USER MOD reduce.3.24.130724 H: found=0, std=0, add=696, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 695 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: B 57 CYS SG : rot -160:sc= -4.68 USER MOD Set 1.2: B 59 THR OG1 : rot -9:sc= -0.2! USER MOD Set 2.1: B 44 CYS SG : rot -138:sc= 0.155 USER MOD Set 2.2: B 49 CYS SG : rot 163:sc= 0.106 USER MOD Set 2.3: B 54 CYS SG : rot -68:sc= 0.382 USER MOD Set 3.1: B 37 TYR OH : rot -78:sc= 0.281 USER MOD Set 3.2: B 65 ASN : amide:sc= -1.04 K(o=-0.76,f=-3.3!) USER MOD Set 4.1: A 349 ASN : amide:sc= -0.708 K(o=-0.94,f=-2!) USER MOD Set 4.2: B 66 ASN : amide:sc= -0.231 K(o=-0.94,f=-2.4) USER MOD Single : A 329 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 330 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 336 GLN : amide:sc= -0.0552 K(o=-0.055,f=-1.5!) USER MOD Single : A 337 SER OG : rot -39:sc= 0.787 USER MOD Single : A 341 ASN : amide:sc= -1.57 K(o=-1.6,f=-4.5!) USER MOD Single : A 348 ASN : amide:sc= -1.72! C(o=-1.7!,f=-9.8!) USER MOD Single : A 354 ASN : amide:sc= -0.0579 K(o=-0.058,f=-2!) USER MOD Single : A 356 MET CE :methyl -154:sc= -0.154 (180deg=-0.322) USER MOD Single : A 358 SER OG : rot -32:sc= 0.949 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 HIS : no HE2:sc= -1.26 K(o=-1.3,f=-2.1!) USER MOD Single : B 36 TYR OH : rot 148:sc= 0.346 USER MOD Single : B 38 HIS : no HE2:sc= 0.941 K(o=0.94,f=-2.9!) USER MOD Single : B 39 GLN : amide:sc= -1.57 K(o=-1.6,f=-5!) USER MOD Single : B 41 THR OG1 : rot -10:sc= -0.181 USER MOD Single : B 46 ASN : amide:sc= -0.0331 K(o=-0.033,f=-1.8!) USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 51 ASN : amide:sc= -3.3! C(o=-3.3!,f=-9.5!) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 63 MET CE :methyl -178:sc= -1.61 (180deg=-1.64) USER MOD Single : B 71 LYS NZ :NH3+ -163:sc= -0.0298 (180deg=-0.418) USER MOD Single : B 76 TYR OH : rot -15:sc= -0.316 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 79 ASN : amide:sc= -0.276 K(o=-0.28,f=-1.7!) USER MOD Single : B 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 299 N ASP A 327 42.083 2.120 -6.888 1.00 0.00 N ATOM 300 CA ASP A 327 43.373 2.241 -6.218 1.00 0.00 C ATOM 301 C ASP A 327 43.175 2.387 -4.712 1.00 0.00 C ATOM 302 O ASP A 327 42.448 3.265 -4.249 1.00 0.00 O ATOM 303 CB ASP A 327 44.138 3.452 -6.765 1.00 0.00 C ATOM 304 CG ASP A 327 44.633 3.164 -8.180 1.00 0.00 C ATOM 305 OD1 ASP A 327 44.602 2.011 -8.573 1.00 0.00 O ATOM 306 OD2 ASP A 327 45.037 4.103 -8.847 1.00 0.00 O ATOM 0 HA ASP A 327 43.953 1.338 -6.410 1.00 0.00 H new ATOM 0 HB2 ASP A 327 43.491 4.329 -6.769 1.00 0.00 H new ATOM 0 HB3 ASP A 327 44.983 3.682 -6.116 1.00 0.00 H new ATOM 311 N VAL A 328 43.832 1.525 -3.952 1.00 0.00 N ATOM 312 CA VAL A 328 43.727 1.565 -2.499 1.00 0.00 C ATOM 313 C VAL A 328 44.245 2.897 -1.962 1.00 0.00 C ATOM 314 O VAL A 328 43.681 3.460 -1.024 1.00 0.00 O ATOM 315 CB VAL A 328 44.516 0.412 -1.884 1.00 0.00 C ATOM 316 CG1 VAL A 328 44.579 0.595 -0.369 1.00 0.00 C ATOM 317 CG2 VAL A 328 43.823 -0.911 -2.209 1.00 0.00 C ATOM 0 H VAL A 328 44.442 0.791 -4.314 1.00 0.00 H new ATOM 0 HA VAL A 328 42.677 1.464 -2.225 1.00 0.00 H new ATOM 0 HB VAL A 328 45.526 0.402 -2.293 1.00 0.00 H new ATOM 0 HG11 VAL A 328 45.142 -0.227 0.074 1.00 0.00 H new ATOM 0 HG12 VAL A 328 45.072 1.539 -0.137 1.00 0.00 H new ATOM 0 HG13 VAL A 328 43.568 0.604 0.039 1.00 0.00 H new ATOM 0 HG21 VAL A 328 44.386 -1.734 -1.770 1.00 0.00 H new ATOM 0 HG22 VAL A 328 42.813 -0.903 -1.799 1.00 0.00 H new ATOM 0 HG23 VAL A 328 43.775 -1.040 -3.290 1.00 0.00 H new ATOM 327 N MET A 329 45.326 3.388 -2.557 1.00 0.00 N ATOM 328 CA MET A 329 45.925 4.650 -2.129 1.00 0.00 C ATOM 329 C MET A 329 44.961 5.809 -2.362 1.00 0.00 C ATOM 330 O MET A 329 45.195 6.927 -1.902 1.00 0.00 O ATOM 331 CB MET A 329 47.224 4.899 -2.899 1.00 0.00 C ATOM 332 CG MET A 329 48.290 3.894 -2.452 1.00 0.00 C ATOM 333 SD MET A 329 48.774 4.239 -0.741 1.00 0.00 S ATOM 334 CE MET A 329 49.836 2.792 -0.510 1.00 0.00 C ATOM 0 H MET A 329 45.805 2.934 -3.335 1.00 0.00 H new ATOM 0 HA MET A 329 46.142 4.584 -1.063 1.00 0.00 H new ATOM 0 HB2 MET A 329 47.047 4.804 -3.970 1.00 0.00 H new ATOM 0 HB3 MET A 329 47.573 5.916 -2.723 1.00 0.00 H new ATOM 0 HG2 MET A 329 47.903 2.878 -2.533 1.00 0.00 H new ATOM 0 HG3 MET A 329 49.160 3.957 -3.106 1.00 0.00 H new ATOM 0 HE1 MET A 329 50.250 2.802 0.498 1.00 0.00 H new ATOM 0 HE2 MET A 329 49.250 1.884 -0.653 1.00 0.00 H new ATOM 0 HE3 MET A 329 50.648 2.817 -1.236 1.00 0.00 H new ATOM 344 N GLN A 330 43.876 5.532 -3.076 1.00 0.00 N ATOM 345 CA GLN A 330 42.875 6.551 -3.364 1.00 0.00 C ATOM 346 C GLN A 330 42.158 6.966 -2.084 1.00 0.00 C ATOM 347 O GLN A 330 41.680 8.095 -1.975 1.00 0.00 O ATOM 348 CB GLN A 330 41.852 6.023 -4.369 1.00 0.00 C ATOM 349 CG GLN A 330 40.948 7.169 -4.823 1.00 0.00 C ATOM 350 CD GLN A 330 39.976 6.672 -5.886 1.00 0.00 C ATOM 351 OE1 GLN A 330 40.004 5.497 -6.252 1.00 0.00 O ATOM 352 NE2 GLN A 330 39.115 7.501 -6.408 1.00 0.00 N ATOM 0 H GLN A 330 43.668 4.612 -3.465 1.00 0.00 H new ATOM 0 HA GLN A 330 43.382 7.417 -3.789 1.00 0.00 H new ATOM 0 HB2 GLN A 330 42.362 5.585 -5.227 1.00 0.00 H new ATOM 0 HB3 GLN A 330 41.255 5.232 -3.915 1.00 0.00 H new ATOM 0 HG2 GLN A 330 40.397 7.568 -3.972 1.00 0.00 H new ATOM 0 HG3 GLN A 330 41.552 7.984 -5.222 1.00 0.00 H new ATOM 0 HE21 GLN A 330 39.094 8.474 -6.103 1.00 0.00 H new ATOM 0 HE22 GLN A 330 38.462 7.176 -7.122 1.00 0.00 H new ATOM 361 N ASP A 331 42.082 6.045 -1.123 1.00 0.00 N ATOM 362 CA ASP A 331 41.416 6.326 0.145 1.00 0.00 C ATOM 363 C ASP A 331 42.397 6.183 1.317 1.00 0.00 C ATOM 364 O ASP A 331 42.468 5.130 1.963 1.00 0.00 O ATOM 365 CB ASP A 331 40.248 5.359 0.339 1.00 0.00 C ATOM 366 CG ASP A 331 39.448 5.763 1.571 1.00 0.00 C ATOM 367 OD1 ASP A 331 39.947 6.573 2.335 1.00 0.00 O ATOM 368 OD2 ASP A 331 38.349 5.261 1.732 1.00 0.00 O ATOM 0 H ASP A 331 42.471 5.105 -1.199 1.00 0.00 H new ATOM 0 HA ASP A 331 41.046 7.351 0.121 1.00 0.00 H new ATOM 0 HB2 ASP A 331 39.606 5.367 -0.542 1.00 0.00 H new ATOM 0 HB3 ASP A 331 40.621 4.341 0.453 1.00 0.00 H new ATOM 373 N PRO A 332 43.146 7.222 1.605 1.00 0.00 N ATOM 374 CA PRO A 332 44.136 7.222 2.726 1.00 0.00 C ATOM 375 C PRO A 332 43.486 6.854 4.056 1.00 0.00 C ATOM 376 O PRO A 332 44.111 6.236 4.916 1.00 0.00 O ATOM 377 CB PRO A 332 44.650 8.667 2.758 1.00 0.00 C ATOM 378 CG PRO A 332 44.415 9.190 1.384 1.00 0.00 C ATOM 379 CD PRO A 332 43.141 8.515 0.895 1.00 0.00 C ATOM 0 HA PRO A 332 44.926 6.487 2.576 1.00 0.00 H new ATOM 0 HB2 PRO A 332 44.117 9.259 3.502 1.00 0.00 H new ATOM 0 HB3 PRO A 332 45.708 8.704 3.019 1.00 0.00 H new ATOM 0 HG2 PRO A 332 44.305 10.274 1.392 1.00 0.00 H new ATOM 0 HG3 PRO A 332 45.255 8.960 0.729 1.00 0.00 H new ATOM 0 HD2 PRO A 332 42.256 9.103 1.137 1.00 0.00 H new ATOM 0 HD3 PRO A 332 43.147 8.380 -0.187 1.00 0.00 H new ATOM 387 N GLU A 333 42.226 7.245 4.219 1.00 0.00 N ATOM 388 CA GLU A 333 41.505 6.955 5.453 1.00 0.00 C ATOM 389 C GLU A 333 41.407 5.446 5.660 1.00 0.00 C ATOM 390 O GLU A 333 41.566 4.951 6.776 1.00 0.00 O ATOM 391 CB GLU A 333 40.094 7.563 5.396 1.00 0.00 C ATOM 392 CG GLU A 333 39.352 7.319 6.719 1.00 0.00 C ATOM 393 CD GLU A 333 40.070 8.036 7.856 1.00 0.00 C ATOM 394 OE1 GLU A 333 40.817 8.956 7.569 1.00 0.00 O ATOM 395 OE2 GLU A 333 39.860 7.658 8.997 1.00 0.00 O ATOM 0 H GLU A 333 41.688 7.758 3.520 1.00 0.00 H new ATOM 0 HA GLU A 333 42.050 7.396 6.288 1.00 0.00 H new ATOM 0 HB2 GLU A 333 40.160 8.633 5.201 1.00 0.00 H new ATOM 0 HB3 GLU A 333 39.534 7.122 4.571 1.00 0.00 H new ATOM 0 HG2 GLU A 333 38.326 7.678 6.642 1.00 0.00 H new ATOM 0 HG3 GLU A 333 39.301 6.250 6.926 1.00 0.00 H new ATOM 402 N PHE A 334 41.140 4.721 4.579 1.00 0.00 N ATOM 403 CA PHE A 334 41.017 3.273 4.656 1.00 0.00 C ATOM 404 C PHE A 334 42.332 2.665 5.121 1.00 0.00 C ATOM 405 O PHE A 334 42.356 1.794 5.991 1.00 0.00 O ATOM 406 CB PHE A 334 40.631 2.702 3.287 1.00 0.00 C ATOM 407 CG PHE A 334 40.377 1.217 3.413 1.00 0.00 C ATOM 408 CD1 PHE A 334 39.147 0.765 3.908 1.00 0.00 C ATOM 409 CD2 PHE A 334 41.362 0.293 3.039 1.00 0.00 C ATOM 410 CE1 PHE A 334 38.902 -0.607 4.029 1.00 0.00 C ATOM 411 CE2 PHE A 334 41.115 -1.079 3.162 1.00 0.00 C ATOM 412 CZ PHE A 334 39.886 -1.529 3.658 1.00 0.00 C ATOM 0 H PHE A 334 41.006 5.110 3.646 1.00 0.00 H new ATOM 0 HA PHE A 334 40.236 3.023 5.374 1.00 0.00 H new ATOM 0 HB2 PHE A 334 39.740 3.203 2.910 1.00 0.00 H new ATOM 0 HB3 PHE A 334 41.428 2.885 2.567 1.00 0.00 H new ATOM 0 HD1 PHE A 334 38.387 1.476 4.196 1.00 0.00 H new ATOM 0 HD2 PHE A 334 42.311 0.639 2.656 1.00 0.00 H new ATOM 0 HE1 PHE A 334 37.953 -0.954 4.409 1.00 0.00 H new ATOM 0 HE2 PHE A 334 41.874 -1.792 2.874 1.00 0.00 H new ATOM 0 HZ PHE A 334 39.698 -2.588 3.754 1.00 0.00 H new ATOM 422 N LEU A 335 43.428 3.133 4.536 1.00 0.00 N ATOM 423 CA LEU A 335 44.747 2.627 4.903 1.00 0.00 C ATOM 424 C LEU A 335 45.055 2.927 6.368 1.00 0.00 C ATOM 425 O LEU A 335 45.625 2.095 7.079 1.00 0.00 O ATOM 426 CB LEU A 335 45.817 3.264 4.015 1.00 0.00 C ATOM 427 CG LEU A 335 45.697 2.718 2.588 1.00 0.00 C ATOM 428 CD1 LEU A 335 46.629 3.503 1.663 1.00 0.00 C ATOM 429 CD2 LEU A 335 46.074 1.228 2.550 1.00 0.00 C ATOM 0 H LEU A 335 43.432 3.853 3.814 1.00 0.00 H new ATOM 0 HA LEU A 335 44.750 1.546 4.759 1.00 0.00 H new ATOM 0 HB2 LEU A 335 45.702 4.348 4.011 1.00 0.00 H new ATOM 0 HB3 LEU A 335 46.809 3.051 4.414 1.00 0.00 H new ATOM 0 HG LEU A 335 44.665 2.828 2.254 1.00 0.00 H new ATOM 0 HD11 LEU A 335 46.545 3.116 0.648 1.00 0.00 H new ATOM 0 HD12 LEU A 335 46.350 4.557 1.674 1.00 0.00 H new ATOM 0 HD13 LEU A 335 47.658 3.397 2.008 1.00 0.00 H new ATOM 0 HD21 LEU A 335 45.983 0.856 1.530 1.00 0.00 H new ATOM 0 HD22 LEU A 335 47.102 1.104 2.892 1.00 0.00 H new ATOM 0 HD23 LEU A 335 45.405 0.667 3.202 1.00 0.00 H new ATOM 441 N GLN A 336 44.675 4.116 6.813 1.00 0.00 N ATOM 442 CA GLN A 336 44.915 4.510 8.194 1.00 0.00 C ATOM 443 C GLN A 336 44.167 3.590 9.152 1.00 0.00 C ATOM 444 O GLN A 336 44.697 3.194 10.191 1.00 0.00 