USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 949 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 117 ASN : amide:sc= -1.58 X(o=-3.7,f=-3.7) USER MOD Set 1.2: A 134 GLN : amide:sc= -2.12 K(o=-3.7,f=-8.8!) USER MOD Set 2.1: A 115 ASN : amide:sc= -2.22! C(o=-8.4!,f=-13!) USER MOD Set 2.2: A 126 TYR OH : rot 15:sc= -1.74 USER MOD Set 2.3: A 128 SER OG : rot -91:sc= -2.81 USER MOD Set 2.4: A 131 GLN : amide:sc= -1.59 K(o=-8.4,f=-13) USER MOD Set 3.1: A 47 HIS : no HE2:sc= -2.24 K(o=-11,f=-5.8) USER MOD Set 3.2: A 78 ASN : amide:sc= -8.66! C(o=-11!,f=-5.8!) USER MOD Set 4.1: A 73 ASN : amide:sc= -2.2! C(o=-7.5!,f=-8.7!) USER MOD Set 4.2: A 140 GLN : amide:sc= -5.35! C(o=-7.5!,f=-7.8!) USER MOD Set 5.1: A 24 HIS : no HE2:sc= -10.8! C(o=-14!,f=-14!) USER MOD Set 5.2: A 136 MET CE :methyl 162:sc= -2.75 (180deg=-2.4!) USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 27 THR OG1 : rot 180:sc= -2.85! USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 152:sc= -5.02 (180deg=-8.76!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot -111:sc= 0.96 USER MOD Single : A 55 LYS NZ :NH3+ -158:sc= -0.0921 (180deg=-0.459) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 172:sc= -3.94! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0878 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -150:sc= -0.0101 USER MOD Single : A 72 HIS : no HD1:sc= -0.233 X(o=-0.23,f=0) USER MOD Single : A 76 MET CE :methyl -114:sc= -3.38 (180deg=-5.67!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -140:sc= -0.272 USER MOD Single : A 96 TYR OH : rot 8:sc= -4.17! USER MOD Single : A 106 SER OG : rot 56:sc= 1.15 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HE2:sc= 0.00801 K(o=0.008,f=-0.77) USER MOD Single : A 119 ASN : amide:sc= -0.996 K(o=-1,f=-1.5) USER MOD Single : A 121 SER OG : rot 45:sc= 1.28 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -134:sc= -0.819 (180deg=-2.42) USER MOD Single : A 124 TYR OH : rot -60:sc= -2.45 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 THR OG1 : rot -148:sc= 1.03 USER MOD ----------------------------------------------------------------- ATOM 308 N HIS A 22 -9.124 -0.551 -10.618 1.00 0.00 N ATOM 309 CA HIS A 22 -9.390 -0.971 -9.241 1.00 0.00 C ATOM 310 C HIS A 22 -8.064 -1.145 -8.509 1.00 0.00 C ATOM 311 O HIS A 22 -7.799 -0.502 -7.495 1.00 0.00 O ATOM 312 CB HIS A 22 -10.185 -2.283 -9.211 1.00 0.00 C ATOM 313 CG HIS A 22 -10.931 -2.575 -10.479 1.00 0.00 C ATOM 314 ND1 HIS A 22 -12.226 -2.155 -10.707 1.00 0.00 N ATOM 315 CD2 HIS A 22 -10.555 -3.249 -11.591 1.00 0.00 C ATOM 316 CE1 HIS A 22 -12.615 -2.560 -11.903 1.00 0.00 C ATOM 317 NE2 HIS A 22 -11.618 -3.225 -12.460 1.00 0.00 N ATOM 0 HA HIS A 22 -9.988 -0.206 -8.746 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -9.500 -3.106 -9.007 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -10.895 -2.247 -8.384 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -9.598 -3.718 -11.763 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -13.582 -2.379 -12.349 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -11.635 -3.652 -13.386 1.00 0.00 H new ATOM 326 N ILE A 23 -7.226 -1.998 -9.081 1.00 0.00 N ATOM 327 CA ILE A 23 -5.880 -2.271 -8.580 1.00 0.00 C ATOM 328 C ILE A 23 -5.721 -2.111 -7.044 1.00 0.00 C ATOM 329 O ILE A 23 -6.367 -2.829 -6.255 1.00 0.00 O ATOM 330 CB ILE A 23 -4.878 -1.364 -9.335 1.00 0.00 C ATOM 331 CG1 ILE A 23 -5.131 -1.436 -10.845 1.00 0.00 C ATOM 332 CG2 ILE A 23 -3.445 -1.747 -9.020 1.00 0.00 C ATOM 333 CD1 ILE A 23 -5.621 -0.134 -11.436 1.00 0.00 C ATOM 0 H ILE A 23 -7.463 -2.529 -9.919 1.00 0.00 H new ATOM 0 HA ILE A 23 -5.674 -3.324 -8.771 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.032 -0.338 -8.999 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.209 -1.729 -11.346 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.865 -2.216 -11.046 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -2.765 -1.092 -9.565 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.268 -1.644 -7.949 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -3.271 -2.781 -9.319 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.779 -0.257 -12.507 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.560 0.151 -10.961 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.878 0.645 -11.266 1.00 0.00 H new ATOM 345 N HIS A 24 -4.831 -1.198 -6.622 1.00 0.00 N ATOM 346 CA HIS A 24 -4.552 -0.981 -5.207 1.00 0.00 C ATOM 347 C HIS A 24 -5.551 -0.029 -4.550 1.00 0.00 C ATOM 348 O HIS A 24 -5.220 0.638 -3.571 1.00 0.00 O ATOM 349 CB HIS A 24 -3.133 -0.441 -5.021 1.00 0.00 C ATOM 350 CG HIS A 24 -2.162 -0.914 -6.062 1.00 0.00 C ATOM 351 ND1 HIS A 24 -1.369 -0.058 -6.798 1.00 0.00 N ATOM 352 CD2 HIS A 24 -1.856 -2.164 -6.486 1.00 0.00 C ATOM 353 CE1 HIS A 24 -0.620 -0.761 -7.628 1.00 0.00 C ATOM 354 NE2 HIS A 24 -0.895 -2.040 -7.459 1.00 0.00 N ATOM 0 H HIS A 24 -4.294 -0.600 -7.250 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.649 -1.950 -4.717 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.164 0.648 -5.036 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.768 -0.736 -4.037 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -1.362 0.959 -6.714 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -2.288 -3.086 -6.126 1.00 0.00 H new ATOM 0 HE1 HIS A 24 0.097 -0.357 -8.327 1.00 0.00 H new ATOM 363 N TRP A 25 -6.767 0.029 -5.082 1.00 0.00 N ATOM 364 CA TRP A 25 -7.793 0.906 -4.524 1.00 0.00 C ATOM 365 C TRP A 25 -9.184 0.297 -4.618 1.00 0.00 C ATOM 366 O TRP A 25 -10.132 0.841 -4.053 1.00 0.00 O ATOM 367 CB TRP A 25 -7.794 2.250 -5.236 1.00 0.00 C ATOM 368 CG TRP A 25 -7.151 2.200 -6.575 1.00 0.00 C ATOM 369 CD1 TRP A 25 -7.781 2.103 -7.773 1.00 0.00 C ATOM 370 CD2 TRP A 25 -5.751 2.245 -6.855 1.00 0.00 C ATOM 371 NE1 TRP A 25 -6.863 2.091 -8.783 1.00 0.00 N ATOM 372 CE2 TRP A 25 -5.608 2.180 -8.249 1.00 0.00 C ATOM 373 CE3 TRP A 25 -4.611 2.338 -6.063 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -4.365 2.207 -8.870 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.376 2.364 -6.676 1.00 0.00 C ATOM 376 CH2 TRP A 25 -3.260 2.301 -8.070 1.00 0.00 C ATOM 0 H TRP A 25 -7.066 -0.515 -5.891 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.548 1.041 -3.471 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.822 2.596 -5.346 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.276 2.983 -4.618 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -8.851 2.044 -7.907 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -7.079 2.026 -9.778 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -4.692 2.389 -4.987 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -4.275 2.156 -9.945 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -2.484 2.434 -6.071 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -2.279 2.327 -8.522 1.00 0.00 H new ATOM 387 N ARG A 26 -9.313 -0.824 -5.328 1.00 0.00 N ATOM 388 CA ARG A 26 -10.609 -1.484 -5.471 1.00 0.00 C ATOM 389 C ARG A 26 -11.447 -1.343 -4.185 1.00 0.00 C ATOM 390 O ARG A 26 -12.635 -1.034 -4.244 1.00 0.00 O ATOM 391 CB ARG A 26 -10.404 -2.963 -5.806 1.00 0.00 C ATOM 392 CG ARG A 26 -11.624 -3.852 -5.596 1.00 0.00 C ATOM 393 CD ARG A 26 -12.730 -3.522 -6.576 1.00 0.00 C ATOM 394 NE ARG A 26 -13.683 -2.557 -6.026 1.00 0.00 N ATOM 395 CZ ARG A 26 -13.974 -1.383 -6.588 1.00 0.00 C ATOM 396 NH1 ARG A 26 -13.383 -1.007 -7.716 1.00 0.00 N ATOM 397 NH2 ARG A 26 -14.860 -0.579 -6.017 1.00 0.00 N ATOM 0 H ARG A 26 -8.543 -1.290 -5.809 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.153 -1.002 -6.283 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.091 -3.043 -6.847 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -9.586 -3.347 -5.197 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.337 -4.897 -5.709 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.992 -3.731 -4.577 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -12.295 -3.120 -7.491 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.257 -4.436 -6.849 1.00 0.00 H new ATOM 0 HE ARG A 26 -14.156 -2.798 -5.155 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -12.699 -1.618 -8.162 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -13.613 -0.107 -8.137 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -15.318 -0.859 -5.149 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -15.084 0.319 -6.445 1.00 0.00 H new ATOM 411 N THR A 27 -10.808 -1.560 -3.025 1.00 0.00 N ATOM 412 CA THR A 27 -11.488 -1.447 -1.731 1.00 0.00 C ATOM 413 C THR A 27 -10.601 -1.983 -0.610 1.00 0.00 C ATOM 414 O THR A 27 -10.053 -3.080 -0.709 1.00 0.00 O ATOM 415 CB THR A 27 -12.825 -2.198 -1.735 1.00 0.00 C ATOM 416 OG1 THR A 27 -12.856 -3.175 -2.758 1.00 0.00 O ATOM 417 CG2 THR A 27 -14.021 -1.291 -1.928 1.00 0.00 C ATOM 0 H THR A 27 -9.822 -1.814 -2.960 1.00 0.00 H new ATOM 0 HA THR A 27 -11.687 -0.390 -1.557 1.00 0.00 H new ATOM 0 HB THR A 27 -12.894 -2.661 -0.751 1.00 0.00 H new ATOM 0 HG1 THR A 27 -13.718 -3.641 -2.739 1.00 0.00 H new ATOM 0 HG21 THR A 27 -14.934 -1.886 -1.921 1.00 0.00 H new ATOM 0 HG22 THR A 27 -14.058 -0.560 -1.120 1.00 0.00 H new ATOM 0 HG23 THR A 27 -13.934 -0.772 -2.883 1.00 0.00 H new ATOM 425 N LEU A 28 -10.467 -1.203 0.459 1.00 0.00 N ATOM 426 CA LEU A 28 -9.645 -1.599 1.598 1.00 0.00 C ATOM 427 C LEU A 28 -10.295 -2.740 2.377 1.00 0.00 C ATOM 428 O LEU A 28 -9.682 -3.786 2.591 1.00 0.00 O ATOM 429 CB LEU A 28 -9.409 -0.403 2.527 1.00 0.00 C ATOM 430 CG LEU A 28 -8.698 -0.733 3.842 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.944 0.480 4.363 1.00 0.00 C ATOM 432 CD2 LEU A 28 -9.698 -1.224 4.878 1.00 0.00 C ATOM 0 H LEU A 28 -10.917 -0.293 0.560 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.687 -1.948 1.213 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.822 0.343 1.992 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.371 0.054 2.757 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.977 -1.528 3.652 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -7.446 0.225 5.298 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.201 0.789 3.628 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.644 1.297 4.536 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -9.176 -1.454 5.807 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -10.442 -0.449 5.062 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -10.194 -2.122 4.508 1.00 0.00 H new ATOM 444 N GLU A 29 -11.539 -2.531 2.803 1.00 0.00 N ATOM 445 CA GLU A 29 -12.271 -3.540 3.566 1.00 0.00 C ATOM 446 C GLU A 29 -12.157 -4.917 2.916 1.00 0.00 C ATOM 447 O GLU A 29 -11.781 -5.892 3.567 1.00 0.00 O ATOM 448 CB GLU A 29 -13.743 -3.140 3.696 1.00 0.00 C ATOM 449 CG GLU A 29 -14.254 -3.160 5.128 1.00 0.00 C ATOM 450 CD GLU A 29 -15.657 -2.602 5.254 1.00 0.00 C ATOM 451 OE1 GLU A 29 -16.616 -3.319 4.898 1.00 0.00 O ATOM 452 OE2 GLU A 29 -15.798 -1.447 5.707 1.00 0.00 O ATOM 0 H GLU A 29 -12.061 -1.672 2.633 1.00 0.00 H new ATOM 0 HA GLU A 29 -11.826 -3.597 4.560 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -13.877 -2.139 3.285 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.349 -3.816 3.093 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -14.240 -4.184 5.501 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -13.579 -2.582 5.759 1.00 0.00 H new ATOM 459 N ASP A 30 -12.484 -4.990 1.630 1.00 0.00 N ATOM 460 CA ASP A 30 -12.414 -6.248 0.897 1.00 0.00 C ATOM 461 C ASP A 30 -10.971 -6.732 0.776 1.00 0.00 C ATOM 462 O ASP A 30 -10.720 -7.923 0.586 1.00 0.00 O ATOM 463 CB ASP A 30 -13.029 -6.085 -0.495 1.00 0.00 C ATOM 464 CG ASP A 30 -14.481 -6.520 -0.538 1.00 0.00 C ATOM 465 OD1 ASP A 30 -15.360 -5.688 -0.228 1.00 0.00 O ATOM 466 OD2 ASP A 30 -14.740 -7.692 -0.884 1.00 0.00 O ATOM 0 H ASP A 30 -12.799 -4.194 1.075 1.00 0.00 H new ATOM 0 HA ASP A 30 -12.981 -6.995 1.453 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -12.955 -5.042 -0.802 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.455 -6.670 -1.214 1.00 0.00 H new ATOM 471 N GLY A 31 -10.025 -5.804 0.882 1.00 0.00 N ATOM 472 CA GLY A 31 -8.622 -6.157 0.778 1.00 0.00 C ATOM 473 C GLY A 31 -8.175 -7.111 1.870 1.00 0.00 C ATOM 474 O GLY A 31 -7.660 -8.190 1.585 1.00 0.00 O ATOM 0 H GLY A 31 -10.206 -4.812 1.038 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.438 -6.613 -0.195 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.019 -5.250 0.824 1.00 0.00 H new ATOM 478 N LYS A 32 -8.367 -6.711 3.123 1.00 0.00 N ATOM 479 CA LYS A 32 -7.973 -7.540 4.258 1.00 0.00 C ATOM 480 C LYS A 32 -8.855 -8.781 4.365 1.00 0.00 C ATOM 481 O LYS A 32 -8.389 -9.852 4.753 1.00 0.00 O ATOM 482 CB LYS A 32 -8.046 -6.735 5.557 1.00 0.00 C ATOM 483 CG LYS A 32 -9.327 -5.930 5.708 1.00 0.00 C ATOM 484 CD LYS A 32 -9.793 -5.889 7.155 1.00 0.00 C ATOM 485 CE LYS A 32 -10.955 -6.841 7.395 1.00 0.00 C ATOM 486 NZ LYS A 32 -12.262 -6.128 7.412 1.00 0.00 N ATOM 0 H LYS A 32 -8.792 -5.820 3.378 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.945 -7.863 4.095 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -7.955 -7.417 6.402 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -7.194 -6.057 5.602 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -9.164 -4.914 5.348 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -10.108 -6.367 5.086 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -8.964 -6.152 7.813 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.094 -4.874 7.412 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.967 -7.603 6.616 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -10.811 -7.358 8.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -13.028 -6.811 7.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -12.260 -5.418 8.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.412 -5.656 6.498 1.00 0.00 H new ATOM 500 N LYS A 33 -10.129 -8.630 4.019 1.00 0.00 N ATOM 501 CA LYS A 33 -11.072 -9.741 4.079 1.00 0.00 C ATOM 502 C LYS A 33 -10.729 -10.805 3.042 1.00 0.00 C ATOM 503 O LYS A 33 -10.824 -12.002 3.312 1.00 0.00 O ATOM 504 CB LYS A 33 -12.500 -9.237 3.858 1.00 0.00 C ATOM 505 CG LYS A 33 -13.549 -10.024 4.628 1.00 0.00 C ATOM 506 CD LYS A 33 -14.491 -10.764 3.690 1.00 0.00 C ATOM 507 CE LYS A 33 -14.067 -12.211 3.501 1.00 0.00 C ATOM 508 NZ LYS A 33 -15.026 -12.964 2.644 1.00 0.00 N ATOM 0 H LYS A 33 -10.532 -7.751 3.695 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.002 -10.191 5.069 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -12.556 -8.189 4.152 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.732 -9.283 2.794 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -13.057 -10.738 5.289 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.122 -9.346 5.261 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.505 -10.730 4.090 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.513 -10.261 2.723 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.075 -12.243 3.050 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -13.991 -12.697 4.