USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 816 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 76 ASN : amide:sc= -4.27! C(o=-9.5!,f=-12!) USER MOD Set 1.2: A 78 GLN : amide:sc= -5.18! C(o=-9.5!,f=-16!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=-0.0077) USER MOD Single : A 29 TYR OH : rot 150:sc= 0 USER MOD Single : A 32 HIS : no HE2:sc= -5.26! C(o=-5.3!,f=-8.9!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 77:sc= -0.106 USER MOD Single : A 44 HIS : no HD1:sc= -3.23! C(o=-3.2!,f=-5!) USER MOD Single : A 47 CYS SG : rot 180:sc= -0.188 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.241 X(o=-0.24,f=-0.16) USER MOD Single : A 58 MET CE :methyl -136:sc= -8.12! (180deg=-11.6!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0143 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.366 USER MOD Single : A 68 TYR OH : rot -133:sc= -4.2! USER MOD Single : A 71 ASN : amide:sc= -4.91! C(o=-4.9!,f=-8.8!) USER MOD Single : A 72 LYS NZ :NH3+ -150:sc= -0.824! (180deg=-3!) USER MOD Single : A 73 GLN : amide:sc= -0.0062 X(o=-0.0062,f=-0.12) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= -0.576 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.0477 X(o=-0.048,f=-0.45) USER MOD Single : A 95 ASN :FLIP amide:sc= -0.711 F(o=-1.9!,f=-0.71) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 105 THR OG1 : rot -73:sc= 1.07 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 93:sc= 0.374 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.0108 X(o=-0.011,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 251 N PRO A 18 10.614 -24.923 -10.188 1.00 0.00 N ATOM 252 CA PRO A 18 11.356 -23.753 -9.707 1.00 0.00 C ATOM 253 C PRO A 18 10.491 -22.827 -8.858 1.00 0.00 C ATOM 254 O PRO A 18 9.958 -21.833 -9.352 1.00 0.00 O ATOM 255 CB PRO A 18 11.786 -23.050 -10.997 1.00 0.00 C ATOM 256 CG PRO A 18 10.780 -23.473 -12.011 1.00 0.00 C ATOM 257 CD PRO A 18 10.381 -24.874 -11.641 1.00 0.00 C ATOM 0 HA PRO A 18 12.188 -24.035 -9.062 1.00 0.00 H new ATOM 0 HB2 PRO A 18 11.793 -21.967 -10.874 1.00 0.00 H new ATOM 0 HB3 PRO A 18 12.793 -23.344 -11.292 1.00 0.00 H new ATOM 0 HG2 PRO A 18 9.917 -22.807 -12.005 1.00 0.00 H new ATOM 0 HG3 PRO A 18 11.201 -23.440 -13.016 1.00 0.00 H new ATOM 0 HD2 PRO A 18 9.338 -25.073 -11.888 1.00 0.00 H new ATOM 0 HD3 PRO A 18 10.981 -25.615 -12.169 1.00 0.00 H new ATOM 265 N LEU A 19 10.356 -23.159 -7.579 1.00 0.00 N ATOM 266 CA LEU A 19 9.556 -22.356 -6.661 1.00 0.00 C ATOM 267 C LEU A 19 9.798 -20.867 -6.886 1.00 0.00 C ATOM 268 O LEU A 19 8.855 -20.082 -6.971 1.00 0.00 O ATOM 269 CB LEU A 19 9.883 -22.724 -5.212 1.00 0.00 C ATOM 270 CG LEU A 19 9.406 -24.099 -4.745 1.00 0.00 C ATOM 271 CD1 LEU A 19 10.483 -24.786 -3.920 1.00 0.00 C ATOM 272 CD2 LEU A 19 8.118 -23.972 -3.944 1.00 0.00 C ATOM 0 H LEU A 19 10.790 -23.978 -7.154 1.00 0.00 H new ATOM 0 HA LEU A 19 8.504 -22.568 -6.855 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.964 -22.672 -5.080 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.446 -21.969 -4.559 1.00 0.00 H new ATOM 0 HG LEU A 19 9.205 -24.711 -5.624 1.00 0.00 H new ATOM 0 HD11 LEU A 19 10.125 -25.763 -3.596 1.00 0.00 H new ATOM 0 HD12 LEU A 19 11.381 -24.910 -4.525 1.00 0.00 H new ATOM 0 HD13 LEU A 19 10.716 -24.177 -3.046 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.792 -24.960 -3.619 1.00 0.00 H new ATOM 0 HD22 LEU A 19 8.293 -23.343 -3.071 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.345 -23.522 -4.567 1.00 0.00 H new ATOM 284 N GLU A 20 11.068 -20.488 -6.986 1.00 0.00 N ATOM 285 CA GLU A 20 11.433 -19.093 -7.203 1.00 0.00 C ATOM 286 C GLU A 20 10.696 -18.520 -8.410 1.00 0.00 C ATOM 287 O GLU A 20 10.107 -17.441 -8.338 1.00 0.00 O ATOM 288 CB GLU A 20 12.945 -18.964 -7.406 1.00 0.00 C ATOM 289 CG GLU A 20 13.623 -18.072 -6.379 1.00 0.00 C ATOM 290 CD GLU A 20 15.134 -18.094 -6.495 1.00 0.00 C ATOM 291 OE1 GLU A 20 15.641 -18.330 -7.612 1.00 0.00 O ATOM 292 OE2 GLU A 20 15.811 -17.875 -5.469 1.00 0.00 O ATOM 0 H GLU A 20 11.861 -21.127 -6.920 1.00 0.00 H new ATOM 0 HA GLU A 20 11.143 -18.526 -6.319 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.394 -19.956 -7.366 1.00 0.00 H new ATOM 0 HB3 GLU A 20 13.137 -18.567 -8.403 1.00 0.00 H new ATOM 0 HG2 GLU A 20 13.268 -17.049 -6.501 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.334 -18.392 -5.378 1.00 0.00 H new ATOM 299 N LYS A 21 10.734 -19.249 -9.520 1.00 0.00 N ATOM 300 CA LYS A 21 10.071 -18.815 -10.744 1.00 0.00 C ATOM 301 C LYS A 21 8.562 -18.720 -10.540 1.00 0.00 C ATOM 302 O LYS A 21 7.897 -17.877 -11.143 1.00 0.00 O ATOM 303 CB LYS A 21 10.381 -19.784 -11.888 1.00 0.00 C ATOM 304 CG LYS A 21 11.766 -19.597 -12.484 1.00 0.00 C ATOM 305 CD LYS A 21 11.694 -19.051 -13.900 1.00 0.00 C ATOM 306 CE LYS A 21 12.791 -18.030 -14.160 1.00 0.00 C ATOM 307 NZ LYS A 21 12.800 -17.574 -15.578 1.00 0.00 N ATOM 0 H LYS A 21 11.217 -20.144 -9.597 1.00 0.00 H new ATOM 0 HA LYS A 21 10.449 -17.826 -11.001 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.287 -20.807 -11.523 1.00 0.00 H new ATOM 0 HB3 LYS A 21 9.636 -19.656 -12.673 1.00 0.00 H new ATOM 0 HG2 LYS A 21 12.343 -18.915 -11.859 1.00 0.00 H new ATOM 0 HG3 LYS A 21 12.294 -20.551 -12.487 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.783 -19.871 -14.612 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.720 -18.590 -14.064 1.00 0.00 H new ATOM 0 HE2 LYS A 21 12.651 -17.171 -13.503 1.00 0.00 H new ATOM 0 HE3 LYS A 21 13.759 -18.466 -13.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 13.562 -16.879 -15.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 12.959 -18.389 -16.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 11.886 -17.135 -15.807 1.00 0.00 H new ATOM 321 N TYR A 22 8.029 -19.587 -9.687 1.00 0.00 N ATOM 322 CA TYR A 22 6.599 -19.601 -9.404 1.00 0.00 C ATOM 323 C TYR A 22 6.168 -18.313 -8.708 1.00 0.00 C ATOM 324 O TYR A 22 5.146 -17.719 -9.053 1.00 0.00 O ATOM 325 CB TYR A 22 6.241 -20.807 -8.535 1.00 0.00 C ATOM 326 CG TYR A 22 5.051 -20.572 -7.632 1.00 0.00 C ATOM 327 CD1 TYR A 22 5.167 -19.795 -6.486 1.00 0.00 C ATOM 328 CD2 TYR A 22 3.811 -21.126 -7.925 1.00 0.00 C ATOM 329 CE1 TYR A 22 4.083 -19.578 -5.657 1.00 0.00 C ATOM 330 CE2 TYR A 22 2.721 -20.912 -7.104 1.00 0.00 C ATOM 331 CZ TYR A 22 2.862 -20.138 -5.971 1.00 0.00 C ATOM 332 OH TYR A 22 1.779 -19.924 -5.150 1.00 0.00 O ATOM 0 H TYR A 22 8.566 -20.290 -9.179 1.00 0.00 H new ATOM 0 HA TYR A 22 6.068 -19.675 -10.353 1.00 0.00 H new ATOM 0 HB2 TYR A 22 6.033 -21.660 -9.181 1.00 0.00 H new ATOM 0 HB3 TYR A 22 7.103 -21.072 -7.924 1.00 0.00 H new ATOM 0 HD1 TYR A 22 6.121 -19.353 -6.239 1.00 0.00 H new ATOM 0 HD2 TYR A 22 3.697 -21.734 -8.810 1.00 0.00 H new ATOM 0 HE1 TYR A 22 4.191 -18.974 -4.769 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.764 -21.348 -7.348 1.00 0.00 H new ATOM 0 HH TYR A 22 0.996 -20.387 -5.514 1.00 0.00 H new ATOM 342 N HIS A 23 6.957 -17.886 -7.727 1.00 0.00 N ATOM 343 CA HIS A 23 6.660 -16.668 -6.982 1.00 0.00 C ATOM 344 C HIS A 23 6.899 -15.432 -7.845 1.00 0.00 C ATOM 345 O HIS A 23 6.263 -14.397 -7.652 1.00 0.00 O ATOM 346 CB HIS A 23 7.516 -16.596 -5.718 1.00 0.00 C ATOM 347 CG HIS A 23 6.801 -16.004 -4.543 1.00 0.00 C ATOM 348 ND1 HIS A 23 5.830 -16.681 -3.834 1.00 0.00 N ATOM 349 CD2 HIS A 23 6.920 -14.793 -3.951 1.00 0.00 C ATOM 350 CE1 HIS A 23 5.383 -15.910 -2.859 1.00 0.00 C ATOM 351 NE2 HIS A 23 6.028 -14.759 -2.908 1.00 0.00 N ATOM 0 H HIS A 23 7.807 -18.366 -7.430 1.00 0.00 H new ATOM 0 HA HIS A 23 5.608 -16.693 -6.697 1.00 0.00 H new ATOM 0 HB2 HIS A 23 7.853 -17.600 -5.460 1.00 0.00 H new ATOM 0 HB3 HIS A 23 8.407 -16.004 -5.926 1.00 0.00 H new ATOM 0 HD2 HIS A 23 7.592 -14.000 -4.245 1.00 0.00 H new ATOM 0 HE1 HIS A 23 4.619 -16.176 -2.143 1.00 0.00 H new ATOM 0 HE2 HIS A 23 5.887 -13.973 -2.274 1.00 0.00 H new ATOM 359 N GLU A 24 7.822 -15.549 -8.795 1.00 0.00 N ATOM 360 CA GLU A 24 8.146 -14.441 -9.685 1.00 0.00 C ATOM 361 C GLU A 24 7.000 -14.169 -10.655 1.00 0.00 C ATOM 362 O GLU A 24 6.592 -13.023 -10.844 1.00 0.00 O ATOM 363 CB GLU A 24 9.428 -14.741 -10.464 1.00 0.00 C ATOM 364 CG GLU A 24 10.681 -14.176 -9.817 1.00 0.00 C ATOM 365 CD GLU A 24 10.814 -12.678 -10.013 1.00 0.00 C ATOM 366 OE1 GLU A 24 9.835 -11.955 -9.735 1.00 0.00 O ATOM 367 OE2 GLU A 24 11.897 -12.230 -10.444 1.00 0.00 O ATOM 0 H GLU A 24 8.358 -16.400 -8.968 1.00 0.00 H new ATOM 0 HA GLU A 24 8.301 -13.552 -9.074 1.00 0.00 H new ATOM 0 HB2 GLU A 24 9.537 -15.821 -10.565 1.00 0.00 H new ATOM 0 HB3 GLU A 24 9.335 -14.334 -11.471 1.00 0.00 H new ATOM 0 HG2 GLU A 24 10.667 -14.399 -8.750 1.00 0.00 H new ATOM 0 HG3 GLU A 24 11.557 -14.673 -10.235 1.00 0.00 H new ATOM 374 N GLU A 25 6.485 -15.231 -11.267 1.00 0.00 N ATOM 375 CA GLU A 25 5.387 -15.107 -12.218 1.00 0.00 C ATOM 376 C GLU A 25 4.083 -14.768 -11.502 1.00 0.00 C ATOM 377 O GLU A 25 3.390 -13.819 -11.868 1.00 0.00 O ATOM 378 CB GLU A 25 5.224 -16.403 -13.015 1.00 0.00 C ATOM 379 CG GLU A 25 6.423 -16.737 -13.886 1.00 0.00 C ATOM 380 CD GLU A 25 6.368 -16.058 -15.240 1.00 0.00 C ATOM 381 OE1 GLU A 25 5.532 -15.146 -15.414 1.00 0.00 O ATOM 382 OE2 GLU A 25 7.161 -16.439 -16.127 1.00 0.00 O ATOM 0 H GLU A 25 6.811 -16.187 -11.121 1.00 0.00 H new ATOM 0 HA GLU A 25 5.625 -14.295 -12.905 1.00 0.00 H new ATOM 0 HB2 GLU A 25 5.048 -17.226 -12.322 1.00 0.00 H new ATOM 0 HB3 GLU A 25 4.339 -16.323 -13.646 1.00 0.00 H new ATOM 0 HG2 GLU A 25 7.336 -16.438 -13.371 1.00 0.00 H new ATOM 0 HG3 GLU A 25 6.475 -17.817 -14.027 1.00 0.00 H new ATOM 389 N ALA A 26 3.754 -15.553 -10.481 1.00 0.00 N ATOM 390 CA ALA A 26 2.535 -15.337 -9.713 1.00 0.00 C ATOM 391 C ALA A 26 2.522 -13.949 -9.082 1.00 0.00 C ATOM 392 O ALA A 26 1.488 -13.282 -9.047 1.00 0.00 O ATOM 393 CB ALA A 26 2.389 -16.407 -8.642 1.00 0.00 C ATOM 0 H ALA A 26 4.315 -16.345 -10.167 1.00 0.00 H new ATOM 0 HA ALA A 26 1.688 -15.405 -10.396 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.474 -16.233 -8.076 1.00 0.00 H new ATOM 0 HB2 ALA A 26 2.343 -17.389 -9.113 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.245 -16.367 -7.969 1.00 0.00 H new ATOM 399 N ASP A 27 3.677 -13.520 -8.583 1.00 0.00 N ATOM 400 CA ASP A 27 3.799 -12.211 -7.953 1.00 0.00 C ATOM 401 C ASP A 27 3.633 -11.096 -8.981 1.00 0.00 C ATOM 402 O ASP A 27 2.951 -10.102 -8.728 1.00 0.00 O ATOM 403 CB ASP A 27 5.154 -12.081 -7.256 1.00 0.00 C ATOM 404 CG ASP A 27 5.347 -10.721 -6.615 1.00 0.00 C ATOM 405 OD1 ASP A 27 4.467 -10.302 -5.834 1.00 0.00 O ATOM 406 OD2 ASP A 27 6.379 -10.075 -6.895 1.00 0.00 O ATOM 0 H ASP A 27 4.542 -14.060 -8.603 1.00 0.00 H new ATOM 0 HA ASP A 27 3.007 -12.117 -7.210 1.00 0.00 H new ATOM 0 HB2 ASP A 27 5.243 -12.855 -6.493 1.00 0.00 H new ATOM 0 HB3 ASP A 27 5.950 -12.254 -7.980 1.00 0.00 H new ATOM 411 N ASP A 28 4.260 -11.267 -10.139 1.00 0.00 N ATOM 412 CA ASP A 28 4.182 -10.275 -11.205 1.00 0.00 C ATOM 413 C ASP A 28 2.806 -10.293 -11.864 1.00 0.00 C ATOM 414 O ASP A 28 2.325 -9.267 -12.347 1.00 0.00 O ATOM 415 CB ASP A 28 5.266 -10.535 -12.253 1.00 0.00 C ATOM 416 CG ASP A 28 5.172 -9.585 -13.430 1.00 0.00 C ATOM 417 OD1 ASP A 28 4.764 -8.423 -13.224 1.00 0.00 O ATOM 418 OD2 ASP A 28 5.506 -10.003 -14.559 1.00 0.00 O ATOM 0 H ASP A 28 4.828 -12.084 -10.364 1.00 0.00 H new ATOM 0 HA ASP A 28 4.342 -9.291 -10.764 1.00 0.00 H new ATOM 0 HB2 ASP A 28 6.247 -10.438 -11.789 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.183 -11.561 -12.611 1.00 0.00 H new ATOM 423 N TYR A 29 2.179 -11.463 -11.881 1.00 0.00 N ATOM 424 CA TYR A 29 0.860 -11.615 -12.483 1.00 0.00 C ATOM 425 C TYR A 29 -0.201 -10.887 -11.663 1.00 0.00 C ATOM 426 O TYR A 29 -0.959 -10.072 -12.190 1.00 0.00 O ATOM 427 CB TYR A 29 0.499 -13.096 -12.605 1.00 0.00 C ATOM 428 CG TYR A 29 0.523 -13.611 -14.026 1.00 0.00 C ATOM 429 CD1 TYR A 29 -0.484 -13.276 -14.924 1.00 0.00 C ATOM 430 CD2 TYR A 29 1.551 -14.433 -14.471 1.00 0.00 C ATOM 431 CE1 TYR A 29 -0.466 -13.745 -16.223 1.00 0.00 C ATOM 432 CE2 TYR A 29 1.577 -14.905 -15.769 1.00 0.00 C ATOM 433 CZ TYR A 29 0.566 -14.558 -16.641 1.00 0.00 C ATOM 434 OH TYR A 29 0.588 -15.027 -17.935 1.00 0.00 O ATOM 0 H TYR A 29 2.563 -12.321 -11.485 1.00 0.00 H new ATOM 0 HA TYR A 29 0.890 -11.172 -13.479 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.195 -13.681 -12.004 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -0.495 -13.254 -12.187 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -1.294 -12.639 -14.601 1.00 0.00 H new ATOM 0 HD2 TYR A 29 2.343 -14.708 -13.790 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -1.257 -13.476 -16.908 1.00 0.00 H new ATOM 0 HE2 TYR A 29 2.384 -15.542 -16.099 1.00 0.00 H new ATOM 0 HH TYR A 29 1.517 -15.153 -18.221 1.00 0.00 H new ATOM 444 N LEU A 30 -0.248 -11.187 -10.370 1.00 0.00 N ATOM 445 CA LEU A 30 -1.214 -10.561 -9.474 1.00 0.00 C ATOM 446 C LEU A 30 -0.933 -9.069 -9.325 1.00 0.00 C ATOM 447 O LEU A 30 -1.855 -8.255 -9.280 1.00 0.00 O ATOM 448 CB LEU A 30 -1.181 -11.237 -8.103 1.00 0.00 C ATOM 449 CG LEU A 30 -1.415 -12.748 -8.094 1.00 0.00 C ATOM 450 CD1 LEU A 30 -0.411 -13.438 -7.182 