USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 816 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 76 ASN : amide:sc= -4.34! C(o=-8.3!,f=-11!) USER MOD Set 1.2: A 78 GLN :FLIP amide:sc= -3.97! F(o=-12,f=-8.3!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= -0.438 X(o=-0.44,f=-0.054) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -76:sc= 1.17 USER MOD Single : A 44 HIS : no HE2:sc= -4.02! C(o=-4!,f=-8.2!) USER MOD Single : A 47 CYS SG : rot 180:sc= -2.42! USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.162 X(o=-0.16,f=-0.032) USER MOD Single : A 58 MET CE :methyl -106:sc= -11.3! (180deg=-16.4!) USER MOD Single : A 59 THR OG1 : rot 180:sc= -0.235 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.393 USER MOD Single : A 68 TYR OH : rot 180:sc= -1.06 USER MOD Single : A 71 ASN : amide:sc= -6.78! C(o=-6.8!,f=-12!) USER MOD Single : A 72 LYS NZ :NH3+ -170:sc= -7.19! (180deg=-7.99!) USER MOD Single : A 73 GLN : amide:sc= -0.345 K(o=-0.35,f=-2.7!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot -50:sc= -1.71 USER MOD Single : A 86 SER OG : rot -72:sc= 1.1 USER MOD Single : A 89 ASN : amide:sc= -10.4! C(o=-10!,f=-15!) USER MOD Single : A 95 ASN : amide:sc=-0.00262 X(o=-0.0026,f=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.089 X(o=-0.089,f=0) USER MOD Single : A 105 THR OG1 : rot -68:sc= -0.687 USER MOD Single : A 106 LYS NZ :NH3+ -155:sc= -0.054 (180deg=-0.363) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 106:sc= 1.18 USER MOD Single : A 117 LYS NZ :NH3+ -165:sc= 0.675 (180deg=0.526) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 251 N PRO A 18 10.735 -24.846 -9.712 1.00 0.00 N ATOM 252 CA PRO A 18 11.454 -23.735 -9.082 1.00 0.00 C ATOM 253 C PRO A 18 10.537 -22.853 -8.242 1.00 0.00 C ATOM 254 O PRO A 18 10.079 -21.804 -8.699 1.00 0.00 O ATOM 255 CB PRO A 18 12.008 -22.950 -10.273 1.00 0.00 C ATOM 256 CG PRO A 18 11.087 -23.270 -11.399 1.00 0.00 C ATOM 257 CD PRO A 18 10.631 -24.685 -11.172 1.00 0.00 C ATOM 0 HA PRO A 18 12.221 -24.085 -8.391 1.00 0.00 H new ATOM 0 HB2 PRO A 18 12.026 -21.880 -10.068 1.00 0.00 H new ATOM 0 HB3 PRO A 18 13.031 -23.248 -10.502 1.00 0.00 H new ATOM 0 HG2 PRO A 18 10.239 -22.585 -11.417 1.00 0.00 H new ATOM 0 HG3 PRO A 18 11.595 -23.173 -12.358 1.00 0.00 H new ATOM 0 HD2 PRO A 18 9.610 -24.839 -11.522 1.00 0.00 H new ATOM 0 HD3 PRO A 18 11.261 -25.400 -11.701 1.00 0.00 H new ATOM 265 N LEU A 19 10.272 -23.283 -7.014 1.00 0.00 N ATOM 266 CA LEU A 19 9.409 -22.531 -6.109 1.00 0.00 C ATOM 267 C LEU A 19 9.701 -21.036 -6.195 1.00 0.00 C ATOM 268 O LEU A 19 8.786 -20.221 -6.300 1.00 0.00 O ATOM 269 CB LEU A 19 9.596 -23.018 -4.671 1.00 0.00 C ATOM 270 CG LEU A 19 9.050 -24.411 -4.358 1.00 0.00 C ATOM 271 CD1 LEU A 19 9.988 -25.154 -3.420 1.00 0.00 C ATOM 272 CD2 LEU A 19 7.656 -24.313 -3.753 1.00 0.00 C ATOM 0 H LEU A 19 10.642 -24.149 -6.621 1.00 0.00 H new ATOM 0 HA LEU A 19 8.375 -22.698 -6.410 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.661 -23.007 -4.441 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.118 -22.303 -4.001 1.00 0.00 H new ATOM 0 HG LEU A 19 8.982 -24.972 -5.290 1.00 0.00 H new ATOM 0 HD11 LEU A 19 9.583 -26.143 -3.209 1.00 0.00 H new ATOM 0 HD12 LEU A 19 10.967 -25.255 -3.889 1.00 0.00 H new ATOM 0 HD13 LEU A 19 10.088 -24.596 -2.489 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.282 -25.314 -3.536 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.700 -23.734 -2.830 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.987 -23.821 -4.459 1.00 0.00 H new ATOM 284 N GLU A 20 10.983 -20.686 -6.150 1.00 0.00 N ATOM 285 CA GLU A 20 11.395 -19.289 -6.224 1.00 0.00 C ATOM 286 C GLU A 20 10.856 -18.629 -7.490 1.00 0.00 C ATOM 287 O GLU A 20 10.277 -17.543 -7.441 1.00 0.00 O ATOM 288 CB GLU A 20 12.921 -19.182 -6.189 1.00 0.00 C ATOM 289 CG GLU A 20 13.506 -19.283 -4.791 1.00 0.00 C ATOM 290 CD GLU A 20 13.836 -17.927 -4.197 1.00 0.00 C ATOM 291 OE1 GLU A 20 14.822 -17.306 -4.646 1.00 0.00 O ATOM 292 OE2 GLU A 20 13.108 -17.487 -3.283 1.00 0.00 O ATOM 0 H GLU A 20 11.753 -21.349 -6.063 1.00 0.00 H new ATOM 0 HA GLU A 20 10.982 -18.768 -5.360 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.346 -19.971 -6.810 1.00 0.00 H new ATOM 0 HB3 GLU A 20 13.220 -18.232 -6.631 1.00 0.00 H new ATOM 0 HG2 GLU A 20 12.798 -19.797 -4.141 1.00 0.00 H new ATOM 0 HG3 GLU A 20 14.410 -19.891 -4.823 1.00 0.00 H new ATOM 299 N LYS A 21 11.051 -19.292 -8.625 1.00 0.00 N ATOM 300 CA LYS A 21 10.586 -18.773 -9.905 1.00 0.00 C ATOM 301 C LYS A 21 9.077 -18.549 -9.886 1.00 0.00 C ATOM 302 O LYS A 21 8.573 -17.596 -10.480 1.00 0.00 O ATOM 303 CB LYS A 21 10.955 -19.737 -11.035 1.00 0.00 C ATOM 304 CG LYS A 21 10.588 -19.224 -12.417 1.00 0.00 C ATOM 305 CD LYS A 21 11.826 -18.913 -13.242 1.00 0.00 C ATOM 306 CE LYS A 21 12.452 -17.589 -12.831 1.00 0.00 C ATOM 307 NZ LYS A 21 12.689 -16.701 -14.003 1.00 0.00 N ATOM 0 H LYS A 21 11.529 -20.191 -8.684 1.00 0.00 H new ATOM 0 HA LYS A 21 11.076 -17.815 -10.079 1.00 0.00 H new ATOM 0 HB2 LYS A 21 12.027 -19.930 -11.001 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.454 -20.690 -10.866 1.00 0.00 H new ATOM 0 HG2 LYS A 21 9.983 -19.969 -12.934 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.977 -18.326 -12.323 1.00 0.00 H new ATOM 0 HD2 LYS A 21 12.555 -19.714 -13.122 1.00 0.00 H new ATOM 0 HD3 LYS A 21 11.561 -18.879 -14.299 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.799 -17.084 -12.119 1.00 0.00 H new ATOM 0 HE3 LYS A 21 13.397 -17.777 -12.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 13.116 -15.809 -13.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 13.332 -17.172 -14.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 11.784 -16.501 -14.476 1.00 0.00 H new ATOM 321 N TYR A 22 8.362 -19.432 -9.198 1.00 0.00 N ATOM 322 CA TYR A 22 6.911 -19.331 -9.102 1.00 0.00 C ATOM 323 C TYR A 22 6.502 -18.087 -8.319 1.00 0.00 C ATOM 324 O TYR A 22 5.601 -17.352 -8.725 1.00 0.00 O ATOM 325 CB TYR A 22 6.335 -20.580 -8.433 1.00 0.00 C ATOM 326 CG TYR A 22 4.943 -20.382 -7.876 1.00 0.00 C ATOM 327 CD1 TYR A 22 4.731 -19.607 -6.742 1.00 0.00 C ATOM 328 CD2 TYR A 22 3.840 -20.971 -8.482 1.00 0.00 C ATOM 329 CE1 TYR A 22 3.462 -19.423 -6.229 1.00 0.00 C ATOM 330 CE2 TYR A 22 2.567 -20.791 -7.977 1.00 0.00 C ATOM 331 CZ TYR A 22 2.383 -20.017 -6.851 1.00 0.00 C ATOM 332 OH TYR A 22 1.116 -19.838 -6.344 1.00 0.00 O ATOM 0 H TYR A 22 8.764 -20.226 -8.699 1.00 0.00 H new ATOM 0 HA TYR A 22 6.510 -19.250 -10.112 1.00 0.00 H new ATOM 0 HB2 TYR A 22 6.315 -21.394 -9.158 1.00 0.00 H new ATOM 0 HB3 TYR A 22 7.000 -20.889 -7.626 1.00 0.00 H new ATOM 0 HD1 TYR A 22 5.574 -19.140 -6.253 1.00 0.00 H new ATOM 0 HD2 TYR A 22 3.980 -21.580 -9.363 1.00 0.00 H new ATOM 0 HE1 TYR A 22 3.315 -18.818 -5.347 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.720 -21.254 -8.462 1.00 0.00 H new ATOM 0 HH TYR A 22 0.470 -20.322 -6.900 1.00 0.00 H new ATOM 342 N HIS A 23 7.171 -17.858 -7.193 1.00 0.00 N ATOM 343 CA HIS A 23 6.879 -16.702 -6.353 1.00 0.00 C ATOM 344 C HIS A 23 7.185 -15.402 -7.091 1.00 0.00 C ATOM 345 O HIS A 23 6.516 -14.390 -6.885 1.00 0.00 O ATOM 346 CB HIS A 23 7.689 -16.769 -5.058 1.00 0.00 C ATOM 347 CG HIS A 23 7.090 -15.979 -3.935 1.00 0.00 C ATOM 348 ND1 HIS A 23 5.845 -16.248 -3.405 1.00 0.00 N ATOM 349 CD2 HIS A 23 7.573 -14.924 -3.239 1.00 0.00 C ATOM 350 CE1 HIS A 23 5.588 -15.391 -2.434 1.00 0.00 C ATOM 351 NE2 HIS A 23 6.621 -14.577 -2.312 1.00 0.00 N ATOM 0 H HIS A 23 7.918 -18.457 -6.842 1.00 0.00 H new ATOM 0 HA HIS A 23 5.817 -16.720 -6.110 1.00 0.00 H new ATOM 0 HB2 HIS A 23 7.781 -17.811 -4.750 1.00 0.00 H new ATOM 0 HB3 HIS A 23 8.698 -16.404 -5.251 1.00 0.00 H new ATOM 0 HD2 HIS A 23 8.529 -14.444 -3.385 1.00 0.00 H new ATOM 0 HE1 HIS A 23 4.686 -15.361 -1.840 1.00 0.00 H new ATOM 0 HE2 HIS A 23 6.699 -13.815 -1.639 1.00 0.00 H new ATOM 359 N GLU A 24 8.199 -15.439 -7.949 1.00 0.00 N ATOM 360 CA GLU A 24 8.593 -14.263 -8.716 1.00 0.00 C ATOM 361 C GLU A 24 7.554 -13.938 -9.786 1.00 0.00 C ATOM 362 O GLU A 24 7.130 -12.791 -9.924 1.00 0.00 O ATOM 363 CB GLU A 24 9.959 -14.486 -9.368 1.00 0.00 C ATOM 364 CG GLU A 24 11.129 -14.170 -8.452 1.00 0.00 C ATOM 365 CD GLU A 24 11.495 -12.699 -8.459 1.00 0.00 C ATOM 366 OE1 GLU A 24 10.660 -11.882 -8.902 1.00 0.00 O ATOM 367 OE2 GLU A 24 12.616 -12.363 -8.023 1.00 0.00 O ATOM 0 H GLU A 24 8.762 -16.270 -8.131 1.00 0.00 H new ATOM 0 HA GLU A 24 8.659 -13.419 -8.030 1.00 0.00 H new ATOM 0 HB2 GLU A 24 10.032 -15.524 -9.692 1.00 0.00 H new ATOM 0 HB3 GLU A 24 10.031 -13.867 -10.262 1.00 0.00 H new ATOM 0 HG2 GLU A 24 10.882 -14.474 -7.435 1.00 0.00 H new ATOM 0 HG3 GLU A 24 11.995 -14.757 -8.759 1.00 0.00 H new ATOM 374 N GLU A 25 7.150 -14.955 -10.539 1.00 0.00 N ATOM 375 CA GLU A 25 6.163 -14.777 -11.597 1.00 0.00 C ATOM 376 C GLU A 25 4.780 -14.505 -11.011 1.00 0.00 C ATOM 377 O GLU A 25 4.122 -13.530 -11.371 1.00 0.00 O ATOM 378 CB GLU A 25 6.114 -16.016 -12.494 1.00 0.00 C ATOM 379 CG GLU A 25 7.236 -16.071 -13.517 1.00 0.00 C ATOM 380 CD GLU A 25 6.738 -16.392 -14.913 1.00 0.00 C ATOM 381 OE1 GLU A 25 5.676 -15.863 -15.300 1.00 0.00 O ATOM 382 OE2 GLU A 25 7.412 -17.173 -15.617 1.00 0.00 O ATOM 0 H GLU A 25 7.491 -15.911 -10.436 1.00 0.00 H new ATOM 0 HA GLU A 25 6.461 -13.916 -12.195 1.00 0.00 H new ATOM 0 HB2 GLU A 25 6.159 -16.908 -11.870 1.00 0.00 H new ATOM 0 HB3 GLU A 25 5.157 -16.039 -13.015 1.00 0.00 H new ATOM 0 HG2 GLU A 25 7.756 -15.113 -13.532 1.00 0.00 H new ATOM 0 HG3 GLU A 25 7.963 -16.824 -13.213 1.00 0.00 H new ATOM 389 N ALA A 26 4.346 -15.377 -10.106 1.00 0.00 N ATOM 390 CA ALA A 26 3.044 -15.231 -9.468 1.00 0.00 C ATOM 391 C ALA A 26 2.932 -13.892 -8.747 1.00 0.00 C ATOM 392 O ALA A 26 1.885 -13.246 -8.775 1.00 0.00 O ATOM 393 CB ALA A 26 2.800 -16.377 -8.497 1.00 0.00 C ATOM 0 H ALA A 26 4.877 -16.192 -9.799 1.00 0.00 H new ATOM 0 HA ALA A 26 2.281 -15.260 -10.246 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.824 -16.255 -8.028 1.00 0.00 H new ATOM 0 HB2 ALA A 26 2.827 -17.323 -9.037 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.574 -16.375 -7.730 1.00 0.00 H new ATOM 399 N ASP A 27 4.018 -13.481 -8.101 1.00 0.00 N ATOM 400 CA ASP A 27 4.042 -12.218 -7.373 1.00 0.00 C ATOM 401 C ASP A 27 3.938 -11.035 -8.331 1.00 0.00 C ATOM 402 O ASP A 27 3.173 -10.099 -8.096 1.00 0.00 O ATOM 403 CB ASP A 27 5.323 -12.107 -6.544 1.00 0.00 C ATOM 404 CG ASP A 27 5.444 -10.769 -5.842 1.00 0.00 C ATOM 405 OD1 ASP A 27 4.886 -10.628 -4.733 1.00 0.00 O ATOM 406 OD2 ASP A 27 6.096 -9.862 -6.400 1.00 0.00 O ATOM 0 H ASP A 27 4.893 -14.004 -8.067 1.00 0.00 H new ATOM 0 HA ASP A 27 3.182 -12.197 -6.704 1.00 0.00 H new ATOM 0 HB2 ASP A 27 5.343 -12.906 -5.803 1.00 0.00 H new ATOM 0 HB3 ASP A 27 6.186 -12.253 -7.193 1.00 0.00 H new ATOM 411 N ASP A 28 4.711 -11.085 -9.409 1.00 0.00 N ATOM 412 CA ASP A 28 4.706 -10.018 -10.403 1.00 0.00 C ATOM 413 C ASP A 28 3.403 -10.020 -11.197 1.00 0.00 C ATOM 414 O ASP A 28 2.932 -8.973 -11.640 1.00 0.00 O ATOM 415 CB ASP A 28 5.896 -10.170 -11.352 1.00 0.00 C ATOM 416 CG ASP A 28 6.143 -8.921 -12.176 1.00 0.00 C ATOM 417 OD1 ASP A 28 6.147 -7.816 -11.592 1.00 0.00 O ATOM 418 OD2 ASP A 28 6.334 -9.048 -13.403 1.00 0.00 O ATOM 0 H ASP A 28 5.349 -11.853 -9.617 1.00 0.00 H new ATOM 0 HA ASP A 28 4.789 -9.066 -9.878 1.00 0.00 H new ATOM 0 HB2 ASP A 28 6.790 -10.403 -10.774 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.719 -11.013 -12.020 1.00 0.00 H new ATOM 423 N TYR A 29 2.827 -11.204 -11.373 1.00 0.00 N ATOM 424 CA TYR A 29 1.580 -11.344 -12.116 1.00 0.00 C ATOM 425 C TYR A 29 0.422 -10.691 -11.366 1.00 0.00 C ATOM 426 O TYR A 29 -0.305 -9.867 -11.920 1.00 0.00 O ATOM 427 CB TYR A 29 1.273 -12.822 -12.364 1.00 0.00 C ATOM 428 CG TYR A 29 1.377 -13.226 -13.818 1.00 0.00 C ATOM 429 CD1 TYR A 29 0.431 -12.806 -14.745 1.00 0.00 C ATOM 430 CD2 TYR A 29 2.420 -14.027 -14.264 1.00 0.00 C ATOM 431 CE1 TYR A 29 0.521 -13.174 -16.074 1.00 0.00 C ATOM 432 CE2 TYR A 29 2.519 -14.398 -15.591 1.00 0.00 C ATOM 433 CZ TYR A 29 1.567 -13.969 -16.492 1.00 0.00 C ATOM 434 OH TYR A 29 1.662 -14.337 -17.814 1.00 0.00 O ATOM 0 H TYR A 29 3.203 -12.080 -11.012 1.00 0.00 H new ATOM 0 HA TYR A 29 1.699 -10.839 -13.074 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.960 -13.431 -11.776 1.00 0.00 H new ATOM 0 HB3 TYR A 29 0.267 -13.041 -12.006 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -0.388 -12.181 -14.421 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.167 -14.366 -13.561 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.224 -12.841 -16.781 1.00 0.00 H new ATOM 0 HE2 TYR A 29 3.337 -15.021 -15.921 1.00 0.00 H new ATOM 0 HH TYR A 29 2.457 -14.896 -17.942 1.00 0.00 H new ATOM 444 N LEU A 30 0.259 -11.067 -10.102 1.00 0.00 N ATOM 445 CA LEU A 30 -0.809 -10.518 -9.274 1.00 0.00 C ATOM 446 C LEU A 30 -0.609 -9.024 -9.046 1.00 0.00 C ATOM 447 O LEU A 30 -1.544 -8.234 -9.180 1.00 0.00 O ATOM 448 CB LEU A 30 -0.865 -11.248 -7.930 1.00 0.00 C ATOM 449 CG LEU A 30 -1.104 -12.757 -7.995 1.00 0.00 C ATOM 450 CD1 LEU A 30 -0.151 -13.489 -7.064 1.00 0.00 C ATOM 451 CD2 LEU A 30 -2.549 -13.083 -7.647 1.00 0.00 C ATOM 0 H LEU A 30 0.852 -11.749 -9.629 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.753 -10.663 -9.799 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.073 -11.071 -7.404 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.657 -10.801 -7.329 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.912 -13.093 -9.014 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.336 -14.562 -7.124 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.877 -13.281 -7.359 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.310 -13.150 -6.040 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.701 -14.161 -7.698 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -2.768 -12.733 -6.638 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.214 -12.589 -8.355 1.00 0.00 H new ATOM 463 N ASP A 31 0.616 -8.642 -8.702 1.00 0.00 N ATOM 464 CA ASP A 31 0.941 -7.241 -8.458 1.00 0.00 C ATOM 465 C ASP A 31 0.585 -6.383 -9.668 1.00 0.00 C ATOM 466 O ASP A 31 0.004 -5.306 -9.529 1.00 0.00 O ATOM 467 CB ASP A 31 2.427 -7.090 -8.129 1.00 0.00 C ATOM 468 CG ASP A 31 2.680 -6.962 -6.640 1.00 0.00 C ATOM 469 OD1 ASP A 31 2.580 -7.986 -5.932 1.00 0.00 O ATOM 470 OD2 ASP A 31 2.977 -5.839 -6.182 1.00 0.00 O ATOM 0 H ASP A 31 1.401 -9.283 -8.586 1.00 0.00 H new ATOM 0 HA ASP A 31 0.352 -6.899 -7.607 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.971 -7.953 -8.514 1.00 0.00 H new ATOM 0 HB3 ASP A 31 2.821 -6.211 -8.639 1.00 0.00 H new ATOM 475 N HIS A 32 0.938 -6.866 -10.855 1.00 0.00 N ATOM 476 CA HIS A 32 0.656 -6.142 -12.090 1.00 0.00 C ATOM 477 C HIS A 32 -0.842 -6.122 -12.377 1.00 0.00 C ATOM 478 O HIS A 32 -1.348 -5.203 -13.023 1.00 0.00 O ATOM 479 CB HIS A 32 1.404 -6.780 -13.261 1.00 0.00 C ATOM 480 CG HIS A 32 2.723 -6.134 -13.553 1.00 0.00 C ATOM 481 ND1 HIS A 32 2.842 -4.836 -14.004 1.00 0.00 N ATOM 482 CD2 HIS A 32 3.985 -6.613 -13.453 1.00 0.00 C ATOM 483 CE1 HIS A 32 4.120 -4.546 -14.171 1.00 0.00 C ATOM 484 NE2 HIS A 32 4.835 -5.608 -13.843 1.00 0.00 N ATOM 0 H HIS A 32 1.420 -7.755 -10.988 1.00 0.00 H new ATOM 0 HA HIS A 32 0.998 -5.114 -11.967 1.00 0.00 H new ATOM 0 HB2 HIS A 32 1.566 -7.836 -13.046 1.00 0.00 H new ATOM 0 HB3 HIS A 32 0.778 -6.729 -14.152 1.00 0.00 H new ATOM 0 HD2 HIS A 32 4.270 -7.602 -13.127 1.00 0.00 H new ATOM 0 HE1 HIS A 32 4.514 -3.602 -14.517 1.00 0.00 H new ATOM 0 HE2 HIS A 32 5.853 -5.671 -13.874 1.00 0.00 H new ATOM 492 N LEU A 33 -1.546 -7.140 -11.896 1.00 0.00 N ATOM 493 CA LEU A 33 -2.986 -7.240 -12.102 1.00 0.00 C ATOM 494 C LEU A 33 -3.723 -6.143 -11.339 1.00 0.00 C ATOM 495 O LEU A 33 -4.502 -5.385 -11.918 1.00 0.00 O ATOM 496 CB LEU A 33 -3.491 -8.614 -11.657 1.00 0.00 C ATOM 497 CG LEU A 33 -4.417 -9.338 -12.635 1.00 0.00 C ATOM 498 CD1 LEU A 33 -4.249 -10.844 -12.514 1.00 0.00 C ATOM 499 CD2 LEU A 33 -5.866 -8.940 -12.392 1.00 0.00 C ATOM 0 H LEU A 33 -1.143 -7.909 -11.360 1.00 0.00 H new ATOM 0 HA LEU A 33 -3.185 -7.114 -13.166 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.628 -9.252 -11.465 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.017 -8.496 -10.709 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.145 -9.043 -13.648 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.916 -11.342 -13.218 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.217 -11.114 -12.739 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.493 -11.157 -11.499 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.511 -9.465 -13.097 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.150 -9.205 -11.374 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.976 -7.865 -12.531 1.00 0.00 H new ATOM 511 N LEU A 34 -3.470 -6.064 -10.037 1.00 0.00 N ATOM 512 CA LEU A 34 -4.107 -5.058 -9.194 1.00 0.00 C ATOM 513 C LEU A 34 -3.587 -3.662 -9.524 1.00 0.00 C ATOM 514 O LEU A 34 -4.280 -2.666 -9.319 1.00 0.00 O ATOM 515 CB LEU A 34 -3.860 -5.371 -7.717 1.00 0.00 C ATOM 516 CG LEU A 34 -2.485 -5.945 -7.374 1.00 0.00 C ATOM 517 CD1 LEU A 34 -1.826 -5.129 -6.273 1.00 0.00 C ATOM 518 CD2 LEU A 34 -2.605 -7.404 -6.959 1.00 0.00 C ATOM 0 H LEU A 34 -2.829 -6.684 -9.542 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.179 -5.082 -9.390 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.003 -4.455 -7.143 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.620 -6.078 -7.384 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.858 -5.891 -8.264 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.848 -5.552 -6.042 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.706 -4.098 -6.606 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.451 -5.151 -5.380 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.617 -7.796 -6.718 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.249 -7.481 -6.083 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -3.035 -7.981 -7.778 1.00 0.00 H new ATOM 530 N ASP A 35 -2.363 -3.599 -10.037 1.00 0.00 N ATOM 531 CA ASP A 35 -1.751 -2.326 -10.399 1.00 0.00 C ATOM 532 C ASP A 35 -2.436 -1.720 -11.620 1.00 0.00 C ATOM 533 O ASP A 35 -2.713 -0.522 -11.658 1.00 0.00 O ATOM 534 CB ASP A 35 -0.259 -2.514 -10.677 1.00 0.00 C ATOM 535 CG ASP A 35 0.499 -1.201 -10.681 1.00 0.00 C ATOM 536 OD1 ASP A 35 0.437 -0.483 -11.701 1.00 0.00 O ATOM 537 OD2 ASP A 35 1.155 -0.891 -9.665 1.00 0.00 O ATOM 0 H ASP A 35 -1.775 -4.414 -10.211 1.00 0.00 H new ATOM 0 HA ASP A 35 -1.873 -1.641 -9.560 1.00 0.00 H new ATOM 0 HB2 ASP A 35 0.168 -3.174 -9.922 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.131 -3.007 -11.641 1.00 0.00 H new ATOM 542 N SER A 36 -2.706 -2.558 -12.616 1.00 0.00 N ATOM 543 CA SER A 36 -3.355 -2.105 -13.841 1.00 0.00 C ATOM 544 C SER A 36 -4.819 -1.760 -13.585 1.00 0.00 C ATOM 545 O SER A 36 -5.289 -0.682 -13.953 1.00 0.00 O ATOM 546 CB SER A 36 -3.254 -3.180 -14.925 1.00 0.00 C ATOM 547 OG SER A 36 -3.186 -2.599 -16.215 1.00 0.00 O ATOM 0 H SER A 36 -2.486 -3.554 -12.599 1.00 0.00 H new ATOM 0 HA SER A 36 -2.843 -1.206 -14.183 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.370 -3.793 -14.752 1.00 0.00 H new ATOM 0 HB3 SER A 36 -4.118 -3.842 -14.866 1.00 0.00 H new ATOM 0 HG SER A 36 -3.120 -3.307 -16.890 1.00 0.00 H new ATOM 553 N LEU A 37 -5.535 -2.683 -12.953 1.00 0.00 N ATOM 554 CA LEU A 37 -6.947 -2.478 -12.647 1.00 0.00 C ATOM 555 C LEU A 37 -7.144 -1.229 -11.795 1.00 0.00 C ATOM 556 O LEU A 37 -8.011 -0.403 -12.079 1.00 0.00 O ATOM 557 CB LEU A 37 -7.513 -3.700 -11.920 1.00 0.00 C ATOM 558 CG LEU A 37 -8.210 -4.739 -12.798 1.00 0.00 C ATOM 559 CD1 LEU A 37 -9.266 -4.079 -13.671 1.00 0.00 C ATOM 560 CD2 LEU A 37 -7.195 -5.481 -13.655 1.00 0.00 C ATOM 0 H LEU A 37 -5.162 -3.580 -12.642 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.482 -2.341 -13.587 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.698 -4.191 -11.388 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.222 -3.354 -11.168 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.705 -5.461 -12.149 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.751 -4.834 -14.289 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.010 -3.595 -13.039 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.794 -3.334 -14.312 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.709 -6.217 -14.273 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.671 -4.771 -14.295 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.476 -5.988 -13.011 1.00 0.00 H new ATOM 572 N GLU A 38 -6.332 -1.097 -10.750 1.00 0.00 N ATOM 573 CA GLU A 38 -6.417 0.054 -9.858 1.00 0.00 C ATOM 574 C GLU A 38 -6.162 1.352 -10.619 1.00 0.00 C ATOM 575 O GLU A 38 -6.831 2.359 -10.390 1.00 0.00 O ATOM 576 CB GLU A 38 -5.411 -0.085 -8.713 1.00 0.00 C ATOM 577 CG GLU A 38 -5.809 -1.122 -7.676 1.00 0.00 C ATOM 578 CD GLU A 38 -4.618 -1.684 -6.926 1.00 0.00 C ATOM 579 OE1 GLU A 38 -3.472 -1.396 -7.332 1.00 0.00 O ATOM 580 OE2 GLU A 38 -4.830 -2.413 -5.934 1.00 0.00 O ATOM 0 H GLU A 38 -5.609 -1.772 -10.501 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.425 0.088 -9.445 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.438 -0.351 -9.126 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.296 0.882 -8.222 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.502 -0.672 -6.965 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -6.341 -1.936 -8.168 1.00 0.00 H new ATOM 587 N GLU A 39 -5.188 1.320 -11.523 1.00 0.00 N ATOM 588 CA GLU A 39 -4.844 2.494 -12.316 1.00 0.00 C ATOM 589 C GLU A 39 -5.933 2.797 -13.341 1.00 0.00 C ATOM 590 O GLU A 39 -6.162 3.954 -13.697 1.00 0.00 O ATOM 591 CB GLU A 39 -3.505 2.282 -13.027 1.00 0.00 C ATOM 592 CG GLU A 39 -2.739 3.570 -13.278 1.00 0.00 C ATOM 593 CD GLU A 39 -1.263 3.444 -12.953 1.00 0.00 C ATOM 594 OE1 GLU A 39 -0.659 2.418 -13.329 1.00 0.00 O ATOM 595 OE2 GLU A 39 -0.712 4.370 -12.322 1.00 0.00 O ATOM 0 H GLU A 39 -4.624 0.494 -11.724 1.00 0.00 H new ATOM 0 HA GLU A 39 -4.758 3.345 -11.640 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.887 1.612 -12.428 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.684 1.784 -13.980 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.854 3.859 -14.323 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -3.173 4.369 -12.677 1.00 0.00 H new ATOM 602 N LEU A 40 -6.603 1.751 -13.811 1.00 0.00 N ATOM 603 CA LEU A 40 -7.668 1.903 -14.796 1.00 0.00 C ATOM 604 C LEU A 40 -8.926 2.477 -14.152 1.00 0.00 C ATOM 605 O LEU A 40 -9.650 3.260 -14.768 1.00 0.00 O ATOM 606 CB LEU A 40 -7.984 0.556 -15.447 1.00 0.00 C ATOM 607 CG LEU A 40 -6.846 -0.091 -16.237 1.00 0.00 C ATOM 608 CD1 LEU A 40 -6.892 -1.605 -16.097 1.00 0.00 C ATOM 609 CD2 LEU A 40 -6.917 0.313 -17.702 1.00 0.00 C ATOM 0 H LEU A 40 -6.428 0.788 -13.526 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.324 2.598 -15.562 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.298 -0.137 -14.667 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -8.834 0.689 -16.116 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.899 0.262 -15.829 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.075 -2.048 -16.666 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.792 -1.876 -15.046 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -7.843 -1.977 -16.478 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.099 -0.157 -18.249 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.869 -0.011 -18.123 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.834 1.397 -17.785 1.00 0.00 H new ATOM 621 N SER A 41 -9.180 2.084 -12.907 1.00 0.00 N ATOM 622 CA SER A 41 -10.351 2.558 -12.180 1.00 0.00 C ATOM 623 C SER A 41 -10.078 3.913 -11.533 1.00 0.00 C ATOM 624 O SER A 41 -11.002 4.674 -11.248 1.00 0.00 O ATOM 625 CB SER A 41 -10.760 1.543 -11.111 1.00 0.00 C ATOM 626 OG SER A 41 -9.647 0.776 -10.684 1.00 0.00 O ATOM 0 H SER A 41 -8.590 1.439 -12.382 1.00 0.00 H new ATOM 0 HA SER A 41 -11.168 2.673 -12.893 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.196 2.064 -10.258 1.00 0.00 H new ATOM 0 HB3 SER A 41 -11.530 0.882 -11.508 1.00 0.00 H new ATOM 0 HG SER A 41 -9.427 0.110 -11.368 1.00 0.00 H new ATOM 632 N GLU A 42 -8.801 4.205 -11.303 1.00 0.00 N ATOM 633 CA GLU A 42 -8.406 5.467 -10.689 1.00 0.00 C ATOM 634 C GLU A 42 -8.059 6.505 -11.752 1.00 0.00 C ATOM 635 O GLU A 42 -8.280 7.700 -11.563 1.00 0.00 O ATOM 636 CB GLU A 42 -7.209 5.254 -9.759 1.00 0.00 C ATOM 637 CG GLU A 42 -6.681 6.538 -9.143 1.00 0.00 C ATOM 638 CD GLU A 42 -5.523 6.297 -8.195 1.00 0.00 C ATOM 639 OE1 GLU A 42 -5.171 5.119 -7.977 1.00 0.00 O ATOM 640 OE2 GLU A 42 -4.968 7.285 -7.671 1.00 0.00 O ATOM 0 H GLU A 42 -8.024 3.585 -11.532 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.249 5.837 -10.106 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.497 4.570 -8.961 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.407 4.772 -10.318 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.361 7.213 -9.937 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.487 7.037 -8.606 1.00 0.00 H new ATOM 647 N ALA A 43 -7.513 6.038 -12.871 1.00 0.00 N ATOM 648 CA ALA A 43 -7.137 6.924 -13.965 1.00 0.00 C ATOM 649 C ALA A 43 -8.333 7.227 -14.862 1.00 0.00 C ATOM 650 O ALA A 43 -8.461 8.332 -15.390 1.00 0.00 O ATOM 651 CB ALA A 43 -6.008 6.309 -14.778 1.00 0.00 C ATOM 0 H ALA A 43 -7.322 5.051 -13.043 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.791 7.864 -13.536 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.737 6.982 -15.592 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.142 6.150 -14.136 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.335 5.354 -15.190 1.00 0.00 H new ATOM 657 N HIS A 44 -9.206 6.239 -15.030 1.00 0.00 N ATOM 658 CA HIS A 44 -10.392 6.401 -15.863 1.00 0.00 C ATOM 659 C HIS A 44 -11.325 5.203 -15.719 1.00 0.00 C ATOM 660 O HIS A 44 -11.421 4.349 -16.601 1.00 0.00 O ATOM 661 CB HIS A 44 -9.991 6.576 -17.328 1.00 0.00 C ATOM 662 CG HIS A 44 -9.437 5.331 -17.951 1.00 0.00 C ATOM 663 ND1 HIS A 44 -9.023 4.242 -17.214 1.00 0.00 N ATOM 664 CD2 HIS A 44 -9.233 5.006 -19.249 1.00 0.00 C ATOM 665 CE1 HIS A 44 -8.585 3.301 -18.032 1.00 0.00 