O ATOM 445 CB GLN A 336 44.460 5.955 8.406 1.00 0.00 C ATOM 446 CG GLN A 336 44.802 6.396 9.831 1.00 0.00 C ATOM 447 CD GLN A 336 44.440 7.863 10.023 1.00 0.00 C ATOM 448 OE1 GLN A 336 44.113 8.555 9.059 1.00 0.00 O ATOM 449 NE2 GLN A 336 44.475 8.382 11.220 1.00 0.00 N ATOM 0 H GLN A 336 44.203 4.819 6.244 1.00 0.00 H new ATOM 0 HA GLN A 336 45.983 4.431 8.397 1.00 0.00 H new ATOM 0 HB2 GLN A 336 44.948 6.610 7.685 1.00 0.00 H new ATOM 0 HB3 GLN A 336 43.386 6.038 8.237 1.00 0.00 H new ATOM 0 HG2 GLN A 336 44.260 5.782 10.550 1.00 0.00 H new ATOM 0 HG3 GLN A 336 45.865 6.247 10.021 1.00 0.00 H new ATOM 0 HE21 GLN A 336 44.746 7.807 12.018 1.00 0.00 H new ATOM 0 HE22 GLN A 336 44.231 9.363 11.358 1.00 0.00 H new ATOM 458 N SER A 337 42.931 3.256 8.799 1.00 0.00 N ATOM 459 CA SER A 337 42.119 2.384 9.639 1.00 0.00 C ATOM 460 C SER A 337 42.761 1.006 9.763 1.00 0.00 C ATOM 461 O SER A 337 42.684 0.367 10.811 1.00 0.00 O ATOM 462 CB SER A 337 40.719 2.240 9.042 1.00 0.00 C ATOM 463 OG SER A 337 40.811 1.607 7.772 1.00 0.00 O ATOM 0 H SER A 337 42.472 3.573 7.945 1.00 0.00 H new ATOM 0 HA SER A 337 42.049 2.831 10.631 1.00 0.00 H new ATOM 0 HB2 SER A 337 40.086 1.654 9.708 1.00 0.00 H new ATOM 0 HB3 SER A 337 40.253 3.220 8.940 1.00 0.00 H new ATOM 0 HG SER A 337 41.599 1.943 7.296 1.00 0.00 H new ATOM 469 N VAL A 338 43.392 0.556 8.687 1.00 0.00 N ATOM 470 CA VAL A 338 44.039 -0.750 8.686 1.00 0.00 C ATOM 471 C VAL A 338 45.166 -0.780 9.716 1.00 0.00 C ATOM 472 O VAL A 338 45.300 -1.735 10.487 1.00 0.00 O ATOM 473 CB VAL A 338 44.604 -1.047 7.292 1.00 0.00 C ATOM 474 CG1 VAL A 338 45.430 -2.332 7.337 1.00 0.00 C ATOM 475 CG2 VAL A 338 43.459 -1.201 6.280 1.00 0.00 C ATOM 0 H VAL A 338 43.470 1.071 7.810 1.00 0.00 H new ATOM 0 HA VAL A 338 43.302 -1.510 8.946 1.00 0.00 H new ATOM 0 HB VAL A 338 45.240 -0.218 6.982 1.00 0.00 H new ATOM 0 HG11 VAL A 338 45.831 -2.542 6.345 1.00 0.00 H new ATOM 0 HG12 VAL A 338 46.252 -2.212 8.043 1.00 0.00 H new ATOM 0 HG13 VAL A 338 44.797 -3.160 7.655 1.00 0.00 H new ATOM 0 HG21 VAL A 338 43.871 -1.412 5.293 1.00 0.00 H new ATOM 0 HG22 VAL A 338 42.811 -2.023 6.586 1.00 0.00 H new ATOM 0 HG23 VAL A 338 42.880 -0.278 6.242 1.00 0.00 H new ATOM 485 N LEU A 339 45.975 0.272 9.728 1.00 0.00 N ATOM 486 CA LEU A 339 47.084 0.351 10.668 1.00 0.00 C ATOM 487 C LEU A 339 46.567 0.357 12.102 1.00 0.00 C ATOM 488 O LEU A 339 47.121 -0.308 12.973 1.00 0.00 O ATOM 489 CB LEU A 339 47.888 1.625 10.408 1.00 0.00 C ATOM 490 CG LEU A 339 48.621 1.506 9.066 1.00 0.00 C ATOM 491 CD1 LEU A 339 49.488 2.746 8.849 1.00 0.00 C ATOM 492 CD2 LEU A 339 49.510 0.253 9.043 1.00 0.00 C ATOM 0 H LEU A 339 45.885 1.074 9.104 1.00 0.00 H new ATOM 0 HA LEU A 339 47.724 -0.520 10.529 1.00 0.00 H new ATOM 0 HB2 LEU A 339 47.224 2.490 10.396 1.00 0.00 H new ATOM 0 HB3 LEU A 339 48.605 1.785 11.213 1.00 0.00 H new ATOM 0 HG LEU A 339 47.881 1.425 8.270 1.00 0.00 H new ATOM 0 HD11 LEU A 339 50.010 2.663 7.896 1.00 0.00 H new ATOM 0 HD12 LEU A 339 48.857 3.635 8.841 1.00 0.00 H new ATOM 0 HD13 LEU A 339 50.217 2.826 9.656 1.00 0.00 H new ATOM 0 HD21 LEU A 339 50.021 0.187 8.083 1.00 0.00 H new ATOM 0 HD22 LEU A 339 50.248 0.316 9.843 1.00 0.00 H new ATOM 0 HD23 LEU A 339 48.893 -0.634 9.187 1.00 0.00 H new ATOM 504 N GLU A 340 45.493 1.101 12.333 1.00 0.00 N ATOM 505 CA GLU A 340 44.898 1.176 13.664 1.00 0.00 C ATOM 506 C GLU A 340 44.387 -0.189 14.099 1.00 0.00 C ATOM 507 O GLU A 340 44.508 -0.567 15.265 1.00 0.00 O ATOM 508 CB GLU A 340 43.753 2.189 13.673 1.00 0.00 C ATOM 509 CG GLU A 340 43.138 2.255 15.076 1.00 0.00 C ATOM 510 CD GLU A 340 42.106 3.374 15.138 1.00 0.00 C ATOM 511 OE1 GLU A 340 41.949 4.064 14.144 1.00 0.00 O ATOM 512 OE2 GLU A 340 41.485 3.523 16.178 1.00 0.00 O ATOM 0 H GLU A 340 45.018 1.658 11.623 1.00 0.00 H new ATOM 0 HA GLU A 340 45.666 1.500 14.367 1.00 0.00 H new ATOM 0 HB2 GLU A 340 44.121 3.172 13.379 1.00 0.00 H new ATOM 0 HB3 GLU A 340 42.994 1.902 12.945 1.00 0.00 H new ATOM 0 HG2 GLU A 340 42.669 1.302 15.322 1.00 0.00 H new ATOM 0 HG3 GLU A 340 43.919 2.427 15.817 1.00 0.00 H new ATOM 519 N ASN A 341 43.808 -0.920 13.158 1.00 0.00 N ATOM 520 CA ASN A 341 43.275 -2.238 13.453 1.00 0.00 C ATOM 521 C ASN A 341 44.379 -3.144 13.966 1.00 0.00 C ATOM 522 O ASN A 341 44.159 -3.967 14.853 1.00 0.00 O ATOM 523 CB ASN A 341 42.661 -2.852 12.194 1.00 0.00 C ATOM 524 CG ASN A 341 41.363 -2.136 11.845 1.00 0.00 C ATOM 525 OD1 ASN A 341 41.242 -1.558 10.764 1.00 0.00 O ATOM 526 ND2 ASN A 341 40.379 -2.136 12.701 1.00 0.00 N ATOM 0 H ASN A 341 43.696 -0.623 12.189 1.00 0.00 H new ATOM 0 HA ASN A 341 42.505 -2.137 14.218 1.00 0.00 H new ATOM 0 HB2 ASN A 341 43.362 -2.776 11.363 1.00 0.00 H new ATOM 0 HB3 ASN A 341 42.469 -3.913 12.353 1.00 0.00 H new ATOM 0 HD21 ASN A 341 39.507 -1.657 12.476 1.00 0.00 H new ATOM 0 HD22 ASN A 341 40.481 -2.615 13.596 1.00 0.00 H new ATOM 533 N LEU A 342 45.567 -3.005 13.396 1.00 0.00 N ATOM 534 CA LEU A 342 46.682 -3.847 13.808 1.00 0.00 C ATOM 535 C LEU A 342 46.987 -3.672 15.306 1.00 0.00 C ATOM 536 O LEU A 342 46.897 -2.566 15.846 1.00 0.00 O ATOM 537 CB LEU A 342 47.928 -3.506 12.991 1.00 0.00 C ATOM 538 CG LEU A 342 47.709 -3.902 11.526 1.00 0.00 C ATOM 539 CD1 LEU A 342 48.898 -3.426 10.690 1.00 0.00 C ATOM 540 CD2 LEU A 342 47.574 -5.427 11.395 1.00 0.00 C ATOM 0 H LEU A 342 45.783 -2.331 12.661 1.00 0.00 H new ATOM 0 HA LEU A 342 46.401 -4.885 13.631 1.00 0.00 H new ATOM 0 HB2 LEU A 342 48.140 -2.439 13.062 1.00 0.00 H new ATOM 0 HB3 LEU A 342 48.794 -4.031 13.394 1.00 0.00 H new ATOM 0 HG LEU A 342 46.791 -3.435 11.169 1.00 0.00 H new ATOM 0 HD11 LEU A 342 48.745 -3.706 9.648 1.00 0.00 H new ATOM 0 HD12 LEU A 342 48.985 -2.342 10.765 1.00 0.00 H new ATOM 0 HD13 LEU A 342 49.812 -3.890 11.060 1.00 0.00 H new ATOM 0 HD21 LEU A 342 47.419 -5.690 10.349 1.00 0.00 H new ATOM 0 HD22 LEU A 342 48.483 -5.905 11.759 1.00 0.00 H new ATOM 0 HD23 LEU A 342 46.724 -5.769 11.985 1.00 0.00 H new ATOM 552 N PRO A 343 47.342 -4.738 15.994 1.00 0.00 N ATOM 553 CA PRO A 343 47.646 -4.672 17.453 1.00 0.00 C ATOM 554 C PRO A 343 48.953 -3.941 17.740 1.00 0.00 C ATOM 555 O PRO A 343 49.957 -4.150 17.060 1.00 0.00 O ATOM 556 CB PRO A 343 47.740 -6.144 17.866 1.00 0.00 C ATOM 557 CG PRO A 343 48.129 -6.874 16.625 1.00 0.00 C ATOM 558 CD PRO A 343 47.501 -6.109 15.468 1.00 0.00 C ATOM 0 HA PRO A 343 46.889 -4.115 18.004 1.00 0.00 H new ATOM 0 HB2 PRO A 343 48.479 -6.285 18.654 1.00 0.00 H new ATOM 0 HB3 PRO A 343 46.788 -6.506 18.254 1.00 0.00 H new ATOM 0 HG2 PRO A 343 49.213 -6.915 16.521 1.00 0.00 H new ATOM 0 HG3 PRO A 343 47.772 -7.903 16.651 1.00 0.00 H new ATOM 0 HD2 PRO A 343 48.139 -6.126 14.584 1.00 0.00 H new ATOM 0 HD3 PRO A 343 46.543 -6.539 15.178 1.00 0.00 H new ATOM 566 N GLY A 344 48.930 -3.089 18.756 1.00 0.00 N ATOM 567 CA GLY A 344 50.119 -2.338 19.130 1.00 0.00 C ATOM 568 C GLY A 344 50.325 -1.151 18.200 1.00 0.00 C ATOM 569 O GLY A 344 51.314 -0.430 18.321 1.00 0.00 O ATOM 0 H GLY A 344 48.109 -2.902 19.331 1.00 0.00 H new ATOM 0 HA2 GLY A 344 50.025 -1.988 20.158 1.00 0.00 H new ATOM 0 HA3 GLY A 344 50.992 -2.990 19.094 1.00 0.00 H new ATOM 573 N VAL A 345 49.391 -0.960 17.270 1.00 0.00 N ATOM 574 CA VAL A 345 49.493 0.142 16.323 1.00 0.00 C ATOM 575 C VAL A 345 48.402 1.166 16.584 1.00 0.00 C ATOM 576 O VAL A 345 47.221 0.823 16.630 1.00 0.00 O ATOM 577 CB VAL A 345 49.358 -0.390 14.899 1.00 0.00 C ATOM 578 CG1 VAL A 345 49.415 0.773 13.903 1.00 0.00 C ATOM 579 CG2 VAL A 345 50.502 -1.359 14.609 1.00 0.00 C ATOM 0 H VAL A 345 48.565 -1.548 17.154 1.00 0.00 H new ATOM 0 HA VAL A 345 50.465 0.620 16.446 1.00 0.00 H new ATOM 0 HB VAL A 345 48.403 -0.906 14.797 1.00 0.00 H new ATOM 0 HG11 VAL A 345 49.318 0.388 12.888 1.00 0.00 H new ATOM 0 HG12 VAL A 345 48.600 1.467 14.107 1.00 0.00 H new ATOM 0 HG13 VAL A 345 50.368 1.293 14.005 1.00 0.00 H new ATOM 0 HG21 VAL A 345 50.407 -1.740 13.592 1.00 0.00 H new ATOM 0 HG22 VAL A 345 51.454 -0.840 14.714 1.00 0.00 H new ATOM 0 HG23 VAL A 345 50.462 -2.190 15.313 1.00 0.00 H new ATOM 589 N ASP A 346 48.804 2.422 16.754 1.00 0.00 N ATOM 590 CA ASP A 346 47.843 3.490 17.008 1.00 0.00 C ATOM 591 C ASP A 346 48.093 4.685 16.082 1.00 0.00 C ATOM 592 O ASP A 346 49.232 4.962 15.709 1.00 0.00 O ATOM 593 CB ASP A 346 47.945 3.939 18.469 1.00 0.00 C ATOM 594 CG ASP A 346 47.520 2.802 19.391 1.00 0.00 C ATOM 595 OD1 ASP A 346 46.997 1.823 18.887 1.00 0.00 O ATOM 596 OD2 ASP A 346 47.719 2.932 20.587 1.00 0.00 O ATOM 0 H ASP A 346 49.778 2.723 16.721 1.00 0.00 H new ATOM 0 HA ASP A 346 46.842 3.106 16.810 1.00 0.00 H new ATOM 0 HB2 ASP A 346 48.968 4.240 18.696 1.00 0.00 H new ATOM 0 HB3 ASP A 346 47.312 4.810 18.636 1.00 0.00 H new ATOM 601 N PRO A 347 47.058 5.406 15.714 1.00 0.00 N ATOM 602 CA PRO A 347 47.186 6.602 14.827 1.00 0.00 C ATOM 603 C PRO A 347 47.936 7.745 15.507 1.00 0.00 C ATOM 604 O PRO A 347 48.428 8.659 14.844 1.00 0.00 O ATOM 605 CB PRO A 347 45.735 6.995 14.529 1.00 0.00 C ATOM 606 CG PRO A 347 44.938 6.435 15.656 1.00 0.00 C ATOM 607 CD PRO A 347 45.652 5.163 16.089 1.00 0.00 C ATOM 0 HA PRO A 347 47.762 6.384 13.928 1.00 0.00 H new ATOM 0 HB2 PRO A 347 45.625 8.078 14.469 1.00 0.00 H new ATOM 0 HB3 PRO A 347 45.405 6.588 13.573 1.00 0.00 H new ATOM 0 HG2 PRO A 347 44.875 7.146 16.480 1.00 0.00 H new ATOM 0 HG3 PRO A 347 43.917 6.221 15.342 1.00 0.00 H new ATOM 0 HD2 PRO A 347 45.547 4.990 17.160 1.00 0.00 H new ATOM 0 HD3 PRO A 347 45.249 4.286 15.584 1.00 0.00 H new ATOM 615 N ASN A 348 48.014 7.690 16.831 1.00 0.00 N ATOM 616 CA ASN A 348 48.700 8.729 17.589 1.00 0.00 C ATOM 617 C ASN A 348 50.211 8.532 17.533 1.00 0.00 C ATOM 618 O ASN A 348 50.970 9.313 18.108 1.00 0.00 O ATOM 619 CB ASN A 348 48.232 8.708 19.046 1.00 0.00 C ATOM 620 CG ASN A 348 48.702 7.428 19.730 1.00 0.00 C ATOM 621 OD1 ASN A 348 49.408 6.621 19.124 1.00 0.00 O ATOM 622 ND2 ASN A 348 48.354 7.192 20.966 1.00 0.00 N ATOM 0 H ASN A 348 47.614 6.943 17.399 1.00 0.00 H new ATOM 0 HA ASN A 348 48.458 9.694 17.143 1.00 0.00 H new ATOM 0 HB2 