USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 766 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 LYS NZ :NH3+ -145:sc= 0.682 (180deg=0) USER MOD Set 1.2: A 77 ASN :FLIP amide:sc= -1.8! C(o=-9.4!,f=-1.1!) USER MOD Single : A 24 GLN : amide:sc= -7.95! C(o=-8!,f=-10!) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 ASN :FLIP amide:sc= -0.752 F(o=-1.8!,f=-0.75) USER MOD Single : A 34 SER OG : rot -98:sc= 1.27 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.256 K(o=-0.26,f=-2.5!) USER MOD Single : A 47 LYS NZ :NH3+ -172:sc= 0.102 (180deg=0.0878) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.0275 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.297 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -2.91 K(o=-2.9,f=-4!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.0147 X(o=-0.015,f=-0.44) USER MOD Single : A 84 ASN :FLIP amide:sc= -1.19 F(o=-2.5,f=-1.2) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -154:sc= -0.101 (180deg=-0.612) USER MOD Single : A 92 SER OG : rot -45:sc= 0.314 USER MOD Single : A 93 ASN : amide:sc= -1.41 K(o=-1.4,f=-4.9!) USER MOD Single : A 94 HIS : no HD1:sc= -0.27 X(o=-0.27,f=-0.5) USER MOD Single : A 97 MET CE :methyl 174:sc= -0.969 (180deg=-0.994) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 70:sc= 0.158 USER MOD Single : A 104 MET CE :methyl -110:sc= -7.54! (180deg=-12!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= -11.6! C(o=-12!,f=-24!) USER MOD Single : A 113 MET CE :methyl 171:sc= -1.9 (180deg=-1.98) USER MOD Single : A 115 GLN : amide:sc= -4.73! C(o=-4.7!,f=-7.2!) USER MOD ----------------------------------------------------------------- ATOM 283 N GLU A 23 -1.898 15.764 -5.094 1.00 0.00 N ATOM 284 CA GLU A 23 -1.393 14.616 -5.828 1.00 0.00 C ATOM 285 C GLU A 23 -2.289 13.399 -5.591 1.00 0.00 C ATOM 286 O GLU A 23 -2.502 12.993 -4.449 1.00 0.00 O ATOM 287 CB GLU A 23 0.056 14.313 -5.444 1.00 0.00 C ATOM 288 CG GLU A 23 1.032 15.005 -6.397 1.00 0.00 C ATOM 289 CD GLU A 23 2.366 14.257 -6.454 1.00 0.00 C ATOM 290 OE1 GLU A 23 2.642 13.514 -5.488 1.00 0.00 O ATOM 291 OE2 GLU A 23 3.080 14.446 -7.463 1.00 0.00 O ATOM 0 HA GLU A 23 -1.410 14.854 -6.892 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.242 14.645 -4.423 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.224 13.236 -5.465 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.597 15.056 -7.395 1.00 0.00 H new ATOM 0 HG3 GLU A 23 1.200 16.031 -6.069 1.00 0.00 H new ATOM 298 N GLN A 24 -2.791 12.850 -6.687 1.00 0.00 N ATOM 299 CA GLN A 24 -3.659 11.688 -6.613 1.00 0.00 C ATOM 300 C GLN A 24 -3.199 10.617 -7.605 1.00 0.00 C ATOM 301 O GLN A 24 -2.721 10.937 -8.692 1.00 0.00 O ATOM 302 CB GLN A 24 -5.118 12.076 -6.863 1.00 0.00 C ATOM 303 CG GLN A 24 -5.972 10.840 -7.153 1.00 0.00 C ATOM 304 CD GLN A 24 -7.402 11.029 -6.642 1.00 0.00 C ATOM 305 OE1 GLN A 24 -7.654 11.721 -5.669 1.00 0.00 O ATOM 306 NE2 GLN A 24 -8.320 10.378 -7.350 1.00 0.00 N ATOM 0 H GLN A 24 -2.613 13.189 -7.632 1.00 0.00 H new ATOM 0 HA GLN A 24 -3.595 11.275 -5.606 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -5.513 12.599 -5.992 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.175 12.767 -7.704 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.988 10.648 -8.226 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -5.525 9.966 -6.679 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -8.040 9.816 -8.154 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -9.304 10.441 -7.089 1.00 0.00 H new ATOM 315 N LEU A 25 -3.360 9.368 -7.194 1.00 0.00 N ATOM 316 CA LEU A 25 -2.967 8.248 -8.033 1.00 0.00 C ATOM 317 C LEU A 25 -4.015 7.139 -7.920 1.00 0.00 C ATOM 318 O LEU A 25 -4.403 6.756 -6.818 1.00 0.00 O ATOM 319 CB LEU A 25 -1.548 7.791 -7.686 1.00 0.00 C ATOM 320 CG LEU A 25 -0.411 8.627 -8.275 1.00 0.00 C ATOM 321 CD1 LEU A 25 0.917 8.313 -7.583 1.00 0.00 C ATOM 322 CD2 LEU A 25 -0.324 8.444 -9.792 1.00 0.00 C ATOM 0 H LEU A 25 -3.757 9.107 -6.292 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.933 8.550 -9.080 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.444 7.786 -6.601 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.427 6.761 -8.022 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.630 9.679 -8.089 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.708 8.921 -8.021 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.835 8.536 -6.519 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.155 7.258 -7.715 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.493 9.049 -10.185 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.141 7.394 -10.022 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.262 8.758 -10.251 1.00 0.00 H new ATOM 334 N THR A 26 -4.444 6.655 -9.077 1.00 0.00 N ATOM 335 CA THR A 26 -5.440 5.598 -9.122 1.00 0.00 C ATOM 336 C THR A 26 -4.811 4.294 -9.617 1.00 0.00 C ATOM 337 O THR A 26 -4.569 4.132 -10.812 1.00 0.00 O ATOM 338 CB THR A 26 -6.602 6.081 -9.992 1.00 0.00 C ATOM 339 OG1 THR A 26 -6.894 7.382 -9.490 1.00 0.00 O ATOM 340 CG2 THR A 26 -7.888 5.289 -9.743 1.00 0.00 C ATOM 0 H THR A 26 -4.120 6.975 -9.990 1.00 0.00 H new ATOM 0 HA THR A 26 -5.829 5.378 -8.128 1.00 0.00 H new ATOM 0 HB THR A 26 -6.325 6.003 -11.043 1.00 0.00 H new ATOM 0 HG1 THR A 26 -7.636 7.770 -9.999 1.00 0.00 H new ATOM 0 HG21 THR A 26 -8.681 5.672 -10.385 1.00 0.00 H new ATOM 0 HG22 THR A 26 -7.716 4.236 -9.967 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.184 5.394 -8.699 1.00 0.00 H new ATOM 348 N LEU A 27 -4.565 3.398 -8.673 1.00 0.00 N ATOM 349 CA LEU A 27 -3.969 2.113 -8.998 1.00 0.00 C ATOM 350 C LEU A 27 -5.027 1.016 -8.861 1.00 0.00 C ATOM 351 O LEU A 27 -5.577 0.810 -7.780 1.00 0.00 O ATOM 352 CB LEU A 27 -2.720 1.871 -8.148 1.00 0.00 C ATOM 353 CG LEU A 27 -1.641 2.954 -8.220 1.00 0.00 C ATOM 354 CD1 LEU A 27 -1.174 3.169 -9.661 1.00 0.00 C ATOM 355 CD2 LEU A 27 -2.125 4.254 -7.574 1.00 0.00 C ATOM 0 H LEU A 27 -4.767 3.536 -7.683 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.629 2.102 -10.034 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.028 1.761 -7.108 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.276 0.923 -8.451 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.777 2.613 -7.650 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.407 3.944 -9.683 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.762 2.239 -10.052 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -2.020 3.478 -10.275 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.339 5.007 -7.639 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -3.013 4.611 -8.095 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.368 4.072 -6.527 1.00 0.00 H new ATOM 367 N GLU A 28 -5.280 0.341 -9.973 1.00 0.00 N ATOM 368 CA GLU A 28 -6.262 -0.730 -9.991 1.00 0.00 C ATOM 369 C GLU A 28 -5.578 -2.082 -9.778 1.00 0.00 C ATOM 370 O GLU A 28 -4.486 -2.316 -10.294 1.00 0.00 O ATOM 371 CB GLU A 28 -7.062 -0.719 -11.295 1.00 0.00 C ATOM 372 CG GLU A 28 -7.586 0.684 -11.605 1.00 0.00 C ATOM 373 CD GLU A 28 -7.525 0.973 -13.106 1.00 0.00 C ATOM 374 OE1 GLU A 28 -7.403 -0.010 -13.869 1.00 0.00 O ATOM 375 OE2 GLU A 28 -7.603 2.170 -13.458 1.00 0.00 O ATOM 0 H GLU A 28 -4.822 0.515 -10.868 1.00 0.00 H new ATOM 0 HA GLU A 28 -6.963 -0.567 -9.172 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.433 -1.065 -12.115 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.898 -1.415 -11.219 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.614 0.778 -11.255 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -6.996 1.424 -11.064 1.00 0.00 H new ATOM 382 N ILE A 29 -6.248 -2.936 -9.019 1.00 0.00 N ATOM 383 CA ILE A 29 -5.718 -4.258 -8.732 1.00 0.00 C ATOM 384 C ILE A 29 -6.788 -5.308 -9.035 1.00 0.00 C ATOM 385 O ILE A 29 -7.914 -5.211 -8.548 1.00 0.00 O ATOM 386 CB ILE A 29 -5.181 -4.321 -7.301 1.00 0.00 C ATOM 387 CG1 ILE A 29 -3.924 -3.462 -7.148 1.00 0.00 C ATOM 388 CG2 ILE A 29 -4.942 -5.769 -6.868 1.00 0.00 C ATOM 