USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=29 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 49 MET CE :methyl 160:sc= -4.63! (180deg=-5.05!) USER MOD Set 1.2: A 53 ASN :FLIP amide:sc= -8.66! C(o=-26!,f=-24!) USER MOD Set 1.3: B 49 MET CE :methyl 165:sc= -5.53! (180deg=-5.76!) USER MOD Set 1.4: B 53 ASN : amide:sc= -5.04! C(o=-24!,f=-26!) USER MOD Single : A 23 HIS : no HD1:sc=-0.00854 X(o=-0.0085,f=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0537 USER MOD Single : A 26 SER OG : rot 23:sc= 0.529 USER MOD Single : A 28 GLN :FLIP amide:sc= -9.42! C(o=-15!,f=-9.4!) USER MOD Single : A 29 ASN : amide:sc= -0.0477 K(o=-0.048,f=-1.1) USER MOD Single : A 30 MET CE :methyl -173:sc= -3.19 (180deg=-3.44) USER MOD Single : A 31 SER OG : rot 180:sc= 0.021 USER MOD Single : A 32 LYS NZ :NH3+ 141:sc= 0.667 (180deg=-0.0225) USER MOD Single : A 33 GLN : amide:sc= 0.289 K(o=0.29,f=-9.7!) USER MOD Single : A 37 LYS NZ :NH3+ -164:sc= -0.209 (180deg=-0.92) USER MOD Single : A 39 TYR OH : rot 134:sc= -2.43! USER MOD Single : A 44 LYS NZ :NH3+ 171:sc= -0.61 (180deg=-0.791) USER MOD Single : A 45 CYS SG : rot 65:sc= 0.991 USER MOD Single : A 47 SER OG : rot 89:sc= 0.672 USER MOD Single : A 54 ASN : amide:sc= -0.0901 K(o=-0.09,f=-2!) USER MOD Single : A 60 SER OG : rot -90:sc= 0.772 USER MOD Single : A 61 LYS NZ :NH3+ -120:sc= -0.114 (180deg=-0.792) USER MOD Single : B 23 HIS : no HD1:sc= -0.11 X(o=-0.11,f=0) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0.0204 USER MOD Single : B 26 SER OG : rot 30:sc= 0.591 USER MOD Single : B 28 GLN :FLIP amide:sc= -9.84! C(o=-16!,f=-9.8!) USER MOD Single : B 29 ASN : amide:sc= -1.28! K(o=-1.3!,f=-1.9) USER MOD Single : B 30 MET CE :methyl 179:sc= -3.94! (180deg=-4.05) USER MOD Single : B 31 SER OG : rot 148:sc= 1.24 USER MOD Single : B 32 LYS NZ :NH3+ 135:sc= 0.456 (180deg=-0.537!) USER MOD Single : B 33 GLN : amide:sc= -0.0166 K(o=-0.017,f=-11!) USER MOD Single : B 37 LYS NZ :NH3+ -164:sc= -0.435 (180deg=-1.36!) USER MOD Single : B 39 TYR OH : rot 138:sc= -3.13! USER MOD Single : B 44 LYS NZ :NH3+ -179:sc= -0.603 (180deg=-0.619) USER MOD Single : B 45 CYS SG : rot 53:sc= 0.89 USER MOD Single : B 47 SER OG : rot 92:sc= 0.702 USER MOD Single : B 54 ASN : amide:sc= -0.101 K(o=-0.1,f=-2.3!) USER MOD Single : B 60 SER OG : rot -88:sc= 0.392 USER MOD Single : B 61 LYS NZ :NH3+ 154:sc= -0.397 (180deg=-1.12) USER MOD Single : B 84 ASN : amide:sc= -0.315! X(o=-0.31!,f=-0.71) USER MOD Single : B 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 332 N HIS A 23 146.854 -7.158 -7.686 1.00 0.00 N ATOM 333 CA HIS A 23 147.048 -7.026 -6.202 1.00 0.00 C ATOM 334 C HIS A 23 146.554 -5.648 -5.798 1.00 0.00 C ATOM 335 O HIS A 23 146.116 -5.431 -4.683 1.00 0.00 O ATOM 336 CB HIS A 23 148.542 -7.162 -5.854 1.00 0.00 C ATOM 337 CG HIS A 23 148.704 -7.519 -4.395 1.00 0.00 C ATOM 338 ND1 HIS A 23 149.089 -8.789 -3.982 1.00 0.00 N ATOM 339 CD2 HIS A 23 148.559 -6.778 -3.242 1.00 0.00 C ATOM 340 CE1 HIS A 23 149.168 -8.770 -2.634 1.00 0.00 C ATOM 341 NE2 HIS A 23 148.852 -7.571 -2.131 1.00 0.00 N ATOM 0 HA HIS A 23 146.498 -7.805 -5.674 1.00 0.00 H new ATOM 0 HB2 HIS A 23 149.000 -7.930 -6.477 1.00 0.00 H new ATOM 0 HB3 HIS A 23 149.060 -6.227 -6.067 1.00 0.00 H new ATOM 0 HD2 HIS A 23 148.263 -5.740 -3.204 1.00 0.00 H new ATOM 0 HE1 HIS A 23 149.452 -9.621 -2.033 1.00 0.00 H new ATOM 0 HE2 HIS A 23 148.830 -7.296 -1.149 1.00 0.00 H new ATOM 350 N THR A 24 146.563 -4.734 -6.729 1.00 0.00 N ATOM 351 CA THR A 24 146.022 -3.382 -6.481 1.00 0.00 C ATOM 352 C THR A 24 144.622 -3.528 -5.849 1.00 0.00 C ATOM 353 O THR A 24 144.240 -2.748 -4.991 1.00 0.00 O ATOM 354 CB THR A 24 145.974 -2.642 -7.817 1.00 0.00 C ATOM 355 OG1 THR A 24 147.223 -2.854 -8.487 1.00 0.00 O ATOM 356 CG2 THR A 24 145.781 -1.147 -7.588 1.00 0.00 C ATOM 0 H THR A 24 146.932 -4.878 -7.669 1.00 0.00 H new ATOM 0 HA THR A 24 146.645 -2.810 -5.793 1.00 0.00 H new ATOM 0 HB THR A 24 145.142 -3.015 -8.414 1.00 0.00 H new ATOM 0 HG1 THR A 24 147.215 -2.389 -9.349 1.00 0.00 H new ATOM 0 HG21 THR A 24 145.749 -0.633 -8.549 1.00 0.00 H new ATOM 0 HG22 THR A 24 144.845 -0.978 -7.055 1.00 0.00 H new ATOM 0 HG23 THR A 24 146.611 -0.759 -6.997 1.00 0.00 H new ATOM 364 N GLU A 25 143.945 -4.624 -6.129 1.00 0.00 N ATOM 365 CA GLU A 25 142.684 -4.961 -5.419 1.00 0.00 C ATOM 366 C GLU A 25 142.907 -4.717 -3.931 1.00 0.00 C ATOM 367 O GLU A 25 142.273 -3.880 -3.318 1.00 0.00 O ATOM 368 CB GLU A 25 142.439 -6.490 -5.642 1.00 0.00 C ATOM 369 CG GLU A 25 141.418 -7.058 -4.615 1.00 0.00 C ATOM 370 CD GLU A 25 142.143 -7.603 -3.394 1.00 0.00 C ATOM 371 OE1 GLU A 25 143.215 -8.160 -3.553 1.00 0.00 O ATOM 372 OE2 GLU A 25 141.646 -7.448 -2.327 1.00 0.00 O ATOM 0 H GLU A 25 144.227 -5.305 -6.834 1.00 0.00 H new ATOM 0 HA GLU A 25 141.842 -4.368 -5.776 1.00 0.00 H new ATOM 0 HB2 GLU A 25 142.070 -6.657 -6.654 1.00 0.00 H new ATOM 0 HB3 GLU A 25 143.383 -7.028 -5.554 1.00 0.00 H new ATOM 0 HG2 GLU A 25 140.722 -6.275 -4.313 1.00 0.00 H new ATOM 0 HG3 GLU A 25 140.828 -7.848 -5.078 1.00 0.00 H new ATOM 379 N SER A 26 143.762 -5.484 -3.348 1.00 0.00 N ATOM 380 CA SER A 26 144.036 -5.378 -1.906 1.00 0.00 C ATOM 381 C SER A 26 144.220 -3.918 -1.517 1.00 0.00 C ATOM 382 O SER A 26 143.728 -3.479 -0.503 1.00 0.00 O ATOM 383 CB SER A 26 145.300 -6.171 -1.610 1.00 0.00 C ATOM 384 OG SER A 26 145.087 -7.549 -2.012 1.00 0.00 O ATOM 0 H SER A 26 144.301 -6.205 -3.828 1.00 0.00 H new ATOM 0 HA SER A 26 143.202 -5.777 -1.329 1.00 0.00 H new ATOM 0 HB2 SER A 26 146.148 -5.747 -2.148 1.00 0.00 H new ATOM 0 HB3 SER A 26 145.539 -6.119 -0.548 1.00 0.00 H new ATOM 0 HG SER A 26 144.376 -7.587 -2.685 1.00 0.00 H new ATOM 390 N LEU A 27 144.836 -3.140 -2.358 1.00 0.00 N ATOM 391 CA LEU A 27 144.985 -1.709 -2.045 1.00 0.00 C ATOM 392 C LEU A 27 143.603 -1.064 -2.027 1.00 0.00 C ATOM 393 O LEU A 27 143.302 -0.262 -1.167 1.00 0.00 O ATOM 394 CB LEU A 27 145.869 -1.040 -3.083 1.00 0.00 C ATOM 395 CG LEU A 27 147.332 -1.469 -2.903 1.00 0.00 C ATOM 396 CD1 LEU A 27 148.152 -1.004 -4.106 1.00 0.00 C ATOM 397 CD2 LEU A 27 147.911 -0.843 -1.629 1.00 0.00 C ATOM 0 H LEU A 27 145.240 -3.439 -3.246 1.00 0.00 H new ATOM 0 HA LEU A 27 145.455 -1.589 -1.069 1.00 0.00 H new ATOM 0 HB2 LEU A 27 145.527 -1.304 -4.084 1.00 0.00 H new ATOM 0 HB3 LEU A 27 145.788 0.043 -2.994 1.00 0.00 H new ATOM 0 HG LEU A 27 147.374 -2.555 -2.823 1.00 0.00 H new ATOM 0 HD11 LEU A 27 149.191 -1.309 -3.978 1.00 0.00 H new ATOM 0 HD12 LEU A 27 147.751 -1.453 -5.015 1.00 0.00 H new ATOM 0 HD13 LEU A 27 148.099 0.082 -4.184 1.00 0.00 H new ATOM 0 HD21 LEU A 27 148.949 -1.153 -1.510 1.00 0.00 H new ATOM 0 HD22 LEU A 27 147.863 0.243 -1.703 1.00 0.00 H new ATOM 0 HD23 LEU A 27 147.333 -1.173 -0.766 1.00 0.00 H new ATOM 409 N GLN A 28 142.736 -1.428 -2.937 1.00 0.00 N ATOM 410 CA GLN A 28 141.369 -0.842 -2.890 1.00 0.00 C ATOM 411 C GLN A 28 140.597 -1.505 -1.765 1.00 0.00 C ATOM 412 O GLN A 28 139.722 -0.888 -1.169 1.00 0.00 O ATOM 413 CB GLN A 28 140.559 -0.956 -4.210 1.00 0.00 C ATOM 414 CG GLN A 28 141.394 -1.480 -5.373 1.00 0.00 C ATOM 415 CD GLN A 28 142.295 -0.372 -5.859 1.00 0.00 C ATOM 416 OE1 GLN A 28 143.533 -0.407 -5.577 1.00 0.00 O flip ATOM 417 NE2 GLN A 28 141.851 0.557 -6.499 1.00 0.00 N flip ATOM 0 H GLN A 28 142.911 -2.090 -3.693 1.00 0.00 H new ATOM 0 HA GLN A 28 141.501 0.227 -2.724 1.00 0.00 H new ATOM 0 HB2 GLN A 28 139.708 -1.619 -4.052 1.00 0.00 H new ATOM 0 HB3 GLN A 28 140.157 0.023 -4.470 1.00 0.00 H new ATOM 0 HG2 GLN A 28 141.987 -2.338 -5.056 1.00 0.00 H new ATOM 0 HG3 GLN A 28 140.746 -1.821 -6.180 1.00 0.00 H new ATOM 0 HE21 GLN A 28 140.858 0.590 -6.728 1.00 0.00 H new ATOM 0 HE22 GLN A 28 142.471 1.306 -6.808 1.00 0.00 H new ATOM 426 N ASN A 29 140.898 -2.743 -1.455 1.00 0.00 N ATOM 427 CA ASN A 29 140.147 -3.427 -0.361 1.00 0.00 C ATOM 428 C ASN A 29 140.630 -2.944 0.992 1.00 0.00 C ATOM 429 O ASN A 29 140.031 -3.247 2.006 1.00 0.00 O ATOM 430 CB ASN A 29 140.232 -4.944 -0.459 1.00 0.00 C ATOM 431 CG ASN A 29 139.074 -5.478 -1.279 1.00 0.00 C ATOM 432 OD1 ASN A 29 137.926 -5.137 -1.021 1.00 0.00 O ATOM 433 ND2 ASN A 29 139.299 -6.320 -2.224 1.00 0.00 N ATOM 0 H ASN A 29 141.622 -3.302 -1.907 1.00 0.00 H new ATOM 0 HA ASN A 29 139.095 -3.164 -0.475 1.00 0.00 H new ATOM 0 HB2 ASN A 29 141.177 -5.234 -0.918 1.00 0.00 H new ATOM 0 HB3 ASN A 29 140.214 -5.382 0.539 1.00 0.00 H new ATOM 0 HD21 ASN A 29 138.521 -6.705 -2.760 1.00 0.00 H new ATOM 0 HD22 ASN A 29 140.255 -6.603 -2.438 1.00 0.00 H new ATOM 440 N MET A 30 141.662 -2.158 1.023 1.00 0.00 N ATOM 441 CA MET A 30 142.125 -1.594 2.295 1.00 0.00 C ATOM 442 C MET A 30 141.341 -0.311 2.522 1.00 0.00 C ATOM 443 O MET A 30 140.759 0.227 1.596 1.00 0.00 O ATOM 444 CB MET A 30 143.622 -1.265 2.203 1.00 0.00 C ATOM 445 CG MET A 30 144.452 -2.561 2.284 1.00 0.00 C ATOM 446 SD MET A 30 146.028 -2.337 1.407 1.00 0.00 S ATOM 447 CE MET A 30 146.593 -0.864 2.297 1.00 0.00 C ATOM 0 H MET A 30 142.206 -1.883 0.205 1.00 0.00 H new ATOM 0 HA MET A 30 141.974 -2.300 3.111 1.00 0.00 H new ATOM 0 HB2 MET A 30 143.832 -0.747 1.267 1.00 0.00 H new ATOM 0 HB3 MET A 30 143.905 -0.591 3.011 1.00 0.00 H new ATOM 0 HG2 MET A 30 144.639 -2.820 3.326 1.00 0.00 H new ATOM 0 HG3 MET A 30 143.895 -3.389 1.845 1.00 0.00 H new ATOM 0 HE1 MET A 30 147.499 -0.480 1.827 1.00 0.00 H new ATOM 0 HE2 MET A 30 145.816 -0.100 2.266 1.00 0.00 H new ATOM 0 HE3 MET A 30 146.805 -1.124 3.334 1.00 0.00 H new ATOM 457 N SER A 31 141.263 0.158 3.717 1.00 0.00 N ATOM 458 CA SER A 31 140.444 1.378 3.976 1.00 0.00 C ATOM 459 C SER A 31 141.320 2.622 3.775 1.00 0.00 C ATOM 460 O SER A 31 142.544 2.553 3.797 1.00 0.00 O ATOM 461 CB SER A 31 139.897 1.331 5.417 1.00 0.00 C ATOM 462 OG SER A 31 139.999 -0.019 5.932 1.00 0.00 O ATOM 0 H SER A 31 141.726 -0.241 4.534 1.00 0.00 H new ATOM 0 HA SER A 31 139.603 1.419 3.284 1.00 0.00 H new ATOM 0 HB2 SER A 31 140.458 2.017 6.052 1.00 0.00 H new ATOM 0 HB3 SER A 31 138.858 1.660 5.433 1.00 0.00 H new ATOM 0 HG SER A 31 139.653 -0.047 6.848 1.00 0.00 H new ATOM 468 N LYS A 32 140.708 3.740 3.503 1.00 0.00 N ATOM 469 CA LYS A 32 141.477 4.992 3.218 1.00 0.00 C ATOM 470 C LYS A 32 142.386 5.295 4.406 1.00 0.00 C ATOM 471 O LYS A 32 143.570 5.537 4.244 1.00 0.00 O ATOM 472 CB LYS A 32 140.507 6.165 2.966 1.00 0.00 C ATOM 473 CG LYS A 32 141.213 7.329 2.232 1.00 0.00 C ATOM 474 CD LYS A 32 140.712 7.416 0.792 1.00 0.00 C ATOM 475 CE LYS A 32 140.729 8.873 0.300 1.00 0.00 C ATOM 476 NZ LYS A 32 139.690 9.675 0.985 1.00 0.00 N ATOM 0 H LYS A 32 139.694 3.845 3.465 1.00 0.00 H new ATOM 0 HA LYS A 32 142.085 4.856 2.323 1.00 0.00 H new ATOM 0 HB2 LYS A 32 139.660 5.819 2.373 1.00 0.00 H new ATOM 0 HB3 LYS A 32 140.107 6.520 3.916 1.00 0.00 H new ATOM 0 HG2 LYS A 32 141.020 8.268 2.751 1.00 0.00 H new ATOM 0 HG3 LYS A 32 142.292 7.176 2.242 1.00 0.00 H new ATOM 0 HD2 LYS A 32 141.338 6.801 0.146 1.00 0.00 H new ATOM 0 HD3 LYS A 32 139.700 7.017 0.729 1.00 0.00 H new ATOM 0 HE2 LYS A 32 141.710 9.311 0.482 1.00 0.00 H new ATOM 0 HE3 LYS A 32 140.563 8.899 -0.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 140.064 10.623 1.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 138.855 9.759 0.