USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=22 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= -1.93! C(o=-2.4!,f=-2!) USER MOD Set 1.2: A 78 GLN : amide:sc= -0.437 X(o=-2.4,f=-2) USER MOD Set 2.1: A 22 TYR OH : rot 30:sc= -0.0237 USER MOD Set 2.2: A 72 LYS NZ :NH3+ 179:sc= 2.16 (180deg=0.964) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 HIS : no HD1:sc= -0.0119 X(o=-0.012,f=0) USER MOD Single : A 29 TYR OH : rot 150:sc= -0.293 USER MOD Single : A 32 HIS : no HE2:sc= -2.62! C(o=-2.6!,f=-3.7!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 HIS : no HE2:sc= -4.04! C(o=-4!,f=-8.3!) USER MOD Single : A 47 CYS SG : rot 180:sc= -2.65! USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 58 MET CE :methyl -131:sc= -7.36! (180deg=-8.76!) USER MOD Single : A 59 THR OG1 : rot 180:sc= -0.174 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 111:sc= -1.07 USER MOD Single : A 71 ASN : amide:sc= -6.09! C(o=-6.1!,f=-10!) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= -0.501 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= -0.504 K(o=-0.5,f=-4.2!) USER MOD Single : A 100 SER OG : rot 82:sc= 1.16 USER MOD Single : A 103 ASN : amide:sc= -0.26 X(o=-0.26,f=-0.029) USER MOD Single : A 105 THR OG1 : rot 59:sc= 1.04 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 180:sc= 0 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+ 167:sc= 0 (180deg=-0.18) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.0129 X(o=-0.013,f=0) USER MOD ----------------------------------------------------------------- ATOM 251 N PRO A 18 9.882 -24.792 -11.583 1.00 0.00 N ATOM 252 CA PRO A 18 10.690 -23.661 -11.116 1.00 0.00 C ATOM 253 C PRO A 18 9.945 -22.794 -10.106 1.00 0.00 C ATOM 254 O PRO A 18 9.395 -21.749 -10.456 1.00 0.00 O ATOM 255 CB PRO A 18 10.967 -22.870 -12.397 1.00 0.00 C ATOM 256 CG PRO A 18 9.841 -23.217 -13.308 1.00 0.00 C ATOM 257 CD PRO A 18 9.475 -24.641 -12.990 1.00 0.00 C ATOM 0 HA PRO A 18 11.591 -23.990 -10.598 1.00 0.00 H new ATOM 0 HB2 PRO A 18 11.001 -21.798 -12.201 1.00 0.00 H new ATOM 0 HB3 PRO A 18 11.928 -23.145 -12.832 1.00 0.00 H new ATOM 0 HG2 PRO A 18 8.992 -22.551 -13.151 1.00 0.00 H new ATOM 0 HG3 PRO A 18 10.138 -23.114 -14.352 1.00 0.00 H new ATOM 0 HD2 PRO A 18 8.408 -24.820 -13.121 1.00 0.00 H new ATOM 0 HD3 PRO A 18 9.998 -25.345 -13.637 1.00 0.00 H new ATOM 265 N LEU A 19 9.932 -23.234 -8.853 1.00 0.00 N ATOM 266 CA LEU A 19 9.255 -22.498 -7.791 1.00 0.00 C ATOM 267 C LEU A 19 9.504 -20.999 -7.923 1.00 0.00 C ATOM 268 O LEU A 19 8.576 -20.196 -7.833 1.00 0.00 O ATOM 269 CB LEU A 19 9.730 -22.987 -6.422 1.00 0.00 C ATOM 270 CG LEU A 19 9.274 -24.388 -6.014 1.00 0.00 C ATOM 271 CD1 LEU A 19 10.432 -25.174 -5.419 1.00 0.00 C ATOM 272 CD2 LEU A 19 8.118 -24.308 -5.028 1.00 0.00 C ATOM 0 H LEU A 19 10.382 -24.097 -8.547 1.00 0.00 H new ATOM 0 HA LEU A 19 8.184 -22.679 -7.883 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.820 -22.963 -6.408 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.386 -22.280 -5.667 1.00 0.00 H new ATOM 0 HG LEU A 19 8.928 -24.910 -6.906 1.00 0.00 H new ATOM 0 HD11 LEU A 19 10.089 -26.169 -5.134 1.00 0.00 H new ATOM 0 HD12 LEU A 19 11.229 -25.263 -6.157 1.00 0.00 H new ATOM 0 HD13 LEU A 19 10.810 -24.655 -4.538 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.807 -25.315 -4.749 1.00 0.00 H new ATOM 0 HD22 LEU A 19 8.436 -23.767 -4.137 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.281 -23.785 -5.490 1.00 0.00 H new ATOM 284 N GLU A 20 10.763 -20.631 -8.140 1.00 0.00 N ATOM 285 CA GLU A 20 11.133 -19.228 -8.286 1.00 0.00 C ATOM 286 C GLU A 20 10.348 -18.573 -9.418 1.00 0.00 C ATOM 287 O GLU A 20 9.862 -17.449 -9.284 1.00 0.00 O ATOM 288 CB GLU A 20 12.635 -19.099 -8.551 1.00 0.00 C ATOM 289 CG GLU A 20 13.497 -19.442 -7.348 1.00 0.00 C ATOM 290 CD GLU A 20 14.593 -18.422 -7.106 1.00 0.00 C ATOM 291 OE1 GLU A 20 15.176 -17.932 -8.095 1.00 0.00 O ATOM 292 OE2 GLU A 20 14.867 -18.114 -5.927 1.00 0.00 O ATOM 0 H GLU A 20 11.543 -21.284 -8.218 1.00 0.00 H new ATOM 0 HA GLU A 20 10.890 -18.716 -7.355 1.00 0.00 H new ATOM 0 HB2 GLU A 20 12.907 -19.753 -9.380 1.00 0.00 H new ATOM 0 HB3 GLU A 20 12.854 -18.078 -8.865 1.00 0.00 H new ATOM 0 HG2 GLU A 20 12.867 -19.510 -6.461 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.946 -20.424 -7.496 1.00 0.00 H new ATOM 299 N LYS A 21 10.227 -19.283 -10.535 1.00 0.00 N ATOM 300 CA LYS A 21 9.500 -18.773 -11.692 1.00 0.00 C ATOM 301 C LYS A 21 8.001 -18.727 -11.416 1.00 0.00 C ATOM 302 O LYS A 21 7.283 -17.896 -11.972 1.00 0.00 O ATOM 303 CB LYS A 21 9.777 -19.645 -12.918 1.00 0.00 C ATOM 304 CG LYS A 21 11.244 -19.697 -13.310 1.00 0.00 C ATOM 305 CD LYS A 21 11.694 -18.398 -13.957 1.00 0.00 C ATOM 306 CE LYS A 21 12.929 -18.604 -14.821 1.00 0.00 C ATOM 307 NZ LYS A 21 12.576 -19.067 -16.192 1.00 0.00 N ATOM 0 H LYS A 21 10.623 -20.214 -10.664 1.00 0.00 H new ATOM 0 HA LYS A 21 9.846 -17.758 -11.889 1.00 0.00 H new ATOM 0 HB2 LYS A 21 9.427 -20.658 -12.719 1.00 0.00 H new ATOM 0 HB3 LYS A 21 9.198 -19.267 -13.760 1.00 0.00 H new ATOM 0 HG2 LYS A 21 11.851 -19.894 -12.426 1.00 0.00 H new ATOM 0 HG3 LYS A 21 11.408 -20.524 -14.000 1.00 0.00 H new ATOM 0 HD2 LYS A 21 10.885 -17.995 -14.567 1.00 0.00 H new ATOM 0 HD3 LYS A 21 11.909 -17.660 -13.184 1.00 0.00 H new ATOM 0 HE2 LYS A 21 13.487 -17.670 -14.886 1.00 0.00 H new ATOM 0 HE3 LYS A 21 13.585 -19.335 -14.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 13.445 -19.196 -16.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 12.066 -19.971 -16.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 11.971 -18.358 -16.653 1.00 0.00 H new ATOM 321 N TYR A 22 7.535 -19.624 -10.553 1.00 0.00 N ATOM 322 CA TYR A 22 6.121 -19.686 -10.204 1.00 0.00 C ATOM 323 C TYR A 22 5.720 -18.493 -9.341 1.00 0.00 C ATOM 324 O TYR A 22 4.711 -17.835 -9.600 1.00 0.00 O ATOM 325 CB TYR A 22 5.813 -20.990 -9.466 1.00 0.00 C ATOM 326 CG TYR A 22 4.872 -20.815 -8.295 1.00 0.00 C ATOM 327 CD1 TYR A 22 5.325 -20.304 -7.085 1.00 0.00 C ATOM 328 CD2 TYR A 22 3.531 -21.162 -8.398 1.00 0.00 C ATOM 329 CE1 TYR A 22 4.470 -20.144 -6.012 1.00 0.00 C ATOM 330 CE2 TYR A 22 2.668 -21.003 -7.331 1.00 0.00 C ATOM 331 CZ TYR A 22 3.142 -20.494 -6.140 1.00 0.00 C ATOM 332 OH TYR A 22 2.286 -20.336 -5.075 1.00 0.00 O ATOM 0 H TYR A 22 8.116 -20.318 -10.083 1.00 0.00 H new ATOM 0 HA TYR A 22 5.543 -19.654 -11.128 1.00 0.00 H new ATOM 0 HB2 TYR A 22 5.378 -21.701 -10.168 1.00 0.00 H new ATOM 0 HB3 TYR A 22 6.747 -21.425 -9.109 1.00 0.00 H new ATOM 0 HD1 TYR A 22 6.364 -20.027 -6.982 1.00 0.00 H new ATOM 0 HD2 TYR A 22 3.157 -21.563 -9.328 1.00 0.00 H new ATOM 0 HE1 TYR A 22 4.839 -19.747 -5.078 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.628 -21.276 -7.429 1.00 0.00 H new ATOM 0 HH TYR A 22 2.586 -19.584 -4.523 1.00 0.00 H new ATOM 342 N HIS A 23 6.518 -18.219 -8.314 1.00 0.00 N ATOM 343 CA HIS A 23 6.248 -17.105 -7.412 1.00 0.00 C ATOM 344 C HIS A 23 6.487 -15.770 -8.111 1.00 0.00 C ATOM 345 O HIS A 23 5.872 -14.761 -7.768 1.00 0.00 O ATOM 346 CB HIS A 23 7.128 -17.206 -6.166 1.00 0.00 C ATOM 347 CG HIS A 23 6.428 -16.803 -4.904 1.00 0.00 C ATOM 348 ND1 HIS A 23 6.485 -17.545 -3.743 1.00 0.00 N ATOM 349 CD2 HIS A 23 5.654 -15.729 -4.625 1.00 0.00 C ATOM 350 CE1 HIS A 23 5.774 -16.944 -2.805 1.00 0.00 C ATOM 351 NE2 HIS A 23 5.260 -15.840 -3.315 1.00 0.00 N ATOM 0 H HIS A 23 7.357 -18.753 -8.086 1.00 0.00 H new ATOM 0 HA HIS A 23 5.201 -17.157 -7.114 1.00 0.00 H new ATOM 0 HB2 HIS A 23 7.482 -18.232 -6.064 1.00 0.00 H new ATOM 0 HB3 HIS A 23 8.008 -16.577 -6.301 1.00 0.00 H new ATOM 0 HD2 HIS A 23 5.394 -14.932 -5.306 1.00 0.00 H new ATOM 0 HE1 HIS A 23 5.637 -17.296 -1.793 1.00 0.00 H new ATOM 0 HE2 HIS A 23 4.666 -15.177 -2.816 1.00 0.00 H new ATOM 359 N GLU A 24 7.384 -15.774 -9.093 1.00 0.00 N ATOM 360 CA GLU A 24 7.704 -14.562 -9.838 1.00 0.00 C ATOM 361 C GLU A 24 6.574 -14.200 -10.798 1.00 0.00 C ATOM 362 O GLU A 24 6.200 -13.034 -10.920 1.00 0.00 O ATOM 363 CB GLU A 24 9.009 -14.745 -10.615 1.00 0.00 C ATOM 364 CG GLU A 24 10.234 -14.231 -9.877 1.00 0.00 C ATOM 365 CD GLU A 24 11.485 -14.260 -10.733 1.00 0.00 C ATOM 366 OE1 GLU A 24 11.595 -13.424 -11.654 1.00 0.00 O ATOM 367 OE2 GLU A 24 12.356 -15.119 -10.480 1.00 0.00 O ATOM 0 H GLU A 24 7.901 -16.602 -9.390 1.00 0.00 H new ATOM 0 HA GLU A 24 7.826 -13.748 -9.124 1.00 0.00 H new ATOM 0 HB2 GLU A 24 9.146 -15.804 -10.835 1.00 0.00 H new ATOM 0 HB3 GLU A 24 8.928 -14.228 -11.571 1.00 0.00 H new ATOM 0 HG2 GLU A 24 10.050 -13.210 -9.543 1.00 0.00 H new ATOM 0 HG3 GLU A 24 10.395 -14.835 -8.984 1.00 0.00 H new ATOM 374 N GLU A 25 6.036 -15.208 -11.478 1.00 0.00 N ATOM 375 CA GLU A 25 4.951 -14.995 -12.428 1.00 0.00 C ATOM 376 C GLU A 25 3.656 -14.637 -11.704 1.00 0.00 C ATOM 377 O GLU A 25 3.050 -13.600 -11.971 1.00 0.00 O ATOM 378 CB GLU A 25 4.740 -16.246 -13.284 1.00 0.00 C ATOM 379 CG GLU A 25 5.899 -16.546 -14.219 1.00 0.00 C ATOM 380 CD GLU A 25 5.780 -15.822 -15.546 1.00 0.00 C ATOM 381 OE1 GLU A 25 4.770 -15.117 -15.750 1.00 0.00 O ATOM 382 OE2 GLU A 25 6.699 -15.961 -16.382 1.00 0.00 O ATOM 0 H GLU A 25 6.334 -16.179 -11.388 1.00 0.00 H new ATOM 0 HA GLU A 25 5.227 -14.163 -13.075 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.582 -17.102 -12.628 1.00 0.00 H new ATOM 0 HB3 GLU A 25 3.831 -16.124 -13.873 1.00 0.00 H new ATOM 0 HG2 GLU A 25 6.834 -16.261 -13.736 1.00 0.00 H new ATOM 0 HG3 GLU A 25 5.948 -17.620 -14.398 1.00 0.00 H new ATOM 389 N ALA A 26 3.239 -15.503 -10.787 1.00 0.00 N ATOM 390 CA ALA A 26 2.018 -15.278 -10.023 1.00 0.00 C ATOM 391 C ALA A 26 2.083 -13.960 -9.260 1.00 0.00 C ATOM 392 O ALA A 26 1.100 -13.221 -9.192 1.00 0.00 O ATOM 393 CB ALA A 26 1.775 -16.434 -9.064 1.00 0.00 C ATOM 0 H ALA A 26 3.729 -16.367 -10.555 1.00 0.00 H new ATOM 0 HA ALA A 26 1.185 -15.221 -10.724 1.00 0.00 H new ATOM 0 HB1 ALA A 26 0.860 -16.253 -8.500 1.00 0.00 H new ATOM 0 HB2 ALA A 26 1.675 -17.361 -9.629 1.00 0.00 H new ATOM 0 HB3 ALA A 26 2.615 -16.518 -8.375 1.00 0.00 H new ATOM 399 N ASP A 27 3.246 -13.670 -8.686 1.00 0.00 N ATOM 400 CA ASP A 27 3.439 -12.440 -7.928 1.00 0.00 C ATOM 401 C ASP A 27 3.317 -11.218 -8.833 1.00 0.00 C ATOM 402 O ASP A 27 2.635 -10.250 -8.498 1.00 0.00 O ATOM 403 CB ASP A 27 4.806 -12.448 -7.242 1.00 0.00 C ATOM 404 CG ASP A 27 5.091 -11.155 -6.503 1.00 0.00 C ATOM 405 OD1 ASP A 27 4.512 -10.953 -5.415 1.00 0.00 O ATOM 406 OD2 ASP A 27 5.893 -10.345 -7.013 1.00 0.00 O ATOM 0 H ASP A 27 4.069 -14.271 -8.732 1.00 0.00 H new ATOM 0 HA ASP A 27 2.660 -12.385 -7.168 1.00 0.00 H new ATOM 0 HB2 ASP A 27 4.853 -13.281 -6.541 1.00 0.00 H new ATOM 0 HB3 ASP A 27 5.583 -12.615 -7.988 1.00 0.00 H new ATOM 411 N ASP A 28 3.984 -11.271 -9.981 1.00 0.00 N ATOM 412 CA ASP A 28 3.951 -10.169 -10.936 1.00 0.00 C ATOM 413 C ASP A 28 2.572 -10.048 -11.578 1.00 0.00 C ATOM 414 O ASP A 28 2.158 -8.961 -11.983 1.00 0.00 O ATOM 415 CB ASP A 28 5.015 -10.369 -12.016 1.00 0.00 C ATOM 416 CG ASP A 28 6.414 -10.076 -11.512 1.00 0.00 C ATOM 417 OD1 ASP A 28 6.540 -9.519 -10.401 1.00 0.00 O ATOM 418 OD2 ASP A 28 7.384 -10.402 -12.228 1.00 0.00 O ATOM 0 H ASP A 28 4.554 -12.065 -10.273 1.00 0.00 H new ATOM 0 HA ASP A 28 4.163 -9.246 -10.396 1.00 0.00 H new ATOM 0 HB2 ASP A 28 4.971 -11.396 -12.380 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.794 -9.721 -12.864 1.00 0.00 H new ATOM 423 N TYR A 29 1.867 -11.170 -11.669 1.00 0.00 N ATOM 424 CA TYR A 29 0.537 -11.190 -12.266 1.00 0.00 C ATOM 425 C TYR A 29 -0.471 -10.473 -11.373 1.00 0.00 C ATOM 426 O TYR A 29 -1.220 -9.609 -11.832 1.00 0.00 O ATOM 427 CB TYR A 29 0.086 -12.632 -12.508 1.00 0.00 C ATOM 428 CG TYR A 29 -0.687 -12.817 -13.794 1.00 0.00 C ATOM 429 CD1 TYR A 29 -1.334 -11.746 -14.398 1.00 0.00 C ATOM 430 CD2 TYR A 29 -0.771 -14.062 -14.405 1.00 0.00 C ATOM 431 CE1 TYR A 29 -2.042 -11.910 -15.573 1.00 0.00 C ATOM 432 CE2 TYR A 29 -1.475 -14.235 -15.580 1.00 0.00 C ATOM 433 CZ TYR A 29 -2.109 -13.156 -16.160 1.00 0.00 C ATOM 434 OH TYR A 29 -2.813 -13.324 -17.331 1.00 0.00 O ATOM 0 H TYR A 29 2.194 -12.077 -11.337 1.00 0.00 H new ATOM 0 HA TYR A 29 0.586 -10.667 -13.221 1.00 0.00 H new ATOM 0 HB2 TYR A 29 0.962 -13.280 -12.524 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -0.534 -12.955 -11.672 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -1.283 -10.769 -13.941 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -0.277 -14.909 -13.953 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -2.540 -11.067 -16.029 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -1.529 -15.210 -16.042 1.00 0.00 H new ATOM 0 HH TYR A 29 -2.409 -14.047 -17.855 1.00 0.00 H new ATOM 444 N LEU A 30 -0.485 -10.837 -10.096 1.00 0.00 N ATOM 445 CA LEU A 30 -1.400 -10.229 -9.137 1.00 0.00 C ATOM 446 C LEU A 30 -1.061 -8.758 -8.918 1.00 0.00 C ATOM 447 O LEU A 30 -1.926 -7.888 -9.026 1.00 0.00 O ATOM 448 CB LEU A 30 -1.347 -10.980 -7.805 1.00 0.00 C ATOM 449 CG LEU A 30 -1.454 -12.503 -7.888 1.00 0.00 C ATOM 450 CD1 LEU A 30 -0.378 -13.161 -7.039 1.00 0.00 C ATOM 451 CD2 LEU A 30 -2.837 -12.965 -7.453 1.00 0.00 C ATOM 0 H LEU A 30 0.127 -11.551 -9.700 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.409 -10.294 -9.544 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.411 -10.728 -7.306 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.155 -10.613 -7.172 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.303 -12.803 -8.925 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.470 -14.245 -7.111 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.605 -12.856 -7.397 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.497 -12.855 -6.000 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.895 -14.051 -7.518 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.018 -12.653 -6.424 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.590 -12.522 -8.104 1.00 0.00 H new ATOM 463 N ASP A 31 0.203 -8.487 -8.611 1.00 0.00 N ATOM 464 CA ASP A 31 0.658 -7.121 -8.381 1.00 0.00 C ATOM 465 C ASP A 31 0.300 -6.222 -9.561 1.00 0.00 C ATOM 466 O ASP A 31 -0.233 -5.127 -9.381 1.00 0.00 O ATOM 467 CB ASP A 31 2.169 -7.096 -8.145 1.00 0.00 C ATOM 468 CG ASP A 31 2.524 -6.814 -6.698 1.00 0.00 C ATOM 469 OD1 ASP A 31 1.892 -7.415 -5.804 1.00 0.00 O ATOM 470 OD2 ASP A 31 3.435 -5.994 -6.461 1.00 0.00 O ATOM 0 H ASP A 31 0.931 -9.195 -8.516 1.00 0.00 H new ATOM 0 HA ASP A 31 0.153 -6.742 -7.492 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.596 -8.054 -8.441 1.00 0.00 H new ATOM 0 HB3 ASP A 31 2.621 -6.336 -8.782 1.00 0.00 H new ATOM 475 N HIS A 32 0.598 -6.693 -10.768 1.00 0.00 N ATOM 476 CA HIS A 32 0.308 -5.931 -11.978 1.00 0.00 C ATOM 477 C HIS A 32 -1.195 -5.858 -12.227 1.00 0.00 C ATOM 478 O HIS A 32 -1.680 -4.950 -12.902 1.00 0.00 O ATOM 479 CB HIS A 32 1.006 -6.563 -13.182 1.00 0.00 C ATOM 480 CG HIS A 32 2.499 -6.450 -13.137 1.00 0.00 C ATOM 481 ND1 HIS A 32 3.343 -7.438 -13.599 1.00 0.00 N ATOM 482 CD2 HIS A 32 3.298 -5.457 -12.681 1.00 0.00 C ATOM 483 CE1 HIS A 32 4.597 -7.058 -13.429 1.00 0.00 C ATOM 484 NE2 HIS A 32 4.597 -5.859 -12.874 1.00 0.00 N ATOM 0 H HIS A 32 1.040 -7.597 -10.934 1.00 0.00 H new ATOM 0 HA HIS A 32 0.685 -4.918 -11.839 1.00 0.00 H new ATOM 0 HB2 HIS A 32 0.731 -7.616 -13.239 1.00 0.00 H new ATOM 0 HB3 HIS A 32 0.641 -6.089 -14.093 1.00 0.00 H new ATOM 0 HD1 HIS A 32 3.046 -8.324 -14.008 1.00 0.00 H new ATOM 0 HD2 HIS A 32 2.974 -4.523 -12.246 1.00 0.00 H new ATOM 0 HE1 HIS A 32 5.473 -7.630 -13.698 1.00 0.00 H new ATOM 492 N LEU A 33 -1.928 -6.821 -11.678 1.00 0.00 N ATOM 493 CA LEU A 33 -3.377 -6.866 -11.841 1.00 0.00 C ATOM 494 C LEU A 33 -4.047 -5.725 -11.082 1.00 0.00 C ATOM 495 O LEU A 33 -4.811 -4.948 -11.656 1.00 0.00 O ATOM 496 CB LEU A 33 -3.923 -8.209 -11.352 1.00 0.00 C ATOM 497 CG LEU A 33 -4.217 -9.249 -12.434 1.00 0.00 C ATOM 498 CD1 LEU A 33 -3.331 -9.020 -13.648 1.00 0.00 C ATOM 499 CD2 LEU A 33 -4.025 -10.656 -11.887 1.00 0.00 C ATOM 0 H LEU A 33 -1.543 -7.581 -11.117 1.00 0.00 H new ATOM 0 HA LEU A 33 -3.602 -6.753 -12.902 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.206 -8.636 -10.651 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.842 -8.024 -10.795 1.00 0.00 H new ATOM 0 HG LEU A 33 -5.256 -9.141 -12.744 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -3.554 -9.769 -14.408 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.519 -8.026 -14.053 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -2.284 -9.101 -13.355 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.238 -11.383 -12.670 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -2.996 -10.778 -11.549 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -4.703 -10.816 -11.049 1.00 0.00 H new ATOM 511 N LEU A 34 -3.753 -5.628 -9.790 1.00 0.00 N ATOM 512 CA LEU A 34 -4.325 -4.580 -8.952 1.00 0.00 C ATOM 513 C LEU A 34 -3.741 -3.217 -9.311 1.00 0.00 C ATOM 514 O LEU A 34 -4.380 -2.185 -9.110 1.00 0.00 O ATOM 515 CB LEU A 34 -4.070 -4.885 -7.475 1.00 0.00 C ATOM 516 CG LEU A 34 -2.742 -5.571 -7.151 1.00 0.00 C ATOM 517 CD1 LEU A 34 -2.039 -4.859 -6.005 1.00 0.00 C ATOM 518 CD2 LEU A 34 -2.969 -7.037 -6.812 1.00 0.00 C ATOM 0 H LEU A 34 -3.122 -6.262 -9.300 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.400 -4.552 -9.130 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.118 -3.949 -6.918 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.880 -5.516 -7.110 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.102 -5.517 -8.032 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.096 -5.361 -5.788 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.843 -3.824 -6.285 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.674 -4.881 -5.119 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.014 -7.510 -6.584 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.627 -7.113 -5.946 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -3.429 -7.540 -7.662 1.00 0.00 H new ATOM 530 N ASP A 35 -2.524 -3.223 -9.843 1.00 0.00 N ATOM 531 CA ASP A 35 -1.854 -1.987 -10.233 1.00 0.00 C ATOM 532 C ASP A 35 -2.517 -1.376 -11.464 1.00 0.00 C ATOM 533 O ASP A 35 -2.733 -0.166 -11.528 1.00 0.00 O ATOM 534 CB ASP A 35 -0.374 -2.251 -10.513 1.00 0.00 C ATOM 535 CG ASP A 35 0.449 -0.977 -10.524 1.00 0.00 C ATOM 536 OD1 ASP A 35 0.170 -0.099 -11.367 1.00 0.00 O ATOM 537 OD2 ASP A 35 1.371 -0.859 -9.691 1.00 0.00 O ATOM 0 H ASP A 35 -1.981 -4.069 -10.014 1.00 0.00 H new ATOM 0 HA ASP A 35 -1.939 -1.280 -9.408 1.00 0.00 H new ATOM 0 HB2 ASP A 35 0.021 -2.929 -9.756 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.273 -2.754 -11.475 1.00 0.00 H new ATOM 542 N SER A 36 -2.835 -2.220 -12.440 1.00 0.00 N ATOM 543 CA SER A 36 -3.468 -1.762 -13.671 1.00 0.00 C ATOM 544 C SER A 36 -4.917 -1.357 -13.418 1.00 0.00 C ATOM 545 O SER A 36 -5.348 -0.271 -13.810 1.00 0.00 O ATOM 546 CB SER A 36 -3.411 -2.858 -14.737 1.00 0.00 C ATOM 547 OG SER A 36 -3.291 -2.302 -16.034 1.00 0.00 O ATOM 0 H SER A 36 -2.665 -3.225 -12.402 1.00 0.00 H new ATOM 0 HA SER A 36 -2.922 -0.889 -14.029 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.565 -3.517 -14.541 1.00 0.00 H new ATOM 0 HB3 SER A 36 -4.311 -3.470 -14.682 1.00 0.00 H new ATOM 0 HG SER A 36 -3.255 -3.023 -16.697 1.00 0.00 H new ATOM 553 N LEU A 37 -5.665 -2.237 -12.762 1.00 0.00 N ATOM 554 CA LEU A 37 -7.067 -1.972 -12.456 1.00 0.00 C ATOM 555 C LEU A 37 -7.207 -0.740 -11.569 1.00 0.00 C ATOM 556 O LEU A 37 -8.147 0.040 -11.718 1.00 0.00 O ATOM 557 CB LEU A 37 -7.697 -3.185 -11.768 1.00 0.00 C ATOM 558 CG LEU A 37 -8.456 -4.153 -12.676 1.00 0.00 C ATOM 559 CD1 LEU A 37 -7.904 -4.100 -14.093 1.00 0.00 C ATOM 560 CD2 LEU A 37 -8.382 -5.569 -12.126 1.00 0.00 C ATOM 0 H LEU A 37 -5.325 -3.140 -12.432 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.589 -1.782 -13.394 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.908 -3.739 -11.259 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.382 -2.827 -11.000 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.503 -3.850 -12.704 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.456 -4.795 -14.725 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.010 -3.089 -14.487 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.850 -4.377 -14.083 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.928 -6.244 -12.785 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.340 -5.883 -12.067 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -8.826 -5.596 -11.131 1.00 0.00 H new ATOM 572 N GLU A 38 -6.265 -0.570 -10.647 1.00 0.00 N ATOM 573 CA GLU A 38 -6.284 0.569 -9.737 1.00 0.00 C ATOM 574 C GLU A 38 -6.038 1.873 -10.492 1.00 0.00 C ATOM 575 O GLU A 38 -6.671 2.891 -10.215 1.00 0.00 O ATOM 576 CB GLU A 38 -5.228 0.394 -8.643 1.00 0.00 C ATOM 577 CG GLU A 38 -5.652 -0.556 -7.536 1.00 0.00 C ATOM 578 CD GLU A 38 -6.353 0.154 -6.394 1.00 0.00 C ATOM 579 OE1 GLU A 38 -7.140 1.084 -6.669 1.00 0.00 O ATOM 580 OE2 GLU A 38 -6.115 -0.220 -5.227 1.00 0.00 O ATOM 0 H GLU A 38 -5.479 -1.206 -10.510 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.271 0.616 -9.276 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.307 0.025 -9.094 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.002 1.368 -8.208 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.316 -1.316 -7.949 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -4.774 -1.075 -7.152 1.00 0.00 H new ATOM 587 N GLU A 39 -5.113 1.832 -11.446 1.00 0.00 N ATOM 588 CA GLU A 39 -4.783 3.010 -12.240 1.00 0.00 C ATOM 589 C GLU A 39 -5.875 3.299 -13.266 1.00 0.00 C ATOM 590 O GLU A 39 -6.125 4.453 -13.615 1.00 0.00 O ATOM 591 CB GLU A 39 -3.441 2.815 -12.948 1.00 0.00 C ATOM 592 CG GLU A 39 -2.276 3.490 -12.244 1.00 0.00 C ATOM 593 CD GLU A 39 -1.033 3.561 -13.108 1.00 0.00 C ATOM 594 OE1 GLU A 39 -0.273 2.570 -13.135 1.00 0.00 O ATOM 595 OE2 GLU A 39 -0.819 4.606 -13.758 1.00 0.00 O ATOM 0 H GLU A 39 -4.579 0.997 -11.688 1.00 0.00 H new ATOM 0 HA GLU A 39 -4.709 3.862 -11.565 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.235 1.748 -13.030 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.516 3.205 -13.963 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.568 4.498 -11.952 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.046 2.946 -11.328 1.00 0.00 H new ATOM 602 N LEU A 40 -6.522 2.242 -13.745 1.00 0.00 N ATOM 603 CA LEU A 40 -7.588 2.380 -14.732 1.00 0.00 C ATOM 604 C LEU A 40 -8.858 2.926 -14.088 1.00 0.00 C ATOM 605 O LEU A 40 -9.579 3.722 -14.690 1.00 0.00 O ATOM 606 CB LEU A 40 -7.876 1.031 -15.392 1.00 0.00 C ATOM 607 CG LEU A 40 -6.709 0.388 -16.142 1.00 0.00 C ATOM 608 CD1 LEU A 40 -6.754 -1.126 -16.003 1.00 0.00 C ATOM 609 CD2 LEU A 40 -6.730 0.791 -17.609 1.00 0.00 C ATOM 0 H LEU A 40 -6.327 1.280 -13.466 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.256 3.086 -15.493 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.213 0.337 -14.622 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -8.703 1.160 -16.090 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.779 0.746 -15.701 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.916 -1.566 -16.543 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.689 -1.397 -14.949 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -7.690 -1.502 -16.417 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.892 0.324 -18.127 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.665 0.463 -18.063 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.648 1.875 -17.690 1.00 0.00 H new ATOM 621 N SER A 41 -9.126 2.494 -12.860 1.00 0.00 N ATOM 622 CA SER A 41 -10.311 2.938 -12.135 1.00 0.00 C ATOM 623 C SER A 41 -10.064 4.287 -11.466 1.00 0.00 C ATOM 624 O SER A 41 -11.003 5.029 -11.177 1.00 0.00 O ATOM 625 CB SER A 41 -10.710 1.901 -11.084 1.00 0.00 C ATOM 626 OG SER A 41 -11.305 0.765 -11.688 1.00 0.00 O ATOM 0 H SER A 41 -8.539 1.837 -12.346 1.00 0.00 H new ATOM 0 HA SER A 41 -11.125 3.050 -12.852 1.00 0.00 H new ATOM 0 HB2 SER A 41 -9.830 1.596 -10.517 1.00 0.00 H new ATOM 0 HB3 SER A 41 -11.408 2.347 -10.375 1.00 0.00 H new ATOM 0 HG SER A 41 -11.549 0.116 -10.995 1.00 0.00 H new ATOM 632 N GLU A 42 -8.795 4.598 -11.224 1.00 0.00 N ATOM 633 CA GLU A 42 -8.425 5.857 -10.588 1.00 0.00 C ATOM 634 C GLU A 42 -8.102 6.920 -11.634 1.00 0.00 C ATOM 635 O GLU A 42 -8.360 8.106 -11.430 1.00 0.00 O ATOM 636 CB GLU A 42 -7.222 5.653 -9.665 1.00 0.00 C ATOM 637 CG GLU A 42 -7.552 4.886 -8.396 1.00 0.00 C ATOM 638 CD GLU A 42 -6.349 4.162 -7.822 1.00 0.00 C ATOM 639 OE1 GLU A 42 -5.252 4.277 -8.407 1.00 0.00 O ATOM 640 OE2 GLU A 42 -6.506 3.481 -6.787 1.00 0.00 O ATOM 0 H GLU A 42 -8.006 3.996 -11.459 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.274 6.199 -9.997 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.443 5.120 -10.210 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.813 6.626 -9.395 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.945 5.577 -7.650 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -8.340 4.163 -8.607 1.00 0.00 H new ATOM 647 N ALA A 43 -7.536 6.486 -12.756 1.00 0.00 N ATOM 648 CA ALA A 43 -7.180 7.399 -13.835 1.00 0.00 C ATOM 649 C ALA A 43 -8.374 7.667 -14.744 1.00 0.00 C ATOM 650 O ALA A 43 -8.531 8.769 -15.271 1.00 0.00 O ATOM 651 CB ALA A 43 -6.017 6.837 -14.639 1.00 0.00 C ATOM 0 H ALA A 43 -7.314 5.508 -12.941 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.876 8.347 -13.391 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.761 7.529 -15.442 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.154 6.704 -13.986 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.301 5.875 -15.066 1.00 0.00 H new ATOM 657 N HIS A 44 -9.213 6.652 -14.926 1.00 0.00 N ATOM 658 CA HIS A 44 -10.394 6.778 -15.772 1.00 0.00 C ATOM 659 C HIS A 44 -11.292 5.552 -15.639 1.00 0.00 C ATOM 660 O HIS A 44 -11.344 4.692 -16.518 1.00 0.00 O ATOM 661 CB HIS A 44 -9.982 6.966 -17.233 1.00 0.00 C ATOM 662 CG HIS A 44 -9.391 5.737 -17.852 1.00 0.00 C ATOM 663 ND1 HIS A 44 -8.943 4.663 -17.112 1.00 0.00 N ATOM 664 CD2 HIS A 44 -9.177 5.414 -19.149 1.00 0.00 C ATOM 665 CE1 HIS A 44 -8.477 3.734 -17.927 1.00 0.00 C ATOM 666 NE2 HIS A 44 -8.609 4.165 -19.169 1.00 0.00 N