1.00 0.00 C ATOM 451 CD2 LEU A 30 -2.838 -13.065 -7.659 1.00 0.00 C ATOM 0 H LEU A 30 0.371 -11.860 -9.918 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.206 -10.683 -9.908 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.213 -11.037 -7.645 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.936 -10.769 -7.471 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.274 -13.124 -9.107 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.593 -14.513 -7.188 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.600 -13.239 -7.537 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.520 -13.057 -6.167 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.986 -14.145 -7.659 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.007 -12.675 -6.655 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.542 -12.602 -8.351 1.00 0.00 H new ATOM 463 N ASP A 31 0.346 -8.719 -9.252 1.00 0.00 N ATOM 464 CA ASP A 31 0.750 -7.324 -9.111 1.00 0.00 C ATOM 465 C ASP A 31 0.264 -6.496 -10.296 1.00 0.00 C ATOM 466 O ASP A 31 -0.404 -5.476 -10.122 1.00 0.00 O ATOM 467 CB ASP A 31 2.271 -7.221 -8.991 1.00 0.00 C ATOM 468 CG ASP A 31 2.739 -7.217 -7.549 1.00 0.00 C ATOM 469 OD1 ASP A 31 1.881 -7.311 -6.647 1.00 0.00 O ATOM 470 OD2 ASP A 31 3.964 -7.118 -7.322 1.00 0.00 O ATOM 0 H ASP A 31 1.121 -9.381 -9.288 1.00 0.00 H new ATOM 0 HA ASP A 31 0.294 -6.929 -8.203 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.731 -8.057 -9.517 1.00 0.00 H new ATOM 0 HB3 ASP A 31 2.610 -6.309 -9.483 1.00 0.00 H new ATOM 475 N HIS A 32 0.605 -6.940 -11.502 1.00 0.00 N ATOM 476 CA HIS A 32 0.203 -6.239 -12.717 1.00 0.00 C ATOM 477 C HIS A 32 -1.316 -6.234 -12.864 1.00 0.00 C ATOM 478 O HIS A 32 -1.887 -5.334 -13.481 1.00 0.00 O ATOM 479 CB HIS A 32 0.844 -6.891 -13.942 1.00 0.00 C ATOM 480 CG HIS A 32 -0.115 -7.698 -14.762 1.00 0.00 C ATOM 481 ND1 HIS A 32 -1.248 -7.164 -15.338 1.00 0.00 N ATOM 482 CD2 HIS A 32 -0.104 -9.008 -15.103 1.00 0.00 C ATOM 483 CE1 HIS A 32 -1.894 -8.110 -15.995 1.00 0.00 C ATOM 484 NE2 HIS A 32 -1.220 -9.239 -15.869 1.00 0.00 N ATOM 0 H HIS A 32 1.158 -7.781 -11.664 1.00 0.00 H new ATOM 0 HA HIS A 32 0.546 -5.207 -12.643 1.00 0.00 H new ATOM 0 HB2 HIS A 32 1.282 -6.114 -14.569 1.00 0.00 H new ATOM 0 HB3 HIS A 32 1.661 -7.535 -13.615 1.00 0.00 H new ATOM 0 HD1 HIS A 32 -1.542 -6.190 -15.268 1.00 0.00 H new ATOM 0 HD2 HIS A 32 0.643 -9.736 -14.824 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -2.816 -7.982 -16.542 1.00 0.00 H new ATOM 492 N LEU A 33 -1.964 -7.245 -12.295 1.00 0.00 N ATOM 493 CA LEU A 33 -3.416 -7.358 -12.364 1.00 0.00 C ATOM 494 C LEU A 33 -4.087 -6.243 -11.567 1.00 0.00 C ATOM 495 O LEU A 33 -4.923 -5.507 -12.093 1.00 0.00 O ATOM 496 CB LEU A 33 -3.867 -8.721 -11.836 1.00 0.00 C ATOM 497 CG LEU A 33 -4.341 -9.725 -12.887 1.00 0.00 C ATOM 498 CD1 LEU A 33 -5.282 -9.057 -13.878 1.00 0.00 C ATOM 499 CD2 LEU A 33 -3.152 -10.341 -13.610 1.00 0.00 C ATOM 0 H LEU A 33 -1.506 -7.998 -11.781 1.00 0.00 H new ATOM 0 HA LEU A 33 -3.714 -7.263 -13.408 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.039 -9.167 -11.284 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.676 -8.562 -11.123 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.886 -10.522 -12.381 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.609 -9.787 -14.618 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.150 -8.664 -13.348 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.763 -8.240 -14.379 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -3.508 -11.053 -14.354 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -2.580 -9.556 -14.104 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.516 -10.856 -12.890 1.00 0.00 H new ATOM 511 N LEU A 34 -3.714 -6.124 -10.298 1.00 0.00 N ATOM 512 CA LEU A 34 -4.278 -5.097 -9.428 1.00 0.00 C ATOM 513 C LEU A 34 -3.804 -3.709 -9.846 1.00 0.00 C ATOM 514 O LEU A 34 -4.483 -2.711 -9.603 1.00 0.00 O ATOM 515 CB LEU A 34 -3.891 -5.365 -7.973 1.00 0.00 C ATOM 516 CG LEU A 34 -2.407 -5.628 -7.711 1.00 0.00 C ATOM 517 CD1 LEU A 34 -1.708 -4.352 -7.271 1.00 0.00 C ATOM 518 CD2 LEU A 34 -2.236 -6.720 -6.665 1.00 0.00 C ATOM 0 H LEU A 34 -3.024 -6.725 -9.848 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.363 -5.133 -9.521 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.199 -4.509 -7.372 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.460 -6.225 -7.619 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.948 -5.967 -8.640 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.653 -4.559 -7.089 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.800 -3.598 -8.053 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.168 -3.982 -6.355 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.174 -6.894 -6.491 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.710 -6.409 -5.734 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.701 -7.640 -7.020 1.00 0.00 H new ATOM 530 N ASP A 35 -2.637 -3.654 -10.478 1.00 0.00 N ATOM 531 CA ASP A 35 -2.073 -2.388 -10.933 1.00 0.00 C ATOM 532 C ASP A 35 -2.886 -1.816 -12.090 1.00 0.00 C ATOM 533 O ASP A 35 -3.174 -0.620 -12.128 1.00 0.00 O ATOM 534 CB ASP A 35 -0.617 -2.578 -11.361 1.00 0.00 C ATOM 535 CG ASP A 35 0.128 -1.264 -11.479 1.00 0.00 C ATOM 536 OD1 ASP A 35 -0.523 -0.202 -11.388 1.00 0.00 O ATOM 537 OD2 ASP A 35 1.363 -1.296 -11.663 1.00 0.00 O ATOM 0 H ASP A 35 -2.063 -4.471 -10.687 1.00 0.00 H new ATOM 0 HA ASP A 35 -2.110 -1.683 -10.103 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -0.109 -3.216 -10.638 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.588 -3.096 -12.320 1.00 0.00 H new ATOM 542 N SER A 36 -3.251 -2.679 -13.033 1.00 0.00 N ATOM 543 CA SER A 36 -4.026 -2.258 -14.195 1.00 0.00 C ATOM 544 C SER A 36 -5.468 -1.950 -13.803 1.00 0.00 C ATOM 545 O SER A 36 -6.040 -0.947 -14.233 1.00 0.00 O ATOM 546 CB SER A 36 -4.000 -3.344 -15.272 1.00 0.00 C ATOM 547 OG SER A 36 -4.048 -2.777 -16.570 1.00 0.00 O ATOM 0 H SER A 36 -3.023 -3.673 -13.015 1.00 0.00 H new ATOM 0 HA SER A 36 -3.574 -1.350 -14.593 1.00 0.00 H new ATOM 0 HB2 SER A 36 -3.096 -3.943 -15.167 1.00 0.00 H new ATOM 0 HB3 SER A 36 -4.846 -4.017 -15.134 1.00 0.00 H new ATOM 0 HG SER A 36 -4.028 -3.492 -17.240 1.00 0.00 H new ATOM 553 N LEU A 37 -6.051 -2.818 -12.984 1.00 0.00 N ATOM 554 CA LEU A 37 -7.426 -2.640 -12.532 1.00 0.00 C ATOM 555 C LEU A 37 -7.548 -1.418 -11.628 1.00 0.00 C ATOM 556 O LEU A 37 -8.482 -0.628 -11.760 1.00 0.00 O ATOM 557 CB LEU A 37 -7.906 -3.888 -11.790 1.00 0.00 C ATOM 558 CG LEU A 37 -8.618 -4.942 -12.638 1.00 0.00 C ATOM 559 CD1 LEU A 37 -8.065 -4.949 -14.055 1.00 0.00 C ATOM 560 CD2 LEU A 37 -8.483 -6.318 -12.004 1.00 0.00 C ATOM 0 H LEU A 37 -5.592 -3.653 -12.619 1.00 0.00 H new ATOM 0 HA LEU A 37 -8.053 -2.484 -13.410 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.045 -4.356 -11.313 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.581 -3.575 -10.993 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.677 -4.688 -12.684 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.584 -5.705 -14.644 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.215 -3.969 -14.509 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.999 -5.177 -14.029 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.996 -7.055 -12.622 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.428 -6.581 -11.926 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -8.928 -6.305 -11.009 1.00 0.00 H new ATOM 572 N GLU A 38 -6.597 -1.269 -10.711 1.00 0.00 N ATOM 573 CA GLU A 38 -6.599 -0.142 -9.786 1.00 0.00 C ATOM 574 C GLU A 38 -6.462 1.179 -10.538 1.00 0.00 C ATOM 575 O GLU A 38 -7.116 2.166 -10.201 1.00 0.00 O ATOM 576 CB GLU A 38 -5.462 -0.284 -8.772 1.00 0.00 C ATOM 577 CG GLU A 38 -5.705 -1.365 -7.732 1.00 0.00 C ATOM 578 CD GLU A 38 -6.246 -0.810 -6.429 1.00 0.00 C ATOM 579 OE1 GLU A 38 -6.318 0.430 -6.296 1.00 0.00 O ATOM 580 OE2 GLU A 38 -6.597 -1.615 -5.542 1.00 0.00 O ATOM 0 H GLU A 38 -5.816 -1.914 -10.589 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.551 -0.142 -9.256 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.537 -0.505 -9.305 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.317 0.670 -8.265 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.408 -2.096 -8.131 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -4.772 -1.893 -7.538 1.00 0.00 H new ATOM 587 N GLU A 39 -5.608 1.188 -11.556 1.00 0.00 N ATOM 588 CA GLU A 39 -5.385 2.388 -12.355 1.00 0.00 C ATOM 589 C GLU A 39 -6.613 2.715 -13.200 1.00 0.00 C ATOM 590 O GLU A 39 -6.889 3.880 -13.489 1.00 0.00 O ATOM 591 CB GLU A 39 -4.164 2.206 -13.259 1.00 0.00 C ATOM 592 CG GLU A 39 -2.926 2.934 -12.763 1.00 0.00 C ATOM 593 CD GLU A 39 -1.899 3.150 -13.857 1.00 0.00 C ATOM 594 OE1 GLU A 39 -1.441 2.149 -14.447 1.00 0.00 O ATOM 595 OE2 GLU A 39 -1.553 4.320 -14.124 1.00 0.00 O ATOM 0 H GLU A 39 -5.059 0.379 -11.847 1.00 0.00 H new ATOM 0 HA GLU A 39 -5.203 3.219 -11.673 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.940 1.143 -13.344 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.407 2.561 -14.260 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.218 3.899 -12.348 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.473 2.363 -11.953 1.00 0.00 H new ATOM 602 N LEU A 40 -7.346 1.679 -13.593 1.00 0.00 N ATOM 603 CA LEU A 40 -8.545 1.855 -14.405 1.00 0.00 C ATOM 604 C LEU A 40 -9.699 2.392 -13.565 1.00 0.00 C ATOM 605 O LEU A 40 -10.583 3.081 -14.074 1.00 0.00 O ATOM 606 CB LEU A 40 -8.945 0.528 -15.053 1.00 0.00 C ATOM 607 CG LEU A 40 -8.114 0.093 -16.261 1.00 0.00 C ATOM 608 CD1 LEU A 40 -8.463 -1.331 -16.663 1.00 0.00 C ATOM 609 CD2 LEU A 40 -8.328 1.047 -17.427 1.00 0.00 C ATOM 0 H LEU A 40 -7.131 0.709 -13.363 1.00 0.00 H new ATOM 0 HA LEU A 40 -8.321 2.581 -15.186 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.887 -0.255 -14.297 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.988 0.597 -15.361 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.060 0.122 -15.983 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.862 -1.624 -17.524 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.257 -2.005 -15.831 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.520 -1.387 -16.922 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.729 0.722 -18.278 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -9.382 1.051 -17.705 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.027 2.053 -17.134 1.00 0.00 H new ATOM 621 N SER A 41 -9.683 2.073 -12.275 1.00 0.00 N ATOM 622 CA SER A 41 -10.729 2.522 -11.363 1.00 0.00 C ATOM 623 C SER A 41 -10.369 3.870 -10.745 1.00 0.00 C ATOM 624 O SER A 41 -11.243 4.615 -10.304 1.00 0.00 O ATOM 625 CB SER A 41 -10.953 1.486 -10.260 1.00 0.00 C ATOM 626 OG SER A 41 -11.376 0.247 -10.803 1.00 0.00 O ATOM 0 H SER A 41 -8.957 1.505 -11.837 1.00 0.00 H new ATOM 0 HA SER A 41 -11.650 2.638 -11.935 1.00 0.00 H new ATOM 0 HB2 SER A 41 -10.030 1.344 -9.697 1.00 0.00 H new ATOM 0 HB3 SER A 41 -11.701 1.854 -9.558 1.00 0.00 H new ATOM 0 HG SER A 41 -10.607 -0.218 -11.194 1.00 0.00 H new ATOM 632 N GLU A 42 -9.075 4.174 -10.716 1.00 0.00 N ATOM 633 CA GLU A 42 -8.599 5.431 -10.151 1.00 0.00 C ATOM 634 C GLU A 42 -8.453 6.495 -11.235 1.00 0.00 C ATOM 635 O GLU A 42 -8.881 7.635 -11.062 1.00 0.00 O ATOM 636 CB GLU A 42 -7.259 5.222 -9.442 1.00 0.00 C ATOM 637 CG GLU A 42 -6.544 6.518 -9.098 1.00 0.00 C ATOM 638 CD GLU A 42 -5.351 6.302 -8.187 1.00 0.00 C ATOM 639 OE1 GLU A 42 -4.468 5.496 -8.547 1.00 0.00 O ATOM 640 OE2 GLU A 42 -5.301 6.939 -7.114 1.00 0.00 O ATOM 0 H GLU A 42 -8.338 3.568 -11.077 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.336 5.776 -9.426 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.427 4.655 -8.526 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.612 4.617 -10.077 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.212 7.000 -10.017 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.246 7.199 -8.616 1.00 0.00 H new ATOM 647 N ALA A 43 -7.845 6.112 -12.353 1.00 0.00 N ATOM 648 CA ALA A 43 -7.643 7.030 -13.467 1.00 0.00 C ATOM 649 C ALA A 43 -8.973 7.426 -14.100 1.00 0.00 C ATOM 650 O ALA A 43 -9.188 8.589 -14.443 1.00 0.00 O ATOM 651 CB ALA A 43 -6.726 6.405 -14.507 1.00 0.00 C ATOM 0 H ALA A 43 -7.484 5.171 -12.511 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.172 7.933 -13.080 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.584 7.102 -15.333 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.761 6.180 -14.053 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.175 5.485 -14.882 1.00 0.00 H new ATOM 657 N HIS A 44 -9.864 6.450 -14.253 1.00 0.00 N ATOM 658 CA HIS A 44 -11.173 6.697 -14.846 1.00 0.00 C ATOM 659 C HIS A 44 -11.729 5.427 -15.484 1.00 0.00 C ATOM 660 O HIS A 44 -11.567 5.182 -16.679 1.00 0.00 O ATOM 661 CB HIS A 44 -11.082 7.809 -15.891 1.00 0.00 C ATOM 662 CG HIS A 44 -12.118 7.705 -16.968 1.00 0.00 C ATOM 663 ND1 HIS A 44 -13.337 7.088 -16.783 1.00 0.00 N ATOM 664 CD2 HIS A 44 -12.112 8.147 -18.247 1.00 0.00 C ATOM 665 CE1 HIS A 44 -14.035 7.152 -17.902 1.00 0.00 C ATOM 666 NE2 HIS