM 0 HG23 THR A 34 8.413 -2.835 5.203 1.00 10.00 H new ATOM 463 N VAL A 35 13.136 -1.046 4.186 1.00 10.00 N ATOM 464 CA VAL A 35 14.270 -0.627 3.370 1.00 10.00 C ATOM 465 C VAL A 35 15.233 -1.799 3.296 1.00 10.00 C ATOM 466 O VAL A 35 15.470 -2.427 4.328 1.00 10.00 O ATOM 467 CB VAL A 35 14.968 0.592 4.003 1.00 10.00 C ATOM 468 CG1 VAL A 35 16.010 1.180 3.042 1.00 10.00 C ATOM 469 CG2 VAL A 35 13.956 1.667 4.410 1.00 10.00 C ATOM 0 H VAL A 35 13.420 -1.435 5.085 1.00 10.00 H new ATOM 0 HA VAL A 35 13.935 -0.338 2.374 1.00 10.00 H new ATOM 0 HB VAL A 35 15.476 0.249 4.904 1.00 10.00 H new ATOM 0 HG11 VAL A 35 16.491 2.040 3.509 1.00 10.00 H new ATOM 0 HG12 VAL A 35 16.761 0.424 2.813 1.00 10.00 H new ATOM 0 HG13 VAL A 35 15.519 1.495 2.121 1.00 10.00 H new ATOM 0 HG21 VAL A 35 14.482 2.513 4.853 1.00 10.00 H new ATOM 0 HG22 VAL A 35 13.407 2.002 3.530 1.00 10.00 H new ATOM 0 HG23 VAL A 35 13.258 1.253 5.137 1.00 10.00 H new ATOM 479 N ALA A 36 15.823 -2.066 2.123 1.00 10.00 N ATOM 480 CA ALA A 36 16.727 -3.202 1.917 1.00 10.00 C ATOM 481 C ALA A 36 18.120 -2.987 2.538 1.00 10.00 C ATOM 482 O ALA A 36 19.130 -3.367 1.947 1.00 10.00 O ATOM 483 CB ALA A 36 16.834 -3.497 0.424 1.00 10.00 C ATOM 0 H ALA A 36 15.685 -1.497 1.288 1.00 10.00 H new ATOM 0 HA ALA A 36 16.300 -4.061 2.435 1.00 10.00 H new ATOM 0 HB1 ALA A 36 17.505 -4.341 0.267 1.00 10.00 H new ATOM 0 HB2 ALA A 36 15.847 -3.740 0.029 1.00 10.00 H new ATOM 0 HB3 ALA A 36 17.226 -2.621 -0.093 1.00 10.00 H new ATOM 489 N ALA A 37 18.175 -2.351 3.713 1.00 10.00 N ATOM 490 CA ALA A 37 19.349 -1.711 4.295 1.00 10.00 C ATOM 491 C ALA A 37 20.256 -1.152 3.193 1.00 10.00 C ATOM 492 O ALA A 37 19.763 -0.408 2.349 1.00 10.00 O ATOM 493 CB ALA A 37 20.043 -2.649 5.286 1.00 10.00 C ATOM 0 H ALA A 37 17.354 -2.267 4.313 1.00 10.00 H new ATOM 0 HA ALA A 37 19.047 -0.847 4.887 1.00 10.00 H new ATOM 0 HB1 ALA A 37 20.916 -2.151 5.708 1.00 10.00 H new ATOM 0 HB2 ALA A 37 19.351 -2.909 6.087 1.00 10.00 H new ATOM 0 HB3 ALA A 37 20.357 -3.556 4.770 1.00 10.00 H new ATOM 499 N VAL A 38 21.536 -1.529 3.163 1.00 10.00 N ATOM 500 CA VAL A 38 22.394 -1.379 1.995 1.00 10.00 C ATOM 501 C VAL A 38 22.636 -2.795 1.467 1.00 10.00 C ATOM 502 O VAL A 38 23.289 -3.578 2.158 1.00 10.00 O ATOM 503 CB VAL A 38 23.708 -0.672 2.383 1.00 10.00 C ATOM 504 CG1 VAL A 38 24.745 -0.725 1.257 1.00 10.00 C ATOM 505 CG2 VAL A 38 23.426 0.798 2.706 1.00 10.00 C ATOM 0 H VAL A 38 22.008 -1.952 3.962 1.00 10.00 H new ATOM 0 HA VAL A 38 21.935 -0.759 1.224 1.00 10.00 H new ATOM 0 HB VAL A 38 24.110 -1.194 3.251 1.00 10.00 H new ATOM 0 HG11 VAL A 38 25.654 -0.215 1.575 1.00 10.00 H new ATOM 0 HG12 VAL A 38 24.975 -1.764 1.023 1.00 10.00 H new ATOM 0 HG13 VAL A 38 24.345 -0.234 0.370 1.00 10.00 H new ATOM 0 HG21 VAL A 38 24.356 1.295 2.980 1.00 10.00 H new ATOM 0 HG22 VAL A 38 22.997 1.287 1.831 1.00 10.00 H new ATOM 0 HG23 VAL A 38 22.723 0.860 3.537 1.00 10.00 H new ATOM 515 N PRO A 39 22.117 -3.161 0.284 1.00 10.00 N ATOM 516 CA PRO A 39 22.516 -4.388 -0.385 1.00 10.00 C ATOM 517 C PRO A 39 24.021 -4.322 -0.676 1.00 10.00 C ATOM 518 O PRO A 39 24.581 -3.226 -0.703 1.00 10.00 O ATOM 519 CB PRO A 39 21.699 -4.436 -1.685 1.00 10.00 C ATOM 520 CG PRO A 39 20.540 -3.472 -1.427 1.00 10.00 C ATOM 521 CD PRO A 39 21.193 -2.412 -0.546 1.00 10.00 C ATOM 0 HA PRO A 39 22.334 -5.280 0.215 1.00 10.00 H new ATOM 0 HB2 PRO A 39 22.295 -4.124 -2.543 1.00 10.00 H new ATOM 0 HB3 PRO A 39 21.341 -5.444 -1.895 1.00 10.00 H new ATOM 0 HG2 PRO A 39 20.149 -3.048 -2.352 1.00 10.00 H new ATOM 0 HG3 PRO A 39 19.707 -3.963 -0.924 1.00 10.00 H new ATOM 0 HD2 PRO A 39 21.712 -1.662 -1.143 1.00 10.00 H new ATOM 0 HD3 PRO A 39 20.454 -1.884 0.057 1.00 10.00 H new ATOM 529 N PRO A 40 24.701 -5.451 -0.920 1.00 10.00 N ATOM 530 CA PRO A 40 26.122 -5.456 -1.236 1.00 10.00 C ATOM 531 C PRO A 40 26.357 -4.980 -2.676 1.00 10.00 C ATOM 532 O PRO A 40 26.878 -5.716 -3.512 1.00 10.00 O ATOM 533 CB PRO A 40 26.566 -6.900 -0.997 1.00 10.00 C ATOM 534 CG PRO A 40 25.310 -7.706 -1.338 1.00 10.00 C ATOM 535 CD PRO A 40 24.175 -6.803 -0.852 1.00 10.00 C ATOM 0 HA PRO A 40 26.703 -4.769 -0.620 1.00 10.00 H new ATOM 0 HB2 PRO A 40 27.407 -7.174 -1.634 1.00 10.00 H new ATOM 0 HB3 PRO A 40 26.881 -7.060 0.034 1.00 10.00 H new ATOM 0 HG2 PRO A 40 25.237 -7.905 -2.407 1.00 10.00 H new ATOM 0 HG3 PRO A 40 25.301 -8.672 -0.833 1.00 10.00 H new ATOM 0 HD2 PRO A 40 23.290 -6.912 -1.479 1.00 10.00 H new ATOM 0 HD3 PRO A 40 23.878 -7.058 0.165 1.00 10.00 H new ATOM 543 N SER A 41 25.973 -3.737 -2.970 1.00 10.00 N ATOM 544 CA SER A 41 26.073 -3.139 -4.284 1.00 10.00 C ATOM 545 C SER A 41 25.934 -1.626 -4.133 1.00 10.00 C ATOM 546 O SER A 41 24.999 -1.051 -4.682 1.00 10.00 O ATOM 547 CB SER A 41 24.991 -3.727 -5.202 1.00 10.00 C ATOM 548 OG SER A 41 23.705 -3.475 -4.669 1.00 10.00 O ATOM 0 H SER A 41 25.573 -3.108 -2.274 1.00 10.00 H new ATOM 0 HA SER A 41 27.038 -3.357 -4.741 1.00 10.00 H new ATOM 0 HB2 SER A 41 25.072 -3.290 -6.197 1.00 10.00 H new ATOM 0 HB3 SER A 41 25.142 -4.801 -5.312 1.00 10.00 H new ATOM 0 HG SER A 41 23.588 -2.511 -4.539 1.00 10.00 H new ATOM 554 N ILE A 42 26.870 -1.005 -3.404 1.00 10.00 N ATOM 555 CA ILE A 42 26.990 0.438 -3.231 1.00 10.00 C ATOM 556 C ILE A 42 25.943 0.944 -2.230 1.00 10.00 C ATOM 557 O ILE A 42 24.914 0.310 -2.020 1.00 10.00 O ATOM 558 CB ILE A 42 26.958 1.182 -4.585 1.00 10.00 C ATOM 559 CG1 ILE A 42 27.930 0.519 -5.588 1.00 10.00 C ATOM 560 CG2 ILE A 42 27.360 2.647 -4.377 1.00 10.00 C ATOM 561 CD1 ILE A 42 27.993 1.219 -6.948 1.00 10.00 C ATOM 0 H ILE A 42 27.591 -1.521 -2.900 1.00 10.00 H new ATOM 0 HA ILE A 42 27.968 0.660 -2.804 1.00 10.00 H new ATOM 0 HB ILE A 42 25.946 1.132 -4.988 1.00 10.00 H new ATOM 0 HG12 ILE A 42 28.929 0.502 -5.153 1.00 10.00 H new ATOM 0 HG13 ILE A 42 27.630 -0.518 -5.738 1.00 10.00 H new ATOM 0 HG21 ILE A 42 27.337 3.170 -5.333 1.00 10.00 H new ATOM 0 HG22 ILE A 42 26.662 3.121 -3.687 1.00 10.00 H new ATOM 0 HG23 ILE A 42 28.367 2.693 -3.963 1.00 10.00 H new ATOM 0 HD11 ILE A 42 28.696 0.694 -7.595 1.00 10.00 H new ATOM 0 HD12 ILE A 42 27.004 1.213 -7.406 1.00 10.00 H new ATOM 0 HD13 ILE A 42 28.324 2.249 -6.812 1.00 10.00 H new ATOM 573 N ARG A 43 26.195 2.095 -1.597 1.00 10.00 N ATOM 574 CA ARG A 43 25.281 2.728 -0.649 1.00 10.00 C ATOM 575 C ARG A 43 24.042 3.345 -1.312 1.00 10.00 C ATOM 576 O ARG A 43 23.583 4.406 -0.881 1.00 10.00 O ATOM 577 CB ARG A 43 26.036 3.750 0.214 1.00 10.00 C ATOM 578 CG ARG A 43 26.571 4.955 -0.575 1.00 10.00 C ATOM 579 CD ARG A 43 27.627 5.735 0.227 1.00 10.00 C ATOM 580 NE ARG A 43 27.228 7.138 0.432 1.00 10.00 N ATOM 581 CZ ARG A 43 27.514 8.190 -0.349 1.00 10.00 C ATOM 582 NH1 ARG A 43 28.270 8.051 -1.443 1.00 10.00 N ATOM 583 NH2 ARG A 43 27.007 9.379 -0.016 1.00 10.00 N ATOM 0 H ARG A 43 27.058 2.621 -1.734 1.00 10.00 H new ATOM 0 HA ARG A 43 24.896 1.939 -0.003 1.00 10.00 H new ATOM 0 HB2 ARG A 43 25.372 4.109 1.000 1.00 10.00 H new ATOM 0 HB3 ARG A 43 26.871 3.250 0.705 1.00 10.00 H new ATOM 0 HG2 ARG A 43 27.007 4.612 -1.513 1.00 10.00 H new ATOM 0 HG3 ARG A 43 25.745 5.618 -0.831 1.00 10.00 H new ATOM 0 HD2 ARG A 43 27.778 5.255 1.194 1.00 10.00 H new ATOM 0 HD3 ARG A 43 28.581 5.701 -0.298 1.00 10.00 H new ATOM 0 HE ARG A 43 26.670 7.332 1.264 1.00 10.00 H new ATOM 0 HH11 ARG A 43 28.639 7.134 -1.695 1.00 10.00 H new ATOM 0 HH12 ARG A 43 28.478 8.862 -2.026 1.00 10.00 H new ATOM 0 HH21 ARG A 43 26.420 9.469 0.813 1.00 10.00 H new ATOM 0 HH22 ARG A 43 27.207 10.198 -0.591 1.00 10.00 H new ATOM 597 N ASP A 44 23.476 2.684 -2.322 1.00 10.00 N ATOM 598 CA ASP A 44 22.116 2.938 -2.757 1.00 10.00 C ATOM 599 C ASP A 44 21.257 1.799 -2.241 1.00 10.00 C ATOM 600 O ASP A 44 21.761 0.741 -1.870 1.00 10.00 O ATOM 601 CB ASP A 44 22.010 3.154 -4.273 1.00 10.00 C ATOM 602 CG ASP A 44 21.746 1.891 -5.094 1.00 10.00 C ATOM 603 OD1 ASP A 44 20.596 1.399 -5.048 1.00 10.00 O ATOM 604 OD2 ASP A 44 22.677 1.479 -5.814 1.00 10.00 O ATOM 0 H ASP A 44 23.953 1.959 -2.857 1.00 10.00 H new ATOM 0 HA ASP A 44 21.754 3.878 -2.341 1.00 10.00 H new ATOM 0 HB2 ASP A 44 21.210 3.868 -4.467 1.00 10.00 H new ATOM 0 HB3 ASP A 44 22.936 3.610 -4.625 1.00 10.00 H new ATOM 609 N THR A 45 19.962 2.053 -2.142 1.00 10.00 N ATOM 610 CA THR A 45 19.003 1.047 -1.759 1.00 10.00 C ATOM 611 C THR A 45 17.654 1.492 -2.304 1.00 10.00 C ATOM 612 O THR A 45 17.574 2.458 -3.065 1.00 10.00 O ATOM 613 CB THR A 45 19.031 0.868 -0.233 1.00 10.00 C ATOM 614 OG1 THR A 45 18.157 -0.163 0.180 1.00 10.00 O ATOM 615 CG2 THR A 45 18.683 2.153 0.522 1.00 10.00 C ATOM 0 H THR A 45 19.552 2.968 -2.327 1.00 10.00 H new ATOM 0 HA THR A 45 19.231 0.065 -2.174 1.00 10.00 H new ATOM 0 HB THR A 45 20.058 0.599 0.014 1.00 10.00 H new ATOM 0 HG1 THR A 45 18.457 -0.521 1.042 1.00 10.00 H new ATOM 0 HG21 THR A 45 18.719 1.966 1.595 1.00 10.00 H new ATOM 0 HG22 THR A 45 19.401 2.932 0.265 1.00 10.00 H new ATOM 0 HG23 THR A 45 17.681 2.478 0.244 1.00 10.00 H new ATOM 623 N ALA A 46 16.592 0.820 -1.874 1.00 10.00 N ATOM 624 CA ALA A 46 15.228 1.202 -2.157 1.00 10.00 C ATOM 625 C ALA A 46 14.373 0.811 -0.962 1.00 10.00 C ATOM 626 O ALA A 46 14.773 -0.053 -0.174 1.00 10.00 O ATOM 627 CB ALA A 46 14.741 0.510 -3.431 1.00 10.00 C ATOM 0 H ALA A 46 16.665 -0.024 -1.306 1.00 10.00 H new ATOM 0 HA ALA A 46 15.158 2.277 -2.321 1.00 10.00 H new ATOM 0 HB1 ALA A 46 13.712 0.805 -3.635 1.00 10.00 H new ATOM 0 HB2 ALA A 46 15.375 0.802 -4.269 1.00 10.00 H new ATOM 0 HB3 ALA A 46 14.789 -0.571 -3.299 1.00 10.00 H new ATOM 633 N ALA A 47 13.193 1.424 -0.851 1.00 10.00 N ATOM 634 CA ALA A 47 12.180 0.922 0.058 1.00 10.00 C ATOM 635 C ALA A 47 11.428 -0.218 -0.634 1.00 10.00 C ATOM 636 O ALA A 47 11.517 -0.371 -1.853 1.00 10.00 O ATOM 637 CB ALA A 47 11.273 2.053 0.549 1.00 10.00 C ATOM 0 H ALA A 47 12.924 2.257 -1.375 1.00 10.00 H new ATOM 0 HA ALA A 47 12.639 0.517 0.960 1.00 10.00 H new ATOM 0 HB1 ALA A 47 10.523 1.649 1.229 1.00 10.00 H new ATOM 0 HB2 ALA A 47 11.872 2.799 1.072 1.00 10.00 H new ATOM 0 HB3 ALA A 47 10.777 2.518 -0.303 1.00 10.00 H new ATOM 643 N TYR A 48 10.730 -1.041 0.150 1.00 10.00 N ATOM 644 CA TYR A 48 9.986 -2.201 -0.309 1.00 10.00 C ATOM 645 C TYR A 48 8.630 -2.159 0.390 1.00 10.00 C ATOM 646 O TYR A 48 8.543 -2.403 1.594 1.00 10.00 O ATOM 647 CB TYR A 48 10.748 -3.495 -0.024 1.00 10.00 C ATOM 648 CG TYR A 48 11.875 -3.812 -0.993 1.00 10.00 C ATOM 649 CD1 TYR A 48 13.055 -3.044 -1.007 1.00 10.00 C ATOM 650 CD2 TYR A 48 11.767 -4.928 -1.846 1.00 10.00 C ATOM 651 CE1 TYR A 48 14.116 -3.400 -1.855 1.00 10.00 C ATOM 652 CE2 TYR A 48 12.875 -5.349 -2.602 1.00 10.00 C ATOM 653 CZ TYR A 48 14.072 -4.618 -2.548 1.00 10.00 C ATOM 654 OH TYR A 48 15.204 -5.113 -3.123 1.00 10.00 O ATOM 0 H TYR A 48 10.669 -0.907 1.159 1.00 10.00 H new ATOM 0 HA TYR A 48 9.848 -2.178 -1.390 1.00 10.00 H new ATOM 0 HB2 TYR A 48 11.162 -3.439 0.983 1.00 10.00 H new ATOM 0 HB3 TYR A 48 10.040 -4.324 -0.032 1.00 10.00 H new ATOM 0 HD1 TYR A 48 13.144 -2.180 -0.365 1.00 10.00 H new ATOM 0 HD2 TYR A 48 10.831 -5.461 -1.919 1.00 10.00 H new ATOM 0 HE1 TYR A 48 14.962 -2.739 -1.973 1.00 10.00 H new ATOM 0 HE2 TYR A 48 12.805 -6.231 -3.222 1.00 10.00 H new ATOM 0 HH TYR A 48 15.002 -5.965 -3.563 1.00 10.00 H new ATOM 664 N MET A 49 7.607 -1.731 -0.349 1.00 10.00 N ATOM 665 CA MET A 49 6.240 -1.512 0.100 1.00 10.00 C ATOM 666 C MET A 49 5.302 -1.465 -1.116 1.00 10.00 C ATOM 667 O MET A 49 5.681 -1.868 -2.213 1.00 10.00 O ATOM 668 CB MET A 49 6.152 -0.299 1.035 1.00 10.00 C ATOM 669 CG MET A 49 5.169 -0.503 2.199 1.00 10.00 C ATOM 670 SD MET A 49 5.694 -1.439 3.670 1.00 10.00 S ATOM 671 CE MET A 49 5.597 -3.172 3.168 1.00 10.00 C ATOM 0 H MET A 49 7.722 -1.515 -1.339 1.00 10.00 H new ATOM 0 HA MET A 49 5.902 -2.348 0.712 1.00 10.00 H new ATOM 0 HB2 MET A 49 7.142 -0.086 1.437 1.00 10.00 H new ATOM 0 HB3 