USER MOD reduce.3.24.130724 H: found=0, std=0, add=688, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 690 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 68 MET CE :methyl -177:sc= -0.223 (180deg=-0.24) USER MOD Set 1.2: A 74 CYS SG : rot 119:sc= 0.363 USER MOD Set 2.1: A 47 LYS NZ :NH3+ 159:sc= 0.996 (180deg=0) USER MOD Set 2.2: A 62 THR OG1 : rot 180:sc= 0.859 USER MOD Single : A 25 LYS NZ :NH3+ -112:sc= 1.09 (180deg=0.338) USER MOD Single : A 30 MET CE :methyl 140:sc= -1.08 (180deg=-3.85!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 4:sc= 0.275 USER MOD Single : A 39 THR OG1 : rot 98:sc= 1.24 USER MOD Single : A 45 MET CE :methyl -160:sc= -0.109 (180deg=-0.65) USER MOD Single : A 49 LYS NZ :NH3+ 179:sc= 2.4 (180deg=2.38) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -178:sc= 1.21 (180deg=1.09) USER MOD Single : A 76 LYS NZ :NH3+ -175:sc= 1.86 (180deg=1.76) USER MOD Single : A 78 MET CE :methyl -150:sc= 0 (180deg=-0.137) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 30:sc= -0.0376 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -159:sc= 1.13 (180deg=0.728) USER MOD Single : A 98 SER OG : rot 180:sc= 0.808 USER MOD Single : A 109 THR OG1 : rot 120:sc= 0.602 USER MOD Single : A 110 GLN : amide:sc= -0.262 X(o=-0.26,f=-0.26) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 346 N ALA A 22 -3.883 -29.774 -5.442 1.00 0.00 N ATOM 347 CA ALA A 22 -3.615 -29.118 -6.708 1.00 0.00 C ATOM 348 C ALA A 22 -2.122 -29.187 -7.036 1.00 0.00 C ATOM 349 O ALA A 22 -1.274 -29.010 -6.157 1.00 0.00 O ATOM 350 CB ALA A 22 -4.064 -27.657 -6.619 1.00 0.00 C ATOM 0 HA ALA A 22 -4.166 -29.624 -7.501 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -3.866 -27.157 -7.567 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.132 -27.617 -6.404 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -3.514 -27.155 -5.822 1.00 0.00 H new ATOM 356 N GLU A 23 -1.811 -29.349 -8.319 1.00 0.00 N ATOM 357 CA GLU A 23 -0.467 -29.259 -8.882 1.00 0.00 C ATOM 358 C GLU A 23 -0.459 -28.344 -10.116 1.00 0.00 C ATOM 359 O GLU A 23 0.593 -27.797 -10.454 1.00 0.00 O ATOM 360 CB GLU A 23 0.060 -30.659 -9.245 1.00 0.00 C ATOM 361 CG GLU A 23 0.273 -31.560 -8.019 1.00 0.00 C ATOM 362 CD GLU A 23 0.926 -32.898 -8.411 1.00 0.00 C ATOM 363 OE1 GLU A 23 0.204 -33.865 -8.745 1.00 0.00 O ATOM 364 OE2 GLU A 23 2.174 -33.007 -8.372 1.00 0.00 O ATOM 0 H GLU A 23 -2.518 -29.555 -9.024 1.00 0.00 H new ATOM 0 HA GLU A 23 0.193 -28.827 -8.130 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -0.643 -31.140 -9.924 1.00 0.00 H new ATOM 0 HB3 GLU A 23 1.003 -30.558 -9.782 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.902 -31.046 -7.293 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.685 -31.749 -7.534 1.00 0.00 H new ATOM 371 N ASP A 24 -1.616 -28.091 -10.742 1.00 0.00 N ATOM 372 CA ASP A 24 -1.748 -27.236 -11.922 1.00 0.00 C ATOM 373 C ASP A 24 -2.589 -25.997 -11.602 1.00 0.00 C ATOM 374 O ASP A 24 -3.449 -26.028 -10.717 1.00 0.00 O ATOM 375 CB ASP A 24 -2.380 -28.029 -13.075 1.00 0.00 C ATOM 376 CG ASP A 24 -2.514 -27.158 -14.331 1.00 0.00 C ATOM 377 OD1 ASP A 24 -1.495 -26.907 -15.010 1.00 0.00 O ATOM 378 OD2 ASP A 24 -3.625 -26.662 -14.614 1.00 0.00 O ATOM 0 H ASP A 24 -2.504 -28.485 -10.433 1.00 0.00 H new ATOM 0 HA ASP A 24 -0.755 -26.903 -12.224 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.769 -28.904 -13.298 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.362 -28.394 -12.775 1.00 0.00 H new ATOM 383 N LYS A 25 -2.347 -24.911 -12.344 1.00 0.00 N ATOM 384 CA LYS A 25 -3.069 -23.640 -12.249 1.00 0.00 C ATOM 385 C LYS A 25 -4.591 -23.823 -12.198 1.00 0.00 C ATOM 386 O LYS A 25 -5.252 -23.115 -11.446 1.00 0.00 O ATOM 387 CB LYS A 25 -2.631 -22.727 -13.421 1.00 0.00 C ATOM 388 CG LYS A 25 -3.234 -23.198 -14.756 1.00 0.00 C ATOM 389 CD LYS A 25 -2.402 -23.010 -16.026 1.00 0.00 C ATOM 390 CE LYS A 25 -3.134 -23.736 -17.171 1.00 0.00 C ATOM 391 NZ LYS A 25 -3.129 -25.219 -17.039 1.00 0.00 N ATOM 0 H LYS A 25 -1.615 -24.894 -13.054 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.809 -23.163 -11.304 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -2.942 -21.702 -13.221 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.543 -22.722 -13.493 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -3.465 -24.259 -14.662 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -4.181 -22.677 -14.897 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -2.287 -21.951 -16.255 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -1.400 -23.418 -15.892 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.166 -23.387 -17.210 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -2.669 -23.463 -18.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -2.543 -25.633 -17.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -2.739 -25.484 -16.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -4.102 -25.578 -17.121 1.00 0.00 H new ATOM 405 N GLU A 26 -5.154 -24.766 -12.961 1.00 0.00 N ATOM 406 CA GLU A 26 -6.594 -24.962 -13.053 1.00 0.00 C ATOM 407 C GLU A 26 -7.110 -25.553 -11.742 1.00 0.00 C ATOM 408 O GLU A 26 -8.154 -25.145 -11.236 1.00 0.00 O ATOM 409 CB GLU A 26 -6.902 -25.897 -14.236 1.00 0.00 C ATOM 410 CG GLU A 26 -6.690 -25.203 -15.594 1.00 0.00 C ATOM 411 CD GLU A 26 -6.663 -26.190 -16.777 1.00 0.00 C ATOM 412 OE1 GLU A 26 -7.633 -26.960 -16.967 1.00 0.00 O ATOM 413 OE2 GLU A 26 -5.682 -26.167 -17.557 1.00 0.00 O ATOM 0 H GLU A 26 -4.615 -25.416 -13.533 1.00 0.00 H new ATOM 0 HA GLU A 26 -7.094 -24.008 -13.222 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -6.264 -26.778 -14.176 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -7.933 -26.244 -14.164 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.487 -24.476 -15.753 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -5.752 -24.648 -15.570 1.00 0.00 H new ATOM 420 N GLU A 27 -6.356 -26.479 -11.151 1.00 0.00 N ATOM 421 CA GLU A 27 -6.722 -27.125 -9.899 1.00 0.00 C ATOM 422 C GLU A 27 -6.612 -26.112 -8.756 1.00 0.00 C ATOM 423 O GLU A 27 -7.501 -26.041 -7.905 1.00 0.00 O ATOM 424 CB GLU A 27 -5.802 -28.325 -9.645 1.00 0.00 C ATOM 425 CG GLU A 27 -5.840 -29.373 -10.768 1.00 0.00 C ATOM 426 CD GLU A 27 -4.840 -30.508 -10.504 1.00 0.00 C ATOM 427 OE1 GLU A 27 -3.655 -30.206 -10.239 1.00 0.00 O ATOM 428 OE2 GLU A 27 -5.233 -31.696 -10.577 1.00 0.00 O ATOM 0 H GLU A 27 -5.467 -26.802 -11.534 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.750 -27.484 -9.957 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -4.779 -27.969 -9.525 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -6.087 -28.799 -8.706 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -6.846 -29.784 -10.852 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -5.610 -28.897 -11.721 1.00 0.00 H new ATOM 435 N ARG A 28 -5.562 -25.279 -8.761 1.00 0.00 N ATOM 436 CA ARG A 28 -5.439 -24.185 -7.798 1.00 0.00 C ATOM 437 C ARG A 28 -6.601 -23.212 -7.961 1.00 0.00 C ATOM 438 O ARG A 28 -7.155 -22.771 -6.956 1.00 0.00 O ATOM 439 CB ARG A 28 -4.088 -23.460 -7.942 1.00 0.00 C ATOM 440 CG ARG A 28 -2.918 -24.320 -7.434 1.00 0.00 C ATOM 441 CD ARG A 28 -1.585 -23.561 -7.414 1.00 0.00 C ATOM 442 NE ARG A 28 -1.036 -23.361 -8.765 1.00 0.00 N ATOM 443 CZ ARG A 28 -0.257 -24.199 -9.456 1.00 0.00 C ATOM 444 NH1 ARG A 28 0.093 -25.387 -8.969 1.00 0.00 N ATOM 445 NH2 ARG A 28 0.159 -23.810 -10.653 1.00 0.00 N ATOM 0 H ARG A 28 -4.788 -25.345 -9.422 1.00 0.00 H new ATOM 0 HA ARG A 28 -5.475 -24.607 -6.794 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.923 -23.205 -8.989 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -4.118 -22.523 -7.386 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -3.144 -24.674 -6.428 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -2.819 -25.201 -8.068 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -1.728 -22.592 -6.935 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -0.865 -24.112 -6.809 1.00 0.00 H new ATOM 0 HE ARG A 28 -1.277 -22.484 -9.226 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -0.234 -25.677 -8.048 1.00 0.00 H new ATOM 0 HH12 ARG A 28 0.689 -26.008 -9.517 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -0.117 -22.898 -11.017 1.00 0.00 H new ATOM 0 HH22 ARG A 28 0.755 -24.423 -11.210 1.00 0.00 H new ATOM 459 N ALA A 29 -7.004 -22.912 -9.198 1.00 0.00 N ATOM 460 CA ALA A 29 -8.111 -22.012 -9.459 1.00 0.00 C ATOM 461 C ALA A 29 -9.409 -22.582 -8.894 1.00 0.00 C ATOM 462 O ALA A 29 -10.177 -21.832 -8.301 1.00 0.00 O ATOM 463 CB ALA A 29 -8.231 -21.724 -10.958 1.00 0.00 C ATOM 0 H ALA A 29 -6.568 -23.289 -10.040 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.916 -21.065 -8.955 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.067 -21.047 -11.133 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.310 -21.263 -11.315 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.401 -22.657 -11.495 1.00 0.00 H new ATOM 469 N MET A 30 -9.644 -23.893 -9.015 1.00 0.00 N ATOM 470 CA MET A 30 -10.802 -24.530 -8.398 1.00 0.00 C ATOM 471 C MET A 30 -10.726 -24.469 -6.875 1.00 0.00 C ATOM 472 O MET A 30 -11.729 -24.137 -6.247 1.00 0.00 O ATOM 473 CB MET A 30 -10.969 -25.970 -8.896 1.00 0.00 C ATOM 474 CG MET A 30 -11.328 -26.055 -10.385 1.00 0.00 C ATOM 475 SD MET A 30 -12.939 -25.373 -10.890 1.00 0.00 S ATOM 476 CE MET A 30 -12.569 -23.606 -11.104 1.00 0.00 C ATOM 0 H MET A 30 -9.043 -24.531 -9.537 1.00 0.00 H new ATOM 0 HA MET A 30 -11.688 -23.972 -8.700 1.00 0.00 H new ATOM 0 HB2 MET A 30 -10.044 -26.518 -8.720 1.00 0.00 H new ATOM 0 HB3 MET A 30 -11.747 -26.462 -8.312 1.00 0.00 H new ATOM 0 HG2 MET A 30 -10.551 -25.541 -10.950 1.00 0.00 H new ATOM 0 HG3 MET A 30 -11.297 -27.104 -10.681 1.00 0.00 H new ATOM 0 HE1 MET A 30 -13.091 -23.229 -11.983 1.00 0.00 H new ATOM 0 HE2 MET A 30 -12.898 -23.056 -10.222 1.00 0.00 H new ATOM 0 HE3 MET A 30 -11.495 -23.472 -11.235 1.00 0.00 H new ATOM 486 N GLY A 31 -9.560 -24.729 -6.276 1.00 0.00 N ATOM 487 CA GLY A 31 -9.377 -24.630 -4.830 1.00 0.00 C ATOM 488 C GLY A 31 -9.769 -23.243 -4.316 1.00 0.00 C ATOM 489 O GLY A 31 -10.651 -23.120 -3.455 1.00 0.00 O ATOM 0 H GLY A 31 -8.720 -25.013 -6.781 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -9.980 -25.389 -4.332 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.336 -24.833 -4.578 1.00 0.00 H new ATOM 493 N TRP A 32 -9.171 -22.202 -4.911 1.00 0.00 N ATOM 494 CA TRP A 32 -9.533 -20.816 -4.657 1.00 0.00 C ATOM 495 C TRP A 32 -11.040 -20.615 -4.840 1.00 0.00 C ATOM 496 O TRP A 32 -11.707 -20.178 -3.908 1.00 0.00 O ATOM 497 CB TRP A 32 -8.766 -19.864 -5.585 1.00 0.00 C ATOM 498 CG TRP A 32 -7.414 -19.413 -5.128 1.00 0.00 C ATOM 499 CD1 TRP A 32 -6.232 -19.977 -5.455 1.00 0.00 C ATOM 500 CD2 TRP A 32 -7.079 -18.257 -4.299 1.00 0.00 C ATOM 501 NE1 TRP A 32 -5.195 -19.216 -4.965 1.00 0.00 N ATOM 502 CE2 TRP A 32 -5.658 -18.146 -4.227 1.00 0.00 C ATOM 503 CE3 TRP A 32 -7.835 -17.290 -3.599 1.00 0.00 C ATOM 504 CZ2 TRP A 32 -5.024 -17.126 -3.502 1.00 0.00 C ATOM 505 CZ3 TRP A 32 -7.207 -16.290 -2.832 1.00 0.00 C ATOM 506 CH2 TRP A 32 -5.805 -16.203 -2.786 1.00 0.00 C ATOM 0 H TRP A 32 -8.415 -22.308 -5.588 1.00 0.00 H new ATOM 0 HA TRP A 32 -9.263 -20.585 -3.627 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -8.651 -20.353 -6.552 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -9.382 -18.979 -5.747 