USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 905 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 60 SER OG : rot 101:sc= 0.454! USER MOD Set 1.2: B 60 SER OG : rot 82:sc= 1.08 USER MOD Set 2.1: B 32 LYS NZ :NH3+ -168:sc= 0.634 (180deg=-0.42) USER MOD Set 2.2: B 33 GLN : amide:sc= -0.452 K(o=0.18,f=-24!) USER MOD Set 3.1: A 49 MET CE :methyl 157:sc= -4.12 (180deg=-5.33!) USER MOD Set 3.2: A 53 ASN :FLIP amide:sc= -3.43! C(o=-31!,f=-18!) USER MOD Set 3.3: B 49 MET CE :methyl 151:sc= -4.5! (180deg=-6.95!) USER MOD Set 3.4: B 53 ASN :FLIP amide:sc= -5.52! C(o=-31!,f=-18!) USER MOD Set 4.1: A 32 LYS NZ :NH3+ -167:sc= 0.758 (180deg=-0.404) USER MOD Set 4.2: A 33 GLN : amide:sc= 0.0764 K(o=0.83,f=-22!) USER MOD Single : A 23 HIS : no HD1:sc= -0.0889 X(o=-0.089,f=-0.18) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.122 USER MOD Single : A 26 SER OG : rot 68:sc= 0.708 USER MOD Single : A 28 GLN :FLIP amide:sc= -14.2! C(o=-18!,f=-14!) USER MOD Single : A 29 ASN : amide:sc= -0.153 K(o=-0.15,f=-1.4) USER MOD Single : A 30 MET CE :methyl -135:sc= -0.622 (180deg=-4.74!) USER MOD Single : A 31 SER OG : rot 180:sc= -1.18 USER MOD Single : A 37 LYS NZ :NH3+ 146:sc= -0.161 (180deg=-1.37!) USER MOD Single : A 39 TYR OH : rot 144:sc= -2.81! USER MOD Single : A 44 LYS NZ :NH3+ -168:sc= -0.0923 (180deg=-0.363) USER MOD Single : A 45 CYS SG : rot 82:sc= 0.144 USER MOD Single : A 47 SER OG : rot 87:sc= 0.803 USER MOD Single : A 54 ASN : amide:sc= -0.0195 K(o=-0.02,f=-1.2) USER MOD Single : A 61 LYS NZ :NH3+ -161:sc= 0.0135 (180deg=-2.24!) USER MOD Single : B 23 HIS : no HD1:sc= -0.107 X(o=-0.11,f=-0.34) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0.121 USER MOD Single : B 26 SER OG : rot 180:sc= 0.139 USER MOD Single : B 28 GLN :FLIP amide:sc= -9.77! C(o=-16!,f=-9.8!) USER MOD Single : B 29 ASN : amide:sc= -0.0848 K(o=-0.085,f=-1.3) USER MOD Single : B 30 MET CE :methyl -138:sc= -0.437 (180deg=-4.49!) USER MOD Single : B 31 SER OG : rot 180:sc= -1.3 USER MOD Single : B 37 LYS NZ :NH3+ 168:sc= -0.627 (180deg=-0.867) USER MOD Single : B 39 TYR OH : rot 145:sc= -2.59! USER MOD Single : B 44 LYS NZ :NH3+ -173:sc= 0.222 (180deg=-0.253!) USER MOD Single : B 45 CYS SG : rot 81:sc= 0.145 USER MOD Single : B 47 SER OG : rot 85:sc= 0.905 USER MOD Single : B 54 ASN : amide:sc= -0.258 K(o=-0.26,f=-2.6!) USER MOD Single : B 61 LYS NZ :NH3+ -164:sc= -0.108! (180deg=-1.99!) USER MOD Single : B 84 ASN : amide:sc= 0.0946! X(o=0.095!,f=-0.34) USER MOD Single : B 86 GLN : amide:sc= -0.646 X(o=-0.65,f=-0.38) USER MOD ----------------------------------------------------------------- ATOM 332 N HIS A 23 152.410 11.176 -15.010 1.00 0.00 N ATOM 333 CA HIS A 23 152.082 12.305 -14.094 1.00 0.00 C ATOM 334 C HIS A 23 151.295 11.779 -12.905 1.00 0.00 C ATOM 335 O HIS A 23 150.978 10.590 -12.819 1.00 0.00 O ATOM 336 CB HIS A 23 151.217 13.337 -14.845 1.00 0.00 C ATOM 337 CG HIS A 23 152.085 14.358 -15.521 1.00 0.00 C ATOM 338 ND1 HIS A 23 153.412 14.112 -15.842 1.00 0.00 N ATOM 339 CD2 HIS A 23 151.826 15.631 -15.953 1.00 0.00 C ATOM 340 CE1 HIS A 23 153.894 15.215 -16.443 1.00 0.00 C ATOM 341 NE2 HIS A 23 152.966 16.171 -16.534 1.00 0.00 N ATOM 0 HA HIS A 23 153.005 12.772 -13.751 1.00 0.00 H new ATOM 0 HB2 HIS A 23 150.597 12.831 -15.585 1.00 0.00 H new ATOM 0 HB3 HIS A 23 150.541 13.831 -14.147 1.00 0.00 H new ATOM 0 HD2 HIS A 23 150.878 16.139 -15.856 1.00 0.00 H new ATOM 0 HE1 HIS A 23 154.906 15.315 -16.807 1.00 0.00 H new ATOM 0 HE2 HIS A 23 153.072 17.099 -16.943 1.00 0.00 H new ATOM 350 N THR A 24 150.949 12.659 -12.008 1.00 0.00 N ATOM 351 CA THR A 24 150.164 12.292 -10.807 1.00 0.00 C ATOM 352 C THR A 24 148.986 11.390 -11.202 1.00 0.00 C ATOM 353 O THR A 24 148.700 10.411 -10.523 1.00 0.00 O ATOM 354 CB THR A 24 149.636 13.585 -10.165 1.00 0.00 C ATOM 355 OG1 THR A 24 150.515 14.670 -10.482 1.00 0.00 O ATOM 356 CG2 THR A 24 149.524 13.434 -8.643 1.00 0.00 C ATOM 0 H THR A 24 151.188 13.649 -12.064 1.00 0.00 H new ATOM 0 HA THR A 24 150.793 11.749 -10.102 1.00 0.00 H new ATOM 0 HB THR A 24 148.642 13.790 -10.562 1.00 0.00 H new ATOM 0 HG1 THR A 24 150.177 15.495 -10.074 1.00 0.00 H new ATOM 0 HG21 THR A 24 149.148 14.362 -8.212 1.00 0.00 H new ATOM 0 HG22 THR A 24 148.838 12.621 -8.408 1.00 0.00 H new ATOM 0 HG23 THR A 24 150.506 13.212 -8.226 1.00 0.00 H new ATOM 364 N GLU A 25 148.305 11.716 -12.275 1.00 0.00 N ATOM 365 CA GLU A 25 147.102 10.937 -12.707 1.00 0.00 C ATOM 366 C GLU A 25 147.267 9.470 -12.365 1.00 0.00 C ATOM 367 O GLU A 25 146.496 8.922 -11.599 1.00 0.00 O ATOM 368 CB GLU A 25 146.967 11.045 -14.249 1.00 0.00 C ATOM 369 CG GLU A 25 147.465 12.407 -14.745 1.00 0.00 C ATOM 370 CD GLU A 25 147.023 12.589 -16.170 1.00 0.00 C ATOM 371 OE1 GLU A 25 145.845 12.684 -16.395 1.00 0.00 O ATOM 372 OE2 GLU A 25 147.856 12.631 -17.024 1.00 0.00 O ATOM 0 H GLU A 25 148.537 12.504 -12.880 1.00 0.00 H new ATOM 0 HA GLU A 25 146.226 11.338 -12.198 1.00 0.00 H new ATOM 0 HB2 GLU A 25 147.539 10.248 -14.725 1.00 0.00 H new ATOM 0 HB3 GLU A 25 145.925 10.906 -14.538 1.00 0.00 H new ATOM 0 HG2 GLU A 25 147.066 13.206 -14.120 1.00 0.00 H new ATOM 0 HG3 GLU A 25 148.551 12.461 -14.676 1.00 0.00 H new ATOM 379 N SER A 26 148.207 8.816 -12.970 1.00 0.00 N ATOM 380 CA SER A 26 148.395 7.357 -12.729 1.00 0.00 C ATOM 381 C SER A 26 148.237 7.035 -11.231 1.00 0.00 C ATOM 382 O SER A 26 147.589 6.076 -10.874 1.00 0.00 O ATOM 383 CB SER A 26 149.760 6.912 -13.246 1.00 0.00 C ATOM 384 OG SER A 26 150.387 8.012 -13.946 1.00 0.00 O ATOM 0 H SER A 26 148.865 9.230 -13.631 1.00 0.00 H new ATOM 0 HA SER A 26 147.628 6.806 -13.273 1.00 0.00 H new ATOM 0 HB2 SER A 26 150.388 6.588 -12.416 1.00 0.00 H new ATOM 0 HB3 SER A 26 149.648 6.057 -13.913 1.00 0.00 H new ATOM 0 HG SER A 26 150.620 8.717 -13.306 1.00 0.00 H new ATOM 390 N LEU A 27 148.744 7.862 -10.362 1.00 0.00 N ATOM 391 CA LEU A 27 148.578 7.594 -8.920 1.00 0.00 C ATOM 392 C LEU A 27 147.117 7.748 -8.537 1.00 0.00 C ATOM 393 O LEU A 27 146.554 6.902 -7.873 1.00 0.00 O ATOM 394 CB LEU A 27 149.434 8.559 -8.112 1.00 0.00 C ATOM 395 CG LEU A 27 150.908 8.165 -8.238 1.00 0.00 C ATOM 396 CD1 LEU A 27 151.796 9.333 -7.824 1.00 0.00 C ATOM 397 CD2 LEU A 27 151.208 6.961 -7.335 1.00 0.00 C ATOM 0 H LEU A 27 149.264 8.708 -10.593 1.00 0.00 H new ATOM 0 HA LEU A 27 148.898 6.574 -8.705 1.00 0.00 H new ATOM 0 HB2 LEU A 27 149.287 9.578 -8.470 1.00 0.00 H new ATOM 0 HB3 LEU A 27 149.130 8.542 -7.065 1.00 0.00 H new ATOM 0 HG LEU A 27 151.112 7.902 -9.276 1.00 0.00 H new ATOM 0 HD11 LEU A 27 152.843 9.045 -7.916 1.00 0.00 H new ATOM 0 HD12 LEU A 27 151.597 10.188 -8.470 1.00 0.00 H new ATOM 0 HD13 LEU A 27 151.584 9.602 -6.789 1.00 0.00 H new ATOM 0 HD21 LEU A 27 152.259 6.687 -7.431 1.00 0.00 H new ATOM 0 HD22 LEU A 27 150.994 7.221 -6.298 1.00 0.00 H new ATOM 0 HD23 LEU A 27 150.585 6.118 -7.634 1.00 0.00 H new ATOM 409 N GLN A 28 146.462 8.780 -8.994 1.00 0.00 N ATOM 410 CA GLN A 28 145.017 8.915 -8.689 1.00 0.00 C ATOM 411 C GLN A 28 144.252 7.876 -9.473 1.00 0.00 C ATOM 412 O GLN A 28 143.199 7.432 -9.055 1.00 0.00 O ATOM 413 CB GLN A 28 144.499 10.307 -9.049 1.00 0.00 C ATOM 414 CG GLN A 28 145.270 11.357 -8.269 1.00 0.00 C ATOM 415 CD GLN A 28 146.532 11.703 -9.005 1.00 0.00 C ATOM 416 OE1 GLN A 28 147.640 11.265 -8.555 1.00 0.00 O flip ATOM 417 NE2 GLN A 28 146.504 12.364 -10.017 1.00 0.00 N flip ATOM 0 H GLN A 28 146.864 9.527 -9.560 1.00 0.00 H new ATOM 0 HA GLN A 28 144.874 8.768 -7.618 1.00 0.00 H new ATOM 0 HB2 GLN A 28 144.609 10.481 -10.119 1.00 0.00 H new ATOM 0 HB3 GLN A 28 143.435 10.380 -8.822 1.00 0.00 H new ATOM 0 HG2 GLN A 28 144.658 12.249 -8.137 1.00 0.00 H new ATOM 0 HG3 GLN A 28 145.508 10.983 -7.273 1.00 0.00 H new ATOM 0 HE21 GLN A 28 145.614 12.713 -10.374 1.00 0.00 H new ATOM 0 HE22 GLN A 28 147.370 12.573 -10.514 1.00 0.00 H new ATOM 426 N ASN A 29 144.724 7.520 -10.627 1.00 0.00 N ATOM 427 CA ASN A 29 143.970 6.552 -11.448 1.00 0.00 C ATOM 428 C ASN A 29 144.063 5.183 -10.785 1.00 0.00 C ATOM 429 O ASN A 29 143.411 4.240 -11.198 1.00 0.00 O ATOM 430 CB ASN A 29 144.545 6.485 -12.858 1.00 0.00 C ATOM 431 CG ASN A 29 144.496 7.853 -13.543 1.00 0.00 C ATOM 432 OD1 ASN A 29 143.830 8.772 -13.074 1.00 0.00 O ATOM 433 ND2 ASN A 29 145.169 8.040 -14.637 1.00 0.00 N ATOM 0 H ASN A 29 145.596 7.857 -11.034 1.00 0.00 H new ATOM 0 HA ASN A 29 142.929 6.866 -11.521 1.00 0.00 H new ATOM 0 HB2 ASN A 29 145.576 6.133 -12.817 1.00 0.00 H new ATOM 0 HB3 ASN A 29 143.984 5.760 -13.448 1.00 0.00 H new ATOM 0 HD21 ASN A 29 145.143 8.947 -15.103 1.00 0.00 H new ATOM 0 HD22 ASN A 29 145.724 7.280 -15.031 1.00 0.00 H new ATOM 440 N MET A 30 144.871 5.061 -9.765 1.00 0.00 N ATOM 441 CA MET A 30 145.017 3.779 -9.063 1.00 0.00 C ATOM 442 C MET A 30 144.067 3.754 -7.887 1.00 0.00 C ATOM 443 O MET A 30 143.603 4.787 -7.427 1.00 0.00 O ATOM 444 CB MET A 30 146.447 3.642 -8.544 1.00 0.00 C ATOM 445 CG MET A 30 147.405 3.404 -9.719 1.00 0.00 C ATOM 446 SD MET A 30 148.257 1.833 -9.474 1.00 0.00 S ATOM 447 CE MET A 30 149.259 2.351 -8.060 1.00 0.00 C ATOM 0 H MET A 30 145.442 5.819 -9.391 1.00 0.00 H new ATOM 0 HA MET A 30 144.794 2.960 -9.747 1.00 0.00 H new ATOM 0 HB2 MET A 30 146.736 4.544 -8.004 1.00 0.00 H new ATOM 0 HB3 MET A 30 146.510 2.814 -7.838 1.00 0.00 H new ATOM 0 HG2 MET A 30 146.852 3.390 -10.658 1.00 0.00 H new ATOM 0 HG3 MET A 30 148.127 4.217 -9.786 1.00 0.00 H new ATOM 0 HE1 MET A 30 150.285 2.008 -8.196 1.00 0.00 H new ATOM 0 HE2 MET A 30 149.247 3.438 -7.984 1.00 0.00 H new ATOM 0 HE3 MET A 30 148.850 1.919 -7.147 1.00 0.00 H new ATOM 457 N SER A 31 143.764 2.609 -7.398 1.00 0.00 N ATOM 458 CA SER A 31 142.816 2.509 -6.266 1.00 0.00 C ATOM 459 C SER A 31 143.600 2.605 -4.956 1.00 0.00 C ATOM 460 O SER A 31 144.757 2.209 -4.874 1.00 0.00 O ATOM 461 CB SER A 31 142.053 1.183 -6.373 1.00 0.00 C ATOM 462 OG SER A 31 142.124 0.708 -7.742 1.00 0.00 O ATOM 0 H SER A 31 144.133 1.719 -7.733 1.00 0.00 H new ATOM 0 HA SER A 31 142.090 3.322 -6.290 1.00 0.00 H new ATOM 0 HB2 SER A 31 142.483 0.445 -5.695 1.00 0.00 H new ATOM 0 HB3 SER A 31 141.014 1.321 -6.076 1.00 0.00 H new ATOM 0 HG SER A 31 141.640 -0.141 -7.819 1.00 0.00 H new ATOM 468 N LYS A 32 143.025 3.227 -3.974 1.00 0.00 N ATOM 469 CA LYS A 32 143.744 3.492 -2.696 1.00 0.00 C ATOM 470 C LYS A 32 144.431 2.243 -2.167 1.00 0.00 C ATOM 471 O LYS A 32 145.570 2.296 -1.747 1.00 0.00 O ATOM 472 CB LYS A 32 142.763 4.015 -1.641 1.00 0.00 C ATOM 473 CG LYS A 32 143.537 4.425 -0.376 1.00 0.00 C ATOM 474 CD LYS A 32 142.749 5.483 0.409 1.00 0.00 C ATOM 475 CE LYS A 32 142.015 4.835 1.588 1.00 0.00 C ATOM 476 NZ LYS A 32 141.171 3.704 1.102 1.00 0.00 N ATOM 0 H LYS A 32 142.066 3.572 -4.000 1.00 0.00 H new ATOM 0 HA LYS A 32 144.508 4.242 -2.900 1.00 0.00 H new ATOM 0 HB2 LYS A 32 142.211 4.868 -2.034 1.00 0.00 H new ATOM 0 HB3 LYS A 32 142.030 3.246 -1.398 1.00 0.00 H new ATOM 0 HG2 LYS A 32 143.711 3.551 0.252 1.00 0.00 H new ATOM 0 HG3 LYS A 32 144.515 4.820 -0.651 1.00 0.00 H new ATOM 0 HD2 LYS A 32 143.427 6.254 0.774 1.00 0.00 H new ATOM 0 HD3 LYS A 32 142.032 5.974 -0.249 1.00 0.00 H new ATOM 0 HE2 LYS A 32 142.736 4.473 2.322 1.00 0.00 H new ATOM 0 HE3 LYS A 32 141.392 5.575 2.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 140.515 3.412 1.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 140.629 4.009 0.