ASN A 348 48.624 9.577 19.574 1.00 0.00 H new ATOM 0 HB3 ASN A 348 47.145 8.774 19.088 1.00 0.00 H new ATOM 0 HD21 ASN A 348 48.667 6.339 21.430 1.00 0.00 H new ATOM 0 HD22 ASN A 348 47.769 7.860 21.468 1.00 0.00 H new ATOM 629 N ASN A 349 50.646 7.487 16.835 1.00 0.00 N ATOM 630 CA ASN A 349 52.065 7.203 16.709 1.00 0.00 C ATOM 631 C ASN A 349 52.719 8.194 15.757 1.00 0.00 C ATOM 632 O ASN A 349 52.182 8.501 14.692 1.00 0.00 O ATOM 633 CB ASN A 349 52.262 5.781 16.185 1.00 0.00 C ATOM 634 CG ASN A 349 52.364 4.801 17.351 1.00 0.00 C ATOM 635 OD1 ASN A 349 52.880 5.148 18.412 1.00 0.00 O ATOM 636 ND2 ASN A 349 51.902 3.588 17.212 1.00 0.00 N ATOM 0 H ASN A 349 50.036 6.828 16.351 1.00 0.00 H new ATOM 0 HA ASN A 349 52.530 7.296 17.690 1.00 0.00 H new ATOM 0 HB2 ASN A 349 51.428 5.504 15.539 1.00 0.00 H new ATOM 0 HB3 ASN A 349 53.166 5.731 15.578 1.00 0.00 H new ATOM 0 HD21 ASN A 349 51.968 2.925 17.985 1.00 0.00 H new ATOM 0 HD22 ASN A 349 51.475 3.303 16.331 1.00 0.00 H new ATOM 643 N GLU A 350 53.881 8.692 16.152 1.00 0.00 N ATOM 644 CA GLU A 350 54.612 9.650 15.334 1.00 0.00 C ATOM 645 C GLU A 350 55.059 9.004 14.028 1.00 0.00 C ATOM 646 O GLU A 350 55.057 9.646 12.977 1.00 0.00 O ATOM 647 CB GLU A 350 55.835 10.170 16.097 1.00 0.00 C ATOM 648 CG GLU A 350 55.384 11.029 17.287 1.00 0.00 C ATOM 649 CD GLU A 350 54.966 10.139 18.456 1.00 0.00 C ATOM 650 OE1 GLU A 350 55.131 8.934 18.351 1.00 0.00 O ATOM 651 OE2 GLU A 350 54.484 10.677 19.439 1.00 0.00 O ATOM 0 H GLU A 350 54.338 8.450 17.031 1.00 0.00 H new ATOM 0 HA GLU A 350 53.949 10.485 15.106 1.00 0.00 H new ATOM 0 HB2 GLU A 350 56.437 9.333 16.450 1.00 0.00 H new ATOM 0 HB3 GLU A 350 56.466 10.759 15.431 1.00 0.00 H new ATOM 0 HG2 GLU A 350 56.195 11.689 17.596 1.00 0.00 H new ATOM 0 HG3 GLU A 350 54.551 11.665 16.990 1.00 0.00 H new ATOM 658 N ALA A 351 55.456 7.737 14.103 1.00 0.00 N ATOM 659 CA ALA A 351 55.917 7.026 12.916 1.00 0.00 C ATOM 660 C ALA A 351 54.814 6.950 11.868 1.00 0.00 C ATOM 661 O ALA A 351 55.049 7.199 10.687 1.00 0.00 O ATOM 662 CB ALA A 351 56.352 5.611 13.299 1.00 0.00 C ATOM 0 H ALA A 351 55.468 7.187 14.962 1.00 0.00 H new ATOM 0 HA ALA A 351 56.762 7.571 12.495 1.00 0.00 H new ATOM 0 HB1 ALA A 351 56.696 5.083 12.410 1.00 0.00 H new ATOM 0 HB2 ALA A 351 57.163 5.664 14.026 1.00 0.00 H new ATOM 0 HB3 ALA A 351 55.508 5.076 13.735 1.00 0.00 H new ATOM 668 N ILE A 352 53.606 6.625 12.310 1.00 0.00 N ATOM 669 CA ILE A 352 52.471 6.542 11.400 1.00 0.00 C ATOM 670 C ILE A 352 52.172 7.901 10.785 1.00 0.00 C ATOM 671 O ILE A 352 51.926 8.008 9.584 1.00 0.00 O ATOM 672 CB ILE A 352 51.239 6.025 12.144 1.00 0.00 C ATOM 673 CG1 ILE A 352 51.301 4.497 12.243 1.00 0.00 C ATOM 674 CG2 ILE A 352 49.971 6.438 11.392 1.00 0.00 C ATOM 675 CD1 ILE A 352 52.554 4.063 13.006 1.00 0.00 C ATOM 0 H ILE A 352 53.388 6.416 13.284 1.00 0.00 H new ATOM 0 HA ILE A 352 52.724 5.848 10.599 1.00 0.00 H new ATOM 0 HB ILE A 352 51.219 6.452 13.147 1.00 0.00 H new ATOM 0 HG12 ILE A 352 50.411 4.123 12.749 1.00 0.00 H new ATOM 0 HG13 ILE A 352 51.307 4.061 11.244 1.00 0.00 H new ATOM 0 HG21 ILE A 352 49.095 6.068 11.925 1.00 0.00 H new ATOM 0 HG22 ILE A 352 49.924 7.525 11.327 1.00 0.00 H new ATOM 0 HG23 ILE A 352 49.990 6.015 10.387 1.00 0.00 H new ATOM 0 HD11 ILE A 352 52.584 2.975 13.068 1.00 0.00 H new ATOM 0 HD12 ILE A 352 53.441 4.421 12.483 1.00 0.00 H new ATOM 0 HD13 ILE A 352 52.531 4.483 14.012 1.00 0.00 H new ATOM 687 N ARG A 353 52.192 8.937 11.610 1.00 0.00 N ATOM 688 CA ARG A 353 51.911 10.280 11.124 1.00 0.00 C ATOM 689 C ARG A 353 52.919 10.682 10.052 1.00 0.00 C ATOM 690 O ARG A 353 52.547 11.195 8.995 1.00 0.00 O ATOM 691 CB ARG A 353 51.975 11.273 12.287 1.00 0.00 C ATOM 692 CG ARG A 353 51.669 12.684 11.780 1.00 0.00 C ATOM 693 CD ARG A 353 51.594 13.649 12.964 1.00 0.00 C ATOM 694 NE ARG A 353 52.887 13.723 13.635 1.00 0.00 N ATOM 695 CZ ARG A 353 53.042 14.430 14.749 1.00 0.00 C ATOM 696 NH1 ARG A 353 54.207 14.477 15.336 1.00 0.00 N ATOM 697 NH2 ARG A 353 52.030 15.079 15.256 1.00 0.00 N ATOM 0 H ARG A 353 52.397 8.876 12.607 1.00 0.00 H new ATOM 0 HA ARG A 353 50.912 10.292 10.688 1.00 0.00 H new ATOM 0 HB2 ARG A 353 51.259 10.990 13.059 1.00 0.00 H new ATOM 0 HB3 ARG A 353 52.964 11.248 12.745 1.00 0.00 H new ATOM 0 HG2 ARG A 353 52.443 13.007 11.083 1.00 0.00 H new ATOM 0 HG3 ARG A 353 50.726 12.689 11.234 1.00 0.00 H new ATOM 0 HD2 ARG A 353 51.299 14.639 12.617 1.00 0.00 H new ATOM 0 HD3 ARG A 353 50.830 13.316 13.666 1.00 0.00 H new ATOM 0 HE ARG A 353 53.685 13.224 13.243 1.00 0.00 H new ATOM 0 HH11 ARG A 353 54.999 13.971 14.939 1.00 0.00 H new ATOM 0 HH12 ARG A 353 54.326 15.020 16.191 1.00 0.00 H new ATOM 0 HH21 ARG A 353 51.120 15.044 14.797 1.00 0.00 H new ATOM 0 HH22 ARG A 353 52.149 15.622 16.111 1.00 0.00 H new ATOM 711 N ASN A 354 54.193 10.445 10.331 1.00 0.00 N ATOM 712 CA ASN A 354 55.247 10.784 9.383 1.00 0.00 C ATOM 713 C ASN A 354 55.115 9.950 8.113 1.00 0.00 C ATOM 714 O ASN A 354 55.346 10.444 7.009 1.00 0.00 O ATOM 715 CB ASN A 354 56.617 10.549 10.016 1.00 0.00 C ATOM 716 CG ASN A 354 56.882 11.603 11.086 1.00 0.00 C ATOM 717 OD1 ASN A 354 56.234 12.649 11.103 1.00 0.00 O ATOM 718 ND2 ASN A 354 57.805 11.389 11.983 1.00 0.00 N ATOM 0 H ASN A 354 54.521 10.022 11.199 1.00 0.00 H new ATOM 0 HA ASN A 354 55.148 11.837 9.121 1.00 0.00 H new ATOM 0 HB2 ASN A 354 56.658 9.553 10.457 1.00 0.00 H new ATOM 0 HB3 ASN A 354 57.393 10.591 9.251 1.00 0.00 H new ATOM 0 HD21 ASN A 354 57.991 12.090 12.701 1.00 0.00 H new ATOM 0 HD22 ASN A 354 58.341 10.521 11.967 1.00 0.00 H new ATOM 725 N ALA A 355 54.753 8.681 8.278 1.00 0.00 N ATOM 726 CA ALA A 355 54.605 7.785 7.138 1.00 0.00 C ATOM 727 C ALA A 355 53.535 8.303 6.182 1.00 0.00 C ATOM 728 O ALA A 355 53.718 8.288 4.966 1.00 0.00 O ATOM 729 CB ALA A 355 54.222 6.386 7.623 1.00 0.00 C ATOM 0 H ALA A 355 54.558 8.253 9.183 1.00 0.00 H new ATOM 0 HA ALA A 355 55.557 7.741 6.609 1.00 0.00 H new ATOM 0 HB1 ALA A 355 54.113 5.721 6.766 1.00 0.00 H new ATOM 0 HB2 ALA A 355 55.001 6.003 8.282 1.00 0.00 H new ATOM 0 HB3 ALA A 355 53.279 6.435 8.167 1.00 0.00 H new ATOM 735 N MET A 356 52.423 8.772 6.738 1.00 0.00 N ATOM 736 CA MET A 356 51.344 9.301 5.913 1.00 0.00 C ATOM 737 C MET A 356 51.799 10.550 5.168 1.00 0.00 C ATOM 738 O MET A 356 51.459 10.744 4.001 1.00 0.00 O ATOM 739 CB MET A 356 50.133 9.636 6.787 1.00 0.00 C ATOM 740 CG MET A 356 49.187 8.433 6.843 1.00 0.00 C ATOM 741 SD MET A 356 50.025 7.031 7.618 1.00 0.00 S ATOM 742 CE MET A 356 49.880 5.880 6.229 1.00 0.00 C ATOM 0 H MET A 356 52.246 8.797 7.742 1.00 0.00 H new ATOM 0 HA MET A 356 51.065 8.541 5.184 1.00 0.00 H new ATOM 0 HB2 MET A 356 50.460 9.900 7.793 1.00 0.00 H new ATOM 0 HB3 MET A 356 49.610 10.503 6.384 1.00 0.00 H new ATOM 0 HG2 MET A 356 48.290 8.690 7.407 1.00 0.00 H new ATOM 0 HG3 MET A 356 48.865 8.165 5.837 1.00 0.00 H new ATOM 0 HE1 MET A 356 49.898 4.856 6.602 1.00 0.00 H new ATOM 0 HE2 MET A 356 48.941 6.059 5.705 1.00 0.00 H new ATOM 0 HE3 MET A 356 50.713 6.031 5.543 1.00 0.00 H new ATOM 752 N GLY A 357 52.573 11.390 5.847 1.00 0.00 N ATOM 753 CA GLY A 357 53.070 12.613 5.231 1.00 0.00 C ATOM 754 C GLY A 357 53.983 12.300 4.050 1.00 0.00 C ATOM 755 O GLY A 357 53.882 12.922 2.993 1.00 0.00 O ATOM 0 H GLY A 357 52.867 11.248 6.813 1.00 0.00 H new ATOM 0 HA2 GLY A 357 52.231 13.222 4.895 1.00 0.00 H new ATOM 0 HA3 GLY A 357 53.614 13.201 5.970 1.00 0.00 H new ATOM 759 N SER A 358 54.871 11.330 4.239 1.00 0.00 N ATOM 760 CA SER A 358 55.797 10.943 3.182 1.00 0.00 C ATOM 761 C SER A 358 55.051 10.306 2.018 1.00 0.00 C ATOM 762 O SER A 358 55.381 10.534 0.855 1.00 0.00 O ATOM 763 CB SER A 358 56.828 9.953 3.728 1.00 0.00 C ATOM 764 OG SER A 358 56.161 8.778 4.169 1.00 0.00 O ATOM 0 H SER A 358 54.969 10.802 5.106 1.00 0.00 H new ATOM 0 HA SER A 358 56.303 11.840 2.826 1.00 0.00 H new ATOM 0 HB2 SER A 358 57.555 9.704 2.955 1.00 0.00 H new ATOM 0 HB3 SER A 358 57.380 10.403 4.553 1.00 0.00 H new ATOM 0 HG SER A 358 55.272 9.014 4.508 1.00 0.00 H new ATOM 770 N LEU A 359 54.047 9.501 2.337 1.00 0.00 N ATOM 771 CA LEU A 359 53.270 8.832 1.302 1.00 0.00 C ATOM 772 C LEU A 359 52.550 9.855 0.433 1.00 0.00 C ATOM 773 O LEU A 359 52.531 9.742 -0.792 1.00 0.00 O ATOM 774 CB LEU A 359 52.249 7.881 1.943 1.00 0.00 C ATOM 775 CG LEU A 359 51.446 7.151 0.855 1.00 0.00 C ATOM 776 CD1 LEU A 359 52.391 6.318 -0.015 1.00 0.00 C ATOM 777 CD2 LEU A 359 50.423 6.224 1.516 1.00 0.00 C ATOM 0 H LEU A 359 53.753 9.297 3.292 1.00 0.00 H new ATOM 0 HA LEU A 359 53.950 8.256 0.675 1.00 0.00 H new ATOM 0 HB2 LEU A 359 52.763 7.156 2.574 1.00 0.00 H new ATOM 0 HB3 LEU A 359 51.574 8.443 2.588 1.00 0.00 H new ATOM 0 HG LEU A 359 50.933 7.885 0.233 1.00 0.00 H new ATOM 0 HD11 LEU A 359 51.817 5.802 -0.785 1.00 0.00 H new ATOM 0 HD12 LEU A 359 53.124 6.973 -0.486 1.00 0.00 H new ATOM 0 HD13 LEU A 359 52.906 5.585 0.606 1.00 0.00 H new ATOM 0 HD21 LEU A 359 49.852 5.705 0.746 1.00 0.00 H new ATOM 0 HD22 LEU A 359 50.942 5.494 2.137 1.00 0.00 H new ATOM 0 HD23 LEU A 359 49.746 6.812 2.136 1.00 0.00 H new ATOM 789 N ALA A 360 51.951 10.851 1.075 1.00 0.00 N ATOM 790 CA ALA A 360 51.225 11.882 0.349 1.00 0.00 C ATOM 791 C ALA A 360 52.162 12.639 -0.585 1.00 0.00 C ATOM 792 O ALA A 360 51.797 12.963 -1.716 1.00 0.00 O ATOM 793 CB ALA A 360 50.582 12.859 1.335 1.00 0.00 C ATOM 0 H ALA A 360 51.954 10.965 2.089 1.00 0.00 H new ATOM 0 HA ALA A 360 50.447 11.403 -0.246 1.00 0.00 H new ATOM 0 HB1 ALA A 360 50.040 13.628 0.784 1.00 0.00 H new ATOM 0 HB2 ALA A 360 49.890 12.320 1.982 1.00 0.00 H new ATOM 0 HB3 ALA A 360 51.357 13.326 1.942 1.00 0.00 H new ATOM 1099 N LYS B 25 37.409 -5.477 -2.962 1.00 0.00 N ATOM 1100 CA LYS B 25 38.806 -5.103 -3.144 1.00 0.00 C ATOM 1101 C LYS B 25 39.351 -4.438 -1.886 1.00 0.00 C ATOM 1102 O LYS B 25 40.495 -4.671 -1.497 1.00 0.00 O ATOM 1103 CB LYS B 25 38.942 -4.148 -4.329 1.00 0.00 C ATOM 1104 CG LYS B 25 38.764 -4.922 -5.637 1.00 0.00 C ATOM 1105 CD LYS B 25 38.796 -3.943 -6.812 1.00 0.00 C ATOM 1106 CE