MET A 49 5.847 0.575 0.459 1.00 10.00 H new ATOM 0 HG2 MET A 49 4.855 0.485 2.537 1.00 10.00 H new ATOM 0 HG3 MET A 49 4.286 -0.998 1.796 1.00 10.00 H new ATOM 0 HE1 MET A 49 5.421 -3.795 4.045 1.00 10.00 H new ATOM 0 HE2 MET A 49 4.778 -3.301 2.460 1.00 10.00 H new ATOM 0 HE3 MET A 49 6.534 -3.467 2.696 1.00 10.00 H new ATOM 681 N THR A 50 4.040 -1.074 -0.941 1.00 10.00 N ATOM 682 CA THR A 50 3.063 -1.015 -2.015 1.00 10.00 C ATOM 683 C THR A 50 2.085 0.132 -1.739 1.00 10.00 C ATOM 684 O THR A 50 1.455 0.167 -0.681 1.00 10.00 O ATOM 685 CB THR A 50 2.386 -2.391 -2.098 1.00 10.00 C ATOM 686 OG1 THR A 50 3.300 -3.331 -2.631 1.00 10.00 O ATOM 687 CG2 THR A 50 1.131 -2.390 -2.963 1.00 10.00 C ATOM 0 H THR A 50 3.668 -0.787 -0.036 1.00 10.00 H new ATOM 0 HA THR A 50 3.518 -0.805 -2.983 1.00 10.00 H new ATOM 0 HB THR A 50 2.086 -2.656 -1.084 1.00 10.00 H new ATOM 0 HG1 THR A 50 4.188 -2.921 -2.700 1.00 10.00 H new ATOM 0 HG21 THR A 50 0.700 -3.391 -2.981 1.00 10.00 H new ATOM 0 HG22 THR A 50 0.405 -1.690 -2.550 1.00 10.00 H new ATOM 0 HG23 THR A 50 1.389 -2.088 -3.978 1.00 10.00 H new ATOM 695 N LEU A 51 1.937 1.059 -2.691 1.00 10.00 N ATOM 696 CA LEU A 51 0.914 2.089 -2.623 1.00 10.00 C ATOM 697 C LEU A 51 -0.358 1.444 -3.130 1.00 10.00 C ATOM 698 O LEU A 51 -0.340 0.785 -4.166 1.00 10.00 O ATOM 699 CB LEU A 51 1.238 3.293 -3.511 1.00 10.00 C ATOM 700 CG LEU A 51 2.362 4.207 -3.012 1.00 10.00 C ATOM 701 CD1 LEU A 51 2.284 4.521 -1.518 1.00 10.00 C ATOM 702 CD2 LEU A 51 3.753 3.678 -3.380 1.00 10.00 C ATOM 0 H LEU A 51 2.524 1.110 -3.524 1.00 10.00 H new ATOM 0 HA LEU A 51 0.834 2.459 -1.601 1.00 10.00 H new ATOM 0 HB2 LEU A 51 1.506 2.928 -4.502 1.00 10.00 H new ATOM 0 HB3 LEU A 51 0.333 3.890 -3.625 1.00 10.00 H new ATOM 0 HG LEU A 51 2.205 5.148 -3.538 1.00 10.00 H new ATOM 0 HD11 LEU A 51 3.112 5.172 -1.239 1.00 10.00 H new ATOM 0 HD12 LEU A 51 1.340 5.021 -1.300 1.00 10.00 H new ATOM 0 HD13 LEU A 51 2.344 3.594 -0.948 1.00 10.00 H new ATOM 0 HD21 LEU A 51 4.514 4.362 -3.004 1.00 10.00 H new ATOM 0 HD22 LEU A 51 3.898 2.694 -2.935 1.00 10.00 H new ATOM 0 HD23 LEU A 51 3.838 3.602 -4.464 1.00 10.00 H new ATOM 714 N THR A 52 -1.432 1.586 -2.356 1.00 10.00 N ATOM 715 CA THR A 52 -2.575 0.701 -2.426 1.00 10.00 C ATOM 716 C THR A 52 -3.842 1.495 -2.747 1.00 10.00 C ATOM 717 O THR A 52 -4.510 1.979 -1.833 1.00 10.00 O ATOM 718 CB THR A 52 -2.646 -0.052 -1.086 1.00 10.00 C ATOM 719 OG1 THR A 52 -1.428 -0.739 -0.852 1.00 10.00 O ATOM 720 CG2 THR A 52 -3.768 -1.092 -1.069 1.00 10.00 C ATOM 0 H THR A 52 -1.527 2.326 -1.660 1.00 10.00 H new ATOM 0 HA THR A 52 -2.479 -0.027 -3.231 1.00 10.00 H new ATOM 0 HB THR A 52 -2.836 0.696 -0.316 1.00 10.00 H new ATOM 0 HG1 THR A 52 -1.480 -1.215 0.003 1.00 10.00 H new ATOM 0 HG21 THR A 52 -3.780 -1.598 -0.104 1.00 10.00 H new ATOM 0 HG22 THR A 52 -4.725 -0.597 -1.231 1.00 10.00 H new ATOM 0 HG23 THR A 52 -3.599 -1.823 -1.860 1.00 10.00 H new ATOM 728 N ASN A 53 -4.228 1.565 -4.029 1.00 10.00 N ATOM 729 CA ASN A 53 -5.475 2.227 -4.432 1.00 10.00 C ATOM 730 C ASN A 53 -6.710 1.366 -4.155 1.00 10.00 C ATOM 731 O ASN A 53 -7.560 1.119 -5.009 1.00 10.00 O ATOM 732 CB ASN A 53 -5.416 2.631 -5.910 1.00 10.00 C ATOM 733 CG ASN A 53 -5.422 4.139 -6.050 1.00 10.00 C ATOM 734 OD1 ASN A 53 -6.479 4.736 -6.208 1.00 10.00 O ATOM 735 ND2 ASN A 53 -4.256 4.759 -5.990 1.00 10.00 N ATOM 0 H ASN A 53 -3.694 1.171 -4.804 1.00 10.00 H new ATOM 0 HA ASN A 53 -5.572 3.126 -3.823 1.00 10.00 H new ATOM 0 HB2 ASN A 53 -4.516 2.221 -6.369 1.00 10.00 H new ATOM 0 HB3 ASN A 53 -6.267 2.207 -6.443 1.00 10.00 H new ATOM 0 HD21 ASN A 53 -4.213 5.774 -6.077 1.00 10.00 H new ATOM 0 HD22 ASN A 53 -3.399 4.222 -5.857 1.00 10.00 H new ATOM 742 N LYS A 54 -6.892 1.007 -2.890 1.00 10.00 N ATOM 743 CA LYS A 54 -8.072 0.287 -2.436 1.00 10.00 C ATOM 744 C LYS A 54 -9.167 1.324 -2.164 1.00 10.00 C ATOM 745 O LYS A 54 -9.641 1.447 -1.038 1.00 10.00 O ATOM 746 CB LYS A 54 -7.666 -0.575 -1.228 1.00 10.00 C ATOM 747 CG LYS A 54 -8.825 -1.346 -0.580 1.00 10.00 C ATOM 748 CD LYS A 54 -8.337 -2.526 0.274 1.00 10.00 C ATOM 749 CE LYS A 54 -7.499 -2.052 1.472 1.00 10.00 C ATOM 750 NZ LYS A 54 -7.098 -3.172 2.349 1.00 10.00 N ATOM 0 H LYS A 54 -6.222 1.209 -2.148 1.00 10.00 H new ATOM 0 HA LYS A 54 -8.480 -0.405 -3.173 1.00 10.00 H new ATOM 0 HB2 LYS A 54 -6.904 -1.287 -1.545 1.00 10.00 H new ATOM 0 HB3 LYS A 54 -7.208 0.068 -0.476 1.00 10.00 H new ATOM 0 HG2 LYS A 54 -9.407 -0.666 0.043 1.00 10.00 H new ATOM 0 HG3 LYS A 54 -9.492 -1.716 -1.358 1.00 10.00 H new ATOM 0 HD2 LYS A 54 -9.195 -3.095 0.632 1.00 10.00 H new ATOM 0 HD3 LYS A 54 -7.742 -3.200 -0.342 1.00 10.00 H new ATOM 0 HE2 LYS A 54 -6.608 -1.539 1.110 1.00 10.00 H new ATOM 0 HE3 LYS A 54 -8.072 -1.327 2.050 1.00 10.00 H new ATOM 0 HZ1 LYS A 54 -6.535 -2.807 3.143 1.00 10.00 H new ATOM 0 HZ2 LYS A 54 -7.947 -3.647 2.716 1.00 10.00 H new ATOM 0 HZ3 LYS A 54 -6.529 -3.852 1.805 1.00 10.00 H new ATOM 764 N SER A 55 -9.532 2.099 -3.196 1.00 10.00 N ATOM 765 CA SER A 55 -10.457 3.228 -3.065 1.00 10.00 C ATOM 766 C SER A 55 -10.727 3.969 -4.383 1.00 10.00 C ATOM 767 O SER A 55 -11.807 4.534 -4.529 1.00 10.00 O ATOM 768 CB SER A 55 -9.933 4.250 -2.043 1.00 10.00 C ATOM 769 OG SER A 55 -10.997 4.939 -1.417 1.00 10.00 O ATOM 0 H SER A 55 -9.191 1.958 -4.147 1.00 10.00 H new ATOM 0 HA SER A 55 -11.395 2.784 -2.732 1.00 10.00 H new ATOM 0 HB2 SER A 55 -9.333 3.740 -1.289 1.00 10.00 H new ATOM 0 HB3 SER A 55 -9.278 4.964 -2.542 1.00 10.00 H new ATOM 0 HG SER A 55 -10.636 5.582 -0.772 1.00 10.00 H new ATOM 775 N ASP A 56 -9.740 4.033 -5.291 1.00 10.00 N ATOM 776 CA ASP A 56 -9.724 4.902 -6.466 1.00 10.00 C ATOM 777 C ASP A 56 -9.603 6.377 -6.090 1.00 10.00 C ATOM 778 O ASP A 56 -10.601 7.095 -6.036 1.00 10.00 O ATOM 779 CB ASP A 56 -10.891 4.641 -7.438 1.00 10.00 C ATOM 780 CG ASP A 56 -10.645 3.478 -8.374 1.00 10.00 C ATOM 781 OD1 ASP A 56 -9.476 3.069 -8.517 1.00 10.00 O ATOM 782 OD2 ASP A 56 -11.600 3.080 -9.076 1.00 10.00 O ATOM 0 H ASP A 56 -8.902 3.456 -5.219 1.00 10.00 H new ATOM 0 HA ASP A 56 -8.821 4.637 -7.016 1.00 10.00 H new ATOM 0 HB2 ASP A 56 -11.797 4.450 -6.863 1.00 10.00 H new ATOM 0 HB3 ASP A 56 -11.071 5.540 -8.027 1.00 10.00 H new ATOM 787 N GLN A 57 -8.367 6.846 -5.883 1.00 10.00 N ATOM 788 CA GLN A 57 -8.033 8.258 -5.826 1.00 10.00 C ATOM 789 C GLN A 57 -6.609 8.479 -6.377 1.00 10.00 C ATOM 790 O GLN A 57 -5.737 7.643 -6.139 1.00 10.00 O ATOM 791 CB GLN A 57 -8.087 8.767 -4.384 1.00 10.00 C ATOM 792 CG GLN A 57 -9.482 8.979 -3.779 1.00 10.00 C ATOM 793 CD GLN A 57 -9.909 7.842 -2.857 1.00 10.00 C ATOM 794 OE1 GLN A 57 -9.396 7.715 -1.748 1.00 10.00 O ATOM 795 NE2 GLN A 57 -10.852 7.016 -3.291 1.00 10.00 N ATOM 0 H GLN A 57 -7.561 6.235 -5.749 1.00 10.00 H new ATOM 0 HA GLN A 57 -8.758 8.805 -6.428 1.00 10.00 H new ATOM 0 HB2 GLN A 57 -7.547 8.061 -3.754 1.00 10.00 H new ATOM 0 HB3 GLN A 57 -7.548 9.713 -4.337 1.00 10.00 H new ATOM 0 HG2 GLN A 57 -9.492 9.915 -3.221 1.00 10.00 H new ATOM 0 HG3 GLN A 57 -10.210 9.080 -4.584 1.00 10.00 H new ATOM 0 HE21 GLN A 57 -11.259 7.148 -4.217 1.00 10.00 H new ATOM 0 HE22 GLN A 57 -11.170 6.249 -2.699 1.00 10.00 H new ATOM 804 N PRO A 58 -6.349 9.598 -7.078 1.00 10.00 N ATOM 805 CA PRO A 58 -5.024 9.960 -7.566 1.00 10.00 C ATOM 806 C PRO A 58 -4.237 10.766 -6.516 1.00 10.00 C ATOM 807 O PRO A 58 -4.472 11.964 -6.381 1.00 10.00 O ATOM 808 CB PRO A 58 -5.304 10.799 -8.818 1.00 10.00 C ATOM 809 CG PRO A 58 -6.608 11.524 -8.477 1.00 10.00 C ATOM 810 CD PRO A 58 -7.354 10.513 -7.604 1.00 10.00 C ATOM 0 HA PRO A 58 -4.407 9.087 -7.778 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -4.495 11.501 -9.020 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -5.412 10.174 -9.704 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -6.422 12.456 -7.944 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -7.174 11.777 -9.373 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -7.883 11.016 -6.794 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -8.102 9.975 -8.187 1.00 10.00 H new ATOM 818 N ILE A 59 -3.310 10.140 -5.776 1.00 10.00 N ATOM 819 CA ILE A 59 -2.537 10.793 -4.708 1.00 10.00 C ATOM 820 C ILE A 59 -1.065 10.881 -5.129 1.00 10.00 C ATOM 821 O ILE A 59 -0.331 9.899 -5.064 1.00 10.00 O ATOM 822 CB ILE A 59 -2.730 10.058 -3.358 1.00 10.00 C ATOM 823 CG1 ILE A 59 -4.024 10.469 -2.631 1.00 10.00 C ATOM 824 CG2 ILE A 59 -1.615 10.359 -2.341 1.00 10.00 C ATOM 825 CD1 ILE A 59 -5.299 10.356 -3.459 1.00 10.00 C ATOM 0 H ILE A 59 -3.073 9.156 -5.903 1.00 10.00 H new ATOM 0 HA ILE A 59 -2.903 11.809 -4.556 1.00 10.00 H new ATOM 0 HB ILE A 59 -2.740 9.008 -3.651 1.00 10.00 H new ATOM 0 HG12 ILE A 59 -4.133 9.851 -1.740 1.00 10.00 H new ATOM 0 HG13 ILE A 59 -3.920 11.500 -2.293 1.00 10.00 H new ATOM 0 HG21 ILE A 59 -1.809 9.814 -1.417 1.00 10.00 H new ATOM 0 HG22 ILE A 59 -0.654 10.048 -2.751 1.00 10.00 H new ATOM 0 HG23 ILE A 59 -1.591 11.429 -2.133 1.00 10.00 H new ATOM 0 HD11 ILE A 59 -6.153 10.668 -2.857 1.00 10.00 H new ATOM 0 HD12 ILE A 59 -5.221 10.997 -4.337 1.00 10.00 H new ATOM 0 HD13 ILE A 59 -5.437 9.322 -3.775 1.00 10.00 H new ATOM 837 N LYS A 60 -0.601 12.059 -5.544 1.00 10.00 N ATOM 838 CA LYS A 60 0.746 12.235 -6.060 1.00 10.00 C ATOM 839 C LYS A 60 1.735 12.408 -4.899 1.00 10.00 C ATOM 840 O LYS A 60 1.891 13.498 -4.340 1.00 10.00 O ATOM 841 CB LYS A 60 0.749 13.329 -7.145 1.00 10.00 C ATOM 842 CG LYS A 60 0.675 14.790 -6.680 1.00 10.00 C ATOM 843 CD LYS A 60 0.331 15.731 -7.856 1.00 10.00 C ATOM 844 CE LYS A 60 -0.896 16.615 -7.572 1.00 10.00 C ATOM 845 NZ LYS A 60 -2.133 15.829 -7.401 1.00 10.00 N ATOM 0 H LYS A 60 -1.153 12.916 -5.530 1.00 10.00 H new ATOM 0 HA LYS A 60 1.102 11.344 -6.577 1.00 10.00 H new ATOM 0 HB2 LYS A 60 1.655 13.211 -7.739 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -0.095 13.145 -7.810 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -0.079 14.889 -5.899 1.00 10.00 H new ATOM 0 HG3 LYS A 60 1.629 15.084 -6.242 1.00 10.00 H new ATOM 0 HD2 LYS A 60 1.190 16.367 -8.070 1.00 10.00 H new ATOM 0 HD3 LYS A 60 0.145 15.135 -8.750 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -0.716 17.202 -6.672 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -1.029 17.321 -8.392 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -2.794 16.351 -6.791 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -2.572 15.667 -8.330 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -1.905 14.914 -6.961 1.00 10.00 H new ATOM 859 N LEU A 61 2.386 11.303 -4.516 1.00 10.00 N ATOM 860 CA LEU A 61 3.282 11.258 -3.370 1.00 10.00 C ATOM 861 C LEU A 61 4.661 11.788 -3.766 1.00 10.00 C ATOM 862 O LEU A 61 5.224 11.343 -4.760 1.00 10.00 O ATOM 863 CB LEU A 61 3.203 9.902 -2.641 1.00 10.00 C ATOM 864 CG LEU A 61 4.101 8.731 -3.067 1.00 10.00 C ATOM 865 CD1 LEU A 61 3.934 8.326 -4.536 1.00 10.00 C ATOM 866 CD2 LEU A 61 5.561 8.970 -2.666 1.00 10.00 C ATOM 0 H LEU A 61 2.300 10.410 -5.002 1.00 10.00 H new ATOM 0 HA LEU A 61 2.961 11.944 -2.586 1.00 10.00 H new ATOM 0 HB2 LEU A 61 3.402 10.092 -1.586 1.00 10.00 H new ATOM 0 HB3 LEU A 61 2.171 9.558 -2.713 1.00 10.00 H new ATOM 0 HG LEU A 61 3.756 7.860 -2.509 1.00 10.00 H new ATOM 0 HD11 LEU A 61 4.600 7.493 -4.762 1.00 10.00 H new ATOM 0 HD12 LEU A 61 2.902 8.024 -4.715 1.00 10.00 H new ATOM 0 HD13 LEU A 61 4.181 9.172 -5.177 1.00 10.00 H new ATOM 0 HD21 LEU A 61 6.169 8.122 -2.982 1.00 10.00 H new ATOM 0 HD22 LEU A 61 5.926 9.878 -3.146 1.00 10.00 H new ATOM 0 HD23 LEU A 61 5.628 9.080 -1.584 1.00 10.00 H new ATOM 878 N VAL A 62 5.178 12.802 -3.059 1.00 10.00 N ATOM 879 CA VAL A 62 6.430 13.459 -3.419 1.00 10.00 C ATOM 880 C VAL A 62 7.167 13.886 -2.149 1.00 10.00 C ATOM 881 O VAL A 62 7.556 15.039 -1.972 1.00 10.00 O ATOM 882 CB VAL A 62 6.144 14.606 -4.407 1.00 10.00 C ATOM 883 CG1 VAL A 62 5.251 15.724 -3.856 