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 139.420 9.207 1.874 1.00 0.00 H new ATOM 490 N GLN A 33 141.858 5.266 5.579 1.00 0.00 N ATOM 491 CA GLN A 33 142.675 5.570 6.775 1.00 0.00 C ATOM 492 C GLN A 33 143.893 4.633 6.845 1.00 0.00 C ATOM 493 O GLN A 33 144.987 5.054 7.205 1.00 0.00 O ATOM 494 CB GLN A 33 141.799 5.439 8.026 1.00 0.00 C ATOM 495 CG GLN A 33 140.675 6.505 7.979 1.00 0.00 C ATOM 496 CD GLN A 33 139.413 5.934 7.315 1.00 0.00 C ATOM 497 OE1 GLN A 33 139.481 5.320 6.250 1.00 0.00 O ATOM 498 NE2 GLN A 33 138.265 6.102 7.884 1.00 0.00 N ATOM 0 H GLN A 33 140.881 5.042 5.769 1.00 0.00 H new ATOM 0 HA GLN A 33 143.051 6.591 6.714 1.00 0.00 H new ATOM 0 HB2 GLN A 33 141.366 4.440 8.078 1.00 0.00 H new ATOM 0 HB3 GLN A 33 142.404 5.571 8.923 1.00 0.00 H new ATOM 0 HG2 GLN A 33 140.441 6.839 8.990 1.00 0.00 H new ATOM 0 HG3 GLN A 33 141.019 7.379 7.426 1.00 0.00 H new ATOM 0 HE21 GLN A 33 138.203 6.610 8.766 1.00 0.00 H new ATOM 0 HE22 GLN A 33 137.421 5.727 7.451 1.00 0.00 H new ATOM 507 N GLU A 34 143.737 3.386 6.482 1.00 0.00 N ATOM 508 CA GLU A 34 144.897 2.460 6.513 1.00 0.00 C ATOM 509 C GLU A 34 145.909 2.946 5.493 1.00 0.00 C ATOM 510 O GLU A 34 147.004 3.370 5.843 1.00 0.00 O ATOM 511 CB GLU A 34 144.467 1.013 6.149 1.00 0.00 C ATOM 512 CG GLU A 34 142.988 0.755 6.479 1.00 0.00 C ATOM 513 CD GLU A 34 142.720 1.067 7.926 1.00 0.00 C ATOM 514 OE1 GLU A 34 143.169 0.328 8.765 1.00 0.00 O ATOM 515 OE2 GLU A 34 142.061 2.028 8.183 1.00 0.00 O ATOM 0 H GLU A 34 142.858 2.975 6.167 1.00 0.00 H new ATOM 0 HA GLU A 34 145.320 2.447 7.517 1.00 0.00 H new ATOM 0 HB2 GLU A 34 144.638 0.840 5.086 1.00 0.00 H new ATOM 0 HB3 GLU A 34 145.090 0.302 6.692 1.00 0.00 H new ATOM 0 HG2 GLU A 34 142.352 1.370 5.842 1.00 0.00 H new ATOM 0 HG3 GLU A 34 142.737 -0.285 6.270 1.00 0.00 H new ATOM 522 N LEU A 35 145.529 2.912 4.233 1.00 0.00 N ATOM 523 CA LEU A 35 146.424 3.362 3.114 1.00 0.00 C ATOM 524 C LEU A 35 147.106 4.655 3.503 1.00 0.00 C ATOM 525 O LEU A 35 148.254 4.900 3.157 1.00 0.00 O ATOM 526 CB LEU A 35 145.581 3.631 1.858 1.00 0.00 C ATOM 527 CG LEU A 35 144.987 2.325 1.312 1.00 0.00 C ATOM 528 CD1 LEU A 35 143.702 2.628 0.545 1.00 0.00 C ATOM 529 CD2 LEU A 35 145.987 1.659 0.366 1.00 0.00 C ATOM 0 H LEU A 35 144.613 2.583 3.928 1.00 0.00 H new ATOM 0 HA LEU A 35 147.162 2.585 2.917 1.00 0.00 H new ATOM 0 HB2 LEU A 35 144.779 4.330 2.095 1.00 0.00 H new ATOM 0 HB3 LEU A 35 146.199 4.103 1.094 1.00 0.00 H new ATOM 0 HG LEU A 35 144.770 1.657 2.145 1.00 0.00 H new ATOM 0 HD11 LEU A 35 143.282 1.700 0.158 1.00 0.00 H new ATOM 0 HD12 LEU A 35 142.983 3.101 1.213 1.00 0.00 H new ATOM 0 HD13 LEU A 35 143.923 3.300 -0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 35 145.562 0.732 -0.019 1.00 0.00 H new ATOM 0 HD22 LEU A 35 146.206 2.331 -0.464 1.00 0.00 H new ATOM 0 HD23 LEU A 35 146.908 1.438 0.906 1.00 0.00 H new ATOM 541 N ILE A 36 146.406 5.508 4.156 1.00 0.00 N ATOM 542 CA ILE A 36 147.002 6.786 4.535 1.00 0.00 C ATOM 543 C ILE A 36 147.976 6.553 5.677 1.00 0.00 C ATOM 544 O ILE A 36 149.113 6.988 5.630 1.00 0.00 O ATOM 545 CB ILE A 36 145.891 7.743 4.963 1.00 0.00 C ATOM 546 CG1 ILE A 36 144.997 8.039 3.740 1.00 0.00 C ATOM 547 CG2 ILE A 36 146.509 9.051 5.478 1.00 0.00 C ATOM 548 CD1 ILE A 36 143.671 8.643 4.187 1.00 0.00 C ATOM 0 H ILE A 36 145.437 5.373 4.446 1.00 0.00 H new ATOM 0 HA ILE A 36 147.540 7.224 3.694 1.00 0.00 H new ATOM 0 HB ILE A 36 145.297 7.293 5.758 1.00 0.00 H new ATOM 0 HG12 ILE A 36 145.508 8.726 3.065 1.00 0.00 H new ATOM 0 HG13 ILE A 36 144.816 7.120 3.182 1.00 0.00 H new ATOM 0 HG21 ILE A 36 145.715 9.733 5.783 1.00 0.00 H new ATOM 0 HG22 ILE A 36 147.152 8.838 6.332 1.00 0.00 H new ATOM 0 HG23 ILE A 36 147.099 9.512 4.685 1.00 0.00 H new ATOM 0 HD11 ILE A 36 143.051 8.846 3.314 1.00 0.00 H new ATOM 0 HD12 ILE A 36 143.155 7.942 4.843 1.00 0.00 H new ATOM 0 HD13 ILE A 36 143.857 9.573 4.724 1.00 0.00 H new ATOM 560 N LYS A 37 147.564 5.851 6.693 1.00 0.00 N ATOM 561 CA LYS A 37 148.480 5.589 7.825 1.00 0.00 C ATOM 562 C LYS A 37 149.751 4.942 7.303 1.00 0.00 C ATOM 563 O LYS A 37 150.860 5.337 7.685 1.00 0.00 O ATOM 564 CB LYS A 37 147.799 4.682 8.848 1.00 0.00 C ATOM 565 CG LYS A 37 147.051 5.540 9.888 1.00 0.00 C ATOM 566 CD LYS A 37 147.229 4.930 11.290 1.00 0.00 C ATOM 567 CE LYS A 37 146.556 5.825 12.347 1.00 0.00 C ATOM 568 NZ LYS A 37 146.830 7.255 12.047 1.00 0.00 N ATOM 0 H LYS A 37 146.631 5.449 6.785 1.00 0.00 H new ATOM 0 HA LYS A 37 148.734 6.529 8.315 1.00 0.00 H new ATOM 0 HB2 LYS A 37 147.101 4.012 8.346 1.00 0.00 H new ATOM 0 HB3 LYS A 37 148.541 4.057 9.344 1.00 0.00 H new ATOM 0 HG2 LYS A 37 147.433 6.561 9.874 1.00 0.00 H new ATOM 0 HG3 LYS A 37 145.992 5.593 9.636 1.00 0.00 H new ATOM 0 HD2 LYS A 37 146.794 3.931 11.318 1.00 0.00 H new ATOM 0 HD3 LYS A 37 148.290 4.822 11.516 1.00 0.00 H new ATOM 0 HE2 LYS A 37 145.481 5.646 12.357 1.00 0.00 H new ATOM 0 HE3 LYS A 37 146.930 5.574 13.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 146.617 7.833 12.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 147.832 7.371 11.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 146.233 7.564 11.253 1.00 0.00 H new ATOM 582 N GLU A 38 149.634 3.964 6.434 1.00 0.00 N ATOM 583 CA GLU A 38 150.856 3.349 5.915 1.00 0.00 C ATOM 584 C GLU A 38 151.653 4.373 5.126 1.00 0.00 C ATOM 585 O GLU A 38 152.850 4.373 5.183 1.00 0.00 O ATOM 586 CB GLU A 38 150.595 2.050 5.121 1.00 0.00 C ATOM 587 CG GLU A 38 149.365 2.116 4.213 1.00 0.00 C ATOM 588 CD GLU A 38 148.700 0.768 4.248 1.00 0.00 C ATOM 589 OE1 GLU A 38 149.247 -0.141 3.673 1.00 0.00 O ATOM 590 OE2 GLU A 38 147.699 0.642 4.881 1.00 0.00 O ATOM 0 H GLU A 38 148.756 3.585 6.079 1.00 0.00 H new ATOM 0 HA GLU A 38 151.457 3.031 6.767 1.00 0.00 H new ATOM 0 HB2 GLU A 38 151.471 1.825 4.513 1.00 0.00 H new ATOM 0 HB3 GLU A 38 150.473 1.225 5.823 1.00 0.00 H new ATOM 0 HG2 GLU A 38 148.678 2.891 4.555 1.00 0.00 H new ATOM 0 HG3 GLU A 38 149.655 2.374 3.194 1.00 0.00 H new ATOM 597 N TYR A 39 151.007 5.332 4.496 1.00 0.00 N ATOM 598 CA TYR A 39 151.780 6.421 3.827 1.00 0.00 C ATOM 599 C TYR A 39 152.616 7.159 4.810 1.00 0.00 C ATOM 600 O TYR A 39 153.740 7.481 4.536 1.00 0.00 O ATOM 601 CB TYR A 39 150.884 7.426 3.078 1.00 0.00 C ATOM 602 CG TYR A 39 150.732 7.041 1.632 1.00 0.00 C ATOM 603 CD1 TYR A 39 151.886 6.866 0.858 1.00 0.00 C ATOM 604 CD2 TYR A 39 149.473 6.904 1.048 1.00 0.00 C ATOM 605 CE1 TYR A 39 151.786 6.546 -0.479 1.00 0.00 C ATOM 606 CE2 TYR A 39 149.379 6.588 -0.309 1.00 0.00 C ATOM 607 CZ TYR A 39 150.544 6.406 -1.064 1.00 0.00 C ATOM 608 OH TYR A 39 150.470 6.105 -2.383 1.00 0.00 O ATOM 0 H TYR A 39 149.992 5.403 4.419 1.00 0.00 H new ATOM 0 HA TYR A 39 152.414 5.926 3.091 1.00 0.00 H new ATOM 0 HB2 TYR A 39 149.903 7.467 3.552 1.00 0.00 H new ATOM 0 HB3 TYR A 39 151.314 8.425 3.149 1.00 0.00 H new ATOM 0 HD1 TYR A 39 152.859 6.982 1.311 1.00 0.00 H new ATOM 0 HD2 TYR A 39 148.580 7.041 1.639 1.00 0.00 H new ATOM 0 HE1 TYR A 39 152.680 6.405 -1.069 1.00 0.00 H new ATOM 0 HE2 TYR A 39 148.410 6.484 -0.775 1.00 0.00 H new ATOM 0 HH TYR A 39 149.821 5.384 -2.518 1.00 0.00 H new ATOM 618 N LEU A 40 152.107 7.431 5.950 1.00 0.00 N ATOM 619 CA LEU A 40 152.925 8.178 6.929 1.00 0.00 C ATOM 620 C LEU A 40 154.179 7.367 7.230 1.00 0.00 C ATOM 621 O LEU A 40 155.272 7.897 7.253 1.00 0.00 O ATOM 622 CB LEU A 40 152.102 8.459 8.197 1.00 0.00 C ATOM 623 CG LEU A 40 150.655 8.863 7.796 1.00 0.00 C ATOM 624 CD1 LEU A 40 149.878 9.328 9.012 1.00 0.00 C ATOM 625 CD2 LEU A 40 150.677 9.993 6.753 1.00 0.00 C ATOM 0 H LEU A 40 151.168 7.176 6.256 1.00 0.00 H new ATOM 0 HA LEU A 40 153.225 9.144 6.522 1.00 0.00 H new ATOM 0 HB2 LEU A 40 152.081 7.574 8.833 1.00 0.00 H new ATOM 0 HB3 LEU A 40 152.567 9.257 8.776 1.00 0.00 H new ATOM 0 HG LEU A 40 150.170 7.986 7.368 1.00 0.00 H new ATOM 0 HD11 LEU A 40 148.868 9.607 8.713 1.00 0.00 H new ATOM 0 HD12 LEU A 40 149.831 8.522 9.744 1.00 0.00 H new ATOM 0 HD13 LEU A 40 150.377 10.190 9.454 1.00 0.00 H new ATOM 0 HD21 LEU A 40 149.655 10.261 6.486 1.00 0.00 H new ATOM 0 HD22 LEU A 40 151.183 10.863 7.170 1.00 0.00 H new ATOM 0 HD23 LEU A 40 151.208 9.656 5.863 1.00 0.00 H new ATOM 637 N GLU A 41 154.048 6.073 7.359 1.00 0.00 N ATOM 638 CA GLU A 41 155.265 5.223 7.575 1.00 0.00 C ATOM 639 C GLU A 41 156.081 5.209 6.274 1.00 0.00 C ATOM 640 O GLU A 41 157.245 5.579 6.235 1.00 0.00 O ATOM 641 CB GLU A 41 154.862 3.766 7.912 1.00 0.00 C ATOM 642 CG GLU A 41 153.571 3.707 8.749 1.00 0.00 C ATOM 643 CD GLU A 41 153.177 2.259 8.925 1.00 0.00 C ATOM 644 OE1 GLU A 41 152.970 1.595 7.942 1.00 0.00 O ATOM 645 OE2 GLU A 41 153.114 1.822 10.033 1.00 0.00 O ATOM 0 H GLU A 41 153.162 5.568 7.325 1.00 0.00 H new ATOM 0 HA GLU A 41 155.843 5.633 8.403 1.00 0.00 H new ATOM 0 HB2 GLU A 41 154.722 3.205 6.988 1.00 0.00 H new ATOM 0 HB3 GLU A 41 155.672 3.282 8.459 1.00 0.00 H new ATOM 0 HG2 GLU A 41 153.728 4.177 9.720 1.00 0.00 H new ATOM 0 HG3 GLU A 41 152.773 4.259 8.253 1.00 0.00 H new ATOM 652 N LEU A 42 155.470 4.724 5.235 1.00 0.00 N ATOM 653 CA LEU A 42 156.103 4.578 3.900 1.00 0.00 C ATOM 654 C LEU A 42 156.875 5.853 3.589 1.00 0.00 C ATOM 655 O LEU A 42 158.060 5.833 3.278 1.00 0.00 O ATOM 656 CB LEU A 42 154.967 4.416 2.861 1.00 0.00 C ATOM 657 CG LEU A 42 155.388 3.540 1.669 1.00 0.00 C ATOM 658 CD1 LEU A 42 156.835 3.792 1.266 1.00 0.00 C ATOM 659 CD2 LEU A 42 155.214 2.074 2.034 1.00 0.00 C ATOM 0 H LEU A 42 154.501 4.405 5.261 1.00 0.00 H new ATOM 0 HA LEU A 42 156.776 3.721 3.876 1.00 0.00 H new ATOM 0 HB2 LEU A 42 154.096 3.974 3.344 1.00 0.00 H new ATOM 0 HB3 LEU A 42 154.666 5.399 2.499 1.00 0.00 H new ATOM 0 HG LEU A 42 154.753 3.799 0.821 1.00 0.00 H new ATOM 0 HD11 LEU A 42 157.094 3.154 0.421 1.00 0.00 H new ATOM 0 HD12 LEU A 42 156.957 4.837 0.982 1.00 0.00 H new ATOM 0 HD13 LEU A 42 157.491 3.565 2.106 1.00 0.00 H new ATOM 0 HD21 LEU A 42 155.512 1.451 1.190 1.00 0.00 H new ATOM 0 HD22 LEU A 42 155.836 1.838 2.897 1.00 0.00 H new ATOM 0 HD23 LEU A 42 154.169 1.881 2.276 1.00 0.00 H new ATOM 671 N GLU A 43 156.199 6.950 3.653 1.00 0.00 N ATOM 672 CA GLU A 43 156.822 8.252 3.362 1.00 0.00 C ATOM 673 C GLU A 43 157.975 8.482 4.317 1.00 0.00 C ATOM 674 O GLU A 43 159.067 8.785 3.892 1.00 0.00 O ATOM 675 CB GLU A 43 155.784 9.367 3.506 1.00 0.00 C ATOM 676 CG GLU A 43 154.729 9.231 2.378 1.00 0.00 C ATOM 677 CD GLU A 43 154.749 10.440 1.471 1.00 0.00 C ATOM 678 OE1 GLU A 43 154.905 11.542 1.963 1.00 0.00 O ATOM 679 OE2 GLU A 43 154.581 10.268 0.302 1.00 0.00 O ATOM 0 H GLU A 43 155.211 6.999 3.902 1.00 0.00 H new ATOM 0 HA GLU A 43 157.199 8.256 2.339 1.00 0.00 H new ATOM 0 HB2 GLU A 43 155.301 9.307 4.481 1.00 0.00 H new ATOM 0 HB3 GLU A 43 156.269 10.341 3.451 1.00 0.00 H new ATOM 0 HG2 GLU A 43 154.928 8.331 1.796 1.00 0.00 H new ATOM 0 HG3 GLU A 43 153.737 9.115 2.815 1.00 0.00 H new ATOM 686 N LYS A 44 157.766 8.334 5.601 1.00 0.00 N ATOM 687 CA LYS A 44 158.887 8.538 6.549 1.00 0.00 C ATOM 688 C LYS A 44 160.064 7.698 6.074 1.00 0.00 C ATOM 689 O LYS A 44 161.185 8.177 5.947 1.00 0.00 O ATOM 690 CB LYS A 44 158.472 8.065 7.940 1.00 0.00 C ATOM 691 CG LYS A 44 157.418 9.008 8.545 1.00 0.00 C ATOM 692 CD LYS A 44 158.046 9.861 9.663 1.00 0.00 C ATOM 693 CE LYS A 44 157.063 10.963 10.126 1.00 0.00 C ATOM 694 NZ LYS A 44 155.700 10.736 9.557 1.00 0.00 N ATOM 0 H LYS A 44 156.873 8.083 6.025 1.00 0.00 H new ATOM 0 HA LYS A 44 159.156 9.593 6.592 1.00 0.00 H new ATOM 0 HB2 LYS A 44 158.070 7.053 7.880 1.00 0.00 H new ATOM 0 HB3 LYS A 44 159.346 8.023 8.591 1.00 0.00 H new ATOM 0 HG2 LYS A 44 157.011 9.656 7.769 1.00 0.00 H new ATOM 0 HG3 LYS A 44 156.586 8.427 8.944 1.00 0.00 H new ATOM 0 HD2 LYS A 44 158.311 9.225 10.507 1.00 0.00 H new ATOM 0 HD3 LYS A 44 158.969 10.317 9.305 1.00 0.00 H new ATOM 0 HE2 LYS A 44 157.010 10.974 11.215 1.00 0.00 H new ATOM 0 HE3 LYS A 44 157.433 11.940 9.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 155.026 11.393 9.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 155.721 10.899 8.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 155.404 9.757 9.746 1.00 0.00 H new ATOM 708 N CYS A 45 159.807 6.459 5.782 1.00 0.00 N ATOM 709 CA CYS A 45 160.866 5.558 5.304 1.00 0.00 C ATOM 710 C CYS A 45 161.494 6.128 4.042 1.00 0.00 C ATOM 711 O CYS A 45 162.663 6.437 4.020 1.00 0.00 O ATOM 712 CB CYS A 45 160.268 4.182 5.014 1.00 0.00 C ATOM 713 SG CYS A 45 159.284 3.639 6.433 1.00 0.00 S ATOM 0 H CYS A 45 158.885 6.030 5.859 1.00 0.00 H new ATOM 0 HA CYS A 45 161.636 5.462 6.070 1.00 0.00 H new ATOM 0 HB2 CYS A 45 159.644 4.226 4.121 1.00 0.00 H new ATOM 0 HB3 CYS A 45 161.063 3.464 4.813 1.00 0.00 H new ATOM 0 HG CYS A 45 158.267 4.434 6.586 1.00 0.00 H new ATOM 719 N LEU A 46 160.743 6.260 2.985 1.00 0.00 N ATOM 720 CA LEU A 46 161.341 6.789 1.720 1.00 0.00 C ATOM 721 C LEU A 46 162.047 8.109 2.004 1.00 0.00 C ATOM 722 O LEU A 46 163.051 8.388 1.436 1.00 0.00 O ATOM 723 CB LEU A 46 160.262 6.976 0.634 1.00 0.00 C ATOM 724 CG LEU A 46 160.926 7.313 -0.736 1.00 0.00 C ATOM 725 CD1 LEU A 46 162.153 6.435 -0.995 1.00 0.00 C ATOM 726 CD2 LEU A 46 159.936 7.086 -1.867 1.00 0.00 C ATOM 0 H LEU A 46 159.751 6.028 2.938 1.00 0.00 H new ATOM 0 HA LEU A 46 162.066 6.066 1.346 1.00 0.00 H new ATOM 0 HB2 LEU A 46 159.666 6.068 0.543 1.00 0.00 H new ATOM 0 HB3 LEU A 46 159.581 7.777 0.922 1.00 0.00 H new ATOM 0 HG LEU A 46 161.233 8.358 -0.697 1.00 0.00 H new ATOM 0 HD11 LEU A 46 162.591 6.697 -1.958 1.00 0.00 H new ATOM 0 HD12 LEU A 46 162.888 6.596 -0.207 1.00 0.00 H new ATOM 0 HD13 LEU A 46 161.855 5.387 -1.005 1.00 0.00 H new ATOM 0 HD21 LEU A 46 160.410 7.324 -2.819 1.00 0.00 H new ATOM 0 HD22 LEU A 46 159.620 6.043 -1.870 1.00 0.00 H new ATOM 0 HD23 LEU A 46 159.067 7.728 -1.724 1.00 0.00 H new ATOM 738 N SER A 47 161.546 8.896 2.901 1.00 0.00 N ATOM 739 CA SER A 47 162.224 10.181 3.225 1.00 0.00 C ATOM 740 C SER A 47 163.625 9.874 3.744 1.00 0.00 C ATOM 741 O SER A 47 164.634 10.350 3.214 1.00 0.00 O ATOM 742 CB SER A 47 161.423 10.935 4.290 1.00 0.00 C ATOM 743 OG SER A 47 160.036 10.920 3.937 1.00 0.00 O ATOM 0 H SER A 47 160.693 8.709 3.429 1.00 0.00 H new ATOM 0 HA SER A 47 162.289 10.804 2.333 1.00 0.00 H new ATOM 0 HB2 SER A 47 161.567 10.471 5.266 1.00 0.00 H new ATOM 0 HB3 SER A 47 161.779 11.962 4.370 1.00 0.00 H new ATOM 0 HG SER A 47 159.613 10.118 4.308 1.00 0.00 H new ATOM 749 N ARG A 48 163.706 9.044 4.738 1.00 0.00 N ATOM 750 CA ARG A 48 165.029 8.645 5.286 1.00 0.00 C ATOM 751 C ARG A 48 165.834 8.031 4.164 1.00 0.00 C ATOM 752 O ARG