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -14.701 -13.946 2.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -15.967 -12.956 3.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.080 -12.516 1.707 1.00 0.00 H new ATOM 522 N GLU A 34 -10.332 -10.362 1.854 1.00 0.00 N ATOM 523 CA GLU A 34 -9.975 -11.277 0.777 1.00 0.00 C ATOM 524 C GLU A 34 -8.523 -11.728 0.901 1.00 0.00 C ATOM 525 O GLU A 34 -8.165 -12.821 0.462 1.00 0.00 O ATOM 526 CB GLU A 34 -10.197 -10.609 -0.582 1.00 0.00 C ATOM 527 CG GLU A 34 -10.235 -11.592 -1.741 1.00 0.00 C ATOM 528 CD GLU A 34 -11.441 -11.389 -2.638 1.00 0.00 C ATOM 529 OE1 GLU A 34 -11.345 -10.581 -3.588 1.00 0.00 O ATOM 530 OE2 GLU A 34 -12.480 -12.036 -2.393 1.00 0.00 O ATOM 0 H GLU A 34 -10.249 -9.374 1.613 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.617 -12.155 0.854 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.134 -10.053 -0.556 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.402 -9.884 -0.756 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -9.325 -11.487 -2.332 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -10.245 -12.609 -1.350 1.00 0.00 H new ATOM 537 N ALA A 35 -7.692 -10.882 1.501 1.00 0.00 N ATOM 538 CA ALA A 35 -6.281 -11.196 1.681 1.00 0.00 C ATOM 539 C ALA A 35 -6.104 -12.433 2.554 1.00 0.00 C ATOM 540 O ALA A 35 -5.157 -13.198 2.377 1.00 0.00 O ATOM 541 CB ALA A 35 -5.550 -10.009 2.290 1.00 0.00 C ATOM 0 H ALA A 35 -7.972 -9.974 1.871 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.852 -11.409 0.702 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.497 -10.258 2.419 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.641 -9.147 1.629 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.988 -9.770 3.259 1.00 0.00 H new ATOM 547 N ALA A 36 -7.024 -12.623 3.494 1.00 0.00 N ATOM 548 CA ALA A 36 -6.973 -13.768 4.395 1.00 0.00 C ATOM 549 C ALA A 36 -7.123 -15.077 3.627 1.00 0.00 C ATOM 550 O ALA A 36 -6.323 -16.000 3.791 1.00 0.00 O ATOM 551 CB ALA A 36 -8.054 -13.650 5.459 1.00 0.00 C ATOM 0 H ALA A 36 -7.815 -11.998 3.651 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.998 -13.773 4.883 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -8.005 -14.511 6.125 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.900 -12.737 6.034 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -9.033 -13.617 4.981 1.00 0.00 H new ATOM 557 N ALA A 37 -8.152 -15.152 2.789 1.00 0.00 N ATOM 558 CA ALA A 37 -8.408 -16.348 1.996 1.00 0.00 C ATOM 559 C ALA A 37 -7.224 -16.665 1.087 1.00 0.00 C ATOM 560 O ALA A 37 -6.500 -17.636 1.310 1.00 0.00 O ATOM 561 CB ALA A 37 -9.676 -16.174 1.173 1.00 0.00 C ATOM 0 H ALA A 37 -8.822 -14.398 2.642 1.00 0.00 H new ATOM 0 HA ALA A 37 -8.544 -17.186 2.679 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.855 -17.075 0.586 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -10.521 -16.001 1.839 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -9.561 -15.321 0.504 1.00 0.00 H new ATOM 567 N SER A 38 -7.032 -15.839 0.063 1.00 0.00 N ATOM 568 CA SER A 38 -5.935 -16.028 -0.879 1.00 0.00 C ATOM 569 C SER A 38 -4.593 -16.009 -0.156 1.00 0.00 C ATOM 570 O SER A 38 -3.647 -16.687 -0.559 1.00 0.00 O ATOM 571 CB SER A 38 -5.963 -14.940 -1.954 1.00 0.00 C ATOM 572 OG SER A 38 -6.849 -15.285 -3.005 1.00 0.00 O ATOM 0 H SER A 38 -7.623 -15.032 -0.135 1.00 0.00 H new ATOM 0 HA SER A 38 -6.060 -17.001 -1.355 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.271 -13.993 -1.510 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.960 -14.793 -2.353 1.00 0.00 H new ATOM 0 HG SER A 38 -6.850 -14.573 -3.679 1.00 0.00 H new ATOM 578 N GLY A 39 -4.519 -15.226 0.915 1.00 0.00 N ATOM 579 CA GLY A 39 -3.292 -15.130 1.681 1.00 0.00 C ATOM 580 C GLY A 39 -2.280 -14.199 1.044 1.00 0.00 C ATOM 581 O GLY A 39 -1.073 -14.410 1.163 1.00 0.00 O ATOM 0 H GLY A 39 -5.288 -14.656 1.266 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.522 -14.778 2.686 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.853 -16.123 1.784 1.00 0.00 H new ATOM 585 N LEU A 40 -2.768 -13.163 0.369 1.00 0.00 N ATOM 586 CA LEU A 40 -1.888 -12.198 -0.281 1.00 0.00 C ATOM 587 C LEU A 40 -1.867 -10.881 0.489 1.00 0.00 C ATOM 588 O LEU A 40 -2.881 -10.460 1.047 1.00 0.00 O ATOM 589 CB LEU A 40 -2.321 -11.956 -1.731 1.00 0.00 C ATOM 590 CG LEU A 40 -3.800 -11.620 -1.932 1.00 0.00 C ATOM 591 CD1 LEU A 40 -4.119 -10.241 -1.377 1.00 0.00 C ATOM 592 CD2 LEU A 40 -4.164 -11.699 -3.408 1.00 0.00 C ATOM 0 H LEU A 40 -3.764 -12.971 0.258 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.880 -12.614 -0.286 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.723 -11.141 -2.139 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.087 -12.846 -2.315 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.396 -12.352 -1.387 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.176 -10.023 -1.531 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.895 -10.217 -0.311 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.515 -9.493 -1.891 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.219 -11.458 -3.536 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.558 -10.989 -3.971 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.975 -12.708 -3.776 1.00 0.00 H new ATOM 604 N PRO A 41 -0.703 -10.207 0.535 1.00 0.00 N ATOM 605 CA PRO A 41 -0.554 -8.933 1.246 1.00 0.00 C ATOM 606 C PRO A 41 -1.460 -7.847 0.682 1.00 0.00 C ATOM 607 O PRO A 41 -2.064 -8.008 -0.382 1.00 0.00 O ATOM 608 CB PRO A 41 0.919 -8.564 1.032 1.00 0.00 C ATOM 609 CG PRO A 41 1.349 -9.360 -0.152 1.00 0.00 C ATOM 610 CD PRO A 41 0.557 -10.633 -0.097 1.00 0.00 C ATOM 0 HA PRO A 41 -0.833 -9.023 2.296 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.036 -7.495 0.852 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.518 -8.807 1.910 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.156 -8.819 -1.078 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.419 -9.563 -0.119 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.391 -11.049 -1.091 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.064 -11.400 0.489 1.00 0.00 H new ATOM 618 N LEU A 42 -1.554 -6.735 1.393 1.00 0.00 N ATOM 619 CA LEU A 42 -2.387 -5.635 0.946 1.00 0.00 C ATOM 620 C LEU A 42 -1.536 -4.496 0.414 1.00 0.00 C ATOM 621 O LEU A 42 -0.365 -4.349 0.771 1.00 0.00 O ATOM 622 CB LEU A 42 -3.299 -5.130 2.072 1.00 0.00 C ATOM 623 CG LEU A 42 -3.088 -5.769 3.445 1.00 0.00 C ATOM 624 CD1 LEU A 42 -3.621 -4.858 4.536 1.00 0.00 C ATOM 625 CD2 LEU A 42 -3.768 -7.130 3.504 1.00 0.00 C ATOM 0 H LEU A 42 -1.067 -6.572 2.275 1.00 0.00 H new ATOM 0 HA LEU A 42 -3.017 -6.009 0.139 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.160 -4.053 2.169 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -4.335 -5.292 1.774 1.00 0.00 H new ATOM 0 HG LEU A 42 -2.019 -5.911 3.605 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.465 -5.325 5.508 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.095 -3.904 4.503 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -4.687 -4.690 4.381 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -3.610 -7.574 4.487 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.837 -7.011 3.328 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -3.345 -7.782 2.740 1.00 0.00 H new ATOM 637 N MET A 43 -2.141 -3.695 -0.444 1.00 0.00 N ATOM 638 CA MET A 43 -1.463 -2.561 -1.036 1.00 0.00 C ATOM 639 C MET A 43 -2.033 -1.266 -0.468 1.00 0.00 C ATOM 640 O MET A 43 -2.885 -0.622 -1.083 1.00 0.00 O ATOM 641 CB MET A 43 -1.602 -2.609 -2.562 1.00 0.00 C ATOM 642 CG MET A 43 -0.678 -1.644 -3.293 1.00 0.00 C ATOM 643 SD MET A 43 1.040 -1.768 -2.757 1.00 0.00 S ATOM 644 CE MET A 43 1.519 -3.323 -3.504 1.00 0.00 C ATOM 0 H MET A 43 -3.108 -3.812 -0.747 1.00 0.00 H new ATOM 0 HA MET A 43 -0.401 -2.601 -0.792 1.00 0.00 H new ATOM 0 HB2 MET A 43 -1.397 -3.623 -2.905 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.634 -2.384 -2.831 1.00 0.00 H new ATOM 0 HG2 MET A 43 -0.733 -1.838 -4.364 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.029 -0.624 -3.135 1.00 0.00 H new ATOM 0 HE1 MET A 43 2.590 -3.315 -3.705 1.00 0.00 H new ATOM 0 HE2 MET A 43 1.283 -4.141 -2.824 1.00 0.00 H new ATOM 0 HE3 MET A 43 0.975 -3.460 -4.439 1.00 0.00 H new ATOM 654 N VAL A 44 -1.565 -0.910 0.730 1.00 0.00 N ATOM 655 CA VAL A 44 -2.028 0.290 1.416 1.00 0.00 C ATOM 656 C VAL A 44 -1.379 1.543 0.848 1.00 0.00 C ATOM 657 O VAL A 44 -0.351 2.001 1.341 1.00 0.00 O ATOM 658 CB VAL A 44 -1.744 0.223 2.930 1.00 0.00 C ATOM 659 CG1 VAL A 44 -2.130 1.527 3.618 1.00 0.00 C ATOM 660 CG2 VAL A 44 -2.482 -0.947 3.558 1.00 0.00 C ATOM 0 H VAL A 44 -0.862 -1.441 1.244 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.105 0.340 1.256 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.673 0.073 3.066 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.919 1.452 4.685 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.554 2.348 3.191 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -3.194 1.715 3.471 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -2.270 -0.979 4.627 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.554 -0.826 3.404 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -2.152 -1.877 3.094 1.00 0.00 H new ATOM 670 N ILE A 45 -1.997 2.103 -0.180 1.00 0.00 N ATOM 671 CA ILE A 45 -1.489 3.315 -0.800 1.00 0.00 C ATOM 672 C ILE A 45 -2.269 4.524 -0.308 1.00 0.00 C ATOM 673 O ILE A 45 -3.477 4.614 -0.498 1.00 0.00 O ATOM 674 CB ILE A 45 -1.577 3.243 -2.336 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.904 1.962 -2.839 1.00 0.00 C ATOM 676 CG2 ILE A 45 -0.946 4.479 -2.967 1.00 0.00 C ATOM 677 CD1 ILE A 45 -0.685 1.926 -4.338 1.00 0.00 C ATOM 0 H ILE A 45 -2.851 1.737 -0.602 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.441 3.413 -0.518 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.626 3.218 -2.630 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.058 1.849 -2.339 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -1.515 1.106 -2.551 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.018 4.410 -4.052 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.471 5.371 -2.624 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.103 4.541 -2.676 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.204 0.987 -4.613 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.645 2.005 -4.848 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.048 2.760 -4.633 1.00 0.00 H new ATOM 689 N ILE A 46 -1.581 5.454 0.334 1.00 0.00 N ATOM 690 CA ILE A 46 -2.235 6.645 0.844 1.00 0.00 C ATOM 691 C ILE A 46 -1.543 7.882 0.306 1.00 0.00 C ATOM 692 O ILE A 46 -0.321 7.996 0.366 1.00 0.00 O ATOM 693 CB ILE A 46 -2.247 6.671 2.382 1.00 0.00 C ATOM 694 CG1 ILE A 46 -2.622 5.295 2.933 1.00 0.00 C ATOM 695 CG2 ILE A 46 -3.218 7.720 2.897 1.00 0.00 C ATOM 696 CD1 ILE A 46 -1.704 4.828 4.036 1.00 0.00 C ATOM 0 H ILE A 46 -0.578 5.407 0.513 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.271 6.631 0.506 1.00 0.00 H new ATOM 0 HB ILE A 46 -1.245 6.930 2.725 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.645 5.327 3.309 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.604 4.568 2.121 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -3.209 7.720 3.987 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.919 8.703 2.532 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.223 7.491 2.542 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.024 3.846 4.384 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.684 4.765 3.658 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.741 5.536 4.864 1.00 0.00 H new ATOM 708 N HIS A 47 -2.328 8.793 -0.247 1.00 0.00 N ATOM 709 CA HIS A 47 -1.777 10.008 -0.825 1.00 0.00 C ATOM 710 C HIS A 47 -2.574 11.235 -0.415 1.00 0.00 C ATOM 711 O HIS A 47 -3.752 11.361 -0.748 1.00 0.00 O ATOM 712 CB HIS A 47 -1.754 9.893 -2.348 1.00 0.00 C ATOM 713 CG HIS A 47 -3.091 9.560 -2.942 1.00 0.00 C ATOM 714 ND1 HIS A 47 -3.665 10.295 -3.959 1.00 0.00 N ATOM 715 CD2 HIS A 47 -3.968 8.568 -2.656 1.00 0.00 C ATOM 716 CE1 HIS A 47 -4.835 9.768 -4.272 1.00 0.00 C ATOM 717 NE2 HIS A 47 -5.043 8.719 -3.497 1.00 0.00 N ATOM 0 H HIS A 47 -3.343 8.715 -0.308 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.761 10.126 -0.448 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -1.402 10.834 -2.770 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.036 9.125 -2.636 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -3.251 11.116 -4.400 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.845 7.801 -1.906 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -5.508 10.133 -5.033 1.00 0.00 H new ATOM 726 N LYS A 48 -1.924 12.144 0.301 1.00 0.00 N ATOM 727 CA LYS A 48 -2.589 13.369 0.739 1.00 0.00 C ATOM 728 C LYS A 48 -1.834 14.606 0.259 1.00 0.00 C ATOM 729 O LYS A 48 -0.721 14.505 -0.256 1.00 0.00 O ATOM 730 CB LYS A 48 -2.735 13.392 2.262 1.00 0.00 C ATOM 731 CG LYS A 48 -4.175 13.315 2.738 1.00 0.00 C ATOM 732 CD LYS A 48 -4.276 12.649 4.100 1.00 0.00 C ATOM 733 CE LYS A 48 -5.348 13.300 4.958 1.00 0.00 C ATOM 734 NZ LYS A 48 -4.809 14.438 5.754 1.00 0.00 N ATOM 0 H LYS A 48 -0.949 12.060 0.589 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.584 13.384 0.295 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.177 12.556 2.684 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -2.282 14.305 2.648 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.596 14.319 2.791 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.769 12.757 2.014 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.503 11.590 3.973 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.314 12.710 4.609 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.157 13.655 4.320 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.775 12.557 5.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.572 14.854 6.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.054 14.096 6.