1.00 10.00 C ATOM 884 CG2 VAL A 62 7.423 15.158 -5.045 1.00 10.00 C ATOM 0 H VAL A 62 4.736 13.185 -2.223 1.00 10.00 H new ATOM 0 HA VAL A 62 7.100 12.775 -3.939 1.00 10.00 H new ATOM 0 HB VAL A 62 5.553 14.140 -5.196 1.00 10.00 H new ATOM 0 HG11 VAL A 62 5.106 16.485 -4.623 1.00 10.00 H new ATOM 0 HG12 VAL A 62 4.285 15.310 -3.569 1.00 10.00 H new ATOM 0 HG13 VAL A 62 5.727 16.173 -2.984 1.00 10.00 H new ATOM 0 HG21 VAL A 62 7.168 15.964 -5.733 1.00 10.00 H new ATOM 0 HG22 VAL A 62 8.082 15.541 -4.266 1.00 10.00 H new ATOM 0 HG23 VAL A 62 7.930 14.362 -5.591 1.00 10.00 H new ATOM 894 N GLY A 63 7.398 12.924 -1.257 1.00 10.00 N ATOM 895 CA GLY A 63 8.287 13.116 -0.133 1.00 10.00 C ATOM 896 C GLY A 63 8.725 11.764 0.400 1.00 10.00 C ATOM 897 O GLY A 63 7.938 10.819 0.400 1.00 10.00 O ATOM 0 H GLY A 63 6.973 11.998 -1.300 1.00 10.00 H new ATOM 0 HA2 GLY A 63 9.157 13.698 -0.438 1.00 10.00 H new ATOM 0 HA3 GLY A 63 7.783 13.682 0.650 1.00 10.00 H new ATOM 901 N ALA A 64 9.967 11.705 0.869 1.00 10.00 N ATOM 902 CA ALA A 64 10.523 10.632 1.673 1.00 10.00 C ATOM 903 C ALA A 64 11.720 11.205 2.430 1.00 10.00 C ATOM 904 O ALA A 64 12.864 10.825 2.192 1.00 10.00 O ATOM 905 CB ALA A 64 10.910 9.448 0.788 1.00 10.00 C ATOM 0 H ALA A 64 10.645 12.445 0.687 1.00 10.00 H new ATOM 0 HA ALA A 64 9.792 10.252 2.386 1.00 10.00 H new ATOM 0 HB1 ALA A 64 11.325 8.652 1.406 1.00 10.00 H new ATOM 0 HB2 ALA A 64 10.027 9.079 0.267 1.00 10.00 H new ATOM 0 HB3 ALA A 64 11.655 9.767 0.059 1.00 10.00 H new ATOM 911 N ALA A 65 11.454 12.156 3.324 1.00 10.00 N ATOM 912 CA ALA A 65 12.481 12.832 4.098 1.00 10.00 C ATOM 913 C ALA A 65 12.844 11.925 5.267 1.00 10.00 C ATOM 914 O ALA A 65 12.016 11.131 5.711 1.00 10.00 O ATOM 915 CB ALA A 65 11.952 14.181 4.590 1.00 10.00 C ATOM 0 H ALA A 65 10.508 12.478 3.530 1.00 10.00 H new ATOM 0 HA ALA A 65 13.367 13.027 3.493 1.00 10.00 H new ATOM 0 HB1 ALA A 65 12.725 14.685 5.170 1.00 10.00 H new ATOM 0 HB2 ALA A 65 11.679 14.799 3.734 1.00 10.00 H new ATOM 0 HB3 ALA A 65 11.074 14.021 5.216 1.00 10.00 H new ATOM 921 N THR A 66 14.095 11.976 5.725 1.00 10.00 N ATOM 922 CA THR A 66 14.624 10.934 6.584 1.00 10.00 C ATOM 923 C THR A 66 15.970 11.372 7.158 1.00 10.00 C ATOM 924 O THR A 66 16.691 12.125 6.503 1.00 10.00 O ATOM 925 CB THR A 66 14.772 9.644 5.756 1.00 10.00 C ATOM 926 OG1 THR A 66 15.478 8.665 6.488 1.00 10.00 O ATOM 927 CG2 THR A 66 15.503 9.860 4.428 1.00 10.00 C ATOM 0 H THR A 66 14.753 12.726 5.513 1.00 10.00 H new ATOM 0 HA THR A 66 13.947 10.749 7.418 1.00 10.00 H new ATOM 0 HB THR A 66 13.756 9.315 5.538 1.00 10.00 H new ATOM 0 HG1 THR A 66 15.270 7.776 6.131 1.00 10.00 H new ATOM 0 HG21 THR A 66 15.574 8.913 3.893 1.00 10.00 H new ATOM 0 HG22 THR A 66 14.951 10.578 3.822 1.00 10.00 H new ATOM 0 HG23 THR A 66 16.505 10.243 4.622 1.00 10.00 H new ATOM 935 N PRO A 67 16.347 10.881 8.349 1.00 10.00 N ATOM 936 CA PRO A 67 17.699 11.013 8.860 1.00 10.00 C ATOM 937 C PRO A 67 18.659 9.991 8.221 1.00 10.00 C ATOM 938 O PRO A 67 19.846 10.017 8.541 1.00 10.00 O ATOM 939 CB PRO A 67 17.558 10.777 10.366 1.00 10.00 C ATOM 940 CG PRO A 67 16.441 9.737 10.435 1.00 10.00 C ATOM 941 CD PRO A 67 15.506 10.168 9.304 1.00 10.00 C ATOM 0 HA PRO A 67 18.129 11.987 8.627 1.00 10.00 H new ATOM 0 HB2 PRO A 67 18.484 10.408 10.807 1.00 10.00 H new ATOM 0 HB3 PRO A 67 17.294 11.692 10.897 1.00 10.00 H new ATOM 0 HG2 PRO A 67 16.820 8.726 10.284 1.00 10.00 H new ATOM 0 HG3 PRO A 67 15.938 9.747 11.402 1.00 10.00 H new ATOM 0 HD2 PRO A 67 15.030 9.305 8.839 1.00 10.00 H new ATOM 0 HD3 PRO A 67 14.708 10.809 9.678 1.00 10.00 H new ATOM 949 N LEU A 68 18.168 9.083 7.363 1.00 10.00 N ATOM 950 CA LEU A 68 18.866 7.861 6.959 1.00 10.00 C ATOM 951 C LEU A 68 19.515 7.959 5.572 1.00 10.00 C ATOM 952 O LEU A 68 20.625 7.464 5.360 1.00 10.00 O ATOM 953 CB LEU A 68 17.831 6.730 6.979 1.00 10.00 C ATOM 954 CG LEU A 68 18.431 5.316 6.986 1.00 10.00 C ATOM 955 CD1 LEU A 68 19.215 5.047 8.277 1.00 10.00 C ATOM 956 CD2 LEU A 68 17.291 4.298 6.858 1.00 10.00 C ATOM 0 H LEU A 68 17.253 9.184 6.923 1.00 10.00 H new ATOM 0 HA LEU A 68 19.687 7.680 7.652 1.00 10.00 H new ATOM 0 HB2 LEU A 68 17.200 6.848 7.860 1.00 10.00 H new ATOM 0 HB3 LEU A 68 17.184 6.832 6.108 1.00 10.00 H new ATOM 0 HG LEU A 68 19.123 5.225 6.149 1.00 10.00 H new ATOM 0 HD11 LEU A 68 19.626 4.038 8.249 1.00 10.00 H new ATOM 0 HD12 LEU A 68 20.028 5.768 8.366 1.00 10.00 H new ATOM 0 HD13 LEU A 68 18.549 5.144 9.134 1.00 10.00 H new ATOM 0 HD21 LEU A 68 17.702 3.289 6.862 1.00 10.00 H new ATOM 0 HD22 LEU A 68 16.605 4.413 7.697 1.00 10.00 H new ATOM 0 HD23 LEU A 68 16.755 4.468 5.924 1.00 10.00 H new ATOM 968 N ALA A 69 18.809 8.583 4.625 1.00 10.00 N ATOM 969 CA ALA A 69 19.236 8.727 3.238 1.00 10.00 C ATOM 970 C ALA A 69 19.812 10.118 3.011 1.00 10.00 C ATOM 971 O ALA A 69 19.146 11.111 3.300 1.00 10.00 O ATOM 972 CB ALA A 69 18.039 8.528 2.311 1.00 10.00 C ATOM 0 H ALA A 69 17.902 9.012 4.810 1.00 10.00 H new ATOM 0 HA ALA A 69 19.999 7.979 3.025 1.00 10.00 H new ATOM 0 HB1 ALA A 69 18.359 8.636 1.275 1.00 10.00 H new ATOM 0 HB2 ALA A 69 17.625 7.531 2.461 1.00 10.00 H new ATOM 0 HB3 ALA A 69 17.277 9.275 2.535 1.00 10.00 H new ATOM 978 N THR A 70 21.032 10.201 2.484 1.00 10.00 N ATOM 979 CA THR A 70 21.642 11.458 2.072 1.00 10.00 C ATOM 980 C THR A 70 20.976 11.961 0.789 1.00 10.00 C ATOM 981 O THR A 70 20.884 13.166 0.573 1.00 10.00 O ATOM 982 CB THR A 70 23.154 11.251 1.894 1.00 10.00 C ATOM 983 OG1 THR A 70 23.605 10.343 2.882 1.00 10.00 O ATOM 984 CG2 THR A 70 23.927 12.564 2.036 1.00 10.00 C ATOM 0 H THR A 70 21.629 9.388 2.331 1.00 10.00 H new ATOM 0 HA THR A 70 21.494 12.220 2.837 1.00 10.00 H new ATOM 0 HB THR A 70 23.331 10.862 0.891 1.00 10.00 H new ATOM 0 HG1 THR A 70 24.463 9.959 2.606 1.00 10.00 H new ATOM 0 HG21 THR A 70 24.992 12.375 1.904 1.00 10.00 H new ATOM 0 HG22 THR A 70 23.587 13.270 1.279 1.00 10.00 H new ATOM 0 HG23 THR A 70 23.753 12.983 3.027 1.00 10.00 H new ATOM 992 N SER A 71 20.507 11.027 -0.043 1.00 10.00 N ATOM 993 CA SER A 71 20.009 11.280 -1.381 1.00 10.00 C ATOM 994 C SER A 71 18.650 10.593 -1.577 1.00 10.00 C ATOM 995 O SER A 71 18.569 9.642 -2.352 1.00 10.00 O ATOM 996 CB SER A 71 21.056 10.740 -2.366 1.00 10.00 C ATOM 997 OG SER A 71 22.343 11.250 -2.056 1.00 10.00 O ATOM 0 H SER A 71 20.466 10.041 0.214 1.00 10.00 H new ATOM 0 HA SER A 71 19.856 12.346 -1.549 1.00 10.00 H new ATOM 0 HB2 SER A 71 21.072 9.651 -2.328 1.00 10.00 H new ATOM 0 HB3 SER A 71 20.784 11.019 -3.384 1.00 10.00 H new ATOM 0 HG SER A 71 22.998 10.894 -2.692 1.00 10.00 H new ATOM 1003 N PRO A 72 17.586 11.038 -0.889 1.00 10.00 N ATOM 1004 CA PRO A 72 16.254 10.483 -1.056 1.00 10.00 C ATOM 1005 C PRO A 72 15.621 10.990 -2.350 1.00 10.00 C ATOM 1006 O PRO A 72 15.334 12.180 -2.473 1.00 10.00 O ATOM 1007 CB PRO A 72 15.469 10.940 0.177 1.00 10.00 C ATOM 1008 CG PRO A 72 16.127 12.274 0.538 1.00 10.00 C ATOM 1009 CD PRO A 72 17.589 12.071 0.136 1.00 10.00 C ATOM 0 HA PRO A 72 16.265 9.396 -1.134 1.00 10.00 H new ATOM 0 HB2 PRO A 72 14.408 11.061 -0.043 1.00 10.00 H new ATOM 0 HB3 PRO A 72 15.545 10.220 0.992 1.00 10.00 H new ATOM 0 HG2 PRO A 72 15.674 13.105 -0.003 1.00 10.00 H new ATOM 0 HG3 PRO A 72 16.030 12.495 1.601 1.00 10.00 H new ATOM 0 HD2 PRO A 72 18.021 12.997 -0.245 1.00 10.00 H new ATOM 0 HD3 PRO A 72 18.190 11.768 0.993 1.00 10.00 H new ATOM 1017 N MET A 73 15.387 10.089 -3.309 1.00 10.00 N ATOM 1018 CA MET A 73 14.813 10.440 -4.601 1.00 10.00 C ATOM 1019 C MET A 73 13.826 9.369 -5.066 1.00 10.00 C ATOM 1020 O MET A 73 14.061 8.179 -4.869 1.00 10.00 O ATOM 1021 CB MET A 73 15.947 10.615 -5.616 1.00 10.00 C ATOM 1022 CG MET A 73 16.630 11.986 -5.498 1.00 10.00 C ATOM 1023 SD MET A 73 18.159 12.022 -4.530 1.00 10.00 S ATOM 1024 CE MET A 73 18.488 13.798 -4.525 1.00 10.00 C ATOM 0 H MET A 73 15.592 9.095 -3.206 1.00 10.00 H new ATOM 0 HA MET A 73 14.260 11.375 -4.511 1.00 10.00 H new ATOM 0 HB2 MET A 73 16.688 9.829 -5.469 1.00 10.00 H new ATOM 0 HB3 MET A 73 15.551 10.495 -6.624 1.00 10.00 H new ATOM 0 HG2 MET A 73 16.849 12.350 -6.502 1.00 10.00 H new ATOM 0 HG3 MET A 73 15.923 12.686 -5.052 1.00 10.00 H new ATOM 0 HE1 MET A 73 19.403 13.997 -3.966 1.00 10.00 H new ATOM 0 HE2 MET A 73 18.605 14.149 -5.550 1.00 10.00 H new ATOM 0 HE3 MET A 73 17.655 14.321 -4.055 1.00 10.00 H new ATOM 1034 N LEU A 74 12.725 9.798 -5.686 1.00 10.00 N ATOM 1035 CA LEU A 74 11.677 8.932 -6.211 1.00 10.00 C ATOM 1036 C LEU A 74 12.065 8.437 -7.610 1.00 10.00 C ATOM 1037 O LEU A 74 12.798 9.114 -8.331 1.00 10.00 O ATOM 1038 CB LEU A 74 10.354 9.725 -6.215 1.00 10.00 C ATOM 1039 CG LEU A 74 9.691 9.661 -4.829 1.00 10.00 C ATOM 1040 CD1 LEU A 74 8.799 10.880 -4.600 1.00 10.00 C ATOM 1041 CD2 LEU A 74 8.832 8.394 -4.718 1.00 10.00 C ATOM 0 H LEU A 74 12.536 10.789 -5.839 1.00 10.00 H new ATOM 0 HA LEU A 74 11.548 8.048 -5.587 1.00 10.00 H new ATOM 0 HB2 LEU A 74 10.545 10.763 -6.487 1.00 10.00 H new ATOM 0 HB3 LEU A 74 9.680 9.317 -6.968 1.00 10.00 H new ATOM 0 HG LEU A 74 10.480 9.646 -4.077 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.340 10.815 -3.614 1.00 10.00 H new ATOM 0 HD12 LEU A 74 9.400 11.787 -4.661 1.00 10.00 H new ATOM 0 HD13 LEU A 74 8.020 10.909 -5.362 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.366 8.356 -3.734 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.058 8.411 -5.486 1.00 10.00 H new ATOM 0 HD23 LEU A 74 9.461 7.515 -4.856 1.00 10.00 H new ATOM 1053 N MET A 75 11.607 7.235 -7.972 1.00 10.00 N ATOM 1054 CA MET A 75 11.993 6.511 -9.174 1.00 10.00 C ATOM 1055 C MET A 75 10.846 5.623 -9.634 1.00 10.00 C ATOM 1056 O MET A 75 9.951 5.336 -8.848 1.00 10.00 O ATOM 1057 CB MET A 75 13.153 5.565 -8.838 1.00 10.00 C ATOM 1058 CG MET A 75 14.172 5.476 -9.973 1.00 10.00 C ATOM 1059 SD MET A 75 15.890 5.937 -9.646 1.00 10.00 S ATOM 1060 CE MET A 75 15.721 7.355 -8.539 1.00 10.00 C ATOM 0 H MET A 75 10.929 6.723 -7.408 1.00 10.00 H new ATOM 0 HA MET A 75 12.264 7.237 -9.941 1.00 10.00 H new ATOM 0 HB2 MET A 75 13.650 5.910 -7.932 1.00 10.00 H new ATOM 0 HB3 MET A 75 12.759 4.571 -8.627 1.00 10.00 H new ATOM 0 HG2 MET A 75 14.170 4.449 -10.337 1.00 10.00 H new ATOM 0 HG3 MET A 75 13.812 6.104 -10.788 1.00 10.00 H new ATOM 0 HE1 MET A 75 16.649 7.926 -8.535 1.00 10.00 H new ATOM 0 HE2 MET A 75 14.905 7.990 -8.883 1.00 10.00 H new ATOM 0 HE3 MET A 75 15.507 7.005 -7.529 1.00 10.00 H new ATOM 1070 N THR A 76 10.950 5.057 -10.840 1.00 10.00 N ATOM 1071 CA THR A 76 10.093 3.941 -11.228 1.00 10.00 C ATOM 1072 C THR A 76 10.856 2.946 -12.098 1.00 10.00 C ATOM 1073 O THR A 76 11.876 3.287 -12.680 1.00 10.00 O ATOM 1074 CB THR A 76 8.810 4.464 -11.891 1.00 10.00 C ATOM 1075 OG1 THR A 76 8.003 3.395 -12.346 1.00 10.00 O ATOM 1076 CG2 THR A 76 9.146 5.418 -13.043 1.00 10.00 C ATOM 0 H THR A 76 11.614 5.352 -11.556 1.00 10.00 H new ATOM 0 HA THR A 76 9.788 3.392 -10.337 1.00 10.00 H new ATOM 0 HB THR A 76 8.245 5.018 -11.142 1.00 10.00 H new ATOM 0 HG1 THR A 76 8.453 2.937 -13.086 1.00 10.00 H new ATOM 0 HG21 THR A 76 8.223 5.777 -13.499 1.00 10.00 H new ATOM 0 HG22 THR A 76 9.715 6.265 -12.660 1.00 10.00 H new ATOM 0 HG23 THR A 76 9.739 4.891 -13.791 1.00 10.00 H new ATOM 1084 N THR A 77 10.392 1.699 -12.181 1.00 10.00 N ATOM 1085 CA THR A 77 10.931 0.700 -13.103 1.00 10.00 C ATOM 1086 C THR A 77 9.856 -0.350 -13.392 1.00 10.00 C ATOM 1087 O THR A 77 10.016 -1.530 -13.099 1.00 10.00 O ATOM 1088 CB THR A 77 12.230 0.071 -12.564 1.00 10.00 C ATOM 1089 OG1 THR A 77 12.928 0.980 -11.741 1.00 10.00 O ATOM 1090 CG2 THR A 77 13.137 -0.394 -13.707 1.00 10.00 C ATOM 0 H THR A 77 9.625 1.351 -11.605 1.00 10.00 H new ATOM 0 HA THR A 77 11.201 1.187 -14.040 1.00 10.00 H new ATOM 0 HB THR A 77 11.947 -0.798 -11.969 1.00 10.00 H new ATOM 0 HG1 THR A 77 12.523 0.991 -10.849 1.00 10.00 H new ATOM 0 HG21 THR A 77 