A 44 -13.314 7.790 -18.807 1.00 0.00 N ATOM 0 H HIS A 44 -9.703 5.482 -13.975 1.00 0.00 H new ATOM 0 HA HIS A 44 -11.851 7.010 -14.052 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -11.183 8.773 -15.393 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -10.092 7.788 -16.347 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -11.311 8.681 -18.736 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -15.027 6.751 -18.052 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -13.603 7.985 -19.765 1.00 0.00 H new ATOM 674 N PRO A 45 -12.399 4.599 -14.669 1.00 0.00 N ATOM 675 CA PRO A 45 -12.991 3.341 -15.132 1.00 0.00 C ATOM 676 C PRO A 45 -14.189 3.567 -16.048 1.00 0.00 C ATOM 677 O PRO A 45 -14.039 3.682 -17.265 1.00 0.00 O ATOM 678 CB PRO A 45 -13.432 2.658 -13.835 1.00 0.00 C ATOM 679 CG PRO A 45 -13.641 3.774 -12.871 1.00 0.00 C ATOM 680 CD PRO A 45 -12.631 4.828 -13.233 1.00 0.00 C ATOM 0 HA PRO A 45 -12.288 2.753 -15.722 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -14.347 2.085 -13.981 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -12.674 1.962 -13.476 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.656 4.165 -12.941 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -13.500 3.435 -11.845 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -13.011 5.831 -13.042 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -11.713 4.720 -12.655 1.00 0.00 H new ATOM 688 N ASP A 46 -15.377 3.629 -15.457 1.00 0.00 N ATOM 689 CA ASP A 46 -16.601 3.843 -16.221 1.00 0.00 C ATOM 690 C ASP A 46 -17.695 4.437 -15.339 1.00 0.00 C ATOM 691 O ASP A 46 -18.374 5.386 -15.731 1.00 0.00 O ATOM 692 CB ASP A 46 -17.081 2.526 -16.834 1.00 0.00 C ATOM 693 CG ASP A 46 -17.525 2.687 -18.275 1.00 0.00 C ATOM 694 OD1 ASP A 46 -16.658 2.930 -19.139 1.00 0.00 O ATOM 695 OD2 ASP A 46 -18.741 2.569 -18.538 1.00 0.00 O ATOM 0 H ASP A 46 -15.519 3.534 -14.451 1.00 0.00 H new ATOM 0 HA ASP A 46 -16.382 4.549 -17.022 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.278 1.791 -16.784 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -17.909 2.134 -16.243 1.00 0.00 H new ATOM 700 N CYS A 47 -17.860 3.871 -14.149 1.00 0.00 N ATOM 701 CA CYS A 47 -18.873 4.343 -13.212 1.00 0.00 C ATOM 702 C CYS A 47 -18.274 4.558 -11.826 1.00 0.00 C ATOM 703 O CYS A 47 -17.941 5.683 -11.450 1.00 0.00 O ATOM 704 CB CYS A 47 -20.029 3.345 -13.132 1.00 0.00 C ATOM 705 SG CYS A 47 -19.800 1.867 -14.148 1.00 0.00 S ATOM 0 H CYS A 47 -17.306 3.085 -13.810 1.00 0.00 H new ATOM 0 HA CYS A 47 -19.252 5.298 -13.576 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -20.162 3.042 -12.093 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -20.948 3.845 -13.438 1.00 0.00 H new ATOM 0 HG CYS A 47 -20.828 1.083 -14.012 1.00 0.00 H new ATOM 711 N ILE A 48 -18.142 3.474 -11.070 1.00 0.00 N ATOM 712 CA ILE A 48 -17.583 3.544 -9.725 1.00 0.00 C ATOM 713 C ILE A 48 -17.208 2.158 -9.212 1.00 0.00 C ATOM 714 O ILE A 48 -17.762 1.661 -8.232 1.00 0.00 O ATOM 715 CB ILE A 48 -18.571 4.194 -8.739 1.00 0.00 C ATOM 716 CG1 ILE A 48 -18.049 4.072 -7.305 1.00 0.00 C ATOM 717 CG2 ILE A 48 -19.945 3.552 -8.864 1.00 0.00 C ATOM 718 CD1 ILE A 48 -17.941 5.399 -6.587 1.00 0.00 C ATOM 0 H ILE A 48 -18.414 2.536 -11.365 1.00 0.00 H new ATOM 0 HA ILE A 48 -16.686 4.160 -9.788 1.00 0.00 H new ATOM 0 HB ILE A 48 -18.662 5.252 -8.984 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -18.711 3.415 -6.740 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -17.068 3.597 -7.323 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -20.632 4.023 -8.160 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -20.318 3.685 -9.879 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -19.871 2.487 -8.642 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -17.565 5.237 -5.577 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -17.256 6.051 -7.129 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -18.924 5.867 -6.537 1.00 0.00 H new ATOM 730 N PRO A 49 -16.243 1.518 -9.889 1.00 0.00 N ATOM 731 CA PRO A 49 -15.770 0.181 -9.518 1.00 0.00 C ATOM 732 C PRO A 49 -14.986 0.185 -8.211 1.00 0.00 C ATOM 733 O PRO A 49 -14.560 1.237 -7.734 1.00 0.00 O ATOM 734 CB PRO A 49 -14.860 -0.210 -10.686 1.00 0.00 C ATOM 735 CG PRO A 49 -14.400 1.087 -11.258 1.00 0.00 C ATOM 736 CD PRO A 49 -15.539 2.051 -11.067 1.00 0.00 C ATOM 0 HA PRO A 49 -16.595 -0.511 -9.352 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -14.018 -0.814 -10.347 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -15.399 -0.801 -11.427 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.501 1.440 -10.752 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -14.151 0.981 -12.314 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -15.182 3.066 -10.896 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -16.188 2.085 -11.942 1.00 0.00 H new ATOM 744 N ASP A 50 -14.799 -0.998 -7.635 1.00 0.00 N ATOM 745 CA ASP A 50 -14.064 -1.130 -6.382 1.00 0.00 C ATOM 746 C ASP A 50 -12.919 -2.128 -6.527 1.00 0.00 C ATOM 747 O ASP A 50 -13.140 -3.309 -6.791 1.00 0.00 O ATOM 748 CB ASP A 50 -15.004 -1.574 -5.260 1.00 0.00 C ATOM 749 CG ASP A 50 -14.544 -1.095 -3.897 1.00 0.00 C ATOM 750 OD1 ASP A 50 -14.503 0.135 -3.682 1.00 0.00 O ATOM 751 OD2 ASP A 50 -14.225 -1.950 -3.044 1.00 0.00 O ATOM 0 H ASP A 50 -15.146 -1.878 -8.015 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.644 -0.156 -6.130 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -16.006 -1.193 -5.457 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -15.072 -2.662 -5.256 1.00 0.00 H new ATOM 756 N VAL A 51 -11.693 -1.643 -6.353 1.00 0.00 N ATOM 757 CA VAL A 51 -10.513 -2.491 -6.464 1.00 0.00 C ATOM 758 C VAL A 51 -9.975 -2.867 -5.088 1.00 0.00 C ATOM 759 O VAL A 51 -9.967 -2.049 -4.170 1.00 0.00 O ATOM 760 CB VAL A 51 -9.397 -1.797 -7.268 1.00 0.00 C ATOM 761 CG1 VAL A 51 -9.793 -1.667 -8.730 1.00 0.00 C ATOM 762 CG2 VAL A 51 -9.079 -0.435 -6.670 1.00 0.00 C ATOM 0 H VAL A 51 -11.492 -0.667 -6.135 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.821 -3.395 -6.990 1.00 0.00 H new ATOM 0 HB VAL A 51 -8.498 -2.411 -7.214 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -8.992 -1.174 -9.281 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -9.966 -2.658 -9.150 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -10.705 -1.075 -8.809 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -8.289 0.041 -7.250 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -9.972 0.190 -6.692 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -8.748 -0.559 -5.639 1.00 0.00 H new ATOM 772 N GLU A 52 -9.525 -4.111 -4.955 1.00 0.00 N ATOM 773 CA GLU A 52 -8.985 -4.596 -3.690 1.00 0.00 C ATOM 774 C GLU A 52 -7.946 -5.688 -3.925 1.00 0.00 C ATOM 775 O GLU A 52 -8.197 -6.656 -4.645 1.00 0.00 O ATOM 776 CB GLU A 52 -10.111 -5.130 -2.801 1.00 0.00 C ATOM 777 CG GLU A 52 -11.497 -4.937 -3.392 1.00 0.00 C ATOM 778 CD GLU A 52 -12.595 -5.464 -2.488 1.00 0.00 C ATOM 779 OE1 GLU A 52 -12.291 -5.823 -1.331 1.00 0.00 O ATOM 780 OE2 GLU A 52 -13.759 -5.517 -2.939 1.00 0.00 O ATOM 0 H GLU A 52 -9.524 -4.800 -5.707 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.500 -3.760 -3.187 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.947 -6.192 -2.620 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.065 -4.631 -1.833 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.664 -3.876 -3.579 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -11.551 -5.443 -4.356 1.00 0.00 H new ATOM 787 N LEU A 53 -6.778 -5.527 -3.313 1.00 0.00 N ATOM 788 CA LEU A 53 -5.699 -6.498 -3.454 1.00 0.00 C ATOM 789 C LEU A 53 -5.402 -7.180 -2.123 1.00 0.00 C ATOM 790 O LEU A 53 -5.089 -6.520 -1.132 1.00 0.00 O ATOM 791 CB LEU A 53 -4.437 -5.815 -3.984 1.00 0.00 C ATOM 792 CG LEU A 53 -3.114 -6.512 -3.668 1.00 0.00 C ATOM 793 CD1 LEU A 53 -2.733 -6.300 -2.211 1.00 0.00 C ATOM 794 CD2 LEU A 53 -3.204 -7.997 -3.987 1.00 0.00 C ATOM 0 H LEU A 53 -6.554 -4.732 -2.714 1.00 0.00 H new ATOM 0 HA LEU A 53 -6.019 -7.258 -4.166 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.526 -5.721 -5.066 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.398 -4.804 -3.579 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.336 -6.073 -4.293 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.788 -6.804 -2.005 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.626 -5.233 -2.014 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.511 -6.711 -1.568 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.253 -8.477 -3.756 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.994 -8.450 -3.389 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.429 -8.129 -5.045 1.00 0.00 H new ATOM 806 N SER A 54 -5.499 -8.505 -2.108 1.00 0.00 N ATOM 807 CA SER A 54 -5.242 -9.277 -0.897 1.00 0.00 C ATOM 808 C SER A 54 -4.047 -10.206 -1.089 1.00 0.00 C ATOM 809 O SER A 54 -3.609 -10.450 -2.214 1.00 0.00 O ATOM 810 CB SER A 54 -6.479 -10.092 -0.514 1.00 0.00 C ATOM 811 OG SER A 54 -7.080 -9.583 0.664 1.00 0.00 O ATOM 0 H SER A 54 -5.754 -9.067 -2.920 1.00 0.00 H new ATOM 0 HA SER A 54 -5.012 -8.579 -0.092 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.199 -10.071 -1.332 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.199 -11.134 -0.362 1.00 0.00 H new ATOM 0 HG SER A 54 -7.869 -10.120 0.887 1.00 0.00 H new ATOM 817 N HIS A 55 -3.522 -10.720 0.019 1.00 0.00 N ATOM 818 CA HIS A 55 -2.377 -11.623 -0.026 1.00 0.00 C ATOM 819 C HIS A 55 -2.674 -12.835 -0.903 1.00 0.00 C ATOM 820 O HIS A 55 -3.191 -13.846 -0.428 1.00 0.00 O ATOM 821 CB HIS A 55 -2.005 -12.079 1.386 1.00 0.00 C ATOM 822 CG HIS A 55 -0.983 -11.206 2.047 1.00 0.00 C ATOM 823 ND1 HIS A 55 -0.680 -11.287 3.390 1.00 0.00 N ATOM 824 CD2 HIS A 55 -0.192 -10.230 1.542 1.00 0.00 C ATOM 825 CE1 HIS A 55 0.253 -10.398 3.683 1.00 0.00 C ATOM 826 NE2 HIS A 55 0.566 -9.744 2.579 1.00 0.00 N ATOM 0 H HIS A 55 -3.871 -10.527 0.958 1.00 0.00 H new ATOM 0 HA HIS A 55 -1.536 -11.082 -0.459 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -2.905 -12.101 2.001 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.625 -13.100 1.341 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.163 -9.896 0.515 1.00 0.00 H new ATOM 0 HE1 HIS A 55 0.686 -10.234 4.659 1.00 0.00 H new ATOM 0 HE2 HIS A 55 1.259 -8.999 2.508 1.00 0.00 H new ATOM 834 N GLY A 56 -2.345 -12.727 -2.186 1.00 0.00 N ATOM 835 CA GLY A 56 -2.585 -13.821 -3.109 1.00 0.00 C ATOM 836 C GLY A 56 -3.972 -13.771 -3.718 1.00 0.00 C ATOM 837 O GLY A 56 -4.455 -14.765 -4.262 1.00 0.00 O ATOM 0 H GLY A 56 -1.916 -11.901 -2.603 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -1.841 -13.791 -3.905 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.455 -14.769 -2.586 1.00 0.00 H new ATOM 841 N VAL A 57 -4.617 -12.612 -3.626 1.00 0.00 N ATOM 842 CA VAL A 57 -5.957 -12.437 -4.171 1.00 0.00 C ATOM 843 C VAL A 57 -6.119 -11.058 -4.801 1.00 0.00 C ATOM 844 O VAL A 57 -5.511 -10.086 -4.354 1.00 0.00 O ATOM 845 CB VAL A 57 -7.034 -12.623 -3.086 1.00 0.00 C ATOM 846 CG1 VAL A 57 -8.335 -13.116 -3.702 1.00 0.00 C ATOM 847 CG2 VAL A 57 -6.546 -13.584 -2.012 1.00 0.00 C ATOM 0 H VAL A 57 -4.232 -11.780 -3.179 1.00 0.00 H new ATOM 0 HA VAL A 57 -6.088 -13.201 -4.937 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.225 -11.657 -2.619 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.083 -13.241 -2.920 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.691 -12.388 -4.431 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.164 -14.072 -4.197 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.319 -13.704 -1.253 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.326 -14.552 -2.463 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.643 -13.185 -1.550 1.00 0.00 H new ATOM 857 N MET A 58 -6.944 -10.981 -5.840 1.00 0.00 N ATOM 858 CA MET A 58 -7.187 -9.720 -6.531 1.00 0.00 C ATOM 859 C MET A 58 -8.672 -9.541 -6.829 1.00 0.00 C ATOM 860 O MET A 58 -9.179 -10.040 -7.833 1.00 0.00 O ATOM 861 CB MET A 58 -6.383 -9.662 -7.831 1.00 0.00 C ATOM 862 CG MET A 58 -5.778 -8.296 -8.112 1.00 0.00 C ATOM 863 SD MET A 58 -6.935 -6.948 -7.806 1.00 0.00 S ATOM 864 CE MET A 58 -8.232 -7.343 -8.975 1.00 0.00 C ATOM 0 H MET A 58 -7.455 -11.777 -6.222 1.00 0.00 H new ATOM 0 HA MET A 58 -6.865 -8.909 -5.878 1.00 0.00 H new ATOM 0 HB2 MET A 58 -5.584 -10.402 -7.787 1.00 0.00 H new ATOM 0 HB3 MET A 58 -7.031 -9.941 -8.662 1.00 0.00 H new ATOM 0 HG2 MET A 58 -4.894 -8.159 -7.489 1.00 0.00 H new ATOM 0 HG3 MET A 58 -5.446 -8.256 -9.149 1.00 0.00 H new ATOM 0 HE1 MET A 58 -8.548 -6.435 -9.489 1.00 0.00 H new ATOM 0 HE2 MET A 58 -7.858 -8.061 -9.705 1.00 0.00 H new ATOM 0 HE3 MET A 58 -9.081 -7.774 -8.444 1.00 0.00 H new ATOM 874 N THR A 59 -9.365 -8.824 -5.949 1.00 0.00 N ATOM 875 CA THR A 59 -10.792 -8.581 -6.118 1.00 0.00 C ATOM 876 C THR A 59 -11.045 -7.235 -6.788 1.00 0.00 C ATOM 877 O THR A 59 -10.458 -6.221 -6.409 1.00 0.00 O ATOM 878 CB THR A 59 -11.531 -8.615 -4.767 1.00 0.00 C ATOM 879 OG1 THR A 59 -10.625 -8.986 -3.722 1.00 0.00 O ATOM 880 CG2 THR A 59 -12.693 -9.596 -4.810 1.00 0.00 C ATOM 0 