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 141.781 2.902 0.844 1.00 0.00 H new ATOM 490 N GLN A 33 143.755 1.146 -2.125 1.00 0.00 N ATOM 491 CA GLN A 33 144.380 -0.046 -1.516 1.00 0.00 C ATOM 492 C GLN A 33 145.550 -0.549 -2.364 1.00 0.00 C ATOM 493 O GLN A 33 146.526 -1.060 -1.834 1.00 0.00 O ATOM 494 CB GLN A 33 143.329 -1.131 -1.273 1.00 0.00 C ATOM 495 CG GLN A 33 142.594 -0.835 0.060 1.00 0.00 C ATOM 496 CD GLN A 33 141.747 0.437 -0.075 1.00 0.00 C ATOM 497 OE1 GLN A 33 142.120 1.519 0.408 1.00 0.00 O ATOM 498 NE2 GLN A 33 140.633 0.371 -0.697 1.00 0.00 N ATOM 0 H GLN A 33 142.807 1.019 -2.481 1.00 0.00 H new ATOM 0 HA GLN A 33 144.794 0.231 -0.547 1.00 0.00 H new ATOM 0 HB2 GLN A 33 142.617 -1.156 -2.098 1.00 0.00 H new ATOM 0 HB3 GLN A 33 143.803 -2.112 -1.231 1.00 0.00 H new ATOM 0 HG2 GLN A 33 141.957 -1.678 0.328 1.00 0.00 H new ATOM 0 HG3 GLN A 33 143.319 -0.715 0.865 1.00 0.00 H new ATOM 0 HE21 GLN A 33 140.323 -0.515 -1.095 1.00 0.00 H new ATOM 0 HE22 GLN A 33 140.054 1.205 -0.795 1.00 0.00 H new ATOM 507 N GLU A 34 145.524 -0.329 -3.656 1.00 0.00 N ATOM 508 CA GLU A 34 146.694 -0.738 -4.483 1.00 0.00 C ATOM 509 C GLU A 34 147.878 0.115 -4.043 1.00 0.00 C ATOM 510 O GLU A 34 148.862 -0.391 -3.527 1.00 0.00 O ATOM 511 CB GLU A 34 146.421 -0.513 -5.988 1.00 0.00 C ATOM 512 CG GLU A 34 144.931 -0.665 -6.306 1.00 0.00 C ATOM 513 CD GLU A 34 144.745 -0.660 -7.804 1.00 0.00 C ATOM 514 OE1 GLU A 34 144.842 -1.697 -8.387 1.00 0.00 O ATOM 515 OE2 GLU A 34 144.498 0.390 -8.350 1.00 0.00 O ATOM 0 H GLU A 34 144.755 0.109 -4.164 1.00 0.00 H new ATOM 0 HA GLU A 34 146.895 -1.800 -4.342 1.00 0.00 H new ATOM 0 HB2 GLU A 34 146.758 0.482 -6.277 1.00 0.00 H new ATOM 0 HB3 GLU A 34 146.996 -1.228 -6.576 1.00 0.00 H new ATOM 0 HG2 GLU A 34 144.548 -1.594 -5.882 1.00 0.00 H new ATOM 0 HG3 GLU A 34 144.365 0.149 -5.854 1.00 0.00 H new ATOM 522 N LEU A 35 147.753 1.409 -4.186 1.00 0.00 N ATOM 523 CA LEU A 35 148.836 2.363 -3.754 1.00 0.00 C ATOM 524 C LEU A 35 149.315 1.980 -2.352 1.00 0.00 C ATOM 525 O LEU A 35 150.476 2.148 -1.998 1.00 0.00 O ATOM 526 CB LEU A 35 148.247 3.789 -3.694 1.00 0.00 C ATOM 527 CG LEU A 35 147.685 4.208 -5.066 1.00 0.00 C ATOM 528 CD1 LEU A 35 146.446 5.075 -4.874 1.00 0.00 C ATOM 529 CD2 LEU A 35 148.730 5.016 -5.832 1.00 0.00 C ATOM 0 H LEU A 35 146.933 1.860 -4.591 1.00 0.00 H new ATOM 0 HA LEU A 35 149.666 2.321 -4.459 1.00 0.00 H new ATOM 0 HB2 LEU A 35 147.456 3.829 -2.945 1.00 0.00 H new ATOM 0 HB3 LEU A 35 149.018 4.493 -3.382 1.00 0.00 H new ATOM 0 HG LEU A 35 147.428 3.309 -5.626 1.00 0.00 H new ATOM 0 HD11 LEU A 35 146.053 5.368 -5.847 1.00 0.00 H new ATOM 0 HD12 LEU A 35 145.688 4.511 -4.331 1.00 0.00 H new ATOM 0 HD13 LEU A 35 146.710 5.967 -4.306 1.00 0.00 H new ATOM 0 HD21 LEU A 35 148.325 5.309 -6.801 1.00 0.00 H new ATOM 0 HD22 LEU A 35 148.989 5.909 -5.262 1.00 0.00 H new ATOM 0 HD23 LEU A 35 149.623 4.408 -5.980 1.00 0.00 H new ATOM 541 N ILE A 36 148.424 1.509 -1.550 1.00 0.00 N ATOM 542 CA ILE A 36 148.771 1.136 -0.167 1.00 0.00 C ATOM 543 C ILE A 36 149.650 -0.113 -0.182 1.00 0.00 C ATOM 544 O ILE A 36 150.709 -0.139 0.417 1.00 0.00 O ATOM 545 CB ILE A 36 147.459 0.902 0.603 1.00 0.00 C ATOM 546 CG1 ILE A 36 146.870 2.271 0.980 1.00 0.00 C ATOM 547 CG2 ILE A 36 147.686 0.055 1.866 1.00 0.00 C ATOM 548 CD1 ILE A 36 145.564 2.088 1.732 1.00 0.00 C ATOM 0 H ILE A 36 147.446 1.363 -1.799 1.00 0.00 H new ATOM 0 HA ILE A 36 149.336 1.926 0.327 1.00 0.00 H new ATOM 0 HB ILE A 36 146.767 0.350 -0.033 1.00 0.00 H new ATOM 0 HG12 ILE A 36 147.579 2.823 1.596 1.00 0.00 H new ATOM 0 HG13 ILE A 36 146.701 2.863 0.081 1.00 0.00 H new ATOM 0 HG21 ILE A 36 146.737 -0.089 2.383 1.00 0.00 H new ATOM 0 HG22 ILE A 36 148.097 -0.915 1.585 1.00 0.00 H new ATOM 0 HG23 ILE A 36 148.385 0.567 2.527 1.00 0.00 H new ATOM 0 HD11 ILE A 36 145.155 3.064 1.994 1.00 0.00 H new ATOM 0 HD12 ILE A 36 144.853 1.554 1.102 1.00 0.00 H new ATOM 0 HD13 ILE A 36 145.745 1.514 2.641 1.00 0.00 H new ATOM 560 N LYS A 37 149.234 -1.145 -0.850 1.00 0.00 N ATOM 561 CA LYS A 37 150.050 -2.373 -0.887 1.00 0.00 C ATOM 562 C LYS A 37 151.453 -2.029 -1.393 1.00 0.00 C ATOM 563 O LYS A 37 152.469 -2.410 -0.790 1.00 0.00 O ATOM 564 CB LYS A 37 149.388 -3.366 -1.819 1.00 0.00 C ATOM 565 CG LYS A 37 148.020 -3.802 -1.254 1.00 0.00 C ATOM 566 CD LYS A 37 148.208 -4.824 -0.113 1.00 0.00 C ATOM 567 CE LYS A 37 147.608 -6.178 -0.518 1.00 0.00 C ATOM 568 NZ LYS A 37 148.109 -6.564 -1.865 1.00 0.00 N ATOM 0 H LYS A 37 148.359 -1.187 -1.373 1.00 0.00 H new ATOM 0 HA LYS A 37 150.130 -2.808 0.109 1.00 0.00 H new ATOM 0 HB2 LYS A 37 149.256 -2.918 -2.804 1.00 0.00 H new ATOM 0 HB3 LYS A 37 150.030 -4.237 -1.948 1.00 0.00 H new ATOM 0 HG2 LYS A 37 147.478 -2.931 -0.885 1.00 0.00 H new ATOM 0 HG3 LYS A 37 147.415 -4.241 -2.048 1.00 0.00 H new ATOM 0 HD2 LYS A 37 149.268 -4.939 0.112 1.00 0.00 H new ATOM 0 HD3 LYS A 37 147.727 -4.461 0.795 1.00 0.00 H new ATOM 0 HE2 LYS A 37 147.878 -6.940 0.213 1.00 0.00 H new ATOM 0 HE3 LYS A 37 146.520 -6.117 -0.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 148.216 -7.597 -1.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 147.432 -6.252 -2.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 149.030 -6.113 -2.035 1.00 0.00 H new ATOM 582 N GLU A 38 151.539 -1.280 -2.459 1.00 0.00 N ATOM 583 CA GLU A 38 152.869 -0.917 -2.945 1.00 0.00 C ATOM 584 C GLU A 38 153.616 -0.109 -1.892 1.00 0.00 C ATOM 585 O GLU A 38 154.814 -0.228 -1.772 1.00 0.00 O ATOM 586 CB GLU A 38 152.844 -0.251 -4.331 1.00 0.00 C ATOM 587 CG GLU A 38 151.700 0.744 -4.538 1.00 0.00 C ATOM 588 CD GLU A 38 151.440 0.810 -6.022 1.00 0.00 C ATOM 589 OE1 GLU A 38 152.171 1.488 -6.700 1.00 0.00 O ATOM 590 OE2 GLU A 38 150.572 0.125 -6.475 1.00 0.00 O ATOM 0 H GLU A 38 150.752 -0.917 -2.996 1.00 0.00 H new ATOM 0 HA GLU A 38 153.430 -1.838 -3.103 1.00 0.00 H new ATOM 0 HB2 GLU A 38 153.791 0.266 -4.489 1.00 0.00 H new ATOM 0 HB3 GLU A 38 152.775 -1.028 -5.092 1.00 0.00 H new ATOM 0 HG2 GLU A 38 150.806 0.422 -4.003 1.00 0.00 H new ATOM 0 HG3 GLU A 38 151.967 1.726 -4.149 1.00 0.00 H new ATOM 597 N TYR A 39 152.917 0.602 -1.026 1.00 0.00 N ATOM 598 CA TYR A 39 153.629 1.259 0.101 1.00 0.00 C ATOM 599 C TYR A 39 154.295 0.248 0.952 1.00 0.00 C ATOM 600 O TYR A 39 155.396 0.449 1.384 1.00 0.00 O ATOM 601 CB TYR A 39 152.724 2.148 0.968 1.00 0.00 C ATOM 602 CG TYR A 39 152.771 3.565 0.483 1.00 0.00 C ATOM 603 CD1 TYR A 39 154.015 4.206 0.397 1.00 0.00 C ATOM 604 CD2 TYR A 39 151.609 4.254 0.154 1.00 0.00 C ATOM 605 CE1 TYR A 39 154.093 5.514 -0.023 1.00 0.00 C ATOM 606 CE2 TYR A 39 151.697 5.576 -0.264 1.00 0.00 C ATOM 607 CZ TYR A 39 152.943 6.201 -0.353 1.00 0.00 C ATOM 608 OH TYR A 39 153.038 7.488 -0.761 1.00 0.00 O ATOM 0 H TYR A 39 151.908 0.747 -1.058 1.00 0.00 H new ATOM 0 HA TYR A 39 154.370 1.915 -0.356 1.00 0.00 H new ATOM 0 HB2 TYR A 39 151.699 1.778 0.934 1.00 0.00 H new ATOM 0 HB3 TYR A 39 153.046 2.101 2.008 1.00 0.00 H new ATOM 0 HD1 TYR A 39 154.915 3.671 0.661 1.00 0.00 H new ATOM 0 HD2 TYR A 39 150.648 3.766 0.223 1.00 0.00 H new ATOM 0 HE1 TYR A 39 155.054 6.002 -0.094 1.00 0.00 H new ATOM 0 HE2 TYR A 39 150.801 6.121 -0.520 1.00 0.00 H new ATOM 0 HH TYR A 39 152.366 7.662 -1.452 1.00 0.00 H new ATOM 618 N LEU A 40 153.679 -0.847 1.190 1.00 0.00 N ATOM 619 CA LEU A 40 154.348 -1.858 2.032 1.00 0.00 C ATOM 620 C LEU A 40 155.644 -2.243 1.352 1.00 0.00 C ATOM 621 O LEU A 40 156.648 -2.469 1.996 1.00 0.00 O ATOM 622 CB LEU A 40 153.441 -3.080 2.219 1.00 0.00 C ATOM 623 CG LEU A 40 151.985 -2.620 2.449 1.00 0.00 C ATOM 624 CD1 LEU A 40 151.119 -3.810 2.827 1.00 0.00 C ATOM 625 CD2 LEU A 40 151.930 -1.571 3.567 1.00 0.00 C ATOM 0 H LEU A 40 152.751 -1.094 0.847 1.00 0.00 H new ATOM 0 HA LEU A 40 154.556 -1.454 3.023 1.00 0.00 H new ATOM 0 HB2 LEU A 40 153.495 -3.722 1.340 1.00 0.00 H new ATOM 0 HB3 LEU A 40 153.783 -3.672 3.068 1.00 0.00 H new ATOM 0 HG LEU A 40 151.610 -2.178 1.526 1.00 0.00 H new ATOM 0 HD11 LEU A 40 150.094 -3.477 2.988 1.00 0.00 H new ATOM 0 HD12 LEU A 40 151.140 -4.545 2.023 1.00 0.00 H new ATOM 0 HD13 LEU A 40 151.501 -4.262 3.742 1.00 0.00 H new ATOM 0 HD21 LEU A 40 150.898 -1.255 3.719 1.00 0.00 H new ATOM 0 HD22 LEU A 40 152.317 -2.002 4.490 1.00 0.00 H new ATOM 0 HD23 LEU A 40 152.536 -0.709 3.287 1.00 0.00 H new ATOM 637 N GLU A 41 155.648 -2.288 0.059 1.00 0.00 N ATOM 638 CA GLU A 41 156.916 -2.618 -0.657 1.00 0.00 C ATOM 639 C GLU A 41 157.837 -1.392 -0.671 1.00 0.00 C ATOM 640 O GLU A 41 158.924 -1.420 -0.140 1.00 0.00 O ATOM 641 CB GLU A 41 156.611 -3.032 -2.101 1.00 0.00 C ATOM 642 CG GLU A 41 155.723 -4.280 -2.117 1.00 0.00 C ATOM 643 CD GLU A 41 156.557 -5.460 -2.526 1.00 0.00 C ATOM 644 OE1 GLU A 41 157.180 -6.040 -1.673 1.00 0.00 O ATOM 645 OE2 GLU A 41 156.575 -5.766 -3.694 1.00 0.00 O ATOM 0 H GLU A 41 154.839 -2.113 -0.537 1.00 0.00 H new ATOM 0 HA GLU A 41 157.407 -3.442 -0.139 1.00 0.00 H new ATOM 0 HB2 GLU A 41 156.113 -2.215 -2.624 1.00 0.00 H new ATOM 0 HB3 GLU A 41 157.541 -3.231 -2.634 1.00 0.00 H new ATOM 0 HG2 GLU A 41 155.289 -4.448 -1.131 1.00 0.00 H new ATOM 0 HG3 GLU A 41 154.894 -4.145 -2.811 1.00 0.00 H new ATOM 652 N LEU A 42 157.431 -0.344 -1.323 1.00 0.00 N ATOM 653 CA LEU A 42 158.304 0.863 -1.455 1.00 0.00 C ATOM 654 C LEU A 42 158.731 1.361 -0.077 1.00 0.00 C ATOM 655 O LEU A 42 159.860 1.777 0.117 1.00 0.00 O ATOM 656 CB LEU A 42 157.558 1.985 -2.205 1.00 0.00 C ATOM 657 CG LEU A 42 158.581 2.839 -2.983 1.00 0.00 C ATOM 658 CD1 LEU A 42 158.760 2.283 -4.398 1.00 0.00 C ATOM 659 CD2 LEU A 42 158.120 4.295 -3.076 1.00 0.00 C ATOM 0 H LEU A 42 156.521 -0.266 -1.778 1.00 0.00 H new ATOM 0 HA LEU A 42 159.191 0.585 -2.024 1.00 0.00 H new ATOM 0 HB2 LEU A 42 156.827 1.557 -2.891 1.00 0.00 H new ATOM 0 HB3 LEU A 42 157.008 2.607 -1.500 1.00 0.00 H new ATOM 0 HG LEU A 42 159.528 2.800 -2.445 1.00 0.00 H new ATOM 0 HD11 LEU A 42 159.484 2.892 -4.939 1.00 0.00 H new ATOM 0 HD12 LEU A 42 159.120 1.256 -4.342 1.00 0.00 H new ATOM 0 HD13 LEU A 42 157.804 2.305 -4.921 1.00 0.00 H new ATOM 0 HD21 LEU A 42 158.858 4.876 -3.629 1.00 0.00 H new ATOM 0 HD22 LEU A 42 157.161 4.341 -3.593 1.00 0.00 H new ATOM 0 HD23 LEU A 42 158.012 4.707 -2.073 1.00 0.00 H new ATOM 671 N GLU A 43 157.845 1.335 0.872 1.00 0.00 N ATOM 672 CA GLU A 43 158.188 1.813 2.239 1.00 0.00 C ATOM 673 C GLU A 43 159.234 0.887 2.817 1.00 0.00 C ATOM 674 O GLU A 43 160.299 1.315 3.224 1.00 0.00 O ATOM 675 CB GLU A 43 156.927 1.795 3.132 1.00 0.00 C ATOM 676 CG GLU A 43 157.230 2.431 4.497 1.00 0.00 C ATOM 677 CD GLU A 43 156.779 1.496 5.594 1.00 0.00 C ATOM 678 OE1 GLU A 43 157.312 0.417 5.686 1.00 0.00 O ATOM 679 OE2 GLU A 43 155.903 1.861 6.331 1.00 0.00 O ATOM 0 H GLU A 43 156.888 1.000 0.761 1.00 0.00 H new ATOM 0 HA GLU A 43 158.571 2.833 2.194 1.00 0.00 H new ATOM 0 HB2 GLU A 43 156.119 2.338 2.642 1.00 0.00 H new ATOM 0 HB3 GLU A 43 156.585 0.769 3.269 1.00 0.00 H new ATOM 0 HG2 GLU A 43 158.298 2.630 4.589 1.00 0.00 H new ATOM 0 HG3 GLU A 43 156.718 3.389 4.586 1.00 0.00 H new ATOM 686 N LYS A 44 158.940 -0.373 2.886 1.00 0.00 N ATOM 687 CA LYS A 44 159.905 -1.329 3.452 1.00 0.00 C ATOM 688 C LYS A 44 161.220 -1.220 2.669 1.00 0.00 C ATOM 689 O LYS A 44 162.298 -1.129 3.247 1.00 0.00 O ATOM 690 CB LYS A 44 159.307 -2.733 3.347 1.00 0.00 C ATOM 691 CG LYS A 44 158.087 -2.846 4.300 1.00 0.00 C ATOM 692 CD LYS A 44 158.559 -3.017 5.767 1.00 0.00 C ATOM 693 CE LYS A 44 157.427 -2.658 6.773 1.00 0.00 C ATOM 694 NZ LYS A 44 156.415 -1.767 6.140 1.00 0.00 N ATOM 0 H LYS A 44 158.061 -0.782 2.570 1.00 0.00 H new ATOM 0 HA LYS A 44 160.111 -1.114 4.501 1.00 0.00 H new ATOM 0 HB2 LYS A 44 159.000 -2.934 2.320 1.00 0.00 H new ATOM 0 HB3 LYS A 44 160.057 -3.480 3.608 1.00 0.00 H new ATOM 0 HG2 LYS A 44 157.466 -1.954 4.213 1.00 0.00 H new ATOM 0 HG3 LYS A 44 157.468 -3.695 4.009 1.00 0.00 H new ATOM 0 HD2 LYS A 44 158.880 -4.046 5.930 1.00 0.00 H new ATOM 0 HD3 LYS A 44 159.425 -2.380 5.949 1.00 0.00 H new ATOM 0 HE2 LYS A 44 156.945 -3.570 7.125 1.00 0.00 H new ATOM 0 HE3 LYS A 44 157.854 -2.166 7.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 155.788 -1.379 6.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 156.898 -0.988 5.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 155.852 -2.312 5.456 1.00 0.00 H new ATOM 708 N CYS A 45 161.127 -1.136 1.370 1.00 0.00 N ATOM 709 CA CYS A 45 162.327 -0.956 0.522 1.00 0.00 C ATOM 710 C CYS A 45 163.064 0.301 0.963 1.00 0.00 C ATOM 711 O CYS A 45 164.191 0.245 1.400 1.00 0.00 O ATOM 712 CB CYS A 45 161.888 -0.810 -0.937 1.00 0.00 C ATOM 713 SG CYS A 45 161.361 -2.421 -1.574 1.00 0.00 S ATOM 0 H CYS A 45 160.248 -1.186 0.855 1.00 0.00 H new ATOM 0 HA CYS A 45 162.988 -1.817 0.620 1.00 0.00 H new ATOM 0 HB2 CYS A 45 161.071 -0.093 -1.012 1.00 0.00 H new ATOM 0 HB3 CYS A 45 162.710 -0.421 -1.538 1.00 0.00 H new ATOM 0 HG CYS A 45 160.136 -2.653 -1.206 1.00 0.00 H new ATOM 719 N LEU A 46 162.437 1.437 0.859 1.00 0.00 N ATOM 720 CA LEU A 46 163.113 2.708 1.259 1.00 0.00 C ATOM 721 C LEU A 46 163.601 2.594 2.696 1.00 0.00 C ATOM 722 O LEU A 46 164.659 3.043 3.021 1.00 0.00 O ATOM 723 CB LEU A 46 162.141 3.902 1.128 1.00 0.00 C ATOM 724 CG LEU A 46 162.868 5.234 1.467 1.00 0.00 C ATOM 725 CD1 LEU A 46 164.204 5.315 0.743 1.00 0.00 C ATOM 726 CD2 LEU A 46 162.021 6.418 1.027 1.00 0.00 C ATOM 0 H LEU A 46 161.483 1.544 0.514 1.00 0.00 H new ATOM 0 HA LEU A 46 163.963 2.879 0.598 1.00 0.00 H new ATOM 0 HB2 LEU A 46 161.743 3.945 0.114 1.00 0.00 H new ATOM 0 HB3 LEU A 46 161.292 3.763 1.798 1.00 0.00 H new ATOM 0 HG LEU A 46 163.029 5.261 2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 46 164.697 6.254 0.993 1.00 0.00 H new ATOM 0 HD12 LEU A 46 164.835 4.481 1.050 1.00 0.00 H new ATOM 0 HD13 LEU A 46 164.038 5.268 -0.333 1.00 0.00 H new ATOM 0 HD21 LEU A 46 162.539 7.346 1.269 1.00 0.00 H new ATOM 0 HD22 LEU A 46 161.854 6.366 -0.049 1.00 0.00 H new ATOM 0 HD23 LEU A 46 161.062 6.392 1.545 1.00 0.00 H new ATOM 738 N SER A 47 162.859 1.964 3.536 1.00 0.00 N ATOM 739 CA SER A 47 163.292 1.805 4.940 1.00 0.00 C ATOM 740 C SER A 47 164.581 0.977 4.975 1.00 0.00 C ATOM 741 O SER A 47 165.555 1.340 5.634 1.00 0.00 O ATOM 742 CB SER A 47 162.191 1.122 5.733 1.00 0.00 C ATOM 743 OG SER A 47 160.942 1.794 5.480 1.00 0.00 O ATOM 0 H SER A 47 161.957 1.544 3.312 1.00 0.00 H new ATOM 0 HA SER A 47 163.487 2.780 5.388 1.00 0.00 H new ATOM 0 HB2 SER A 47 162.118 0.072 5.448 1.00 0.00 H new ATOM 0 HB3 SER A 47 162.423 