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.424 15.160 5.111 1.00 0.00 H new ATOM 748 N SER A 49 -2.454 15.774 0.424 1.00 0.00 N ATOM 749 CA SER A 49 -1.847 17.034 -0.002 1.00 0.00 C ATOM 750 C SER A 49 -1.840 17.137 -1.525 1.00 0.00 C ATOM 751 O SER A 49 -2.570 16.413 -2.203 1.00 0.00 O ATOM 752 CB SER A 49 -0.421 17.155 0.544 1.00 0.00 C ATOM 753 OG SER A 49 0.040 18.492 0.478 1.00 0.00 O ATOM 0 H SER A 49 -3.376 15.874 0.849 1.00 0.00 H new ATOM 0 HA SER A 49 -2.443 17.854 0.399 1.00 0.00 H new ATOM 0 HB2 SER A 49 -0.394 16.809 1.577 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.246 16.509 -0.027 1.00 0.00 H new ATOM 0 HG SER A 49 0.752 18.560 -0.192 1.00 0.00 H new ATOM 759 N TRP A 50 -1.011 18.034 -2.061 1.00 0.00 N ATOM 760 CA TRP A 50 -0.913 18.217 -3.509 1.00 0.00 C ATOM 761 C TRP A 50 -0.821 16.869 -4.217 1.00 0.00 C ATOM 762 O TRP A 50 -1.566 16.594 -5.159 1.00 0.00 O ATOM 763 CB TRP A 50 0.308 19.072 -3.855 1.00 0.00 C ATOM 764 CG TRP A 50 1.562 18.615 -3.172 1.00 0.00 C ATOM 765 CD1 TRP A 50 1.987 18.962 -1.923 1.00 0.00 C ATOM 766 CD2 TRP A 50 2.552 17.726 -3.703 1.00 0.00 C ATOM 767 NE1 TRP A 50 3.182 18.344 -1.643 1.00 0.00 N ATOM 768 CE2 TRP A 50 3.549 17.580 -2.721 1.00 0.00 C ATOM 769 CE3 TRP A 50 2.692 17.039 -4.912 1.00 0.00 C ATOM 770 CZ2 TRP A 50 4.670 16.776 -2.909 1.00 0.00 C ATOM 771 CZ3 TRP A 50 3.806 16.240 -5.100 1.00 0.00 C ATOM 772 CH2 TRP A 50 4.781 16.114 -4.103 1.00 0.00 C ATOM 0 H TRP A 50 -0.400 18.643 -1.516 1.00 0.00 H new ATOM 0 HA TRP A 50 -1.813 18.729 -3.850 1.00 0.00 H new ATOM 0 HB2 TRP A 50 0.462 19.054 -4.934 1.00 0.00 H new ATOM 0 HB3 TRP A 50 0.108 20.107 -3.579 1.00 0.00 H new ATOM 0 HD1 TRP A 50 1.461 19.625 -1.252 1.00 0.00 H new ATOM 0 HE1 TRP A 50 3.710 18.438 -0.775 1.00 0.00 H new ATOM 0 HE3 TRP A 50 1.944 17.130 -5.686 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 5.424 16.678 -2.142 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 3.925 15.705 -6.031 1.00 0.00 H new ATOM 0 HH2 TRP A 50 5.639 15.482 -4.279 1.00 0.00 H new ATOM 783 N CYS A 51 0.087 16.028 -3.737 1.00 0.00 N ATOM 784 CA CYS A 51 0.278 14.696 -4.295 1.00 0.00 C ATOM 785 C CYS A 51 0.705 14.745 -5.761 1.00 0.00 C ATOM 786 O CYS A 51 0.095 15.435 -6.578 1.00 0.00 O ATOM 787 CB CYS A 51 -1.011 13.878 -4.170 1.00 0.00 C ATOM 788 SG CYS A 51 -0.911 12.208 -4.897 1.00 0.00 S ATOM 0 H CYS A 51 0.706 16.248 -2.957 1.00 0.00 H new ATOM 0 HA CYS A 51 1.076 14.221 -3.725 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -1.270 13.788 -3.115 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -1.822 14.424 -4.652 1.00 0.00 H new ATOM 793 N GLY A 52 1.739 13.978 -6.086 1.00 0.00 N ATOM 794 CA GLY A 52 2.222 13.904 -7.454 1.00 0.00 C ATOM 795 C GLY A 52 2.221 12.478 -7.949 1.00 0.00 C ATOM 796 O GLY A 52 1.895 12.209 -9.104 1.00 0.00 O ATOM 0 H GLY A 52 2.256 13.402 -5.422 1.00 0.00 H new ATOM 0 HA2 GLY A 52 1.594 14.518 -8.099 1.00 0.00 H new ATOM 0 HA3 GLY A 52 3.231 14.312 -7.510 1.00 0.00 H new ATOM 800 N ALA A 53 2.570 11.557 -7.054 1.00 0.00 N ATOM 801 CA ALA A 53 2.592 10.139 -7.380 1.00 0.00 C ATOM 802 C ALA A 53 1.268 9.712 -7.962 1.00 0.00 C ATOM 803 O ALA A 53 1.201 8.764 -8.740 1.00 0.00 O ATOM 804 CB ALA A 53 2.929 9.316 -6.146 1.00 0.00 C ATOM 0 H ALA A 53 2.842 11.772 -6.095 1.00 0.00 H new ATOM 0 HA ALA A 53 3.366 9.966 -8.128 1.00 0.00 H new ATOM 0 HB1 ALA A 53 2.941 8.258 -6.407 1.00 0.00 H new ATOM 0 HB2 ALA A 53 3.909 9.609 -5.770 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.178 9.491 -5.376 1.00 0.00 H new ATOM 810 N CYS A 54 0.217 10.424 -7.595 1.00 0.00 N ATOM 811 CA CYS A 54 -1.098 10.114 -8.104 1.00 0.00 C ATOM 812 C CYS A 54 -1.279 10.713 -9.491 1.00 0.00 C ATOM 813 O CYS A 54 -1.859 10.087 -10.382 1.00 0.00 O ATOM 814 CB CYS A 54 -2.187 10.615 -7.149 1.00 0.00 C ATOM 815 SG CYS A 54 -1.982 12.349 -6.619 1.00 0.00 S ATOM 0 H CYS A 54 0.252 11.214 -6.951 1.00 0.00 H new ATOM 0 HA CYS A 54 -1.192 9.031 -8.178 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -3.157 10.508 -7.635 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -2.201 9.977 -6.266 1.00 0.00 H new ATOM 820 N LYS A 55 -0.758 11.923 -9.678 1.00 0.00 N ATOM 821 CA LYS A 55 -0.844 12.593 -10.968 1.00 0.00 C ATOM 822 C LYS A 55 -0.086 11.788 -12.014 1.00 0.00 C ATOM 823 O LYS A 55 -0.580 11.557 -13.117 1.00 0.00 O ATOM 824 CB LYS A 55 -0.272 14.009 -10.875 1.00 0.00 C ATOM 825 CG LYS A 55 -1.307 15.060 -10.511 1.00 0.00 C ATOM 826 CD LYS A 55 -0.695 16.186 -9.695 1.00 0.00 C ATOM 827 CE LYS A 55 -1.605 17.402 -9.654 1.00 0.00 C ATOM 828 NZ LYS A 55 -1.769 18.020 -10.999 1.00 0.00 N ATOM 0 H LYS A 55 -0.274 12.456 -8.955 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.892 12.664 -11.260 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.524 14.022 -10.131 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.181 14.273 -11.831 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -1.749 15.467 -11.420 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -2.114 14.596 -9.944 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -0.504 15.839 -8.680 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.268 16.465 -10.123 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -2.582 17.111 -9.267 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -1.195 18.139 -8.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -2.063 19.012 -10.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -0.865 17.980 -11.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -2.494 17.500 -11.534 1.00 0.00 H new ATOM 842 N ALA A 56 1.115 11.350 -11.648 1.00 0.00 N ATOM 843 CA ALA A 56 1.944 10.551 -12.541 1.00 0.00 C ATOM 844 C ALA A 56 1.298 9.202 -12.846 1.00 0.00 C ATOM 845 O ALA A 56 1.718 8.508 -13.763 1.00 0.00 O ATOM 846 CB ALA A 56 3.327 10.349 -11.939 1.00 0.00 C ATOM 0 H ALA A 56 1.535 11.536 -10.737 1.00 0.00 H new ATOM 0 HA ALA A 56 2.041 11.095 -13.481 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.935 9.750 -12.617 1.00 0.00 H new ATOM 0 HB2 ALA A 56 3.802 11.318 -11.785 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.236 9.834 -10.983 1.00 0.00 H new ATOM 852 N LEU A 57 0.285 8.826 -12.070 1.00 0.00 N ATOM 853 CA LEU A 57 -0.389 7.547 -12.276 1.00 0.00 C ATOM 854 C LEU A 57 -1.471 7.639 -13.352 1.00 0.00 C ATOM 855 O LEU A 57 -1.726 6.676 -14.071 1.00 0.00 O ATOM 856 CB LEU A 57 -1.021 7.053 -10.968 1.00 0.00 C ATOM 857 CG LEU A 57 -0.051 6.577 -9.872 1.00 0.00 C ATOM 858 CD1 LEU A 57 -0.442 5.194 -9.366 1.00 0.00 C ATOM 859 CD2 LEU A 57 1.391 6.575 -10.367 1.00 0.00 C ATOM 0 H LEU A 57 -0.085 9.383 -11.299 1.00 0.00 H new ATOM 0 HA LEU A 57 0.370 6.839 -12.610 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.630 7.859 -10.558 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.697 6.232 -11.205 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.120 7.282 -9.044 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.258 4.878 -8.592 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.450 5.230 -8.952 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.414 4.483 -10.192 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.049 6.234 -9.568 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.481 5.906 -11.222 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.675 7.584 -10.665 1.00 0.00 H new ATOM 871 N LYS A 58 -2.128 8.784 -13.445 1.00 0.00 N ATOM 872 CA LYS A 58 -3.203 8.965 -14.417 1.00 0.00 C ATOM 873 C LYS A 58 -2.844 8.426 -15.814 1.00 0.00 C ATOM 874 O LYS A 58 -3.314 7.353 -16.204 1.00 0.00 O ATOM 875 CB LYS A 58 -3.611 10.438 -14.493 1.00 0.00 C ATOM 876 CG LYS A 58 -4.750 10.802 -13.553 1.00 0.00 C ATOM 877 CD LYS A 58 -5.311 12.180 -13.866 1.00 0.00 C ATOM 878 CE LYS A 58 -4.463 13.280 -13.247 1.00 0.00 C ATOM 879 NZ LYS A 58 -5.073 14.624 -13.436 1.00 0.00 N ATOM 0 H LYS A 58 -1.940 9.601 -12.864 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.050 8.376 -14.066 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.746 11.059 -14.260 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.906 10.673 -15.516 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.543 10.058 -13.635 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.395 10.778 -12.523 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.357 12.319 -14.946 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.332 12.252 -13.492 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.337 13.085 -12.182 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -3.469 13.267 -13.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.464 15.346 -13.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.170 14.821 -14.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.011 14.646 -12.988 1.00 0.00 H new ATOM 893 N PRO A 59 -2.014 9.149 -16.590 1.00 0.00 N ATOM 894 CA PRO A 59 -1.634 8.723 -17.944 1.00 0.00 C ATOM 895 C PRO A 59 -0.610 7.598 -17.968 1.00 0.00 C ATOM 896 O PRO A 59 -0.478 6.894 -18.968 1.00 0.00 O ATOM 897 CB PRO A 59 -1.033 9.989 -18.545 1.00 0.00 C ATOM 898 CG PRO A 59 -0.458 10.710 -17.378 1.00 0.00 C ATOM 899 CD PRO A 59 -1.382 10.431 -16.224 1.00 0.00 C ATOM 0 HA PRO A 59 -2.490 8.320 -18.485 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.267 9.754 -19.285 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -1.791 10.589 -19.050 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.552 10.361 -17.163 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -0.391 11.780 -17.575 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.837 10.356 -15.283 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -2.121 11.222 -16.102 1.00 0.00 H new ATOM 907 N LYS A 60 0.122 7.433 -16.876 1.00 0.00 N ATOM 908 CA LYS A 60 1.135 6.392 -16.809 1.00 0.00 C ATOM 909 C LYS A 60 0.587 5.135 -16.152 1.00 0.00 C ATOM 910 O LYS A 60 0.591 4.062 -16.756 1.00 0.00 O ATOM 911 CB LYS A 60 2.368 6.897 -16.057 1.00 0.00 C ATOM 912 CG LYS A 60 3.097 5.823 -15.266 1.00 0.00 C ATOM 913 CD LYS A 60 3.932 4.940 -16.179 1.00 0.00 C ATOM 914 CE LYS A 60 5.000 5.749 -16.897 1.00 0.00 C ATOM 915 NZ LYS A 60 4.812 5.730 -18.373 1.00 0.00 N ATOM 0 H LYS A 60 0.035 8.000 -16.033 1.00 0.00 H new ATOM 0 HA LYS A 60 1.427 6.137 -17.828 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.061 7.339 -16.773 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.064 7.692 -15.375 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.740 6.290 -14.520 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.374 5.212 -14.726 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.402 4.149 -15.594 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.286 4.455 -16.911 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.976 6.779 -16.541 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.984 5.350 -16.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.560 6.293 -18.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.861 4.750 -18.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.884 6.134 -18.610 1.00 0.00 H new ATOM 929 N PHE A 61 0.111 5.260 -14.914 1.00 0.00 N ATOM 930 CA PHE A 61 -0.431 4.113 -14.214 1.00 0.00 C ATOM 931 C PHE A 61 -1.564 3.511 -15.019 1.00 0.00 C ATOM 932 O PHE A 61 -1.887 2.339 -14.858 1.00 0.00 O ATOM 933 CB PHE A 61 -0.889 4.464 -12.806 1.00 0.00 C ATOM 934 CG PHE A 61 -1.068 3.248 -11.945 1.00 0.00 C ATOM 935 CD1 PHE A 61 -2.246 2.522 -11.984 1.00 0.00 C ATOM 936 CD2 PHE A 61 -0.049 2.820 -11.107 1.00 0.00 C ATOM 937 CE1 PHE A 61 -2.407 1.393 -11.204 1.00 0.00 C ATOM 938 CE2 PHE A 61 -0.205 1.693 -10.323 1.00 0.00 C ATOM 939 CZ PHE A 61 -1.385 0.978 -10.373 1.00 0.00 C ATOM 0 H PHE A 61 0.092 6.133 -14.387 1.00 0.00 H new ATOM 0 HA PHE A 61 0.365 3.376 -14.109 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.159 5.129 -12.344 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.830 5.011 -12.858 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.049 2.842 -12.632 1.00 0.00 H new ATOM 0 HD2 PHE A 61 0.877 3.374 -11.067 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.331 0.836 -11.244 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.595 1.372 -9.672 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.509 0.095 -9.763 1.00 0.00 H new ATOM 949 N ALA A 62 -2.135 4.295 -15.935 1.00 0.00 N ATOM 950 CA ALA A 62 -3.174 3.774 -16.802 1.00 0.00 C ATOM 951 C ALA A 62 -2.625 2.537 -17.530 1.00 0.00 C ATOM 952 O ALA A 62 -3.375 1.681 -17.998 1.00 0.00 O ATOM 953 CB ALA A 62 -3.627 4.847 -17.781 1.00 0.00 C ATOM 0 H ALA A 62 -1.896 5.275 -16.089 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.047 3.482 -16.218 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -4.407 4.444 -18.427 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.018 5.702 -17.229 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.781 5.165 -18.390 1.00 0.00 H new ATOM 959 N GLU A 63 -1.286 2.455 -17.572 1.00 0.00 N ATOM 960 CA GLU A 63 -0.560 1.342 -18.178 1.00 0.00 C ATOM 961 C GLU A 63 -0.605 0.121 -17.269 1.00 0.00 C ATOM 962 O GLU A 63 -0.290 -0.997 -17.684 1.00 0.00 O ATOM 963 CB GLU A 63 0.895 1.753 -18.433 1.00 0.00 C ATOM 964 CG GLU A 63 1.538 1.026 -19.602 1.00 0.00 C ATOM 965 CD GLU A 63 2.262 1.963 -20.548 1.00 0.00 C ATOM 966 OE1 GLU A 63 1.596 2.831 -21.149 1.00 0.00 O ATOM 967 OE2 GLU A 63 3.498 1.829 -20.687 1.00 0.00 O ATOM 0 H GLU A 63 -0.675 3.171 -17.180 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.033 1.086 -19.126 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.933 2.826 -18.619 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.480 1.564 -17.533 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.242 0.286 -19.221 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.770 0.482 -20.153 1.00 0.00 H new ATOM 974 N SER A 64 -1.007 0.348 -16.024 1.00 0.00 N ATOM 975 CA SER A 64 -1.111 -0.708 -15.035 1.00 0.00 C ATOM 976 C SER A 64 -2.046 -1.825 -15.486 1.00 0.00 C ATOM 977 O SER A 64 -2.307 -2.751 -14.722 1.00 0.00 O ATOM 978 CB SER A 64 -1.607 -0.127 -13.719 1.00 0.00 C ATOM 979 OG SER A 64 -0.602 0.652 -13.095 1.00 0.00 O ATOM 0 H SER A 64 -1.269 1.270 -15.676 1.00 0.00 H new ATOM 0 HA SER A 64 -0.118 -1.140 -14.906 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.489 0.488 -13.899 1.00 0.00 H new ATOM 0 HB3 SER A 64 -1.912 -0.934 -13.053 1.00 0.00 H new ATOM 0 HG SER A 64 -0.984 1.121 -12.324 1.00 0.00 H new ATOM 985 N THR A 65 -2.541 -1.761 -16.724 1.00 0.00 N ATOM 986 CA THR A 65 -3.414 -2.807 -17.235 1.00 0.00 C ATOM 987 C THR A 65 -2.793 -4.159 -16.917 1.00 0.00 C ATOM 988 O THR A 65 -3.484 -5.105 -16.541 1.00 0.00 O ATOM 989 CB THR A 65 -3.617 -2.652 -18.742 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.352 -1.321 -19.148 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.018 -3.000 -19.193 1.00 0.00 C ATOM 0 H THR A 65 -2.352 -1.003 -17.380 1.00 0.00 H new ATOM 0 HA THR A 65 -4.392 -2.731 -16.759 1.00 0.00 H new ATOM 0 HB THR A 65 -2.920 -3.351 -19.203 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.486 -1.241 -20.116 