USER MOD reduce.3.24.130724 H: found=0, std=0, add=824, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 823 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 44 SER OG : rot 79:sc= 1.15 USER MOD Set 1.2: A 46 THR OG1 : rot -150:sc= -0.474 USER MOD Set 1.3: A 61 LYS NZ :NH3+ 174:sc= 1.02 (180deg=0) USER MOD Set 1.4: A 63 GLN : amide:sc= 1.22 K(o=2.9,f=-16!) USER MOD Set 2.1: A 31 HIS : no HD1:sc= -3.36! C(o=-4.1!,f=-8.5!) USER MOD Set 2.2: A 32 SER OG : rot -28:sc= -0.775 USER MOD Single : A 27 SER OG : rot -62:sc= 0.493 USER MOD Single : A 34 HIS :FLIP no HD1:sc= -0.426 F(o=-2,f=-0.43) USER MOD Single : A 38 LYS NZ :NH3+ -131:sc= -0.0651 (180deg=-0.611) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= -1.11 USER MOD Single : A 57 ASN : amide:sc= -2.79! C(o=-2.8!,f=-14!) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0531 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 165:sc= -0.195 USER MOD Single : A 73 TYR OH : rot -135:sc= 0.309 USER MOD Single : A 78 SER OG : rot 94:sc= -1.14 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.716 X(o=-0.72,f=-0.76) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= -1.92 K(o=-1.9,f=-4!) USER MOD Single : A 94 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.24) USER MOD Single : A 103 HIS : no HE2:sc= -9.44! C(o=-9.4!,f=-16!) USER MOD Single : A 105 MET CE :methyl -151:sc= -0.124 (180deg=-0.976) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 30:sc= -0.0154 USER MOD Single : A 111 LYS NZ :NH3+ 177:sc= 0.981 (180deg=0.94) USER MOD Single : A 112 THR OG1 : rot -86:sc= 1.16 USER MOD Single : A 114 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 HIS : no HD1:sc= -0.0586 X(o=-0.059,f=-0.061) USER MOD Single : A 118 SER OG : rot 180:sc= -0.62 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -0.251 K(o=-0.25,f=-3!) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 155:sc= 0.798 (180deg=-0.236) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 287 N ALA A 21 3.862 7.534 7.403 1.00 0.00 N ATOM 288 CA ALA A 21 2.732 6.701 7.777 1.00 0.00 C ATOM 289 C ALA A 21 3.215 5.571 8.688 1.00 0.00 C ATOM 290 O ALA A 21 4.411 5.288 8.751 1.00 0.00 O ATOM 291 CB ALA A 21 2.043 6.178 6.514 1.00 0.00 C ATOM 0 HA ALA A 21 1.996 7.281 8.334 1.00 0.00 H new ATOM 0 HB1 ALA A 21 1.195 5.553 6.794 1.00 0.00 H new ATOM 0 HB2 ALA A 21 1.692 7.019 5.916 1.00 0.00 H new ATOM 0 HB3 ALA A 21 2.751 5.589 5.931 1.00 0.00 H new ATOM 297 N ALA A 22 2.262 4.956 9.371 1.00 0.00 N ATOM 298 CA ALA A 22 2.575 3.863 10.276 1.00 0.00 C ATOM 299 C ALA A 22 2.122 2.542 9.650 1.00 0.00 C ATOM 300 O ALA A 22 0.972 2.412 9.232 1.00 0.00 O ATOM 301 CB ALA A 22 1.920 4.120 11.634 1.00 0.00 C ATOM 0 H ALA A 22 1.272 5.194 9.316 1.00 0.00 H new ATOM 0 HA ALA A 22 3.651 3.798 10.441 1.00 0.00 H new ATOM 0 HB1 ALA A 22 2.155 3.300 12.312 1.00 0.00 H new ATOM 0 HB2 ALA A 22 2.298 5.054 12.049 1.00 0.00 H new ATOM 0 HB3 ALA A 22 0.839 4.189 11.509 1.00 0.00 H new ATOM 307 N VAL A 23 3.049 1.596 9.605 1.00 0.00 N ATOM 308 CA VAL A 23 2.759 0.291 9.037 1.00 0.00 C ATOM 309 C VAL A 23 1.609 -0.354 9.814 1.00 0.00 C ATOM 310 O VAL A 23 1.397 -0.047 10.986 1.00 0.00 O ATOM 311 CB VAL A 23 4.026 -0.567 9.023 1.00 0.00 C ATOM 312 CG1 VAL A 23 3.690 -2.036 8.761 1.00 0.00 C ATOM 313 CG2 VAL A 23 5.031 -0.042 7.996 1.00 0.00 C ATOM 0 H VAL A 23 4.001 1.708 9.953 1.00 0.00 H new ATOM 0 HA VAL A 23 2.437 0.389 8.000 1.00 0.00 H new ATOM 0 HB VAL A 23 4.488 -0.500 10.008 1.00 0.00 H new ATOM 0 HG11 VAL A 23 4.608 -2.624 8.756 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.028 -2.403 9.545 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.194 -2.129 7.795 1.00 0.00 H new ATOM 0 HG21 VAL A 23 5.923 -0.669 8.006 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.582 -0.065 7.003 1.00 0.00 H new ATOM 0 HG23 VAL A 23 5.305 0.983 8.246 1.00 0.00 H new ATOM 323 N ASP A 24 0.896 -1.237 9.129 1.00 0.00 N ATOM 324 CA ASP A 24 -0.227 -1.928 9.740 1.00 0.00 C ATOM 325 C ASP A 24 0.299 -3.036 10.656 1.00 0.00 C ATOM 326 O ASP A 24 1.352 -3.614 10.394 1.00 0.00 O ATOM 327 CB ASP A 24 -1.119 -2.575 8.679 1.00 0.00 C ATOM 328 CG ASP A 24 -2.618 -2.329 8.857 1.00 0.00 C ATOM 329 OD1 ASP A 24 -3.035 -1.174 8.626 1.00 0.00 O ATOM 330 OD2 ASP A 24 -3.313 -3.303 9.221 1.00 0.00 O ATOM 0 H ASP A 24 1.074 -1.490 8.157 1.00 0.00 H new ATOM 0 HA ASP A 24 -0.808 -1.197 10.302 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.819 -2.204 7.699 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.940 -3.650 8.682 1.00 0.00 H new ATOM 335 N PRO A 25 -0.480 -3.304 11.738 1.00 0.00 N ATOM 336 CA PRO A 25 -0.104 -4.332 12.694 1.00 0.00 C ATOM 337 C PRO A 25 -0.355 -5.729 12.123 1.00 0.00 C ATOM 338 O PRO A 25 0.181 -6.715 12.627 1.00 0.00 O ATOM 339 CB PRO A 25 -0.933 -4.039 13.933 1.00 0.00 C ATOM 340 CG PRO A 25 -2.075 -3.149 13.470 1.00 0.00 C ATOM 341 CD PRO A 25 -1.733 -2.639 12.080 1.00 0.00 C ATOM 0 HA PRO A 25 0.960 -4.318 12.931 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -1.311 -4.960 14.377 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -0.334 -3.541 14.695 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -3.011 -3.707 13.452 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -2.213 -2.316 14.159 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -2.518 -2.883 11.365 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -1.620 -1.555 12.073 1.00 0.00 H new ATOM 349 N ASP A 26 -1.170 -5.770 11.080 1.00 0.00 N ATOM 350 CA ASP A 26 -1.499 -7.030 10.435 1.00 0.00 C ATOM 351 C ASP A 26 -0.287 -7.523 9.642 1.00 0.00 C ATOM 352 O ASP A 26 -0.118 -8.725 9.444 1.00 0.00 O ATOM 353 CB ASP A 26 -2.666 -6.862 9.460 1.00 0.00 C ATOM 354 CG ASP A 26 -3.982 -6.410 10.098 1.00 0.00 C ATOM 355 OD1 ASP A 26 -4.184 -6.750 11.283 1.00 0.00 O ATOM 356 OD2 ASP A 26 -4.755 -5.735 9.385 1.00 0.00 O ATOM 0 H ASP A 26 -1.613 -4.950 10.665 1.00 0.00 H new ATOM 0 HA ASP A 26 -1.778 -7.743 11.211 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -2.381 -6.137 8.698 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -2.834 -7.811 8.951 1.00 0.00 H new ATOM 361 N SER A 27 0.525 -6.570 9.209 1.00 0.00 N ATOM 362 CA SER A 27 1.715 -6.893 8.442 1.00 0.00 C ATOM 363 C SER A 27 2.839 -7.336 9.381 1.00 0.00 C ATOM 364 O SER A 27 3.724 -8.091 8.983 1.00 0.00 O ATOM 365 CB SER A 27 2.168 -5.698 7.599 1.00 0.00 C ATOM 366 OG SER A 27 2.912 -4.755 8.366 1.00 0.00 O ATOM 0 H SER A 27 0.382 -5.574 9.375 1.00 0.00 H new ATOM 0 HA SER A 27 1.473 -7.711 7.764 1.00 0.00 H new ATOM 0 HB2 SER A 27 2.778 -6.051 6.768 1.00 0.00 H new ATOM 0 HB3 SER A 27 1.296 -5.207 7.168 1.00 0.00 H new ATOM 0 HG SER A 27 2.347 -4.399 9.083 1.00 0.00 H new ATOM 372 N GLY A 28 2.767 -6.847 10.610 1.00 0.00 N ATOM 373 CA GLY A 28 3.767 -7.183 11.609 1.00 0.00 C ATOM 374 C GLY A 28 4.970 -6.241 11.520 1.00 0.00 C ATOM 375 O GLY A 28 5.740 -6.120 12.471 1.00 0.00 O ATOM 0 H GLY A 28 2.031 -6.221 10.937 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.326 -7.123 12.604 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.096 -8.213 11.468 1.00 0.00 H new ATOM 379 N LEU A 29 5.094 -5.600 10.367 1.00 0.00 N ATOM 380 CA LEU A 29 6.189 -4.673 10.141 1.00 0.00 C ATOM 381 C LEU A 29 5.972 -3.416 10.986 1.00 0.00 C ATOM 382 O LEU A 29 6.854 -2.563 11.075 1.00 0.00 O ATOM 383 CB LEU A 29 6.350 -4.388 8.646 1.00 0.00 C ATOM 384 CG LEU A 29 7.317 -5.302 7.890 1.00 0.00 C ATOM 385 CD1 LEU A 29 7.191 -6.749 8.368 1.00 0.00 C ATOM 386 CD2 LEU A 29 7.118 -5.179 6.378 1.00 0.00 C ATOM 0 H LEU A 29 4.454 -5.705 9.580 1.00 0.00 H new ATOM 0 HA LEU A 29 7.133 -5.114 10.462 1.00 0.00 H new ATOM 0 HB2 LEU A 29 5.370 -4.460 8.175 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.686 -3.358 8.527 1.00 0.00 H new ATOM 0 HG LEU A 29 8.335 -4.978 8.109 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.889 -7.377 7.815 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.421 -6.802 9.432 1.00 0.00 H new ATOM 0 HD13 LEU A 29 6.173 -7.101 8.198 1.00 0.00 H new ATOM 0 HD21 LEU A 29 7.817 -5.839 5.864 1.00 0.00 H new ATOM 0 HD22 LEU A 29 6.097 -5.462 6.121 1.00 0.00 H new ATOM 0 HD23 LEU A 29 7.298 -4.149 6.070 1.00 0.00 H new ATOM 398 N GLU A 30 4.793 -3.342 11.586 1.00 0.00 N ATOM 399 CA GLU A 30 4.449 -2.204 12.422 1.00 0.00 C ATOM 400 C GLU A 30 5.604 -1.872 13.368 1.00 0.00 C ATOM 401 O GLU A 30 5.803 -0.712 13.727 1.00 0.00 O ATOM 402 CB GLU A 30 3.159 -2.467 13.201 1.00 0.00 C ATOM 403 CG GLU A 30 3.237 -3.793 13.960 1.00 0.00 C ATOM 404 CD GLU A 30 2.543 -3.689 15.320 1.00 0.00 C ATOM 405 OE1 GLU A 30 2.601 -2.585 15.903 1.00 0.00 O ATOM 406 OE2 GLU A 30 1.971 -4.716 15.745 1.00 0.00 O ATOM 0 H GLU A 30 4.064 -4.051 11.510 1.00 0.00 H new ATOM 0 HA GLU A 30 4.276 -1.343 11.777 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.981 -1.652 13.903 1.00 0.00 H new ATOM 0 HB3 GLU A 30 2.313 -2.486 12.514 1.00 0.00 H new ATOM 0 HG2 GLU A 30 2.771 -4.582 13.370 1.00 0.00 H new ATOM 0 HG3 GLU A 30 4.281 -4.074 14.101 1.00 0.00 H new ATOM 413 N HIS A 31 6.335 -2.911 13.746 1.00 0.00 N ATOM 414 CA HIS A 31 7.465 -2.743 14.644 1.00 0.00 C ATOM 415 C HIS A 31 8.745 -3.217 13.953 1.00 0.00 C ATOM 416 O HIS A 31 9.841 -3.045 14.482 1.00 0.00 O ATOM 417 CB HIS A 31 7.211 -3.455 15.975 1.00 0.00 C ATOM 418 CG HIS A 31 6.755 -4.887 15.828 1.00 0.00 C ATOM 419 ND1 HIS A 31 6.928 -5.613 14.662 1.00 0.00 N ATOM 420 CD2 HIS A 31 6.132 -5.719 16.711 1.00 0.00 C ATOM 421 CE1 HIS A 31 6.427 -6.826 14.846 1.00 0.00 C ATOM 422 NE2 HIS A 31 5.933 -6.890 16.116 1.00 0.00 N ATOM 0 H HIS A 31 6.167 -3.872 13.447 1.00 0.00 H new ATOM 0 HA HIS A 31 7.592 -1.687 14.881 1.00 0.00 H new ATOM 0 HB2 HIS A 31 8.126 -3.435 16.567 1.00 0.00 H new ATOM 0 HB3 HIS A 31 6.458 -2.900 16.534 1.00 0.00 H new ATOM 0 HD2 HIS A 31 5.848 -5.468 17.723 1.00 0.00 H new ATOM 0 HE1 HIS A 31 6.412 -7.624 14.118 1.00 0.00 H new ATOM 0 HE2 HIS A 31 5.485 -7.703 16.539 1.00 0.00 H new ATOM 430 N SER A 32 8.562 -3.805 12.779 1.00 0.00 N ATOM 431 CA SER A 32 9.689 -4.305 12.010 1.00 0.00 C ATOM 432 C SER A 32 10.114 -3.267 10.969 1.00 0.00 C ATOM 433 O SER A 32 11.159 -2.634 11.110 1.00 0.00 O ATOM 434 CB SER A 32 9.344 -5.630 11.327 1.00 0.00 C ATOM 435 OG SER A 32 8.304 -6.327 12.007 1.00 0.00 O ATOM 0 H SER A 32 7.651 -3.946 12.342 1.00 0.00 H new ATOM 0 HA SER A 32 10.518 -4.484 12.695 1.00 0.00 H new ATOM 0 HB2 SER A 32 9.039 -5.439 10.298 1.00 0.00 H new ATOM 0 HB3 SER A 32 10.234 -6.258 11.285 1.00 0.00 H new ATOM 0 HG SER A 32 8.314 -6.085 12.957 1.00 0.00 H new ATOM 441 N ALA A 33 9.281 -3.123 9.949 1.00 0.00 N ATOM 442 CA ALA A 33 9.558 -2.173 8.885 1.00 0.00 C ATOM 443 C ALA A 33 8.689 -0.928 9.081 1.00 0.00 C ATOM 444 O ALA A 33 8.040 -0.776 10.114 1.00 0.00 O ATOM 445 CB ALA A 33 9.323 -2.841 7.529 1.00 0.00 C ATOM 0 H ALA A 33 8.414 -3.648 9.837 1.00 0.00 H new ATOM 0 HA ALA A 33 10.600 -1.856 8.915 1.00 0.00 H new ATOM 0 HB1 ALA A 33 9.531 -2.128 6.731 1.00 0.00 H new ATOM 0 HB2 ALA A 33 9.984 -3.702 7.428 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.286 -3.170 7.460 1.00 0.00 H new ATOM 451 N HIS A 34 8.705 -0.070 8.071 1.00 0.00 N ATOM 452 CA HIS A 34 7.927 1.156 8.119 1.00 0.00 C ATOM 453 C HIS A 34 7.432 1.505 6.714 1.00 0.00 C ATOM 454 O HIS A 34 7.993 1.042 5.722 1.00 0.00 O ATOM 455 CB HIS A 34 8.732 2.286 8.762 1.00 0.00 C ATOM 456 CG HIS A 34 9.969 2.677 7.988 1.00 0.00 C ATOM 457 ND1 HIS A 34 10.157 2.877 6.652 1.00 0.00 N flip ATOM 458 CD2 HIS A 34 11.192 2.904 8.594 1.00 0.00 C flip ATOM 459 CE1 HIS A 34 11.427 3.210 6.453 1.00 0.00 C flip ATOM 460 NE2 HIS A 34 12.070 3.226 7.655 1.00 0.00 N flip ATOM 0 H HIS A 34 9.244 -0.200 7.215 1.00 0.00 H new ATOM 0 HA HIS A 34 7.050 1.010 8.750 1.00 0.00 H new ATOM 0 HB2 HIS A 34 8.090 3.161 8.868 1.00 0.00 H new ATOM 0 HB3 HIS A 34 9.025 1.983 9.767 1.00 0.00 H new ATOM 0 HD2 HIS A 34 11.396 2.831 9.652 1.00 0.00 H new ATOM 0 HE1 HIS A 34 11.877 3.432 5.496 1.00 0.00 H new ATOM 0 HE2 HIS A 34 13.054 3.447 7.805 1.00 0.00 H new ATOM 468 N VAL A 35 6.387 2.318 6.674 1.00 0.00 N ATOM 469 CA VAL A 35 5.811 2.735 5.407 1.00 0.00 C ATOM 470 C VAL A 35 6.922 3.256 4.493 1.00 0.00 C ATOM 471 O VAL A 35 7.814 3.974 4.942 1.00 0.00 O ATOM 472 CB VAL A 35 4.704 3.764 5.649 1.00 0.00 C ATOM 473 CG1 VAL A 35 4.174 4.320 4.325 1.00 0.00 C ATOM 474 CG2 VAL A 35 3.572 3.165 6.485 1.00 0.00 C ATOM 0 H VAL A 35 5.924 2.699 7.499 1.00 0.00 H new ATOM 0 HA VAL A 35 5.345 1.889 4.902 1.00 0.00 H new ATOM 0 HB VAL A 35 5.133 4.592 6.212 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.389 