1.148 6.798 1.00 0.00 H new ATOM 0 HG SER A 47 160.521 1.412 4.682 1.00 0.00 H new ATOM 749 N ARG A 48 164.629 -0.097 4.239 1.00 0.00 N ATOM 750 CA ARG A 48 165.881 -0.900 4.181 1.00 0.00 C ATOM 751 C ARG A 48 166.961 -0.034 3.545 1.00 0.00 C ATOM 752 O ARG A 48 168.110 -0.001 3.993 1.00 0.00 O ATOM 753 CB ARG A 48 165.651 -2.146 3.319 1.00 0.00 C ATOM 754 CG ARG A 48 165.167 -3.301 4.202 1.00 0.00 C ATOM 755 CD ARG A 48 164.803 -4.506 3.322 1.00 0.00 C ATOM 756 NE ARG A 48 163.323 -4.739 3.395 1.00 0.00 N ATOM 757 CZ ARG A 48 162.605 -5.009 2.323 1.00 0.00 C ATOM 758 NH1 ARG A 48 163.168 -5.066 1.141 1.00 0.00 N ATOM 759 NH2 ARG A 48 161.328 -5.225 2.448 1.00 0.00 N ATOM 0 H ARG A 48 163.857 -0.453 3.676 1.00 0.00 H new ATOM 0 HA ARG A 48 166.181 -1.213 5.181 1.00 0.00 H new ATOM 0 HB2 ARG A 48 164.914 -1.934 2.545 1.00 0.00 H new ATOM 0 HB3 ARG A 48 166.575 -2.425 2.812 1.00 0.00 H new ATOM 0 HG2 ARG A 48 165.945 -3.579 4.913 1.00 0.00 H new ATOM 0 HG3 ARG A 48 164.300 -2.988 4.784 1.00 0.00 H new ATOM 0 HD2 ARG A 48 165.104 -4.323 2.291 1.00 0.00 H new ATOM 0 HD3 ARG A 48 165.340 -5.393 3.658 1.00 0.00 H new ATOM 0 HE ARG A 48 162.858 -4.687 4.301 1.00 0.00 H new ATOM 0 HH11 ARG A 48 164.170 -4.901 1.045 1.00 0.00 H new ATOM 0 HH12 ARG A 48 162.604 -5.276 0.317 1.00 0.00 H new ATOM 0 HH21 ARG A 48 160.892 -5.185 3.369 1.00 0.00 H new ATOM 0 HH22 ARG A 48 160.763 -5.435 1.625 1.00 0.00 H new ATOM 773 N MET A 49 166.612 0.661 2.511 1.00 0.00 N ATOM 774 CA MET A 49 167.580 1.527 1.827 1.00 0.00 C ATOM 775 C MET A 49 167.974 2.663 2.752 1.00 0.00 C ATOM 776 O MET A 49 169.009 3.205 2.623 1.00 0.00 O ATOM 777 CB MET A 49 166.951 2.116 0.557 1.00 0.00 C ATOM 778 CG MET A 49 166.409 0.990 -0.339 1.00 0.00 C ATOM 779 SD MET A 49 167.589 0.659 -1.662 1.00 0.00 S ATOM 780 CE MET A 49 167.229 2.120 -2.669 1.00 0.00 C ATOM 0 H MET A 49 165.676 0.662 2.106 1.00 0.00 H new ATOM 0 HA MET A 49 168.457 0.939 1.558 1.00 0.00 H new ATOM 0 HB2 MET A 49 166.144 2.798 0.825 1.00 0.00 H new ATOM 0 HB3 MET A 49 167.693 2.699 0.012 1.00 0.00 H new ATOM 0 HG2 MET A 49 166.244 0.088 0.251 1.00 0.00 H new ATOM 0 HG3 MET A 49 165.445 1.277 -0.759 1.00 0.00 H new ATOM 0 HE1 MET A 49 168.086 2.345 -3.303 1.00 0.00 H new ATOM 0 HE2 MET A 49 166.357 1.926 -3.293 1.00 0.00 H new ATOM 0 HE3 MET A 49 167.027 2.970 -2.017 1.00 0.00 H new ATOM 790 N GLU A 50 167.181 2.979 3.719 1.00 0.00 N ATOM 791 CA GLU A 50 167.554 4.058 4.650 1.00 0.00 C ATOM 792 C GLU A 50 168.662 3.552 5.542 1.00 0.00 C ATOM 793 O GLU A 50 169.726 4.154 5.652 1.00 0.00 O ATOM 794 CB GLU A 50 166.348 4.453 5.469 1.00 0.00 C ATOM 795 CG GLU A 50 165.424 5.369 4.647 1.00 0.00 C ATOM 796 CD GLU A 50 165.509 6.775 5.177 1.00 0.00 C ATOM 797 OE1 GLU A 50 166.347 7.511 4.711 1.00 0.00 O ATOM 798 OE2 GLU A 50 164.741 7.103 6.041 1.00 0.00 O ATOM 0 H GLU A 50 166.283 2.533 3.907 1.00 0.00 H new ATOM 0 HA GLU A 50 167.900 4.936 4.104 1.00 0.00 H new ATOM 0 HB2 GLU A 50 165.804 3.562 5.782 1.00 0.00 H new ATOM 0 HB3 GLU A 50 166.668 4.966 6.376 1.00 0.00 H new ATOM 0 HG2 GLU A 50 165.714 5.347 3.596 1.00 0.00 H new ATOM 0 HG3 GLU A 50 164.396 5.010 4.702 1.00 0.00 H new ATOM 805 N ASP A 51 168.455 2.411 6.126 1.00 0.00 N ATOM 806 CA ASP A 51 169.499 1.798 6.977 1.00 0.00 C ATOM 807 C ASP A 51 170.762 1.670 6.171 1.00 0.00 C ATOM 808 O ASP A 51 171.837 2.040 6.618 1.00 0.00 O ATOM 809 CB ASP A 51 169.058 0.402 7.406 1.00 0.00 C ATOM 810 CG ASP A 51 168.314 0.478 8.696 1.00 0.00 C ATOM 811 OD1 ASP A 51 168.944 0.600 9.705 1.00 0.00 O ATOM 812 OD2 ASP A 51 167.113 0.416 8.664 1.00 0.00 O ATOM 0 H ASP A 51 167.594 1.871 6.048 1.00 0.00 H new ATOM 0 HA ASP A 51 169.663 2.420 7.857 1.00 0.00 H new ATOM 0 HB2 ASP A 51 168.425 -0.041 6.637 1.00 0.00 H new ATOM 0 HB3 ASP A 51 169.928 -0.246 7.516 1.00 0.00 H new ATOM 817 N GLU A 52 170.660 1.088 5.021 1.00 0.00 N ATOM 818 CA GLU A 52 171.858 0.881 4.194 1.00 0.00 C ATOM 819 C GLU A 52 172.406 2.226 3.769 1.00 0.00 C ATOM 820 O GLU A 52 173.566 2.449 3.818 1.00 0.00 O ATOM 821 CB GLU A 52 171.507 0.056 2.946 1.00 0.00 C ATOM 822 CG GLU A 52 171.994 -1.384 3.124 1.00 0.00 C ATOM 823 CD GLU A 52 171.898 -2.090 1.808 1.00 0.00 C ATOM 824 OE1 GLU A 52 170.840 -2.558 1.498 1.00 0.00 O ATOM 825 OE2 GLU A 52 172.871 -2.125 1.098 1.00 0.00 O ATOM 0 H GLU A 52 169.789 0.745 4.617 1.00 0.00 H new ATOM 0 HA GLU A 52 172.605 0.341 4.776 1.00 0.00 H new ATOM 0 HB2 GLU A 52 170.429 0.068 2.782 1.00 0.00 H new ATOM 0 HB3 GLU A 52 171.969 0.499 2.064 1.00 0.00 H new ATOM 0 HG2 GLU A 52 173.023 -1.393 3.483 1.00 0.00 H new ATOM 0 HG3 GLU A 52 171.390 -1.897 3.873 1.00 0.00 H new ATOM 832 N ASN A 53 171.574 3.088 3.283 1.00 0.00 N ATOM 833 CA ASN A 53 172.048 4.396 2.755 1.00 0.00 C ATOM 834 C ASN A 53 172.779 5.125 3.831 1.00 0.00 C ATOM 835 O ASN A 53 173.859 5.644 3.618 1.00 0.00 O ATOM 836 CB ASN A 53 170.831 5.196 2.273 1.00 0.00 C ATOM 837 CG ASN A 53 170.430 4.627 0.919 1.00 0.00 C ATOM 838 OD1 ASN A 53 170.573 3.352 0.713 1.00 0.00 O flip ATOM 839 ND2 ASN A 53 169.993 5.336 0.039 1.00 0.00 N flip ATOM 0 H ASN A 53 170.566 2.945 3.226 1.00 0.00 H new ATOM 0 HA ASN A 53 172.731 4.252 1.918 1.00 0.00 H new ATOM 0 HB2 ASN A 53 170.009 5.113 2.984 1.00 0.00 H new ATOM 0 HB3 ASN A 53 171.075 6.255 2.189 1.00 0.00 H new ATOM 0 HD21 ASN A 53 169.880 6.337 0.199 1.00 0.00 H new ATOM 0 HD22 ASN A 53 169.738 4.932 -0.862 1.00 0.00 H new ATOM 846 N ASN A 54 172.238 5.095 5.014 1.00 0.00 N ATOM 847 CA ASN A 54 172.903 5.723 6.176 1.00 0.00 C ATOM 848 C ASN A 54 174.312 5.187 6.277 1.00 0.00 C ATOM 849 O ASN A 54 175.271 5.923 6.236 1.00 0.00 O ATOM 850 CB ASN A 54 172.152 5.335 7.450 1.00 0.00 C ATOM 851 CG ASN A 54 170.967 6.262 7.679 1.00 0.00 C ATOM 852 OD1 ASN A 54 170.592 7.047 6.811 1.00 0.00 O ATOM 853 ND2 ASN A 54 170.343 6.201 8.794 1.00 0.00 N ATOM 0 H ASN A 54 171.344 4.651 5.224 1.00 0.00 H new ATOM 0 HA ASN A 54 172.912 6.806 6.056 1.00 0.00 H new ATOM 0 HB2 ASN A 54 171.805 4.305 7.374 1.00 0.00 H new ATOM 0 HB3 ASN A 54 172.827 5.382 8.305 1.00 0.00 H new ATOM 0 HD21 ASN A 54 169.537 6.803 8.961 1.00 0.00 H new ATOM 0 HD22 ASN A 54 170.652 5.550 9.516 1.00 0.00 H new ATOM 860 N ARG A 55 174.441 3.900 6.402 1.00 0.00 N ATOM 861 CA ARG A 55 175.782 3.290 6.514 1.00 0.00 C ATOM 862 C ARG A 55 176.550 3.557 5.235 1.00 0.00 C ATOM 863 O ARG A 55 177.531 4.235 5.240 1.00 0.00 O ATOM 864 CB ARG A 55 175.627 1.784 6.726 1.00 0.00 C ATOM 865 CG ARG A 55 175.111 1.516 8.142 1.00 0.00 C ATOM 866 CD ARG A 55 176.293 1.415 9.126 1.00 0.00 C ATOM 867 NE ARG A 55 176.202 0.115 9.859 1.00 0.00 N ATOM 868 CZ ARG A 55 176.793 -0.975 9.414 1.00 0.00 C ATOM 869 NH1 ARG A 55 177.591 -0.932 8.369 1.00 0.00 N ATOM 870 NH2 ARG A 55 176.600 -2.099 10.040 1.00 0.00 N ATOM 0 H ARG A 55 173.664 3.240 6.431 1.00 0.00 H new ATOM 0 HA ARG A 55 176.324 3.718 7.357 1.00 0.00 H new ATOM 0 HB2 ARG A 55 174.935 1.372 5.992 1.00 0.00 H new ATOM 0 HB3 ARG A 55 176.584 1.285 6.576 1.00 0.00 H new ATOM 0 HG2 ARG A 55 174.439 2.317 8.450 1.00 0.00 H new ATOM 0 HG3 ARG A 55 174.534 0.591 8.158 1.00 0.00 H new ATOM 0 HD2 ARG A 55 177.239 1.479 8.587 1.00 0.00 H new ATOM 0 HD3 ARG A 55 176.270 2.247 9.830 1.00 0.00 H new ATOM 0 HE ARG A 55 175.668 0.071 10.727 1.00 0.00 H new ATOM 0 HH11 ARG A 55 177.759 -0.046 7.892 1.00 0.00 H new ATOM 0 HH12 ARG A 55 178.042 -1.784 8.036 1.00 0.00 H new ATOM 0 HH21 ARG A 55 175.998 -2.128 10.863 1.00 0.00 H new ATOM 0 HH22 ARG A 55 177.051 -2.952 9.708 1.00 0.00 H new ATOM 884 N LEU A 56 176.084 3.022 4.157 1.00 0.00 N ATOM 885 CA LEU A 56 176.715 3.194 2.823 1.00 0.00 C ATOM 886 C LEU A 56 177.325 4.560 2.682 1.00 0.00 C ATOM 887 O LEU A 56 178.501 4.701 2.458 1.00 0.00 O ATOM 888 CB LEU A 56 175.606 3.077 1.759 1.00 0.00 C ATOM 889 CG LEU A 56 175.357 1.595 1.430 1.00 0.00 C ATOM 890 CD1 LEU A 56 174.156 1.461 0.489 1.00 0.00 C ATOM 891 CD2 LEU A 56 176.597 1.012 0.752 1.00 0.00 C ATOM 0 H LEU A 56 175.246 2.440 4.141 1.00 0.00 H new ATOM 0 HA LEU A 56 177.492 2.439 2.703 1.00 0.00 H new ATOM 0 HB2 LEU A 56 174.688 3.537 2.124 1.00 0.00 H new ATOM 0 HB3 LEU A 56 175.896 3.616 0.857 1.00 0.00 H new ATOM 0 HG LEU A 56 175.150 1.054 2.353 1.00 0.00 H new ATOM 0 HD11 LEU A 56 173.988 0.408 0.262 1.00 0.00 H new ATOM 0 HD12 LEU A 56 173.269 1.875 0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 56 174.355 2.004 -0.435 1.00 0.00 H new ATOM 0 HD21 LEU A 56 176.424 -0.038 0.518 1.00 0.00 H new ATOM 0 HD22 LEU A 56 176.800 1.560 -0.168 1.00 0.00 H new ATOM 0 HD23 LEU A 56 177.452 1.098 1.422 1.00 0.00 H new ATOM 903 N ARG A 57 176.521 5.569 2.779 1.00 0.00 N ATOM 904 CA ARG A 57 177.018 6.942 2.622 1.00 0.00 C ATOM 905 C ARG A 57 178.129 7.203 3.630 1.00 0.00 C ATOM 906 O ARG A 57 179.155 7.799 3.298 1.00 0.00 O ATOM 907 CB ARG A 57 175.860 7.920 2.838 1.00 0.00 C ATOM 908 CG ARG A 57 174.839 7.774 1.684 1.00 0.00 C ATOM 909 CD ARG A 57 174.459 9.155 1.181 1.00 0.00 C ATOM 910 NE ARG A 57 173.276 9.104 0.264 1.00 0.00 N ATOM 911 CZ ARG A 57 172.044 9.121 0.733 1.00 0.00 C ATOM 912 NH1 ARG A 57 171.824 8.888 1.996 1.00 0.00 N ATOM 913 NH2 ARG A 57 171.049 9.338 -0.081 1.00 0.00 N ATOM 0 H ARG A 57 175.521 5.494 2.964 1.00 0.00 H new ATOM 0 HA ARG A 57 177.421 7.080 1.618 1.00 0.00 H new ATOM 0 HB2 ARG A 57 175.375 7.721 3.794 1.00 0.00 H new ATOM 0 HB3 ARG A 57 176.236 8.942 2.878 1.00 0.00 H new ATOM 0 HG2 ARG A 57 175.268 7.184 0.874 1.00 0.00 H new ATOM 0 HG3 ARG A 57 173.953 7.243 2.031 1.00 0.00 H new ATOM 0 HD2 ARG A 57 174.235 9.802 2.029 1.00 0.00 H new ATOM 0 HD3 ARG A 57 175.306 9.598 0.658 1.00 0.00 H new ATOM 0 HE ARG A 57 173.427 9.055 -0.744 1.00 0.00 H new ATOM 0 HH11 ARG A 57 172.605 8.692 2.622 1.00 0.00 H new ATOM 0 HH12 ARG A 57 170.871 8.901 2.359 1.00 0.00 H new ATOM 0 HH21 ARG A 57 171.226 9.493 -1.073 1.00 0.00 H new ATOM 0 HH22 ARG A 57 170.093 9.353 0.275 1.00 0.00 H new ATOM 927 N LEU A 58 177.952 6.784 4.839 1.00 0.00 N ATOM 928 CA LEU A 58 178.976 7.032 5.863 1.00 0.00 C ATOM 929 C LEU A 58 180.223 6.213 5.539 1.00 0.00 C ATOM 930 O LEU A 58 181.341 6.658 5.770 1.00 0.00 O ATOM 931 CB LEU A 58 178.440 6.674 7.221 1.00 0.00 C ATOM 932 CG LEU A 58 177.317 7.636 7.622 1.00 0.00 C ATOM 933 CD1 LEU A 58 176.563 7.095 8.853 1.00 0.00 C ATOM 934 CD2 LEU A 58 177.911 9.011 7.926 1.00 0.00 C ATOM 0 H LEU A 58 177.130 6.274 5.163 1.00 0.00 H new ATOM 0 HA LEU A 58 179.241 8.089 5.869 1.00 0.00 H new ATOM 0 HB2 LEU A 58 178.065 5.650 7.213 1.00 0.00 H new ATOM 0 HB3 LEU A 58 179.242 6.714 7.958 1.00 0.00 H new ATOM 0 HG LEU A 58 176.609 7.725 6.798 1.00 0.00 H new ATOM 0 HD11 LEU A 58 175.768 7.789 9.127 1.00 0.00 H new ATOM 0 HD12 LEU A 58 176.131 6.123 8.617 1.00 0.00 H new ATOM 0 HD13 LEU A 58 177.256 6.991 9.687 1.00 0.00 H new ATOM 0 HD21 LEU A 58 177.113 9.697 8.211 1.00 0.00 H new ATOM 0 HD22 LEU A 58 178.626 8.926 8.744 1.00 0.00 H new ATOM 0 HD23 LEU A 58 178.418 9.393 7.040 1.00 0.00 H new ATOM 946 N GLU A 59 180.044 5.052 5.058 1.00 0.00 N ATOM 947 CA GLU A 59 181.172 4.154 4.743 1.00 0.00 C ATOM 948 C GLU A 59 181.812 4.555 3.419 1.00 0.00 C ATOM 949 O GLU A 59 182.923 5.010 3.391 1.00 0.00 O ATOM 950 CB GLU A 59 180.634 2.714 4.690 1.00 0.00 C ATOM 951 CG GLU A 59 180.151 2.334 6.108 1.00 0.00 C ATOM 952 CD GLU A 59 179.769 0.883 6.167 1.00 0.00 C ATOM 953 OE1 GLU A 59 180.470 0.084 5.608 1.00 0.00 O ATOM 954 OE2 GLU A 59 178.771 0.584 6.783 1.00 0.00 O ATOM 0 H GLU A 59 179.125 4.657 4.856 1.00 0.00 H new ATOM 0 HA GLU A 59 181.944 4.226 5.510 1.00 0.00 H new ATOM 0 HB2 GLU A 59 179.815 2.639 3.975 1.00 0.00 H new ATOM 0 HB3 GLU A 59 181.412 2.028 4.356 1.00 0.00 H new ATOM 0 HG2 GLU A 59 180.939 2.538 6.833 1.00 0.00 H new ATOM 0 HG3 GLU A 59 179.297 2.952 6.384 1.00 0.00 H new ATOM 961 N SER A 60 181.109 4.419 2.341 1.00 0.00 N ATOM 962 CA SER A 60 181.654 4.787 0.995 1.00 0.00 C ATOM 963 C SER A 60 182.549 6.043 1.071 1.00 0.00 C ATOM 964 O SER A 60 183.653 6.059 0.567 1.00 0.00 O ATOM 965 CB SER A 60 180.482 5.054 0.029 1.00 0.00 C ATOM 966 OG SER A 60 180.442 4.046 -0.987 1.00 0.00 O ATOM 0 H SER A 60 180.154 4.060 2.325 1.00 0.00 H new ATOM 0 HA SER A 60 182.263 3.958 0.635 1.00 0.00 H new ATOM 0 HB2 SER A 60 179.542 5.063 0.580 1.00 0.00 H new ATOM 0 HB3 SER A 60 180.594 6.037 -0.428 1.00 0.00 H new ATOM 0 HG SER A 60 179.750 3.388 -0.768 1.00 0.00 H new ATOM 972 N LYS A 61 182.100 7.100 1.708 1.00 0.00 N ATOM 973 CA LYS A 61 182.970 8.328 1.771 1.00 0.00 C ATOM 974 C LYS A 61 184.347 7.956 2.345 1.00 0.00 C ATOM 975 O LYS A 61 185.338 8.630 2.096 1.00 0.00 O ATOM 976 CB LYS A 61 182.314 9.438 2.614 1.00 0.00 C ATOM 977 CG LYS A 61 181.995 8.927 4.033 1.00 0.00 C ATOM 978 CD LYS A 61 181.054 9.922 4.757 1.00 0.00 C ATOM 979 CE LYS A 61 181.389 10.004 6.268 1.00 0.00 C ATOM 980 NZ LYS A 61 182.023 8.741 6.735 1.00 0.00 N ATOM 0 H LYS A 61 181.196 7.171 2.176 1.00 0.00 H new ATOM 0 HA LYS A 61 183.094 8.715 0.760 1.00 0.00 H new ATOM 0 HB2 LYS A 61 182.980 10.299 2.673 1.00 0.00 H new ATOM 0 HB3 LYS A 61 181.398 9.777 2.129 1.00 0.00 H new ATOM 0 HG2 LYS A 61 181.525 7.945 3.977 1.00 0.00 H new ATOM 0 HG3 LYS A 61 182.918 8.808 4.601 1.00 0.00 H new ATOM 0 HD2 LYS A 61 181.147 10.910 4.306 1.00 0.00 H new ATOM 0 HD3 LYS A 61 180.018 9.609 4.627 1.00 0.00 H new ATOM 0 HE2 LYS A 61 182.060 10.843 6.452 1.00 0.00 H new ATOM 0 HE3 LYS A 61 180.479 10.192 6.