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.096 -2.869 -20.272 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.236 -4.037 -18.937 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.734 -2.345 -18.696 1.00 0.00 H new ATOM 999 N GLU A 66 -1.468 -4.215 -17.023 1.00 0.00 N ATOM 1000 CA GLU A 66 -0.735 -5.425 -16.696 1.00 0.00 C ATOM 1001 C GLU A 66 -0.581 -5.511 -15.193 1.00 0.00 C ATOM 1002 O GLU A 66 -0.604 -6.598 -14.617 1.00 0.00 O ATOM 1003 CB GLU A 66 0.636 -5.451 -17.372 1.00 0.00 C ATOM 1004 CG GLU A 66 0.867 -6.694 -18.215 1.00 0.00 C ATOM 1005 CD GLU A 66 2.326 -7.100 -18.270 1.00 0.00 C ATOM 1006 OE1 GLU A 66 2.857 -7.552 -17.235 1.00 0.00 O ATOM 1007 OE2 GLU A 66 2.939 -6.964 -19.351 1.00 0.00 O ATOM 0 H GLU A 66 -0.885 -3.437 -17.332 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.294 -6.285 -17.065 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.739 -4.568 -18.003 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.411 -5.389 -16.608 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.280 -7.518 -17.809 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.506 -6.514 -19.227 1.00 0.00 H new ATOM 1014 N ILE A 67 -0.461 -4.352 -14.551 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.352 -4.325 -13.107 1.00 0.00 C ATOM 1016 C ILE A 67 -1.665 -4.791 -12.488 1.00 0.00 C ATOM 1017 O ILE A 67 -1.713 -5.156 -11.313 1.00 0.00 O ATOM 1018 CB ILE A 67 0.010 -2.925 -12.577 1.00 0.00 C ATOM 1019 CG1 ILE A 67 1.283 -2.415 -13.252 1.00 0.00 C ATOM 1020 CG2 ILE A 67 0.181 -2.955 -11.065 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.600 -0.970 -12.929 1.00 0.00 C ATOM 0 H ILE A 67 -0.438 -3.438 -15.003 1.00 0.00 H new ATOM 0 HA ILE A 67 0.456 -4.999 -12.823 1.00 0.00 H new ATOM 0 HB ILE A 67 -0.805 -2.242 -12.815 1.00 0.00 H new ATOM 0 HG12 ILE A 67 2.122 -3.040 -12.947 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.181 -2.524 -14.332 1.00 0.00 H new ATOM 0 HG21 ILE A 67 0.437 -1.957 -10.708 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -0.750 -3.279 -10.600 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.979 -3.650 -10.803 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.516 -0.675 -13.441 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.778 -0.335 -13.260 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.734 -0.859 -11.853 1.00 0.00 H new ATOM 1033 N SER A 68 -2.728 -4.808 -13.299 1.00 0.00 N ATOM 1034 CA SER A 68 -4.025 -5.268 -12.834 1.00 0.00 C ATOM 1035 C SER A 68 -3.931 -6.749 -12.501 1.00 0.00 C ATOM 1036 O SER A 68 -4.559 -7.233 -11.561 1.00 0.00 O ATOM 1037 CB SER A 68 -5.096 -5.032 -13.900 1.00 0.00 C ATOM 1038 OG SER A 68 -6.349 -4.736 -13.308 1.00 0.00 O ATOM 0 H SER A 68 -2.709 -4.509 -14.274 1.00 0.00 H new ATOM 0 HA SER A 68 -4.309 -4.707 -11.944 1.00 0.00 H new ATOM 0 HB2 SER A 68 -4.793 -4.210 -14.548 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.188 -5.917 -14.530 1.00 0.00 H new ATOM 0 HG SER A 68 -7.016 -4.588 -14.011 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.109 -7.455 -13.274 1.00 0.00 N ATOM 1045 CA GLU A 69 -2.887 -8.875 -13.061 1.00 0.00 C ATOM 1046 C GLU A 69 -1.871 -9.066 -11.946 1.00 0.00 C ATOM 1047 O GLU A 69 -2.046 -9.908 -11.064 1.00 0.00 O ATOM 1048 CB GLU A 69 -2.396 -9.543 -14.346 1.00 0.00 C ATOM 1049 CG GLU A 69 -3.181 -9.135 -15.582 1.00 0.00 C ATOM 1050 CD GLU A 69 -4.658 -9.458 -15.466 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -5.315 -8.908 -14.557 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -5.157 -10.258 -16.285 1.00 0.00 O ATOM 0 H GLU A 69 -2.586 -7.061 -14.056 1.00 0.00 H new ATOM 0 HA GLU A 69 -3.829 -9.342 -12.775 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.345 -9.296 -14.495 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.455 -10.625 -14.229 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.059 -8.065 -15.749 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.769 -9.643 -16.454 1.00 0.00 H new ATOM 1059 N LEU A 70 -0.815 -8.258 -11.983 1.00 0.00 N ATOM 1060 CA LEU A 70 0.225 -8.316 -10.961 1.00 0.00 C ATOM 1061 C LEU A 70 -0.368 -8.014 -9.590 1.00 0.00 C ATOM 1062 O LEU A 70 0.183 -8.404 -8.561 1.00 0.00 O ATOM 1063 CB LEU A 70 1.340 -7.318 -11.268 1.00 0.00 C ATOM 1064 CG LEU A 70 2.411 -7.817 -12.236 1.00 0.00 C ATOM 1065 CD1 LEU A 70 1.776 -8.258 -13.545 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.455 -6.737 -12.477 1.00 0.00 C ATOM 0 H LEU A 70 -0.657 -7.557 -12.707 1.00 0.00 H new ATOM 0 HA LEU A 70 0.645 -9.322 -10.959 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.893 -6.414 -11.681 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.822 -7.037 -10.332 1.00 0.00 H new ATOM 0 HG LEU A 70 2.910 -8.678 -11.791 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.551 -8.611 -14.225 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.068 -9.064 -13.353 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.253 -7.416 -13.998 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.211 -7.109 -13.169 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.975 -5.856 -12.903 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.928 -6.471 -11.532 1.00 0.00 H new ATOM 1078 N SER A 71 -1.498 -7.314 -9.584 1.00 0.00 N ATOM 1079 CA SER A 71 -2.170 -6.958 -8.345 1.00 0.00 C ATOM 1080 C SER A 71 -2.656 -8.196 -7.605 1.00 0.00 C ATOM 1081 O SER A 71 -2.909 -8.147 -6.405 1.00 0.00 O ATOM 1082 CB SER A 71 -3.362 -6.057 -8.628 1.00 0.00 C ATOM 1083 OG SER A 71 -3.298 -4.863 -7.866 1.00 0.00 O ATOM 0 H SER A 71 -1.966 -6.983 -10.427 1.00 0.00 H new ATOM 0 HA SER A 71 -1.447 -6.432 -7.722 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.391 -5.812 -9.690 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.285 -6.589 -8.398 1.00 0.00 H new ATOM 0 HG SER A 71 -4.206 -4.545 -7.679 1.00 0.00 H new ATOM 1089 N HIS A 72 -2.779 -9.310 -8.321 1.00 0.00 N ATOM 1090 CA HIS A 72 -3.226 -10.556 -7.710 1.00 0.00 C ATOM 1091 C HIS A 72 -2.278 -10.958 -6.588 1.00 0.00 C ATOM 1092 O HIS A 72 -2.593 -11.815 -5.762 1.00 0.00 O ATOM 1093 CB HIS A 72 -3.305 -11.667 -8.759 1.00 0.00 C ATOM 1094 CG HIS A 72 -4.605 -11.697 -9.500 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -5.653 -12.521 -9.149 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -5.028 -10.995 -10.577 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -6.663 -12.326 -9.979 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -6.308 -11.403 -10.854 1.00 0.00 N ATOM 0 H HIS A 72 -2.577 -9.375 -9.319 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.221 -10.402 -7.293 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -2.492 -11.540 -9.473 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -3.152 -12.629 -8.270 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -4.462 -10.251 -11.118 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -7.615 -12.834 -9.947 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -6.891 -11.050 -11.613 1.00 0.00 H new ATOM 1107 N ASN A 73 -1.112 -10.323 -6.575 1.00 0.00 N ATOM 1108 CA ASN A 73 -0.096 -10.589 -5.573 1.00 0.00 C ATOM 1109 C ASN A 73 -0.457 -9.941 -4.234 1.00 0.00 C ATOM 1110 O ASN A 73 -0.030 -10.397 -3.174 1.00 0.00 O ATOM 1111 CB ASN A 73 1.242 -10.075 -6.083 1.00 0.00 C ATOM 1112 CG ASN A 73 1.782 -10.935 -7.208 1.00 0.00 C ATOM 1113 OD1 ASN A 73 2.633 -11.797 -6.991 1.00 0.00 O ATOM 1114 ND2 ASN A 73 1.289 -10.705 -8.423 1.00 0.00 N ATOM 0 H ASN A 73 -0.848 -9.612 -7.258 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.032 -11.664 -5.401 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.128 -9.049 -6.432 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.960 -10.055 -5.263 1.00 0.00 H new ATOM 0 HD21 ASN A 73 1.616 -11.254 -9.218 1.00 0.00 H new ATOM 0 HD22 ASN A 73 0.584 -9.980 -8.559 1.00 0.00 H new ATOM 1121 N PHE A 74 -1.252 -8.878 -4.302 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.706 -8.144 -3.127 1.00 0.00 C ATOM 1123 C PHE A 74 -3.121 -7.636 -3.385 1.00 0.00 C ATOM 1124 O PHE A 74 -3.808 -8.171 -4.254 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.753 -6.988 -2.825 1.00 0.00 C ATOM 1126 CG PHE A 74 -0.038 -6.457 -4.034 1.00 0.00 C ATOM 1127 CD1 PHE A 74 -0.696 -5.660 -4.955 1.00 0.00 C ATOM 1128 CD2 PHE A 74 1.293 -6.768 -4.249 1.00 0.00 C ATOM 1129 CE1 PHE A 74 -0.036 -5.180 -6.072 1.00 0.00 C ATOM 1130 CE2 PHE A 74 1.959 -6.292 -5.360 1.00 0.00 C ATOM 1131 CZ PHE A 74 1.295 -5.497 -6.274 1.00 0.00 C ATOM 0 H PHE A 74 -1.602 -8.499 -5.182 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.714 -8.800 -2.257 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.316 -6.177 -2.363 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.015 -7.320 -2.095 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.735 -5.410 -4.800 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.817 -7.391 -3.539 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.559 -4.559 -6.785 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.998 -6.541 -5.515 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.814 -5.124 -7.144 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.588 -6.619 -2.656 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.945 -6.139 -2.911 1.00 0.00 C ATOM 1143 C VAL A 75 -5.197 -4.658 -2.603 1.00 0.00 C ATOM 1144 O VAL A 75 -4.652 -4.070 -1.672 1.00 0.00 O ATOM 1145 CB VAL A 75 -6.004 -6.978 -2.169 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.953 -6.717 -0.670 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -7.394 -6.686 -2.732 1.00 0.00 C ATOM 0 H VAL A 75 -3.075 -6.133 -1.920 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.042 -6.256 -3.990 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.784 -8.034 -2.326 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.710 -7.321 -0.170 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.967 -6.981 -0.288 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.146 -5.662 -0.478 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.135 -7.284 -2.201 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.623 -5.628 -2.605 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.417 -6.938 -3.792 1.00 0.00 H new ATOM 1157 N MET A 76 -6.071 -4.112 -3.438 1.00 0.00 N ATOM 1158 CA MET A 76 -6.553 -2.741 -3.423 1.00 0.00 C ATOM 1159 C MET A 76 -6.776 -2.102 -2.051 1.00 0.00 C ATOM 1160 O MET A 76 -7.796 -2.365 -1.405 1.00 0.00 O ATOM 1161 CB MET A 76 -7.909 -2.793 -4.092 1.00 0.00 C ATOM 1162 CG MET A 76 -8.744 -3.999 -3.639 1.00 0.00 C ATOM 1163 SD MET A 76 -8.873 -5.294 -4.906 1.00 0.00 S ATOM 1164 CE MET A 76 -10.027 -6.419 -4.122 1.00 0.00 C ATOM 0 H MET A 76 -6.489 -4.654 -4.194 1.00 0.00 H new ATOM 0 HA MET A 76 -5.785 -2.135 -3.904 1.00 0.00 H new ATOM 0 HB2 MET A 76 -8.454 -1.875 -3.872 1.00 0.00 H new ATOM 0 HB3 MET A 76 -7.776 -2.833 -5.173 1.00 0.00 H new ATOM 0 HG2 MET A 76 -8.300 -4.423 -2.739 1.00 0.00 H new ATOM 0 HG3 MET A 76 -9.745 -3.660 -3.371 1.00 0.00 H new ATOM 0 HE1 MET A 76 -9.523 -7.359 -3.898 1.00 0.00 H new ATOM 0 HE2 MET A 76 -10.396 -5.976 -3.197 1.00 0.00 H new ATOM 0 HE3 MET A 76 -10.865 -6.607 -4.793 1.00 0.00 H new ATOM 1174 N VAL A 77 -5.873 -1.195 -1.657 1.00 0.00 N ATOM 1175 CA VAL A 77 -6.023 -0.459 -0.402 1.00 0.00 C ATOM 1176 C VAL A 77 -5.481 0.971 -0.512 1.00 0.00 C ATOM 1177 O VAL A 77 -4.557 1.349 0.207 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.325 -1.168 0.776 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.567 -0.409 2.075 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -5.811 -2.597 0.902 1.00 0.00 C ATOM 0 H VAL A 77 -5.036 -0.956 -2.188 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.095 -0.423 -0.206 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.253 -1.185 0.579 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -5.067 -0.924 2.896 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.170 0.602 1.985 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.637 -0.362 2.275 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.307 -3.080 1.739 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.887 -2.601 1.075 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.589 -3.139 -0.017 1.00 0.00 H new ATOM 1190 N ASN A 78 -6.063 1.770 -1.402 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.628 3.154 -1.576 1.00 0.00 C ATOM 1192 C ASN A 78 -6.496 4.114 -0.770 1.00 0.00 C ATOM 1193 O ASN A 78 -7.608 4.449 -1.179 1.00 0.00 O ATOM 1194 CB ASN A 78 -5.671 3.563 -3.047 1.00 0.00 C ATOM 1195 CG ASN A 78 -4.543 4.505 -3.432 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -3.909 4.346 -4.473 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -4.287 5.495 -2.590 1.00 0.00 N ATOM 0 H ASN A 78 -6.831 1.487 -2.010 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.601 3.211 -1.214 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -5.620 2.669 -3.669 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -6.627 4.043 -3.258 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -3.541 6.159 -2.796 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.836 5.593 -1.736 1.00 0.00 H new ATOM 1204 N LEU A 79 -5.981 4.564 0.366 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.716 5.500 1.214 1.00 0.00 C ATOM 1206 C LEU A 79 -6.458 6.943 0.780 1.00 0.00 C ATOM 1207 O LEU A 79 -5.365 7.280 0.319 1.00 0.00 O ATOM 1208 CB LEU A 79 -6.325 5.320 2.680 1.00 0.00 C ATOM 1209 CG LEU A 79 -6.333 3.874 3.180 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -5.502 3.744 4.447 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -7.762 3.403 3.422 1.00 0.00 C ATOM 0 H LEU A 79 -5.063 4.300 0.723 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.779 5.287 1.105 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -5.327 5.734 2.827 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -7.007 5.905 3.297 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.888 3.240 2.413 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -5.519 2.709 4.789 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.474 4.041 4.240 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.917 4.389 5.222 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.750 2.373 3.777 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -8.233 4.040 4.171 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -8.326 3.459 2.491 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.472 7.790 0.929 1.00 0.00 N ATOM 1224 CA GLU A 80 -7.361 9.195 0.552 1.00 0.00 C ATOM 1225 C GLU A 80 -7.486 10.104 1.769 1.00 0.00 C ATOM 1226 O GLU A 80 -7.461 9.641 2.910 1.00 0.00 O ATOM 1227 CB GLU A 80 -8.430 9.555 -0.482 1.00 0.00 C ATOM 1228 CG GLU A 80 -7.923 10.472 -1.582 