C ATOM 666 NE2 HIS A 44 -8.702 3.740 -19.273 1.00 0.00 N ATOM 0 H HIS A 44 -9.115 5.318 -14.601 1.00 0.00 H new ATOM 0 HA HIS A 44 -10.921 7.293 -15.529 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -10.861 6.901 -17.898 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -9.248 7.370 -17.400 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -9.050 4.173 -16.197 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -9.448 5.627 -20.106 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -8.197 2.337 -17.737 1.00 0.00 H new ATOM 674 N PRO A 45 -12.030 5.134 -14.579 1.00 0.00 N ATOM 675 CA PRO A 45 -12.967 4.045 -14.292 1.00 0.00 C ATOM 676 C PRO A 45 -14.211 4.103 -15.173 1.00 0.00 C ATOM 677 O PRO A 45 -14.228 4.790 -16.194 1.00 0.00 O ATOM 678 CB PRO A 45 -13.339 4.274 -12.825 1.00 0.00 C ATOM 679 CG PRO A 45 -13.121 5.731 -12.602 1.00 0.00 C ATOM 680 CD PRO A 45 -11.965 6.116 -13.484 1.00 0.00 C ATOM 0 HA PRO A 45 -12.527 3.067 -14.486 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -14.374 3.994 -12.631 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -12.717 3.674 -12.161 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.013 6.303 -12.857 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -12.899 5.937 -11.555 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -12.064 7.137 -13.853 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -11.016 6.061 -12.950 1.00 0.00 H new ATOM 688 N ASP A 46 -15.250 3.380 -14.770 1.00 0.00 N ATOM 689 CA ASP A 46 -16.499 3.351 -15.522 1.00 0.00 C ATOM 690 C ASP A 46 -17.603 4.086 -14.769 1.00 0.00 C ATOM 691 O ASP A 46 -18.436 4.764 -15.373 1.00 0.00 O ATOM 692 CB ASP A 46 -16.923 1.907 -15.792 1.00 0.00 C ATOM 693 CG ASP A 46 -17.394 1.699 -17.218 1.00 0.00 C ATOM 694 OD1 ASP A 46 -16.599 1.948 -18.148 1.00 0.00 O ATOM 695 OD2 ASP A 46 -18.557 1.285 -17.404 1.00 0.00 O ATOM 0 H ASP A 46 -15.252 2.806 -13.927 1.00 0.00 H new ATOM 0 HA ASP A 46 -16.334 3.857 -16.473 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.084 1.241 -15.589 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -17.723 1.632 -15.104 1.00 0.00 H new ATOM 700 N CYS A 47 -17.605 3.947 -13.448 1.00 0.00 N ATOM 701 CA CYS A 47 -18.609 4.596 -12.612 1.00 0.00 C ATOM 702 C CYS A 47 -18.119 4.722 -11.173 1.00 0.00 C ATOM 703 O CYS A 47 -18.169 5.802 -10.583 1.00 0.00 O ATOM 704 CB CYS A 47 -19.921 3.810 -12.650 1.00 0.00 C ATOM 705 SG CYS A 47 -20.002 2.574 -13.967 1.00 0.00 S ATOM 0 H CYS A 47 -16.923 3.391 -12.933 1.00 0.00 H new ATOM 0 HA CYS A 47 -18.783 5.597 -13.007 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -20.062 3.313 -11.690 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -20.748 4.510 -12.771 1.00 0.00 H new ATOM 0 HG CYS A 47 -21.147 1.961 -13.917 1.00 0.00 H new ATOM 711 N ILE A 48 -17.649 3.613 -10.614 1.00 0.00 N ATOM 712 CA ILE A 48 -17.151 3.599 -9.244 1.00 0.00 C ATOM 713 C ILE A 48 -16.705 2.200 -8.835 1.00 0.00 C ATOM 714 O ILE A 48 -17.173 1.637 -7.846 1.00 0.00 O ATOM 715 CB ILE A 48 -18.219 4.096 -8.252 1.00 0.00 C ATOM 716 CG1 ILE A 48 -17.714 3.958 -6.814 1.00 0.00 C ATOM 717 CG2 ILE A 48 -19.516 3.324 -8.440 1.00 0.00 C ATOM 718 CD1 ILE A 48 -18.066 5.138 -5.935 1.00 0.00 C ATOM 0 H ILE A 48 -17.602 2.711 -11.089 1.00 0.00 H new ATOM 0 HA ILE A 48 -16.295 4.274 -9.213 1.00 0.00 H new ATOM 0 HB ILE A 48 -18.415 5.150 -8.449 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -18.132 3.051 -6.376 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -16.631 3.836 -6.828 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -20.261 3.687 -7.732 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -19.881 3.468 -9.457 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -19.336 2.263 -8.266 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -17.677 4.972 -4.930 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -17.626 6.045 -6.350 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -19.149 5.248 -5.891 1.00 0.00 H new ATOM 730 N PRO A 49 -15.775 1.624 -9.612 1.00 0.00 N ATOM 731 CA PRO A 49 -15.243 0.284 -9.349 1.00 0.00 C ATOM 732 C PRO A 49 -14.366 0.243 -8.102 1.00 0.00 C ATOM 733 O PRO A 49 -13.935 1.281 -7.601 1.00 0.00 O ATOM 734 CB PRO A 49 -14.411 -0.019 -10.598 1.00 0.00 C ATOM 735 CG PRO A 49 -14.027 1.318 -11.130 1.00 0.00 C ATOM 736 CD PRO A 49 -15.172 2.238 -10.807 1.00 0.00 C ATOM 0 HA PRO A 49 -16.036 -0.440 -9.163 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -13.532 -0.615 -10.353 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -14.987 -0.586 -11.330 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.103 1.670 -10.671 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -13.853 1.275 -12.205 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -14.828 3.253 -10.607 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -15.884 2.299 -11.630 1.00 0.00 H new ATOM 744 N ASP A 50 -14.107 -0.962 -7.607 1.00 0.00 N ATOM 745 CA ASP A 50 -13.280 -1.139 -6.419 1.00 0.00 C ATOM 746 C ASP A 50 -12.299 -2.292 -6.606 1.00 0.00 C ATOM 747 O ASP A 50 -12.703 -3.442 -6.779 1.00 0.00 O ATOM 748 CB ASP A 50 -14.158 -1.393 -5.193 1.00 0.00 C ATOM 749 CG ASP A 50 -14.058 -0.281 -4.168 1.00 0.00 C ATOM 750 OD1 ASP A 50 -12.922 0.096 -3.810 1.00 0.00 O ATOM 751 OD2 ASP A 50 -15.115 0.213 -3.723 1.00 0.00 O ATOM 0 H ASP A 50 -14.458 -1.831 -8.010 1.00 0.00 H new ATOM 0 HA ASP A 50 -12.710 -0.223 -6.264 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -15.196 -1.499 -5.509 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -13.867 -2.336 -4.731 1.00 0.00 H new ATOM 756 N VAL A 51 -11.008 -1.977 -6.570 1.00 0.00 N ATOM 757 CA VAL A 51 -9.970 -2.987 -6.735 1.00 0.00 C ATOM 758 C VAL A 51 -9.360 -3.372 -5.392 1.00 0.00 C ATOM 759 O VAL A 51 -8.662 -2.576 -4.765 1.00 0.00 O ATOM 760 CB VAL A 51 -8.851 -2.493 -7.672 1.00 0.00 C ATOM 761 CG1 VAL A 51 -8.362 -3.625 -8.562 1.00 0.00 C ATOM 762 CG2 VAL A 51 -9.336 -1.318 -8.507 1.00 0.00 C ATOM 0 H VAL A 51 -10.656 -1.030 -6.428 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.446 -3.861 -7.179 1.00 0.00 H new ATOM 0 HB VAL A 51 -8.013 -2.154 -7.063 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.572 -3.258 -9.217 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -7.973 -4.433 -7.942 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -9.190 -3.997 -9.166 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -8.533 -0.982 -9.163 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -10.191 -1.627 -9.109 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -9.632 -0.501 -7.849 1.00 0.00 H new ATOM 772 N GLU A 52 -9.628 -4.599 -4.957 1.00 0.00 N ATOM 773 CA GLU A 52 -9.106 -5.090 -3.687 1.00 0.00 C ATOM 774 C GLU A 52 -8.021 -6.140 -3.915 1.00 0.00 C ATOM 775 O GLU A 52 -8.207 -7.085 -4.683 1.00 0.00 O ATOM 776 CB GLU A 52 -10.234 -5.682 -2.840 1.00 0.00 C ATOM 777 CG GLU A 52 -11.589 -5.047 -3.102 1.00 0.00 C ATOM 778 CD GLU A 52 -12.717 -5.762 -2.385 1.00 0.00 C ATOM 779 OE1 GLU A 52 -12.434 -6.492 -1.412 1.00 0.00 O ATOM 780 OE2 GLU A 52 -13.884 -5.592 -2.797 1.00 0.00 O ATOM 0 H GLU A 52 -10.203 -5.271 -5.465 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.666 -4.247 -3.154 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.300 -6.752 -3.035 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -9.985 -5.565 -1.785 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.565 -4.005 -2.785 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -11.786 -5.049 -4.174 1.00 0.00 H new ATOM 787 N LEU A 53 -6.889 -5.967 -3.243 1.00 0.00 N ATOM 788 CA LEU A 53 -5.773 -6.899 -3.371 1.00 0.00 C ATOM 789 C LEU A 53 -5.433 -7.529 -2.024 1.00 0.00 C ATOM 790 O LEU A 53 -4.964 -6.849 -1.111 1.00 0.00 O ATOM 791 CB LEU A 53 -4.547 -6.181 -3.936 1.00 0.00 C ATOM 792 CG LEU A 53 -3.196 -6.843 -3.661 1.00 0.00 C ATOM 793 CD1 LEU A 53 -2.682 -6.455 -2.283 1.00 0.00 C ATOM 794 CD2 LEU A 53 -3.308 -8.356 -3.783 1.00 0.00 C ATOM 0 H LEU A 53 -6.719 -5.191 -2.604 1.00 0.00 H new ATOM 0 HA LEU A 53 -6.070 -7.692 -4.057 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.671 -6.088 -5.015 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.523 -5.170 -3.529 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.482 -6.490 -4.406 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.720 -6.935 -2.105 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.562 -5.373 -2.231 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.395 -6.778 -1.524 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.337 -8.810 -3.584 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.036 -8.726 -3.062 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.631 -8.617 -4.791 1.00 0.00 H new ATOM 806 N SER A 54 -5.669 -8.832 -1.909 1.00 0.00 N ATOM 807 CA SER A 54 -5.389 -9.553 -0.673 1.00 0.00 C ATOM 808 C SER A 54 -4.332 -10.630 -0.901 1.00 0.00 C ATOM 809 O SER A 54 -4.576 -11.620 -1.591 1.00 0.00 O ATOM 810 CB SER A 54 -6.669 -10.187 -0.126 1.00 0.00 C ATOM 811 OG SER A 54 -7.788 -9.849 -0.927 1.00 0.00 O ATOM 0 H SER A 54 -6.053 -9.410 -2.657 1.00 0.00 H new ATOM 0 HA SER A 54 -5.005 -8.839 0.056 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.556 -11.271 -0.092 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.836 -9.852 0.898 1.00 0.00 H new ATOM 0 HG SER A 54 -8.593 -10.268 -0.557 1.00 0.00 H new ATOM 817 N HIS A 55 -3.156 -10.429 -0.314 1.00 0.00 N ATOM 818 CA HIS A 55 -2.060 -11.381 -0.452 1.00 0.00 C ATOM 819 C HIS A 55 -2.587 -12.768 -0.810 1.00 0.00 C ATOM 820 O HIS A 55 -2.902 -13.569 0.069 1.00 0.00 O ATOM 821 CB HIS A 55 -1.250 -11.450 0.843 1.00 0.00 C ATOM 822 CG HIS A 55 0.103 -10.816 0.737 1.00 0.00 C ATOM 823 ND1 HIS A 55 1.195 -11.249 1.458 1.00 0.00 N ATOM 824 CD2 HIS A 55 0.537 -9.775 -0.012 1.00 0.00 C ATOM 825 CE1 HIS A 55 2.243 -10.502 1.158 1.00 0.00 C ATOM 826 NE2 HIS A 55 1.870 -9.600 0.268 1.00 0.00 N ATOM 0 H HIS A 55 -2.938 -9.616 0.262 1.00 0.00 H new ATOM 0 HA HIS A 55 -1.413 -11.037 -1.259 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -1.811 -10.960 1.639 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.131 -12.494 1.133 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.055 -9.191 -0.701 1.00 0.00 H new ATOM 0 HE1 HIS A 55 3.235 -10.610 1.570 1.00 0.00 H new ATOM 0 HE2 HIS A 55 2.474 -8.889 -0.144 1.00 0.00 H new ATOM 834 N GLY A 56 -2.683 -13.043 -2.107 1.00 0.00 N ATOM 835 CA GLY A 56 -3.173 -14.332 -2.558 1.00 0.00 C ATOM 836 C GLY A 56 -4.488 -14.223 -3.304 1.00 0.00 C ATOM 837 O GLY A 56 -5.102 -15.234 -3.647 1.00 0.00 O ATOM 0 H GLY A 56 -2.430 -12.396 -2.854 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.428 -14.794 -3.206 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -3.300 -14.990 -1.698 1.00 0.00 H new ATOM 841 N VAL A 57 -4.924 -12.993 -3.556 1.00 0.00 N ATOM 842 CA VAL A 57 -6.176 -12.756 -4.265 1.00 0.00 C ATOM 843 C VAL A 57 -6.220 -11.347 -4.846 1.00 0.00 C ATOM 844 O VAL A 57 -5.619 -10.421 -4.301 1.00 0.00 O ATOM 845 CB VAL A 57 -7.391 -12.957 -3.341 1.00 0.00 C ATOM 846 CG1 VAL A 57 -8.687 -12.781 -4.118 1.00 0.00 C ATOM 847 CG2 VAL A 57 -7.337 -14.326 -2.681 1.00 0.00 C ATOM 0 H VAL A 57 -4.429 -12.145 -3.280 1.00 0.00 H new ATOM 0 HA VAL A 57 -6.223 -13.482 -5.077 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.359 -12.200 -2.557 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.535 -12.927 -3.449 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.725 -11.776 -4.539 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.731 -13.514 -4.924 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -8.203 -14.451 -2.031 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.344 -15.100 -3.448 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.425 -14.409 -2.090 1.00 0.00 H new ATOM 857 N MET A 58 -6.936 -11.191 -5.954 1.00 0.00 N ATOM 858 CA MET A 58 -7.060 -9.894 -6.608 1.00 0.00 C ATOM 859 C MET A 58 -8.515 -9.596 -6.955 1.00 0.00 C ATOM 860 O MET A 58 -8.954 -9.822 -8.083 1.00 0.00 O ATOM 861 CB MET A 58 -6.203 -9.853 -7.875 1.00 0.00 C ATOM 862 CG MET A 58 -5.795 -8.448 -8.287 1.00 0.00 C ATOM 863 SD MET A 58 -6.912 -7.730 -9.507 1.00 0.00 S ATOM 864 CE MET A 58 -8.123 -6.953 -8.441 1.00 0.00 C ATOM 0 H MET A 58 -7.439 -11.947 -6.418 1.00 0.00 H new ATOM 0 HA MET A 58 -6.707 -9.131 -5.914 1.00 0.00 H new ATOM 0 HB2 MET A 58 -5.306 -10.451 -7.717 1.00 0.00 H new ATOM 0 HB3 MET A 58 -6.755 -10.317 -8.692 1.00 0.00 H new ATOM 0 HG2 MET A 58 -5.767 -7.808 -7.405 1.00 0.00 H new ATOM 0 HG3 MET A 58 -4.785 -8.472 -8.695 1.00 0.00 H new ATOM 0 HE1 MET A 58 -9.045 -7.535 -8.452 1.00 0.00 H new ATOM 0 HE2 MET A 58 -7.736 -6.907 -7.423 1.00 0.00 H new ATOM 0 HE3 MET A 58 -8.327 -5.943 -8.798 1.00 0.00 H new ATOM 874 N THR A 59 -9.260 -9.089 -5.978 1.00 0.00 N ATOM 875 CA THR A 59 -10.666 -8.763 -6.180 1.00 0.00 C ATOM 876 C THR A 59 -10.823 -7.419 -6.882 1.00 0.00 C ATOM 877 O THR A 59 -10.008 -6.514 -6.703 1.00 0.00 O ATOM 878 CB THR A 59 -11.431 -8.723 -4.843 1.00 0.00 C ATOM 879 OG1 THR A 59 -10.538 -9.001 -3.759 1.00 0.00 O ATOM 880 CG2 THR A 59 -12.569 -9.732 -4.841 1.00 0.00 C ATOM 0 H THR