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -6.117 -20.891 -6.018 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -4.208 -19.418 -5.127 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -8.913 -17.318 -3.653 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -3.947 -17.051 -3.494 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -7.807 -15.585 -2.275 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -5.329 -15.429 -2.202 1.00 0.00 H new ATOM 517 N TYR A 33 -11.583 -20.952 -6.013 1.00 0.00 N ATOM 518 CA TYR A 33 -12.977 -20.702 -6.357 1.00 0.00 C ATOM 519 C TYR A 33 -13.927 -21.285 -5.309 1.00 0.00 C ATOM 520 O TYR A 33 -14.832 -20.578 -4.856 1.00 0.00 O ATOM 521 CB TYR A 33 -13.285 -21.286 -7.747 1.00 0.00 C ATOM 522 CG TYR A 33 -14.768 -21.390 -8.039 1.00 0.00 C ATOM 523 CD1 TYR A 33 -15.484 -20.256 -8.456 1.00 0.00 C ATOM 524 CD2 TYR A 33 -15.448 -22.599 -7.792 1.00 0.00 C ATOM 525 CE1 TYR A 33 -16.874 -20.332 -8.632 1.00 0.00 C ATOM 526 CE2 TYR A 33 -16.844 -22.669 -7.932 1.00 0.00 C ATOM 527 CZ TYR A 33 -17.566 -21.534 -8.367 1.00 0.00 C ATOM 528 OH TYR A 33 -18.920 -21.580 -8.515 1.00 0.00 O ATOM 0 H TYR A 33 -11.057 -21.411 -6.756 1.00 0.00 H new ATOM 0 HA TYR A 33 -13.134 -19.624 -6.378 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -12.815 -20.662 -8.508 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -12.836 -22.276 -7.825 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -14.965 -19.327 -8.641 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -14.893 -23.476 -7.494 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -17.419 -19.464 -8.973 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -17.365 -23.588 -7.708 1.00 0.00 H new ATOM 0 HH TYR A 33 -19.243 -22.479 -8.295 1.00 0.00 H new ATOM 538 N TYR A 34 -13.723 -22.550 -4.922 1.00 0.00 N ATOM 539 CA TYR A 34 -14.647 -23.247 -4.044 1.00 0.00 C ATOM 540 C TYR A 34 -14.704 -22.555 -2.689 1.00 0.00 C ATOM 541 O TYR A 34 -15.806 -22.245 -2.231 1.00 0.00 O ATOM 542 CB TYR A 34 -14.269 -24.730 -3.881 1.00 0.00 C ATOM 543 CG TYR A 34 -14.518 -25.627 -5.087 1.00 0.00 C ATOM 544 CD1 TYR A 34 -15.762 -25.612 -5.750 1.00 0.00 C ATOM 545 CD2 TYR A 34 -13.522 -26.532 -5.506 1.00 0.00 C ATOM 546 CE1 TYR A 34 -15.995 -26.461 -6.847 1.00 0.00 C ATOM 547 CE2 TYR A 34 -13.752 -27.395 -6.593 1.00 0.00 C ATOM 548 CZ TYR A 34 -14.989 -27.356 -7.276 1.00 0.00 C ATOM 549 OH TYR A 34 -15.231 -28.182 -8.334 1.00 0.00 O ATOM 0 H TYR A 34 -12.919 -23.107 -5.210 1.00 0.00 H new ATOM 0 HA TYR A 34 -15.635 -23.213 -4.502 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -13.211 -24.787 -3.625 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -14.824 -25.133 -3.034 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -16.541 -24.944 -5.413 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -12.575 -26.563 -4.988 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.944 -26.429 -7.362 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -12.984 -28.087 -6.905 1.00 0.00 H new ATOM 0 HH TYR A 34 -14.440 -28.735 -8.505 1.00 0.00 H new ATOM 559 N TYR A 35 -13.555 -22.289 -2.047 1.00 0.00 N ATOM 560 CA TYR A 35 -13.603 -21.665 -0.727 1.00 0.00 C ATOM 561 C TYR A 35 -14.088 -20.215 -0.839 1.00 0.00 C ATOM 562 O TYR A 35 -14.835 -19.765 0.029 1.00 0.00 O ATOM 563 CB TYR A 35 -12.268 -21.782 0.032 1.00 0.00 C ATOM 564 CG TYR A 35 -11.415 -20.527 0.030 1.00 0.00 C ATOM 565 CD1 TYR A 35 -10.537 -20.288 -1.036 1.00 0.00 C ATOM 566 CD2 TYR A 35 -11.551 -19.567 1.054 1.00 0.00 C ATOM 567 CE1 TYR A 35 -9.784 -19.105 -1.089 1.00 0.00 C ATOM 568 CE2 TYR A 35 -10.809 -18.374 1.007 1.00 0.00 C ATOM 569 CZ TYR A 35 -9.920 -18.137 -0.068 1.00 0.00 C ATOM 570 OH TYR A 35 -9.194 -16.986 -0.125 1.00 0.00 O ATOM 0 H TYR A 35 -12.621 -22.488 -2.406 1.00 0.00 H new ATOM 0 HA TYR A 35 -14.327 -22.215 -0.126 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -12.478 -22.058 1.065 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -11.690 -22.596 -0.404 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -10.439 -21.021 -1.823 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -12.227 -19.749 1.876 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -9.102 -18.934 -1.909 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -10.917 -17.639 1.791 1.00 0.00 H new ATOM 0 HH TYR A 35 -8.677 -16.966 -0.958 1.00 0.00 H new ATOM 580 N LEU A 36 -13.682 -19.484 -1.885 1.00 0.00 N ATOM 581 CA LEU A 36 -13.958 -18.058 -1.997 1.00 0.00 C ATOM 582 C LEU A 36 -15.464 -17.863 -2.162 1.00 0.00 C ATOM 583 O LEU A 36 -16.064 -17.170 -1.344 1.00 0.00 O ATOM 584 CB LEU A 36 -13.131 -17.442 -3.144 1.00 0.00 C ATOM 585 CG LEU A 36 -12.816 -15.941 -3.007 1.00 0.00 C ATOM 586 CD1 LEU A 36 -11.913 -15.508 -4.170 1.00 0.00 C ATOM 587 CD2 LEU A 36 -14.050 -15.037 -2.965 1.00 0.00 C ATOM 0 H LEU A 36 -13.156 -19.868 -2.670 1.00 0.00 H new ATOM 0 HA LEU A 36 -13.654 -17.531 -1.093 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.190 -17.987 -3.222 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -13.668 -17.598 -4.079 1.00 0.00 H new ATOM 0 HG LEU A 36 -12.319 -15.821 -2.044 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.686 -14.446 -4.079 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -10.986 -16.081 -4.143 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -12.425 -15.690 -5.115 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -13.736 -13.998 -2.867 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -14.622 -15.159 -3.885 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -14.672 -15.310 -2.113 1.00 0.00 H new ATOM 599 N ASP A 37 -16.100 -18.521 -3.139 1.00 0.00 N ATOM 600 CA ASP A 37 -17.540 -18.367 -3.371 1.00 0.00 C ATOM 601 C ASP A 37 -18.354 -18.821 -2.162 1.00 0.00 C ATOM 602 O ASP A 37 -19.331 -18.171 -1.798 1.00 0.00 O ATOM 603 CB ASP A 37 -18.006 -19.156 -4.597 1.00 0.00 C ATOM 604 CG ASP A 37 -19.462 -18.787 -4.935 1.00 0.00 C ATOM 605 OD1 ASP A 37 -19.713 -17.620 -5.317 1.00 0.00 O ATOM 606 OD2 ASP A 37 -20.340 -19.676 -4.845 1.00 0.00 O ATOM 0 H ASP A 37 -15.639 -19.165 -3.782 1.00 0.00 H new ATOM 0 HA ASP A 37 -17.707 -17.304 -3.544 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -17.360 -18.939 -5.447 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -17.928 -20.226 -4.403 1.00 0.00 H new ATOM 611 N ASP A 38 -17.924 -19.903 -1.503 1.00 0.00 N ATOM 612 CA ASP A 38 -18.541 -20.371 -0.257 1.00 0.00 C ATOM 613 C ASP A 38 -18.408 -19.353 0.889 1.00 0.00 C ATOM 614 O ASP A 38 -19.264 -19.310 1.775 1.00 0.00 O ATOM 615 CB ASP A 38 -17.929 -21.711 0.165 1.00 0.00 C ATOM 616 CG ASP A 38 -18.562 -22.237 1.464 1.00 0.00 C ATOM 617 OD1 ASP A 38 -19.735 -22.672 1.436 1.00 0.00 O ATOM 618 OD2 ASP A 38 -17.876 -22.264 2.511 1.00 0.00 O ATOM 0 H ASP A 38 -17.141 -20.477 -1.817 1.00 0.00 H new ATOM 0 HA ASP A 38 -19.605 -20.496 -0.458 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -18.069 -22.442 -0.631 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -16.854 -21.593 0.305 1.00 0.00 H new ATOM 623 N THR A 39 -17.368 -18.515 0.872 1.00 0.00 N ATOM 624 CA THR A 39 -17.130 -17.494 1.887 1.00 0.00 C ATOM 625 C THR A 39 -17.900 -16.204 1.569 1.00 0.00 C ATOM 626 O THR A 39 -18.317 -15.519 2.503 1.00 0.00 O ATOM 627 CB THR A 39 -15.615 -17.234 2.008 1.00 0.00 C ATOM 628 OG1 THR A 39 -14.941 -18.435 2.330 1.00 0.00 O ATOM 629 CG2 THR A 39 -15.281 -16.204 3.092 1.00 0.00 C ATOM 0 H THR A 39 -16.658 -18.530 0.139 1.00 0.00 H new ATOM 0 HA THR A 39 -17.500 -17.854 2.847 1.00 0.00 H new ATOM 0 HB THR A 39 -15.291 -16.845 1.043 1.00 0.00 H new ATOM 0 HG1 THR A 39 -14.566 -18.828 1.515 1.00 0.00 H new ATOM 0 HG21 THR A 39 -14.202 -16.058 3.135 1.00 0.00 H new ATOM 0 HG22 THR A 39 -15.766 -15.257 2.856 1.00 0.00 H new ATOM 0 HG23 THR A 39 -15.638 -16.563 4.057 1.00 0.00 H new ATOM 637 N LEU A 40 -18.105 -15.867 0.287 1.00 0.00 N ATOM 638 CA LEU A 40 -18.823 -14.659 -0.110 1.00 0.00 C ATOM 639 C LEU A 40 -20.241 -14.704 0.472 1.00 0.00 C ATOM 640 O LEU A 40 -21.011 -15.612 0.152 1.00 0.00 O ATOM 641 CB LEU A 40 -18.916 -14.513 -1.640 1.00 0.00 C ATOM 642 CG LEU A 40 -17.603 -14.280 -2.399 1.00 0.00 C ATOM 643 CD1 LEU A 40 -17.889 -14.208 -3.903 1.00 0.00 C ATOM 644 CD2 LEU A 40 -16.830 -13.042 -1.955 1.00 0.00 C ATOM 0 H LEU A 40 -17.776 -16.428 -0.499 1.00 0.00 H new ATOM 0 HA LEU A 40 -18.269 -13.803 0.275 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -19.382 -15.414 -2.038 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -19.587 -13.683 -1.861 1.00 0.00 H new ATOM 0 HG LEU A 40 -16.960 -15.128 -2.164 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -16.957 -14.042 -4.443 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -18.338 -15.145 -4.233 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -18.576 -13.386 -4.104 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -15.916 -12.953 -2.543 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -17.446 -12.155 -2.106 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -16.575 -13.132 -0.899 1.00 0.00 H new ATOM 656 N GLU A 41 -20.630 -13.701 1.257 1.00 0.00 N ATOM 657 CA GLU A 41 -21.991 -13.516 1.771 1.00 0.00 C ATOM 658 C GLU A 41 -22.859 -12.856 0.687 1.00 0.00 C ATOM 659 O GLU A 41 -23.520 -11.840 0.909 1.00 0.00 O ATOM 660 CB GLU A 41 -21.944 -12.720 3.088 1.00 0.00 C ATOM 661 CG GLU A 41 -21.338 -13.554 4.224 1.00 0.00 C ATOM 662 CD GLU A 41 -22.333 -14.587 4.787 1.00 0.00 C ATOM 663 OE1 GLU A 41 -23.125 -14.242 5.695 1.00 0.00 O ATOM 664 OE2 GLU A 41 -22.330 -15.758 4.345 1.00 0.00 O ATOM 0 H GLU A 41 -19.988 -12.970 1.564 1.00 0.00 H new ATOM 0 HA GLU A 41 -22.452 -14.476 2.005 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -21.356 -11.813 2.946 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -22.951 -12.407 3.362 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -20.450 -14.070 3.859 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -21.014 -12.890 5.026 1.00 0.00 H new ATOM 671 N PHE A 42 -22.773 -13.396 -0.528 1.00 0.00 N ATOM 672 CA PHE A 42 -23.396 -12.844 -1.725 1.00 0.00 C ATOM 673 C PHE A 42 -24.938 -12.913 -1.661 1.00 0.00 C ATOM 674 O PHE A 42 -25.472 -13.785 -0.966 1.00 0.00 O ATOM 675 CB PHE A 42 -22.842 -13.564 -2.972 1.00 0.00 C ATOM 676 CG PHE A 42 -23.276 -15.013 -3.169 1.00 0.00 C ATOM 677 CD1 PHE A 42 -24.549 -15.308 -3.700 1.00 0.00 C ATOM 678 CD2 PHE A 42 -22.401 -16.074 -2.862 1.00 0.00 C ATOM 679 CE1 PHE A 42 -24.953 -16.641 -3.889 1.00 0.00 C ATOM 680 CE2 PHE A 42 -22.804 -17.407 -3.050 1.00 0.00 C ATOM 681 CZ PHE A 42 -24.082 -17.694 -3.559 1.00 0.00 C ATOM 0 H PHE A 42 -22.252 -14.254 -0.709 1.00 0.00 H new ATOM 0 HA PHE A 42 -23.144 -11.785 -1.789 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -23.138 -12.996 -3.854 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -21.753 -13.537 -2.926 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -25.219 -14.503 -3.964 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -21.414 -15.861 -2.480 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -25.933 -16.856 -4.288 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -22.129 -18.213 -2.803 1.00 0.00 H new ATOM 0 HZ PHE A 42 -24.394 -18.719 -3.696 1.00 0.00 H new ATOM 691 N PRO A 43 -25.672 -12.065 -2.414 1.00 0.00 N ATOM 692 CA PRO A 43 -25.186 -10.900 -3.156 1.00 0.00 C ATOM 693 C PRO A 43 -24.640 -9.818 -2.213 1.00 0.00 C