389 CD1 ILE A 29 -3.590 -3.237 -5.672 1.00 0.00 C ATOM 0 H ILE A 29 -7.154 -2.738 -8.594 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.866 -4.476 -9.377 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.937 -3.906 -6.634 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -3.084 -3.948 -7.645 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -4.073 -2.502 -7.641 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.560 -5.785 -5.847 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -5.880 -6.322 -6.914 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.215 -6.233 -7.535 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.693 -2.624 -5.591 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.422 -2.729 -5.184 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.417 -4.198 -5.187 1.00 0.00 H new ATOM 401 N PRO A 30 -6.390 -6.315 -9.858 1.00 0.00 N ATOM 402 CA PRO A 30 -7.302 -7.382 -10.231 1.00 0.00 C ATOM 403 C PRO A 30 -7.502 -8.362 -9.073 1.00 0.00 C ATOM 404 O PRO A 30 -6.575 -8.621 -8.307 1.00 0.00 O ATOM 405 CB PRO A 30 -6.672 -8.028 -11.454 1.00 0.00 C ATOM 406 CG PRO A 30 -5.212 -7.606 -11.443 1.00 0.00 C ATOM 407 CD PRO A 30 -5.065 -6.462 -10.453 1.00 0.00 C ATOM 0 HA PRO A 30 -8.304 -7.019 -10.461 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -6.765 -9.113 -11.414 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.167 -7.699 -12.368 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.575 -8.443 -11.157 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.898 -7.292 -12.438 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.314 -6.687 -9.696 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.751 -5.545 -10.951 1.00 0.00 H new ATOM 415 N LEU A 31 -8.718 -8.881 -8.983 1.00 0.00 N ATOM 416 CA LEU A 31 -9.051 -9.827 -7.931 1.00 0.00 C ATOM 417 C LEU A 31 -9.591 -11.113 -8.561 1.00 0.00 C ATOM 418 O LEU A 31 -10.524 -11.720 -8.038 1.00 0.00 O ATOM 419 CB LEU A 31 -10.006 -9.190 -6.920 1.00 0.00 C ATOM 420 CG LEU A 31 -9.498 -7.927 -6.221 1.00 0.00 C ATOM 421 CD1 LEU A 31 -10.421 -7.530 -5.068 1.00 0.00 C ATOM 422 CD2 LEU A 31 -8.048 -8.101 -5.762 1.00 0.00 C ATOM 0 H LEU A 31 -9.484 -8.665 -9.621 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.159 -10.098 -7.365 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -10.937 -8.948 -7.432 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.245 -9.932 -6.158 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.512 -7.108 -6.940 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.037 -6.630 -4.588 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -11.422 -7.337 -5.453 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.462 -8.340 -4.340 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.711 -7.190 -5.268 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -7.985 -8.936 -5.064 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.414 -8.301 -6.626 1.00 0.00 H new ATOM 434 N ASN A 32 -8.980 -11.490 -9.674 1.00 0.00 N ATOM 435 CA ASN A 32 -9.388 -12.693 -10.380 1.00 0.00 C ATOM 436 C ASN A 32 -8.988 -13.921 -9.560 1.00 0.00 C ATOM 437 O ASN A 32 -9.847 -14.681 -9.114 1.00 0.00 O ATOM 438 CB ASN A 32 -8.700 -12.791 -11.744 1.00 0.00 C ATOM 439 CG ASN A 32 -8.949 -11.531 -12.575 1.00 0.00 C ATOM 440 OD1 ASN A 32 -7.927 -10.680 -12.586 1.00 0.00 O flip ATOM 441 ND2 ASN A 32 -9.999 -11.344 -13.167 1.00 0.00 N flip ATOM 0 H ASN A 32 -8.206 -10.984 -10.104 1.00 0.00 H new ATOM 0 HA ASN A 32 -10.468 -12.651 -10.522 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -7.628 -12.934 -11.605 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.071 -13.664 -12.281 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -10.744 -12.039 -13.116 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -10.132 -10.493 -13.713 1.00 0.00 H new ATOM 448 N ASP A 33 -7.684 -14.077 -9.385 1.00 0.00 N ATOM 449 CA ASP A 33 -7.160 -15.200 -8.626 1.00 0.00 C ATOM 450 C ASP A 33 -7.064 -14.811 -7.149 1.00 0.00 C ATOM 451 O ASP A 33 -7.200 -15.661 -6.270 1.00 0.00 O ATOM 452 CB ASP A 33 -5.759 -15.584 -9.106 1.00 0.00 C ATOM 453 CG ASP A 33 -5.594 -17.049 -9.515 1.00 0.00 C ATOM 454 OD1 ASP A 33 -6.522 -17.561 -10.176 1.00 0.00 O ATOM 455 OD2 ASP A 33 -4.543 -17.623 -9.157 1.00 0.00 O ATOM 0 H ASP A 33 -6.975 -13.445 -9.756 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.833 -16.046 -8.767 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -5.497 -14.954 -9.956 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -5.046 -15.362 -8.312 1.00 0.00 H new ATOM 460 N SER A 34 -6.831 -13.527 -6.922 1.00 0.00 N ATOM 461 CA SER A 34 -6.715 -13.016 -5.567 1.00 0.00 C ATOM 462 C SER A 34 -8.101 -12.914 -4.926 1.00 0.00 C ATOM 463 O SER A 34 -8.247 -13.108 -3.721 1.00 0.00 O ATOM 464 CB SER A 34 -6.021 -11.652 -5.551 1.00 0.00 C ATOM 465 OG SER A 34 -5.177 -11.497 -4.413 1.00 0.00 O ATOM 0 H SER A 34 -6.719 -12.825 -7.654 1.00 0.00 H new ATOM 0 HA SER A 34 -6.105 -13.711 -4.990 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.430 -11.535 -6.459 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.773 -10.863 -5.556 1.00 0.00 H new ATOM 0 HG SER A 34 -5.654 -10.999 -3.717 1.00 0.00 H new ATOM 471 N GLY A 35 -9.083 -12.609 -5.762 1.00 0.00 N ATOM 472 CA GLY A 35 -10.452 -12.479 -5.292 1.00 0.00 C ATOM 473 C GLY A 35 -10.763 -13.520 -4.215 1.00 0.00 C ATOM 474 O GLY A 35 -11.418 -13.213 -3.220 1.00 0.00 O ATOM 0 H GLY A 35 -8.958 -12.448 -6.761 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.609 -11.478 -4.891 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -11.140 -12.599 -6.129 1.00 0.00 H new ATOM 478 N SER A 36 -10.279 -14.731 -4.450 1.00 0.00 N ATOM 479 CA SER A 36 -10.497 -15.820 -3.513 1.00 0.00 C ATOM 480 C SER A 36 -10.366 -15.308 -2.077 1.00 0.00 C ATOM 481 O SER A 36 -11.323 -15.359 -1.306 1.00 0.00 O ATOM 482 CB SER A 36 -9.513 -16.965 -3.760 1.00 0.00 C ATOM 483 OG SER A 36 -10.015 -18.211 -3.285 1.00 0.00 O ATOM 0 H SER A 36 -9.736 -14.982 -5.276 1.00 0.00 H new ATOM 0 HA SER A 36 -11.505 -16.205 -3.665 1.00 0.00 H new ATOM 0 HB2 SER A 36 -9.305 -17.041 -4.827 1.00 0.00 H new ATOM 0 HB3 SER A 36 -8.567 -16.743 -3.266 1.00 0.00 H new ATOM 0 HG SER A 36 -9.359 -18.917 -3.463 1.00 0.00 H new ATOM 489 N ALA A 37 -9.173 -14.826 -1.761 1.00 0.00 N ATOM 490 CA ALA A 37 -8.905 -14.306 -0.431 1.00 0.00 C ATOM 491 C ALA A 37 -9.150 -12.796 -0.420 1.00 0.00 C ATOM 492 O ALA A 37 -9.757 -12.269 0.511 1.00 0.00 O ATOM 493 CB ALA A 37 -7.476 -14.667 -0.020 1.00 0.00 C ATOM 0 H ALA A 37 -8.381 -14.785 -2.403 1.00 0.00 H new ATOM 0 HA ALA A 37 -9.578 -14.755 0.299 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.275 -14.277 0.978 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.361 -15.751 -0.016 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -6.772 -14.231 -0.729 1.00 0.00 H new ATOM 499 N GLY A 38 -8.665 -12.142 -1.466 1.00 0.00 N ATOM 500 CA GLY A 38 -8.825 -10.703 -1.588 1.00 0.00 C ATOM 501 C GLY A 38 -7.513 -10.040 -2.014 1.00 0.00 C ATOM 502 O GLY A 38 -6.550 -10.725 -2.356 1.00 0.00 O ATOM 0 H GLY A 38 -8.161 -12.582 -2.236 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.603 -10.481 -2.318 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.154 -10.288 -0.635 1.00 0.00 H new ATOM 506 N LEU A 39 -7.517 -8.716 -1.979 1.00 0.00 N ATOM 507 CA LEU A 39 -6.340 -7.953 -2.356 1.00 0.00 C ATOM 508 C LEU A 39 -5.090 -8.655 -1.822 1.00 0.00 C ATOM 509 O LEU A 39 -4.271 -9.147 -2.596 1.00 0.00 O ATOM 510 CB LEU A 39 -6.473 -6.500 -1.897 1.00 0.00 C ATOM 511 CG LEU A 39 -7.323 -5.590 -2.787 1.00 0.00 C ATOM 512 CD1 LEU A 39 -7.786 -4.350 -2.020 1.00 0.00 C ATOM 513 CD2 LEU A 39 -6.575 -5.224 -4.071 1.00 0.00 C ATOM 0 H LEU A 39 -8.318 -8.152 -1.695 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.244 -7.912 -3.441 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.899 -6.494 -0.894 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -5.474 -6.071 -1.822 