ATOM 0 H HIS A 44 -9.097 5.733 -14.499 1.00 0.00 H new ATOM 0 HA HIS A 44 -10.954 7.654 -15.444 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -10.854 7.271 -17.811 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -9.258 7.778 -17.296 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -8.968 4.596 -16.094 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -9.410 6.026 -20.008 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -8.059 2.784 -17.629 1.00 0.00 H new ATOM 674 N PRO A 45 -12.016 5.468 -14.512 1.00 0.00 N ATOM 675 CA PRO A 45 -12.925 4.351 -14.237 1.00 0.00 C ATOM 676 C PRO A 45 -14.152 4.367 -15.141 1.00 0.00 C ATOM 677 O PRO A 45 -14.234 5.160 -16.079 1.00 0.00 O ATOM 678 CB PRO A 45 -13.332 4.577 -12.779 1.00 0.00 C ATOM 679 CG PRO A 45 -13.163 6.041 -12.560 1.00 0.00 C ATOM 680 CD PRO A 45 -12.003 6.457 -13.422 1.00 0.00 C ATOM 0 HA PRO A 45 -12.452 3.386 -14.417 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -14.362 4.267 -12.603 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -12.705 4.000 -12.099 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.068 6.584 -12.834 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -12.967 6.259 -11.510 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -12.126 7.472 -13.799 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -11.063 6.434 -12.870 1.00 0.00 H new ATOM 688 N ASP A 46 -15.105 3.486 -14.853 1.00 0.00 N ATOM 689 CA ASP A 46 -16.329 3.400 -15.639 1.00 0.00 C ATOM 690 C ASP A 46 -17.505 4.011 -14.884 1.00 0.00 C ATOM 691 O ASP A 46 -18.426 4.562 -15.488 1.00 0.00 O ATOM 692 CB ASP A 46 -16.634 1.942 -15.989 1.00 0.00 C ATOM 693 CG ASP A 46 -17.192 1.788 -17.390 1.00 0.00 C ATOM 694 OD1 ASP A 46 -17.678 2.793 -17.949 1.00 0.00 O ATOM 695 OD2 ASP A 46 -17.142 0.661 -17.928 1.00 0.00 O ATOM 0 H ASP A 46 -15.052 2.822 -14.081 1.00 0.00 H new ATOM 0 HA ASP A 46 -16.180 3.964 -16.560 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -15.723 1.351 -15.897 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -17.348 1.541 -15.270 1.00 0.00 H new ATOM 700 N CYS A 47 -17.467 3.910 -13.560 1.00 0.00 N ATOM 701 CA CYS A 47 -18.531 4.451 -12.721 1.00 0.00 C ATOM 702 C CYS A 47 -18.049 4.639 -11.286 1.00 0.00 C ATOM 703 O CYS A 47 -17.750 5.757 -10.863 1.00 0.00 O ATOM 704 CB CYS A 47 -19.749 3.527 -12.745 1.00 0.00 C ATOM 705 SG CYS A 47 -19.616 2.162 -13.923 1.00 0.00 S ATOM 0 H CYS A 47 -16.711 3.459 -13.044 1.00 0.00 H new ATOM 0 HA CYS A 47 -18.815 5.424 -13.121 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -19.901 3.118 -11.746 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -20.634 4.116 -12.986 1.00 0.00 H new ATOM 0 HG CYS A 47 -20.693 1.435 -13.869 1.00 0.00 H new ATOM 711 N ILE A 48 -17.977 3.541 -10.543 1.00 0.00 N ATOM 712 CA ILE A 48 -17.532 3.585 -9.155 1.00 0.00 C ATOM 713 C ILE A 48 -17.031 2.220 -8.695 1.00 0.00 C ATOM 714 O ILE A 48 -17.370 1.740 -7.613 1.00 0.00 O ATOM 715 CB ILE A 48 -18.661 4.049 -8.217 1.00 0.00 C ATOM 716 CG1 ILE A 48 -18.077 4.720 -6.972 1.00 0.00 C ATOM 717 CG2 ILE A 48 -19.542 2.871 -7.826 1.00 0.00 C ATOM 718 CD1 ILE A 48 -16.895 3.980 -6.386 1.00 0.00 C ATOM 0 H ILE A 48 -18.221 2.609 -10.878 1.00 0.00 H new ATOM 0 HA ILE A 48 -16.714 4.304 -9.108 1.00 0.00 H new ATOM 0 HB ILE A 48 -19.275 4.778 -8.745 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -17.771 5.735 -7.226 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -18.856 4.802 -6.214 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -20.336 3.215 -7.163 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -19.982 2.433 -8.722 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -18.940 2.121 -7.313 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -16.532 4.512 -5.507 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -17.201 2.973 -6.101 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -16.099 3.920 -7.128 1.00 0.00 H new ATOM 730 N PRO A 49 -16.203 1.580 -9.533 1.00 0.00 N ATOM 731 CA PRO A 49 -15.635 0.263 -9.232 1.00 0.00 C ATOM 732 C PRO A 49 -14.610 0.317 -8.105 1.00 0.00 C ATOM 733 O PRO A 49 -14.123 1.389 -7.747 1.00 0.00 O ATOM 734 CB PRO A 49 -14.963 -0.142 -10.547 1.00 0.00 C ATOM 735 CG PRO A 49 -14.655 1.146 -11.227 1.00 0.00 C ATOM 736 CD PRO A 49 -15.756 2.094 -10.839 1.00 0.00 C ATOM 0 HA PRO A 49 -16.395 -0.440 -8.891 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -14.057 -0.721 -10.367 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -15.622 -0.762 -11.154 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.683 1.529 -10.916 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -14.615 1.016 -12.309 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -15.396 3.120 -10.765 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -16.565 2.092 -11.570 1.00 0.00 H new ATOM 744 N ASP A 50 -14.287 -0.846 -7.549 1.00 0.00 N ATOM 745 CA ASP A 50 -13.318 -0.931 -6.463 1.00 0.00 C ATOM 746 C ASP A 50 -12.363 -2.101 -6.676 1.00 0.00 C ATOM 747 O ASP A 50 -12.776 -3.187 -7.085 1.00 0.00 O ATOM 748 CB ASP A 50 -14.036 -1.082 -5.121 1.00 0.00 C ATOM 749 CG ASP A 50 -13.579 -0.058 -4.101 1.00 0.00 C ATOM 750 OD1 ASP A 50 -12.362 0.004 -3.826 1.00 0.00 O ATOM 751 OD2 ASP A 50 -14.438 0.682 -3.578 1.00 0.00 O ATOM 0 H ASP A 50 -14.682 -1.743 -7.833 1.00 0.00 H new ATOM 0 HA ASP A 50 -12.738 -0.008 -6.455 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -15.111 -0.983 -5.274 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -13.861 -2.084 -4.729 1.00 0.00 H new ATOM 756 N VAL A 51 -11.083 -1.872 -6.399 1.00 0.00 N ATOM 757 CA VAL A 51 -10.069 -2.907 -6.561 1.00 0.00 C ATOM 758 C VAL A 51 -9.541 -3.375 -5.210 1.00 0.00 C ATOM 759 O VAL A 51 -8.923 -2.606 -4.474 1.00 0.00 O ATOM 760 CB VAL A 51 -8.889 -2.407 -7.416 1.00 0.00 C ATOM 761 CG1 VAL A 51 -8.344 -3.531 -8.284 1.00 0.00 C ATOM 762 CG2 VAL A 51 -9.314 -1.222 -8.269 1.00 0.00 C ATOM 0 H VAL A 51 -10.724 -0.979 -6.061 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.548 -3.743 -7.070 1.00 0.00 H new ATOM 0 HB VAL A 51 -8.093 -2.078 -6.748 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.511 -3.159 -8.881 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -7.999 -4.347 -7.649 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -9.131 -3.894 -8.946 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -8.468 -0.882 -8.866 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -10.127 -1.522 -8.930 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -9.652 -0.411 -7.623 1.00 0.00 H new ATOM 772 N GLU A 52 -9.788 -4.642 -4.891 1.00 0.00 N ATOM 773 CA GLU A 52 -9.337 -5.212 -3.627 1.00 0.00 C ATOM 774 C GLU A 52 -8.186 -6.190 -3.851 1.00 0.00 C ATOM 775 O GLU A 52 -8.242 -7.039 -4.741 1.00 0.00 O ATOM 776 CB GLU A 52 -10.493 -5.923 -2.921 1.00 0.00 C ATOM 777 CG GLU A 52 -11.818 -5.188 -3.033 1.00 0.00 C ATOM 778 CD GLU A 52 -12.847 -5.959 -3.838 1.00 0.00 C ATOM 779 OE1 GLU A 52 -13.574 -6.779 -3.239 1.00 0.00 O ATOM 780 OE2 GLU A 52 -12.924 -5.743 -5.065 1.00 0.00 O ATOM 0 H GLU A 52 -10.297 -5.292 -5.490 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.982 -4.397 -2.997 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.605 -6.922 -3.341 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.243 -6.046 -1.867 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -12.211 -5.000 -2.034 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -11.652 -4.216 -3.498 1.00 0.00 H new ATOM 787 N LEU A 53 -7.143 -6.062 -3.038 1.00 0.00 N ATOM 788 CA LEU A 53 -5.978 -6.933 -3.147 1.00 0.00 C ATOM 789 C LEU A 53 -5.597 -7.505 -1.785 1.00 0.00 C ATOM 790 O LEU A 53 -5.143 -6.779 -0.900 1.00 0.00 O ATOM 791 CB LEU A 53 -4.795 -6.164 -3.738 1.00 0.00 C ATOM 792 CG LEU A 53 -3.406 -6.718 -3.419 1.00 0.00 C ATOM 793 CD1 LEU A 53 -2.911 -6.181 -2.085 1.00 0.00 C ATOM 794 CD2 LEU A 53 -3.429 -8.240 -3.408 1.00 0.00 C ATOM 0 H LEU A 53 -7.080 -5.364 -2.297 1.00 0.00 H new ATOM 0 HA LEU A 53 -6.234 -7.760 -3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.912 -6.134 -4.821 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.843 -5.134 -3.384 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.717 -6.390 -4.197 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.921 -6.586 -1.874 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.856 -5.093 -2.128 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.600 -6.478 -1.295 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.432 -8.617 -3.179 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.131 -8.588 -2.650 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.740 -8.606 -4.386 1.00 0.00 H new ATOM 806 N SER A 54 -5.782 -8.811 -1.625 1.00 0.00 N ATOM 807 CA SER A 54 -5.459 -9.481 -0.370 1.00 0.00 C ATOM 808 C SER A 54 -4.366 -10.525 -0.577 1.00 0.00 C ATOM 809 O SER A 54 -4.571 -11.528 -1.260 1.00 0.00 O ATOM 810 CB SER A 54 -6.708 -10.143 0.215 1.00 0.00 C ATOM 811 OG SER A 54 -7.260 -9.359 1.258 1.00 0.00 O ATOM 0 H SER A 54 -6.154 -9.427 -2.348 1.00 0.00 H new ATOM 0 HA SER A 54 -5.092 -8.730 0.330 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.451 -10.284 -0.570 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.455 -11.133 0.595 1.00 0.00 H new ATOM 0 HG SER A 54 -8.058 -9.803 1.614 1.00 0.00 H new ATOM 817 N HIS A 55 -3.203 -10.280 0.018 1.00 0.00 N ATOM 818 CA HIS A 55 -2.076 -11.198 -0.100 1.00 0.00 C ATOM 819 C HIS A 55 -2.555 -12.605 -0.445 1.00 0.00 C ATOM 820 O HIS A 55 -2.858 -13.403 0.441 1.00 0.00 O ATOM 821 CB HIS A 55 -1.273 -11.224 1.201 1.00 0.00 C ATOM 822 CG HIS A 55 0.206 -11.326 0.991 1.00 0.00 C ATOM 823 ND1 HIS A 55 1.062 -10.254 1.132 1.00 0.00 N ATOM 824 CD2 HIS A 55 0.981 -12.382 0.650 1.00 0.00 C ATOM 825 CE1 HIS A 55 2.299 -10.646 0.885 1.00 0.00 C ATOM 826 NE2 HIS A 55 2.278 -11.933 0.590 1.00 0.00 N ATOM 0 H HIS A 55 -3.016 -9.454 0.586 1.00 0.00 H new ATOM 0 HA HIS A 55 -1.434 -10.844 -0.907 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -1.489 -10.320 1.770 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.605 -12.068 1.806 1.00 0.00 H new ATOM 0 HD2 HIS A 55 0.643 -13.390 0.460 1.00 0.00 H new ATOM 0 HE1 HIS A 55 3.178 -10.020 0.919 1.00 0.00 H new ATOM 0 HE2 HIS A 55 3.092 -12.501 0.356 1.00 0.00 H new ATOM 834 N GLY A 56 -2.621 -12.902 -1.739 1.00 0.00 N ATOM 835 CA GLY A 56 -3.065 -14.212 -2.178 1.00 0.00 C ATOM 836 C GLY A 56 -4.370 -14.155 -2.948 1.00 0.00 C ATOM 837 O GLY A 56 -4.939 -15.189 -3.297 1.00 0.00 O ATOM 0 H GLY A 56 -2.375 -12.259 -2.491 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.296 -14.661 -2.806 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -3.187 -14.860 -1.310 1.00 0.00 H new ATOM 841 N VAL A 57 -4.846 -12.943 -3.212 1.00 0.00 N ATOM 842 CA VAL A 57 -6.092 -12.754 -3.945 1.00 0.00 C ATOM 843 C VAL A 57 -6.163 -11.360 -4.558 1.00 0.00 C ATOM 844 O VAL A 57 -5.633 -10.399 -4.003 1.00 0.00 O ATOM 845 CB VAL A 57 -7.316 -12.966 -3.035 1.00 0.00 C ATOM 846 CG1 VAL A 57 -8.601 -12.926 -3.849 1.00 0.00 C ATOM 847 CG2 VAL A 57 -7.196 -14.280 -2.278 1.00 0.00 C ATOM 0 H VAL A 57 -4.388 -12.077 -2.929 1.00 0.00 H new ATOM 0 HA VAL A 57 -6.107 -13.499 -4.741 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.350 -12.155 -2.307 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.455 -13.078 -3.189 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.690 -11.957 -4.341 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.580 -13.714 -4.601 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -8.070 -14.413 -1.640 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.136 -15.105 -2.988 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.296 -14.265 -1.663 1.00 0.00 H new ATOM 857 N MET A 58 -6.823 -11.258 -5.708 1.00 0.00 N ATOM 858 CA MET A 58 -6.966 -9.980 -6.396 1.00 0.00 C ATOM 859 C MET A 58 -8.415 -9.743 -6.807 1.00 0.00 C ATOM 860 O MET A 58 -8.817 -10.074 -7.923 1.00 0.00 O ATOM 861 CB MET A 58 -6.060 -9.937 -7.628 1.00 0.00 C ATOM 862 CG MET A 58 -5.814 -8.532 -8.152 1.00 0.00 C ATOM 863 SD MET A 58 -7.119 -7.964 -9.260 1.00 0.00 S ATOM 864 CE MET A 58 -7.574 -6.417 -8.481 1.00 0.00 C ATOM 0 H MET A 58 -7.267 -12.045 -6.182 1.00 0.00 H new ATOM 0 HA MET A 58 -6.669 -9.189 -5.707 1.00 0.00 H new ATOM 0 HB2 MET A 58 -5.103 -10.397 -7.381 1.00 0.00 H new ATOM 0 HB3 MET A 58 -6.508 -10.538 -8.419 1.00 0.00 H new ATOM 0 HG2 MET A 58 -5.732 -7.844 -7.311 1.00 0.00 H new ATOM 0 HG3 MET A 58 -4.860 -8.507 -8.678 1.00 0.00 H new ATOM 0 HE1 MET A 58 -8.657 -6.370 -8.370 1.00 0.00 H new ATOM 0 HE2 MET A 58 -7.106 -6.353 -7.499 1.00 0.00 H new ATOM 0 HE3 MET A 58 -7.236 -5.585 -9.099 1.00 0.00 H new ATOM 874 N THR A 59 -9.197 -9.167 -5.899 1.00 0.00 N ATOM 875 CA THR A 59 -10.602 -8.887 -6.167 1.00 0.00 C ATOM 876 C THR A 59 -10.771 -7.538 -6.857 1.00 0.00 C ATOM 877 O THR A 59 -10.007 -6.604 -6.613 1.00 0.00 O ATOM 878 CB THR A 59 -11.433 -8.896 -4.870 1.00 0.00 C ATOM 879 OG1 THR A 59 -10.614 -9.295 -3.765 1.00 0.00 O ATOM 880 CG2 THR A 59 -12.620 -9.839 -4.995 1.00 0.00 C ATOM 0 H THR A 59 -8.881 -8.885 -4.971 1.00 0.00 H new ATOM 