5.049 4.525 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.987 4.802 3.782 1.00 0.00 H new ATOM 0 HG13 VAL A 35 3.769 3.506 3.724 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.799 3.917 6.642 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.145 2.310 5.960 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.964 2.841 7.449 1.00 0.00 H new ATOM 484 N LEU A 36 6.832 2.873 3.228 1.00 0.00 N ATOM 485 CA LEU A 36 7.818 3.292 2.247 1.00 0.00 C ATOM 486 C LEU A 36 7.557 4.749 1.858 1.00 0.00 C ATOM 487 O LEU A 36 6.419 5.213 1.903 1.00 0.00 O ATOM 488 CB LEU A 36 7.832 2.331 1.057 1.00 0.00 C ATOM 489 CG LEU A 36 8.641 2.783 -0.161 1.00 0.00 C ATOM 490 CD1 LEU A 36 10.126 2.911 0.184 1.00 0.00 C ATOM 491 CD2 LEU A 36 8.408 1.850 -1.351 1.00 0.00 C ATOM 0 H LEU A 36 6.091 2.277 2.860 1.00 0.00 H new ATOM 0 HA LEU A 36 8.821 3.250 2.673 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.226 1.372 1.394 1.00 0.00 H new ATOM 0 HB3 LEU A 36 6.803 2.160 0.742 1.00 0.00 H new ATOM 0 HG LEU A 36 8.292 3.773 -0.455 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.678 3.233 -0.699 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.253 3.645 0.980 1.00 0.00 H new ATOM 0 HD13 LEU A 36 10.507 1.946 0.517 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.994 2.194 -2.203 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.713 0.838 -1.085 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.350 1.853 -1.614 1.00 0.00 H new ATOM 503 N GLU A 37 8.631 5.430 1.486 1.00 0.00 N ATOM 504 CA GLU A 37 8.533 6.825 1.090 1.00 0.00 C ATOM 505 C GLU A 37 9.369 7.080 -0.166 1.00 0.00 C ATOM 506 O GLU A 37 10.511 6.633 -0.257 1.00 0.00 O ATOM 507 CB GLU A 37 8.960 7.750 2.231 1.00 0.00 C ATOM 508 CG GLU A 37 7.757 8.166 3.079 1.00 0.00 C ATOM 509 CD GLU A 37 8.159 8.361 4.542 1.00 0.00 C ATOM 510 OE1 GLU A 37 8.636 9.473 4.857 1.00 0.00 O ATOM 511 OE2 GLU A 37 7.980 7.394 5.314 1.00 0.00 O ATOM 0 H GLU A 37 9.574 5.042 1.450 1.00 0.00 H new ATOM 0 HA GLU A 37 7.491 7.045 0.859 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.694 7.244 2.858 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.446 8.636 1.823 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.334 9.091 2.688 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.979 7.406 3.010 1.00 0.00 H new ATOM 518 N LYS A 38 8.767 7.798 -1.103 1.00 0.00 N ATOM 519 CA LYS A 38 9.442 8.118 -2.349 1.00 0.00 C ATOM 520 C LYS A 38 8.940 9.468 -2.864 1.00 0.00 C ATOM 521 O LYS A 38 7.803 9.855 -2.596 1.00 0.00 O ATOM 522 CB LYS A 38 9.279 6.977 -3.355 1.00 0.00 C ATOM 523 CG LYS A 38 10.194 7.177 -4.565 1.00 0.00 C ATOM 524 CD LYS A 38 10.410 5.861 -5.313 1.00 0.00 C ATOM 525 CE LYS A 38 11.130 6.097 -6.642 1.00 0.00 C ATOM 526 NZ LYS A 38 10.298 6.927 -7.542 1.00 0.00 N ATOM 0 H LYS A 38 7.819 8.167 -1.024 1.00 0.00 H new ATOM 0 HA LYS A 38 10.515 8.218 -2.186 1.00 0.00 H new ATOM 0 HB2 LYS A 38 9.510 6.027 -2.873 1.00 0.00 H new ATOM 0 HB3 LYS A 38 8.241 6.923 -3.684 1.00 0.00 H new ATOM 0 HG2 LYS A 38 9.757 7.914 -5.238 1.00 0.00 H new ATOM 0 HG3 LYS A 38 11.154 7.575 -4.237 1.00 0.00 H new ATOM 0 HD2 LYS A 38 10.994 5.179 -4.695 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.449 5.381 -5.496 1.00 0.00 H new ATOM 0 HE2 LYS A 38 12.085 6.590 -6.462 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.349 5.141 -7.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 10.250 6.481 -8.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 9.339 7.010 -7.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 10.720 7.874 -7.630 1.00 0.00 H new ATOM 540 N GLY A 39 9.811 10.149 -3.594 1.00 0.00 N ATOM 541 CA GLY A 39 9.470 11.448 -4.148 1.00 0.00 C ATOM 542 C GLY A 39 8.665 12.277 -3.147 1.00 0.00 C ATOM 543 O GLY A 39 7.625 12.836 -3.492 1.00 0.00 O ATOM 0 H GLY A 39 10.753 9.825 -3.815 1.00 0.00 H new ATOM 0 HA2 GLY A 39 10.381 11.982 -4.419 1.00 0.00 H new ATOM 0 HA3 GLY A 39 8.893 11.317 -5.064 1.00 0.00 H new ATOM 547 N GLY A 40 9.176 12.332 -1.926 1.00 0.00 N ATOM 548 CA GLY A 40 8.518 13.084 -0.871 1.00 0.00 C ATOM 549 C GLY A 40 7.046 12.684 -0.749 1.00 0.00 C ATOM 550 O GLY A 40 6.181 13.537 -0.557 1.00 0.00 O ATOM 0 H GLY A 40 10.039 11.868 -1.643 1.00 0.00 H new ATOM 0 HA2 GLY A 40 9.026 12.908 0.077 1.00 0.00 H new ATOM 0 HA3 GLY A 40 8.593 14.151 -1.079 1.00 0.00 H new ATOM 554 N LYS A 41 6.807 11.385 -0.865 1.00 0.00 N ATOM 555 CA LYS A 41 5.455 10.862 -0.770 1.00 0.00 C ATOM 556 C LYS A 41 5.451 9.637 0.147 1.00 0.00 C ATOM 557 O LYS A 41 6.490 9.016 0.365 1.00 0.00 O ATOM 558 CB LYS A 41 4.888 10.588 -2.164 1.00 0.00 C ATOM 559 CG LYS A 41 4.444 11.887 -2.841 1.00 0.00 C ATOM 560 CD LYS A 41 2.996 12.226 -2.480 1.00 0.00 C ATOM 561 CE LYS A 41 2.029 11.700 -3.542 1.00 0.00 C ATOM 562 NZ LYS A 41 0.821 12.553 -3.610 1.00 0.00 N ATOM 0 H LYS A 41 7.527 10.680 -1.024 1.00 0.00 H new ATOM 0 HA LYS A 41 4.791 11.600 -0.320 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.642 10.094 -2.777 1.00 0.00 H new ATOM 0 HB3 LYS A 41 4.042 9.905 -2.088 1.00 0.00 H new ATOM 0 HG2 LYS A 41 5.099 12.703 -2.536 1.00 0.00 H new ATOM 0 HG3 LYS A 41 4.540 11.789 -3.922 1.00 0.00 H new ATOM 0 HD2 LYS A 41 2.748 11.793 -1.511 1.00 0.00 H new ATOM 0 HD3 LYS A 41 2.885 13.306 -2.384 1.00 0.00 H new ATOM 0 HE2 LYS A 41 2.522 11.680 -4.514 1.00 0.00 H new ATOM 0 HE3 LYS A 41 1.745 10.674 -3.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 0.175 12.182 -4.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 0.342 12.551 -2.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 1.096 13.525 -3.856 1.00 0.00 H new ATOM 576 N VAL A 42 4.269 9.326 0.660 1.00 0.00 N ATOM 577 CA VAL A 42 4.116 8.187 1.549 1.00 0.00 C ATOM 578 C VAL A 42 3.281 7.111 0.852 1.00 0.00 C ATOM 579 O VAL A 42 2.291 7.420 0.191 1.00 0.00 O ATOM 580 CB VAL A 42 3.515 8.640 2.881 1.00 0.00 C ATOM 581 CG1 VAL A 42 2.952 7.450 3.662 1.00 0.00 C ATOM 582 CG2 VAL A 42 4.544 9.405 3.715 1.00 0.00 C ATOM 0 H VAL A 42 3.409 9.843 0.477 1.00 0.00 H new ATOM 0 HA VAL A 42 5.087 7.748 1.778 1.00 0.00 H new ATOM 0 HB VAL A 42 2.690 9.318 2.662 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.531 7.800 4.605 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.173 6.965 3.074 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.751 6.737 3.864 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.091 9.716 4.656 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.399 8.760 3.919 1.00 0.00 H new ATOM 0 HG23 VAL A 42 4.877 10.285 3.165 1.00 0.00 H new ATOM 592 N PHE A 43 3.712 5.870 1.024 1.00 0.00 N ATOM 593 CA PHE A 43 3.017 4.746 0.419 1.00 0.00 C ATOM 594 C PHE A 43 1.879 4.258 1.318 1.00 0.00 C ATOM 595 O PHE A 43 1.839 3.087 1.694 1.00 0.00 O ATOM 596 CB PHE A 43 4.041 3.621 0.257 1.00 0.00 C ATOM 597 CG PHE A 43 4.967 3.792 -0.949 1.00 0.00 C ATOM 598 CD1 PHE A 43 5.670 4.945 -1.108 1.00 0.00 C ATOM 599 CD2 PHE A 43 5.086 2.792 -1.862 1.00 0.00 C ATOM 600 CE1 PHE A 43 6.529 5.104 -2.228 1.00 0.00 C ATOM 601 CE2 PHE A 43 5.946 2.950 -2.982 1.00 0.00 C ATOM 602 CZ PHE A 43 6.649 4.103 -3.141 1.00 0.00 C ATOM 0 H PHE A 43 4.534 5.618 1.573 1.00 0.00 H new ATOM 0 HA PHE A 43 2.587 5.045 -0.537 1.00 0.00 H new ATOM 0 HB2 PHE A 43 4.646 3.561 1.161 1.00 0.00 H new ATOM 0 HB3 PHE A 43 3.512 2.672 0.164 1.00 0.00 H new ATOM 0 HD1 PHE A 43 5.575 5.740 -0.383 1.00 0.00 H new ATOM 0 HD2 PHE A 43 4.527 1.877 -1.736 1.00 0.00 H new ATOM 0 HE1 PHE A 43 7.087 6.020 -2.355 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.041 2.155 -3.707 1.00 0.00 H new ATOM 0 HZ PHE A 43 7.303 4.224 -3.992 1.00 0.00 H new ATOM 612 N SER A 44 0.982 5.179 1.636 1.00 0.00 N ATOM 613 CA SER A 44 -0.154 4.857 2.484 1.00 0.00 C ATOM 614 C SER A 44 -1.434 5.450 1.891 1.00 0.00 C ATOM 615 O SER A 44 -1.726 6.628 2.089 1.00 0.00 O ATOM 616 CB SER A 44 0.059 5.371 3.909 1.00 0.00 C ATOM 617 OG SER A 44 -1.123 5.264 4.697 1.00 0.00 O ATOM 0 H SER A 44 1.018 6.149 1.322 1.00 0.00 H new ATOM 0 HA SER A 44 -0.251 3.772 2.529 1.00 0.00 H new ATOM 0 HB2 SER A 44 0.862 4.806 4.382 1.00 0.00 H new ATOM 0 HB3 SER A 44 0.379 6.412 3.875 1.00 0.00 H new ATOM 0 HG SER A 44 -1.234 4.337 4.996 1.00 0.00 H new ATOM 623 N ALA A 45 -2.163 4.605 1.176 1.00 0.00 N ATOM 624 CA ALA A 45 -3.405 5.031 0.554 1.00 0.00 C ATOM 625 C ALA A 45 -4.565 4.220 1.134 1.00 0.00 C ATOM 626 O ALA A 45 -4.464 3.003 1.284 1.00 0.00 O ATOM 627 CB ALA A 45 -3.292 4.882 -0.965 1.00 0.00 C ATOM 0 H ALA A 45 -1.917 3.628 1.014 1.00 0.00 H new ATOM 0 HA ALA A 45 -3.599 6.082 0.766 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -4.224 5.201 -1.432 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -2.472 5.500 -1.331 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -3.100 3.839 -1.215 1.00 0.00 H new ATOM 633 N THR A 46 -5.642 4.927 1.446 1.00 0.00 N ATOM 634 CA THR A 46 -6.820 4.288 2.007 1.00 0.00 C ATOM 635 C THR A 46 -7.980 4.341 1.011 1.00 0.00 C ATOM 636 O THR A 46 -8.669 5.355 0.908 1.00 0.00 O ATOM 637 CB THR A 46 -7.135 4.966 3.342 1.00 0.00 C ATOM 638 OG1 THR A 46 -6.025 4.630 4.171 1.00 0.00 O ATOM 639 CG2 THR A 46 -8.334 4.333 4.052 1.00 0.00 C ATOM 0 H THR A 46 -5.723 5.936 1.321 1.00 0.00 H new ATOM 0 HA THR A 46 -6.643 3.229 2.197 1.00 0.00 H new ATOM 0 HB THR A 46 -7.330 6.025 3.174 1.00 0.00 H new ATOM 0 HG1 THR A 46 -6.316 4.587 5.106 1.00 0.00 H new ATOM 0 HG21 THR A 46 -8.514 4.851 4.994 1.00 0.00 H new ATOM 0 HG22 THR A 46 -9.217 4.414 3.418 1.00 0.00 H new ATOM 0 HG23 THR A 46 -8.126 3.282 4.251 1.00 0.00 H new ATOM 647 N LEU A 47 -8.161 3.236 0.303 1.00 0.00 N ATOM 648 CA LEU A 47 -9.226 3.143 -0.681 1.00 0.00 C ATOM 649 C LEU A 47 -10.486 2.589 -0.013 1.00 0.00 C ATOM 650 O LEU A 47 -10.400 1.868 0.981 1.00 0.00 O ATOM 651 CB LEU A 47 -8.766 2.333 -1.894 1.00 0.00 C ATOM 652 CG LEU A 47 -7.519 2.852 -2.614 1.00 0.00 C ATOM 653 CD1 LEU A 47 -7.132 1.930 -3.772 1.00 0.00 C ATOM 654 CD2 LEU A 47 -7.713 4.298 -3.072 1.00 0.00 C ATOM 0 H LEU A 47 -7.588 2.397 0.391 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.477 4.132 -1.064 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.575 1.309 -1.571 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -9.586 2.294 -2.612 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.689 2.847 -1.908 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -6.243 2.321 -4.267 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.924 0.931 -3.388 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.953 1.880 -4.487 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.813 4.642 -3.581 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.560 4.352 -3.756 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -7.905 4.931 -2.206 1.00 0.00 H new ATOM 666 N GLY A 48 -11.626 2.945 -0.585 1.00 0.00 N ATOM 667 CA GLY A 48 -12.902 2.492 -0.056 1.00 0.00 C ATOM 668 C GLY A 48 -13.921 2.294 -1.180 1.00 0.00 C ATOM 669 O GLY A 48 -14.193 3.217 -1.947 1.00 0.00 O ATOM 0 H GLY A 48 -11.694 3.542 -1.409 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -12.764 1.555 0.484 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -13.282 3.220 0.660 1.00 0.00 H new ATOM 673 N LEU A 49 -14.458 1.084 -1.243 1.00 0.00 N ATOM 674 CA LEU A 49 -15.441 0.753 -2.260 1.00 0.00 C ATOM 675 C LEU A 49 -16.721 0.257 -1.583 1.00 0.00 C ATOM 676 O LEU A 49 -16.663 -0.429 -0.564 1.00 0.00 O ATOM 677 CB LEU A 49 -14.856 -0.237 -3.269 1.00 0.00 C ATOM 678 CG LEU A 49 -15.545 -0.290 -4.634 1.00 0.00 C ATOM 679 CD1 LEU A 49 -16.757 -1.223 -4.600 1.00 0.00 C ATOM 680 CD2 LEU A 49 -15.916 1.114 -5.116 1.00 0.00 C ATOM 0 H LEU A 49 -14.230 0.321 -0.606 1.00 0.00 H new ATOM 0 HA LEU A 49 -15.707 1.639 -2.836 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -13.806 0.011 -3.424 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -14.887 -1.234 -2.830 1.00 0.00 H new ATOM 0 HG LEU A 49 -14.841 -0.703 -5.356 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -17.229 -1.243 -5.582 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -16.434 -2.229 -4.332 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -17.473 -0.863 -3.861 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -16.404 1.048 -6.088 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -16.595 1.577 -4.400 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -15.014 1.719 -5.204 1.00 0.00 H new ATOM 692 N VAL A 50 -17.847 0.624 -2.178 1.00 0.00 N ATOM 693 CA VAL A 50 -19.139 0.226 -1.646 1.00 0.00 C ATOM 694 C VAL A 50 -20.020 -0.286 -2.787 1.00 0.00 C ATOM 695 O VAL A 50 -20.112 