ATOM 694 O PRO A 43 -25.045 -9.734 -1.051 1.00 0.00 O ATOM 695 CB PRO A 43 -26.392 -10.358 -3.937 1.00 0.00 C ATOM 696 CG PRO A 43 -27.357 -11.539 -3.993 1.00 0.00 C ATOM 697 CD PRO A 43 -27.091 -12.251 -2.669 1.00 0.00 C ATOM 0 HA PRO A 43 -24.365 -11.182 -3.816 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -26.840 -9.500 -3.435 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -26.105 -10.029 -4.936 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -28.393 -11.212 -4.076 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -27.157 -12.185 -4.848 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -27.694 -11.827 -1.866 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -27.344 -13.309 -2.733 1.00 0.00 H new ATOM 705 N PHE A 44 -23.742 -8.977 -2.722 1.00 0.00 N ATOM 706 CA PHE A 44 -23.138 -7.859 -2.000 1.00 0.00 C ATOM 707 C PHE A 44 -22.901 -6.716 -2.988 1.00 0.00 C ATOM 708 O PHE A 44 -23.402 -6.771 -4.112 1.00 0.00 O ATOM 709 CB PHE A 44 -21.863 -8.319 -1.270 1.00 0.00 C ATOM 710 CG PHE A 44 -20.681 -8.757 -2.123 1.00 0.00 C ATOM 711 CD1 PHE A 44 -20.685 -10.011 -2.763 1.00 0.00 C ATOM 712 CD2 PHE A 44 -19.536 -7.941 -2.217 1.00 0.00 C ATOM 713 CE1 PHE A 44 -19.563 -10.446 -3.487 1.00 0.00 C ATOM 714 CE2 PHE A 44 -18.417 -8.369 -2.953 1.00 0.00 C ATOM 715 CZ PHE A 44 -18.425 -9.627 -3.580 1.00 0.00 C ATOM 0 H PHE A 44 -23.403 -9.058 -3.681 1.00 0.00 H new ATOM 0 HA PHE A 44 -23.805 -7.489 -1.221 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -21.530 -7.503 -0.629 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -22.131 -9.149 -0.616 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -21.558 -10.643 -2.697 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -19.518 -6.982 -1.721 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -19.575 -11.411 -3.973 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -17.550 -7.730 -3.037 1.00 0.00 H new ATOM 0 HZ PHE A 44 -17.559 -9.963 -4.131 1.00 0.00 H new ATOM 725 N MET A 45 -22.165 -5.670 -2.609 1.00 0.00 N ATOM 726 CA MET A 45 -21.874 -4.560 -3.508 1.00 0.00 C ATOM 727 C MET A 45 -20.390 -4.217 -3.517 1.00 0.00 C ATOM 728 O MET A 45 -19.607 -4.679 -2.686 1.00 0.00 O ATOM 729 CB MET A 45 -22.771 -3.350 -3.193 1.00 0.00 C ATOM 730 CG MET A 45 -22.347 -2.533 -1.963 1.00 0.00 C ATOM 731 SD MET A 45 -22.735 -0.763 -2.063 1.00 0.00 S ATOM 732 CE MET A 45 -21.587 -0.243 -3.377 1.00 0.00 C ATOM 0 H MET A 45 -21.759 -5.571 -1.679 1.00 0.00 H new ATOM 0 HA MET A 45 -22.113 -4.872 -4.525 1.00 0.00 H new ATOM 0 HB2 MET A 45 -22.785 -2.691 -4.061 1.00 0.00 H new ATOM 0 HB3 MET A 45 -23.792 -3.702 -3.043 1.00 0.00 H new ATOM 0 HG2 MET A 45 -22.834 -2.949 -1.081 1.00 0.00 H new ATOM 0 HG3 MET A 45 -21.273 -2.649 -1.819 1.00 0.00 H new ATOM 0 HE1 MET A 45 -21.435 0.835 -3.322 1.00 0.00 H new ATOM 0 HE2 MET A 45 -20.631 -0.751 -3.247 1.00 0.00 H new ATOM 0 HE3 MET A 45 -22.006 -0.501 -4.350 1.00 0.00 H new ATOM 742 N GLY A 46 -20.011 -3.371 -4.464 1.00 0.00 N ATOM 743 CA GLY A 46 -18.646 -2.932 -4.611 1.00 0.00 C ATOM 744 C GLY A 46 -18.543 -1.756 -5.554 1.00 0.00 C ATOM 745 O GLY A 46 -19.536 -1.249 -6.081 1.00 0.00 O ATOM 0 H GLY A 46 -20.651 -2.973 -5.151 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -18.245 -2.655 -3.636 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -18.036 -3.754 -4.985 1.00 0.00 H new ATOM 749 N LYS A 47 -17.305 -1.343 -5.770 1.00 0.00 N ATOM 750 CA LYS A 47 -16.936 -0.384 -6.789 1.00 0.00 C ATOM 751 C LYS A 47 -16.039 -1.137 -7.760 1.00 0.00 C ATOM 752 O LYS A 47 -15.047 -1.735 -7.345 1.00 0.00 O ATOM 753 CB LYS A 47 -16.226 0.809 -6.126 1.00 0.00 C ATOM 754 CG LYS A 47 -16.097 2.019 -7.062 1.00 0.00 C ATOM 755 CD LYS A 47 -17.390 2.845 -7.135 1.00 0.00 C ATOM 756 CE LYS A 47 -17.615 3.716 -5.890 1.00 0.00 C ATOM 757 NZ LYS A 47 -18.793 4.607 -6.044 1.00 0.00 N ATOM 0 H LYS A 47 -16.510 -1.677 -5.225 1.00 0.00 H new ATOM 0 HA LYS A 47 -17.792 0.027 -7.323 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -16.777 1.103 -5.233 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -15.233 0.500 -5.800 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -15.282 2.655 -6.718 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -15.832 1.675 -8.062 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -17.358 3.484 -8.018 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -18.238 2.172 -7.259 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -17.755 3.076 -5.019 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -16.726 4.318 -5.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -19.128 4.905 -5.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -18.524 5.445 -6.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -19.553 4.096 -6.536 1.00 0.00 H new ATOM 771 N TRP A 48 -16.389 -1.136 -9.040 1.00 0.00 N ATOM 772 CA TRP A 48 -15.514 -1.624 -10.093 1.00 0.00 C ATOM 773 C TRP A 48 -14.480 -0.521 -10.302 1.00 0.00 C ATOM 774 O TRP A 48 -14.799 0.539 -10.843 1.00 0.00 O ATOM 775 CB TRP A 48 -16.323 -1.955 -11.361 1.00 0.00 C ATOM 776 CG TRP A 48 -15.606 -2.715 -12.444 1.00 0.00 C ATOM 777 CD1 TRP A 48 -14.267 -2.819 -12.601 1.00 0.00 C ATOM 778 CD2 TRP A 48 -16.175 -3.508 -13.537 1.00 0.00 C ATOM 779 NE1 TRP A 48 -13.971 -3.606 -13.686 1.00 0.00 N ATOM 780 CE2 TRP A 48 -15.106 -4.069 -14.301 1.00 0.00 C ATOM 781 CE3 TRP A 48 -17.486 -3.818 -13.963 1.00 0.00 C ATOM 782 CZ2 TRP A 48 -15.317 -4.890 -15.415 1.00 0.00 C ATOM 783 CZ3 TRP A 48 -17.713 -4.648 -15.080 1.00 0.00 C ATOM 784 CH2 TRP A 48 -16.632 -5.184 -15.803 1.00 0.00 C ATOM 0 H TRP A 48 -17.290 -0.796 -9.376 1.00 0.00 H new ATOM 0 HA TRP A 48 -15.016 -2.558 -9.832 1.00 0.00 H new ATOM 0 HB2 TRP A 48 -17.199 -2.532 -11.064 1.00 0.00 H new ATOM 0 HB3 TRP A 48 -16.686 -1.019 -11.786 1.00 0.00 H new ATOM 0 HD1 TRP A 48 -13.534 -2.349 -11.963 1.00 0.00 H new ATOM 0 HE1 TRP A 48 -13.023 -3.820 -13.997 1.00 0.00 H new ATOM 0 HE3 TRP A 48 -18.329 -3.412 -13.424 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 -14.480 -5.291 -15.967 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 -18.725 -4.874 -15.383 1.00 0.00 H new ATOM 0 HH2 TRP A 48 -16.815 -5.821 -16.656 1.00 0.00 H new ATOM 795 N LYS A 49 -13.259 -0.741 -9.810 1.00 0.00 N ATOM 796 CA LYS A 49 -12.134 0.192 -9.866 1.00 0.00 C ATOM 797 C LYS A 49 -11.423 0.017 -11.215 1.00 0.00 C ATOM 798 O LYS A 49 -10.224 -0.263 -11.254 1.00 0.00 O ATOM 799 CB LYS A 49 -11.166 -0.109 -8.694 1.00 0.00 C ATOM 800 CG LYS A 49 -11.797 -0.228 -7.299 1.00 0.00 C ATOM 801 CD LYS A 49 -12.341 1.080 -6.718 1.00 0.00 C ATOM 802 CE LYS A 49 -11.199 1.958 -6.187 1.00 0.00 C ATOM 803 NZ LYS A 49 -11.673 2.901 -5.150 1.00 0.00 N ATOM 0 H LYS A 49 -13.018 -1.614 -9.341 1.00 0.00 H new ATOM 0 HA LYS A 49 -12.481 1.221 -9.774 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -10.644 -1.040 -8.913 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -10.413 0.679 -8.662 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -12.610 -0.952 -7.346 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -11.051 -0.630 -6.613 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -12.895 1.621 -7.485 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -13.042 0.861 -5.913 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -10.415 1.324 -5.772 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -10.755 2.516 -7.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.872 3.466 -4.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -12.391 3.533 -5.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -12.089 2.368 -4.360 1.00 0.00 H new ATOM 817 N LYS A 50 -12.179 0.087 -12.313 1.00 0.00 N ATOM 818 CA LYS A 50 -11.713 -0.272 -13.646 1.00 0.00 C ATOM 819 C LYS A 50 -10.471 0.538 -13.982 1.00 0.00 C ATOM 820 O LYS A 50 -10.559 1.757 -14.115 1.00 0.00 O ATOM 821 CB LYS A 50 -12.840 -0.067 -14.670 1.00 0.00 C ATOM 822 CG LYS A 50 -12.363 -0.432 -16.086 1.00 0.00 C ATOM 823 CD LYS A 50 -13.507 -0.560 -17.103 1.00 0.00 C ATOM 824 CE LYS A 50 -14.396 -1.782 -16.814 1.00 0.00 C ATOM 825 NZ LYS A 50 -15.424 -1.993 -17.864 1.00 0.00 N ATOM 0 H LYS A 50 -13.149 0.401 -12.296 1.00 0.00 H new ATOM 0 HA LYS A 50 -11.440 -1.327 -13.678 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -13.699 -0.682 -14.401 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -13.172 0.971 -14.649 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -11.663 0.328 -16.432 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -11.816 -1.374 -16.045 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -14.115 0.345 -17.082 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -13.092 -0.642 -18.108 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -13.772 -2.672 -16.736 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -14.887 -1.651 -15.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -15.998 -2.827 -17.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -16.038 -1.155 -17.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -14.958 -2.145 -18.781 1.00 0.00 H new ATOM 976 N GLU A 59 -11.269 4.400 -13.408 1.00 0.00 N ATOM 977 CA GLU A 59 -12.663 4.798 -13.412 1.00 0.00 C ATOM 978 C GLU A 59 -13.319 3.966 -12.312 1.00 0.00 C ATOM 979 O GLU A 59 -12.891 2.846 -12.019 1.00 0.00 O ATOM 980 CB GLU A 59 -13.317 4.523 -14.777 1.00 0.00 C ATOM 981 CG GLU A 59 -12.909 5.555 -15.835 1.00 0.00 C ATOM 982 CD GLU A 59 -13.654 5.323 -17.162 1.00 0.00 C ATOM 983 OE1 GLU A 59 -13.190 4.521 -18.004 1.00 0.00 O ATOM 984 OE2 GLU A 59 -14.709 5.960 -17.388 1.00 0.00 O ATOM 0 HA GLU A 59 -12.778 5.868 -13.236 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -13.037 3.526 -15.118 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -14.401 4.529 -14.666 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -13.121 6.559 -15.467 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -11.834 5.499 -16.005 1.00 0.00 H new ATOM 991 N GLU A 60 -14.353 4.512 -11.682 1.00 0.00 N ATOM 992 CA GLU A 60 -14.943 3.942 -10.482 1.00 0.00 C ATOM 993 C GLU A 60 -16.449 3.895 -10.711 1.00 0.00 C ATOM 994 O GLU A 60 -17.084 4.942 -10.866 1.00 0.00 O ATOM 995 CB GLU A 60 -14.561 4.795 -9.260 1.00 0.00 C ATOM 996 CG GLU A 60 -13.048 4.806 -8.987 1.00 0.00 C ATOM 997 CD GLU A 60 -12.741 5.515 -7.659 1.00 0.00 C ATOM 998 OE1 GLU A 60 -12.910 4.888 -6.589 1.00 0.00 O ATOM 999 OE2 GLU A 60 -12.317 6.694 -7.675 1.00 0.00 O ATOM 0 H GLU A 60 -14.807 5.370 -11.995 1.00 0.00 H new ATOM 0 HA GLU A 60 -14.576 2.935 -10.282 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -14.904 5.818 -9.416 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -15.081 4.414 -8.381 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -12.672 3.783 -8.955 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -12.530 5.310 -9.803 1.00 0.00 H new ATOM 1006 N LYS A 61 -17.018 2.686 -10.759 1.00 0.00 N ATOM 1007 CA LYS A 61 -18.436 2.487 -11.069 1.00 0.00 C ATOM 1008 C LYS A 61 -19.057 1.610 -9.995 1.00 0.00 C ATOM 1009 O LYS A 61 -18.516 0.549 -9.694 1.00 0.00 O ATOM 1010 CB LYS A 61 -18.561 1.865 -12.470 1.00 0.00 C ATOM 1011 CG LYS A 61 -20.025 1.838 -12.936 1.00 0.00 C ATOM 1012 CD LYS A 61 -20.170 1.442 -14.410 1.00 0.00 C ATOM 1013 CE LYS A 61 -19.697 0.007 -14.680 1.00 0.00 C ATOM 1014 NZ LYS A 61 -20.045 -0.430 -16.053 1.00 0.00 N ATOM 0 H LYS A 61 -16.509 1.820 -10.584 1.00 0.00 H new ATOM 0 HA LYS A 61 -18.972 3.436 -11.077 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -17.961 2.435 -13.179 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -18.161 0.851 -12.458 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -20.586 1.136 -12.319 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -20.469 2.822 -12.783 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -21.214 1.540 -14.709 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -19.596 2.133 -15.027 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -18.618 -0.054 -14.540 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -20.151 -0.669 -13.