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.217 -6.139 -3.081 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.388 -3.720 -2.675 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -8.384 -4.656 -1.161 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.917 -3.789 -1.676 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.201 -4.577 -4.685 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -5.652 -4.702 -3.818 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.338 -6.132 -4.625 1.00 0.00 H new ATOM 525 N GLY A 40 -4.982 -8.678 -0.502 1.00 0.00 N ATOM 526 CA GLY A 40 -3.846 -9.311 0.146 1.00 0.00 C ATOM 527 C GLY A 40 -2.910 -8.266 0.756 1.00 0.00 C ATOM 528 O GLY A 40 -1.690 -8.399 0.677 1.00 0.00 O ATOM 0 H GLY A 40 -5.663 -8.268 0.137 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.198 -9.988 0.925 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -3.300 -9.915 -0.578 1.00 0.00 H new ATOM 532 N VAL A 41 -3.517 -7.250 1.351 1.00 0.00 N ATOM 533 CA VAL A 41 -2.753 -6.183 1.974 1.00 0.00 C ATOM 534 C VAL A 41 -3.514 -5.665 3.197 1.00 0.00 C ATOM 535 O VAL A 41 -4.739 -5.755 3.255 1.00 0.00 O ATOM 536 CB VAL A 41 -2.452 -5.088 0.950 1.00 0.00 C ATOM 537 CG1 VAL A 41 -1.296 -5.497 0.034 1.00 0.00 C ATOM 538 CG2 VAL A 41 -3.700 -4.740 0.136 1.00 0.00 C ATOM 0 H VAL A 41 -4.529 -7.143 1.415 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.790 -6.556 2.323 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.148 -4.194 1.495 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.102 -4.701 -0.685 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.402 -5.671 0.632 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -1.560 -6.411 -0.499 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.458 -3.959 -0.585 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.048 -5.627 -0.393 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.484 -4.386 0.805 1.00 0.00 H new ATOM 548 N SER A 42 -2.755 -5.133 4.144 1.00 0.00 N ATOM 549 CA SER A 42 -3.341 -4.600 5.362 1.00 0.00 C ATOM 550 C SER A 42 -3.179 -3.079 5.399 1.00 0.00 C ATOM 551 O SER A 42 -2.225 -2.540 4.842 1.00 0.00 O ATOM 552 CB SER A 42 -2.706 -5.233 6.602 1.00 0.00 C ATOM 553 OG SER A 42 -3.404 -4.887 7.795 1.00 0.00 O ATOM 0 H SER A 42 -1.739 -5.060 4.092 1.00 0.00 H new ATOM 0 HA SER A 42 -4.403 -4.845 5.366 1.00 0.00 H new ATOM 0 HB2 SER A 42 -2.695 -6.317 6.490 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.668 -4.910 6.683 1.00 0.00 H new ATOM 0 HG SER A 42 -2.969 -5.312 8.563 1.00 0.00 H new ATOM 559 N LEU A 43 -4.126 -2.431 6.062 1.00 0.00 N ATOM 560 CA LEU A 43 -4.099 -0.983 6.180 1.00 0.00 C ATOM 561 C LEU A 43 -3.991 -0.598 7.656 1.00 0.00 C ATOM 562 O LEU A 43 -4.158 -1.441 8.536 1.00 0.00 O ATOM 563 CB LEU A 43 -5.306 -0.366 5.470 1.00 0.00 C ATOM 564 CG LEU A 43 -5.720 -1.027 4.154 1.00 0.00 C ATOM 565 CD1 LEU A 43 -6.579 -0.082 3.312 1.00 0.00 C ATOM 566 CD2 LEU A 43 -4.497 -1.529 3.383 1.00 0.00 C ATOM 0 H LEU A 43 -4.916 -2.882 6.523 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.221 -0.576 5.679 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.157 -0.394 6.151 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -5.089 0.684 5.274 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.333 -1.898 4.388 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.860 -0.577 2.382 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.478 0.184 3.867 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.012 0.821 3.086 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.820 -1.994 2.452 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.838 -0.690 3.160 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.961 -2.261 3.987 1.00 0.00 H new ATOM 578 N LYS A 44 -3.712 0.678 7.883 1.00 0.00 N ATOM 579 CA LYS A 44 -3.579 1.185 9.238 1.00 0.00 C ATOM 580 C LYS A 44 -4.477 2.413 9.408 1.00 0.00 C ATOM 581 O LYS A 44 -4.615 3.217 8.488 1.00 0.00 O ATOM 582 CB LYS A 44 -2.109 1.448 9.570 1.00 0.00 C ATOM 583 CG LYS A 44 -1.735 2.904 9.287 1.00 0.00 C ATOM 584 CD LYS A 44 -0.293 3.192 9.711 1.00 0.00 C ATOM 585 CE LYS A 44 0.455 3.964 8.622 1.00 0.00 C ATOM 586 NZ LYS A 44 1.914 3.751 8.745 1.00 0.00 N ATOM 0 H LYS A 44 -3.575 1.375 7.151 1.00 0.00 H new ATOM 0 HA LYS A 44 -3.916 0.440 9.959 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -1.923 1.218 10.619 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.475 0.785 8.981 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -1.854 3.114 8.224 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.414 3.568 9.821 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -0.290 3.767 10.637 1.00 0.00 H new ATOM 0 HD3 LYS A 44 0.223 2.254 9.917 1.00 0.00 H new ATOM 0 HE2 LYS A 44 0.116 3.638 7.639 1.00 0.00 H new ATOM 0 HE3 LYS A 44 0.229 5.027 8.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 2.416 4.623 8.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 2.147 3.503 9.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.206 2.978 8.114 1.00 0.00 H new ATOM 600 N GLY A 45 -5.064 2.517 10.592 1.00 0.00 N ATOM 601 CA GLY A 45 -5.944 3.633 10.894 1.00 0.00 C ATOM 602 C GLY A 45 -5.180 4.762 11.589 1.00 0.00 C ATOM 603 O GLY A 45 -4.351 4.509 12.462 1.00 0.00 O ATOM 0 H GLY A 45 -4.947 1.847 11.352 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.393 4.006 9.973 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -6.760 3.295 11.532 1.00 0.00 H new ATOM 607 N ASN A 46 -5.486 5.983 11.175 1.00 0.00 N ATOM 608 CA ASN A 46 -4.838 7.151 11.747 1.00 0.00 C ATOM 609 C ASN A 46 -5.904 8.103 12.295 1.00 0.00 C ATOM 610 O ASN A 46 -6.860 8.437 11.598 1.00 0.00 O ATOM 611 CB ASN A 46 -4.030 7.905 10.690 1.00 0.00 C ATOM 612 CG ASN A 46 -2.529 7.787 10.960 1.00 0.00 C ATOM 613 OD1 ASN A 46 -2.079 7.000 11.777 1.00 0.00 O ATOM 614 ND2 ASN A 46 -1.781 8.611 10.231 1.00 0.00 N ATOM 0 H ASN A 46 -6.174 6.189 10.450 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.169 6.812 12.538 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.258 7.507 9.701 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.321 8.955 10.686 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -0.767 8.609 10.338 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -2.222 9.245 9.565 1.00 0.00 H new ATOM 621 N LYS A 47 -5.703 8.511 13.539 1.00 0.00 N ATOM 622 CA LYS A 47 -6.635 9.418 14.189 1.00 0.00 C ATOM 623 C LYS A 47 -5.894 10.689 14.608 1.00 0.00 C ATOM 624 O LYS A 47 -4.710 10.642 14.939 1.00 0.00 O ATOM 625 CB LYS A 47 -7.350 8.714 15.343 1.00 0.00 C ATOM 626 CG LYS A 47 -8.728 9.331 15.593 1.00 0.00 C ATOM 627 CD LYS A 47 -9.139 9.180 17.059 1.00 0.00 C ATOM 628 CE LYS A 47 -10.111 10.287 17.472 1.00 0.00 C ATOM 629 NZ LYS A 47 -11.509 9.871 17.220 1.00 0.00 N ATOM 0 H LYS A 47 -4.909 8.231 14.115 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.420 9.720 13.495 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.458 7.654 15.115 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.746 8.786 16.248 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -8.712 10.387 15.323 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.467 8.850 14.953 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -9.605 8.206 17.211 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -8.254 9.213 17.694 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -9.979 10.519 18.529 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -9.891 11.198 16.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -12.145 10.679 17.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -11.602 9.543 16.