14.045 -0.833 -13.295 1.00 10.00 H new ATOM 0 HG22 THR A 77 12.614 -1.139 -14.307 1.00 10.00 H new ATOM 0 HG23 THR A 77 13.398 0.458 -14.334 1.00 10.00 H new ATOM 1098 N THR A 78 8.727 0.093 -13.937 1.00 10.00 N ATOM 1099 CA THR A 78 7.585 -0.764 -14.208 1.00 10.00 C ATOM 1100 C THR A 78 6.761 -0.136 -15.328 1.00 10.00 C ATOM 1101 O THR A 78 6.452 1.051 -15.278 1.00 10.00 O ATOM 1102 CB THR A 78 6.765 -0.994 -12.924 1.00 10.00 C ATOM 1103 OG1 THR A 78 5.530 -1.616 -13.233 1.00 10.00 O ATOM 1104 CG2 THR A 78 6.479 0.302 -12.158 1.00 10.00 C ATOM 0 H THR A 78 8.581 1.066 -14.204 1.00 10.00 H new ATOM 0 HA THR A 78 7.916 -1.749 -14.538 1.00 10.00 H new ATOM 0 HB THR A 78 7.373 -1.636 -12.287 1.00 10.00 H new ATOM 0 HG1 THR A 78 4.980 -1.671 -12.424 1.00 10.00 H new ATOM 0 HG21 THR A 78 5.898 0.076 -11.264 1.00 10.00 H new ATOM 0 HG22 THR A 78 7.420 0.770 -11.871 1.00 10.00 H new ATOM 0 HG23 THR A 78 5.914 0.984 -12.794 1.00 10.00 H new ATOM 1112 N HIS A 79 6.413 -0.930 -16.342 1.00 10.00 N ATOM 1113 CA HIS A 79 5.470 -0.517 -17.373 1.00 10.00 C ATOM 1114 C HIS A 79 4.065 -0.465 -16.771 1.00 10.00 C ATOM 1115 O HIS A 79 3.280 0.424 -17.082 1.00 10.00 O ATOM 1116 CB HIS A 79 5.517 -1.496 -18.552 1.00 10.00 C ATOM 1117 CG HIS A 79 6.795 -1.436 -19.351 1.00 10.00 C ATOM 1118 ND1 HIS A 79 6.912 -0.879 -20.624 1.00 10.00 N ATOM 1119 CD2 HIS A 79 8.005 -1.943 -18.966 1.00 10.00 C ATOM 1120 CE1 HIS A 79 8.191 -1.064 -20.981 1.00 10.00 C ATOM 1121 NE2 HIS A 79 8.869 -1.702 -20.009 1.00 10.00 N ATOM 0 H HIS A 79 6.778 -1.874 -16.468 1.00 10.00 H new ATOM 0 HA HIS A 79 5.738 0.472 -17.743 1.00 10.00 H new ATOM 0 HB2 HIS A 79 5.384 -2.510 -18.174 1.00 10.00 H new ATOM 0 HB3 HIS A 79 4.677 -1.290 -19.215 1.00 10.00 H new ATOM 0 HD2 HIS A 79 8.236 -2.434 -18.032 1.00 10.00 H new ATOM 0 HE1 HIS A 79 8.619 -0.745 -21.920 1.00 10.00 H new ATOM 0 HE2 HIS A 79 9.855 -1.962 -20.040 1.00 10.00 H new ATOM 1129 N SER A 80 3.750 -1.442 -15.916 1.00 10.00 N ATOM 1130 CA SER A 80 2.469 -1.569 -15.245 1.00 10.00 C ATOM 1131 C SER A 80 2.194 -0.373 -14.331 1.00 10.00 C ATOM 1132 O SER A 80 1.072 0.127 -14.289 1.00 10.00 O ATOM 1133 CB SER A 80 2.488 -2.874 -14.442 1.00 10.00 C ATOM 1134 OG SER A 80 3.187 -3.868 -15.173 1.00 10.00 O ATOM 0 H SER A 80 4.404 -2.185 -15.669 1.00 10.00 H new ATOM 0 HA SER A 80 1.668 -1.589 -15.984 1.00 10.00 H new ATOM 0 HB2 SER A 80 2.968 -2.713 -13.477 1.00 10.00 H new ATOM 0 HB3 SER A 80 1.469 -3.205 -14.241 1.00 10.00 H new ATOM 0 HG SER A 80 3.201 -4.702 -14.659 1.00 10.00 H new ATOM 1140 N GLY A 81 3.206 0.036 -13.560 1.00 10.00 N ATOM 1141 CA GLY A 81 3.102 1.157 -12.642 1.00 10.00 C ATOM 1142 C GLY A 81 3.467 2.470 -13.335 1.00 10.00 C ATOM 1143 O GLY A 81 2.929 2.790 -14.390 1.00 10.00 O ATOM 0 H GLY A 81 4.124 -0.409 -13.561 1.00 10.00 H new ATOM 0 HA2 GLY A 81 2.086 1.218 -12.251 1.00 10.00 H new ATOM 0 HA3 GLY A 81 3.762 0.996 -11.790 1.00 10.00 H new ATOM 1147 N GLY A 82 4.371 3.240 -12.722 1.00 10.00 N ATOM 1148 CA GLY A 82 4.745 4.567 -13.188 1.00 10.00 C ATOM 1149 C GLY A 82 5.326 4.571 -14.604 1.00 10.00 C ATOM 1150 O GLY A 82 4.723 5.121 -15.523 1.00 10.00 O ATOM 0 H GLY A 82 4.866 2.950 -11.879 1.00 10.00 H new ATOM 0 HA2 GLY A 82 3.868 5.214 -13.161 1.00 10.00 H new ATOM 0 HA3 GLY A 82 5.477 4.993 -12.501 1.00 10.00 H new ATOM 1154 N MET A 83 6.532 4.019 -14.766 1.00 10.00 N ATOM 1155 CA MET A 83 7.259 3.987 -16.033 1.00 10.00 C ATOM 1156 C MET A 83 8.478 3.067 -15.903 1.00 10.00 C ATOM 1157 O MET A 83 8.928 2.769 -14.794 1.00 10.00 O ATOM 1158 CB MET A 83 7.683 5.416 -16.442 1.00 10.00 C ATOM 1159 CG MET A 83 7.116 5.818 -17.811 1.00 10.00 C ATOM 1160 SD MET A 83 7.758 4.933 -19.257 1.00 10.00 S ATOM 1161 CE MET A 83 9.468 5.516 -19.289 1.00 10.00 C ATOM 0 H MET A 83 7.039 3.573 -14.002 1.00 10.00 H new ATOM 0 HA MET A 83 6.609 3.594 -16.814 1.00 10.00 H new ATOM 0 HB2 MET A 83 7.342 6.125 -15.687 1.00 10.00 H new ATOM 0 HB3 MET A 83 8.771 5.477 -16.469 1.00 10.00 H new ATOM 0 HG2 MET A 83 6.035 5.683 -17.783 1.00 10.00 H new ATOM 0 HG3 MET A 83 7.301 6.883 -17.955 1.00 10.00 H new ATOM 0 HE1 MET A 83 9.953 5.172 -20.203 1.00 10.00 H new ATOM 0 HE2 MET A 83 9.482 6.605 -19.259 1.00 10.00 H new ATOM 0 HE3 MET A 83 10.003 5.122 -18.425 1.00 10.00 H new ATOM 1171 N ALA A 84 9.075 2.649 -17.020 1.00 10.00 N ATOM 1172 CA ALA A 84 10.293 1.852 -17.037 1.00 10.00 C ATOM 1173 C ALA A 84 11.475 2.811 -16.912 1.00 10.00 C ATOM 1174 O ALA A 84 12.344 2.861 -17.778 1.00 10.00 O ATOM 1175 CB ALA A 84 10.337 1.041 -18.335 1.00 10.00 C ATOM 0 H ALA A 84 8.717 2.860 -17.951 1.00 10.00 H new ATOM 0 HA ALA A 84 10.330 1.143 -16.210 1.00 10.00 H new ATOM 0 HB1 ALA A 84 11.246 0.440 -18.358 1.00 10.00 H new ATOM 0 HB2 ALA A 84 9.467 0.386 -18.384 1.00 10.00 H new ATOM 0 HB3 ALA A 84 10.329 1.719 -19.188 1.00 10.00 H new ATOM 1181 N GLY A 85 11.445 3.637 -15.866 1.00 10.00 N ATOM 1182 CA GLY A 85 12.163 4.899 -15.832 1.00 10.00 C ATOM 1183 C GLY A 85 13.004 5.029 -14.567 1.00 10.00 C ATOM 1184 O GLY A 85 12.699 5.869 -13.717 1.00 10.00 O ATOM 0 H GLY A 85 10.916 3.442 -15.016 1.00 10.00 H new ATOM 0 HA2 GLY A 85 12.807 4.976 -16.708 1.00 10.00 H new ATOM 0 HA3 GLY A 85 11.453 5.724 -15.885 1.00 10.00 H new ATOM 1188 N MET A 86 14.047 4.202 -14.419 1.00 10.00 N ATOM 1189 CA MET A 86 14.807 4.115 -13.171 1.00 10.00 C ATOM 1190 C MET A 86 15.822 5.259 -13.093 1.00 10.00 C ATOM 1191 O MET A 86 17.033 5.057 -13.092 1.00 10.00 O ATOM 1192 CB MET A 86 15.406 2.712 -13.001 1.00 10.00 C ATOM 1193 CG MET A 86 15.671 2.224 -11.568 1.00 10.00 C ATOM 1194 SD MET A 86 17.097 2.898 -10.664 1.00 10.00 S ATOM 1195 CE MET A 86 17.637 1.425 -9.770 1.00 10.00 C ATOM 0 H MET A 86 14.383 3.581 -15.155 1.00 10.00 H new ATOM 0 HA MET A 86 14.146 4.248 -12.315 1.00 10.00 H new ATOM 0 HB2 MET A 86 14.735 1.999 -13.481 1.00 10.00 H new ATOM 0 HB3 MET A 86 16.349 2.680 -13.547 1.00 10.00 H new ATOM 0 HG2 MET A 86 14.778 2.431 -10.978 1.00 10.00 H new ATOM 0 HG3 MET A 86 15.785 1.141 -11.604 1.00 10.00 H new ATOM 0 HE1 MET A 86 18.391 1.703 -9.033 1.00 10.00 H new ATOM 0 HE2 MET A 86 16.784 0.973 -9.264 1.00 10.00 H new ATOM 0 HE3 MET A 86 18.063 0.709 -10.473 1.00 10.00 H new ATOM 1205 N LYS A 87 15.285 6.473 -13.036 1.00 10.00 N ATOM 1206 CA LYS A 87 15.993 7.742 -12.997 1.00 10.00 C ATOM 1207 C LYS A 87 15.344 8.654 -11.954 1.00 10.00 C ATOM 1208 O LYS A 87 14.239 8.384 -11.485 1.00 10.00 O ATOM 1209 CB LYS A 87 15.969 8.372 -14.398 1.00 10.00 C ATOM 1210 CG LYS A 87 14.553 8.807 -14.811 1.00 10.00 C ATOM 1211 CD LYS A 87 14.409 8.992 -16.325 1.00 10.00 C ATOM 1212 CE LYS A 87 15.328 10.105 -16.854 1.00 10.00 C ATOM 1213 NZ LYS A 87 15.134 10.351 -18.298 1.00 10.00 N ATOM 0 H LYS A 87 14.273 6.602 -13.014 1.00 10.00 H new ATOM 0 HA LYS A 87 17.033 7.592 -12.708 1.00 10.00 H new ATOM 0 HB2 LYS A 87 16.634 9.236 -14.418 1.00 10.00 H new ATOM 0 HB3 LYS A 87 16.354 7.656 -15.124 1.00 10.00 H new ATOM 0 HG2 LYS A 87 13.835 8.061 -14.470 1.00 10.00 H new ATOM 0 HG3 LYS A 87 14.304 9.742 -14.310 1.00 10.00 H new ATOM 0 HD2 LYS A 87 14.645 8.055 -16.830 1.00 10.00 H new ATOM 0 HD3 LYS A 87 13.373 9.231 -16.565 1.00 10.00 H new ATOM 0 HE2 LYS A 87 15.136 11.025 -16.302 1.00 10.00 H new ATOM 0 HE3 LYS A 87 16.367 9.833 -16.670 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 15.774 11.109 -18.610 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 15.342 9.481 -18.829 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 14.149 10.636 -18.472 1.00 10.00 H new ATOM 1227 N MET A 88 16.008 9.763 -11.626 1.00 10.00 N ATOM 1228 CA MET A 88 15.605 10.647 -10.541 1.00 10.00 C ATOM 1229 C MET A 88 14.495 11.573 -11.029 1.00 10.00 C ATOM 1230 O MET A 88 14.711 12.755 -11.290 1.00 10.00 O ATOM 1231 CB MET A 88 16.840 11.417 -10.053 1.00 10.00 C ATOM 1232 CG MET A 88 17.849 10.471 -9.388 1.00 10.00 C ATOM 1233 SD MET A 88 19.569 11.043 -9.355 1.00 10.00 S ATOM 1234 CE MET A 88 19.420 12.556 -8.383 1.00 10.00 C ATOM 0 H MET A 88 16.849 10.073 -12.113 1.00 10.00 H new ATOM 0 HA MET A 88 15.206 10.081 -9.699 1.00 10.00 H new ATOM 0 HB2 MET A 88 17.312 11.925 -10.894 1.00 10.00 H new ATOM 0 HB3 MET A 88 16.536 12.187 -9.344 1.00 10.00 H new ATOM 0 HG2 MET A 88 17.527 10.290 -8.362 1.00 10.00 H new ATOM 0 HG3 MET A 88 17.815 9.513 -9.906 1.00 10.00 H new ATOM 0 HE1 MET A 88 20.401 13.019 -8.279 1.00 10.00 H new ATOM 0 HE2 MET A 88 18.744 13.247 -8.887 1.00 10.00 H new ATOM 0 HE3 MET A 88 19.025 12.317 -7.396 1.00 10.00 H new ATOM 1244 N VAL A 89 13.299 11.005 -11.181 1.00 10.00 N ATOM 1245 CA VAL A 89 12.118 11.751 -11.581 1.00 10.00 C ATOM 1246 C VAL A 89 11.653 12.682 -10.449 1.00 10.00 C ATOM 1247 O VAL A 89 11.973 12.428 -9.288 1.00 10.00 O ATOM 1248 CB VAL A 89 10.994 10.783 -12.012 1.00 10.00 C ATOM 1249 CG1 VAL A 89 11.400 9.981 -13.254 1.00 10.00 C ATOM 1250 CG2 VAL A 89 10.583 9.809 -10.901 1.00 10.00 C ATOM 0 H VAL A 89 13.127 10.011 -11.028 1.00 10.00 H new ATOM 0 HA VAL A 89 12.372 12.376 -12.437 1.00 10.00 H new ATOM 0 HB VAL A 89 10.135 11.413 -12.241 1.00 10.00 H new ATOM 0 HG11 VAL A 89 10.589 9.308 -13.534 1.00 10.00 H new ATOM 0 HG12 VAL A 89 11.605 10.665 -14.078 1.00 10.00 H new ATOM 0 HG13 VAL A 89 12.295 9.399 -13.035 1.00 10.00 H new ATOM 0 HG21 VAL A 89 9.790 9.156 -11.265 1.00 10.00 H new ATOM 0 HG22 VAL A 89 11.443 9.207 -10.608 1.00 10.00 H new ATOM 0 HG23 VAL A 89 10.223 10.371 -10.039 1.00 10.00 H new ATOM 1260 N PRO A 90 10.858 13.725 -10.759 1.00 10.00 N ATOM 1261 CA PRO A 90 10.067 14.460 -9.775 1.00 10.00 C ATOM 1262 C PRO A 90 9.377 13.525 -8.775 1.00 10.00 C ATOM 1263 O PRO A 90 9.533 13.719 -7.572 1.00 10.00 O ATOM 1264 CB PRO A 90 9.115 15.358 -10.573 1.00 10.00 C ATOM 1265 CG PRO A 90 9.165 14.813 -12.001 1.00 10.00 C ATOM 1266 CD PRO A 90 10.563 14.215 -12.097 1.00 10.00 C ATOM 0 HA PRO A 90 10.692 15.082 -9.135 1.00 10.00 H new ATOM 0 HB2 PRO A 90 8.103 15.318 -10.170 1.00 10.00 H new ATOM 0 HB3 PRO A 90 9.431 16.400 -10.537 1.00 10.00 H new ATOM 0 HG2 PRO A 90 8.393 14.062 -12.173 1.00 10.00 H new ATOM 0 HG3 PRO A 90 9.013 15.601 -12.738 1.00 10.00 H new ATOM 0 HD2 PRO A 90 10.597 13.408 -12.829 1.00 10.00 H new ATOM 0 HD3 PRO A 90 11.291 14.963 -12.413 1.00 10.00 H new ATOM 1274 N TRP A 91 8.642 12.521 -9.267 1.00 10.00 N ATOM 1275 CA TRP A 91 7.831 11.576 -8.517 1.00 10.00 C ATOM 1276 C TRP A 91 7.048 10.719 -9.505 1.00 10.00 C ATOM 1277 O TRP A 91 7.405 10.673 -10.682 1.00 10.00 O ATOM 1278 CB TRP A 91 6.859 12.300 -7.589 1.00 10.00 C ATOM 1279 CG TRP A 91 5.709 13.047 -8.181 1.00 10.00 C ATOM 1280 CD1 TRP A 91 4.602 13.304 -7.471 1.00 10.00 C ATOM 1281 CD2 TRP A 91 5.545 13.781 -9.435 1.00 10.00 C ATOM 1282 NE1 TRP A 91 3.933 14.357 -8.045 1.00 10.00 N ATOM 1283 CE2 TRP A 91 4.516 14.735 -9.233 1.00 10.00 C ATOM 1284 CE3 TRP A 91 6.139 13.771 -10.715 1.00 10.00 C ATOM 1285 CZ2 TRP A 91 4.265 15.762 -10.145 1.00 10.00 C ATOM 1286 CZ3 TRP A 91 5.784 14.711 -11.701 1.00 10.00 C ATOM 1287 CH2 TRP A 91 4.900 15.753 -11.393 1.00 10.00 C ATOM 0 H TRP A 91 8.601 12.342 -10.270 1.00 10.00 H new ATOM 0 HA TRP A 91 8.485 10.956 -7.904 1.00 10.00 H new ATOM 0 HB2 TRP A 91 6.451 11.561 -6.900 1.00 10.00 H new ATOM 0 HB3 TRP A 91 7.438 13.006 -6.993 1.00 10.00 H new ATOM 0 HD1 TRP A 91 4.286 12.768 -6.588 1.00 10.00 H new ATOM 0 HE1 TRP A 91 3.109 14.802 -7.642 1.00 10.00 H new ATOM 0 HE3 TRP A 91 6.884 13.024 -10.944 1.00 10.00 H new ATOM 0 HZ2 TRP A 91 3.584 16.560 -9.889 1.00 10.00 H new ATOM 0 HZ3 TRP A 91 6.194 14.629 -12.697 1.00 10.00 H new ATOM 0 HH2 TRP A 91 4.711 16.539 -12.109 1.00 10.00 H new ATOM 1298 N LEU A 92 5.944 10.128 -9.039 1.00 10.00 N ATOM 1299 CA LEU A 92 4.873 9.601 -9.859 1.00 10.00 C ATOM 1300 C LEU A 92 3.575 10.199 -9.318 1.00 10.00 C ATOM 1301 O LEU A 92 3.386 10.275 -8.104 1.00 10.00 O ATOM 1302 CB LEU A 92 4.799 8.071 -9.760 1.00 10.00 C ATOM 1303 CG