0.349 -3.837 1.00 0.00 O ATOM 696 CB VAL A 50 -19.770 1.389 -0.878 1.00 0.00 C ATOM 697 CG1 VAL A 50 -21.130 0.991 -0.301 1.00 0.00 C ATOM 698 CG2 VAL A 50 -18.834 1.892 0.222 1.00 0.00 C ATOM 0 H VAL A 50 -17.891 1.193 -3.024 1.00 0.00 H new ATOM 0 HA VAL A 50 -19.023 -0.591 -0.934 1.00 0.00 H new ATOM 0 HB VAL A 50 -19.930 2.207 -1.581 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -21.557 1.835 0.240 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -21.799 0.704 -1.112 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -21.004 0.150 0.381 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -19.307 2.719 0.752 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -18.627 1.083 0.922 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -17.900 2.234 -0.223 1.00 0.00 H new ATOM 708 N ASP A 51 -20.645 -1.428 -2.543 1.00 0.00 N ATOM 709 CA ASP A 51 -21.516 -2.032 -3.538 1.00 0.00 C ATOM 710 C ASP A 51 -22.901 -1.388 -3.455 1.00 0.00 C ATOM 711 O ASP A 51 -23.457 -1.240 -2.367 1.00 0.00 O ATOM 712 CB ASP A 51 -21.677 -3.533 -3.290 1.00 0.00 C ATOM 713 CG ASP A 51 -21.085 -4.434 -4.375 1.00 0.00 C ATOM 714 OD1 ASP A 51 -21.322 -4.124 -5.563 1.00 0.00 O ATOM 715 OD2 ASP A 51 -20.408 -5.413 -3.993 1.00 0.00 O ATOM 0 H ASP A 51 -20.566 -1.951 -1.671 1.00 0.00 H new ATOM 0 HA ASP A 51 -21.068 -1.874 -4.519 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -21.209 -3.781 -2.337 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -22.739 -3.758 -3.191 1.00 0.00 H new ATOM 720 N ILE A 52 -23.419 -1.022 -4.618 1.00 0.00 N ATOM 721 CA ILE A 52 -24.729 -0.397 -4.691 1.00 0.00 C ATOM 722 C ILE A 52 -25.797 -1.480 -4.854 1.00 0.00 C ATOM 723 O ILE A 52 -26.881 -1.379 -4.281 1.00 0.00 O ATOM 724 CB ILE A 52 -24.756 0.664 -5.792 1.00 0.00 C ATOM 725 CG1 ILE A 52 -26.075 1.439 -5.774 1.00 0.00 C ATOM 726 CG2 ILE A 52 -24.475 0.041 -7.161 1.00 0.00 C ATOM 727 CD1 ILE A 52 -25.832 2.939 -5.951 1.00 0.00 C ATOM 0 H ILE A 52 -22.955 -1.146 -5.518 1.00 0.00 H new ATOM 0 HA ILE A 52 -24.950 0.133 -3.765 1.00 0.00 H new ATOM 0 HB ILE A 52 -23.959 1.381 -5.595 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -26.725 1.076 -6.570 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -26.594 1.260 -4.832 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -24.500 0.817 -7.926 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -23.491 -0.428 -7.152 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -25.233 -0.710 -7.381 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -26.786 3.467 -5.935 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -25.202 3.304 -5.140 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -25.335 3.117 -6.905 1.00 0.00 H new ATOM 739 N VAL A 53 -25.454 -2.491 -5.638 1.00 0.00 N ATOM 740 CA VAL A 53 -26.371 -3.592 -5.884 1.00 0.00 C ATOM 741 C VAL A 53 -26.358 -4.539 -4.682 1.00 0.00 C ATOM 742 O VAL A 53 -27.407 -4.847 -4.119 1.00 0.00 O ATOM 743 CB VAL A 53 -26.011 -4.289 -7.198 1.00 0.00 C ATOM 744 CG1 VAL A 53 -26.016 -3.298 -8.364 1.00 0.00 C ATOM 745 CG2 VAL A 53 -24.661 -5.001 -7.089 1.00 0.00 C ATOM 0 H VAL A 53 -24.554 -2.571 -6.111 1.00 0.00 H new ATOM 0 HA VAL A 53 -27.390 -3.223 -5.996 1.00 0.00 H new ATOM 0 HB VAL A 53 -26.772 -5.043 -7.397 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -25.757 -3.819 -9.286 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -27.008 -2.857 -8.463 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -25.286 -2.510 -8.175 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -24.429 -5.488 -8.036 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -23.884 -4.273 -6.855 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -24.707 -5.749 -6.298 1.00 0.00 H new ATOM 755 N LYS A 54 -25.159 -4.974 -4.325 1.00 0.00 N ATOM 756 CA LYS A 54 -24.995 -5.880 -3.201 1.00 0.00 C ATOM 757 C LYS A 54 -25.312 -5.135 -1.902 1.00 0.00 C ATOM 758 O LYS A 54 -25.529 -5.757 -0.863 1.00 0.00 O ATOM 759 CB LYS A 54 -23.604 -6.515 -3.221 1.00 0.00 C ATOM 760 CG LYS A 54 -23.559 -7.706 -4.181 1.00 0.00 C ATOM 761 CD LYS A 54 -24.302 -8.909 -3.596 1.00 0.00 C ATOM 762 CE LYS A 54 -23.686 -10.223 -4.083 1.00 0.00 C ATOM 763 NZ LYS A 54 -24.668 -11.325 -3.979 1.00 0.00 N ATOM 0 H LYS A 54 -24.291 -4.716 -4.795 1.00 0.00 H new ATOM 0 HA LYS A 54 -25.699 -6.709 -3.275 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -22.865 -5.772 -3.522 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -23.335 -6.842 -2.217 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -24.006 -7.426 -5.135 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -22.523 -7.977 -4.382 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -24.267 -8.868 -2.507 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -25.353 -8.867 -3.883 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -23.358 -10.117 -5.117 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -22.802 -10.459 -3.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -24.234 -12.209 -4.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -24.961 -11.436 -2.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -25.500 -11.105 -4.563 1.00 0.00 H new ATOM 777 N GLY A 55 -25.329 -3.814 -2.004 1.00 0.00 N ATOM 778 CA GLY A 55 -25.615 -2.978 -0.850 1.00 0.00 C ATOM 779 C GLY A 55 -24.659 -3.289 0.303 1.00 0.00 C ATOM 780 O GLY A 55 -25.075 -3.351 1.460 1.00 0.00 O ATOM 0 H GLY A 55 -25.149 -3.302 -2.868 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -25.527 -1.927 -1.127 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -26.644 -3.137 -0.527 1.00 0.00 H new ATOM 784 N THR A 56 -23.397 -3.478 -0.051 1.00 0.00 N ATOM 785 CA THR A 56 -22.378 -3.781 0.940 1.00 0.00 C ATOM 786 C THR A 56 -21.272 -2.725 0.908 1.00 0.00 C ATOM 787 O THR A 56 -21.222 -1.901 -0.003 1.00 0.00 O ATOM 788 CB THR A 56 -21.872 -5.201 0.678 1.00 0.00 C ATOM 789 OG1 THR A 56 -21.641 -5.233 -0.728 1.00 0.00 O ATOM 790 CG2 THR A 56 -22.953 -6.260 0.903 1.00 0.00 C ATOM 0 H THR A 56 -23.056 -3.427 -1.011 1.00 0.00 H new ATOM 0 HA THR A 56 -22.786 -3.747 1.950 1.00 0.00 H new ATOM 0 HB THR A 56 -21.021 -5.408 1.327 1.00 0.00 H new ATOM 0 HG1 THR A 56 -21.309 -6.119 -0.985 1.00 0.00 H new ATOM 0 HG21 THR A 56 -22.541 -7.249 0.703 1.00 0.00 H new ATOM 0 HG22 THR A 56 -23.299 -6.213 1.936 1.00 0.00 H new ATOM 0 HG23 THR A 56 -23.791 -6.074 0.231 1.00 0.00 H new ATOM 798 N ASN A 57 -20.411 -2.785 1.914 1.00 0.00 N ATOM 799 CA ASN A 57 -19.308 -1.844 2.012 1.00 0.00 C ATOM 800 C ASN A 57 -17.985 -2.601 1.882 1.00 0.00 C ATOM 801 O ASN A 57 -17.915 -3.792 2.180 1.00 0.00 O ATOM 802 CB ASN A 57 -19.313 -1.130 3.365 1.00 0.00 C ATOM 803 CG ASN A 57 -18.503 0.166 3.304 1.00 0.00 C ATOM 804 OD1 ASN A 57 -17.525 0.284 2.584 1.00 0.00 O ATOM 805 ND2 ASN A 57 -18.963 1.130 4.097 1.00 0.00 N ATOM 0 H ASN A 57 -20.455 -3.471 2.668 1.00 0.00 H new ATOM 0 HA ASN A 57 -19.420 -1.109 1.215 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -20.339 -0.908 3.659 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -18.897 -1.787 4.129 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -18.491 2.034 4.127 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -19.787 0.965 4.675 1.00 0.00 H new ATOM 812 N SER A 58 -16.968 -1.878 1.435 1.00 0.00 N ATOM 813 CA SER A 58 -15.651 -2.466 1.261 1.00 0.00 C ATOM 814 C SER A 58 -14.572 -1.398 1.449 1.00 0.00 C ATOM 815 O SER A 58 -14.771 -0.239 1.088 1.00 0.00 O ATOM 816 CB SER A 58 -15.517 -3.120 -0.115 1.00 0.00 C ATOM 817 OG SER A 58 -16.569 -4.047 -0.371 1.00 0.00 O ATOM 0 H SER A 58 -17.030 -0.890 1.188 1.00 0.00 H new ATOM 0 HA SER A 58 -15.521 -3.242 2.016 1.00 0.00 H new ATOM 0 HB2 SER A 58 -15.519 -2.348 -0.885 1.00 0.00 H new ATOM 0 HB3 SER A 58 -14.558 -3.633 -0.180 1.00 0.00 H new ATOM 0 HG SER A 58 -16.448 -4.442 -1.260 1.00 0.00 H new ATOM 823 N TYR A 59 -13.452 -1.826 2.013 1.00 0.00 N ATOM 824 CA TYR A 59 -12.342 -0.921 2.253 1.00 0.00 C ATOM 825 C TYR A 59 -11.008 -1.584 1.904 1.00 0.00 C ATOM 826 O TYR A 59 -10.617 -2.568 2.531 1.00 0.00 O ATOM 827 CB TYR A 59 -12.366 -0.610 3.751 1.00 0.00 C ATOM 828 CG TYR A 59 -11.797 -1.727 4.628 1.00 0.00 C ATOM 829 CD1 TYR A 59 -12.612 -2.757 5.050 1.00 0.00 C ATOM 830 CD2 TYR A 59 -10.467 -1.705 4.996 1.00 0.00 C ATOM 831 CE1 TYR A 59 -12.076 -3.808 5.875 1.00 0.00 C ATOM 832 CE2 TYR A 59 -9.930 -2.756 5.821 1.00 0.00 C ATOM 833 CZ TYR A 59 -10.762 -3.756 6.220 1.00 0.00 C ATOM 834 OH TYR A 59 -10.255 -4.749 6.999 1.00 0.00 O ATOM 0 H TYR A 59 -13.290 -2.788 2.311 1.00 0.00 H new ATOM 0 HA TYR A 59 -12.438 -0.026 1.639 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -11.799 0.304 3.931 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -13.394 -0.412 4.054 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -13.653 -2.775 4.761 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -9.829 -0.899 4.665 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -12.704 -4.620 6.212 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -8.891 -2.751 6.116 1.00 0.00 H new ATOM 0 HH TYR A 59 -9.304 -4.582 7.165 1.00 0.00 H new ATOM 844 N TYR A 60 -10.346 -1.019 0.905 1.00 0.00 N ATOM 845 CA TYR A 60 -9.064 -1.544 0.465 1.00 0.00 C ATOM 846 C TYR A 60 -7.923 -0.602 0.855 1.00 0.00 C ATOM 847 O TYR A 60 -7.827 0.510 0.338 1.00 0.00 O ATOM 848 CB TYR A 60 -9.143 -1.626 -1.060 1.00 0.00 C ATOM 849 CG TYR A 60 -7.894 -2.215 -1.718 1.00 0.00 C ATOM 850 CD1 TYR A 60 -6.775 -1.429 -1.901 1.00 0.00 C ATOM 851 CD2 TYR A 60 -7.886 -3.533 -2.127 1.00 0.00 C ATOM 852 CE1 TYR A 60 -5.598 -1.984 -2.519 1.00 0.00 C ATOM 853 CE2 TYR A 60 -6.709 -4.088 -2.746 1.00 0.00 C ATOM 854 CZ TYR A 60 -5.624 -3.286 -2.911 1.00 0.00 C ATOM 855 OH TYR A 60 -4.513 -3.809 -3.496 1.00 0.00 O ATOM 0 H TYR A 60 -10.673 -0.203 0.388 1.00 0.00 H new ATOM 0 HA TYR A 60 -8.867 -2.512 0.926 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.006 -2.231 -1.337 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -9.314 -0.626 -1.459 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -6.781 -0.398 -1.581 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -8.762 -4.148 -1.983 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -4.715 -1.380 -2.668 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -6.689 -5.118 -3.071 1.00 0.00 H new ATOM 0 HH TYR A 60 -4.578 -4.787 -3.506 1.00 0.00 H new ATOM 865 N LYS A 61 -7.087 -1.082 1.764 1.00 0.00 N ATOM 866 CA LYS A 61 -5.956 -0.297 2.229 1.00 0.00 C ATOM 867 C LYS A 61 -4.668 -0.856 1.622 1.00 0.00 C ATOM 868 O LYS A 61 -4.482 -2.071 1.563 1.00 0.00 O ATOM 869 CB LYS A 61 -5.940 -0.234 3.758 1.00 0.00 C ATOM 870 CG LYS A 61 -6.162 1.197 4.251 1.00 0.00 C ATOM 871 CD LYS A 61 -4.829 1.889 4.542 1.00 0.00 C ATOM 872 CE LYS A 61 -4.743 2.318 6.009 1.00 0.00 C ATOM 873 NZ LYS A 61 -3.974 3.575 6.137 1.00 0.00 N ATOM 0 H LYS A 61 -7.170 -2.005 2.191 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.045 0.736 1.892 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -6.716 -0.885 4.160 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -4.986 -0.607 4.131 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -6.713 1.763 3.500 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.774 1.184 5.153 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -4.006 1.214 4.308 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -4.719 2.761 3.897 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -5.746 2.456 6.413 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -4.268 1.533 6.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -4.011 3.906 7.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -2.984 3.406 5.