H THR A 59 -8.961 -8.402 -5.113 1.00 0.00 H new ATOM 0 HA THR A 59 -11.175 -9.379 -6.754 1.00 0.00 H new ATOM 0 HB THR A 59 -11.925 -7.618 -4.569 1.00 0.00 H new ATOM 0 HG1 THR A 59 -11.102 -9.004 -2.866 1.00 0.00 H new ATOM 0 HG21 THR A 59 -13.200 -9.603 -3.845 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.396 -9.294 -5.587 1.00 0.00 H new ATOM 0 HG23 THR A 59 -12.317 -10.595 -5.029 1.00 0.00 H new ATOM 888 N LEU A 60 -11.923 -7.232 -7.786 1.00 0.00 N ATOM 889 CA LEU A 60 -12.254 -6.010 -8.509 1.00 0.00 C ATOM 890 C LEU A 60 -13.756 -5.917 -8.761 1.00 0.00 C ATOM 891 O LEU A 60 -14.260 -6.435 -9.757 1.00 0.00 O ATOM 892 CB LEU A 60 -11.498 -5.960 -9.838 1.00 0.00 C ATOM 893 CG LEU A 60 -11.982 -4.917 -10.847 1.00 0.00 C ATOM 894 CD1 LEU A 60 -11.162 -3.641 -10.731 1.00 0.00 C ATOM 895 CD2 LEU A 60 -11.912 -5.471 -12.262 1.00 0.00 C ATOM 0 H LEU A 60 -12.418 -8.062 -8.112 1.00 0.00 H new ATOM 0 HA LEU A 60 -11.954 -5.161 -7.895 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.445 -5.771 -9.627 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -11.558 -6.943 -10.305 1.00 0.00 H new ATOM 0 HG LEU A 60 -13.022 -4.678 -10.623 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -11.521 -2.911 -11.456 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -11.264 -3.233 -9.725 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -10.113 -3.863 -10.928 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -12.260 -4.715 -12.966 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -10.882 -5.739 -12.497 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -12.544 -6.356 -12.338 1.00 0.00 H new ATOM 907 N GLU A 61 -14.463 -5.250 -7.854 1.00 0.00 N ATOM 908 CA GLU A 61 -15.906 -5.088 -7.980 1.00 0.00 C ATOM 909 C GLU A 61 -16.248 -4.099 -9.090 1.00 0.00 C ATOM 910 O GLU A 61 -15.573 -3.083 -9.260 1.00 0.00 O ATOM 911 CB GLU A 61 -16.506 -4.612 -6.655 1.00 0.00 C ATOM 912 CG GLU A 61 -17.326 -3.339 -6.781 1.00 0.00 C ATOM 913 CD GLU A 61 -17.920 -2.895 -5.458 1.00 0.00 C ATOM 914 OE1 GLU A 61 -17.738 -3.613 -4.454 1.00 0.00 O ATOM 915 OE2 GLU A 61 -18.568 -1.827 -5.429 1.00 0.00 O ATOM 0 H GLU A 61 -14.060 -4.814 -7.025 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.333 -6.057 -8.237 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -17.137 -5.402 -6.247 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.700 -4.446 -5.940 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.696 -2.543 -7.178 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.129 -3.498 -7.501 1.00 0.00 H new ATOM 922 N ILE A 62 -17.300 -4.404 -9.843 1.00 0.00 N ATOM 923 CA ILE A 62 -17.732 -3.543 -10.937 1.00 0.00 C ATOM 924 C ILE A 62 -19.251 -3.415 -10.969 1.00 0.00 C ATOM 925 O ILE A 62 -19.965 -4.310 -11.421 1.00 0.00 O ATOM 926 CB ILE A 62 -17.243 -4.073 -12.298 1.00 0.00 C ATOM 927 CG1 ILE A 62 -15.773 -4.488 -12.210 1.00 0.00 C ATOM 928 CG2 ILE A 62 -17.439 -3.019 -13.377 1.00 0.00 C ATOM 929 CD1 ILE A 62 -15.371 -5.509 -13.251 1.00 0.00 C ATOM 0 H ILE A 62 -17.869 -5.241 -9.715 1.00 0.00 H new ATOM 0 HA ILE A 62 -17.291 -2.562 -10.759 1.00 0.00 H new ATOM 0 HB ILE A 62 -17.833 -4.951 -12.564 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -15.147 -3.603 -12.320 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -15.578 -4.896 -11.218 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -17.089 -3.408 -14.333 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -18.497 -2.768 -13.453 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -16.872 -2.125 -13.119 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -14.317 -5.757 -13.129 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -15.972 -6.410 -13.128 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -15.534 -5.097 -14.247 1.00 0.00 H new ATOM 941 N PRO A 63 -19.759 -2.274 -10.479 1.00 0.00 N ATOM 942 CA PRO A 63 -21.198 -2.000 -10.442 1.00 0.00 C ATOM 943 C PRO A 63 -21.782 -1.777 -11.833 1.00 0.00 C ATOM 944 O PRO A 63 -21.936 -0.640 -12.277 1.00 0.00 O ATOM 945 CB PRO A 63 -21.295 -0.719 -9.611 1.00 0.00 C ATOM 946 CG PRO A 63 -19.973 -0.054 -9.784 1.00 0.00 C ATOM 947 CD PRO A 63 -18.967 -1.163 -9.923 1.00 0.00 C ATOM 0 HA PRO A 63 -21.761 -2.837 -10.028 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -22.107 -0.081 -9.960 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -21.492 -0.941 -8.562 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -19.971 0.587 -10.665 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -19.740 0.580 -8.928 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -18.148 -0.882 -10.585 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -18.524 -1.426 -8.963 1.00 0.00 H new ATOM 955 N ALA A 64 -22.104 -2.870 -12.517 1.00 0.00 N ATOM 956 CA ALA A 64 -22.673 -2.794 -13.857 1.00 0.00 C ATOM 957 C ALA A 64 -22.657 -4.157 -14.539 1.00 0.00 C ATOM 958 O ALA A 64 -23.615 -4.537 -15.213 1.00 0.00 O ATOM 959 CB ALA A 64 -21.915 -1.774 -14.694 1.00 0.00 C ATOM 0 H ALA A 64 -21.980 -3.819 -12.165 1.00 0.00 H new ATOM 0 HA ALA A 64 -23.711 -2.475 -13.767 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -22.350 -1.727 -15.692 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -21.983 -0.794 -14.222 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -20.868 -2.070 -14.768 1.00 0.00 H new ATOM 965 N PHE A 65 -21.562 -4.890 -14.361 1.00 0.00 N ATOM 966 CA PHE A 65 -21.421 -6.212 -14.961 1.00 0.00 C ATOM 967 C PHE A 65 -21.109 -7.261 -13.898 1.00 0.00 C ATOM 968 O PHE A 65 -21.296 -8.457 -14.117 1.00 0.00 O ATOM 969 CB PHE A 65 -20.318 -6.199 -16.021 1.00 0.00 C ATOM 970 CG PHE A 65 -19.618 -4.875 -16.141 1.00 0.00 C ATOM 971 CD1 PHE A 65 -20.337 -3.716 -16.386 1.00 0.00 C ATOM 972 CD2 PHE A 65 -18.241 -4.790 -16.008 1.00 0.00 C ATOM 973 CE1 PHE A 65 -19.695 -2.497 -16.499 1.00 0.00 C ATOM 974 CE2 PHE A 65 -17.594 -3.573 -16.119 1.00 0.00 C ATOM 975 CZ PHE A 65 -18.322 -2.426 -16.363 1.00 0.00 C ATOM 0 H PHE A 65 -20.760 -4.591 -13.806 1.00 0.00 H new ATOM 0 HA PHE A 65 -22.368 -6.472 -15.435 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -19.584 -6.968 -15.780 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -20.750 -6.462 -16.987 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -21.411 -3.766 -16.490 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -17.667 -5.684 -15.816 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -20.266 -1.601 -16.693 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -16.520 -3.520 -16.015 1.00 0.00 H new ATOM 0 HZ PHE A 65 -17.819 -1.474 -16.448 1.00 0.00 H new ATOM 985 N GLY A 66 -20.630 -6.803 -12.745 1.00 0.00 N ATOM 986 CA GLY A 66 -20.298 -7.714 -11.665 1.00 0.00 C ATOM 987 C GLY A 66 -18.975 -7.376 -11.007 1.00 0.00 C ATOM 988 O GLY A 66 -18.587 -6.209 -10.938 1.00 0.00 O ATOM 0 H GLY A 66 -20.466 -5.817 -12.540 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -21.090 -7.689 -10.916 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.258 -8.732 -12.052 1.00 0.00 H new ATOM 992 N THR A 67 -18.280 -8.398 -10.519 1.00 0.00 N ATOM 993 CA THR A 67 -16.995 -8.204 -9.860 1.00 0.00 C ATOM 994 C THR A 67 -15.973 -9.231 -10.334 1.00 0.00 C ATOM 995 O THR A 67 -16.207 -10.437 -10.253 1.00 0.00 O ATOM 996 CB THR A 67 -17.128 -8.298 -8.329 1.00 0.00 C ATOM 997 OG1 THR A 67 -15.834 -8.243 -7.720 1.00 0.00 O ATOM 998 CG2 THR A 67 -17.830 -9.586 -7.925 1.00 0.00 C ATOM 0 H THR A 67 -18.586 -9.370 -10.568 1.00 0.00 H new ATOM 0 HA THR A 67 -16.652 -7.204 -10.126 1.00 0.00 H new ATOM 0 HB THR A 67 -17.726 -7.454 -7.986 1.00 0.00 H new ATOM 0 HG1 THR A 67 -15.928 -8.302 -6.746 1.00 0.00 H new ATOM 0 HG21 THR A 67 -17.912 -9.630 -6.839 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.827 -9.611 -8.366 1.00 0.00 H new ATOM 0 HG23 THR A 67 -17.255 -10.441 -8.280 1.00 0.00 H new ATOM 1006 N TYR A 68 -14.839 -8.746 -10.828 1.00 0.00 N ATOM 1007 CA TYR A 68 -13.782 -9.623 -11.317 1.00 0.00 C ATOM 1008 C TYR A 68 -12.789 -9.951 -10.205 1.00 0.00 C ATOM 1009 O TYR A 68 -12.244 -9.056 -9.559 1.00 0.00 O ATOM 1010 CB TYR A 68 -13.052 -8.971 -12.492 1.00 0.00 C ATOM 1011 CG TYR A 68 -13.598 -9.372 -13.843 1.00 0.00 C ATOM 1012 CD1 TYR A 68 -13.444 -10.668 -14.319 1.00 0.00 C ATOM 1013 CD2 TYR A 68 -14.270 -8.456 -14.643 1.00 0.00 C ATOM 1014 CE1 TYR A 68 -13.942 -11.039 -15.553 1.00 0.00 C ATOM 1015 CE2 TYR A 68 -14.772 -8.818 -15.878 1.00 0.00 C ATOM 1016 CZ TYR A 68 -14.605 -10.111 -16.329 1.00 0.00 C ATOM 1017 OH TYR A 68 -15.103 -10.477 -17.558 1.00 0.00 O ATOM 0 H TYR A 68 -14.628 -7.751 -10.900 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.242 -10.552 -11.655 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.115 -7.887 -12.391 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -11.996 -9.235 -12.444 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.926 -11.398 -13.714 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -14.402 -7.443 -14.293 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.813 -12.051 -15.908 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -15.292 -8.093 -16.487 1.00 0.00 H new ATOM 0 HH TYR A 68 -14.856 -9.803 -18.225 1.00 0.00 H new ATOM 1027 N VAL A 69 -12.559 -11.242 -9.989 1.00 0.00 N ATOM 1028 CA VAL A 69 -11.631 -11.691 -8.958 1.00 0.00 C ATOM 1029 C VAL A 69 -10.529 -12.562 -9.551 1.00 0.00 C ATOM 1030 O VAL A 69 -10.770 -13.345 -10.470 1.00 0.00 O ATOM 1031 CB VAL A 69 -12.358 -12.483 -7.855 1.00 0.00 C ATOM 1032 CG1 VAL A 69 -11.626 -12.347 -6.528 1.00 0.00 C ATOM 1033 CG2 VAL A 69 -13.800 -12.017 -7.727 1.00 0.00 C ATOM 0 H VAL A 69 -13.003 -11.995 -10.514 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.187 -10.797 -8.521 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.364 -13.537 -8.133 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -12.155 -12.913 -5.761 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.612 -12.734 -6.630 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -11.586 -11.296 -6.240 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -14.298 -12.587 -6.943 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.819 -10.957 -7.472 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.318 -12.172 -8.674 1.00 0.00 H new ATOM 1043 N ILE A 70 -9.320 -12.419 -9.019 1.00 0.00 N ATOM 1044 CA ILE A 70 -8.180 -13.194 -9.495 1.00 0.00 C ATOM 1045 C ILE A 70 -7.246 -13.560 -8.347 1.00 0.00 C ATOM 1046 O ILE A 70 -6.610 -12.692 -7.750 1.00 0.00 O ATOM 1047 CB ILE A 70 -7.384 -12.425 -10.565 1.00 0.00 C ATOM 1048 CG1 ILE A 70 -8.336 -11.681 -11.504 1.00 0.00 C ATOM 1049 CG2 ILE A 70 -6.494 -13.377 -11.350 1.00 0.00 C ATOM 1050 CD1 ILE A 70 -7.724 -11.352 -12.848 1.00 0.00 C ATOM 0 H ILE A 70 -9.104 -11.774 -8.259 1.00 0.00 H new ATOM 0 HA ILE A 70 -8.581 -14.106 -9.938 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.749 -11.693 -10.067 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -9.228 -12.287 -11.659 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -8.658 -10.757 -11.024 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -5.938 -12.818 -12.103 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.795 -13.865 -10.671 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.110 -14.131 -11.840 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.455 -10.825 -13.462 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.848 -10.719 -12.704 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.427 -12.274 -13.348 1.00 0.00 H new ATOM 1062 N ASN A 71 -7.167 -14.852 -8.044 1.00 0.00 N ATOM 1063 CA ASN A 71 -6.309 -15.333 -6.968 1.00 0.00 C ATOM 1064 C ASN A 71 -5.147 -16.151 -7.523 1.00 0.00 C ATOM 1065 O ASN A 71 -5.185 -16.610 -8.665 1.00 0.00 O ATOM 1066 CB ASN A 71 -7.117 -16.179 -5.982 1.00 0.00 C ATOM 1067 CG ASN A 71 -8.613 -15.997 -6.156 1.00 0.00 C ATOM 1068 OD1 ASN A 71 -9.146 -16.160 -7.253 1.00 0.00 O ATOM 1069 ND2 ASN A 71 -9.298 -15.657 -5.070 1.00 0.00 N ATOM 0 H ASN A 71 -7.687 -15.584 -8.528 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.904 -14.466 -6.446 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -6.863 -17.231 -6.117 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -6.837 -15.911 -4.963 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -10.307 -15.521 -5.126 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -8.815 -15.532 -4.180 1.00 0.00 H new ATOM 1076 N LYS A 72 -4.114 -16.332 -6.707 1.00 0.00 N ATOM 1077 CA LYS A 72 -2.941 -17.096 -7.114 1.00 0.00 C ATOM 1078 C LYS A 72 -2.427 -17.957 -5.964 1.00 0.00 C ATOM 1079 O LYS A 72 -1.225 -18.194 -5.845 1.00 0.00 O ATOM 1080 CB LYS A 72 -1.834 -16.154 -7.594 1.00 0.00 C ATOM 1081 CG LYS A 72 -0.575 -16.874 -8.043 1.00 0.00 C ATOM 1082 CD LYS A 72 -0.893 -18.234 -8.641 1.00 0.00 C ATOM 1083 CE LYS A 72 0.373 -19.022 -8.939 1.00 0.00 C ATOM 1084 NZ LYS A 72 0.101 -20.480 -9.073 1.00 0.00 N ATOM 0 H LYS A 72 -4.066 -15.959 -5.759 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.232 -17.752 -7.934 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.213 -15.553 -8.421 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.581 -15.465 -6.789 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.050 -16.266 -8.779 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.097 -16.997 -7.194 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.520 -18.798 -7.951 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.466 -18.104 -9.559 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.824 -18.651 -9.859 1.00 0.00 H new ATOM 0 HE3 LYS A 72 1.098 -18.860 -8.