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -19.742 -1.415 -16.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -21.074 -0.362 -16.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -19.564 0.181 -16.744 1.00 0.00 H new ATOM 1028 N THR A 62 -20.142 2.055 -9.371 1.00 0.00 N ATOM 1029 CA THR A 62 -20.790 1.307 -8.303 1.00 0.00 C ATOM 1030 C THR A 62 -21.522 0.103 -8.908 1.00 0.00 C ATOM 1031 O THR A 62 -22.208 0.237 -9.923 1.00 0.00 O ATOM 1032 CB THR A 62 -21.738 2.247 -7.543 1.00 0.00 C ATOM 1033 OG1 THR A 62 -21.105 3.504 -7.343 1.00 0.00 O ATOM 1034 CG2 THR A 62 -22.080 1.694 -6.162 1.00 0.00 C ATOM 0 H THR A 62 -20.595 2.942 -9.591 1.00 0.00 H new ATOM 0 HA THR A 62 -20.059 0.924 -7.591 1.00 0.00 H new ATOM 0 HB THR A 62 -22.645 2.344 -8.139 1.00 0.00 H new ATOM 0 HG1 THR A 62 -21.712 4.103 -6.860 1.00 0.00 H new ATOM 0 HG21 THR A 62 -22.752 2.383 -5.651 1.00 0.00 H new ATOM 0 HG22 THR A 62 -22.566 0.724 -6.269 1.00 0.00 H new ATOM 0 HG23 THR A 62 -21.166 1.579 -5.579 1.00 0.00 H new ATOM 1042 N VAL A 63 -21.376 -1.067 -8.288 1.00 0.00 N ATOM 1043 CA VAL A 63 -21.880 -2.326 -8.819 1.00 0.00 C ATOM 1044 C VAL A 63 -22.423 -3.221 -7.697 1.00 0.00 C ATOM 1045 O VAL A 63 -22.028 -3.088 -6.537 1.00 0.00 O ATOM 1046 CB VAL A 63 -20.789 -3.028 -9.645 1.00 0.00 C ATOM 1047 CG1 VAL A 63 -20.430 -2.280 -10.941 1.00 0.00 C ATOM 1048 CG2 VAL A 63 -19.497 -3.323 -8.862 1.00 0.00 C ATOM 0 H VAL A 63 -20.898 -1.165 -7.392 1.00 0.00 H new ATOM 0 HA VAL A 63 -22.717 -2.117 -9.485 1.00 0.00 H new ATOM 0 HB VAL A 63 -21.250 -3.981 -9.903 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -19.655 -2.829 -11.475 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -21.316 -2.198 -11.571 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -20.065 -1.283 -10.696 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -18.780 -3.818 -9.517 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -19.071 -2.388 -8.498 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -19.724 -3.972 -8.016 1.00 0.00 H new ATOM 1058 N GLU A 64 -23.307 -4.155 -8.050 1.00 0.00 N ATOM 1059 CA GLU A 64 -23.850 -5.162 -7.146 1.00 0.00 C ATOM 1060 C GLU A 64 -23.252 -6.497 -7.585 1.00 0.00 C ATOM 1061 O GLU A 64 -23.429 -6.908 -8.729 1.00 0.00 O ATOM 1062 CB GLU A 64 -25.384 -5.138 -7.214 1.00 0.00 C ATOM 1063 CG GLU A 64 -26.033 -6.122 -6.232 1.00 0.00 C ATOM 1064 CD GLU A 64 -27.569 -6.016 -6.263 1.00 0.00 C ATOM 1065 OE1 GLU A 64 -28.216 -6.656 -7.123 1.00 0.00 O ATOM 1066 OE2 GLU A 64 -28.149 -5.306 -5.410 1.00 0.00 O ATOM 0 H GLU A 64 -23.673 -4.231 -8.999 1.00 0.00 H new ATOM 0 HA GLU A 64 -23.592 -4.978 -6.103 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -25.738 -4.130 -6.999 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -25.703 -5.379 -8.228 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -25.732 -7.139 -6.482 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -25.673 -5.922 -5.223 1.00 0.00 H new ATOM 1073 N VAL A 65 -22.489 -7.145 -6.711 1.00 0.00 N ATOM 1074 CA VAL A 65 -21.726 -8.341 -7.027 1.00 0.00 C ATOM 1075 C VAL A 65 -22.597 -9.528 -6.611 1.00 0.00 C ATOM 1076 O VAL A 65 -22.998 -9.648 -5.450 1.00 0.00 O ATOM 1077 CB VAL A 65 -20.354 -8.293 -6.328 1.00 0.00 C ATOM 1078 CG1 VAL A 65 -19.465 -9.418 -6.873 1.00 0.00 C ATOM 1079 CG2 VAL A 65 -19.625 -6.954 -6.558 1.00 0.00 C ATOM 0 H VAL A 65 -22.383 -6.844 -5.742 1.00 0.00 H new ATOM 0 HA VAL A 65 -21.497 -8.429 -8.089 1.00 0.00 H new ATOM 0 HB VAL A 65 -20.534 -8.409 -5.259 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -18.494 -9.386 -6.380 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -19.938 -10.381 -6.680 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -19.331 -9.288 -7.947 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -18.663 -6.970 -6.045 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -19.464 -6.806 -7.626 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -20.231 -6.138 -6.166 1.00 0.00 H new ATOM 1089 N LEU A 66 -22.935 -10.380 -7.577 1.00 0.00 N ATOM 1090 CA LEU A 66 -23.936 -11.429 -7.407 1.00 0.00 C ATOM 1091 C LEU A 66 -23.350 -12.718 -6.828 1.00 0.00 C ATOM 1092 O LEU A 66 -24.103 -13.521 -6.282 1.00 0.00 O ATOM 1093 CB LEU A 66 -24.620 -11.716 -8.757 1.00 0.00 C ATOM 1094 CG LEU A 66 -25.217 -10.482 -9.468 1.00 0.00 C ATOM 1095 CD1 LEU A 66 -25.957 -10.926 -10.731 1.00 0.00 C ATOM 1096 CD2 LEU A 66 -26.170 -9.678 -8.576 1.00 0.00 C ATOM 0 H LEU A 66 -22.518 -10.361 -8.507 1.00 0.00 H new ATOM 0 HA LEU A 66 -24.669 -11.065 -6.687 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -23.893 -12.182 -9.422 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -25.416 -12.443 -8.595 1.00 0.00 H new ATOM 0 HG LEU A 66 -24.383 -9.827 -9.719 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -26.378 -10.054 -11.232 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -25.261 -11.429 -11.402 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -26.760 -11.612 -10.460 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -26.556 -8.824 -9.133 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -26.999 -10.313 -8.264 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -25.633 -9.324 -7.696 1.00 0.00 H new ATOM 1108 N GLY A 67 -22.038 -12.930 -6.946 1.00 0.00 N ATOM 1109 CA GLY A 67 -21.337 -14.133 -6.535 1.00 0.00 C ATOM 1110 C GLY A 67 -20.168 -14.328 -7.496 1.00 0.00 C ATOM 1111 O GLY A 67 -19.984 -13.537 -8.429 1.00 0.00 O ATOM 0 H GLY A 67 -21.413 -12.232 -7.350 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -20.980 -14.038 -5.510 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -22.004 -14.995 -6.562 1.00 0.00 H new ATOM 1115 N MET A 68 -19.374 -15.374 -7.287 1.00 0.00 N ATOM 1116 CA MET A 68 -18.372 -15.767 -8.274 1.00 0.00 C ATOM 1117 C MET A 68 -19.080 -16.149 -9.580 1.00 0.00 C ATOM 1118 O MET A 68 -20.226 -16.611 -9.574 1.00 0.00 O ATOM 1119 CB MET A 68 -17.493 -16.920 -7.775 1.00 0.00 C ATOM 1120 CG MET A 68 -16.604 -16.552 -6.579 1.00 0.00 C ATOM 1121 SD MET A 68 -15.366 -15.257 -6.857 1.00 0.00 S ATOM 1122 CE MET A 68 -14.225 -16.172 -7.922 1.00 0.00 C ATOM 0 H MET A 68 -19.403 -15.960 -6.452 1.00 0.00 H new ATOM 0 HA MET A 68 -17.708 -14.920 -8.447 1.00 0.00 H new ATOM 0 HB2 MET A 68 -18.133 -17.757 -7.496 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.860 -17.262 -8.594 1.00 0.00 H new ATOM 0 HG2 MET A 68 -17.249 -16.236 -5.759 1.00 0.00 H new ATOM 0 HG3 MET A 68 -16.087 -17.453 -6.249 1.00 0.00 H new ATOM 0 HE1 MET A 68 -13.363 -15.546 -8.154 1.00 0.00 H new ATOM 0 HE2 MET A 68 -13.891 -17.073 -7.408 1.00 0.00 H new ATOM 0 HE3 MET A 68 -14.732 -16.448 -8.846 1.00 0.00 H new ATOM 1132 N ALA A 69 -18.384 -15.956 -10.701 1.00 0.00 N ATOM 1133 CA ALA A 69 -18.804 -16.441 -12.008 1.00 0.00 C ATOM 1134 C ALA A 69 -18.833 -17.984 -12.010 1.00 0.00 C ATOM 1135 O ALA A 69 -18.341 -18.594 -11.057 1.00 0.00 O ATOM 1136 CB ALA A 69 -17.844 -15.865 -13.059 1.00 0.00 C ATOM 0 H ALA A 69 -17.499 -15.450 -10.722 1.00 0.00 H new ATOM 0 HA ALA A 69 -19.815 -16.112 -12.247 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -18.137 -16.214 -14.049 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -17.885 -14.776 -13.031 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -16.828 -16.196 -12.844 1.00 0.00 H new ATOM 1142 N PRO A 70 -19.388 -18.641 -13.047 1.00 0.00 N ATOM 1143 CA PRO A 70 -19.329 -20.093 -13.174 1.00 0.00 C ATOM 1144 C PRO A 70 -17.904 -20.629 -13.009 1.00 0.00 C ATOM 1145 O PRO A 70 -16.930 -19.955 -13.361 1.00 0.00 O ATOM 1146 CB PRO A 70 -19.891 -20.408 -14.565 1.00 0.00 C ATOM 1147 CG PRO A 70 -20.840 -19.241 -14.827 1.00 0.00 C ATOM 1148 CD PRO A 70 -20.114 -18.069 -14.171 1.00 0.00 C ATOM 0 HA PRO A 70 -19.907 -20.579 -12.388 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -19.102 -20.463 -15.316 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -20.414 -21.364 -14.582 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -20.995 -19.076 -15.893 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -21.822 -19.409 -14.384 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -19.434 -17.586 -14.873 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -20.819 -17.308 -13.836 1.00 0.00 H new ATOM 1156 N ASP A 71 -17.779 -21.875 -12.550 1.00 0.00 N ATOM 1157 CA ASP A 71 -16.489 -22.559 -12.466 1.00 0.00 C ATOM 1158 C ASP A 71 -15.819 -22.646 -13.841 1.00 0.00 C ATOM 1159 O ASP A 71 -14.595 -22.604 -13.926 1.00 0.00 O ATOM 1160 CB ASP A 71 -16.629 -23.956 -11.843 1.00 0.00 C ATOM 1161 CG ASP A 71 -17.139 -25.012 -12.840 1.00 0.00 C ATOM 1162 OD1 ASP A 71 -18.349 -25.002 -13.160 1.00 0.00 O ATOM 1163 OD2 ASP A 71 -16.348 -25.873 -13.283 1.00 0.00 O ATOM 0 H ASP A 71 -18.567 -22.437 -12.227 1.00 0.00 H new ATOM 0 HA ASP A 71 -15.851 -21.965 -11.812 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -15.662 -24.271 -11.451 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -17.314 -23.903 -10.997 1.00 0.00 H new ATOM 1168 N ASP A 72 -16.609 -22.684 -14.921 1.00 0.00 N ATOM 1169 CA ASP A 72 -16.108 -22.658 -16.294 1.00 0.00 C ATOM 1170 C ASP A 72 -15.316 -21.380 -16.589 1.00 0.00 C ATOM 1171 O ASP A 72 -14.330 -21.422 -17.328 1.00 0.00 O ATOM 1172 CB ASP A 72 -17.277 -22.780 -17.277 1.00 0.00 C ATOM 1173 CG ASP A 72 -16.787 -22.710 -18.733 1.00 0.00 C ATOM 1174 OD1 ASP A 72 -16.194 -23.697 -19.223 1.00 0.00 O ATOM 1175 OD2 ASP A 72 -17.030 -21.686 -19.410 1.00 0.00 O ATOM 0 H ASP A 72 -17.626 -22.734 -14.861 1.00 0.00 H new ATOM 0 HA ASP A 72 -15.432 -23.504 -16.415 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -17.799 -23.722 -17.111 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -17.995 -21.981 -17.093 1.00 0.00 H new ATOM 1180 N GLU A 73 -15.707 -20.247 -15.994 1.00 0.00 N ATOM 1181 CA GLU A 73 -14.953 -19.005 -16.105 1.00 0.00 C ATOM 1182 C GLU A 73 -13.805 -18.998 -15.097 1.00 0.00 C ATOM 1183 O GLU A 73 -12.682 -18.633 -15.456 1.00 0.00 O ATOM 1184 CB GLU A 73 -15.857 -17.777 -15.889 1.00 0.00 C ATOM 1185 CG GLU A 73 -16.766 -17.467 -17.090 1.00 0.00 C ATOM 1186 CD GLU A 73 -16.029 -16.944 -18.345 1.00 0.00 C ATOM 1187 OE1 GLU A 73 -14.777 -16.964 -18.409 1.00 0.00 O ATOM 1188 OE2 GLU A 73 -16.717 -16.507 -19.296 1.00 0.00 O ATOM 0 H GLU A 73 -16.551 -20.171 -15.426 1.00 0.00 H new ATOM 0 HA GLU A 73 -14.546 -18.947 -17.115 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -16.476 -17.942 -15.007 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -15.233 -16.908 -15.682 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -17.312 -18.372 -17.357 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -17.506 -16.727 -16.786 1.00 0.00 H new ATOM 1195 N CYS A 74 -14.060 -19.433 -13.861 1.00 0.00 N ATOM 1196 CA CYS A 74 -13.121 -19.325 -12.747 1.00 0.00 C