A 48 167.004 8.344 3.962 1.00 0.00 O ATOM 753 CB ARG A 48 164.817 7.576 6.359 1.00 0.00 C ATOM 754 CG ARG A 48 164.218 8.196 7.615 1.00 0.00 C ATOM 755 CD ARG A 48 164.171 7.139 8.723 1.00 0.00 C ATOM 756 NE ARG A 48 163.078 6.152 8.440 1.00 0.00 N ATOM 757 CZ ARG A 48 161.874 6.330 8.938 1.00 0.00 C ATOM 758 NH1 ARG A 48 161.570 7.463 9.520 1.00 0.00 N ATOM 759 NH2 ARG A 48 160.978 5.393 8.812 1.00 0.00 N ATOM 0 H ARG A 48 162.903 8.618 5.202 1.00 0.00 H new ATOM 0 HA ARG A 48 165.541 9.509 5.709 1.00 0.00 H new ATOM 0 HB2 ARG A 48 164.156 6.797 5.980 1.00 0.00 H new ATOM 0 HB3 ARG A 48 165.767 7.099 6.599 1.00 0.00 H new ATOM 0 HG2 ARG A 48 164.816 9.049 7.935 1.00 0.00 H new ATOM 0 HG3 ARG A 48 163.215 8.569 7.408 1.00 0.00 H new ATOM 0 HD2 ARG A 48 165.130 6.625 8.788 1.00 0.00 H new ATOM 0 HD3 ARG A 48 164.000 7.618 9.687 1.00 0.00 H new ATOM 0 HE ARG A 48 163.270 5.337 7.857 1.00 0.00 H new ATOM 0 HH11 ARG A 48 162.266 8.205 9.586 1.00 0.00 H new ATOM 0 HH12 ARG A 48 160.637 7.603 9.907 1.00 0.00 H new ATOM 0 HH21 ARG A 48 161.212 4.526 8.329 1.00 0.00 H new ATOM 0 HH22 ARG A 48 160.043 5.527 9.197 1.00 0.00 H new ATOM 773 N MET A 49 165.229 7.128 3.475 1.00 0.00 N ATOM 774 CA MET A 49 165.900 6.404 2.394 1.00 0.00 C ATOM 775 C MET A 49 166.275 7.371 1.282 1.00 0.00 C ATOM 776 O MET A 49 167.157 7.094 0.520 1.00 0.00 O ATOM 777 CB MET A 49 164.956 5.325 1.859 1.00 0.00 C ATOM 778 CG MET A 49 164.452 4.456 3.031 1.00 0.00 C ATOM 779 SD MET A 49 165.621 3.130 3.348 1.00 0.00 S ATOM 780 CE MET A 49 165.012 1.994 2.093 1.00 0.00 C ATOM 0 H MET A 49 164.258 6.854 3.625 1.00 0.00 H new ATOM 0 HA MET A 49 166.810 5.937 2.770 1.00 0.00 H new ATOM 0 HB2 MET A 49 164.113 5.787 1.345 1.00 0.00 H new ATOM 0 HB3 MET A 49 165.473 4.704 1.128 1.00 0.00 H new ATOM 0 HG2 MET A 49 164.331 5.068 3.925 1.00 0.00 H new ATOM 0 HG3 MET A 49 163.472 4.041 2.794 1.00 0.00 H new ATOM 0 HE1 MET A 49 165.784 1.261 1.860 1.00 0.00 H new ATOM 0 HE2 MET A 49 164.125 1.481 2.466 1.00 0.00 H new ATOM 0 HE3 MET A 49 164.757 2.551 1.191 1.00 0.00 H new ATOM 790 N GLU A 50 165.629 8.497 1.195 1.00 0.00 N ATOM 791 CA GLU A 50 165.974 9.487 0.147 1.00 0.00 C ATOM 792 C GLU A 50 167.245 10.168 0.566 1.00 0.00 C ATOM 793 O GLU A 50 168.208 10.232 -0.188 1.00 0.00 O ATOM 794 CB GLU A 50 164.847 10.506 -0.019 1.00 0.00 C ATOM 795 CG GLU A 50 163.791 9.999 -1.031 1.00 0.00 C ATOM 796 CD GLU A 50 163.559 11.039 -2.103 1.00 0.00 C ATOM 797 OE1 GLU A 50 164.349 11.108 -3.012 1.00 0.00 O ATOM 798 OE2 GLU A 50 162.606 11.773 -1.996 1.00 0.00 O ATOM 0 H GLU A 50 164.868 8.775 1.814 1.00 0.00 H new ATOM 0 HA GLU A 50 166.109 8.991 -0.814 1.00 0.00 H new ATOM 0 HB2 GLU A 50 164.373 10.691 0.945 1.00 0.00 H new ATOM 0 HB3 GLU A 50 165.257 11.456 -0.360 1.00 0.00 H new ATOM 0 HG2 GLU A 50 164.128 9.067 -1.484 1.00 0.00 H new ATOM 0 HG3 GLU A 50 162.856 9.782 -0.515 1.00 0.00 H new ATOM 805 N ASP A 51 167.313 10.570 1.808 1.00 0.00 N ATOM 806 CA ASP A 51 168.567 11.145 2.316 1.00 0.00 C ATOM 807 C ASP A 51 169.640 10.094 2.183 1.00 0.00 C ATOM 808 O ASP A 51 170.633 10.306 1.533 1.00 0.00 O ATOM 809 CB ASP A 51 168.430 11.551 3.788 1.00 0.00 C ATOM 810 CG ASP A 51 167.978 12.980 3.907 1.00 0.00 C ATOM 811 OD1 ASP A 51 168.734 13.854 3.551 1.00 0.00 O ATOM 812 OD2 ASP A 51 166.895 13.192 4.374 1.00 0.00 O ATOM 0 H ASP A 51 166.549 10.520 2.482 1.00 0.00 H new ATOM 0 HA ASP A 51 168.817 12.039 1.745 1.00 0.00 H new ATOM 0 HB2 ASP A 51 167.715 10.896 4.286 1.00 0.00 H new ATOM 0 HB3 ASP A 51 169.386 11.424 4.296 1.00 0.00 H new ATOM 817 N GLU A 52 169.427 8.940 2.766 1.00 0.00 N ATOM 818 CA GLU A 52 170.438 7.853 2.651 1.00 0.00 C ATOM 819 C GLU A 52 170.786 7.656 1.191 1.00 0.00 C ATOM 820 O GLU A 52 171.912 7.742 0.824 1.00 0.00 O ATOM 821 CB GLU A 52 169.888 6.529 3.206 1.00 0.00 C ATOM 822 CG GLU A 52 169.698 6.604 4.720 1.00 0.00 C ATOM 823 CD GLU A 52 170.951 6.139 5.424 1.00 0.00 C ATOM 824 OE1 GLU A 52 171.258 4.969 5.370 1.00 0.00 O ATOM 825 OE2 GLU A 52 171.594 6.951 6.019 1.00 0.00 O ATOM 0 H GLU A 52 168.599 8.708 3.314 1.00 0.00 H new ATOM 0 HA GLU A 52 171.319 8.138 3.226 1.00 0.00 H new ATOM 0 HB2 GLU A 52 168.936 6.298 2.728 1.00 0.00 H new ATOM 0 HB3 GLU A 52 170.572 5.717 2.962 1.00 0.00 H new ATOM 0 HG2 GLU A 52 169.464 7.627 5.015 1.00 0.00 H new ATOM 0 HG3 GLU A 52 168.852 5.985 5.019 1.00 0.00 H new ATOM 832 N ASN A 53 169.814 7.380 0.363 1.00 0.00 N ATOM 833 CA ASN A 53 170.095 7.134 -1.081 1.00 0.00 C ATOM 834 C ASN A 53 170.942 8.241 -1.622 1.00 0.00 C ATOM 835 O ASN A 53 171.912 8.015 -2.306 1.00 0.00 O ATOM 836 CB ASN A 53 168.777 7.086 -1.863 1.00 0.00 C ATOM 837 CG ASN A 53 168.282 5.652 -1.899 1.00 0.00 C ATOM 838 OD1 ASN A 53 167.515 5.231 -0.977 1.00 0.00 O flip ATOM 839 ND2 ASN A 53 168.607 4.907 -2.787 1.00 0.00 N flip ATOM 0 H ASN A 53 168.831 7.314 0.627 1.00 0.00 H new ATOM 0 HA ASN A 53 170.619 6.184 -1.186 1.00 0.00 H new ATOM 0 HB2 ASN A 53 168.035 7.730 -1.391 1.00 0.00 H new ATOM 0 HB3 ASN A 53 168.925 7.460 -2.876 1.00 0.00 H new ATOM 0 HD21 ASN A 53 169.222 5.237 -3.530 1.00 0.00 H new ATOM 0 HD22 ASN A 53 168.267 3.945 -2.796 1.00 0.00 H new ATOM 846 N ASN A 54 170.571 9.447 -1.317 1.00 0.00 N ATOM 847 CA ASN A 54 171.315 10.621 -1.812 1.00 0.00 C ATOM 848 C ASN A 54 172.728 10.594 -1.277 1.00 0.00 C ATOM 849 O ASN A 54 173.679 10.600 -2.025 1.00 0.00 O ATOM 850 CB ASN A 54 170.630 11.901 -1.333 1.00 0.00 C ATOM 851 CG ASN A 54 169.523 12.298 -2.297 1.00 0.00 C ATOM 852 OD1 ASN A 54 169.246 11.602 -3.261 1.00 0.00 O ATOM 853 ND2 ASN A 54 168.878 13.382 -2.096 1.00 0.00 N ATOM 0 H ASN A 54 169.765 9.669 -0.732 1.00 0.00 H new ATOM 0 HA ASN A 54 171.334 10.595 -2.902 1.00 0.00 H new ATOM 0 HB2 ASN A 54 170.217 11.749 -0.336 1.00 0.00 H new ATOM 0 HB3 ASN A 54 171.361 12.706 -1.256 1.00 0.00 H new ATOM 0 HD21 ASN A 54 168.137 13.661 -2.739 1.00 0.00 H new ATOM 0 HD22 ASN A 54 169.104 13.968 -1.293 1.00 0.00 H new ATOM 860 N ARG A 55 172.877 10.562 0.012 1.00 0.00 N ATOM 861 CA ARG A 55 174.234 10.552 0.604 1.00 0.00 C ATOM 862 C ARG A 55 174.947 9.292 0.153 1.00 0.00 C ATOM 863 O ARG A 55 175.900 9.345 -0.577 1.00 0.00 O ATOM 864 CB ARG A 55 174.142 10.568 2.148 1.00 0.00 C ATOM 865 CG ARG A 55 173.214 11.691 2.650 1.00 0.00 C ATOM 866 CD ARG A 55 173.728 13.086 2.229 1.00 0.00 C ATOM 867 NE ARG A 55 172.752 13.745 1.289 1.00 0.00 N ATOM 868 CZ ARG A 55 171.509 13.998 1.656 1.00 0.00 C ATOM 869 NH1 ARG A 55 171.078 13.598 2.821 1.00 0.00 N ATOM 870 NH2 ARG A 55 170.724 14.650 0.855 1.00 0.00 N ATOM 0 H ARG A 55 172.111 10.542 0.685 1.00 0.00 H new ATOM 0 HA ARG A 55 174.783 11.435 0.277 1.00 0.00 H new ATOM 0 HB2 ARG A 55 173.773 9.605 2.501 1.00 0.00 H new ATOM 0 HB3 ARG A 55 175.138 10.702 2.571 1.00 0.00 H new ATOM 0 HG2 ARG A 55 172.210 11.538 2.254 1.00 0.00 H new ATOM 0 HG3 ARG A 55 173.139 11.643 3.736 1.00 0.00 H new ATOM 0 HD2 ARG A 55 173.870 13.710 3.112 1.00 0.00 H new ATOM 0 HD3 ARG A 55 174.700 12.991 1.746 1.00 0.00 H new ATOM 0 HE ARG A 55 173.058 14.001 0.350 1.00 0.00 H new ATOM 0 HH11 ARG A 55 171.701 13.090 3.448 1.00 0.00 H new ATOM 0 HH12 ARG A 55 170.118 13.794 3.104 1.00 0.00 H new ATOM 0 HH21 ARG A 55 171.068 14.964 -0.052 1.00 0.00 H new ATOM 0 HH22 ARG A 55 169.763 14.849 1.133 1.00 0.00 H new ATOM 884 N LEU A 56 174.477 8.171 0.593 1.00 0.00 N ATOM 885 CA LEU A 56 175.069 6.862 0.247 1.00 0.00 C ATOM 886 C LEU A 56 175.595 6.844 -1.158 1.00 0.00 C ATOM 887 O LEU A 56 176.748 6.517 -1.393 1.00 0.00 O ATOM 888 CB LEU A 56 173.956 5.809 0.311 1.00 0.00 C ATOM 889 CG LEU A 56 173.677 5.423 1.777 1.00 0.00 C ATOM 890 CD1 LEU A 56 172.473 4.486 1.835 1.00 0.00 C ATOM 891 CD2 LEU A 56 174.897 4.699 2.363 1.00 0.00 C ATOM 0 H LEU A 56 173.666 8.107 1.209 1.00 0.00 H new ATOM 0 HA LEU A 56 175.885 6.665 0.942 1.00 0.00 H new ATOM 0 HB2 LEU A 56 173.048 6.199 -0.150 1.00 0.00 H new ATOM 0 HB3 LEU A 56 174.247 4.925 -0.257 1.00 0.00 H new ATOM 0 HG LEU A 56 173.474 6.327 2.352 1.00 0.00 H new ATOM 0 HD11 LEU A 56 172.275 4.212 2.871 1.00 0.00 H new ATOM 0 HD12 LEU A 56 171.600 4.989 1.419 1.00 0.00 H new ATOM 0 HD13 LEU A 56 172.684 3.587 1.256 1.00 0.00 H new ATOM 0 HD21 LEU A 56 174.696 4.428 3.399 1.00 0.00 H new ATOM 0 HD22 LEU A 56 175.098 3.797 1.784 1.00 0.00 H new ATOM 0 HD23 LEU A 56 175.765 5.357 2.322 1.00 0.00 H new ATOM 903 N ARG A 57 174.735 7.113 -2.112 1.00 0.00 N ATOM 904 CA ARG A 57 175.138 7.041 -3.531 1.00 0.00 C ATOM 905 C ARG A 57 176.287 7.990 -3.787 1.00 0.00 C ATOM 906 O ARG A 57 177.180 7.679 -4.548 1.00 0.00 O ATOM 907 CB ARG A 57 173.955 7.382 -4.458 1.00 0.00 C ATOM 908 CG ARG A 57 173.139 6.108 -4.771 1.00 0.00 C ATOM 909 CD ARG A 57 173.909 5.255 -5.793 1.00 0.00 C ATOM 910 NE ARG A 57 173.199 3.959 -6.051 1.00 0.00 N ATOM 911 CZ ARG A 57 173.812 3.009 -6.727 1.00 0.00 C ATOM 912 NH1 ARG A 57 175.055 3.173 -7.097 1.00 0.00 N ATOM 913 NH2 ARG A 57 173.195 1.909 -7.010 1.00 0.00 N ATOM 0 H ARG A 57 173.764 7.381 -1.955 1.00 0.00 H new ATOM 0 HA ARG A 57 175.457 6.021 -3.747 1.00 0.00 H new ATOM 0 HB2 ARG A 57 173.315 8.126 -3.984 1.00 0.00 H new ATOM 0 HB3 ARG A 57 174.324 7.823 -5.384 1.00 0.00 H new ATOM 0 HG2 ARG A 57 172.968 5.537 -3.858 1.00 0.00 H new ATOM 0 HG3 ARG A 57 172.160 6.377 -5.167 1.00 0.00 H new ATOM 0 HD2 ARG A 57 174.017 5.808 -6.726 1.00 0.00 H new ATOM 0 HD3 ARG A 57 174.915 5.056 -5.423 1.00 0.00 H new ATOM 0 HE ARG A 57 172.250 3.815 -5.706 1.00 0.00 H new ATOM 0 HH11 ARG A 57 175.548 4.035 -6.862 1.00 0.00 H new ATOM 0 HH12 ARG A 57 175.532 2.439 -7.621 1.00 0.00 H new ATOM 0 HH21 ARG A 57 172.230 1.774 -6.710 1.00 0.00 H new ATOM 0 HH22 ARG A 57 173.673 1.176 -7.534 1.00 0.00 H new ATOM 927 N LEU A 58 176.277 9.140 -3.187 1.00 0.00 N ATOM 928 CA LEU A 58 177.364 10.101 -3.411 1.00 0.00 C ATOM 929 C LEU A 58 178.602 9.622 -2.649 1.00 0.00 C ATOM 930 O LEU A 58 179.697 9.563 -3.195 1.00 0.00 O ATOM 931 CB LEU A 58 176.930 11.477 -2.947 1.00 0.00 C ATOM 932 CG LEU A 58 175.711 11.942 -3.762 1.00 0.00 C ATOM 933 CD1 LEU A 58 174.987 13.093 -3.043 1.00 0.00 C ATOM 934 CD2 LEU A 58 176.160 12.391 -5.153 1.00 0.00 C ATOM 0 H LEU A 58 175.550 9.453 -2.544 1.00 0.00 H new ATOM 0 HA LEU A 58 177.606 10.167 -4.472 1.00 0.00 H new ATOM 0 HB2 LEU A 58 176.681 11.451 -1.886 1.00 0.00 H new ATOM 0 HB3 LEU A 58 177.750 12.186 -3.065 1.00 0.00 H new ATOM 0 HG LEU A 58 175.017 11.108 -3.861 1.00 0.00 H new ATOM 0 HD11 LEU A 58 174.128 13.408 -3.635 1.00 0.00 H new ATOM 0 HD12 LEU A 58 174.649 12.755 -2.064 1.00 0.00 H new ATOM 0 HD13 LEU A 58 175.671 13.933 -2.920 1.00 0.00 H new ATOM 0 HD21 LEU A 58 175.293 12.719 -5.727 1.00 0.00 H new ATOM 0 HD22 LEU A 58 176.867 13.216 -5.059 1.00 0.00 H new ATOM 0 HD23 LEU A 58 176.641 11.558 -5.667 1.00 0.00 H new ATOM 946 N GLU A 59 178.441 9.264 -1.419 1.00 0.00 N ATOM 947 CA GLU A 59 179.583 8.770 -0.616 1.00 0.00 C ATOM 948 C GLU A 59 180.218 7.580 -1.327 1.00 0.00 C ATOM 949 O GLU A 59 181.398 7.559 -1.599 1.00 0.00 O ATOM 950 CB GLU A 59 179.067 8.302 0.766 1.00 0.00 C ATOM 951 CG GLU A 59 178.440 9.474 1.537 1.00 0.00 C ATOM 952 CD GLU A 59 178.467 9.152 3.009 1.00 0.00 C ATOM 953 OE1 GLU A 59 179.469 9.401 3.620 1.00 0.00 O ATOM 954 OE2 GLU A 59 177.501 8.627 3.506 1.00 0.00 O ATOM 0 H GLU A 59 177.550 9.292 -0.923 1.00 0.00 H new ATOM 0 HA GLU A 59 180.316 9.568 -0.493 1.00 0.00 H new ATOM 0 HB2 GLU A 59 178.329 7.510 0.635 1.00 0.00 H new ATOM 0 HB3 GLU A 59 179.890 7.879 1.343 1.00 0.00 H new ATOM 0 HG2 GLU A 59 178.991 10.394 1.341 1.00 0.00 H new ATOM 0 HG3 GLU A 59 177.415 9.640 1.205 1.00 0.00 H new ATOM 961 N SER A 60 179.444 6.570 -1.553 1.00 0.00 N ATOM 962 CA SER A 60 179.965 5.308 -2.148 1.00 0.00 C ATOM 963 C SER A 60 180.856 5.583 -3.360 1.00 0.00 C ATOM 964 O SER A 60 181.999 5.161 -3.412 1.00 0.00 O ATOM 965 CB SER A 60 178.796 4.430 -2.567 1.00 0.00 C ATOM 966 OG SER A 60 177.743 5.241 -3.094 1.00 0.00 O ATOM 0 H SER A 60 178.445 6.559 -1.347 1.00 0.00 H new ATOM 0 HA SER A 60 180.569 4.801 -1.395 1.00 0.00 H new ATOM 0 HB2 SER A 60 179.122 3.709 -3.317 1.00 0.00 H new ATOM 0 HB3 SER A 60 178.434 3.859 -1.712 1.00 0.00 H new ATOM 0 HG SER A 60 177.143 5.511 -2.368 1.00 0.00 H new ATOM 972 N LYS A 61 180.335 6.229 -4.367 1.00 0.00 N ATOM 973 CA LYS A 61 181.170 6.449 -5.588 1.00 0.00 C ATOM 974 C LYS A 61 182.427 7.211 -5.193 1.00 0.00 C ATOM 975 O LYS A 61 183.509 6.934 -5.672 1.00 0.00 O ATOM 976 CB LYS A 61 180.400 7.206 -6.681 1.00 0.00 C ATOM 977 CG LYS A 61 179.628 8.389 -6.085 1.00 0.00 C ATOM 978 CD LYS A 61 178.505 8.831 -7.035 1.00 0.00 C ATOM 979 CE LYS A 61 179.103 9.291 -8.375 1.00 0.00 C ATOM 980 NZ LYS A 61 179.099 8.171 -9.357 1.00 0.00 N ATOM 0 H LYS A 61 179.389 6.608 -4.402 1.00 0.00 H new ATOM 0 HA LYS A 61 181.438 5.479 -6.006 1.00 0.00 H new ATOM 0 HB2 LYS A 61 181.096 7.565 -7.439 1.00 0.00 H new ATOM 0 HB3 LYS A 61 179.707 6.528 -7.180 1.00 0.00 H new ATOM 0 HG2 LYS A 61 179.206 8.107 -5.120 1.00 0.00 H new ATOM 0 HG3 LYS A 61 180.308 9.221 -5.904 1.00 0.00 H new ATOM 0 HD2 LYS A 61 177.811 8.007 -7.200 1.00 0.00 H new ATOM 0 HD3 LYS A 61 177.934 9.643 -6.584 1.00 0.00 H new ATOM 0 HE2 LYS A 61 178.529 10.130 -8.768 1.00 0.00 H new ATOM 0 HE3 LYS A 61 180.122 9.646 -8.