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -4.385 4.299 5.513 1.00 0.00 H new ATOM 887 N LEU A 62 -3.812 0.056 1.187 1.00 0.00 N ATOM 888 CA LEU A 62 -2.546 -0.331 0.587 1.00 0.00 C ATOM 889 C LEU A 62 -1.409 0.433 1.268 1.00 0.00 C ATOM 890 O LEU A 62 -1.389 1.662 1.258 1.00 0.00 O ATOM 891 CB LEU A 62 -2.593 -0.141 -0.931 1.00 0.00 C ATOM 892 CG LEU A 62 -1.499 -0.854 -1.729 1.00 0.00 C ATOM 893 CD1 LEU A 62 -1.885 -2.307 -2.012 1.00 0.00 C ATOM 894 CD2 LEU A 62 -1.170 -0.088 -3.012 1.00 0.00 C ATOM 0 H LEU A 62 -3.970 1.062 1.238 1.00 0.00 H new ATOM 0 HA LEU A 62 -2.357 -1.393 0.747 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -3.562 -0.487 -1.291 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.535 0.926 -1.146 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.593 -0.874 -1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.090 -2.790 -2.580 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.030 -2.835 -1.070 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -2.810 -2.332 -2.588 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.390 -0.616 -3.561 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -2.064 -0.015 -3.632 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.822 0.913 -2.759 1.00 0.00 H new ATOM 906 N GLN A 63 -0.489 -0.328 1.843 1.00 0.00 N ATOM 907 CA GLN A 63 0.649 0.262 2.528 1.00 0.00 C ATOM 908 C GLN A 63 1.916 -0.548 2.246 1.00 0.00 C ATOM 909 O GLN A 63 1.955 -1.752 2.494 1.00 0.00 O ATOM 910 CB GLN A 63 0.389 0.368 4.032 1.00 0.00 C ATOM 911 CG GLN A 63 -0.981 0.989 4.309 1.00 0.00 C ATOM 912 CD GLN A 63 -0.926 1.922 5.521 1.00 0.00 C ATOM 913 OE1 GLN A 63 -1.637 2.909 5.610 1.00 0.00 O ATOM 914 NE2 GLN A 63 -0.042 1.556 6.445 1.00 0.00 N ATOM 0 H GLN A 63 -0.508 -1.348 1.849 1.00 0.00 H new ATOM 0 HA GLN A 63 0.795 1.272 2.146 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.442 -0.622 4.484 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.167 0.973 4.497 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -1.316 1.544 3.433 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.713 0.201 4.486 1.00 0.00 H new ATOM 0 HE21 GLN A 63 0.522 0.717 6.307 1.00 0.00 H new ATOM 0 HE22 GLN A 63 0.072 2.114 7.291 1.00 0.00 H new ATOM 923 N LEU A 64 2.920 0.145 1.730 1.00 0.00 N ATOM 924 CA LEU A 64 4.185 -0.495 1.412 1.00 0.00 C ATOM 925 C LEU A 64 5.175 -0.255 2.554 1.00 0.00 C ATOM 926 O LEU A 64 5.352 0.878 3.000 1.00 0.00 O ATOM 927 CB LEU A 64 4.695 -0.025 0.048 1.00 0.00 C ATOM 928 CG LEU A 64 5.639 -0.983 -0.682 1.00 0.00 C ATOM 929 CD1 LEU A 64 5.759 -0.613 -2.161 1.00 0.00 C ATOM 930 CD2 LEU A 64 7.004 -1.039 0.007 1.00 0.00 C ATOM 0 H LEU A 64 2.883 1.143 1.524 1.00 0.00 H new ATOM 0 HA LEU A 64 4.054 -1.574 1.324 1.00 0.00 H new ATOM 0 HB2 LEU A 64 3.835 0.165 -0.594 1.00 0.00 H new ATOM 0 HB3 LEU A 64 5.208 0.927 0.183 1.00 0.00 H new ATOM 0 HG LEU A 64 5.213 -1.985 -0.634 1.00 0.00 H new ATOM 0 HD11 LEU A 64 6.436 -1.309 -2.657 1.00 0.00 H new ATOM 0 HD12 LEU A 64 4.777 -0.666 -2.630 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.151 0.400 -2.252 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.656 -1.727 -0.532 1.00 0.00 H new ATOM 0 HD22 LEU A 64 7.450 -0.045 0.011 1.00 0.00 H new ATOM 0 HD23 LEU A 64 6.880 -1.385 1.033 1.00 0.00 H new ATOM 942 N LEU A 65 5.793 -1.341 2.996 1.00 0.00 N ATOM 943 CA LEU A 65 6.760 -1.263 4.078 1.00 0.00 C ATOM 944 C LEU A 65 8.146 -1.631 3.545 1.00 0.00 C ATOM 945 O LEU A 65 8.268 -2.449 2.635 1.00 0.00 O ATOM 946 CB LEU A 65 6.309 -2.120 5.262 1.00 0.00 C ATOM 947 CG LEU A 65 4.806 -2.388 5.362 1.00 0.00 C ATOM 948 CD1 LEU A 65 4.000 -1.178 4.887 1.00 0.00 C ATOM 949 CD2 LEU A 65 4.425 -3.663 4.606 1.00 0.00 C ATOM 0 H LEU A 65 5.643 -2.279 2.625 1.00 0.00 H new ATOM 0 HA LEU A 65 6.825 -0.244 4.458 1.00 0.00 H new ATOM 0 HB2 LEU A 65 6.826 -3.078 5.209 1.00 0.00 H new ATOM 0 HB3 LEU A 65 6.633 -1.633 6.182 1.00 0.00 H new ATOM 0 HG LEU A 65 4.557 -2.549 6.411 1.00 0.00 H new ATOM 0 HD11 LEU A 65 2.935 -1.395 4.969 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.242 -0.314 5.506 1.00 0.00 H new ATOM 0 HD13 LEU A 65 4.247 -0.961 3.848 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.351 -3.830 4.693 1.00 0.00 H new ATOM 0 HD22 LEU A 65 4.692 -3.556 3.555 1.00 0.00 H new ATOM 0 HD23 LEU A 65 4.960 -4.512 5.031 1.00 0.00 H new ATOM 961 N GLU A 66 9.156 -1.008 4.135 1.00 0.00 N ATOM 962 CA GLU A 66 10.529 -1.260 3.731 1.00 0.00 C ATOM 963 C GLU A 66 11.407 -1.507 4.959 1.00 0.00 C ATOM 964 O GLU A 66 11.260 -0.833 5.977 1.00 0.00 O ATOM 965 CB GLU A 66 11.074 -0.104 2.891 1.00 0.00 C ATOM 966 CG GLU A 66 11.534 1.052 3.782 1.00 0.00 C ATOM 967 CD GLU A 66 11.894 2.280 2.943 1.00 0.00 C ATOM 968 OE1 GLU A 66 12.736 2.119 2.033 1.00 0.00 O ATOM 969 OE2 GLU A 66 11.320 3.353 3.232 1.00 0.00 O ATOM 0 H GLU A 66 9.051 -0.330 4.889 1.00 0.00 H new ATOM 0 HA GLU A 66 10.546 -2.156 3.111 1.00 0.00 H new ATOM 0 HB2 GLU A 66 11.908 -0.453 2.283 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.303 0.246 2.204 1.00 0.00 H new ATOM 0 HG2 GLU A 66 10.744 1.308 4.488 1.00 0.00 H new ATOM 0 HG3 GLU A 66 12.398 0.742 4.369 1.00 0.00 H new ATOM 976 N ASP A 67 12.301 -2.476 4.823 1.00 0.00 N ATOM 977 CA ASP A 67 13.203 -2.820 5.909 1.00 0.00 C ATOM 978 C ASP A 67 14.039 -1.593 6.280 1.00 0.00 C ATOM 979 O ASP A 67 14.629 -0.953 5.411 1.00 0.00 O ATOM 980 CB ASP A 67 14.162 -3.938 5.495 1.00 0.00 C ATOM 981 CG ASP A 67 13.684 -5.354 5.820 1.00 0.00 C ATOM 982 OD1 ASP A 67 13.514 -5.633 7.027 1.00 0.00 O ATOM 983 OD2 ASP A 67 13.498 -6.126 4.855 1.00 0.00 O ATOM 0 H ASP A 67 12.420 -3.034 3.977 1.00 0.00 H new ATOM 0 HA ASP A 67 12.601 -3.155 6.754 1.00 0.00 H new ATOM 0 HB2 ASP A 67 14.337 -3.867 4.421 1.00 0.00 H new ATOM 0 HB3 ASP A 67 15.121 -3.773 5.985 1.00 0.00 H new ATOM 988 N ASP A 68 14.062 -1.302 7.573 1.00 0.00 N ATOM 989 CA ASP A 68 14.816 -0.164 8.070 1.00 0.00 C ATOM 990 C ASP A 68 16.231 -0.203 7.491 1.00 0.00 C ATOM 991 O ASP A 68 16.810 0.839 7.187 1.00 0.00 O ATOM 992 CB ASP A 68 14.927 -0.201 9.596 1.00 0.00 C ATOM 993 CG ASP A 68 13.661 -0.653 10.326 1.00 0.00 C ATOM 994 OD1 ASP A 68 12.626 0.022 10.139 1.00 0.00 O ATOM 995 OD2 ASP A 68 13.757 -1.665 11.054 1.00 0.00 O ATOM 0 H ASP A 68 13.571 -1.835 8.291 1.00 0.00 H new ATOM 0 HA ASP A 68 14.294 0.744 7.769 1.00 0.00 H new ATOM 0 HB2 ASP A 68 15.744 -0.869 9.870 1.00 0.00 H new ATOM 0 HB3 ASP A 68 15.197 0.794 9.950 1.00 0.00 H new ATOM 1051 N ARG A 72 14.837 -5.835 2.745 1.00 0.00 N ATOM 1052 CA ARG A 72 13.769 -6.294 1.873 1.00 0.00 C ATOM 1053 C ARG A 72 12.491 -5.495 2.132 1.00 0.00 C ATOM 1054 O ARG A 72 12.382 -4.801 3.142 1.00 0.00 O ATOM 1055 CB ARG A 72 13.484 -7.782 2.089 1.00 0.00 C ATOM 1056 CG ARG A 72 14.781 -8.561 2.320 1.00 0.00 C ATOM 1057 CD ARG A 72 14.729 -9.330 3.642 1.00 0.00 C ATOM 1058 NE ARG A 72 16.081 -9.819 3.996 1.00 0.00 N ATOM 1059 CZ ARG A 72 16.315 -10.855 4.812 1.00 0.00 C ATOM 1060 NH1 ARG A 72 15.290 -11.518 5.364 1.00 0.00 N ATOM 1061 NH2 ARG A 72 17.574 -11.228 5.077 1.00 0.00 N ATOM 0 HA ARG A 72 14.093 -6.143 0.843 1.00 0.00 H new ATOM 0 HB2 ARG A 72 12.822 -7.909 2.946 1.00 0.00 H new ATOM 0 HB3 ARG A 72 12.963 -8.186 1.221 1.00 0.00 H new ATOM 0 HG2 ARG A 72 14.944 -9.256 1.497 1.00 0.00 H new ATOM 0 HG3 ARG A 72 15.626 -7.873 2.328 1.00 0.00 H new ATOM 0 HD2 ARG A 72 14.348 -8.684 4.433 1.00 0.00 H new ATOM 0 HD3 ARG A 72 14.040 -10.170 3.557 1.00 0.00 H new ATOM 0 HE ARG A 72 16.884 -9.337 3.593 1.00 0.00 H new ATOM 0 HH11 ARG A 72 14.331 -11.234 5.163 1.00 0.00 H new ATOM 0 HH12 ARG A 72 15.468 -12.307 5.985 1.00 0.00 H new ATOM 0 HH21 ARG A 72 18.355 -10.723 4.657 1.00 0.00 H new ATOM 0 HH22 ARG A 72 17.752 -12.017 5.698 1.00 0.00 H new ATOM 1075 N TYR A 73 11.555 -5.618 1.202 1.00 0.00 N ATOM 1076 CA TYR A 73 10.289 -4.916 1.317 1.00 0.00 C ATOM 1077 C TYR A 73 9.118 -5.900 1.369 1.00 0.00 C ATOM 1078 O TYR A 73 9.258 -7.058 0.978 1.00 0.00 O ATOM 1079 CB TYR A 73 10.165 -4.061 0.054 1.00 0.00 C ATOM 1080 CG TYR A 73 11.146 -2.888 -0.003 1.00 0.00 C ATOM 1081 CD1 TYR A 73 12.501 -3.127 -0.110 1.00 0.00 C ATOM 1082 CD2 TYR A 73 10.677 -1.592 0.053 1.00 0.00 C ATOM 1083 CE1 TYR A 73 13.425 -2.024 -0.163 1.00 0.00 C ATOM 1084 CE2 TYR A 73 11.601 -0.489 0.000 1.00 0.00 C ATOM 1085 CZ TYR A 73 12.929 -0.759 -0.105 1.00 0.00 C ATOM 1086 OH TYR A 73 13.802 0.283 -0.156 1.00 0.00 O ATOM 0 H TYR A 73 11.649 -6.194 0.365 1.00 0.00 H new ATOM 0 HA TYR A 73 10.262 -4.321 2.230 1.00 0.00 H new ATOM 0 HB2 TYR A 73 10.322 -4.695 -0.818 1.00 0.00 H new ATOM 0 HB3 TYR A 73 9.148 -3.674 -0.012 1.00 0.00 H new ATOM 0 HD1 TYR A 73 12.868 -4.142 -0.154 1.00 0.00 H new ATOM 0 HD2 TYR A 73 9.617 -1.405 0.137 1.00 0.00 H new ATOM 0 HE1 TYR A 73 14.488 -2.197 -0.247 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.247 0.530 0.043 1.00 0.00 H new ATOM 0 HH TYR A 73 13.563 0.943 0.528 1.00 0.00 H new ATOM 1096 N TRP A 74 7.990 -5.403 1.854 1.00 0.00 N ATOM 1097 CA TRP A 74 6.796 -6.224 1.962 1.00 0.00 C ATOM 1098 C TRP A 74 5.645 -5.476 1.286 1.00 0.00 C ATOM 1099 O TRP A 74 5.753 -4.282 1.011 1.00 0.00 O ATOM 1100 CB TRP A 74 6.504 -6.577 3.422 1.00 0.00 C ATOM 1101 CG TRP A 74 7.475 -7.597 4.021 1.00 0.00 C ATOM 1102 CD1 TRP A 74 7.329 -8.926 4.102 1.00 0.00 C ATOM 1103 CD2 TRP A 74 8.755 -7.313 4.624 1.00 0.00 C ATOM 1104 NE1 TRP A 74 8.416 -9.518 4.711 1.00 0.00 N ATOM 1105 CE2 TRP A 74 9.311 -8.506 5.038 1.00 0.00 C ATOM 1106 CE3 TRP A 74 9.421 -6.090 4.813 1.00 0.00 C ATOM 1107 CZ2 TRP A 74 10.559 -8.593 5.668 1.00 0.00 C ATOM 1108 CZ3 TRP A 74 10.667 -6.193 5.444 1.00 0.00 C ATOM 1109 CH2 TRP A 74 11.241 -7.386 5.866 1.00 0.00 C ATOM 0 H TRP A 74 7.877 -4.442 2.177 1.00 0.00 H new ATOM 0 HA TRP A 74 6.937 -7.178 1.454 1.00 0.00 H new ATOM 0 HB2 TRP A 74 6.536 -5.666 4.019 1.00 0.00 H new ATOM 0 HB3 TRP A 74 5.490 -6.970 3.494 1.00 0.00 H new ATOM 0 HD1 TRP A 74 6.468 -9.466 3.736 1.00 0.00 H new ATOM 0 HE1 TRP A 74 8.540 -10.515 4.889 1.00 0.00 H new ATOM 0 HE3 TRP A 74 9.005 -5.145 4.497 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 10.973 -9.539 5.984 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 11.220 -5.281 5.615 1.00 0.00 H new ATOM 0 HH2 TRP A 74 12.209 -7.382 6.345 1.00 0.00 H new ATOM 1120 N ILE A 75 4.570 -6.209 1.038 1.00 0.00 N ATOM 1121 CA ILE A 75 3.400 -5.630 0.400 1.00 0.00 C ATOM 1122 C ILE A 75 2.148 -6.027 1.184 1.00 0.00 C ATOM 1123 O ILE A 75 1.674 -7.156 1.074 1.00 0.00 O ATOM 1124 CB ILE A 75 3.349 -6.019 -1.079 1.00 0.00 C ATOM 1125 CG1 ILE A 75 4.410 -5.264 -1.881 1.00 0.00 C ATOM 1126 CG2 ILE A 75 1.945 -5.815 -1.651 1.00 0.00 C ATOM 1127 CD1 ILE A 75 3.922 -3.862 -2.253 1.00 0.00 C ATOM 0 H ILE A 75 4.484 -7.199 1.267 1.00 0.00 H new ATOM 0 HA ILE A 75 3.456 -4.542 0.418 1.00 0.00 H new ATOM 0 HB ILE A 75 3.579 -7.081 -1.161 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.328 -5.191 -1.298 1.00 0.00 H new ATOM 0 HG13 ILE A 75 4.651 -5.821 -2.786 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.936 -6.099 -2.703 1.00 0.00 H new ATOM 0 HG22 ILE A 75 1.235 -6.434 -1.102 1.00 0.00 H new ATOM 0 HG23 ILE A 75 1.662 -4.767 -1.556 1.00 0.00 H new ATOM 0 HD11 ILE A 75 4.695 -3.347 -2.823 1.00 0.00 H new ATOM 0 HD12 ILE A 75 3.018 -3.940 -2.857 1.00 0.00 H new ATOM 0 HD13 ILE A 75 3.705 -3.299 -1.345 1.00 0.00 H new ATOM 1139 N PHE A 76 1.647 -5.075 1.959 1.00 0.00 N ATOM 1140 CA PHE A 76 0.459 -5.312 2.761 1.00 0.00 C ATOM 1141 C PHE A 76 -0.807 -4.928 1.992 1.00 0.00 C ATOM 1142 O PHE A 76 -0.910 -3.817 1.474 1.00 0.00 O ATOM 1143 CB PHE A 76 0.574 -4.426 4.003 1.00 0.00 C ATOM 1144 CG PHE A 76 -0.694 -4.384 4.858 1.00 0.00 C ATOM 1145 CD1 PHE A 76 -1.142 -5.514 5.466 1.00 0.00 C ATOM 1146 CD2 PHE A 76 -1.374 -3.215 5.008 1.00 0.00 C ATOM 1147 CE1 PHE A 76 -2.319 -5.475 6.259 1.00 0.00 C ATOM 1148 CE2 PHE A 76 -2.551 -3.176 5.801 1.00 0.00 C ATOM 1149 CZ PHE A 76 -2.999 -4.307 6.410 1.00 0.00 C ATOM 0 H PHE A 76 2.042 -4.139 2.048 1.00 0.00 H new ATOM 0 HA PHE A 76 0.389 -6.369 3.019 1.00 0.00 H new ATOM 0 HB2 PHE A 76 1.401 -4.783 4.616 1.00 0.00 H new ATOM 0 HB3 PHE A 76 0.823 -3.412 3.691 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -0.602 -6.442 5.346 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.019 -2.317 4.524 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -2.674 -6.373 6.742 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.091 -2.248 5.921 1.00 0.00 H new ATOM 0 HZ PHE A 76 -3.894 -4.277 7.013 1.00 0.00 H new ATOM 1159 N ARG A 77 -1.739 -5.869 1.943 1.00 0.00 N ATOM 1160 CA ARG A 77 -2.994 -5.643 1.246 1.00 0.00 C ATOM 1161 C ARG A 77 -4.175 -5.992 2.153 1.00 0.00 C ATOM 1162 O ARG A 77 -4.360 -7.152 2.519 1.00 0.00 O ATOM 1163 CB ARG A 77 -3.074 -6.483 -0.030 1.00 0.00 C ATOM 1164 CG ARG A 77 -1.717 -6.541 -0.735 1.00 0.00 C ATOM 1165 CD ARG A 77 -1.687 -7.661 -1.777 1.00 0.00 C ATOM 1166 NE ARG A 77 -0.335 -8.259 -1.839 1.00 0.00 N ATOM 1167 CZ ARG A 77 0.118 -8.986 -2.870 1.00 0.00 C ATOM 1168 NH1 ARG A 77 -0.670 -9.210 -3.930 1.00 0.00 N ATOM 1169 NH2 ARG A 77 1.360 -9.489 -2.840 1.00 0.00 N ATOM 0 H ARG A 77 -1.650 -6.789 2.374 1.00 0.00 H new ATOM 0 HA ARG A 77 -3.038 -4.588 0.976 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -3.404 -7.493 0.215 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -3.819 -6.059 -0.703 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -1.513 -5.585 -1.218 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -0.928 -6.702 -0.000 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -2.420 -8.426 -1.522 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -1.964 -7.267 -2.755 1.00 0.00 H new ATOM 0 HE ARG A 77 0.291 -8.109 -1.048 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -1.615 -8.827 -3.953 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -0.325 -9.763 -4.714 1.00 0.00 H new ATOM 0 HH21 ARG A 77 1.960 -9.319 -2.033 1.00 0.00 H new ATOM 0 HH22 ARG A 77 1.705 -10.042 -3.624 1.00 0.00 H new ATOM 1183 N SER A 78 -4.945 -4.968 2.490 1.00 0.00 N ATOM 1184 CA SER A 78 -6.103 -5.152 3.347 1.00 0.00 C ATOM 1185 C SER A 78 -7.388 -4.943 2.543 1.00 0.00 C ATOM 1186 O SER A 78 -7.435 -4.100 1.649 1.00 0.00 O ATOM 1187 CB SER A 78 -6.063 -4.195 4.541 1.00 0.00 C ATOM 1188 OG SER A 78 -6.878 -3.046 4.331 1.00 0.00 O ATOM 0 H SER A 78 -4.789 -4.007 2.185 1.00 0.00 H new ATOM 0 HA SER A 78 -6.084 -6.172 3.732 1.00 0.00 H new ATOM 0 HB2 SER A 78 -6.398 -4.718 5.437 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.034 -3.882 4.721 1.00 0.00 H new ATOM 0 HG SER A 78 -7.766 -3.201 4.715 1.00 0.00 H new ATOM 1194 N TRP A 79 -8.399 -5.725 2.891 1.00 0.00 N ATOM 1195 CA TRP A 79 -9.681 -5.637 2.212 1.00 0.00 C ATOM 1196 C TRP A 79 -10.741 -6.261 3.122 1.00 0.00 C ATOM 1197 O TRP A 79 -10.418 -6.801 4.179 1.00 0.00 O ATOM 1198 CB TRP A 79 -9.617 -6.292 0.831 1.00 0.00 C ATOM 1199 CG TRP A 79 -9.443 -7.812 0.871 1.00 0.00 C ATOM 1200 CD1 TRP A 79 -10.383 -8.745 1.076 1.00 0.00 C ATOM 1201 CD2 TRP A 79 -8.211 -8.541 0.692 1.00 0.00 C ATOM 1202 NE1 TRP A 79 -9.848 -10.017 1.043 1.00 0.00 N ATOM 1203 CE2 TRP A 79 -8.486 -9.889 0.801 1.00 0.00 C ATOM 1204 CE3 TRP A 79 -6.907 -8.077 0.445 1.00 0.00 C ATOM 1205 CZ2 TRP A 79 -7.508 -10.883 0.678 1.00 0.00 C ATOM 1206 CZ3 TRP A 79 -5.941 -9.083 0.325 1.00 0.00 C ATOM 1207 CH2 TRP A 79 -6.201 -10.444 0.432 1.00 0.00 C ATOM 0 H TRP A 79 -8.357 -6.422 3.634 1.00 0.00 H new ATOM 0 HA TRP A 79 -9.949 -4.597 2.027 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -10.530 -6.055 0.285 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -8.789 -5.856 0.271 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -11.427 -8.529 1.246 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -10.359 -10.890 1.172 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -6.669 -7.027 0.355 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -7.748 -11.932 0.768 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -4.922 -8.780 0.136 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -5.399 -11.160 0.326 1.00 0.00 H new ATOM 1218 N GLY A 80 -11.986 -6.166 2.678 1.00 0.00 N ATOM 1219 CA GLY A 80 -13.096 -6.715 3.439 1.00 0.00 C ATOM 1220 C GLY A 80 -14.163 -5.649 3.697 1.00 0.00 C ATOM 1221 O GLY A 80 -13.983 -4.486 3.341 1.00 0.00 O ATOM 0 H GLY A 80 -12.251 -5.717 1.801 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -13.536 -7.551 2.896 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -12.732 -7.108 4.388 1.00 0.00 H new ATOM 1225 N ARG A 81 -15.252 -6.085 4.314 1.00 0.00 N ATOM 1226 CA ARG A 81 -16.348 -5.184 4.624 1.00 0.00 C ATOM 1227 C ARG A 81 -15.922 -4.179 5.696 1.00 0.00 C ATOM 1228 O ARG A 81 -14.883 -4.347 6.332 1.00 0.00 O ATOM 1229 CB ARG A 81 -17.574 -5.956 5.117 1.00 0.00 C ATOM 1230 CG ARG A 81 -18.502 -6.311 3.954 1.00 0.00 C ATOM 1231 CD ARG A 81 -18.895 -7.789 3.998 1.00 0.00 C ATOM 1232 NE ARG A 81 -18.752 -8.391 2.654 1.00 0.00 N ATOM 1233 CZ ARG A 81 -18.588 -9.702 2.431 1.00 0.00 C ATOM 1234 NH1 ARG A 81 -18.544 -10.557 3.463 1.00 0.00 N ATOM 1235 NH2 ARG A 81 -18.467 -10.159 1.177 1.00 0.00 N ATOM 0 H ARG A 81 -15.398 -7.051 4.607 1.00 0.00 H new ATOM 0 HA ARG A 81 -16.611 -4.654 3.708 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -17.255 -6.867 5.624 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -18.115 -5.357 5.849 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -19.398 -5.691 3.997 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -18.007 -6.091 3.008 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -18.266 -8.320 4.712 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -19.924 -7.890 4.343 1.00 0.00 H new ATOM 0 HE ARG A 81 -18.780 -7.769 1.846 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -18.635 -10.209 4.418 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -18.419 -11.555 3.293 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -18.500 -9.509 0.392 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -18.342 -11.157 1.008 1.00 0.00 H new ATOM 1328 N SER A 88 -9.521 -9.397 6.392 1.00 0.00 N ATOM 1329 CA SER A 88 -8.506 -10.193 5.723 1.00 0.00 C ATOM 1330 C SER A 88 -7.381 -9.287 5.217 1.00 0.00 C ATOM 1331 O SER A 88 -7.638 -8.196 4.710 1.00 0.00 O ATOM 1332 CB SER A 88 -9.107 -10.990 4.564 1.00 0.00 C ATOM 1333 OG SER A 88 -9.776 -12.165 5.014 1.00 0.00 O ATOM 0 HA SER A 88 -8.097 -10.902 6.443 1.00 0.00 H new ATOM 0 HB2 SER A 88 -9.809 -10.361 4.017 1.00 0.00 H new ATOM 0 HB3 SER A 88 -8.317 -11.267 3.867 1.00 0.00 H new ATOM 0 HG SER A 88 -10.147 -12.645 4.245 1.00 0.00 H new ATOM 1339 N ASN A 89 -6.158 -9.773 5.373 1.00 0.00 N ATOM 1340 CA ASN A 89 -4.993 -9.021 4.938 1.00 0.00 C ATOM 1341 C ASN A 89 -3.990 -9.975 4.287 1.00 0.00 C ATOM 1342 O ASN A 89 -3.880 -11.133 4.686 1.00 0.00 O ATOM 1343 CB ASN A 89 -4.301 -8.344 6.123 1.00 0.00 C ATOM 1344 CG ASN A 89 -4.245 -9.279 7.333 1.00 0.00 C ATOM 1345 OD1 ASN A 89 -5.158 -9.350 8.139 1.00 0.00 O ATOM 1346 ND2 ASN A 89 -3.124 -9.991 7.414 1.00 0.00 N ATOM 0 H ASN A 89 -5.949 -10.678 5.794 1.00 0.00 H new ATOM 0 HA ASN A 89 -5.326 -8.260 4.232 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -3.291 -8.050 5.839 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -4.836 -7.432 6.388 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -2.990 -10.645 8.185 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -2.399 -9.883 6.705 1.00 0.00 H new ATOM 1353 N LYS A 90 -3.283 -9.453 3.295 1.00 0.00 N ATOM 1354 CA LYS A 90 -2.293 -10.243 2.585 1.00 0.00 C ATOM 1355 C LYS A 90 -0.939 -9.532 2.646 1.00 0.00 C ATOM 1356 O LYS A 90 -0.844 -8.344 2.339 1.00 0.00 O ATOM 1357 CB LYS A 90 -2.767 -10.543 1.161 1.00 0.00 C ATOM 1358 CG LYS A 90 -1.630 -11.121 0.315 1.00 0.00 C ATOM 1359 CD LYS A 90 -2.166 -12.120 -0.713 1.00 0.00 C ATOM 1360 CE LYS A 90 -2.715 -11.397 -1.944 1.00 0.00 C ATOM 1361 NZ LYS A 90 -3.914 -12.094 -2.462 1.00 0.00 N ATOM 0 H LYS A 90 -3.377 -8.492 2.967 1.00 0.00 H new ATOM 0 HA LYS A 90 -2.165 -11.213 3.065 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.597 -11.248 1.191 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.141 -9.630 0.698 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.105 -10.314 -0.196 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.904 -11.613 0.962 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.370 -12.802 -1.012 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.952 -12.726 -0.262 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -2.968 -10.368 -1.686 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.950 -11.353 -2.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -4.274 -11.590 -3.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -3.662 -13.068 -2.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -4.649 -12.114 -1.726 1.00 0.00 H new ATOM 1375 N LEU A 91 0.074 -10.288 3.043 1.00 0.00 N ATOM 1376 CA LEU A 91 1.417 -9.744 3.147 1.00 0.00 C ATOM 1377 C LEU A 91 2.397 -10.678 2.434 1.00 0.00 C ATOM 1378 O LEU A 91 2.362 -11.891 2.634 1.00 0.00 O ATOM 1379 CB LEU A 91 1.775 -9.479 4.611 1.00 0.00 C ATOM 1380 CG LEU A 91 3.185 -8.944 4.870 1.00 0.00 C ATOM 1381 CD1 LEU A 91 3.278 -7.456 4.525 1.00 0.00 C ATOM 1382 CD2 LEU A 91 3.623 -9.228 6.308 1.00 0.00 C ATOM 0 H LEU A 91 -0.008 -11.273 3.296 1.00 0.00 H new ATOM 0 HA LEU A 91 1.477 -8.777 2.648 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.057 -8.766 5.017 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.652 -10.408 5.168 1.00 0.00 H new ATOM 0 HG LEU A 91 3.877 -9.471 4.213 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.290 -7.100 4.718 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.037 -7.311 3.472 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.573 -6.895 5.139 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.628 -8.838 6.466 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.933 -8.745 7.000 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.620 -10.304 6.484 1.00 0.00 H new ATOM 1394 N GLU A 92 3.248 -10.076 1.616 1.00 0.00 N ATOM 1395 CA GLU A 92 4.236 -10.838 0.871 1.00 0.00 C ATOM 1396 C GLU A 92 5.585 -10.116 0.887 1.00 0.00 C ATOM 1397 O GLU A 92 5.636 -8.888 0.889 1.00 0.00 O ATOM 1398 CB GLU A 92 3.767 -11.092 -0.563 1.00 0.00 C ATOM 1399 CG GLU A 92 2.573 -12.048 -0.588 1.00 0.00 C ATOM 1400 CD GLU A 92 2.915 -13.333 -1.344 1.00 0.00 C ATOM 1401 OE1 GLU A 92 3.412 -13.206 -2.484 1.00 0.00 O ATOM 1402 OE2 GLU A 92 2.673 -14.414 -0.765 1.00 0.00 O ATOM 0 H GLU A 92 3.274 -9.069 1.453 1.00 0.00 H new ATOM 0 HA GLU A 92 4.358 -11.807 1.355 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.491 -10.147 -1.032 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.585 -11.511 -1.148 1.00 0.00 H new ATOM 0 HG2 GLU A 92 2.275 -12.290 0.432 1.00 0.00 H new ATOM 0 HG3 GLU A 92 1.721 -11.559 -1.061 1.00 0.00 H new ATOM 1409 N GLN A 93 6.645 -10.911 0.898 1.00 0.00 N ATOM 1410 CA GLN A 93 7.991 -10.364 0.913 1.00 0.00 C ATOM 1411 C GLN A 93 8.478 -10.110 -0.515 1.00 0.00 C ATOM 1412 O GLN A 93 8.622 -11.046 -1.301 1.00 0.00 O ATOM 1413 CB GLN A 93 8.951 -11.289 1.663 1.00 0.00 C ATOM 1414 CG GLN A 93 10.385 -10.760 1.598 1.00 0.00 C ATOM 1415 CD GLN A 93 11.144 -11.376 0.421 1.00 0.00 C ATOM 1416 OE1 GLN A 93 10.698 -12.316 -0.216 1.00 0.00 O ATOM 1417 NE2 GLN A 93 12.314 -10.795 0.168 1.00 0.00 N ATOM 0 H GLN A 93 6.599 -11.930 0.897 1.00 0.00 H new ATOM 0 HA GLN A 93 7.968 -9.412 1.443 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.639 -11.377 2.704 1.00 0.00 H new ATOM 0 HB3 GLN A 93 8.909 -12.289 1.232 1.00 0.00 H new ATOM 0 HG2 GLN A 93 10.372 -9.675 1.499 1.00 0.00 H new ATOM 0 HG3 GLN A 93 10.903 -10.989 2.529 1.00 0.00 H new ATOM 0 HE21 GLN A 93 12.629 -10.011 0.740 1.00 0.00 H new ATOM 0 HE22 GLN A 93 12.896 -11.133 -0.598 1.00 0.00 H new ATOM 1426 N MET A 94 8.716 -8.840 -0.809 1.00 0.00 N ATOM 1427 CA MET A 94 9.183 -8.452 -2.129 1.00 0.00 C ATOM 1428 C MET A 94 10.689 -8.686 -2.268 1.00 0.00 C ATOM 1429 O MET A 94 11.428 -8.598 -1.289 1.00 0.00 O ATOM 1430 CB MET A 94 8.872 -6.973 -2.366 1.00 0.00 C ATOM 1431 CG MET A 94 7.415 -6.781 -2.793 1.00 0.00 C ATOM 1432 SD MET A 94 7.244 -7.100 -4.540 1.00 0.00 S ATOM 1433 CE MET A 94 5.881 -8.252 -4.513 1.00 0.00 C ATOM 0 H MET A 94 8.594 -8.066 -0.155 1.00 0.00 H new ATOM 0 HA MET A 94 8.669 -9.064 -2.870 1.00 0.00 H new ATOM 0 HB2 MET A 94 9.065 -6.406 -1.455 1.00 0.00 H new ATOM 0 HB3 MET A 94 9.535 -6.577 -3.135 1.00 0.00 H new ATOM 0 HG2 MET A 94 6.770 -7.453 -2.227 1.00 0.00 H new ATOM 0 HG3 MET A 94 7.092 -5.765 -2.567 1.00 0.00 H new ATOM 0 HE1 MET A 94 5.642 -8.556 -5.532 1.00 0.00 H new ATOM 0 HE2 MET A 94 6.157 -9.129 -3.928 1.00 0.00 H new ATOM 0 HE3 MET A 94 5.010 -7.775 -4.063 1.00 0.00 H new ATOM 1443 N PRO A 95 11.109 -8.988 -3.526 1.00 0.00 N ATOM 1444 CA PRO A 95 12.513 -9.235 -3.807 1.00 0.00 C ATOM 1445 C PRO A 95 13.309 -7.929 -3.817 1.00 0.00 C ATOM 1446 O PRO A 95 14.331 -7.815 -3.143 1.00 0.00 O ATOM 1447 CB PRO A 95 12.526 -9.949 -5.148 1.00 0.00 C ATOM 1448 CG PRO A 95 11.177 -9.663 -5.786 1.00 0.00 C ATOM 1449 CD PRO A 95 10.262 -9.101 -4.710 1.00 0.00 C ATOM 0 HA PRO A 95 12.994 -9.844 -3.042 1.00 0.00 H new ATOM 0 HB2 PRO A 95 13.340 -9.586 -5.776 1.00 0.00 H new ATOM 0 HB3 PRO A 95 12.677 -11.021 -5.018 1.00 0.00 H new ATOM 0 HG2 PRO A 95 11.285 -8.952 -6.605 1.00 0.00 H new ATOM 0 HG3 PRO A 95 10.754 -10.574 -6.209 1.00 0.00 H new ATOM 0 HD2 PRO A 95 9.857 -8.132 -5.001 1.00 0.00 H new ATOM 0 HD3 PRO A 95 9.413 -9.760 -4.528 1.00 0.00 H new ATOM 1457 N SER A 96 12.809 -6.975 -4.590 1.00 0.00 N ATOM 1458 CA SER A 96 13.461 -5.681 -4.697 1.00 0.00 C ATOM 1459 C SER A 96 12.481 -4.569 -4.317 1.00 0.00 C ATOM 1460 O SER A 96 11.270 -4.783 -4.301 1.00 0.00 O ATOM 1461 CB SER A 96 14.002 -5.452 -6.109 1.00 0.00 C ATOM 1462 OG SER A 96 15.382 -5.096 -6.101 1.00 0.00 O ATOM 0 H SER A 96 11.961 -7.073 -5.148 1.00 0.00 H new ATOM 0 HA SER A 96 14.305 -5.665 -4.007 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.864 -6.357 -6.701 1.00 0.00 H new ATOM 0 HB3 SER A 96 13.427 -4.663 -6.594 1.00 0.00 H new ATOM 0 HG SER A 96 15.690 -4.960 -7.021 1.00 0.00 H new ATOM 1468 N LYS A 97 13.042 -3.405 -4.020 1.00 0.00 N ATOM 1469 CA LYS A 97 12.232 -2.260 -3.642 1.00 0.00 C ATOM 1470 C LYS A 97 11.227 -1.961 -4.756 1.00 0.00 C ATOM 1471 O LYS A 97 10.049 -1.730 -4.488 1.00 0.00 O ATOM 1472 CB LYS A 97 13.124 -1.069 -3.283 1.00 0.00 C ATOM 1473 CG LYS A 97 12.293 0.202 -3.099 1.00 0.00 C ATOM 1474 CD LYS A 97 12.890 1.367 -3.891 1.00 0.00 C ATOM 1475 CE LYS A 97 13.305 2.508 -2.960 1.00 0.00 C ATOM 1476 NZ LYS A 97 13.433 3.774 -3.716 1.00 0.00 N ATOM 0 H LYS A 97 14.047 -3.231 -4.034 1.00 0.00 H new ATOM 0 HA LYS A 97 11.656 -2.481 -2.743 1.00 0.00 H new ATOM 0 HB2 LYS A 97 13.673 -1.285 -2.367 1.00 0.00 H new ATOM 0 HB3 LYS A 97 13.863 -0.914 -4.069 1.00 0.00 H new ATOM 0 HG2 LYS A 97 11.269 0.022 -3.426 1.00 0.00 H new ATOM 0 HG3 LYS A 97 12.248 0.462 -2.041 1.00 0.00 H new ATOM 0 HD2 LYS A 97 13.755 1.021 -4.456 1.00 0.00 H new ATOM 0 HD3 LYS A 97 12.161 1.731 -4.615 1.00 0.00 H new ATOM 0 HE2 LYS A 97 12.567 2.625 -2.167 1.00 0.00 H new ATOM 0 HE3 LYS A 97 14.253 2.267 -2.