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -11.764 9.099 17.868 1.00 0.00 H new ATOM 643 N SER A 48 -6.622 11.796 14.581 1.00 0.00 N ATOM 644 CA SER A 48 -6.049 13.078 14.955 1.00 0.00 C ATOM 645 C SER A 48 -6.671 13.567 16.264 1.00 0.00 C ATOM 646 O SER A 48 -7.886 13.503 16.441 1.00 0.00 O ATOM 647 CB SER A 48 -6.254 14.116 13.849 1.00 0.00 C ATOM 648 OG SER A 48 -5.040 14.412 13.164 1.00 0.00 O ATOM 0 H SER A 48 -7.604 11.832 14.306 1.00 0.00 H new ATOM 0 HA SER A 48 -4.977 12.945 15.097 1.00 0.00 H new ATOM 0 HB2 SER A 48 -6.991 13.746 13.137 1.00 0.00 H new ATOM 0 HB3 SER A 48 -6.659 15.031 14.281 1.00 0.00 H new ATOM 0 HG SER A 48 -5.213 15.077 12.465 1.00 0.00 H new ATOM 654 N ARG A 49 -5.808 14.046 17.149 1.00 0.00 N ATOM 655 CA ARG A 49 -6.257 14.546 18.437 1.00 0.00 C ATOM 656 C ARG A 49 -6.616 16.030 18.334 1.00 0.00 C ATOM 657 O ARG A 49 -7.580 16.484 18.948 1.00 0.00 O ATOM 658 CB ARG A 49 -5.179 14.362 19.506 1.00 0.00 C ATOM 659 CG ARG A 49 -5.800 14.262 20.901 1.00 0.00 C ATOM 660 CD ARG A 49 -5.083 15.184 21.888 1.00 0.00 C ATOM 661 NE ARG A 49 -4.268 14.383 22.829 1.00 0.00 N ATOM 662 CZ ARG A 49 -3.271 14.882 23.572 1.00 0.00 C ATOM 663 NH1 ARG A 49 -2.959 16.183 23.488 1.00 0.00 N ATOM 664 NH2 ARG A 49 -2.585 14.081 24.398 1.00 0.00 N ATOM 0 H ARG A 49 -4.800 14.098 16.999 1.00 0.00 H new ATOM 0 HA ARG A 49 -7.139 13.974 18.725 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.603 13.461 19.295 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -4.483 15.200 19.473 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -6.856 14.527 20.852 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.745 13.232 21.254 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -4.446 15.884 21.347 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -5.812 15.777 22.440 1.00 0.00 H new ATOM 0 HE ARG A 49 -4.479 13.389 22.917 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -3.481 16.793 22.858 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -2.200 16.563 24.054 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -2.822 13.091 24.461 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -1.826 14.461 24.963 1.00 0.00 H new ATOM 678 N GLU A 50 -5.819 16.746 17.554 1.00 0.00 N ATOM 679 CA GLU A 50 -6.040 18.170 17.363 1.00 0.00 C ATOM 680 C GLU A 50 -7.500 18.435 16.990 1.00 0.00 C ATOM 681 O GLU A 50 -8.226 19.088 17.738 1.00 0.00 O ATOM 682 CB GLU A 50 -5.092 18.734 16.303 1.00 0.00 C ATOM 683 CG GLU A 50 -4.415 20.014 16.799 1.00 0.00 C ATOM 684 CD GLU A 50 -5.357 21.214 16.681 1.00 0.00 C ATOM 685 OE1 GLU A 50 -6.369 21.215 17.416 1.00 0.00 O ATOM 686 OE2 GLU A 50 -5.044 22.102 15.860 1.00 0.00 O ATOM 0 H GLU A 50 -5.019 16.367 17.047 1.00 0.00 H new ATOM 0 HA GLU A 50 -5.827 18.681 18.302 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -4.335 17.990 16.055 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -5.646 18.942 15.388 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.109 19.889 17.837 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -3.510 20.199 16.220 1.00 0.00 H new ATOM 693 N THR A 51 -7.886 17.915 15.835 1.00 0.00 N ATOM 694 CA THR A 51 -9.246 18.087 15.354 1.00 0.00 C ATOM 695 C THR A 51 -10.202 17.168 16.116 1.00 0.00 C ATOM 696 O THR A 51 -11.299 17.580 16.492 1.00 0.00 O ATOM 697 CB THR A 51 -9.248 17.846 13.843 1.00 0.00 C ATOM 698 OG1 THR A 51 -8.741 16.522 13.702 1.00 0.00 O ATOM 699 CG2 THR A 51 -8.224 18.716 13.110 1.00 0.00 C ATOM 0 H THR A 51 -7.281 17.374 15.218 1.00 0.00 H new ATOM 0 HA THR A 51 -9.604 19.100 15.537 1.00 0.00 H new ATOM 0 HB THR A 51 -10.244 18.043 13.446 1.00 0.00 H new ATOM 0 HG1 THR A 51 -8.710 16.283 12.752 1.00 0.00 H new ATOM 0 HG21 THR A 51 -8.267 18.506 12.041 1.00 0.00 H new ATOM 0 HG22 THR A 51 -8.451 19.768 13.282 1.00 0.00 H new ATOM 0 HG23 THR A 51 -7.224 18.494 13.484 1.00 0.00 H new ATOM 707 N GLY A 52 -9.752 15.939 16.323 1.00 0.00 N ATOM 708 CA GLY A 52 -10.553 14.958 17.034 1.00 0.00 C ATOM 709 C GLY A 52 -11.479 14.207 16.075 1.00 0.00 C ATOM 710 O GLY A 52 -12.668 14.049 16.349 1.00 0.00 O ATOM 0 H GLY A 52 -8.842 15.600 16.010 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -9.899 14.250 17.543 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -11.145 15.455 17.803 1.00 0.00 H new ATOM 714 N THR A 53 -10.899 13.762 14.969 1.00 0.00 N ATOM 715 CA THR A 53 -11.656 13.032 13.968 1.00 0.00 C ATOM 716 C THR A 53 -10.794 11.933 13.343 1.00 0.00 C ATOM 717 O THR A 53 -9.576 11.920 13.518 1.00 0.00 O ATOM 718 CB THR A 53 -12.188 14.041 12.948 1.00 0.00 C ATOM 719 OG1 THR A 53 -12.998 14.922 13.722 1.00 0.00 O ATOM 720 CG2 THR A 53 -13.167 13.410 11.956 1.00 0.00 C ATOM 0 H THR A 53 -9.913 13.894 14.745 1.00 0.00 H new ATOM 0 HA THR A 53 -12.508 12.519 14.414 1.00 0.00 H new ATOM 0 HB THR A 53 -11.353 14.481 12.403 1.00 0.00 H new ATOM 0 HG1 THR A 53 -13.382 15.610 13.139 1.00 0.00 H new ATOM 0 HG21 THR A 53 -13.514 14.169 11.255 1.00 0.00 H new ATOM 0 HG22 THR A 53 -12.666 12.612 11.408 1.00 0.00 H new ATOM 0 HG23 THR A 53 -14.019 12.999 12.497 1.00 0.00 H new ATOM 728 N ASP A 54 -11.459 11.038 12.627 1.00 0.00 N ATOM 729 CA ASP A 54 -10.769 9.939 11.975 1.00 0.00 C ATOM 730 C ASP A 54 -10.348 10.368 10.568 1.00 0.00 C ATOM 731 O ASP A 54 -11.177 10.433 9.662 1.00 0.00 O ATOM 732 CB ASP A 54 -11.680 8.717 11.844 1.00 0.00 C ATOM 733 CG ASP A 54 -12.494 8.379 13.095 1.00 0.00 C ATOM 734 OD1 ASP A 54 -12.085 8.846 14.180 1.00 0.00 O ATOM 735 OD2 ASP A 54 -13.506 7.663 12.937 1.00 0.00 O ATOM 0 H ASP A 54 -12.469 11.052 12.484 1.00 0.00 H new ATOM 0 HA ASP A 54 -9.902 9.679 12.582 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -12.368 8.883 11.015 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -11.069 7.853 11.583 1.00 0.00 H new ATOM 740 N LEU A 55 -9.061 10.652 10.431 1.00 0.00 N ATOM 741 CA LEU A 55 -8.521 11.073 9.150 1.00 0.00 C ATOM 742 C LEU A 55 -9.007 10.119 8.057 1.00 0.00 C ATOM 743 O LEU A 55 -9.441 10.558 6.993 1.00 0.00 O ATOM 744 CB LEU A 55 -6.998 11.197 9.225 1.00 0.00 C ATOM 745 CG LEU A 55 -6.455 12.186 10.258 1.00 0.00 C ATOM 746 CD1 LEU A 55 -4.953 11.988 10.471 1.00 0.00 C ATOM 747 CD2 LEU A 55 -6.794 13.626 9.870 1.00 0.00 C ATOM 0 H LEU A 55 -8.377 10.599 11.186 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.886 12.067 8.891 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.584 10.212 9.441 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.628 11.489 8.242 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.944 11.986 11.211 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -4.593 12.704 11.210 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -4.766 10.975 10.826 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.428 12.144 9.529 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.396 14.308 10.621 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.351 13.855 8.901 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.876 13.742 9.811 1.00 0.00 H new ATOM 759 N GLY A 56 -8.919 8.832 8.357 1.00 0.00 N ATOM 760 CA GLY A 56 -9.345 7.812 7.414 1.00 0.00 C ATOM 761 C GLY A 56 -8.503 6.543 7.561 1.00 0.00 C ATOM 762 O GLY A 56 -8.173 6.138 8.675 1.00 0.00 O ATOM 0 H GLY A 56 -8.559 8.472 9.241 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -10.396 7.576 7.578 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -9.259 8.194 6.397 1.00 0.00 H new ATOM 766 N ILE A 57 -8.179 5.951 6.421 1.00 0.00 N ATOM 767 CA ILE A 57 -7.382 4.736 6.409 1.00 0.00 C ATOM 768 C ILE A 57 -6.099 4.981 5.612 1.00 0.00 C ATOM 769 O ILE A 57 -6.100 5.744 4.647 1.00 0.00 O ATOM 770 CB ILE A 57 -8.210 3.557 5.895 1.00 0.00 C ATOM 771 CG1 ILE A 57 -9.560 3.482 6.610 1.00 0.00 C ATOM 772 CG2 ILE A 57 -7.427 2.247 6.008 1.00 0.00 C ATOM 773 CD1 ILE A 57 -9.383 3.070 8.073 1.00 0.00 C ATOM 0 H ILE A 57 -8.454 6.290 5.499 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.082 4.467 7.422 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.415 3.719 4.837 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -10.057 4.451 6.559 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -10.205 2.765 6.102 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -8.038 1.425 5.636 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -6.514 2.317 5.417 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.171 2.065 7.052 