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 180.074 7.969 -9.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 178.690 7.323 -8.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 178.530 8.438 -10.186 1.00 0.00 H new ATOM 994 N ARG A 62 182.301 8.138 -4.286 1.00 0.00 N ATOM 995 CA ARG A 62 183.479 8.895 -3.812 1.00 0.00 C ATOM 996 C ARG A 62 184.222 8.061 -2.775 1.00 0.00 C ATOM 997 O ARG A 62 185.077 8.577 -2.055 1.00 0.00 O ATOM 998 CB ARG A 62 183.052 10.224 -3.186 1.00 0.00 C ATOM 999 CG ARG A 62 182.749 11.258 -4.275 1.00 0.00 C ATOM 1000 CD ARG A 62 183.602 12.521 -4.055 1.00 0.00 C ATOM 1001 NE ARG A 62 185.072 12.200 -4.172 1.00 0.00 N ATOM 1002 CZ ARG A 62 185.869 12.152 -3.114 1.00 0.00 C ATOM 1003 NH1 ARG A 62 185.374 12.195 -1.906 1.00 0.00 N ATOM 1004 NH2 ARG A 62 187.151 12.024 -3.280 1.00 0.00 N ATOM 0 H ARG A 62 181.417 8.403 -3.851 1.00 0.00 H new ATOM 0 HA ARG A 62 184.129 9.105 -4.661 1.00 0.00 H new ATOM 0 HB2 ARG A 62 182.170 10.073 -2.564 1.00 0.00 H new ATOM 0 HB3 ARG A 62 183.842 10.596 -2.533 1.00 0.00 H new ATOM 0 HG2 ARG A 62 182.958 10.835 -5.258 1.00 0.00 H new ATOM 0 HG3 ARG A 62 181.690 11.517 -4.258 1.00 0.00 H new ATOM 0 HD2 ARG A 62 183.331 13.281 -4.788 1.00 0.00 H new ATOM 0 HD3 ARG A 62 183.393 12.940 -3.070 1.00 0.00 H new ATOM 0 HE ARG A 62 185.465 12.014 -5.095 1.00 0.00 H new ATOM 0 HH11 ARG A 62 184.366 12.266 -1.770 1.00 0.00 H new ATOM 0 HH12 ARG A 62 185.996 12.157 -1.098 1.00 0.00 H new ATOM 0 HH21 ARG A 62 187.540 11.961 -4.221 1.00 0.00 H new ATOM 0 HH22 ARG A 62 187.769 11.987 -2.469 1.00 0.00 H new ATOM 1018 N LEU A 63 183.955 6.793 -2.698 1.00 0.00 N ATOM 1019 CA LEU A 63 184.663 5.947 -1.746 1.00 0.00 C ATOM 1020 C LEU A 63 185.450 4.882 -2.503 1.00 0.00 C ATOM 1021 O LEU A 63 185.329 4.725 -3.711 1.00 0.00 O ATOM 1022 CB LEU A 63 183.667 5.260 -0.818 1.00 0.00 C ATOM 1023 CG LEU A 63 183.297 6.160 0.381 1.00 0.00 C ATOM 1024 CD1 LEU A 63 182.032 5.624 1.026 1.00 0.00 C ATOM 1025 CD2 LEU A 63 184.410 6.125 1.428 1.00 0.00 C ATOM 0 H LEU A 63 183.262 6.311 -3.270 1.00 0.00 H new ATOM 0 HA LEU A 63 185.341 6.565 -1.157 1.00 0.00 H new ATOM 0 HB2 LEU A 63 182.765 5.005 -1.375 1.00 0.00 H new ATOM 0 HB3 LEU A 63 184.092 4.325 -0.455 1.00 0.00 H new ATOM 0 HG LEU A 63 183.154 7.181 0.026 1.00 0.00 H new ATOM 0 HD11 LEU A 63 181.762 6.253 1.874 1.00 0.00 H new ATOM 0 HD12 LEU A 63 181.221 5.630 0.297 1.00 0.00 H new ATOM 0 HD13 LEU A 63 182.203 4.604 1.370 1.00 0.00 H new ATOM 0 HD21 LEU A 63 184.139 6.763 2.269 1.00 0.00 H new ATOM 0 HD22 LEU A 63 184.548 5.102 1.778 1.00 0.00 H new ATOM 0 HD23 LEU A 63 185.338 6.485 0.984 1.00 0.00 H new ATOM 2083 N HIS B 23 147.965 17.675 7.705 1.00 0.00 N ATOM 2084 CA HIS B 23 148.135 17.518 6.236 1.00 0.00 C ATOM 2085 C HIS B 23 147.576 16.154 5.845 1.00 0.00 C ATOM 2086 O HIS B 23 147.145 15.947 4.720 1.00 0.00 O ATOM 2087 CB HIS B 23 149.622 17.604 5.874 1.00 0.00 C ATOM 2088 CG HIS B 23 149.770 17.833 4.396 1.00 0.00 C ATOM 2089 ND1 HIS B 23 150.137 19.061 3.866 1.00 0.00 N ATOM 2090 CD2 HIS B 23 149.627 16.993 3.329 1.00 0.00 C ATOM 2091 CE1 HIS B 23 150.210 18.915 2.526 1.00 0.00 C ATOM 2092 NE2 HIS B 23 149.909 17.670 2.152 1.00 0.00 N ATOM 0 HA HIS B 23 147.607 18.308 5.702 1.00 0.00 H new ATOM 0 HB2 HIS B 23 150.095 18.416 6.427 1.00 0.00 H new ATOM 0 HB3 HIS B 23 150.130 16.684 6.162 1.00 0.00 H new ATOM 0 HD2 HIS B 23 149.337 15.955 3.392 1.00 0.00 H new ATOM 0 HE1 HIS B 23 150.478 19.707 1.842 1.00 0.00 H new ATOM 0 HE2 HIS B 23 149.890 17.296 1.203 1.00 0.00 H new ATOM 2101 N THR B 24 147.486 15.250 6.808 1.00 0.00 N ATOM 2102 CA THR B 24 146.835 13.938 6.562 1.00 0.00 C ATOM 2103 C THR B 24 145.504 14.224 5.832 1.00 0.00 C ATOM 2104 O THR B 24 145.085 13.476 4.958 1.00 0.00 O ATOM 2105 CB THR B 24 146.566 13.237 7.917 1.00 0.00 C ATOM 2106 OG1 THR B 24 147.707 13.362 8.786 1.00 0.00 O ATOM 2107 CG2 THR B 24 146.269 11.754 7.693 1.00 0.00 C ATOM 0 H THR B 24 147.842 15.380 7.755 1.00 0.00 H new ATOM 0 HA THR B 24 147.468 13.285 5.960 1.00 0.00 H new ATOM 0 HB THR B 24 145.705 13.717 8.383 1.00 0.00 H new ATOM 0 HG1 THR B 24 147.520 12.915 9.638 1.00 0.00 H new ATOM 0 HG21 THR B 24 146.082 11.272 8.652 1.00 0.00 H new ATOM 0 HG22 THR B 24 145.390 11.651 7.057 1.00 0.00 H new ATOM 0 HG23 THR B 24 147.124 11.281 7.210 1.00 0.00 H new ATOM 2115 N GLU B 25 144.929 15.383 6.085 1.00 0.00 N ATOM 2116 CA GLU B 25 143.742 15.858 5.336 1.00 0.00 C ATOM 2117 C GLU B 25 143.953 15.558 3.855 1.00 0.00 C ATOM 2118 O GLU B 25 143.216 14.802 3.246 1.00 0.00 O ATOM 2119 CB GLU B 25 143.686 17.405 5.532 1.00 0.00 C ATOM 2120 CG GLU B 25 142.762 18.079 4.483 1.00 0.00 C ATOM 2121 CD GLU B 25 143.573 18.574 3.291 1.00 0.00 C ATOM 2122 OE1 GLU B 25 144.714 18.943 3.479 1.00 0.00 O ATOM 2123 OE2 GLU B 25 143.058 18.574 2.212 1.00 0.00 O ATOM 0 H GLU B 25 145.254 16.029 6.804 1.00 0.00 H new ATOM 0 HA GLU B 25 142.826 15.377 5.680 1.00 0.00 H new ATOM 0 HB2 GLU B 25 143.326 17.633 6.535 1.00 0.00 H new ATOM 0 HB3 GLU B 25 144.691 17.819 5.453 1.00 0.00 H new ATOM 0 HG2 GLU B 25 142.007 17.369 4.146 1.00 0.00 H new ATOM 0 HG3 GLU B 25 142.232 18.914 4.941 1.00 0.00 H new ATOM 2130 N SER B 26 144.895 16.219 3.261 1.00 0.00 N ATOM 2131 CA SER B 26 145.152 16.065 1.816 1.00 0.00 C ATOM 2132 C SER B 26 145.168 14.589 1.448 1.00 0.00 C ATOM 2133 O SER B 26 144.617 14.192 0.443 1.00 0.00 O ATOM 2134 CB SER B 26 146.502 16.697 1.486 1.00 0.00 C ATOM 2135 OG SER B 26 146.501 18.085 1.902 1.00 0.00 O ATOM 0 H SER B 26 145.514 16.878 3.732 1.00 0.00 H new ATOM 0 HA SER B 26 144.365 16.559 1.247 1.00 0.00 H new ATOM 0 HB2 SER B 26 147.302 16.156 1.991 1.00 0.00 H new ATOM 0 HB3 SER B 26 146.696 16.627 0.416 1.00 0.00 H new ATOM 0 HG SER B 26 145.909 18.194 2.676 1.00 0.00 H new ATOM 2141 N LEU B 27 145.707 13.761 2.297 1.00 0.00 N ATOM 2142 CA LEU B 27 145.713 12.315 2.007 1.00 0.00 C ATOM 2143 C LEU B 27 144.274 11.808 1.997 1.00 0.00 C ATOM 2144 O LEU B 27 143.892 11.031 1.142 1.00 0.00 O ATOM 2145 CB LEU B 27 146.529 11.575 3.057 1.00 0.00 C ATOM 2146 CG LEU B 27 148.030 11.846 2.873 1.00 0.00 C ATOM 2147 CD1 LEU B 27 148.797 11.287 4.074 1.00 0.00 C ATOM 2148 CD2 LEU B 27 148.534 11.169 1.591 1.00 0.00 C ATOM 0 H LEU B 27 146.143 14.031 3.179 1.00 0.00 H new ATOM 0 HA LEU B 27 146.168 12.136 1.033 1.00 0.00 H new ATOM 0 HB2 LEU B 27 146.218 11.889 4.053 1.00 0.00 H new ATOM 0 HB3 LEU B 27 146.337 10.504 2.985 1.00 0.00 H new ATOM 0 HG LEU B 27 148.191 12.921 2.797 1.00 0.00 H new ATOM 0 HD11 LEU B 27 149.863 11.478 3.946 1.00 0.00 H new ATOM 0 HD12 LEU B 27 148.448 11.772 4.986 1.00 0.00 H new ATOM 0 HD13 LEU B 27 148.627 10.213 4.146 1.00 0.00 H new ATOM 0 HD21 LEU B 27 149.599 11.367 1.469 1.00 0.00 H new ATOM 0 HD22 LEU B 27 148.370 10.094 1.659 1.00 0.00 H new ATOM 0 HD23 LEU B 27 147.991 11.565 0.733 1.00 0.00 H new ATOM 2160 N GLN B 28 143.453 12.263 2.906 1.00 0.00 N ATOM 2161 CA GLN B 28 142.029 11.816 2.872 1.00 0.00 C ATOM 2162 C GLN B 28 141.320 12.547 1.755 1.00 0.00 C ATOM 2163 O GLN B 28 140.372 12.026 1.176 1.00 0.00 O ATOM 2164 CB GLN B 28 141.246 12.024 4.193 1.00 0.00 C ATOM 2165 CG GLN B 28 142.138 12.506 5.329 1.00 0.00 C ATOM 2166 CD GLN B 28 142.924 11.332 5.837 1.00 0.00 C ATOM 2167 OE1 GLN B 28 144.163 11.245 5.580 1.00 0.00 O flip ATOM 2168 NE2 GLN B 28 142.383 10.458 6.468 1.00 0.00 N flip ATOM 0 H GLN B 28 143.698 12.910 3.655 1.00 0.00 H new ATOM 0 HA GLN B 28 142.053 10.738 2.712 1.00 0.00 H new ATOM 0 HB2 GLN B 28 140.449 12.749 4.029 1.00 0.00 H new ATOM 0 HB3 GLN B 28 140.770 11.087 4.481 1.00 0.00 H new ATOM 0 HG2 GLN B 28 142.809 13.290 4.979 1.00 0.00 H new ATOM 0 HG3 GLN B 28 141.536 12.936 6.129 1.00 0.00 H new ATOM 0 HE21 GLN B 28 141.387 10.522 6.678 1.00 0.00 H new ATOM 0 HE22 GLN B 28 142.922 9.655 6.792 1.00 0.00 H new ATOM 2177 N ASN B 29 141.737 13.748 1.451 1.00 0.00 N ATOM 2178 CA ASN B 29 141.041 14.524 0.384 1.00 0.00 C ATOM 2179 C ASN B 29 141.449 13.992 -0.985 1.00 0.00 C ATOM 2180 O ASN B 29 140.850 14.343 -1.993 1.00 0.00 O ATOM 2181 CB ASN B 29 141.329 16.016 0.493 1.00 0.00 C ATOM 2182 CG ASN B 29 140.293 16.694 1.377 1.00 0.00 C ATOM 2183 OD1 ASN B 29 139.119 16.431 1.267 1.00 0.00 O ATOM 2184 ND2 ASN B 29 140.664 17.566 2.235 1.00 0.00 N ATOM 0 H ASN B 29 142.525 14.222 1.893 1.00 0.00 H new ATOM 0 HA ASN B 29 139.966 14.396 0.513 1.00 0.00 H new ATOM 0 HB2 ASN B 29 142.326 16.171 0.906 1.00 0.00 H new ATOM 0 HB3 ASN B 29 141.321 16.468 -0.499 1.00 0.00 H new ATOM 0 HD21 ASN B 29 139.971 18.033 2.820 1.00 0.00 H new ATOM 0 HD22 ASN B 29 141.653 17.795 2.335 1.00 0.00 H new ATOM 2191 N MET B 30 142.403 13.104 -1.030 1.00 0.00 N ATOM 2192 CA MET B 30 142.791 12.470 -2.300 1.00 0.00 C ATOM 2193 C MET B 30 141.903 11.253 -2.461 1.00 0.00 C ATOM 2194 O MET B 30 141.341 10.781 -1.493 1.00 0.00 O ATOM 2195 CB MET B 30 144.255 12.011 -2.215 1.00 0.00 C ATOM 2196 CG MET B 30 145.190 13.224 -2.365 1.00 0.00 C ATOM 2197 SD MET B 30 146.789 12.882 -1.570 1.00 0.00 S ATOM 2198 CE MET B 30 147.088 11.255 -2.301 1.00 0.00 C ATOM 0 H MET B 30 142.935 12.791 -0.218 1.00 0.00 H new ATOM 0 HA MET B 30 142.685 13.161 -3.136 1.00 0.00 H new ATOM 0 HB2 MET B 30 144.436 11.516 -1.261 1.00 0.00 H new ATOM 0 HB3 MET B 30 144.463 11.281 -2.997 1.00 0.00 H new ATOM 0 HG2 MET B 30 145.341 13.449 -3.421 1.00 0.00 H new ATOM 0 HG3 MET B 30 144.732 14.104 -1.914 1.00 0.00 H new ATOM 0 HE1 MET B 30 148.045 10.869 -1.950 1.00 0.00 H new ATOM 0 HE2 MET B 30 146.291 10.572 -2.006 1.00 0.00 H new ATOM 0 HE3 MET B 30 147.108 11.342 -3.387 1.00 0.00 H new ATOM 2208 N SER B 31 141.731 10.756 -3.635 1.00 0.00 N ATOM 2209 CA SER B 31 140.810 9.592 -3.794 1.00 0.00 C ATOM 2210 C SER B 31 141.585 8.281 -3.595 1.00 0.00 C ATOM 2211 O SER B 31 142.812 8.248 -3.596 1.00 0.00 O ATOM 2212 CB SER B 31 140.181 9.619 -5.190 1.00 0.00 C ATOM 2213 OG SER B 31 140.381 10.916 -5.795 1.00 0.00 O ATOM 0 H SER B 31 142.176 11.090 -4.490 1.00 0.00 H new ATOM 0 HA SER B 31 140.021 9.654 -3.044 1.00 0.00 H new ATOM 0 HB2 SER B 31 140.627 8.844 -5.814 1.00 0.00 H new ATOM 0 HB3 SER B 31 139.115 9.400 -5.122 1.00 0.00 H new ATOM 0 HG SER B 31 140.476 10.813 -6.765 1.00 0.00 H new ATOM 2219 N LYS B 32 140.880 7.216 -3.379 1.00 0.00 N ATOM 2220 CA LYS B 32 141.526 5.895 -3.119 1.00 0.00 C ATOM 2221 C LYS B 32 142.383 5.501 -4.322 1.00 0.00 C ATOM 2222 O LYS B 32 143.541 5.156 -4.179 1.00 0.00 O ATOM 2223 CB LYS B 32 140.441 4.831 -2.865 1.00 0.00 C ATOM 2224 CG LYS B 32 141.019 3.613 -2.117 1.00 0.00 C ATOM 2225 CD LYS B 32 140.514 3.603 -0.679 1.00 0.00 C ATOM 2226 CE LYS B 32 140.353 2.163 -0.173 1.00 0.00 C ATOM 2227 NZ LYS B 32 139.245 1.472 -0.875 1.00 0.00 N ATOM 0 H LYS B 32 139.860 7.198 -3.370 1.00 0.00 H new ATOM 0 HA LYS B 32 142.164 5.966 -2.238 1.00 0.00 H new ATOM 0 HB2 LYS B 32 139.629 5.267 -2.283 1.00 0.00 H new ATOM 0 HB3 LYS B 32 140.014 4.509 -3.815 1.00 0.00 H new ATOM 0 HG2 LYS B 32 140.726 2.692 -2.621 1.00 0.00 H new ATOM 0 HG3 LYS B 32 142.108 3.650 -2.129 1.00 0.00 H new ATOM 0 HD2 LYS B 32 141.212 4.143 -0.039 1.00 0.00 H new ATOM 0 HD3 LYS B 32 139.558 4.124 -0.620 1.00 0.00 H new ATOM 0 HE2 LYS B 32 141.283 1.615 -0.325 1.00 0.00 H new ATOM 0 HE3 LYS B 32 140.160 2.171 0.900 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 139.551 0.518 -1.153 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 138.423 1.401 -0.241 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 138.982 2.012 -1.724 1.00 0.00 H new ATOM 2241 N GLN B 33 141.836 5.552 -5.487 1.00 0.00 N ATOM 2242 CA GLN B 33 142.594 5.139 -6.692 1.00 0.00 C ATOM 2243 C GLN B 33 143.864 5.978 -6.849 1.00 0.00 C ATOM 2244 O GLN B 33 144.846 5.518 -7.410 1.00 0.00 O ATOM 2245 CB GLN B 33 141.705 5.276 -7.930 1.00 0.00 C ATOM 2246 CG GLN B 33 140.462 4.370 -7.788 1.00 0.00 C ATOM 2247 CD GLN B 33 139.320 5.145 -7.132 1.00 0.00 C ATOM 2248 OE1 GLN B 33 139.467 5.651 -6.029 1.00 0.00 O ATOM 2249 NE2 GLN B 33 138.201 5.273 -7.743 1.00 0.00 N ATOM 0 H GLN B 33 140.882 5.866 -5.665 1.00 0.00 H new ATOM 0 HA GLN B 33 142.892 4.097 -6.580 1.00 0.00 H new ATOM 0 HB2 GLN B 33 141.397 6.314 -8.054 1.00 0.00 H new ATOM 0 HB3 GLN B 33 142.266 5.001 -8.823 1.00 0.00 H new ATOM 0 HG2 GLN B 33 140.151 4.009 -8.769 1.00 0.00 H new ATOM 0 HG3 GLN B 33 140.708 3.493 -7.189 1.00 0.00 H new ATOM 0 HE21 GLN B 33 138.072 4.853 -8.664 1.00 0.00 H new ATOM 0 HE22 GLN B 33 137.440 5.795 -7.309 1.00 0.00 H new ATOM 2258 N GLU B 34 143.874 7.190 -6.368 1.00 0.00 N ATOM 2259 CA GLU B 34 145.098 8.007 -6.491 1.00 0.00 C ATOM 2260 C GLU B 34 146.092 