ATOM 1197 C CYS A 74 -11.989 -20.367 -12.778 1.00 0.00 C ATOM 1198 O CYS A 74 -11.315 -20.565 -11.770 1.00 0.00 O ATOM 1199 CB CYS A 74 -13.877 -19.366 -11.413 1.00 0.00 C ATOM 1200 SG CYS A 74 -15.089 -18.017 -11.344 1.00 0.00 S ATOM 0 H CYS A 74 -14.941 -19.878 -13.604 1.00 0.00 H new ATOM 0 HA CYS A 74 -12.625 -18.360 -12.855 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -14.382 -20.325 -11.301 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -13.174 -19.277 -10.585 1.00 0.00 H new ATOM 0 HG CYS A 74 -16.285 -18.514 -11.234 1.00 0.00 H new ATOM 1206 N LEU A 75 -11.775 -21.050 -13.905 1.00 0.00 N ATOM 1207 CA LEU A 75 -10.710 -22.039 -14.093 1.00 0.00 C ATOM 1208 C LEU A 75 -9.351 -21.389 -14.376 1.00 0.00 C ATOM 1209 O LEU A 75 -8.340 -22.091 -14.382 1.00 0.00 O ATOM 1210 CB LEU A 75 -11.097 -23.004 -15.235 1.00 0.00 C ATOM 1211 CG LEU A 75 -11.757 -24.296 -14.717 1.00 0.00 C ATOM 1212 CD1 LEU A 75 -12.487 -25.014 -15.858 1.00 0.00 C ATOM 1213 CD2 LEU A 75 -10.726 -25.253 -14.106 1.00 0.00 C ATOM 0 H LEU A 75 -12.354 -20.927 -14.736 1.00 0.00 H new ATOM 0 HA LEU A 75 -10.604 -22.594 -13.161 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -11.781 -22.499 -15.917 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -10.206 -23.260 -15.808 1.00 0.00 H new ATOM 0 HG LEU A 75 -12.467 -24.008 -13.942 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -12.949 -25.925 -15.478 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -13.257 -24.360 -16.266 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -11.774 -25.268 -16.643 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -11.230 -26.153 -13.752 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -9.988 -25.524 -14.861 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -10.226 -24.764 -13.270 1.00 0.00 H new ATOM 1225 N LYS A 76 -9.311 -20.074 -14.622 1.00 0.00 N ATOM 1226 CA LYS A 76 -8.116 -19.377 -15.112 1.00 0.00 C ATOM 1227 C LYS A 76 -7.831 -18.080 -14.356 1.00 0.00 C ATOM 1228 O LYS A 76 -6.680 -17.654 -14.316 1.00 0.00 O ATOM 1229 CB LYS A 76 -8.259 -19.125 -16.627 1.00 0.00 C ATOM 1230 CG LYS A 76 -9.449 -18.214 -16.979 1.00 0.00 C ATOM 1231 CD LYS A 76 -9.730 -18.165 -18.488 1.00 0.00 C ATOM 1232 CE LYS A 76 -11.008 -17.368 -18.806 1.00 0.00 C ATOM 1233 NZ LYS A 76 -12.234 -18.012 -18.269 1.00 0.00 N ATOM 0 H LYS A 76 -10.113 -19.459 -14.486 1.00 0.00 H new ATOM 0 HA LYS A 76 -7.255 -20.019 -14.928 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -7.340 -18.674 -17.002 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -8.377 -20.080 -17.138 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -10.339 -18.568 -16.459 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -9.249 -17.205 -16.618 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -8.882 -17.712 -19.001 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -9.830 -19.180 -18.872 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -10.918 -16.364 -18.391 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.104 -17.258 -19.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -13.071 -17.481 -18.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -12.294 -18.990 -18.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -12.197 -18.017 -17.230 1.00 0.00 H new ATOM 1247 N ASP A 77 -8.849 -17.463 -13.755 1.00 0.00 N ATOM 1248 CA ASP A 77 -8.726 -16.251 -12.941 1.00 0.00 C ATOM 1249 C ASP A 77 -9.976 -16.153 -12.063 1.00 0.00 C ATOM 1250 O ASP A 77 -10.974 -16.813 -12.357 1.00 0.00 O ATOM 1251 CB ASP A 77 -8.587 -15.018 -13.852 1.00 0.00 C ATOM 1252 CG ASP A 77 -8.387 -13.703 -13.082 1.00 0.00 C ATOM 1253 OD1 ASP A 77 -7.834 -13.735 -11.962 1.00 0.00 O ATOM 1254 OD2 ASP A 77 -8.740 -12.634 -13.627 1.00 0.00 O ATOM 0 H ASP A 77 -9.809 -17.801 -13.822 1.00 0.00 H new ATOM 0 HA ASP A 77 -7.837 -16.292 -12.312 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.743 -15.167 -14.525 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -9.479 -14.933 -14.473 1.00 0.00 H new ATOM 1259 N MET A 78 -9.948 -15.367 -10.988 1.00 0.00 N ATOM 1260 CA MET A 78 -11.106 -15.170 -10.121 1.00 0.00 C ATOM 1261 C MET A 78 -12.033 -14.139 -10.771 1.00 0.00 C ATOM 1262 O MET A 78 -11.647 -12.979 -10.942 1.00 0.00 O ATOM 1263 CB MET A 78 -10.648 -14.719 -8.722 1.00 0.00 C ATOM 1264 CG MET A 78 -9.934 -15.824 -7.929 1.00 0.00 C ATOM 1265 SD MET A 78 -10.929 -17.301 -7.555 1.00 0.00 S ATOM 1266 CE MET A 78 -10.356 -18.444 -8.843 1.00 0.00 C ATOM 0 H MET A 78 -9.120 -14.849 -10.694 1.00 0.00 H new ATOM 0 HA MET A 78 -11.652 -16.105 -9.998 1.00 0.00 H new ATOM 0 HB2 MET A 78 -9.978 -13.865 -8.825 1.00 0.00 H new ATOM 0 HB3 MET A 78 -11.515 -14.378 -8.156 1.00 0.00 H new ATOM 0 HG2 MET A 78 -9.053 -16.135 -8.490 1.00 0.00 H new ATOM 0 HG3 MET A 78 -9.581 -15.400 -6.989 1.00 0.00 H new ATOM 0 HE1 MET A 78 -11.162 -19.130 -9.105 1.00 0.00 H new ATOM 0 HE2 MET A 78 -10.059 -17.878 -9.726 1.00 0.00 H new ATOM 0 HE3 MET A 78 -9.503 -19.012 -8.472 1.00 0.00 H new ATOM 1276 N TYR A 79 -13.263 -14.541 -11.104 1.00 0.00 N ATOM 1277 CA TYR A 79 -14.251 -13.700 -11.777 1.00 0.00 C ATOM 1278 C TYR A 79 -15.544 -13.684 -10.965 1.00 0.00 C ATOM 1279 O TYR A 79 -15.864 -14.668 -10.297 1.00 0.00 O ATOM 1280 CB TYR A 79 -14.555 -14.271 -13.170 1.00 0.00 C ATOM 1281 CG TYR A 79 -13.500 -14.041 -14.231 1.00 0.00 C ATOM 1282 CD1 TYR A 79 -13.376 -12.771 -14.825 1.00 0.00 C ATOM 1283 CD2 TYR A 79 -12.696 -15.106 -14.679 1.00 0.00 C ATOM 1284 CE1 TYR A 79 -12.445 -12.558 -15.855 1.00 0.00 C ATOM 1285 CE2 TYR A 79 -11.769 -14.903 -15.715 1.00 0.00 C ATOM 1286 CZ TYR A 79 -11.630 -13.622 -16.301 1.00 0.00 C ATOM 1287 OH TYR A 79 -10.723 -13.397 -17.295 1.00 0.00 O ATOM 0 H TYR A 79 -13.605 -15.482 -10.908 1.00 0.00 H new ATOM 0 HA TYR A 79 -13.853 -12.689 -11.869 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -14.715 -15.345 -13.073 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -15.493 -13.840 -13.520 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -14.000 -11.956 -14.487 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -12.792 -16.081 -14.225 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -12.352 -11.581 -16.306 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -11.162 -15.725 -16.065 1.00 0.00 H new ATOM 0 HH TYR A 79 -10.238 -14.226 -17.489 1.00 0.00 H new ATOM 1297 N VAL A 80 -16.324 -12.610 -11.077 1.00 0.00 N ATOM 1298 CA VAL A 80 -17.588 -12.444 -10.367 1.00 0.00 C ATOM 1299 C VAL A 80 -18.663 -11.980 -11.344 1.00 0.00 C ATOM 1300 O VAL A 80 -18.384 -11.179 -12.238 1.00 0.00 O ATOM 1301 CB VAL A 80 -17.437 -11.459 -9.185 1.00 0.00 C ATOM 1302 CG1 VAL A 80 -16.697 -12.093 -8.002 1.00 0.00 C ATOM 1303 CG2 VAL A 80 -16.732 -10.138 -9.545 1.00 0.00 C ATOM 0 H VAL A 80 -16.090 -11.817 -11.675 1.00 0.00 H new ATOM 0 HA VAL A 80 -17.888 -13.404 -9.946 1.00 0.00 H new ATOM 0 HB VAL A 80 -18.465 -11.224 -8.909 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -16.613 -11.366 -7.194 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -17.251 -12.964 -7.651 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -15.700 -12.400 -8.319 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -16.668 -9.506 -8.659 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -15.728 -10.350 -9.913 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -17.300 -9.621 -10.319 1.00 0.00 H new ATOM 1313 N GLU A 81 -19.886 -12.487 -11.185 1.00 0.00 N ATOM 1314 CA GLU A 81 -21.040 -11.955 -11.904 1.00 0.00 C ATOM 1315 C GLU A 81 -21.433 -10.671 -11.181 1.00 0.00 C ATOM 1316 O GLU A 81 -21.377 -10.599 -9.949 1.00 0.00 O ATOM 1317 CB GLU A 81 -22.201 -12.959 -11.921 1.00 0.00 C ATOM 1318 CG GLU A 81 -22.009 -13.999 -13.031 1.00 0.00 C ATOM 1319 CD GLU A 81 -23.160 -15.020 -13.058 1.00 0.00 C ATOM 1320 OE1 GLU A 81 -23.112 -16.020 -12.308 1.00 0.00 O ATOM 1321 OE2 GLU A 81 -24.118 -14.841 -13.844 1.00 0.00 O ATOM 0 H GLU A 81 -20.101 -13.266 -10.563 1.00 0.00 H new ATOM 0 HA GLU A 81 -20.795 -11.762 -12.949 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -22.268 -13.460 -10.955 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -23.142 -12.430 -12.072 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -21.947 -13.495 -13.995 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -21.063 -14.520 -12.882 1.00 0.00 H new ATOM 1328 N VAL A 82 -21.835 -9.650 -11.932 1.00 0.00 N ATOM 1329 CA VAL A 82 -22.008 -8.319 -11.385 1.00 0.00 C ATOM 1330 C VAL A 82 -23.099 -7.587 -12.165 1.00 0.00 C ATOM 1331 O VAL A 82 -23.089 -7.574 -13.395 1.00 0.00 O ATOM 1332 CB VAL A 82 -20.618 -7.639 -11.408 1.00 0.00 C ATOM 1333 CG1 VAL A 82 -19.948 -7.580 -12.791 1.00 0.00 C ATOM 1334 CG2 VAL A 82 -20.670 -6.236 -10.828 1.00 0.00 C ATOM 0 H VAL A 82 -22.047 -9.726 -12.927 1.00 0.00 H new ATOM 0 HA VAL A 82 -22.355 -8.319 -10.352 1.00 0.00 H new ATOM 0 HB VAL A 82 -20.002 -8.287 -10.785 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -18.980 -7.086 -12.706 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -19.807 -8.592 -13.171 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -20.581 -7.020 -13.479 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -19.675 -5.791 -10.861 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -21.360 -5.626 -11.412 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -21.012 -6.282 -9.794 1.00 0.00 H new ATOM 1344 N ALA A 83 -24.055 -6.993 -11.453 1.00 0.00 N ATOM 1345 CA ALA A 83 -25.103 -6.171 -12.033 1.00 0.00 C ATOM 1346 C ALA A 83 -24.657 -4.720 -11.907 1.00 0.00 C ATOM 1347 O ALA A 83 -24.176 -4.286 -10.854 1.00 0.00 O ATOM 1348 CB ALA A 83 -26.438 -6.439 -11.340 1.00 0.00 C ATOM 0 H ALA A 83 -24.120 -7.074 -10.438 1.00 0.00 H new ATOM 0 HA ALA A 83 -25.261 -6.409 -13.085 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -27.212 -5.815 -11.787 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -26.705 -7.489 -11.459 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -26.351 -6.205 -10.279 1.00 0.00 H new ATOM 1354 N ASP A 84 -24.796 -3.965 -12.992 1.00 0.00 N ATOM 1355 CA ASP A 84 -24.220 -2.634 -13.108 1.00 0.00 C ATOM 1356 C ASP A 84 -25.191 -1.574 -12.604 1.00 0.00 C ATOM 1357 O ASP A 84 -25.770 -0.820 -13.385 1.00 0.00 O ATOM 1358 CB ASP A 84 -23.787 -2.381 -14.555 1.00 0.00 C ATOM 1359 CG ASP A 84 -23.104 -1.021 -14.732 1.00 0.00 C ATOM 1360 OD1 ASP A 84 -22.836 -0.327 -13.727 1.00 0.00 O ATOM 1361 OD2 ASP A 84 -22.789 -0.675 -15.893 1.00 0.00 O ATOM 0 H ASP A 84 -25.314 -4.263 -13.819 1.00 0.00 H new ATOM 0 HA ASP A 84 -23.333 -2.570 -12.477 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -23.105 -3.171 -14.870 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -24.659 -2.434 -15.207 1.00 0.00 H new ATOM 1366 N ILE A 85 -25.414 -1.533 -11.293 1.00 0.00 N ATOM 1367 CA ILE A 85 -26.298 -0.551 -10.653 1.00 0.00 C ATOM 1368 C ILE A 85 -25.875 0.911 -10.903 1.00 0.00 C ATOM 1369 O ILE A 85 -26.670 1.820 -10.660 1.00 0.00 O ATOM 1370 CB ILE A 85 -26.496 -0.864 -9.151 1.00 0.00 C ATOM 1371 CG1 ILE A 85 -25.209 -0.663 -8.323 1.00 0.00 C ATOM 1372 CG2 ILE A 85 -27.050 -2.293 -8.988 1.00 0.00 C ATOM 1373 CD1 ILE A 85 -25.406 -0.803 -6.809 1.00 0.00 C ATOM 0 H ILE A 85 -24.985 -2.184 -10.636 1.00 0.00 H new ATOM 0 HA ILE A 85 -27.270 -0.651 -11.137 1.00 0.00 H new ATOM 0 HB ILE A 85 -27.219 -0.150 -8.756 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -24.464 -1.388 -8.649 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -24.805 0.327 -8.535 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -27.189 -2.511 -7.929 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -28.007 -2.373 -9.503 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -26.347 -3.007 -9.416 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -24.454 -0.647 -6.302 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -26.126 -0.060 -6.465 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -25.779 -1.802 -6.581 1.00 0.00 H new ATOM 1385 N GLY A 86 -24.657 1.150 -11.397 1.00 0.00 N ATOM 1386 CA GLY A 86 -24.143 2.476 -11.700 1.00 0.00 C ATOM 1387 C GLY A 86 -24.461 2.903 -13.134 1.00 0.00 C ATOM 1388 O GLY A 86 -24.672 4.094 -13.373 1.00 0.00 O ATOM 0 H GLY A 86 -23.990 0.405 -11.600 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -24.571 3.198 -11.004 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -23.064 2.489 -11.549 1.00 0.00 H new ATOM 1392 N GLY A 87 -24.529 1.957 -14.078 1.00 0.00 N ATOM 1393 CA GLY A 87 -24.609 2.244 -15.508 1.00 0.00 C ATOM 1394 C GLY A 87 -25.848 1.692 -16.216 1.00 0.00 C ATOM 1395 O GLY A 87 -26.197 2.212 -17.277 1.00 0.00 O ATOM 0 H GLY A 87 -24.530 0.960 -13.864 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -24.582 3.325 -15.647 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -23.722 1.838 -15.994 1.00 0.00 H new ATOM 1399 N LYS A 88 -26.531 0.680 -15.663 1.00 0.00 N ATOM 1400 CA LYS A 88 -27.673 0.017 -16.312 1.00 0.00 C ATOM 1401 C LYS A 88 -28.793 -0.293 -15.326 1.00 0.00 C ATOM 1402 O LYS A 88 -29.958 -0.127 -15.679 1.00 0.00 O ATOM 1403 CB LYS A 88 -27.227 -1.307 -16.968 1.00 0.00 C ATOM 1404 CG LYS A 88 -26.230 -1.178 -18.130 1.00 0.00 C ATOM 1405 CD LYS A 88 -26.831 -0.496 -19.368 1.00 0.00 C ATOM 1406 CE LYS A 88 -25.783 -0.438 -20.487 1.00 0.00 C ATOM 1407 NZ LYS A 88 -26.307 0.211 -21.715 1.00 0.00 N ATOM 0 H LYS A 88 -26.306 0.295 -14.746 1.00 0.00 H new ATOM 0 HA LYS A 88 -28.048 0.710 -17.065 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -26.780 -1.938 -16.200 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -28.114 -1.827 -17.331 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -25.362 -0.609 -17.795 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -25.873 -2.170 -18.407 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -27.709 -1.045 -19.707 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -27.163 0.511 -19.115 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -24.908 0.108 -20.135 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -25.453 -1.449 -20.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -25.564 0.227 -22.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -27.126 -0.324 -22.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -26.598 1.185 -21.496 1.00 0.00 H new ATOM 1421 N ASP A 89 -28.449 -0.769 -14.127 1.00 0.00 N ATOM 1422 CA ASP A 89 -29.301 -1.331 -13.067 1.00 0.00 C ATOM 1423 C ASP A 89 -30.119 -2.570 -13.466 1.00 0.00 C ATOM 1424 O ASP A 89 -30.384 -3.424 -12.621 1.00 0.00 O ATOM 1425 CB ASP A 89 -30.183 -0.243 -12.442 1.00 0.00 C ATOM 1426 CG ASP A 89 -31.041 -0.793 -11.290 1.00 0.00 C ATOM 1427 OD1 ASP A 89 -30.499 -1.022 -10.186 1.00 0.00 O ATOM 1428 OD2 ASP A 89 -32.271 -0.947 -11.467 1.00 0.00 O ATOM 0 H ASP A 89 -27.470 -0.772 -13.842 1.00 0.00 H new ATOM 0 HA ASP A 89 -28.607 -1.706 -12.315 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -29.554 0.566 -12.072 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -30.832 0.182 -13.207 1.00 0.00 H new ATOM 1433 N ASP A 90 -30.458 -2.718 -14.745 1.00 0.00 N ATOM 1434 CA ASP A 90 -31.354 -3.748 -15.273 1.00 0.00 C ATOM 1435 C ASP A 90 -30.591 -4.826 -16.060 1.00 0.00 C ATOM 1436 O ASP A 90 -31.203 -5.709 -16.663 1.00 0.00 O ATOM 1437 CB ASP A 90 -32.394 -3.052 -16.160 1.00 0.00 C ATOM 1438 CG ASP A 90 -33.518 -3.994 -16.631 1.00 0.00 C ATOM 1439 OD1 ASP A 90 -34.205 -4.604 -15.780 1.00 0.00 O ATOM 1440 OD2 ASP A 90 -33.773 -4.076 -17.855 1.00 0.00 O ATOM 0 H ASP A 90 -30.102 -2.099 -15.473 1.00 0.00 H new ATOM 0 HA ASP A 90 -31.842 -4.265 -14.447 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -32.833 -2.220 -15.609 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -31.894 -2.629 -17.031 1.00 0.00 H new ATOM 1445 N ASP A 91 -29.254 -4.773 -16.066 1.00 0.00 N ATOM 1446 CA ASP A 91 -28.407 -5.714 -16.803 1.00 0.00 C ATOM 1447 C ASP A 91 -27.193 -6.135 -15.973 1.00 0.00 C ATOM 1448 O ASP A 91 -26.825 -5.484 -14.989 1.00 0.00 O ATOM 1449 CB ASP A 91 -27.978 -5.126 -18.158 1.00 0.00 C ATOM 1450 CG ASP A 91 -27.498 -6.188 -19.170 1.00 0.00 C ATOM 1451 OD1 ASP A 91 -27.749 -7.398 -18.975 1.00 0.00 O ATOM 1452 OD2 ASP A 91 -26.903 -5.803 -20.201 1.00 0.00 O ATOM 0 H ASP A 91 -28.725 -4.067 -15.553 1.00 0.00 H new ATOM 0 HA ASP A 91 -28.997 -6.609 -17.000 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -28.817 -4.579 -18.589 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -27.177 -4.405 -17.994 1.00 0.00 H new ATOM 1457 N VAL A 92 -26.575 -7.231 -16.398 1.00 0.00 N ATOM 1458 CA VAL A 92 -25.547 -7.971 -15.685 1.00 0.00 C ATOM 1459 C VAL A 92 -24.401 -8.335 -16.639 1.00 0.00 C ATOM 1460 O VAL A 92 -24.602 -8.534 -17.841 1.00 0.00 O ATOM 1461 CB VAL A 92 -26.227 -9.187 -15.002 1.00 0.00 C ATOM 1462 CG1 VAL A 92 -26.998 -10.090 -15.984 1.00 0.00 C ATOM 1463 CG2 VAL A 92 -25.269 -10.063 -14.184 1.00 0.00 C ATOM 0 H VAL A 92 -26.793 -7.649 -17.303 1.00 0.00 H new ATOM 0 HA VAL A 92 -25.082 -7.374 -14.901 1.00 0.00 H new ATOM 0 HB VAL A 92 -26.934 -8.718 -14.318 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -27.448 -10.920 -15.439 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -27.781 -9.510 -16.473 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -26.311 -10.480 -16.736 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -25.822 -10.890 -13.740 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -24.489 -10.457 -14.836 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -24.814 -9.465 -13.394 1.00 0.00 H new ATOM 1473 N TYR A 93 -23.197 -8.414 -16.075 1.00 0.00 N ATOM 1474 CA TYR A 93 -21.924 -8.645 -16.743 1.00 0.00 C ATOM 1475 C TYR A 93 -21.070 -9.556 -15.847 1.00 0.00 C ATOM 1476 O TYR A 93 -21.533 -10.039 -14.808 1.00 0.00 O ATOM 1477 CB TYR A 93 -21.226 -7.288 -16.968 1.00 0.00 C ATOM 1478 CG TYR A 93 -22.016 -6.283 -17.786 1.00 0.00 C ATOM 1479 CD1 TYR A 93 -21.910 -6.281 -19.190 1.00 0.00 C ATOM 1480 CD2 TYR A 93 -22.851 -5.347 -17.144 1.00 0.00 C ATOM 1481 CE1 TYR A 93 -22.628 -5.345 -19.953 1.00 0.00 C ATOM 1482 CE2 TYR A 93 -23.578 -4.412 -17.901 1.00 0.00 C ATOM 1483 CZ TYR A 93 -23.464 -4.402 -19.311 1.00 0.00 C ATOM 1484 OH TYR A 93 -24.148 -3.477 -20.041 1.00 0.00 O ATOM 0 H TYR A 93 -23.081 -8.310 -15.067 1.00 0.00 H new ATOM 0 HA TYR A 93 -22.069 -9.126 -17.710 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -21.003 -6.847 -15.997 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -20.272 -7.466 -17.464 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -21.274 -7.002 -19.682 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -22.933 -5.348 -16.067 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -22.542 -5.346 -21.030 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -24.223 -3.701 -17.406 1.00 0.00 H new ATOM 0 HH TYR A 93 -24.355 -3.846 -20.925 1.00 0.00 H new ATOM 1494 N THR A 94 -19.804 -9.751 -16.218 1.00 0.00 N ATOM 1495 CA THR A 94 -18.797 -10.406 -15.393 1.00 0.00 C ATOM 1496 C THR A 94 -17.637 -9.417 -15.221 1.00 0.00 C ATOM 1497 O THR A 94 -17.362 -8.622 -16.126 1.00 0.00 O ATOM 1498 CB THR A 94 -18.370 -11.732 -16.056 1.00 0.00 C ATOM 1499 OG1 THR A 94 -19.507 -12.524 -16.351 1.00 0.00 O ATOM 1500 CG2 THR A 94 -17.438 -12.576 -15.178 1.00 0.00 C ATOM 0 H THR A 94 -19.445 -9.449 -17.124 1.00 0.00 H new ATOM 0 HA THR A 94 -19.179 -10.668 -14.406 1.00 0.00 H new ATOM 0 HB THR A 94 -17.833 -11.447 -16.961 1.00 0.00 H new ATOM 0 HG1 THR A 94 -19.222 -13.361 -16.773 1.00 0.00 H new ATOM 0 HG21 THR A 94 -17.176 -13.494 -15.703 1.00 0.00 H new ATOM 0 HG22 THR A 94 -16.532 -12.011 -14.961 1.00 0.00 H new ATOM 0 HG23 THR A 94 -17.943 -12.824 -14.244 1.00 0.00 H new ATOM 1508 N ALA A 95 -16.957 -9.471 -14.074 1.00 0.00 N ATOM 1509 CA ALA A 95 -15.794 -8.649 -13.766 1.00 0.00 C ATOM 1510 C ALA A 95 -14.710 -9.500 -13.119 1.00 0.00 C ATOM 1511 O ALA A 95 -14.988 -10.543 -12.526 1.00 0.00 O ATOM 1512 CB ALA A 95 -16.189 -7.483 -12.851 1.00 0.00 C ATOM 0 H ALA A 95 -17.210 -10.106 -13.316 1.00 0.00 H new ATOM 0 HA ALA A 95 -15.400 -8.233 -14.694 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -15.309 -6.879 -12.631 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -16.937 -6.866 -13.350 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -16.603 -7.874 -11.921 1.00 0.00 H new ATOM 1518 N LYS A 96 -13.463 -9.042 -13.233 1.00 0.00 N ATOM 1519 CA LYS A 96 -12.328 -9.656 -12.555 1.00 0.00 C ATOM 1520 C LYS A 96 -12.496 -9.308 -11.083 1.00 0.00 C ATOM 1521 O LYS A 96 -12.687 -8.130 -10.771 1.00 0.00 O ATOM 1522 CB LYS A 96 -10.984 -9.094 -13.064 1.00 0.00 C ATOM 1523 CG LYS A 96 -10.628 -9.307 -14.550 1.00 0.00 C ATOM 1524 CD LYS A 96 -11.476 -8.564 -15.605 1.00 0.00 C ATOM 1525 CE LYS A 96 -11.702 -7.057 -15.355 1.00 0.00 C ATOM 1526 NZ LYS A 96 -10.487 -6.223 -15.543 1.00 0.00 N ATOM 0 H LYS A 96 -13.214 -8.232 -13.801 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.309 -10.730 -12.738 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -10.975 -8.022 -12.868 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -10.188 -9.535 -12.463 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -9.587 -9.016 -14.691 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -10.691 -10.375 -14.760 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -10.996 -8.683 -16.577 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.449 -9.051 -15.668 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.482 -6.701 -16.028 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -12.071 -6.919 -14.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -10.601 -5.323 -15.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -9.658 -6.728 -15.