0 HA THR A 59 -10.963 -9.677 -6.826 1.00 0.00 H new ATOM 0 HB THR A 59 -11.807 -7.887 -4.698 1.00 0.00 H new ATOM 0 HG1 THR A 59 -11.150 -9.296 -2.944 1.00 0.00 H new ATOM 0 HG21 THR A 59 -13.192 -9.829 -4.067 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.257 -9.515 -5.818 1.00 0.00 H new ATOM 0 HG23 THR A 59 -12.262 -10.850 -5.190 1.00 0.00 H new ATOM 888 N LEU A 60 -11.777 -7.443 -7.719 1.00 0.00 N ATOM 889 CA LEU A 60 -12.048 -6.207 -8.445 1.00 0.00 C ATOM 890 C LEU A 60 -13.540 -6.058 -8.729 1.00 0.00 C ATOM 891 O LEU A 60 -14.050 -6.594 -9.712 1.00 0.00 O ATOM 892 CB LEU A 60 -11.263 -6.181 -9.757 1.00 0.00 C ATOM 893 CG LEU A 60 -11.713 -5.145 -10.788 1.00 0.00 C ATOM 894 CD1 LEU A 60 -10.852 -3.894 -10.699 1.00 0.00 C ATOM 895 CD2 LEU A 60 -11.661 -5.731 -12.191 1.00 0.00 C ATOM 0 H LEU A 60 -12.419 -8.207 -7.932 1.00 0.00 H new ATOM 0 HA LEU A 60 -11.730 -5.371 -7.822 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.213 -6.001 -9.525 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -11.324 -7.169 -10.214 1.00 0.00 H new ATOM 0 HG LEU A 60 -12.744 -4.868 -10.569 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -11.187 -3.168 -11.440 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -10.940 -3.462 -9.702 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -9.811 -4.154 -10.891 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -11.985 -4.980 -12.911 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -10.640 -6.037 -12.420 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -12.321 -6.597 -12.248 1.00 0.00 H new ATOM 907 N GLU A 61 -14.231 -5.325 -7.862 1.00 0.00 N ATOM 908 CA GLU A 61 -15.664 -5.104 -8.021 1.00 0.00 C ATOM 909 C GLU A 61 -15.938 -4.073 -9.113 1.00 0.00 C ATOM 910 O GLU A 61 -15.314 -3.012 -9.149 1.00 0.00 O ATOM 911 CB GLU A 61 -16.281 -4.641 -6.700 1.00 0.00 C ATOM 912 CG GLU A 61 -17.166 -3.413 -6.839 1.00 0.00 C ATOM 913 CD GLU A 61 -18.100 -3.230 -5.659 1.00 0.00 C ATOM 914 OE1 GLU A 61 -18.618 -4.247 -5.151 1.00 0.00 O ATOM 915 OE2 GLU A 61 -18.312 -2.072 -5.243 1.00 0.00 O ATOM 0 H GLU A 61 -13.823 -4.874 -7.043 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.121 -6.049 -8.315 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.869 -5.456 -6.278 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.482 -4.424 -5.992 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.539 -2.528 -6.942 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.754 -3.495 -7.753 1.00 0.00 H new ATOM 922 N ILE A 62 -16.874 -4.394 -10.000 1.00 0.00 N ATOM 923 CA ILE A 62 -17.231 -3.496 -11.091 1.00 0.00 C ATOM 924 C ILE A 62 -18.740 -3.469 -11.309 1.00 0.00 C ATOM 925 O ILE A 62 -19.354 -4.463 -11.696 1.00 0.00 O ATOM 926 CB ILE A 62 -16.540 -3.906 -12.406 1.00 0.00 C ATOM 927 CG1 ILE A 62 -15.025 -3.981 -12.210 1.00 0.00 C ATOM 928 CG2 ILE A 62 -16.889 -2.925 -13.515 1.00 0.00 C ATOM 929 CD1 ILE A 62 -14.237 -3.625 -13.451 1.00 0.00 C ATOM 0 H ILE A 62 -17.398 -5.269 -9.984 1.00 0.00 H new ATOM 0 HA ILE A 62 -16.890 -2.501 -10.806 1.00 0.00 H new ATOM 0 HB ILE A 62 -16.898 -4.894 -12.695 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -14.738 -3.309 -11.402 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -14.757 -4.990 -11.896 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -16.394 -3.228 -14.438 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -17.968 -2.918 -13.668 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -16.556 -1.926 -13.235 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -13.170 -3.700 -13.239 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -14.496 -4.313 -14.256 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -14.476 -2.606 -13.754 1.00 0.00 H new ATOM 941 N PRO A 63 -19.353 -2.303 -11.058 1.00 0.00 N ATOM 942 CA PRO A 63 -20.797 -2.116 -11.222 1.00 0.00 C ATOM 943 C PRO A 63 -21.221 -2.136 -12.687 1.00 0.00 C ATOM 944 O PRO A 63 -20.459 -1.742 -13.569 1.00 0.00 O ATOM 945 CB PRO A 63 -21.049 -0.736 -10.611 1.00 0.00 C ATOM 946 CG PRO A 63 -19.746 -0.023 -10.737 1.00 0.00 C ATOM 947 CD PRO A 63 -18.683 -1.076 -10.595 1.00 0.00 C ATOM 0 HA PRO A 63 -21.367 -2.916 -10.750 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.842 -0.208 -11.140 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -21.358 -0.815 -9.569 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -19.669 0.482 -11.700 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -19.643 0.742 -9.967 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -17.806 -0.845 -11.199 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -18.344 -1.168 -9.563 1.00 0.00 H new ATOM 955 N ALA A 64 -22.443 -2.596 -12.938 1.00 0.00 N ATOM 956 CA ALA A 64 -22.969 -2.664 -14.296 1.00 0.00 C ATOM 957 C ALA A 64 -22.520 -3.943 -14.995 1.00 0.00 C ATOM 958 O ALA A 64 -22.856 -4.178 -16.156 1.00 0.00 O ATOM 959 CB ALA A 64 -22.532 -1.443 -15.093 1.00 0.00 C ATOM 0 H ALA A 64 -23.087 -2.927 -12.219 1.00 0.00 H new ATOM 0 HA ALA A 64 -24.057 -2.676 -14.238 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -22.932 -1.507 -16.105 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -22.907 -0.540 -14.611 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -21.443 -1.406 -15.135 1.00 0.00 H new ATOM 965 N PHE A 65 -21.760 -4.766 -14.281 1.00 0.00 N ATOM 966 CA PHE A 65 -21.264 -6.021 -14.834 1.00 0.00 C ATOM 967 C PHE A 65 -21.183 -7.097 -13.755 1.00 0.00 C ATOM 968 O PHE A 65 -21.891 -8.101 -13.810 1.00 0.00 O ATOM 969 CB PHE A 65 -19.887 -5.815 -15.469 1.00 0.00 C ATOM 970 CG PHE A 65 -19.878 -4.780 -16.558 1.00 0.00 C ATOM 971 CD1 PHE A 65 -20.108 -3.445 -16.265 1.00 0.00 C ATOM 972 CD2 PHE A 65 -19.638 -5.142 -17.873 1.00 0.00 C ATOM 973 CE1 PHE A 65 -20.100 -2.492 -17.266 1.00 0.00 C ATOM 974 CE2 PHE A 65 -19.630 -4.193 -18.878 1.00 0.00 C ATOM 975 CZ PHE A 65 -19.860 -2.866 -18.573 1.00 0.00 C ATOM 0 H PHE A 65 -21.474 -4.587 -13.318 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.964 -6.352 -15.601 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -19.179 -5.522 -14.694 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -19.538 -6.764 -15.877 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.295 -3.146 -15.244 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -19.455 -6.178 -18.116 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -20.281 -1.455 -17.026 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -19.444 -4.489 -19.900 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.852 -2.122 -19.356 1.00 0.00 H new ATOM 985 N GLY A 66 -20.312 -6.878 -12.774 1.00 0.00 N ATOM 986 CA GLY A 66 -20.153 -7.836 -11.696 1.00 0.00 C ATOM 987 C GLY A 66 -18.889 -7.602 -10.893 1.00 0.00 C ATOM 988 O GLY A 66 -18.463 -6.461 -10.709 1.00 0.00 O ATOM 0 H GLY A 66 -19.714 -6.054 -12.707 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -21.016 -7.779 -11.033 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.135 -8.844 -12.110 1.00 0.00 H new ATOM 992 N THR A 67 -18.286 -8.685 -10.413 1.00 0.00 N ATOM 993 CA THR A 67 -17.064 -8.592 -9.623 1.00 0.00 C ATOM 994 C THR A 67 -16.003 -9.559 -10.136 1.00 0.00 C ATOM 995 O THR A 67 -16.213 -10.772 -10.157 1.00 0.00 O ATOM 996 CB THR A 67 -17.333 -8.886 -8.135 1.00 0.00 C ATOM 997 OG1 THR A 67 -18.551 -8.254 -7.724 1.00 0.00 O ATOM 998 CG2 THR A 67 -16.183 -8.393 -7.270 1.00 0.00 C ATOM 0 H THR A 67 -18.624 -9.637 -10.557 1.00 0.00 H new ATOM 0 HA THR A 67 -16.700 -7.570 -9.724 1.00 0.00 H new ATOM 0 HB THR A 67 -17.424 -9.965 -8.010 1.00 0.00 H new ATOM 0 HG1 THR A 67 -18.716 -8.447 -6.777 1.00 0.00 H new ATOM 0 HG21 THR A 67 -16.395 -8.611 -6.223 1.00 0.00 H new ATOM 0 HG22 THR A 67 -15.263 -8.897 -7.566 1.00 0.00 H new ATOM 0 HG23 THR A 67 -16.066 -7.317 -7.399 1.00 0.00 H new ATOM 1006 N TYR A 68 -14.864 -9.014 -10.549 1.00 0.00 N ATOM 1007 CA TYR A 68 -13.770 -9.829 -11.064 1.00 0.00 C ATOM 1008 C TYR A 68 -12.806 -10.217 -9.947 1.00 0.00 C ATOM 1009 O TYR A 68 -12.236 -9.356 -9.277 1.00 0.00 O ATOM 1010 CB TYR A 68 -13.018 -9.076 -12.163 1.00 0.00 C ATOM 1011 CG TYR A 68 -13.488 -9.414 -13.559 1.00 0.00 C ATOM 1012 CD1 TYR A 68 -13.273 -10.676 -14.100 1.00 0.00 C ATOM 1013 CD2 TYR A 68 -14.148 -8.472 -14.339 1.00 0.00 C ATOM 1014 CE1 TYR A 68 -13.699 -10.989 -15.376 1.00 0.00 C ATOM 1015 CE2 TYR A 68 -14.580 -8.776 -15.615 1.00 0.00 C ATOM 1016 CZ TYR A 68 -14.353 -10.036 -16.129 1.00 0.00 C ATOM 1017 OH TYR A 68 -14.780 -10.344 -17.400 1.00 0.00 O ATOM 0 H TYR A 68 -14.674 -8.012 -10.537 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.197 -10.740 -11.484 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.131 -8.004 -12.000 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -11.954 -9.300 -12.083 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.764 -11.425 -13.512 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -14.326 -7.484 -13.940 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.521 -11.974 -15.782 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -15.092 -8.032 -16.207 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.759 -10.379 -17.417 1.00 0.00 H new ATOM 1027 N VAL A 69 -12.629 -11.520 -9.752 1.00 0.00 N ATOM 1028 CA VAL A 69 -11.734 -12.024 -8.718 1.00 0.00 C ATOM 1029 C VAL A 69 -10.612 -12.860 -9.322 1.00 0.00 C ATOM 1030 O VAL A 69 -10.840 -13.659 -10.231 1.00 0.00 O ATOM 1031 CB VAL A 69 -12.494 -12.875 -7.683 1.00 0.00 C ATOM 1032 CG1 VAL A 69 -11.780 -12.847 -6.340 1.00 0.00 C ATOM 1033 CG2 VAL A 69 -13.928 -12.388 -7.544 1.00 0.00 C ATOM 0 H VAL A 69 -13.094 -12.246 -10.297 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.307 -11.155 -8.218 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.517 -13.907 -8.033 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -12.332 -13.454 -5.622 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.773 -13.247 -6.455 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -11.723 -11.820 -5.979 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -14.451 -13.000 -6.809 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.929 -11.348 -7.217 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.434 -12.466 -8.506 1.00 0.00 H new ATOM 1043 N ILE A 70 -9.400 -12.671 -8.811 1.00 0.00 N ATOM 1044 CA ILE A 70 -8.242 -13.410 -9.300 1.00 0.00 C ATOM 1045 C ILE A 70 -7.278 -13.735 -8.164 1.00 0.00 C ATOM 1046 O ILE A 70 -6.629 -12.846 -7.614 1.00 0.00 O ATOM 1047 CB ILE A 70 -7.489 -12.621 -10.387 1.00 0.00 C ATOM 1048 CG1 ILE A 70 -8.404 -11.563 -11.007 1.00 0.00 C ATOM 1049 CG2 ILE A 70 -6.963 -13.566 -11.458 1.00 0.00 C ATOM 1050 CD1 ILE A 70 -7.762 -10.800 -12.144 1.00 0.00 C ATOM 0 H ILE A 70 -9.194 -12.013 -8.059 1.00 0.00 H new ATOM 0 HA ILE A 70 -8.618 -14.338 -9.731 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.641 -12.115 -9.926 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -9.311 -12.047 -11.371 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -8.708 -10.858 -10.233 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.433 -12.994 -12.220 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -6.281 -14.286 -11.005 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.797 -14.096 -11.917 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.468 -10.067 -12.535 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.871 -10.288 -11.781 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.484 -11.494 -12.937 1.00 0.00 H new ATOM 1062 N ASN A 71 -7.189 -15.015 -7.819 1.00 0.00 N ATOM 1063 CA ASN A 71 -6.302 -15.458 -6.748 1.00 0.00 C ATOM 1064 C ASN A 71 -5.276 -16.458 -7.271 1.00 0.00 C ATOM 1065 O ASN A 71 -5.450 -17.042 -8.341 1.00 0.00 O ATOM 1066 CB ASN A 71 -7.113 -16.089 -5.615 1.00 0.00 C ATOM 1067 CG ASN A 71 -7.510 -17.521 -5.915 1.00 0.00 C ATOM 1068 OD1 ASN A 71 -6.672 -18.347 -6.277 1.00 0.00 O ATOM 1069 ND2 ASN A 71 -8.795 -17.823 -5.767 1.00 0.00 N ATOM 0 H ASN A 71 -7.719 -15.764 -8.265 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.772 -14.586 -6.365 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -6.529 -16.062 -4.695 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -8.010 -15.495 -5.440 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -9.121 -18.771 -5.956 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -9.456 -17.107 -5.465 1.00 0.00 H new ATOM 1076 N LYS A 72 -4.204 -16.651 -6.509 1.00 0.00 N ATOM 1077 CA LYS A 72 -3.149 -17.581 -6.893 1.00 0.00 C ATOM 1078 C LYS A 72 -2.521 -18.229 -5.663 1.00 0.00 C ATOM 1079 O LYS A 72 -1.303 -18.199 -5.489 1.00 0.00 O ATOM 1080 CB LYS A 72 -2.074 -16.858 -7.707 1.00 0.00 C ATOM 1081 CG LYS A 72 -1.328 -17.764 -8.671 1.00 0.00 C ATOM 1082 CD LYS A 72 -0.185 -18.490 -7.982 1.00 0.00 C ATOM 1083 CE LYS A 72 -0.607 -19.874 -7.511 1.00 0.00 C ATOM 1084 NZ LYS A 72 -0.008 -20.217 -6.192 1.00 0.00 N ATOM 0 H LYS A 72 -4.043 -16.175 -5.621 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.595 -18.364 -7.507 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.539 -16.048 -8.269 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.358 -16.401 -7.023 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -2.019 -18.492 -9.096 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.938 -17.173 -9.500 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.657 -18.579 -8.668 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.159 -17.904 -7.130 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.694 -19.917 -7.439 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.307 -20.617 -8.