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 14.317 4.251 -3.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 13.446 3.570 -4.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 12.626 4.392 -3.497 1.00 0.00 H new ATOM 1490 N GLU A 98 11.728 -1.975 -5.982 1.00 0.00 N ATOM 1491 CA GLU A 98 10.888 -1.708 -7.137 1.00 0.00 C ATOM 1492 C GLU A 98 9.749 -2.727 -7.212 1.00 0.00 C ATOM 1493 O GLU A 98 8.578 -2.353 -7.238 1.00 0.00 O ATOM 1494 CB GLU A 98 11.712 -1.712 -8.426 1.00 0.00 C ATOM 1495 CG GLU A 98 12.735 -0.574 -8.427 1.00 0.00 C ATOM 1496 CD GLU A 98 12.705 0.190 -9.752 1.00 0.00 C ATOM 1497 OE1 GLU A 98 11.829 1.074 -9.877 1.00 0.00 O ATOM 1498 OE2 GLU A 98 13.558 -0.126 -10.609 1.00 0.00 O ATOM 0 H GLU A 98 12.706 -2.167 -6.201 1.00 0.00 H new ATOM 0 HA GLU A 98 10.454 -0.715 -7.024 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.226 -2.668 -8.530 1.00 0.00 H new ATOM 0 HB3 GLU A 98 11.049 -1.611 -9.286 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.525 0.109 -7.604 1.00 0.00 H new ATOM 0 HG3 GLU A 98 13.733 -0.978 -8.259 1.00 0.00 H new ATOM 1505 N ASP A 99 10.133 -3.995 -7.244 1.00 0.00 N ATOM 1506 CA ASP A 99 9.158 -5.070 -7.315 1.00 0.00 C ATOM 1507 C ASP A 99 8.024 -4.790 -6.327 1.00 0.00 C ATOM 1508 O ASP A 99 6.888 -5.210 -6.545 1.00 0.00 O ATOM 1509 CB ASP A 99 9.790 -6.412 -6.941 1.00 0.00 C ATOM 1510 CG ASP A 99 10.916 -6.877 -7.867 1.00 0.00 C ATOM 1511 OD1 ASP A 99 11.986 -6.234 -7.827 1.00 0.00 O ATOM 1512 OD2 ASP A 99 10.680 -7.866 -8.594 1.00 0.00 O ATOM 0 H ASP A 99 11.106 -4.302 -7.222 1.00 0.00 H new ATOM 0 HA ASP A 99 8.785 -5.120 -8.338 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.180 -6.342 -5.926 1.00 0.00 H new ATOM 0 HB3 ASP A 99 9.010 -7.174 -6.931 1.00 0.00 H new ATOM 1517 N ALA A 100 8.370 -4.083 -5.262 1.00 0.00 N ATOM 1518 CA ALA A 100 7.395 -3.742 -4.240 1.00 0.00 C ATOM 1519 C ALA A 100 6.562 -2.549 -4.714 1.00 0.00 C ATOM 1520 O ALA A 100 5.333 -2.596 -4.688 1.00 0.00 O ATOM 1521 CB ALA A 100 8.116 -3.462 -2.919 1.00 0.00 C ATOM 0 H ALA A 100 9.313 -3.737 -5.084 1.00 0.00 H new ATOM 0 HA ALA A 100 6.712 -4.574 -4.068 1.00 0.00 H new ATOM 0 HB1 ALA A 100 7.385 -3.206 -2.152 1.00 0.00 H new ATOM 0 HB2 ALA A 100 8.669 -4.349 -2.611 1.00 0.00 H new ATOM 0 HB3 ALA A 100 8.808 -2.631 -3.052 1.00 0.00 H new ATOM 1527 N ILE A 101 7.265 -1.507 -5.134 1.00 0.00 N ATOM 1528 CA ILE A 101 6.606 -0.304 -5.613 1.00 0.00 C ATOM 1529 C ILE A 101 5.703 -0.659 -6.797 1.00 0.00 C ATOM 1530 O ILE A 101 4.528 -0.297 -6.816 1.00 0.00 O ATOM 1531 CB ILE A 101 7.636 0.782 -5.929 1.00 0.00 C ATOM 1532 CG1 ILE A 101 8.264 1.331 -4.647 1.00 0.00 C ATOM 1533 CG2 ILE A 101 7.020 1.889 -6.786 1.00 0.00 C ATOM 1534 CD1 ILE A 101 9.789 1.378 -4.760 1.00 0.00 C ATOM 0 H ILE A 101 8.284 -1.471 -5.152 1.00 0.00 H new ATOM 0 HA ILE A 101 5.965 0.114 -4.837 1.00 0.00 H new ATOM 0 HB ILE A 101 8.439 0.332 -6.513 1.00 0.00 H new ATOM 0 HG12 ILE A 101 7.879 2.332 -4.449 1.00 0.00 H new ATOM 0 HG13 ILE A 101 7.978 0.706 -3.801 1.00 0.00 H new ATOM 0 HG21 ILE A 101 7.773 2.648 -6.996 1.00 0.00 H new ATOM 0 HG22 ILE A 101 6.660 1.466 -7.724 1.00 0.00 H new ATOM 0 HG23 ILE A 101 6.187 2.343 -6.250 1.00 0.00 H new ATOM 0 HD11 ILE A 101 10.210 1.772 -3.835 1.00 0.00 H new ATOM 0 HD12 ILE A 101 10.172 0.372 -4.934 1.00 0.00 H new ATOM 0 HD13 ILE A 101 10.073 2.023 -5.592 1.00 0.00 H new ATOM 1546 N GLU A 102 6.287 -1.363 -7.755 1.00 0.00 N ATOM 1547 CA GLU A 102 5.550 -1.771 -8.939 1.00 0.00 C ATOM 1548 C GLU A 102 4.225 -2.423 -8.541 1.00 0.00 C ATOM 1549 O GLU A 102 3.163 -2.015 -9.009 1.00 0.00 O ATOM 1550 CB GLU A 102 6.386 -2.713 -9.808 1.00 0.00 C ATOM 1551 CG GLU A 102 7.776 -2.129 -10.069 1.00 0.00 C ATOM 1552 CD GLU A 102 8.186 -2.323 -11.530 1.00 0.00 C ATOM 1553 OE1 GLU A 102 7.280 -2.254 -12.388 1.00 0.00 O ATOM 1554 OE2 GLU A 102 9.397 -2.536 -11.757 1.00 0.00 O ATOM 0 H GLU A 102 7.262 -1.661 -7.736 1.00 0.00 H new ATOM 0 HA GLU A 102 5.331 -0.882 -9.531 1.00 0.00 H new ATOM 0 HB2 GLU A 102 6.481 -3.680 -9.315 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.877 -2.887 -10.756 1.00 0.00 H new ATOM 0 HG2 GLU A 102 7.780 -1.067 -9.824 1.00 0.00 H new ATOM 0 HG3 GLU A 102 8.505 -2.609 -9.416 1.00 0.00 H new ATOM 1561 N HIS A 103 4.330 -3.426 -7.681 1.00 0.00 N ATOM 1562 CA HIS A 103 3.153 -4.139 -7.215 1.00 0.00 C ATOM 1563 C HIS A 103 2.217 -3.167 -6.494 1.00 0.00 C ATOM 1564 O HIS A 103 1.007 -3.189 -6.712 1.00 0.00 O ATOM 1565 CB HIS A 103 3.550 -5.334 -6.347 1.00 0.00 C ATOM 1566 CG HIS A 103 2.435 -6.327 -6.121 1.00 0.00 C ATOM 1567 ND1 HIS A 103 1.696 -6.872 -7.156 1.00 0.00 N ATOM 1568 CD2 HIS A 103 1.942 -6.867 -4.970 1.00 0.00 C ATOM 1569 CE1 HIS A 103 0.800 -7.701 -6.639 1.00 0.00 C ATOM 1570 NE2 HIS A 103 0.954 -7.696 -5.284 1.00 0.00 N ATOM 0 H HIS A 103 5.212 -3.762 -7.295 1.00 0.00 H new ATOM 0 HA HIS A 103 2.610 -4.548 -8.067 1.00 0.00 H new ATOM 0 HB2 HIS A 103 4.390 -5.847 -6.815 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.898 -4.968 -5.381 1.00 0.00 H new ATOM 0 HD1 HIS A 103 1.820 -6.670 -8.148 1.00 0.00 H new ATOM 0 HD2 HIS A 103 2.296 -6.656 -3.972 1.00 0.00 H new ATOM 0 HE1 HIS A 103 0.075 -8.279 -7.193 1.00 0.00 H new ATOM 1578 N PHE A 104 2.813 -2.338 -5.649 1.00 0.00 N ATOM 1579 CA PHE A 104 2.047 -1.361 -4.895 1.00 0.00 C ATOM 1580 C PHE A 104 1.409 -0.328 -5.825 1.00 0.00 C ATOM 1581 O PHE A 104 0.363 0.237 -5.507 1.00 0.00 O ATOM 1582 CB PHE A 104 3.028 -0.651 -3.959 1.00 0.00 C ATOM 1583 CG PHE A 104 2.402 0.485 -3.148 1.00 0.00 C ATOM 1584 CD1 PHE A 104 2.366 1.746 -3.657 1.00 0.00 C ATOM 1585 CD2 PHE A 104 1.881 0.234 -1.917 1.00 0.00 C ATOM 1586 CE1 PHE A 104 1.785 2.800 -2.904 1.00 0.00 C ATOM 1587 CE2 PHE A 104 1.300 1.288 -1.163 1.00 0.00 C ATOM 1588 CZ PHE A 104 1.264 2.549 -1.673 1.00 0.00 C ATOM 0 H PHE A 104 3.817 -2.323 -5.470 1.00 0.00 H new ATOM 0 HA PHE A 104 1.247 -1.858 -4.346 1.00 0.00 H new ATOM 0 HB2 PHE A 104 3.453 -1.383 -3.272 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.853 -0.251 -4.549 1.00 0.00 H new ATOM 0 HD1 PHE A 104 2.780 1.945 -4.635 1.00 0.00 H new ATOM 0 HD2 PHE A 104 1.909 -0.767 -1.513 1.00 0.00 H new ATOM 0 HE1 PHE A 104 1.757 3.801 -3.309 1.00 0.00 H new ATOM 0 HE2 PHE A 104 0.887 1.089 -0.185 1.00 0.00 H new ATOM 0 HZ PHE A 104 0.822 3.351 -1.100 1.00 0.00 H new ATOM 1598 N MET A 105 2.065 -0.111 -6.956 1.00 0.00 N ATOM 1599 CA MET A 105 1.575 0.845 -7.934 1.00 0.00 C ATOM 1600 C MET A 105 0.512 0.211 -8.834 1.00 0.00 C ATOM 1601 O MET A 105 -0.423 0.885 -9.265 1.00 0.00 O ATOM 1602 CB MET A 105 2.741 1.340 -8.792 1.00 0.00 C ATOM 1603 CG MET A 105 3.544 2.416 -8.058 1.00 0.00 C ATOM 1604 SD MET A 105 3.772 3.836 -9.114 1.00 0.00 S ATOM 1605 CE MET A 105 4.534 3.052 -10.526 1.00 0.00 C ATOM 0 H MET A 105 2.932 -0.581 -7.217 1.00 0.00 H new ATOM 0 HA MET A 105 1.123 1.682 -7.402 1.00 0.00 H new ATOM 0 HB2 MET A 105 3.393 0.503 -9.044 1.00 0.00 H new ATOM 0 HB3 MET A 105 2.361 1.742 -9.731 1.00 0.00 H new ATOM 0 HG2 MET A 105 3.024 2.710 -7.146 1.00 0.00 H new ATOM 0 HG3 MET A 105 4.513 2.017 -7.758 1.00 0.00 H new ATOM 0 HE1 MET A 105 5.188 3.764 -11.029 1.00 0.00 H new ATOM 0 HE2 MET A 105 5.119 2.194 -10.194 1.00 0.00 H new ATOM 0 HE3 MET A 105 3.761 2.718 -11.218 1.00 0.00 H new ATOM 1615 N LYS A 106 0.689 -1.076 -9.090 1.00 0.00 N ATOM 1616 CA LYS A 106 -0.243 -1.808 -9.930 1.00 0.00 C ATOM 1617 C LYS A 106 -1.486 -2.166 -9.114 1.00 0.00 C ATOM 1618 O LYS A 106 -2.611 -1.963 -9.568 1.00 0.00 O ATOM 1619 CB LYS A 106 0.444 -3.018 -10.566 1.00 0.00 C ATOM 1620 CG LYS A 106 -0.531 -4.187 -10.715 1.00 0.00 C ATOM 1621 CD LYS A 106 0.183 -5.434 -11.241 1.00 0.00 C ATOM 1622 CE LYS A 106 -0.230 -5.735 -12.683 1.00 0.00 C ATOM 1623 NZ LYS A 106 0.053 -7.148 -13.019 1.00 0.00 N ATOM 0 H LYS A 106 1.465 -1.632 -8.730 1.00 0.00 H new ATOM 0 HA LYS A 106 -0.575 -1.186 -10.761 1.00 0.00 H new ATOM 0 HB2 LYS A 106 0.840 -2.743 -11.544 1.00 0.00 H new ATOM 0 HB3 LYS A 106 1.292 -3.323 -9.953 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -0.991 -4.406 -9.751 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -1.335 -3.910 -11.396 1.00 0.00 H new ATOM 0 HD2 LYS A 106 1.262 -5.288 -11.191 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -0.053 -6.288 -10.606 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -1.293 -5.530 -12.814 1.00 0.00 H new ATOM 0 HE3 LYS A 106 0.308 -5.078 -13.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -0.233 -7.335 -14.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 1.071 -7.333 -12.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -0.480 -7.771 -12.378 1.00 0.00 H new ATOM 1637 N LEU A 107 -1.241 -2.692 -7.922 1.00 0.00 N ATOM 1638 CA LEU A 107 -2.327 -3.080 -7.038 1.00 0.00 C ATOM 1639 C LEU A 107 -3.311 -1.916 -6.905 1.00 0.00 C ATOM 1640 O LEU A 107 -4.498 -2.066 -7.189 1.00 0.00 O ATOM 1641 CB LEU A 107 -1.777 -3.576 -5.700 1.00 0.00 C ATOM 1642 CG LEU A 107 -1.477 -5.074 -5.612 1.00 0.00 C ATOM 1643 CD1 LEU A 107 -0.899 -5.438 -4.243 1.00 0.00 C ATOM 1644 CD2 LEU A 107 -2.719 -5.902 -5.948 1.00 0.00 C ATOM 0 H LEU A 107 -0.307 -2.858 -7.548 1.00 0.00 H new ATOM 0 HA LEU A 107 -2.880 -3.919 -7.460 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -0.860 -3.029 -5.481 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -2.494 -3.323 -4.919 1.00 0.00 H new ATOM 0 HG LEU A 107 -0.718 -5.315 -6.356 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -0.695 -6.508 -4.207 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.027 -4.886 -4.081 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -1.617 -5.179 -3.465 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -2.479 -6.963 -5.878 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -3.517 -5.663 -5.244 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -3.048 -5.670 -6.961 1.00 0.00 H new ATOM 1656 N TYR A 108 -2.781 -0.782 -6.472 1.00 0.00 N ATOM 1657 CA TYR A 108 -3.598 0.407 -6.297 1.00 0.00 C ATOM 1658 C TYR A 108 -4.152 0.894 -7.638 1.00 0.00 C ATOM 1659 O TYR A 108 -4.995 1.788 -7.677 1.00 0.00 O ATOM 1660 CB TYR A 108 -2.667 1.478 -5.725 1.00 0.00 C ATOM 1661 CG TYR A 108 -3.366 2.799 -5.396 1.00 0.00 C ATOM 1662 CD1 TYR A 108 -3.519 3.761 -6.374 1.00 0.00 C ATOM 1663 CD2 TYR A 108 -3.843 3.029 -4.122 1.00 0.00 C ATOM 1664 CE1 TYR A 108 -4.177 5.004 -6.065 1.00 0.00 C ATOM 1665 CE2 TYR A 108 -4.501 4.272 -3.812 1.00 0.00 C ATOM 1666 CZ TYR A 108 -4.635 5.198 -4.799 1.00 0.00 C ATOM 1667 OH TYR A 108 -5.256 6.372 -4.507 1.00 0.00 O ATOM 0 H TYR A 108 -1.796 -0.661 -6.237 1.00 0.00 H new ATOM 0 HA TYR A 108 -4.445 0.197 -5.644 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -2.198 1.092 -4.820 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -1.868 1.670 -6.441 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -3.145 3.581 -7.371 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -3.723 2.276 -3.357 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -4.304 5.765 -6.821 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -4.879 4.464 -2.819 1.00 0.00 H new ATOM 0 HH TYR A 108 -5.702 6.714 -5.309 1.00 0.00 H new ATOM 1677 N GLU A 109 -3.655 0.284 -8.704 1.00 0.00 N ATOM 1678 CA GLU A 109 -4.089 0.643 -10.043 1.00 0.00 C ATOM 1679 C GLU A 109 -5.184 -0.312 -10.520 1.00 0.00 C ATOM 1680 O GLU A 109 -5.933 0.007 -11.442 1.00 0.00 O ATOM 1681 CB GLU A 109 -2.909 