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -10.350 -6.033 -16.556 1.00 0.00 H new ATOM 1540 N LEU A 97 -12.371 -10.274 -10.172 1.00 0.00 N ATOM 1541 CA LEU A 97 -12.388 -9.962 -8.744 1.00 0.00 C ATOM 1542 C LEU A 97 -11.231 -9.016 -8.399 1.00 0.00 C ATOM 1543 O LEU A 97 -11.383 -8.112 -7.580 1.00 0.00 O ATOM 1544 CB LEU A 97 -12.323 -11.254 -7.917 1.00 0.00 C ATOM 1545 CG LEU A 97 -12.441 -11.003 -6.400 1.00 0.00 C ATOM 1546 CD1 LEU A 97 -13.748 -10.284 -6.036 1.00 0.00 C ATOM 1547 CD2 LEU A 97 -12.368 -12.340 -5.661 1.00 0.00 C ATOM 0 H LEU A 97 -12.259 -11.263 -10.393 1.00 0.00 H new ATOM 0 HA LEU A 97 -13.321 -9.456 -8.498 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -13.124 -11.922 -8.233 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -11.382 -11.764 -8.123 1.00 0.00 H new ATOM 0 HG LEU A 97 -11.615 -10.357 -6.101 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -13.789 -10.128 -4.958 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -13.787 -9.321 -6.544 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -14.597 -10.893 -6.347 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -12.451 -12.168 -4.588 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -13.185 -12.982 -5.990 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -11.416 -12.824 -5.878 1.00 0.00 H new ATOM 1559 N SER A 98 -10.103 -9.180 -9.092 1.00 0.00 N ATOM 1560 CA SER A 98 -8.909 -8.350 -9.031 1.00 0.00 C ATOM 1561 C SER A 98 -9.154 -6.863 -9.341 1.00 0.00 C ATOM 1562 O SER A 98 -8.284 -6.039 -9.061 1.00 0.00 O ATOM 1563 CB SER A 98 -7.917 -8.915 -10.055 1.00 0.00 C ATOM 1564 OG SER A 98 -7.914 -10.335 -10.014 1.00 0.00 O ATOM 0 H SER A 98 -9.997 -9.949 -9.754 1.00 0.00 H new ATOM 0 HA SER A 98 -8.535 -8.381 -8.008 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.185 -8.575 -11.055 1.00 0.00 H new ATOM 0 HB3 SER A 98 -6.916 -8.537 -9.847 1.00 0.00 H new ATOM 0 HG SER A 98 -7.277 -10.680 -10.674 1.00 0.00 H new ATOM 1570 N ASP A 99 -10.304 -6.510 -9.930 1.00 0.00 N ATOM 1571 CA ASP A 99 -10.579 -5.175 -10.473 1.00 0.00 C ATOM 1572 C ASP A 99 -11.769 -4.516 -9.762 1.00 0.00 C ATOM 1573 O ASP A 99 -12.307 -3.504 -10.209 1.00 0.00 O ATOM 1574 CB ASP A 99 -10.772 -5.327 -11.991 1.00 0.00 C ATOM 1575 CG ASP A 99 -10.635 -4.048 -12.826 1.00 0.00 C ATOM 1576 OD1 ASP A 99 -9.838 -3.151 -12.480 1.00 0.00 O ATOM 1577 OD2 ASP A 99 -11.226 -4.033 -13.933 1.00 0.00 O ATOM 0 H ASP A 99 -11.084 -7.158 -10.044 1.00 0.00 H new ATOM 0 HA ASP A 99 -9.745 -4.497 -10.293 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -10.046 -6.053 -12.357 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -11.762 -5.747 -12.169 1.00 0.00 H new ATOM 1582 N ILE A 100 -12.166 -5.090 -8.625 1.00 0.00 N ATOM 1583 CA ILE A 100 -13.281 -4.650 -7.793 1.00 0.00 C ATOM 1584 C ILE A 100 -12.780 -4.408 -6.369 1.00 0.00 C ATOM 1585 O ILE A 100 -11.800 -4.996 -5.907 1.00 0.00 O ATOM 1586 CB ILE A 100 -14.450 -5.673 -7.901 1.00 0.00 C ATOM 1587 CG1 ILE A 100 -15.431 -5.178 -8.986 1.00 0.00 C ATOM 1588 CG2 ILE A 100 -15.217 -5.975 -6.594 1.00 0.00 C ATOM 1589 CD1 ILE A 100 -16.518 -6.185 -9.368 1.00 0.00 C ATOM 0 H ILE A 100 -11.696 -5.911 -8.244 1.00 0.00 H new ATOM 0 HA ILE A 100 -13.686 -3.699 -8.140 1.00 0.00 H new ATOM 0 HB ILE A 100 -13.986 -6.625 -8.160 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -15.909 -4.263 -8.636 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -14.863 -4.919 -9.880 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -16.006 -6.700 -6.794 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -14.529 -6.383 -5.854 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -15.658 -5.055 -6.210 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -17.161 -5.753 -10.135 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -16.054 -7.093 -9.752 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -17.115 -6.427 -8.489 1.00 0.00 H new ATOM 1601 N GLU A 101 -13.515 -3.545 -5.679 1.00 0.00 N ATOM 1602 CA GLU A 101 -13.350 -3.203 -4.277 1.00 0.00 C ATOM 1603 C GLU A 101 -14.700 -3.475 -3.622 1.00 0.00 C ATOM 1604 O GLU A 101 -15.708 -2.899 -4.031 1.00 0.00 O ATOM 1605 CB GLU A 101 -12.920 -1.732 -4.169 1.00 0.00 C ATOM 1606 CG GLU A 101 -12.850 -1.228 -2.722 1.00 0.00 C ATOM 1607 CD GLU A 101 -12.157 0.146 -2.629 1.00 0.00 C ATOM 1608 OE1 GLU A 101 -12.656 1.138 -3.209 1.00 0.00 O ATOM 1609 OE2 GLU A 101 -11.101 0.246 -1.962 1.00 0.00 O ATOM 0 H GLU A 101 -14.287 -3.037 -6.111 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.577 -3.787 -3.777 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -11.943 -1.610 -4.637 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -13.621 -1.113 -4.729 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.858 -1.156 -2.313 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -12.309 -1.950 -2.111 1.00 0.00 H new ATOM 1616 N ALA A 102 -14.735 -4.385 -2.649 1.00 0.00 N ATOM 1617 CA ALA A 102 -15.970 -4.778 -1.989 1.00 0.00 C ATOM 1618 C ALA A 102 -16.352 -3.715 -0.961 1.00 0.00 C ATOM 1619 O ALA A 102 -15.493 -3.219 -0.226 1.00 0.00 O ATOM 1620 CB ALA A 102 -15.782 -6.134 -1.310 1.00 0.00 C ATOM 0 H ALA A 102 -13.907 -4.867 -2.300 1.00 0.00 H new ATOM 0 HA ALA A 102 -16.770 -4.865 -2.724 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -16.709 -6.425 -0.816 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -15.518 -6.882 -2.058 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -14.984 -6.063 -0.571 1.00 0.00 H new ATOM 1626 N ILE A 103 -17.642 -3.398 -0.896 1.00 0.00 N ATOM 1627 CA ILE A 103 -18.202 -2.365 -0.030 1.00 0.00 C ATOM 1628 C ILE A 103 -19.408 -2.954 0.709 1.00 0.00 C ATOM 1629 O ILE A 103 -20.146 -3.773 0.159 1.00 0.00 O ATOM 1630 CB ILE A 103 -18.564 -1.139 -0.903 1.00 0.00 C ATOM 1631 CG1 ILE A 103 -17.273 -0.477 -1.440 1.00 0.00 C ATOM 1632 CG2 ILE A 103 -19.435 -0.095 -0.176 1.00 0.00 C ATOM 1633 CD1 ILE A 103 -17.538 0.573 -2.515 1.00 0.00 C ATOM 0 H ILE A 103 -18.348 -3.868 -1.462 1.00 0.00 H new ATOM 0 HA ILE A 103 -17.490 -2.030 0.724 1.00 0.00 H new ATOM 0 HB ILE A 103 -19.168 -1.515 -1.729 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -16.739 -0.012 -0.611 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -16.620 -1.248 -1.848 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -19.648 0.734 -0.850 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -20.371 -0.557 0.138 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -18.903 0.277 0.700 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -16.592 0.999 -2.849 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -18.045 0.108 -3.360 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -18.167 1.363 -2.105 1.00 0.00 H new ATOM 1645 N ASP A 104 -19.621 -2.490 1.946 1.00 0.00 N ATOM 1646 CA ASP A 104 -20.792 -2.788 2.779 1.00 0.00 C ATOM 1647 C ASP A 104 -21.083 -4.293 2.879 1.00 0.00 C ATOM 1648 O ASP A 104 -22.234 -4.734 2.829 1.00 0.00 O ATOM 1649 CB ASP A 104 -21.995 -1.940 2.328 1.00 0.00 C ATOM 1650 CG ASP A 104 -23.192 -2.051 3.293 1.00 0.00 C ATOM 1651 OD1 ASP A 104 -23.003 -1.950 4.527 1.00 0.00 O ATOM 1652 OD2 ASP A 104 -24.346 -2.171 2.821 1.00 0.00 O ATOM 0 H ASP A 104 -18.956 -1.873 2.412 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.569 -2.497 3.805 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -21.691 -0.896 2.251 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -22.305 -2.256 1.332 1.00 0.00 H new ATOM 1657 N VAL A 105 -20.019 -5.094 3.005 1.00 0.00 N ATOM 1658 CA VAL A 105 -20.100 -6.551 3.099 1.00 0.00 C ATOM 1659 C VAL A 105 -19.540 -7.035 4.446 1.00 0.00 C ATOM 1660 O VAL A 105 -18.932 -6.262 5.193 1.00 0.00 O ATOM 1661 CB VAL A 105 -19.437 -7.174 1.849 1.00 0.00 C ATOM 1662 CG1 VAL A 105 -17.900 -7.197 1.890 1.00 0.00 C ATOM 1663 CG2 VAL A 105 -20.015 -8.564 1.565 1.00 0.00 C ATOM 0 H VAL A 105 -19.063 -4.740 3.045 1.00 0.00 H new ATOM 0 HA VAL A 105 -21.136 -6.891 3.095 1.00 0.00 H new ATOM 0 HB VAL A 105 -19.684 -6.511 1.020 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -17.518 -7.650 0.975 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -17.523 -6.178 1.975 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -17.568 -7.779 2.749 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -19.535 -8.984 0.681 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -19.834 -9.215 2.420 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -21.088 -8.483 1.391 1.00 0.00 H new ATOM 1673 N ASP A 106 -19.772 -8.311 4.771 1.00 0.00 N ATOM 1674 CA ASP A 106 -19.291 -8.931 6.001 1.00 0.00 C ATOM 1675 C ASP A 106 -17.768 -9.014 5.993 1.00 0.00 C ATOM 1676 O ASP A 106 -17.141 -9.137 4.939 1.00 0.00 O ATOM 1677 CB ASP A 106 -19.861 -10.343 6.150 1.00 0.00 C ATOM 1678 CG ASP A 106 -19.414 -10.993 7.468 1.00 0.00 C ATOM 1679 OD1 ASP A 106 -19.968 -10.636 8.532 1.00 0.00 O ATOM 1680 OD2 ASP A 106 -18.494 -11.838 7.444 1.00 0.00 O ATOM 0 H ASP A 106 -20.306 -8.946 4.178 1.00 0.00 H new ATOM 0 HA ASP A 106 -19.621 -8.315 6.838 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -20.950 -10.303 6.113 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -19.536 -10.958 5.311 1.00 0.00 H new ATOM 1685 N ASP A 107 -17.189 -8.991 7.189 1.00 0.00 N ATOM 1686 CA ASP A 107 -15.748 -9.018 7.403 1.00 0.00 C ATOM 1687 C ASP A 107 -15.096 -10.212 6.716 1.00 0.00 C ATOM 1688 O ASP A 107 -14.062 -10.040 6.080 1.00 0.00 O ATOM 1689 CB ASP A 107 -15.448 -9.040 8.904 1.00 0.00 C ATOM 1690 CG ASP A 107 -13.936 -9.122 9.170 1.00 0.00 C ATOM 1691 OD1 ASP A 107 -13.238 -8.094 9.016 1.00 0.00 O ATOM 1692 OD2 ASP A 107 -13.452 -10.194 9.597 1.00 0.00 O ATOM 0 H ASP A 107 -17.723 -8.952 8.057 1.00 0.00 H new ATOM 0 HA ASP A 107 -15.325 -8.116 6.960 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -15.854 -8.143 9.371 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -15.947 -9.893 9.364 1.00 0.00 H new ATOM 1697 N ASP A 108 -15.699 -11.403 6.772 1.00 0.00 N ATOM 1698 CA ASP A 108 -15.073 -12.598 6.207 1.00 0.00 C ATOM 1699 C ASP A 108 -15.126 -12.579 4.675 1.00 0.00 C ATOM 1700 O ASP A 108 -14.229 -13.099 4.012 1.00 0.00 O ATOM 1701 CB ASP A 108 -15.737 -13.868 6.758 1.00 0.00 C ATOM 1702 CG ASP A 108 -14.862 -15.129 6.623 1.00 0.00 C ATOM 1703 OD1 ASP A 108 -13.614 -15.043 6.636 1.00 0.00 O ATOM 1704 OD2 ASP A 108 -15.434 -16.243 6.615 1.00 0.00 O ATOM 0 H ASP A 108 -16.611 -11.563 7.199 1.00 0.00 H new ATOM 0 HA ASP A 108 -14.024 -12.601 6.505 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -15.979 -13.715 7.810 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -16.679 -14.032 6.235 1.00 0.00 H new ATOM 1709 N THR A 109 -16.147 -11.929 4.102 1.00 0.00 N ATOM 1710 CA THR A 109 -16.231 -11.705 2.663 1.00 0.00 C ATOM 1711 C THR A 109 -15.154 -10.700 2.253 1.00 0.00 C ATOM 1712 O THR A 109 -14.373 -10.978 1.340 1.00 0.00 O ATOM 1713 CB THR A 109 -17.639 -11.205 2.307 1.00 0.00 C ATOM 1714 OG1 THR A 109 -18.595 -12.177 2.672 1.00 0.00 O ATOM 1715 CG2 THR A 109 -17.792 -10.956 0.810 1.00 0.00 C ATOM 0 H THR A 109 -16.934 -11.546 4.626 1.00 0.00 H new ATOM 0 HA THR A 109 -16.058 -12.633 2.118 1.00 0.00 H new ATOM 0 HB THR A 109 -17.792 -10.270 2.846 1.00 0.00 H new ATOM 0 HG1 THR A 109 -19.218 -11.794 3.325 1.00 0.00 H new ATOM 0 HG21 THR A 109 -18.802 -10.604 0.601 1.00 0.00 H new ATOM 0 HG22 THR A 109 -17.072 -10.203 0.491 1.00 0.00 H new ATOM 0 HG23 THR A 109 -17.612 -11.884 0.267 1.00 0.00 H new ATOM 1723 N GLN A 110 -15.080 -9.555 2.941 1.00 0.00 N ATOM 1724 CA GLN A 110 -14.109 -8.517 2.635 1.00 0.00 C ATOM 1725 C GLN A 110 -12.693 -9.099 2.731 1.00 0.00 C ATOM 1726 O GLN A 110 -11.897 -8.919 1.813 1.00 0.00 O ATOM 1727 CB GLN A 110 -14.326 -7.314 3.576 1.00 0.00 C ATOM 1728 CG GLN A 110 -13.941 -5.966 2.945 1.00 0.00 C ATOM 1729 CD GLN A 110 -12.461 -5.872 2.567 1.00 0.00 C ATOM 1730 OE1 GLN A 110 -11.586 -5.798 3.426 1.00 0.00 O ATOM 1731 NE2 GLN A 110 -12.149 -5.876 1.280 1.00 0.00 N ATOM 0 H GLN A 110 -15.694 -9.329 3.723 1.00 0.00 H new ATOM 0 HA GLN A 110 -14.241 -8.155 1.615 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -15.374 -7.281 3.875 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -13.740 -7.462 4.483 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -14.547 -5.804 2.053 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -14.182 -5.164 3.643 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -12.885 -5.938 0.577 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -11.172 -5.817 0.992 1.00 0.00 H new ATOM 1740 N GLU A 111 -12.395 -9.855 3.789 1.00 0.00 N ATOM 