1.00 0.00 C ATOM 1229 CD GLU A 80 -8.980 11.449 -2.059 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -10.178 11.106 -1.994 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -8.609 12.559 -2.498 1.00 0.00 O ATOM 0 H GLU A 80 -8.381 7.527 1.309 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.375 9.346 0.113 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.813 8.639 -0.931 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -9.267 10.036 0.024 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -7.058 11.027 -1.218 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.583 9.870 -2.425 1.00 0.00 H new ATOM 1238 N ASP A 81 -7.610 11.404 1.515 1.00 0.00 N ATOM 1239 CA ASP A 81 -7.730 12.394 2.582 1.00 0.00 C ATOM 1240 C ASP A 81 -8.718 11.946 3.656 1.00 0.00 C ATOM 1241 O ASP A 81 -8.542 12.246 4.836 1.00 0.00 O ATOM 1242 CB ASP A 81 -8.165 13.742 2.005 1.00 0.00 C ATOM 1243 CG ASP A 81 -7.805 14.902 2.913 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -6.688 15.441 2.773 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -8.642 15.271 3.764 1.00 0.00 O ATOM 0 H ASP A 81 -7.630 11.798 0.574 1.00 0.00 H new ATOM 0 HA ASP A 81 -6.750 12.498 3.048 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.695 13.886 1.032 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -9.243 13.733 1.841 1.00 0.00 H new ATOM 1250 N GLU A 82 -9.757 11.230 3.240 1.00 0.00 N ATOM 1251 CA GLU A 82 -10.768 10.744 4.173 1.00 0.00 C ATOM 1252 C GLU A 82 -10.141 9.840 5.229 1.00 0.00 C ATOM 1253 O GLU A 82 -10.544 9.856 6.391 1.00 0.00 O ATOM 1254 CB GLU A 82 -11.866 9.989 3.423 1.00 0.00 C ATOM 1255 CG GLU A 82 -13.258 10.220 3.991 1.00 0.00 C ATOM 1256 CD GLU A 82 -14.278 10.561 2.922 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -13.884 11.151 1.894 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -15.469 10.237 3.113 1.00 0.00 O ATOM 0 H GLU A 82 -9.921 10.974 2.266 1.00 0.00 H new ATOM 0 HA GLU A 82 -11.210 11.606 4.673 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -11.854 10.292 2.376 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -11.644 8.922 3.448 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -13.581 9.326 4.524 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.218 11.029 4.721 1.00 0.00 H new ATOM 1265 N GLU A 83 -9.153 9.052 4.810 1.00 0.00 N ATOM 1266 CA GLU A 83 -8.455 8.132 5.698 1.00 0.00 C ATOM 1267 C GLU A 83 -9.428 7.282 6.507 1.00 0.00 C ATOM 1268 O GLU A 83 -10.646 7.412 6.383 1.00 0.00 O ATOM 1269 CB GLU A 83 -7.504 8.895 6.632 1.00 0.00 C ATOM 1270 CG GLU A 83 -8.197 9.644 7.764 1.00 0.00 C ATOM 1271 CD GLU A 83 -8.366 11.120 7.468 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -7.398 11.744 6.984 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -9.467 11.655 7.719 1.00 0.00 O ATOM 0 H GLU A 83 -8.816 9.035 3.847 1.00 0.00 H new ATOM 0 HA GLU A 83 -7.867 7.459 5.074 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.793 8.189 7.062 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -6.928 9.607 6.041 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -9.176 9.199 7.944 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -7.619 9.525 8.681 1.00 0.00 H new ATOM 1280 N GLU A 84 -8.872 6.412 7.332 1.00 0.00 N ATOM 1281 CA GLU A 84 -9.670 5.529 8.174 1.00 0.00 C ATOM 1282 C GLU A 84 -8.826 4.944 9.308 1.00 0.00 C ATOM 1283 O GLU A 84 -9.162 5.102 10.481 1.00 0.00 O ATOM 1284 CB GLU A 84 -10.290 4.406 7.338 1.00 0.00 C ATOM 1285 CG GLU A 84 -11.790 4.553 7.139 1.00 0.00 C ATOM 1286 CD GLU A 84 -12.377 3.443 6.289 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -12.713 2.381 6.851 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -12.501 3.638 5.062 1.00 0.00 O ATOM 0 H GLU A 84 -7.864 6.296 7.439 1.00 0.00 H new ATOM 0 HA GLU A 84 -10.473 6.119 8.616 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -9.803 4.379 6.363 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -10.088 3.450 7.822 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -12.283 4.560 8.111 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.998 5.514 6.669 1.00 0.00 H new ATOM 1295 N PRO A 85 -7.714 4.260 8.978 1.00 0.00 N ATOM 1296 CA PRO A 85 -6.834 3.660 9.989 1.00 0.00 C ATOM 1297 C PRO A 85 -6.248 4.705 10.930 1.00 0.00 C ATOM 1298 O PRO A 85 -6.338 4.579 12.152 1.00 0.00 O ATOM 1299 CB PRO A 85 -5.721 3.001 9.164 1.00 0.00 C ATOM 1300 CG PRO A 85 -6.286 2.854 7.794 1.00 0.00 C ATOM 1301 CD PRO A 85 -7.222 4.015 7.611 1.00 0.00 C ATOM 0 HA PRO A 85 -7.371 2.960 10.629 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -4.821 3.616 9.155 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -5.442 2.033 9.581 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -5.497 2.866 7.042 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -6.813 1.906 7.688 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -6.710 4.887 7.204 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -8.035 3.774 6.926 1.00 0.00 H new ATOM 1309 N LYS A 86 -5.649 5.735 10.350 1.00 0.00 N ATOM 1310 CA LYS A 86 -5.045 6.813 11.127 1.00 0.00 C ATOM 1311 C LYS A 86 -3.973 6.270 12.069 1.00 0.00 C ATOM 1312 O LYS A 86 -4.282 5.632 13.075 1.00 0.00 O ATOM 1313 CB LYS A 86 -6.117 7.559 11.924 1.00 0.00 C ATOM 1314 CG LYS A 86 -6.337 8.987 11.453 1.00 0.00 C ATOM 1315 CD LYS A 86 -7.353 9.714 12.322 1.00 0.00 C ATOM 1316 CE LYS A 86 -8.608 10.067 11.539 1.00 0.00 C ATOM 1317 NZ LYS A 86 -9.139 11.407 11.917 1.00 0.00 N ATOM 0 H LYS A 86 -5.567 5.849 9.340 1.00 0.00 H new ATOM 0 HA LYS A 86 -4.572 7.508 10.433 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -7.057 7.012 11.853 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.834 7.571 12.976 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -5.390 9.526 11.471 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -6.681 8.981 10.419 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -7.619 9.088 13.174 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -6.905 10.624 12.723 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.387 10.052 10.472 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.372 9.310 11.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -9.994 11.611 11.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -9.374 11.414 12.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -8.420 12.133 11.724 1.00 0.00 H new ATOM 1331 N ASP A 87 -2.712 6.529 11.736 1.00 0.00 N ATOM 1332 CA ASP A 87 -1.596 6.068 12.553 1.00 0.00 C ATOM 1333 C ASP A 87 -0.269 6.595 12.012 1.00 0.00 C ATOM 1334 O ASP A 87 -0.245 7.480 11.157 1.00 0.00 O ATOM 1335 CB ASP A 87 -1.570 4.539 12.599 1.00 0.00 C ATOM 1336 CG ASP A 87 -1.215 4.010 13.974 1.00 0.00 C ATOM 1337 OD1 ASP A 87 -2.134 3.853 14.807 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -0.018 3.754 14.221 1.00 0.00 O ATOM 0 H ASP A 87 -2.438 7.055 10.906 1.00 0.00 H new ATOM 0 HA ASP A 87 -1.734 6.454 13.563 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -2.546 4.152 12.304 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.847 4.168 11.872 1.00 0.00 H new ATOM 1343 N GLU A 88 0.830 6.046 12.519 1.00 0.00 N ATOM 1344 CA GLU A 88 2.161 6.459 12.088 1.00 0.00 C ATOM 1345 C GLU A 88 2.565 5.760 10.792 1.00 0.00 C ATOM 1346 O GLU A 88 3.473 6.209 10.094 1.00 0.00 O ATOM 1347 CB GLU A 88 3.187 6.164 13.185 1.00 0.00 C ATOM 1348 CG GLU A 88 3.632 7.397 13.953 1.00 0.00 C ATOM 1349 CD GLU A 88 4.460 8.344 13.106 1.00 0.00 C ATOM 1350 OE1 GLU A 88 3.932 8.853 12.094 1.00 0.00 O ATOM 1351 OE2 GLU A 88 5.637 8.576 13.453 1.00 0.00 O ATOM 0 H GLU A 88 0.825 5.314 13.229 1.00 0.00 H new ATOM 0 HA GLU A 88 2.135 7.532 11.900 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.761 5.445 13.885 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.061 5.692 12.736 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.754 7.924 14.328 1.00 0.00 H new ATOM 0 HG3 GLU A 88 4.214 7.089 14.822 1.00 0.00 H new ATOM 1358 N ASP A 89 1.889 4.657 10.474 1.00 0.00 N ATOM 1359 CA ASP A 89 2.186 3.903 9.260 1.00 0.00 C ATOM 1360 C ASP A 89 2.184 4.814 8.032 1.00 0.00 C ATOM 1361 O ASP A 89 3.029 4.680 7.150 1.00 0.00 O ATOM 1362 CB ASP A 89 1.167 2.772 9.073 1.00 0.00 C ATOM 1363 CG ASP A 89 1.633 1.460 9.681 1.00 0.00 C ATOM 1364 OD1 ASP A 89 2.568 1.489 10.509 1.00 0.00 O ATOM 1365 OD2 ASP A 89 1.063 0.400 9.329 1.00 0.00 O ATOM 0 H ASP A 89 1.134 4.268 11.039 1.00 0.00 H new ATOM 0 HA ASP A 89 3.182 3.473 9.367 1.00 0.00 H new ATOM 0 HB2 ASP A 89 0.220 3.063 9.527 1.00 0.00 H new ATOM 0 HB3 ASP A 89 0.980 2.629 8.009 1.00 0.00 H new ATOM 1370 N PHE A 90 1.229 5.743 7.990 1.00 0.00 N ATOM 1371 CA PHE A 90 1.102 6.681 6.871 1.00 0.00 C ATOM 1372 C PHE A 90 2.456 7.256 6.455 1.00 0.00 C ATOM 1373 O PHE A 90 2.667 7.588 5.284 1.00 0.00 O ATOM 1374 CB PHE A 90 0.156 7.822 7.248 1.00 0.00 C ATOM 1375 CG PHE A 90 -1.286 7.407 7.320 1.00 0.00 C ATOM 1376 CD1 PHE A 90 -1.786 6.778 8.449 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -2.141 7.647 6.257 1.00 0.00 C ATOM 1378 CE1 PHE A 90 -3.113 6.396 8.516 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -3.469 7.267 6.318 1.00 0.00 C ATOM 1380 CZ PHE A 90 -3.955 6.641 7.449 1.00 0.00 C ATOM 0 H PHE A 90 0.528 5.867 8.721 1.00 0.00 H new ATOM 0 HA PHE A 90 0.696 6.128 6.024 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.457 8.229 8.213 1.00 0.00 H new ATOM 0 HB3 PHE A 90 0.259 8.625 6.518 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.132 6.584 9.286 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.766 8.137 5.370 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -3.491 5.907 9.402 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.125 7.459 5.482 1.00 0.00 H new ATOM 0 HZ PHE A 90 -4.992 6.343 7.499 1.00 0.00 H new ATOM 1390 N SER A 91 3.364 7.364 7.420 1.00 0.00 N ATOM 1391 CA SER A 91 4.701 7.889 7.166 1.00 0.00 C ATOM 1392 C SER A 91 5.698 7.323 8.173 1.00 0.00 C ATOM 1393 O SER A 91 5.987 7.951 9.192 1.00 0.00 O ATOM 1394 CB SER A 91 4.702 9.418 7.236 1.00 0.00 C ATOM 1395 OG SER A 91 5.917 9.948 6.735 1.00 0.00 O ATOM 0 H SER A 91 3.197 7.094 8.389 1.00 0.00 H new ATOM 0 HA SER A 91 5.000 7.583 6.163 1.00 0.00 H new ATOM 0 HB2 SER A 91 3.864 9.813 6.661 1.00 0.00 H new ATOM 0 HB3 SER A 91 4.559 9.739 8.268 1.00 0.00 H new ATOM 0 HG SER A 91 6.200 10.702 7.294 1.00 0.00 H new ATOM 1401 N PRO A 92 6.239 6.122 7.900 1.00 0.00 N ATOM 1402 CA PRO A 92 7.205 5.469 8.784 1.00 0.00 C ATOM 1403 C PRO A 92 8.565 6.156 8.734 1.00 0.00 C ATOM 1404 O PRO A 92 8.995 6.781 9.703 1.00 0.00 O ATOM 1405 CB PRO A 92 7.304 4.036 8.231 1.00 0.00 C ATOM 1406 CG PRO A 92 6.217 3.918 7.210 1.00 0.00 C ATOM 1407 CD PRO A 92 5.957 5.309 6.715 1.00 0.00 C ATOM 0 HA PRO A 92 6.894 5.505 9.828 1.00 0.00 H new ATOM 0 HB2 PRO A 92 8.282 3.856 7.784 1.00 0.00 H new ATOM 0 HB3 PRO A 92 7.176 3.300 9.025 1.00 0.00 H new ATOM 0 HG2 PRO A 92 6.520 3.264 6.392 1.00 0.00 H new ATOM 0 HG3 PRO A 92 5.317 3.486 7.647 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.606 5.571 5.879 1.00 0.00 H new ATOM 0 HD3 PRO A 92 4.930 5.433 6.372 1.00 0.00 H new ATOM 1415 N ASP A 93 9.228 6.047 7.590 1.00 0.00 N ATOM 1416 CA ASP A 93 10.531 6.669 7.394 1.00 0.00 C ATOM 1417 C ASP A 93 10.439 7.746 6.319 1.00 0.00 C ATOM 1418 O ASP A 93 11.399 8.001 5.593 1.00 0.00 O ATOM 1419 CB ASP A 93 11.570 5.614 7.000 1.00 0.00 C ATOM 1420 CG ASP A 93 12.514 5.282 8.138 1.00 0.00 C ATOM 1421 OD1 ASP A 93 12.058 5.265 9.302 1.00 0.00 O ATOM 1422 OD2 ASP A 93 13.708 5.038 7.868 1.00 0.00 O ATOM 0 H ASP A 93 8.883 5.531 6.780 1.00 0.00 H new ATOM 0 HA ASP A 93 10.844 7.131 8.330 1.00 0.00 H new ATOM 0 HB2 ASP A 93 11.059 4.706 6.679 1.00 0.00 H new ATOM 0 HB3 ASP A 93 12.145 5.975 6.147 1.00 0.00 H new ATOM 1427 N GLY A 94 9.266 8.367 6.221 1.00 0.00 N ATOM 1428 CA GLY A 94 9.052 9.402 5.231 1.00 0.00 C ATOM 1429 C GLY A 94 8.988 10.788 5.839 1.00 0.00 C ATOM 1430 O GLY A 94 9.901 11.202 6.554 1.00 0.00 O ATOM 0 H GLY A 94 8.459 8.169 6.813 1.00 0.00 H new ATOM 0 HA2 GLY A 94 9.857 9.369 4.497 1.00 0.00 H new ATOM 0 HA3 GLY A 94 8.124 9.201 4.696 1.00 0.00 H new ATOM 1434 N GLY A 95 7.907 11.507 5.554 1.00 0.00 N ATOM 1435 CA GLY A 95 7.752 12.846 6.086 1.00 0.00 C ATOM 1436 C GLY A 95 6.493 13.535 5.595 1.00 0.00 C ATOM 1437 O GLY A 95 5.763 14.134 6.386 1.00 0.00 O ATOM 0 H GLY A 95 7.138 11.186 4.966 1.00 0.00 H new ATOM 0 HA2 GLY A 95 7.733 12.799 7.175 1.00 0.00 H new ATOM 0 HA3 GLY A 95 8.620 13.445 5.808 1.00 0.00 H new ATOM 1441 N TYR A 96 6.234 13.462 4.291 1.00 0.00 N ATOM 1442 CA TYR A 96 5.053 14.097 3.721 1.00 0.00 C ATOM 1443 C TYR A 96 3.796 13.289 4.033 1.00 0.00 C ATOM 1444 O TYR A 96 3.872 12.155 4.506 1.00 0.00 O ATOM 1445 CB TYR A 96 5.208 14.312 2.210 1.00 0.00 C ATOM 1446 CG TYR A 96 5.181 13.045 1.382 1.00 0.00 C ATOM 1447 CD1 TYR A 96 3.978 12.510 0.936 1.00 0.00 C ATOM 1448 CD2 TYR A 96 6.358 12.391 1.034 1.00 0.00 C ATOM 1449 CE1 TYR A 96 3.949 11.360 0.171 1.00 0.00 C ATOM 1450 CE2 TYR A 96 6.335 11.241 0.270 1.00 0.00 C ATOM 1451 CZ TYR A 96 5.130 10.729 -0.158 1.00 0.00 C ATOM 1452 OH TYR A 96 5.106 9.584 -0.919 1.00 0.00 O ATOM 0 H TYR A 96 6.822 12.973 3.616 1.00 0.00 H new ATOM 0 HA TYR A 96 4.948 15.078 4.184 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.410 14.970 1.867 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.149 14.830 2.026 1.00 0.00 H new ATOM 0 HD1 TYR A 96 3.051 13.001 1.192 1.00 0.00 H new ATOM 0 HD2 TYR A 96 7.305 12.789 1.367 1.00 0.00 H new ATOM 0 HE1 TYR A 96 3.006 10.957 -0.168 1.00 0.00 H new ATOM 0 HE2 TYR A 96 7.258 10.745 0.009 1.00 0.00 H new ATOM 0 HH TYR A 96 4.195 9.427 -1.245 1.00 0.00 H new ATOM 1462 N ILE A 97 2.641 13.898 3.789 1.00 0.00 N ATOM 1463 CA ILE A 97 1.357 13.257 4.068 1.00 0.00 C ATOM 1464 C ILE A 97 0.564 13.000 2.741 1.00 0.00 C ATOM 1465 O ILE A 97 -0.112 13.966 2.410 1.00 0.00 O ATOM 1466 CB ILE A 97 0.552 14.117 5.093 1.00 0.00 C ATOM 1467 CG1 ILE A 97 -0.084 15.363 4.456 1.00 0.00 C ATOM 1468 CG2 ILE A 97 1.463 14.531 6.239 1.00 0.00 C ATOM 1469 CD1 ILE A 97 0.861 16.193 3.611 1.00 0.00 C ATOM 0 H ILE A 97 2.565 14.837 3.398 1.00 0.00 H new ATOM 0 HA ILE A 97 1.527 12.280 4.520 1.00 0.00 H new ATOM 0 HB ILE A 97 -0.265 13.497 5.463 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -0.924 15.049 3.836 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -0.490 15.992 5.248 1.00 0.00 H new ATOM 0 HG21 ILE A 97 0.899 15.131 6.953 1.00 0.00 H new ATOM 0 HG22 ILE A 97 1.849 13.641 6.737 1.00 0.00 H new ATOM 0 HG23 ILE A 97 2.295 15.118 5.849 1.00 0.00 H new ATOM 0 HD11 ILE A 97 0.326 17.050 3.203 1.00 0.00 H new ATOM 0 HD12 ILE A 97 1.689 16.542 