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.333 -21.160 -5.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.029 -20.217 -6.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.301 -19.514 -5.484 1.00 0.00 H new ATOM 1098 N GLN A 73 -3.360 -18.814 -4.815 1.00 0.00 N ATOM 1099 CA GLN A 73 -2.885 -19.470 -3.602 1.00 0.00 C ATOM 1100 C GLN A 73 -3.640 -20.771 -3.355 1.00 0.00 C ATOM 1101 O GLN A 73 -4.051 -21.077 -2.235 1.00 0.00 O ATOM 1102 CB GLN A 73 -3.043 -18.538 -2.398 1.00 0.00 C ATOM 1103 CG GLN A 73 -2.141 -18.897 -1.229 1.00 0.00 C ATOM 1104 CD GLN A 73 -1.740 -17.686 -0.409 1.00 0.00 C ATOM 1105 OE1 GLN A 73 -0.651 -17.138 -0.581 1.00 0.00 O ATOM 1106 NE2 GLN A 73 -2.620 -17.262 0.490 1.00 0.00 N ATOM 0 H GLN A 73 -4.371 -18.847 -4.945 1.00 0.00 H new ATOM 0 HA GLN A 73 -1.829 -19.704 -3.736 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -2.830 -17.516 -2.710 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -4.081 -18.560 -2.066 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -2.653 -19.613 -0.586 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -1.244 -19.390 -1.605 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -3.511 -17.746 0.599 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -2.405 -16.452 1.071 1.00 0.00 H new ATOM 1115 N PRO A 74 -3.830 -21.558 -4.425 1.00 0.00 N ATOM 1116 CA PRO A 74 -4.537 -22.840 -4.349 1.00 0.00 C ATOM 1117 C PRO A 74 -3.741 -23.897 -3.591 1.00 0.00 C ATOM 1118 O PRO A 74 -2.567 -23.713 -3.271 1.00 0.00 O ATOM 1119 CB PRO A 74 -4.698 -23.243 -5.817 1.00 0.00 C ATOM 1120 CG PRO A 74 -3.585 -22.551 -6.525 1.00 0.00 C ATOM 1121 CD PRO A 74 -3.369 -21.256 -5.790 1.00 0.00 C ATOM 0 HA PRO A 74 -5.480 -22.754 -3.810 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -4.634 -24.324 -5.940 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -5.668 -22.935 -6.208 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.680 -23.159 -6.519 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.840 -22.369 -7.569 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.321 -20.956 -5.803 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.939 -20.441 -6.236 1.00 0.00 H new ATOM 1129 N PRO A 75 -4.393 -25.031 -3.296 1.00 0.00 N ATOM 1130 CA PRO A 75 -3.765 -26.140 -2.572 1.00 0.00 C ATOM 1131 C PRO A 75 -2.706 -26.851 -3.408 1.00 0.00 C ATOM 1132 O PRO A 75 -2.118 -27.840 -2.971 1.00 0.00 O ATOM 1133 CB PRO A 75 -4.936 -27.082 -2.280 1.00 0.00 C ATOM 1134 CG PRO A 75 -5.936 -26.784 -3.344 1.00 0.00 C ATOM 1135 CD PRO A 75 -5.794 -25.318 -3.647 1.00 0.00 C ATOM 0 HA PRO A 75 -3.242 -25.799 -1.679 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -4.622 -28.125 -2.312 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -5.349 -26.904 -1.287 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -5.750 -27.386 -4.234 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -6.946 -27.017 -3.007 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -5.998 -25.103 -4.696 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -6.487 -24.717 -3.058 1.00 0.00 H new ATOM 1143 N ASN A 76 -2.467 -26.341 -4.611 1.00 0.00 N ATOM 1144 CA ASN A 76 -1.478 -26.928 -5.508 1.00 0.00 C ATOM 1145 C ASN A 76 -0.618 -25.845 -6.153 1.00 0.00 C ATOM 1146 O ASN A 76 0.400 -25.432 -5.597 1.00 0.00 O ATOM 1147 CB ASN A 76 -2.170 -27.757 -6.592 1.00 0.00 C ATOM 1148 CG ASN A 76 -1.248 -28.078 -7.752 1.00 0.00 C ATOM 1149 OD1 ASN A 76 -0.029 -28.148 -7.590 1.00 0.00 O ATOM 1150 ND2 ASN A 76 -1.826 -28.273 -8.931 1.00 0.00 N ATOM 0 H ASN A 76 -2.945 -25.522 -4.988 1.00 0.00 H new ATOM 0 HA ASN A 76 -0.831 -27.579 -4.919 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -2.537 -28.686 -6.156 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -3.039 -27.213 -6.962 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -1.256 -28.491 -9.749 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -2.840 -28.205 -9.019 1.00 0.00 H new ATOM 1157 N LYS A 77 -1.034 -25.388 -7.329 1.00 0.00 N ATOM 1158 CA LYS A 77 -0.304 -24.352 -8.050 1.00 0.00 C ATOM 1159 C LYS A 77 -1.067 -23.916 -9.296 1.00 0.00 C ATOM 1160 O LYS A 77 -0.863 -24.460 -10.381 1.00 0.00 O ATOM 1161 CB LYS A 77 1.086 -24.857 -8.441 1.00 0.00 C ATOM 1162 CG LYS A 77 1.683 -24.133 -9.635 1.00 0.00 C ATOM 1163 CD LYS A 77 1.633 -24.990 -10.889 1.00 0.00 C ATOM 1164 CE LYS A 77 3.011 -25.516 -11.261 1.00 0.00 C ATOM 1165 NZ LYS A 77 2.933 -26.622 -12.254 1.00 0.00 N ATOM 0 H LYS A 77 -1.874 -25.719 -7.804 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.199 -23.491 -7.390 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.756 -24.748 -7.588 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.027 -25.922 -8.665 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.140 -23.203 -9.807 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.717 -23.863 -9.419 1.00 0.00 H new ATOM 0 HD2 LYS A 77 0.953 -25.827 -10.732 1.00 0.00 H new ATOM 0 HD3 LYS A 77 1.231 -24.404 -11.715 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.612 -24.703 -11.669 1.00 0.00 H new ATOM 0 HE3 LYS A 77 3.519 -25.869 -10.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 3.892 -26.953 -12.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.381 -27.408 -11.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.471 -26.279 -13.120 1.00 0.00 H new ATOM 1179 N GLN A 78 -1.945 -22.931 -9.133 1.00 0.00 N ATOM 1180 CA GLN A 78 -2.737 -22.423 -10.246 1.00 0.00 C ATOM 1181 C GLN A 78 -3.359 -21.074 -9.900 1.00 0.00 C ATOM 1182 O GLN A 78 -3.279 -20.617 -8.760 1.00 0.00 O ATOM 1183 CB GLN A 78 -3.834 -23.423 -10.618 1.00 0.00 C ATOM 1184 CG GLN A 78 -3.418 -24.407 -11.700 1.00 0.00 C ATOM 1185 CD GLN A 78 -3.475 -25.847 -11.232 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -2.443 -26.483 -11.017 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -4.685 -26.370 -11.072 1.00 0.00 N ATOM 0 H GLN A 78 -2.125 -22.470 -8.241 1.00 0.00 H new ATOM 0 HA GLN A 78 -2.073 -22.289 -11.100 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.126 -23.978 -9.726 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.714 -22.876 -10.955 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -4.068 -24.285 -12.566 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -2.404 -24.175 -12.027 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -5.513 -25.806 -11.262 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -4.786 -27.336 -10.759 1.00 0.00 H new ATOM 1196 N ILE A 79 -3.978 -20.442 -10.892 1.00 0.00 N ATOM 1197 CA ILE A 79 -4.614 -19.145 -10.691 1.00 0.00 C ATOM 1198 C ILE A 79 -6.124 -19.239 -10.878 1.00 0.00 C ATOM 1199 O ILE A 79 -6.606 -19.631 -11.941 1.00 0.00 O ATOM 1200 CB ILE A 79 -4.053 -18.088 -11.660 1.00 0.00 C ATOM 1201 CG1 ILE A 79 -2.930 -17.294 -10.989 1.00 0.00 C ATOM 1202 CG2 ILE A 79 -5.162 -17.156 -12.126 1.00 0.00 C ATOM 1203 CD1 ILE A 79 -2.609 -15.992 -11.689 1.00 0.00 C ATOM 0 H ILE A 79 -4.053 -20.806 -11.842 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.395 -18.841 -9.667 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.642 -18.597 -12.532 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.212 -17.083 -9.957 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.031 -17.910 -10.954 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.750 -16.414 -12.810 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.932 -17.734 -12.637 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.599 -16.651 -11.264 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.804 -15.483 -11.159 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.296 -16.197 -12.713 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.495 -15.357 -11.700 1.00 0.00 H new ATOM 1215 N TRP A 80 -6.867 -18.876 -9.838 1.00 0.00 N ATOM 1216 CA TRP A 80 -8.324 -18.917 -9.888 1.00 0.00 C ATOM 1217 C TRP A 80 -8.889 -17.596 -10.398 1.00 0.00 C ATOM 1218 O TRP A 80 -8.510 -16.523 -9.925 1.00 0.00 O ATOM 1219 CB TRP A 80 -8.893 -19.229 -8.503 1.00 0.00 C ATOM 1220 CG TRP A 80 -9.006 -20.697 -8.224 1.00 0.00 C ATOM 1221 CD1 TRP A 80 -8.037 -21.643 -8.404 1.00 0.00 C ATOM 1222 CD2 TRP A 80 -10.154 -21.387 -7.717 1.00 0.00 C ATOM 1223 NE1 TRP A 80 -8.514 -22.879 -8.040 1.00 0.00 N ATOM 1224 CE2 TRP A 80 -9.809 -22.749 -7.614 1.00 0.00 C ATOM 1225 CE3 TRP A 80 -11.438 -20.987 -7.339 1.00 0.00 C ATOM 1226 CZ2 TRP A 80 -10.703 -23.710 -7.150 1.00 0.00 C ATOM 1227 CZ3 TRP A 80 -12.325 -21.942 -6.879 1.00 0.00 C ATOM 1228 CH2 TRP A 80 -11.954 -23.290 -6.786 1.00 0.00 C ATOM 0 H TRP A 80 -6.484 -18.550 -8.950 1.00 0.00 H new ATOM 0 HA TRP A 80 -8.617 -19.707 -10.580 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -8.258 -18.770 -7.745 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -9.878 -18.772 -8.412 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -7.043 -21.448 -8.777 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -7.989 -23.752 -8.081 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.732 -19.950 -7.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -10.420 -24.750 -7.080 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -13.321 -21.644 -6.586 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -12.669 -24.012 -6.420 1.00 0.00 H new ATOM 1239 N LEU A 81 -9.796 -17.679 -11.364 1.00 0.00 N ATOM 1240 CA LEU A 81 -10.414 -16.489 -11.938 1.00 0.00 C ATOM 1241 C LEU A 81 -11.928 -16.518 -11.753 1.00 0.00 C ATOM 1242 O LEU A 81 -12.635 -17.241 -12.455 1.00 0.00 O ATOM 1243 CB LEU A 81 -10.073 -16.380 -13.425 1.00 0.00 C ATOM 1244 CG LEU A 81 -10.156 -14.979 -14.032 1.00 0.00 C ATOM 1245 CD1 LEU A 81 -11.073 -14.976 -15.245 1.00 0.00 C ATOM 1246 CD2 LEU A 81 -10.639 -13.976 -12.994 1.00 0.00 C ATOM 0 H LEU A 81 -10.120 -18.558 -11.767 1.00 0.00 H new ATOM 0 HA LEU A 81 -10.019 -15.617 -11.416 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -9.062 -16.759 -13.574 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -10.744 -17.035 -13.980 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.158 -14.685 -14.356 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.120 -13.971 -15.663 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -10.685 -15.664 -15.996 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.073 -15.291 -14.946 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.692 -12.984 -13.443 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -11.628 -14.267 -12.639 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.944 -13.957 -12.155 1.00 0.00 H new ATOM 1258 N ALA A 82 -12.419 -15.726 -10.805 1.00 0.00 N ATOM 1259 CA ALA A 82 -13.849 -15.658 -10.531 1.00 0.00 C ATOM 1260 C ALA A 82 -14.519 -14.580 -11.375 1.00 0.00 C ATOM 1261 O ALA A 82 -14.482 -13.398 -11.033 1.00 0.00 O ATOM 1262 CB ALA A 82 -14.091 -15.400 -9.051 1.00 0.00 C ATOM 0 H ALA A 82 -11.847 -15.123 -10.214 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.291 -16.618 -10.798 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -15.163 -15.352 -8.861 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -13.654 -16.209 -8.465 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.629 -14.455 -8.766 1.00 0.00 H new ATOM 1268 N SER A 83 -15.130 -14.994 -12.480 1.00 0.00 N ATOM 1269 CA SER A 83 -15.805 -14.062 -13.376 1.00 0.00 C ATOM 1270 C SER A 83 -16.722 -13.125 -12.595 1.00 0.00 C ATOM 1271 O SER A 83 -16.985 -13.320 -11.408 1.00 0.00 O ATOM 1272 CB SER A 83 -16.612 -14.826 -14.427 1.00 0.00 C ATOM 1273 OG SER A 83 -16.065 -14.645 -15.722 1.00 0.00 O ATOM 0 H SER A 83 -15.172 -15.969 -12.777 1.00 0.00 H new ATOM 0 HA SER A 83 -15.045 -13.463 -13.877 1.00 0.00 H new ATOM 0 HB2 SER A 83 -16.625 -15.887 -14.179 1.00 0.00 H new ATOM 0 HB3 SER A 83 -17.647 -14.484 -14.415 1.00 0.00 H new ATOM 0 HG SER A 83 -16.598 -15.145 -16.375 1.00 0.00 H new ATOM 1279 N PRO A 84 -17.220 -12.083 -13.277 1.00 0.00 N ATOM 1280 CA PRO A 84 -18.116 -11.095 -12.668 1.00 0.00 C ATOM 1281 C PRO A 84 -19.491 -11.674 -12.355 1.00 0.00 C ATOM 1282 O PRO A 84 -20.348 -10.996 -11.786 1.00 0.00 O ATOM 1283 CB PRO A 84 -18.225 -10.007 -13.739 1.00 0.00 C ATOM 1284 CG PRO A 84 -17.943 -10.710 -15.022 1.00 0.00 C ATOM 1285 CD PRO A 84 -16.948 -11.789 -14.694 1.00 0.00 C ATOM 0 HA PRO A 84 -17.736 -10.735 -11.712 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -19.217 -9.555 -13.745 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -17.510 -9.204 -13.562 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -18.854 -11.135 -15.443 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -17.540 -10.021 -15.764 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.088 -12.669 -15.321 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -15.923 -11.450 -14.845 1.00 0.00 H new ATOM 1293 N LEU A 85 -19.697 -12.932 -12.730 1.00 0.00 N ATOM 1294 CA LEU A 85 -20.970 -13.603 -12.489 1.00 0.00 C ATOM 1295 C LEU A 85 -20.763 -14.900 -11.713 1.00 0.00 C ATOM 1296 O LEU A 85 -21.492 -15.873 -11.905 1.00 0.00 O ATOM 1297 CB LEU A 85 -21.674 -13.896 -13.815 1.00 0.00 C ATOM 1298 CG LEU A 85 -23.192 -14.060 -13.747 1.00 0.00 C ATOM 1299 CD1 LEU A 85 -23.860 -12.726 -13.454 1.00 0.00 C ATOM 1300 CD2 LEU A 85 -23.724 -14.651 -15.045 1.00 0.00 C ATOM 0 H LEU A 85 -18.999 -13.508 -13.202 1.00 0.00 H new ATOM 0 HA LEU A 85 -21.595 -12.939 -11.892 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -21.447 -13.088 -14.510 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -21.249 -14.807 -14.236 1.00 0.00 H new ATOM 0 HG LEU A 85 -23.428 -14.748 -12.935 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -24.941 -12.862 -13.409 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -23.503 -12.342 -12.498 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -23.616 -12.016 -14.244 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -24.806 -14.761 -14.978 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -23.477 -13.989 -15.875 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -23.270 -15.628 -15.213 1.00 0.00 H new ATOM 1312 N SER A 86 -19.766 -14.905 -10.834 1.00 0.00 N ATOM 1313 CA SER A 86 -19.462 -16.082 -10.029 1.00 0.00 C ATOM 1314 C SER A 86 -18.996 -17.237 -10.911 1.00 0.00 C ATOM 1315 O SER A 86 -19.630 -18.290 -10.960 1.00 0.00 O ATOM 1316 CB SER A 86 -20.691 -16.506 -9.222 1.00 0.00 C ATOM 1317 OG SER A 86 -20.315 -17.223 -8.059 1.00 0.00 O ATOM 0 H SER A 86 -19.155 -14.107 -10.661 1.00 0.00 H new ATOM 0 HA SER A 86 -18.656 -15.824 -9.342 1.00 0.00 H new ATOM 0 HB2 SER A 86 -21.266 -15.624 -8.939 1.00 0.00 H new ATOM 0 HB3 SER A 86 -21.340 -17.125 -9.841 1.00 0.00 H new ATOM 0 HG SER A 86 -21.118 -17.481 -7.560 1.00 0.00 H new ATOM 1323 N GLY A 87 -17.882 -17.030 -11.606 1.00 0.00 N ATOM 1324 CA GLY A 87 -17.348 -18.062 -12.477 1.00 0.00 C ATOM 1325 C GLY A 87 -15.858 -18.264 -12.291 1.00 0.00 C ATOM 1326 O GLY A 87 -15.038 -17.713 -13.025 1.00 0.00 O ATOM 0 H GLY A 87 -17.339 -16.167 -11.582 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -17.866 -19.001 -12.282 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -17.549 -17.797 -13.515 1.00 0.00 H new ATOM 1330 N PRO A 88 -15.488 -19.072 -11.286 1.00 0.00 N ATOM 1331 CA PRO A 88 -14.084 -19.364 -10.981 1.00 0.00 C ATOM 1332 C PRO A 88 -13.426 -20.230 -12.050 1.00 0.00 C ATOM 1333 O PRO A 88 -13.996 -21.227 -12.492 1.00 0.00 O ATOM 1334 CB PRO A 88 -14.160 -20.120 -9.652 1.00 0.00 C ATOM 1335 CG PRO A 88 -15.520 -20.728 -9.639 1.00 0.00 C ATOM 1336 CD PRO A 88 -16.412 -19.764 -10.371 1.00 0.00 C ATOM 0 HA PRO A 88 -13.479 -18.458 -10.938 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -13.385 -20.883 -9.586 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -14.019 -19.448 -8.806 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -15.516 -21.703 -10.126 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.868 -20.883 -8.618 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.203 -20.281 -10.914 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.898 -19.067 -9.688 1.00 0.00 H new ATOM 1344 N ASN A 89 -12.223 -19.843 -12.461 1.00 0.00 N ATOM 1345 CA ASN A 89 -11.488 -20.584 -13.478 1.00 0.00 C ATOM 1346 C ASN A 89 -10.014 -20.710 -13.102 1.00 0.00 C ATOM 1347 O ASN A 89 -9.273 -19.727 -13.121 1.00 0.00 O ATOM 1348 CB ASN A 89 -11.622 -19.895 -14.838 1.00 0.00 C ATOM 1349 CG ASN A 89 -12.788 -20.431 -15.646 1.00 0.00 C ATOM 1350 OD1 ASN A 89 -12.614 -21.284 -16.516 1.00 0.00 O ATOM 1351 ND2 ASN A 89 -13.984 -19.931 -15.360 1.00 0.00 N ATOM 0 H ASN A 89 -11.737 -19.020 -12.105 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.915 -21.585 -13.542 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -11.750 -18.823 -14.688 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -10.700 -20.030 -15.403 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -14.807 -20.253 -15.870 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -14.080 -19.225 -14.630 1.00 0.00 H new ATOM 1358 N ARG A 90 -9.598 -21.925 -12.762 1.00 0.00 N ATOM 1359 CA ARG A 90 -8.214 -22.179 -12.380 1.00 0.00 C ATOM 1360 C ARG A 90 -7.302 -22.169 -13.604 1.00 0.00 C ATOM 1361 O ARG A 90 -7.652 -22.703 -14.656 1.00 0.00 O ATOM 1362 CB ARG A 90 -8.100 -23.522 -11.657 1.00 0.00 C ATOM 1363 CG ARG A 90 -8.158 -24.722 -12.589 1.00 0.00 C ATOM 1364 CD ARG A 90 -9.429 -24.718 -13.423 1.00 0.00 C ATOM 1365 NE ARG A 90 -9.523 -25.894 -14.284 1.00 0.00 N ATOM 1366 CZ ARG A 90 -10.615 -26.221 -14.965 1.00 0.00 C ATOM 1367 NH1 ARG A 90 -11.701 -25.465 -14.887 1.00 0.00 N ATOM 1368 NH2 ARG A 90 -10.623 -27.307 -15.728 1.00 0.00 N ATOM 0 H ARG A 90 -10.199 -22.749 -12.743 1.00 0.00 H new ATOM 0 HA ARG A 90 -7.898 -21.383 -11.705 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -7.162 -23.548 -11.103 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.905 -23.601 -10.926 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.289 -24.715 -13.247 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -8.108 -25.641 -12.005 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -10.296 -24.682 -12.763 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -9.458 -23.817 -14.036 1.00 0.00 H new ATOM 0 HE ARG A 90 -8.705 -26.497 -14.367 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -11.700 -24.629 -14.303 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -12.538 -25.719 -15.411 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -9.790 -27.892 -15.792 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -11.463 -27.557 -16.251 1.00 0.00 H new ATOM 1382 N PHE A 91 -6.131 -21.557 -13.458 1.00 0.00 N ATOM 1383 CA PHE A 91 -5.170 -21.476 -14.551 1.00 0.00 C ATOM 1384 C PHE A 91 -3.878 -22.206 -14.195 1.00 0.00 C ATOM 1385 O PHE A 91 -3.436 -22.184 -13.046 1.00 0.00 O ATOM 1386 CB PHE A 91 -4.866 -20.014 -14.884 1.00 0.00 C ATOM 1387 CG PHE A 91 -5.955 -19.340 -15.670 1.00 0.00 C ATOM 1388 CD1 PHE A 91 -7.072 -18.826 -15.031 1.00 0.00 C ATOM 1389 CD2 PHE A 91 -5.861 -19.221 -17.047 1.00 0.00 C ATOM 1390 CE1 PHE A 91 -8.075 -18.204 -15.751 1.00 0.00 C ATOM 1391 CE2 PHE A 91 -6.861 -18.600 -17.772 1.00 0.00 C ATOM 1392 CZ PHE A 91 -7.969 -18.093 -17.124 1.00 0.00 C ATOM 0 H PHE A 91 -5.825 -21.110 -12.594 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.610 -21.957 -15.424 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -4.704 -19.464 -13.957 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -3.936 -19.964 -15.450 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -7.160 -18.912 -13.958 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -4.997 -19.618 -17.560 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -8.940 -17.806 -15.241 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.775 -18.512 -18.845 1.00 0.00 H new ATOM 0 HZ PHE A 91 -8.752 -17.610 -17.689 1.00 0.00 H new ATOM 1402 N ASP A 92 -3.279 -22.854 -15.188 1.00 0.00 N ATOM 1403 CA ASP A 92 -2.038 -23.591 -14.981 1.00 0.00 C ATOM 1404 C ASP A 92 -0.848 -22.822 -15.547 1.00 0.00 C ATOM 1405 O ASP A 92 -0.834 -22.456 -16.723 1.00 0.00 O ATOM 1406 CB ASP A 92 -2.125 -24.972 -15.633 1.00 0.00 C ATOM 1407 CG ASP A 92 -0.801 -25.421 -16.218 1.00 0.00 C ATOM 1408 OD1 ASP A 92 0.035 -25.952 -15.457 1.00 0.00 O ATOM 1409 OD2 ASP A 92 -0.600 -25.242 -17.437 1.00 0.00 O ATOM 0 H ASP A 92 -3.633 -22.884 -16.144 1.00 0.00 H new ATOM 0 HA ASP A 92 -1.892 -23.713 -13.908 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -2.457 -25.700 -14.893 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.878 -24.952 -16.420 1.00 0.00 H new ATOM 1414 N LEU A 93 0.148 -22.579 -14.703 1.00 0.00 N ATOM 1415 CA LEU A 93 1.343 -21.852 -15.118 1.00 0.00 C ATOM 1416 C LEU A 93 2.188 -22.691 -16.072 1.00 0.00 C ATOM 1417 O LEU A 93 2.771 -23.701 -15.676 1.00 0.00 O ATOM 1418 CB LEU A 93 2.174 -21.456 -13.897 1.00 0.00 C ATOM 1419 CG LEU A 93 3.686 -21.646 -14.023 1.00 0.00 C ATOM 1420 CD1 LEU A 93 4.202 -20.990 -15.295 1.00 0.00 C ATOM 1421 CD2 LEU A 93 4.398 -21.080 -12.803 1.00 0.00 C ATOM 0 H LEU A 93 0.152 -22.875 -13.727 1.00 0.00 H new ATOM 0 HA LEU A 93 1.025 -20.950 -15.641 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.977 -20.407 -13.673 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.825 -22.035 -13.042 1.00 0.00 H new ATOM 0 HG LEU A 93 3.895 -22.714 -14.078 1.00 0.00 H new ATOM 0 HD11 LEU A 93 5.280 -21.135 -15.368 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.716 -21.441 -16.160 1.00 0.00 H new ATOM 0 HD13 LEU A 93 3.981 -19.923 -15.270 1.00 0.00 H new ATOM 0 HD21 LEU A 93 5.473 -21.224 -12.910 1.00 0.00 H new ATOM 0 HD22 LEU A 93 4.181 -20.015 -12.717 1.00 0.00 H new ATOM 0 HD23 LEU A 93 4.050 -21.595 -11.907 1.00 0.00 H new ATOM 1433 N LEU A 94 2.250 -22.267 -17.329 1.00 0.00 N ATOM 1434 CA LEU A 94 3.025 -22.978 -18.339 1.00 0.00 C ATOM 1435 C LEU A 94 3.993 -22.035 -19.046 1.00 0.00 C ATOM 1436 O LEU A 94 3.578 -21.127 -19.764 1.00 0.00 O ATOM 1437 CB LEU A 94 2.092 -23.630 -19.361 1.00 0.00 C ATOM 1438 CG LEU A 94 2.724 -24.684 -20.271 1.00 0.00 C ATOM 1439 CD1 LEU A 94 2.835 -26.017 -19.546 1.00 0.00 C ATOM 1440 CD2 LEU A 94 1.917 -24.837 -21.551 1.00 0.00 C ATOM 0 H LEU A 94 1.773 -21.434 -17.673 1.00 0.00 H new ATOM 0 HA LEU A 94 3.604 -23.754 -17.838 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.264 -24.092 -18.824 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.667 -22.846 -19.988 1.00 0.00 H new ATOM 0 HG LEU A 94 3.728 -24.353 -20.536 1.00 0.00 H new ATOM 0 HD11 LEU A 94 3.287 -26.755 -20.209 1.00 0.00 H new ATOM 0 HD12 LEU A 94 3.456 -25.898 -18.658 1.00 0.00 H new ATOM 0 HD13 LEU A 94 1.841 -26.354 -19.251 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.382 -25.591 -22.186 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.901 -25.145 -21.306 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.889 -23.884 -22.080 1.00 0.00 H new ATOM 1452 N ASN A 95 5.287 -22.259 -18.839 1.00 0.00 N ATOM 1453 CA ASN A 95 6.315 -21.430 -19.458 1.00 0.00 C ATOM 1454 C ASN A 95 6.134 -19.964 -19.078 1.00 0.00 C ATOM 1455 O ASN A 95 6.257 -19.074 -19.918 1.00 0.00 O ATOM 1456 CB ASN A 95 6.274 -21.583 -20.980 1.00 0.00 C ATOM 1457 CG ASN A 95 6.524 -23.010 -21.426 1.00 0.00 C ATOM 1458 OD1 ASN A 95 6.202 -23.961 -20.712 1.00 0.00 O ATOM 1459 ND2 ASN A 95 7.102 -23.168 -22.611 1.00 0.00 N ATOM 0 H ASN A 95 5.648 -23.007 -18.248 1.00 0.00 H new ATOM 0 HA ASN A 95 7.286 -21.764 -19.092 1.00 0.00 H new ATOM 0 HB2 ASN A 95 5.302 -21.255 -21.349 1.00 0.00 H new ATOM 0 HB3 ASN A 95 7.022 -20.929 -21.428 1.00 0.00 H new ATOM 0 HD21 ASN A 95 7.296 -24.106 -22.963 1.00 0.00 H new ATOM 0 HD22 ASN A 95 7.352 -22.352 -23.169 1.00 0.00 H new ATOM 1466 N GLY A 96 5.840 -19.721 -17.804 1.00 0.00 N ATOM 1467 CA GLY A 96 5.647 -18.362 -17.333 1.00 0.00 C ATOM 1468 C GLY A 96 4.316 -17.781 -17.768 1.00 0.00 C ATOM 1469 O GLY A 96 4.033 -16.610 -17.522 1.00 0.00 O ATOM 0 H GLY A 96 5.732 -20.441 -17.090 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.709 -18.346 -16.245 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.454 -17.733 -17.708 1.00 0.00 H new ATOM 1473 N GLU A 97 3.499 -18.603 -18.419 1.00 0.00 N ATOM 1474 CA GLU A 97 2.191 -18.162 -18.892 1.00 0.00 C ATOM 1475 C GLU A 97 1.089 -19.088 -18.384 1.00 0.00 C ATOM 1476 O GLU A 97 1.048 -20.268 -18.730 1.00 0.00 O ATOM 1477 CB GLU A 97 2.167 -18.112 -20.421 1.00 0.00 C ATOM 1478 CG GLU A 97 2.978 -16.968 -21.005 1.00 0.00 C ATOM 1479 CD GLU A 97 2.129 -15.753 -21.322 1.00 0.00 C ATOM 1480 OE1 GLU A 97 1.922 -14.921 -20.414 1.00 0.00 O ATOM 1481 OE2 GLU A 97 1.671 -15.633 -22.478 1.00 0.00 O ATOM 0 H GLU A 97 3.719 -19.576 -18.631 1.00 0.00 H new ATOM 0 HA GLU A 97 2.010 -17.161 -18.501 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.549 -19.054 -20.813 1.00 0.00 H new ATOM 0 HB3 GLU A 97 1.134 -18.023 -20.757 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.761 -16.686 -20.301 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.475 -17.307 -21.914 1.00 0.00 H new ATOM 1488 N TRP A 98 0.199 -18.543 -17.563 1.00 0.00 N ATOM 1489 CA TRP A 98 -0.903 -19.320 -17.007 1.00 0.00 C ATOM 1490 C TRP A 98 -1.999 -19.530 -18.046 1.00 0.00 C ATOM 1491 O TRP A 98 -2.454 -18.581 -18.684 1.00 0.00 O ATOM 1492 CB TRP A 98 -1.479 -18.618 -15.776 1.00 0.00 C ATOM 1493 CG TRP A 98 -0.427 -18.085 -14.850 1.00 0.00 C ATOM 1494 CD1 TRP A 98 0.283 -16.928 -14.995 1.00 0.00 C ATOM 1495 CD2 TRP A 98 0.034 -18.691 -13.638 1.00 0.00 C ATOM 1496 NE1 TRP A 98 1.157 -16.778 -13.946 1.00 0.00 N ATOM 1497 CE2 TRP A 98 1.023 -17.846 -13.099 1.00 0.00 C ATOM 1498 CE3 TRP A 98 -0.294 -19.865 -12.953 1.00 0.00 C ATOM 1499 CZ2 TRP A 98 1.686 -18.139 -11.910 1.00 0.00 C ATOM 1500 CZ3 TRP A 98 0.365 -20.155 -11.774 1.00 0.00 C ATOM 1501 CH2 TRP A 98 1.345 -19.295 -11.262 1.00 0.00 C ATOM 0 H TRP A 98 0.219 -17.567 -17.268 1.00 0.00 H new ATOM 0 HA TRP A 98 -0.515 -20.295 -16.713 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -2.117 -17.796 -16.101 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -2.112 -19.318 -15.231 1.00 0.00 H new ATOM 0 HD1 TRP A 98 0.174 -16.233 -15.814 1.00 0.00 H new ATOM 0 HE1 TRP A 98 1.801 -15.998 -13.818 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -1.049 -20.533 -13.