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.938 -21.018 -8.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.710 -20.738 -8.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.116 -20.703 -10.065 1.00 0.00 H new ATOM 1098 N GLN A 73 -3.344 -18.421 -5.122 1.00 0.00 N ATOM 1099 CA GLN A 73 -2.982 -19.256 -3.983 1.00 0.00 C ATOM 1100 C GLN A 73 -3.958 -20.417 -3.827 1.00 0.00 C ATOM 1101 O GLN A 73 -4.294 -20.834 -2.718 1.00 0.00 O ATOM 1102 CB GLN A 73 -2.954 -18.422 -2.701 1.00 0.00 C ATOM 1103 CG GLN A 73 -1.608 -18.435 -1.995 1.00 0.00 C ATOM 1104 CD GLN A 73 -1.722 -18.796 -0.527 1.00 0.00 C ATOM 1105 OE1 GLN A 73 -2.322 -19.810 -0.170 1.00 0.00 O ATOM 1106 NE2 GLN A 73 -1.145 -17.965 0.333 1.00 0.00 N ATOM 0 H GLN A 73 -4.343 -18.233 -5.207 1.00 0.00 H new ATOM 0 HA GLN A 73 -1.988 -19.663 -4.165 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -3.219 -17.392 -2.942 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -3.717 -18.796 -2.018 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -0.949 -19.148 -2.490 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -1.143 -17.453 -2.089 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -0.658 -17.136 -0.007 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -1.189 -18.156 1.334 1.00 0.00 H new ATOM 1115 N PRO A 74 -4.426 -20.954 -4.964 1.00 0.00 N ATOM 1116 CA PRO A 74 -5.370 -22.076 -4.979 1.00 0.00 C ATOM 1117 C PRO A 74 -4.730 -23.379 -4.512 1.00 0.00 C ATOM 1118 O PRO A 74 -3.512 -23.551 -4.555 1.00 0.00 O ATOM 1119 CB PRO A 74 -5.775 -22.177 -6.452 1.00 0.00 C ATOM 1120 CG PRO A 74 -4.629 -21.591 -7.202 1.00 0.00 C ATOM 1121 CD PRO A 74 -4.069 -20.509 -6.321 1.00 0.00 C ATOM 0 HA PRO A 74 -6.208 -21.913 -4.302 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -5.951 -23.212 -6.744 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -6.697 -21.630 -6.647 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -3.875 -22.348 -7.417 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.956 -21.185 -8.159 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.990 -20.412 -6.441 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -4.504 -19.537 -6.553 1.00 0.00 H new ATOM 1129 N PRO A 75 -5.570 -24.320 -4.055 1.00 0.00 N ATOM 1130 CA PRO A 75 -5.108 -25.625 -3.571 1.00 0.00 C ATOM 1131 C PRO A 75 -4.577 -26.505 -4.697 1.00 0.00 C ATOM 1132 O PRO A 75 -5.115 -27.579 -4.964 1.00 0.00 O ATOM 1133 CB PRO A 75 -6.368 -26.242 -2.958 1.00 0.00 C ATOM 1134 CG PRO A 75 -7.498 -25.580 -3.669 1.00 0.00 C ATOM 1135 CD PRO A 75 -7.034 -24.183 -3.975 1.00 0.00 C ATOM 0 HA PRO A 75 -4.279 -25.530 -2.870 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -6.389 -27.322 -3.100 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -6.415 -26.061 -1.884 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -7.751 -26.116 -4.584 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -8.394 -25.566 -3.049 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -7.455 -23.816 -4.911 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -7.330 -23.481 -3.195 1.00 0.00 H new ATOM 1143 N ASN A 76 -3.519 -26.043 -5.355 1.00 0.00 N ATOM 1144 CA ASN A 76 -2.915 -26.790 -6.453 1.00 0.00 C ATOM 1145 C ASN A 76 -2.095 -25.869 -7.351 1.00 0.00 C ATOM 1146 O ASN A 76 -2.096 -26.014 -8.574 1.00 0.00 O ATOM 1147 CB ASN A 76 -3.998 -27.492 -7.275 1.00 0.00 C ATOM 1148 CG ASN A 76 -5.280 -26.686 -7.351 1.00 0.00 C ATOM 1149 OD1 ASN A 76 -5.252 -25.470 -7.542 1.00 0.00 O ATOM 1150 ND2 ASN A 76 -6.413 -27.362 -7.199 1.00 0.00 N ATOM 0 H ASN A 76 -3.062 -25.155 -5.147 1.00 0.00 H new ATOM 0 HA ASN A 76 -2.248 -27.540 -6.027 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -3.625 -27.672 -8.283 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -4.210 -28.466 -6.835 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -7.308 -26.874 -7.239 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -6.389 -28.370 -7.043 1.00 0.00 H new ATOM 1157 N LYS A 77 -1.396 -24.921 -6.736 1.00 0.00 N ATOM 1158 CA LYS A 77 -0.569 -23.977 -7.478 1.00 0.00 C ATOM 1159 C LYS A 77 -1.193 -23.655 -8.833 1.00 0.00 C ATOM 1160 O LYS A 77 -0.936 -24.341 -9.822 1.00 0.00 O ATOM 1161 CB LYS A 77 0.839 -24.544 -7.675 1.00 0.00 C ATOM 1162 CG LYS A 77 1.554 -23.989 -8.895 1.00 0.00 C ATOM 1163 CD LYS A 77 1.567 -24.990 -10.037 1.00 0.00 C ATOM 1164 CE LYS A 77 2.936 -25.633 -10.198 1.00 0.00 C ATOM 1165 NZ LYS A 77 2.900 -26.789 -11.137 1.00 0.00 N ATOM 0 H LYS A 77 -1.386 -24.786 -5.725 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.505 -23.056 -6.899 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.435 -24.331 -6.787 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.776 -25.629 -7.764 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.063 -23.072 -9.220 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.578 -23.726 -8.629 1.00 0.00 H new ATOM 0 HD2 LYS A 77 0.820 -25.762 -9.854 1.00 0.00 H new ATOM 0 HD3 LYS A 77 1.287 -24.490 -10.964 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.645 -24.890 -10.564 1.00 0.00 H new ATOM 0 HE3 LYS A 77 3.297 -25.967 -9.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 3.852 -27.199 -11.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.243 -27.509 -10.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.580 -26.466 -12.073 1.00 0.00 H new ATOM 1179 N GLN A 78 -2.010 -22.608 -8.869 1.00 0.00 N ATOM 1180 CA GLN A 78 -2.669 -22.196 -10.103 1.00 0.00 C ATOM 1181 C GLN A 78 -3.248 -20.792 -9.968 1.00 0.00 C ATOM 1182 O GLN A 78 -3.179 -20.181 -8.901 1.00 0.00 O ATOM 1183 CB GLN A 78 -3.778 -23.184 -10.468 1.00 0.00 C ATOM 1184 CG GLN A 78 -3.335 -24.263 -11.443 1.00 0.00 C ATOM 1185 CD GLN A 78 -3.272 -25.637 -10.804 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -4.075 -25.965 -9.930 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -2.316 -26.449 -11.239 1.00 0.00 N ATOM 0 H GLN A 78 -2.232 -22.030 -8.059 1.00 0.00 H new ATOM 0 HA GLN A 78 -1.923 -22.187 -10.898 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.146 -23.657 -9.558 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.614 -22.635 -10.902 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -4.024 -24.290 -12.287 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -2.353 -24.006 -11.842 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -1.672 -26.136 -11.965 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -2.225 -27.386 -10.847 1.00 0.00 H new ATOM 1196 N ILE A 79 -3.816 -20.284 -11.057 1.00 0.00 N ATOM 1197 CA ILE A 79 -4.407 -18.952 -11.060 1.00 0.00 C ATOM 1198 C ILE A 79 -5.929 -19.026 -11.126 1.00 0.00 C ATOM 1199 O ILE A 79 -6.495 -19.488 -12.117 1.00 0.00 O ATOM 1200 CB ILE A 79 -3.893 -18.110 -12.243 1.00 0.00 C ATOM 1201 CG1 ILE A 79 -2.720 -17.232 -11.801 1.00 0.00 C ATOM 1202 CG2 ILE A 79 -5.015 -17.257 -12.813 1.00 0.00 C ATOM 1203 CD1 ILE A 79 -3.056 -16.310 -10.650 1.00 0.00 C ATOM 0 H ILE A 79 -3.879 -20.775 -11.949 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.109 -18.473 -10.128 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.543 -18.784 -13.025 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.886 -17.872 -11.512 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.384 -16.635 -12.649 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.636 -16.668 -13.648 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.822 -17.902 -13.161 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.393 -16.589 -12.039 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.178 -15.718 -10.390 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.869 -15.645 -10.942 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.363 -16.902 -9.788 1.00 0.00 H new ATOM 1215 N TRP A 80 -6.584 -18.565 -10.067 1.00 0.00 N ATOM 1216 CA TRP A 80 -8.042 -18.577 -10.006 1.00 0.00 C ATOM 1217 C TRP A 80 -8.622 -17.308 -10.621 1.00 0.00 C ATOM 1218 O TRP A 80 -8.121 -16.208 -10.388 1.00 0.00 O ATOM 1219 CB TRP A 80 -8.511 -18.716 -8.557 1.00 0.00 C ATOM 1220 CG TRP A 80 -8.806 -20.132 -8.162 1.00 0.00 C ATOM 1221 CD1 TRP A 80 -8.069 -21.239 -8.471 1.00 0.00 C ATOM 1222 CD2 TRP A 80 -9.918 -20.591 -7.387 1.00 0.00 C ATOM 1223 NE1 TRP A 80 -8.656 -22.360 -7.934 1.00 0.00 N ATOM 1224 CE2 TRP A 80 -9.792 -21.989 -7.264 1.00 0.00 C ATOM 1225 CE3 TRP A 80 -11.008 -19.958 -6.784 1.00 0.00 C ATOM 1226 CZ2 TRP A 80 -10.715 -22.760 -6.563 1.00 0.00 C ATOM 1227 CZ3 TRP A 80 -11.924 -20.725 -6.089 1.00 0.00 C ATOM 1228 CH2 TRP A 80 -11.772 -22.114 -5.983 1.00 0.00 C ATOM 0 H TRP A 80 -6.130 -18.179 -9.239 1.00 0.00 H new ATOM 0 HA TRP A 80 -8.398 -19.433 -10.579 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -7.745 -18.313 -7.894 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -9.407 -18.112 -8.413 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -7.159 -21.235 -9.052 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -8.303 -23.313 -8.020 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.133 -18.888 -6.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -10.601 -23.831 -6.480 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -12.771 -20.246 -5.620 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -12.504 -22.686 -5.432 1.00 0.00 H new ATOM 1239 N LEU A 81 -9.681 -17.469 -11.407 1.00 0.00 N ATOM 1240 CA LEU A 81 -10.331 -16.335 -12.056 1.00 0.00 C ATOM 1241 C LEU A 81 -11.837 -16.358 -11.813 1.00 0.00 C ATOM 1242 O LEU A 81 -12.563 -17.138 -12.427 1.00 0.00 O ATOM 1243 CB LEU A 81 -10.046 -16.350 -13.559 1.00 0.00 C ATOM 1244 CG LEU A 81 -10.193 -15.012 -14.284 1.00 0.00 C ATOM 1245 CD1 LEU A 81 -11.648 -14.757 -14.643 1.00 0.00 C ATOM 1246 CD2 LEU A 81 -9.646 -13.879 -13.428 1.00 0.00 C ATOM 0 H LEU A 81 -10.108 -18.373 -11.610 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.925 -15.420 -11.624 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -9.030 -16.714 -13.712 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -10.716 -17.070 -14.028 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.615 -15.055 -15.207 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.733 -13.800 -15.158 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -12.007 -15.554 -15.295 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.249 -14.734 -13.734 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.759 -12.934 -13.960 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.196 -13.835 -12.488 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.590 -14.056 -13.222 1.00 0.00 H new ATOM 1258 N ALA A 82 -12.299 -15.495 -10.914 1.00 0.00 N ATOM 1259 CA ALA A 82 -13.718 -15.413 -10.592 1.00 0.00 C ATOM 1260 C ALA A 82 -14.418 -14.373 -11.460 1.00 0.00 C ATOM 1261 O ALA A 82 -14.241 -13.170 -11.268 1.00 0.00 O ATOM 1262 CB ALA A 82 -13.908 -15.088 -9.118 1.00 0.00 C ATOM 0 H ALA A 82 -11.711 -14.843 -10.396 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.169 -16.384 -10.799 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -14.973 -15.030 -8.893 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -13.451 -15.869 -8.511 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.437 -14.131 -8.893 1.00 0.00 H new ATOM 1268 N SER A 83 -15.214 -14.844 -12.415 1.00 0.00 N ATOM 1269 CA SER A 83 -15.937 -13.954 -13.316 1.00 0.00 C ATOM 1270 C SER A 83 -16.812 -12.981 -12.531 1.00 0.00 C ATOM 1271 O SER A 83 -16.997 -13.110 -11.320 1.00 0.00 O ATOM 1272 CB SER A 83 -16.798 -14.765 -14.285 1.00 0.00 C ATOM 1273 OG SER A 83 -16.324 -14.641 -15.615 1.00 0.00 O ATOM 0 H SER A 83 -15.374 -15.837 -12.585 1.00 0.00 H new ATOM 0 HA SER A 83 -15.206 -13.380 -13.885 1.00 0.00 H new ATOM 0 HB2 SER A 83 -16.793 -15.814 -13.990 1.00 0.00 H new ATOM 0 HB3 SER A 83 -17.832 -14.424 -14.231 1.00 0.00 H new ATOM 0 HG SER A 83 -16.890 -15.170 -16.215 1.00 0.00 H new ATOM 1279 N PRO A 84 -17.366 -11.983 -13.236 1.00 0.00 N ATOM 1280 CA PRO A 84 -18.232 -10.969 -12.627 1.00 0.00 C ATOM 1281 C PRO A 84 -19.577 -11.541 -12.194 1.00 0.00 C ATOM 1282 O PRO A 84 -20.387 -10.849 -11.575 1.00 0.00 O ATOM 1283 CB PRO A 84 -18.422 -9.945 -13.749 1.00 0.00 C ATOM 1284 CG PRO A 84 -18.215 -10.718 -15.006 1.00 0.00 C ATOM 1285 CD PRO A 84 -17.189 -11.769 -14.682 1.00 0.00 C ATOM 0 HA PRO A 84 -17.796 -10.551 -11.720 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -19.417 -9.502 -13.716 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -17.706 -9.128 -13.664 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -19.147 -11.173 -15.342 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -17.868 -10.069 -15.810 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.359 -12.685 -15.248 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -16.180 -11.432 -14.918 