A 59 -8.913 -8.895 -5.039 1.00 0.00 H new ATOM 0 HA THR A 59 -11.086 -9.549 -6.807 1.00 0.00 H new ATOM 0 HB THR A 59 -11.851 -7.725 -4.720 1.00 0.00 H new ATOM 0 HG1 THR A 59 -11.032 -8.972 -2.913 1.00 0.00 H new ATOM 0 HG21 THR A 59 -13.095 -9.686 -3.887 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.263 -9.500 -5.649 1.00 0.00 H new ATOM 0 HG23 THR A 59 -12.167 -10.735 -4.985 1.00 0.00 H new ATOM 888 N LEU A 60 -11.877 -7.295 -7.682 1.00 0.00 N ATOM 889 CA LEU A 60 -12.142 -6.060 -8.412 1.00 0.00 C ATOM 890 C LEU A 60 -13.640 -5.859 -8.617 1.00 0.00 C ATOM 891 O LEU A 60 -14.201 -6.291 -9.623 1.00 0.00 O ATOM 892 CB LEU A 60 -11.428 -6.081 -9.765 1.00 0.00 C ATOM 893 CG LEU A 60 -11.928 -5.075 -10.803 1.00 0.00 C ATOM 894 CD1 LEU A 60 -10.881 -4.002 -11.054 1.00 0.00 C ATOM 895 CD2 LEU A 60 -12.290 -5.783 -12.100 1.00 0.00 C ATOM 0 H LEU A 60 -12.561 -8.034 -7.841 1.00 0.00 H new ATOM 0 HA LEU A 60 -11.761 -5.228 -7.820 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.366 -5.901 -9.596 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -11.519 -7.082 -10.186 1.00 0.00 H new ATOM 0 HG LEU A 60 -12.825 -4.594 -10.412 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -11.255 -3.295 -11.795 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -10.670 -3.475 -10.124 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -9.966 -4.466 -11.423 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -12.644 -5.052 -12.827 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -11.410 -6.291 -12.495 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -13.076 -6.514 -11.909 1.00 0.00 H new ATOM 907 N GLU A 61 -14.280 -5.200 -7.657 1.00 0.00 N ATOM 908 CA GLU A 61 -15.713 -4.941 -7.734 1.00 0.00 C ATOM 909 C GLU A 61 -16.027 -3.945 -8.846 1.00 0.00 C ATOM 910 O GLU A 61 -15.274 -2.998 -9.077 1.00 0.00 O ATOM 911 CB GLU A 61 -16.230 -4.407 -6.396 1.00 0.00 C ATOM 912 CG GLU A 61 -17.674 -3.938 -6.445 1.00 0.00 C ATOM 913 CD GLU A 61 -18.161 -3.407 -5.110 1.00 0.00 C ATOM 914 OE1 GLU A 61 -17.597 -3.810 -4.071 1.00 0.00 O ATOM 915 OE2 GLU A 61 -19.105 -2.590 -5.105 1.00 0.00 O ATOM 0 H GLU A 61 -13.830 -4.836 -6.817 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.214 -5.882 -7.960 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.136 -5.188 -5.642 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.598 -3.578 -6.077 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.773 -3.158 -7.200 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.311 -4.766 -6.756 1.00 0.00 H new ATOM 922 N ILE A 62 -17.143 -4.166 -9.532 1.00 0.00 N ATOM 923 CA ILE A 62 -17.557 -3.288 -10.620 1.00 0.00 C ATOM 924 C ILE A 62 -19.061 -3.040 -10.584 1.00 0.00 C ATOM 925 O ILE A 62 -19.864 -3.874 -11.004 1.00 0.00 O ATOM 926 CB ILE A 62 -17.178 -3.875 -11.992 1.00 0.00 C ATOM 927 CG1 ILE A 62 -15.737 -4.388 -11.972 1.00 0.00 C ATOM 928 CG2 ILE A 62 -17.359 -2.830 -13.083 1.00 0.00 C ATOM 929 CD1 ILE A 62 -14.904 -3.897 -13.135 1.00 0.00 C ATOM 0 H ILE A 62 -17.777 -4.945 -9.354 1.00 0.00 H new ATOM 0 HA ILE A 62 -17.032 -2.343 -10.480 1.00 0.00 H new ATOM 0 HB ILE A 62 -17.839 -4.715 -12.206 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -15.263 -4.079 -11.040 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -15.748 -5.478 -11.978 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -17.087 -3.260 -14.047 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -18.400 -2.508 -13.110 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -16.720 -1.972 -12.875 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -13.895 -4.300 -13.055 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -15.354 -4.228 -14.071 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -14.862 -2.808 -13.118 1.00 0.00 H new ATOM 941 N PRO A 63 -19.455 -1.864 -10.071 1.00 0.00 N ATOM 942 CA PRO A 63 -20.865 -1.477 -9.970 1.00 0.00 C ATOM 943 C PRO A 63 -21.490 -1.203 -11.333 1.00 0.00 C ATOM 944 O PRO A 63 -21.883 -0.076 -11.631 1.00 0.00 O ATOM 945 CB PRO A 63 -20.822 -0.196 -9.134 1.00 0.00 C ATOM 946 CG PRO A 63 -19.460 0.362 -9.366 1.00 0.00 C ATOM 947 CD PRO A 63 -18.553 -0.823 -9.551 1.00 0.00 C ATOM 0 HA PRO A 63 -21.474 -2.268 -9.532 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.596 0.506 -9.445 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -20.989 -0.407 -8.078 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -19.446 1.005 -10.246 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -19.139 0.971 -8.521 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -17.745 -0.606 -10.250 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -18.090 -1.125 -8.612 1.00 0.00 H new ATOM 955 N ALA A 64 -21.580 -2.242 -12.157 1.00 0.00 N ATOM 956 CA ALA A 64 -22.160 -2.113 -13.488 1.00 0.00 C ATOM 957 C ALA A 64 -22.403 -3.482 -14.116 1.00 0.00 C ATOM 958 O ALA A 64 -23.454 -3.725 -14.710 1.00 0.00 O ATOM 959 CB ALA A 64 -21.256 -1.275 -14.380 1.00 0.00 C ATOM 0 H ALA A 64 -21.259 -3.182 -11.926 1.00 0.00 H new ATOM 0 HA ALA A 64 -23.122 -1.610 -13.390 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -21.702 -1.187 -15.371 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -21.137 -0.282 -13.947 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -20.281 -1.754 -14.463 1.00 0.00 H new ATOM 965 N PHE A 65 -21.426 -4.372 -13.981 1.00 0.00 N ATOM 966 CA PHE A 65 -21.534 -5.716 -14.536 1.00 0.00 C ATOM 967 C PHE A 65 -21.274 -6.770 -13.464 1.00 0.00 C ATOM 968 O PHE A 65 -21.562 -7.950 -13.656 1.00 0.00 O ATOM 969 CB PHE A 65 -20.547 -5.893 -15.692 1.00 0.00 C ATOM 970 CG PHE A 65 -19.747 -4.658 -15.993 1.00 0.00 C ATOM 971 CD1 PHE A 65 -20.380 -3.457 -16.268 1.00 0.00 C ATOM 972 CD2 PHE A 65 -18.362 -4.698 -16.000 1.00 0.00 C ATOM 973 CE1 PHE A 65 -19.647 -2.319 -16.545 1.00 0.00 C ATOM 974 CE2 PHE A 65 -17.623 -3.563 -16.277 1.00 0.00 C ATOM 975 CZ PHE A 65 -18.267 -2.372 -16.549 1.00 0.00 C ATOM 0 H PHE A 65 -20.550 -4.187 -13.492 1.00 0.00 H new ATOM 0 HA PHE A 65 -22.549 -5.848 -14.910 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -19.865 -6.709 -15.455 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -21.096 -6.187 -16.586 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -21.459 -3.410 -16.266 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -17.854 -5.627 -15.787 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -20.153 -1.389 -16.758 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -16.544 -3.608 -16.281 1.00 0.00 H new ATOM 0 HZ PHE A 65 -17.692 -1.483 -16.765 1.00 0.00 H new ATOM 985 N GLY A 66 -20.726 -6.333 -12.334 1.00 0.00 N ATOM 986 CA GLY A 66 -20.435 -7.251 -11.248 1.00 0.00 C ATOM 987 C GLY A 66 -19.076 -7.000 -10.625 1.00 0.00 C ATOM 988 O GLY A 66 -18.634 -5.855 -10.520 1.00 0.00 O ATOM 0 H GLY A 66 -20.479 -5.360 -12.151 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -21.205 -7.159 -10.482 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.477 -8.275 -11.620 1.00 0.00 H new ATOM 992 N THR A 67 -18.411 -8.072 -10.207 1.00 0.00 N ATOM 993 CA THR A 67 -17.096 -7.963 -9.589 1.00 0.00 C ATOM 994 C THR A 67 -16.158 -9.053 -10.095 1.00 0.00 C ATOM 995 O THR A 67 -16.452 -10.242 -9.978 1.00 0.00 O ATOM 996 CB THR A 67 -17.188 -8.053 -8.054 1.00 0.00 C ATOM 997 OG1 THR A 67 -15.874 -8.108 -7.487 1.00 0.00 O ATOM 998 CG2 THR A 67 -17.979 -9.281 -7.630 1.00 0.00 C ATOM 0 H THR A 67 -18.762 -9.026 -10.285 1.00 0.00 H new ATOM 0 HA THR A 67 -16.697 -6.987 -9.866 1.00 0.00 H new ATOM 0 HB THR A 67 -17.704 -7.164 -7.691 1.00 0.00 H new ATOM 0 HG1 THR A 67 -15.941 -8.164 -6.511 1.00 0.00 H new ATOM 0 HG21 THR A 67 -18.030 -9.323 -6.542 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.988 -9.223 -8.039 1.00 0.00 H new ATOM 0 HG23 THR A 67 -17.487 -10.178 -8.005 1.00 0.00 H new ATOM 1006 N TYR A 68 -15.028 -8.639 -10.658 1.00 0.00 N ATOM 1007 CA TYR A 68 -14.047 -9.581 -11.185 1.00 0.00 C ATOM 1008 C TYR A 68 -13.018 -9.948 -10.120 1.00 0.00 C ATOM 1009 O TYR A 68 -12.439 -9.075 -9.472 1.00 0.00 O ATOM 1010 CB TYR A 68 -13.343 -8.987 -12.406 1.00 0.00 C ATOM 1011 CG TYR A 68 -13.891 -9.489 -13.723 1.00 0.00 C ATOM 1012 CD1 TYR A 68 -13.627 -10.780 -14.162 1.00 0.00 C ATOM 1013 CD2 TYR A 68 -14.673 -8.671 -14.529 1.00 0.00 C ATOM 1014 CE1 TYR A 68 -14.124 -11.242 -15.365 1.00 0.00 C ATOM 1015 CE2 TYR A 68 -15.176 -9.125 -15.733 1.00 0.00 C ATOM 1016 CZ TYR A 68 -14.899 -10.411 -16.147 1.00 0.00 C ATOM 1017 OH TYR A 68 -15.397 -10.868 -17.345 1.00 0.00 O ATOM 0 H TYR A 68 -14.769 -7.658 -10.761 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.575 -10.487 -11.483 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.433 -7.901 -12.375 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -12.280 -9.220 -12.352 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -13.022 -11.434 -13.552 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -14.891 -7.663 -14.209 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.907 -12.248 -15.692 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -15.783 -8.476 -16.347 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.923 -10.160 -17.772 1.00 0.00 H new ATOM 1027 N VAL A 69 -12.795 -11.246 -9.944 1.00 0.00 N ATOM 1028 CA VAL A 69 -11.835 -11.731 -8.960 1.00 0.00 C ATOM 1029 C VAL A 69 -10.734 -12.550 -9.623 1.00 0.00 C ATOM 1030 O VAL A 69 -10.991 -13.319 -10.550 1.00 0.00 O ATOM 1031 CB VAL A 69 -12.522 -12.591 -7.883 1.00 0.00 C ATOM 1032 CG1 VAL A 69 -11.738 -12.541 -6.580 1.00 0.00 C ATOM 1033 CG2 VAL A 69 -13.956 -12.133 -7.670 1.00 0.00 C ATOM 0 H VAL A 69 -13.267 -11.981 -10.471 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.395 -10.853 -8.487 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.543 -13.625 -8.227 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -12.238 -13.154 -5.831 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.730 -12.922 -6.747 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -11.683 -11.511 -6.228 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -14.426 -12.752 -6.906 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.961 -11.092 -7.348 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.510 -12.226 -8.604 1.00 0.00 H new ATOM 1043 N ILE A 70 -9.507 -12.381 -9.142 1.00 0.00 N ATOM 1044 CA ILE A 70 -8.366 -13.106 -9.688 1.00 0.00 C ATOM 1045 C ILE A 70 -7.370 -13.469 -8.592 1.00 0.00 C ATOM 1046 O ILE A 70 -6.699 -12.600 -8.037 1.00 0.00 O ATOM 1047 CB ILE A 70 -7.643 -12.286 -10.772 1.00 0.00 C ATOM 1048 CG1 ILE A 70 -8.647 -11.436 -11.554 1.00 0.00 C ATOM 1049 CG2 ILE A 70 -6.876 -13.206 -11.710 1.00 0.00 C ATOM 1050 CD1 ILE A 70 -8.887 -10.072 -10.946 1.00 0.00 C ATOM 0 H ILE A 70 -9.277 -11.749 -8.375 1.00 0.00 H new ATOM 0 HA ILE A 70 -8.758 -14.019 -10.137 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.931 -11.619 -10.287 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -8.287 -11.311 -12.575 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -9.595 -11.970 -11.613 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.371 -12.611 -12.471 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -6.138 -13.772 -11.142 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.570 -13.896 -12.191 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -9.609 -9.525 -11.553 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -9.277 -10.188 -9.935 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.949 -9.519 -10.912 1.00 0.00 H new ATOM 1062 N ASN A 71 -7.278 -14.759 -8.286 1.00 0.00 N ATOM 1063 CA ASN A 71 -6.362 -15.237 -7.257 1.00 0.00 C ATOM 1064 C ASN A 71 -5.359 -16.229 -7.839 1.00 0.00 C ATOM 1065 O ASN A 71 -5.570 -16.780 -8.920 1.00 0.00 O ATOM 1066 CB ASN A 71 -7.142 -15.894 -6.116 1.00 0.00 C ATOM 1067 CG ASN A 71 -7.524 -17.328 -6.427 1.00 0.00 C ATOM 1068 OD1 ASN A 71 -6.678 -18.141 -6.798 1.00 0.00 O ATOM 1069 ND2 ASN A 71 -8.806 -17.644 -6.278 1.00 0.00 N ATOM 0 H ASN A 71 -7.827 -15.492 -8.736 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.814 -14.379 -6.867 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -6.540 -15.870 -5.207 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -8.044 -15.316 -5.916 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -9.123 -18.593 -6.474 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -9.473 -16.937 -5.968 1.00 0.00 H new ATOM 1076 N LYS A 72 -4.268 -16.453 -7.115 1.00 0.00 N ATOM 1077 CA LYS A 72 -3.232 -17.379 -7.557 1.00 0.00 C ATOM 1078 C LYS A 72 -2.760 -18.258 -6.403 1.00 0.00 C ATOM 1079 O LYS A 72 -1.565 -18.508 -6.252 1.00 0.00 O ATOM 1080 CB LYS A 72 -2.047 -16.609 -8.144 1.00 0.00 C ATOM 1081 CG LYS A 72 -1.052 -17.492 -8.877 1.00 0.00 C ATOM 1082 CD LYS A 72 -0.002 -16.666 -9.601 1.00 0.00 C ATOM 1083 CE LYS A 72 -0.464 -16.276 -10.996 1.00 0.00 C ATOM 1084 NZ LYS A 72 0.454 -15.289 -11.630 1.00 0.00 N ATOM 0 H LYS A 72 -4.078 -16.005 -6.218 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.658 -18.020 -8.328 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.422 -15.850 -8.831 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.531 -16.084 -7.340 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.565 -18.160 -8.167 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -1.581 -18.120 -9.594 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.216 -15.767 -9.024 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.926 -17.234 -9.669 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.526 -17.167 -11.620 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.468 -15.855 -10.