4.228 1.00 0.00 H new ATOM 0 HD13 ILE A 97 1.248 15.584 2.794 1.00 0.00 H new ATOM 1481 N PRO A 98 -0.074 11.788 2.695 1.00 0.00 N ATOM 1482 CA PRO A 98 0.333 10.368 2.981 1.00 0.00 C ATOM 1483 C PRO A 98 1.102 9.774 1.817 1.00 0.00 C ATOM 1484 O PRO A 98 1.098 10.335 0.717 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.980 9.637 3.169 1.00 0.00 C ATOM 1486 CG PRO A 98 -1.583 10.559 4.092 1.00 0.00 C ATOM 1487 CD PRO A 98 -0.512 11.610 4.151 1.00 0.00 C ATOM 0 HA PRO A 98 0.989 10.296 3.849 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.545 9.530 2.243 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -0.856 8.637 3.585 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -2.532 10.952 3.728 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.777 10.107 5.065 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.892 12.542 4.568 1.00 0.00 H new ATOM 0 HD3 PRO A 98 0.320 11.295 4.781 1.00 0.00 H new ATOM 1495 N ARG A 99 1.778 8.651 2.076 1.00 0.00 N ATOM 1496 CA ARG A 99 2.595 7.981 1.064 1.00 0.00 C ATOM 1497 C ARG A 99 2.134 6.538 0.828 1.00 0.00 C ATOM 1498 O ARG A 99 1.247 6.041 1.522 1.00 0.00 O ATOM 1499 CB ARG A 99 4.064 7.992 1.514 1.00 0.00 C ATOM 1500 CG ARG A 99 4.375 9.068 2.554 1.00 0.00 C ATOM 1501 CD ARG A 99 5.755 8.892 3.166 1.00 0.00 C ATOM 1502 NE ARG A 99 6.595 10.080 2.993 1.00 0.00 N ATOM 1503 CZ ARG A 99 7.858 10.046 2.564 1.00 0.00 C ATOM 1504 NH1 ARG A 99 8.418 8.898 2.220 1.00 0.00 N ATOM 1505 NH2 ARG A 99 8.567 11.163 2.488 1.00 0.00 N ATOM 0 H ARG A 99 1.774 8.186 2.984 1.00 0.00 H new ATOM 0 HA ARG A 99 2.485 8.520 0.123 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.317 7.015 1.927 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.701 8.145 0.643 1.00 0.00 H new ATOM 0 HG2 ARG A 99 4.309 10.051 2.088 1.00 0.00 H new ATOM 0 HG3 ARG A 99 3.623 9.037 3.342 1.00 0.00 H new ATOM 0 HD2 ARG A 99 5.654 8.673 4.229 1.00 0.00 H new ATOM 0 HD3 ARG A 99 6.246 8.033 2.709 1.00 0.00 H new ATOM 0 HE ARG A 99 6.189 10.989 3.214 1.00 0.00 H new ATOM 0 HH11 ARG A 99 7.884 8.031 2.282 1.00 0.00 H new ATOM 0 HH12 ARG A 99 9.384 8.880 1.893 1.00 0.00 H new ATOM 0 HH21 ARG A 99 8.148 12.053 2.758 1.00 0.00 H new ATOM 0 HH22 ARG A 99 9.532 11.133 2.160 1.00 0.00 H new ATOM 1519 N ILE A 100 2.752 5.870 -0.153 1.00 0.00 N ATOM 1520 CA ILE A 100 2.412 4.480 -0.471 1.00 0.00 C ATOM 1521 C ILE A 100 3.015 3.537 0.564 1.00 0.00 C ATOM 1522 O ILE A 100 4.148 3.731 0.994 1.00 0.00 O ATOM 1523 CB ILE A 100 2.905 4.085 -1.877 1.00 0.00 C ATOM 1524 CG1 ILE A 100 2.407 5.100 -2.912 1.00 0.00 C ATOM 1525 CG2 ILE A 100 2.443 2.673 -2.223 1.00 0.00 C ATOM 1526 CD1 ILE A 100 2.489 4.615 -4.346 1.00 0.00 C ATOM 0 H ILE A 100 3.487 6.268 -0.738 1.00 0.00 H new ATOM 0 HA ILE A 100 1.325 4.396 -0.452 1.00 0.00 H new ATOM 0 HB ILE A 100 3.995 4.093 -1.889 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.372 5.356 -2.685 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.990 6.016 -2.816 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.798 2.408 -3.219 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.846 1.970 -1.494 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.354 2.631 -2.204 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.118 5.392 -5.015 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.526 4.387 -4.594 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.883 3.717 -4.462 1.00 0.00 H new ATOM 1538 N LEU A 101 2.242 2.538 0.991 1.00 0.00 N ATOM 1539 CA LEU A 101 2.707 1.603 2.016 1.00 0.00 C ATOM 1540 C LEU A 101 2.438 0.138 1.671 1.00 0.00 C ATOM 1541 O LEU A 101 1.281 -0.272 1.557 1.00 0.00 O ATOM 1542 CB LEU A 101 1.982 1.901 3.332 1.00 0.00 C ATOM 1543 CG LEU A 101 2.601 2.977 4.218 1.00 0.00 C ATOM 1544 CD1 LEU A 101 2.769 4.273 3.448 1.00 0.00 C ATOM 1545 CD2 LEU A 101 1.730 3.195 5.446 1.00 0.00 C ATOM 0 H LEU A 101 1.299 2.356 0.647 1.00 0.00 H new ATOM 0 HA LEU A 101 3.786 1.742 2.091 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.959 2.197 3.099 1.00 0.00 H new ATOM 0 HB3 LEU A 101 1.924 0.977 3.907 1.00 0.00 H new ATOM 0 HG LEU A 101 3.588 2.644 4.538 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.212 5.028 4.098 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.421 4.105 2.590 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.795 4.619 3.101 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.176 3.964 6.076 1.00 0.00 H new ATOM 0 HD22 LEU A 101 0.735 3.513 5.135 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.654 2.264 6.008 1.00 0.00 H new ATOM 1557 N PHE A 102 3.497 -0.673 1.581 1.00 0.00 N ATOM 1558 CA PHE A 102 3.313 -2.098 1.337 1.00 0.00 C ATOM 1559 C PHE A 102 3.322 -2.818 2.687 1.00 0.00 C ATOM 1560 O PHE A 102 4.206 -2.578 3.522 1.00 0.00 O ATOM 1561 CB PHE A 102 4.401 -2.647 0.421 1.00 0.00 C ATOM 1562 CG PHE A 102 4.025 -3.937 -0.251 1.00 0.00 C ATOM 1563 CD1 PHE A 102 3.738 -5.065 0.500 1.00 0.00 C ATOM 1564 CD2 PHE A 102 3.962 -4.019 -1.633 1.00 0.00 C ATOM 1565 CE1 PHE A 102 3.392 -6.253 -0.117 1.00 0.00 C ATOM 1566 CE2 PHE A 102 3.617 -5.204 -2.254 1.00 0.00 C ATOM 1567 CZ PHE A 102 3.331 -6.323 -1.495 1.00 0.00 C ATOM 0 H PHE A 102 4.467 -0.372 1.672 1.00 0.00 H new ATOM 0 HA PHE A 102 2.361 -2.263 0.832 1.00 0.00 H new ATOM 0 HB2 PHE A 102 4.632 -1.903 -0.342 1.00 0.00 H new ATOM 0 HB3 PHE A 102 5.310 -2.801 1.002 1.00 0.00 H new ATOM 0 HD1 PHE A 102 3.785 -5.016 1.578 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.185 -3.148 -2.231 1.00 0.00 H new ATOM 0 HE1 PHE A 102 3.169 -7.126 0.479 1.00 0.00 H new ATOM 0 HE2 PHE A 102 3.571 -5.256 -3.332 1.00 0.00 H new ATOM 0 HZ PHE A 102 3.060 -7.250 -1.978 1.00 0.00 H new ATOM 1577 N LEU A 103 2.324 -3.663 2.933 1.00 0.00 N ATOM 1578 CA LEU A 103 2.244 -4.346 4.221 1.00 0.00 C ATOM 1579 C LEU A 103 1.819 -5.807 4.103 1.00 0.00 C ATOM 1580 O LEU A 103 1.316 -6.252 3.068 1.00 0.00 O ATOM 1581 CB LEU A 103 1.282 -3.593 5.144 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.207 -3.815 4.888 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.033 -2.783 5.637 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.512 -3.756 3.401 1.00 0.00 C ATOM 0 H LEU A 103 1.577 -3.888 2.276 1.00 0.00 H new ATOM 0 HA LEU A 103 3.249 -4.349 4.642 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.500 -3.879 6.173 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.489 -2.526 5.059 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.472 -4.807 5.254 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.092 -2.955 5.444 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.840 -2.869 6.706 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.760 -1.783 5.299 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.578 -3.917 3.242 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.230 -2.778 3.010 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.053 -4.531 2.883 1.00 0.00 H new ATOM 1596 N ASP A 104 2.031 -6.544 5.194 1.00 0.00 N ATOM 1597 CA ASP A 104 1.683 -7.958 5.259 1.00 0.00 C ATOM 1598 C ASP A 104 0.178 -8.142 5.428 1.00 0.00 C ATOM 1599 O ASP A 104 -0.502 -7.280 6.002 1.00 0.00 O ATOM 1600 CB ASP A 104 2.420 -8.638 6.415 1.00 0.00 C ATOM 1601 CG ASP A 104 3.850 -8.157 6.560 1.00 0.00 C ATOM 1602 OD1 ASP A 104 4.669 -8.452 5.664 1.00 0.00 O ATOM 1603 OD2 ASP A 104 4.152 -7.486 7.569 1.00 0.00 O ATOM 0 H ASP A 104 2.446 -6.178 6.051 1.00 0.00 H new ATOM 0 HA ASP A 104 1.987 -8.421 4.320 1.00 0.00 H new ATOM 0 HB2 ASP A 104 1.882 -8.450 7.344 1.00 0.00 H new ATOM 0 HB3 ASP A 104 2.418 -9.717 6.258 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.353 -9.281 4.933 1.00 0.00 N ATOM 1609 CA PRO A 105 -1.782 -9.604 5.018 1.00 0.00 C ATOM 1610 C PRO A 105 -2.304 -9.568 6.447 1.00 0.00 C ATOM 1611 O PRO A 105 -2.224 -10.556 7.177 1.00 0.00 O ATOM 1612 CB PRO A 105 -1.881 -11.026 4.445 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.482 -11.544 4.417 1.00 0.00 C ATOM 1614 CD PRO A 105 0.405 -10.344 4.257 1.00 0.00 C ATOM 0 HA PRO A 105 -2.386 -8.877 4.476 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -2.520 -11.655 5.065 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.316 -11.017 3.446 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.247 -12.082 5.336 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.342 -12.244 3.593 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.381 -10.499 4.717 1.00 0.00 H new ATOM 0 HD3 PRO A 105 0.581 -10.109 3.207 1.00 0.00 H new ATOM 1622 N SER A 106 -2.839 -8.414 6.832 1.00 0.00 N ATOM 1623 CA SER A 106 -3.389 -8.204 8.170 1.00 0.00 C ATOM 1624 C SER A 106 -3.467 -6.713 8.477 1.00 0.00 C ATOM 1625 O SER A 106 -4.287 -6.273 9.282 1.00 0.00 O ATOM 1626 CB SER A 106 -2.536 -8.903 9.234 1.00 0.00 C ATOM 1627 OG SER A 106 -3.026 -10.204 9.506 1.00 0.00 O ATOM 0 H SER A 106 -2.904 -7.596 6.226 1.00 0.00 H new ATOM 0 HA SER A 106 -4.390 -8.634 8.192 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.502 -8.964 8.894 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.535 -8.312 10.150 1.00 0.00 H new ATOM 0 HG SER A 106 -3.069 -10.718 8.673 1.00 0.00 H new ATOM 1633 N GLY A 107 -2.598 -5.941 7.829 1.00 0.00 N ATOM 1634 CA GLY A 107 -2.571 -4.510 8.043 1.00 0.00 C ATOM 1635 C GLY A 107 -1.349 -4.085 8.826 1.00 0.00 C ATOM 1636 O GLY A 107 -1.441 -3.236 9.715 1.00 0.00 O ATOM 0 H GLY A 107 -1.911 -6.286 7.158 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -2.583 -3.998 7.081 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -3.470 -4.205 8.578 1.00 0.00 H new ATOM 1640 N LYS A 108 -0.201 -4.682 8.511 1.00 0.00 N ATOM 1641 CA LYS A 108 1.034 -4.356 9.221 1.00 0.00 C ATOM 1642 C LYS A 108 2.106 -3.808 8.282 1.00 0.00 C ATOM 1643 O LYS A 108 2.998 -4.539 7.853 1.00 0.00 O ATOM 1644 CB LYS A 108 1.566 -5.594 9.946 1.00 0.00 C ATOM 1645 CG LYS A 108 0.913 -5.833 11.297 1.00 0.00 C ATOM 1646 CD LYS A 108 1.874 -6.499 12.268 1.00 0.00 C ATOM 1647 CE LYS A 108 1.227 -6.726 13.625 1.00 0.00 C ATOM 1648 NZ LYS A 108 0.747 -8.127 13.784 1.00 0.00 N ATOM 0 H LYS A 108 -0.100 -5.385 7.779 1.00 0.00 H new ATOM 0 HA LYS A 108 0.797 -3.577 9.946 1.00 0.00 H new ATOM 0 HB2 LYS A 108 1.410 -6.469 9.316 1.00 0.00 H new ATOM 0 HB3 LYS A 108 2.642 -5.489 10.085 1.00 0.00 H new ATOM 0 HG2 LYS A 108 0.574 -4.884 11.712 1.00 0.00 H new ATOM 0 HG3 LYS A 108 0.030 -6.459 11.170 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.205 -7.453 11.857 1.00 0.00 H new ATOM 0 HD3 LYS A 108 2.762 -5.878 12.386 1.00 0.00 H new ATOM 0 HE2 LYS A 108 1.945 -6.497 14.412 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.389 -6.039 13.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 0.312 -8.241 14.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 0.043 -8.338 13.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 1.550 -8.782 13.693 1.00 0.00 H new ATOM 1662 N VAL A 109 2.026 -2.512 7.976 1.00 0.00 N ATOM 1663 CA VAL A 109 2.992 -1.871 7.109 1.00 0.00 C ATOM 1664 C VAL A 109 4.378 -1.922 7.712 1.00 0.00 C ATOM 1665 O VAL A 109 4.584 -1.564 8.870 1.00 0.00 O ATOM 1666 CB VAL A 109 2.608 -0.405 6.854 1.00 0.00 C ATOM 1667 CG1 VAL A 109 3.709 0.308 6.100 1.00 0.00 C ATOM 1668 CG2 VAL A 109 1.287 -0.317 6.102 1.00 0.00 C ATOM 0 H VAL A 109 1.295 -1.891 8.322 1.00 0.00 H new ATOM 0 HA VAL A 109 2.993 -2.414 6.164 1.00 0.00 H new ATOM 0 HB VAL A 109 2.480 0.090 7.817 1.00 0.00 H new ATOM 0 HG11 VAL A 109 3.420 1.345 5.928 1.00 0.00 H new ATOM 0 HG12 VAL A 109 4.628 0.280 6.685 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.873 -0.186 5.142 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.034 0.730 5.932 1.00 0.00 H new ATOM 0 HG22 VAL A 109 1.379 -0.828 5.144 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.501 -0.789 6.691 1.00 0.00 H new ATOM 1678 N HIS A 110 5.326 -2.356 6.903 1.00 0.00 N ATOM 1679 CA HIS A 110 6.703 -2.440 7.339 1.00 0.00 C ATOM 1680 C HIS A 110 7.527 -1.400 6.600 1.00 0.00 C ATOM 1681 O HIS A 110 7.456 -1.310 5.374 1.00 0.00 O ATOM 1682 CB HIS A 110 7.263 -3.841 7.086 1.00 0.00 C ATOM 1683 CG HIS A 110 7.121 -4.760 8.260 1.00 0.00 C ATOM 1684 ND1 HIS A 110 5.912 -5.022 8.869 1.00 0.00 N ATOM 1685 CD2 HIS A 110 8.045 -5.479 8.938 1.00 0.00 C ATOM 1686 CE1 HIS A 110 6.099 -5.861 9.872 1.00 0.00 C ATOM 1687 NE2 HIS A 110 7.384 -6.156 9.935 1.00 0.00 N ATOM 0 H HIS A 110 5.166 -2.655 5.941 1.00 0.00 H new ATOM 0 HA HIS A 110 6.751 -2.246 8.410 1.00 0.00 H new ATOM 0 HB2 HIS A 110 6.753 -4.279 6.228 1.00 0.00 H new ATOM 0 HB3 HIS A 110 8.318 -3.760 6.823 1.00 0.00 H new ATOM 0 HD1 HIS A 110 5.013 -4.629 8.589 1.00 0.00 H new ATOM 0 HD2 HIS A 110 9.105 -5.514 8.734 1.00 0.00 H new ATOM 0 HE1 HIS A 110 5.331 -6.241 10.529 1.00 0.00 H new ATOM 1696 N PRO A 111 8.319 -0.594 7.320 1.00 0.00 N ATOM 1697 CA PRO A 111 9.151 0.436 6.698 1.00 0.00 C ATOM 1698 C PRO A 111 10.282 -0.177 5.883 1.00 0.00 C ATOM 1699 O PRO A 111 11.409 0.319 5.893 1.00 0.00 O ATOM 1700 CB PRO A 111 9.707 1.219 7.888 1.00 0.00 C ATOM 1701 CG PRO A 111 9.668 0.256 9.025 1.00 0.00 C ATOM 1702 CD PRO A 111 8.471 -0.620 8.785 1.00 0.00 C ATOM 0 HA PRO A 111 8.590 1.057 6.000 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.723 1.564 7.696 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.105 2.103 8.097 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.582 -0.336 9.067 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.584 0.780 9.977 1.00 0.00 H new ATOM 0 HD2 PRO A 111 8.633 -1.633 9.154 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.584 -0.235 9.288 1.00 0.00 H new ATOM 1710 N GLU A 112 9.973 -1.264 5.181 1.00 0.00 N ATOM 1711 CA GLU A 112 10.964 -1.954 4.365 1.00 0.00 C ATOM 1712 C GLU A 112 10.525 -2.017 2.908 1.00 0.00 C ATOM 1713 O GLU A 112 11.340 -1.877 1.998 1.00 0.00 O ATOM 1714 CB GLU A 112 11.202 -3.366 4.900 1.00 0.00 C ATOM 1715 CG GLU A 112 11.510 -3.409 6.389 1.00 0.00 C ATOM 1716 CD GLU A 112 11.434 -4.812 6.958 1.00 0.00 C ATOM 1717 OE1 GLU A 112 11.603 -5.777 6.184 1.00 0.00 O ATOM 1718 OE2 GLU A 112 11.206 -4.946 8.178 1.00 0.00 O ATOM 0 H GLU A 112 9.044 -1.685 5.162 1.00 0.00 H new ATOM 0 HA GLU A 112 11.895 -1.390 4.419 1.00 0.00 H new ATOM 0 HB2 GLU A 112 10.319 -3.974 4.702 1.00 0.00 H new ATOM 0 HB3 GLU A 112 12.029 -3.818 4.353 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.507 -3.004 6.562 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.808 -2.766 6.921 1.00 0.00 H new ATOM 1725 N ILE A 113 9.231 -2.231 2.691 1.00 0.00 N ATOM 1726 CA ILE A 113 8.695 -2.313 1.341 1.00 0.00 C ATOM 1727 C ILE A 113 8.207 -0.950 0.856 1.00 0.00 C ATOM 1728 O ILE A 113 7.030 -0.576 1.037 1.00 0.00 O ATOM 1729 CB ILE A 113 7.554 -3.334 1.246 1.00 