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -10.358 3.024 8.559 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.908 2.090 8.120 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -8.757 3.802 8.584 1.00 0.00 H new ATOM 785 N PHE A 58 -5.036 4.320 6.044 1.00 0.00 N ATOM 786 CA PHE A 58 -3.749 4.456 5.383 1.00 0.00 C ATOM 787 C PHE A 58 -3.060 3.097 5.239 1.00 0.00 C ATOM 788 O PHE A 58 -2.853 2.394 6.227 1.00 0.00 O ATOM 789 CB PHE A 58 -2.886 5.361 6.265 1.00 0.00 C ATOM 790 CG PHE A 58 -3.424 6.786 6.408 1.00 0.00 C ATOM 791 CD1 PHE A 58 -4.542 7.020 7.147 1.00 0.00 C ATOM 792 CD2 PHE A 58 -2.784 7.819 5.797 1.00 0.00 C ATOM 793 CE1 PHE A 58 -5.040 8.343 7.280 1.00 0.00 C ATOM 794 CE2 PHE A 58 -3.283 9.141 5.929 1.00 0.00 C ATOM 795 CZ PHE A 58 -4.401 9.376 6.668 1.00 0.00 C ATOM 0 H PHE A 58 -5.039 3.688 6.845 1.00 0.00 H new ATOM 0 HA PHE A 58 -3.886 4.872 4.385 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.803 4.914 7.256 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.879 5.404 5.849 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -5.050 6.200 7.632 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.896 7.633 5.211 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.927 8.529 7.868 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.775 9.961 5.443 1.00 0.00 H new ATOM 0 HZ PHE A 58 -4.781 10.382 6.769 1.00 0.00 H new ATOM 805 N ILE A 59 -2.724 2.768 4.000 1.00 0.00 N ATOM 806 CA ILE A 59 -2.063 1.507 3.714 1.00 0.00 C ATOM 807 C ILE A 59 -1.016 1.228 4.794 1.00 0.00 C ATOM 808 O ILE A 59 -0.388 2.152 5.307 1.00 0.00 O ATOM 809 CB ILE A 59 -1.496 1.510 2.293 1.00 0.00 C ATOM 810 CG1 ILE A 59 -2.595 1.781 1.264 1.00 0.00 C ATOM 811 CG2 ILE A 59 -0.745 0.209 2.000 1.00 0.00 C ATOM 812 CD1 ILE A 59 -2.097 1.505 -0.156 1.00 0.00 C ATOM 0 H ILE A 59 -2.898 3.353 3.183 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.779 0.686 3.745 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.775 2.324 2.215 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -3.461 1.154 1.478 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -2.924 2.817 1.343 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.352 0.237 0.984 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.079 0.098 2.705 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -1.426 -0.635 2.103 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -2.898 1.706 -0.868 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.247 2.151 -0.375 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.791 0.462 -0.238 1.00 0.00 H new ATOM 824 N LYS A 60 -0.861 -0.050 5.107 1.00 0.00 N ATOM 825 CA LYS A 60 0.099 -0.462 6.116 1.00 0.00 C ATOM 826 C LYS A 60 1.368 -0.973 5.430 1.00 0.00 C ATOM 827 O LYS A 60 2.468 -0.511 5.728 1.00 0.00 O ATOM 828 CB LYS A 60 -0.531 -1.474 7.074 1.00 0.00 C ATOM 829 CG LYS A 60 0.450 -1.868 8.180 1.00 0.00 C ATOM 830 CD LYS A 60 0.334 -3.357 8.512 1.00 0.00 C ATOM 831 CE LYS A 60 -0.165 -3.563 9.943 1.00 0.00 C ATOM 832 NZ LYS A 60 0.975 -3.777 10.863 1.00 0.00 N ATOM 0 H LYS A 60 -1.384 -0.814 4.679 1.00 0.00 H new ATOM 0 HA LYS A 60 0.390 0.388 6.733 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.432 -1.049 7.517 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.836 -2.362 6.521 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.468 -1.640 7.865 1.00 0.00 H new ATOM 0 HG3 LYS A 60 0.253 -1.276 9.074 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -0.350 -3.837 7.812 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.305 -3.837 8.389 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -0.740 -2.694 10.263 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -0.836 -4.421 9.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 0.619 -3.915 11.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 1.507 -4.620 10.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.601 -2.947 10.840 1.00 0.00 H new ATOM 846 N SER A 61 1.171 -1.919 4.523 1.00 0.00 N ATOM 847 CA SER A 61 2.285 -2.498 3.792 1.00 0.00 C ATOM 848 C SER A 61 1.765 -3.457 2.720 1.00 0.00 C ATOM 849 O SER A 61 0.647 -3.960 2.821 1.00 0.00 O ATOM 850 CB SER A 61 3.245 -3.225 4.735 1.00 0.00 C ATOM 851 OG SER A 61 2.671 -4.418 5.265 1.00 0.00 O ATOM 0 H SER A 61 0.257 -2.299 4.278 1.00 0.00 H new ATOM 0 HA SER A 61 2.835 -1.690 3.311 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.162 -3.471 4.200 1.00 0.00 H new ATOM 0 HB3 SER A 61 3.522 -2.561 5.554 1.00 0.00 H new ATOM 0 HG SER A 61 3.315 -4.854 5.861 1.00 0.00 H new ATOM 857 N ILE A 62 2.602 -3.683 1.717 1.00 0.00 N ATOM 858 CA ILE A 62 2.240 -4.574 0.627 1.00 0.00 C ATOM 859 C ILE A 62 2.984 -5.901 0.791 1.00 0.00 C ATOM 860 O ILE A 62 4.205 -5.918 0.938 1.00 0.00 O ATOM 861 CB ILE A 62 2.483 -3.895 -0.722 1.00 0.00 C ATOM 862 CG1 ILE A 62 1.878 -2.490 -0.746 1.00 0.00 C ATOM 863 CG2 ILE A 62 1.967 -4.762 -1.873 1.00 0.00 C ATOM 864 CD1 ILE A 62 2.972 -1.421 -0.754 1.00 0.00 C ATOM 0 H ILE A 62 3.529 -3.265 1.636 1.00 0.00 H new ATOM 0 HA ILE A 62 1.174 -4.800 0.657 1.00 0.00 H new ATOM 0 HB ILE A 62 3.559 -3.784 -0.860 1.00 0.00 H new ATOM 0 HG12 ILE A 62 1.248 -2.377 -1.628 1.00 0.00 H new ATOM 0 HG13 ILE A 62 1.236 -2.352 0.124 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.152 -4.256 -2.821 1.00 0.00 H new ATOM 0 HG22 ILE A 62 2.485 -5.721 -1.866 1.00 0.00 H new ATOM 0 HG23 ILE A 62 0.896 -4.927 -1.753 1.00 0.00 H new ATOM 0 HD11 ILE A 62 2.514 -0.432 -0.771 1.00 0.00 H new ATOM 0 HD12 ILE A 62 3.585 -1.521 0.141 1.00 0.00 H new ATOM 0 HD13 ILE A 62 3.597 -1.547 -1.638 1.00 0.00 H new ATOM 876 N ILE A 63 2.217 -6.980 0.760 1.00 0.00 N ATOM 877 CA ILE A 63 2.787 -8.309 0.903 1.00 0.00 C ATOM 878 C ILE A 63 3.226 -8.822 -0.470 1.00 0.00 C ATOM 879 O ILE A 63 2.391 -9.067 -1.340 1.00 0.00 O ATOM 880 CB ILE A 63 1.808 -9.238 1.623 1.00 0.00 C ATOM 881 CG1 ILE A 63 1.582 -8.784 3.067 1.00 0.00 C ATOM 882 CG2 ILE A 63 2.276 -10.693 1.546 1.00 0.00 C ATOM 883 CD1 ILE A 63 0.573 -7.636 3.129 1.00 0.00 C ATOM 0 H ILE A 63 1.205 -6.961 0.638 1.00 0.00 H new ATOM 0 HA ILE A 63 3.678 -8.276 1.530 1.00 0.00 H new ATOM 0 HB ILE A 63 0.846 -9.182 1.114 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.222 -9.622 3.663 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.528 -8.465 3.504 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.563 -11.333 2.065 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.344 -10.999 0.502 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.255 -10.786 2.016 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.431 -7.332 4.166 1.00 0.00 H new ATOM 0 HD12 ILE A 63 0.948 -6.791 2.552 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.379 -7.966 2.713 1.00 0.00 H new ATOM 895 N HIS A 64 4.534 -8.968 -0.622 1.00 0.00 N ATOM 896 CA HIS A 64 5.093 -9.447 -1.875 1.00 0.00 C ATOM 897 C HIS A 64 4.638 -10.886 -2.122 1.00 0.00 C ATOM 898 O HIS A 64 4.115 -11.540 -1.221 1.00 0.00 O ATOM 899 CB HIS A 64 6.615 -9.296 -1.883 1.00 0.00 C ATOM 900 CG HIS A 64 7.091 -7.876 -2.074 1.00 0.00 C ATOM 901 ND1 HIS A 64 8.270 -7.561 -2.726 1.00 0.00 N ATOM 902 CD2 HIS A 64 6.534 -6.691 -1.692 1.00 0.00 C ATOM 903 CE1 HIS A 64 8.407 -6.244 -2.731 1.00 0.00 C ATOM 904 NE2 HIS A 64 7.331 -5.706 -2.089 1.00 0.00 N ATOM 0 H HIS A 64 5.223 -8.763 0.102 1.00 0.00 H new ATOM 0 HA HIS A 64 4.722 -8.839 -2.700 1.00 0.00 H new ATOM 0 HB2 HIS A 64 7.013 -9.678 -0.943 1.00 0.00 H new ATOM 0 HB3 HIS A 64 7.027 -9.916 -2.679 1.00 0.00 H new ATOM 0 HD2 HIS A 64 5.603 -6.574 -1.157 1.00 0.00 H new ATOM 0 HE1 HIS A 64 9.227 -5.693 -3.167 1.00 0.00 H new ATOM 0 HE2 HIS A 64 7.166 -4.711 -1.939 1.00 0.00 H new ATOM 912 N GLY A 65 4.853 -11.338 -3.349 1.00 0.00 N ATOM 913 CA GLY A 65 4.472 -12.688 -3.727 1.00 0.00 C ATOM 914 C GLY A 65 2.950 -12.836 -3.771 1.00 0.00 C ATOM 915 O GLY A 65 2.426 -13.943 -3.650 1.00 0.00 O ATOM 0 H GLY A 65 5.286 -10.793 -4.094 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.893 -12.929 -4.703 