0.656 -11.017 1.00 0.00 C ATOM 1682 CG GLU A 109 -3.395 0.765 -12.464 1.00 0.00 C ATOM 1683 CD GLU A 109 -2.221 0.691 -13.443 1.00 0.00 C ATOM 1684 OE1 GLU A 109 -1.707 -0.433 -13.629 1.00 0.00 O ATOM 1685 OE2 GLU A 109 -1.864 1.761 -13.982 1.00 0.00 O ATOM 0 H GLU A 109 -2.955 -0.457 -8.667 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.502 1.651 -10.012 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -2.251 1.494 -10.786 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -2.321 -0.254 -10.894 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -4.101 -0.038 -12.676 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -3.930 1.705 -12.602 1.00 0.00 H new ATOM 1692 N GLU A 110 -5.243 -1.466 -9.871 1.00 0.00 N ATOM 1693 CA GLU A 110 -6.234 -2.470 -10.218 1.00 0.00 C ATOM 1694 C GLU A 110 -7.563 -2.167 -9.522 1.00 0.00 C ATOM 1695 O GLU A 110 -8.627 -2.288 -10.127 1.00 0.00 O ATOM 1696 CB GLU A 110 -5.738 -3.874 -9.866 1.00 0.00 C ATOM 1697 CG GLU A 110 -6.249 -4.307 -8.490 1.00 0.00 C ATOM 1698 CD GLU A 110 -5.806 -5.736 -8.166 1.00 0.00 C ATOM 1699 OE1 GLU A 110 -4.745 -6.134 -8.693 1.00 0.00 O ATOM 1700 OE2 GLU A 110 -6.539 -6.396 -7.398 1.00 0.00 O ATOM 0 H GLU A 110 -4.620 -1.728 -9.107 1.00 0.00 H new ATOM 0 HA GLU A 110 -6.395 -2.437 -11.296 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -6.075 -4.583 -10.623 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.648 -3.892 -9.875 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.874 -3.624 -7.727 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -7.337 -4.245 -8.466 1.00 0.00 H new ATOM 1707 N LYS A 111 -7.457 -1.779 -8.259 1.00 0.00 N ATOM 1708 CA LYS A 111 -8.637 -1.458 -7.474 1.00 0.00 C ATOM 1709 C LYS A 111 -9.326 -0.231 -8.075 1.00 0.00 C ATOM 1710 O LYS A 111 -10.447 -0.325 -8.572 1.00 0.00 O ATOM 1711 CB LYS A 111 -8.271 -1.297 -5.998 1.00 0.00 C ATOM 1712 CG LYS A 111 -7.701 -2.598 -5.429 1.00 0.00 C ATOM 1713 CD LYS A 111 -8.810 -3.624 -5.189 1.00 0.00 C ATOM 1714 CE LYS A 111 -8.264 -5.051 -5.271 1.00 0.00 C ATOM 1715 NZ LYS A 111 -8.809 -5.878 -4.172 1.00 0.00 N ATOM 0 H LYS A 111 -6.573 -1.680 -7.760 1.00 0.00 H new ATOM 0 HA LYS A 111 -9.355 -2.277 -7.513 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -7.540 -0.496 -5.886 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -9.154 -1.004 -5.431 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -6.964 -3.009 -6.119 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -7.182 -2.393 -4.493 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -9.258 -3.458 -4.209 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -9.600 -3.490 -5.928 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -8.528 -5.493 -6.232 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -7.176 -5.034 -5.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -8.469 -6.856 -4.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -8.494 -5.493 -3.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -9.848 -5.867 -4.212 1.00 0.00 H new ATOM 1729 N THR A 112 -8.626 0.892 -8.009 1.00 0.00 N ATOM 1730 CA THR A 112 -9.155 2.136 -8.540 1.00 0.00 C ATOM 1731 C THR A 112 -9.252 2.067 -10.065 1.00 0.00 C ATOM 1732 O THR A 112 -10.207 2.573 -10.654 1.00 0.00 O ATOM 1733 CB THR A 112 -8.270 3.279 -8.039 1.00 0.00 C ATOM 1734 OG1 THR A 112 -7.063 3.135 -8.782 1.00 0.00 O ATOM 1735 CG2 THR A 112 -7.836 3.089 -6.584 1.00 0.00 C ATOM 0 H THR A 112 -7.696 0.966 -7.596 1.00 0.00 H new ATOM 0 HA THR A 112 -10.171 2.315 -8.189 1.00 0.00 H new ATOM 0 HB THR A 112 -8.806 4.223 -8.138 1.00 0.00 H new ATOM 0 HG1 THR A 112 -6.472 2.499 -8.327 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.210 3.928 -6.279 1.00 0.00 H new ATOM 0 HG22 THR A 112 -8.717 3.042 -5.945 1.00 0.00 H new ATOM 0 HG23 THR A 112 -7.271 2.162 -6.491 1.00 0.00 H new ATOM 1743 N GLY A 113 -8.251 1.436 -10.662 1.00 0.00 N ATOM 1744 CA GLY A 113 -8.212 1.294 -12.107 1.00 0.00 C ATOM 1745 C GLY A 113 -7.270 2.324 -12.734 1.00 0.00 C ATOM 1746 O GLY A 113 -6.794 2.136 -13.853 1.00 0.00 O ATOM 0 H GLY A 113 -7.461 1.018 -10.171 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -7.883 0.288 -12.368 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -9.215 1.417 -12.515 1.00 0.00 H new ATOM 1750 N ASN A 114 -7.028 3.390 -11.985 1.00 0.00 N ATOM 1751 CA ASN A 114 -6.152 4.450 -12.454 1.00 0.00 C ATOM 1752 C ASN A 114 -4.758 4.256 -11.854 1.00 0.00 C ATOM 1753 O ASN A 114 -4.615 3.658 -10.788 1.00 0.00 O ATOM 1754 CB ASN A 114 -6.667 5.824 -12.018 1.00 0.00 C ATOM 1755 CG ASN A 114 -7.519 6.463 -13.116 1.00 0.00 C ATOM 1756 OD1 ASN A 114 -7.068 7.302 -13.878 1.00 0.00 O ATOM 1757 ND2 ASN A 114 -8.773 6.021 -13.154 1.00 0.00 N ATOM 0 H ASN A 114 -7.423 3.542 -11.057 1.00 0.00 H new ATOM 0 HA ASN A 114 -6.121 4.405 -13.543 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -7.257 5.723 -11.107 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -5.825 6.474 -11.782 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -9.422 6.386 -13.851 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -9.086 5.317 -12.486 1.00 0.00 H new ATOM 1764 N ALA A 115 -3.766 4.773 -12.563 1.00 0.00 N ATOM 1765 CA ALA A 115 -2.388 4.663 -12.114 1.00 0.00 C ATOM 1766 C ALA A 115 -2.248 5.333 -10.746 1.00 0.00 C ATOM 1767 O ALA A 115 -3.006 6.244 -10.416 1.00 0.00 O ATOM 1768 CB ALA A 115 -1.459 5.279 -13.162 1.00 0.00 C ATOM 0 H ALA A 115 -3.889 5.269 -13.446 1.00 0.00 H new ATOM 0 HA ALA A 115 -2.103 3.617 -12.000 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.426 5.197 -12.825 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -1.576 4.750 -14.108 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -1.713 6.330 -13.300 1.00 0.00 H new ATOM 1774 N TRP A 116 -1.274 4.855 -9.985 1.00 0.00 N ATOM 1775 CA TRP A 116 -1.025 5.396 -8.660 1.00 0.00 C ATOM 1776 C TRP A 116 -0.907 6.916 -8.784 1.00 0.00 C ATOM 1777 O TRP A 116 -1.613 7.655 -8.099 1.00 0.00 O ATOM 1778 CB TRP A 116 0.210 4.751 -8.028 1.00 0.00 C ATOM 1779 CG TRP A 116 0.878 5.608 -6.951 1.00 0.00 C ATOM 1780 CD1 TRP A 116 1.819 6.549 -7.112 1.00 0.00 C ATOM 1781 CD2 TRP A 116 0.616 5.566 -5.533 1.00 0.00 C ATOM 1782 NE1 TRP A 116 2.181 7.113 -5.906 1.00 0.00 N ATOM 1783 CE2 TRP A 116 1.426 6.497 -4.915 1.00 0.00 C ATOM 1784 CE3 TRP A 116 -0.277 4.768 -4.796 1.00 0.00 C ATOM 1785 CZ2 TRP A 116 1.425 6.716 -3.532 1.00 0.00 C ATOM 1786 CZ3 TRP A 116 -0.265 4.999 -3.415 1.00 0.00 C ATOM 1787 CH2 TRP A 116 0.544 5.932 -2.778 1.00 0.00 C ATOM 0 H TRP A 116 -0.648 4.099 -10.261 1.00 0.00 H new ATOM 0 HA TRP A 116 -1.851 5.165 -7.988 1.00 0.00 H new ATOM 0 HB2 TRP A 116 -0.076 3.794 -7.591 1.00 0.00 H new ATOM 0 HB3 TRP A 116 0.937 4.539 -8.812 1.00 0.00 H new ATOM 0 HD1 TRP A 116 2.241 6.830 -8.066 1.00 0.00 H new ATOM 0 HE1 TRP A 116 2.875 7.847 -5.767 1.00 0.00 H new ATOM 0 HE3 TRP A 116 -0.921 4.035 -5.259 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 2.069 7.450 -3.072 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 -0.931 4.411 -2.802 1.00 0.00 H new ATOM 0 HH2 TRP A 116 0.493 6.052 -1.706 1.00 0.00 H new ATOM 1798 N HIS A 117 -0.011 7.339 -9.664 1.00 0.00 N ATOM 1799 CA HIS A 117 0.208 8.758 -9.886 1.00 0.00 C ATOM 1800 C HIS A 117 -1.005 9.358 -10.599 1.00 0.00 C ATOM 1801 O HIS A 117 -1.840 10.007 -9.971 1.00 0.00 O ATOM 1802 CB HIS A 117 1.517 8.993 -10.643 1.00 0.00 C ATOM 1803 CG HIS A 117 2.757 8.746 -9.817 1.00 0.00 C ATOM 1804 ND1 HIS A 117 3.061 9.480 -8.684 1.00 0.00 N ATOM 1805 CD2 HIS A 117 3.764 7.840 -9.971 1.00 0.00 C ATOM 1806 CE1 HIS A 117 4.203 9.028 -8.187 1.00 0.00 C ATOM 1807 NE2 HIS A 117 4.638 8.012 -8.986 1.00 0.00 N ATOM 0 H HIS A 117 0.572 6.724 -10.232 1.00 0.00 H new ATOM 0 HA HIS A 117 0.313 9.269 -8.929 1.00 0.00 H new ATOM 0 HB2 HIS A 117 1.540 8.343 -11.518 1.00 0.00 H new ATOM 0 HB3 HIS A 117 1.534 10.020 -11.008 1.00 0.00 H new ATOM 0 HD2 HIS A 117 3.838 7.107 -10.760 1.00 0.00 H new ATOM 0 HE1 HIS A 117 4.702 9.399 -7.304 1.00 0.00 H new ATOM 0 HE2 HIS A 117 5.493 7.473 -8.850 1.00 0.00 H new ATOM 1815 N SER A 118 -1.063 9.121 -11.901 1.00 0.00 N ATOM 1816 CA SER A 118 -2.160 9.631 -12.706 1.00 0.00 C ATOM 1817 C SER A 118 -2.154 11.161 -12.692 1.00 0.00 C ATOM 1818 O SER A 118 -1.294 11.775 -12.063 1.00 0.00 O ATOM 1819 CB SER A 118 -3.505 9.101 -12.203 1.00 0.00 C ATOM 1820 OG SER A 118 -4.396 10.156 -11.852 1.00 0.00 O ATOM 0 H SER A 118 -0.368 8.583 -12.419 1.00 0.00 H new ATOM 0 HA SER A 118 -2.022 9.283 -13.730 1.00 0.00 H new ATOM 0 HB2 SER A 118 -3.962 8.482 -12.975 1.00 0.00 H new ATOM 0 HB3 SER A 118 -3.341 8.461 -11.336 1.00 0.00 H new ATOM 0 HG SER A 118 -5.243 9.777 -11.537 1.00 0.00 H new ATOM 1826 N LYS A 119 -3.122 11.732 -13.393 1.00 0.00 N ATOM 1827 CA LYS A 119 -3.239 13.178 -13.468 1.00 0.00 C ATOM 1828 C LYS A 119 -4.591 13.607 -12.895 1.00 0.00 C ATOM 1829 O LYS A 119 -4.648 14.416 -11.970 1.00 0.00 O ATOM 1830 CB LYS A 119 -2.996 13.661 -14.900 1.00 0.00 C ATOM 1831 CG LYS A 119 -1.528 14.035 -15.111 1.00 0.00 C ATOM 1832 CD LYS A 119 -1.399 15.450 -15.678 1.00 0.00 C ATOM 1833 CE LYS A 119 -0.976 15.416 -17.148 1.00 0.00 C ATOM 1834 NZ LYS A 119 -1.020 16.775 -17.732 1.00 0.00 N ATOM 0 H LYS A 119 -3.833 11.219 -13.914 1.00 0.00 H new ATOM 0 HA LYS A 119 -2.470 13.655 -12.860 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.281 12.879 -15.604 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -3.628 14.524 -15.109 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -0.992 13.969 -14.164 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -1.062 13.323 -15.792 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -2.351 15.972 -15.582 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -0.667 16.012 -15.098 1.00 0.00 H new ATOM 0 HE2 LYS A 119 0.032 15.010 -17.233 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -1.635 14.752 -17.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -0.730 16.734 -18.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -1.988 17.149 -17.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -0.373 17.399 -17.209 1.00 0.00 H new ATOM 1848 N ASN A 120 -5.645 13.047 -13.468 1.00 0.00 N ATOM 1849 CA ASN A 120 -6.993 13.362 -13.026 1.00 0.00 C ATOM 1850 C ASN A 120 -7.744 12.062 -12.728 1.00 0.00 C ATOM 1851 O ASN A 120 -8.119 11.333 -13.645 1.00 0.00 O ATOM 1852 CB ASN A 120 -7.766 14.116 -14.109 1.00 0.00 C ATOM 1853 CG ASN A 120 -9.094 14.649 -13.565 1.00 0.00 C ATOM 1854 OD1 ASN A 120 -9.514 14.333 -12.464 1.00 0.00 O ATOM 1855 ND2 ASN A 120 -9.727 15.472 -14.396 1.00 0.00 N ATOM 0 H ASN A 120 -5.593 12.377 -14.235 1.00 0.00 H new ATOM 0 HA ASN A 120 -6.918 13.986 -12.136 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -7.163 14.944 -14.481 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -7.955 13.454 -14.954 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -10.621 15.881 -14.126 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -9.318 15.694 -15.304 1.00 0.00 H new ATOM 1862 N PHE A 121 -7.940 11.812 -11.442 1.00 0.00 N ATOM 1863 CA PHE A 121 -8.639 10.613 -11.011 1.00 0.00 C ATOM 1864 C PHE A 121 -10.061 10.575 -11.575 1.00 0.00 C ATOM 1865 O PHE A 121 -10.733 11.603 -11.644 1.00 0.00 O ATOM 1866 CB PHE A 121 -8.710 10.661 -9.483 1.00 0.00 C ATOM 1867 CG PHE A 121 -9.168 9.350 -8.840 1.00 0.00 C ATOM 1868 CD1 PHE A 121 -8.340 8.271 -8.832 1.00 0.00 C ATOM 1869 CD2 PHE A 121 -10.403 9.264 -8.277 1.00 0.00 C ATOM 1870 CE1 PHE A 121 -8.765 7.055 -8.235 1.00 0.00 C ATOM 1871 CE2 PHE A 121 -10.828 8.048 -7.681 1.00 0.00 C ATOM 1872 CZ PHE A 121 -10.000 6.969 -7.672 1.00 0.00 C ATOM 0 H PHE A 121 -7.627 12.419 -10.684 1.00 0.00 H new ATOM 0 HA PHE A 121 -8.112 9.727 -11.366 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -7.727 10.922 -9.092 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -9.392 11.457 -9.186 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -7.360 8.339 -9.280 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -11.060 10.121 -8.283 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.108 6.198 -8.228 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -11.809 7.979 -7.235 1.00 0.00 H new ATOM 0 HZ PHE A 121 -10.323 6.044 -7.218 1.00 0.00 H new ATOM 1882 N THR A 122 -10.478 9.379 -11.963 1.00 0.00 N ATOM 1883 CA THR A 122 -11.807 9.193 -12.519 1.00 0.00 C ATOM 1884 C THR A 122 -12.584 8.153 -11.708 1.00 0.00 C ATOM 1885 O THR A 122 -12.252 6.969 -11.731 1.00 0.00 O ATOM 1886 CB THR A 122 -11.655 8.823 -13.995 1.00 0.00 C ATOM 1887 OG1 THR A 122 -11.320 10.054 -14.629 1.00 0.00 O ATOM 1888 CG2 THR A 122 -12.985 8.423 -14.638 1.00 0.00 C ATOM 0 H THR A 122 -9.918 8.528 -11.903 1.00 0.00 H new ATOM 0 HA THR A 122 -12.393 10.110 -12.458 1.00 0.00 H new ATOM 0 HB THR A 122 -10.943 8.003 -14.092 1.00 0.00 H new ATOM 0 HG1 THR A 122 -11.201 9.905 -15.590 1.00 0.00 H new ATOM 0 HG21 THR A 122 -12.821 8.170 -15.686 1.00 0.00 H new ATOM 0 HG22 THR A 122 -13.396 7.559 -14.116 1.00 0.00 H new ATOM 0 HG23 THR A 122 -13.686 9.255 -14.571 1.00 0.00 H new ATOM 1896 N LYS A 123 -13.603 8.634 -11.011 1.00 0.00 N ATOM 1897 CA LYS A 123 -14.429 7.761 -10.195 1.00 0.00 C ATOM 1898 C LYS A 123 -15.230 6.826 -11.104 1.00 0.00 C ATOM 1899 O LYS A 123 -16.119 7.271 -11.828 1.00 0.00 O ATOM 1900 CB LYS A 123 -15.298 8.583 -9.241 1.00 0.00 C ATOM 1901 CG LYS A 123 -15.135 8.101 -7.798 1.00 0.00 C ATOM 1902 CD LYS A 123 -16.463 7.590 -7.237 1.00 0.00 C ATOM 1903 CE LYS A 123 -16.648 6.100 -7.534 1.00 0.00 C ATOM 1904 NZ LYS A 123 -17.504 5.912 -8.726 1.00 0.00 N ATOM 0 H LYS A 123 -13.875 9.617 -10.995 1.00 0.00 H new ATOM 0 HA LYS A 123 -13.805 7.132 -9.560 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -15.024 9.636 -9.310 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -16.344 8.506 -9.538 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -14.390 7.307 -7.758 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -14.764 8.917 -7.178 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -16.495 7.756 -6.160 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -17.287 8.156 -7.671 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -15.677 5.633 -7.699 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -17.098 5.605 -6.