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 181.948 8.677 7.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 181.539 7.929 6.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 183.026 8.733 6.459 1.00 0.00 H new ATOM 994 N ARG A 62 184.422 6.871 3.055 1.00 0.00 N ATOM 995 CA ARG A 62 185.704 6.383 3.620 1.00 0.00 C ATOM 996 C ARG A 62 186.268 5.292 2.695 1.00 0.00 C ATOM 997 O ARG A 62 186.950 4.376 3.152 1.00 0.00 O ATOM 998 CB ARG A 62 185.430 5.771 5.014 1.00 0.00 C ATOM 999 CG ARG A 62 185.045 6.877 6.018 1.00 0.00 C ATOM 1000 CD ARG A 62 185.612 6.543 7.410 1.00 0.00 C ATOM 1001 NE ARG A 62 187.059 6.169 7.282 1.00 0.00 N ATOM 1002 CZ ARG A 62 187.759 5.783 8.325 1.00 0.00 C ATOM 1003 NH1 ARG A 62 187.239 5.834 9.518 1.00 0.00 N ATOM 1004 NH2 ARG A 62 188.977 5.376 8.161 1.00 0.00 N ATOM 0 H ARG A 62 183.618 6.282 3.274 1.00 0.00 H new ATOM 0 HA ARG A 62 186.417 7.203 3.706 1.00 0.00 H new ATOM 0 HB2 ARG A 62 184.627 5.037 4.945 1.00 0.00 H new ATOM 0 HB3 ARG A 62 186.315 5.242 5.367 1.00 0.00 H new ATOM 0 HG2 ARG A 62 185.432 7.838 5.679 1.00 0.00 H new ATOM 0 HG3 ARG A 62 183.960 6.971 6.071 1.00 0.00 H new ATOM 0 HD2 ARG A 62 185.504 7.401 8.074 1.00 0.00 H new ATOM 0 HD3 ARG A 62 185.051 5.722 7.856 1.00 0.00 H new ATOM 0 HE ARG A 62 187.508 6.215 6.367 1.00 0.00 H new ATOM 0 HH11 ARG A 62 186.286 6.174 9.645 1.00 0.00 H new ATOM 0 HH12 ARG A 62 187.785 5.534 10.326 1.00 0.00 H new ATOM 0 HH21 ARG A 62 189.387 5.357 7.227 1.00 0.00 H new ATOM 0 HH22 ARG A 62 189.527 5.075 8.966 1.00 0.00 H new ATOM 1018 N LEU A 63 185.974 5.367 1.411 1.00 0.00 N ATOM 1019 CA LEU A 63 186.414 4.324 0.414 1.00 0.00 C ATOM 1020 C LEU A 63 187.947 4.131 0.370 1.00 0.00 C ATOM 1021 O LEU A 63 188.532 3.961 -0.691 1.00 0.00 O ATOM 1022 CB LEU A 63 185.874 4.691 -0.996 1.00 0.00 C ATOM 1023 CG LEU A 63 184.488 4.030 -1.222 1.00 0.00 C ATOM 1024 CD1 LEU A 63 183.587 4.928 -2.067 1.00 0.00 C ATOM 1025 CD2 LEU A 63 184.674 2.702 -1.949 1.00 0.00 C ATOM 0 H LEU A 63 185.433 6.129 1.002 1.00 0.00 H new ATOM 0 HA LEU A 63 185.996 3.372 0.740 1.00 0.00 H new ATOM 0 HB2 LEU A 63 185.790 5.774 -1.092 1.00 0.00 H new ATOM 0 HB3 LEU A 63 186.575 4.357 -1.761 1.00 0.00 H new ATOM 0 HG LEU A 63 184.021 3.872 -0.250 1.00 0.00 H new ATOM 0 HD11 LEU A 63 182.622 4.443 -2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 63 183.442 5.880 -1.557 1.00 0.00 H new ATOM 0 HD13 LEU A 63 184.054 5.103 -3.036 1.00 0.00 H new ATOM 0 HD21 LEU A 63 183.702 2.236 -2.109 1.00 0.00 H new ATOM 0 HD22 LEU A 63 185.155 2.878 -2.911 1.00 0.00 H new ATOM 0 HD23 LEU A 63 185.298 2.042 -1.347 1.00 0.00 H new ATOM 2083 N HIS B 23 149.974 -0.548 11.610 1.00 0.00 N ATOM 2084 CA HIS B 23 149.602 -1.662 10.694 1.00 0.00 C ATOM 2085 C HIS B 23 149.113 -1.093 9.371 1.00 0.00 C ATOM 2086 O HIS B 23 149.331 0.070 9.056 1.00 0.00 O ATOM 2087 CB HIS B 23 148.490 -2.510 11.348 1.00 0.00 C ATOM 2088 CG HIS B 23 149.097 -3.692 12.052 1.00 0.00 C ATOM 2089 ND1 HIS B 23 150.385 -3.667 12.575 1.00 0.00 N ATOM 2090 CD2 HIS B 23 148.605 -4.938 12.329 1.00 0.00 C ATOM 2091 CE1 HIS B 23 150.613 -4.871 13.132 1.00 0.00 C ATOM 2092 NE2 HIS B 23 149.559 -5.681 13.009 1.00 0.00 N ATOM 0 HA HIS B 23 150.472 -2.291 10.509 1.00 0.00 H new ATOM 0 HB2 HIS B 23 147.927 -1.903 12.057 1.00 0.00 H new ATOM 0 HB3 HIS B 23 147.785 -2.850 10.589 1.00 0.00 H new ATOM 0 HD2 HIS B 23 147.621 -5.291 12.059 1.00 0.00 H new ATOM 0 HE1 HIS B 23 151.536 -5.148 13.619 1.00 0.00 H new ATOM 0 HE2 HIS B 23 149.473 -6.641 13.343 1.00 0.00 H new ATOM 2101 N THR B 24 148.463 -1.898 8.594 1.00 0.00 N ATOM 2102 CA THR B 24 147.941 -1.457 7.283 1.00 0.00 C ATOM 2103 C THR B 24 146.870 -0.388 7.507 1.00 0.00 C ATOM 2104 O THR B 24 146.806 0.598 6.788 1.00 0.00 O ATOM 2105 CB THR B 24 147.323 -2.684 6.598 1.00 0.00 C ATOM 2106 OG1 THR B 24 147.993 -3.864 7.061 1.00 0.00 O ATOM 2107 CG2 THR B 24 147.447 -2.582 5.078 1.00 0.00 C ATOM 0 H THR B 24 148.266 -2.873 8.820 1.00 0.00 H new ATOM 0 HA THR B 24 148.733 -1.036 6.663 1.00 0.00 H new ATOM 0 HB THR B 24 146.263 -2.732 6.849 1.00 0.00 H new ATOM 0 HG1 THR B 24 147.603 -4.652 6.629 1.00 0.00 H new ATOM 0 HG21 THR B 24 147.002 -3.463 4.617 1.00 0.00 H new ATOM 0 HG22 THR B 24 146.928 -1.689 4.730 1.00 0.00 H new ATOM 0 HG23 THR B 24 148.500 -2.521 4.802 1.00 0.00 H new ATOM 2115 N GLU B 25 146.041 -0.586 8.486 1.00 0.00 N ATOM 2116 CA GLU B 25 144.915 0.348 8.781 1.00 0.00 C ATOM 2117 C GLU B 25 145.310 1.781 8.455 1.00 0.00 C ATOM 2118 O GLU B 25 144.747 2.391 7.564 1.00 0.00 O ATOM 2119 CB GLU B 25 144.593 0.250 10.303 1.00 0.00 C ATOM 2120 CG GLU B 25 145.087 -1.102 10.858 1.00 0.00 C ATOM 2121 CD GLU B 25 144.498 -1.344 12.212 1.00 0.00 C ATOM 2122 OE1 GLU B 25 143.337 -1.621 12.286 1.00 0.00 O ATOM 2123 OE2 GLU B 25 145.212 -1.271 13.166 1.00 0.00 O ATOM 0 H GLU B 25 146.096 -1.384 9.119 1.00 0.00 H new ATOM 0 HA GLU B 25 144.050 0.077 8.176 1.00 0.00 H new ATOM 0 HB2 GLU B 25 145.072 1.070 10.838 1.00 0.00 H new ATOM 0 HB3 GLU B 25 143.519 0.349 10.464 1.00 0.00 H new ATOM 0 HG2 GLU B 25 144.805 -1.908 10.180 1.00 0.00 H new ATOM 0 HG3 GLU B 25 146.175 -1.104 10.920 1.00 0.00 H new ATOM 2130 N SER B 26 146.219 2.335 9.182 1.00 0.00 N ATOM 2131 CA SER B 26 146.630 3.749 8.950 1.00 0.00 C ATOM 2132 C SER B 26 146.760 4.052 7.450 1.00 0.00 C ATOM 2133 O SER B 26 146.359 5.107 7.000 1.00 0.00 O ATOM 2134 CB SER B 26 147.932 4.007 9.675 1.00 0.00 C ATOM 2135 OG SER B 26 147.983 3.125 10.809 1.00 0.00 O ATOM 0 H SER B 26 146.710 1.867 9.944 1.00 0.00 H new ATOM 0 HA SER B 26 145.862 4.415 9.342 1.00 0.00 H new ATOM 0 HB2 SER B 26 148.780 3.829 9.014 1.00 0.00 H new ATOM 0 HB3 SER B 26 147.991 5.047 9.996 1.00 0.00 H new ATOM 0 HG SER B 26 148.820 3.269 11.298 1.00 0.00 H new ATOM 2141 N LEU B 27 147.237 3.124 6.662 1.00 0.00 N ATOM 2142 CA LEU B 27 147.327 3.387 5.214 1.00 0.00 C ATOM 2143 C LEU B 27 145.928 3.452 4.634 1.00 0.00 C ATOM 2144 O LEU B 27 145.596 4.367 3.909 1.00 0.00 O ATOM 2145 CB LEU B 27 148.127 2.286 4.533 1.00 0.00 C ATOM 2146 CG LEU B 27 149.618 2.440 4.868 1.00 0.00 C ATOM 2147 CD1 LEU B 27 150.363 1.158 4.506 1.00 0.00 C ATOM 2148 CD2 LEU B 27 150.222 3.610 4.072 1.00 0.00 C ATOM 0 H LEU B 27 147.563 2.206 6.964 1.00 0.00 H new ATOM 0 HA LEU B 27 147.834 4.337 5.046 1.00 0.00 H new ATOM 0 HB2 LEU B 27 147.771 1.310 4.861 1.00 0.00 H new ATOM 0 HB3 LEU B 27 147.981 2.333 3.454 1.00 0.00 H new ATOM 0 HG LEU B 27 149.717 2.637 5.935 1.00 0.00 H new ATOM 0 HD11 LEU B 27 151.420 1.272 4.745 1.00 0.00 H new ATOM 0 HD12 LEU B 27 149.950 0.324 5.074 1.00 0.00 H new ATOM 0 HD13 LEU B 27 150.251 0.961 3.440 1.00 0.00 H new ATOM 0 HD21 LEU B 27 151.279 3.710 4.318 1.00 0.00 H new ATOM 0 HD22 LEU B 27 150.114 3.418 3.004 1.00 0.00 H new ATOM 0 HD23 LEU B 27 149.701 4.532 4.329 1.00 0.00 H new ATOM 2160 N GLN B 28 145.065 2.543 5.003 1.00 0.00 N ATOM 2161 CA GLN B 28 143.666 2.632 4.527 1.00 0.00 C ATOM 2162 C GLN B 28 142.982 3.789 5.232 1.00 0.00 C ATOM 2163 O GLN B 28 142.030 4.362 4.716 1.00 0.00 O ATOM 2164 CB GLN B 28 142.906 1.332 4.805 1.00 0.00 C ATOM 2165 CG GLN B 28 143.586 0.184 4.070 1.00 0.00 C ATOM 2166 CD GLN B 28 144.640 -0.432 4.951 1.00 0.00 C ATOM 2167 OE1 GLN B 28 145.867 -0.178 4.711 1.00 0.00 O flip ATOM 2168 NE2 GLN B 28 144.337 -1.143 5.883 1.00 0.00 N flip ATOM 0 H GLN B 28 145.272 1.750 5.610 1.00 0.00 H new ATOM 0 HA GLN B 28 143.668 2.795 3.449 1.00 0.00 H new ATOM 0 HB2 GLN B 28 142.885 1.131 5.876 1.00 0.00 H new ATOM 0 HB3 GLN B 28 141.870 1.426 4.478 1.00 0.00 H new ATOM 0 HG2 GLN B 28 142.848 -0.568 3.789 1.00 0.00 H new ATOM 0 HG3 GLN B 28 144.037 0.548 3.147 1.00 0.00 H new ATOM 0 HE21 GLN B 28 143.355 -1.344 6.073 1.00 0.00 H new ATOM 0 HE22 GLN B 28 145.063 -1.540 6.478 1.00 0.00 H new ATOM 2177 N ASN B 29 143.385 4.087 6.434 1.00 0.00 N ATOM 2178 CA ASN B 29 142.701 5.160 7.189 1.00 0.00 C ATOM 2179 C ASN B 29 143.030 6.496 6.542 1.00 0.00 C ATOM 2180 O ASN B 29 142.485 7.524 6.914 1.00 0.00 O ATOM 2181 CB ASN B 29 143.178 5.174 8.639 1.00 0.00 C ATOM 2182 CG ASN B 29 142.809 3.867 9.346 1.00 0.00 C ATOM 2183 OD1 ASN B 29 141.991 3.102 8.859 1.00 0.00 O ATOM 2184 ND2 ASN B 29 143.372 3.567 10.470 1.00 0.00 N ATOM 0 H ASN B 29 144.157 3.633 6.922 1.00 0.00 H new ATOM 0 HA ASN B 29 141.625 4.983 7.174 1.00 0.00 H new ATOM 0 HB2 ASN B 29 144.258 5.317 8.670 1.00 0.00 H new ATOM 0 HB3 ASN B 29 142.730 6.017 9.166 1.00 0.00 H new ATOM 0 HD21 ASN B 29 143.132 2.696 10.944 1.00 0.00 H new ATOM 0 HD22 ASN B 29 144.056 4.201 10.883 1.00 0.00 H new ATOM 2191 N MET B 30 143.946 6.499 5.604 1.00 0.00 N ATOM 2192 CA MET B 30 144.343 7.743 4.926 1.00 0.00 C ATOM 2193 C MET B 30 143.554 7.873 3.646 1.00 0.00 C ATOM 2194 O MET B 30 143.015 6.898 3.137 1.00 0.00 O ATOM 2195 CB MET B 30 145.827 7.678 4.574 1.00 0.00 C ATOM 2196 CG MET B 30 146.667 7.824 5.843 1.00 0.00 C ATOM 2197 SD MET B 30 147.777 9.236 5.655 1.00 0.00 S ATOM 2198 CE MET B 30 148.921 8.465 4.487 1.00 0.00 C ATOM 0 H MET B 30 144.438 5.665 5.283 1.00 0.00 H new ATOM 0 HA MET B 30 144.153 8.593 5.581 1.00 0.00 H new ATOM 0 HB2 MET B 30 146.053 6.731 4.084 1.00 0.00 H new ATOM 0 HB3 MET B 30 146.078 8.470 3.868 1.00 0.00 H new ATOM 0 HG2 MET B 30 146.020 7.967 6.708 1.00 0.00 H new ATOM 0 HG3 MET B 30 147.241 6.915 6.021 1.00 0.00 H new ATOM 0 HE1 MET B 30 149.945 8.722 4.757 1.00 0.00 H new ATOM 0 HE2 MET B 30 148.798 7.382 4.518 1.00 0.00 H new ATOM 0 HE3 MET B 30 148.710 8.825 3.480 1.00 0.00 H new ATOM 2208 N SER B 31 143.475 9.040 3.116 1.00 0.00 N ATOM 2209 CA SER B 31 142.700 9.238 1.874 1.00 0.00 C ATOM 2210 C SER B 31 143.624 9.010 0.671 1.00 0.00 C ATOM 2211 O SER B 31 144.826 9.267 0.722 1.00 0.00 O ATOM 2212 CB SER B 31 142.095 10.653 1.868 1.00 0.00 C ATOM 2213 OG SER B 31 142.060 11.157 3.227 1.00 0.00 O ATOM 0 H SER B 31 143.917 9.880 3.490 1.00 0.00 H new ATOM 0 HA SER B 31 141.878 8.525 1.815 1.00 0.00 H new ATOM 0 HB2 SER B 31 142.689 11.314 1.237 1.00 0.00 H new ATOM 0 HB3 SER B 31 141.089 10.631 1.449 1.00 0.00 H new ATOM 0 HG SER B 31 141.677 12.059 3.232 1.00 0.00 H new ATOM 2219 N LYS B 32 143.096 8.442 -0.366 1.00 0.00 N ATOM 2220 CA LYS B 32 143.906 8.068 -1.554 1.00 0.00 C ATOM 2221 C LYS B 32 144.801 9.218 -1.995 1.00 0.00 C ATOM 2222 O LYS B 32 145.967 9.024 -2.285 1.00 0.00 O ATOM 2223 CB LYS B 32 142.974 7.676 -2.713 1.00 0.00 C ATOM 2224 CG LYS B 32 143.814 7.118 -3.878 1.00 0.00 C ATOM 2225 CD LYS B 32 142.949 6.239 -4.800 1.00 0.00 C ATOM 2226 CE LYS B 32 142.585 7.018 -6.070 1.00 0.00 C ATOM 2227 NZ LYS B 32 141.903 8.289 -5.693 1.00 0.00 N ATOM 0 H LYS B 32 142.105 8.213 -0.445 1.00 0.00 H new ATOM 0 HA LYS B 32 144.538 7.223 -1.281 1.00 0.00 H new ATOM 0 HB2 LYS B 32 142.254 6.929 -2.379 1.00 0.00 H new ATOM 0 HB3 LYS B 32 142.403 8.543 -3.044 1.00 0.00 H new ATOM 0 HG2 LYS B 32 144.244 7.941 -4.450 1.00 0.00 H new ATOM 0 HG3 LYS B 32 144.646 6.533 -3.486 1.00 0.00 H new ATOM 0 HD2 LYS B 32 143.490 5.330 -5.063 1.00 0.00 H new ATOM 0 HD3 LYS B 32 142.042 5.932 -4.279 1.00 0.00 H new ATOM 0 HE2 LYS B 32 143.484 7.232 -6.648 1.00 0.00 H new ATOM 0 HE3 LYS B 32 141.933 6.417 -6.704 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 141.477 8.719 -6.539 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 141.159 8.090 -4.994 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 142.596 8.947 -5.283 1.00 0.00 H new ATOM 2241 N GLN B 33 144.271 10.391 -2.101 1.00 0.00 N ATOM 2242 CA GLN B 33 145.088 11.511 -2.617 1.00 0.00 C ATOM 2243 C GLN B 33 146.184 11.906 -1.625 1.00 0.00 C ATOM 2244 O GLN B 33 147.154 12.552 -1.994 1.00 0.00 O ATOM 2245 CB GLN B 33 144.184 12.698 -2.962 1.00 0.00 C ATOM 2246 CG GLN B 33 143.641 12.519 -4.398 1.00 0.00 C ATOM 2247 CD GLN B 33 142.715 11.302 -4.461 1.00 0.00 C ATOM 2248 OE1 GLN B 33 143.102 10.229 -4.933 1.00 0.00 O ATOM 2249 NE2 GLN B 33 141.523 11.401 -4.005 1.00 0.00 N ATOM 0 H GLN B 33 143.310 10.626 -1.854 1.00 0.00 H new ATOM 0 HA GLN B 33 145.591 11.185 -3.528 1.00 0.00 H new ATOM 0 HB2 GLN B 33 143.359 12.761 -2.253 1.00 0.00 H new ATOM 0 HB3 GLN B 33 144.742 13.631 -2.885 1.00 0.00 H new ATOM 0 HG2 GLN B 33 143.100 13.414 -4.705 1.00 0.00 H new ATOM 0 HG3 GLN B 33 144.469 12.392 -5.095 1.00 0.00 H new ATOM 0 HE21 GLN B 33 141.198 12.285 -3.614 1.00 0.00 H new ATOM 0 HE22 GLN B 33 140.898 10.596 -4.033 1.00 0.00 H new ATOM 2258 N GLU B 34 146.078 11.509 -0.388 1.00 0.00 N ATOM 2259 CA GLU B 34 147.164 11.842 0.586 1.00 0.00 C ATOM 2260 C GLU B 34 148.296 10.848 0.361 1.00 0.00 C ATOM 2261 O