7.494 -5.468 1.00 0.00 C ATOM 2261 O GLU B 34 147.135 6.966 -5.814 1.00 0.00 O ATOM 2262 CB GLU B 34 144.797 9.505 -6.213 1.00 0.00 C ATOM 2263 CG GLU B 34 143.285 9.841 -6.301 1.00 0.00 C ATOM 2264 CD GLU B 34 142.695 9.585 -7.679 1.00 0.00 C ATOM 2265 OE1 GLU B 34 143.312 8.952 -8.493 1.00 0.00 O ATOM 2266 OE2 GLU B 34 141.616 10.038 -7.897 1.00 0.00 O ATOM 0 H GLU B 34 143.089 7.642 -5.899 1.00 0.00 H new ATOM 0 HA GLU B 34 145.494 7.928 -7.503 1.00 0.00 H new ATOM 0 HB2 GLU B 34 145.166 9.767 -5.221 1.00 0.00 H new ATOM 0 HB3 GLU B 34 145.343 10.119 -6.929 1.00 0.00 H new ATOM 0 HG2 GLU B 34 142.744 9.247 -5.565 1.00 0.00 H new ATOM 0 HG3 GLU B 34 143.136 10.888 -6.038 1.00 0.00 H new ATOM 2273 N LEU B 35 145.732 7.595 -4.198 1.00 0.00 N ATOM 2274 CA LEU B 35 146.608 7.095 -3.079 1.00 0.00 C ATOM 2275 C LEU B 35 147.183 5.749 -3.463 1.00 0.00 C ATOM 2276 O LEU B 35 148.308 5.408 -3.120 1.00 0.00 O ATOM 2277 CB LEU B 35 145.759 6.895 -1.812 1.00 0.00 C ATOM 2278 CG LEU B 35 145.293 8.244 -1.249 1.00 0.00 C ATOM 2279 CD1 LEU B 35 143.994 8.056 -0.467 1.00 0.00 C ATOM 2280 CD2 LEU B 35 146.363 8.805 -0.313 1.00 0.00 C ATOM 0 H LEU B 35 144.853 8.010 -3.889 1.00 0.00 H new ATOM 0 HA LEU B 35 147.402 7.819 -2.897 1.00 0.00 H new ATOM 0 HB2 LEU B 35 144.894 6.274 -2.043 1.00 0.00 H new ATOM 0 HB3 LEU B 35 146.341 6.363 -1.059 1.00 0.00 H new ATOM 0 HG LEU B 35 145.126 8.936 -2.074 1.00 0.00 H new ATOM 0 HD11 LEU B 35 143.667 9.016 -0.069 1.00 0.00 H new ATOM 0 HD12 LEU B 35 143.225 7.657 -1.129 1.00 0.00 H new ATOM 0 HD13 LEU B 35 144.162 7.361 0.355 1.00 0.00 H new ATOM 0 HD21 LEU B 35 146.031 9.763 0.086 1.00 0.00 H new ATOM 0 HD22 LEU B 35 146.530 8.108 0.508 1.00 0.00 H new ATOM 0 HD23 LEU B 35 147.292 8.944 -0.865 1.00 0.00 H new ATOM 2292 N ILE B 36 146.412 4.962 -4.111 1.00 0.00 N ATOM 2293 CA ILE B 36 146.884 3.638 -4.495 1.00 0.00 C ATOM 2294 C ILE B 36 147.875 3.779 -5.642 1.00 0.00 C ATOM 2295 O ILE B 36 148.968 3.241 -5.594 1.00 0.00 O ATOM 2296 CB ILE B 36 145.681 2.800 -4.913 1.00 0.00 C ATOM 2297 CG1 ILE B 36 144.782 2.590 -3.674 1.00 0.00 C ATOM 2298 CG2 ILE B 36 146.158 1.444 -5.449 1.00 0.00 C ATOM 2299 CD1 ILE B 36 143.404 2.094 -4.093 1.00 0.00 C ATOM 0 H ILE B 36 145.458 5.184 -4.396 1.00 0.00 H new ATOM 0 HA ILE B 36 147.387 3.146 -3.663 1.00 0.00 H new ATOM 0 HB ILE B 36 145.121 3.308 -5.698 1.00 0.00 H new ATOM 0 HG12 ILE B 36 145.245 1.870 -2.999 1.00 0.00 H new ATOM 0 HG13 ILE B 36 144.686 3.526 -3.124 1.00 0.00 H new ATOM 0 HG21 ILE B 36 145.296 0.847 -5.747 1.00 0.00 H new ATOM 0 HG22 ILE B 36 146.806 1.601 -6.311 1.00 0.00 H new ATOM 0 HG23 ILE B 36 146.711 0.919 -4.670 1.00 0.00 H new ATOM 0 HD11 ILE B 36 142.784 1.951 -3.208 1.00 0.00 H new ATOM 0 HD12 ILE B 36 142.937 2.829 -4.749 1.00 0.00 H new ATOM 0 HD13 ILE B 36 143.504 1.146 -4.622 1.00 0.00 H new ATOM 2311 N LYS B 37 147.533 4.524 -6.653 1.00 0.00 N ATOM 2312 CA LYS B 37 148.469 4.718 -7.784 1.00 0.00 C ATOM 2313 C LYS B 37 149.784 5.252 -7.253 1.00 0.00 C ATOM 2314 O LYS B 37 150.863 4.718 -7.567 1.00 0.00 O ATOM 2315 CB LYS B 37 147.867 5.701 -8.782 1.00 0.00 C ATOM 2316 CG LYS B 37 146.979 4.932 -9.773 1.00 0.00 C ATOM 2317 CD LYS B 37 147.131 5.527 -11.181 1.00 0.00 C ATOM 2318 CE LYS B 37 146.414 4.632 -12.204 1.00 0.00 C ATOM 2319 NZ LYS B 37 146.599 3.202 -11.837 1.00 0.00 N ATOM 0 H LYS B 37 146.640 5.008 -6.742 1.00 0.00 H new ATOM 0 HA LYS B 37 148.644 3.768 -8.288 1.00 0.00 H new ATOM 0 HB2 LYS B 37 147.280 6.456 -8.259 1.00 0.00 H new ATOM 0 HB3 LYS B 37 148.659 6.227 -9.316 1.00 0.00 H new ATOM 0 HG2 LYS B 37 147.257 3.878 -9.782 1.00 0.00 H new ATOM 0 HG3 LYS B 37 145.937 4.984 -9.457 1.00 0.00 H new ATOM 0 HD2 LYS B 37 146.713 6.533 -11.208 1.00 0.00 H new ATOM 0 HD3 LYS B 37 148.187 5.614 -11.437 1.00 0.00 H new ATOM 0 HE2 LYS B 37 145.352 4.875 -12.233 1.00 0.00 H new ATOM 0 HE3 LYS B 37 146.810 4.815 -13.203 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 146.358 2.601 -12.651 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 147.590 3.038 -11.567 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 145.979 2.966 -11.036 1.00 0.00 H new ATOM 2333 N GLU B 38 149.740 6.286 -6.457 1.00 0.00 N ATOM 2334 CA GLU B 38 151.002 6.806 -5.922 1.00 0.00 C ATOM 2335 C GLU B 38 151.723 5.716 -5.135 1.00 0.00 C ATOM 2336 O GLU B 38 152.933 5.643 -5.178 1.00 0.00 O ATOM 2337 CB GLU B 38 150.821 8.100 -5.109 1.00 0.00 C ATOM 2338 CG GLU B 38 149.547 8.129 -4.271 1.00 0.00 C ATOM 2339 CD GLU B 38 148.962 9.510 -4.382 1.00 0.00 C ATOM 2340 OE1 GLU B 38 149.576 10.425 -3.872 1.00 0.00 O ATOM 2341 OE2 GLU B 38 147.957 9.653 -5.004 1.00 0.00 O ATOM 0 H GLU B 38 148.895 6.777 -6.166 1.00 0.00 H new ATOM 0 HA GLU B 38 151.631 7.090 -6.766 1.00 0.00 H new ATOM 0 HB2 GLU B 38 151.680 8.227 -4.451 1.00 0.00 H new ATOM 0 HB3 GLU B 38 150.814 8.949 -5.792 1.00 0.00 H new ATOM 0 HG2 GLU B 38 148.837 7.383 -4.627 1.00 0.00 H new ATOM 0 HG3 GLU B 38 149.767 7.889 -3.231 1.00 0.00 H new ATOM 2348 N TYR B 39 150.999 4.800 -4.513 1.00 0.00 N ATOM 2349 CA TYR B 39 151.677 3.648 -3.839 1.00 0.00 C ATOM 2350 C TYR B 39 152.431 2.821 -4.820 1.00 0.00 C ATOM 2351 O TYR B 39 153.512 2.372 -4.541 1.00 0.00 O ATOM 2352 CB TYR B 39 150.696 2.728 -3.078 1.00 0.00 C ATOM 2353 CG TYR B 39 150.580 3.129 -1.631 1.00 0.00 C ATOM 2354 CD1 TYR B 39 151.743 3.180 -0.852 1.00 0.00 C ATOM 2355 CD2 TYR B 39 149.338 3.402 -1.052 1.00 0.00 C ATOM 2356 CE1 TYR B 39 151.669 3.511 0.485 1.00 0.00 C ATOM 2357 CE2 TYR B 39 149.272 3.730 0.303 1.00 0.00 C ATOM 2358 CZ TYR B 39 150.446 3.786 1.064 1.00 0.00 C ATOM 2359 OH TYR B 39 150.399 4.105 2.381 1.00 0.00 O ATOM 0 H TYR B 39 149.981 4.806 -4.447 1.00 0.00 H new ATOM 0 HA TYR B 39 152.358 4.095 -3.115 1.00 0.00 H new ATOM 0 HB2 TYR B 39 149.714 2.771 -3.549 1.00 0.00 H new ATOM 0 HB3 TYR B 39 151.037 1.695 -3.145 1.00 0.00 H new ATOM 0 HD1 TYR B 39 152.701 2.959 -1.300 1.00 0.00 H new ATOM 0 HD2 TYR B 39 148.438 3.360 -1.647 1.00 0.00 H new ATOM 0 HE1 TYR B 39 152.569 3.555 1.080 1.00 0.00 H new ATOM 0 HE2 TYR B 39 148.318 3.940 0.763 1.00 0.00 H new ATOM 0 HH TYR B 39 149.778 4.851 2.515 1.00 0.00 H new ATOM 2369 N LEU B 40 151.890 2.590 -5.957 1.00 0.00 N ATOM 2370 CA LEU B 40 152.611 1.737 -6.926 1.00 0.00 C ATOM 2371 C LEU B 40 153.939 2.390 -7.255 1.00 0.00 C ATOM 2372 O LEU B 40 154.946 1.727 -7.365 1.00 0.00 O ATOM 2373 CB LEU B 40 151.762 1.528 -8.184 1.00 0.00 C ATOM 2374 CG LEU B 40 150.295 1.243 -7.778 1.00 0.00 C ATOM 2375 CD1 LEU B 40 149.486 0.828 -8.995 1.00 0.00 C ATOM 2376 CD2 LEU B 40 150.235 0.126 -6.723 1.00 0.00 C ATOM 0 H LEU B 40 150.986 2.947 -6.266 1.00 0.00 H new ATOM 0 HA LEU B 40 152.798 0.754 -6.494 1.00 0.00 H new ATOM 0 HB2 LEU B 40 151.809 2.413 -8.818 1.00 0.00 H new ATOM 0 HB3 LEU B 40 152.157 0.696 -8.768 1.00 0.00 H new ATOM 0 HG LEU B 40 149.874 2.156 -7.356 1.00 0.00 H new ATOM 0 HD11 LEU B 40 148.456 0.630 -8.697 1.00 0.00 H new ATOM 0 HD12 LEU B 40 149.503 1.629 -9.734 1.00 0.00 H new ATOM 0 HD13 LEU B 40 149.918 -0.074 -9.429 1.00 0.00 H new ATOM 0 HD21 LEU B 40 149.197 -0.061 -6.450 1.00 0.00 H new ATOM 0 HD22 LEU B 40 150.672 -0.785 -7.132 1.00 0.00 H new ATOM 0 HD23 LEU B 40 150.794 0.431 -5.838 1.00 0.00 H new ATOM 2388 N GLU B 41 153.971 3.688 -7.328 1.00 0.00 N ATOM 2389 CA GLU B 41 155.279 4.373 -7.566 1.00 0.00 C ATOM 2390 C GLU B 41 156.074 4.330 -6.267 1.00 0.00 C ATOM 2391 O GLU B 41 157.195 3.866 -6.217 1.00 0.00 O ATOM 2392 CB GLU B 41 155.070 5.851 -7.946 1.00 0.00 C ATOM 2393 CG GLU B 41 153.762 6.054 -8.721 1.00 0.00 C ATOM 2394 CD GLU B 41 153.555 7.523 -8.990 1.00 0.00 C ATOM 2395 OE1 GLU B 41 153.904 8.322 -8.156 1.00 0.00 O ATOM 2396 OE2 GLU B 41 153.047 7.837 -10.018 1.00 0.00 O ATOM 0 H GLU B 41 153.162 4.303 -7.235 1.00 0.00 H new ATOM 0 HA GLU B 41 155.799 3.869 -8.381 1.00 0.00 H new ATOM 0 HB2 GLU B 41 155.057 6.461 -7.043 1.00 0.00 H new ATOM 0 HB3 GLU B 41 155.909 6.194 -8.551 1.00 0.00 H new ATOM 0 HG2 GLU B 41 153.796 5.503 -9.661 1.00 0.00 H new ATOM 0 HG3 GLU B 41 152.923 5.657 -8.149 1.00 0.00 H new ATOM 2403 N LEU B 42 155.498 4.875 -5.235 1.00 0.00 N ATOM 2404 CA LEU B 42 156.146 4.976 -3.903 1.00 0.00 C ATOM 2405 C LEU B 42 156.803 3.636 -3.593 1.00 0.00 C ATOM 2406 O LEU B 42 157.986 3.552 -3.287 1.00 0.00 O ATOM 2407 CB LEU B 42 155.035 5.243 -2.862 1.00 0.00 C ATOM 2408 CG LEU B 42 155.534 6.092 -1.681 1.00 0.00 C ATOM 2409 CD1 LEU B 42 156.965 5.743 -1.293 1.00 0.00 C ATOM 2410 CD2 LEU B 42 155.460 7.565 -2.052 1.00 0.00 C ATOM 0 H LEU B 42 154.559 5.273 -5.265 1.00 0.00 H new ATOM 0 HA LEU B 42 156.890 5.772 -3.882 1.00 0.00 H new ATOM 0 HB2 LEU B 42 154.201 5.752 -3.346 1.00 0.00 H new ATOM 0 HB3 LEU B 42 154.654 4.292 -2.488 1.00 0.00 H new ATOM 0 HG LEU B 42 154.894 5.880 -0.825 1.00 0.00 H new ATOM 0 HD11 LEU B 42 157.277 6.366 -0.455 1.00 0.00 H new ATOM 0 HD12 LEU B 42 157.018 4.693 -1.004 1.00 0.00 H new ATOM 0 HD13 LEU B 42 157.625 5.919 -2.142 1.00 0.00 H new ATOM 0 HD21 LEU B 42 155.813 8.169 -1.216 1.00 0.00 H new ATOM 0 HD22 LEU B 42 156.085 7.752 -2.925 1.00 0.00 H new ATOM 0 HD23 LEU B 42 154.428 7.831 -2.281 1.00 0.00 H new ATOM 2422 N GLU B 43 156.028 2.600 -3.655 1.00 0.00 N ATOM 2423 CA GLU B 43 156.532 1.242 -3.369 1.00 0.00 C ATOM 2424 C GLU B 43 157.668 0.916 -4.327 1.00 0.00 C ATOM 2425 O GLU B 43 158.727 0.497 -3.905 1.00 0.00 O ATOM 2426 CB GLU B 43 155.390 0.222 -3.523 1.00 0.00 C ATOM 2427 CG GLU B 43 154.365 0.411 -2.376 1.00 0.00 C ATOM 2428 CD GLU B 43 154.265 -0.859 -1.553 1.00 0.00 C ATOM 2429 OE1 GLU B 43 154.044 -1.906 -2.128 1.00 0.00 O ATOM 2430 OE2 GLU B 43 154.421 -0.781 -0.367 1.00 0.00 O ATOM 0 H GLU B 43 155.038 2.641 -3.899 1.00 0.00 H new ATOM 0 HA GLU B 43 156.905 1.195 -2.346 1.00 0.00 H new ATOM 0 HB2 GLU B 43 154.900 0.353 -4.488 1.00 0.00 H new ATOM 0 HB3 GLU B 43 155.790 -0.792 -3.504 1.00 0.00 H new ATOM 0 HG2 GLU B 43 154.668 1.243 -1.740 1.00 0.00 H new ATOM 0 HG3 GLU B 43 153.388 0.664 -2.788 1.00 0.00 H new ATOM 2437 N LYS B 44 157.480 1.108 -5.610 1.00 0.00 N ATOM 2438 CA LYS B 44 158.577 0.821 -6.566 1.00 0.00 C ATOM 2439 C LYS B 44 159.825 1.549 -6.085 1.00 0.00 C ATOM 2440 O LYS B 44 160.901 0.976 -5.968 1.00 0.00 O ATOM 2441 CB LYS B 44 158.210 1.367 -7.944 1.00 0.00 C ATOM 2442 CG LYS B 44 157.077 0.551 -8.584 1.00 0.00 C ATOM 2443 CD LYS B 44 157.664 -0.468 -9.576 1.00 0.00 C ATOM 2444 CE LYS B 44 156.542 -1.248 -10.295 1.00 0.00 C ATOM 2445 NZ LYS B 44 155.201 -0.878 -9.760 1.00 0.00 N ATOM 0 H LYS B 44 156.615 1.450 -6.029 1.00 0.00 H new ATOM 0 HA LYS B 44 158.745 -0.254 -6.627 1.00 0.00 H new ATOM 0 HB2 LYS B 44 157.905 2.410 -7.855 1.00 0.00 H new ATOM 0 HB3 LYS B 44 159.087 1.346 -8.591 1.00 0.00 H new ATOM 0 HG2 LYS B 44 156.508 0.034 -7.812 1.00 0.00 H new ATOM 0 HG3 LYS B 44 156.384 1.216 -9.099 1.00 0.00 H new ATOM 0 HD2 LYS B 44 158.282 0.048 -10.311 1.00 0.00 H new ATOM 0 HD3 LYS B 44 158.314 -1.164 -9.046 1.00 0.00 H new ATOM 0 HE2 LYS B 44 156.580 -1.041 -11.365 1.00 0.00 H new ATOM 0 HE3 LYS B 44 156.703 -2.319 -10.171 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 154.468 -1.430 -10.249 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 155.165 -1.082 -8.741 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 155.033 0.136 -9.916 1.00 0.00 H new ATOM 2459 N CYS B 45 159.679 2.807 -5.800 1.00 0.00 N ATOM 2460 CA CYS B 45 160.814 3.616 -5.337 1.00 0.00 C ATOM 2461 C CYS B 45 161.390 3.012 -4.071 1.00 0.00 C ATOM 2462 O CYS B 45 162.519 2.589 -4.048 1.00 0.00 O ATOM 2463 CB CYS B 45 160.343 5.045 -5.068 1.00 0.00 C ATOM 2464 SG CYS B 45 159.368 5.642 -6.471 1.00 0.00 S ATOM 0 H CYS B 45 158.797 3.313 -5.873 1.00 0.00 H new ATOM 0 HA CYS B 45 161.588 3.632 -6.105 1.00 0.00 H new ATOM 0 HB2 CYS B 45 159.744 5.075 -4.158 1.00 0.00 H new ATOM 0 HB3 CYS B 45 161.202 5.697 -4.906 1.00 0.00 H new ATOM 0 HG CYS B 45 158.423 4.790 -6.737 1.00 0.00 H new ATOM 2470 N LEU B 46 160.631 2.968 -3.011 1.00 0.00 N ATOM 2471 CA LEU B 46 161.172 2.408 -1.736 1.00 0.00 C ATOM 2472 C LEU B 46 161.755 1.026 -1.990 1.00 0.00 C ATOM 2473 O LEU B 46 162.718 0.659 -1.396 1.00 0.00 O ATOM 2474 CB LEU B 46 160.072 2.338 -0.659 1.00 0.00 C ATOM 2475 CG LEU B 46 160.687 1.932 0.710 1.00 0.00 C ATOM 2476 CD1 LEU B 46 161.988 2.688 0.980 1.00 0.00 C ATOM 2477 CD2 LEU B 46 159.714 2.247 1.833 1.00 0.00 C ATOM 0 H LEU B 46 159.665 3.293 -2.970 1.00 0.00 H new ATOM 0 HA LEU B 46 161.960 3.067 -1.370 1.00 0.00 H new ATOM 0 HB2 LEU B 46 159.577 3.305 -0.571 1.00 0.00 H new ATOM 0 HB3 LEU B 46 159.311 1.615 -0.953 1.00 0.00 H new ATOM 0 HG LEU B 46 160.893 0.862 0.671 1.00 0.00 H new ATOM 0 HD11 LEU B 46 162.393 2.382 1.945 1.00 0.00 H new ATOM 0 HD12 LEU B 46 162.710 2.462 0.195 1.00 0.00 H new ATOM 0 HD13 LEU B 46 161.790 3.760 0.993 1.00 0.00 H new ATOM 0 HD21 LEU B 46 160.154 1.959 2.788 1.00 0.00 H new ATOM 0 HD22 LEU B 46 159.500 3.316 1.840 1.00 0.00 H new