0.00 C ATOM 1730 CG1 ILE A 113 7.928 -4.625 1.975 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.223 -3.622 -0.213 1.00 0.00 C ATOM 1732 CD1 ILE A 113 6.755 -5.556 2.178 1.00 0.00 C ATOM 0 H ILE A 113 8.539 -2.350 3.430 1.00 0.00 H new ATOM 0 HA ILE A 113 9.510 -2.645 0.698 1.00 0.00 H new ATOM 0 HB ILE A 113 6.671 -2.913 1.726 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.701 -5.144 1.408 1.00 0.00 H new ATOM 0 HG13 ILE A 113 8.357 -4.375 2.945 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.412 -4.348 -0.266 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.917 -2.699 -0.706 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.104 -4.025 -0.713 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.088 -6.453 2.701 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.990 -5.054 2.770 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.339 -5.834 1.209 1.00 0.00 H new ATOM 1744 N ILE A 114 9.140 -0.222 0.244 1.00 0.00 N ATOM 1745 CA ILE A 114 8.896 1.110 -0.291 1.00 0.00 C ATOM 1746 C ILE A 114 9.381 1.188 -1.745 1.00 0.00 C ATOM 1747 O ILE A 114 9.353 0.192 -2.468 1.00 0.00 O ATOM 1748 CB ILE A 114 9.642 2.171 0.550 1.00 0.00 C ATOM 1749 CG1 ILE A 114 11.161 1.950 0.455 1.00 0.00 C ATOM 1750 CG2 ILE A 114 9.180 2.129 1.998 1.00 0.00 C ATOM 1751 CD1 ILE A 114 11.681 0.845 1.352 1.00 0.00 C ATOM 0 H ILE A 114 10.097 -0.548 0.106 1.00 0.00 H new ATOM 0 HA ILE A 114 7.825 1.307 -0.251 1.00 0.00 H new ATOM 0 HB ILE A 114 9.410 3.159 0.151 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.420 1.717 -0.578 1.00 0.00 H new ATOM 0 HG13 ILE A 114 11.670 2.880 0.709 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.717 2.883 2.573 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.110 2.331 2.044 1.00 0.00 H new ATOM 0 HG23 ILE A 114 9.382 1.143 2.416 1.00 0.00 H new ATOM 0 HD11 ILE A 114 12.760 0.752 1.227 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.456 1.084 2.391 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.202 -0.097 1.084 1.00 0.00 H new ATOM 1763 N ASN A 115 9.854 2.364 -2.159 1.00 0.00 N ATOM 1764 CA ASN A 115 10.375 2.548 -3.505 1.00 0.00 C ATOM 1765 C ASN A 115 11.897 2.462 -3.483 1.00 0.00 C ATOM 1766 O ASN A 115 12.585 3.473 -3.605 1.00 0.00 O ATOM 1767 CB ASN A 115 9.941 3.903 -4.067 1.00 0.00 C ATOM 1768 CG ASN A 115 10.455 4.136 -5.475 1.00 0.00 C ATOM 1769 OD1 ASN A 115 10.996 3.229 -6.108 1.00 0.00 O ATOM 1770 ND2 ASN A 115 10.289 5.356 -5.972 1.00 0.00 N ATOM 0 H ASN A 115 9.885 3.201 -1.577 1.00 0.00 H new ATOM 0 HA ASN A 115 9.976 1.761 -4.145 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.853 3.962 -4.066 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.304 4.697 -3.414 1.00 0.00 H new ATOM 0 HD21 ASN A 115 10.615 5.572 -6.914 1.00 0.00 H new ATOM 0 HD22 ASN A 115 9.835 6.077 -5.412 1.00 0.00 H new ATOM 1777 N GLU A 116 12.414 1.252 -3.310 1.00 0.00 N ATOM 1778 CA GLU A 116 13.856 1.038 -3.258 1.00 0.00 C ATOM 1779 C GLU A 116 14.553 1.652 -4.470 1.00 0.00 C ATOM 1780 O GLU A 116 15.741 1.969 -4.417 1.00 0.00 O ATOM 1781 CB GLU A 116 14.163 -0.456 -3.168 1.00 0.00 C ATOM 1782 CG GLU A 116 13.992 -1.018 -1.766 1.00 0.00 C ATOM 1783 CD GLU A 116 15.107 -0.596 -0.829 1.00 0.00 C ATOM 1784 OE1 GLU A 116 16.254 -0.450 -1.299 1.00 0.00 O ATOM 1785 OE2 GLU A 116 14.830 -0.413 0.375 1.00 0.00 O ATOM 0 H GLU A 116 11.857 0.404 -3.203 1.00 0.00 H new ATOM 0 HA GLU A 116 14.239 1.534 -2.366 1.00 0.00 H new ATOM 0 HB2 GLU A 116 13.509 -0.997 -3.852 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.186 -0.631 -3.501 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.036 -0.687 -1.360 1.00 0.00 H new ATOM 0 HG3 GLU A 116 13.957 -2.106 -1.816 1.00 0.00 H new ATOM 1792 N ASN A 117 13.808 1.826 -5.557 1.00 0.00 N ATOM 1793 CA ASN A 117 14.360 2.411 -6.773 1.00 0.00 C ATOM 1794 C ASN A 117 14.294 3.938 -6.731 1.00 0.00 C ATOM 1795 O ASN A 117 14.802 4.611 -7.628 1.00 0.00 O ATOM 1796 CB ASN A 117 13.608 1.890 -7.998 1.00 0.00 C ATOM 1797 CG ASN A 117 14.257 2.321 -9.299 1.00 0.00 C ATOM 1798 OD1 ASN A 117 13.774 3.227 -9.978 1.00 0.00 O ATOM 1799 ND2 ASN A 117 15.360 1.672 -9.653 1.00 0.00 N ATOM 0 H ASN A 117 12.822 1.571 -5.620 1.00 0.00 H new ATOM 0 HA ASN A 117 15.407 2.117 -6.842 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.565 0.802 -7.959 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.580 2.251 -7.971 1.00 0.00 H new ATOM 0 HD21 ASN A 117 15.841 1.918 -10.518 1.00 0.00 H new ATOM 0 HD22 ASN A 117 15.726 0.927 -9.060 1.00 0.00 H new ATOM 1806 N GLY A 118 13.667 4.485 -5.689 1.00 0.00 N ATOM 1807 CA GLY A 118 13.553 5.926 -5.566 1.00 0.00 C ATOM 1808 C GLY A 118 14.734 6.544 -4.841 1.00 0.00 C ATOM 1809 O GLY A 118 15.757 5.891 -4.638 1.00 0.00 O ATOM 0 H GLY A 118 13.238 3.955 -4.931 1.00 0.00 H new ATOM 0 HA2 GLY A 118 13.470 6.367 -6.560 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.635 6.170 -5.032 1.00 0.00 H new ATOM 1813 N ASN A 119 14.591 7.807 -4.449 1.00 0.00 N ATOM 1814 CA ASN A 119 15.654 8.516 -3.745 1.00 0.00 C ATOM 1815 C ASN A 119 15.564 8.276 -2.238 1.00 0.00 C ATOM 1816 O ASN A 119 14.504 7.932 -1.718 1.00 0.00 O ATOM 1817 CB ASN A 119 15.579 10.016 -4.043 1.00 0.00 C ATOM 1818 CG ASN A 119 14.330 10.660 -3.471 1.00 0.00 C ATOM 1819 OD1 ASN A 119 13.269 10.646 -4.094 1.00 0.00 O ATOM 1820 ND2 ASN A 119 14.455 11.233 -2.278 1.00 0.00 N ATOM 0 H ASN A 119 13.749 8.360 -4.607 1.00 0.00 H new ATOM 0 HA ASN A 119 16.611 8.131 -4.098 1.00 0.00 H new ATOM 0 HB2 ASN A 119 16.459 10.509 -3.631 1.00 0.00 H new ATOM 0 HB3 ASN A 119 15.602 10.171 -5.122 1.00 0.00 H new ATOM 0 HD21 ASN A 119 13.651 11.685 -1.843 1.00 0.00 H new ATOM 0 HD22 ASN A 119 15.355 11.220 -1.798 1.00 0.00 H new ATOM 1827 N PRO A 120 16.684 8.452 -1.514 1.00 0.00 N ATOM 1828 CA PRO A 120 16.730 8.249 -0.064 1.00 0.00 C ATOM 1829 C PRO A 120 16.161 9.433 0.715 1.00 0.00 C ATOM 1830 O PRO A 120 16.823 9.985 1.595 1.00 0.00 O ATOM 1831 CB PRO A 120 18.224 8.097 0.211 1.00 0.00 C ATOM 1832 CG PRO A 120 18.880 8.934 -0.834 1.00 0.00 C ATOM 1833 CD PRO A 120 17.999 8.856 -2.054 1.00 0.00 C ATOM 0 HA PRO A 120 16.128 7.396 0.250 1.00 0.00 H new ATOM 0 HB2 PRO A 120 18.480 8.440 1.213 1.00 0.00 H new ATOM 0 HB3 PRO A 120 18.537 7.055 0.140 1.00 0.00 H new ATOM 0 HG2 PRO A 120 18.986 9.965 -0.496 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.882 8.566 -1.054 1.00 0.00 H new ATOM 0 HD2 PRO A 120 17.943 9.815 -2.569 1.00 0.00 H new ATOM 0 HD3 PRO A 120 18.376 8.130 -2.774 1.00 0.00 H new ATOM 1841 N SER A 121 14.931 9.819 0.388 1.00 0.00 N ATOM 1842 CA SER A 121 14.273 10.933 1.056 1.00 0.00 C ATOM 1843 C SER A 121 12.869 11.095 0.503 1.00 0.00 C ATOM 1844 O SER A 121 12.393 12.209 0.283 1.00 0.00 O ATOM 1845 CB SER A 121 15.071 12.223 0.864 1.00 0.00 C ATOM 1846 OG SER A 121 15.970 12.432 1.940 1.00 0.00 O ATOM 0 H SER A 121 14.370 9.374 -0.338 1.00 0.00 H new ATOM 0 HA SER A 121 14.218 10.724 2.124 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.626 12.175 -0.073 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.388 13.069 0.787 1.00 0.00 H new ATOM 0 HG SER A 121 16.428 11.592 2.152 1.00 0.00 H new ATOM 1852 N TYR A 122 12.224 9.964 0.260 1.00 0.00 N ATOM 1853 CA TYR A 122 10.882 9.946 -0.294 1.00 0.00 C ATOM 1854 C TYR A 122 10.363 8.509 -0.363 1.00 0.00 C ATOM 1855 O TYR A 122 9.215 8.236 -0.021 1.00 0.00 O ATOM 1856 CB TYR A 122 10.907 10.578 -1.686 1.00 0.00 C ATOM 1857 CG TYR A 122 10.300 11.963 -1.745 1.00 0.00 C ATOM 1858 CD1 TYR A 122 8.935 12.154 -1.593 1.00 0.00 C ATOM 1859 CD2 TYR A 122 11.099 13.080 -1.954 1.00 0.00 C ATOM 1860 CE1 TYR A 122 8.380 13.419 -1.648 1.00 0.00 C ATOM 1861 CE2 TYR A 122 10.553 14.348 -2.010 1.00 0.00 C ATOM 1862 CZ TYR A 122 9.194 14.512 -1.856 1.00 0.00 C ATOM 1863 OH TYR A 122 8.646 15.774 -1.911 1.00 0.00 O ATOM 0 H TYR A 122 12.615 9.039 0.440 1.00 0.00 H new ATOM 0 HA TYR A 122 10.211 10.519 0.346 1.00 0.00 H new ATOM 0 HB2 TYR A 122 11.939 10.630 -2.031 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.372 9.928 -2.378 1.00 0.00 H new ATOM 0 HD1 TYR A 122 8.295 11.300 -1.429 1.00 0.00 H new ATOM 0 HD2 TYR A 122 12.165 12.955 -2.075 1.00 0.00 H new ATOM 0 HE1 TYR A 122 7.315 13.550 -1.529 1.00 0.00 H new ATOM 0 HE2 TYR A 122 11.188 15.206 -2.174 1.00 0.00 H new ATOM 0 HH TYR A 122 9.356 16.433 -2.063 1.00 0.00 H new ATOM 1873 N LYS A 123 11.241 7.600 -0.790 1.00 0.00 N ATOM 1874 CA LYS A 123 10.928 6.169 -0.898 1.00 0.00 C ATOM 1875 C LYS A 123 9.444 5.900 -1.187 1.00 0.00 C ATOM 1876 O LYS A 123 9.031 5.806 -2.341 1.00 0.00 O ATOM 1877 CB LYS A 123 11.341 5.454 0.394 1.00 0.00 C ATOM 1878 CG LYS A 123 12.803 5.044 0.431 1.00 0.00 C ATOM 1879 CD LYS A 123 13.163 4.159 -0.751 1.00 0.00 C ATOM 1880 CE LYS A 123 14.049 4.892 -1.744 1.00 0.00 C ATOM 1881 NZ LYS A 123 15.131 4.019 -2.278 1.00 0.00 N ATOM 0 H LYS A 123 12.193 7.833 -1.072 1.00 0.00 H new ATOM 0 HA LYS A 123 11.492 5.781 -1.746 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.136 6.109 1.241 1.00 0.00 H new ATOM 0 HB3 LYS A 123 10.722 4.566 0.520 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.432 5.934 0.425 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.010 4.514 1.360 1.00 0.00 H new ATOM 0 HD2 LYS A 123 13.675 3.265 -0.395 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.252 3.827 -1.250 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.440 5.261 -2.570 1.00 0.00 H new ATOM 0 HE3 LYS A 123 14.492 5.763 -1.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.034 4.534 -2.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.207 3.163 -1.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 14.908 3.750 -3.258 1.00 0.00 H new ATOM 1895 N TYR A 124 8.656 5.767 -0.119 1.00 0.00 N ATOM 1896 CA TYR A 124 7.220 5.491 -0.210 1.00 0.00 C ATOM 1897 C TYR A 124 6.560 6.225 -1.383 1.00 0.00 C ATOM 1898 O TYR A 124 5.567 5.754 -1.941 1.00 0.00 O ATOM 1899 CB TYR A 124 6.533 5.872 1.104 1.00 0.00 C ATOM 1900 CG TYR A 124 7.114 5.179 2.325 1.00 0.00 C ATOM 1901 CD1 TYR A 124 8.258 5.664 2.950 1.00 0.00 C ATOM 1902 CD2 TYR A 124 6.515 4.044 2.856 1.00 0.00 C ATOM 1903 CE1 TYR A 124 8.787 5.037 4.063 1.00 0.00 C ATOM 1904 CE2 TYR A 124 7.037 3.412 3.969 1.00 0.00 C ATOM 1905 CZ TYR A 124 8.173 3.912 4.568 1.00 0.00 C ATOM 1906 OH TYR A 124 8.696 3.287 5.676 1.00 0.00 O ATOM 0 H TYR A 124 8.997 5.848 0.839 1.00 0.00 H new ATOM 0 HA TYR A 124 7.102 4.423 -0.391 1.00 0.00 H new ATOM 0 HB2 TYR A 124 6.606 6.951 1.241 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.472 5.631 1.032 1.00 0.00 H new ATOM 0 HD1 TYR A 124 8.742 6.547 2.559 1.00 0.00 H new ATOM 0 HD2 TYR A 124 5.625 3.648 2.391 1.00 0.00 H new ATOM 0 HE1 TYR A 124 9.677 5.427 4.534 1.00 0.00 H new ATOM 0 HE2 TYR A 124 6.557 2.530 4.367 1.00 0.00 H new ATOM 0 HH TYR A 124 9.611 2.992 5.484 1.00 0.00 H new ATOM 1916 N PHE A 125 7.118 7.374 -1.757 1.00 0.00 N ATOM 1917 CA PHE A 125 6.591 8.162 -2.866 1.00 0.00 C ATOM 1918 C PHE A 125 6.876 7.468 -4.197 1.00 0.00 C ATOM 1919 O PHE A 125 8.019 7.123 -4.495 1.00 0.00 O ATOM 1920 CB PHE A 125 7.218 9.556 -2.848 1.00 0.00 C ATOM 1921 CG PHE A 125 6.547 10.547 -3.756 1.00 0.00 C ATOM 1922 CD1 PHE A 125 5.197 10.831 -3.621 1.00 0.00 C ATOM 1923 CD2 PHE A 125 7.271 11.203 -4.738 1.00 0.00 C ATOM 1924 CE1 PHE A 125 4.583 11.750 -4.449 1.00 0.00 C ATOM 1925 CE2 PHE A 125 6.662 12.124 -5.567 1.00 0.00 C ATOM 1926 CZ PHE A 125 5.317 12.399 -5.423 1.00 0.00 C ATOM 0 H PHE A 125 7.938 7.780 -1.306 1.00 0.00 H new ATOM 0 HA PHE A 125 5.511 8.255 -2.754 1.00 0.00 H new ATOM 0 HB2 PHE A 125 7.193 9.940 -1.828 1.00 0.00 H new ATOM 0 HB3 PHE A 125 8.267 9.473 -3.131 1.00 0.00 H new ATOM 0 HD1 PHE A 125 4.619 10.328 -2.860 1.00 0.00 H new ATOM 0 HD2 PHE A 125 8.323 10.992 -4.856 1.00 0.00 H new ATOM 0 HE1 PHE A 125 3.530 11.961 -4.335 1.00 0.00 H new ATOM 0 HE2 PHE A 125 7.238 12.629 -6.328 1.00 0.00 H new ATOM 0 HZ PHE A 125 4.840 13.120 -6.070 1.00 0.00 H new ATOM 1936 N TYR A 126 5.829 7.257 -4.990 1.00 0.00 N ATOM 1937 CA TYR A 126 5.970 6.593 -6.284 1.00 0.00 C ATOM 1938 C TYR A 126 5.384 7.445 -7.409 1.00 0.00 C ATOM 1939 O TYR A 126 4.174 7.441 -7.633 1.00 0.00 O ATOM 1940 CB TYR A 126 5.270 5.231 -6.249 1.00 0.00 C ATOM 1941 CG TYR A 126 6.217 4.058 -6.119 1.00 0.00 C ATOM 1942 CD1 TYR A 126 7.306 3.924 -6.969 1.00 0.00 C ATOM 1943 CD2 TYR A 126 6.015 3.083 -5.151 1.00 0.00 C ATOM 1944 CE1 TYR A 126 8.168 2.849 -6.858 1.00 0.00 C ATOM 1945 CE2 TYR A 126 6.872 2.007 -5.034 1.00 0.00 C ATOM 1946 CZ TYR A 126 7.947 1.893 -5.889 1.00 0.00 C ATOM 1947 OH TYR A 126 8.805 0.821 -5.780 1.00 0.00 O ATOM 0 H TYR A 126 4.875 7.535 -4.760 1.00 0.00 H new ATOM 0 HA TYR A 126 7.033 6.454 -6.479 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.570 5.215 -5.414 1.00 0.00 H new ATOM 0 HB3 TYR A 126 4.683 5.112 -7.159 1.00 0.00 H new ATOM 0 HD1 TYR A 126 7.483 4.671 -7.729 1.00 0.00 H new ATOM 0 HD2 TYR A 126 5.174 3.168 -4.479 1.00 0.00 H new ATOM 0 HE1 TYR A 126 9.011 2.758 -7.527 1.00 0.00 H new ATOM 0 HE2 TYR A 126 6.701 1.258 -4.275 1.00 0.00 H new ATOM 0 HH TYR A 126 9.625 1.006 -6.283 1.00 0.00 H new ATOM 1957 N VAL A 127 6.247 8.165 -8.120 1.00 0.00 N ATOM 1958 CA VAL A 127 5.805 9.013 -9.224 1.00 0.00 C ATOM 1959 C VAL A 127 6.200 8.419 -10.572 1.00 0.00 C ATOM 1960 O VAL A 127 6.947 9.029 -11.337 1.00 0.00 O ATOM 1961 CB VAL A 127 6.378 10.441 -9.115 1.00 0.00 C ATOM 1962 CG1 VAL A 127 5.517 11.293 -8.197 1.00 0.00 C ATOM 1963 CG2 VAL A 127 7.821 10.410 -8.631 1.00 0.00 C ATOM 0 H VAL A 127 7.253 8.179 -7.953 1.00 0.00 H new ATOM 0 HA VAL A 127 4.718 9.065 -9.157 1.00 0.00 H new ATOM 0 HB VAL A 127 6.366 10.891 -10.108 1.00 0.00 H new ATOM 0 HG11 VAL A 127 5.937 12.297 -8.132 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.504 11.348 -8.596 1.00 0.00 H new ATOM 0 HG13 VAL A 127 5.492 10.846 -7.203 1.00 0.00 H new ATOM 0 HG21 VAL A 127 8.204 11.428 -8.562 1.00 0.00 H new ATOM 0 HG22 VAL A 127 7.865 9.938 -7.649 1.00 0.00 H new ATOM 0 HG23 VAL A 127 8.429 9.841 -9.335 1.00 0.00 H new ATOM 1973 N SER A 128 5.687 7.223 -10.855 1.00 0.00 N ATOM 1974 CA SER A 128 5.973 6.532 -12.112 1.00 0.00 C ATOM 1975 C SER A 128 5.603 5.055 -12.014 1.00 0.00 C ATOM 1976 O SER A 128 6.361 4.251 -11.473 1.00 0.00 O ATOM 1977 CB SER A 128 7.454 6.665 -12.487 1.00 0.00 C ATOM 1978 OG SER A 128 8.264 6.789 -11.332 1.00 0.00 O ATOM 0 H SER A 128 5.068 6.710 -10.227 1.00 0.00 H new ATOM 0 HA SER A 128 5.369 7.000 -12.889 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.766 5.793 -13.062 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.593 7.536 -13.128 1.00 0.00 H new ATOM 0 HG SER A 128 8.378 