LYS B 25 37.367 -3.582 -7.219 1.00 0.00 C ATOM 1107 NZ LYS B 25 36.818 -4.653 -8.101 1.00 0.00 N ATOM 0 HA LYS B 25 39.381 -6.008 -3.341 1.00 0.00 H new ATOM 0 HB2 LYS B 25 38.195 -3.357 -4.259 1.00 0.00 H new ATOM 0 HB3 LYS B 25 39.920 -3.666 -4.310 1.00 0.00 H new ATOM 0 HG2 LYS B 25 39.556 -5.663 -5.745 1.00 0.00 H new ATOM 0 HG3 LYS B 25 37.819 -5.464 -5.626 1.00 0.00 H new ATOM 0 HD2 LYS B 25 39.344 -3.043 -6.533 1.00 0.00 H new ATOM 0 HD3 LYS B 25 39.323 -4.389 -7.655 1.00 0.00 H new ATOM 0 HE2 LYS B 25 36.742 -3.469 -6.333 1.00 0.00 H new ATOM 0 HE3 LYS B 25 37.356 -2.625 -7.741 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 35.846 -4.409 -8.379 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 37.410 -4.740 -8.952 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 36.815 -5.558 -7.588 1.00 0.00 H new ATOM 1121 N ARG B 26 38.531 -3.607 -1.253 1.00 0.00 N ATOM 1122 CA ARG B 26 38.956 -2.917 -0.044 1.00 0.00 C ATOM 1123 C ARG B 26 39.291 -3.925 1.051 1.00 0.00 C ATOM 1124 O ARG B 26 40.297 -3.789 1.747 1.00 0.00 O ATOM 1125 CB ARG B 26 37.835 -1.995 0.439 1.00 0.00 C ATOM 1126 CG ARG B 26 37.691 -0.816 -0.524 1.00 0.00 C ATOM 1127 CD ARG B 26 36.451 -0.002 -0.152 1.00 0.00 C ATOM 1128 NE ARG B 26 36.367 1.195 -0.982 1.00 0.00 N ATOM 1129 CZ ARG B 26 35.298 1.985 -0.948 1.00 0.00 C ATOM 1130 NH1 ARG B 26 34.299 1.698 -0.160 1.00 0.00 N ATOM 1131 NH2 ARG B 26 35.248 3.051 -1.702 1.00 0.00 N ATOM 0 H ARG B 26 37.579 -3.397 -1.553 1.00 0.00 H new ATOM 0 HA ARG B 26 39.846 -2.329 -0.268 1.00 0.00 H new ATOM 0 HB2 ARG B 26 36.897 -2.546 0.498 1.00 0.00 H new ATOM 0 HB3 ARG B 26 38.055 -1.633 1.443 1.00 0.00 H new ATOM 0 HG2 ARG B 26 38.579 -0.186 -0.480 1.00 0.00 H new ATOM 0 HG3 ARG B 26 37.608 -1.178 -1.549 1.00 0.00 H new ATOM 0 HD2 ARG B 26 35.555 -0.609 -0.284 1.00 0.00 H new ATOM 0 HD3 ARG B 26 36.493 0.278 0.900 1.00 0.00 H new ATOM 0 HE ARG B 26 37.143 1.430 -1.600 1.00 0.00 H new ATOM 0 HH11 ARG B 26 34.338 0.867 0.431 1.00 0.00 H new ATOM 0 HH12 ARG B 26 33.479 2.304 -0.134 1.00 0.00 H new ATOM 0 HH21 ARG B 26 36.029 3.278 -2.317 1.00 0.00 H new ATOM 0 HH22 ARG B 26 34.428 3.656 -1.675 1.00 0.00 H new ATOM 1145 N ALA B 27 38.450 -4.943 1.186 1.00 0.00 N ATOM 1146 CA ALA B 27 38.676 -5.978 2.190 1.00 0.00 C ATOM 1147 C ALA B 27 39.962 -6.742 1.892 1.00 0.00 C ATOM 1148 O ALA B 27 40.735 -7.059 2.797 1.00 0.00 O ATOM 1149 CB ALA B 27 37.496 -6.952 2.219 1.00 0.00 C ATOM 0 H ALA B 27 37.612 -5.075 0.619 1.00 0.00 H new ATOM 0 HA ALA B 27 38.769 -5.496 3.163 1.00 0.00 H new ATOM 0 HB1 ALA B 27 37.676 -7.719 2.972 1.00 0.00 H new ATOM 0 HB2 ALA B 27 36.583 -6.410 2.465 1.00 0.00 H new ATOM 0 HB3 ALA B 27 37.387 -7.421 1.241 1.00 0.00 H new ATOM 1155 N ALA B 28 40.184 -7.036 0.615 1.00 0.00 N ATOM 1156 CA ALA B 28 41.377 -7.764 0.202 1.00 0.00 C ATOM 1157 C ALA B 28 42.635 -6.974 0.542 1.00 0.00 C ATOM 1158 O ALA B 28 43.635 -7.543 0.978 1.00 0.00 O ATOM 1159 CB ALA B 28 41.337 -8.032 -1.304 1.00 0.00 C ATOM 0 H ALA B 28 39.556 -6.782 -0.148 1.00 0.00 H new ATOM 0 HA ALA B 28 41.399 -8.712 0.739 1.00 0.00 H new ATOM 0 HB1 ALA B 28 42.234 -8.576 -1.601 1.00 0.00 H new ATOM 0 HB2 ALA B 28 40.455 -8.626 -1.545 1.00 0.00 H new ATOM 0 HB3 ALA B 28 41.294 -7.085 -1.841 1.00 0.00 H new ATOM 1165 N ALA B 29 42.578 -5.661 0.335 1.00 0.00 N ATOM 1166 CA ALA B 29 43.724 -4.808 0.621 1.00 0.00 C ATOM 1167 C ALA B 29 44.097 -4.899 2.097 1.00 0.00 C ATOM 1168 O ALA B 29 45.271 -5.025 2.444 1.00 0.00 O ATOM 1169 CB ALA B 29 43.394 -3.352 0.259 1.00 0.00 C ATOM 0 H ALA B 29 41.760 -5.170 -0.026 1.00 0.00 H new ATOM 0 HA ALA B 29 44.570 -5.146 0.022 1.00 0.00 H new ATOM 0 HB1 ALA B 29 44.255 -2.719 0.475 1.00 0.00 H new ATOM 0 HB2 ALA B 29 43.153 -3.287 -0.802 1.00 0.00 H new ATOM 0 HB3 ALA B 29 42.540 -3.016 0.847 1.00 0.00 H new ATOM 1175 N LYS B 30 43.090 -4.848 2.963 1.00 0.00 N ATOM 1176 CA LYS B 30 43.328 -4.938 4.398 1.00 0.00 C ATOM 1177 C LYS B 30 43.915 -6.295 4.766 1.00 0.00 C ATOM 1178 O LYS B 30 44.841 -6.386 5.571 1.00 0.00 O ATOM 1179 CB LYS B 30 42.023 -4.705 5.162 1.00 0.00 C ATOM 1180 CG LYS B 30 42.287 -4.787 6.669 1.00 0.00 C ATOM 1181 CD LYS B 30 41.019 -4.395 7.430 1.00 0.00 C ATOM 1182 CE LYS B 30 41.245 -4.577 8.933 1.00 0.00 C ATOM 1183 NZ LYS B 30 39.980 -5.028 9.579 1.00 0.00 N ATOM 0 H LYS B 30 42.110 -4.746 2.699 1.00 0.00 H new ATOM 0 HA LYS B 30 44.047 -4.167 4.676 1.00 0.00 H new ATOM 0 HB2 LYS B 30 41.610 -3.729 4.908 1.00 0.00 H new ATOM 0 HB3 LYS B 30 41.282 -5.450 4.871 1.00 0.00 H new ATOM 0 HG2 LYS B 30 42.590 -5.798 6.942 1.00 0.00 H new ATOM 0 HG3 LYS B 30 43.108 -4.124 6.942 1.00 0.00 H new ATOM 0 HD2 LYS B 30 40.759 -3.359 7.214 1.00 0.00 H new ATOM 0 HD3 LYS B 30 40.181 -5.009 7.101 1.00 0.00 H new ATOM 0 HE2 LYS B 30 42.034 -5.309 9.106 1.00 0.00 H new ATOM 0 HE3 LYS B 30 41.577 -3.639 9.377 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 40.136 -5.151 10.600 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 39.238 -4.315 9.426 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 39.681 -5.933 9.163 1.00 0.00 H new ATOM 1197 N HIS B 31 43.361 -7.347 4.178 1.00 0.00 N ATOM 1198 CA HIS B 31 43.826 -8.698 4.457 1.00 0.00 C ATOM 1199 C HIS B 31 45.295 -8.859 4.069 1.00 0.00 C ATOM 1200 O HIS B 31 46.087 -9.421 4.820 1.00 0.00 O ATOM 1201 CB HIS B 31 42.976 -9.711 3.687 1.00 0.00 C ATOM 1202 CG HIS B 31 43.415 -11.106 4.039 1.00 0.00 C ATOM 1203 ND1 HIS B 31 43.146 -11.670 5.277 1.00 0.00 N ATOM 1204 CD2 HIS B 31 44.099 -12.063 3.332 1.00 0.00 C ATOM 1205 CE1 HIS B 31 43.659 -12.913 5.277 1.00 0.00 C ATOM 1206 NE2 HIS B 31 44.253 -13.204 4.116 1.00 0.00 N ATOM 0 H HIS B 31 42.593 -7.291 3.509 1.00 0.00 H new ATOM 0 HA HIS B 31 43.728 -8.879 5.527 1.00 0.00 H new ATOM 0 HB2 HIS B 31 41.922 -9.578 3.931 1.00 0.00 H new ATOM 0 HB3 HIS B 31 43.078 -9.546 2.614 1.00 0.00 H new ATOM 0 HD1 HIS B 31 42.649 -11.223 6.048 1.00 0.00 H new ATOM 0 HD2 HIS B 31 44.463 -11.949 2.321 1.00 0.00 H new ATOM 0 HE1 HIS B 31 43.598 -13.593 6.114 1.00 0.00 H new ATOM 1215 N LEU B 32 45.650 -8.365 2.888 1.00 0.00 N ATOM 1216 CA LEU B 32 47.025 -8.468 2.409 1.00 0.00 C ATOM 1217 C LEU B 32 47.975 -7.723 3.335 1.00 0.00 C ATOM 1218 O LEU B 32 49.054 -8.216 3.658 1.00 0.00 O ATOM 1219 CB LEU B 32 47.121 -7.883 0.997 1.00 0.00 C ATOM 1220 CG LEU B 32 46.393 -8.801 0.006 1.00 0.00 C ATOM 1221 CD1 LEU B 32 46.300 -8.113 -1.358 1.00 0.00 C ATOM 1222 CD2 LEU B 32 47.145 -10.133 -0.145 1.00 0.00 C ATOM 0 H LEU B 32 45.011 -7.893 2.248 1.00 0.00 H new ATOM 0 HA LEU B 32 47.310 -9.520 2.393 1.00 0.00 H new ATOM 0 HB2 LEU B 32 46.680 -6.886 0.975 1.00 0.00 H new ATOM 0 HB3 LEU B 32 48.166 -7.776 0.708 1.00 0.00 H new ATOM 0 HG LEU B 32 45.392 -9.002 0.387 1.00 0.00 H new ATOM 0 HD11 LEU B 32 45.783 -8.766 -2.061 1.00 0.00 H new ATOM 0 HD12 LEU B 32 45.748 -7.179 -1.257 1.00 0.00 H new ATOM 0 HD13 LEU B 32 47.303 -7.903 -1.729 1.00 0.00 H new ATOM 0 HD21 LEU B 32 46.615 -10.772 -0.851 1.00 0.00 H new ATOM 0 HD22 LEU B 32 48.153 -9.942 -0.514 1.00 0.00 H new ATOM 0 HD23 LEU B 32 47.201 -10.631 0.823 1.00 0.00 H new ATOM 1234 N ILE B 33 47.561 -6.542 3.774 1.00 0.00 N ATOM 1235 CA ILE B 33 48.383 -5.749 4.675 1.00 0.00 C ATOM 1236 C ILE B 33 48.622 -6.508 5.973 1.00 0.00 C ATOM 1237 O ILE B 33 49.736 -6.527 6.497 1.00 0.00 O ATOM 1238 CB ILE B 33 47.702 -4.412 4.966 1.00 0.00 C ATOM 1239 CG1 ILE B 33 47.724 -3.544 3.704 1.00 0.00 C ATOM 1240 CG2 ILE B 33 48.447 -3.692 6.090 1.00 0.00 C ATOM 1241 CD1 ILE B 33 46.787 -2.348 3.889 1.00 0.00 C ATOM 0 H ILE B 33 46.669 -6.116 3.523 1.00 0.00 H new ATOM 0 HA ILE B 33 49.344 -5.559 4.198 1.00 0.00 H new ATOM 0 HB ILE B 33 46.670 -4.589 5.270 1.00 0.00 H new ATOM 0 HG12 ILE B 33 48.738 -3.197 3.506 1.00 0.00 H new ATOM 0 HG13 ILE B 33 47.414 -4.132 2.840 1.00 0.00 H new ATOM 0 HG21 ILE B 33 47.961 -2.739 6.297 1.00 0.00 H new ATOM 0 HG22 ILE B 33 48.434 -4.309 6.989 1.00 0.00 H new ATOM 0 HG23 ILE B 33 49.479 -3.515 5.787 1.00 0.00 H new ATOM 0 HD11 ILE B 33 46.803 -1.731 2.991 1.00 0.00 H new ATOM 0 HD12 ILE B 33 45.772 -2.705 4.066 1.00 0.00 H new ATOM 0 HD13 ILE B 33 47.117 -1.756 4.742 1.00 0.00 H new ATOM 1253 N GLU B 34 47.570 -7.136 6.482 1.00 0.00 N ATOM 1254 CA GLU B 34 47.677 -7.902 7.714 1.00 0.00 C ATOM 1255 C GLU B 34 48.655 -9.055 7.540 1.00 0.00 C ATOM 1256 O GLU B 34 49.435 -9.356 8.444 1.00 0.00 O ATOM 1257 CB GLU B 34 46.309 -8.452 8.114 1.00 0.00 C ATOM 1258 CG GLU B 34 45.419 -7.304 8.590 1.00 0.00 C ATOM 1259 CD GLU B 34 43.992 -7.801 8.782 1.00 0.00 C ATOM 1260 OE1 GLU B 34 43.668 -8.839 8.232 1.00 0.00 O ATOM 1261 OE2 GLU B 34 43.245 -7.138 9.482 1.00 0.00 O ATOM 0 H GLU B 34 46.640 -7.130 6.064 1.00 0.00 H new ATOM 0 HA GLU B 34 48.043 -7.239 8.498 1.00 0.00 H new ATOM 0 HB2 GLU B 34 45.846 -8.958 7.267 1.00 0.00 H new ATOM 0 HB3 GLU B 34 46.420 -9.193 8.906 1.00 0.00 H new ATOM 0 HG2 GLU B 34 45.802 -6.900 9.527 1.00 0.00 H new ATOM 0 HG3 GLU B 34 45.436 -6.493 7.862 1.00 0.00 H new ATOM 1268 N ARG B 35 48.611 -9.700 6.376 1.00 0.00 N ATOM 1269 CA ARG B 35 49.508 -10.819 6.115 1.00 0.00 C ATOM 1270 C ARG B 35 50.964 -10.368 6.152 1.00 0.00 C ATOM 1271 O ARG B 35 51.817 -11.046 6.721 1.00 0.00 O ATOM 1272 CB ARG B 35 49.207 -11.426 4.744 1.00 0.00 C ATOM 1273 CG ARG B 35 47.869 -12.166 4.790 1.00 0.00 C ATOM 1274 CD ARG B 35 47.517 -12.662 3.387 1.00 0.00 C ATOM 1275 NE ARG B 35 48.515 -13.619 2.926 1.00 0.00 N ATOM 1276 CZ ARG B 35 48.539 -14.034 1.665 1.00 0.00 C ATOM 1277 NH1 ARG B 35 47.660 -13.584 0.812 1.00 0.00 N ATOM 1278 NH2 ARG B 35 49.442 -14.893 1.278 1.00 0.00 N ATOM 0 H ARG B 35 47.975 -9.471 5.612 1.00 0.00 H new ATOM 0 HA ARG B 35 49.348 -11.566 6.892 1.00 0.00 H new ATOM 0 HB2 ARG B 35 49.174 -10.642 3.988 1.00 0.00 H new ATOM 0 HB3 ARG B 35 50.003 -12.112 4.457 1.00 0.00 H new ATOM 0 HG2 ARG B 35 47.929 -13.007 5.481 1.00 0.00 H new ATOM 0 HG3 ARG B 35 47.087 -11.504 5.161 1.00 0.00 H new ATOM 0 HD2 ARG B 35 46.532 -13.128 3.395 1.00 0.00 H new ATOM 0 HD3 ARG B 35 47.465 -11.819 2.698 1.00 0.00 H new ATOM 0 HE ARG B 