ATOM 0 HD23 LEU B 46 158.788 1.693 1.678 1.00 0.00 H new ATOM 2489 N SER B 47 161.191 0.276 -2.877 1.00 0.00 N ATOM 2490 CA SER B 47 161.742 -1.068 -3.169 1.00 0.00 C ATOM 2491 C SER B 47 163.152 -0.911 -3.758 1.00 0.00 C ATOM 2492 O SER B 47 164.121 -1.447 -3.249 1.00 0.00 O ATOM 2493 CB SER B 47 160.821 -1.783 -4.153 1.00 0.00 C ATOM 2494 OG SER B 47 159.467 -1.721 -3.651 1.00 0.00 O ATOM 0 H SER B 47 160.366 0.534 -3.418 1.00 0.00 H new ATOM 0 HA SER B 47 161.805 -1.661 -2.257 1.00 0.00 H new ATOM 0 HB2 SER B 47 160.881 -1.315 -5.135 1.00 0.00 H new ATOM 0 HB3 SER B 47 161.131 -2.821 -4.275 1.00 0.00 H new ATOM 0 HG SER B 47 159.019 -0.930 -4.016 1.00 0.00 H new ATOM 2500 N ARG B 48 163.288 -0.121 -4.777 1.00 0.00 N ATOM 2501 CA ARG B 48 164.645 0.126 -5.345 1.00 0.00 C ATOM 2502 C ARG B 48 165.517 0.693 -4.233 1.00 0.00 C ATOM 2503 O ARG B 48 166.634 0.261 -3.992 1.00 0.00 O ATOM 2504 CB ARG B 48 164.528 1.174 -6.453 1.00 0.00 C ATOM 2505 CG ARG B 48 163.883 0.559 -7.693 1.00 0.00 C ATOM 2506 CD ARG B 48 163.884 1.598 -8.816 1.00 0.00 C ATOM 2507 NE ARG B 48 162.931 2.712 -8.487 1.00 0.00 N ATOM 2508 CZ ARG B 48 161.704 2.716 -8.978 1.00 0.00 C ATOM 2509 NH1 ARG B 48 161.246 1.658 -9.611 1.00 0.00 N ATOM 2510 NH2 ARG B 48 160.940 3.759 -8.801 1.00 0.00 N ATOM 0 H ARG B 48 162.524 0.366 -5.245 1.00 0.00 H new ATOM 0 HA ARG B 48 165.072 -0.794 -5.744 1.00 0.00 H new ATOM 0 HB2 ARG B 48 163.932 2.018 -6.104 1.00 0.00 H new ATOM 0 HB3 ARG B 48 165.515 1.562 -6.702 1.00 0.00 H new ATOM 0 HG2 ARG B 48 164.432 -0.331 -8.002 1.00 0.00 H new ATOM 0 HG3 ARG B 48 162.863 0.244 -7.471 1.00 0.00 H new ATOM 0 HD2 ARG B 48 164.889 1.997 -8.953 1.00 0.00 H new ATOM 0 HD3 ARG B 48 163.597 1.129 -9.757 1.00 0.00 H new ATOM 0 HE ARG B 48 163.234 3.473 -7.879 1.00 0.00 H new ATOM 0 HH11 ARG B 48 161.838 0.835 -9.723 1.00 0.00 H new ATOM 0 HH12 ARG B 48 160.299 1.661 -9.990 1.00 0.00 H new ATOM 0 HH21 ARG B 48 161.291 4.566 -8.286 1.00 0.00 H new ATOM 0 HH22 ARG B 48 159.992 3.767 -9.178 1.00 0.00 H new ATOM 2524 N MET B 49 165.005 1.672 -3.573 1.00 0.00 N ATOM 2525 CA MET B 49 165.736 2.341 -2.492 1.00 0.00 C ATOM 2526 C MET B 49 166.036 1.347 -1.388 1.00 0.00 C ATOM 2527 O MET B 49 166.934 1.561 -0.614 1.00 0.00 O ATOM 2528 CB MET B 49 164.873 3.472 -1.941 1.00 0.00 C ATOM 2529 CG MET B 49 164.466 4.408 -3.089 1.00 0.00 C ATOM 2530 SD MET B 49 165.762 5.615 -3.353 1.00 0.00 S ATOM 2531 CE MET B 49 165.240 6.773 -2.087 1.00 0.00 C ATOM 0 H MET B 49 164.073 2.049 -3.747 1.00 0.00 H new ATOM 0 HA MET B 49 166.675 2.743 -2.874 1.00 0.00 H new ATOM 0 HB2 MET B 49 163.985 3.064 -1.457 1.00 0.00 H new ATOM 0 HB3 MET B 49 165.423 4.028 -1.182 1.00 0.00 H new ATOM 0 HG2 MET B 49 164.297 3.834 -4.000 1.00 0.00 H new ATOM 0 HG3 MET B 49 163.528 4.910 -2.850 1.00 0.00 H new ATOM 0 HE1 MET B 49 166.046 7.479 -1.885 1.00 0.00 H new ATOM 0 HE2 MET B 49 164.360 7.316 -2.431 1.00 0.00 H new ATOM 0 HE3 MET B 49 164.997 6.229 -1.174 1.00 0.00 H new ATOM 2541 N GLU B 50 165.306 0.274 -1.310 1.00 0.00 N ATOM 2542 CA GLU B 50 165.566 -0.733 -0.263 1.00 0.00 C ATOM 2543 C GLU B 50 166.770 -1.510 -0.667 1.00 0.00 C ATOM 2544 O GLU B 50 167.720 -1.653 0.101 1.00 0.00 O ATOM 2545 CB GLU B 50 164.383 -1.664 -0.110 1.00 0.00 C ATOM 2546 CG GLU B 50 163.382 -1.095 0.901 1.00 0.00 C ATOM 2547 CD GLU B 50 163.290 -2.014 2.079 1.00 0.00 C ATOM 2548 OE1 GLU B 50 164.223 -2.055 2.847 1.00 0.00 O ATOM 2549 OE2 GLU B 50 162.290 -2.673 2.202 1.00 0.00 O ATOM 0 H GLU B 50 164.532 0.054 -1.937 1.00 0.00 H new ATOM 0 HA GLU B 50 165.728 -0.238 0.694 1.00 0.00 H new ATOM 0 HB2 GLU B 50 163.895 -1.804 -1.075 1.00 0.00 H new ATOM 0 HB3 GLU B 50 164.725 -2.645 0.220 1.00 0.00 H new ATOM 0 HG2 GLU B 50 163.698 -0.103 1.223 1.00 0.00 H new ATOM 0 HG3 GLU B 50 162.403 -0.982 0.436 1.00 0.00 H new ATOM 2556 N ASP B 51 166.782 -1.963 -1.884 1.00 0.00 N ATOM 2557 CA ASP B 51 167.960 -2.670 -2.385 1.00 0.00 C ATOM 2558 C ASP B 51 169.131 -1.724 -2.281 1.00 0.00 C ATOM 2559 O ASP B 51 170.108 -2.022 -1.632 1.00 0.00 O ATOM 2560 CB ASP B 51 167.745 -3.109 -3.842 1.00 0.00 C ATOM 2561 CG ASP B 51 167.143 -4.497 -3.868 1.00 0.00 C ATOM 2562 OD1 ASP B 51 167.899 -5.438 -3.807 1.00 0.00 O ATOM 2563 OD2 ASP B 51 165.943 -4.617 -3.955 1.00 0.00 O ATOM 0 H ASP B 51 166.015 -1.868 -2.550 1.00 0.00 H new ATOM 0 HA ASP B 51 168.145 -3.570 -1.799 1.00 0.00 H new ATOM 0 HB2 ASP B 51 167.086 -2.406 -4.351 1.00 0.00 H new ATOM 0 HB3 ASP B 51 168.694 -3.103 -4.379 1.00 0.00 H new ATOM 2568 N GLU B 52 169.022 -0.555 -2.856 1.00 0.00 N ATOM 2569 CA GLU B 52 170.133 0.433 -2.744 1.00 0.00 C ATOM 2570 C GLU B 52 170.495 0.615 -1.280 1.00 0.00 C ATOM 2571 O GLU B 52 171.610 0.407 -0.896 1.00 0.00 O ATOM 2572 CB GLU B 52 169.710 1.795 -3.313 1.00 0.00 C ATOM 2573 CG GLU B 52 169.311 1.671 -4.780 1.00 0.00 C ATOM 2574 CD GLU B 52 170.425 2.172 -5.665 1.00 0.00 C ATOM 2575 OE1 GLU B 52 170.813 3.304 -5.530 1.00 0.00 O ATOM 2576 OE2 GLU B 52 170.868 1.435 -6.493 1.00 0.00 O ATOM 0 H GLU B 52 168.215 -0.243 -3.396 1.00 0.00 H new ATOM 0 HA GLU B 52 170.986 0.058 -3.309 1.00 0.00 H new ATOM 0 HB2 GLU B 52 168.874 2.191 -2.737 1.00 0.00 H new ATOM 0 HB3 GLU B 52 170.530 2.506 -3.214 1.00 0.00 H new ATOM 0 HG2 GLU B 52 169.088 0.631 -5.017 1.00 0.00 H new ATOM 0 HG3 GLU B 52 168.402 2.243 -4.967 1.00 0.00 H new ATOM 2583 N ASN B 53 169.553 1.012 -0.459 1.00 0.00 N ATOM 2584 CA ASN B 53 169.853 1.243 0.986 1.00 0.00 C ATOM 2585 C ASN B 53 170.585 0.059 1.536 1.00 0.00 C ATOM 2586 O ASN B 53 171.529 0.191 2.294 1.00 0.00 O ATOM 2587 CB ASN B 53 168.546 1.432 1.767 1.00 0.00 C ATOM 2588 CG ASN B 53 168.196 2.908 1.797 1.00 0.00 C ATOM 2589 OD1 ASN B 53 168.603 3.623 2.683 1.00 0.00 O ATOM 2590 ND2 ASN B 53 167.473 3.400 0.873 1.00 0.00 N ATOM 0 H ASN B 53 168.585 1.186 -0.731 1.00 0.00 H new ATOM 0 HA ASN B 53 170.467 2.138 1.085 1.00 0.00 H new ATOM 0 HB2 ASN B 53 167.742 0.864 1.298 1.00 0.00 H new ATOM 0 HB3 ASN B 53 168.656 1.051 2.782 1.00 0.00 H new ATOM 0 HD21 ASN B 53 167.240 4.393 0.882 1.00 0.00 H new ATOM 0 HD22 ASN B 53 167.127 2.802 0.123 1.00 0.00 H new ATOM 2597 N ASN B 54 170.134 -1.105 1.190 1.00 0.00 N ATOM 2598 CA ASN B 54 170.761 -2.342 1.694 1.00 0.00 C ATOM 2599 C ASN B 54 172.172 -2.450 1.179 1.00 0.00 C ATOM 2600 O ASN B 54 173.116 -2.516 1.952 1.00 0.00 O ATOM 2601 CB ASN B 54 169.969 -3.563 1.222 1.00 0.00 C ATOM 2602 CG ASN B 54 168.897 -3.922 2.241 1.00 0.00 C ATOM 2603 OD1 ASN B 54 168.709 -3.232 3.232 1.00 0.00 O ATOM 2604 ND2 ASN B 54 168.186 -4.964 2.049 1.00 0.00 N ATOM 0 H ASN B 54 169.341 -1.252 0.566 1.00 0.00 H new ATOM 0 HA ASN B 54 170.767 -2.307 2.783 1.00 0.00 H new ATOM 0 HB2 ASN B 54 169.508 -3.355 0.257 1.00 0.00 H new ATOM 0 HB3 ASN B 54 170.642 -4.408 1.078 1.00 0.00 H new ATOM 0 HD21 ASN B 54 167.463 -5.219 2.722 1.00 0.00 H new ATOM 0 HD22 ASN B 54 168.341 -5.542 1.223 1.00 0.00 H new ATOM 2611 N ARG B 55 172.337 -2.456 -0.115 1.00 0.00 N ATOM 2612 CA ARG B 55 173.690 -2.574 -0.710 1.00 0.00 C ATOM 2613 C ARG B 55 174.520 -1.382 -0.269 1.00 0.00 C ATOM 2614 O ARG B 55 175.469 -1.515 0.465 1.00 0.00 O ATOM 2615 CB ARG B 55 173.589 -2.583 -2.261 1.00 0.00 C ATOM 2616 CG ARG B 55 172.535 -3.599 -2.760 1.00 0.00 C ATOM 2617 CD ARG B 55 172.899 -5.045 -2.361 1.00 0.00 C ATOM 2618 NE ARG B 55 171.877 -5.601 -1.391 1.00 0.00 N ATOM 2619 CZ ARG B 55 170.590 -5.711 -1.710 1.00 0.00 C ATOM 2620 NH1 ARG B 55 170.159 -5.248 -2.845 1.00 0.00 N ATOM 2621 NH2 ARG B 55 169.764 -6.279 -0.886 1.00 0.00 N ATOM 0 H ARG B 55 171.578 -2.383 -0.792 1.00 0.00 H new ATOM 0 HA ARG B 55 174.155 -3.502 -0.379 1.00 0.00 H new ATOM 0 HB2 ARG B 55 173.329 -1.585 -2.614 1.00 0.00 H new ATOM 0 HB3 ARG B 55 174.562 -2.829 -2.688 1.00 0.00 H new ATOM 0 HG2 ARG B 55 171.559 -3.343 -2.347 1.00 0.00 H new ATOM 0 HG3 ARG B 55 172.450 -3.532 -3.845 1.00 0.00 H new ATOM 0 HD2 ARG B 55 172.944 -5.673 -3.250 1.00 0.00 H new ATOM 0 HD3 ARG B 55 173.889 -5.065 -1.906 1.00 0.00 H new ATOM 0 HE ARG B 55 172.185 -5.900 -0.466 1.00 0.00 H new ATOM 0 HH11 ARG B 55 170.808 -4.800 -3.492 1.00 0.00 H new ATOM 0 HH12 ARG B 55 169.172 -5.333 -3.089 1.00 0.00 H new ATOM 0 HH21 ARG B 55 170.101 -6.641 0.006 1.00 0.00 H new ATOM 0 HH22 ARG B 55 168.777 -6.363 -1.130 1.00 0.00 H new ATOM 2635 N LEU B 56 174.153 -0.225 -0.724 1.00 0.00 N ATOM 2636 CA LEU B 56 174.869 1.031 -0.407 1.00 0.00 C ATOM 2637 C LEU B 56 175.420 1.023 0.988 1.00 0.00 C ATOM 2638 O LEU B 56 176.591 1.265 1.198 1.00 0.00 O ATOM 2639 CB LEU B 56 173.857 2.183 -0.482 1.00 0.00 C ATOM 2640 CG LEU B 56 173.592 2.558 -1.953 1.00 0.00 C ATOM 2641 CD1 LEU B 56 172.415 3.530 -2.028 1.00 0.00 C ATOM 2642 CD2 LEU B 56 174.837 3.235 -2.551 1.00 0.00 C ATOM 0 H LEU B 56 173.345 -0.095 -1.333 1.00 0.00 H new ATOM 0 HA LEU B 56 175.691 1.141 -1.114 1.00 0.00 H new ATOM 0 HB2 LEU B 56 172.925 1.891 0.001 1.00 0.00 H new ATOM 0 HB3 LEU B 56 174.238 3.049 0.059 1.00 0.00 H new ATOM 0 HG LEU B 56 173.362 1.653 -2.515 1.00 0.00 H new ATOM 0 HD11 LEU B 56 172.228 3.795 -3.069 1.00 0.00 H new ATOM 0 HD12 LEU B 56 171.526 3.059 -1.608 1.00 0.00 H new ATOM 0 HD13 LEU B 56 172.650 4.431 -1.461 1.00 0.00 H new ATOM 0 HD21 LEU B 56 174.644 3.498 -3.591 1.00 0.00 H new ATOM 0 HD22 LEU B 56 175.067 4.138 -1.985 1.00 0.00 H new ATOM 0 HD23 LEU B 56 175.683 2.550 -2.501 1.00 0.00 H new ATOM 2654 N ARG B 57 174.575 0.828 1.963 1.00 0.00 N ATOM 2655 CA ARG B 57 175.043 0.877 3.359 1.00 0.00 C ATOM 2656 C ARG B 57 176.084 -0.211 3.588 1.00 0.00 C ATOM 2657 O ARG B 57 177.045 0.001 4.278 1.00 0.00 O ATOM 2658 CB ARG B 57 173.868 0.719 4.348 1.00 0.00 C ATOM 2659 CG ARG B 57 173.234 2.099 4.653 1.00 0.00 C ATOM 2660 CD ARG B 57 174.179 2.917 5.568 1.00 0.00 C ATOM 2661 NE ARG B 57 173.611 4.288 5.830 1.00 0.00 N ATOM 2662 CZ ARG B 57 174.318 5.190 6.501 1.00 0.00 C ATOM 2663 NH1 ARG B 57 175.551 4.936 6.831 1.00 0.00 N ATOM 2664 NH2 ARG B 57 173.795 6.337 6.793 1.00 0.00 N ATOM 0 H ARG B 57 173.580 0.637 1.844 1.00 0.00 H new ATOM 0 HA ARG B 57 175.496 1.852 3.539 1.00 0.00 H new ATOM 0 HB2 ARG B 57 173.117 0.051 3.927 1.00 0.00 H new ATOM 0 HB3 ARG B 57 174.220 0.261 5.272 1.00 0.00 H new ATOM 0 HG2 ARG B 57 173.053 2.640 3.724 1.00 0.00 H new ATOM 0 HG3 ARG B 57 172.267 1.966 5.138 1.00 0.00 H new ATOM 0 HD2 ARG B 57 174.324 2.392 6.512 1.00 0.00 H new ATOM 0 HD3 ARG B 57 175.159 3.007 5.099 1.00 0.00 H new ATOM 0 HE ARG B 57 172.679 4.524 5.490 1.00 0.00 H new ATOM 0 HH11 ARG B 57 175.974 4.044 6.574 1.00 0.00 H new ATOM 0 HH12 ARG B 57 176.094 5.629 7.346 1.00 0.00 H new ATOM 0 HH21 ARG B 57 172.839 6.549 6.508 1.00 0.00 H new ATOM 0 HH22 ARG B 57 174.339 7.029 7.308 1.00 0.00 H new ATOM 2678 N LEU B 58 175.920 -1.361 3.011 1.00 0.00 N ATOM 2679 CA LEU B 58 176.916 -2.425 3.214 1.00 0.00 C ATOM 2680 C LEU B 58 178.183 -2.052 2.453 1.00 0.00 C ATOM 2681 O LEU B 58 179.283 -2.096 2.992 1.00 0.00 O ATOM 2682 CB LEU B 58 176.362 -3.749 2.741 1.00 0.00 C ATOM 2683 CG LEU B 58 175.134 -4.120 3.577 1.00 0.00 C ATOM 2684 CD1 LEU B 58 174.314 -5.207 2.871 1.00 0.00 C ATOM 2685 CD2 LEU B 58 175.585 -4.606 4.952 1.00 0.00 C ATOM 0 H LEU B 58 175.135 -1.606 2.407 1.00 0.00 H new ATOM 0 HA LEU B 58 177.153 -2.527 4.273 1.00 0.00 H new ATOM 0 HB2 LEU B 58 176.091 -3.686 1.687 1.00 0.00 H new ATOM 0 HB3 LEU B 58 177.122 -4.525 2.829 1.00 0.00 H new ATOM 0 HG LEU B 58 174.503 -3.239 3.695 1.00 0.00 H new ATOM 0 HD11 LEU B 58 173.445 -5.459 3.478 1.00 0.00 H new ATOM 0 HD12 LEU B 58 173.984 -4.840 1.899 1.00 0.00 H new ATOM 0 HD13 LEU B 58 174.930 -6.095 2.733 1.00 0.00 H new ATOM 0 HD21 LEU B 58 174.712 -4.871 5.549 1.00 0.00 H new ATOM 0 HD22 LEU B 58 176.225 -5.481 4.837 1.00 0.00 H new ATOM 0 HD23 LEU B 58 176.141 -3.814 5.454 1.00 0.00 H new ATOM 2697 N GLU B 59 178.043 -1.665 1.235 1.00 0.00 N ATOM 2698 CA GLU B 59 179.213 -1.264 0.428 1.00 0.00 C ATOM 2699 C GLU B 59 179.930 -0.113 1.117 1.00 0.00 C ATOM 2700 O GLU B 59 181.098 -0.192 1.423 1.00 0.00 O ATOM 2701 CB GLU B 59 178.720 -0.804 -0.953 1.00 0.00 C ATOM 2702 CG GLU B 59 177.929 -1.932 -1.632 1.00 0.00 C ATOM 2703 CD GLU B 59 177.952 -1.724 -3.121 1.00 0.00 C ATOM 2704 OE1 GLU B 59 177.390 -0.762 -3.575 1.00 0.00 O ATOM 2705 OE2 GLU B 59 178.534 -2.523 -3.787 1.00 0.00 O ATOM 0 H GLU B 59 177.148 -1.607 0.749 1.00 0.00 H new ATOM 0 HA GLU B 59 179.900 -2.104 0.320 1.00 0.00 H new ATOM 0 HB2 GLU B 59 178.091 0.080 -0.848 1.00 0.00 H new ATOM 0 HB3 GLU B 59 179.569 -0.519 -1.575 1.00 0.00 H new ATOM 0 HG2 GLU B 59 178.364 -2.900 -1.381 1.00 0.00 H new ATOM 0 HG3 GLU B 59 176.901 -1.941 -1.270 1.00 0.00 H new ATOM 2712 N SER B 60 179.242 0.964 1.310 1.00 0.00 N ATOM 2713 CA SER B 60 179.861 2.176 1.901 1.00 0.00 C ATOM 2714 C SER B 60 180.715 1.818 3.123 1.00 0.00 C ATOM 2715 O SER B 60 181.816 2.323 3.283 1.00 0.00 O ATOM 2716 CB SER B 60 178.773 3.172 2.305 1.00 0.00 C ATOM 2717 OG SER B 60 177.681 2.477 2.909 