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 2.442 -17.478 -11.514 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.120 -21.060 -11.238 1.00 0.00 H new ATOM 0 HH2 TRP A 98 1.841 -19.549 -10.337 1.00 0.00 H new ATOM 1512 N VAL A 99 -2.420 -20.780 -18.211 1.00 0.00 N ATOM 1513 CA VAL A 99 -3.464 -21.115 -19.172 1.00 0.00 C ATOM 1514 C VAL A 99 -4.493 -22.058 -18.560 1.00 0.00 C ATOM 1515 O VAL A 99 -4.144 -23.105 -18.014 1.00 0.00 O ATOM 1516 CB VAL A 99 -2.874 -21.768 -20.437 1.00 0.00 C ATOM 1517 CG1 VAL A 99 -1.601 -21.053 -20.862 1.00 0.00 C ATOM 1518 CG2 VAL A 99 -2.612 -23.247 -20.200 1.00 0.00 C ATOM 0 H VAL A 99 -2.054 -21.578 -17.691 1.00 0.00 H new ATOM 0 HA VAL A 99 -3.952 -20.180 -19.448 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.600 -21.677 -21.245 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.198 -21.528 -21.757 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.825 -20.008 -21.075 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.866 -21.110 -20.059 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.196 -23.692 -21.104 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.905 -23.364 -19.379 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -3.547 -23.746 -19.948 1.00 0.00 H new ATOM 1528 N SER A 100 -5.764 -21.681 -18.654 1.00 0.00 N ATOM 1529 CA SER A 100 -6.845 -22.491 -18.106 1.00 0.00 C ATOM 1530 C SER A 100 -7.651 -23.149 -19.222 1.00 0.00 C ATOM 1531 O SER A 100 -7.676 -22.663 -20.354 1.00 0.00 O ATOM 1532 CB SER A 100 -7.765 -21.632 -17.236 1.00 0.00 C ATOM 1533 OG SER A 100 -8.865 -22.386 -16.758 1.00 0.00 O ATOM 0 H SER A 100 -6.070 -20.819 -19.105 1.00 0.00 H new ATOM 0 HA SER A 100 -6.402 -23.274 -17.491 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.203 -21.229 -16.394 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.127 -20.781 -17.813 1.00 0.00 H new ATOM 0 HG SER A 100 -8.591 -22.901 -15.971 1.00 0.00 H new ATOM 1539 N LEU A 101 -8.308 -24.256 -18.896 1.00 0.00 N ATOM 1540 CA LEU A 101 -9.115 -24.982 -19.870 1.00 0.00 C ATOM 1541 C LEU A 101 -8.243 -25.885 -20.736 1.00 0.00 C ATOM 1542 O LEU A 101 -7.399 -25.407 -21.495 1.00 0.00 O ATOM 1543 CB LEU A 101 -9.888 -24.001 -20.754 1.00 0.00 C ATOM 1544 CG LEU A 101 -11.243 -24.487 -21.270 1.00 0.00 C ATOM 1545 CD1 LEU A 101 -12.071 -25.066 -20.134 1.00 0.00 C ATOM 1546 CD2 LEU A 101 -11.992 -23.351 -21.953 1.00 0.00 C ATOM 0 H LEU A 101 -8.298 -24.671 -17.964 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.823 -25.606 -19.325 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -10.045 -23.081 -20.191 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -9.265 -23.747 -21.612 1.00 0.00 H new ATOM 0 HG LEU A 101 -11.069 -25.275 -22.003 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -13.032 -25.406 -20.521 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -11.540 -25.908 -19.689 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -12.236 -24.300 -19.377 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -12.954 -23.715 -22.314 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.154 -22.542 -21.241 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -11.405 -22.982 -22.794 1.00 0.00 H new ATOM 1558 N ARG A 102 -8.453 -27.192 -20.619 1.00 0.00 N ATOM 1559 CA ARG A 102 -7.687 -28.161 -21.392 1.00 0.00 C ATOM 1560 C ARG A 102 -7.317 -27.596 -22.761 1.00 0.00 C ATOM 1561 O ARG A 102 -6.243 -27.877 -23.290 1.00 0.00 O ATOM 1562 CB ARG A 102 -8.485 -29.455 -21.562 1.00 0.00 C ATOM 1563 CG ARG A 102 -7.652 -30.622 -22.068 1.00 0.00 C ATOM 1564 CD ARG A 102 -7.979 -31.905 -21.320 1.00 0.00 C ATOM 1565 NE ARG A 102 -7.956 -31.716 -19.872 1.00 0.00 N ATOM 1566 CZ ARG A 102 -6.842 -31.720 -19.148 1.00 0.00 C ATOM 1567 NH1 ARG A 102 -5.667 -31.902 -19.735 1.00 0.00 N ATOM 1568 NH2 ARG A 102 -6.902 -31.541 -17.835 1.00 0.00 N ATOM 0 H ARG A 102 -9.148 -27.604 -19.996 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.768 -28.377 -20.847 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.931 -29.726 -20.605 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.306 -29.277 -22.257 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.833 -30.765 -23.133 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -6.593 -30.392 -21.952 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -8.964 -32.260 -21.623 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -7.262 -32.678 -21.596 1.00 0.00 H new ATOM 0 HE ARG A 102 -8.844 -31.573 -19.390 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -5.617 -32.039 -20.744 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -4.813 -31.905 -19.177 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -7.804 -31.400 -17.380 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -6.046 -31.544 -17.280 1.00 0.00 H new ATOM 1582 N ASN A 103 -8.216 -26.797 -23.328 1.00 0.00 N ATOM 1583 CA ASN A 103 -7.985 -26.193 -24.635 1.00 0.00 C ATOM 1584 C ASN A 103 -6.731 -25.324 -24.619 1.00 0.00 C ATOM 1585 O ASN A 103 -5.862 -25.455 -25.479 1.00 0.00 O ATOM 1586 CB ASN A 103 -9.195 -25.355 -25.053 1.00 0.00 C ATOM 1587 CG ASN A 103 -8.838 -24.299 -26.082 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -9.144 -23.119 -25.908 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -8.189 -24.720 -27.161 1.00 0.00 N ATOM 0 H ASN A 103 -9.111 -26.553 -22.903 1.00 0.00 H new ATOM 0 HA ASN A 103 -7.840 -26.995 -25.358 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -9.964 -26.011 -25.461 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -9.621 -24.872 -24.173 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -7.923 -24.056 -27.888 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.956 -25.708 -27.263 1.00 0.00 H new ATOM 1596 N GLY A 104 -6.645 -24.437 -23.632 1.00 0.00 N ATOM 1597 CA GLY A 104 -5.494 -23.560 -23.521 1.00 0.00 C ATOM 1598 C GLY A 104 -5.860 -22.099 -23.692 1.00 0.00 C ATOM 1599 O GLY A 104 -5.691 -21.530 -24.771 1.00 0.00 O ATOM 0 H GLY A 104 -7.352 -24.310 -22.908 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.025 -23.702 -22.547 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -4.756 -23.837 -24.274 1.00 0.00 H new ATOM 1603 N THR A 105 -6.365 -21.488 -22.625 1.00 0.00 N ATOM 1604 CA THR A 105 -6.759 -20.085 -22.662 1.00 0.00 C ATOM 1605 C THR A 105 -5.991 -19.271 -21.627 1.00 0.00 C ATOM 1606 O THR A 105 -5.863 -19.678 -20.472 1.00 0.00 O ATOM 1607 CB THR A 105 -8.270 -19.919 -22.411 1.00 0.00 C ATOM 1608 OG1 THR A 105 -8.816 -21.135 -21.889 1.00 0.00 O ATOM 1609 CG2 THR A 105 -8.993 -19.543 -23.695 1.00 0.00 C ATOM 0 H THR A 105 -6.511 -21.943 -21.724 1.00 0.00 H new ATOM 0 HA THR A 105 -6.521 -19.716 -23.660 1.00 0.00 H new ATOM 0 HB THR A 105 -8.410 -19.118 -21.686 1.00 0.00 H new ATOM 0 HG1 THR A 105 -8.357 -21.369 -21.056 1.00 0.00 H new ATOM 0 HG21 THR A 105 -10.058 -19.431 -23.493 1.00 0.00 H new ATOM 0 HG22 THR A 105 -8.595 -18.602 -24.075 1.00 0.00 H new ATOM 0 HG23 THR A 105 -8.845 -20.326 -24.439 1.00 0.00 H new ATOM 1617 N LYS A 106 -5.481 -18.118 -22.047 1.00 0.00 N ATOM 1618 CA LYS A 106 -4.727 -17.245 -21.157 1.00 0.00 C ATOM 1619 C LYS A 106 -5.665 -16.419 -20.282 1.00 0.00 C ATOM 1620 O LYS A 106 -6.748 -16.023 -20.716 1.00 0.00 O ATOM 1621 CB LYS A 106 -3.820 -16.316 -21.967 1.00 0.00 C ATOM 1622 CG LYS A 106 -2.397 -16.829 -22.109 1.00 0.00 C ATOM 1623 CD LYS A 106 -2.247 -17.729 -23.324 1.00 0.00 C ATOM 1624 CE LYS A 106 -1.053 -17.324 -24.174 1.00 0.00 C ATOM 1625 NZ LYS A 106 -1.334 -16.102 -24.979 1.00 0.00 N ATOM 0 H LYS A 106 -5.577 -17.767 -23.000 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.112 -17.871 -20.511 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.249 -16.178 -22.960 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -3.798 -15.336 -21.490 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -1.712 -15.985 -22.193 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -2.116 -17.379 -21.211 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -2.130 -18.763 -23.000 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -3.155 -17.684 -23.925 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -0.193 -17.144 -23.529 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -0.786 -18.144 -24.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -0.496 -15.859 -25.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -2.139 -16.281 -25.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -1.564 -15.312 -24.343 1.00 0.00 H new ATOM 1639 N LEU A 107 -5.243 -16.161 -19.049 1.00 0.00 N ATOM 1640 CA LEU A 107 -6.044 -15.381 -18.113 1.00 0.00 C ATOM 1641 C LEU A 107 -6.288 -13.973 -18.648 1.00 0.00 C ATOM 1642 O LEU A 107 -7.350 -13.681 -19.200 1.00 0.00 O ATOM 1643 CB LEU A 107 -5.349 -15.308 -16.752 1.00 0.00 C ATOM 1644 CG LEU A 107 -6.030 -14.437 -15.696 1.00 0.00 C ATOM 1645 CD1 LEU A 107 -6.784 -15.300 -14.697 1.00 0.00 C ATOM 1646 CD2 LEU A 107 -5.006 -13.564 -14.985 1.00 0.00 C ATOM 0 H LEU A 107 -4.350 -16.481 -18.674 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.007 -15.878 -17.995 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.260 -16.320 -16.357 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.336 -14.935 -16.903 1.00 0.00 H new ATOM 0 HG LEU A 107 -6.748 -13.787 -16.196 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.262 -14.662 -13.953 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.544 -15.881 -15.219 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.087 -15.976 -14.201 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -5.508 -12.951 -14.237 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -4.264 -14.197 -14.497 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.511 -12.919 -15.711 1.00 0.00 H new ATOM 1658 N THR A 108 -5.297 -13.102 -18.481 1.00 0.00 N ATOM 1659 CA THR A 108 -5.403 -11.726 -18.948 1.00 0.00 C ATOM 1660 C THR A 108 -6.064 -11.659 -20.320 1.00 0.00 C ATOM 1661 O THR A 108 -6.639 -10.636 -20.694 1.00 0.00 O ATOM 1662 CB THR A 108 -4.021 -11.050 -19.023 1.00 0.00 C ATOM 1663 OG1 THR A 108 -4.168 -9.672 -19.382 1.00 0.00 O ATOM 1664 CG2 THR A 108 -3.131 -11.751 -20.038 1.00 0.00 C ATOM 0 H THR A 108 -4.412 -13.326 -18.026 1.00 0.00 H new ATOM 0 HA THR A 108 -6.021 -11.194 -18.224 1.00 0.00 H new ATOM 0 HB THR A 108 -3.553 -11.121 -18.041 1.00 0.00 H new ATOM 0 HG1 THR A 108 -3.285 -9.249 -19.426 1.00 0.00 H new ATOM 0 HG21 THR A 108 -2.160 -11.256 -20.074 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.997 -12.793 -19.746 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.597 -11.707 -21.022 1.00 0.00 H new ATOM 1672 N ASP A 109 -5.980 -12.755 -21.066 1.00 0.00 N ATOM 1673 CA ASP A 109 -6.572 -12.822 -22.397 1.00 0.00 C ATOM 1674 C ASP A 109 -8.091 -12.932 -22.311 1.00 0.00 C ATOM 1675 O ASP A 109 -8.814 -12.242 -23.029 1.00 0.00 O ATOM 1676 CB ASP A 109 -6.004 -14.012 -23.171 1.00 0.00 C ATOM 1677 CG ASP A 109 -5.428 -13.607 -24.514 1.00 0.00 C ATOM 1678 OD1 ASP A 109 -4.444 -12.838 -24.529 1.00 0.00 O ATOM 1679 OD2 ASP A 109 -5.960 -14.059 -25.549 1.00 0.00 O ATOM 0 H ASP A 109 -5.507 -13.610 -20.771 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.322 -11.902 -22.926 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.227 -14.492 -22.576 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.790 -14.751 -23.324 1.00 0.00 H new ATOM 1684 N ILE A 110 -8.566 -13.804 -21.429 1.00 0.00 N ATOM 1685 CA ILE A 110 -9.999 -14.004 -21.250 1.00 0.00 C ATOM 1686 C ILE A 110 -10.626 -12.840 -20.490 1.00 0.00 C ATOM 1687 O ILE A 110 -11.784 -12.488 -20.717 1.00 0.00 O ATOM 1688 CB ILE A 110 -10.295 -15.314 -20.495 1.00 0.00 C ATOM 1689 CG1 ILE A 110 -10.866 -16.362 -21.452 1.00 0.00 C ATOM 1690 CG2 ILE A 110 -11.258 -15.057 -19.346 1.00 0.00 C ATOM 1691 CD1 ILE A 110 -9.945 -16.691 -22.606 1.00 0.00 C ATOM 0 H ILE A 110 -7.980 -14.383 -20.827 1.00 0.00 H new ATOM 0 HA ILE A 110 -10.436 -14.062 -22.247 1.00 0.00 H new ATOM 0 HB ILE A 110 -9.362 -15.697 -20.082 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.077 -17.275 -20.895 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.816 -16.002 -21.847 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -11.457 -15.992 -18.822 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -10.816 -14.341 -18.654 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -12.192 -14.654 -19.737 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.414 -17.441 -23.243 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.753 -15.789 -23.187 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.003 -17.081 -22.220 1.00 0.00 H new ATOM 1703 N LEU A 111 -9.853 -12.245 -19.588 1.00 0.00 N ATOM 1704 CA LEU A 111 -10.332 -11.118 -18.795 1.00 0.00 C ATOM 1705 C