35 49.208 -13.976 3.584 1.00 0.00 H new ATOM 0 HH11 ARG B 35 46.954 -12.913 1.114 1.00 0.00 H new ATOM 0 HH12 ARG B 35 47.679 -13.903 -0.157 1.00 0.00 H new ATOM 0 HH21 ARG B 35 50.129 -15.246 1.944 1.00 0.00 H new ATOM 0 HH22 ARG B 35 49.461 -15.212 0.309 1.00 0.00 H new ATOM 1292 N TYR B 36 51.243 -9.217 5.552 1.00 0.00 N ATOM 1293 CA TYR B 36 52.605 -8.697 5.534 1.00 0.00 C ATOM 1294 C TYR B 36 53.060 -8.320 6.939 1.00 0.00 C ATOM 1295 O TYR B 36 54.196 -8.586 7.326 1.00 0.00 O ATOM 1296 CB TYR B 36 52.680 -7.468 4.626 1.00 0.00 C ATOM 1297 CG TYR B 36 52.503 -7.890 3.186 1.00 0.00 C ATOM 1298 CD1 TYR B 36 51.405 -7.427 2.450 1.00 0.00 C ATOM 1299 CD2 TYR B 36 53.433 -8.747 2.588 1.00 0.00 C ATOM 1300 CE1 TYR B 36 51.238 -7.822 1.117 1.00 0.00 C ATOM 1301 CE2 TYR B 36 53.267 -9.142 1.255 1.00 0.00 C ATOM 1302 CZ TYR B 36 52.169 -8.679 0.520 1.00 0.00 C ATOM 1303 OH TYR B 36 52.004 -9.068 -0.795 1.00 0.00 O ATOM 0 H TYR B 36 50.555 -8.633 5.077 1.00 0.00 H new ATOM 0 HA TYR B 36 53.264 -9.477 5.151 1.00 0.00 H new ATOM 0 HB2 TYR B 36 51.907 -6.751 4.903 1.00 0.00 H new ATOM 0 HB3 TYR B 36 53.640 -6.967 4.753 1.00 0.00 H new ATOM 0 HD1 TYR B 36 50.687 -6.765 2.911 1.00 0.00 H new ATOM 0 HD2 TYR B 36 54.280 -9.104 3.155 1.00 0.00 H new ATOM 0 HE1 TYR B 36 50.391 -7.465 0.550 1.00 0.00 H new ATOM 0 HE2 TYR B 36 53.986 -9.803 0.794 1.00 0.00 H new ATOM 0 HH TYR B 36 52.882 -9.199 -1.210 1.00 0.00 H new ATOM 1313 N TYR B 37 52.166 -7.704 7.701 1.00 0.00 N ATOM 1314 CA TYR B 37 52.488 -7.293 9.061 1.00 0.00 C ATOM 1315 C TYR B 37 52.850 -8.496 9.920 1.00 0.00 C ATOM 1316 O TYR B 37 53.878 -8.502 10.599 1.00 0.00 O ATOM 1317 CB TYR B 37 51.294 -6.564 9.680 1.00 0.00 C ATOM 1318 CG TYR B 37 51.584 -6.258 11.129 1.00 0.00 C ATOM 1319 CD1 TYR B 37 52.441 -5.203 11.464 1.00 0.00 C ATOM 1320 CD2 TYR B 37 50.997 -7.031 12.139 1.00 0.00 C ATOM 1321 CE1 TYR B 37 52.710 -4.920 12.808 1.00 0.00 C ATOM 1322 CE2 TYR B 37 51.267 -6.749 13.483 1.00 0.00 C ATOM 1323 CZ TYR B 37 52.123 -5.693 13.818 1.00 0.00 C ATOM 1324 OH TYR B 37 52.390 -5.415 15.144 1.00 0.00 O ATOM 0 H TYR B 37 51.217 -7.479 7.403 1.00 0.00 H new ATOM 0 HA TYR B 37 53.347 -6.623 9.021 1.00 0.00 H new ATOM 0 HB2 TYR B 37 51.096 -5.641 9.135 1.00 0.00 H new ATOM 0 HB3 TYR B 37 50.398 -7.179 9.600 1.00 0.00 H new ATOM 0 HD1 TYR B 37 52.895 -4.608 10.685 1.00 0.00 H new ATOM 0 HD2 TYR B 37 50.336 -7.845 11.880 1.00 0.00 H new ATOM 0 HE1 TYR B 37 53.370 -4.105 13.066 1.00 0.00 H new ATOM 0 HE2 TYR B 37 50.815 -7.346 14.261 1.00 0.00 H new ATOM 0 HH TYR B 37 53.269 -5.776 15.383 1.00 0.00 H new ATOM 1334 N HIS B 38 51.999 -9.513 9.884 1.00 0.00 N ATOM 1335 CA HIS B 38 52.241 -10.719 10.661 1.00 0.00 C ATOM 1336 C HIS B 38 53.413 -11.523 10.116 1.00 0.00 C ATOM 1337 O HIS B 38 54.182 -12.103 10.875 1.00 0.00 O ATOM 1338 CB HIS B 38 51.009 -11.622 10.630 1.00 0.00 C ATOM 1339 CG HIS B 38 49.958 -11.065 11.548 1.00 0.00 C ATOM 1340 ND1 HIS B 38 49.124 -10.024 11.173 1.00 0.00 N ATOM 1341 CD2 HIS B 38 49.592 -11.394 12.831 1.00 0.00 C ATOM 1342 CE1 HIS B 38 48.306 -9.765 12.208 1.00 0.00 C ATOM 1343 NE2 HIS B 38 48.549 -10.571 13.244 1.00 0.00 N ATOM 0 H HIS B 38 51.143 -9.527 9.330 1.00 0.00 H new ATOM 0 HA HIS B 38 52.467 -10.396 11.677 1.00 0.00 H new ATOM 0 HB2 HIS B 38 50.620 -11.691 9.614 1.00 0.00 H new ATOM 0 HB3 HIS B 38 51.278 -12.633 10.938 1.00 0.00 H new ATOM 0 HD1 HIS B 38 49.130 -9.542 10.274 1.00 0.00 H new ATOM 0 HD2 HIS B 38 50.045 -12.172 13.427 1.00 0.00 H new ATOM 0 HE1 HIS B 38 47.545 -8.998 12.202 1.00 0.00 H new ATOM 1352 N GLN B 39 53.567 -11.520 8.795 1.00 0.00 N ATOM 1353 CA GLN B 39 54.678 -12.226 8.170 1.00 0.00 C ATOM 1354 C GLN B 39 56.023 -11.617 8.544 1.00 0.00 C ATOM 1355 O GLN B 39 56.989 -12.335 8.798 1.00 0.00 O ATOM 1356 CB GLN B 39 54.547 -12.157 6.646 1.00 0.00 C ATOM 1357 CG GLN B 39 55.674 -12.959 5.991 1.00 0.00 C ATOM 1358 CD GLN B 39 55.604 -12.803 4.477 1.00 0.00 C ATOM 1359 OE1 GLN B 39 54.541 -12.984 3.882 1.00 0.00 O ATOM 1360 NE2 GLN B 39 56.679 -12.475 3.814 1.00 0.00 N ATOM 0 H GLN B 39 52.944 -11.042 8.144 1.00 0.00 H new ATOM 0 HA GLN B 39 54.639 -13.256 8.525 1.00 0.00 H new ATOM 0 HB2 GLN B 39 53.580 -12.553 6.337 1.00 0.00 H new ATOM 0 HB3 GLN B 39 54.587 -11.119 6.315 1.00 0.00 H new ATOM 0 HG2 GLN B 39 56.640 -12.612 6.357 1.00 0.00 H new ATOM 0 HG3 GLN B 39 55.589 -14.011 6.262 1.00 0.00 H new ATOM 0 HE21 GLN B 39 57.558 -12.326 4.309 1.00 0.00 H new ATOM 0 HE22 GLN B 39 56.640 -12.368 2.800 1.00 0.00 H new ATOM 1369 N LEU B 40 56.074 -10.291 8.612 1.00 0.00 N ATOM 1370 CA LEU B 40 57.306 -9.617 9.006 1.00 0.00 C ATOM 1371 C LEU B 40 57.614 -9.845 10.482 1.00 0.00 C ATOM 1372 O LEU B 40 58.766 -10.058 10.861 1.00 0.00 O ATOM 1373 CB LEU B 40 57.179 -8.120 8.736 1.00 0.00 C ATOM 1374 CG LEU B 40 57.181 -7.872 7.223 1.00 0.00 C ATOM 1375 CD1 LEU B 40 56.985 -6.381 6.954 1.00 0.00 C ATOM 1376 CD2 LEU B 40 58.508 -8.331 6.600 1.00 0.00 C ATOM 0 H LEU B 40 55.292 -9.671 8.404 1.00 0.00 H new ATOM 0 HA LEU B 40 58.124 -10.033 8.419 1.00 0.00 H new ATOM 0 HB2 LEU B 40 56.259 -7.737 9.177 1.00 0.00 H new ATOM 0 HB3 LEU B 40 58.004 -7.584 9.204 1.00 0.00 H new ATOM 0 HG LEU B 40 56.368 -8.443 6.774 1.00 0.00 H new ATOM 0 HD11 LEU B 40 56.986 -6.202 5.879 1.00 0.00 H new ATOM 0 HD12 LEU B 40 56.033 -6.057 7.375 1.00 0.00 H new ATOM 0 HD13 LEU B 40 57.796 -5.818 7.416 1.00 0.00 H new ATOM 0 HD21 LEU B 40 58.489 -8.146 5.526 1.00 0.00 H new ATOM 0 HD22 LEU B 40 59.332 -7.776 7.049 1.00 0.00 H new ATOM 0 HD23 LEU B 40 58.646 -9.397 6.782 1.00 0.00 H new ATOM 1388 N THR B 41 56.578 -9.789 11.310 1.00 0.00 N ATOM 1389 CA THR B 41 56.749 -9.984 12.746 1.00 0.00 C ATOM 1390 C THR B 41 56.964 -11.456 13.084 1.00 0.00 C ATOM 1391 O THR B 41 57.629 -11.786 14.066 1.00 0.00 O ATOM 1392 CB THR B 41 55.519 -9.460 13.488 1.00 0.00 C ATOM 1393 OG1 THR B 41 54.369 -10.167 13.048 1.00 0.00 O ATOM 1394 CG2 THR B 41 55.344 -7.965 13.202 1.00 0.00 C ATOM 0 H THR B 41 55.618 -9.612 11.016 1.00 0.00 H new ATOM 0 HA THR B 41 57.634 -9.430 13.060 1.00 0.00 H new ATOM 0 HB THR B 41 55.650 -9.608 14.560 1.00 0.00 H new ATOM 0 HG1 THR B 41 54.599 -10.712 12.267 1.00 0.00 H new ATOM 0 HG21 THR B 41 54.467 -7.593 13.732 1.00 0.00 H new ATOM 0 HG22 THR B 41 56.228 -7.424 13.540 1.00 0.00 H new ATOM 0 HG23 THR B 41 55.213 -7.812 12.131 1.00 0.00 H new ATOM 1402 N GLU B 42 56.389 -12.340 12.272 1.00 0.00 N ATOM 1403 CA GLU B 42 56.416 -13.771 12.586 1.00 0.00 C ATOM 1404 C GLU B 42 57.558 -14.368 11.773 1.00 0.00 C ATOM 1405 O GLU B 42 58.492 -14.947 12.327 1.00 0.00 O ATOM 1406 CB GLU B 42 55.108 -14.470 12.207 1.00 0.00 C ATOM 1407 CG GLU B 42 53.982 -13.977 13.121 1.00 0.00 C ATOM 1408 CD GLU B 42 52.662 -14.629 12.720 1.00 0.00 C ATOM 1409 OE1 GLU B 42 52.659 -15.357 11.741 1.00 0.00 O ATOM 1410 OE2 GLU B 42 51.677 -14.389 13.396 1.00 0.00 O ATOM 0 H GLU B 42 55.906 -12.100 11.406 1.00 0.00 H new ATOM 0 HA GLU B 42 56.549 -13.909 13.659 1.00 0.00 H new ATOM 0 HB2 GLU B 42 54.862 -14.264 11.165 1.00 0.00 H new ATOM 0 HB3 GLU B 42 55.220 -15.550 12.300 1.00 0.00 H new ATOM 0 HG2 GLU B 42 54.214 -14.215 14.159 1.00 0.00 H new ATOM 0 HG3 GLU B 42 53.897 -12.892 13.054 1.00 0.00 H new ATOM 1417 N GLY B 43 57.480 -14.225 10.454 1.00 0.00 N ATOM 1418 CA GLY B 43 58.629 -14.579 9.605 1.00 0.00 C ATOM 1419 C GLY B 43 58.272 -15.972 9.100 1.00 0.00 C ATOM 1420 O GLY B 43 57.113 -16.384 9.158 1.00 0.00 O ATOM 0 H GLY B 43 56.662 -13.877 9.954 1.00 0.00 H new ATOM 0 HA2 GLY B 43 58.756 -13.873 8.784 1.00 0.00 H new ATOM 0 HA3 GLY B 43 59.561 -14.582 10.170 1.00 0.00 H new ATOM 1424 N CYS B 44 59.274 -16.694 8.608 1.00 0.00 N ATOM 1425 CA CYS B 44 59.045 -18.043 8.100 1.00 0.00 C ATOM 1426 C CYS B 44 59.437 -19.087 9.139 1.00 0.00 C ATOM 1427 O CYS B 44 59.092 -20.262 9.014 1.00 0.00 O ATOM 1428 CB CYS B 44 59.853 -18.264 6.819 1.00 0.00 C ATOM 1429 SG CYS B 44 61.529 -17.603 7.021 1.00 0.00 S ATOM 0 H CYS B 44 60.241 -16.373 8.550 1.00 0.00 H new ATOM 0 HA CYS B 44 57.982 -18.150 7.883 1.00 0.00 H new ATOM 0 HB2 CYS B 44 59.898 -19.328 6.587 1.00 0.00 H new ATOM 0 HB3 CYS B 44 59.359 -17.775 5.979 1.00 0.00 H new ATOM 0 HG CYS B 44 61.887 -16.988 5.933 1.00 0.00 H new ATOM 1434 N GLY B 45 60.147 -18.648 10.170 1.00 0.00 N ATOM 1435 CA GLY B 45 60.567 -19.551 11.234 1.00 0.00 C ATOM 1436 C GLY B 45 61.914 -20.187 10.907 1.00 0.00 C ATOM 1437 O GLY B 45 62.594 -20.712 11.788 1.00 0.00 O ATOM 0 H GLY B 45 60.443 -17.679 10.292 1.00 0.00 H new ATOM 0 HA2 GLY B 45 60.637 -19.004 12.174 1.00 0.00 H new ATOM 0 HA3 GLY B 45 59.817 -20.329 11.373 1.00 0.00 H new ATOM 1441 N ASN B 46 62.290 -20.137 9.632 1.00 0.00 N ATOM 1442 CA ASN B 46 63.551 -20.713 9.191 1.00 0.00 C ATOM 1443 C ASN B 46 64.721 -19.851 9.648 1.00 0.00 C ATOM 1444 O ASN B 46 64.622 -18.625 9.694 1.00 0.00 O ATOM 1445 CB ASN B 46 63.568 -20.831 7.666 1.00 0.00 C ATOM 1446 CG ASN B 46 62.584 -21.904 7.211 1.00 0.00 C ATOM 1447 OD1 ASN B 46 62.210 -22.778 7.995 1.00 0.00 O ATOM 1448 ND2 ASN B 46 62.139 -21.891 5.984 1.00 0.00 N ATOM 0 H ASN B 46 61.740 -19.704 8.890 1.00 0.00 H new ATOM 0 HA ASN B 46 63.649 -21.705 9.633 1.00 0.00 H new ATOM 0 HB2 ASN B 46 63.306 -19.873 7.217 1.00 0.00 H new ATOM 0 HB3 ASN B 46 64.573 -21.080 7.324 1.00 0.00 H new ATOM 0 HD21 ASN B 46 61.481 -22.605 5.673 1.00 0.00 H new ATOM 0 HD22 ASN B 46 62.450 -21.167 5.336 1.00 0.00 H new ATOM 1455 N GLU B 47 65.825 -20.503 9.984 1.00 0.00 N ATOM 1456 CA GLU B 47 67.013 -19.787 10.435 1.00 0.00 C ATOM 1457 C GLU B 47 67.545 -18.884 9.326 1.00 0.00 C ATOM 1458 O GLU B 47 67.981 -17.762 9.585 1.00 0.00 O ATOM 1459 CB GLU B 47 68.098 -20.780 10.858 1.00 0.00 C ATOM 1460 CG GLU B 47 67.668 -21.484 12.147 1.00 0.00 C ATOM 1461 CD GLU B 47 68.696 -22.543 12.531 1.00 0.00 C ATOM 1462 OE1 GLU B 47 69.589 -22.790 11.738 1.00 0.00 O ATOM 1463 OE2 GLU B 47 68.575 -23.092 13.615 1.00 0.00 O ATOM 0 H GLU B 47 65.924 -21.518 9.954 1.00 0.00 H new ATOM 0 HA GLU B 47 66.739 -19.170 11.291 1.00 0.00 H new ATOM 0 HB2 GLU B 47 68.264 -21.513 10.068 1.00 