1741 CA GLU A 111 -11.086 -10.455 3.998 1.00 0.00 C ATOM 1742 C GLU A 111 -10.753 -11.479 2.910 1.00 0.00 C ATOM 1743 O GLU A 111 -9.602 -11.528 2.485 1.00 0.00 O ATOM 1744 CB GLU A 111 -11.011 -11.100 5.392 1.00 0.00 C ATOM 1745 CG GLU A 111 -10.887 -10.070 6.528 1.00 0.00 C ATOM 1746 CD GLU A 111 -9.488 -9.428 6.585 1.00 0.00 C ATOM 1747 OE1 GLU A 111 -8.570 -10.017 7.201 1.00 0.00 O ATOM 1748 OE2 GLU A 111 -9.293 -8.321 6.036 1.00 0.00 O ATOM 0 H GLU A 111 -13.065 -10.067 4.529 1.00 0.00 H new ATOM 0 HA GLU A 111 -10.342 -9.661 3.937 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.903 -11.705 5.554 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.157 -11.776 5.428 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -11.637 -9.291 6.392 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.101 -10.555 7.480 1.00 0.00 H new ATOM 1755 N ALA A 112 -11.719 -12.266 2.415 1.00 0.00 N ATOM 1756 CA ALA A 112 -11.453 -13.227 1.345 1.00 0.00 C ATOM 1757 C ALA A 112 -11.029 -12.501 0.063 1.00 0.00 C ATOM 1758 O ALA A 112 -10.087 -12.912 -0.616 1.00 0.00 O ATOM 1759 CB ALA A 112 -12.693 -14.092 1.086 1.00 0.00 C ATOM 0 H ALA A 112 -12.686 -12.253 2.739 1.00 0.00 H new ATOM 0 HA ALA A 112 -10.635 -13.876 1.658 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -12.481 -14.803 0.287 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -12.954 -14.635 1.994 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -13.527 -13.454 0.792 1.00 0.00 H new ATOM 1765 N ILE A 113 -11.717 -11.405 -0.257 1.00 0.00 N ATOM 1766 CA ILE A 113 -11.453 -10.614 -1.452 1.00 0.00 C ATOM 1767 C ILE A 113 -10.108 -9.895 -1.286 1.00 0.00 C ATOM 1768 O ILE A 113 -9.283 -9.916 -2.200 1.00 0.00 O ATOM 1769 CB ILE A 113 -12.648 -9.662 -1.689 1.00 0.00 C ATOM 1770 CG1 ILE A 113 -13.930 -10.496 -1.951 1.00 0.00 C ATOM 1771 CG2 ILE A 113 -12.366 -8.689 -2.849 1.00 0.00 C ATOM 1772 CD1 ILE A 113 -15.213 -9.666 -1.940 1.00 0.00 C ATOM 0 H ILE A 113 -12.480 -11.040 0.314 1.00 0.00 H new ATOM 0 HA ILE A 113 -11.364 -11.236 -2.342 1.00 0.00 H new ATOM 0 HB ILE A 113 -12.799 -9.056 -0.796 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -13.838 -10.995 -2.916 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -14.006 -11.277 -1.195 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -13.225 -8.033 -2.991 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -11.486 -8.089 -2.615 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -12.187 -9.255 -3.763 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -16.068 -10.315 -2.130 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -15.329 -9.188 -0.967 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -15.158 -8.902 -2.715 1.00 0.00 H new ATOM 1784 N ALA A 114 -9.854 -9.306 -0.112 1.00 0.00 N ATOM 1785 CA ALA A 114 -8.587 -8.662 0.198 1.00 0.00 C ATOM 1786 C ALA A 114 -7.437 -9.662 0.083 1.00 0.00 C ATOM 1787 O ALA A 114 -6.391 -9.325 -0.457 1.00 0.00 O ATOM 1788 CB ALA A 114 -8.637 -8.054 1.603 1.00 0.00 C ATOM 0 H ALA A 114 -10.531 -9.266 0.650 1.00 0.00 H new ATOM 0 HA ALA A 114 -8.414 -7.861 -0.521 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -7.684 -7.574 1.826 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -9.436 -7.314 1.651 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -8.827 -8.841 2.333 1.00 0.00 H new ATOM 1794 N ASP A 115 -7.631 -10.897 0.543 1.00 0.00 N ATOM 1795 CA ASP A 115 -6.598 -11.929 0.505 1.00 0.00 C ATOM 1796 C ASP A 115 -6.259 -12.340 -0.928 1.00 0.00 C ATOM 1797 O ASP A 115 -5.081 -12.524 -1.237 1.00 0.00 O ATOM 1798 CB ASP A 115 -7.024 -13.150 1.320 1.00 0.00 C ATOM 1799 CG ASP A 115 -5.887 -14.174 1.396 1.00 0.00 C ATOM 1800 OD1 ASP A 115 -4.953 -13.977 2.202 1.00 0.00 O ATOM 1801 OD2 ASP A 115 -5.980 -15.239 0.750 1.00 0.00 O ATOM 0 H ASP A 115 -8.511 -11.210 0.953 1.00 0.00 H new ATOM 0 HA ASP A 115 -5.698 -11.504 0.950 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -7.309 -12.841 2.326 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -7.903 -13.608 0.866 1.00 0.00 H new ATOM 1806 N TRP A 116 -7.252 -12.414 -1.826 1.00 0.00 N ATOM 1807 CA TRP A 116 -6.997 -12.612 -3.251 1.00 0.00 C ATOM 1808 C TRP A 116 -6.167 -11.452 -3.811 1.00 0.00 C ATOM 1809 O TRP A 116 -5.183 -11.679 -4.519 1.00 0.00 O ATOM 1810 CB TRP A 116 -8.312 -12.766 -4.034 1.00 0.00 C ATOM 1811 CG TRP A 116 -8.135 -12.698 -5.523 1.00 0.00 C ATOM 1812 CD1 TRP A 116 -8.492 -11.660 -6.313 1.00 0.00 C ATOM 1813 CD2 TRP A 116 -7.442 -13.640 -6.401 1.00 0.00 C ATOM 1814 NE1 TRP A 116 -8.064 -11.889 -7.604 1.00 0.00 N ATOM 1815 CE2 TRP A 116 -7.392 -13.086 -7.714 1.00 0.00 C ATOM 1816 CE3 TRP A 116 -6.821 -14.893 -6.220 1.00 0.00 C ATOM 1817 CZ2 TRP A 116 -6.751 -13.735 -8.779 1.00 0.00 C ATOM 1818 CZ3 TRP A 116 -6.195 -15.566 -7.284 1.00 0.00 C ATOM 1819 CH2 TRP A 116 -6.155 -14.989 -8.565 1.00 0.00 C ATOM 0 H TRP A 116 -8.240 -12.339 -1.585 1.00 0.00 H new ATOM 0 HA TRP A 116 -6.429 -13.535 -3.368 1.00 0.00 H new ATOM 0 HB2 TRP A 116 -8.771 -13.720 -3.774 1.00 0.00 H new ATOM 0 HB3 TRP A 116 -9.005 -11.984 -3.723 1.00 0.00 H new ATOM 0 HD1 TRP A 116 -9.031 -10.784 -5.983 1.00 0.00 H new ATOM 0 HE1 TRP A 116 -8.225 -11.250 -8.382 1.00 0.00 H new ATOM 0 HE3 TRP A 116 -6.826 -15.347 -5.240 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 -6.716 -13.275 -9.755 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 -5.742 -16.532 -7.116 1.00 0.00 H new ATOM 0 HH2 TRP A 116 -5.669 -15.506 -9.379 1.00 0.00 H new ATOM 1830 N LEU A 117 -6.541 -10.209 -3.488 1.00 0.00 N ATOM 1831 CA LEU A 117 -5.839 -9.025 -3.976 1.00 0.00 C ATOM 1832 C LEU A 117 -4.392 -9.023 -3.466 1.00 0.00 C ATOM 1833 O LEU A 117 -3.473 -8.756 -4.242 1.00 0.00 O ATOM 1834 CB LEU A 117 -6.582 -7.748 -3.539 1.00 0.00 C ATOM 1835 CG LEU A 117 -7.928 -7.537 -4.264 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -8.793 -6.530 -3.500 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -7.722 -7.038 -5.699 1.00 0.00 C ATOM 0 H LEU A 117 -7.336 -10.000 -2.884 1.00 0.00 H new ATOM 0 HA LEU A 117 -5.816 -9.047 -5.066 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -6.761 -7.791 -2.465 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -5.942 -6.885 -3.721 1.00 0.00 H new ATOM 0 HG LEU A 117 -8.432 -8.503 -4.301 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -9.739 -6.392 -4.024 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -8.986 -6.905 -2.495 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -8.270 -5.576 -3.437 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -8.691 -6.901 -6.179 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -7.188 -6.088 -5.681 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -7.140 -7.770 -6.259 1.00 0.00 H new ATOM 1849 N TYR A 118 -4.172 -9.358 -2.189 1.00 0.00 N ATOM 1850 CA TYR A 118 -2.842 -9.453 -1.601 1.00 0.00 C ATOM 1851 C TYR A 118 -2.031 -10.540 -2.303 1.00 0.00 C ATOM 1852 O TYR A 118 -0.910 -10.263 -2.715 1.00 0.00 O ATOM 1853 CB TYR A 118 -2.909 -9.734 -0.090 1.00 0.00 C ATOM 1854 CG TYR A 118 -3.600 -8.705 0.796 1.00 0.00 C ATOM 1855 CD1 TYR A 118 -3.627 -7.334 0.460 1.00 0.00 C ATOM 1856 CD2 TYR A 118 -4.199 -9.134 1.998 1.00 0.00 C ATOM 1857 CE1 TYR A 118 -4.270 -6.409 1.303 1.00 0.00 C ATOM 1858 CE2 TYR A 118 -4.843 -8.216 2.846 1.00 0.00 C ATOM 1859 CZ TYR A 118 -4.884 -6.845 2.499 1.00 0.00 C ATOM 1860 OH TYR A 118 -5.501 -5.938 3.308 1.00 0.00 O ATOM 0 H TYR A 118 -4.924 -9.572 -1.533 1.00 0.00 H new ATOM 0 HA TYR A 118 -2.349 -8.491 -1.739 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.414 -10.690 0.050 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -1.889 -9.857 0.273 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -3.152 -6.994 -0.448 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -4.163 -10.179 2.270 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -4.294 -5.363 1.035 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -5.306 -8.557 3.761 1.00 0.00 H new ATOM 0 HH TYR A 118 -5.874 -6.397 4.089 1.00 0.00 H new ATOM 1870 N TRP A 119 -2.595 -11.735 -2.513 1.00 0.00 N ATOM 1871 CA TRP A 119 -1.928 -12.809 -3.241 1.00 0.00 C ATOM 1872 C TRP A 119 -1.488 -12.334 -4.627 1.00 0.00 C ATOM 1873 O TRP A 119 -0.348 -12.573 -5.028 1.00 0.00 O ATOM 1874 CB TRP A 119 -2.860 -14.027 -3.345 1.00 0.00 C ATOM 1875 CG TRP A 119 -2.568 -14.958 -4.482 1.00 0.00 C ATOM 1876 CD1 TRP A 119 -3.201 -14.941 -5.676 1.00 0.00 C ATOM 1877 CD2 TRP A 119 -1.560 -16.010 -4.584 1.00 0.00 C ATOM 1878 NE1 TRP A 119 -2.663 -15.898 -6.508 1.00 0.00 N ATOM 1879 CE2 TRP A 119 -1.650 -16.597 -5.883 1.00 0.00 C ATOM 1880 CE3 TRP A 119 -0.582 -16.532 -3.710 1.00 0.00 C ATOM 1881 CZ2 TRP A 119 -0.819 -17.653 -6.285 1.00 0.00 C ATOM 1882 CZ3 TRP A 119 0.259 -17.590 -4.105 1.00 0.00 C ATOM 1883 CH2 TRP A 119 0.141 -18.153 -5.389 1.00 0.00 C ATOM 0 H TRP A 119 -3.528 -11.980 -2.181 1.00 0.00 H new ATOM 0 HA TRP A 119 -1.033 -13.103 -2.693 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -2.803 -14.589 -2.413 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -3.886 -13.672 -3.441 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -4.010 -14.275 -5.939 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -2.974 -16.068 -7.464 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -0.477 -16.112 -2.720 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -0.916 -18.078 -7.273 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 1.000 -17.972 -3.418 1.00 0.00 H new ATOM 0 HH2 TRP A 119 0.786 -18.967 -5.685 1.00 0.00 H new ATOM 1894 N LEU A 120 -2.368 -11.642 -5.355 1.00 0.00 N ATOM 1895 CA LEU A 120 -2.076 -11.219 -6.716 1.00 0.00 C ATOM 1896 C LEU A 120 -0.896 -10.246 -6.711 1.00 0.00 C ATOM 1897 O LEU A 120 0.030 -10.387 -7.510 1.00 0.00 O ATOM 1898 CB LEU A 120 -3.334 -10.593 -7.339 1.00 0.00 C ATOM 1899 CG LEU A 120 -3.144 -10.161 -8.805 1.00 0.00 C ATOM 1900 CD1 LEU A 120 -2.799 -11.345 -9.717 1.00 0.00 C ATOM 1901 CD2 LEU A 120 -4.435 -9.507 -9.300 1.00 0.00 C ATOM 0 H LEU A 120 -3.290 -11.365 -5.018 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.793 -12.078 -7.325 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -4.153 -11.310 -7.283 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -3.629 -9.726 -6.748 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.311 -9.460 -8.843 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -2.674 -10.992 -10.741 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -1.872 -11.808 -9.378 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -3.605 -12.078 -9.682 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -4.311 -9.197 -10.338 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -5.255 -10.222 -9.230 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.660 -8.635 -8.685 1.00 0.00 H new ATOM 1913 N ALA A 121 -0.906 -9.294 -5.775 1.00 0.00 N ATOM 1914 CA ALA A 121 0.155 -8.314 -5.602 1.00 0.00 C ATOM 1915 C ALA A 121 1.470 -8.956 -5.127 1.00 0.00 C ATOM 1916 O ALA A 121 2.546 -8.552 -5.569 1.00 0.00 O ATOM 1917 CB ALA A 121 -0.346 -7.268 -4.604 1.00 0.00 C ATOM 0 H ALA A 121 -1.669 -9.185 -5.106 1.00 0.00 H new ATOM 0 HA ALA A 121 0.385 -7.850 -6.561 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.426 -6.514 -4.449 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -1.245 -6.792 -4.996 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -0.577 -7.752 -3.655 1.00 0.00 H new