GLU B 34 149.414 11.228 0.038 1.00 0.00 O ATOM 2262 CB GLU B 34 146.643 11.744 2.038 1.00 0.00 C ATOM 2263 CG GLU B 34 145.166 12.147 2.091 1.00 0.00 C ATOM 2264 CD GLU B 34 144.707 12.205 3.525 1.00 0.00 C ATOM 2265 OE1 GLU B 34 144.413 11.170 4.080 1.00 0.00 O ATOM 2266 OE2 GLU B 34 144.615 13.276 4.045 1.00 0.00 O ATOM 0 H GLU B 34 145.297 10.974 -0.008 1.00 0.00 H new ATOM 0 HA GLU B 34 147.512 12.864 0.433 1.00 0.00 H new ATOM 0 HB2 GLU B 34 146.765 10.726 2.409 1.00 0.00 H new ATOM 0 HB3 GLU B 34 147.229 12.393 2.688 1.00 0.00 H new ATOM 0 HG2 GLU B 34 145.027 13.118 1.615 1.00 0.00 H new ATOM 0 HG3 GLU B 34 144.563 11.429 1.535 1.00 0.00 H new ATOM 2273 N LEU B 35 147.982 9.573 0.442 1.00 0.00 N ATOM 2274 CA LEU B 35 148.990 8.484 0.175 1.00 0.00 C ATOM 2275 C LEU B 35 149.688 8.771 -1.151 1.00 0.00 C ATOM 2276 O LEU B 35 150.843 8.416 -1.371 1.00 0.00 O ATOM 2277 CB LEU B 35 148.241 7.148 0.038 1.00 0.00 C ATOM 2278 CG LEU B 35 147.452 6.838 1.322 1.00 0.00 C ATOM 2279 CD1 LEU B 35 146.145 6.143 0.966 1.00 0.00 C ATOM 2280 CD2 LEU B 35 148.268 5.913 2.220 1.00 0.00 C ATOM 0 H LEU B 35 147.052 9.232 0.686 1.00 0.00 H new ATOM 0 HA LEU B 35 149.716 8.441 0.987 1.00 0.00 H new ATOM 0 HB2 LEU B 35 147.561 7.191 -0.812 1.00 0.00 H new ATOM 0 HB3 LEU B 35 148.951 6.345 -0.162 1.00 0.00 H new ATOM 0 HG LEU B 35 147.247 7.773 1.843 1.00 0.00 H new ATOM 0 HD11 LEU B 35 145.589 5.925 1.878 1.00 0.00 H new ATOM 0 HD12 LEU B 35 145.550 6.793 0.325 1.00 0.00 H new ATOM 0 HD13 LEU B 35 146.359 5.212 0.440 1.00 0.00 H new ATOM 0 HD21 LEU B 35 147.704 5.697 3.128 1.00 0.00 H new ATOM 0 HD22 LEU B 35 148.475 4.983 1.691 1.00 0.00 H new ATOM 0 HD23 LEU B 35 149.208 6.398 2.483 1.00 0.00 H new ATOM 2292 N ILE B 36 148.977 9.356 -2.049 1.00 0.00 N ATOM 2293 CA ILE B 36 149.531 9.652 -3.380 1.00 0.00 C ATOM 2294 C ILE B 36 150.598 10.744 -3.256 1.00 0.00 C ATOM 2295 O ILE B 36 151.717 10.578 -3.700 1.00 0.00 O ATOM 2296 CB ILE B 36 148.365 10.073 -4.295 1.00 0.00 C ATOM 2297 CG1 ILE B 36 147.644 8.801 -4.774 1.00 0.00 C ATOM 2298 CG2 ILE B 36 148.849 10.897 -5.498 1.00 0.00 C ATOM 2299 CD1 ILE B 36 146.484 9.163 -5.683 1.00 0.00 C ATOM 0 H ILE B 36 148.010 9.650 -1.915 1.00 0.00 H new ATOM 0 HA ILE B 36 150.017 8.779 -3.815 1.00 0.00 H new ATOM 0 HB ILE B 36 147.684 10.709 -3.730 1.00 0.00 H new ATOM 0 HG12 ILE B 36 148.344 8.157 -5.306 1.00 0.00 H new ATOM 0 HG13 ILE B 36 147.280 8.236 -3.916 1.00 0.00 H new ATOM 0 HG21 ILE B 36 147.995 11.173 -6.117 1.00 0.00 H new ATOM 0 HG22 ILE B 36 149.348 11.799 -5.144 1.00 0.00 H new ATOM 0 HG23 ILE B 36 149.548 10.304 -6.088 1.00 0.00 H new ATOM 0 HD11 ILE B 36 145.983 8.253 -6.014 1.00 0.00 H new ATOM 0 HD12 ILE B 36 145.777 9.789 -5.139 1.00 0.00 H new ATOM 0 HD13 ILE B 36 146.858 9.708 -6.550 1.00 0.00 H new ATOM 2311 N LYS B 37 150.270 11.854 -2.674 1.00 0.00 N ATOM 2312 CA LYS B 37 151.259 12.939 -2.548 1.00 0.00 C ATOM 2313 C LYS B 37 152.523 12.408 -1.862 1.00 0.00 C ATOM 2314 O LYS B 37 153.658 12.661 -2.309 1.00 0.00 O ATOM 2315 CB LYS B 37 150.644 14.061 -1.742 1.00 0.00 C ATOM 2316 CG LYS B 37 149.437 14.651 -2.507 1.00 0.00 C ATOM 2317 CD LYS B 37 149.913 15.625 -3.607 1.00 0.00 C ATOM 2318 CE LYS B 37 149.713 17.081 -3.148 1.00 0.00 C ATOM 2319 NZ LYS B 37 150.224 17.246 -1.762 1.00 0.00 N ATOM 0 H LYS B 37 149.352 12.055 -2.278 1.00 0.00 H new ATOM 0 HA LYS B 37 151.538 13.314 -3.533 1.00 0.00 H new ATOM 0 HB2 LYS B 37 150.324 13.689 -0.769 1.00 0.00 H new ATOM 0 HB3 LYS B 37 151.386 14.838 -1.558 1.00 0.00 H new ATOM 0 HG2 LYS B 37 148.854 13.846 -2.954 1.00 0.00 H new ATOM 0 HG3 LYS B 37 148.779 15.173 -1.812 1.00 0.00 H new ATOM 0 HD2 LYS B 37 150.965 15.447 -3.830 1.00 0.00 H new ATOM 0 HD3 LYS B 37 149.357 15.446 -4.527 1.00 0.00 H new ATOM 0 HE2 LYS B 37 150.236 17.760 -3.822 1.00 0.00 H new ATOM 0 HE3 LYS B 37 148.656 17.343 -3.189 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 150.276 18.258 -1.529 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 149.582 16.771 -1.096 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 151.172 16.825 -1.689 1.00 0.00 H new ATOM 2333 N GLU B 38 152.367 11.644 -0.815 1.00 0.00 N ATOM 2334 CA GLU B 38 153.565 11.091 -0.175 1.00 0.00 C ATOM 2335 C GLU B 38 154.290 10.167 -1.149 1.00 0.00 C ATOM 2336 O GLU B 38 155.497 10.107 -1.142 1.00 0.00 O ATOM 2337 CB GLU B 38 153.267 10.429 1.184 1.00 0.00 C ATOM 2338 CG GLU B 38 151.988 9.588 1.187 1.00 0.00 C ATOM 2339 CD GLU B 38 151.484 9.528 2.600 1.00 0.00 C ATOM 2340 OE1 GLU B 38 150.747 10.397 2.971 1.00 0.00 O ATOM 2341 OE2 GLU B 38 151.888 8.650 3.313 1.00 0.00 O ATOM 0 H GLU B 38 151.475 11.390 -0.391 1.00 0.00 H new ATOM 0 HA GLU B 38 154.236 11.916 0.066 1.00 0.00 H new ATOM 0 HB2 GLU B 38 154.109 9.796 1.463 1.00 0.00 H new ATOM 0 HB3 GLU B 38 153.185 11.204 1.946 1.00 0.00 H new ATOM 0 HG2 GLU B 38 151.238 10.031 0.532 1.00 0.00 H new ATOM 0 HG3 GLU B 38 152.189 8.585 0.810 1.00 0.00 H new ATOM 2348 N TYR B 39 153.588 9.558 -2.095 1.00 0.00 N ATOM 2349 CA TYR B 39 154.316 8.794 -3.144 1.00 0.00 C ATOM 2350 C TYR B 39 155.219 9.677 -3.909 1.00 0.00 C ATOM 2351 O TYR B 39 156.318 9.307 -4.206 1.00 0.00 O ATOM 2352 CB TYR B 39 153.398 8.034 -4.113 1.00 0.00 C ATOM 2353 CG TYR B 39 153.198 6.628 -3.641 1.00 0.00 C ATOM 2354 CD1 TYR B 39 154.328 5.831 -3.418 1.00 0.00 C ATOM 2355 CD2 TYR B 39 151.927 6.097 -3.467 1.00 0.00 C ATOM 2356 CE1 TYR B 39 154.187 4.524 -3.016 1.00 0.00 C ATOM 2357 CE2 TYR B 39 151.794 4.768 -3.069 1.00 0.00 C ATOM 2358 CZ TYR B 39 152.928 3.990 -2.842 1.00 0.00 C ATOM 2359 OH TYR B 39 152.807 2.695 -2.465 1.00 0.00 O ATOM 0 H TYR B 39 152.571 9.563 -2.174 1.00 0.00 H new ATOM 0 HA TYR B 39 154.894 8.044 -2.604 1.00 0.00 H new ATOM 0 HB2 TYR B 39 152.436 8.541 -4.187 1.00 0.00 H new ATOM 0 HB3 TYR B 39 153.834 8.031 -5.112 1.00 0.00 H new ATOM 0 HD1 TYR B 39 155.315 6.245 -3.563 1.00 0.00 H new ATOM 0 HD2 TYR B 39 151.052 6.706 -3.638 1.00 0.00 H new ATOM 0 HE1 TYR B 39 155.062 3.916 -2.837 1.00 0.00 H new ATOM 0 HE2 TYR B 39 150.811 4.340 -2.936 1.00 0.00 H new ATOM 0 HH TYR B 39 152.029 2.597 -1.878 1.00 0.00 H new ATOM 2369 N LEU B 40 154.802 10.839 -4.227 1.00 0.00 N ATOM 2370 CA LEU B 40 155.705 11.721 -4.990 1.00 0.00 C ATOM 2371 C LEU B 40 156.972 11.901 -4.181 1.00 0.00 C ATOM 2372 O LEU B 40 158.058 11.889 -4.716 1.00 0.00 O ATOM 2373 CB LEU B 40 155.028 13.072 -5.264 1.00 0.00 C ATOM 2374 CG LEU B 40 153.540 12.852 -5.617 1.00 0.00 C ATOM 2375 CD1 LEU B 40 152.910 14.164 -6.065 1.00 0.00 C ATOM 2376 CD2 LEU B 40 153.410 11.814 -6.738 1.00 0.00 C ATOM 0 H LEU B 40 153.886 11.225 -4.000 1.00 0.00 H new ATOM 0 HA LEU B 40 155.944 11.278 -5.957 1.00 0.00 H new ATOM 0 HB2 LEU B 40 155.112 13.715 -4.388 1.00 0.00 H new ATOM 0 HB3 LEU B 40 155.534 13.583 -6.084 1.00 0.00 H new ATOM 0 HG LEU B 40 153.023 12.488 -4.729 1.00 0.00 H new ATOM 0 HD11 LEU B 40 151.861 13.999 -6.312 1.00 0.00 H new ATOM 0 HD12 LEU B 40 152.982 14.896 -5.260 1.00 0.00 H new ATOM 0 HD13 LEU B 40 153.435 14.538 -6.944 1.00 0.00 H new ATOM 0 HD21 LEU B 40 152.357 11.668 -6.978 1.00 0.00 H new ATOM 0 HD22 LEU B 40 153.938 12.167 -7.624 1.00 0.00 H new ATOM 0 HD23 LEU B 40 153.842 10.869 -6.410 1.00 0.00 H new ATOM 2388 N GLU B 41 156.848 12.008 -2.896 1.00 0.00 N ATOM 2389 CA GLU B 41 158.071 12.148 -2.053 1.00 0.00 C ATOM 2390 C GLU B 41 158.778 10.796 -1.913 1.00 0.00 C ATOM 2391 O GLU B 41 159.918 10.650 -2.282 1.00 0.00 O ATOM 2392 CB GLU B 41 157.690 12.674 -0.666 1.00 0.00 C ATOM 2393 CG GLU B 41 156.924 13.997 -0.806 1.00 0.00 C ATOM 2394 CD GLU B 41 157.878 15.152 -0.641 1.00 0.00 C ATOM 2395 OE1 GLU B 41 158.803 15.253 -1.421 1.00 0.00 O ATOM 2396 OE2 GLU B 41 157.686 15.917 0.249 1.00 0.00 O ATOM 0 H GLU B 41 155.963 12.005 -2.389 1.00 0.00 H new ATOM 0 HA GLU B 41 158.748 12.854 -2.535 1.00 0.00 H new ATOM 0 HB2 GLU B 41 157.075 11.940 -0.145 1.00 0.00 H new ATOM 0 HB3 GLU B 41 158.587 12.824 -0.064 1.00 0.00 H new ATOM 0 HG2 GLU B 41 156.441 14.048 -1.782 1.00 0.00 H new ATOM 0 HG3 GLU B 41 156.135 14.054 -0.056 1.00 0.00 H new ATOM 2403 N LEU B 42 158.132 9.834 -1.330 1.00 0.00 N ATOM 2404 CA LEU B 42 158.789 8.512 -1.083 1.00 0.00 C ATOM 2405 C LEU B 42 159.281 7.913 -2.401 1.00 0.00 C ATOM 2406 O LEU B 42 160.339 7.311 -2.458 1.00 0.00 O ATOM 2407 CB LEU B 42 157.804 7.537 -0.401 1.00 0.00 C ATOM 2408 CG LEU B 42 158.598 6.561 0.501 1.00 0.00 C ATOM 2409 CD1 LEU B 42 158.661 7.098 1.936 1.00 0.00 C ATOM 2410 CD2 LEU B 42 157.943 5.176 0.517 1.00 0.00 C ATOM 0 H LEU B 42 157.167 9.900 -1.008 1.00 0.00 H new ATOM 0 HA LEU B 42 159.641 8.670 -0.422 1.00 0.00 H new ATOM 0 HB2 LEU B 42 157.078 8.091 0.193 1.00 0.00 H new ATOM 0 HB3 LEU B 42 157.243 6.982 -1.153 1.00 0.00 H new ATOM 0 HG LEU B 42 159.605 6.475 0.094 1.00 0.00 H new ATOM 0 HD11 LEU B 42 159.222 6.403 2.560 1.00 0.00 H new ATOM 0 HD12 LEU B 42 159.156 8.069 1.940 1.00 0.00 H new ATOM 0 HD13 LEU B 42 157.650 7.204 2.329 1.00 0.00 H new ATOM 0 HD21 LEU B 42 158.519 4.508 1.158 1.00 0.00 H new ATOM 0 HD22 LEU B 42 156.926 5.259 0.901 1.00 0.00 H new ATOM 0 HD23 LEU B 42 157.917 4.774 -0.496 1.00 0.00 H new ATOM 2422 N GLU B 43 158.526 8.062 -3.449 1.00 0.00 N ATOM 2423 CA GLU B 43 158.936 7.503 -4.767 1.00 0.00 C ATOM 2424 C GLU B 43 160.174 8.243 -5.229 1.00 0.00 C ATOM 2425 O GLU B 43 161.179 7.647 -5.563 1.00 0.00 O ATOM 2426 CB GLU B 43 157.798 7.696 -5.797 1.00 0.00 C ATOM 2427 CG GLU B 43 158.150 6.989 -7.119 1.00 0.00 C ATOM 2428 CD GLU B 43 157.997 7.952 -8.268 1.00 0.00 C ATOM 2429 OE1 GLU B 43 158.596 9.004 -8.229 1.00 0.00 O ATOM 2430 OE2 GLU B 43 157.292 7.629 -9.179 1.00 0.00 O ATOM 0 H GLU B 43 157.632 8.553 -3.451 1.00 0.00 H new ATOM 0 HA GLU B 43 159.145 6.437 -4.674 1.00 0.00 H new ATOM 0 HB2 GLU B 43 156.866 7.295 -5.399 1.00 0.00 H new ATOM 0 HB3 GLU B 43 157.637 8.759 -5.977 1.00 0.00 H new ATOM 0 HG2 GLU B 43 159.173 6.614 -7.080 1.00 0.00 H new ATOM 0 HG3 GLU B 43 157.499 6.127 -7.266 1.00 0.00 H new ATOM 2437 N LYS B 44 160.096 9.529 -5.307 1.00 0.00 N ATOM 2438 CA LYS B 44 161.247 10.319 -5.775 1.00 0.00 C ATOM 2439 C LYS B 44 162.431 10.065 -4.834 1.00 0.00 C ATOM 2440 O LYS B 44 163.556 9.844 -5.271 1.00 0.00 O ATOM 2441 CB LYS B 44 160.843 11.789 -5.782 1.00 0.00 C ATOM 2442 CG LYS B 44 159.764 12.015 -6.870 1.00 0.00 C ATOM 2443 CD LYS B 44 160.419 12.097 -8.271 1.00 0.00 C ATOM 2444 CE LYS B 44 159.359 11.927 -9.395 1.00 0.00 C ATOM 2445 NZ LYS B 44 158.119 11.282 -8.869 1.00 0.00 N ATOM 0 H LYS B 44 159.270 10.075 -5.062 1.00 0.00 H new ATOM 0 HA LYS B 44 161.546 10.034 -6.784 1.00 0.00 H new ATOM 0 HB2 LYS B 44 160.457 12.077 -4.804 1.00 0.00 H new ATOM 0 HB3 LYS B 44 161.712 12.417 -5.979 1.00 0.00 H new ATOM 0 HG2 LYS B 44 159.040 11.201 -6.847 1.00 0.00 H new ATOM 0 HG3 LYS B 44 159.217 12.935 -6.663 1.00 0.00 H new ATOM 0 HD2 LYS B 44 160.923 13.057 -8.385 1.00 0.00 H new ATOM 0 HD3 LYS B 44 161.181 11.323 -8.365 1.00 0.00 H new ATOM 0 HE2 LYS B 44 159.115 12.901 -9.819 1.00 0.00 H new ATOM 0 HE3 LYS B 44 159.773 11.323 -10.202 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 157.475 11.072 -9.658 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 158.368 10.398 -8.381 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 157.649 11.926 -8.201 1.00 0.00 H new ATOM 2459 N CYS B 45 162.168 9.997 -3.562 1.00 0.00 N ATOM 2460 CA CYS B 45 163.222 9.676 -2.578 1.00 0.00 C ATOM 2461 C CYS B 45 163.813 8.324 -2.933 1.00 0.00 C ATOM 2462 O CYS B 45 164.990 8.205 -3.199 1.00 0.00 O ATOM 2463 CB CYS B 45 162.600 9.604 -1.181 1.00 0.00 C ATOM 2464 SG CYS B 45 162.284 11.276 -0.573 1.00 0.00 S ATOM 0 H CYS B 45 161.244 10.155 -3.159 1.00 0.00 H new ATOM 0 HA CYS B 45 163.998 10.441 -2.591 1.00 0.00 H new ATOM 0 HB2 CYS B 45 161.670 9.036 -1.214 1.00 0.00 H new ATOM 0 HB3 CYS B 45 163.270 9.079 -0.500 1.00 0.00 H new ATOM 0 HG CYS B 45 161.173 11.720 -1.081 1.00 0.00 H new ATOM 2470 N LEU B 46 163.008 7.299 -2.943 1.00 0.00 N ATOM 2471 CA LEU B 46 163.533 5.944 -3.278 1.00 0.00 C ATOM 2472 C LEU B 46 164.189 5.986 -4.649 1.00 0.00 C ATOM 2473 O LEU B 46 165.183 5.375 -4.861 1.00 0.00 O ATOM 2474 CB LEU B 46 162.399 4.892 -3.265 1.00 0.00 C ATOM 2475 CG LEU B 46 162.987 3.464 -3.465 1.00 0.00 C ATOM 2476 CD1 LEU B 46 164.158 3.225 -2.528 1.00 0.00 C ATOM 2477 CD2 LEU B 46 161.930 2.414 -3.166 1.00 0.00 C ATOM 0 H LEU B 46 162.010 7.339 -2.734 1.00 0.00 H new ATOM 0 HA LEU B 46 164.268 5.656 -2.526 1.00 0.00 H new ATOM 0 HB2 LEU B 46 161.858 4.941 -2.320 1.00 0.00 H new ATOM 0 HB3 LEU B 46 161.681 5.111 -4.055 1.00 0.00 H new ATOM 0 HG LEU B 46 163.319 3.389 -4.500 1.00 0.00 H new ATOM 0 HD11 LEU B 46 164.552 2.221 -2.686 1.00 0.00 H new ATOM 0 HD12 LEU B 46 164.940 3.957 -2.729 1.00 0.00 H new ATOM 0 HD13 LEU B 46 163.824 3.325 -1.495 1.00 0.00 H new ATOM 0 HD21 LEU B 46 162.354 1.420 -3.310 1.00 0.00 H new ATOM 0 HD22 LEU B 46 161.594 2.520 -2.135 1.00 0.00 H new ATOM 0 HD23 LEU B 46 161.083 