7.737 -11.113 1.00 0.00 H new ATOM 1984 N ALA A 129 4.432 4.707 -12.546 1.00 0.00 N ATOM 1985 CA ALA A 129 3.952 3.326 -12.526 1.00 0.00 C ATOM 1986 C ALA A 129 5.051 2.338 -12.909 1.00 0.00 C ATOM 1987 O ALA A 129 5.024 1.178 -12.505 1.00 0.00 O ATOM 1988 CB ALA A 129 2.757 3.168 -13.452 1.00 0.00 C ATOM 0 H ALA A 129 3.797 5.365 -12.997 1.00 0.00 H new ATOM 0 HA ALA A 129 3.646 3.100 -11.505 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.411 2.135 -13.426 1.00 0.00 H new ATOM 0 HB2 ALA A 129 1.954 3.828 -13.125 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.048 3.428 -14.470 1.00 0.00 H new ATOM 1994 N GLU A 130 6.021 2.800 -13.691 1.00 0.00 N ATOM 1995 CA GLU A 130 7.123 1.944 -14.115 1.00 0.00 C ATOM 1996 C GLU A 130 7.869 1.386 -12.905 1.00 0.00 C ATOM 1997 O GLU A 130 7.963 0.171 -12.717 1.00 0.00 O ATOM 1998 CB GLU A 130 8.087 2.726 -15.010 1.00 0.00 C ATOM 1999 CG GLU A 130 8.796 1.860 -16.039 1.00 0.00 C ATOM 2000 CD GLU A 130 9.882 0.999 -15.429 1.00 0.00 C ATOM 2001 OE1 GLU A 130 10.942 1.550 -15.064 1.00 0.00 O ATOM 2002 OE2 GLU A 130 9.673 -0.227 -15.311 1.00 0.00 O ATOM 0 H GLU A 130 6.067 3.757 -14.042 1.00 0.00 H new ATOM 0 HA GLU A 130 6.710 1.110 -14.682 1.00 0.00 H new ATOM 0 HB2 GLU A 130 7.535 3.512 -15.526 1.00 0.00 H new ATOM 0 HB3 GLU A 130 8.832 3.218 -14.385 1.00 0.00 H new ATOM 0 HG2 GLU A 130 8.066 1.220 -16.534 1.00 0.00 H new ATOM 0 HG3 GLU A 130 9.233 2.499 -16.807 1.00 0.00 H new ATOM 2009 N GLN A 131 8.404 2.271 -12.079 1.00 0.00 N ATOM 2010 CA GLN A 131 9.135 1.831 -10.905 1.00 0.00 C ATOM 2011 C GLN A 131 8.239 1.047 -9.956 1.00 0.00 C ATOM 2012 O GLN A 131 8.681 0.092 -9.321 1.00 0.00 O ATOM 2013 CB GLN A 131 9.756 2.998 -10.157 1.00 0.00 C ATOM 2014 CG GLN A 131 8.812 4.168 -9.932 1.00 0.00 C ATOM 2015 CD GLN A 131 9.438 5.269 -9.097 1.00 0.00 C ATOM 2016 OE1 GLN A 131 10.594 5.171 -8.686 1.00 0.00 O ATOM 2017 NE2 GLN A 131 8.674 6.325 -8.841 1.00 0.00 N ATOM 0 H GLN A 131 8.347 3.282 -12.198 1.00 0.00 H new ATOM 0 HA GLN A 131 9.933 1.181 -11.263 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.116 2.645 -9.191 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.626 3.349 -10.712 1.00 0.00 H new ATOM 0 HG2 GLN A 131 8.508 4.576 -10.896 1.00 0.00 H new ATOM 0 HG3 GLN A 131 7.908 3.811 -9.438 1.00 0.00 H new ATOM 0 HE21 GLN A 131 7.721 6.364 -9.202 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.041 7.097 -8.283 1.00 0.00 H new ATOM 2026 N VAL A 132 6.978 1.452 -9.850 1.00 0.00 N ATOM 2027 CA VAL A 132 6.046 0.771 -8.962 1.00 0.00 C ATOM 2028 C VAL A 132 5.949 -0.710 -9.320 1.00 0.00 C ATOM 2029 O VAL A 132 5.639 -1.540 -8.468 1.00 0.00 O ATOM 2030 CB VAL A 132 4.634 1.416 -8.975 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.720 2.924 -9.156 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.734 0.796 -10.040 1.00 0.00 C ATOM 0 H VAL A 132 6.582 2.240 -10.362 1.00 0.00 H new ATOM 0 HA VAL A 132 6.441 0.874 -7.951 1.00 0.00 H new ATOM 0 HB VAL A 132 4.182 1.212 -8.004 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.716 3.348 -9.161 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.292 3.357 -8.336 1.00 0.00 H new ATOM 0 HG13 VAL A 132 5.214 3.149 -10.101 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.756 1.276 -10.014 1.00 0.00 H new ATOM 0 HG22 VAL A 132 4.183 0.938 -11.023 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.620 -0.270 -9.844 1.00 0.00 H new ATOM 2042 N VAL A 133 6.220 -1.031 -10.584 1.00 0.00 N ATOM 2043 CA VAL A 133 6.165 -2.413 -11.036 1.00 0.00 C ATOM 2044 C VAL A 133 7.424 -3.172 -10.641 1.00 0.00 C ATOM 2045 O VAL A 133 7.372 -4.373 -10.393 1.00 0.00 O ATOM 2046 CB VAL A 133 5.960 -2.532 -12.560 1.00 0.00 C ATOM 2047 CG1 VAL A 133 7.248 -2.239 -13.314 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.444 -3.919 -12.910 1.00 0.00 C ATOM 0 H VAL A 133 6.477 -0.357 -11.305 1.00 0.00 H new ATOM 0 HA VAL A 133 5.300 -2.855 -10.542 1.00 0.00 H new ATOM 0 HB VAL A 133 5.221 -1.791 -12.863 1.00 0.00 H new ATOM 0 HG11 VAL A 133 7.071 -2.331 -14.386 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.580 -1.226 -13.087 1.00 0.00 H new ATOM 0 HG13 VAL A 133 8.017 -2.950 -13.011 1.00 0.00 H new ATOM 0 HG21 VAL A 133 5.302 -3.993 -13.988 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.166 -4.668 -12.586 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.493 -4.091 -12.406 1.00 0.00 H new ATOM 2058 N GLN A 134 8.562 -2.476 -10.573 1.00 0.00 N ATOM 2059 CA GLN A 134 9.799 -3.151 -10.186 1.00 0.00 C ATOM 2060 C GLN A 134 9.819 -3.324 -8.678 1.00 0.00 C ATOM 2061 O GLN A 134 10.278 -4.344 -8.162 1.00 0.00 O ATOM 2062 CB GLN A 134 11.041 -2.394 -10.665 1.00 0.00 C ATOM 2063 CG GLN A 134 10.905 -0.888 -10.597 1.00 0.00 C ATOM 2064 CD GLN A 134 12.181 -0.171 -10.992 1.00 0.00 C ATOM 2065 OE1 GLN A 134 13.084 0.009 -10.176 1.00 0.00 O ATOM 2066 NE2 GLN A 134 12.261 0.243 -12.252 1.00 0.00 N ATOM 0 H GLN A 134 8.652 -1.480 -10.774 1.00 0.00 H new ATOM 0 HA GLN A 134 9.825 -4.128 -10.668 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.896 -2.699 -10.062 1.00 0.00 H new ATOM 0 HB3 GLN A 134 11.257 -2.684 -11.693 1.00 0.00 H new ATOM 0 HG2 GLN A 134 10.095 -0.570 -11.253 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.627 -0.597 -9.584 1.00 0.00 H new ATOM 0 HE21 GLN A 134 11.488 0.072 -12.895 1.00 0.00 H new ATOM 0 HE22 GLN A 134 13.096 0.732 -12.576 1.00 0.00 H new ATOM 2075 N GLY A 135 9.274 -2.337 -7.981 1.00 0.00 N ATOM 2076 CA GLY A 135 9.191 -2.413 -6.542 1.00 0.00 C ATOM 2077 C GLY A 135 8.087 -3.358 -6.124 1.00 0.00 C ATOM 2078 O GLY A 135 8.154 -3.981 -5.062 1.00 0.00 O ATOM 0 H GLY A 135 8.888 -1.486 -8.389 1.00 0.00 H new ATOM 0 HA2 GLY A 135 10.143 -2.754 -6.135 1.00 0.00 H new ATOM 0 HA3 GLY A 135 9.004 -1.421 -6.130 1.00 0.00 H new ATOM 2082 N MET A 136 7.073 -3.487 -6.984 1.00 0.00 N ATOM 2083 CA MET A 136 5.959 -4.386 -6.712 1.00 0.00 C ATOM 2084 C MET A 136 6.369 -5.814 -7.018 1.00 0.00 C ATOM 2085 O MET A 136 6.312 -6.687 -6.155 1.00 0.00 O ATOM 2086 CB MET A 136 4.736 -4.003 -7.550 1.00 0.00 C ATOM 2087 CG MET A 136 3.874 -2.926 -6.910 1.00 0.00 C ATOM 2088 SD MET A 136 2.782 -2.116 -8.095 1.00 0.00 S ATOM 2089 CE MET A 136 2.426 -0.586 -7.235 1.00 0.00 C ATOM 0 H MET A 136 7.004 -2.982 -7.868 1.00 0.00 H new ATOM 0 HA MET A 136 5.693 -4.302 -5.658 1.00 0.00 H new ATOM 0 HB2 MET A 136 5.070 -3.656 -8.528 1.00 0.00 H new ATOM 0 HB3 MET A 136 4.128 -4.892 -7.718 1.00 0.00 H new ATOM 0 HG2 MET A 136 3.275 -3.370 -6.115 1.00 0.00 H new ATOM 0 HG3 MET A 136 4.518 -2.179 -6.445 1.00 0.00 H new ATOM 0 HE1 MET A 136 2.040 0.148 -7.943 1.00 0.00 H new ATOM 0 HE2 MET A 136 1.682 -0.769 -6.460 1.00 0.00 H new ATOM 0 HE3 MET A 136 3.339 -0.204 -6.779 1.00 0.00 H new ATOM 2099 N LYS A 137 6.804 -6.039 -8.253 1.00 0.00 N ATOM 2100 CA LYS A 137 7.247 -7.356 -8.686 1.00 0.00 C ATOM 2101 C LYS A 137 8.320 -7.905 -7.745 1.00 0.00 C ATOM 2102 O LYS A 137 8.527 -9.116 -7.667 1.00 0.00 O ATOM 2103 CB LYS A 137 7.769 -7.295 -10.126 1.00 0.00 C ATOM 2104 CG LYS A 137 9.093 -6.567 -10.286 1.00 0.00 C ATOM 2105 CD LYS A 137 9.316 -6.125 -11.728 1.00 0.00 C ATOM 2106 CE LYS A 137 9.088 -7.259 -12.717 1.00 0.00 C ATOM 2107 NZ LYS A 137 10.164 -8.286 -12.644 1.00 0.00 N ATOM 0 H LYS A 137 6.859 -5.320 -8.975 1.00 0.00 H new ATOM 0 HA LYS A 137 6.394 -8.033 -8.655 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.880 -8.312 -10.502 1.00 0.00 H new ATOM 0 HB3 LYS A 137 7.021 -6.805 -10.750 1.00 0.00 H new ATOM 0 HG2 LYS A 137 9.113 -5.697 -9.630 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.908 -7.220 -9.974 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.643 -5.300 -11.962 1.00 0.00 H new ATOM 0 HD3 LYS A 137 10.333 -5.748 -11.838 1.00 0.00 H new ATOM 0 HE2 LYS A 137 8.125 -7.728 -12.516 1.00 0.00 H new ATOM 0 HE3 LYS A 137 9.041 -6.855 -13.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 9.971 -9.041 -13.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 11.080 -7.845 -12.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 10.193 -8.691 -11.687 1.00 0.00 H new ATOM 2121 N GLU A 138 8.986 -7.006 -7.021 1.00 0.00 N ATOM 2122 CA GLU A 138 10.020 -7.405 -6.071 1.00 0.00 C ATOM 2123 C GLU A 138 9.394 -8.099 -4.873 1.00 0.00 C ATOM 2124 O GLU A 138 9.606 -9.291 -4.645 1.00 0.00 O ATOM 2125 CB GLU A 138 10.815 -6.184 -5.603 1.00 0.00 C ATOM 2126 CG GLU A 138 12.108 -6.540 -4.888 1.00 0.00 C ATOM 2127 CD GLU A 138 11.877 -6.980 -3.455 1.00 0.00 C ATOM 2128 OE1 GLU A 138 11.483 -6.130 -2.631 1.00 0.00 O ATOM 2129 OE2 GLU A 138 12.090 -8.174 -3.159 1.00 0.00 O ATOM 0 H GLU A 138 8.828 -6.000 -7.075 1.00 0.00 H new ATOM 0 HA GLU A 138 10.697 -8.098 -6.571 1.00 0.00 H new ATOM 0 HB2 GLU A 138 11.046 -5.559 -6.465 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.192 -5.589 -4.935 1.00 0.00 H new ATOM 0 HG2 GLU A 138 12.613 -7.338 -5.433 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.774 -5.677 -4.897 1.00 0.00 H new ATOM 2136 N ALA A 139 8.611 -7.342 -4.117 1.00 0.00 N ATOM 2137 CA ALA A 139 7.930 -7.872 -2.941 1.00 0.00 C ATOM 2138 C ALA A 139 6.818 -8.842 -3.342 1.00 0.00 C ATOM 2139 O ALA A 139 6.302 -9.589 -2.514 1.00 0.00 O ATOM 2140 CB ALA A 139 7.363 -6.735 -2.105 1.00 0.00 C ATOM 0 H ALA A 139 8.430 -6.354 -4.297 1.00 0.00 H new ATOM 0 HA ALA A 139 8.659 -8.420 -2.344 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.857 -7.144 -1.230 1.00 0.00 H new ATOM 0 HB2 ALA A 139 8.173 -6.081 -1.783 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.652 -6.164 -2.702 1.00 0.00 H new ATOM 2146 N GLN A 140 6.451 -8.817 -4.618 1.00 0.00 N ATOM 2147 CA GLN A 140 5.395 -9.678 -5.135 1.00 0.00 C ATOM 2148 C GLN A 140 5.715 -11.162 -4.945 1.00 0.00 C ATOM 2149 O GLN A 140 4.833 -12.010 -5.084 1.00 0.00 O ATOM 2150 CB GLN A 140 5.162 -9.386 -6.618 1.00 0.00 C ATOM 2151 CG GLN A 140 4.055 -8.372 -6.872 1.00 0.00 C ATOM 2152 CD GLN A 140 3.667 -8.276 -8.335 1.00 0.00 C ATOM 2153 OE1 GLN A 140 3.483 -7.182 -8.867 1.00 0.00 O ATOM 2154 NE2 GLN A 140 3.544 -9.422 -8.996 1.00 0.00 N ATOM 0 H GLN A 140 6.873 -8.206 -5.317 1.00 0.00 H new ATOM 0 HA GLN A 140 4.491 -9.460 -4.567 1.00 0.00 H new ATOM 0 HB2 GLN A 140 6.089 -9.017 -7.057 1.00 0.00 H new ATOM 0 HB3 GLN A 140 4.915 -10.317 -7.129 1.00 0.00 H new ATOM 0 HG2 GLN A 140 3.178 -8.645 -6.286 1.00 0.00 H new ATOM 0 HG3 GLN A 140 4.380 -7.392 -6.522 1.00 0.00 H new ATOM 0 HE21 GLN A 140 3.706 -10.307 -8.516 1.00 0.00 H new ATOM 0 HE22 GLN A 140 3.288 -9.416 -9.983 1.00 0.00 H new ATOM 2163 N GLU A 141 6.973 -11.481 -4.648 1.00 0.00 N ATOM 2164 CA GLU A 141 7.376 -12.874 -4.465 1.00 0.00 C ATOM 2165 C GLU A 141 7.822 -13.161 -3.033 1.00 0.00 C ATOM 2166 O GLU A 141 7.479 -14.199 -2.466 1.00 0.00 O ATOM 2167 CB GLU A 141 8.492 -13.227 -5.434 1.00 0.00 C ATOM 2168 CG GLU A 141 9.604 -12.220 -5.396 1.00 0.00 C ATOM 2169 CD GLU A 141 10.772 -12.589 -6.290 1.00 0.00 C ATOM 2170 OE1 GLU A 141 10.741 -12.226 -7.485 1.00 0.00 O ATOM 2171 OE2 GLU A 141 11.716 -13.239 -5.795 1.00 0.00 O ATOM 0 H GLU A 141 7.724 -10.802 -4.530 1.00 0.00 H new ATOM 0 HA GLU A 141 6.503 -13.494 -4.668 1.00 0.00 H new ATOM 0 HB2 GLU A 141 8.887 -14.213 -5.190 1.00 0.00 H new ATOM 0 HB3 GLU A 141 8.090 -13.286 -6.445 1.00 0.00 H new ATOM 0 HG2 GLU A 141 9.216 -11.247 -5.699 1.00 0.00 H new ATOM 0 HG3 GLU A 141 9.958 -12.117 -4.370 1.00 0.00 H new ATOM 2178 N ARG A 142 8.596 -12.249 -2.457 1.00 0.00 N ATOM 2179 CA ARG A 142 9.096 -12.425 -1.094 1.00 0.00 C ATOM 2180 C ARG A 142 8.022 -12.121 -0.052 1.00 0.00 C ATOM 2181 O ARG A 142 8.090 -12.610 1.076 1.00 0.00 O ATOM 2182 CB ARG A 142 10.329 -11.544 -0.850 1.00 0.00 C ATOM 2183 CG ARG A 142 10.157 -10.100 -1.292 1.00 0.00 C ATOM 2184 CD ARG A 142 9.552 -9.247 -0.189 1.00 0.00 C ATOM 2185 NE ARG A 142 10.358 -9.275 1.028 1.00 0.00 N ATOM 2186 CZ ARG A 142 11.462 -8.552 1.202 1.00 0.00 C ATOM 2187 NH1 ARG A 142 11.895 -7.744 0.241 1.00 0.00 N ATOM 2188 NH2 ARG A 142 12.137 -8.636 2.342 1.00 0.00 N ATOM 0 H ARG A 142 8.891 -11.383 -2.908 1.00 0.00 H new ATOM 0 HA ARG A 142 9.380 -13.472 -0.988 1.00 0.00 H new ATOM 0 HB2 ARG A 142 10.570 -11.561 0.213 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.180 -11.975 -1.377 1.00 0.00 H new ATOM 0 HG2 ARG A 142 11.124 -9.690 -1.581 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.518 -10.062 -2.174 1.00 0.00 H new ATOM 0 HD2 ARG A 142 9.457 -8.218 -0.537 1.00 0.00 H new ATOM 0 HD3 ARG A 142 8.546 -9.603 0.034 1.00 0.00 H new ATOM 0 HE ARG A 142 10.058 -9.884 1.789 1.00 0.00 H new ATOM 0 HH11 ARG A 142 11.381 -7.675 -0.637 1.00 0.00 H new ATOM 0 HH12 ARG A 142 12.742 -7.193 0.381 1.00 0.00 H new ATOM 0 HH21 ARG A 142 11.810 -9.254 3.084 1.00 0.00 H new ATOM 0 HH22 ARG A 142 12.983 -8.082 2.476 1.00 0.00 H new ATOM 2202 N LEU A 143 7.033 -11.316 -0.425 1.00 0.00 N ATOM 2203 CA LEU A 143 5.957 -10.962 0.493 1.00 0.00 C ATOM 2204 C LEU A 143 4.760 -11.893 0.327 1.00 0.00 C ATOM 2205 O LEU A 143 4.061 -12.199 1.292 1.00 0.00 O ATOM 2206 CB LEU A 143 5.530 -9.507 0.275 1.00 0.00 C ATOM 2207 CG LEU A 143 5.642 -8.606 1.504 1.00 0.00 C ATOM 2208 CD1 LEU A 143 4.648 -9.030 2.573 1.00 0.00 C ATOM 2209 CD2 LEU A 143 7.064 -8.623 2.050 1.00 0.00 C ATOM 0 H LEU A 143 6.954 -10.898 -1.352 1.00 0.00 H new ATOM 0 HA LEU A 143 6.333 -11.074 1.510 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.138 -9.082 -0.524 1.00 0.00 H new ATOM 0 HB3 LEU A 143 4.496 -9.496 -0.071 1.00 0.00 H new ATOM 0 HG LEU A 143 5.403 -7.585 1.205 1.00 0.00 H new ATOM 0 HD11 LEU A 143 4.744 -8.376 3.439 1.00 0.00 H new ATOM 0 HD12 LEU A 143 3.635 -8.960 2.176 1.00 0.00 H new ATOM 0 HD13 LEU A 143 4.851 -10.059 2.871 1.00 0.00 H new ATOM 0 HD21 LEU A 143 7.126 -7.976 2.925 1.00 0.00 H new ATOM 0 HD22 LEU A 143 7.333 -9.641 2.332 1.00 0.00 H new ATOM 0 HD23 LEU A 143 7.752 -8.264 1.284 1.00 0.00 H new ATOM 2221 N THR A 144 4.529 -12.343 -0.902 1.00 0.00 N ATOM 2222 CA THR A 144 3.420 -13.238 -1.192 1.00 0.00 C ATOM 2223 C THR A 144 3.649 -14.608 -0.561 1.00 0.00 C ATOM 2224 O THR A 144 2.698 -15.294 -0.180 1.00 0.00 O ATOM 2225 CB THR A 144 3.243 -13.380 -2.700 1.00 0.00 C ATOM 2226 OG1 THR A 144 4.472 -13.709 -3.321 1.00 0.00 O ATOM 2227 CG2 THR A 144 2.711 -12.127 -3.360 1.00 0.00 C ATOM 0 H THR A 144 5.098 -12.101 -1.713 1.00 0.00 H new ATOM 0 HA THR A 144 2.513 -12.810 -0.764 1.00 0.00 H new ATOM 0 HB THR A 144 2.511 -14.177 -2.832 1.00 0.00 H new ATOM 0 HG1 THR A 144 4.501 -13.315 -4.218 1.00 0.00 H new ATOM 0 HG21 THR A 144 2.609 -12.296 -4.432 1.00 0.00 H new ATOM 0 HG22 THR A 144 1.738 -11.878 -2.937 1.00 0.00 H new ATOM 0 HG23 THR A 144 3.403 -11.303 -3.187 1.00 0.00 H new