0.00 H new ATOM 0 HB3 GLU B 47 69.043 -20.259 11.013 1.00 0.00 H new ATOM 0 HG2 GLU B 47 67.566 -20.756 12.952 1.00 0.00 H new ATOM 0 HG3 GLU B 47 66.691 -21.947 12.010 1.00 0.00 H new ATOM 1470 N ALA B 48 67.503 -19.384 8.093 1.00 0.00 N ATOM 1471 CA ALA B 48 67.979 -18.621 6.944 1.00 0.00 C ATOM 1472 C ALA B 48 66.834 -18.359 5.973 1.00 0.00 C ATOM 1473 O ALA B 48 66.027 -19.247 5.695 1.00 0.00 O ATOM 1474 CB ALA B 48 69.092 -19.391 6.227 1.00 0.00 C ATOM 0 H ALA B 48 67.145 -20.312 7.865 1.00 0.00 H new ATOM 0 HA ALA B 48 68.371 -17.668 7.299 1.00 0.00 H new ATOM 0 HB1 ALA B 48 69.441 -18.813 5.371 1.00 0.00 H new ATOM 0 HB2 ALA B 48 69.921 -19.557 6.915 1.00 0.00 H new ATOM 0 HB3 ALA B 48 68.707 -20.352 5.884 1.00 0.00 H new ATOM 1480 N CYS B 49 66.769 -17.134 5.462 1.00 0.00 N ATOM 1481 CA CYS B 49 65.718 -16.765 4.524 1.00 0.00 C ATOM 1482 C CYS B 49 66.308 -15.989 3.352 1.00 0.00 C ATOM 1483 O CYS B 49 67.074 -15.044 3.541 1.00 0.00 O ATOM 1484 CB CYS B 49 64.662 -15.912 5.233 1.00 0.00 C ATOM 1485 SG CYS B 49 63.290 -15.592 4.102 1.00 0.00 S ATOM 0 H CYS B 49 67.427 -16.386 5.680 1.00 0.00 H new ATOM 0 HA CYS B 49 65.249 -17.674 4.146 1.00 0.00 H new ATOM 0 HB2 CYS B 49 64.301 -16.427 6.124 1.00 0.00 H new ATOM 0 HB3 CYS B 49 65.101 -14.971 5.565 1.00 0.00 H new ATOM 0 HG CYS B 49 62.251 -15.203 4.779 1.00 0.00 H new ATOM 1490 N THR B 50 65.952 -16.401 2.140 1.00 0.00 N ATOM 1491 CA THR B 50 66.457 -15.747 0.936 1.00 0.00 C ATOM 1492 C THR B 50 65.566 -14.573 0.539 1.00 0.00 C ATOM 1493 O THR B 50 65.830 -13.892 -0.452 1.00 0.00 O ATOM 1494 CB THR B 50 66.517 -16.754 -0.216 1.00 0.00 C ATOM 1495 OG1 THR B 50 65.219 -17.282 -0.451 1.00 0.00 O ATOM 1496 CG2 THR B 50 67.477 -17.890 0.141 1.00 0.00 C ATOM 0 H THR B 50 65.319 -17.181 1.964 1.00 0.00 H new ATOM 0 HA THR B 50 67.457 -15.369 1.147 1.00 0.00 H new ATOM 0 HB THR B 50 66.874 -16.253 -1.116 1.00 0.00 H new ATOM 0 HG1 THR B 50 65.256 -17.925 -1.189 1.00 0.00 H new ATOM 0 HG21 THR B 50 67.517 -18.605 -0.681 1.00 0.00 H new ATOM 0 HG22 THR B 50 68.473 -17.483 0.317 1.00 0.00 H new ATOM 0 HG23 THR B 50 67.126 -18.393 1.042 1.00 0.00 H new ATOM 1504 N ASN B 51 64.510 -14.337 1.314 1.00 0.00 N ATOM 1505 CA ASN B 51 63.595 -13.246 1.025 1.00 0.00 C ATOM 1506 C ASN B 51 63.975 -12.012 1.834 1.00 0.00 C ATOM 1507 O ASN B 51 63.930 -12.025 3.064 1.00 0.00 O ATOM 1508 CB ASN B 51 62.164 -13.668 1.354 1.00 0.00 C ATOM 1509 CG ASN B 51 61.197 -12.547 0.999 1.00 0.00 C ATOM 1510 OD1 ASN B 51 60.990 -11.631 1.793 1.00 0.00 O ATOM 1511 ND2 ASN B 51 60.589 -12.565 -0.154 1.00 0.00 N ATOM 0 H ASN B 51 64.271 -14.885 2.141 1.00 0.00 H new ATOM 0 HA ASN B 51 63.660 -13.002 -0.035 1.00 0.00 H new ATOM 0 HB2 ASN B 51 61.906 -14.571 0.801 1.00 0.00 H new ATOM 0 HB3 ASN B 51 62.081 -13.909 2.414 1.00 0.00 H new ATOM 0 HD21 ASN B 51 59.939 -11.818 -0.400 1.00 0.00 H new ATOM 0 HD22 ASN B 51 60.763 -13.326 -0.810 1.00 0.00 H new ATOM 1518 N GLU B 52 64.356 -10.949 1.136 1.00 0.00 N ATOM 1519 CA GLU B 52 64.749 -9.715 1.803 1.00 0.00 C ATOM 1520 C GLU B 52 63.602 -9.182 2.649 1.00 0.00 C ATOM 1521 O GLU B 52 63.810 -8.720 3.770 1.00 0.00 O ATOM 1522 CB GLU B 52 65.154 -8.666 0.764 1.00 0.00 C ATOM 1523 CG GLU B 52 65.610 -7.387 1.474 1.00 0.00 C ATOM 1524 CD GLU B 52 66.133 -6.383 0.452 1.00 0.00 C ATOM 1525 OE1 GLU B 52 66.136 -6.710 -0.723 1.00 0.00 O ATOM 1526 OE2 GLU B 52 66.524 -5.302 0.861 1.00 0.00 O ATOM 0 H GLU B 52 64.401 -10.916 0.118 1.00 0.00 H new ATOM 0 HA GLU B 52 65.598 -9.926 2.453 1.00 0.00 H new ATOM 0 HB2 GLU B 52 65.958 -9.052 0.137 1.00 0.00 H new ATOM 0 HB3 GLU B 52 64.313 -8.448 0.106 1.00 0.00 H new ATOM 0 HG2 GLU B 52 64.779 -6.953 2.030 1.00 0.00 H new ATOM 0 HG3 GLU B 52 66.390 -7.621 2.198 1.00 0.00 H new ATOM 1533 N PHE B 53 62.388 -9.245 2.110 1.00 0.00 N ATOM 1534 CA PHE B 53 61.233 -8.758 2.846 1.00 0.00 C ATOM 1535 C PHE B 53 60.628 -9.872 3.695 1.00 0.00 C ATOM 1536 O PHE B 53 59.456 -10.214 3.544 1.00 0.00 O ATOM 1537 CB PHE B 53 60.179 -8.242 1.863 1.00 0.00 C ATOM 1538 CG PHE B 53 60.761 -7.115 1.046 1.00 0.00 C ATOM 1539 CD1 PHE B 53 61.314 -7.377 -0.213 1.00 0.00 C ATOM 1540 CD2 PHE B 53 60.749 -5.808 1.547 1.00 0.00 C ATOM 1541 CE1 PHE B 53 61.857 -6.332 -0.970 1.00 0.00 C ATOM 1542 CE2 PHE B 53 61.290 -4.763 0.790 1.00 0.00 C ATOM 1543 CZ PHE B 53 61.844 -5.024 -0.469 1.00 0.00 C ATOM 0 H PHE B 53 62.183 -9.621 1.184 1.00 0.00 H new ATOM 0 HA PHE B 53 61.555 -7.950 3.503 1.00 0.00 H new ATOM 0 HB2 PHE B 53 59.852 -9.049 1.208 1.00 0.00 H new ATOM 0 HB3 PHE B 53 59.299 -7.895 2.405 1.00 0.00 H new ATOM 0 HD1 PHE B 53 61.322 -8.385 -0.600 1.00 0.00 H new ATOM 0 HD2 PHE B 53 60.322 -5.606 2.518 1.00 0.00 H new ATOM 0 HE1 PHE B 53 62.286 -6.534 -1.940 1.00 0.00 H new ATOM 0 HE2 PHE B 53 61.280 -3.755 1.177 1.00 0.00 H new ATOM 0 HZ PHE B 53 62.261 -4.217 -1.054 1.00 0.00 H new ATOM 1553 N CYS B 54 61.434 -10.430 4.596 1.00 0.00 N ATOM 1554 CA CYS B 54 60.964 -11.496 5.468 1.00 0.00 C ATOM 1555 C CYS B 54 61.794 -11.542 6.747 1.00 0.00 C ATOM 1556 O CYS B 54 63.005 -11.328 6.718 1.00 0.00 O ATOM 1557 CB CYS B 54 61.059 -12.838 4.752 1.00 0.00 C ATOM 1558 SG CYS B 54 60.298 -14.116 5.779 1.00 0.00 S ATOM 0 H CYS B 54 62.408 -10.162 4.738 1.00 0.00 H new ATOM 0 HA CYS B 54 59.924 -11.297 5.726 1.00 0.00 H new ATOM 0 HB2 CYS B 54 60.557 -12.784 3.786 1.00 0.00 H new ATOM 0 HB3 CYS B 54 62.102 -13.086 4.556 1.00 0.00 H new ATOM 0 HG CYS B 54 61.025 -14.311 6.839 1.00 0.00 H new ATOM 1563 N ALA B 55 61.138 -11.825 7.866 1.00 0.00 N ATOM 1564 CA ALA B 55 61.826 -11.904 9.148 1.00 0.00 C ATOM 1565 C ALA B 55 62.743 -13.118 9.175 1.00 0.00 C ATOM 1566 O ALA B 55 62.726 -13.939 8.260 1.00 0.00 O ATOM 1567 CB ALA B 55 60.811 -12.011 10.285 1.00 0.00 C ATOM 0 H ALA B 55 60.135 -12.003 7.912 1.00 0.00 H new ATOM 0 HA ALA B 55 62.420 -10.999 9.279 1.00 0.00 H new ATOM 0 HB1 ALA B 55 61.337 -12.069 11.238 1.00 0.00 H new ATOM 0 HB2 ALA B 55 60.165 -11.133 10.280 1.00 0.00 H new ATOM 0 HB3 ALA B 55 60.206 -12.907 10.149 1.00 0.00 H new ATOM 1573 N SER B 56 63.546 -13.212 10.228 1.00 0.00 N ATOM 1574 CA SER B 56 64.478 -14.323 10.384 1.00 0.00 C ATOM 1575 C SER B 56 65.512 -14.306 9.270 1.00 0.00 C ATOM 1576 O SER B 56 66.137 -15.327 8.986 1.00 0.00 O ATOM 1577 CB SER B 56 63.731 -15.658 10.365 1.00 0.00 C ATOM 1578 OG SER B 56 62.641 -15.598 11.275 1.00 0.00 O ATOM 0 H SER B 56 63.571 -12.532 10.988 1.00 0.00 H new ATOM 0 HA SER B 56 64.982 -14.211 11.344 1.00 0.00 H new ATOM 0 HB2 SER B 56 63.369 -15.871 9.359 1.00 0.00 H new ATOM 0 HB3 SER B 56 64.405 -16.469 10.640 1.00 0.00 H new ATOM 0 HG SER B 56 62.159 -16.451 11.264 1.00 0.00 H new ATOM 1584 N CYS B 57 65.684 -13.144 8.638 1.00 0.00 N ATOM 1585 CA CYS B 57 66.648 -13.023 7.550 1.00 0.00 C ATOM 1586 C CYS B 57 67.782 -12.069 7.944 1.00 0.00 C ATOM 1587 O CYS B 57 67.579 -11.152 8.740 1.00 0.00 O ATOM 1588 CB CYS B 57 65.949 -12.497 6.290 1.00 0.00 C ATOM 1589 SG CYS B 57 66.254 -10.723 6.118 1.00 0.00 S ATOM 0 H CYS B 57 65.176 -12.287 8.858 1.00 0.00 H new ATOM 0 HA CYS B 57 67.069 -14.008 7.347 1.00 0.00 H new ATOM 0 HB2 CYS B 57 66.317 -13.026 5.411 1.00 0.00 H new ATOM 0 HB3 CYS B 57 64.877 -12.687 6.351 1.00 0.00 H new ATOM 0 HG CYS B 57 65.357 -10.202 5.335 1.00 0.00 H new ATOM 1595 N PRO B 58 68.961 -12.262 7.404 1.00 0.00 N ATOM 1596 CA PRO B 58 70.142 -11.395 7.708 1.00 0.00 C ATOM 1597 C PRO B 58 69.958 -9.966 7.200 1.00 0.00 C ATOM 1598 O PRO B 58 70.623 -9.042 7.665 1.00 0.00 O ATOM 1599 CB PRO B 58 71.303 -12.090 6.988 1.00 0.00 C ATOM 1600 CG PRO B 58 70.670 -12.910 5.917 1.00 0.00 C ATOM 1601 CD PRO B 58 69.307 -13.329 6.451 1.00 0.00 C ATOM 0 HA PRO B 58 70.304 -11.291 8.781 1.00 0.00 H new ATOM 0 HB2 PRO B 58 71.997 -11.362 6.567 1.00 0.00 H new ATOM 0 HB3 PRO B 58 71.874 -12.714 7.675 1.00 0.00 H new ATOM 0 HG2 PRO B 58 70.567 -12.335 4.996 1.00 0.00 H new ATOM 0 HG3 PRO B 58 71.281 -13.782 5.682 1.00 0.00 H new ATOM 0 HD2 PRO B 58 68.570 -13.406 5.651 1.00 0.00 H new ATOM 0 HD3 PRO B 58 69.350 -14.303 6.939 1.00 0.00 H new ATOM 1609 N THR B 59 69.058 -9.795 6.240 1.00 0.00 N ATOM 1610 CA THR B 59 68.763 -8.467 5.710 1.00 0.00 C ATOM 1611 C THR B 59 67.574 -7.803 6.402 1.00 0.00 C ATOM 1612 O THR B 59 67.002 -6.843 5.884 1.00 0.00 O ATOM 1613 CB THR B 59 68.482 -8.590 4.213 1.00 0.00 C ATOM 1614 OG1 THR B 59 67.332 -9.400 4.013 1.00 0.00 O ATOM 1615 CG2 THR B 59 69.686 -9.230 3.518 1.00 0.00 C ATOM 0 H THR B 59 68.523 -10.552 5.814 1.00 0.00 H new ATOM 0 HA THR B 59 69.630 -7.833 5.897 1.00 0.00 H new ATOM 0 HB THR B 59 68.306 -7.600 3.793 1.00 0.00 H new ATOM 0 HG1 THR B 59 67.068 -9.808 4.864 1.00 0.00 H new ATOM 0 HG21 THR B 59 69.485 -9.318 2.450 1.00 0.00 H new ATOM 0 HG22 THR B 59 70.568 -8.608 3.672 1.00 0.00 H new ATOM 0 HG23 THR B 59 69.863 -10.221 3.936 1.00 0.00 H new ATOM 1623 N PHE B 60 67.201 -8.324 7.567 1.00 0.00 N ATOM 1624 CA PHE B 60 65.973 -7.877 8.230 1.00 0.00 C ATOM 1625 C PHE B 60 66.165 -7.986 9.667 1.00 0.00 C ATOM 1626 O PHE B 60 66.563 -9.021 10.200 1.00 0.00 O ATOM 1627 CB PHE B 60 64.725 -8.701 7.920 1.00 0.00 C ATOM 1628 CG PHE B 60 63.544 -8.122 8.661 1.00 0.00 C ATOM 1629 CD1 PHE B 60 62.736 -7.159 8.043 1.00 0.00 C ATOM 1630 CD2 PHE B 60 63.260 -8.540 9.967 1.00 0.00 C ATOM 1631 CE1 PHE B 60 61.643 -6.617 8.730 1.00 0.00 C ATOM 1632 CE2 PHE B 60 62.168 -7.997 10.654 1.00 0.00 C ATOM 1633 CZ PHE B 60 61.359 -7.037 10.034 1.00 0.00 C ATOM 0 H PHE B 60 67.720 -9.045 8.068 1.00 0.00 H new ATOM 0 HA PHE B 60 65.805 -6.864 7.863 1.00 0.00 H new ATOM 0 HB2 PHE B 60 64.532 -8.699 6.847 1.00 0.00 H new ATOM 0 HB3 PHE B 60 64.879 -9.739 8.214 1.00 0.00 H new ATOM 0 HD1 PHE B 60 62.956 -6.835 7.037 1.00 0.00 H new ATOM 0 HD2 PHE B 60 63.884 -9.281 10.444 1.00 0.00 H new ATOM 0 HE1 PHE B 60 61.019 -5.875 8.254 1.00 0.00 H new ATOM 0 HE2 PHE B 60 61.950 -8.318 11.662 1.00 0.00 H new ATOM 0 HZ PHE B 60 60.515 -6.620 10.563 1.00 0.00 H new ATOM 1643 N LEU B 61 65.933 -6.864 10.341 1.00 0.00 N ATOM 1644 CA LEU B 61 66.142 -6.786 11.782 1.00 0.00 C ATOM 1645 C