2.548 -3.839 1.00 0.00 H new ATOM 2489 N SER B 47 163.657 6.733 -5.558 1.00 0.00 N ATOM 2490 CA SER B 47 164.275 6.828 -6.904 1.00 0.00 C ATOM 2491 C SER B 47 165.685 7.409 -6.763 1.00 0.00 C ATOM 2492 O SER B 47 166.663 6.851 -7.259 1.00 0.00 O ATOM 2493 CB SER B 47 163.424 7.722 -7.811 1.00 0.00 C ATOM 2494 OG SER B 47 162.052 7.267 -7.788 1.00 0.00 O ATOM 0 H SER B 47 162.812 7.290 -5.430 1.00 0.00 H new ATOM 0 HA SER B 47 164.332 5.836 -7.353 1.00 0.00 H new ATOM 0 HB2 SER B 47 163.480 8.757 -7.475 1.00 0.00 H new ATOM 0 HB3 SER B 47 163.810 7.696 -8.830 1.00 0.00 H new ATOM 0 HG SER B 47 161.591 7.657 -7.016 1.00 0.00 H new ATOM 2500 N ARG B 48 165.818 8.495 -6.057 1.00 0.00 N ATOM 2501 CA ARG B 48 167.172 9.080 -5.842 1.00 0.00 C ATOM 2502 C ARG B 48 168.013 8.065 -5.089 1.00 0.00 C ATOM 2503 O ARG B 48 169.173 7.806 -5.424 1.00 0.00 O ATOM 2504 CB ARG B 48 167.052 10.351 -4.999 1.00 0.00 C ATOM 2505 CG ARG B 48 166.901 11.571 -5.905 1.00 0.00 C ATOM 2506 CD ARG B 48 166.607 12.809 -5.042 1.00 0.00 C ATOM 2507 NE ARG B 48 165.191 13.225 -5.263 1.00 0.00 N ATOM 2508 CZ ARG B 48 164.385 13.550 -4.273 1.00 0.00 C ATOM 2509 NH1 ARG B 48 164.790 13.490 -3.029 1.00 0.00 N ATOM 2510 NH2 ARG B 48 163.174 13.928 -4.549 1.00 0.00 N ATOM 0 H ARG B 48 165.050 9.004 -5.619 1.00 0.00 H new ATOM 0 HA ARG B 48 167.631 9.324 -6.800 1.00 0.00 H new ATOM 0 HB2 ARG B 48 166.193 10.275 -4.333 1.00 0.00 H new ATOM 0 HB3 ARG B 48 167.935 10.463 -4.369 1.00 0.00 H new ATOM 0 HG2 ARG B 48 167.812 11.724 -6.483 1.00 0.00 H new ATOM 0 HG3 ARG B 48 166.093 11.411 -6.619 1.00 0.00 H new ATOM 0 HD2 ARG B 48 166.774 12.583 -3.989 1.00 0.00 H new ATOM 0 HD3 ARG B 48 167.284 13.622 -5.305 1.00 0.00 H new ATOM 0 HE ARG B 48 164.833 13.259 -6.218 1.00 0.00 H new ATOM 0 HH11 ARG B 48 165.741 13.189 -2.816 1.00 0.00 H new ATOM 0 HH12 ARG B 48 164.155 13.745 -2.273 1.00 0.00 H new ATOM 0 HH21 ARG B 48 162.861 13.969 -5.519 1.00 0.00 H new ATOM 0 HH22 ARG B 48 162.535 14.184 -3.796 1.00 0.00 H new ATOM 2524 N MET B 49 167.452 7.496 -4.070 1.00 0.00 N ATOM 2525 CA MET B 49 168.180 6.504 -3.271 1.00 0.00 C ATOM 2526 C MET B 49 168.470 5.292 -4.135 1.00 0.00 C ATOM 2527 O MET B 49 169.381 4.599 -3.899 1.00 0.00 O ATOM 2528 CB MET B 49 167.338 6.069 -2.060 1.00 0.00 C ATOM 2529 CG MET B 49 166.857 7.297 -1.255 1.00 0.00 C ATOM 2530 SD MET B 49 167.872 7.495 0.233 1.00 0.00 S ATOM 2531 CE MET B 49 167.307 6.014 1.116 1.00 0.00 C ATOM 0 H MET B 49 166.500 7.685 -3.756 1.00 0.00 H new ATOM 0 HA MET B 49 169.110 6.947 -2.914 1.00 0.00 H new ATOM 0 HB2 MET B 49 166.478 5.491 -2.398 1.00 0.00 H new ATOM 0 HB3 MET B 49 167.928 5.416 -1.417 1.00 0.00 H new ATOM 0 HG2 MET B 49 166.920 8.194 -1.871 1.00 0.00 H new ATOM 0 HG3 MET B 49 165.810 7.174 -0.978 1.00 0.00 H new ATOM 0 HE1 MET B 49 168.104 5.651 1.765 1.00 0.00 H new ATOM 0 HE2 MET B 49 166.433 6.261 1.718 1.00 0.00 H new ATOM 0 HE3 MET B 49 167.045 5.239 0.396 1.00 0.00 H new ATOM 2541 N GLU B 50 167.727 5.074 -5.152 1.00 0.00 N ATOM 2542 CA GLU B 50 167.987 3.915 -6.028 1.00 0.00 C ATOM 2543 C GLU B 50 169.263 4.173 -6.782 1.00 0.00 C ATOM 2544 O GLU B 50 170.186 3.353 -6.781 1.00 0.00 O ATOM 2545 CB GLU B 50 166.821 3.724 -6.981 1.00 0.00 C ATOM 2546 CG GLU B 50 165.775 2.788 -6.364 1.00 0.00 C ATOM 2547 CD GLU B 50 166.113 1.378 -6.731 1.00 0.00 C ATOM 2548 OE1 GLU B 50 165.690 0.937 -7.761 1.00 0.00 O ATOM 2549 OE2 GLU B 50 166.830 0.759 -5.998 1.00 0.00 O ATOM 0 H GLU B 50 166.934 5.654 -5.427 1.00 0.00 H new ATOM 0 HA GLU B 50 168.092 3.003 -5.440 1.00 0.00 H new ATOM 0 HB2 GLU B 50 166.367 4.688 -7.208 1.00 0.00 H new ATOM 0 HB3 GLU B 50 167.178 3.310 -7.924 1.00 0.00 H new ATOM 0 HG2 GLU B 50 165.759 2.902 -5.280 1.00 0.00 H new ATOM 0 HG3 GLU B 50 164.779 3.044 -6.726 1.00 0.00 H new ATOM 2556 N ASP B 51 169.356 5.317 -7.377 1.00 0.00 N ATOM 2557 CA ASP B 51 170.584 5.694 -8.105 1.00 0.00 C ATOM 2558 C ASP B 51 171.743 5.634 -7.138 1.00 0.00 C ATOM 2559 O ASP B 51 172.735 4.956 -7.367 1.00 0.00 O ATOM 2560 CB ASP B 51 170.435 7.125 -8.633 1.00 0.00 C ATOM 2561 CG ASP B 51 169.830 7.092 -10.009 1.00 0.00 C ATOM 2562 OD1 ASP B 51 170.385 6.453 -10.868 1.00 0.00 O ATOM 2563 OD2 ASP B 51 168.808 7.695 -10.191 1.00 0.00 O ATOM 0 H ASP B 51 168.618 6.021 -7.390 1.00 0.00 H new ATOM 0 HA ASP B 51 170.755 5.017 -8.942 1.00 0.00 H new ATOM 0 HB2 ASP B 51 169.805 7.708 -7.961 1.00 0.00 H new ATOM 0 HB3 ASP B 51 171.408 7.616 -8.664 1.00 0.00 H new ATOM 2568 N GLU B 52 171.619 6.323 -6.047 1.00 0.00 N ATOM 2569 CA GLU B 52 172.699 6.320 -5.042 1.00 0.00 C ATOM 2570 C GLU B 52 172.959 4.898 -4.579 1.00 0.00 C ATOM 2571 O GLU B 52 174.064 4.488 -4.487 1.00 0.00 O ATOM 2572 CB GLU B 52 172.309 7.187 -3.841 1.00 0.00 C ATOM 2573 CG GLU B 52 172.792 8.619 -4.058 1.00 0.00 C ATOM 2574 CD GLU B 52 172.851 9.313 -2.738 1.00 0.00 C ATOM 2575 OE1 GLU B 52 171.858 9.837 -2.328 1.00 0.00 O ATOM 2576 OE2 GLU B 52 173.882 9.302 -2.130 1.00 0.00 O ATOM 0 H GLU B 52 170.807 6.893 -5.809 1.00 0.00 H new ATOM 0 HA GLU B 52 173.603 6.729 -5.494 1.00 0.00 H new ATOM 0 HB2 GLU B 52 171.227 7.175 -3.708 1.00 0.00 H new ATOM 0 HB3 GLU B 52 172.747 6.780 -2.930 1.00 0.00 H new ATOM 0 HG2 GLU B 52 173.775 8.618 -4.528 1.00 0.00 H new ATOM 0 HG3 GLU B 52 172.117 9.147 -4.732 1.00 0.00 H new ATOM 2583 N ASN B 53 171.943 4.180 -4.236 1.00 0.00 N ATOM 2584 CA ASN B 53 172.116 2.795 -3.712 1.00 0.00 C ATOM 2585 C ASN B 53 172.886 1.995 -4.706 1.00 0.00 C ATOM 2586 O ASN B 53 173.813 1.273 -4.364 1.00 0.00 O ATOM 2587 CB ASN B 53 170.741 2.151 -3.496 1.00 0.00 C ATOM 2588 CG ASN B 53 170.296 2.459 -2.085 1.00 0.00 C ATOM 2589 OD1 ASN B 53 169.781 3.602 -1.829 1.00 0.00 O flip ATOM 2590 ND2 ASN B 53 170.451 1.662 -1.194 1.00 0.00 N flip ATOM 0 H ASN B 53 170.974 4.494 -4.295 1.00 0.00 H new ATOM 0 HA ASN B 53 172.652 2.825 -2.763 1.00 0.00 H new ATOM 0 HB2 ASN B 53 170.021 2.540 -4.216 1.00 0.00 H new ATOM 0 HB3 ASN B 53 170.796 1.074 -3.651 1.00 0.00 H new ATOM 0 HD21 ASN B 53 170.861 0.749 -1.392 1.00 0.00 H new ATOM 0 HD22 ASN B 53 170.172 1.900 -0.242 1.00 0.00 H new ATOM 2597 N ASN B 54 172.532 2.138 -5.952 1.00 0.00 N ATOM 2598 CA ASN B 54 173.244 1.420 -7.023 1.00 0.00 C ATOM 2599 C ASN B 54 174.706 1.723 -6.934 1.00 0.00 C ATOM 2600 O ASN B 54 175.521 0.835 -6.744 1.00 0.00 O ATOM 2601 CB ASN B 54 172.708 1.847 -8.390 1.00 0.00 C ATOM 2602 CG ASN B 54 171.556 0.928 -8.789 1.00 0.00 C ATOM 2603 OD1 ASN B 54 171.183 0.021 -8.044 1.00 0.00 O ATOM 2604 ND2 ASN B 54 170.981 1.095 -9.920 1.00 0.00 N ATOM 0 H ASN B 54 171.767 2.733 -6.270 1.00 0.00 H new ATOM 0 HA ASN B 54 173.085 0.348 -6.904 1.00 0.00 H new ATOM 0 HB2 ASN B 54 172.367 2.882 -8.353 1.00 0.00 H new ATOM 0 HB3 ASN B 54 173.502 1.799 -9.136 1.00 0.00 H new ATOM 0 HD21 ASN B 54 170.218 0.479 -10.200 1.00 0.00 H new ATOM 0 HD22 ASN B 54 171.286 1.844 -10.541 1.00 0.00 H new ATOM 2611 N ARG B 55 175.054 2.959 -7.018 1.00 0.00 N ATOM 2612 CA ARG B 55 176.474 3.341 -6.917 1.00 0.00 C ATOM 2613 C ARG B 55 177.001 2.950 -5.549 1.00 0.00 C ATOM 2614 O ARG B 55 177.867 2.136 -5.433 1.00 0.00 O ATOM 2615 CB ARG B 55 176.595 4.846 -7.115 1.00 0.00 C ATOM 2616 CG ARG B 55 176.317 5.188 -8.576 1.00 0.00 C ATOM 2617 CD ARG B 55 177.623 5.117 -9.385 1.00 0.00 C ATOM 2618 NE ARG B 55 177.780 6.395 -10.139 1.00 0.00 N ATOM 2619 CZ ARG B 55 178.533 7.385 -9.686 1.00 0.00 C ATOM 2620 NH1 ARG B 55 179.232 7.254 -8.577 1.00 0.00 N ATOM 2621 NH2 ARG B 55 178.570 8.506 -10.346 1.00 0.00 N ATOM 0 H ARG B 55 174.407 3.735 -7.155 1.00 0.00 H new ATOM 0 HA ARG B 55 177.058 2.828 -7.682 1.00 0.00 H new ATOM 0 HB2 ARG B 55 175.890 5.367 -6.467 1.00 0.00 H new ATOM 0 HB3 ARG B 55 177.593 5.182 -6.835 1.00 0.00 H new ATOM 0 HG2 ARG B 55 175.585 4.494 -8.989 1.00 0.00 H new ATOM 0 HG3 ARG B 55 175.887 6.187 -8.650 1.00 0.00 H new ATOM 0 HD2 ARG B 55 178.473 4.962 -8.720 1.00 0.00 H new ATOM 0 HD3 ARG B 55 177.598 4.272 -10.073 1.00 0.00 H new ATOM 0 HE ARG B 55 177.294 6.509 -11.028 1.00 0.00 H new ATOM 0 HH11 ARG B 55 179.198 6.379 -8.053 1.00 0.00 H new ATOM 0 HH12 ARG B 55 179.807 8.027 -8.242 1.00 0.00 H new ATOM 0 HH21 ARG B 55 178.023 8.613 -11.200 1.00 0.00 H new ATOM 0 HH22 ARG B 55 179.146 9.278 -10.009 1.00 0.00 H new ATOM 2635 N LEU B 56 176.474 3.541 -4.531 1.00 0.00 N ATOM 2636 CA LEU B 56 176.902 3.282 -3.136 1.00 0.00 C ATOM 2637 C LEU B 56 177.300 1.847 -2.926 1.00 0.00 C ATOM 2638 O LEU B 56 178.403 1.573 -2.531 1.00 0.00 O ATOM 2639 CB LEU B 56 175.718 3.592 -2.193 1.00 0.00 C ATOM 2640 CG LEU B 56 175.695 5.106 -1.881 1.00 0.00 C ATOM 2641 CD1 LEU B 56 174.475 5.459 -1.031 1.00 0.00 C ATOM 2642 CD2 LEU B 56 176.973 5.511 -1.124 1.00 0.00 C ATOM 0 H LEU B 56 175.725 4.229 -4.610 1.00 0.00 H new ATOM 0 HA LEU B 56 177.765 3.914 -2.927 1.00 0.00 H new ATOM 0 HB2 LEU B 56 174.779 3.291 -2.658 1.00 0.00 H new ATOM 0 HB3 LEU B 56 175.814 3.020 -1.270 1.00 0.00 H new ATOM 0 HG LEU B 56 175.643 5.648 -2.825 1.00 0.00 H new ATOM 0 HD11 LEU B 56 174.475 6.529 -0.821 1.00 0.00 H new ATOM 0 HD12 LEU B 56 173.566 5.195 -1.572 1.00 0.00 H new ATOM 0 HD13 LEU B 56 174.512 4.905 -0.093 1.00 0.00 H new ATOM 0 HD21 LEU B 56 176.946 6.579 -0.910 1.00 0.00 H new ATOM 0 HD22 LEU B 56 177.034 4.955 -0.189 1.00 0.00 H new ATOM 0 HD23 LEU B 56 177.846 5.286 -1.737 1.00 0.00 H new ATOM 2654 N ARG B 57 176.410 0.919 -3.123 1.00 0.00 N ATOM 2655 CA ARG B 57 176.777 -0.490 -2.883 1.00 0.00 C ATOM 2656 C ARG B 57 177.923 -0.894 -3.798 1.00 0.00 C ATOM 2657 O ARG B 57 178.802 -1.643 -3.399 1.00 0.00 O ATOM 2658 CB ARG B 57 175.589 -1.405 -3.116 1.00 0.00 C ATOM 2659 CG ARG B 57 174.705 -1.402 -1.862 1.00 0.00 C ATOM 2660 CD ARG B 57 173.315 -1.007 -2.264 1.00 0.00 C ATOM 2661 NE ARG B 57 172.304 -1.466 -1.255 1.00 0.00 N ATOM 2662 CZ ARG B 57 171.033 -1.561 -1.604 1.00 0.00 C ATOM 2663 NH1 ARG B 57 170.688 -1.344 -2.843 1.00 0.00 N ATOM 2664 NH2 ARG B 57 170.135 -1.887 -0.730 1.00 0.00 N ATOM 0 H ARG B 57 175.453 1.078 -3.437 1.00 0.00 H new ATOM 0 HA ARG B 57 177.092 -0.588 -1.844 1.00 0.00 H new ATOM 0 HB2 ARG B 57 175.017 -1.068 -3.981 1.00 0.00 H new ATOM 0 HB3 ARG B 57 175.930 -2.417 -3.334 1.00 0.00 H new ATOM 0 HG2 ARG B 57 174.700 -2.389 -1.399 1.00 0.00 H new ATOM 0 HG3 ARG B 57 175.098 -0.705 -1.122 1.00 0.00 H new ATOM 0 HD2 ARG B 57 173.259 0.076 -2.371 1.00 0.00 H new ATOM 0 HD3 ARG B 57 173.080 -1.436 -3.238 1.00 0.00 H new ATOM 0 HE ARG B 57 172.596 -1.703 -0.307 1.00 0.00 H new ATOM 0 HH11 ARG B 57 171.397 -1.103 -3.535 1.00 0.00 H new ATOM 0 HH12 ARG B 57 169.709 -1.416 -3.120 1.00 0.00 H new ATOM 0 HH21 ARG B 57 170.407 -2.072 0.235 1.00 0.00 H new ATOM 0 HH22 ARG B 57 169.156 -1.958 -1.007 1.00 0.00 H new ATOM 2678 N LEU B 58 177.933 -0.431 -5.013 1.00 0.00 N ATOM 2679 CA LEU B 58 179.012 -0.820 -5.938 1.00 0.00 C ATOM 2680 C LEU B 58 180.313 -0.167 -5.481 1.00 0.00 C ATOM 2681 O LEU B 58 181.371 -0.770 -5.530 1.00 0.00 O ATOM 2682 CB LEU B 58 178.667 -0.405 -7.343 1.00 0.00 C ATOM 2683 CG LEU B 58 177.441 -1.176 -7.838 1.00 0.00 C ATOM 2684 CD1 LEU B 58 176.881 -0.526 -9.112 1.00 0.00 C ATOM 2685 CD2 LEU B 58 177.823 -2.627 -8.119 1.00 0.00 C ATOM 0 H LEU B 58 177.234 0.203 -5.401 1.00 0.00 H new ATOM 0 HA LEU B 58 179.134 -1.903 -5.931 1.00 0.00 H new ATOM 0 HB2 LEU B 58 178.469 0.666 -7.375 1.00 0.00 H new ATOM 0 HB3 LEU B 58 179.514 -0.592 -8.003 1.00 0.00 H new ATOM 0 HG LEU B 58 176.672 -1.150 -7.066 1.00 0.00 H new ATOM 0 HD11 LEU B 58 176.009 -1.085 -9.453 1.00 0.00 H new ATOM 0 HD12 LEU B 58 176.592 0.503 -8.898 1.00 0.00 H new ATOM 0 HD13 LEU B 58 177.644 -0.534 -9.890 1.00 0.00 H new ATOM 0 HD21 LEU B 58 176.947 -3.172 -8.471 1.00 0.00 H new ATOM 0 HD22 LEU B 58 178.600 -2.657 -8.882 1.00 0.00 H new ATOM 0 HD23 LEU B 58 178.194 -3.089 -7.204 1.00 0.00 H new ATOM 2697 N GLU B 59 180.246 1.028 -5.058 1.00 0.00 N ATOM 2698 CA GLU B 59 181.447 1.755 -4.588 1.00 0.00 C ATOM 2699 C GLU B 59 181.820 1.269 -3.196 1.00 0.00 C ATOM 2700 O GLU B 59 182.828 0.641 -3.015 1.00 0.00 O ATOM 2701 CB GLU B 59 181.127 3.257 -4.568 1.00 0.00 C ATOM 2702 CG GLU B 59 180.866 3.727 -6.015 1.00 0.00 C ATOM 2703 CD GLU B 59 180.691 5.228 -6.064 1.00 0.00 C ATOM 2704 OE1 GLU B 59 181.412 5.915 -5.378 1.00 0.00 O ATOM 2705 OE2 GLU B 59 179.831 5.678 -6.779 1.00 0.00 O ATOM 0 H GLU B 59 179.382 1.567 -5.010 1.00 0.00 H new ATOM 0 HA GLU B 59 182.291 1.573 -5.254 1.00 0.00 H new ATOM 0 HB2 GLU B 59 180.253 3.449 -3.945 1.00 0.00 H new ATOM 0 HB3 GLU B 59 181.957 3.814 -4.134 1.00 0.00 H new ATOM 0 HG2 GLU B 59 181.698 3.431 -6.655 1.00 0.00 H new ATOM 0 HG3 GLU B 59 179.974 3.239 -6.406 1.00 0.00 H new ATOM 2712 N SER B 60 181.002 1.544 -2.229 1.00 0.00 N ATOM 2713 CA SER B 60 181.269 1.131 -0.817 1.00 0.00 C ATOM 2714 C SER B 60 181.971 -0.249 -0.757 1.00 0.00 C ATOM 2715 O SER B 60 182.953 -0.422 -0.077 1.00 0.00 O ATOM 2716 CB SER B 60 179.943 1.052 -0.061 1.00 0.00 C ATOM 2717 OG SER B 60 179.163 2.207 -0.375 1.00 0.00 O ATOM 0 