1.00 0.00 O ATOM 0 H SER B 60 178.253 1.061 1.079 1.00 0.00 H new ATOM 0 HA SER B 60 180.509 2.628 1.150 1.00 0.00 H new ATOM 0 HB2 SER B 60 179.179 3.905 3.002 1.00 0.00 H new ATOM 0 HB3 SER B 60 178.427 3.721 1.430 1.00 0.00 H new ATOM 0 HG SER B 60 177.052 2.189 2.215 1.00 0.00 H new ATOM 2723 N LYS B 61 180.216 0.986 4.019 1.00 0.00 N ATOM 2724 CA LYS B 61 181.037 0.671 5.239 1.00 0.00 C ATOM 2725 C LYS B 61 182.274 -0.066 4.789 1.00 0.00 C ATOM 2726 O LYS B 61 183.386 0.267 5.167 1.00 0.00 O ATOM 2727 CB LYS B 61 180.283 -0.206 6.241 1.00 0.00 C ATOM 2728 CG LYS B 61 178.886 0.344 6.499 1.00 0.00 C ATOM 2729 CD LYS B 61 177.938 -0.773 6.958 1.00 0.00 C ATOM 2730 CE LYS B 61 178.465 -1.403 8.251 1.00 0.00 C ATOM 2731 NZ LYS B 61 178.941 -0.343 9.192 1.00 0.00 N ATOM 0 H LYS B 61 179.307 0.526 3.962 1.00 0.00 H new ATOM 0 HA LYS B 61 181.278 1.609 5.739 1.00 0.00 H new ATOM 0 HB2 LYS B 61 180.213 -1.224 5.859 1.00 0.00 H new ATOM 0 HB3 LYS B 61 180.838 -0.255 7.178 1.00 0.00 H new ATOM 0 HG2 LYS B 61 178.932 1.124 7.259 1.00 0.00 H new ATOM 0 HG3 LYS B 61 178.499 0.806 5.591 1.00 0.00 H new ATOM 0 HD2 LYS B 61 176.938 -0.370 7.120 1.00 0.00 H new ATOM 0 HD3 LYS B 61 177.853 -1.533 6.181 1.00 0.00 H new ATOM 0 HE2 LYS B 61 177.678 -1.991 8.724 1.00 0.00 H new ATOM 0 HE3 LYS B 61 179.281 -2.088 8.023 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 178.877 -0.692 10.169 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 179.929 -0.103 8.974 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 178.348 0.505 9.088 1.00 0.00 H new ATOM 2745 N ARG B 62 182.087 -1.055 3.971 1.00 0.00 N ATOM 2746 CA ARG B 62 183.220 -1.843 3.456 1.00 0.00 C ATOM 2747 C ARG B 62 183.960 -1.029 2.404 1.00 0.00 C ATOM 2748 O ARG B 62 184.761 -1.573 1.646 1.00 0.00 O ATOM 2749 CB ARG B 62 182.707 -3.144 2.824 1.00 0.00 C ATOM 2750 CG ARG B 62 182.187 -4.099 3.912 1.00 0.00 C ATOM 2751 CD ARG B 62 183.042 -5.388 3.968 1.00 0.00 C ATOM 2752 NE ARG B 62 184.515 -5.066 3.983 1.00 0.00 N ATOM 2753 CZ ARG B 62 185.273 -5.227 2.907 1.00 0.00 C ATOM 2754 NH1 ARG B 62 184.727 -5.544 1.759 1.00 0.00 N ATOM 2755 NH2 ARG B 62 186.563 -5.047 2.988 1.00 0.00 N ATOM 0 H ARG B 62 181.172 -1.354 3.632 1.00 0.00 H new ATOM 0 HA ARG B 62 183.894 -2.085 4.278 1.00 0.00 H new ATOM 0 HB2 ARG B 62 181.910 -2.922 2.115 1.00 0.00 H new ATOM 0 HB3 ARG B 62 183.509 -3.624 2.262 1.00 0.00 H new ATOM 0 HG2 ARG B 62 182.210 -3.600 4.881 1.00 0.00 H new ATOM 0 HG3 ARG B 62 181.147 -4.356 3.710 1.00 0.00 H new ATOM 0 HD2 ARG B 62 182.783 -5.961 4.859 1.00 0.00 H new ATOM 0 HD3 ARG B 62 182.813 -6.017 3.107 1.00 0.00 H new ATOM 0 HE ARG B 62 184.939 -4.716 4.842 1.00 0.00 H new ATOM 0 HH11 ARG B 62 183.717 -5.667 1.692 1.00 0.00 H new ATOM 0 HH12 ARG B 62 185.312 -5.667 0.933 1.00 0.00 H new ATOM 0 HH21 ARG B 62 186.986 -4.783 3.878 1.00 0.00 H new ATOM 0 HH22 ARG B 62 187.148 -5.170 2.162 1.00 0.00 H new ATOM 2769 N LEU B 63 183.759 0.250 2.366 1.00 0.00 N ATOM 2770 CA LEU B 63 184.463 1.076 1.400 1.00 0.00 C ATOM 2771 C LEU B 63 185.412 2.028 2.139 1.00 0.00 C ATOM 2772 O LEU B 63 185.538 2.000 3.360 1.00 0.00 O ATOM 2773 CB LEU B 63 183.448 1.874 0.569 1.00 0.00 C ATOM 2774 CG LEU B 63 182.932 1.042 -0.637 1.00 0.00 C ATOM 2775 CD1 LEU B 63 181.682 1.696 -1.223 1.00 0.00 C ATOM 2776 CD2 LEU B 63 183.995 0.979 -1.738 1.00 0.00 C ATOM 0 H LEU B 63 183.121 0.755 2.982 1.00 0.00 H new ATOM 0 HA LEU B 63 185.046 0.444 0.730 1.00 0.00 H new ATOM 0 HB2 LEU B 63 182.608 2.166 1.199 1.00 0.00 H new ATOM 0 HB3 LEU B 63 183.911 2.793 0.209 1.00 0.00 H new ATOM 0 HG LEU B 63 182.705 0.037 -0.282 1.00 0.00 H new ATOM 0 HD11 LEU B 63 181.326 1.107 -2.068 1.00 0.00 H new ATOM 0 HD12 LEU B 63 180.905 1.743 -0.460 1.00 0.00 H new ATOM 0 HD13 LEU B 63 181.923 2.705 -1.559 1.00 0.00 H new ATOM 0 HD21 LEU B 63 183.617 0.392 -2.575 1.00 0.00 H new ATOM 0 HD22 LEU B 63 184.227 1.988 -2.078 1.00 0.00 H new ATOM 0 HD23 LEU B 63 184.898 0.511 -1.346 1.00 0.00 H new ATOM 2788 N GLY B 64 186.099 2.822 1.414 1.00 0.00 N ATOM 2789 CA GLY B 64 187.078 3.786 1.977 1.00 0.00 C ATOM 2790 C GLY B 64 187.552 4.636 0.826 1.00 0.00 C ATOM 2791 O GLY B 64 186.777 5.332 0.224 1.00 0.00 O ATOM 0 H GLY B 64 186.028 2.854 0.397 1.00 0.00 H new ATOM 0 HA2 GLY B 64 186.616 4.401 2.749 1.00 0.00 H new ATOM 0 HA3 GLY B 64 187.913 3.263 2.443 1.00 0.00 H new ATOM 2795 N GLY B 65 188.770 4.534 0.447 1.00 0.00 N ATOM 2796 CA GLY B 65 189.250 5.313 -0.738 1.00 0.00 C ATOM 2797 C GLY B 65 190.743 5.350 -0.659 1.00 0.00 C ATOM 2798 O GLY B 65 191.317 4.614 0.116 1.00 0.00 O ATOM 0 H GLY B 65 189.473 3.947 0.896 1.00 0.00 H new ATOM 0 HA2 GLY B 65 188.924 4.844 -1.666 1.00 0.00 H new ATOM 0 HA3 GLY B 65 188.838 6.322 -0.729 1.00 0.00 H new ATOM 2802 N ASP B 66 191.401 6.137 -1.475 1.00 0.00 N ATOM 2803 CA ASP B 66 192.897 6.196 -1.439 1.00 0.00 C ATOM 2804 C ASP B 66 193.501 4.898 -1.966 1.00 0.00 C ATOM 2805 O ASP B 66 194.702 4.774 -2.116 1.00 0.00 O ATOM 2806 CB ASP B 66 193.375 6.451 0.016 1.00 0.00 C ATOM 2807 CG ASP B 66 194.152 7.748 0.066 1.00 0.00 C ATOM 2808 OD1 ASP B 66 193.559 8.787 -0.076 1.00 0.00 O ATOM 2809 OD2 ASP B 66 195.329 7.703 0.264 1.00 0.00 O ATOM 0 H ASP B 66 190.964 6.744 -2.168 1.00 0.00 H new ATOM 0 HA ASP B 66 193.229 7.014 -2.078 1.00 0.00 H new ATOM 0 HB2 ASP B 66 192.519 6.500 0.689 1.00 0.00 H new ATOM 0 HB3 ASP B 66 194.001 5.625 0.356 1.00 0.00 H new ATOM 2814 N ASP B 67 192.678 3.950 -2.319 1.00 0.00 N ATOM 2815 CA ASP B 67 193.180 2.668 -2.915 1.00 0.00 C ATOM 2816 C ASP B 67 194.115 2.995 -4.058 1.00 0.00 C ATOM 2817 O ASP B 67 195.108 2.323 -4.284 1.00 0.00 O ATOM 2818 CB ASP B 67 192.009 1.845 -3.471 1.00 0.00 C ATOM 2819 CG ASP B 67 190.937 2.770 -3.974 1.00 0.00 C ATOM 2820 OD1 ASP B 67 191.119 3.363 -4.994 1.00 0.00 O ATOM 2821 OD2 ASP B 67 189.948 2.877 -3.319 1.00 0.00 O ATOM 0 H ASP B 67 191.664 4.005 -2.221 1.00 0.00 H new ATOM 0 HA ASP B 67 193.693 2.095 -2.143 1.00 0.00 H new ATOM 0 HB2 ASP B 67 192.356 1.200 -4.279 1.00 0.00 H new ATOM 0 HB3 ASP B 67 191.607 1.195 -2.694 1.00 0.00 H new ATOM 2826 N ALA B 68 193.811 3.999 -4.796 1.00 0.00 N ATOM 2827 CA ALA B 68 194.699 4.362 -5.937 1.00 0.00 C ATOM 2828 C ALA B 68 196.004 4.932 -5.358 1.00 0.00 C ATOM 2829 O ALA B 68 197.084 4.683 -5.878 1.00 0.00 O ATOM 2830 CB ALA B 68 194.010 5.330 -6.871 1.00 0.00 C ATOM 0 H ALA B 68 192.991 4.593 -4.671 1.00 0.00 H new ATOM 0 HA ALA B 68 194.931 3.482 -6.537 1.00 0.00 H new ATOM 0 HB1 ALA B 68 194.679 5.579 -7.695 1.00 0.00 H new ATOM 0 HB2 ALA B 68 193.103 4.872 -7.266 1.00 0.00 H new ATOM 0 HB3 ALA B 68 193.751 6.238 -6.327 1.00 0.00 H new ATOM 2836 N ARG B 69 195.932 5.569 -4.230 1.00 0.00 N ATOM 2837 CA ARG B 69 197.155 6.030 -3.553 1.00 0.00 C ATOM 2838 C ARG B 69 197.979 4.808 -3.213 1.00 0.00 C ATOM 2839 O ARG B 69 199.189 4.788 -3.391 1.00 0.00 O ATOM 2840 CB ARG B 69 196.783 6.749 -2.258 1.00 0.00 C ATOM 2841 CG ARG B 69 198.007 7.511 -1.710 1.00 0.00 C ATOM 2842 CD ARG B 69 197.784 9.012 -1.858 1.00 0.00 C ATOM 2843 NE ARG B 69 196.421 9.333 -1.342 1.00 0.00 N ATOM 2844 CZ ARG B 69 195.842 10.477 -1.613 1.00 0.00 C ATOM 2845 NH1 ARG B 69 196.515 11.428 -2.217 1.00 0.00 N ATOM 2846 NH2 ARG B 69 194.608 10.662 -1.262 1.00 0.00 N ATOM 0 H ARG B 69 195.062 5.791 -3.745 1.00 0.00 H new ATOM 0 HA ARG B 69 197.711 6.712 -4.196 1.00 0.00 H new ATOM 0 HB2 ARG B 69 195.963 7.444 -2.440 1.00 0.00 H new ATOM 0 HB3 ARG B 69 196.432 6.028 -1.520 1.00 0.00 H new ATOM 0 HG2 ARG B 69 198.166 7.258 -0.662 1.00 0.00 H new ATOM 0 HG3 ARG B 69 198.906 7.212 -2.249 1.00 0.00 H new ATOM 0 HD2 ARG B 69 198.541 9.566 -1.303 1.00 0.00 H new ATOM 0 HD3 ARG B 69 197.875 9.309 -2.903 1.00 0.00 H new ATOM 0 HE ARG B 69 195.930 8.648 -0.767 1.00 0.00 H new ATOM 0 HH11 ARG B 69 197.490 11.277 -2.476 1.00 0.00 H new ATOM 0 HH12 ARG B 69 196.063 12.318 -2.427 1.00 0.00 H new ATOM 0 HH21 ARG B 69 194.098 9.921 -0.780 1.00 0.00 H new ATOM 0 HH22 ARG B 69 194.147 11.548 -1.467 1.00 0.00 H new ATOM 2860 N VAL B 70 197.333 3.770 -2.745 1.00 0.00 N ATOM 2861 CA VAL B 70 198.066 2.518 -2.411 1.00 0.00 C ATOM 2862 C VAL B 70 198.940 2.186 -3.581 1.00 0.00 C ATOM 2863 O VAL B 70 200.129 2.060 -3.455 1.00 0.00 O ATOM 2864 CB VAL B 70 197.066 1.354 -2.182 1.00 0.00 C ATOM 2865 CG1 VAL B 70 197.788 0.022 -1.944 1.00 0.00 C ATOM 2866 CG2 VAL B 70 196.209 1.653 -0.981 1.00 0.00 C ATOM 0 H VAL B 70 196.327 3.739 -2.581 1.00 0.00 H new ATOM 0 HA VAL B 70 198.652 2.657 -1.502 1.00 0.00 H new ATOM 0 HB VAL B 70 196.456 1.264 -3.081 1.00 0.00 H new ATOM 0 HG11 VAL B 70 197.053 -0.768 -1.788 1.00 0.00 H new ATOM 0 HG12 VAL B 70 198.401 -0.220 -2.812 1.00 0.00 H new ATOM 0 HG13 VAL B 70 198.424 0.105 -1.063 1.00 0.00 H new ATOM 0 HG21 VAL B 70 195.507 0.834 -0.822 1.00 0.00 H new ATOM 0 HG22 VAL B 70 196.842 1.764 -0.101 1.00 0.00 H new ATOM 0 HG23 VAL B 70 195.656 2.577 -1.150 1.00 0.00 H new ATOM 2876 N ARG B 71 198.349 2.062 -4.716 1.00 0.00 N ATOM 2877 CA ARG B 71 199.132 1.700 -5.929 1.00 0.00 C ATOM 2878 C ARG B 71 200.291 2.655 -6.092 1.00 0.00 C ATOM 2879 O ARG B 71 201.413 2.247 -6.352 1.00 0.00 O ATOM 2880 CB ARG B 71 198.235 1.747 -7.183 1.00 0.00 C ATOM 2881 CG ARG B 71 199.028 1.265 -8.418 1.00 0.00 C ATOM 2882 CD ARG B 71 199.076 -0.268 -8.434 1.00 0.00 C ATOM 2883 NE ARG B 71 197.699 -0.795 -8.678 1.00 0.00 N ATOM 2884 CZ ARG B 71 197.144 -1.724 -7.914 1.00 0.00 C ATOM 2885 NH1 ARG B 71 197.759 -2.193 -6.851 1.00 0.00 N ATOM 2886 NH2 ARG B 71 195.960 -2.163 -8.225 1.00 0.00 N ATOM 0 H ARG B 71 197.349 2.195 -4.869 1.00 0.00 H new ATOM 0 HA ARG B 71 199.513 0.686 -5.810 1.00 0.00 H new ATOM 0 HB2 ARG B 71 197.357 1.118 -7.036 1.00 0.00 H new ATOM 0 HB3 ARG B 71 197.875 2.763 -7.345 1.00 0.00 H new ATOM 0 HG2 ARG B 71 198.559 1.634 -9.330 1.00 0.00 H new ATOM 0 HG3 ARG B 71 200.040 1.670 -8.394 1.00 0.00 H new ATOM 0 HD2 ARG B 71 199.756 -0.615 -9.212 1.00 0.00 H new ATOM 0 HD3 ARG B 71 199.460 -0.643 -7.485 1.00 0.00 H new ATOM 0 HE ARG B 71 197.165 -0.425 -9.464 1.00 0.00 H new ATOM 0 HH11 ARG B 71 198.683 -1.842 -6.600 1.00 0.00 H new ATOM 0 HH12 ARG B 71 197.312 -2.908 -6.277 1.00 0.00 H new ATOM 0 HH21 ARG B 71 195.477 -1.792 -9.043 1.00 0.00 H new ATOM 0 HH22 ARG B 71 195.514 -2.878 -7.650 1.00 0.00 H new ATOM 2900 N GLU B 72 200.053 3.914 -5.930 1.00 0.00 N ATOM 2901 CA GLU B 72 201.162 4.885 -6.072 1.00 0.00 C ATOM 2902 C GLU B 72 202.236 4.535 -5.083 1.00 0.00 C ATOM 2903 O GLU B 72 203.424 4.538 -5.405 1.00 0.00 O ATOM 2904 CB GLU B 72 200.662 6.287 -5.800 1.00 0.00 C ATOM 2905 CG GLU B 72 199.627 6.653 -6.850 1.00 0.00 C ATOM 2906 CD GLU B 72 199.370 8.125 -6.759 1.00 0.00 C ATOM 2907 OE1 GLU B 72 198.655 8.516 -5.879 1.00 0.00 O ATOM 2908 OE2 GLU B 72 199.923 8.848 -7.542 1.00 0.00 O ATOM 0 H GLU B 72 199.143 4.316 -5.706 1.00 0.00 H new ATOM 0 HA GLU B 72 201.557 4.844 -7.087 1.00 0.00 H new ATOM 0 HB2 GLU B 72 200.224 6.344 -4.803 1.00 0.00 H new ATOM 0 HB3 GLU B 72 201.491 6.994 -5.825 1.00 0.00 H new ATOM 0 HG2 GLU B 72 199.986 6.390 -7.845 1.00 0.00 H new ATOM 0 HG3 GLU B 72 198.705 6.095 -6.686 1.00 0.00 H new ATOM 2915 N LEU B 73 201.850 4.231 -3.888 1.00 0.00 N ATOM 2916 CA LEU B 73 202.848 3.873 -2.881 1.00 0.00 C ATOM 2917 C LEU B 73 203.480 2.559 -3.260 1.00 0.00 C ATOM 2918 O LEU B 73 204.642 2.379 -3.078 1.00 0.00 O ATOM 2919 CB LEU B 73 202.225 3.791 -1.504 1.00 0.00 C ATOM 2920 CG LEU B 73 201.549 5.127 -1.144 1.00 0.00 C ATOM 2921 CD1 LEU B 73 200.857 4.968 0.181 1.00 0.00 C ATOM 2922 CD2 LEU B 73 202.580 6.270 -1.023 1.00 0.00 C ATOM 0 H LEU B 73 200.881 4.217 -3.570 1.00 0.00 H new ATOM 0 HA LEU B 73 203.614 4.647 -2.846 1.00 0.00 H new ATOM 0 HB2 LEU B 73 201.491 2.985 -1.476 1.00 0.00 H new ATOM 0 HB3 LEU B 73 202.990 3.551 -0.765 1.00 0.00 H new ATOM 0 HG LEU B 73 200.844 5.381 -1.936 1.00 0.00 H new ATOM 0 HD11 LEU B 73 200.372 5.905 0.453 1.00 0.00 H new ATOM 0 HD12 LEU B 73 200.108 4.180 0.108 1.00 0.00 H new ATOM 0 HD13 LEU B 73 201.589 4.704 0.944 1.00 0.00 H new ATOM 0 HD21 LEU B 73 202.067 7.197 -0.768 1.00 0.00 H new ATOM 0 HD22 LEU B 73 203.301 6.028 -0.243 1.00 0.00 H new ATOM 0 HD23 LEU B 73 203.100 6.393 -1.973 1.00 0.00 H new ATOM 2934 N GLU B 74 202.733 1.650 -3.822 1.00 0.00 N ATOM 2935 CA GLU B 74 203.336 0.374 -4.274 1.00 0.00 C ATOM 2936 C GLU B 74 204.397 0.703 -5.331 1.00 0.00 C ATOM 2937 O GLU B 74 205.513 0.191 -5.300 1.00 0.00 O ATOM 2938 CB GLU B 74 202.258 -0.502 -4.909 1.00 0.00 C ATOM 2939 CG GLU B 74 201.183 -0.872 -3.883 1.00 0.00 C ATOM 2940 CD GLU B 74 200.273 -1.929 -4.461 1.00 0.00 C ATOM 2941 OE1 GLU B 74 199.923 -1.843 -5.616 1.00 0.00 O ATOM 2942 OE2 GLU B 74 199.945 -2.827 -3.749 1.00 0.00 O ATOM 0 H GLU B 74 201.730 1.739 -3.986 1.00 0.00 H new ATOM 0 HA GLU B 74 203.780 -0.155 -3.431 1.00 0.00 H new ATOM 0 HB2 GLU B 74 201.801 0.025 -5.747 1.00 0.00 H new ATOM 0 HB3 GLU B 74 202.710 -1.408 -5.311 1.00 0.00 H