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.890 -13.400 -3.016 1.00 0.00 H new ATOM 919 N GLY A 66 2.282 -11.705 -3.944 1.00 0.00 N ATOM 920 CA GLY A 66 0.830 -11.695 -4.006 1.00 0.00 C ATOM 921 C GLY A 66 0.339 -10.910 -5.224 1.00 0.00 C ATOM 922 O GLY A 66 1.112 -10.624 -6.136 1.00 0.00 O ATOM 0 H GLY A 66 2.719 -10.789 -4.043 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.457 -12.718 -4.054 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.427 -11.251 -3.096 1.00 0.00 H new ATOM 926 N ALA A 67 -0.945 -10.584 -5.199 1.00 0.00 N ATOM 927 CA ALA A 67 -1.550 -9.838 -6.290 1.00 0.00 C ATOM 928 C ALA A 67 -1.276 -8.346 -6.094 1.00 0.00 C ATOM 929 O ALA A 67 -1.048 -7.621 -7.061 1.00 0.00 O ATOM 930 CB ALA A 67 -3.045 -10.153 -6.357 1.00 0.00 C ATOM 0 H ALA A 67 -1.583 -10.823 -4.440 1.00 0.00 H new ATOM 0 HA ALA A 67 -1.113 -10.131 -7.245 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -3.498 -9.593 -7.175 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -3.185 -11.221 -6.526 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.519 -9.870 -5.417 1.00 0.00 H new ATOM 936 N ALA A 68 -1.308 -7.931 -4.836 1.00 0.00 N ATOM 937 CA ALA A 68 -1.066 -6.538 -4.501 1.00 0.00 C ATOM 938 C ALA A 68 0.387 -6.184 -4.827 1.00 0.00 C ATOM 939 O ALA A 68 0.674 -5.072 -5.268 1.00 0.00 O ATOM 940 CB ALA A 68 -1.407 -6.300 -3.028 1.00 0.00 C ATOM 0 H ALA A 68 -1.498 -8.535 -4.036 1.00 0.00 H new ATOM 0 HA ALA A 68 -1.706 -5.884 -5.094 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.225 -5.255 -2.777 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.456 -6.538 -2.854 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -0.782 -6.937 -2.402 1.00 0.00 H new ATOM 946 N PHE A 69 1.264 -7.150 -4.598 1.00 0.00 N ATOM 947 CA PHE A 69 2.679 -6.955 -4.863 1.00 0.00 C ATOM 948 C PHE A 69 2.891 -6.165 -6.156 1.00 0.00 C ATOM 949 O PHE A 69 3.760 -5.297 -6.222 1.00 0.00 O ATOM 950 CB PHE A 69 3.301 -8.344 -5.020 1.00 0.00 C ATOM 951 CG PHE A 69 4.741 -8.326 -5.537 1.00 0.00 C ATOM 952 CD1 PHE A 69 5.670 -7.537 -4.933 1.00 0.00 C ATOM 953 CD2 PHE A 69 5.092 -9.099 -6.599 1.00 0.00 C ATOM 954 CE1 PHE A 69 7.006 -7.521 -5.412 1.00 0.00 C ATOM 955 CE2 PHE A 69 6.428 -9.082 -7.078 1.00 0.00 C ATOM 956 CZ PHE A 69 7.357 -8.294 -6.475 1.00 0.00 C ATOM 0 H PHE A 69 1.022 -8.071 -4.232 1.00 0.00 H new ATOM 0 HA PHE A 69 3.136 -6.395 -4.047 1.00 0.00 H new ATOM 0 HB2 PHE A 69 3.278 -8.852 -4.056 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.688 -8.930 -5.704 1.00 0.00 H new ATOM 0 HD1 PHE A 69 5.391 -6.923 -4.089 1.00 0.00 H new ATOM 0 HD2 PHE A 69 4.354 -9.726 -7.078 1.00 0.00 H new ATOM 0 HE1 PHE A 69 7.744 -6.895 -4.933 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.707 -9.696 -7.922 1.00 0.00 H new ATOM 0 HZ PHE A 69 8.373 -8.282 -6.840 1.00 0.00 H new ATOM 966 N LYS A 70 2.082 -6.493 -7.152 1.00 0.00 N ATOM 967 CA LYS A 70 2.170 -5.825 -8.439 1.00 0.00 C ATOM 968 C LYS A 70 2.080 -4.312 -8.231 1.00 0.00 C ATOM 969 O LYS A 70 2.875 -3.557 -8.789 1.00 0.00 O ATOM 970 CB LYS A 70 1.117 -6.377 -9.402 1.00 0.00 C ATOM 971 CG LYS A 70 1.286 -7.885 -9.594 1.00 0.00 C ATOM 972 CD LYS A 70 0.202 -8.445 -10.518 1.00 0.00 C ATOM 973 CE LYS A 70 0.797 -8.883 -11.858 1.00 0.00 C ATOM 974 NZ LYS A 70 -0.272 -9.055 -12.868 1.00 0.00 N ATOM 0 H LYS A 70 1.362 -7.213 -7.094 1.00 0.00 H new ATOM 0 HA LYS A 70 3.134 -6.026 -8.907 1.00 0.00 H new ATOM 0 HB2 LYS A 70 0.120 -6.166 -9.016 1.00 0.00 H new ATOM 0 HB3 LYS A 70 1.200 -5.873 -10.365 1.00 0.00 H new ATOM 0 HG2 LYS A 70 2.270 -8.094 -10.014 1.00 0.00 H new ATOM 0 HG3 LYS A 70 1.239 -8.386 -8.627 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.287 -9.293 -10.039 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -0.564 -7.688 -10.686 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.516 -8.140 -12.204 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.341 -9.819 -11.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 0.149 -9.352 -13.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.943 -9.780 -12.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -0.773 -8.153 -13.000 1.00 0.00 H new ATOM 988 N ASP A 71 1.106 -3.914 -7.426 1.00 0.00 N ATOM 989 CA ASP A 71 0.902 -2.505 -7.137 1.00 0.00 C ATOM 990 C ASP A 71 1.748 -2.110 -5.924 1.00 0.00 C ATOM 991 O ASP A 71 1.922 -0.925 -5.644 1.00 0.00 O ATOM 992 CB ASP A 71 -0.563 -2.217 -6.806 1.00 0.00 C ATOM 993 CG ASP A 71 -0.990 -0.758 -6.978 1.00 0.00 C ATOM 994 OD1 ASP A 71 -0.427 -0.104 -7.883 1.00 0.00 O ATOM 995 OD2 ASP A 71 -1.870 -0.328 -6.201 1.00 0.00 O ATOM 0 H ASP A 71 0.449 -4.543 -6.965 1.00 0.00 H new ATOM 0 HA ASP A 71 1.191 -1.934 -8.020 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.193 -2.841 -7.440 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.753 -2.516 -5.775 1.00 0.00 H new ATOM 1000 N GLY A 72 2.250 -3.126 -5.237 1.00 0.00 N ATOM 1001 CA GLY A 72 3.073 -2.899 -4.061 1.00 0.00 C ATOM 1002 C GLY A 72 4.029 -1.725 -4.278 1.00 0.00 C ATOM 1003 O GLY A 72 4.432 -1.063 -3.323 1.00 0.00 O ATOM 0 H GLY A 72 2.103 -4.108 -5.472 1.00 0.00 H new ATOM 0 HA2 GLY A 72 2.435 -2.699 -3.200 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.643 -3.799 -3.833 1.00 0.00 H new ATOM 1007 N ARG A 73 4.363 -1.501 -5.541 1.00 0.00 N ATOM 1008 CA ARG A 73 5.264 -0.418 -5.895 1.00 0.00 C ATOM 1009 C ARG A 73 4.969 0.819 -5.043 1.00 0.00 C ATOM 1010 O ARG A 73 5.861 1.625 -4.783 1.00 0.00 O ATOM 1011 CB ARG A 73 5.131 -0.052 -7.375 1.00 0.00 C ATOM 1012 CG ARG A 73 3.697 0.364 -7.710 1.00 0.00 C ATOM 1013 CD ARG A 73 3.678 1.666 -8.513 1.00 0.00 C ATOM 1014 NE ARG A 73 3.672 1.367 -9.962 1.00 0.00 N ATOM 1015 CZ ARG A 73 3.367 2.261 -10.913 1.00 0.00 C ATOM 1016 NH1 ARG A 73 3.042 3.516 -10.573 1.00 0.00 N ATOM 1017 NH2 ARG A 73 3.388 1.901 -12.203 1.00 0.00 N ATOM 0 H ARG A 73 4.026 -2.051 -6.331 1.00 0.00 H new ATOM 0 HA ARG A 73 6.282 -0.759 -5.706 1.00 0.00 H new ATOM 0 HB2 ARG A 73 5.815 0.762 -7.615 1.00 0.00 H new ATOM 0 HB3 ARG A 73 5.420 -0.903 -7.991 1.00 0.00 H new ATOM 0 HG2 ARG A 73 3.209 -0.426 -8.280 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.127 0.492 -6.790 1.00 0.00 H new ATOM 0 HD2 ARG A 73 2.797 2.252 -8.251 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.549 2.271 -8.262 1.00 0.00 H new ATOM 0 HE ARG A 73 3.915 0.421 -10.256 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.027 3.791 -9.591 1.00 0.00 H new ATOM 0 HH12 ARG A 73 2.810 4.197 -11.296 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.636 0.946 -12.462 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.156 2.582 -12.926 1.00 0.00 H new ATOM 1031 N LEU A 74 3.714 0.929 -4.633 1.00 0.00 N ATOM 1032 CA LEU A 74 3.291 2.053 -3.816 1.00 0.00 C ATOM 1033 C LEU A 74 4.028 2.011 -2.476 1.00 0.00 C ATOM 1034 O LEU A 74 4.893 1.162 -2.266 1.00 0.00 O ATOM 1035 CB LEU A 74 1.767 2.072 -3.679 1.00 0.00 C ATOM 1036 CG LEU A 74 0.994 2.651 -4.865 1.00 0.00 C ATOM 1037 CD1 LEU A 74 -0.515 2.493 -4.666 1.00 0.00 C ATOM 1038 CD2 LEU A 74 1.389 4.106 -5.120 1.00 0.00 C ATOM 0 H LEU A 74 2.977 0.259 -4.851 1.00 0.00 H new ATOM 0 HA LEU A 74 3.557 2.994 -4.297 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.424 1.051 -3.511 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.509 2.645 -2.788 1.00 0.00 H new ATOM 0 HG LEU A 74 1.262 2.084 -5.756 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.041 2.913 -5.523 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.761 1.435 -4.572 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.820 3.018 -3.761 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.825 4.493 -5.968 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.169 4.703 -4.235 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.455 4.161 -5.339 1.00 0.00 H new ATOM 1050 N ARG A 75 3.659 2.938 -1.604 1.00 0.00 N ATOM 1051 CA ARG A 75 4.275 3.017 -0.290 1.00 0.00 C ATOM 1052 C ARG A 75 3.201 3.135 0.793 1.00 0.00 C ATOM 1053 O ARG A 75 2.286 3.949 0.679 1.00 