H SER B 60 180.128 2.055 -2.356 1.00 0.00 H new ATOM 0 HA SER B 60 181.927 1.870 -0.361 1.00 0.00 H new ATOM 0 HB2 SER B 60 179.404 0.146 -0.338 1.00 0.00 H new ATOM 0 HB3 SER B 60 180.124 0.999 1.013 1.00 0.00 H new ATOM 0 HG SER B 60 178.703 2.069 -1.229 1.00 0.00 H new ATOM 2723 N LYS B 61 181.479 -1.239 -1.469 1.00 0.00 N ATOM 2724 CA LYS B 61 182.157 -2.583 -1.403 1.00 0.00 C ATOM 2725 C LYS B 61 183.635 -2.423 -1.770 1.00 0.00 C ATOM 2726 O LYS B 61 184.489 -3.171 -1.319 1.00 0.00 O ATOM 2727 CB LYS B 61 181.478 -3.603 -2.337 1.00 0.00 C ATOM 2728 CG LYS B 61 181.465 -3.087 -3.789 1.00 0.00 C ATOM 2729 CD LYS B 61 180.504 -3.953 -4.643 1.00 0.00 C ATOM 2730 CE LYS B 61 180.968 -4.025 -6.119 1.00 0.00 C ATOM 2731 NZ LYS B 61 181.886 -2.900 -6.452 1.00 0.00 N ATOM 0 H LYS B 61 180.662 -1.183 -2.077 1.00 0.00 H new ATOM 0 HA LYS B 61 182.072 -2.965 -0.386 1.00 0.00 H new ATOM 0 HB2 LYS B 61 182.006 -4.555 -2.289 1.00 0.00 H new ATOM 0 HB3 LYS B 61 180.457 -3.787 -2.002 1.00 0.00 H new ATOM 0 HG2 LYS B 61 181.148 -2.044 -3.812 1.00 0.00 H new ATOM 0 HG3 LYS B 61 182.471 -3.123 -4.207 1.00 0.00 H new ATOM 0 HD2 LYS B 61 180.452 -4.959 -4.227 1.00 0.00 H new ATOM 0 HD3 LYS B 61 179.498 -3.536 -4.596 1.00 0.00 H new ATOM 0 HE2 LYS B 61 181.473 -4.974 -6.298 1.00 0.00 H new ATOM 0 HE3 LYS B 61 180.100 -3.996 -6.777 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 181.965 -2.811 -7.485 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 181.509 -2.015 -6.056 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 182.826 -3.087 -6.048 1.00 0.00 H new ATOM 2745 N ARG B 62 183.944 -1.426 -2.523 1.00 0.00 N ATOM 2746 CA ARG B 62 185.336 -1.139 -2.905 1.00 0.00 C ATOM 2747 C ARG B 62 185.934 -0.172 -1.887 1.00 0.00 C ATOM 2748 O ARG B 62 186.797 0.633 -2.228 1.00 0.00 O ATOM 2749 CB ARG B 62 185.353 -0.478 -4.297 1.00 0.00 C ATOM 2750 CG ARG B 62 184.803 -1.445 -5.356 1.00 0.00 C ATOM 2751 CD ARG B 62 185.521 -1.204 -6.689 1.00 0.00 C ATOM 2752 NE ARG B 62 187.000 -1.296 -6.484 1.00 0.00 N ATOM 2753 CZ ARG B 62 187.826 -1.222 -7.505 1.00 0.00 C ATOM 2754 NH1 ARG B 62 187.359 -1.084 -8.715 1.00 0.00 N ATOM 2755 NH2 ARG B 62 189.103 -1.279 -7.303 1.00 0.00 N ATOM 0 H ARG B 62 183.261 -0.771 -2.905 1.00 0.00 H new ATOM 0 HA ARG B 62 185.914 -2.063 -2.930 1.00 0.00 H new ATOM 0 HB2 ARG B 62 184.754 0.433 -4.281 1.00 0.00 H new ATOM 0 HB3 ARG B 62 186.371 -0.186 -4.556 1.00 0.00 H new ATOM 0 HG2 ARG B 62 184.949 -2.476 -5.033 1.00 0.00 H new ATOM 0 HG3 ARG B 62 183.730 -1.297 -5.477 1.00 0.00 H new ATOM 0 HD2 ARG B 62 185.199 -1.940 -7.426 1.00 0.00 H new ATOM 0 HD3 ARG B 62 185.258 -0.222 -7.083 1.00 0.00 H new ATOM 0 HE ARG B 62 187.372 -1.417 -5.542 1.00 0.00 H new ATOM 0 HH11 ARG B 62 186.352 -1.033 -8.870 1.00 0.00 H new ATOM 0 HH12 ARG B 62 188.001 -1.027 -9.506 1.00 0.00 H new ATOM 0 HH21 ARG B 62 189.465 -1.381 -6.355 1.00 0.00 H new ATOM 0 HH22 ARG B 62 189.747 -1.222 -8.092 1.00 0.00 H new ATOM 2769 N LEU B 63 185.499 -0.227 -0.645 1.00 0.00 N ATOM 2770 CA LEU B 63 186.010 0.716 0.418 1.00 0.00 C ATOM 2771 C LEU B 63 187.514 0.563 0.638 1.00 0.00 C ATOM 2772 O LEU B 63 188.015 0.742 1.734 1.00 0.00 O ATOM 2773 CB LEU B 63 185.262 0.463 1.743 1.00 0.00 C ATOM 2774 CG LEU B 63 184.016 1.364 1.832 1.00 0.00 C ATOM 2775 CD1 LEU B 63 182.912 0.659 2.626 1.00 0.00 C ATOM 2776 CD2 LEU B 63 184.391 2.668 2.544 1.00 0.00 C ATOM 0 H LEU B 63 184.801 -0.894 -0.316 1.00 0.00 H new ATOM 0 HA LEU B 63 185.825 1.734 0.075 1.00 0.00 H new ATOM 0 HB2 LEU B 63 184.968 -0.584 1.808 1.00 0.00 H new ATOM 0 HB3 LEU B 63 185.924 0.661 2.586 1.00 0.00 H new ATOM 0 HG LEU B 63 183.654 1.575 0.826 1.00 0.00 H new ATOM 0 HD11 LEU B 63 182.036 1.305 2.683 1.00 0.00 H new ATOM 0 HD12 LEU B 63 182.644 -0.273 2.128 1.00 0.00 H new ATOM 0 HD13 LEU B 63 183.269 0.443 3.633 1.00 0.00 H new ATOM 0 HD21 LEU B 63 183.514 3.311 2.611 1.00 0.00 H new ATOM 0 HD22 LEU B 63 184.754 2.444 3.547 1.00 0.00 H new ATOM 0 HD23 LEU B 63 185.173 3.178 1.981 1.00 0.00 H new ATOM 2788 N GLY B 64 188.231 0.283 -0.372 1.00 0.00 N ATOM 2789 CA GLY B 64 189.677 0.112 -0.237 1.00 0.00 C ATOM 2790 C GLY B 64 190.367 0.796 -1.368 1.00 0.00 C ATOM 2791 O GLY B 64 191.286 0.250 -1.963 1.00 0.00 O ATOM 0 H GLY B 64 187.871 0.160 -1.318 1.00 0.00 H new ATOM 0 HA2 GLY B 64 190.016 0.526 0.713 1.00 0.00 H new ATOM 0 HA3 GLY B 64 189.929 -0.948 -0.231 1.00 0.00 H new ATOM 2795 N GLY B 65 190.013 2.018 -1.635 1.00 0.00 N ATOM 2796 CA GLY B 65 190.773 2.770 -2.646 1.00 0.00 C ATOM 2797 C GLY B 65 192.149 2.967 -2.046 1.00 0.00 C ATOM 2798 O GLY B 65 192.441 2.431 -0.998 1.00 0.00 O ATOM 0 H GLY B 65 189.238 2.518 -1.199 1.00 0.00 H new ATOM 0 HA2 GLY B 65 190.829 2.220 -3.586 1.00 0.00 H new ATOM 0 HA3 GLY B 65 190.298 3.727 -2.864 1.00 0.00 H new ATOM 2802 N ASP B 66 192.984 3.701 -2.670 1.00 0.00 N ATOM 2803 CA ASP B 66 194.371 3.924 -2.145 1.00 0.00 C ATOM 2804 C ASP B 66 195.220 2.674 -2.371 1.00 0.00 C ATOM 2805 O ASP B 66 196.418 2.750 -2.324 1.00 0.00 O ATOM 2806 CB ASP B 66 194.381 4.311 -0.634 1.00 0.00 C ATOM 2807 CG ASP B 66 195.029 5.662 -0.429 1.00 0.00 C ATOM 2808 OD1 ASP B 66 195.944 5.994 -1.135 1.00 0.00 O ATOM 2809 OD2 ASP B 66 194.586 6.364 0.440 1.00 0.00 O ATOM 0 H ASP B 66 192.781 4.179 -3.548 1.00 0.00 H new ATOM 0 HA ASP B 66 194.795 4.764 -2.695 1.00 0.00 H new ATOM 0 HB2 ASP B 66 193.360 4.331 -0.252 1.00 0.00 H new ATOM 0 HB3 ASP B 66 194.920 3.554 -0.064 1.00 0.00 H new ATOM 2814 N ASP B 67 194.610 1.518 -2.635 1.00 0.00 N ATOM 2815 CA ASP B 67 195.424 0.261 -2.907 1.00 0.00 C ATOM 2816 C ASP B 67 196.652 0.652 -3.700 1.00 0.00 C ATOM 2817 O ASP B 67 197.753 0.493 -3.251 1.00 0.00 O ATOM 2818 CB ASP B 67 194.580 -0.802 -3.668 1.00 0.00 C ATOM 2819 CG ASP B 67 195.363 -1.401 -4.828 1.00 0.00 C ATOM 2820 OD1 ASP B 67 196.226 -2.212 -4.595 1.00 0.00 O ATOM 2821 OD2 ASP B 67 195.086 -1.041 -5.949 1.00 0.00 O ATOM 0 H ASP B 67 193.598 1.393 -2.673 1.00 0.00 H new ATOM 0 HA ASP B 67 195.725 -0.193 -1.963 1.00 0.00 H new ATOM 0 HB2 ASP B 67 194.282 -1.593 -2.980 1.00 0.00 H new ATOM 0 HB3 ASP B 67 193.665 -0.343 -4.042 1.00 0.00 H new ATOM 2826 N ALA B 68 196.483 1.085 -4.899 1.00 0.00 N ATOM 2827 CA ALA B 68 197.658 1.475 -5.748 1.00 0.00 C ATOM 2828 C ALA B 68 198.668 2.287 -4.928 1.00 0.00 C ATOM 2829 O ALA B 68 199.867 2.169 -5.129 1.00 0.00 O ATOM 2830 CB ALA B 68 197.182 2.304 -6.933 1.00 0.00 C ATOM 0 H ALA B 68 195.574 1.193 -5.350 1.00 0.00 H new ATOM 0 HA ALA B 68 198.145 0.568 -6.107 1.00 0.00 H new ATOM 0 HB1 ALA B 68 198.037 2.585 -7.547 1.00 0.00 H new ATOM 0 HB2 ALA B 68 196.484 1.718 -7.530 1.00 0.00 H new ATOM 0 HB3 ALA B 68 196.684 3.203 -6.571 1.00 0.00 H new ATOM 2836 N ARG B 69 198.219 3.047 -3.964 1.00 0.00 N ATOM 2837 CA ARG B 69 199.183 3.770 -3.110 1.00 0.00 C ATOM 2838 C ARG B 69 199.905 2.717 -2.295 1.00 0.00 C ATOM 2839 O ARG B 69 201.124 2.679 -2.248 1.00 0.00 O ATOM 2840 CB ARG B 69 198.451 4.765 -2.180 1.00 0.00 C ATOM 2841 CG ARG B 69 199.450 5.519 -1.283 1.00 0.00 C ATOM 2842 CD ARG B 69 199.803 6.898 -1.864 1.00 0.00 C ATOM 2843 NE ARG B 69 200.031 7.856 -0.734 1.00 0.00 N ATOM 2844 CZ ARG B 69 201.064 7.714 0.080 1.00 0.00 C ATOM 2845 NH1 ARG B 69 201.976 6.806 -0.170 1.00 0.00 N ATOM 2846 NH2 ARG B 69 201.188 8.496 1.114 1.00 0.00 N ATOM 0 H ARG B 69 197.235 3.192 -3.739 1.00 0.00 H new ATOM 0 HA ARG B 69 199.881 4.351 -3.713 1.00 0.00 H new ATOM 0 HB2 ARG B 69 197.884 5.478 -2.779 1.00 0.00 H new ATOM 0 HB3 ARG B 69 197.733 4.228 -1.560 1.00 0.00 H new ATOM 0 HG2 ARG B 69 199.025 5.641 -0.287 1.00 0.00 H new ATOM 0 HG3 ARG B 69 200.358 4.927 -1.172 1.00 0.00 H new ATOM 0 HD2 ARG B 69 200.696 6.828 -2.485 1.00 0.00 H new ATOM 0 HD3 ARG B 69 198.996 7.255 -2.504 1.00 0.00 H new ATOM 0 HE ARG B 69 199.380 8.628 -0.591 1.00 0.00 H new ATOM 0 HH11 ARG B 69 201.889 6.209 -0.992 1.00 0.00 H new ATOM 0 HH12 ARG B 69 202.772 6.697 0.458 1.00 0.00 H new ATOM 0 HH21 ARG B 69 200.489 9.217 1.295 1.00 0.00 H new ATOM 0 HH22 ARG B 69 201.984 8.388 1.743 1.00 0.00 H new ATOM 2860 N VAL B 70 199.157 1.813 -1.739 1.00 0.00 N ATOM 2861 CA VAL B 70 199.738 0.678 -0.977 1.00 0.00 C ATOM 2862 C VAL B 70 200.728 -0.043 -1.887 1.00 0.00 C ATOM 2863 O VAL B 70 201.890 -0.225 -1.564 1.00 0.00 O ATOM 2864 CB VAL B 70 198.605 -0.326 -0.592 1.00 0.00 C ATOM 2865 CG1 VAL B 70 199.144 -1.425 0.317 1.00 0.00 C ATOM 2866 CG2 VAL B 70 197.450 0.389 0.128 1.00 0.00 C ATOM 0 H VAL B 70 198.138 1.813 -1.782 1.00 0.00 H new ATOM 0 HA VAL B 70 200.227 1.045 -0.075 1.00 0.00 H new ATOM 0 HB VAL B 70 198.234 -0.764 -1.518 1.00 0.00 H new ATOM 0 HG11 VAL B 70 198.338 -2.113 0.573 1.00 0.00 H new ATOM 0 HG12 VAL B 70 199.935 -1.969 -0.199 1.00 0.00 H new ATOM 0 HG13 VAL B 70 199.544 -0.980 1.228 1.00 0.00 H new ATOM 0 HG21 VAL B 70 196.677 -0.335 0.383 1.00 0.00 H new ATOM 0 HG22 VAL B 70 197.823 0.858 1.039 1.00 0.00 H new ATOM 0 HG23 VAL B 70 197.030 1.152 -0.527 1.00 0.00 H new ATOM 2876 N ARG B 71 200.254 -0.478 -3.005 1.00 0.00 N ATOM 2877 CA ARG B 71 201.090 -1.253 -3.945 1.00 0.00 C ATOM 2878 C ARG B 71 202.310 -0.457 -4.330 1.00 0.00 C ATOM 2879 O ARG B 71 203.413 -0.975 -4.320 1.00 0.00 O ATOM 2880 CB ARG B 71 200.278 -1.616 -5.191 1.00 0.00 C ATOM 2881 CG ARG B 71 200.139 -3.143 -5.293 1.00 0.00 C ATOM 2882 CD ARG B 71 199.117 -3.517 -6.380 1.00 0.00 C ATOM 2883 NE ARG B 71 198.001 -2.500 -6.431 1.00 0.00 N ATOM 2884 CZ ARG B 71 197.999 -1.560 -7.345 1.00 0.00 C ATOM 2885 NH1 ARG B 71 199.080 -1.331 -8.035 1.00 0.00 N ATOM 2886 NH2 ARG B 71 196.952 -0.805 -7.499 1.00 0.00 N ATOM 0 H ARG B 71 199.295 -0.326 -3.317 1.00 0.00 H new ATOM 0 HA ARG B 71 201.413 -2.172 -3.457 1.00 0.00 H new ATOM 0 HB2 ARG B 71 199.292 -1.154 -5.141 1.00 0.00 H new ATOM 0 HB3 ARG B 71 200.768 -1.226 -6.083 1.00 0.00 H new ATOM 0 HG2 ARG B 71 201.106 -3.588 -5.526 1.00 0.00 H new ATOM 0 HG3 ARG B 71 199.824 -3.551 -4.333 1.00 0.00 H new ATOM 0 HD2 ARG B 71 199.612 -3.571 -7.350 1.00 0.00 H new ATOM 0 HD3 ARG B 71 198.706 -4.506 -6.176 1.00 0.00 H new ATOM 0 HE ARG B 71 197.244 -2.545 -5.749 1.00 0.00 H new ATOM 0 HH11 ARG B 71 199.921 -1.882 -7.863 1.00 0.00 H new ATOM 0 HH12 ARG B 71 199.085 -0.601 -8.748 1.00 0.00 H new ATOM 0 HH21 ARG B 71 196.132 -0.944 -6.909 1.00 0.00 H new ATOM 0 HH22 ARG B 71 196.951 -0.074 -8.210 1.00 0.00 H new ATOM 2900 N GLU B 72 202.157 0.795 -4.630 1.00 0.00 N ATOM 2901 CA GLU B 72 203.357 1.587 -4.983 1.00 0.00 C ATOM 2902 C GLU B 72 204.320 1.539 -3.809 1.00 0.00 C ATOM 2903 O GLU B 72 205.523 1.400 -3.987 1.00 0.00 O ATOM 2904 CB GLU B 72 202.978 3.039 -5.326 1.00 0.00 C ATOM 2905 CG GLU B 72 202.997 3.224 -6.853 1.00 0.00 C ATOM 2906 CD GLU B 72 202.062 4.337 -7.237 1.00 0.00 C ATOM 2907 OE1 GLU B 72 202.442 5.482 -7.107 1.00 0.00 O ATOM 2908 OE2 GLU B 72 200.970 4.048 -7.638 1.00 0.00 O ATOM 0 H GLU B 72 201.270 1.298 -4.647 1.00 0.00 H new ATOM 0 HA GLU B 72 203.832 1.164 -5.868 1.00 0.00 H new ATOM 0 HB2 GLU B 72 201.988 3.271 -4.933 1.00 0.00 H new ATOM 0 HB3 GLU B 72 203.678 3.730 -4.856 1.00 0.00 H new ATOM 0 HG2 GLU B 72 204.008 3.453 -7.189 1.00 0.00 H new ATOM 0 HG3 GLU B 72 202.699 2.298 -7.345 1.00 0.00 H new ATOM 2915 N LEU B 73 203.809 1.606 -2.613 1.00 0.00 N ATOM 2916 CA LEU B 73 204.687 1.523 -1.433 1.00 0.00 C ATOM 2917 C LEU B 73 205.271 0.128 -1.323 1.00 0.00 C ATOM 2918 O LEU B 73 206.431 -0.023 -1.037 1.00 0.00 O ATOM 2919 CB LEU B 73 203.938 1.887 -0.170 1.00 0.00 C ATOM 2920 CG LEU B 73 203.373 3.295 -0.311 1.00 0.00 C ATOM 2921 CD1 LEU B 73 202.309 3.515 0.729 1.00 0.00 C ATOM 2922 CD2 LEU B 73 204.478 4.339 -0.138 1.00 0.00 C ATOM 0 H LEU B 73 202.816 1.715 -2.409 1.00 0.00 H new ATOM 0 HA LEU B 73 205.499 2.240 -1.555 1.00 0.00 H new ATOM 0 HB2 LEU B 73 203.132 1.175 0.007 1.00 0.00 H new ATOM 0 HB3 LEU B 73 204.605 1.834 0.691 1.00 0.00 H new ATOM 0 HG LEU B 73 202.945 3.401 -1.308 1.00 0.00 H new ATOM 0 HD11 LEU B 73 201.905 4.522 0.628 1.00 0.00 H new ATOM 0 HD12 LEU B 73 201.509 2.787 0.591 1.00 0.00 H new ATOM 0 HD13 LEU B 73 202.741 3.395 1.723 1.00 0.00 H new ATOM 0 HD21 LEU B 73 204.054 5.338 -0.242 1.00 0.00 H new ATOM 0 HD22 LEU B 73 204.925 4.236 0.851 1.00 0.00 H new ATOM 0 HD23 LEU B 73 205.243 4.188 -0.899 1.00 0.00 H new ATOM 2934 N GLU B 74 204.503 -0.899 -1.568 1.00 0.00 N ATOM 2935 CA GLU B 74 205.072 -2.271 -1.504 1.00 0.00 C ATOM 2936 C GLU B 74 206.170 -2.392 -2.566 1.00 0.00 C ATOM 2937 O GLU B 74 207.262 -2.905 -2.306 1.00 0.00 O ATOM 2938 CB GLU B 74 203.963 -3.286 -1.784 1.00 0.00 C ATOM 2939 CG GLU B 74 202.790 -3.054 -0.816 1.00 0.00 C ATOM 2940 CD GLU B 74 202.549 -4.298 -0.006 1.00 0.00 C ATOM 2941 OE1 GLU B 74 201.865 -5.161 -0.482 1.00 0.00 O ATOM 2942 OE2 GLU B 74 203.041 -4.387 1.086 1.00 0.00 O ATOM 0 H GLU B 74 203.513 -0.846 -1.808 1.00 0.00 H new ATOM 0 HA GLU B 74 205.492 -2.464 -0.517 1.00 0.00 H new ATOM 0 HB2 GLU B 74 203.621 -3.190 -2.814 1.00 0.00 H new ATOM 0 HB3 GLU B 74 204.347 -4.300 -1.669 