LEU A 111 -10.453 -9.862 -19.652 1.00 0.00 C ATOM 1706 O LEU A 111 -11.415 -9.102 -19.527 1.00 0.00 O ATOM 1707 CB LEU A 111 -9.387 -10.858 -17.620 1.00 0.00 C ATOM 1708 CG LEU A 111 -10.052 -10.606 -16.267 1.00 0.00 C ATOM 1709 CD1 LEU A 111 -10.929 -9.365 -16.325 1.00 0.00 C ATOM 1710 CD2 LEU A 111 -10.868 -11.818 -15.840 1.00 0.00 C ATOM 0 H LEU A 111 -8.893 -12.524 -19.388 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.320 -11.370 -18.410 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.719 -11.714 -17.520 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.766 -9.996 -17.863 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.271 -10.439 -15.526 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.394 -9.202 -15.353 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -10.319 -8.500 -16.585 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.704 -9.502 -17.079 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.334 -11.621 -14.875 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.641 -12.016 -16.583 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.214 -12.686 -15.757 1.00 0.00 H new ATOM 1722 N THR A 112 -9.473 -9.650 -20.525 1.00 0.00 N ATOM 1723 CA THR A 112 -9.471 -8.488 -21.404 1.00 0.00 C ATOM 1724 C THR A 112 -10.519 -8.626 -22.502 1.00 0.00 C ATOM 1725 O THR A 112 -11.208 -7.664 -22.840 1.00 0.00 O ATOM 1726 CB THR A 112 -8.090 -8.276 -22.052 1.00 0.00 C ATOM 1727 OG1 THR A 112 -7.232 -7.562 -21.155 1.00 0.00 O ATOM 1728 CG2 THR A 112 -8.217 -7.508 -23.359 1.00 0.00 C ATOM 0 H THR A 112 -8.670 -10.268 -20.642 1.00 0.00 H new ATOM 0 HA THR A 112 -9.710 -7.624 -20.784 1.00 0.00 H new ATOM 0 HB THR A 112 -7.659 -9.255 -22.264 1.00 0.00 H new ATOM 0 HG1 THR A 112 -6.356 -7.433 -21.574 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.229 -7.371 -23.798 1.00 0.00 H new ATOM 0 HG22 THR A 112 -8.846 -8.068 -24.050 1.00 0.00 H new ATOM 0 HG23 THR A 112 -8.667 -6.534 -23.166 1.00 0.00 H new ATOM 1736 N GLU A 113 -10.635 -9.830 -23.055 1.00 0.00 N ATOM 1737 CA GLU A 113 -11.600 -10.093 -24.116 1.00 0.00 C ATOM 1738 C GLU A 113 -13.020 -10.145 -23.558 1.00 0.00 C ATOM 1739 O GLU A 113 -13.969 -9.707 -24.208 1.00 0.00 O ATOM 1740 CB GLU A 113 -11.269 -11.409 -24.822 1.00 0.00 C ATOM 1741 CG GLU A 113 -10.082 -11.311 -25.766 1.00 0.00 C ATOM 1742 CD GLU A 113 -10.365 -10.431 -26.969 1.00 0.00 C ATOM 1743 OE1 GLU A 113 -11.390 -10.661 -27.643 1.00 0.00 O ATOM 1744 OE2 GLU A 113 -9.560 -9.514 -27.235 1.00 0.00 O ATOM 0 H GLU A 113 -10.073 -10.638 -22.786 1.00 0.00 H new ATOM 0 HA GLU A 113 -11.541 -9.278 -24.837 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.064 -12.173 -24.072 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.143 -11.740 -25.383 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -9.223 -10.914 -25.224 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -9.810 -12.310 -26.107 1.00 0.00 H new ATOM 1751 N GLU A 114 -13.156 -10.686 -22.351 1.00 0.00 N ATOM 1752 CA GLU A 114 -14.460 -10.797 -21.707 1.00 0.00 C ATOM 1753 C GLU A 114 -15.001 -9.420 -21.334 1.00 0.00 C ATOM 1754 O GLU A 114 -16.133 -9.073 -21.674 1.00 0.00 O ATOM 1755 CB GLU A 114 -14.363 -11.675 -20.458 1.00 0.00 C ATOM 1756 CG GLU A 114 -15.694 -11.881 -19.754 1.00 0.00 C ATOM 1757 CD GLU A 114 -16.453 -13.082 -20.284 1.00 0.00 C ATOM 1758 OE1 GLU A 114 -15.818 -13.960 -20.904 1.00 0.00 O ATOM 1759 OE2 GLU A 114 -17.684 -13.143 -20.078 1.00 0.00 O ATOM 0 H GLU A 114 -12.380 -11.054 -21.800 1.00 0.00 H new ATOM 0 HA GLU A 114 -15.149 -11.259 -22.414 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -13.955 -12.646 -20.738 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -13.658 -11.223 -19.760 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -15.520 -12.008 -18.686 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -16.306 -10.987 -19.873 1.00 0.00 H new ATOM 1766 N VAL A 115 -14.185 -8.640 -20.633 1.00 0.00 N ATOM 1767 CA VAL A 115 -14.581 -7.300 -20.214 1.00 0.00 C ATOM 1768 C VAL A 115 -14.771 -6.382 -21.415 1.00 0.00 C ATOM 1769 O VAL A 115 -15.595 -5.469 -21.387 1.00 0.00 O ATOM 1770 CB VAL A 115 -13.539 -6.678 -19.265 1.00 0.00 C ATOM 1771 CG1 VAL A 115 -13.490 -7.442 -17.951 1.00 0.00 C ATOM 1772 CG2 VAL A 115 -12.169 -6.649 -19.925 1.00 0.00 C ATOM 0 H VAL A 115 -13.246 -8.912 -20.343 1.00 0.00 H new ATOM 0 HA VAL A 115 -15.529 -7.401 -19.685 1.00 0.00 H new ATOM 0 HB VAL A 115 -13.836 -5.652 -19.050 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -12.748 -6.988 -17.294 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -14.469 -7.407 -17.473 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -13.218 -8.480 -18.143 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -11.445 -6.207 -19.241 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -11.862 -7.666 -20.171 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -12.217 -6.054 -20.837 1.00 0.00 H new ATOM 1782 N GLU A 116 -14.001 -6.631 -22.471 1.00 0.00 N ATOM 1783 CA GLU A 116 -14.085 -5.825 -23.683 1.00 0.00 C ATOM 1784 C GLU A 116 -15.412 -6.056 -24.400 1.00 0.00 C ATOM 1785 O GLU A 116 -16.095 -5.108 -24.788 1.00 0.00 O ATOM 1786 CB GLU A 116 -12.922 -6.153 -24.621 1.00 0.00 C ATOM 1787 CG GLU A 116 -12.871 -5.273 -25.859 1.00 0.00 C ATOM 1788 CD GLU A 116 -12.208 -5.960 -27.037 1.00 0.00 C ATOM 1789 OE1 GLU A 116 -11.023 -6.335 -26.916 1.00 0.00 O ATOM 1790 OE2 GLU A 116 -12.875 -6.123 -28.080 1.00 0.00 O ATOM 0 H GLU A 116 -13.313 -7.383 -22.511 1.00 0.00 H new ATOM 0 HA GLU A 116 -14.026 -4.775 -23.395 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.985 -6.050 -24.074 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -12.998 -7.196 -24.930 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -13.885 -4.983 -26.136 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -12.329 -4.356 -25.626 1.00 0.00 H new ATOM 1797 N LYS A 117 -15.771 -7.324 -24.573 1.00 0.00 N ATOM 1798 CA LYS A 117 -17.015 -7.683 -25.243 1.00 0.00 C ATOM 1799 C LYS A 117 -18.205 -7.519 -24.302 1.00 0.00 C ATOM 1800 O LYS A 117 -19.357 -7.527 -24.737 1.00 0.00 O ATOM 1801 CB LYS A 117 -16.948 -9.125 -25.750 1.00 0.00 C ATOM 1802 CG LYS A 117 -15.914 -9.337 -26.842 1.00 0.00 C ATOM 1803 CD LYS A 117 -16.369 -10.384 -27.845 1.00 0.00 C ATOM 1804 CE LYS A 117 -15.828 -11.762 -27.497 1.00 0.00 C ATOM 1805 NZ LYS A 117 -15.840 -12.676 -28.673 1.00 0.00 N ATOM 0 H LYS A 117 -15.217 -8.121 -24.258 1.00 0.00 H new ATOM 0 HA LYS A 117 -17.149 -7.012 -26.092 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -16.721 -9.786 -24.913 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -17.928 -9.415 -26.128 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -15.729 -8.394 -27.357 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -14.969 -9.646 -26.395 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -17.458 -10.416 -27.871 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -16.035 -10.102 -28.843 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -14.809 -11.668 -27.121 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -16.426 -12.195 -26.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -15.464 -13.605 -28.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -16.815 -12.786 -29.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -15.249 -12.276 -29.430 1.00 0.00 H new ATOM 1819 N ALA A 118 -17.919 -7.368 -23.013 1.00 0.00 N ATOM 1820 CA ALA A 118 -18.966 -7.198 -22.013 1.00 0.00 C ATOM 1821 C ALA A 118 -19.373 -5.734 -21.888 1.00 0.00 C ATOM 1822 O ALA A 118 -20.523 -5.425 -21.571 1.00 0.00 O ATOM 1823 CB ALA A 118 -18.502 -7.736 -20.668 1.00 0.00 C ATOM 0 H ALA A 118 -16.971 -7.360 -22.637 1.00 0.00 H new ATOM 0 HA ALA A 118 -19.840 -7.764 -22.337 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -19.293 -7.603 -19.930 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -18.268 -8.796 -20.761 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -17.612 -7.195 -20.347 1.00 0.00 H new ATOM 1829 N ILE A 119 -18.425 -4.838 -22.138 1.00 0.00 N ATOM 1830 CA ILE A 119 -18.687 -3.406 -22.054 1.00 0.00 C ATOM 1831 C ILE A 119 -18.894 -2.802 -23.439 1.00 0.00 C ATOM 1832 O ILE A 119 -19.613 -1.816 -23.596 1.00 0.00 O ATOM 1833 CB ILE A 119 -17.536 -2.664 -21.349 1.00 0.00 C ATOM 1834 CG1 ILE A 119 -17.120 -3.411 -20.080 1.00 0.00 C ATOM 1835 CG2 ILE A 119 -17.950 -1.237 -21.019 1.00 0.00 C ATOM 1836 CD1 ILE A 119 -15.629 -3.389 -19.827 1.00 0.00 C ATOM 0 H ILE A 119 -17.469 -5.078 -22.400 1.00 0.00 H new ATOM 0 HA ILE A 119 -19.599 -3.286 -21.469 1.00 0.00 H new ATOM 0 HB ILE A 119 -16.680 -2.627 -22.023 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -17.632 -2.970 -19.225 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -17.453 -4.446 -20.152 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -17.126 -0.725 -20.521 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -18.202 -0.709 -21.939 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -18.818 -1.253 -20.360 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -15.407 -3.937 -18.911 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -15.111 -3.856 -20.664 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -15.293 -2.357 -19.722 1.00 0.00 H new ATOM 1848 N SER A 120 -18.260 -3.403 -24.440 1.00 0.00 N ATOM 1849 CA SER A 120 -18.372 -2.924 -25.813 1.00 0.00 C ATOM 1850 C SER A 120 -19.483 -3.659 -26.556 1.00 0.00 C ATOM 1851 O SER A 120 -20.428 -3.044 -27.051 1.00 0.00 O ATOM 1852 CB SER A 120 -17.044 -3.105 -26.550 1.00 0.00 C ATOM 1853 OG SER A 120 -17.014 -2.343 -27.744 1.00 0.00 O ATOM 0 H SER A 120 -17.663 -4.222 -24.326 1.00 0.00 H new ATOM 0 HA SER A 120 -18.620 -1.863 -25.782 1.00 0.00 H new ATOM 0 HB2 SER A 120 -16.221 -2.803 -25.902 1.00 0.00 H new ATOM 0 HB3 SER A 120 -16.895 -4.159 -26.784 1.00 0.00 H new ATOM 0 HG SER A 120 -16.154 -2.475 -28.195 1.00 0.00 H new ATOM 1859 N LYS A 121 -19.363 -4.980 -26.630 1.00 0.00 N ATOM 1860 CA LYS A 121 -20.356 -5.803 -27.311 1.00 0.00 C ATOM 1861 C LYS A 121 -21.736 -5.616 -26.689 1.00 0.00 C ATOM 1862 O LYS A 121 -22.743 -6.053 -27.246 1.00 0.00 O ATOM 1863 CB LYS A 121 -19.954 -7.278 -27.251 1.00 0.00 C ATOM 1864 CG LYS A 121 -20.059 -7.991 -28.588 1.00 0.00 C ATOM 1865 CD LYS A 121 -19.189 -7.329 -29.643 1.00 0.00 C ATOM 1866 CE LYS A 121 -18.909 -8.269 -30.806 1.00 0.00 C ATOM 1867 NZ LYS A 121 -20.154 -8.909 -31.313 1.00 0.00 N ATOM 0 H LYS A 121 -18.587 -5.504 -26.226 1.00 0.00 H new ATOM 0 HA LYS A 121 -20.400 -5.487 -28.353 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -18.929 -7.352 -26.889 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -20.586 -7.789 -26.525 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -19.760 -9.033 -28.470 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -21.097 -7.993 -28.920 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -19.683 -6.430 -30.011 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -18.247 -7.014 -29.194 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -18.430 -7.715 -31.614 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -18.207 -9.040 -30.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -19.963 -9.363 -32.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -20.478 -9.626 -30.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -20.892 -8.186 -31.432 1.00 0.00 H new ATOM 1881 N SER A 122 -21.775 -4.962 -25.532 1.00 0.00 N ATOM 1882 CA SER A 122 -23.032 -4.719 -24.833 1.00 0.00 C ATOM 1883 C SER A 122 -23.341 -3.226 -24.774 1.00 0.00 C ATOM 1884 O SER A 122 -24.369 -2.775 -25.277 1.00 0.00 O ATOM 1885 CB SER A 122 -22.973 -5.296 -23.417 1.00 0.00 C ATOM 1886 OG SER A 122 -24.274 -5.496 -22.893 1.00 0.00 O ATOM 0 H SER A 122 -20.951 -4.591 -25.059 1.00 0.00 H new ATOM 0 HA SER A 122 -23.829 -5.216 -25.387 1.00 0.00 H new ATOM 0 HB2 SER A 122 -22.433 -6.243 -23.429 1.00 0.00 H new ATOM 0 HB3 SER A 122 -22.416 -4.620 -22.768 1.00 0.00 H new ATOM 0 HG SER A 122 -24.209 -5.867 -21.988 1.00 0.00 H new ATOM 1892 N GLN A 123 -22.443 -2.467 -24.155 1.00 0.00 N ATOM 1893 CA GLN A 123 -22.619 -1.025 -24.029 1.00 0.00 C ATOM 1894 C GLN A 123 -23.970 -0.695 -23.403 1.00 0.00 C ATOM 1895 O GLN A 123 -24.107 0.292 -22.679 1.00 0.00 O ATOM 1896 CB GLN A 123 -22.500 -0.354 -25.398 1.00 0.00 C ATOM 1897 CG GLN A 123 -22.231 1.141 -25.322 1.00 0.00 C ATOM 1898 CD GLN A 123 -21.682 1.702 -26.618 1.00 0.00 C ATOM 1899 OE1 GLN A 123 -22.348 2.477 -27.304 1.00 0.00 O ATOM 1900 NE2 GLN A 123 -20.459 1.313 -26.961 1.00 0.00 N ATOM 0 H GLN A 123 -21.587 -2.826 -23.733 1.00 0.00 H new ATOM 0 HA GLN A 123 -21.834 -0.644 -23.376 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -21.696 -0.831 -25.959 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -23.421 -0.521 -25.957 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -23.155 1.660 -25.069 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -21.524 1.338 -24.517 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -19.942 0.669 -26.362 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -20.037 1.659 -27.823 1.00 0.00 H new