new ATOM 0 HG2 GLU B 74 201.650 -1.240 -2.969 1.00 0.00 H new ATOM 0 HG3 GLU B 74 200.605 0.012 -3.612 1.00 0.00 H new ATOM 2949 N LEU B 75 204.063 1.563 -6.258 1.00 0.00 N ATOM 2950 CA LEU B 75 205.028 1.955 -7.315 1.00 0.00 C ATOM 2951 C LEU B 75 206.207 2.668 -6.641 1.00 0.00 C ATOM 2952 O LEU B 75 207.371 2.421 -6.952 1.00 0.00 O ATOM 2953 CB LEU B 75 204.346 2.915 -8.300 1.00 0.00 C ATOM 2954 CG LEU B 75 203.096 2.264 -8.936 1.00 0.00 C ATOM 2955 CD1 LEU B 75 202.070 3.351 -9.324 1.00 0.00 C ATOM 2956 CD2 LEU B 75 203.510 1.497 -10.195 1.00 0.00 C ATOM 0 H LEU B 75 203.150 2.013 -6.324 1.00 0.00 H new ATOM 0 HA LEU B 75 205.375 1.076 -7.858 1.00 0.00 H new ATOM 0 HB2 LEU B 75 204.059 3.830 -7.782 1.00 0.00 H new ATOM 0 HB3 LEU B 75 205.050 3.199 -9.082 1.00 0.00 H new ATOM 0 HG LEU B 75 202.644 1.584 -8.214 1.00 0.00 H new ATOM 0 HD11 LEU B 75 201.194 2.881 -9.771 1.00 0.00 H new ATOM 0 HD12 LEU B 75 201.771 3.904 -8.433 1.00 0.00 H new ATOM 0 HD13 LEU B 75 202.520 4.036 -10.042 1.00 0.00 H new ATOM 0 HD21 LEU B 75 202.631 1.037 -10.646 1.00 0.00 H new ATOM 0 HD22 LEU B 75 203.965 2.185 -10.907 1.00 0.00 H new ATOM 0 HD23 LEU B 75 204.229 0.722 -9.929 1.00 0.00 H new ATOM 2968 N GLU B 76 205.916 3.524 -5.708 1.00 0.00 N ATOM 2969 CA GLU B 76 206.972 4.261 -4.969 1.00 0.00 C ATOM 2970 C GLU B 76 207.849 3.245 -4.234 1.00 0.00 C ATOM 2971 O GLU B 76 209.077 3.327 -4.233 1.00 0.00 O ATOM 2972 CB GLU B 76 206.270 5.180 -3.938 1.00 0.00 C ATOM 2973 CG GLU B 76 207.178 6.350 -3.518 1.00 0.00 C ATOM 2974 CD GLU B 76 207.268 7.382 -4.622 1.00 0.00 C ATOM 2975 OE1 GLU B 76 206.309 7.569 -5.323 1.00 0.00 O ATOM 2976 OE2 GLU B 76 208.302 7.975 -4.752 1.00 0.00 O ATOM 0 H GLU B 76 204.964 3.750 -5.419 1.00 0.00 H new ATOM 0 HA GLU B 76 207.589 4.853 -5.645 1.00 0.00 H new ATOM 0 HB2 GLU B 76 205.346 5.570 -4.366 1.00 0.00 H new ATOM 0 HB3 GLU B 76 205.994 4.598 -3.059 1.00 0.00 H new ATOM 0 HG2 GLU B 76 206.787 6.813 -2.612 1.00 0.00 H new ATOM 0 HG3 GLU B 76 208.174 5.976 -3.281 1.00 0.00 H new ATOM 2983 N LEU B 77 207.222 2.317 -3.590 1.00 0.00 N ATOM 2984 CA LEU B 77 207.935 1.297 -2.802 1.00 0.00 C ATOM 2985 C LEU B 77 208.851 0.544 -3.701 1.00 0.00 C ATOM 2986 O LEU B 77 210.025 0.494 -3.469 1.00 0.00 O ATOM 2987 CB LEU B 77 206.937 0.324 -2.162 1.00 0.00 C ATOM 2988 CG LEU B 77 206.380 0.932 -0.870 1.00 0.00 C ATOM 2989 CD1 LEU B 77 205.144 0.159 -0.423 1.00 0.00 C ATOM 2990 CD2 LEU B 77 207.441 0.867 0.233 1.00 0.00 C ATOM 0 H LEU B 77 206.207 2.222 -3.578 1.00 0.00 H new ATOM 0 HA LEU B 77 208.503 1.787 -2.012 1.00 0.00 H new ATOM 0 HB2 LEU B 77 206.124 0.113 -2.856 1.00 0.00 H new ATOM 0 HB3 LEU B 77 207.427 -0.626 -1.947 1.00 0.00 H new ATOM 0 HG LEU B 77 206.110 1.971 -1.057 1.00 0.00 H new ATOM 0 HD11 LEU B 77 204.754 0.597 0.496 1.00 0.00 H new ATOM 0 HD12 LEU B 77 204.382 0.209 -1.201 1.00 0.00 H new ATOM 0 HD13 LEU B 77 205.411 -0.882 -0.244 1.00 0.00 H new ATOM 0 HD21 LEU B 77 207.040 1.300 1.149 1.00 0.00 H new ATOM 0 HD22 LEU B 77 207.715 -0.172 0.413 1.00 0.00 H new ATOM 0 HD23 LEU B 77 208.323 1.427 -0.077 1.00 0.00 H new ATOM 3002 N ASP B 78 208.334 -0.052 -4.729 1.00 0.00 N ATOM 3003 CA ASP B 78 209.203 -0.825 -5.637 1.00 0.00 C ATOM 3004 C ASP B 78 210.313 0.050 -6.157 1.00 0.00 C ATOM 3005 O ASP B 78 211.448 -0.387 -6.269 1.00 0.00 O ATOM 3006 CB ASP B 78 208.384 -1.430 -6.771 1.00 0.00 C ATOM 3007 CG ASP B 78 207.916 -2.805 -6.357 1.00 0.00 C ATOM 3008 OD1 ASP B 78 207.540 -2.980 -5.220 1.00 0.00 O ATOM 3009 OD2 ASP B 78 207.982 -3.694 -7.159 1.00 0.00 O ATOM 0 H ASP B 78 207.345 -0.036 -4.978 1.00 0.00 H new ATOM 0 HA ASP B 78 209.656 -1.649 -5.085 1.00 0.00 H new ATOM 0 HB2 ASP B 78 207.529 -0.794 -6.999 1.00 0.00 H new ATOM 0 HB3 ASP B 78 208.985 -1.494 -7.678 1.00 0.00 H new ATOM 3014 N ARG B 79 210.036 1.297 -6.394 1.00 0.00 N ATOM 3015 CA ARG B 79 211.105 2.214 -6.808 1.00 0.00 C ATOM 3016 C ARG B 79 212.136 2.250 -5.691 1.00 0.00 C ATOM 3017 O ARG B 79 213.333 2.115 -5.916 1.00 0.00 O ATOM 3018 CB ARG B 79 210.535 3.610 -7.023 1.00 0.00 C ATOM 3019 CG ARG B 79 211.408 4.393 -8.023 1.00 0.00 C ATOM 3020 CD ARG B 79 212.474 5.217 -7.271 1.00 0.00 C ATOM 3021 NE ARG B 79 211.867 6.495 -6.769 1.00 0.00 N ATOM 3022 CZ ARG B 79 212.589 7.370 -6.085 1.00 0.00 C ATOM 3023 NH1 ARG B 79 213.815 7.092 -5.771 1.00 0.00 N ATOM 3024 NH2 ARG B 79 212.069 8.517 -5.733 1.00 0.00 N ATOM 0 H ARG B 79 209.109 1.715 -6.316 1.00 0.00 H new ATOM 0 HA ARG B 79 211.557 1.878 -7.741 1.00 0.00 H new ATOM 0 HB2 ARG B 79 209.514 3.540 -7.398 1.00 0.00 H new ATOM 0 HB3 ARG B 79 210.490 4.143 -6.073 1.00 0.00 H new ATOM 0 HG2 ARG B 79 211.892 3.702 -8.713 1.00 0.00 H new ATOM 0 HG3 ARG B 79 210.783 5.055 -8.622 1.00 0.00 H new ATOM 0 HD2 ARG B 79 212.871 4.640 -6.436 1.00 0.00 H new ATOM 0 HD3 ARG B 79 213.311 5.437 -7.933 1.00 0.00 H new ATOM 0 HE ARG B 79 210.884 6.692 -6.957 1.00 0.00 H new ATOM 0 HH11 ARG B 79 214.223 6.200 -6.051 1.00 0.00 H new ATOM 0 HH12 ARG B 79 214.372 7.765 -5.244 1.00 0.00 H new ATOM 0 HH21 ARG B 79 211.106 8.739 -5.985 1.00 0.00 H new ATOM 0 HH22 ARG B 79 212.626 9.190 -5.206 1.00 0.00 H new ATOM 3038 N LEU B 80 211.684 2.396 -4.475 1.00 0.00 N ATOM 3039 CA LEU B 80 212.625 2.412 -3.342 1.00 0.00 C ATOM 3040 C LEU B 80 213.335 1.070 -3.281 1.00 0.00 C ATOM 3041 O LEU B 80 214.505 1.007 -3.028 1.00 0.00 O ATOM 3042 CB LEU B 80 211.881 2.678 -2.032 1.00 0.00 C ATOM 3043 CG LEU B 80 211.698 4.197 -1.803 1.00 0.00 C ATOM 3044 CD1 LEU B 80 211.178 4.458 -0.387 1.00 0.00 C ATOM 3045 CD2 LEU B 80 213.031 4.942 -1.989 1.00 0.00 C ATOM 0 H LEU B 80 210.701 2.504 -4.227 1.00 0.00 H new ATOM 0 HA LEU B 80 213.354 3.210 -3.483 1.00 0.00 H new ATOM 0 HB2 LEU B 80 210.907 2.189 -2.056 1.00 0.00 H new ATOM 0 HB3 LEU B 80 212.435 2.244 -1.199 1.00 0.00 H new ATOM 0 HG LEU B 80 210.978 4.562 -2.535 1.00 0.00 H new ATOM 0 HD11 LEU B 80 211.053 5.530 -0.237 1.00 0.00 H new ATOM 0 HD12 LEU B 80 210.218 3.959 -0.254 1.00 0.00 H new ATOM 0 HD13 LEU B 80 211.892 4.071 0.340 1.00 0.00 H new ATOM 0 HD21 LEU B 80 212.878 6.008 -1.823 1.00 0.00 H new ATOM 0 HD22 LEU B 80 213.762 4.565 -1.274 1.00 0.00 H new ATOM 0 HD23 LEU B 80 213.399 4.782 -3.002 1.00 0.00 H new ATOM 3057 N ARG B 81 212.626 -0.007 -3.447 1.00 0.00 N ATOM 3058 CA ARG B 81 213.264 -1.356 -3.405 1.00 0.00 C ATOM 3059 C ARG B 81 214.304 -1.405 -4.510 1.00 0.00 C ATOM 3060 O ARG B 81 215.373 -1.960 -4.336 1.00 0.00 O ATOM 3061 CB ARG B 81 212.210 -2.461 -3.626 1.00 0.00 C ATOM 3062 CG ARG B 81 211.138 -2.411 -2.509 1.00 0.00 C ATOM 3063 CD ARG B 81 210.122 -3.580 -2.650 1.00 0.00 C ATOM 3064 NE ARG B 81 209.715 -3.782 -4.096 1.00 0.00 N ATOM 3065 CZ ARG B 81 210.397 -4.593 -4.882 1.00 0.00 C ATOM 3066 NH1 ARG B 81 211.463 -5.186 -4.424 1.00 0.00 N ATOM 3067 NH2 ARG B 81 210.013 -4.798 -6.111 1.00 0.00 N ATOM 0 H ARG B 81 211.619 -0.014 -3.612 1.00 0.00 H new ATOM 0 HA ARG B 81 213.725 -1.524 -2.432 1.00 0.00 H new ATOM 0 HB2 ARG B 81 211.737 -2.333 -4.600 1.00 0.00 H new ATOM 0 HB3 ARG B 81 212.693 -3.438 -3.633 1.00 0.00 H new ATOM 0 HG2 ARG B 81 211.623 -2.463 -1.534 1.00 0.00 H new ATOM 0 HG3 ARG B 81 210.609 -1.459 -2.552 1.00 0.00 H new ATOM 0 HD2 ARG B 81 210.564 -4.498 -2.262 1.00 0.00 H new ATOM 0 HD3 ARG B 81 209.238 -3.372 -2.047 1.00 0.00 H new ATOM 0 HE ARG B 81 208.904 -3.285 -4.466 1.00 0.00 H new ATOM 0 HH11 ARG B 81 211.765 -5.022 -3.464 1.00 0.00 H new ATOM 0 HH12 ARG B 81 211.995 -5.814 -5.026 1.00 0.00 H new ATOM 0 HH21 ARG B 81 209.181 -4.330 -6.470 1.00 0.00 H new ATOM 0 HH22 ARG B 81 210.545 -5.426 -6.713 1.00 0.00 H new ATOM 3081 N ALA B 82 214.014 -0.790 -5.624 1.00 0.00 N ATOM 3082 CA ALA B 82 214.988 -0.738 -6.741 1.00 0.00 C ATOM 3083 C ALA B 82 216.229 0.005 -6.255 1.00 0.00 C ATOM 3084 O ALA B 82 217.352 -0.489 -6.357 1.00 0.00 O ATOM 3085 CB ALA B 82 214.373 0.010 -7.932 1.00 0.00 C ATOM 0 H ALA B 82 213.129 -0.316 -5.806 1.00 0.00 H new ATOM 0 HA ALA B 82 215.250 -1.747 -7.059 1.00 0.00 H new ATOM 0 HB1 ALA B 82 215.092 0.046 -8.750 1.00 0.00 H new ATOM 0 HB2 ALA B 82 213.473 -0.509 -8.262 1.00 0.00 H new ATOM 0 HB3 ALA B 82 214.116 1.025 -7.630 1.00 0.00 H new ATOM 3091 N GLU B 83 216.042 1.181 -5.714 1.00 0.00 N ATOM 3092 CA GLU B 83 217.200 1.961 -5.194 1.00 0.00 C ATOM 3093 C GLU B 83 217.893 1.137 -4.121 1.00 0.00 C ATOM 3094 O GLU B 83 219.075 0.893 -4.182 1.00 0.00 O ATOM 3095 CB GLU B 83 216.709 3.287 -4.581 1.00 0.00 C ATOM 3096 CG GLU B 83 217.270 4.468 -5.377 1.00 0.00 C ATOM 3097 CD GLU B 83 216.196 5.488 -5.591 1.00 0.00 C ATOM 3098 OE1 GLU B 83 215.281 5.207 -6.317 1.00 0.00 O ATOM 3099 OE2 GLU B 83 216.306 6.555 -5.048 1.00 0.00 O ATOM 0 H GLU B 83 215.134 1.634 -5.611 1.00 0.00 H new ATOM 0 HA GLU B 83 217.890 2.182 -6.008 1.00 0.00 H new ATOM 0 HB2 GLU B 83 215.619 3.319 -4.586 1.00 0.00 H new ATOM 0 HB3 GLU B 83 217.025 3.356 -3.540 1.00 0.00 H new ATOM 0 HG2 GLU B 83 218.108 4.915 -4.841 1.00 0.00 H new ATOM 0 HG3 GLU B 83 217.653 4.123 -6.337 1.00 0.00 H new ATOM 3106 N ASN B 84 217.144 0.674 -3.167 1.00 0.00 N ATOM 3107 CA ASN B 84 217.694 -0.171 -2.082 1.00 0.00 C ATOM 3108 C ASN B 84 218.511 -1.251 -2.707 1.00 0.00 C ATOM 3109 O ASN B 84 219.625 -1.476 -2.341 1.00 0.00 O ATOM 3110 CB ASN B 84 216.550 -0.831 -1.326 1.00 0.00 C ATOM 3111 CG ASN B 84 216.007 0.111 -0.268 1.00 0.00 C ATOM 3112 OD1 ASN B 84 216.509 0.163 0.833 1.00 0.00 O ATOM 3113 ND2 ASN B 84 215.007 0.864 -0.546 1.00 0.00 N ATOM 0 H ASN B 84 216.142 0.853 -3.093 1.00 0.00 H new ATOM 0 HA ASN B 84 218.291 0.438 -1.403 1.00 0.00 H new ATOM 0 HB2 ASN B 84 215.756 -1.105 -2.021 1.00 0.00 H new ATOM 0 HB3 ASN B 84 216.897 -1.753 -0.859 1.00 0.00 H new ATOM 0 HD21 ASN B 84 214.638 1.503 0.159 1.00 0.00 H new ATOM 0 HD22 ASN B 84 214.580 0.824 -1.472 1.00 0.00 H new ATOM 3120 N LEU B 85 217.966 -1.907 -3.679 1.00 0.00 N ATOM 3121 CA LEU B 85 218.721 -2.976 -4.370 1.00 0.00 C ATOM 3122 C LEU B 85 220.004 -2.368 -4.927 1.00 0.00 C ATOM 3123 O LEU B 85 221.080 -2.845 -4.666 1.00 0.00 O ATOM 3124 CB LEU B 85 217.846 -3.591 -5.503 1.00 0.00 C ATOM 3125 CG LEU B 85 218.711 -4.141 -6.667 1.00 0.00 C ATOM 3126 CD1 LEU B 85 219.699 -5.202 -6.173 1.00 0.00 C ATOM 3127 CD2 LEU B 85 217.802 -4.758 -7.731 1.00 0.00 C ATOM 0 H LEU B 85 217.021 -1.748 -4.029 1.00 0.00 H new ATOM 0 HA LEU B 85 218.976 -3.779 -3.678 1.00 0.00 H new ATOM 0 HB2 LEU B 85 217.234 -4.395 -5.094 1.00 0.00 H new ATOM 0 HB3 LEU B 85 217.162 -2.833 -5.885 1.00 0.00 H new ATOM 0 HG LEU B 85 219.278 -3.311 -7.089 1.00 0.00 H new ATOM 0 HD11 LEU B 85 220.290 -5.568 -7.013 1.00 0.00 H new ATOM 0 HD12 LEU B 85 220.361 -4.763 -5.427 1.00 0.00 H new ATOM 0 HD13 LEU B 85 219.150 -6.031 -5.728 1.00 0.00 H new ATOM 0 HD21 LEU B 85 218.410 -5.145 -8.549 1.00 0.00 H new ATOM 0 HD22 LEU B 85 217.227 -5.572 -7.290 1.00 0.00 H new ATOM 0 HD23 LEU B 85 217.121 -3.998 -8.113 1.00 0.00 H new ATOM 3139 N GLN B 86 219.899 -1.307 -5.665 1.00 0.00 N ATOM 3140 CA GLN B 86 221.126 -0.673 -6.242 1.00 0.00 C ATOM 3141 C GLN B 86 222.122 -0.354 -5.114 1.00 0.00 C ATOM 3142 O GLN B 86 223.324 -0.471 -5.274 1.00 0.00 O ATOM 3143 CB GLN B 86 220.750 0.627 -6.985 1.00 0.00 C ATOM 3144 CG GLN B 86 221.489 0.712 -8.333 1.00 0.00 C ATOM 3145 CD GLN B 86 222.837 1.387 -8.122 1.00 0.00 C ATOM 3146 OE1 GLN B 86 222.917 2.605 -8.078 1.00 0.00 O ATOM 3147 NE2 GLN B 86 223.891 0.672 -7.971 1.00 0.00 N ATOM 0 H GLN B 86 219.020 -0.845 -5.899 1.00 0.00 H new ATOM 0 HA GLN B 86 221.586 -1.365 -6.947 1.00 0.00 H new ATOM 0 HB2 GLN B 86 219.673 0.659 -7.151 1.00 0.00 H new ATOM 0 HB3 GLN B 86 221.003 1.490 -6.370 1.00 0.00 H new ATOM 0 HG2 GLN B 86 221.629 -0.286 -8.748 1.00 0.00 H new ATOM 0 HG3 GLN B 86 220.895 1.276 -9.052 1.00 0.00 H new ATOM 0 HE21 GLN B 86 223.827 -0.345 -8.007 1.00 0.00 H new ATOM 0 HE22 GLN B 86 224.794 1.121 -7.815 1.00 0.00 H new ATOM 3156 N LEU B 87 221.644 0.108 -4.015 1.00 0.00 N ATOM 3157 CA LEU B 87 222.552 0.498 -2.907 1.00 0.00 C ATOM 3158 C LEU B 87 223.082 -0.743 -2.200 1.00 0.00 C ATOM 3159 O LEU B 87 224.273 -0.924 -2.064 1.00 0.00 O ATOM 3160 CB LEU B 87 221.796 1.388 -1.925 1.00 0.00 C ATOM 3161 CG LEU B 87 221.173 2.580 -2.682 1.00 0.00 C ATOM 3162 CD1 LEU B 87 219.969 3.122 -1.919 1.00 0.00 C ATOM 3163 CD2 LEU B 87 222.212 3.688 -2.834 1.00 0.00 C ATOM 0 H LEU B 87 220.650 0.238 -3.825 1.00 0.00 H new ATOM 0 HA LEU B 87 223.401 1.050 -3.311 1.00 0.00 H new ATOM 0 HB2 LEU B 87 221.016 0.814 -1.424 1.00 0.00 H new ATOM 0 HB3 LEU B 87 222.473 1.749 -1.151 1.00 0.00 H new ATOM 0 HG LEU B 87 220.848 2.239 -3.665 1.00 0.00 H new ATOM 0 HD11 LEU B 87 219.540 3.962 -2.465 1.00 0.00 H new ATOM 0 HD12 LEU B 87 219.220 2.337 -1.815 1.00 0.00 H new ATOM 0 HD13 LEU B 87 220.285 3.455 -0.930 1.00 0.00 H new ATOM 0 HD21 LEU B 87 221.771 4.529 -3.369 1.00 0.00 H new ATOM 0 HD22 LEU B 87 222.540 4.017 -1.848 1.00 0.00 H new ATOM 0 HD23 LEU B 87 223.067 3.310 -3.394 1.00 0.00 H new