LEU B 61 64.804 -6.710 12.504 1.00 0.00 C ATOM 1646 O LEU B 61 63.821 -6.209 11.960 1.00 0.00 O ATOM 1647 CB LEU B 61 66.982 -5.552 12.123 1.00 0.00 C ATOM 1648 CG LEU B 61 68.313 -5.608 11.368 1.00 0.00 C ATOM 1649 CD1 LEU B 61 69.129 -4.353 11.680 1.00 0.00 C ATOM 1650 CD2 LEU B 61 69.106 -6.847 11.798 1.00 0.00 C ATOM 0 H LEU B 61 65.601 -5.999 9.914 1.00 0.00 H new ATOM 0 HA LEU B 61 66.671 -7.682 12.107 1.00 0.00 H new ATOM 0 HB2 LEU B 61 66.439 -4.646 11.855 1.00 0.00 H new ATOM 0 HB3 LEU B 61 67.164 -5.509 13.197 1.00 0.00 H new ATOM 0 HG LEU B 61 68.114 -5.662 10.298 1.00 0.00 H new ATOM 0 HD11 LEU B 61 70.077 -4.392 11.143 1.00 0.00 H new ATOM 0 HD12 LEU B 61 68.572 -3.470 11.368 1.00 0.00 H new ATOM 0 HD13 LEU B 61 69.321 -4.301 12.752 1.00 0.00 H new ATOM 0 HD21 LEU B 61 70.051 -6.880 11.257 1.00 0.00 H new ATOM 0 HD22 LEU B 61 69.303 -6.799 12.869 1.00 0.00 H new ATOM 0 HD23 LEU B 61 68.529 -7.744 11.575 1.00 0.00 H new ATOM 1662 N ARG B 62 64.769 -7.217 13.726 1.00 0.00 N ATOM 1663 CA ARG B 62 63.543 -7.210 14.506 1.00 0.00 C ATOM 1664 C ARG B 62 63.032 -5.782 14.663 1.00 0.00 C ATOM 1665 O ARG B 62 63.802 -4.859 14.930 1.00 0.00 O ATOM 1666 CB ARG B 62 63.814 -7.808 15.886 1.00 0.00 C ATOM 1667 CG ARG B 62 64.258 -9.271 15.757 1.00 0.00 C ATOM 1668 CD ARG B 62 63.037 -10.187 15.627 1.00 0.00 C ATOM 1669 NE ARG B 62 62.192 -10.056 16.807 1.00 0.00 N ATOM 1670 CZ ARG B 62 62.480 -10.702 17.932 1.00 0.00 C ATOM 1671 NH1 ARG B 62 63.537 -11.467 17.991 1.00 0.00 N ATOM 1672 NH2 ARG B 62 61.712 -10.568 18.977 1.00 0.00 N ATOM 0 H ARG B 62 65.571 -7.636 14.197 1.00 0.00 H new ATOM 0 HA ARG B 62 62.789 -7.804 13.990 1.00 0.00 H new ATOM 0 HB2 ARG B 62 64.586 -7.230 16.394 1.00 0.00 H new ATOM 0 HB3 ARG B 62 62.915 -7.747 16.499 1.00 0.00 H new ATOM 0 HG2 ARG B 62 64.903 -9.387 14.886 1.00 0.00 H new ATOM 0 HG3 ARG B 62 64.846 -9.558 16.629 1.00 0.00 H new ATOM 0 HD2 ARG B 62 62.471 -9.928 14.733 1.00 0.00 H new ATOM 0 HD3 ARG B 62 63.358 -11.222 15.512 1.00 0.00 H new ATOM 0 HE ARG B 62 61.366 -9.459 16.769 1.00 0.00 H new ATOM 0 HH11 ARG B 62 64.140 -11.568 17.174 1.00 0.00 H new ATOM 0 HH12 ARG B 62 63.760 -11.964 18.854 1.00 0.00 H new ATOM 0 HH21 ARG B 62 60.889 -9.967 18.931 1.00 0.00 H new ATOM 0 HH22 ARG B 62 61.934 -11.064 19.840 1.00 0.00 H new ATOM 1686 N MET B 63 61.726 -5.618 14.488 1.00 0.00 N ATOM 1687 CA MET B 63 61.100 -4.307 14.602 1.00 0.00 C ATOM 1688 C MET B 63 59.881 -4.364 15.520 1.00 0.00 C ATOM 1689 O MET B 63 59.323 -5.432 15.769 1.00 0.00 O ATOM 1690 CB MET B 63 60.678 -3.810 13.215 1.00 0.00 C ATOM 1691 CG MET B 63 61.576 -2.647 12.784 1.00 0.00 C ATOM 1692 SD MET B 63 63.289 -3.220 12.653 1.00 0.00 S ATOM 1693 CE MET B 63 63.211 -3.766 10.929 1.00 0.00 C ATOM 0 H MET B 63 61.081 -6.376 14.267 1.00 0.00 H new ATOM 0 HA MET B 63 61.826 -3.617 15.032 1.00 0.00 H new ATOM 0 HB2 MET B 63 60.747 -4.622 12.491 1.00 0.00 H new ATOM 0 HB3 MET B 63 59.637 -3.489 13.235 1.00 0.00 H new ATOM 0 HG2 MET B 63 61.240 -2.250 11.826 1.00 0.00 H new ATOM 0 HG3 MET B 63 61.508 -1.834 13.507 1.00 0.00 H new ATOM 0 HE1 MET B 63 64.169 -4.197 10.640 1.00 0.00 H new ATOM 0 HE2 MET B 63 62.428 -4.516 10.820 1.00 0.00 H new ATOM 0 HE3 MET B 63 62.989 -2.914 10.287 1.00 0.00 H new ATOM 1703 N ASP B 64 59.479 -3.199 16.019 1.00 0.00 N ATOM 1704 CA ASP B 64 58.331 -3.106 16.910 1.00 0.00 C ATOM 1705 C ASP B 64 57.037 -3.180 16.111 1.00 0.00 C ATOM 1706 O ASP B 64 57.057 -3.236 14.883 1.00 0.00 O ATOM 1707 CB ASP B 64 58.411 -1.827 17.746 1.00 0.00 C ATOM 1708 CG ASP B 64 59.527 -1.948 18.777 1.00 0.00 C ATOM 1709 OD1 ASP B 64 60.018 -3.049 18.963 1.00 0.00 O ATOM 1710 OD2 ASP B 64 59.874 -0.939 19.368 1.00 0.00 O ATOM 0 H ASP B 64 59.932 -2.307 15.821 1.00 0.00 H new ATOM 0 HA ASP B 64 58.342 -3.951 17.599 1.00 0.00 H new ATOM 0 HB2 ASP B 64 58.594 -0.970 17.098 1.00 0.00 H new ATOM 0 HB3 ASP B 64 57.459 -1.650 18.247 1.00 0.00 H new ATOM 1715 N ASN B 65 55.913 -3.138 16.812 1.00 0.00 N ATOM 1716 CA ASN B 65 54.619 -3.159 16.146 1.00 0.00 C ATOM 1717 C ASN B 65 54.437 -1.919 15.277 1.00 0.00 C ATOM 1718 O ASN B 65 53.951 -2.007 14.151 1.00 0.00 O ATOM 1719 CB ASN B 65 53.500 -3.218 17.191 1.00 0.00 C ATOM 1720 CG ASN B 65 53.466 -4.590 17.854 1.00 0.00 C ATOM 1721 OD1 ASN B 65 53.985 -5.562 17.306 1.00 0.00 O ATOM 1722 ND2 ASN B 65 52.881 -4.725 19.012 1.00 0.00 N ATOM 0 H ASN B 65 55.870 -3.090 17.830 1.00 0.00 H new ATOM 0 HA ASN B 65 54.575 -4.042 15.508 1.00 0.00 H new ATOM 0 HB2 ASN B 65 53.656 -2.446 17.945 1.00 0.00 H new ATOM 0 HB3 ASN B 65 52.540 -3.012 16.718 1.00 0.00 H new ATOM 0 HD21 ASN B 65 52.853 -5.638 19.466 1.00 0.00 H new ATOM 0 HD22 ASN B 65 52.452 -3.917 19.464 1.00 0.00 H new ATOM 1729 N ASN B 66 54.838 -0.769 15.798 1.00 0.00 N ATOM 1730 CA ASN B 66 54.719 0.472 15.045 1.00 0.00 C ATOM 1731 C ASN B 66 55.578 0.420 13.783 1.00 0.00 C ATOM 1732 O ASN B 66 55.116 0.719 12.677 1.00 0.00 O ATOM 1733 CB ASN B 66 55.162 1.645 15.925 1.00 0.00 C ATOM 1734 CG ASN B 66 54.630 1.464 17.339 1.00 0.00 C ATOM 1735 OD1 ASN B 66 53.457 1.147 17.521 1.00 0.00 O ATOM 1736 ND2 ASN B 66 55.425 1.651 18.359 1.00 0.00 N ATOM 0 H ASN B 66 55.244 -0.668 16.728 1.00 0.00 H new ATOM 0 HA ASN B 66 53.679 0.606 14.749 1.00 0.00 H new ATOM 0 HB2 ASN B 66 56.250 1.707 15.942 1.00 0.00 H new ATOM 0 HB3 ASN B 66 54.796 2.583 15.507 1.00 0.00 H new ATOM 0 HD21 ASN B 66 55.072 1.534 19.309 1.00 0.00 H new ATOM 0 HD22 ASN B 66 56.398 1.914 18.205 1.00 0.00 H new ATOM 1743 N ALA B 67 56.834 0.025 13.957 1.00 0.00 N ATOM 1744 CA ALA B 67 57.754 -0.073 12.830 1.00 0.00 C ATOM 1745 C ALA B 67 57.283 -1.143 11.856 1.00 0.00 C ATOM 1746 O ALA B 67 57.380 -0.979 10.639 1.00 0.00 O ATOM 1747 CB ALA B 67 59.166 -0.396 13.324 1.00 0.00 C ATOM 0 H ALA B 67 57.236 -0.230 14.859 1.00 0.00 H new ATOM 0 HA ALA B 67 57.774 0.887 12.314 1.00 0.00 H new ATOM 0 HB1 ALA B 67 59.842 -0.466 12.472 1.00 0.00 H new ATOM 0 HB2 ALA B 67 59.507 0.394 13.994 1.00 0.00 H new ATOM 0 HB3 ALA B 67 59.156 -1.346 13.859 1.00 0.00 H new ATOM 1753 N ALA B 68 56.769 -2.238 12.403 1.00 0.00 N ATOM 1754 CA ALA B 68 56.314 -3.346 11.583 1.00 0.00 C ATOM 1755 C ALA B 68 55.140 -2.878 10.730 1.00 0.00 C ATOM 1756 O ALA B 68 55.015 -3.263 9.568 1.00 0.00 O ATOM 1757 CB ALA B 68 55.885 -4.511 12.474 1.00 0.00 C ATOM 0 H ALA B 68 56.659 -2.379 13.407 1.00 0.00 H new ATOM 0 HA ALA B 68 57.124 -3.684 10.937 1.00 0.00 H new ATOM 0 HB1 ALA B 68 55.545 -5.339 11.852 1.00 0.00 H new ATOM 0 HB2 ALA B 68 56.731 -4.836 13.080 1.00 0.00 H new ATOM 0 HB3 ALA B 68 55.073 -4.190 13.127 1.00 0.00 H new ATOM 1763 N ALA B 69 54.280 -2.049 11.314 1.00 0.00 N ATOM 1764 CA ALA B 69 53.121 -1.544 10.589 1.00 0.00 C ATOM 1765 C ALA B 69 53.560 -0.768 9.351 1.00 0.00 C ATOM 1766 O ALA B 69 52.971 -0.904 8.279 1.00 0.00 O ATOM 1767 CB ALA B 69 52.303 -0.626 11.500 1.00 0.00 C ATOM 0 H ALA B 69 54.362 -1.717 12.275 1.00 0.00 H new ATOM 0 HA ALA B 69 52.511 -2.391 10.276 1.00 0.00 H new ATOM 0 HB1 ALA B 69 51.437 -0.250 10.955 1.00 0.00 H new ATOM 0 HB2 ALA B 69 51.967 -1.185 12.373 1.00 0.00 H new ATOM 0 HB3 ALA B 69 52.921 0.212 11.822 1.00 0.00 H new ATOM 1773 N ILE B 70 54.599 0.040 9.505 1.00 0.00 N ATOM 1774 CA ILE B 70 55.107 0.831 8.389 1.00 0.00 C ATOM 1775 C ILE B 70 55.623 -0.087 7.292 1.00 0.00 C ATOM 1776 O ILE B 70 55.347 0.121 6.110 1.00 0.00 O ATOM 1777 CB ILE B 70 56.236 1.752 8.868 1.00 0.00 C ATOM 1778 CG1 ILE B 70 55.708 2.703 9.955 1.00 0.00 C ATOM 1779 CG2 ILE B 70 56.787 2.567 7.692 1.00 0.00 C ATOM 1780 CD1 ILE B 70 54.505 3.507 9.449 1.00 0.00 C ATOM 0 H ILE B 70 55.104 0.166 10.382 1.00 0.00 H new ATOM 0 HA ILE B 70 54.295 1.440 7.992 1.00 0.00 H new ATOM 0 HB ILE B 70 57.037 1.140 9.283 1.00 0.00 H new ATOM 0 HG12 ILE B 70 55.421 2.129 10.836 1.00 0.00 H new ATOM 0 HG13 ILE B 70 56.501 3.384 10.263 1.00 0.00 H new ATOM 0 HG21 ILE B 70 57.588 3.217 8.044 1.00 0.00 H new ATOM 0 HG22 ILE B 70 57.176 1.890 6.931 1.00 0.00 H new ATOM 0 HG23 ILE B 70 55.989 3.173 7.264 1.00 0.00 H new ATOM 0 HD11 ILE B 70 54.153 4.171 10.239 1.00 0.00 H new ATOM 0 HD12 ILE B 70 54.801 4.099 8.583 1.00 0.00 H new ATOM 0 HD13 ILE B 70 53.704 2.824 9.165 1.00 0.00 H new ATOM 1792 N LYS B 71 56.366 -1.107 7.688 1.00 0.00 N ATOM 1793 CA LYS B 71 56.903 -2.051 6.724 1.00 0.00 C ATOM 1794 C LYS B 71 55.765 -2.763 6.007 1.00 0.00 C ATOM 1795 O LYS B 71 55.822 -2.986 4.799 1.00 0.00 O ATOM 1796 CB LYS B 71 57.790 -3.075 7.433 1.00 0.00 C ATOM 1797 CG LYS B 71 59.080 -2.399 7.910 1.00 0.00 C ATOM 1798 CD LYS B 71 60.130 -2.421 6.792 1.00 0.00 C ATOM 1799 CE LYS B 71 61.428 -1.795 7.302 1.00 0.00 C ATOM 1800 NZ LYS B 71 61.201 -0.352 7.595 1.00 0.00 N ATOM 0 H LYS B 71 56.609 -1.301 8.659 1.00 0.00 H new ATOM 0 HA LYS B 71 57.502 -1.508 5.993 1.00 0.00 H new ATOM 0 HB2 LYS B 71 57.258 -3.505 8.282 1.00 0.00 H new ATOM 0 HB3 LYS B 71 58.027 -3.896 6.756 1.00 0.00 H new ATOM 0 HG2 LYS B 71 58.873 -1.370 8.205 1.00 0.00 H new ATOM 0 HG3 LYS B 71 59.465 -2.912 8.791 1.00 0.00 H new ATOM 0 HD2 LYS B 71 60.311 -3.446 6.468 1.00 0.00 H new ATOM 0 HD3 LYS B 71 59.765 -1.872 5.924 1.00 0.00 H new ATOM 0 HE2 LYS B 71 61.765 -2.311 8.201 1.00 0.00 H new ATOM 0 HE3 LYS B 71 62.216 -1.906 6.557 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 62.116 0.137 7.661 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 60.636 0.072 6.832 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 60.692 -0.257 8.497 1.00 0.00 H new ATOM 1814 N ALA B 72 54.728 -3.108 6.758 1.00 0.00 N ATOM 1815 CA ALA B 72 53.585 -3.786 6.174 1.00 0.00 C ATOM 1816 C ALA B 72 52.941 -2.907 5.114 1.00 0.00 C ATOM 1817 O ALA B 72 52.561 -3.391 4.048 1.00 0.00 O ATOM 1818 CB ALA B 72 52.557 -4.113 7.257 1.00 0.00 C ATOM 0 H ALA B 72 54.657 -2.931 7.760 1.00 0.00 H new ATOM 0 HA ALA B 72 53.929 -4.712 5.713 1.00 0.00 H new ATOM 0 HB1 ALA B 72 51.704 -4.621 6.807 1.00 0.00 H new ATOM 0 HB2 ALA B 72 53.012 -4.761 8.007 1.00 0.00 H new ATOM 0 HB3 ALA B 72 52.221 -3.190 7.730 1.00 0.00 H new ATOM 1824 N LEU B 73 52.820 -1.614 5.406 1.00 0.00 