0.00 O ATOM 1054 CB ARG A 75 5.218 4.218 -0.196 1.00 0.00 C ATOM 1055 CG ARG A 75 6.215 4.224 -1.357 1.00 0.00 C ATOM 1056 CD ARG A 75 7.396 3.294 -1.071 1.00 0.00 C ATOM 1057 NE ARG A 75 8.658 4.066 -1.065 1.00 0.00 N ATOM 1058 CZ ARG A 75 9.842 3.567 -0.684 1.00 0.00 C ATOM 1059 NH1 ARG A 75 9.932 2.294 -0.276 1.00 0.00 N ATOM 1060 NH2 ARG A 75 10.935 4.341 -0.711 1.00 0.00 N ATOM 0 H ARG A 75 2.941 3.641 -1.782 1.00 0.00 H new ATOM 0 HA ARG A 75 4.851 2.104 -0.138 1.00 0.00 H new ATOM 0 HB2 ARG A 75 4.639 5.141 -0.204 1.00 0.00 H new ATOM 0 HB3 ARG A 75 5.757 4.189 0.751 1.00 0.00 H new ATOM 0 HG2 ARG A 75 5.714 3.910 -2.273 1.00 0.00 H new ATOM 0 HG3 ARG A 75 6.578 5.238 -1.524 1.00 0.00 H new ATOM 0 HD2 ARG A 75 7.257 2.801 -0.109 1.00 0.00 H new ATOM 0 HD3 ARG A 75 7.443 2.510 -1.827 1.00 0.00 H new ATOM 0 HE ARG A 75 8.625 5.039 -1.370 1.00 0.00 H new ATOM 0 HH11 ARG A 75 9.100 1.705 -0.255 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.833 1.914 0.014 1.00 0.00 H new ATOM 0 HH21 ARG A 75 10.866 5.310 -1.022 1.00 0.00 H new ATOM 0 HH22 ARG A 75 11.836 3.961 -0.421 1.00 0.00 H new ATOM 1074 N MET A 76 3.347 2.310 1.819 1.00 0.00 N ATOM 1075 CA MET A 76 2.401 2.311 2.922 1.00 0.00 C ATOM 1076 C MET A 76 2.086 3.739 3.372 1.00 0.00 C ATOM 1077 O MET A 76 2.713 4.692 2.912 1.00 0.00 O ATOM 1078 CB MET A 76 2.985 1.523 4.096 1.00 0.00 C ATOM 1079 CG MET A 76 4.336 2.099 4.526 1.00 0.00 C ATOM 1080 SD MET A 76 5.531 0.785 4.702 1.00 0.00 S ATOM 1081 CE MET A 76 6.977 1.737 5.138 1.00 0.00 C ATOM 0 H MET A 76 4.107 1.636 1.910 1.00 0.00 H new ATOM 0 HA MET A 76 1.476 1.844 2.584 1.00 0.00 H new ATOM 0 HB2 MET A 76 2.291 1.548 4.936 1.00 0.00 H new ATOM 0 HB3 MET A 76 3.105 0.477 3.813 1.00 0.00 H new ATOM 0 HG2 MET A 76 4.684 2.822 3.788 1.00 0.00 H new ATOM 0 HG3 MET A 76 4.229 2.633 5.470 1.00 0.00 H new ATOM 0 HE1 MET A 76 7.823 1.066 5.285 1.00 0.00 H new ATOM 0 HE2 MET A 76 7.206 2.439 4.336 1.00 0.00 H new ATOM 0 HE3 MET A 76 6.786 2.288 6.059 1.00 0.00 H new ATOM 1091 N ASN A 77 1.113 3.842 4.265 1.00 0.00 N ATOM 1092 CA ASN A 77 0.706 5.138 4.782 1.00 0.00 C ATOM 1093 C ASN A 77 0.011 5.930 3.672 1.00 0.00 C ATOM 1094 O ASN A 77 -0.023 7.159 3.710 1.00 0.00 O ATOM 1095 CB ASN A 77 1.916 5.947 5.254 1.00 0.00 C ATOM 1096 CG ASN A 77 1.889 6.139 6.771 1.00 0.00 C ATOM 1097 OD1 ASN A 77 2.976 5.692 7.393 1.00 0.00 O flip ATOM 1098 ND2 ASN A 77 0.943 6.660 7.341 1.00 0.00 N flip ATOM 0 H ASN A 77 0.594 3.050 4.644 1.00 0.00 H new ATOM 0 HA ASN A 77 0.034 4.970 5.624 1.00 0.00 H new ATOM 0 HB2 ASN A 77 2.835 5.436 4.965 1.00 0.00 H new ATOM 0 HB3 ASN A 77 1.923 6.919 4.761 1.00 0.00 H new ATOM 0 HD21 ASN A 77 0.138 6.982 6.804 1.00 0.00 H new ATOM 0 HD22 ASN A 77 0.958 6.773 8.355 1.00 0.00 H new ATOM 1105 N ASP A 78 -0.526 5.193 2.711 1.00 0.00 N ATOM 1106 CA ASP A 78 -1.218 5.811 1.593 1.00 0.00 C ATOM 1107 C ASP A 78 -2.697 5.982 1.945 1.00 0.00 C ATOM 1108 O ASP A 78 -3.462 5.019 1.913 1.00 0.00 O ATOM 1109 CB ASP A 78 -1.128 4.938 0.339 1.00 0.00 C ATOM 1110 CG ASP A 78 0.113 5.171 -0.524 1.00 0.00 C ATOM 1111 OD1 ASP A 78 1.001 5.914 -0.052 1.00 0.00 O ATOM 1112 OD2 ASP A 78 0.147 4.601 -1.636 1.00 0.00 O ATOM 0 H ASP A 78 -0.496 4.174 2.683 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.748 6.774 1.396 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -1.150 3.891 0.641 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.014 5.113 -0.271 1.00 0.00 H new ATOM 1117 N GLN A 79 -3.056 7.214 2.274 1.00 0.00 N ATOM 1118 CA GLN A 79 -4.429 7.523 2.632 1.00 0.00 C ATOM 1119 C GLN A 79 -5.383 7.059 1.529 1.00 0.00 C ATOM 1120 O GLN A 79 -5.126 7.283 0.347 1.00 0.00 O ATOM 1121 CB GLN A 79 -4.600 9.018 2.912 1.00 0.00 C ATOM 1122 CG GLN A 79 -5.970 9.307 3.529 1.00 0.00 C ATOM 1123 CD GLN A 79 -6.057 10.756 4.015 1.00 0.00 C ATOM 1124 OE1 GLN A 79 -5.403 11.650 3.503 1.00 0.00 O ATOM 1125 NE2 GLN A 79 -6.899 10.936 5.028 1.00 0.00 N ATOM 0 H GLN A 79 -2.419 8.010 2.300 1.00 0.00 H new ATOM 0 HA GLN A 79 -4.675 6.985 3.548 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -3.814 9.357 3.587 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -4.489 9.580 1.985 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.752 9.119 2.793 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -6.148 8.628 4.363 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -7.415 10.143 5.409 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -7.029 11.867 5.424 1.00 0.00 H new ATOM 1134 N LEU A 80 -6.464 6.422 1.955 1.00 0.00 N ATOM 1135 CA LEU A 80 -7.457 5.925 1.018 1.00 0.00 C ATOM 1136 C LEU A 80 -8.611 6.925 0.926 1.00 0.00 C ATOM 1137 O LEU A 80 -9.485 6.952 1.791 1.00 0.00 O ATOM 1138 CB LEU A 80 -7.898 4.512 1.404 1.00 0.00 C ATOM 1139 CG LEU A 80 -6.835 3.419 1.275 1.00 0.00 C ATOM 1140 CD1 LEU A 80 -5.885 3.433 2.474 1.00 0.00 C ATOM 1141 CD2 LEU A 80 -7.481 2.047 1.071 1.00 0.00 C ATOM 0 H LEU A 80 -6.674 6.239 2.936 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.029 5.839 0.019 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.248 4.531 2.436 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.751 4.237 0.784 1.00 0.00 H new ATOM 0 HG LEU A 80 -6.237 3.628 0.388 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.140 2.646 2.357 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.386 4.400 2.531 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.452 3.262 3.389 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.703 1.288 0.982 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -8.119 1.815 1.924 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.081 2.059 0.161 1.00 0.00 H new ATOM 1153 N ILE A 81 -8.576 7.724 -0.131 1.00 0.00 N ATOM 1154 CA ILE A 81 -9.608 8.724 -0.347 1.00 0.00 C ATOM 1155 C ILE A 81 -10.774 8.091 -1.109 1.00 0.00 C ATOM 1156 O ILE A 81 -11.699 8.786 -1.526 1.00 0.00 O ATOM 1157 CB ILE A 81 -9.022 9.959 -1.035 1.00 0.00 C ATOM 1158 CG1 ILE A 81 -8.269 9.571 -2.309 1.00 0.00 C ATOM 1159 CG2 ILE A 81 -8.145 10.759 -0.071 1.00 0.00 C ATOM 1160 CD1 ILE A 81 -8.113 10.774 -3.241 1.00 0.00 C ATOM 0 H ILE A 81 -7.850 7.699 -0.847 1.00 0.00 H new ATOM 0 HA ILE A 81 -10.003 9.076 0.606 1.00 0.00 H new ATOM 0 HB ILE A 81 -9.846 10.607 -1.333 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.286 9.178 -2.049 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -8.805 8.774 -2.824 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.741 11.631 -0.585 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -8.743 11.084 0.780 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -7.325 10.133 0.280 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -7.574 10.471 -4.139 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -9.098 11.150 -3.518 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -7.555 11.559 -2.731 1.00 0.00 H new ATOM 1172 N ALA A 82 -10.692 6.778 -1.268 1.00 0.00 N ATOM 1173 CA ALA A 82 -11.729 6.043 -1.972 1.00 0.00 C ATOM 1174 C ALA A 82 -11.195 4.662 -2.359 1.00 0.00 C ATOM 1175 O ALA A 82 -10.025 4.358 -2.131 1.00 0.00 O ATOM 1176 CB ALA A 82 -12.192 6.850 -3.186 1.00 0.00 C ATOM 0 H ALA A 82 -9.923 6.204 -0.921 1.00 0.00 H new ATOM 0 HA ALA A 82 -12.597 5.893 -1.330 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -12.970 6.299 -3.714 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.588 7.810 -2.855 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -11.348 7.017 -3.855 1.00 0.00 H new ATOM 1182 N VAL A 83 -12.079 3.863 -2.939 1.00 0.00 N ATOM 1183 CA VAL A 83 -11.712 2.522 -3.360 1.00 0.00 C ATOM 1184 C VAL A 83 -12.838 1.933 -4.212 1.00 0.00 C ATOM 1185 O VAL A 83 -13.952 1.741 -3.728 1.00 0.00 O ATOM 1186 CB VAL A 83 -11.375 1.663 -2.139 1.00 0.00 C ATOM 1187 CG1 VAL A 83 -12.447 1.806 -1.056 1.00 0.00 C ATOM 1188 CG2 VAL A 83 -11.186 0.198 -2.534 1.00 0.00 C ATOM 0 H VAL A 83 -13.048 4.119 -3.127 1.00 0.00 H new ATOM 0 HA VAL A 83 -10.815 2.549 -3.979 1.00 0.00 H new ATOM 0 HB VAL A 83 -10.432 