LEU A 92 5.982 7.291 -10.356 1.00 10.00 C ATOM 1304 CD1 LEU A 92 6.209 7.626 -11.834 1.00 10.00 C ATOM 1305 CD2 LEU A 92 7.273 7.440 -9.540 1.00 10.00 C ATOM 0 H LEU A 92 5.775 10.004 -8.041 1.00 10.00 H new ATOM 0 HA LEU A 92 5.041 9.858 -10.905 1.00 10.00 H new ATOM 0 HB2 LEU A 92 4.706 7.801 -8.708 1.00 10.00 H new ATOM 0 HB3 LEU A 92 3.887 7.740 -10.256 1.00 10.00 H new ATOM 0 HG LEU A 92 5.701 6.239 -10.298 1.00 10.00 H new ATOM 0 HD11 LEU A 92 7.055 7.051 -12.212 1.00 10.00 H new ATOM 0 HD12 LEU A 92 5.315 7.375 -12.405 1.00 10.00 H new ATOM 0 HD13 LEU A 92 6.419 8.691 -11.938 1.00 10.00 H new ATOM 0 HD21 LEU A 92 8.070 6.866 -10.012 1.00 10.00 H new ATOM 0 HD22 LEU A 92 7.558 8.491 -9.499 1.00 10.00 H new ATOM 0 HD23 LEU A 92 7.109 7.069 -8.528 1.00 10.00 H new ATOM 1317 N THR A 93 2.671 10.597 -10.213 1.00 10.00 N ATOM 1318 CA THR A 93 1.274 10.792 -9.866 1.00 10.00 C ATOM 1319 C THR A 93 0.611 9.425 -9.981 1.00 10.00 C ATOM 1320 O THR A 93 0.282 9.004 -11.087 1.00 10.00 O ATOM 1321 CB THR A 93 0.655 11.842 -10.802 1.00 10.00 C ATOM 1322 OG1 THR A 93 1.277 13.086 -10.544 1.00 10.00 O ATOM 1323 CG2 THR A 93 -0.857 12.000 -10.604 1.00 10.00 C ATOM 0 H THR A 93 2.890 10.791 -11.190 1.00 10.00 H new ATOM 0 HA THR A 93 1.138 11.174 -8.854 1.00 10.00 H new ATOM 0 HB THR A 93 0.815 11.509 -11.827 1.00 10.00 H new ATOM 0 HG1 THR A 93 0.897 13.770 -11.133 1.00 10.00 H new ATOM 0 HG21 THR A 93 -1.237 12.755 -11.292 1.00 10.00 H new ATOM 0 HG22 THR A 93 -1.351 11.048 -10.800 1.00 10.00 H new ATOM 0 HG23 THR A 93 -1.059 12.309 -9.579 1.00 10.00 H new ATOM 1331 N ILE A 94 0.432 8.717 -8.861 1.00 10.00 N ATOM 1332 CA ILE A 94 -0.168 7.393 -8.896 1.00 10.00 C ATOM 1333 C ILE A 94 -1.687 7.615 -8.958 1.00 10.00 C ATOM 1334 O ILE A 94 -2.218 8.355 -8.128 1.00 10.00 O ATOM 1335 CB ILE A 94 0.325 6.525 -7.717 1.00 10.00 C ATOM 1336 CG1 ILE A 94 -0.206 6.950 -6.342 1.00 10.00 C ATOM 1337 CG2 ILE A 94 1.857 6.558 -7.650 1.00 10.00 C ATOM 1338 CD1 ILE A 94 -1.448 6.169 -5.929 1.00 10.00 C ATOM 0 H ILE A 94 0.694 9.041 -7.930 1.00 10.00 H new ATOM 0 HA ILE A 94 0.133 6.816 -9.770 1.00 10.00 H new ATOM 0 HB ILE A 94 -0.062 5.527 -7.922 1.00 10.00 H new ATOM 0 HG12 ILE A 94 0.574 6.807 -5.595 1.00 10.00 H new ATOM 0 HG13 ILE A 94 -0.439 8.015 -6.359 1.00 10.00 H new ATOM 0 HG21 ILE A 94 2.198 5.944 -6.816 1.00 10.00 H new ATOM 0 HG22 ILE A 94 2.270 6.169 -8.580 1.00 10.00 H new ATOM 0 HG23 ILE A 94 2.193 7.585 -7.505 1.00 10.00 H new ATOM 0 HD11 ILE A 94 -1.782 6.509 -4.949 1.00 10.00 H new ATOM 0 HD12 ILE A 94 -2.240 6.333 -6.660 1.00 10.00 H new ATOM 0 HD13 ILE A 94 -1.211 5.106 -5.883 1.00 10.00 H new ATOM 1350 N PRO A 95 -2.380 7.102 -9.987 1.00 10.00 N ATOM 1351 CA PRO A 95 -3.753 7.491 -10.281 1.00 10.00 C ATOM 1352 C PRO A 95 -4.759 6.729 -9.410 1.00 10.00 C ATOM 1353 O PRO A 95 -4.382 5.930 -8.557 1.00 10.00 O ATOM 1354 CB PRO A 95 -3.931 7.159 -11.768 1.00 10.00 C ATOM 1355 CG PRO A 95 -3.020 5.947 -11.964 1.00 10.00 C ATOM 1356 CD PRO A 95 -1.838 6.278 -11.059 1.00 10.00 C ATOM 0 HA PRO A 95 -3.936 8.544 -10.067 1.00 10.00 H new ATOM 0 HB2 PRO A 95 -4.969 6.926 -12.008 1.00 10.00 H new ATOM 0 HB3 PRO A 95 -3.636 7.993 -12.405 1.00 10.00 H new ATOM 0 HG2 PRO A 95 -3.510 5.019 -11.670 1.00 10.00 H new ATOM 0 HG3 PRO A 95 -2.716 5.831 -13.004 1.00 10.00 H new ATOM 0 HD2 PRO A 95 -1.382 5.371 -10.663 1.00 10.00 H new ATOM 0 HD3 PRO A 95 -1.062 6.811 -11.608 1.00 10.00 H new ATOM 1364 N ALA A 96 -6.057 6.914 -9.679 1.00 10.00 N ATOM 1365 CA ALA A 96 -7.056 5.900 -9.353 1.00 10.00 C ATOM 1366 C ALA A 96 -6.573 4.531 -9.872 1.00 10.00 C ATOM 1367 O ALA A 96 -5.847 4.477 -10.864 1.00 10.00 O ATOM 1368 CB ALA A 96 -8.397 6.283 -9.983 1.00 10.00 C ATOM 0 H ALA A 96 -6.435 7.753 -10.119 1.00 10.00 H new ATOM 0 HA ALA A 96 -7.191 5.837 -8.273 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -9.143 5.526 -9.740 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -8.719 7.249 -9.593 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -8.285 6.348 -11.065 1.00 10.00 H new ATOM 1374 N ARG A 97 -6.931 3.421 -9.218 1.00 10.00 N ATOM 1375 CA ARG A 97 -6.333 2.095 -9.415 1.00 10.00 C ATOM 1376 C ARG A 97 -4.808 2.064 -9.254 1.00 10.00 C ATOM 1377 O ARG A 97 -4.198 1.020 -9.493 1.00 10.00 O ATOM 1378 CB ARG A 97 -6.731 1.443 -10.751 1.00 10.00 C ATOM 1379 CG ARG A 97 -8.247 1.353 -10.927 1.00 10.00 C ATOM 1380 CD ARG A 97 -8.768 2.550 -11.726 1.00 10.00 C ATOM 1381 NE ARG A 97 -10.158 2.842 -11.355 1.00 10.00 N ATOM 1382 CZ ARG A 97 -11.065 3.532 -12.058 1.00 10.00 C ATOM 1383 NH1 ARG A 97 -10.795 3.937 -13.304 1.00 10.00 N ATOM 1384 NH2 ARG A 97 -12.236 3.816 -11.487 1.00 10.00 N ATOM 0 H ARG A 97 -7.669 3.420 -8.514 1.00 10.00 H new ATOM 0 HA ARG A 97 -6.756 1.502 -8.604 1.00 10.00 H new ATOM 0 HB2 ARG A 97 -6.306 2.018 -11.574 1.00 10.00 H new ATOM 0 HB3 ARG A 97 -6.302 0.443 -10.806 1.00 10.00 H new ATOM 0 HG2 ARG A 97 -8.505 0.426 -11.440 1.00 10.00 H new ATOM 0 HG3 ARG A 97 -8.731 1.322 -9.951 1.00 10.00 H new ATOM 0 HD2 ARG A 97 -8.143 3.423 -11.537 1.00 10.00 H new ATOM 0 HD3 ARG A 97 -8.706 2.339 -12.793 1.00 10.00 H new ATOM 0 HE ARG A 97 -10.470 2.476 -10.455 1.00 10.00 H new ATOM 0 HH11 ARG A 97 -9.892 3.721 -13.726 1.00 10.00 H new ATOM 0 HH12 ARG A 97 -11.492 4.462 -13.832 1.00 10.00 H new ATOM 0 HH21 ARG A 97 -12.426 3.509 -10.533 1.00 10.00 H new ATOM 0 HH22 ARG A 97 -12.942 4.341 -12.004 1.00 10.00 H new ATOM 1398 N GLY A 98 -4.175 3.159 -8.823 1.00 10.00 N ATOM 1399 CA GLY A 98 -2.740 3.256 -8.682 1.00 10.00 C ATOM 1400 C GLY A 98 -2.280 2.369 -7.532 1.00 10.00 C ATOM 1401 O GLY A 98 -2.177 2.810 -6.384 1.00 10.00 O ATOM 0 H GLY A 98 -4.666 4.014 -8.560 1.00 10.00 H new ATOM 0 HA2 GLY A 98 -2.252 2.951 -9.608 1.00 10.00 H new ATOM 0 HA3 GLY A 98 -2.452 4.290 -8.495 1.00 10.00 H new ATOM 1405 N THR A 99 -2.088 1.092 -7.850 1.00 10.00 N ATOM 1406 CA THR A 99 -1.739 0.039 -6.917 1.00 10.00 C ATOM 1407 C THR A 99 -0.301 -0.370 -7.195 1.00 10.00 C ATOM 1408 O THR A 99 -0.021 -1.488 -7.622 1.00 10.00 O ATOM 1409 CB THR A 99 -2.749 -1.109 -7.051 1.00 10.00 C ATOM 1410 OG1 THR A 99 -4.058 -0.576 -7.154 1.00 10.00 O ATOM 1411 CG2 THR A 99 -2.704 -2.051 -5.845 1.00 10.00 C ATOM 0 H THR A 99 -2.177 0.754 -8.808 1.00 10.00 H new ATOM 0 HA THR A 99 -1.792 0.369 -5.879 1.00 10.00 H new ATOM 0 HB THR A 99 -2.486 -1.675 -7.944 1.00 10.00 H new ATOM 0 HG1 THR A 99 -4.166 -0.140 -8.025 1.00 10.00 H new ATOM 0 HG21 THR A 99 -3.434 -2.849 -5.979 1.00 10.00 H new ATOM 0 HG22 THR A 99 -1.707 -2.482 -5.757 1.00 10.00 H new ATOM 0 HG23 THR A 99 -2.939 -1.493 -4.939 1.00 10.00 H new ATOM 1419 N LEU A 100 0.602 0.595 -7.035 1.00 10.00 N ATOM 1420 CA LEU A 100 1.973 0.457 -7.471 1.00 10.00 C ATOM 1421 C LEU A 100 2.790 -0.222 -6.384 1.00 10.00 C ATOM 1422 O LEU A 100 2.446 -0.187 -5.205 1.00 10.00 O ATOM 1423 CB LEU A 100 2.536 1.816 -7.887 1.00 10.00 C ATOM 1424 CG LEU A 100 2.199 2.125 -9.351 1.00 10.00 C ATOM 1425 CD1 LEU A 100 0.695 2.130 -9.653 1.00 10.00 C ATOM 1426 CD2 LEU A 100 2.768 3.482 -9.766 1.00 10.00 C ATOM 0 H LEU A 100 0.395 1.493 -6.598 1.00 10.00 H new ATOM 0 HA LEU A 100 2.024 -0.180 -8.354 1.00 10.00 H new ATOM 0 HB2 LEU A 100 2.128 2.595 -7.244 1.00 10.00 H new ATOM 0 HB3 LEU A 100 3.617 1.823 -7.749 1.00 10.00 H new ATOM 0 HG LEU A 100 2.655 1.316 -9.922 1.00 10.00 H new ATOM 0 HD11 LEU A 100 0.536 2.356 -10.707 1.00 10.00 H new ATOM 0 HD12 LEU A 100 0.275 1.151 -9.425 1.00 10.00 H new ATOM 0 HD13 LEU A 100 0.204 2.887 -9.042 1.00 10.00 H new ATOM 0 HD21 LEU A 100 2.516 3.679 -10.808 1.00 10.00 H new ATOM 0 HD22 LEU A 100 2.342 4.263 -9.136 1.00 10.00 H new ATOM 0 HD23 LEU A 100 3.852 3.473 -9.650 1.00 10.00 H new ATOM 1438 N THR A 101 3.862 -0.881 -6.810 1.00 10.00 N ATOM 1439 CA THR A 101 4.653 -1.769 -5.991 1.00 10.00 C ATOM 1440 C THR A 101 6.015 -1.103 -5.870 1.00 10.00 C ATOM 1441 O THR A 101 6.743 -0.961 -6.849 1.00 10.00 O ATOM 1442 CB THR A 101 4.677 -3.184 -6.593 1.00 10.00 C ATOM 1443 OG1 THR A 101 4.878 -3.165 -7.995 1.00 10.00 O ATOM 1444 CG2 THR A 101 3.345 -3.893 -6.326 1.00 10.00 C ATOM 0 H THR A 101 4.209 -0.804 -7.766 1.00 10.00 H new ATOM 0 HA THR A 101 4.241 -1.920 -4.993 1.00 10.00 H new ATOM 0 HB THR A 101 5.506 -3.710 -6.120 1.00 10.00 H new ATOM 0 HG1 THR A 101 4.730 -4.063 -8.359 1.00 10.00 H new ATOM 0 HG21 THR A 101 3.373 -4.894 -6.757 1.00 10.00 H new ATOM 0 HG22 THR A 101 3.180 -3.965 -5.251 1.00 10.00 H new ATOM 0 HG23 THR A 101 2.533 -3.325 -6.780 1.00 10.00 H new ATOM 1452 N LEU A 102 6.306 -0.642 -4.662 1.00 10.00 N ATOM 1453 CA LEU A 102 7.494 0.103 -4.312 1.00 10.00 C ATOM 1454 C LEU A 102 8.575 -0.949 -4.080 1.00 10.00 C ATOM 1455 O LEU A 102 8.454 -1.722 -3.137 1.00 10.00 O ATOM 1456 CB LEU A 102 7.131 0.927 -3.056 1.00 10.00 C ATOM 1457 CG LEU A 102 7.968 2.169 -2.753 1.00 10.00 C ATOM 1458 CD1 LEU A 102 7.400 2.886 -1.522 1.00 10.00 C ATOM 1459 CD2 LEU A 102 9.413 1.784 -2.467 1.00 10.00 C ATOM 0 H LEU A 102 5.686 -0.788 -3.865 1.00 10.00 H new ATOM 0 HA LEU A 102 7.857 0.803 -5.065 1.00 10.00 H new ATOM 0 HB2 LEU A 102 6.091 1.239 -3.149 1.00 10.00 H new ATOM 0 HB3 LEU A 102 7.189 0.265 -2.192 1.00 10.00 H new ATOM 0 HG LEU A 102 7.934 2.825 -3.622 1.00 10.00 H new ATOM 0 HD11 LEU A 102 7.999 3.771 -1.308 1.00 10.00 H new ATOM 0 HD12 LEU A 102 6.370 3.183 -1.717 1.00 10.00 H new ATOM 0 HD13 LEU A 102 7.427 2.214 -0.664 1.00 10.00 H new ATOM 0 HD21 LEU A 102 9.993 2.682 -2.254 1.00 10.00 H new ATOM 0 HD22 LEU A 102 9.448 1.116 -1.606 1.00 10.00 H new ATOM 0 HD23 LEU A 102 9.834 1.278 -3.336 1.00 10.00 H new ATOM 1471 N GLN A 103 9.574 -1.064 -4.962 1.00 10.00 N ATOM 1472 CA GLN A 103 10.572 -2.129 -4.870 1.00 10.00 C ATOM 1473 C GLN A 103 11.875 -1.723 -5.556 1.00 10.00 C ATOM 1474 O GLN A 103 11.900 -0.735 -6.283 1.00 10.00 O ATOM 1475 CB GLN A 103 9.996 -3.412 -5.487 1.00 10.00 C ATOM 1476 CG GLN A 103 9.905 -3.339 -7.016 1.00 10.00 C ATOM 1477 CD GLN A 103 8.703 -4.100 -7.558 1.00 10.00 C ATOM 1478 OE1 GLN A 103 8.756 -5.308 -7.764 1.00 10.00 O ATOM 1479 NE2 GLN A 103 7.601 -3.390 -7.771 1.00 10.00 N ATOM 0 H GLN A 103 9.711 -0.429 -5.749 1.00 10.00 H new ATOM 0 HA GLN A 103 10.807 -2.311 -3.821 1.00 10.00 H new ATOM 0 HB2 GLN A 103 10.620 -4.260 -5.203 1.00 10.00 H new ATOM 0 HB3 GLN A 103 9.003 -3.595 -5.076 1.00 10.00 H new ATOM 0 HG2 GLN A 103 9.842 -2.296 -7.325 1.00 10.00 H new ATOM 0 HG3 GLN A 103 10.817 -3.746 -7.452 1.00 10.00 H new ATOM 0 HE21 GLN A 103 7.597 -2.387 -7.587 1.00 10.00 H new ATOM 0 HE22 GLN A 103 6.758 -3.848 -8.118 1.00 10.00 H new ATOM 1488 N ARG A 104 12.939 -2.518 -5.373 1.00 10.00 N ATOM 1489 CA ARG A 104 14.262 -2.290 -5.969 1.00 10.00 C ATOM 1490 C ARG A 104 14.179 -1.692 -7.375 1.00 10.00 C ATOM 1491 O ARG A 104 14.890 -0.740 -7.691 1.00 10.00 O ATOM 1492 CB ARG A 104 15.078 -3.593 -6.021 1.00 10.00 C ATOM 1493 CG ARG A 104 16.511 -3.431 -5.488 1.00 10.00 C ATOM 1494 CD ARG A 104 17.353 -2.313 -6.124 1.00 10.00 C ATOM 1495 NE ARG A 104 17.419 -2.400 -7.593 1.00 10.00 N ATOM 1496 CZ ARG A 104 18.337 -1.801 -8.367 1.00 10.00 C ATOM 1497 NH1 ARG A 104 19.350 -1.118 -7.815 1.00 10.00 N ATOM 1498 NH2 ARG A 104 18.233 -1.879 -9.696 1.00 10.00 N ATOM 0 H ARG A 104 12.902 -3.356 -4.793 1.00 10.00 H new ATOM 0 HA ARG A 104 14.763 -1.568 -5.324 1.00 10.00 H new ATOM 0 HB2 ARG A 104 14.565 -4.359 -5.439 1.00 10.00 H new ATOM 0 HB3 ARG A 104 15.118 -3.948 -7.051 1.00 10.00 H new ATOM 0 HG2 ARG A 104 16.458 -3.251 -4.414 1.00 10.00 H new ATOM 0 HG3 ARG A 104 17.036 -4.376 -5.627 1.00 10.00 H new ATOM 0 HD2 ARG A 104 16.934 -1.347 -5.842 1.00 10.00 H new ATOM 0 HD3 ARG A 104 18.364 -2.353 -5.718 1.00 10.00 H new ATOM 0 HE ARG A 104 16.708 -2.962 -8.061 1.00 10.00 H new ATOM 0 HH11 ARG A 104 19.427 -1.051 -6.800 1.00 10.00 H new ATOM 0 HH12 ARG A 104 20.044 -0.665 -8.410 1.00 10.00 H new ATOM 0 HH21 ARG A 104 17.459 -2.392 -10.118 1.00 10.00 H new ATOM 0 HH22 ARG A 104 18.928 -1.426 -10.289 1.00 10.00 H new ATOM 1512 N ASP A 105 13.295 -2.265 -8.196 1.00 10.00 N ATOM 1513 CA ASP A 105 13.001 -1.843 -9.549 1.00 10.00 C ATOM 1514 C ASP A 105 11.472 -1.871 -9.700 1.00 10.00 C ATOM 1515 O ASP A 105 10.889 -2.933 -9.896 1.00 10.00 O ATOM 1516 CB ASP A 105 13.740 -2.777 -10.522 1.00 10.00 C ATOM 1517 CG ASP A 105 15.251 -2.676 -10.343 1.00 10.00 C ATOM 1518 OD1 ASP A 105 15.806 -3.375 -9.470 1.00 10.00 O ATOM 1519 OD2 ASP A 105 15.900 -1.851 -11.021 1.00 10.00 O ATOM 0 H ASP A 105 12.743 -3.074 -7.912 1.00 10.00 H new ATOM 0 HA ASP A 105 13.344 -0.833 -9.773 1.00 10.00 H new ATOM 0 HB2 ASP A 105 13.420 -3.806 -10.357 1.00 10.00 H new ATOM 0 HB3 ASP A 105 13.475 -2.521 -11.548 1.00 10.00 H new ATOM 1524 N GLY A 106 10.826 -0.706 -9.564 1.00 10.00 N ATOM 1525 CA GLY A 106 9.379 -0.526 -9.580 1.00 10.00 C ATOM 1526 C GLY A 106 8.968 0.572 -8.589 1.00 10.00 C ATOM 1527 O GLY A 106 9.211 0.414 -7.395 1.00 10.00 O ATOM 0 H GLY A 106 11.326 0.174 -9.434 1.00 10.00 H new ATOM 0 HA2 GLY A 106 9.050 -0.260 -10.585 1.00 10.00 H new ATOM 0 HA3 GLY A 106 8.886 -1.463 -9.320 1.00 10.00 H new ATOM 1531 N ASP A 107 8.393 1.672 -9.108 1.00 10.00 N ATOM 1532 CA ASP A 107 7.815 2.831 -8.413 1.00 10.00 C ATOM 1533 C ASP A 107 8.365 3.055 -7.006 1.00 10.00 C ATOM 1534 O ASP A 107 7.637 2.888 -6.032 1.00 10.00 O ATOM 1535 CB ASP A 107 6.285 2.713 -8.398 1.00 10.00 C ATOM 1536 CG ASP A 107 5.645 3.958 -7.781 1.00 10.00 C ATOM 1537 OD1 ASP A 107 6.145 5.058 -8.094 1.00 10.00 O ATOM 1538 OD2 ASP A 107 4.650 3.800 -7.044 1.00 10.00 O ATOM 0 H ASP A 107 8.315 1.779 -10.119 1.00 10.00 H new ATOM 0 HA ASP A 107 8.115 3.715 -8.976 1.00 10.00 H new ATOM 0 HB2 ASP A 107 5.917 2.577 -9.415 1.00 10.00 H new ATOM 0 HB3 ASP A 107 5.990 1.830 -7.832 1.00 10.00 H new ATOM 1543 N HIS A 108 9.655 3.386 -6.885 1.00 10.00 N ATOM 1544 CA HIS A 108 10.352 3.296 -5.610 1.00 10.00 C ATOM 1545 C HIS A 108 10.893 4.629 -5.119 1.00 10.00 C ATOM 1546 O HIS A 108 11.052 5.573 -5.886 1.00 10.00 O ATOM 1547 CB HIS A 108 11.449 2.229 -5.646 1.00 10.00 C ATOM 1548 CG HIS A 108 12.570 2.422 -6.643 1.00 10.00 C ATOM 1549 ND1 HIS A 108 12.892 1.566 -7.669 1.00 10.00 N ATOM 1550 CD2 HIS A 108 13.604 3.310 -6.532 1.00 10.00 C ATOM 1551 CE1 HIS A 108 14.056 1.965 -8.194 1.00 10.00 C ATOM 1552 NE2 HIS A 108 14.545 3.034 -7.541 1.00 10.00 N ATOM 0 H HIS A 108 10.232 3.718 -7.658 1.00 10.00 H new ATOM 0 HA HIS A 108 9.601 2.990 -4.881 1.00 10.00 H new ATOM 0 HB2 HIS A 108 11.890 2.164 -4.651 1.00 10.00 H new ATOM 0 HB3 HIS A 108 10.978 1.267 -5.850 1.00 10.00 H new ATOM 0 HD1 HIS A 108 12.340 0.766 -7.977 1.00 10.00 H new ATOM 0 HD2 HIS A 108 13.685 4.093 -5.793 1.00 10.00 H new ATOM 0 HE1 HIS A 108 14.541 1.490 -9.034 1.00 10.00 H new ATOM 1560 N VAL A 109 11.251 4.659 -3.835 1.00 10.00 N ATOM 1561 CA VAL A 109 12.074 5.687 -3.233 1.00 10.00 C ATOM 1562 C VAL A 109 13.461 5.074 -3.105 1.00 10.00 C ATOM 1563 O VAL A 109 13.605 4.060 -2.420 1.00 10.00 O ATOM 1564 CB VAL A 109 11.540 6.053 -1.838 1.00 10.00 C ATOM 1565 CG1 VAL A 109 12.422 7.138 -1.208 1.00 10.00 C ATOM 1566 CG2 VAL A 109 10.097 6.562 -1.884 1.00 10.00 C ATOM 0 H VAL A 109 10.962 3.941 -3.171 1.00 10.00 H new ATOM 0 HA VAL A 109 12.078 6.598 -3.832 1.00 10.00 H new ATOM 0 HB VAL A 109 11.563 5.142 -1.240 1.00 10.00 H new ATOM 0 HG11 VAL A 109 12.037 7.392 -0.220 1.00 10.00 H new ATOM 0 HG12 VAL A 109 13.443 6.768 -1.116 1.00 10.00 H new ATOM 0 HG13 VAL A 109 12.413 8.026 -1.840 1.00 10.00 H new ATOM 0 HG21 VAL A 109 9.765 6.807 -0.875 1.00 10.00 H new ATOM 0 HG22 VAL A 109 10.045 7.453 -2.510 1.00 10.00 H new ATOM 0 HG23 VAL A 109 9.451 5.789 -2.300 1.00 10.00 H new ATOM 1576 N MET A 110 14.470 5.687 -3.724 1.00 10.00 N ATOM 1577 CA MET A 110 15.854 5.382 -3.430 1.00 10.00 C ATOM 1578 C MET A 110 16.247 6.184 -2.205 1.00 10.00 C ATOM 1579 O MET A 110 16.597 7.357 -2.303 1.00 10.00 O ATOM 1580 CB MET A 110 16.786 5.720 -4.595 1.00 10.00 C ATOM 1581 CG MET A 110 16.469 4.856 -5.807 1.00 10.00 C ATOM 1582 SD MET A 110 17.787 4.767 -7.037 1.00 10.00 S ATOM 1583 CE MET A 110 18.781 3.444 -6.320 1.00 10.00 C ATOM 0 H MET A 110 14.343 6.404 -4.438 1.00 10.00 H new ATOM 0 HA MET A 110 15.952 4.311 -3.255 1.00 10.00 H new ATOM 0 HB2 MET A 110 16.682 6.773 -4.856 1.00 10.00 H new ATOM 0 HB3 MET A 110 17.822 5.567 -4.294 1.00 10.00 H new ATOM 0 HG2 MET A 110 16.240 3.846 -5.466 1.00 10.00 H new ATOM 0 HG3 MET A 110 15.569 5.242 -6.286 1.00 10.00 H new ATOM 0 HE1 MET A 110 19.691 3.314 -6.906 1.00 10.00 H new ATOM 0 HE2 MET A 110 19.044 3.701 -5.294 1.00 10.00 H new ATOM 0 HE3 MET A 110 18.210 2.516 -6.326 1.00 10.00 H new ATOM 1593 N LEU A 111 16.235 5.524 -1.052 1.00 10.00 N ATOM 1594 CA LEU A 111 16.741 6.075 0.198 1.00 10.00 C ATOM 1595 C LEU A 111 18.267 5.929 0.189 1.00 10.00 C ATOM 1596 O LEU A 111 18.859 5.287 1.053 1.00 10.00 O ATOM 1597 CB LEU A 111 16.108 5.296 1.359 1.00 10.00 C ATOM 1598 CG LEU A 111 14.584 5.472 1.439 1.00 10.00 C ATOM 1599 CD1 LEU A 111 14.029 4.367 2.333 1.00 10.00 C ATOM 1600 CD2 LEU A 111 14.199 6.841 2.011 1.00 10.00 C ATOM 0 H LEU A 111 15.868 4.577 -0.959 1.00 10.00 H new ATOM 0 HA LEU A 111 16.488 7.129 0.313 1.00 10.00 H new ATOM 0 HB2 LEU A 111 16.341 4.237 1.248 1.00 10.00 H new ATOM 0 HB3 LEU A 111 16.556 5.624 2.297 1.00 10.00 H new ATOM 0 HG LEU A 111 14.166 5.412 0.434 1.00 10.00 H new ATOM 0 HD11 LEU A 111 12.946 4.468 2.407 1.00 10.00 H new ATOM 0 HD12 LEU A 111 14.274 3.395 1.905 1.00 10.00 H new ATOM 0 HD13 LEU A 111 14.470 4.447 3.327 1.00 10.00 H new ATOM 0 HD21 LEU A 111 13.113 6.926 2.051 1.00 10.00 H new ATOM 0 HD22 LEU A 111 14.609 6.944 3.016 1.00 10.00 H new ATOM 0 HD23 LEU A 111 14.601 7.628 1.373 1.00 10.00 H new ATOM 1612 N MET A 112 18.897 6.531 -0.819 1.00 10.00 N ATOM 1613 CA MET A 112 20.296 6.330 -1.154 1.00 10.00 C ATOM 1614 C MET A 112 21.192 7.239 -0.311 1.00 10.00 C ATOM 1615 O MET A 112 20.752 8.255 0.227 1.00 10.00 O ATOM 1616 CB MET A 112 20.434 6.587 -2.667 1.00 10.00 C ATOM 1617 CG MET A 112 21.859 6.706 -3.225 1.00 10.00 C ATOM 1618 SD MET A 112 21.975 6.722 -5.035 1.00 10.00 S ATOM 1619 CE MET A 112 20.978 8.172 -5.448 1.00 10.00 C ATOM 0 H MET A 112 18.429 7.191 -1.440 1.00 10.00 H new ATOM 0 HA MET A 112 20.621 5.314 -0.928 1.00 10.00 H new ATOM 0 HB2 MET A 112 19.929 5.778 -3.196 1.00 10.00 H new ATOM 0 HB3 MET A 112 19.899 7.506 -2.905 1.00 10.00 H new ATOM 0 HG2 MET A 112 22.309 7.621 -2.839 1.00 10.00 H new ATOM 0 HG3 MET A 112 22.452 5.874 -2.845 1.00 10.00 H new ATOM 0 HE1 MET A 112 21.061 8.378 -6.515 1.00 10.00 H new ATOM 0 HE2 MET A 112 19.935 7.981 -5.195 1.00 10.00 H new ATOM 0 HE3 MET A 112 21.336 9.033 -4.883 1.00 10.00 H new ATOM 1629 N GLY A 113 22.480 6.900 -0.242 1.00 10.00 N ATOM 1630 CA GLY A 113 23.527 7.869 0.043 1.00 10.00 C ATOM 1631 C GLY A 113 24.187 7.716 1.414 1.00 10.00 C ATOM 1632 O GLY A 113 25.158 8.432 1.674 1.00 10.00 O ATOM 0 H GLY A 113 22.821 5.949 -0.382 1.00 10.00 H new ATOM 0 HA2 GLY A 113 24.296 7.789 -0.726 1.00 10.00 H new ATOM 0 HA3 GLY A 113 23.105 8.871 -0.032 1.00 10.00 H new ATOM 1636 N LEU A 114 23.705 6.791 2.254 1.00 10.00 N ATOM 1637 CA LEU A 114 24.224 6.478 3.592 1.00 10.00 C ATOM 1638 C LEU A 114 24.472 7.729 4.449 1.00 10.00 C ATOM 1639 O LEU A 114 25.570 8.280 4.455 1.00 10.00 O ATOM 1640 CB LEU A 114 25.471 5.583 3.476 1.00 10.00 C ATOM 1641 CG LEU A 114 26.210 5.257 4.786 1.00 10.00 C ATOM 1642 CD1 LEU A 114 25.297 4.565 5.799 1.00 10.00 C ATOM 1643 CD2 LEU A 114 27.401 4.343 4.477 1.00 10.00 C ATOM 0 H LEU A 114 22.903 6.212 2.007 1.00 10.00 H new ATOM 0 HA LEU A 114 23.453 5.922 4.126 1.00 10.00 H new ATOM 0 HB2 LEU A 114 25.174 4.644 3.010 1.00 10.00 H new ATOM 0 HB3 LEU A 114 26.175 6.066 2.799 1.00 10.00 H new ATOM 0 HG LEU A 114 26.547 6.196 5.224 1.00 10.00 H new ATOM 0 HD11 LEU A 114 25.858 4.353 6.709 1.00 10.00 H new ATOM 0 HD12 LEU A 114 24.456 5.217 6.035 1.00 10.00 H new ATOM 0 HD13 LEU A 114 24.925 3.632 5.376 1.00 10.00 H new ATOM 0 HD21 LEU A 114 27.929 4.108 5.401 1.00 10.00 H new ATOM 0 HD22 LEU A 114 27.043 3.421 4.019 1.00 10.00 H new ATOM 0 HD23 LEU A 114 28.079 4.849 3.790 1.00 10.00 H new ATOM 1655 N LYS A 115 23.453 8.162 5.194 1.00 10.00 N ATOM 1656 CA LYS A 115 23.511 9.314 6.073 1.00 10.00 C ATOM 1657 C LYS A 115 23.815 8.879 7.509 1.00 10.00 C ATOM 1658 O LYS A 115 24.563 9.541 8.224 1.00 10.00 O ATOM 1659 CB LYS A 115 22.129 9.944 5.982 1.00 10.00 C ATOM 1660 CG LYS A 115 22.039 11.390 6.420 1.00 10.00 C ATOM 1661 CD LYS A 115 20.657 11.858 5.943 1.00 10.00 C ATOM 1662 CE LYS A 115 20.068 12.998 6.770 1.00 10.00 C ATOM 1663 NZ LYS A 115 20.779 14.271 6.544 1.00 10.00 N ATOM 0 H LYS A 115 22.542 7.703 5.197 1.00 10.00 H new ATOM 0 HA LYS A 115 24.298 10.012 5.787 1.00 10.00 H new ATOM 0 HB2 LYS A 115 21.785 9.874 4.950 1.00 10.00 H new ATOM 0 HB3 LYS A 115 21.441 9.356 6.589 1.00 10.00 H new ATOM 0 HG2 LYS A 115 22.137 11.483 7.502 1.00 10.00 H new ATOM 0 HG3 LYS A 115 22.835 11.988 5.976 1.00 10.00 H new ATOM 0 HD2 LYS A 115 20.732 12.178 4.904 1.00 10.00 H new ATOM 0 HD3 LYS A 115 19.970 11.012 5.968 1.00 10.00 H new ATOM 0 HE2 LYS A 115 19.015 13.122 6.518 1.00 10.00 H new ATOM 0 HE3 LYS A 115 20.115 12.740 7.828 1.00 10.00 H new ATOM 0 HZ1 LYS A 115 20.347 15.018 7.125 1.00 10.00 H new ATOM 0 HZ2 LYS A 115 21.779 14.162 6.808 1.00 10.00 H new ATOM 0 HZ3 LYS A 115 20.713 14.532 5.539 1.00 10.00 H new ATOM 1677 N ARG A 116 23.198 7.772 7.931 1.00 10.00 N ATOM 1678 CA ARG A 116 23.397 7.103 9.208 1.00 10.00 C ATOM 1679 C ARG A 116 23.383 5.605 8.899 1.00 10.00 C ATOM 1680 O ARG A 116 22.768 5.228 7.903 1.00 10.00 O ATOM 1681 CB ARG A 116 22.256 7.467 10.169 1.00 10.00 C ATOM 1682 CG ARG A 116 22.382 8.905 10.683 1.00 10.00 C ATOM 1683 CD ARG A 116 21.318 9.162 11.754 1.00 10.00 C ATOM 1684 NE ARG A 116 21.441 10.516 12.315 1.00 10.00 N ATOM 1685 CZ ARG A 116 20.692 10.999 13.320 1.00 10.00 C ATOM 1686 NH1 ARG A 116 19.721 10.245 13.846 1.00 10.00 N ATOM 1687 NH2 ARG A 116 20.918 12.230 13.794 1.00 10.00 N ATOM 0 H ARG A 116 22.507 7.295 7.352 1.00 10.00 H new ATOM 0 HA ARG A 116 24.331 7.400 9.685 1.00 10.00 H new ATOM 0 HB2 ARG A 116 21.300 7.345 9.660 1.00 10.00 H new ATOM 0 HB3 ARG A 116 22.258 6.778 11.013 1.00 10.00 H new ATOM 0 HG2 ARG A 116 23.377 9.068 11.098 1.00 10.00 H new ATOM 0 HG3 ARG A 116 22.261 9.608 9.859 1.00 10.00 H new ATOM 0 HD2 ARG A 116 20.326 9.034 11.322 1.00 10.00 H new ATOM 0 HD3 ARG A 116 21.416 8.425 12.551 1.00 10.00 H new ATOM 0 HE ARG A 116 22.146 11.133 11.912 1.00 10.00 H new ATOM 0 HH11 ARG A 116 19.551 9.307 13.484 1.00 10.00 H new ATOM 0 HH12 ARG A 116 19.150 10.608 14.609 1.00 10.00 H new ATOM 0 HH21 ARG A 116 21.660 12.803 13.392 1.00 10.00 H new ATOM 0 HH22 ARG A 116 20.348 12.595 14.557 1.00 10.00 H new ATOM 1701 N PRO A 117 24.056 4.755 9.690 1.00 10.00 N ATOM 1702 CA PRO A 117 24.193 3.338 9.389 1.00 10.00 C ATOM 1703 C PRO A 117 22.830 2.653 9.253 1.00 10.00 C ATOM 1704 O PRO A 117 22.038 2.631 10.194 1.00 10.00 O ATOM 1705 CB PRO A 117 25.037 2.744 10.524 1.00 10.00 C ATOM 1706 CG PRO A 117 24.883 3.752 11.663 1.00 10.00 C ATOM 1707 CD PRO A 117 24.756 5.081 10.921 1.00 10.00 C ATOM 0 HA PRO A 117 24.680 3.182 8.426 1.00 10.00 H new ATOM 0 HB2 PRO A 117 24.679 1.756 10.814 1.00 10.00 H new ATOM 0 HB3 PRO A 117 26.080 2.631 10.229 1.00 10.00 H new ATOM 0 HG2 PRO A 117 24.004 3.543 12.272 1.00 10.00 H new ATOM 0 HG3 PRO A 117 25.744 3.742 12.331 1.00 10.00 H new ATOM 0 HD2 PRO A 117 24.201 5.811 11.510 1.00 10.00 H new ATOM 0 HD3 PRO A 117 25.735 5.515 10.716 1.00 10.00 H new ATOM 1715 N LEU A 118 22.570 2.067 8.079 1.00 10.00 N ATOM 1716 CA LEU A 118 21.366 1.300 7.810 1.00 10.00 C ATOM 1717 C LEU A 118 21.477 -0.051 8.527 1.00 10.00 C ATOM 1718 O LEU A 118 21.732 -1.086 7.917 1.00 10.00 