1.00 0.00 H new ATOM 1293 N LEU A 85 -19.810 -12.807 -12.521 1.00 0.00 N ATOM 1294 CA LEU A 85 -21.059 -13.472 -12.165 1.00 0.00 C ATOM 1295 C LEU A 85 -20.802 -14.643 -11.222 1.00 0.00 C ATOM 1296 O LEU A 85 -21.635 -15.540 -11.088 1.00 0.00 O ATOM 1297 CB LEU A 85 -21.775 -13.964 -13.424 1.00 0.00 C ATOM 1298 CG LEU A 85 -21.942 -12.938 -14.545 1.00 0.00 C ATOM 1299 CD1 LEU A 85 -21.803 -13.606 -15.905 1.00 0.00 C ATOM 1300 CD2 LEU A 85 -23.287 -12.236 -14.429 1.00 0.00 C ATOM 0 H LEU A 85 -19.151 -13.394 -13.032 1.00 0.00 H new ATOM 0 HA LEU A 85 -21.694 -12.749 -11.653 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -21.226 -14.819 -13.820 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -22.763 -14.325 -13.138 1.00 0.00 H new ATOM 0 HG LEU A 85 -21.155 -12.190 -14.448 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -21.925 -12.860 -16.691 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -20.816 -14.062 -15.987 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -22.568 -14.375 -16.013 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -23.389 -11.509 -15.235 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -24.089 -12.971 -14.500 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -23.349 -11.724 -13.469 1.00 0.00 H new ATOM 1312 N SER A 86 -19.645 -14.626 -10.567 1.00 0.00 N ATOM 1313 CA SER A 86 -19.278 -15.687 -9.637 1.00 0.00 C ATOM 1314 C SER A 86 -18.887 -16.957 -10.387 1.00 0.00 C ATOM 1315 O SER A 86 -19.586 -17.967 -10.327 1.00 0.00 O ATOM 1316 CB SER A 86 -20.437 -15.982 -8.683 1.00 0.00 C ATOM 1317 OG SER A 86 -19.961 -16.365 -7.405 1.00 0.00 O ATOM 0 H SER A 86 -18.946 -13.889 -10.663 1.00 0.00 H new ATOM 0 HA SER A 86 -18.418 -15.348 -9.059 1.00 0.00 H new ATOM 0 HB2 SER A 86 -21.069 -15.099 -8.589 1.00 0.00 H new ATOM 0 HB3 SER A 86 -21.059 -16.776 -9.096 1.00 0.00 H new ATOM 0 HG SER A 86 -20.721 -16.546 -6.814 1.00 0.00 H new ATOM 1323 N GLY A 87 -17.763 -16.896 -11.096 1.00 0.00 N ATOM 1324 CA GLY A 87 -17.298 -18.046 -11.849 1.00 0.00 C ATOM 1325 C GLY A 87 -15.791 -18.202 -11.796 1.00 0.00 C ATOM 1326 O GLY A 87 -15.066 -17.740 -12.678 1.00 0.00 O ATOM 0 H GLY A 87 -17.167 -16.071 -11.162 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -17.768 -18.948 -11.456 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -17.614 -17.948 -12.888 1.00 0.00 H new ATOM 1330 N PRO A 88 -15.297 -18.865 -10.740 1.00 0.00 N ATOM 1331 CA PRO A 88 -13.862 -19.094 -10.549 1.00 0.00 C ATOM 1332 C PRO A 88 -13.294 -20.085 -11.560 1.00 0.00 C ATOM 1333 O PRO A 88 -13.885 -21.134 -11.814 1.00 0.00 O ATOM 1334 CB PRO A 88 -13.779 -19.669 -9.133 1.00 0.00 C ATOM 1335 CG PRO A 88 -15.114 -20.289 -8.897 1.00 0.00 C ATOM 1336 CD PRO A 88 -16.102 -19.442 -9.650 1.00 0.00 C ATOM 0 HA PRO A 88 -13.282 -18.182 -10.688 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -12.980 -20.406 -9.051 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -13.570 -18.889 -8.401 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -15.134 -21.320 -9.251 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.351 -20.313 -7.833 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -16.931 -20.037 -10.034 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.533 -18.668 -9.016 1.00 0.00 H new ATOM 1344 N ASN A 89 -12.145 -19.745 -12.134 1.00 0.00 N ATOM 1345 CA ASN A 89 -11.497 -20.605 -13.118 1.00 0.00 C ATOM 1346 C ASN A 89 -10.045 -20.873 -12.734 1.00 0.00 C ATOM 1347 O ASN A 89 -9.266 -19.943 -12.524 1.00 0.00 O ATOM 1348 CB ASN A 89 -11.560 -19.964 -14.506 1.00 0.00 C ATOM 1349 CG ASN A 89 -12.567 -20.646 -15.412 1.00 0.00 C ATOM 1350 OD1 ASN A 89 -12.630 -21.874 -15.476 1.00 0.00 O ATOM 1351 ND2 ASN A 89 -13.360 -19.850 -16.119 1.00 0.00 N ATOM 0 H ASN A 89 -11.643 -18.880 -11.935 1.00 0.00 H new ATOM 0 HA ASN A 89 -12.029 -21.556 -13.140 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -11.821 -18.910 -14.405 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -10.573 -20.005 -14.968 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -14.057 -20.251 -16.747 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -13.273 -18.837 -16.034 1.00 0.00 H new ATOM 1358 N ARG A 90 -9.688 -22.150 -12.646 1.00 0.00 N ATOM 1359 CA ARG A 90 -8.330 -22.541 -12.287 1.00 0.00 C ATOM 1360 C ARG A 90 -7.430 -22.570 -13.519 1.00 0.00 C ATOM 1361 O ARG A 90 -7.671 -23.326 -14.460 1.00 0.00 O ATOM 1362 CB ARG A 90 -8.334 -23.914 -11.612 1.00 0.00 C ATOM 1363 CG ARG A 90 -9.598 -24.199 -10.819 1.00 0.00 C ATOM 1364 CD ARG A 90 -9.305 -25.045 -9.589 1.00 0.00 C ATOM 1365 NE ARG A 90 -9.621 -26.454 -9.806 1.00 0.00 N ATOM 1366 CZ ARG A 90 -10.839 -26.898 -10.096 1.00 0.00 C ATOM 1367 NH1 ARG A 90 -11.850 -26.047 -10.204 1.00 0.00 N ATOM 1368 NH2 ARG A 90 -11.047 -28.196 -10.279 1.00 0.00 N ATOM 0 H ARG A 90 -10.320 -22.932 -12.818 1.00 0.00 H new ATOM 0 HA ARG A 90 -7.937 -21.802 -11.589 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.212 -24.684 -12.374 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -7.474 -23.985 -10.946 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.057 -23.259 -10.514 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.319 -24.715 -11.454 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -8.252 -24.946 -9.323 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -9.883 -24.670 -8.745 1.00 0.00 H new ATOM 0 HE ARG A 90 -8.865 -27.135 -9.731 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -11.694 -25.049 -10.064 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -12.784 -26.391 -10.427 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -10.271 -28.853 -10.197 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -11.982 -28.536 -10.502 1.00 0.00 H new ATOM 1382 N PHE A 91 -6.391 -21.741 -13.505 1.00 0.00 N ATOM 1383 CA PHE A 91 -5.455 -21.670 -14.622 1.00 0.00 C ATOM 1384 C PHE A 91 -4.165 -22.418 -14.298 1.00 0.00 C ATOM 1385 O PHE A 91 -3.653 -22.340 -13.181 1.00 0.00 O ATOM 1386 CB PHE A 91 -5.141 -20.211 -14.959 1.00 0.00 C ATOM 1387 CG PHE A 91 -6.208 -19.542 -15.777 1.00 0.00 C ATOM 1388 CD1 PHE A 91 -7.329 -19.001 -15.169 1.00 0.00 C ATOM 1389 CD2 PHE A 91 -6.090 -19.454 -17.155 1.00 0.00 C ATOM 1390 CE1 PHE A 91 -8.313 -18.384 -15.919 1.00 0.00 C ATOM 1391 CE2 PHE A 91 -7.070 -18.838 -17.910 1.00 0.00 C ATOM 1392 CZ PHE A 91 -8.183 -18.304 -17.291 1.00 0.00 C ATOM 0 H PHE A 91 -6.176 -21.110 -12.733 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.922 -22.143 -15.486 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.002 -19.654 -14.032 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.197 -20.167 -15.502 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -7.436 -19.062 -14.096 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -5.222 -19.871 -17.644 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -9.182 -17.965 -15.432 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.966 -18.774 -18.983 1.00 0.00 H new ATOM 0 HZ PHE A 91 -8.951 -17.824 -17.880 1.00 0.00 H new ATOM 1402 N ASP A 92 -3.647 -23.144 -15.283 1.00 0.00 N ATOM 1403 CA ASP A 92 -2.417 -23.906 -15.104 1.00 0.00 C ATOM 1404 C ASP A 92 -1.224 -23.160 -15.693 1.00 0.00 C ATOM 1405 O ASP A 92 -1.265 -22.708 -16.839 1.00 0.00 O ATOM 1406 CB ASP A 92 -2.545 -25.283 -15.758 1.00 0.00 C ATOM 1407 CG ASP A 92 -1.334 -26.159 -15.507 1.00 0.00 C ATOM 1408 OD1 ASP A 92 -0.202 -25.685 -15.736 1.00 0.00 O ATOM 1409 OD2 ASP A 92 -1.518 -27.319 -15.082 1.00 0.00 O ATOM 0 H ASP A 92 -4.060 -23.221 -16.213 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.251 -24.033 -14.034 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.436 -25.782 -15.376 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.684 -25.160 -16.832 1.00 0.00 H new ATOM 1414 N LEU A 93 -0.164 -23.032 -14.903 1.00 0.00 N ATOM 1415 CA LEU A 93 1.041 -22.339 -15.346 1.00 0.00 C ATOM 1416 C LEU A 93 1.756 -23.131 -16.436 1.00 0.00 C ATOM 1417 O LEU A 93 2.294 -24.210 -16.183 1.00 0.00 O ATOM 1418 CB LEU A 93 1.985 -22.110 -14.164 1.00 0.00 C ATOM 1419 CG LEU A 93 3.466 -22.384 -14.425 1.00 0.00 C ATOM 1420 CD1 LEU A 93 3.936 -21.644 -15.668 1.00 0.00 C ATOM 1421 CD2 LEU A 93 4.303 -21.987 -13.217 1.00 0.00 C ATOM 0 H LEU A 93 -0.114 -23.399 -13.953 1.00 0.00 H new ATOM 0 HA LEU A 93 0.744 -21.375 -15.759 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.880 -21.076 -13.836 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.659 -22.741 -13.337 1.00 0.00 H new ATOM 0 HG LEU A 93 3.593 -23.453 -14.595 1.00 0.00 H new ATOM 0 HD11 LEU A 93 4.993 -21.852 -15.837 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.358 -21.977 -16.530 1.00 0.00 H new ATOM 0 HD13 LEU A 93 3.795 -20.572 -15.529 1.00 0.00 H new ATOM 0 HD21 LEU A 93 5.355 -22.189 -13.421 1.00 0.00 H new ATOM 0 HD22 LEU A 93 4.170 -20.924 -13.016 1.00 0.00 H new ATOM 0 HD23 LEU A 93 3.984 -22.563 -12.348 1.00 0.00 H new ATOM 1433 N LEU A 94 1.760 -22.587 -17.648 1.00 0.00 N ATOM 1434 CA LEU A 94 2.411 -23.242 -18.778 1.00 0.00 C ATOM 1435 C LEU A 94 3.390 -22.295 -19.465 1.00 0.00 C ATOM 1436 O LEU A 94 2.988 -21.307 -20.076 1.00 0.00 O ATOM 1437 CB LEU A 94 1.366 -23.730 -19.782 1.00 0.00 C ATOM 1438 CG LEU A 94 1.687 -25.040 -20.502 1.00 0.00 C ATOM 1439 CD1 LEU A 94 1.338 -26.231 -19.623 1.00 0.00 C ATOM 1440 CD2 LEU A 94 0.942 -25.116 -21.827 1.00 0.00 C ATOM 0 H LEU A 94 1.320 -21.695 -17.874 1.00 0.00 H new ATOM 0 HA LEU A 94 2.968 -24.099 -18.398 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.417 -23.849 -19.259 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.221 -22.953 -20.532 1.00 0.00 H new ATOM 0 HG LEU A 94 2.757 -25.067 -20.707 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.573 -27.155 -20.152 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.916 -26.184 -18.700 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.274 -26.209 -19.386 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.182 -26.055 -22.326 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.131 -25.066 -21.644 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.241 -24.281 -22.461 1.00 0.00 H new ATOM 1452 N ASN A 95 4.678 -22.607 -19.362 1.00 0.00 N ATOM 1453 CA ASN A 95 5.715 -21.785 -19.975 1.00 0.00 C ATOM 1454 C ASN A 95 5.631 -20.345 -19.481 1.00 0.00 C ATOM 1455 O ASN A 95 5.762 -19.401 -20.259 1.00 0.00 O ATOM 1456 CB ASN A 95 5.588 -21.821 -21.500 1.00 0.00 C ATOM 1457 CG ASN A 95 5.060 -23.150 -22.005 1.00 0.00 C ATOM 1458 OD1 ASN A 95 5.379 -24.223 -21.291 1.00 0.00 O flip ATOM 1459 ND2 ASN A 95 4.372 -23.210 -23.024 1.00 0.00 N flip ATOM 0 H ASN A 95 5.028 -23.423 -18.860 1.00 0.00 H new ATOM 0 HA ASN A 95 6.684 -22.193 -19.687 1.00 0.00 H new ATOM 0 HB2 ASN A 95 4.922 -21.021 -21.825 1.00 0.00 H new ATOM 0 HB3 ASN A 95 6.563 -21.627 -21.948 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.152 -22.359 -23.541 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.022 -24.111 -23.351 1.00 0.00 H new ATOM 1466 N GLY A 96 5.411 -20.183 -18.179 1.00 0.00 N ATOM 1467 CA GLY A 96 5.314 -18.855 -17.603 1.00 0.00 C ATOM 1468 C GLY A 96 3.943 -18.239 -17.795 1.00 0.00 C ATOM 1469 O GLY A 96 3.590 -17.271 -17.122 1.00 0.00 O ATOM 0 H GLY A 96 5.298 -20.948 -17.514 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.540 -18.907 -16.538 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.066 -18.210 -18.057 1.00 0.00 H new ATOM 1473 N GLU A 97 3.168 -18.799 -18.719 1.00 0.00 N ATOM 1474 CA GLU A 97 1.828 -18.296 -18.999 1.00 0.00 C ATOM 1475 C GLU A 97 0.765 -19.266 -18.492 1.00 0.00 C ATOM 1476 O GLU A 97 0.732 -20.430 -18.889 1.00 0.00 O ATOM 1477 CB GLU A 97 1.650 -18.067 -20.502 1.00 0.00 C ATOM 1478 CG GLU A 97 2.449 -16.890 -21.037 1.00 0.00 C ATOM 1479 CD GLU A 97 2.806 -17.047 -22.503 1.00 0.00 C ATOM 1480 OE1 GLU A 97 2.800 -18.194 -22.995 1.00 0.00 O ATOM 1481 OE2 GLU A 97 3.091 -16.022 -23.157 1.00 0.00 O ATOM 0 H GLU A 97 3.445 -19.600 -19.286 1.00 0.00 H new ATOM 0 HA GLU A 97 1.707 -17.347 -18.476 1.00 0.00 H new ATOM 0 HB2 GLU A 97 1.947 -18.970 -21.036 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.593 -17.904 -20.714 1.00 0.00 H new ATOM 0 HG2 GLU A 97 1.874 -15.974 -20.903 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.363 -16.781 -20.454 1.00 0.00 H new ATOM 1488 N TRP A 98 -0.101 -18.777 -17.612 1.00 0.00 N ATOM 1489 CA TRP A 98 -1.166 -19.600 -17.049 1.00 0.00 C ATOM 1490 C TRP A 98 -2.314 -19.756 -18.039 1.00 0.00 C ATOM 1491 O TRP A 98 -3.105 -18.834 -18.239 1.00 0.00 O ATOM 1492 CB TRP A 98 -1.679 -18.985 -15.746 1.00 0.00 C ATOM 1493 CG TRP A 98 -0.583 -18.571 -14.812 1.00 0.00 C ATOM 1494 CD1 TRP A 98 0.119 -17.400 -14.839 1.00 0.00 C ATOM 1495 CD2 TRP A 98 -0.062 -19.328 -13.714 1.00 0.00 C ATOM 1496 NE1 TRP A 98 1.045 -17.384 -13.824 1.00 0.00 N ATOM 1497 CE2 TRP A 98 0.954 -18.554 -13.119 1.00 0.00 C ATOM 1498 CE3 TRP A 98 -0.356 -20.583 -13.174 1.00 0.00 C ATOM 1499 CZ2 TRP A 98 1.675 -18.997 -12.013 1.00 0.00 C ATOM 1500 CZ3 TRP A 98 0.362 -21.021 -12.077 1.00 0.00 C ATOM 1501 CH2 TRP A 98 1.367 -20.229 -11.505 1.00 0.00 C ATOM 0 H TRP A 98 -0.087 -17.815 -17.273 1.00 0.00 