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.021 -14.922 -12.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.627 -14.503 -10.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.356 -15.752 -11.861 1.00 0.00 H new ATOM 1098 N GLN A 73 -3.706 -18.724 -5.594 1.00 0.00 N ATOM 1099 CA GLN A 73 -3.385 -19.575 -4.455 1.00 0.00 C ATOM 1100 C GLN A 73 -4.433 -20.669 -4.281 1.00 0.00 C ATOM 1101 O GLN A 73 -4.809 -21.031 -3.165 1.00 0.00 O ATOM 1102 CB GLN A 73 -3.287 -18.739 -3.178 1.00 0.00 C ATOM 1103 CG GLN A 73 -2.493 -19.411 -2.070 1.00 0.00 C ATOM 1104 CD GLN A 73 -1.485 -18.479 -1.426 1.00 0.00 C ATOM 1105 OE1 GLN A 73 -1.153 -17.429 -1.977 1.00 0.00 O ATOM 1106 NE2 GLN A 73 -0.993 -18.858 -0.253 1.00 0.00 N ATOM 0 H GLN A 73 -4.700 -18.527 -5.706 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.421 -20.047 -4.647 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -2.824 -17.781 -3.415 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -4.293 -18.526 -2.815 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -3.180 -19.779 -1.308 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -1.972 -20.278 -2.476 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -1.296 -19.736 0.167 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -0.312 -18.271 0.228 1.00 0.00 H new ATOM 1115 N PRO A 74 -4.917 -21.211 -5.408 1.00 0.00 N ATOM 1116 CA PRO A 74 -5.928 -22.272 -5.406 1.00 0.00 C ATOM 1117 C PRO A 74 -5.377 -23.597 -4.891 1.00 0.00 C ATOM 1118 O PRO A 74 -4.168 -23.777 -4.740 1.00 0.00 O ATOM 1119 CB PRO A 74 -6.319 -22.392 -6.882 1.00 0.00 C ATOM 1120 CG PRO A 74 -5.128 -21.900 -7.630 1.00 0.00 C ATOM 1121 CD PRO A 74 -4.514 -20.828 -6.772 1.00 0.00 C ATOM 0 HA PRO A 74 -6.764 -22.037 -4.747 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -6.555 -23.423 -7.147 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -7.203 -21.795 -7.107 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -4.420 -22.708 -7.811 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -5.415 -21.504 -8.604 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -3.430 -20.800 -6.878 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -4.885 -19.838 -7.038 1.00 0.00 H new ATOM 1129 N PRO A 75 -6.282 -24.548 -4.616 1.00 0.00 N ATOM 1130 CA PRO A 75 -5.908 -25.874 -4.114 1.00 0.00 C ATOM 1131 C PRO A 75 -5.201 -26.715 -5.171 1.00 0.00 C ATOM 1132 O PRO A 75 -5.624 -27.829 -5.476 1.00 0.00 O ATOM 1133 CB PRO A 75 -7.253 -26.504 -3.741 1.00 0.00 C ATOM 1134 CG PRO A 75 -8.249 -25.806 -4.602 1.00 0.00 C ATOM 1135 CD PRO A 75 -7.738 -24.402 -4.773 1.00 0.00 C ATOM 0 HA PRO A 75 -5.205 -25.812 -3.283 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -7.252 -27.578 -3.927 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -7.476 -26.364 -2.683 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -8.349 -26.305 -5.566 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -9.235 -25.808 -4.138 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -7.998 -23.996 -5.751 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -8.157 -23.728 -4.026 1.00 0.00 H new ATOM 1143 N ASN A 76 -4.121 -26.175 -5.726 1.00 0.00 N ATOM 1144 CA ASN A 76 -3.355 -26.877 -6.749 1.00 0.00 C ATOM 1145 C ASN A 76 -2.523 -25.898 -7.572 1.00 0.00 C ATOM 1146 O ASN A 76 -2.344 -26.078 -8.777 1.00 0.00 O ATOM 1147 CB ASN A 76 -4.292 -27.665 -7.667 1.00 0.00 C ATOM 1148 CG ASN A 76 -5.598 -26.938 -7.920 1.00 0.00 C ATOM 1149 OD1 ASN A 76 -5.612 -25.736 -8.184 1.00 0.00 O ATOM 1150 ND2 ASN A 76 -6.706 -27.667 -7.841 1.00 0.00 N ATOM 0 H ASN A 76 -3.757 -25.253 -5.484 1.00 0.00 H new ATOM 0 HA ASN A 76 -2.679 -27.571 -6.249 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -3.793 -27.851 -8.618 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -4.501 -28.637 -7.221 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -7.615 -27.233 -8.002 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -6.648 -28.661 -7.619 1.00 0.00 H new ATOM 1157 N LYS A 77 -2.015 -24.862 -6.914 1.00 0.00 N ATOM 1158 CA LYS A 77 -1.200 -23.855 -7.583 1.00 0.00 C ATOM 1159 C LYS A 77 -1.759 -23.532 -8.964 1.00 0.00 C ATOM 1160 O LYS A 77 -1.454 -24.215 -9.942 1.00 0.00 O ATOM 1161 CB LYS A 77 0.247 -24.340 -7.707 1.00 0.00 C ATOM 1162 CG LYS A 77 0.930 -23.893 -8.987 1.00 0.00 C ATOM 1163 CD LYS A 77 2.434 -23.770 -8.803 1.00 0.00 C ATOM 1164 CE LYS A 77 3.093 -25.135 -8.679 1.00 0.00 C ATOM 1165 NZ LYS A 77 3.933 -25.456 -9.866 1.00 0.00 N ATOM 0 H LYS A 77 -2.153 -24.697 -5.917 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.222 -22.947 -6.980 1.00 0.00 H new ATOM 0 HB2 LYS A 77 0.818 -23.975 -6.854 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.262 -25.429 -7.658 1.00 0.00 H new ATOM 0 HG2 LYS A 77 0.717 -24.607 -9.783 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.521 -22.933 -9.302 1.00 0.00 H new ATOM 0 HD2 LYS A 77 2.863 -23.233 -9.649 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.646 -23.180 -7.911 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.710 -25.160 -7.780 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.325 -25.899 -8.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 4.364 -26.394 -9.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.340 -25.457 -10.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 4.682 -24.741 -9.965 1.00 0.00 H new ATOM 1179 N GLN A 78 -2.577 -22.487 -9.037 1.00 0.00 N ATOM 1180 CA GLN A 78 -3.177 -22.074 -10.300 1.00 0.00 C ATOM 1181 C GLN A 78 -3.762 -20.670 -10.191 1.00 0.00 C ATOM 1182 O GLN A 78 -3.748 -20.063 -9.120 1.00 0.00 O ATOM 1183 CB GLN A 78 -4.268 -23.062 -10.718 1.00 0.00 C ATOM 1184 CG GLN A 78 -3.817 -24.051 -11.781 1.00 0.00 C ATOM 1185 CD GLN A 78 -3.647 -25.456 -11.236 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -4.670 -25.954 -10.553 1.00 0.00 O flip ATOM 1187 NE2 GLN A 78 -2.606 -26.086 -11.428 1.00 0.00 N flip ATOM 0 H GLN A 78 -2.839 -21.911 -8.237 1.00 0.00 H new ATOM 0 HA GLN A 78 -2.395 -22.065 -11.059 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.604 -23.613 -9.840 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -5.127 -22.505 -11.092 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -4.546 -24.065 -12.591 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -2.872 -23.714 -12.208 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -1.845 -25.663 -11.959 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -2.505 -27.030 -11.056 1.00 0.00 H new ATOM 1196 N ILE A 79 -4.275 -20.160 -11.306 1.00 0.00 N ATOM 1197 CA ILE A 79 -4.865 -18.827 -11.335 1.00 0.00 C ATOM 1198 C ILE A 79 -6.384 -18.901 -11.448 1.00 0.00 C ATOM 1199 O ILE A 79 -6.922 -19.255 -12.497 1.00 0.00 O ATOM 1200 CB ILE A 79 -4.314 -17.993 -12.506 1.00 0.00 C ATOM 1201 CG1 ILE A 79 -3.146 -17.123 -12.037 1.00 0.00 C ATOM 1202 CG2 ILE A 79 -5.415 -17.132 -13.107 1.00 0.00 C ATOM 1203 CD1 ILE A 79 -2.461 -16.375 -13.158 1.00 0.00 C ATOM 0 H ILE A 79 -4.294 -20.649 -12.201 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.596 -18.342 -10.397 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.949 -18.672 -13.276 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.510 -16.405 -11.302 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.414 -17.753 -11.532 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -5.010 -16.548 -13.934 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -6.218 -17.772 -13.474 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.807 -16.458 -12.345 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.644 -15.779 -12.752 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.066 -17.087 -13.882 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.179 -15.718 -13.649 1.00 0.00 H new ATOM 1215 N TRP A 80 -7.069 -18.563 -10.362 1.00 0.00 N ATOM 1216 CA TRP A 80 -8.528 -18.590 -10.340 1.00 0.00 C ATOM 1217 C TRP A 80 -9.103 -17.251 -10.787 1.00 0.00 C ATOM 1218 O TRP A 80 -8.809 -16.209 -10.199 1.00 0.00 O ATOM 1219 CB TRP A 80 -9.031 -18.932 -8.937 1.00 0.00 C ATOM 1220 CG TRP A 80 -9.334 -20.388 -8.753 1.00 0.00 C ATOM 1221 CD1 TRP A 80 -8.530 -21.441 -9.087 1.00 0.00 C ATOM 1222 CD2 TRP A 80 -10.525 -20.952 -8.194 1.00 0.00 C ATOM 1223 NE1 TRP A 80 -9.150 -22.625 -8.769 1.00 0.00 N ATOM 1224 CE2 TRP A 80 -10.375 -22.352 -8.219 1.00 0.00 C ATOM 1225 CE3 TRP A 80 -11.703 -20.410 -7.672 1.00 0.00 C ATOM 1226 CZ2 TRP A 80 -11.359 -23.215 -7.744 1.00 0.00 C ATOM 1227 CZ3 TRP A 80 -12.679 -21.268 -7.201 1.00 0.00 C ATOM 1228 CH2 TRP A 80 -12.502 -22.657 -7.239 1.00 0.00 C ATOM 0 H TRP A 80 -6.639 -18.267 -9.486 1.00 0.00 H new ATOM 0 HA TRP A 80 -8.863 -19.359 -11.036 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -8.281 -18.629 -8.206 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -9.930 -18.352 -8.730 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -7.551 -21.355 -9.535 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -8.761 -23.556 -8.918 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.848 -19.340 -7.637 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -11.225 -24.286 -7.773 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -13.594 -20.860 -6.797 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -13.283 -23.300 -6.862 1.00 0.00 H new ATOM 1239 N LEU A 81 -9.925 -17.283 -11.830 1.00 0.00 N ATOM 1240 CA LEU A 81 -10.542 -16.071 -12.357 1.00 0.00 C ATOM 1241 C LEU A 81 -12.052 -16.091 -12.141 1.00 0.00 C ATOM 1242 O LEU A 81 -12.787 -16.740 -12.886 1.00 0.00 O ATOM 1243 CB LEU A 81 -10.230 -15.921 -13.846 1.00 0.00 C ATOM 1244 CG LEU A 81 -10.362 -14.510 -14.421 1.00 0.00 C ATOM 1245 CD1 LEU A 81 -11.808 -14.218 -14.792 1.00 0.00 C ATOM 1246 CD2 LEU A 81 -9.845 -13.479 -13.429 1.00 0.00 C ATOM 0 H LEU A 81 -10.180 -18.136 -12.328 1.00 0.00 H new ATOM 0 HA LEU A 81 -10.128 -15.219 -11.819 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -9.212 -16.269 -14.020 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -10.893 -16.583 -14.404 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.757 -14.449 -15.326 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.883 -13.210 -15.199 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -12.144 -14.937 -15.539 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.435 -14.298 -13.904 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.947 -12.481 -13.855 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.422 -13.540 -12.506 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.795 -13.676 -13.214 1.00 0.00 H new ATOM 1258 N ALA A 82 -12.509 -15.375 -11.119 1.00 0.00 N ATOM 1259 CA ALA A 82 -13.932 -15.308 -10.809 1.00 0.00 C ATOM 1260 C ALA A 82 -14.624 -14.230 -11.636 1.00 0.00 C ATOM 1261 O ALA A 82 -14.214 -13.070 -11.628 1.00 0.00 O ATOM 1262 CB ALA A 82 -14.136 -15.048 -9.324 1.00 0.00 C ATOM 0 H ALA A 82 -11.915 -14.833 -10.492 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.380 -16.268 -11.064 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -15.203 -15.000 -9.106 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -13.684 -15.855 -8.748 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.668 -14.102 -9.053 1.00 0.00 H new ATOM 1268 N SER A 83 -15.674 -14.622 -12.350 1.00 0.00 N ATOM 1269 CA SER A 83 -16.420 -13.690 -13.187 1.00 0.00 C ATOM 1270 C SER A 83 -17.199 -12.695 -12.332 1.00 0.00 C ATOM 1271 O SER A 83 -17.298 -12.831 -11.112 1.00 0.00 O ATOM 1272 CB SER A 83 -17.379 -14.451 -14.105 1.00 0.00 C ATOM 1273 OG SER A 83 -17.209 -15.851 -13.971 1.00 0.00 O ATOM 0 H SER A 83 -16.027 -15.579 -12.366 1.00 0.00 H new ATOM 0 HA SER A 83 -15.706 -13.137 -13.797 1.00 0.00 H new ATOM 0 HB2 SER A 83 -18.408 -14.182 -13.865 1.00 0.00 H new ATOM 0 HB3 SER A 83 -17.206 -14.158 -15.140 1.00 0.00 H new ATOM 0 HG SER A 83 -16.259 -16.075 -14.057 1.00 0.00 H new ATOM 1279 N PRO A 84 -17.765 -11.670 -12.985 1.00 0.00 N ATOM 1280 CA PRO A 84 -18.546 -10.632 -12.306 1.00 0.00 C ATOM 1281 C PRO A 84 -19.876 -11.159 -11.779 1.00 0.00 C ATOM 1282 O PRO A 84 -20.680 -10.405 -11.228 1.00 0.00 O ATOM 1283 CB PRO A 84 -18.780 -9.590 -13.402 1.00 0.00 C ATOM 1284 CG PRO A 84 -18.695 -10.355 -14.677 1.00 0.00 C ATOM 1285 CD PRO A 84 -17.688 -11.446 -14.439 1.00 0.00 C ATOM 0 HA PRO A 84 -18.029 -10.240 -11.430 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -19.753 -9.111 -13.292 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -18.030 -8.800 -13.364 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -19.665 -10.772 -14.947 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -18.385 -9.710 -15.499 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.934 -12.349 -14.998 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -16.687 -11.143 -14.747 1.00 0.00 H new ATOM 1293 N LEU A 85 -20.103 -12.457 -11.951 1.00 0.00 N ATOM 1294 CA LEU A 85 -21.337 -13.085 -11.492 1.00 0.00 C ATOM 1295 C LEU A 85 -21.038 -14.268 -10.577 1.00 0.00 C ATOM 1296 O LEU A 85 -21.528 -14.334 -9.450 1.00 0.00 O ATOM 1297 CB LEU A 85 -22.172 -13.548 -12.687 1.00 0.00 C ATOM 1298 CG LEU A 85 -23.224 -12.560 -13.193 1.00 0.00 C ATOM 1299 CD1 LEU A 85 -24.391 -12.478 -12.221 1.00 0.00 C ATOM 1300 CD2 LEU A 85 -22.607 -11.186 -13.406 1.00 0.00 C ATOM 0 H LEU A 85 -19.449 -13.095 -12.405 1.00 0.00 H new ATOM 0 HA LEU A 85 -21.903 -12.345 -10.926 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -21.495 -13.781 -13.509 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -22.675 -14.476 -12.416 1.00 0.00 H new ATOM 0 HG LEU A 85 -23.601 -12.919 -14.151 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -25.129 -11.770 -12.598 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -24.850 -13.461 -12.120 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -24.031 -12.143 -11.248 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -23.370 -10.496 -13.766 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -22.202 -10.819 -12.463 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -21.806 -11.257 -14.142 1.00 0.00 H new ATOM 1312 N SER A 86 -20.229 -15.201 -11.070 1.00 0.00 N ATOM 1313 CA SER A 86 -19.865 -16.383 -10.297 1.00 0.00 C ATOM 1314 C SER A 86 -19.326 -17.482 -11.208 1.00 0.00 C ATOM 1315 O SER A 86 -19.949 -18.530 -11.370 1.00 0.00 O ATOM 1316 CB SER A 86 -21.075 -16.900 -9.516 1.00 0.00 C ATOM 1317 OG SER A 86 -20.908 -18.261 -9.159 1.00 0.00 O ATOM 0 H SER A 86 -19.813 -15.161 -12.001 1.00 0.00 H new ATOM 0 HA SER A 86 -19.081 -16.101 -9.594 1.00 0.00 H new ATOM 0 HB2 SER A 86 -21.215 -16.300 -8.617 1.00 0.00 H new ATOM 0 HB3 SER A 86 -21.976 -16.787 -10.119 1.00 0.00 H new ATOM 0 HG SER A 86 -20.996 -18.822 -9.958 1.00 0.00 H new ATOM 1323 N GLY A 87 -18.162 -17.233 -11.800 1.00 0.00 N ATOM 1324 CA GLY A 87 -17.557 -18.209 -12.687 1.00 0.00 C ATOM 1325 C GLY A 87 -16.044 -18.210 -12.603 1.00 0.00 C ATOM 1326 O GLY A 87 -15.357 -17.554 -13.386 1.00 0.00 O ATOM 0 H GLY A 87 -17.627 -16.373 -11.681 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -17.932 -19.202 -12.439 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -17.861 -18.000 -13.713 1.00 0.00 H new ATOM 1330 N PRO A 88 -15.502 -18.960 -11.632 1.00 0.00 N ATOM 1331 CA PRO A 88 -14.054 -19.060 -11.424 1.00 0.00 C ATOM 1332 C PRO A 88 -13.360 -19.832 -12.542 1.00 0.00 C ATOM 1333 O PRO A 88 -13.831 -20.886 -12.965 1.00 0.00 O ATOM 1334 CB PRO A 88 -13.938 -19.818 -10.099 1.00 0.00 C ATOM 1335 CG PRO A 88 -15.200 -20.603 -10.000 1.00 0.00 C ATOM 1336 CD PRO A 88 -16.260 -19.768 -10.662 1.00 0.00 C ATOM 0 HA PRO A 88 -13.575 -18.081 -11.414 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -13.065 -20.470 -10.091 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -13.831 -19.132 -9.259 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -15.099 -21.569 -10.495 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.454 -20.803 -8.959 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.010 -20.387 -11.154 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.786 -19.142 -9.942 1.00 0.00 H new ATOM 1344 N ASN A 89 -12.239 -19.298 -13.015 1.00 0.00 N ATOM 1345 CA ASN A 89 -11.480 -19.937 -14.084 1.00 0.00 C ATOM 1346 C ASN A 89 -10.129 -20.429 -13.573 1.00 0.00 C ATOM 1347 O ASN A 89 -9.279 -19.635 -13.170 1.00 0.00 O ATOM 1348 CB ASN A 89 -11.274 -18.962 -15.244 1.00 0.00 C ATOM 1349 CG ASN A 89 -12.444 -18.013 -15.417 1.00 0.00 C ATOM 1350 OD1 ASN A 89 -13.525 -18.236 -14.871 1.00 0.00 O ATOM 1351 ND2 ASN A 89 -12.233 -16.946 -16.179 1.00 0.00 N ATOM 0 H ASN A 89 -11.836 -18.425 -12.675 1.00 0.00 H new ATOM 0 HA ASN A 89 -12.050 -20.796 -14.437 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -10.365 -18.386 -15.073 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -11.127 -19.525 -16.166 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -12.983 -16.272 -16.331 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -11.321 -16.801 -16.612 1.00 0.00 H new ATOM 1358 N ARG A 90 -9.939 -21.745 -13.593 1.00 0.00 N ATOM 1359 CA ARG A 90 -8.692 -22.343 -13.132 1.00 0.00 C ATOM 1360 C ARG A 90 -7.658 -22.378 -14.253 1.00 0.00 C ATOM 1361 O ARG A 90 -7.763 -23.176 -15.184 1.00 0.00 O ATOM 1362 CB ARG A 90 -8.943 -23.760 -12.612 1.00 0.00 C ATOM 1363 CG ARG A 90 -10.257 -23.909 -11.861 1.00 0.00 C ATOM 1364 CD ARG A 90 -10.572 -25.368 -11.574 1.00 0.00 C ATOM 1365 NE ARG A 90 -11.508 -25.927 -12.546 1.00 0.00 N ATOM 1366 CZ ARG A 90 -11.968 -27.172 -12.492 1.00 0.00 C ATOM 1367 NH1 ARG A 90 -11.579 -27.984 -11.518 1.00 0.00 N ATOM 1368 NH2 ARG A 90 -12.818 -27.608 -13.413 1.00 0.00 N ATOM 0 H ARG A 90 -10.632 -22.416 -13.923 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.302 -21.728 -12.321 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.934 -24.454 -13.453 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.123 -24.047 -11.953 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.206 -23.355 -10.923 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -11.064 -23.470 -12.447 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.649 -25.947 -11.585 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -10.993 -25.458 -10.572 1.00 0.00 H new ATOM 0 HE ARG A 90 -11.826 -25.328 -13.308 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -10.925 -27.653 -10.808 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -11.934 -28.940 -11.479 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -13.119 -26.987 -14.164 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -13.170 -28.564 -13.370 1.00 0.00 H new ATOM 1382 N PHE A 91 -6.659 -21.506 -14.157 1.00 0.00 N ATOM 1383 CA PHE A 91 -5.606 -21.436 -15.164 1.00 0.00 C ATOM 1384 C PHE A 91 -4.352 -22.164 -14.691 1.00 0.00 C ATOM 1385 O PHE A 91 -3.997 -22.112 -13.513 1.00 0.00 O ATOM 1386 CB PHE A 91 -5.273 -19.977 -15.483 1.00 0.00 C ATOM 1387 CG PHE A 91 -6.250 -19.331 -16.423 1.00 0.00 C ATOM 1388 CD1 PHE A 91 -6.082 -19.431 -17.795 1.00 0.00 C ATOM 1389 CD2 PHE A 91 -7.337 -18.624 -15.936 1.00 0.00 C ATOM 1390 CE1 PHE A 91 -6.979 -18.837 -18.662 1.00 0.00 C ATOM 1391 CE2 PHE A 91 -8.238 -18.028 -16.798 1.00 0.00 C ATOM 1392 CZ PHE A 91 -8.059 -18.135 -18.164 1.00 0.00 C ATOM 0 H PHE A 91 -6.557 -20.838 -13.393 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.969 -21.925 -16.068 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.244 -19.408 -14.554 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.275 -19.927 -15.918 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.240 -19.980 -18.191 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.482 -18.537 -14.869 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.836 -18.922 -19.729 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -9.081 -17.479 -16.404 1.00 0.00 H new ATOM 0 HZ PHE A 91 -8.762 -17.671 -18.840 1.00 0.00 H new ATOM 1402 N ASP A 92 -3.685 -22.843 -15.617 1.00 0.00 N ATOM 1403 CA ASP A 92 -2.469 -23.582 -15.297 1.00 0.00 C ATOM 1404 C ASP A 92 -1.236 -22.855 -15.824 1.00 0.00 C ATOM 1405 O ASP A 92 -1.245 -22.318 -16.933 1.00 0.00 O ATOM 1406 CB ASP A 92 -2.534 -24.993 -15.884 1.00 0.00 C ATOM 1407 CG ASP A 92 -2.528 -26.066 -14.813 1.00 0.00 C ATOM 1408 OD1 ASP A 92 -1.848 -25.874 -13.783 1.00 0.00 O ATOM 1409 OD2 ASP A 92 -3.205 -27.098 -15.004 1.00 0.00 O ATOM 0 H ASP A 92 -3.966 -22.897 -16.596 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.391 -23.652 -14.212 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.436 -25.091 -16.488 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.686 -25.145 -16.552 1.00 0.00 H new ATOM 1414 N LEU A 93 -0.176 -22.840 -15.023 1.00 0.00 N ATOM 1415 CA LEU A 93 1.065 -22.178 -15.408 1.00 0.00 C ATOM 1416 C LEU A 93 1.749 -22.925 -16.549 1.00 0.00 C ATOM 1417 O LEU A 93 2.152 -24.079 -16.396 1.00 0.00 O ATOM 1418 CB LEU A 93 2.008 -22.081 -14.208 1.00 0.00 C ATOM 1419 CG LEU A 93 2.758 -23.362 -13.839 1.00 0.00 C ATOM 1420 CD1 LEU A 93 3.608 -23.143 -12.597 1.00 0.00 C ATOM 1421 CD2 LEU A 93 1.781 -24.508 -13.623 1.00 0.00 C ATOM 0 H LEU A 93 -0.151 -23.279 -14.103 1.00 0.00 H new ATOM 0 HA LEU A 93 0.821 -21.173 -15.752 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.741 -21.300 -14.409 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.430 -21.760 -13.342 1.00 0.00 H new ATOM 0 HG LEU A 93 3.419 -23.625 -14.665 1.00 0.00 H new ATOM 0 HD11 LEU A 93 4.134 -24.065 -12.349 1.00 0.00 H new ATOM 0 HD12 LEU A 93 4.333 -22.351 -12.787 1.00 0.00 H new ATOM 0 HD13 LEU A 93 2.967 -22.856 -11.763 1.00 0.00 H new ATOM 0 HD21 LEU A 93 2.332 -25.411 -13.361 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.095 -24.254 -12.815 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.215 -24.681 -14.538 1.00 0.00 H new ATOM 1433 N LEU A 94 1.880 -22.259 -17.691 1.00 0.00 N ATOM 1434 CA LEU A 94 2.518 -22.858 -18.858 1.00 0.00 C ATOM 1435 C LEU A 94 3.632 -21.962 -19.390 1.00 0.00 C ATOM 1436 O LEU A 94 3.373 -20.980 -20.084 1.00 0.00 O ATOM 1437 CB LEU A 94 1.483 -23.112 -19.955 1.00 0.00 C ATOM 1438 CG LEU A 94 1.440 -24.531 -20.522 1.00 0.00 C ATOM 1439 CD1 LEU A 94 0.744 -25.472 -19.552 1.00 0.00 C ATOM 1440 CD2 LEU A 94 0.742 -24.545 -21.874 1.00 0.00 C ATOM 0 H LEU A 94 1.553 -21.304 -17.834 1.00 0.00 H new ATOM 0 HA LEU A 94 2.956 -23.809 -18.554 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.497 -22.871 -19.559 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.675 -22.420 -20.775 1.00 0.00 H new ATOM 0 HG LEU A 94 2.464 -24.877 -20.661 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.723 -26.477 -19.972 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.286 -25.486 -18.606 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.276 -25.129 -19.381 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.721 -25.563 -22.262 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.278 -24.179 -21.761 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.283 -23.903 -22.569 1.00 0.00 H new ATOM 1452 N ASN A 95 4.872 -22.310 -19.061 1.00 0.00 N ATOM 1453 CA ASN A 95 6.026 -21.537 -19.507 1.00 0.00 C ATOM 1454 C ASN A 95 5.887 -20.071 -19.108 1.00 0.00 C ATOM 1455 O ASN A 95 6.172 -19.172 -19.898 1.00 0.00 O ATOM 1456 CB ASN A 95 6.186 -21.652 -21.024 1.00 0.00 C ATOM 1457 CG ASN A 95 6.116 -23.088 -21.507 1.00 0.00 C ATOM 1458 OD1 ASN A 95 7.118 -23.803 -21.510 1.00 0.00 O ATOM 1459 ND2 ASN A 95 4.928 -23.516 -21.917 1.00 0.00 N ATOM 0 H ASN A 95 5.103 -23.121 -18.488 1.00 0.00 H new ATOM 0 HA ASN A 95 6.914 -21.943 -19.022 1.00 0.00 H new ATOM 0 HB2 ASN A 95 5.406 -21.069 -21.514 1.00 0.00 H new ATOM 0 HB3 ASN A 95 7.141 -21.219 -21.319 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.819 -24.473 -22.252 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.125 -22.888 -21.897 1.00 0.00 H new ATOM 1466 N GLY A 96 5.446 -19.838 -17.875 1.00 0.00 N ATOM 1467 CA GLY A 96 5.277 -18.480 -17.393 1.00 0.00 C ATOM 1468 C GLY A 96 3.906 -17.918 -17.713 1.00 0.00 C ATOM 1469 O GLY A 96 3.434 -17.000 -17.043 1.00 0.00 O ATOM 0 H GLY A 96 5.203 -20.565 -17.202 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.432 -18.459 -16.314 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.041 -17.842 -17.838 1.00 0.00 H new ATOM 1473 N GLU A 97 3.267 -18.468 -18.740 1.00 0.00 N ATOM 1474 CA GLU A 97 1.943 -18.012 -19.148 1.00 0.00 C ATOM 1475 C GLU A 97 0.860 -18.954 -18.629 1.00 0.00 C ATOM 1476 O GLU A 97 0.870 -20.149 -18.921 1.00 0.00 O ATOM 1477 CB GLU A 97 1.861 -17.914 -20.673 1.00 0.00 C ATOM 1478 CG GLU A 97 1.663 -16.496 -21.182 1.00 0.00 C ATOM 1479 CD GLU A 97 2.833 -16.005 -22.012 1.00 0.00 C ATOM 1480 OE1 GLU A 97 3.176 -16.674 -23.009 1.00 0.00 O ATOM 1481 OE2 GLU A 97 3.406 -14.952 -21.664 1.00 0.00 O ATOM 0 H GLU A 97 3.644 -19.229 -19.305 1.00 0.00 H new ATOM 0 HA GLU A 97 1.778 -17.024 -18.718 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.775 -18.322 -21.105 1.00 0.00 H new ATOM 0 HB3 GLU A 97 1.038 -18.536 -21.025 1.00 0.00 H new ATOM 0 HG2 GLU A 97 0.754 -16.453 -21.782 1.00 0.00 H new ATOM 0 HG3 GLU A 97 1.518 -15.827 -20.334 1.00 0.00 H new ATOM 1488 N TRP A 98 -0.072 -18.405 -17.858 1.00 0.00 N ATOM 1489 CA TRP A 98 -1.162 -19.195 -17.298 1.00 0.00 C ATOM 1490 C TRP A 98 -2.302 -19.340 -18.300 1.00 0.00 C ATOM 1491 O TRP A 98 -2.997 -18.372 -18.608 1.00 0.00 O ATOM 1492 CB TRP A 98 -1.678 -18.549 -16.010 1.00 0.00 C ATOM 1493 CG TRP A 98 -0.583 -18.126 -15.079 1.00 0.00 C ATOM 1494 CD1 TRP A 98 0.211 -17.021 -15.195 1.00 0.00 C ATOM 1495 CD2 TRP A 98 -0.161 -18.802 -13.889 1.00 0.00 C ATOM 1496 NE1 TRP A 98 1.102 -16.969 -14.150 1.00 0.00 N ATOM 1497 CE2 TRP A 98 0.893 -18.050 -13.334 1.00 0.00 C ATOM 1498 CE3 TRP A 98 -0.572 -19.967 -13.237 1.00 0.00 C ATOM 1499 CZ2 TRP A 98 1.540 -18.428 -12.161 1.00 0.00 C ATOM 1500 CZ3 TRP A 98 0.071 -20.342 -12.073 1.00 0.00 C ATOM 1501 CH2 TRP A 98 1.117 -19.574 -11.544 1.00 0.00 C ATOM 0 H TRP A 98 -0.095 -17.417 -17.607 1.00 0.00 H new ATOM 0 HA TRP A 98 -0.776 -20.189 -17.070 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -2.284 -17.680 -16.265 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -2.331 -19.253 -15.495 1.00 0.00 H new ATOM 0 HD1 TRP A 98 0.148 -16.294 -15.991 1.00 0.00 H new ATOM 0 HE1 TRP A 98 1.805 -16.244 -14.005 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -1.379 -20.564 -13.636 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 2.347 -17.838 -11.752 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 -0.238 -21.242 -11.562 1.00 0.00 H new ATOM 0 HH2 TRP A 98 1.599 -19.893 -10.631 1.00 0.00 H new ATOM 1512 N VAL A 99 -2.488 -20.554 -18.807 1.00 0.00 N ATOM 1513 CA VAL A 99 -3.545 -20.825 -19.774 1.00 0.00 C ATOM 1514 C VAL A 99 -4.424 -21.984 -19.318 1.00 0.00 C ATOM 1515 O VAL A 99 -3.997 -22.827 -18.528 1.00 0.00 O ATOM 1516 CB VAL A 99 -2.964 -21.152 -21.163 1.00 0.00 C ATOM 1517 CG1 VAL A 99 -1.444 -21.099 -21.132 1.00 0.00 C ATOM 1518 CG2 VAL A 99 -3.449 -22.514 -21.636 1.00 0.00 C ATOM 0 H VAL A 99 -1.920 -21.366 -18.564 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.149 -19.920 -19.844 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.315 -20.401 -21.871 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.052 -21.333 -22.122 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.121 -20.100 -20.840 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.069 -21.826 -20.412 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -3.029 -22.729 -22.619 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -3.129 -23.280 -20.929 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -4.537 -22.511 -21.699 1.00 0.00 H new ATOM 1528 N SER A 100 -5.654 -22.020 -19.820 1.00 0.00 N ATOM 1529 CA SER A 100 -6.595 -23.074 -19.462 1.00 0.00 C ATOM 1530 C SER A 100 -6.790 -24.046 -20.622 1.00 0.00 C ATOM 1531 O SER A 100 -6.914 -23.636 -21.777 1.00 0.00 O ATOM 1532 CB SER A 100 -7.941 -22.469 -19.057 1.00 0.00 C ATOM 1533 OG SER A 100 -8.897 -23.482 -18.793 1.00 0.00 O ATOM 0 H SER A 100 -6.022 -21.331 -20.476 1.00 0.00 H new ATOM 0 HA SER A 100 -6.182 -23.624 -18.616 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.812 -21.847 -18.171 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.305 -21.819 -19.853 1.00 0.00 H new ATOM 0 HG SER A 100 -9.748 -23.070 -18.535 1.00 0.00 H new ATOM 1539 N LEU A 101 -6.816 -25.336 -20.306 1.00 0.00 N ATOM 1540 CA LEU A 101 -6.996 -26.369 -21.320 1.00 0.00 C ATOM 1541 C LEU A 101 -7.922 -25.885 -22.431 1.00 0.00 C ATOM 1542 O LEU A 101 -7.665 -26.119 -23.613 1.00 0.00 O ATOM 1543 CB LEU A 101 -7.561 -27.641 -20.687 1.00 0.00 C ATOM 1544 CG LEU A 101 -7.223 -28.952 -21.398 1.00 0.00 C ATOM 1545 CD1 LEU A 101 -7.621 -28.883 -22.864 1.00 0.00 C ATOM 1546 CD2 LEU A 101 -5.741 -29.267 -21.260 1.00 0.00 C ATOM 0 H LEU A 101 -6.715 -25.692 -19.355 1.00 0.00 H new ATOM 0 HA LEU A 101 -6.021 -26.590 -21.755 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -7.199 -27.704 -19.661 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -8.646 -27.547 -20.637 1.00 0.00 H new ATOM 0 HG LEU A 101 -7.790 -29.755 -20.927 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -7.373 -29.825 -23.353 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.694 -28.705 -22.942 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -7.082 -28.069 -23.349 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -5.519 -30.203 -21.772 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -5.155 -28.462 -21.704 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.486 -29.361 -20.204 1.00 0.00 H new ATOM 1558 N ARG A 102 -8.998 -25.209 -22.045 1.00 0.00 N ATOM 1559 CA ARG A 102 -9.962 -24.691 -23.008 1.00 0.00 C ATOM 1560 C ARG A 102 -9.263 -24.235 -24.285 1.00 0.00 C ATOM 1561 O ARG A 102 -8.807 -23.096 -24.382 1.00 0.00 O ATOM 1562 CB ARG A 102 -10.748 -23.528 -22.401 1.00 0.00 C ATOM 1563 CG ARG A 102 -11.437 -22.652 -23.435 1.00 0.00 C ATOM 1564 CD ARG A 102 -12.781 -22.149 -22.933 1.00 0.00 C ATOM 1565 NE ARG A 102 -13.731 -23.239 -22.726 1.00 0.00 N ATOM 1566 CZ ARG A 102 -14.763 -23.166 -21.893 1.00 0.00 C ATOM 1567 NH1 ARG A 102 -14.978 -22.061 -21.193 1.00 0.00 N ATOM 1568 NH2 ARG A 102 -15.583 -24.201 -21.759 1.00 0.00 N ATOM 0 H ARG A 102 -9.225 -25.007 -21.071 1.00 0.00 H new ATOM 0 HA ARG A 102 -10.654 -25.495 -23.260 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.498 -23.925 -21.717 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.070 -22.912 -21.809 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.798 -21.803 -23.678 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -11.580 -23.218 -24.356 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.639 -21.609 -21.997 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -13.194 -21.440 -23.651 1.00 0.00 H new ATOM 0 HE ARG A 102 -13.594 -24.104 -23.250 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.350 -21.264 -21.293 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -15.771 -22.008 -20.554 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -15.421 -25.053 -22.296 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -16.375 -24.144 -21.119 1.00 0.00 H new ATOM 1582 N ASN A 103 -9.182 -25.132 -25.263 1.00 0.00 N ATOM 1583 CA ASN A 103 -8.538 -24.822 -26.534 1.00 0.00 C ATOM 1584 C ASN A 103 -7.331 -23.912 -26.324 1.00 0.00 C ATOM 1585 O ASN A 103 -6.989 -23.108 -27.189 1.00 0.00 O ATOM 1586 CB ASN A 103 -9.534 -24.155 -27.485 1.00 0.00 C ATOM 1587 CG ASN A 103 -10.317 -25.165 -28.301 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -11.541 -25.248 -28.197 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -9.613 -25.938 -29.120 1.00 0.00 N ATOM 0 H ASN A 103 -9.554 -26.079 -25.199 1.00 0.00 H new ATOM 0 HA ASN A 103 -8.194 -25.757 -26.976 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -10.227 -23.541 -26.909 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -8.998 -23.485 -28.158 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -10.086 -26.635 -29.695 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -8.600 -25.834 -29.174 1.00 0.00 H new ATOM 1596 N GLY A 104 -6.690 -24.046 -25.167 1.00 0.00 N ATOM 1597 CA GLY A 104 -5.528 -23.231 -24.864 1.00 0.00 C ATOM 1598 C GLY A 104 -5.868 -21.758 -24.745 1.00 0.00 C ATOM 1599 O GLY A 104 -5.474 -20.952 -25.589 1.00 0.00 O ATOM 0 H GLY A 104 -6.955 -24.704 -24.434 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.081 -23.574 -23.931 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -4.780 -23.366 -25.645 1.00 0.00 H new ATOM 1603 N THR A 105 -6.604 -21.405 -23.696 1.00 0.00 N ATOM 1604 CA THR A 105 -6.999 -20.020 -23.472 1.00 0.00 C ATOM 1605 C THR A 105 -6.102 -19.353 -22.435 1.00 0.00 C ATOM 1606 O THR A 105 -5.482 -20.025 -21.611 1.00 0.00 O ATOM 1607 CB THR A 105 -8.464 -19.923 -23.005 1.00 0.00 C ATOM 1608 OG1 THR A 105 -8.803 -21.067 -22.213 1.00 0.00 O ATOM 1609 CG2 THR A 105 -9.406 -19.827 -24.195 1.00 0.00 C ATOM 0 H THR A 105 -6.939 -22.059 -22.988 1.00 0.00 H new ATOM 0 HA THR A 105 -6.894 -19.503 -24.426 1.00 0.00 H new ATOM 0 HB THR A 105 -8.571 -19.021 -22.403 1.00 0.00 H new ATOM 0 HG1 THR A 105 -8.820 -21.865 -22.782 1.00 0.00 H new ATOM 0 HG21 THR A 105 -10.434 -19.760 -23.840 1.00 0.00 H new ATOM 0 HG22 THR A 105 -9.165 -18.939 -24.779 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.295 -20.714 -24.819 1.00 0.00 H new ATOM 1617 N LYS A 106 -6.038 -18.027 -22.481 1.00 0.00 N ATOM 1618 CA LYS A 106 -5.218 -17.267 -21.545 1.00 0.00 C ATOM 1619 C LYS A 106 -6.089 -16.415 -20.627 1.00 0.00 C ATOM 1620 O LYS A 106 -7.241 -16.118 -20.946 1.00 0.00 O ATOM 1621 CB LYS A 106 -4.234 -16.374 -22.305 1.00 0.00 C ATOM 1622 CG LYS A 106 -2.842 -16.970 -22.427 1.00 0.00 C ATOM 1623 CD LYS A 106 -2.633 -17.626 -23.781 1.00 0.00 C ATOM 1624 CE LYS A 106 -1.215 -17.415 -24.290 1.00 0.00 C ATOM 1625 NZ LYS A 106 -0.944 -15.984 -24.597 1.00 0.00 N ATOM 0 H LYS A 106 -6.545 -17.456 -23.157 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.659 -17.975 -20.933 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.627 -16.182 -23.303 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -4.165 -15.411 -21.799 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -2.097 -16.188 -22.282 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -2.690 -17.706 -21.638 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -2.838 -18.694 -23.705 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -3.343 -17.216 -24.499 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -0.504 -17.767 -23.542 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -1.058 -18.015 -25.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -0.184 -15.919 -25.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -1.806 -15.540 -24.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -0.652 -15.492 -23.729 1.00 0.00 H new ATOM 1639 N LEU A 107 -5.531 -16.024 -19.486 1.00 0.00 N ATOM 1640 CA LEU A 107 -6.256 -15.204 -18.522 1.00 0.00 C ATOM 1641 C LEU A 107 -6.555 -13.823 -19.097 1.00 0.00 C ATOM 1642 O LEU A 107 -7.660 -13.563 -19.575 1.00 0.00 O ATOM 1643 CB LEU A 107 -5.449 -15.067 -17.230 1.00 0.00 C ATOM 1644 CG LEU A 107 -5.992 -14.075 -16.201 1.00 0.00 C ATOM 1645 CD1 LEU A 107 -7.492 -14.254 -16.026 1.00 0.00 C ATOM 1646 CD2 LEU A 107 -5.274 -14.241 -14.869 1.00 0.00 C ATOM 0 H LEU A 107 -4.579 -16.262 -19.206 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.202 -15.698 -18.301 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.384 -16.048 -16.760 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.433 -14.770 -17.490 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.808 -13.065 -16.567 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.860 -13.539 -15.290 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.992 -14.084 -16.979 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.700 -15.268 -15.683 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -5.673 -13.527 -14.149 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.426 -15.254 -14.498 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.208 -14.061 -15.005 1.00 0.00 H new ATOM 1658 N THR A 108 -5.562 -12.940 -19.049 1.00 0.00 N ATOM 1659 CA THR A 108 -5.718 -11.587 -19.566 1.00 0.00 C ATOM 1660 C THR A 108 -6.534 -11.580 -20.853 1.00 0.00 C ATOM 1661 O THR A 108 -7.165 -10.580 -21.194 1.00 0.00 O ATOM 1662 CB THR A 108 -4.352 -10.927 -19.833 1.00 0.00 C ATOM 1663 OG1 THR A 108 -4.527 -9.534 -20.116 1.00 0.00 O ATOM 1664 CG2 THR A 108 -3.645 -11.601 -20.999 1.00 0.00 C ATOM 0 H THR A 108 -4.641 -13.138 -18.657 1.00 0.00 H new ATOM 0 HA THR A 108 -6.246 -11.016 -18.802 1.00 0.00 H new ATOM 0 HB THR A 108 -3.738 -11.041 -18.940 1.00 0.00 H new ATOM 0 HG1 THR A 108 -3.654 -9.122 -20.283 1.00 0.00 H new ATOM 0 HG21 THR A 108 -2.683 -11.118 -21.169 1.00 0.00 H new ATOM 0 HG22 THR A 108 -3.487 -12.655 -20.769 1.00 0.00 H new ATOM 0 HG23 THR A 108 -4.258 -11.514 -21.896 1.00 0.00 H new ATOM 1672 N ASP A 109 -6.517 -12.702 -21.564 1.00 0.00 N ATOM 1673 CA ASP A 109 -7.257 -12.826 -22.815 1.00 0.00 C ATOM 1674 C ASP A 109 -8.748 -13.005 -22.548 1.00 0.00 C ATOM 1675 O ASP A 109 -9.585 -12.390 -23.210 1.00 0.00 O ATOM 1676 CB ASP A 109 -6.727 -14.005 -23.631 1.00 0.00 C ATOM 1677 CG ASP A 109 -6.301 -13.598 -25.028 1.00 0.00 C ATOM 1678 OD1 ASP A 109 -5.650 -12.541 -25.165 1.00 0.00 O ATOM 1679 OD2 ASP A 109 -6.618 -14.336 -25.984 1.00 0.00 O ATOM 0 H ASP A 109 -5.999 -13.539 -21.296 1.00 0.00 H new ATOM 0 HA ASP A 109 -7.116 -11.908 -23.385 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.879 -14.451 -23.111 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -7.498 -14.772 -23.699 1.00 0.00 H new ATOM 1684 N ILE A 110 -9.073 -13.850 -21.576 1.00 0.00 N ATOM 1685 CA ILE A 110 -10.463 -14.110 -21.222 1.00 0.00 C ATOM 1686 C ILE A 110 -11.057 -12.945 -20.437 1.00 0.00 C ATOM 1687 O ILE A 110 -12.248 -12.650 -20.548 1.00 0.00 O ATOM 1688 CB ILE A 110 -10.601 -15.398 -20.390 1.00 0.00 C ATOM 1689 CG1 ILE A 110 -11.623 -16.339 -21.032 1.00 0.00 C ATOM 1690 CG2 ILE A 110 -11.004 -15.066 -18.961 1.00 0.00 C ATOM 1691 CD1 ILE A 110 -11.274 -16.732 -22.450 1.00 0.00 C ATOM 0 H ILE A 110 -8.392 -14.367 -21.019 1.00 0.00 H new ATOM 0 HA ILE A 110 -11.009 -14.232 -22.157 1.00 0.00 H new ATOM 0 HB ILE A 110 -9.635 -15.902 -20.366 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.708 -17.240 -20.424 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -12.601 -15.858 -21.027 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -11.097 -15.987 -18.386 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -10.244 -14.430 -18.507 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -11.960 -14.542 -18.965 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -12.042 -17.399 -22.842 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -11.218 -15.839 -23.072 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -10.311 -17.242 -22.460 1.00 0.00 H new ATOM 1703 N LEU A 111 -10.220 -12.285 -19.645 1.00 0.00 N ATOM 1704 CA LEU A 111 -10.661 -11.149 -18.842 