O ATOM 1719 CB LEU A 118 21.147 1.167 6.292 1.00 10.00 C ATOM 1720 CG LEU A 118 20.696 2.487 5.634 1.00 10.00 C ATOM 1721 CD1 LEU A 118 21.856 3.401 5.223 1.00 10.00 C ATOM 1722 CD2 LEU A 118 19.854 2.217 4.384 1.00 10.00 C ATOM 0 H LEU A 118 23.205 2.118 7.282 1.00 10.00 H new ATOM 0 HA LEU A 118 20.484 1.811 8.197 1.00 10.00 H new ATOM 0 HB2 LEU A 118 22.073 0.831 5.824 1.00 10.00 H new ATOM 0 HB3 LEU A 118 20.398 0.398 6.104 1.00 10.00 H new ATOM 0 HG LEU A 118 20.113 2.996 6.402 1.00 10.00 H new ATOM 0 HD11 LEU A 118 21.460 4.309 4.768 1.00 10.00 H new ATOM 0 HD12 LEU A 118 22.443 3.663 6.104 1.00 10.00 H new ATOM 0 HD13 LEU A 118 22.491 2.882 4.505 1.00 10.00 H new ATOM 0 HD21 LEU A 118 19.549 3.164 3.939 1.00 10.00 H new ATOM 0 HD22 LEU A 118 20.444 1.651 3.663 1.00 10.00 H new ATOM 0 HD23 LEU A 118 18.969 1.643 4.659 1.00 10.00 H new ATOM 1734 N LYS A 119 21.324 -0.015 9.850 1.00 10.00 N ATOM 1735 CA LYS A 119 21.579 -1.127 10.744 1.00 10.00 C ATOM 1736 C LYS A 119 20.458 -2.157 10.620 1.00 10.00 C ATOM 1737 O LYS A 119 19.354 -1.959 11.134 1.00 10.00 O ATOM 1738 CB LYS A 119 21.752 -0.599 12.174 1.00 10.00 C ATOM 1739 CG LYS A 119 22.106 -1.704 13.185 1.00 10.00 C ATOM 1740 CD LYS A 119 20.963 -1.880 14.192 1.00 10.00 C ATOM 1741 CE LYS A 119 21.289 -2.914 15.278 1.00 10.00 C ATOM 1742 NZ LYS A 119 20.248 -2.919 16.324 1.00 10.00 N ATOM 0 H LYS A 119 21.008 0.822 10.339 1.00 10.00 H new ATOM 0 HA LYS A 119 22.505 -1.634 10.472 1.00 10.00 H new ATOM 0 HB2 LYS A 119 22.536 0.159 12.183 1.00 10.00 H new ATOM 0 HB3 LYS A 119 20.831 -0.109 12.488 1.00 10.00 H new ATOM 0 HG2 LYS A 119 22.288 -2.643 12.661 1.00 10.00 H new ATOM 0 HG3 LYS A 119 23.027 -1.448 13.709 1.00 10.00 H new ATOM 0 HD2 LYS A 119 20.746 -0.921 14.662 1.00 10.00 H new ATOM 0 HD3 LYS A 119 20.061 -2.186 13.663 1.00 10.00 H new ATOM 0 HE2 LYS A 119 21.367 -3.905 14.831 1.00 10.00 H new ATOM 0 HE3 LYS A 119 22.258 -2.688 15.723 1.00 10.00 H new ATOM 0 HZ1 LYS A 119 20.479 -3.637 17.040 1.00 10.00 H new ATOM 0 HZ2 LYS A 119 20.204 -1.983 16.774 1.00 10.00 H new ATOM 0 HZ3 LYS A 119 19.327 -3.141 15.896 1.00 10.00 H new ATOM 1756 N VAL A 120 20.774 -3.262 9.941 1.00 10.00 N ATOM 1757 CA VAL A 120 19.898 -4.408 9.780 1.00 10.00 C ATOM 1758 C VAL A 120 19.174 -4.747 11.087 1.00 10.00 C ATOM 1759 O VAL A 120 19.815 -5.097 12.077 1.00 10.00 O ATOM 1760 CB VAL A 120 20.675 -5.600 9.181 1.00 10.00 C ATOM 1761 CG1 VAL A 120 21.953 -5.966 9.952 1.00 10.00 C ATOM 1762 CG2 VAL A 120 19.787 -6.846 9.065 1.00 10.00 C ATOM 0 H VAL A 120 21.675 -3.380 9.477 1.00 10.00 H new ATOM 0 HA VAL A 120 19.113 -4.156 9.067 1.00 10.00 H new ATOM 0 HB VAL A 120 20.980 -5.262 8.191 1.00 10.00 H new ATOM 0 HG11 VAL A 120 22.440 -6.812 9.468 1.00 10.00 H new ATOM 0 HG12 VAL A 120 22.631 -5.112 9.959 1.00 10.00 H new ATOM 0 HG13 VAL A 120 21.696 -6.233 10.977 1.00 10.00 H new ATOM 0 HG21 VAL A 120 20.365 -7.666 8.640 1.00 10.00 H new ATOM 0 HG22 VAL A 120 19.427 -7.130 10.054 1.00 10.00 H new ATOM 0 HG23 VAL A 120 18.937 -6.628 8.419 1.00 10.00 H new ATOM 1772 N GLY A 121 17.844 -4.627 11.088 1.00 10.00 N ATOM 1773 CA GLY A 121 17.004 -5.006 12.209 1.00 10.00 C ATOM 1774 C GLY A 121 16.279 -3.799 12.786 1.00 10.00 C ATOM 1775 O GLY A 121 15.196 -3.965 13.345 1.00 10.00 O ATOM 0 H GLY A 121 17.320 -4.258 10.295 1.00 10.00 H new ATOM 0 HA2 GLY A 121 16.276 -5.751 11.886 1.00 10.00 H new ATOM 0 HA3 GLY A 121 17.614 -5.471 12.983 1.00 10.00 H new ATOM 1779 N GLU A 122 16.849 -2.594 12.662 1.00 10.00 N ATOM 1780 CA GLU A 122 16.253 -1.432 13.275 1.00 10.00 C ATOM 1781 C GLU A 122 15.073 -0.952 12.446 1.00 10.00 C ATOM 1782 O GLU A 122 14.625 -1.566 11.474 1.00 10.00 O ATOM 1783 CB GLU A 122 17.307 -0.327 13.486 1.00 10.00 C ATOM 1784 CG GLU A 122 17.427 0.079 14.965 1.00 10.00 C ATOM 1785 CD GLU A 122 18.169 -0.969 15.785 1.00 10.00 C ATOM 1786 OE1 GLU A 122 17.911 -2.180 15.603 1.00 10.00 O ATOM 1787 OE2 GLU A 122 19.104 -0.603 16.531 1.00 10.00 O ATOM 0 H GLU A 122 17.711 -2.413 12.147 1.00 10.00 H new ATOM 0 HA GLU A 122 15.874 -1.701 14.261 1.00 10.00 H new ATOM 0 HB2 GLU A 122 18.275 -0.676 13.126 1.00 10.00 H new ATOM 0 HB3 GLU A 122 17.041 0.546 12.891 1.00 10.00 H new ATOM 0 HG2 GLU A 122 17.949 1.033 15.038 1.00 10.00 H new ATOM 0 HG3 GLU A 122 16.431 0.228 15.382 1.00 10.00 H new ATOM 1794 N THR A 123 14.558 0.185 12.877 1.00 10.00 N ATOM 1795 CA THR A 123 13.426 0.859 12.278 1.00 10.00 C ATOM 1796 C THR A 123 13.594 2.353 12.520 1.00 10.00 C ATOM 1797 O THR A 123 13.906 2.762 13.636 1.00 10.00 O ATOM 1798 CB THR A 123 12.114 0.271 12.827 1.00 10.00 C ATOM 1799 OG1 THR A 123 11.949 -1.054 12.352 1.00 10.00 O ATOM 1800 CG2 THR A 123 10.881 1.065 12.393 1.00 10.00 C ATOM 0 H THR A 123 14.933 0.681 13.685 1.00 10.00 H new ATOM 0 HA THR A 123 13.380 0.704 11.200 1.00 10.00 H new ATOM 0 HB THR A 123 12.192 0.309 13.914 1.00 10.00 H new ATOM 0 HG1 THR A 123 12.791 -1.369 11.961 1.00 10.00 H new ATOM 0 HG21 THR A 123 9.986 0.604 12.810 1.00 10.00 H new ATOM 0 HG22 THR A 123 10.963 2.090 12.754 1.00 10.00 H new ATOM 0 HG23 THR A 123 10.814 1.068 11.305 1.00 10.00 H new ATOM 1808 N VAL A 124 13.458 3.148 11.456 1.00 10.00 N ATOM 1809 CA VAL A 124 13.766 4.569 11.448 1.00 10.00 C ATOM 1810 C VAL A 124 12.557 5.325 10.899 1.00 10.00 C ATOM 1811 O VAL A 124 11.983 4.924 9.889 1.00 10.00 O ATOM 1812 CB VAL A 124 15.026 4.808 10.597 1.00 10.00 C ATOM 1813 CG1 VAL A 124 15.402 6.294 10.573 1.00 10.00 C ATOM 1814 CG2 VAL A 124 16.215 4.006 11.147 1.00 10.00 C ATOM 0 H VAL A 124 13.121 2.806 10.556 1.00 10.00 H new ATOM 0 HA VAL A 124 13.971 4.932 12.455 1.00 10.00 H new ATOM 0 HB VAL A 124 14.799 4.478 9.583 1.00 10.00 H new ATOM 0 HG11 VAL A 124 16.296 6.433 9.965 1.00 10.00 H new ATOM 0 HG12 VAL A 124 14.580 6.870 10.148 1.00 10.00 H new ATOM 0 HG13 VAL A 124 15.598 6.636 11.589 1.00 10.00 H new ATOM 0 HG21 VAL A 124 17.095 4.190 10.530 1.00 10.00 H new ATOM 0 HG22 VAL A 124 16.419 4.315 12.172 1.00 10.00 H new ATOM 0 HG23 VAL A 124 15.976 2.943 11.130 1.00 10.00 H new ATOM 1824 N ASN A 125 12.163 6.414 11.562 1.00 10.00 N ATOM 1825 CA ASN A 125 11.058 7.243 11.101 1.00 10.00 C ATOM 1826 C ASN A 125 11.504 8.055 9.889 1.00 10.00 C ATOM 1827 O ASN A 125 12.308 8.976 10.028 1.00 10.00 O ATOM 1828 CB ASN A 125 10.552 8.172 12.215 1.00 10.00 C ATOM 1829 CG ASN A 125 9.698 7.455 13.260 1.00 10.00 C ATOM 1830 OD1 ASN A 125 9.444 6.259 13.170 1.00 10.00 O ATOM 1831 ND2 ASN A 125 9.235 8.189 14.268 1.00 10.00 N ATOM 0 H ASN A 125 12.599 6.740 12.425 1.00 10.00 H new ATOM 0 HA ASN A 125 10.231 6.592 10.818 1.00 10.00 H new ATOM 0 HB2 ASN A 125 11.407 8.634 12.709 1.00 10.00 H new ATOM 0 HB3 ASN A 125 9.968 8.977 11.769 1.00 10.00 H new ATOM 0 HD21 ASN A 125 8.655 7.758 14.988 1.00 10.00 H new ATOM 0 HD22 ASN A 125 9.460 9.182 14.321 1.00 10.00 H new ATOM 1838 N ILE A 126 10.962 7.734 8.713 1.00 10.00 N ATOM 1839 CA ILE A 126 10.959 8.643 7.579 1.00 10.00 C ATOM 1840 C ILE A 126 9.749 9.571 7.699 1.00 10.00 C ATOM 1841 O ILE A 126 8.974 9.472 8.652 1.00 10.00 O ATOM 1842 CB ILE A 126 10.978 7.866 6.253 1.00 10.00 C ATOM 1843 CG1 ILE A 126 9.715 7.035 5.987 1.00 10.00 C ATOM 1844 CG2 ILE A 126 12.225 6.973 6.194 1.00 10.00 C ATOM 1845 CD1 ILE A 126 9.653 6.618 4.519 1.00 10.00 C ATOM 0 H ILE A 126 10.515 6.837 8.526 1.00 10.00 H new ATOM 0 HA ILE A 126 11.862 9.253 7.584 1.00 10.00 H new ATOM 0 HB ILE A 126 11.006 8.616 5.462 1.00 10.00 H new ATOM 0 HG12 ILE A 126 9.713 6.150 6.624 1.00 10.00 H new ATOM 0 HG13 ILE A 126 8.829 7.615 6.245 1.00 10.00 H new ATOM 0 HG21 ILE A 126 12.235 6.424 5.253 1.00 10.00 H new ATOM 0 HG22 ILE A 126 13.119 7.592 6.262 1.00 10.00 H new ATOM 0 HG23 ILE A 126 12.207 6.268 7.025 1.00 10.00 H new ATOM 0 HD11 ILE A 126 8.752 6.029 4.346 1.00 10.00 H new ATOM 0 HD12 ILE A 126 9.632 7.507 3.889 1.00 10.00 H new ATOM 0 HD13 ILE A 126 10.530 6.019 4.273 1.00 10.00 H new ATOM 1857 N THR A 127 9.564 10.484 6.745 1.00 10.00 N ATOM 1858 CA THR A 127 8.393 11.341 6.665 1.00 10.00 C ATOM 1859 C THR A 127 8.076 11.621 5.196 1.00 10.00 C ATOM 1860 O THR A 127 8.932 12.132 4.475 1.00 10.00 O ATOM 1861 CB THR A 127 8.633 12.619 7.487 1.00 10.00 C ATOM 1862 OG1 THR A 127 8.775 12.290 8.856 1.00 10.00 O ATOM 1863 CG2 THR A 127 7.488 13.628 7.367 1.00 10.00 C ATOM 0 H THR A 127 10.238 10.647 5.997 1.00 10.00 H new ATOM 0 HA THR A 127 7.520 10.850 7.095 1.00 10.00 H new ATOM 0 HB THR A 127 9.539 13.075 7.087 1.00 10.00 H new ATOM 0 HG1 THR A 127 8.728 11.317 8.965 1.00 10.00 H new ATOM 0 HG21 THR A 127 7.714 14.508 7.968 1.00 10.00 H new ATOM 0 HG22 THR A 127 7.370 13.922 6.324 1.00 10.00 H new ATOM 0 HG23 THR A 127 6.564 13.173 7.723 1.00 10.00 H new ATOM 1871 N LEU A 128 6.869 11.267 4.742 1.00 10.00 N ATOM 1872 CA LEU A 128 6.444 11.505 3.365 1.00 10.00 C ATOM 1873 C LEU A 128 5.826 12.894 3.203 1.00 10.00 C ATOM 1874 O LEU A 128 5.694 13.631 4.178 1.00 10.00 O ATOM 1875 CB LEU A 128 5.540 10.374 2.835 1.00 10.00 C ATOM 1876 CG LEU A 128 4.388 9.895 3.728 1.00 10.00 C ATOM 1877 CD1 LEU A 128 3.283 10.948 3.720 1.00 10.00 C ATOM 1878 CD2 LEU A 128 3.822 8.583 3.173 1.00 10.00 C ATOM 0 H LEU A 128 6.164 10.809 5.319 1.00 10.00 H new ATOM 0 HA LEU A 128 7.335 11.490 2.737 1.00 10.00 H new ATOM 0 HB2 LEU A 128 5.113 10.704 1.888 1.00 10.00 H new ATOM 0 HB3 LEU A 128 6.174 9.514 2.617 1.00 10.00 H new ATOM 0 HG LEU A 128 4.754 9.739 4.743 1.00 10.00 H new ATOM 0 HD11 LEU A 128 2.460 10.616 4.352 1.00 10.00 H new ATOM 0 HD12 LEU A 128 3.676 11.891 4.101 1.00 10.00 H new ATOM 0 HD13 LEU A 128 2.923 11.090 2.701 1.00 10.00 H new ATOM 0 HD21 LEU A 128 3.004 8.243 3.807 1.00 10.00 H new ATOM 0 HD22 LEU A 128 3.453 8.746 2.160 1.00 10.00 H new ATOM 0 HD23 LEU A 128 4.607 7.827 3.156 1.00 10.00 H new ATOM 1890 N LYS A 129 5.444 13.248 1.970 1.00 10.00 N ATOM 1891 CA LYS A 129 4.681 14.439 1.629 1.00 10.00 C ATOM 1892 C LYS A 129 3.983 14.185 0.296 1.00 10.00 C ATOM 1893 O LYS A 129 4.597 14.311 -0.760 1.00 10.00 O ATOM 1894 CB LYS A 129 5.604 15.662 1.571 1.00 10.00 C ATOM 1895 CG LYS A 129 4.879 16.957 1.179 1.00 10.00 C ATOM 1896 CD LYS A 129 5.896 18.103 1.104 1.00 10.00 C ATOM 1897 CE LYS A 129 5.215 19.408 0.665 1.00 10.00 C ATOM 1898 NZ LYS A 129 6.179 20.521 0.540 1.00 10.00 N ATOM 0 H LYS A 129 5.672 12.683 1.152 1.00 10.00 H new ATOM 0 HA LYS A 129 3.929 14.650 2.390 1.00 10.00 H new ATOM 0 HB2 LYS A 129 6.075 15.799 2.545 1.00 10.00 H new ATOM 0 HB3 LYS A 129 6.403 15.471 0.855 1.00 10.00 H new ATOM 0 HG2 LYS A 129 4.382 16.833 0.217 1.00 10.00 H new ATOM 0 HG3 LYS A 129 4.105 17.190 1.910 1.00 10.00 H new ATOM 0 HD2 LYS A 129 6.366 18.242 2.077 1.00 10.00 H new ATOM 0 HD3 LYS A 129 6.689 17.847 0.401 1.00 10.00 H new ATOM 0 HE2 LYS A 129 4.715 19.252 -0.291 1.00 10.00 H new ATOM 0 HE3 LYS A 129 4.444 19.676 1.388 1.00 10.00 H new ATOM 0 HZ1 LYS A 129 5.678 21.382 0.242 1.00 10.00 H new ATOM 0 HZ2 LYS A 129 6.638 20.688 1.458 1.00 10.00 H new ATOM 0 HZ3 LYS A 129 6.900 20.277 -0.168 1.00 10.00 H new ATOM 1912 N ALA A 130 2.701 13.831 0.327 1.00 10.00 N ATOM 1913 CA ALA A 130 1.875 13.811 -0.866 1.00 10.00 C ATOM 1914 C ALA A 130 1.193 15.154 -1.044 1.00 10.00 C ATOM 1915 O ALA A 130 0.457 15.597 -0.163 1.00 10.00 O ATOM 1916 CB ALA A 130 0.862 12.669 -0.809 1.00 10.00 C ATOM 0 H ALA A 130 2.212 13.552 1.178 1.00 10.00 H new ATOM 0 HA ALA A 130 2.511 13.634 -1.734 1.00 10.00 H new ATOM 0 HB1 ALA A 130 0.255 12.675 -1.714 1.00 10.00 H new ATOM 0 HB2 ALA A 130 1.389 11.718 -0.733 1.00 10.00 H new ATOM 0 HB3 ALA A 130 0.218 12.797 0.061 1.00 10.00 H new ATOM 1922 N THR A 131 1.414 15.792 -2.195 1.00 10.00 N ATOM 1923 CA THR A 131 0.804 17.076 -2.513 1.00 10.00 C ATOM 1924 C THR A 131 -0.609 16.817 -3.055 1.00 10.00 C ATOM 1925 O THR A 131 -0.931 17.116 -4.201 1.00 10.00 O ATOM 1926 CB THR A 131 1.758 17.928 -3.375 1.00 10.00 C ATOM 1927 OG1 