H new ATOM 0 HA TRP A 98 -0.756 -20.588 -16.839 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -2.294 -18.116 -15.980 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -2.323 -19.705 -15.242 1.00 0.00 H new ATOM 0 HD1 TRP A 98 -0.031 -16.604 -15.553 1.00 0.00 H new ATOM 0 HE1 TRP A 98 1.695 -16.623 -13.627 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -1.130 -21.200 -13.606 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 2.451 -18.389 -11.572 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.145 -21.990 -11.653 1.00 0.00 H new ATOM 0 HH2 TRP A 98 1.909 -20.599 -10.647 1.00 0.00 H new ATOM 1512 N VAL A 99 -2.402 -20.930 -18.657 1.00 0.00 N ATOM 1513 CA VAL A 99 -3.456 -21.207 -19.626 1.00 0.00 C ATOM 1514 C VAL A 99 -4.590 -22.004 -18.991 1.00 0.00 C ATOM 1515 O VAL A 99 -4.382 -22.738 -18.024 1.00 0.00 O ATOM 1516 CB VAL A 99 -2.912 -21.986 -20.839 1.00 0.00 C ATOM 1517 CG1 VAL A 99 -1.550 -21.450 -21.250 1.00 0.00 C ATOM 1518 CG2 VAL A 99 -2.837 -23.473 -20.527 1.00 0.00 C ATOM 0 H VAL A 99 -1.756 -21.704 -18.504 1.00 0.00 H new ATOM 0 HA VAL A 99 -3.838 -20.243 -19.964 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.598 -21.848 -21.675 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.182 -22.012 -22.108 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.639 -20.397 -21.517 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.852 -21.556 -20.420 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.451 -24.008 -21.395 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -2.174 -23.633 -19.677 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -3.833 -23.845 -20.285 1.00 0.00 H new ATOM 1528 N SER A 100 -5.790 -21.856 -19.541 1.00 0.00 N ATOM 1529 CA SER A 100 -6.959 -22.559 -19.027 1.00 0.00 C ATOM 1530 C SER A 100 -7.391 -23.667 -19.983 1.00 0.00 C ATOM 1531 O SER A 100 -7.542 -23.443 -21.185 1.00 0.00 O ATOM 1532 CB SER A 100 -8.115 -21.581 -18.808 1.00 0.00 C ATOM 1533 OG SER A 100 -9.350 -22.267 -18.695 1.00 0.00 O ATOM 0 H SER A 100 -5.979 -21.255 -20.343 1.00 0.00 H new ATOM 0 HA SER A 100 -6.689 -23.010 -18.072 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.936 -20.998 -17.905 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.162 -20.877 -19.638 1.00 0.00 H new ATOM 0 HG SER A 100 -10.072 -21.620 -18.554 1.00 0.00 H new ATOM 1539 N LEU A 101 -7.587 -24.864 -19.442 1.00 0.00 N ATOM 1540 CA LEU A 101 -8.001 -26.009 -20.245 1.00 0.00 C ATOM 1541 C LEU A 101 -8.932 -25.575 -21.373 1.00 0.00 C ATOM 1542 O LEU A 101 -8.778 -26.001 -22.517 1.00 0.00 O ATOM 1543 CB LEU A 101 -8.698 -27.049 -19.366 1.00 0.00 C ATOM 1544 CG LEU A 101 -8.595 -28.501 -19.834 1.00 0.00 C ATOM 1545 CD1 LEU A 101 -9.097 -28.638 -21.263 1.00 0.00 C ATOM 1546 CD2 LEU A 101 -7.161 -28.998 -19.720 1.00 0.00 C ATOM 0 H LEU A 101 -7.466 -25.067 -18.450 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.109 -26.454 -20.685 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -8.283 -26.982 -18.360 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -9.753 -26.786 -19.294 1.00 0.00 H new ATOM 0 HG LEU A 101 -9.223 -29.116 -19.190 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.016 -29.678 -21.579 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -10.139 -28.323 -21.314 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -8.496 -28.011 -21.921 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -7.107 -30.033 -20.057 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.511 -28.380 -20.340 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -6.836 -28.938 -18.681 1.00 0.00 H new ATOM 1558 N ARG A 102 -9.897 -24.723 -21.042 1.00 0.00 N ATOM 1559 CA ARG A 102 -10.852 -24.230 -22.027 1.00 0.00 C ATOM 1560 C ARG A 102 -10.165 -23.957 -23.361 1.00 0.00 C ATOM 1561 O ARG A 102 -9.643 -22.866 -23.589 1.00 0.00 O ATOM 1562 CB ARG A 102 -11.529 -22.956 -21.519 1.00 0.00 C ATOM 1563 CG ARG A 102 -12.879 -22.685 -22.162 1.00 0.00 C ATOM 1564 CD ARG A 102 -14.022 -23.175 -21.287 1.00 0.00 C ATOM 1565 NE ARG A 102 -14.632 -22.089 -20.525 1.00 0.00 N ATOM 1566 CZ ARG A 102 -15.434 -21.175 -21.061 1.00 0.00 C ATOM 1567 NH1 ARG A 102 -15.720 -21.217 -22.355 1.00 0.00 N ATOM 1568 NH2 ARG A 102 -15.951 -20.218 -20.302 1.00 0.00 N ATOM 0 H ARG A 102 -10.038 -24.360 -20.099 1.00 0.00 H new ATOM 0 HA ARG A 102 -11.609 -24.999 -22.179 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.659 -23.030 -20.439 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.871 -22.107 -21.704 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -12.990 -21.616 -22.341 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -12.926 -23.178 -23.133 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -14.779 -23.649 -21.912 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -13.652 -23.937 -20.600 1.00 0.00 H new ATOM 0 HE ARG A 102 -14.432 -22.029 -19.527 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -15.324 -21.952 -22.941 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -16.336 -20.514 -22.764 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -15.733 -20.183 -19.306 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -16.566 -19.517 -20.714 1.00 0.00 H new ATOM 1582 N ASN A 103 -10.169 -24.955 -24.238 1.00 0.00 N ATOM 1583 CA ASN A 103 -9.544 -24.822 -25.550 1.00 0.00 C ATOM 1584 C ASN A 103 -8.173 -24.163 -25.436 1.00 0.00 C ATOM 1585 O ASN A 103 -7.658 -23.605 -26.404 1.00 0.00 O ATOM 1586 CB ASN A 103 -10.439 -24.005 -26.483 1.00 0.00 C ATOM 1587 CG ASN A 103 -11.557 -24.834 -27.086 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -12.258 -25.558 -26.379 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -11.727 -24.732 -28.399 1.00 0.00 N ATOM 0 H ASN A 103 -10.598 -25.864 -24.065 1.00 0.00 H new ATOM 0 HA ASN A 103 -9.413 -25.821 -25.965 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -10.868 -23.169 -25.930 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -9.833 -23.581 -27.283 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -12.463 -25.267 -28.861 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -11.122 -24.119 -28.945 1.00 0.00 H new ATOM 1596 N GLY A 104 -7.587 -24.233 -24.244 1.00 0.00 N ATOM 1597 CA GLY A 104 -6.280 -23.639 -24.025 1.00 0.00 C ATOM 1598 C GLY A 104 -6.295 -22.131 -24.178 1.00 0.00 C ATOM 1599 O GLY A 104 -5.720 -21.589 -25.122 1.00 0.00 O ATOM 0 H GLY A 104 -7.993 -24.690 -23.427 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.931 -23.896 -23.025 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.568 -24.066 -24.731 1.00 0.00 H new ATOM 1603 N THR A 105 -6.958 -21.450 -23.248 1.00 0.00 N ATOM 1604 CA THR A 105 -7.048 -19.996 -23.285 1.00 0.00 C ATOM 1605 C THR A 105 -6.449 -19.376 -22.028 1.00 0.00 C ATOM 1606 O THR A 105 -6.750 -19.797 -20.911 1.00 0.00 O ATOM 1607 CB THR A 105 -8.508 -19.528 -23.428 1.00 0.00 C ATOM 1608 OG1 THR A 105 -9.396 -20.525 -22.911 1.00 0.00 O ATOM 1609 CG2 THR A 105 -8.846 -19.247 -24.885 1.00 0.00 C ATOM 0 H THR A 105 -7.440 -21.883 -22.460 1.00 0.00 H new ATOM 0 HA THR A 105 -6.481 -19.666 -24.155 1.00 0.00 H new ATOM 0 HB THR A 105 -8.628 -18.606 -22.859 1.00 0.00 H new ATOM 0 HG1 THR A 105 -9.434 -21.283 -23.531 1.00 0.00 H new ATOM 0 HG21 THR A 105 -9.882 -18.918 -24.961 1.00 0.00 H new ATOM 0 HG22 THR A 105 -8.188 -18.466 -25.267 1.00 0.00 H new ATOM 0 HG23 THR A 105 -8.710 -20.155 -25.472 1.00 0.00 H new ATOM 1617 N LYS A 106 -5.599 -18.372 -22.217 1.00 0.00 N ATOM 1618 CA LYS A 106 -4.957 -17.691 -21.098 1.00 0.00 C ATOM 1619 C LYS A 106 -5.979 -16.905 -20.282 1.00 0.00 C ATOM 1620 O LYS A 106 -7.119 -16.719 -20.709 1.00 0.00 O ATOM 1621 CB LYS A 106 -3.863 -16.751 -21.607 1.00 0.00 C ATOM 1622 CG LYS A 106 -2.505 -17.417 -21.745 1.00 0.00 C ATOM 1623 CD LYS A 106 -2.198 -17.762 -23.192 1.00 0.00 C ATOM 1624 CE LYS A 106 -0.781 -18.293 -23.350 1.00 0.00 C ATOM 1625 NZ LYS A 106 -0.691 -19.320 -24.425 1.00 0.00 N ATOM 0 H LYS A 106 -5.339 -18.012 -23.135 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.507 -18.447 -20.454 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.162 -16.350 -22.576 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -3.776 -15.905 -20.925 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -1.732 -16.754 -21.356 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -2.480 -18.324 -21.141 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -2.909 -18.508 -23.548 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -2.327 -16.876 -23.814 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -0.107 -17.467 -23.579 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -0.447 -18.725 -22.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 0.290 -19.657 -24.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -1.315 -20.119 -24.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -0.985 -18.901 -25.331 1.00 0.00 H new ATOM 1639 N LEU A 107 -5.563 -16.445 -19.107 1.00 0.00 N ATOM 1640 CA LEU A 107 -6.441 -15.677 -18.231 1.00 0.00 C ATOM 1641 C LEU A 107 -6.536 -14.226 -18.692 1.00 0.00 C ATOM 1642 O LEU A 107 -7.542 -13.810 -19.267 1.00 0.00 O ATOM 1643 CB LEU A 107 -5.933 -15.735 -16.790 1.00 0.00 C ATOM 1644 CG LEU A 107 -6.267 -14.528 -15.912 1.00 0.00 C ATOM 1645 CD1 LEU A 107 -7.676 -14.032 -16.199 1.00 0.00 C ATOM 1646 CD2 LEU A 107 -6.114 -14.881 -14.440 1.00 0.00 C ATOM 0 H LEU A 107 -4.623 -16.591 -18.739 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.436 -16.119 -18.276 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -6.343 -16.628 -16.317 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.850 -15.854 -16.812 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.567 -13.727 -16.148 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.896 -13.173 -15.565 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.752 -13.739 -17.246 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -8.391 -14.828 -15.992 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -6.356 -14.011 -13.830 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -6.790 -15.698 -14.190 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -5.086 -15.187 -14.244 1.00 0.00 H new ATOM 1658 N THR A 108 -5.480 -13.460 -18.437 1.00 0.00 N ATOM 1659 CA THR A 108 -5.443 -12.056 -18.826 1.00 0.00 C ATOM 1660 C THR A 108 -6.069 -11.849 -20.201 1.00 0.00 C ATOM 1661 O THR A 108 -6.550 -10.761 -20.517 1.00 0.00 O ATOM 1662 CB THR A 108 -4.001 -11.516 -18.845 1.00 0.00 C ATOM 1663 OG1 THR A 108 -4.011 -10.097 -19.043 1.00 0.00 O ATOM 1664 CG2 THR A 108 -3.189 -12.180 -19.947 1.00 0.00 C ATOM 0 H THR A 108 -4.639 -13.789 -17.963 1.00 0.00 H new ATOM 0 HA THR A 108 -6.019 -11.507 -18.081 1.00 0.00 H new ATOM 0 HB THR A 108 -3.538 -11.746 -17.885 1.00 0.00 H new ATOM 0 HG1 THR A 108 -3.090 -9.762 -19.052 1.00 0.00 H new ATOM 0 HG21 THR A 108 -2.174 -11.783 -19.941 1.00 0.00 H new ATOM 0 HG22 THR A 108 -3.158 -13.256 -19.778 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.652 -11.977 -20.913 1.00 0.00 H new ATOM 1672 N ASP A 109 -6.061 -12.900 -21.013 1.00 0.00 N ATOM 1673 CA ASP A 109 -6.630 -12.835 -22.354 1.00 0.00 C ATOM 1674 C ASP A 109 -8.154 -12.860 -22.299 1.00 0.00 C ATOM 1675 O ASP A 109 -8.822 -12.067 -22.964 1.00 0.00 O ATOM 1676 CB ASP A 109 -6.118 -13.997 -23.206 1.00 0.00 C ATOM 1677 CG ASP A 109 -5.502 -13.532 -24.510 1.00 0.00 C ATOM 1678 OD1 ASP A 109 -5.763 -12.379 -24.912 1.00 0.00 O ATOM 1679 OD2 ASP A 109 -4.758 -14.321 -25.130 1.00 0.00 O ATOM 0 H ASP A 109 -5.667 -13.808 -20.766 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.316 -11.896 -22.810 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.378 -14.561 -22.639 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.942 -14.678 -23.419 1.00 0.00 H new ATOM 1684 N ILE A 110 -8.697 -13.776 -21.505 1.00 0.00 N ATOM 1685 CA ILE A 110 -10.142 -13.904 -21.364 1.00 0.00 C ATOM 1686 C ILE A 110 -10.711 -12.790 -20.491 1.00 0.00 C ATOM 1687 O ILE A 110 -11.845 -12.351 -20.686 1.00 0.00 O ATOM 1688 CB ILE A 110 -10.530 -15.265 -20.756 1.00 0.00 C ATOM 1689 CG1 ILE A 110 -11.140 -16.171 -21.827 1.00 0.00 C ATOM 1690 CG2 ILE A 110 -11.502 -15.072 -19.602 1.00 0.00 C ATOM 1691 CD1 ILE A 110 -11.137 -17.637 -21.452 1.00 0.00 C ATOM 0 H ILE A 110 -8.158 -14.440 -20.949 1.00 0.00 H new ATOM 0 HA ILE A 110 -10.564 -13.829 -22.366 1.00 0.00 H new ATOM 0 HB ILE A 110 -9.630 -15.744 -20.371 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -12.166 -15.855 -22.017 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -10.588 -16.041 -22.758 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -11.767 -16.043 -19.183 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -11.035 -14.459 -18.831 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -12.402 -14.575 -19.964 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -11.584 -18.220 -22.258 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.112 -17.969 -21.290 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -11.713 -17.780 -20.538 1.00 0.00 H new ATOM 1703 N LEU A 111 -9.915 -12.335 -19.530 1.00 0.00 N ATOM 1704 CA LEU A 111 -10.337 -11.269 -18.627 1.00 0.00 C ATOM 1705 C LEU A 111 -10.336 -9.921 -19.340 1.00 0.00 C ATOM 1706 O LEU A 111 -11.230 -9.098 -19.137 1.00 0.00 O ATOM 1707 CB LEU A 111 -9.418 -11.214 -17.406 1.00 0.00 C ATOM 1708 CG LEU A 111 -9.831 -10.245 -16.298 1.00 0.00 C ATOM 1709 CD1 LEU A 111 -9.394 -8.828 -16.637 1.00 0.00 C ATOM 1710 CD2 LEU A 111 -11.335 -10.302 -16.073 1.00 0.00 C ATOM 0 H LEU A 111 -8.974 -12.687 -19.356 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.354 -11.485 -18.299 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -9.353 -12.215 -16.980 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.417 -10.945 -17.742 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.334 -10.545 -15.376 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -9.697 -8.153 -15.837 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -8.310 -8.798 -16.747 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -9.862 -8.517 -17.571 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.611 -9.606 -15.281 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.851 -10.028 -16.993 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -11.622 -11.313 -15.784 1.00 0.00 H new ATOM 1722 N THR A 112 -9.328 -9.700 -20.177 1.00 0.00 N ATOM 1723 CA THR A 112 -9.211 -8.452 -20.921 1.00 0.00 C ATOM 1724 C THR A 112 -10.225 -8.392 -22.058 1.00 0.00 C ATOM 1725 O THR A 112 -10.804 -7.341 -22.330 1.00 0.00 O ATOM 1726 CB THR A 112 -7.795 -8.274 -21.502 1.00 0.00 C ATOM 1727 OG1 THR A 112 -6.878 -7.926 -20.458 1.00 0.00 O ATOM 1728 CG2 THR A 112 -7.782 -7.197 -22.576 1.00 0.00 C ATOM 0 H THR A 112 -8.580 -10.370 -20.357 1.00 0.00 H new ATOM 0 HA THR A 112 -9.411 -7.645 -20.216 1.00 0.00 H new ATOM 0 HB THR A 112 -7.490 -9.218 -21.954 1.00 0.00 H new ATOM 0 HG1 THR A 112 -6.464 -8.740 -20.102 1.00 0.00 H new ATOM 0 HG21 THR A 112 -6.772 -7.089 -22.971 1.00 0.00 H new ATOM 0 HG22 THR A 112 -8.459 -7.479 -23.382 1.00 0.00 H new ATOM 0 HG23 THR A 112 -8.106 -6.250 -22.145 1.00 0.00 H new ATOM 1736 N GLU A 113 -10.435 -9.527 -22.718 1.00 0.00 N ATOM 1737 CA GLU A 113 -11.380 -9.602 -23.825 1.00 0.00 C ATOM 1738 C GLU A 113 -12.818 -9.597 -23.315 1.00 0.00 C ATOM 1739 O GLU A 113 -13.704 -9.006 -23.932 1.00 0.00 O ATOM 1740 CB GLU A 113 -11.127 -10.862 -24.656 1.00 0.00 C ATOM 1741 CG GLU A 113 -11.698 -10.789 -26.062 1.00 0.00 C ATOM 1742 CD GLU A 113 -10.920 -9.845 -26.959 1.00 0.00 C ATOM 1743 OE1 GLU A 113 -9.955 -10.303 -27.606 1.00 0.00 O ATOM 1744 OE2 GLU A 113 -11.276 -8.649 -27.013 1.00 0.00 O ATOM 0 H GLU A 113 -9.964 -10.406 -22.505 1.00 0.00 H new ATOM 0 HA GLU A 113 -11.233 -8.724 -24.454 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -10.053 -11.037 -24.718 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -11.560 -11.720 -24.141 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -11.698 -11.786 -26.503 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.737 -10.463 -26.012 1.00 0.00 H new ATOM 1751 N GLU A 114 -13.041 -10.260 -22.184 1.00 0.00 N ATOM 1752 CA GLU A 114 -14.372 -10.332 -21.592 1.00 0.00 C ATOM 1753 C GLU A 114 -14.795 -8.975 -21.037 1.00 0.00 C ATOM 1754 O GLU A 114 -15.927 -8.535 -21.237 1.00 0.00 O ATOM 1755 CB GLU A 114 -14.403 -11.382 -20.479 1.00 0.00 C ATOM 1756 CG GLU A 114 -15.790 -11.626 -19.911 1.00 0.00 C ATOM 1757 CD GLU A 114 -15.792 -12.656 -18.798 1.00 0.00 C ATOM 1758 OE1 GLU A 114 -14.695 -13.073 -18.373 1.00 0.00 O ATOM 1759 OE2 GLU A 114 -16.892 -13.044 -18.352 1.00 0.00 O ATOM 0 H GLU A 114 -12.318 -10.754 -21.660 1.00 0.00 H new ATOM 0 HA GLU A 114 -15.074 -10.620 -22.374 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -14.008 -12.321 -20.866 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -13.740 -11.065 -19.674 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -16.194 -10.687 -19.533 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -16.452 -11.959 -20.710 1.00 0.00 H new ATOM 1766 N VAL A 115 -13.877 -8.316 -20.337 1.00 0.00 N ATOM 1767 CA VAL A 115 -14.153 -7.009 -19.753 1.00 0.00 C ATOM 1768 C VAL A 115 -14.273 -5.939 -20.833 1.00 0.00 C ATOM 1769 O VAL A 115 -15.031 -4.981 -20.689 1.00 0.00 O ATOM 1770 CB VAL A 115 -13.054 -6.596 -18.756 1.00 0.00 C ATOM 1771 CG1 VAL A 115 -12.971 -7.592 -17.610 1.00 0.00 C ATOM 1772 CG2 VAL A 115 -11.713 -6.471 -19.464 1.00 0.00 C ATOM 0 H VAL A 115 -12.935 -8.666 -20.161 1.00 0.00 H new ATOM 0 HA VAL A 115 -15.101 -7.093 -19.222 1.00 0.00 H new ATOM 0 HB VAL A 115 -13.312 -5.622 -18.340 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -12.189 -7.284 -16.916 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -13.927 -7.626 -17.088 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -12.737 -8.581 -18.004 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -10.948 -6.179 -18.745 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -11.446 -7.430 -19.909 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -11.784 -5.715 -20.246 1.00 0.00 H new ATOM 1782 N GLU A 116 -13.519 -6.110 -21.914 1.00 0.00 N ATOM 1783 CA GLU A 116 -13.541 -5.158 -23.018 1.00 0.00 C ATOM 1784 C GLU A 116 -14.862 -5.236 -23.778 1.00 0.00 C ATOM 1785 O GLU A 116 -15.465 -4.214 -24.105 1.00 0.00 O ATOM 1786 CB GLU A 116 -12.375 -5.423 -23.973 1.00 0.00 C ATOM 1787 CG GLU A 116 -12.151 -4.310 -24.984 1.00 0.00 C ATOM 1788 CD GLU A 116 -10.805 -3.633 -24.816 1.00 0.00 C ATOM 1789 OE1 GLU A 116 -10.524 -3.135 -23.706 1.00 0.00 O ATOM 1790 OE2 GLU A 116 -10.032 -3.600 -25.797 1.00 0.00 O ATOM 0 H GLU A 116 -12.886 -6.898 -22.049 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.440 -4.156 -22.601 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.464 -5.562 -23.391 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -12.558 -6.356 -24.507 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.225 -4.719 -25.992 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -12.942 -3.567 -24.883 1.00 0.00 H new ATOM 1797 N LYS A 117 -15.306 -6.457 -24.056 1.00 0.00 N ATOM 1798 CA LYS A 117 -16.556 -6.672 -24.776 1.00 0.00 C ATOM 1799 C LYS A 117 -17.747 -6.626 -23.825 1.00 0.00 C ATOM 1800 O LYS A 117 -18.897 -6.564 -24.258 1.00 0.00 O ATOM 1801 CB LYS A 117 -16.523 -8.017 -25.506 1.00 0.00 C ATOM 1802 CG LYS A 117 -15.373 -8.148 -26.489 1.00 0.00 C ATOM 1803 CD LYS A 117 -15.206 -9.582 -26.964 1.00 0.00 C ATOM 1804 CE LYS A 117 -16.085 -9.875 -28.170 1.00 0.00 C ATOM 1805 NZ LYS A 117 -15.306 -10.463 -29.294 1.00 0.00 N ATOM 0 H LYS A 117 -14.818 -7.314 -23.793 1.00 0.00 H new ATOM 0 HA LYS A 117 -16.667 -5.871 -25.507 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -16.454 -8.818 -24.770 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -17.463 -8.154 -26.040 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -15.550 -7.498 -27.346 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -14.450 -7.810 -26.018 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -14.162 -9.762 -27.221 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -15.458 -10.266 -26.154 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -16.881 -10.562 -27.881 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -16.564 -8.954 -28.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -15.941 -10.648 -30.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -14.563 -9.797 -29.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -14.870 -11.355 -28.985 1.00 0.00 H new ATOM 1819 N ALA A 118 -17.463 -6.655 -22.527 1.00 0.00 N ATOM 1820 CA ALA A 118 -18.511 -6.614 -21.515 1.00 0.00 C ATOM 1821 C ALA A 118 -18.766 -5.185 -21.046 1.00 0.00 C ATOM 1822 O ALA A 118 -19.855 -4.863 -20.570 1.00 0.00 O ATOM 1823 CB ALA A 118 -18.141 -7.500 -20.335 1.00 0.00 C ATOM 0 H ALA A 118 -16.516 -6.707 -22.152 1.00 0.00 H new ATOM 0 HA ALA A 118 -19.430 -6.991 -21.964 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -18.933 -7.459 -19.587 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -18.017 -8.528 -20.676 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -17.208 -7.149 -19.895 1.00 0.00 H new ATOM 1829 N ILE A 119 -17.755 -4.333 -21.185 1.00 0.00 N ATOM 1830 CA ILE A 119 -17.871 -2.939 -20.776 1.00 0.00 C ATOM 1831 C ILE A 119 -18.118 -2.032 -21.977 1.00 0.00 C ATOM 1832 O ILE A 119 -18.773 -0.996 -21.862 1.00 0.00 O ATOM 1833 CB ILE A 119 -16.606 -2.462 -20.038 1.00 0.00 C ATOM 1834 CG1 ILE A 119 -16.569 -3.035 -18.620 1.00 0.00 C ATOM 1835 CG2 ILE A 119 -16.556 -0.942 -20.002 1.00 0.00 C ATOM 1836 CD1 ILE A 119 -15.355 -3.896 -18.348 1.00 0.00 C ATOM 0 H ILE A 119 -16.848 -4.584 -21.577 1.00 0.00 H new ATOM 0 HA ILE A 119 -18.722 -2.879 -20.098 1.00 0.00 H new ATOM 0 HB ILE A 119 -15.731 -2.823 -20.578 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -16.589 -2.213 -17.904 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -17.469 -3.627 -18.452 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -15.657 -0.620 -19.477 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -16.540 -0.554 -21.021 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -17.435 -0.561 -19.482 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -15.395 -4.268 -17.324 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -15.344 -4.738 -19.040 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -14.451 -3.303 -18.483 1.00 0.00 H new ATOM 1848 N SER A 120 -17.591 -2.431 -23.130 1.00 0.00 N ATOM 1849 CA SER A 120 -17.752 -1.653 -24.353 1.00 0.00 C ATOM 1850 C SER A 120 -19.011 -2.077 -25.104 1.00 0.00 C ATOM 1851 O SER A 120 -19.582 -1.301 -25.871 1.00 0.00 O ATOM 1852 CB SER A 120 -16.527 -1.820 -25.254 1.00 0.00 C ATOM 1853 OG SER A 120 -16.362 -0.698 -26.103 1.00 0.00 O ATOM 0 H SER A 120 -17.049 -3.288 -23.243 1.00 0.00 H new ATOM 0 HA SER A 120 -17.850 -0.603 -24.076 1.00 0.00 H new ATOM 0 HB2 SER A 120 -15.635 -1.950 -24.641 1.00 0.00 H new ATOM 0 HB3 SER A 120 -16.634 -2.723 -25.856 1.00 0.00 H new ATOM 0 HG SER A 120 -15.572 -0.828 -26.668 1.00 0.00 H new ATOM 1859 N LYS A 121 -19.438 -3.315 -24.878 1.00 0.00 N ATOM 1860 CA LYS A 121 -20.630 -3.844 -25.531 1.00 0.00 C ATOM 1861 C LYS A 121 -21.761 -2.820 -25.512 1.00 0.00 C ATOM 1862 O LYS A 121 -22.678 -2.879 -26.331 1.00 0.00 O ATOM 1863 CB LYS A 121 -21.083 -5.133 -24.842 1.00 0.00 C ATOM 1864 CG LYS A 121 -22.588 -5.224 -24.651 1.00 0.00 C ATOM 1865 CD LYS A 121 -22.987 -6.529 -23.982 1.00 0.00 C ATOM 1866 CE LYS A 121 -24.498 -6.701 -23.952 1.00 0.00 C ATOM 1867 NZ LYS A 121 -24.990 -7.479 -25.122 1.00 0.00 N ATOM 0 H LYS A 121 -18.976 -3.971 -24.248 1.00 0.00 H new ATOM 0 HA LYS A 121 -20.379 -4.062 -26.569 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -20.748 -5.987 -25.431 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -20.597 -5.205 -23.869 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -22.930 -4.384 -24.046 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -23.084 -5.143 -25.618 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -22.535 -7.365 -24.515 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -22.597 -6.552 -22.964 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -24.788 -7.207 -23.031 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -24.975 -5.721 -23.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -26.024 -7.575 -25.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -24.736 -6.983 -26.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -24.554 -8.423 -25.119 1.00 0.00 H new ATOM 1881 N SER A 122 -21.688 -1.882 -24.573 1.00 0.00 N ATOM 1882 CA SER A 122 -22.707 -0.847 -24.447 1.00 0.00 C ATOM 1883 C SER A 122 -22.410 0.325 -25.378 1.00 0.00 C ATOM 1884 O SER A 122 -23.267 0.750 -26.151 1.00 0.00 O ATOM 1885 CB SER A 122 -22.789 -0.356 -23.000 1.00 0.00 C ATOM 1886 OG SER A 122 -24.136 -0.214 -22.585 1.00 0.00 O ATOM 0 H SER A 122 -20.934 -1.818 -23.889 1.00 0.00 H new ATOM 0 HA SER A 122 -23.666 -1.280 -24.731 1.00 0.00 H new ATOM 0 HB2 SER A 122 -22.276 -1.059 -22.344 1.00 0.00 H new ATOM 0 HB3 SER A 122 -22.274 0.600 -22.907 1.00 0.00 H new ATOM 0 HG SER A 122 -24.161 0.099 -21.657 1.00 0.00 H new ATOM 1892 N GLN A 123 -21.188 0.841 -25.296 1.00 0.00 N ATOM 1893 CA GLN A 123 -20.776 1.964 -26.130 1.00 0.00 C ATOM 1894 C GLN A 123 -19.615 1.572 -27.038 1.00 0.00 C ATOM 1895 O GLN A 123 -19.788 1.394 -28.244 1.00 0.00 O ATOM 1896 CB GLN A 123 -20.377 3.156 -25.258 1.00 0.00 C ATOM 1897 CG GLN A 123 -19.040 2.977 -24.558 1.00 0.00 C ATOM 1898 CD GLN A 123 -18.195 4.236 -24.584 1.00 0.00 C ATOM 1899 OE1 GLN A 123 -18.712 5.346 -24.460 1.00 0.00 O ATOM 1900 NE2 GLN A 123 -16.887 4.068 -24.745 1.00 0.00 N ATOM 0 H GLN A 123 -20.466 0.500 -24.661 1.00 0.00 H new ATOM 0 HA GLN A 123 -21.622 2.248 -26.756 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -20.336 4.052 -25.878 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -21.151 3.322 -24.508 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -19.213 2.681 -23.523 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -18.490 2.165 -25.034 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -16.502 3.129 -24.844 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -16.268 4.878 -24.770 1.00 0.00 H new