1.00 0.00 C ATOM 1705 C LEU A 111 -10.881 -9.918 -19.715 1.00 0.00 C ATOM 1706 O LEU A 111 -11.829 -9.159 -19.510 1.00 0.00 O ATOM 1707 CB LEU A 111 -9.633 -10.840 -17.753 1.00 0.00 C ATOM 1708 CG LEU A 111 -10.197 -10.529 -16.366 1.00 0.00 C ATOM 1709 CD1 LEU A 111 -10.985 -9.229 -16.389 1.00 0.00 C ATOM 1710 CD2 LEU A 111 -11.071 -11.675 -15.877 1.00 0.00 C ATOM 0 H LEU A 111 -9.232 -12.516 -19.541 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.609 -11.413 -18.373 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.958 -11.692 -17.666 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.033 -9.990 -18.078 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.363 -10.412 -15.674 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.379 -9.024 -15.393 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -10.331 -8.413 -16.696 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.811 -9.317 -17.095 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.464 -11.437 -14.889 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.899 -11.823 -16.571 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.477 -12.587 -15.821 1.00 0.00 H new ATOM 1722 N THR A 112 -9.999 -9.726 -20.691 1.00 0.00 N ATOM 1723 CA THR A 112 -10.097 -8.588 -21.596 1.00 0.00 C ATOM 1724 C THR A 112 -11.244 -8.767 -22.584 1.00 0.00 C ATOM 1725 O THR A 112 -11.976 -7.822 -22.877 1.00 0.00 O ATOM 1726 CB THR A 112 -8.788 -8.380 -22.381 1.00 0.00 C ATOM 1727 OG1 THR A 112 -7.702 -8.159 -21.473 1.00 0.00 O ATOM 1728 CG2 THR A 112 -8.908 -7.199 -23.332 1.00 0.00 C ATOM 0 H THR A 112 -9.209 -10.344 -20.875 1.00 0.00 H new ATOM 0 HA THR A 112 -10.286 -7.710 -20.979 1.00 0.00 H new ATOM 0 HB THR A 112 -8.595 -9.279 -22.966 1.00 0.00 H new ATOM 0 HG1 THR A 112 -7.141 -8.961 -21.433 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.971 -7.072 -23.875 1.00 0.00 H new ATOM 0 HG22 THR A 112 -9.716 -7.383 -24.040 1.00 0.00 H new ATOM 0 HG23 THR A 112 -9.123 -6.294 -22.763 1.00 0.00 H new ATOM 1736 N GLU A 113 -11.396 -9.986 -23.092 1.00 0.00 N ATOM 1737 CA GLU A 113 -12.456 -10.288 -24.047 1.00 0.00 C ATOM 1738 C GLU A 113 -13.815 -10.336 -23.354 1.00 0.00 C ATOM 1739 O GLU A 113 -14.822 -9.900 -23.911 1.00 0.00 O ATOM 1740 CB GLU A 113 -12.180 -11.621 -24.746 1.00 0.00 C ATOM 1741 CG GLU A 113 -12.785 -11.717 -26.136 1.00 0.00 C ATOM 1742 CD GLU A 113 -13.236 -13.123 -26.480 1.00 0.00 C ATOM 1743 OE1 GLU A 113 -12.362 -13.987 -26.702 1.00 0.00 O ATOM 1744 OE2 GLU A 113 -14.461 -13.359 -26.527 1.00 0.00 O ATOM 0 H GLU A 113 -10.799 -10.780 -22.859 1.00 0.00 H new ATOM 0 HA GLU A 113 -12.475 -9.493 -24.792 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.102 -11.768 -24.817 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.572 -12.432 -24.132 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -13.636 -11.039 -26.205 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.052 -11.385 -26.871 1.00 0.00 H new ATOM 1751 N GLU A 114 -13.833 -10.871 -22.137 1.00 0.00 N ATOM 1752 CA GLU A 114 -15.068 -10.978 -21.369 1.00 0.00 C ATOM 1753 C GLU A 114 -15.579 -9.598 -20.965 1.00 0.00 C ATOM 1754 O GLU A 114 -16.743 -9.265 -21.185 1.00 0.00 O ATOM 1755 CB GLU A 114 -14.847 -11.838 -20.123 1.00 0.00 C ATOM 1756 CG GLU A 114 -14.785 -13.328 -20.415 1.00 0.00 C ATOM 1757 CD GLU A 114 -14.243 -14.129 -19.247 1.00 0.00 C ATOM 1758 OE1 GLU A 114 -13.811 -13.508 -18.253 1.00 0.00 O ATOM 1759 OE2 GLU A 114 -14.249 -15.375 -19.327 1.00 0.00 O ATOM 0 H GLU A 114 -13.007 -11.237 -21.662 1.00 0.00 H new ATOM 0 HA GLU A 114 -15.819 -11.453 -22.001 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -13.919 -11.532 -19.641 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -15.652 -11.649 -19.414 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -15.783 -13.687 -20.665 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -14.157 -13.497 -21.290 1.00 0.00 H new ATOM 1766 N VAL A 115 -14.699 -8.799 -20.370 1.00 0.00 N ATOM 1767 CA VAL A 115 -15.058 -7.455 -19.935 1.00 0.00 C ATOM 1768 C VAL A 115 -15.370 -6.556 -21.126 1.00 0.00 C ATOM 1769 O VAL A 115 -16.177 -5.632 -21.025 1.00 0.00 O ATOM 1770 CB VAL A 115 -13.932 -6.814 -19.103 1.00 0.00 C ATOM 1771 CG1 VAL A 115 -14.400 -5.503 -18.489 1.00 0.00 C ATOM 1772 CG2 VAL A 115 -13.453 -7.775 -18.025 1.00 0.00 C ATOM 0 H VAL A 115 -13.732 -9.060 -20.178 1.00 0.00 H new ATOM 0 HA VAL A 115 -15.948 -7.552 -19.314 1.00 0.00 H new ATOM 0 HB VAL A 115 -13.093 -6.598 -19.765 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -13.590 -5.065 -17.905 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -14.690 -4.813 -19.282 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -15.256 -5.690 -17.840 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -12.657 -7.306 -17.447 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -14.283 -8.024 -17.364 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -13.075 -8.685 -18.491 1.00 0.00 H new ATOM 1782 N GLU A 116 -14.724 -6.834 -22.255 1.00 0.00 N ATOM 1783 CA GLU A 116 -14.933 -6.049 -23.466 1.00 0.00 C ATOM 1784 C GLU A 116 -16.325 -6.294 -24.040 1.00 0.00 C ATOM 1785 O GLU A 116 -17.040 -5.354 -24.388 1.00 0.00 O ATOM 1786 CB GLU A 116 -13.870 -6.392 -24.512 1.00 0.00 C ATOM 1787 CG GLU A 116 -13.975 -5.563 -25.781 1.00 0.00 C ATOM 1788 CD GLU A 116 -12.742 -4.714 -26.026 1.00 0.00 C ATOM 1789 OE1 GLU A 116 -11.629 -5.278 -26.058 1.00 0.00 O ATOM 1790 OE2 GLU A 116 -12.893 -3.485 -26.187 1.00 0.00 O ATOM 0 H GLU A 116 -14.053 -7.596 -22.356 1.00 0.00 H new ATOM 0 HA GLU A 116 -14.848 -4.994 -23.204 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -12.882 -6.248 -24.075 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -13.953 -7.448 -24.770 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -14.130 -6.226 -26.632 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -14.850 -4.916 -25.717 1.00 0.00 H new ATOM 1797 N LYS A 117 -16.703 -7.564 -24.138 1.00 0.00 N ATOM 1798 CA LYS A 117 -18.009 -7.935 -24.669 1.00 0.00 C ATOM 1799 C LYS A 117 -19.096 -7.759 -23.613 1.00 0.00 C ATOM 1800 O LYS A 117 -20.286 -7.791 -23.923 1.00 0.00 O ATOM 1801 CB LYS A 117 -17.990 -9.385 -25.159 1.00 0.00 C ATOM 1802 CG LYS A 117 -17.163 -9.591 -26.416 1.00 0.00 C ATOM 1803 CD LYS A 117 -16.549 -10.981 -26.458 1.00 0.00 C ATOM 1804 CE LYS A 117 -17.618 -12.060 -26.536 1.00 0.00 C ATOM 1805 NZ LYS A 117 -17.277 -13.241 -25.695 1.00 0.00 N ATOM 0 H LYS A 117 -16.123 -8.354 -23.856 1.00 0.00 H new ATOM 0 HA LYS A 117 -18.232 -7.277 -25.509 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -17.597 -10.022 -24.367 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -19.013 -9.709 -25.350 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -17.791 -9.443 -27.294 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -16.373 -8.842 -26.460 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -15.886 -11.061 -27.319 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -15.937 -11.137 -25.569 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -18.574 -11.648 -26.213 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -17.741 -12.375 -27.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -17.881 -14.044 -25.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -16.279 -13.495 -25.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -17.432 -13.010 -24.693 1.00 0.00 H new ATOM 1819 N ALA A 118 -18.678 -7.571 -22.366 1.00 0.00 N ATOM 1820 CA ALA A 118 -19.616 -7.386 -21.266 1.00 0.00 C ATOM 1821 C ALA A 118 -19.933 -5.909 -21.057 1.00 0.00 C ATOM 1822 O ALA A 118 -21.032 -5.555 -20.631 1.00 0.00 O ATOM 1823 CB ALA A 118 -19.057 -7.994 -19.988 1.00 0.00 C ATOM 0 H ALA A 118 -17.696 -7.543 -22.092 1.00 0.00 H new ATOM 0 HA ALA A 118 -20.544 -7.897 -21.523 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -19.768 -7.849 -19.175 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -18.888 -9.061 -20.136 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -18.114 -7.509 -19.737 1.00 0.00 H new ATOM 1829 N ILE A 119 -18.963 -5.052 -21.358 1.00 0.00 N ATOM 1830 CA ILE A 119 -19.139 -3.614 -21.204 1.00 0.00 C ATOM 1831 C ILE A 119 -19.595 -2.972 -22.510 1.00 0.00 C ATOM 1832 O ILE A 119 -20.318 -1.976 -22.505 1.00 0.00 O ATOM 1833 CB ILE A 119 -17.839 -2.934 -20.737 1.00 0.00 C ATOM 1834 CG1 ILE A 119 -17.779 -2.892 -19.209 1.00 0.00 C ATOM 1835 CG2 ILE A 119 -17.738 -1.530 -21.315 1.00 0.00 C ATOM 1836 CD1 ILE A 119 -16.375 -2.991 -18.656 1.00 0.00 C ATOM 0 H ILE A 119 -18.047 -5.329 -21.710 1.00 0.00 H new ATOM 0 HA ILE A 119 -19.907 -3.471 -20.444 1.00 0.00 H new ATOM 0 HB ILE A 119 -16.992 -3.517 -21.099 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -18.233 -1.964 -18.861 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -18.377 -3.710 -18.807 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -16.814 -1.062 -20.976 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -17.739 -1.584 -22.404 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -18.589 -0.937 -20.980 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -16.409 -2.955 -17.567 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -15.924 -3.931 -18.974 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -15.778 -2.158 -19.028 1.00 0.00 H new ATOM 1848 N SER A 120 -19.167 -3.551 -23.628 1.00 0.00 N ATOM 1849 CA SER A 120 -19.530 -3.035 -24.942 1.00 0.00 C ATOM 1850 C SER A 120 -20.841 -3.648 -25.424 1.00 0.00 C ATOM 1851 O SER A 120 -21.565 -3.049 -26.220 1.00 0.00 O ATOM 1852 CB SER A 120 -18.417 -3.325 -25.952 1.00 0.00 C ATOM 1853 OG SER A 120 -18.410 -2.364 -26.993 1.00 0.00 O ATOM 0 H SER A 120 -18.569 -4.377 -23.649 1.00 0.00 H new ATOM 0 HA SER A 120 -19.663 -1.956 -24.857 1.00 0.00 H new ATOM 0 HB2 SER A 120 -17.452 -3.323 -25.445 1.00 0.00 H new ATOM 0 HB3 SER A 120 -18.554 -4.321 -26.373 1.00 0.00 H new ATOM 0 HG SER A 120 -17.689 -2.571 -27.624 1.00 0.00 H new ATOM 1859 N LYS A 121 -21.141 -4.846 -24.936 1.00 0.00 N ATOM 1860 CA LYS A 121 -22.365 -5.543 -25.314 1.00 0.00 C ATOM 1861 C LYS A 121 -23.558 -4.592 -25.302 1.00 0.00 C ATOM 1862 O LYS A 121 -24.556 -4.824 -25.984 1.00 0.00 O ATOM 1863 CB LYS A 121 -22.624 -6.714 -24.364 1.00 0.00 C ATOM 1864 CG LYS A 121 -24.086 -6.879 -23.987 1.00 0.00 C ATOM 1865 CD LYS A 121 -24.294 -8.073 -23.070 1.00 0.00 C ATOM 1866 CE LYS A 121 -24.997 -7.671 -21.783 1.00 0.00 C ATOM 1867 NZ LYS A 121 -26.466 -7.519 -21.978 1.00 0.00 N ATOM 0 H LYS A 121 -20.553 -5.356 -24.277 1.00 0.00 H new ATOM 0 HA LYS A 121 -22.237 -5.926 -26.326 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -22.272 -7.634 -24.830 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -22.037 -6.571 -23.457 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -24.440 -5.974 -23.493 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -24.684 -7.004 -24.890 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -24.883 -8.831 -23.586 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -23.330 -8.524 -22.834 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -24.808 -8.422 -21.016 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -24.580 -6.732 -21.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -26.909 -7.244 -21.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -26.647 -6.784 -22.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -26.869 -8.422 -22.301 1.00 0.00 H new ATOM 1881 N SER A 122 -23.446 -3.520 -24.524 1.00 0.00 N ATOM 1882 CA SER A 122 -24.517 -2.535 -24.422 1.00 0.00 C ATOM 1883 C SER A 122 -24.089 -1.203 -25.032 1.00 0.00 C ATOM 1884 O SER A 122 -24.799 -0.632 -25.859 1.00 0.00 O ATOM 1885 CB SER A 122 -24.916 -2.334 -22.959 1.00 0.00 C ATOM 1886 OG SER A 122 -26.323 -2.398 -22.801 1.00 0.00 O ATOM 0 H SER A 122 -22.625 -3.311 -23.955 1.00 0.00 H new ATOM 0 HA SER A 122 -25.377 -2.910 -24.977 1.00 0.00 H new ATOM 0 HB2 SER A 122 -24.442 -3.097 -22.341 1.00 0.00 H new ATOM 0 HB3 SER A 122 -24.551 -1.369 -22.609 1.00 0.00 H new ATOM 0 HG SER A 122 -26.552 -2.268 -21.857 1.00 0.00 H new ATOM 1892 N GLN A 123 -22.925 -0.716 -24.616 1.00 0.00 N ATOM 1893 CA GLN A 123 -22.403 0.549 -25.121 1.00 0.00 C ATOM 1894 C GLN A 123 -23.247 1.721 -24.631 1.00 0.00 C ATOM 1895 O GLN A 123 -23.808 2.472 -25.429 1.00 0.00 O ATOM 1896 CB GLN A 123 -22.365 0.536 -26.650 1.00 0.00 C ATOM 1897 CG GLN A 123 -21.519 1.649 -27.247 1.00 0.00 C ATOM 1898 CD GLN A 123 -20.206 1.145 -27.812 1.00 0.00 C ATOM 1899 OE1 GLN A 123 -19.264 0.866 -27.071 1.00 0.00 O ATOM 1900 NE2 GLN A 123 -20.138 1.024 -29.133 1.00 0.00 N ATOM 0 H GLN A 123 -22.326 -1.177 -23.931 1.00 0.00 H new ATOM 0 HA GLN A 123 -21.389 0.672 -24.741 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -21.977 -0.425 -26.987 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -23.383 0.620 -27.031 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -22.083 2.145 -28.037 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -21.317 2.397 -26.481 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -20.944 1.267 -29.710 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -19.280 0.688 -29.571 1.00 0.00 H new