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -17.291 4.993 -9.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -18.504 5.937 -8.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -17.319 6.673 -9.410 1.00 0.00 H new ATOM 1918 N TYR A 124 -14.884 5.549 -11.038 1.00 0.00 N ATOM 1919 CA TYR A 124 -15.560 4.548 -11.846 1.00 0.00 C ATOM 1920 C TYR A 124 -16.433 3.640 -10.978 1.00 0.00 C ATOM 1921 O TYR A 124 -16.278 3.604 -9.759 1.00 0.00 O ATOM 1922 CB TYR A 124 -14.454 3.709 -12.489 1.00 0.00 C ATOM 1923 CG TYR A 124 -14.049 4.179 -13.888 1.00 0.00 C ATOM 1924 CD1 TYR A 124 -15.020 4.467 -14.826 1.00 0.00 C ATOM 1925 CD2 TYR A 124 -12.715 4.314 -14.211 1.00 0.00 C ATOM 1926 CE1 TYR A 124 -14.639 4.910 -16.143 1.00 0.00 C ATOM 1927 CE2 TYR A 124 -12.334 4.757 -15.528 1.00 0.00 C ATOM 1928 CZ TYR A 124 -13.315 5.032 -16.428 1.00 0.00 C ATOM 1929 OH TYR A 124 -12.956 5.450 -17.672 1.00 0.00 O ATOM 0 H TYR A 124 -14.144 5.184 -10.438 1.00 0.00 H new ATOM 0 HA TYR A 124 -16.207 5.023 -12.583 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -13.576 3.727 -11.843 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -14.786 2.672 -12.547 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -16.064 4.360 -14.573 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -11.956 4.088 -13.477 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -15.388 5.140 -16.887 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -11.293 4.868 -15.794 1.00 0.00 H new ATOM 0 HH TYR A 124 -11.979 5.492 -17.734 1.00 0.00 H new ATOM 1939 N PRO A 125 -17.357 2.909 -11.659 1.00 0.00 N ATOM 1940 CA PRO A 125 -18.255 2.004 -10.963 1.00 0.00 C ATOM 1941 C PRO A 125 -17.522 0.734 -10.525 1.00 0.00 C ATOM 1942 O PRO A 125 -16.968 0.015 -11.355 1.00 0.00 O ATOM 1943 CB PRO A 125 -19.379 1.731 -11.949 1.00 0.00 C ATOM 1944 CG PRO A 125 -18.838 2.117 -13.315 1.00 0.00 C ATOM 1945 CD PRO A 125 -17.569 2.926 -13.103 1.00 0.00 C ATOM 0 HA PRO A 125 -18.648 2.428 -10.039 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -19.671 0.681 -11.927 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -20.266 2.314 -11.701 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -18.628 1.227 -13.908 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -19.575 2.701 -13.866 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -16.725 2.485 -13.633 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -17.682 3.944 -13.475 1.00 0.00 H new ATOM 1953 N LYS A 126 -17.544 0.496 -9.221 1.00 0.00 N ATOM 1954 CA LYS A 126 -16.889 -0.674 -8.663 1.00 0.00 C ATOM 1955 C LYS A 126 -15.421 -0.347 -8.384 1.00 0.00 C ATOM 1956 O LYS A 126 -14.778 -1.008 -7.570 1.00 0.00 O ATOM 1957 CB LYS A 126 -17.086 -1.885 -9.577 1.00 0.00 C ATOM 1958 CG LYS A 126 -18.531 -1.969 -10.073 1.00 0.00 C ATOM 1959 CD LYS A 126 -18.914 -3.412 -10.406 1.00 0.00 C ATOM 1960 CE LYS A 126 -19.013 -4.260 -9.137 1.00 0.00 C ATOM 1961 NZ LYS A 126 -19.896 -5.427 -9.360 1.00 0.00 N ATOM 0 H LYS A 126 -18.005 1.094 -8.536 1.00 0.00 H new ATOM 0 HA LYS A 126 -17.342 -0.946 -7.710 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -16.409 -1.816 -10.428 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -16.829 -2.797 -9.038 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -19.204 -1.577 -9.311 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -18.653 -1.344 -10.957 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -19.868 -3.426 -10.933 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -18.172 -3.843 -11.079 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -18.020 -4.599 -8.841 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -19.401 -3.655 -8.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -19.952 -5.992 -8.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -20.847 -5.098 -9.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -19.510 -6.013 -10.128 1.00 0.00 H new ATOM 1975 N LYS A 127 -14.934 0.673 -9.074 1.00 0.00 N ATOM 1976 CA LYS A 127 -13.553 1.097 -8.911 1.00 0.00 C ATOM 1977 C LYS A 127 -13.369 1.690 -7.513 1.00 0.00 C ATOM 1978 O LYS A 127 -14.238 2.406 -7.018 1.00 0.00 O ATOM 1979 CB LYS A 127 -13.146 2.045 -10.040 1.00 0.00 C ATOM 1980 CG LYS A 127 -12.996 1.290 -11.363 1.00 0.00 C ATOM 1981 CD LYS A 127 -11.977 0.156 -11.234 1.00 0.00 C ATOM 1982 CE LYS A 127 -11.542 -0.348 -12.612 1.00 0.00 C ATOM 1983 NZ LYS A 127 -11.601 -1.826 -12.665 1.00 0.00 N ATOM 0 H LYS A 127 -15.471 1.219 -9.748 1.00 0.00 H new ATOM 0 HA LYS A 127 -12.880 0.243 -8.987 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -13.894 2.830 -10.148 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -12.205 2.534 -9.788 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -13.961 0.884 -11.666 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -12.681 1.980 -12.146 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.106 0.506 -10.679 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -12.411 -0.665 -10.663 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -12.188 0.076 -13.381 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -10.528 -0.011 -12.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.303 -2.152 -13.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -10.967 -2.225 -11.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -12.575 -2.141 -12.482 1.00 0.00 H new ATOM 1997 N PHE A 128 -12.230 1.371 -6.915 1.00 0.00 N ATOM 1998 CA PHE A 128 -11.920 1.864 -5.583 1.00 0.00 C ATOM 1999 C PHE A 128 -11.376 3.292 -5.641 1.00 0.00 C ATOM 2000 O PHE A 128 -10.668 3.654 -6.579 1.00 0.00 O ATOM 2001 CB PHE A 128 -10.844 0.943 -5.005 1.00 0.00 C ATOM 2002 CG PHE A 128 -11.393 -0.343 -4.384 1.00 0.00 C ATOM 2003 CD1 PHE A 128 -11.709 -1.400 -5.178 1.00 0.00 C ATOM 2004 CD2 PHE A 128 -11.564 -0.429 -3.037 1.00 0.00 C ATOM 2005 CE1 PHE A 128 -12.218 -2.594 -4.602 1.00 0.00 C ATOM 2006 CE2 PHE A 128 -12.073 -1.622 -2.461 1.00 0.00 C ATOM 2007 CZ PHE A 128 -12.390 -2.680 -3.255 1.00 0.00 C ATOM 0 H PHE A 128 -11.511 0.777 -7.328 1.00 0.00 H new ATOM 0 HA PHE A 128 -12.821 1.872 -4.969 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -10.141 0.681 -5.796 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -10.282 1.489 -4.247 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -11.573 -1.332 -6.247 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -11.312 0.411 -2.406 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -12.469 -3.434 -5.233 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -12.209 -1.690 -1.392 1.00 0.00 H new ATOM 0 HZ PHE A 128 -12.778 -3.588 -2.817 1.00 0.00 H new ATOM 2017 N TYR A 129 -11.727 4.067 -4.624 1.00 0.00 N ATOM 2018 CA TYR A 129 -11.283 5.448 -4.547 1.00 0.00 C ATOM 2019 C TYR A 129 -10.754 5.776 -3.149 1.00 0.00 C ATOM 2020 O TYR A 129 -11.009 5.041 -2.197 1.00 0.00 O ATOM 2021 CB TYR A 129 -12.519 6.305 -4.826 1.00 0.00 C ATOM 2022 CG TYR A 129 -13.609 6.192 -3.758 1.00 0.00 C ATOM 2023 CD1 TYR A 129 -13.394 6.708 -2.496 1.00 0.00 C ATOM 2024 CD2 TYR A 129 -14.806 5.573 -4.056 1.00 0.00 C ATOM 2025 CE1 TYR A 129 -14.420 6.602 -1.491 1.00 0.00 C ATOM 2026 CE2 TYR A 129 -15.831 5.467 -3.051 1.00 0.00 C ATOM 2027 CZ TYR A 129 -15.588 5.986 -1.818 1.00 0.00 C ATOM 2028 OH TYR A 129 -16.556 5.886 -0.868 1.00 0.00 O ATOM 0 H TYR A 129 -12.314 3.764 -3.847 1.00 0.00 H new ATOM 0 HA TYR A 129 -10.478 5.633 -5.258 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -12.214 7.348 -4.910 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.938 6.017 -5.790 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -12.457 7.191 -2.262 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -14.974 5.168 -5.043 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.266 7.003 -0.500 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -16.772 4.986 -3.271 1.00 0.00 H new ATOM 0 HH TYR A 129 -17.335 5.424 -1.242 1.00 0.00 H new ATOM 2038 N PRO A 130 -10.008 6.911 -3.069 1.00 0.00 N ATOM 2039 CA PRO A 130 -9.442 7.346 -1.804 1.00 0.00 C ATOM 2040 C PRO A 130 -10.518 7.948 -0.899 1.00 0.00 C ATOM 2041 O PRO A 130 -11.167 8.926 -1.267 1.00 0.00 O ATOM 2042 CB PRO A 130 -8.357 8.342 -2.180 1.00 0.00 C ATOM 2043 CG PRO A 130 -8.666 8.777 -3.604 1.00 0.00 C ATOM 2044 CD PRO A 130 -9.686 7.806 -4.176 1.00 0.00 C ATOM 0 HA PRO A 130 -9.025 6.522 -1.225 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -8.358 9.195 -1.502 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -7.369 7.886 -2.117 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -9.058 9.794 -3.616 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -7.759 8.778 -4.208 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -10.573 8.329 -4.533 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -9.277 7.256 -5.024 1.00 0.00 H new ATOM 2052 N LEU A 131 -10.674 7.339 0.267 1.00 0.00 N ATOM 2053 CA LEU A 131 -11.661 7.803 1.228 1.00 0.00 C ATOM 2054 C LEU A 131 -11.238 9.171 1.766 1.00 0.00 C ATOM 2055 O LEU A 131 -11.994 10.138 1.679 1.00 0.00 O ATOM 2056 CB LEU A 131 -11.881 6.754 2.319 1.00 0.00 C ATOM 2057 CG LEU A 131 -12.349 5.377 1.842 1.00 0.00 C ATOM 2058 CD1 LEU A 131 -12.234 4.341 2.961 1.00 0.00 C ATOM 2059 CD2 LEU A 131 -13.765 5.448 1.268 1.00 0.00 C ATOM 0 H LEU A 131 -10.134 6.528 0.568 1.00 0.00 H new ATOM 0 HA LEU A 131 -12.630 7.935 0.746 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -10.948 6.628 2.868 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -12.616 7.141 3.025 1.00 0.00 H new ATOM 0 HG LEU A 131 -11.691 5.053 1.036 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -12.573 3.372 2.596 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -11.195 4.265 3.281 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -12.852 4.647 3.805 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -14.073 4.456 0.936 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -14.452 5.804 2.036 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -13.781 6.135 0.422 1.00 0.00 H new ATOM 2071 N GLU A 132 -10.031 9.209 2.312 1.00 0.00 N ATOM 2072 CA GLU A 132 -9.499 10.443 2.865 1.00 0.00 C ATOM 2073 C GLU A 132 -8.202 10.829 2.151 1.00 0.00 C ATOM 2074 O GLU A 132 -7.152 10.238 2.401 1.00 0.00 O ATOM 2075 CB GLU A 132 -9.277 10.317 4.374 1.00 0.00 C ATOM 2076 CG GLU A 132 -10.148 11.314 5.141 1.00 0.00 C ATOM 2077 CD GLU A 132 -9.556 11.610 6.521 1.00 0.00 C ATOM 2078 OE1 GLU A 132 -8.655 12.474 6.578 1.00 0.00 O ATOM 2079 OE2 GLU A 132 -10.019 10.967 7.487 1.00 0.00 O ATOM 0 H GLU A 132 -9.407 8.405 2.383 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.230 11.235 2.703 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -9.510 9.302 4.696 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -8.227 10.492 4.607 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -10.235 12.240 4.572 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -11.155 10.913 5.252 1.00 0.00 H new