THR A 131 1.249 19.235 -3.533 1.00 10.00 O ATOM 1928 CG2 THR A 131 2.113 17.334 -4.740 1.00 10.00 C ATOM 0 H THR A 131 2.021 15.430 -2.930 1.00 10.00 H new ATOM 0 HA THR A 131 0.656 17.706 -1.636 1.00 10.00 H new ATOM 0 HB THR A 131 2.694 17.946 -2.817 1.00 10.00 H new ATOM 0 HG1 THR A 131 1.867 19.763 -4.081 1.00 10.00 H new ATOM 0 HG21 THR A 131 2.788 18.009 -5.266 1.00 10.00 H new ATOM 0 HG22 THR A 131 2.601 16.369 -4.601 1.00 10.00 H new ATOM 0 HG23 THR A 131 1.204 17.200 -5.326 1.00 10.00 H new ATOM 1936 N ASP A 132 -1.421 16.209 -2.184 1.00 10.00 N ATOM 1937 CA ASP A 132 -2.826 15.842 -2.337 1.00 10.00 C ATOM 1938 C ASP A 132 -3.292 15.425 -0.945 1.00 10.00 C ATOM 1939 O ASP A 132 -4.213 16.003 -0.376 1.00 10.00 O ATOM 1940 CB ASP A 132 -3.027 14.633 -3.269 1.00 10.00 C ATOM 1941 CG ASP A 132 -2.942 14.942 -4.749 1.00 10.00 C ATOM 1942 OD1 ASP A 132 -3.534 15.933 -5.231 1.00 10.00 O ATOM 1943 OD2 ASP A 132 -2.247 14.172 -5.446 1.00 10.00 O ATOM 0 H ASP A 132 -1.073 15.936 -1.265 1.00 10.00 H new ATOM 0 HA ASP A 132 -3.373 16.682 -2.765 1.00 10.00 H new ATOM 0 HB2 ASP A 132 -2.278 13.879 -3.027 1.00 10.00 H new ATOM 0 HB3 ASP A 132 -4.002 14.192 -3.061 1.00 10.00 H new ATOM 1948 N GLY A 133 -2.627 14.390 -0.420 1.00 10.00 N ATOM 1949 CA GLY A 133 -2.958 13.758 0.842 1.00 10.00 C ATOM 1950 C GLY A 133 -2.372 14.523 2.024 1.00 10.00 C ATOM 1951 O GLY A 133 -3.033 15.389 2.592 1.00 10.00 O ATOM 0 H GLY A 133 -1.823 13.964 -0.881 1.00 10.00 H new ATOM 0 HA2 GLY A 133 -4.041 13.699 0.947 1.00 10.00 H new ATOM 0 HA3 GLY A 133 -2.581 12.735 0.847 1.00 10.00 H new ATOM 1955 N ARG A 134 -1.165 14.152 2.468 1.00 10.00 N ATOM 1956 CA ARG A 134 -0.573 14.723 3.660 1.00 10.00 C ATOM 1957 C ARG A 134 0.933 14.490 3.649 1.00 10.00 C ATOM 1958 O ARG A 134 1.446 13.731 2.828 1.00 10.00 O ATOM 1959 CB ARG A 134 -1.224 14.105 4.913 1.00 10.00 C ATOM 1960 CG ARG A 134 -1.693 15.207 5.866 1.00 10.00 C ATOM 1961 CD ARG A 134 -2.206 14.601 7.176 1.00 10.00 C ATOM 1962 NE ARG A 134 -2.736 15.645 8.066 1.00 10.00 N ATOM 1963 CZ ARG A 134 -3.211 15.430 9.304 1.00 10.00 C ATOM 1964 NH1 ARG A 134 -3.209 14.191 9.809 1.00 10.00 N ATOM 1965 NH2 ARG A 134 -3.685 16.451 10.027 1.00 10.00 N ATOM 0 H ARG A 134 -0.584 13.452 2.007 1.00 10.00 H new ATOM 0 HA ARG A 134 -0.751 15.798 3.680 1.00 10.00 H new ATOM 0 HB2 ARG A 134 -2.070 13.482 4.622 1.00 10.00 H new ATOM 0 HB3 ARG A 134 -0.510 13.456 5.420 1.00 10.00 H new ATOM 0 HG2 ARG A 134 -0.870 15.892 6.073 1.00 10.00 H new ATOM 0 HG3 ARG A 134 -2.483 15.791 5.395 1.00 10.00 H new ATOM 0 HD2 ARG A 134 -2.986 13.870 6.962 1.00 10.00 H new ATOM 0 HD3 ARG A 134 -1.397 14.068 7.676 1.00 10.00 H new ATOM 0 HE ARG A 134 -2.743 16.604 7.717 1.00 10.00 H new ATOM 0 HH11 ARG A 134 -2.848 13.415 9.254 1.00 10.00 H new ATOM 0 HH12 ARG A 134 -3.569 14.023 10.749 1.00 10.00 H new ATOM 0 HH21 ARG A 134 -3.686 17.394 9.638 1.00 10.00 H new ATOM 0 HH22 ARG A 134 -4.045 16.286 10.967 1.00 10.00 H new ATOM 1979 N THR A 135 1.608 15.092 4.624 1.00 10.00 N ATOM 1980 CA THR A 135 2.867 14.644 5.171 1.00 10.00 C ATOM 1981 C THR A 135 2.521 13.798 6.397 1.00 10.00 C ATOM 1982 O THR A 135 1.519 14.066 7.064 1.00 10.00 O ATOM 1983 CB THR A 135 3.765 15.853 5.494 1.00 10.00 C ATOM 1984 OG1 THR A 135 4.975 15.431 6.082 1.00 10.00 O ATOM 1985 CG2 THR A 135 3.108 16.872 6.433 1.00 10.00 C ATOM 0 H THR A 135 1.269 15.945 5.069 1.00 10.00 H new ATOM 0 HA THR A 135 3.440 14.041 4.467 1.00 10.00 H new ATOM 0 HB THR A 135 3.944 16.343 4.537 1.00 10.00 H new ATOM 0 HG1 THR A 135 5.331 14.665 5.585 1.00 10.00 H new ATOM 0 HG21 THR A 135 3.798 17.696 6.616 1.00 10.00 H new ATOM 0 HG22 THR A 135 2.198 17.257 5.973 1.00 10.00 H new ATOM 0 HG23 THR A 135 2.861 16.389 7.378 1.00 10.00 H new ATOM 1993 N LEU A 136 3.297 12.745 6.648 1.00 10.00 N ATOM 1994 CA LEU A 136 3.094 11.813 7.742 1.00 10.00 C ATOM 1995 C LEU A 136 4.450 11.176 8.017 1.00 10.00 C ATOM 1996 O LEU A 136 5.213 10.960 7.074 1.00 10.00 O ATOM 1997 CB LEU A 136 2.043 10.765 7.347 1.00 10.00 C ATOM 1998 CG LEU A 136 1.693 9.760 8.457 1.00 10.00 C ATOM 1999 CD1 LEU A 136 1.044 10.439 9.670 1.00 10.00 C ATOM 2000 CD2 LEU A 136 0.732 8.708 7.892 1.00 10.00 C ATOM 0 H LEU A 136 4.108 12.515 6.074 1.00 10.00 H new ATOM 0 HA LEU A 136 2.721 12.308 8.639 1.00 10.00 H new ATOM 0 HB2 LEU A 136 1.132 11.280 7.041 1.00 10.00 H new ATOM 0 HB3 LEU A 136 2.406 10.215 6.478 1.00 10.00 H new ATOM 0 HG LEU A 136 2.620 9.298 8.795 1.00 10.00 H new ATOM 0 HD11 LEU A 136 0.815 9.689 10.427 1.00 10.00 H new ATOM 0 HD12 LEU A 136 1.731 11.176 10.085 1.00 10.00 H new ATOM 0 HD13 LEU A 136 0.124 10.935 9.360 1.00 10.00 H new ATOM 0 HD21 LEU A 136 0.478 7.991 8.672 1.00 10.00 H new ATOM 0 HD22 LEU A 136 -0.176 9.197 7.539 1.00 10.00 H new ATOM 0 HD23 LEU A 136 1.210 8.187 7.062 1.00 10.00 H new ATOM 2012 N ASN A 137 4.742 10.910 9.290 1.00 10.00 N ATOM 2013 CA ASN A 137 5.945 10.259 9.769 1.00 10.00 C ATOM 2014 C ASN A 137 5.678 8.766 9.746 1.00 10.00 C ATOM 2015 O ASN A 137 4.613 8.326 10.173 1.00 10.00 O ATOM 2016 CB ASN A 137 6.296 10.726 11.185 1.00 10.00 C ATOM 2017 CG ASN A 137 5.195 10.397 12.191 1.00 10.00 C ATOM 2018 OD1 ASN A 137 4.064 10.851 12.037 1.00 10.00 O ATOM 2019 ND2 ASN A 137 5.505 9.613 13.221 1.00 10.00 N ATOM 0 H ASN A 137 4.107 11.159 10.049 1.00 10.00 H new ATOM 0 HA ASN A 137 6.795 10.511 9.135 1.00 10.00 H new ATOM 0 HB2 ASN A 137 7.227 10.255 11.501 1.00 10.00 H new ATOM 0 HB3 ASN A 137 6.470 11.802 11.178 1.00 10.00 H new ATOM 0 HD21 ASN A 137 4.794 9.373 13.911 1.00 10.00 H new ATOM 0 HD22 ASN A 137 6.454 9.252 13.320 1.00 10.00 H new ATOM 2026 N VAL A 138 6.608 7.998 9.191 1.00 10.00 N ATOM 2027 CA VAL A 138 6.353 6.626 8.804 1.00 10.00 C ATOM 2028 C VAL A 138 7.563 5.795 9.226 1.00 10.00 C ATOM 2029 O VAL A 138 8.694 6.133 8.890 1.00 10.00 O ATOM 2030 CB VAL A 138 6.058 6.622 7.292 1.00 10.00 C ATOM 2031 CG1 VAL A 138 6.346 5.269 6.625 1.00 10.00 C ATOM 2032 CG2 VAL A 138 4.594 7.000 7.028 1.00 10.00 C ATOM 0 H VAL A 138 7.559 8.314 8.999 1.00 10.00 H new ATOM 0 HA VAL A 138 5.487 6.179 9.292 1.00 10.00 H new ATOM 0 HB VAL A 138 6.729 7.360 6.854 1.00 10.00 H new ATOM 0 HG11 VAL A 138 6.118 5.332 5.561 1.00 10.00 H new ATOM 0 HG12 VAL A 138 7.398 5.015 6.756 1.00 10.00 H new ATOM 0 HG13 VAL A 138 5.727 4.498 7.084 1.00 10.00 H new ATOM 0 HG21 VAL A 138 4.404 6.992 5.955 1.00 10.00 H new ATOM 0 HG22 VAL A 138 3.938 6.280 7.518 1.00 10.00 H new ATOM 0 HG23 VAL A 138 4.399 7.997 7.424 1.00 10.00 H new ATOM 2042 N ALA A 139 7.328 4.731 9.996 1.00 10.00 N ATOM 2043 CA ALA A 139 8.380 3.911 10.573 1.00 10.00 C ATOM 2044 C ALA A 139 8.842 2.891 9.535 1.00 10.00 C ATOM 2045 O ALA A 139 8.082 1.994 9.173 1.00 10.00 O ATOM 2046 CB ALA A 139 7.841 3.230 11.834 1.00 10.00 C ATOM 0 H ALA A 139 6.388 4.416 10.236 1.00 10.00 H new ATOM 0 HA ALA A 139 9.239 4.520 10.854 1.00 10.00 H new ATOM 0 HB1 ALA A 139 8.622 2.612 12.276 1.00 10.00 H new ATOM 0 HB2 ALA A 139 7.529 3.988 12.552 1.00 10.00 H new ATOM 0 HB3 ALA A 139 6.987 2.604 11.573 1.00 10.00 H new ATOM 2052 N ALA A 140 10.072 3.047 9.042 1.00 10.00 N ATOM 2053 CA ALA A 140 10.647 2.205 8.009 1.00 10.00 C ATOM 2054 C ALA A 140 11.612 1.196 8.619 1.00 10.00 C ATOM 2055 O ALA A 140 12.605 1.604 9.218 1.00 10.00 O ATOM 2056 CB ALA A 140 11.373 3.079 6.993 1.00 10.00 C ATOM 0 H ALA A 140 10.705 3.781 9.362 1.00 10.00 H new ATOM 0 HA ALA A 140 9.849 1.655 7.511 1.00 10.00 H new ATOM 0 HB1 ALA A 140 11.806 2.450 6.215 1.00 10.00 H new ATOM 0 HB2 ALA A 140 10.667 3.777 6.543 1.00 10.00 H new ATOM 0 HB3 ALA A 140 12.166 3.636 7.493 1.00 10.00 H new ATOM 2062 N THR A 141 11.340 -0.102 8.461 1.00 10.00 N ATOM 2063 CA THR A 141 12.182 -1.163 9.015 1.00 10.00 C ATOM 2064 C THR A 141 13.356 -1.455 8.079 1.00 10.00 C ATOM 2065 O THR A 141 13.159 -1.683 6.887 1.00 10.00 O ATOM 2066 CB THR A 141 11.331 -2.400 9.322 1.00 10.00 C ATOM 2067 OG1 THR A 141 10.341 -2.035 10.262 1.00 10.00 O ATOM 2068 CG2 THR A 141 12.151 -3.558 9.902 1.00 10.00 C ATOM 0 H THR A 141 10.530 -0.446 7.945 1.00 10.00 H new ATOM 0 HA THR A 141 12.616 -0.836 9.960 1.00 10.00 H new ATOM 0 HB THR A 141 10.897 -2.745 8.383 1.00 10.00 H new ATOM 0 HG1 THR A 141 10.771 -1.684 11.070 1.00 10.00 H new ATOM 0 HG21 THR A 141 11.495 -4.406 10.099 1.00 10.00 H new ATOM 0 HG22 THR A 141 12.920 -3.853 9.188 1.00 10.00 H new ATOM 0 HG23 THR A 141 12.622 -3.240 10.832 1.00 10.00 H new ATOM 2076 N VAL A 142 14.584 -1.423 8.601 1.00 10.00 N ATOM 2077 CA VAL A 142 15.791 -1.366 7.794 1.00 10.00 C ATOM 2078 C VAL A 142 16.461 -2.732 7.869 1.00 10.00 C ATOM 2079 O VAL A 142 16.939 -3.100 8.938 1.00 10.00 O ATOM 2080 CB VAL A 142 16.697 -0.250 8.346 1.00 10.00 C ATOM 2081 CG1 VAL A 142 17.928 -0.068 7.457 1.00 10.00 C ATOM 2082 CG2 VAL A 142 15.952 1.091 8.428 1.00 10.00 C ATOM 0 H VAL A 142 14.763 -1.436 9.605 1.00 10.00 H new ATOM 0 HA VAL A 142 15.577 -1.137 6.750 1.00 10.00 H new ATOM 0 HB VAL A 142 17.001 -0.552 9.348 1.00 10.00 H new ATOM 0 HG11 VAL A 142 18.556 0.725 7.863 1.00 10.00 H new ATOM 0 HG12 VAL A 142 18.494 -0.999 7.425 1.00 10.00 H new ATOM 0 HG13 VAL A 142 17.612 0.200 6.449 1.00 10.00 H new ATOM 0 HG21 VAL A 142 16.622 1.856 8.822 1.00 10.00 H new ATOM 0 HG22 VAL A 142 15.615 1.381 7.433 1.00 10.00 H new ATOM 0 HG23 VAL A 142 15.090 0.989 9.088 1.00 10.00 H new ATOM 2092 N LYS A 143 16.473 -3.511 6.782 1.00 10.00 N ATOM 2093 CA LYS A 143 17.080 -4.835 6.790 1.00 10.00 C ATOM 2094 C LYS A 143 17.442 -5.276 5.373 1.00 10.00 C ATOM 2095 O LYS A 143 16.739 -4.897 4.448 1.00 10.00 O ATOM 2096 CB LYS A 143 16.100 -5.826 7.433 1.00 10.00 C ATOM 2097 CG LYS A 143 14.808 -5.957 6.613 1.00 10.00 C ATOM 2098 CD LYS A 143 13.859 -6.935 7.301 1.00 10.00 C ATOM 2099 CE LYS A 143 12.717 -7.314 6.351 1.00 10.00 C ATOM 2100 NZ LYS A 143 11.956 -8.451 6.886 1.00 10.00 N ATOM 0 H LYS A 143 16.067 -3.241 5.886 1.00 10.00 H new ATOM 0 HA LYS A 143 18.003 -4.806 7.370 1.00 10.00 H new ATOM 0 HB2 LYS A 143 16.576 -6.803 7.522 1.00 10.00 H new ATOM 0 HB3 LYS A 143 15.858 -5.496 8.443 1.00 10.00 H new ATOM 0 HG2 LYS A 143 14.330 -4.983 6.511 1.00 10.00 H new ATOM 0 HG3 LYS A 143 15.038 -6.306 5.606 1.00 10.00 H new ATOM 0 HD2 LYS A 143 14.403 -7.830 7.604 1.00 10.00 H new ATOM 0 HD3 LYS A 143 13.455 -6.485 8.208 1.00 10.00 H new ATOM 0 HE2 LYS A 143 12.055 -6.460 6.211 1.00 10.00 H new ATOM 0 HE3 LYS A 143 13.121 -7.568 5.371 1.00 10.00 H new ATOM 0 HZ1 LYS A 143 11.187 -8.694 6.229 1.00 10.00 H new ATOM 0 HZ2 LYS A 143 12.587 -9.270 6.997 1.00 10.00 H new ATOM 0 HZ3 LYS A 143 11.554 -8.196 7.811 1.00 10.00 H new ATOM 2114 N LYS A 144 18.481 -6.098 5.193 1.00 10.00 N ATOM 2115 CA LYS A 144 18.843 -6.661 3.889 1.00 10.00 C ATOM 2116 C LYS A 144 18.449 -8.126 3.755 1.00 10.00 C ATOM 2117 O LYS A 144 18.463 -8.829 4.755 1.00 10.00 O ATOM 2118 CB LYS A 144 20.339 -6.450 3.581 1.00 10.00 C ATOM 2119 CG LYS A 144 21.316 -7.482 4.180 1.00 10.00 C ATOM 2120 CD LYS A 144 21.291 -7.585 5.715 1.00 10.00 C ATOM 2121 CE LYS A 144 22.171 -8.726 6.246 1.00 10.00 C ATOM 2122 NZ LYS A 144 21.532 -10.048 6.071 1.00 10.00 N ATOM 0 H LYS A 144 19.097 -6.392 5.951 1.00 10.00 H new ATOM 0 HA LYS A 144 18.267 -6.114 3.143 1.00 10.00 H new ATOM 0 HB2 LYS A 144 20.467 -6.446 2.499 1.00 10.00 H new ATOM 0 HB3 LYS A 144 20.625 -5.461 3.939 1.00 10.00 H new ATOM 0 HG2 LYS A 144 21.088 -8.462 3.761 1.00 10.00 H new ATOM 0 HG3 LYS A 144 22.328 -7.228 3.864 1.00 10.00 H new ATOM 0 HD2 LYS A 144 21.628 -6.641 6.144 1.00 10.00 H new ATOM 0 HD3 LYS A 144 20.265 -7.738 6.048 1.00 10.00 H new ATOM 0 HE2 LYS A 144 23.130 -8.716 5.727 1.00 10.00 H new ATOM 0 HE3 LYS A 144 22.379 -8.561 7.303 1.00 10.00 H new ATOM 0 HZ1 LYS A 144 22.160 -10.789 6.443 1.00 10.00 H new ATOM 0 HZ2 LYS A 144 20.629 -10.068 6.587 1.00 10.00 H new ATOM 0 HZ3 LYS A 144 21.357 -10.218 5.060 1.00 10.00 H new