N ATOM 1825 CA LEU B 73 52.215 -0.700 4.447 1.00 0.00 C ATOM 1826 C LEU B 73 53.062 -0.619 3.181 1.00 0.00 C ATOM 1827 O LEU B 73 52.539 -0.658 2.066 1.00 0.00 O ATOM 1828 CB LEU B 73 52.076 0.693 5.072 1.00 0.00 C ATOM 1829 CG LEU B 73 51.427 1.663 4.074 1.00 0.00 C ATOM 1830 CD1 LEU B 73 50.024 1.174 3.708 1.00 0.00 C ATOM 1831 CD2 LEU B 73 51.326 3.049 4.711 1.00 0.00 C ATOM 0 H LEU B 73 53.126 -1.185 6.279 1.00 0.00 H new ATOM 0 HA LEU B 73 51.227 -1.075 4.182 1.00 0.00 H new ATOM 0 HB2 LEU B 73 51.472 0.634 5.977 1.00 0.00 H new ATOM 0 HB3 LEU B 73 53.057 1.066 5.367 1.00 0.00 H new ATOM 0 HG LEU B 73 52.038 1.712 3.172 1.00 0.00 H new ATOM 0 HD11 LEU B 73 49.570 1.867 3.000 1.00 0.00 H new ATOM 0 HD12 LEU B 73 50.090 0.185 3.256 1.00 0.00 H new ATOM 0 HD13 LEU B 73 49.411 1.121 4.608 1.00 0.00 H new ATOM 0 HD21 LEU B 73 50.866 3.741 4.006 1.00 0.00 H new ATOM 0 HD22 LEU B 73 50.717 2.991 5.613 1.00 0.00 H new ATOM 0 HD23 LEU B 73 52.324 3.404 4.969 1.00 0.00 H new ATOM 1843 N GLU B 74 54.371 -0.496 3.363 1.00 0.00 N ATOM 1844 CA GLU B 74 55.286 -0.398 2.231 1.00 0.00 C ATOM 1845 C GLU B 74 55.290 -1.688 1.421 1.00 0.00 C ATOM 1846 O GLU B 74 55.330 -1.652 0.194 1.00 0.00 O ATOM 1847 CB GLU B 74 56.702 -0.093 2.728 1.00 0.00 C ATOM 1848 CG GLU B 74 56.748 1.324 3.309 1.00 0.00 C ATOM 1849 CD GLU B 74 56.586 2.352 2.193 1.00 0.00 C ATOM 1850 OE1 GLU B 74 56.821 1.998 1.050 1.00 0.00 O ATOM 1851 OE2 GLU B 74 56.230 3.478 2.500 1.00 0.00 O ATOM 0 H GLU B 74 54.821 -0.462 4.278 1.00 0.00 H new ATOM 0 HA GLU B 74 54.946 0.412 1.586 1.00 0.00 H new ATOM 0 HB2 GLU B 74 56.996 -0.818 3.487 1.00 0.00 H new ATOM 0 HB3 GLU B 74 57.414 -0.184 1.908 1.00 0.00 H new ATOM 0 HG2 GLU B 74 55.956 1.449 4.047 1.00 0.00 H new ATOM 0 HG3 GLU B 74 57.694 1.483 3.826 1.00 0.00 H new ATOM 1858 N LEU B 75 55.243 -2.822 2.115 1.00 0.00 N ATOM 1859 CA LEU B 75 55.239 -4.125 1.451 1.00 0.00 C ATOM 1860 C LEU B 75 54.003 -4.273 0.570 1.00 0.00 C ATOM 1861 O LEU B 75 54.072 -4.755 -0.561 1.00 0.00 O ATOM 1862 CB LEU B 75 55.256 -5.234 2.507 1.00 0.00 C ATOM 1863 CG LEU B 75 56.646 -5.863 2.571 1.00 0.00 C ATOM 1864 CD1 LEU B 75 57.652 -4.876 3.175 1.00 0.00 C ATOM 1865 CD2 LEU B 75 56.597 -7.131 3.425 1.00 0.00 C ATOM 0 H LEU B 75 55.207 -2.867 3.133 1.00 0.00 H new ATOM 0 HA LEU B 75 56.125 -4.203 0.821 1.00 0.00 H new ATOM 0 HB2 LEU B 75 54.986 -4.826 3.481 1.00 0.00 H new ATOM 0 HB3 LEU B 75 54.514 -5.994 2.262 1.00 0.00 H new ATOM 0 HG LEU B 75 56.964 -6.115 1.559 1.00 0.00 H new ATOM 0 HD11 LEU B 75 58.638 -5.339 3.214 1.00 0.00 H new ATOM 0 HD12 LEU B 75 57.697 -3.979 2.558 1.00 0.00 H new ATOM 0 HD13 LEU B 75 57.337 -4.607 4.183 1.00 0.00 H new ATOM 0 HD21 LEU B 75 57.590 -7.578 3.469 1.00 0.00 H new ATOM 0 HD22 LEU B 75 56.267 -6.878 4.433 1.00 0.00 H new ATOM 0 HD23 LEU B 75 55.899 -7.841 2.982 1.00 0.00 H new ATOM 1877 N TYR B 76 52.875 -3.854 1.101 1.00 0.00 N ATOM 1878 CA TYR B 76 51.624 -3.924 0.356 1.00 0.00 C ATOM 1879 C TYR B 76 51.710 -3.055 -0.897 1.00 0.00 C ATOM 1880 O TYR B 76 51.315 -3.475 -1.981 1.00 0.00 O ATOM 1881 CB TYR B 76 50.448 -3.470 1.223 1.00 0.00 C ATOM 1882 CG TYR B 76 49.171 -3.552 0.415 1.00 0.00 C ATOM 1883 CD1 TYR B 76 48.573 -4.796 0.174 1.00 0.00 C ATOM 1884 CD2 TYR B 76 48.583 -2.385 -0.086 1.00 0.00 C ATOM 1885 CE1 TYR B 76 47.388 -4.871 -0.569 1.00 0.00 C ATOM 1886 CE2 TYR B 76 47.398 -2.461 -0.830 1.00 0.00 C ATOM 1887 CZ TYR B 76 46.800 -3.705 -1.071 1.00 0.00 C ATOM 1888 OH TYR B 76 45.631 -3.779 -1.802 1.00 0.00 O ATOM 0 H TYR B 76 52.792 -3.463 2.039 1.00 0.00 H new ATOM 0 HA TYR B 76 51.458 -4.961 0.064 1.00 0.00 H new ATOM 0 HB2 TYR B 76 50.372 -4.098 2.110 1.00 0.00 H new ATOM 0 HB3 TYR B 76 50.609 -2.449 1.568 1.00 0.00 H new ATOM 0 HD1 TYR B 76 49.026 -5.697 0.561 1.00 0.00 H new ATOM 0 HD2 TYR B 76 49.043 -1.426 0.101 1.00 0.00 H new ATOM 0 HE1 TYR B 76 46.928 -5.830 -0.755 1.00 0.00 H new ATOM 0 HE2 TYR B 76 46.945 -1.560 -1.218 1.00 0.00 H new ATOM 0 HH TYR B 76 45.478 -4.706 -2.081 1.00 0.00 H new ATOM 1898 N LYS B 77 52.220 -1.836 -0.736 1.00 0.00 N ATOM 1899 CA LYS B 77 52.340 -0.907 -1.860 1.00 0.00 C ATOM 1900 C LYS B 77 53.184 -1.507 -2.980 1.00 0.00 C ATOM 1901 O LYS B 77 52.795 -1.480 -4.148 1.00 0.00 O ATOM 1902 CB LYS B 77 53.002 0.386 -1.377 1.00 0.00 C ATOM 1903 CG LYS B 77 53.157 1.360 -2.552 1.00 0.00 C ATOM 1904 CD LYS B 77 53.763 2.675 -2.066 1.00 0.00 C ATOM 1905 CE LYS B 77 55.289 2.556 -1.971 1.00 0.00 C ATOM 1906 NZ LYS B 77 55.863 3.873 -1.580 1.00 0.00 N ATOM 0 H LYS B 77 52.555 -1.469 0.155 1.00 0.00 H new ATOM 0 HA LYS B 77 51.341 -0.704 -2.246 1.00 0.00 H new ATOM 0 HB2 LYS B 77 52.400 0.842 -0.591 1.00 0.00 H new ATOM 0 HB3 LYS B 77 53.978 0.166 -0.944 1.00 0.00 H new ATOM 0 HG2 LYS B 77 53.793 0.919 -3.319 1.00 0.00 H new ATOM 0 HG3 LYS B 77 52.186 1.546 -3.011 1.00 0.00 H new ATOM 0 HD2 LYS B 77 53.496 3.481 -2.750 1.00 0.00 H new ATOM 0 HD3 LYS B 77 53.350 2.935 -1.091 1.00 0.00 H new ATOM 0 HE2 LYS B 77 55.561 1.796 -1.238 1.00 0.00 H new ATOM 0 HE3 LYS B 77 55.701 2.237 -2.929 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 56.898 3.795 -1.515 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 55.614 4.586 -2.295 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 55.479 4.159 -0.657 1.00 0.00 H new ATOM 1920 N ILE B 78 54.336 -2.045 -2.614 1.00 0.00 N ATOM 1921 CA ILE B 78 55.236 -2.651 -3.595 1.00 0.00 C ATOM 1922 C ILE B 78 54.757 -4.046 -3.971 1.00 0.00 C ATOM 1923 O ILE B 78 55.262 -4.656 -4.913 1.00 0.00 O ATOM 1924 CB ILE B 78 56.664 -2.726 -3.037 1.00 0.00 C ATOM 1925 CG1 ILE B 78 57.572 -3.415 -4.049 1.00 0.00 C ATOM 1926 CG2 ILE B 78 56.672 -3.518 -1.742 1.00 0.00 C ATOM 1927 CD1 ILE B 78 59.033 -3.094 -3.734 1.00 0.00 C ATOM 0 H ILE B 78 54.673 -2.077 -1.652 1.00 0.00 H new ATOM 0 HA ILE B 78 55.236 -2.026 -4.488 1.00 0.00 H new ATOM 0 HB ILE B 78 57.024 -1.715 -2.846 1.00 0.00 H new ATOM 0 HG12 ILE B 78 57.412 -4.493 -4.020 1.00 0.00 H new ATOM 0 HG13 ILE B 78 57.326 -3.083 -5.058 1.00 0.00 H new ATOM 0 HG21 ILE B 78 57.689 -3.567 -1.352 1.00 0.00 H new ATOM 0 HG22 ILE B 78 56.027 -3.029 -1.012 1.00 0.00 H new ATOM 0 HG23 ILE B 78 56.307 -4.527 -1.931 1.00 0.00 H new ATOM 0 HD11 ILE B 78 59.679 -3.588 -4.460 1.00 0.00 H new ATOM 0 HD12 ILE B 78 59.188 -2.016 -3.785 1.00 0.00 H new ATOM 0 HD13 ILE B 78 59.275 -3.448 -2.732 1.00 0.00 H new ATOM 1939 N ASN B 79 53.776 -4.542 -3.232 1.00 0.00 N ATOM 1940 CA ASN B 79 53.226 -5.862 -3.499 1.00 0.00 C ATOM 1941 C ASN B 79 54.338 -6.907 -3.510 1.00 0.00 C ATOM 1942 O ASN B 79 54.306 -7.852 -4.296 1.00 0.00 O ATOM 1943 CB ASN B 79 52.506 -5.868 -4.848 1.00 0.00 C ATOM 1944 CG ASN B 79 51.536 -7.043 -4.915 1.00 0.00 C ATOM 1945 OD1 ASN B 79 50.943 -7.417 -3.904 1.00 0.00 O ATOM 1946 ND2 ASN B 79 51.337 -7.650 -6.054 1.00 0.00 N ATOM 0 H ASN B 79 53.346 -4.053 -2.447 1.00 0.00 H new ATOM 0 HA ASN B 79 52.515 -6.106 -2.710 1.00 0.00 H new ATOM 0 HB2 ASN B 79 51.966 -4.931 -4.986 1.00 0.00 H new ATOM 0 HB3 ASN B 79 53.233 -5.939 -5.657 1.00 0.00 H new ATOM 0 HD21 ASN B 79 50.689 -8.436 -6.107 1.00 0.00 H new ATOM 0 HD22 ASN B 79 51.830 -7.338 -6.891 1.00 0.00 H new ATOM 1953 N ALA B 80 55.314 -6.728 -2.628 1.00 0.00 N ATOM 1954 CA ALA B 80 56.430 -7.656 -2.536 1.00 0.00 C ATOM 1955 C ALA B 80 55.914 -9.075 -2.334 1.00 0.00 C ATOM 1956 O ALA B 80 54.913 -9.294 -1.650 1.00 0.00 O ATOM 1957 CB ALA B 80 57.333 -7.263 -1.364 1.00 0.00 C ATOM 0 H ALA B 80 55.354 -5.951 -1.969 1.00 0.00 H new ATOM 0 HA ALA B 80 57.003 -7.615 -3.462 1.00 0.00 H new ATOM 0 HB1 ALA B 80 58.168 -7.961 -1.298 1.00 0.00 H new ATOM 0 HB2 ALA B 80 57.714 -6.254 -1.521 1.00 0.00 H new ATOM 0 HB3 ALA B 80 56.760 -7.294 -0.437 1.00 0.00 H new ATOM 1963 N LYS B 81 56.595 -10.032 -2.944 1.00 0.00 N ATOM 1964 CA LYS B 81 56.195 -11.427 -2.841 1.00 0.00 C ATOM 1965 C LYS B 81 56.382 -11.932 -1.418 1.00 0.00 C ATOM 1966 O LYS B 81 57.342 -11.569 -0.737 1.00 0.00 O ATOM 1967 CB LYS B 81 57.032 -12.279 -3.792 1.00 0.00 C ATOM 1968 CG LYS B 81 56.773 -11.835 -5.233 1.00 0.00 C ATOM 1969 CD LYS B 81 57.423 -12.821 -6.218 1.00 0.00 C ATOM 1970 CE LYS B 81 58.950 -12.703 -6.162 1.00 0.00 C ATOM 1971 NZ LYS B 81 59.552 -13.477 -7.286 1.00 0.00 N ATOM 0 H LYS B 81 57.425 -9.870 -3.514 1.00 0.00 H new ATOM 0 HA LYS B 81 55.142 -11.504 -3.110 1.00 0.00 H new ATOM 0 HB2 LYS B 81 58.091 -12.177 -3.553 1.00 0.00 H new ATOM 0 HB3 LYS B 81 56.778 -13.332 -3.673 1.00 0.00 H new ATOM 0 HG2 LYS B 81 55.700 -11.780 -5.417 1.00 0.00 H new ATOM 0 HG3 LYS B 81 57.175 -10.834 -5.391 1.00 0.00 H new ATOM 0 HD2 LYS B 81 57.121 -13.840 -5.975 1.00 0.00 H new ATOM 0 HD3 LYS B 81 57.073 -12.618 -7.230 1.00 0.00 H new ATOM 0 HE2 LYS B 81 59.247 -11.656 -6.228 1.00 0.00 H new ATOM 0 HE3 LYS B 81 59.319 -13.080 -5.208 1.00 0.00 H new ATOM 0 HZ1 LYS B 81 60.588 -13.396 -7.247 1.00 0.00 H new ATOM 0 HZ2 LYS B 81 59.279 -14.477 -7.204 1.00 0.00 H new ATOM 0 HZ3 LYS B 81 59.209 -13.098 -8.192 1.00 0.00 H new ATOM 1985 N LEU B 82 55.455 -12.773 -0.980 1.00 0.00 N ATOM 1986 CA LEU B 82 55.515 -13.332 0.366 1.00 0.00 C ATOM 1987 C LEU B 82 56.514 -14.480 0.429 1.00 0.00 C ATOM 1988 O LEU B 82 56.753 -15.166 -0.565 1.00 0.00 O ATOM 1989 CB LEU B 82 54.134 -13.836 0.789 1.00 0.00 C ATOM 1990 CG LEU B 82 53.089 -12.752 0.525 1.00 0.00 C ATOM 1991 CD1 LEU B 82 52.270 -13.126 -0.711 1.00 0.00 C ATOM 1992 CD2 LEU B 82 52.160 -12.634 1.735 1.00 0.00 C ATOM 0 H LEU B 82 54.656 -13.083 -1.533 1.00 0.00 H new ATOM 0 HA LEU B 82 55.839 -12.545 1.046 1.00 0.00 H new ATOM 0 HB2 LEU B 82 53.881 -14.741 0.237 1.00 0.00 H new ATOM 0 HB3 LEU B 82 54.140 -14.099 1.847 1.00 0.00 H new ATOM 0 HG LEU B 82 53.589 -11.798 0.356 1.00 0.00 H new ATOM 0 HD11 LEU B 82 51.524 -12.354 -0.901 1.00 0.00 H new ATOM 0 HD12 LEU B 82 52.931 -13.212 -1.573 1.00 0.00 H new ATOM 0 HD13 LEU B 82 51.770 -14.080 -0.541 1.00 0.00 H new ATOM 0 HD21 LEU B 82 51.415 -11.861 1.547 1.00 0.00 H new ATOM 0 HD22 LEU B 82 51.660 -13.587 1.904 1.00 0.00 H new ATOM 0 HD23 LEU B 82 52.743 -12.369 2.617 1.00 0.00 H new