1.00 0.00 H new ATOM 0 HG2 GLU B 74 203.011 -2.215 -0.156 1.00 0.00 H new ATOM 0 HG3 GLU B 74 201.891 -2.792 -1.374 1.00 0.00 H new ATOM 2949 N LEU B 75 205.903 -1.910 -3.745 1.00 0.00 N ATOM 2950 CA LEU B 75 206.901 -1.958 -4.840 1.00 0.00 C ATOM 2951 C LEU B 75 208.096 -1.081 -4.442 1.00 0.00 C ATOM 2952 O LEU B 75 209.256 -1.457 -4.624 1.00 0.00 O ATOM 2953 CB LEU B 75 206.245 -1.434 -6.128 1.00 0.00 C ATOM 2954 CG LEU B 75 204.981 -2.280 -6.454 1.00 0.00 C ATOM 2955 CD1 LEU B 75 203.943 -1.452 -7.221 1.00 0.00 C ATOM 2956 CD2 LEU B 75 205.367 -3.483 -7.301 1.00 0.00 C ATOM 0 H LEU B 75 205.015 -1.476 -3.998 1.00 0.00 H new ATOM 0 HA LEU B 75 207.248 -2.977 -5.013 1.00 0.00 H new ATOM 0 HB2 LEU B 75 205.972 -0.386 -6.008 1.00 0.00 H new ATOM 0 HB3 LEU B 75 206.953 -1.486 -6.955 1.00 0.00 H new ATOM 0 HG LEU B 75 204.547 -2.607 -5.509 1.00 0.00 H new ATOM 0 HD11 LEU B 75 203.071 -2.070 -7.435 1.00 0.00 H new ATOM 0 HD12 LEU B 75 203.642 -0.596 -6.617 1.00 0.00 H new ATOM 0 HD13 LEU B 75 204.377 -1.101 -8.157 1.00 0.00 H new ATOM 0 HD21 LEU B 75 204.477 -4.071 -7.525 1.00 0.00 H new ATOM 0 HD22 LEU B 75 205.821 -3.142 -8.232 1.00 0.00 H new ATOM 0 HD23 LEU B 75 206.080 -4.099 -6.754 1.00 0.00 H new ATOM 2968 N GLU B 76 207.829 0.043 -3.840 1.00 0.00 N ATOM 2969 CA GLU B 76 208.913 0.918 -3.352 1.00 0.00 C ATOM 2970 C GLU B 76 209.709 0.143 -2.308 1.00 0.00 C ATOM 2971 O GLU B 76 210.919 0.091 -2.347 1.00 0.00 O ATOM 2972 CB GLU B 76 208.298 2.177 -2.703 1.00 0.00 C ATOM 2973 CG GLU B 76 209.332 3.321 -2.655 1.00 0.00 C ATOM 2974 CD GLU B 76 209.596 3.855 -4.048 1.00 0.00 C ATOM 2975 OE1 GLU B 76 208.680 3.893 -4.826 1.00 0.00 O ATOM 2976 OE2 GLU B 76 210.703 4.241 -4.306 1.00 0.00 O ATOM 0 H GLU B 76 206.887 0.392 -3.666 1.00 0.00 H new ATOM 0 HA GLU B 76 209.561 1.221 -4.174 1.00 0.00 H new ATOM 0 HB2 GLU B 76 207.422 2.494 -3.269 1.00 0.00 H new ATOM 0 HB3 GLU B 76 207.958 1.944 -1.694 1.00 0.00 H new ATOM 0 HG2 GLU B 76 208.966 4.124 -2.015 1.00 0.00 H new ATOM 0 HG3 GLU B 76 210.262 2.961 -2.215 1.00 0.00 H new ATOM 2983 N LEU B 77 209.034 -0.467 -1.383 1.00 0.00 N ATOM 2984 CA LEU B 77 209.725 -1.248 -0.331 1.00 0.00 C ATOM 2985 C LEU B 77 210.572 -2.299 -0.994 1.00 0.00 C ATOM 2986 O LEU B 77 211.701 -2.491 -0.639 1.00 0.00 O ATOM 2987 CB LEU B 77 208.701 -1.902 0.599 1.00 0.00 C ATOM 2988 CG LEU B 77 208.167 -0.844 1.576 1.00 0.00 C ATOM 2989 CD1 LEU B 77 206.832 -1.291 2.147 1.00 0.00 C ATOM 2990 CD2 LEU B 77 209.163 -0.640 2.720 1.00 0.00 C ATOM 0 H LEU B 77 208.017 -0.457 -1.311 1.00 0.00 H new ATOM 0 HA LEU B 77 210.355 -0.589 0.267 1.00 0.00 H new ATOM 0 HB2 LEU B 77 207.882 -2.326 0.018 1.00 0.00 H new ATOM 0 HB3 LEU B 77 209.161 -2.723 1.148 1.00 0.00 H new ATOM 0 HG LEU B 77 208.035 0.095 1.038 1.00 0.00 H new ATOM 0 HD11 LEU B 77 206.461 -0.535 2.839 1.00 0.00 H new ATOM 0 HD12 LEU B 77 206.116 -1.424 1.336 1.00 0.00 H new ATOM 0 HD13 LEU B 77 206.960 -2.235 2.676 1.00 0.00 H new ATOM 0 HD21 LEU B 77 208.777 0.112 3.409 1.00 0.00 H new ATOM 0 HD22 LEU B 77 209.304 -1.581 3.252 1.00 0.00 H new ATOM 0 HD23 LEU B 77 210.118 -0.305 2.315 1.00 0.00 H new ATOM 3002 N ASP B 78 210.056 -2.950 -1.997 1.00 0.00 N ATOM 3003 CA ASP B 78 210.872 -3.944 -2.732 1.00 0.00 C ATOM 3004 C ASP B 78 212.073 -3.230 -3.291 1.00 0.00 C ATOM 3005 O ASP B 78 213.201 -3.698 -3.199 1.00 0.00 O ATOM 3006 CB ASP B 78 210.057 -4.530 -3.895 1.00 0.00 C ATOM 3007 CG ASP B 78 209.284 -5.757 -3.471 1.00 0.00 C ATOM 3008 OD1 ASP B 78 209.460 -6.211 -2.372 1.00 0.00 O ATOM 3009 OD2 ASP B 78 208.504 -6.227 -4.252 1.00 0.00 O ATOM 0 H ASP B 78 209.102 -2.834 -2.338 1.00 0.00 H new ATOM 0 HA ASP B 78 211.171 -4.751 -2.064 1.00 0.00 H new ATOM 0 HB2 ASP B 78 209.366 -3.776 -4.272 1.00 0.00 H new ATOM 0 HB3 ASP B 78 210.727 -4.787 -4.716 1.00 0.00 H new ATOM 3014 N ARG B 79 211.846 -2.105 -3.872 1.00 0.00 N ATOM 3015 CA ARG B 79 212.936 -1.331 -4.465 1.00 0.00 C ATOM 3016 C ARG B 79 213.970 -1.026 -3.373 1.00 0.00 C ATOM 3017 O ARG B 79 215.162 -1.240 -3.548 1.00 0.00 O ATOM 3018 CB ARG B 79 212.346 -0.045 -5.022 1.00 0.00 C ATOM 3019 CG ARG B 79 213.137 0.430 -6.241 1.00 0.00 C ATOM 3020 CD ARG B 79 212.980 1.952 -6.408 1.00 0.00 C ATOM 3021 NE ARG B 79 214.295 2.535 -6.832 1.00 0.00 N ATOM 3022 CZ ARG B 79 215.333 2.490 -6.025 1.00 0.00 C ATOM 3023 NH1 ARG B 79 215.165 2.122 -4.799 1.00 0.00 N ATOM 3024 NH2 ARG B 79 216.502 2.860 -6.441 1.00 0.00 N ATOM 0 H ARG B 79 210.923 -1.680 -3.962 1.00 0.00 H new ATOM 0 HA ARG B 79 213.427 -1.882 -5.267 1.00 0.00 H new ATOM 0 HB2 ARG B 79 211.304 -0.207 -5.299 1.00 0.00 H new ATOM 0 HB3 ARG B 79 212.355 0.728 -4.253 1.00 0.00 H new ATOM 0 HG2 ARG B 79 214.190 0.175 -6.124 1.00 0.00 H new ATOM 0 HG3 ARG B 79 212.783 -0.081 -7.136 1.00 0.00 H new ATOM 0 HD2 ARG B 79 212.214 2.172 -7.151 1.00 0.00 H new ATOM 0 HD3 ARG B 79 212.654 2.402 -5.470 1.00 0.00 H new ATOM 0 HE ARG B 79 214.385 2.969 -7.751 1.00 0.00 H new ATOM 0 HH11 ARG B 79 214.235 1.870 -4.465 1.00 0.00 H new ATOM 0 HH12 ARG B 79 215.963 2.083 -4.164 1.00 0.00 H new ATOM 0 HH21 ARG B 79 216.622 3.189 -7.399 1.00 0.00 H new ATOM 0 HH22 ARG B 79 217.303 2.823 -5.811 1.00 0.00 H new ATOM 3038 N LEU B 80 213.527 -0.558 -2.244 1.00 0.00 N ATOM 3039 CA LEU B 80 214.466 -0.265 -1.136 1.00 0.00 C ATOM 3040 C LEU B 80 215.118 -1.560 -0.686 1.00 0.00 C ATOM 3041 O LEU B 80 216.289 -1.594 -0.431 1.00 0.00 O ATOM 3042 CB LEU B 80 213.726 0.382 0.039 1.00 0.00 C ATOM 3043 CG LEU B 80 213.652 1.911 -0.141 1.00 0.00 C ATOM 3044 CD1 LEU B 80 213.121 2.556 1.139 1.00 0.00 C ATOM 3045 CD2 LEU B 80 215.044 2.486 -0.443 1.00 0.00 C ATOM 0 H LEU B 80 212.546 -0.365 -2.041 1.00 0.00 H new ATOM 0 HA LEU B 80 215.228 0.432 -1.486 1.00 0.00 H new ATOM 0 HB2 LEU B 80 212.720 -0.030 0.113 1.00 0.00 H new ATOM 0 HB3 LEU B 80 214.237 0.145 0.972 1.00 0.00 H new ATOM 0 HG LEU B 80 212.984 2.126 -0.975 1.00 0.00 H new ATOM 0 HD11 LEU B 80 213.070 3.637 1.008 1.00 0.00 H new ATOM 0 HD12 LEU B 80 212.125 2.169 1.355 1.00 0.00 H new ATOM 0 HD13 LEU B 80 213.789 2.322 1.968 1.00 0.00 H new ATOM 0 HD21 LEU B 80 214.972 3.567 -0.567 1.00 0.00 H new ATOM 0 HD22 LEU B 80 215.718 2.260 0.383 1.00 0.00 H new ATOM 0 HD23 LEU B 80 215.431 2.041 -1.360 1.00 0.00 H new ATOM 3057 N ARG B 81 214.369 -2.606 -0.532 1.00 0.00 N ATOM 3058 CA ARG B 81 214.963 -3.896 -0.091 1.00 0.00 C ATOM 3059 C ARG B 81 216.009 -4.313 -1.106 1.00 0.00 C ATOM 3060 O ARG B 81 217.086 -4.761 -0.751 1.00 0.00 O ATOM 3061 CB ARG B 81 213.856 -4.959 0.037 1.00 0.00 C ATOM 3062 CG ARG B 81 213.230 -4.851 1.449 1.00 0.00 C ATOM 3063 CD ARG B 81 211.682 -4.868 1.404 1.00 0.00 C ATOM 3064 NE ARG B 81 211.169 -5.637 0.221 1.00 0.00 N ATOM 3065 CZ ARG B 81 211.250 -6.949 0.168 1.00 0.00 C ATOM 3066 NH1 ARG B 81 211.863 -7.609 1.115 1.00 0.00 N ATOM 3067 NH2 ARG B 81 210.720 -7.578 -0.838 1.00 0.00 N ATOM 0 H ARG B 81 213.362 -2.627 -0.693 1.00 0.00 H new ATOM 0 HA ARG B 81 215.436 -3.788 0.885 1.00 0.00 H new ATOM 0 HB2 ARG B 81 213.094 -4.806 -0.727 1.00 0.00 H new ATOM 0 HB3 ARG B 81 214.269 -5.956 -0.119 1.00 0.00 H new ATOM 0 HG2 ARG B 81 213.583 -5.678 2.066 1.00 0.00 H new ATOM 0 HG3 ARG B 81 213.568 -3.931 1.925 1.00 0.00 H new ATOM 0 HD2 ARG B 81 211.296 -5.312 2.322 1.00 0.00 H new ATOM 0 HD3 ARG B 81 211.308 -3.845 1.363 1.00 0.00 H new ATOM 0 HE ARG B 81 210.749 -5.131 -0.559 1.00 0.00 H new ATOM 0 HH11 ARG B 81 212.281 -7.107 1.899 1.00 0.00 H new ATOM 0 HH12 ARG B 81 211.924 -8.626 1.071 1.00 0.00 H new ATOM 0 HH21 ARG B 81 210.248 -7.055 -1.575 1.00 0.00 H new ATOM 0 HH22 ARG B 81 210.776 -8.595 -0.890 1.00 0.00 H new ATOM 3081 N ALA B 82 215.743 -4.084 -2.364 1.00 0.00 N ATOM 3082 CA ALA B 82 216.756 -4.391 -3.407 1.00 0.00 C ATOM 3083 C ALA B 82 218.028 -3.607 -3.088 1.00 0.00 C ATOM 3084 O ALA B 82 219.131 -4.141 -3.124 1.00 0.00 O ATOM 3085 CB ALA B 82 216.232 -3.984 -4.796 1.00 0.00 C ATOM 0 H ALA B 82 214.866 -3.697 -2.712 1.00 0.00 H new ATOM 0 HA ALA B 82 216.962 -5.461 -3.416 1.00 0.00 H new ATOM 0 HB1 ALA B 82 216.984 -4.214 -5.550 1.00 0.00 H new ATOM 0 HB2 ALA B 82 215.317 -4.535 -5.015 1.00 0.00 H new ATOM 0 HB3 ALA B 82 216.023 -2.914 -4.807 1.00 0.00 H new ATOM 3091 N GLU B 83 217.889 -2.348 -2.770 1.00 0.00 N ATOM 3092 CA GLU B 83 219.091 -1.524 -2.441 1.00 0.00 C ATOM 3093 C GLU B 83 219.686 -2.030 -1.129 1.00 0.00 C ATOM 3094 O GLU B 83 220.851 -2.288 -1.039 1.00 0.00 O ATOM 3095 CB GLU B 83 218.697 -0.035 -2.300 1.00 0.00 C ATOM 3096 CG GLU B 83 219.130 0.760 -3.573 1.00 0.00 C ATOM 3097 CD GLU B 83 218.103 1.821 -3.946 1.00 0.00 C ATOM 3098 OE1 GLU B 83 217.058 1.854 -3.352 1.00 0.00 O ATOM 3099 OE2 GLU B 83 218.367 2.581 -4.841 1.00 0.00 O ATOM 0 H GLU B 83 216.998 -1.854 -2.723 1.00 0.00 H new ATOM 0 HA GLU B 83 219.825 -1.611 -3.242 1.00 0.00 H new ATOM 0 HB2 GLU B 83 217.620 0.052 -2.157 1.00 0.00 H new ATOM 0 HB3 GLU B 83 219.171 0.392 -1.417 1.00 0.00 H new ATOM 0 HG2 GLU B 83 220.096 1.233 -3.396 1.00 0.00 H new ATOM 0 HG3 GLU B 83 219.261 0.070 -4.407 1.00 0.00 H new ATOM 3106 N ASN B 84 218.872 -2.191 -0.131 1.00 0.00 N ATOM 3107 CA ASN B 84 219.336 -2.688 1.194 1.00 0.00 C ATOM 3108 C ASN B 84 220.144 -3.935 0.996 1.00 0.00 C ATOM 3109 O ASN B 84 221.237 -4.048 1.486 1.00 0.00 O ATOM 3110 CB ASN B 84 218.129 -3.042 2.049 1.00 0.00 C ATOM 3111 CG ASN B 84 217.573 -1.796 2.710 1.00 0.00 C ATOM 3112 OD1 ASN B 84 218.003 -1.418 3.780 1.00 0.00 O ATOM 3113 ND2 ASN B 84 216.650 -1.120 2.119 1.00 0.00 N ATOM 0 H ASN B 84 217.872 -1.993 -0.177 1.00 0.00 H new ATOM 0 HA ASN B 84 219.934 -1.916 1.679 1.00 0.00 H new ATOM 0 HB2 ASN B 84 217.361 -3.509 1.432 1.00 0.00 H new ATOM 0 HB3 ASN B 84 218.413 -3.770 2.809 1.00 0.00 H new ATOM 0 HD21 ASN B 84 216.284 -0.271 2.550 1.00 0.00 H new ATOM 0 HD22 ASN B 84 216.285 -1.433 1.220 1.00 0.00 H new ATOM 3120 N LEU B 85 219.623 -4.874 0.261 1.00 0.00 N ATOM 3121 CA LEU B 85 220.391 -6.126 0.011 1.00 0.00 C ATOM 3122 C LEU B 85 221.740 -5.739 -0.586 1.00 0.00 C ATOM 3123 O LEU B 85 222.788 -6.116 -0.092 1.00 0.00 O ATOM 3124 CB LEU B 85 219.594 -7.043 -0.965 1.00 0.00 C ATOM 3125 CG LEU B 85 220.541 -7.907 -1.850 1.00 0.00 C ATOM 3126 CD1 LEU B 85 221.457 -8.789 -0.988 1.00 0.00 C ATOM 3127 CD2 LEU B 85 219.712 -8.805 -2.770 1.00 0.00 C ATOM 0 H LEU B 85 218.703 -4.831 -0.177 1.00 0.00 H new ATOM 0 HA LEU B 85 220.546 -6.678 0.938 1.00 0.00 H new ATOM 0 HB2 LEU B 85 218.935 -7.696 -0.393 1.00 0.00 H new ATOM 0 HB3 LEU B 85 218.959 -6.429 -1.604 1.00 0.00 H new ATOM 0 HG LEU B 85 221.159 -7.230 -2.439 1.00 0.00 H new ATOM 0 HD11 LEU B 85 222.106 -9.380 -1.634 1.00 0.00 H new ATOM 0 HD12 LEU B 85 222.066 -8.158 -0.341 1.00 0.00 H new ATOM 0 HD13 LEU B 85 220.849 -9.456 -0.376 1.00 0.00 H new ATOM 0 HD21 LEU B 85 220.378 -9.408 -3.387 1.00 0.00 H new ATOM 0 HD22 LEU B 85 219.083 -9.461 -2.168 1.00 0.00 H new ATOM 0 HD23 LEU B 85 219.083 -8.187 -3.411 1.00 0.00 H new ATOM 3139 N GLN B 86 221.722 -4.983 -1.638 1.00 0.00 N ATOM 3140 CA GLN B 86 222.994 -4.571 -2.293 1.00 0.00 C ATOM 3141 C GLN B 86 223.907 -3.902 -1.270 1.00 0.00 C ATOM 3142 O GLN B 86 225.086 -4.194 -1.183 1.00 0.00 O ATOM 3143 CB GLN B 86 222.682 -3.582 -3.430 1.00 0.00 C ATOM 3144 CG GLN B 86 223.961 -3.227 -4.200 1.00 0.00 C ATOM 3145 CD GLN B 86 224.573 -4.493 -4.776 1.00 0.00 C ATOM 3146 OE1 GLN B 86 224.219 -4.917 -5.861 1.00 0.00 O ATOM 3147 NE2 GLN B 86 225.449 -5.135 -4.091 1.00 0.00 N ATOM 0 H GLN B 86 220.875 -4.627 -2.080 1.00 0.00 H new ATOM 0 HA GLN B 86 223.495 -5.450 -2.699 1.00 0.00 H new ATOM 0 HB2 GLN B 86 221.951 -4.019 -4.110 1.00 0.00 H new ATOM 0 HB3 GLN B 86 222.234 -2.677 -3.020 1.00 0.00 H new ATOM 0 HG2 GLN B 86 223.733 -2.524 -5.001 1.00 0.00 H new ATOM 0 HG3 GLN B 86 224.673 -2.735 -3.537 1.00 0.00 H new ATOM 0 HE21 GLN B 86 225.746 -4.780 -3.182 1.00 0.00 H new ATOM 0 HE22 GLN B 86 225.848 -6.000 -4.456 1.00 0.00 H new ATOM 3156 N LEU B 87 223.392 -2.970 -0.561 1.00 0.00 N ATOM 3157 CA LEU B 87 224.207 -2.205 0.400 1.00 0.00 C ATOM 3158 C LEU B 87 224.706 -3.119 1.499 1.00 0.00 C ATOM 3159 O LEU B 87 225.873 -3.138 1.799 1.00 0.00 O ATOM 3160 CB LEU B 87 223.368 -1.087 0.997 1.00 0.00 C ATOM 3161 CG LEU B 87 222.895 -0.145 -0.118 1.00 0.00 C ATOM 3162 CD1 LEU B 87 221.691 0.668 0.359 1.00 0.00 C ATOM 3163 CD2 LEU B 87 224.035 0.803 -0.492 1.00 0.00 C ATOM 0 H LEU B 87 222.411 -2.692 -0.603 1.00 0.00 H new ATOM 0 HA LEU B 87 225.066 -1.776 -0.117 1.00 0.00 H new ATOM 0 HB2 LEU B 87 222.509 -1.504 1.523 1.00 0.00 H new ATOM 0 HB3 LEU B 87 223.953 -0.533 1.731 1.00 0.00 H new ATOM 0 HG LEU B 87 222.603 -0.734 -0.988 1.00 0.00 H new ATOM 0 HD11 LEU B 87 221.362 1.334 -0.439 1.00 0.00 H new ATOM 0 HD12 LEU B 87 220.878 -0.008 0.626 1.00 0.00 H new ATOM 0 HD13 LEU B 87 221.973 1.258 1.231 1.00 0.00 H new ATOM 0 HD21 LEU B 87 223.704 1.475 -1.284 1.00 0.00 H new ATOM 0 HD22 LEU B 87 224.324 1.387 0.382 1.00 0.00 H new ATOM 0 HD23 LEU B 87 224.890 0.224 -0.841 1.00 0.00 H new