2.022 -1.727 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -12.184 1.186 -0.199 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -12.511 2.848 -0.743 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -13.410 1.486 -1.453 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -10.947 -0.390 -1.648 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -12.105 -0.179 -2.983 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -10.371 0.117 -3.253 1.00 0.00 H new ATOM 1198 N ASN A 84 -12.508 1.663 -5.467 1.00 0.00 N ATOM 1199 CA ASN A 84 -13.478 1.100 -6.390 1.00 0.00 C ATOM 1200 C ASN A 84 -14.553 2.145 -6.694 1.00 0.00 C ATOM 1201 O ASN A 84 -15.588 1.825 -7.277 1.00 0.00 O ATOM 1202 CB ASN A 84 -14.167 -0.125 -5.787 1.00 0.00 C ATOM 1203 CG ASN A 84 -14.242 -1.268 -6.801 1.00 0.00 C ATOM 1204 OD1 ASN A 84 -13.864 -2.447 -6.317 1.00 0.00 O flip ATOM 1205 ND2 ASN A 84 -14.619 -1.091 -7.948 1.00 0.00 N flip ATOM 0 H ASN A 84 -11.583 1.824 -5.865 1.00 0.00 H new ATOM 0 HA ASN A 84 -12.949 0.806 -7.296 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -13.622 -0.454 -4.902 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -15.172 0.143 -5.461 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -14.896 -0.159 -8.256 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -14.658 -1.875 -8.599 1.00 0.00 H new ATOM 1212 N GLY A 85 -14.271 3.374 -6.286 1.00 0.00 N ATOM 1213 CA GLY A 85 -15.201 4.468 -6.507 1.00 0.00 C ATOM 1214 C GLY A 85 -15.958 4.812 -5.223 1.00 0.00 C ATOM 1215 O GLY A 85 -16.586 5.866 -5.132 1.00 0.00 O ATOM 0 H GLY A 85 -13.411 3.636 -5.804 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.659 5.345 -6.860 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -15.910 4.195 -7.289 1.00 0.00 H new ATOM 1219 N GLU A 86 -15.875 3.902 -4.263 1.00 0.00 N ATOM 1220 CA GLU A 86 -16.545 4.096 -2.989 1.00 0.00 C ATOM 1221 C GLU A 86 -15.691 4.970 -2.068 1.00 0.00 C ATOM 1222 O GLU A 86 -14.492 4.738 -1.922 1.00 0.00 O ATOM 1223 CB GLU A 86 -16.866 2.754 -2.328 1.00 0.00 C ATOM 1224 CG GLU A 86 -17.580 2.957 -0.991 1.00 0.00 C ATOM 1225 CD GLU A 86 -18.605 1.849 -0.742 1.00 0.00 C ATOM 1226 OE1 GLU A 86 -18.283 0.691 -1.085 1.00 0.00 O ATOM 1227 OE2 GLU A 86 -19.687 2.185 -0.215 1.00 0.00 O ATOM 0 H GLU A 86 -15.354 3.029 -4.342 1.00 0.00 H new ATOM 0 HA GLU A 86 -17.489 4.609 -3.172 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -17.493 2.159 -2.992 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -15.945 2.193 -2.171 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -16.849 2.969 -0.183 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -18.078 3.926 -0.985 1.00 0.00 H new ATOM 1234 N THR A 87 -16.343 5.956 -1.469 1.00 0.00 N ATOM 1235 CA THR A 87 -15.658 6.866 -0.567 1.00 0.00 C ATOM 1236 C THR A 87 -15.262 6.142 0.721 1.00 0.00 C ATOM 1237 O THR A 87 -15.854 5.122 1.071 1.00 0.00 O ATOM 1238 CB THR A 87 -16.569 8.072 -0.330 1.00 0.00 C ATOM 1239 OG1 THR A 87 -15.671 9.175 -0.246 1.00 0.00 O ATOM 1240 CG2 THR A 87 -17.244 8.036 1.043 1.00 0.00 C ATOM 0 H THR A 87 -17.338 6.144 -1.591 1.00 0.00 H new ATOM 0 HA THR A 87 -14.725 7.225 -1.001 1.00 0.00 H new ATOM 0 HB THR A 87 -17.331 8.109 -1.108 1.00 0.00 H new ATOM 0 HG1 THR A 87 -16.179 9.999 -0.095 1.00 0.00 H new ATOM 0 HG21 THR A 87 -17.879 8.914 1.159 1.00 0.00 H new ATOM 0 HG22 THR A 87 -17.852 7.135 1.126 1.00 0.00 H new ATOM 0 HG23 THR A 87 -16.482 8.033 1.823 1.00 0.00 H new ATOM 1248 N LEU A 88 -14.263 6.697 1.392 1.00 0.00 N ATOM 1249 CA LEU A 88 -13.781 6.117 2.634 1.00 0.00 C ATOM 1250 C LEU A 88 -13.760 7.193 3.721 1.00 0.00 C ATOM 1251 O LEU A 88 -14.201 6.955 4.844 1.00 0.00 O ATOM 1252 CB LEU A 88 -12.428 5.435 2.417 1.00 0.00 C ATOM 1253 CG LEU A 88 -12.433 4.214 1.496 1.00 0.00 C ATOM 1254 CD1 LEU A 88 -11.019 3.657 1.316 1.00 0.00 C ATOM 1255 CD2 LEU A 88 -13.408 3.149 2.002 1.00 0.00 C ATOM 0 H LEU A 88 -13.774 7.543 1.099 1.00 0.00 H new ATOM 0 HA LEU A 88 -14.457 5.333 2.975 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.734 6.170 2.009 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.037 5.131 3.388 1.00 0.00 H new ATOM 0 HG LEU A 88 -12.783 4.530 0.513 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -11.051 2.789 0.657 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.379 4.423 0.877 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -10.618 3.361 2.286 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.392 2.292 1.329 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -13.113 2.831 3.002 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.415 3.565 2.036 1.00 0.00 H new ATOM 1267 N LEU A 89 -13.244 8.355 3.348 1.00 0.00 N ATOM 1268 CA LEU A 89 -13.159 9.469 4.277 1.00 0.00 C ATOM 1269 C LEU A 89 -14.530 9.699 4.916 1.00 0.00 C ATOM 1270 O LEU A 89 -14.629 9.904 6.125 1.00 0.00 O ATOM 1271 CB LEU A 89 -12.590 10.706 3.581 1.00 0.00 C ATOM 1272 CG LEU A 89 -11.444 10.455 2.598 1.00 0.00 C ATOM 1273 CD1 LEU A 89 -10.651 11.738 2.342 1.00 0.00 C ATOM 1274 CD2 LEU A 89 -10.547 9.314 3.082 1.00 0.00 C ATOM 0 H LEU A 89 -12.881 8.549 2.415 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.464 9.239 5.085 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.400 11.202 3.045 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -12.241 11.400 4.345 1.00 0.00 H new ATOM 0 HG LEU A 89 -11.873 10.146 1.645 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.843 11.532 1.640 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -11.312 12.496 1.922 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -10.233 12.101 3.281 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.741 9.156 2.366 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -10.124 9.571 4.053 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.136 8.401 3.172 1.00 0.00 H new ATOM 1286 N GLY A 90 -15.554 9.657 4.076 1.00 0.00 N ATOM 1287 CA GLY A 90 -16.915 9.859 4.543 1.00 0.00 C ATOM 1288 C GLY A 90 -17.301 8.800 5.578 1.00 0.00 C ATOM 1289 O GLY A 90 -18.150 9.045 6.435 1.00 0.00 O ATOM 0 H GLY A 90 -15.468 9.486 3.074 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -17.010 10.853 4.981 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -17.603 9.816 3.699 1.00 0.00 H new ATOM 1293 N LYS A 91 -16.660 7.646 5.466 1.00 0.00 N ATOM 1294 CA LYS A 91 -16.926 6.550 6.381 1.00 0.00 C ATOM 1295 C LYS A 91 -15.965 6.638 7.569 1.00 0.00 C ATOM 1296 O LYS A 91 -15.229 7.614 7.705 1.00 0.00 O ATOM 1297 CB LYS A 91 -16.871 5.211 5.644 1.00 0.00 C ATOM 1298 CG LYS A 91 -17.320 5.367 4.189 1.00 0.00 C ATOM 1299 CD LYS A 91 -17.432 4.005 3.501 1.00 0.00 C ATOM 1300 CE LYS A 91 -18.485 4.036 2.391 1.00 0.00 C ATOM 1301 NZ LYS A 91 -19.837 4.215 2.965 1.00 0.00 N ATOM 0 H LYS A 91 -15.957 7.446 4.755 1.00 0.00 H new ATOM 0 HA LYS A 91 -17.937 6.626 6.782 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -15.855 4.816 5.675 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -17.510 4.487 6.150 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -18.283 5.876 4.154 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -16.609 5.993 3.650 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -16.465 3.724 3.082 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -17.695 3.243 4.235 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -18.267 4.848 1.698 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -18.446 3.109 1.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -20.545 3.810 2.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -19.890 3.732 3.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -20.028 5.229 3.095 1.00 0.00 H new ATOM 1315 N SER A 92 -16.002 5.605 8.397 1.00 0.00 N ATOM 1316 CA SER A 92 -15.144 5.553 9.568 1.00 0.00 C ATOM 1317 C SER A 92 -14.018 4.541 9.348 1.00 0.00 C ATOM 1318 O SER A 92 -14.019 3.813 8.356 1.00 0.00 O ATOM 1319 CB SER A 92 -15.944 5.193 10.822 1.00 0.00 C ATOM 1320 OG SER A 92 -15.811 6.179 11.842 1.00 0.00 O ATOM 0 H SER A 92 -16.613 4.797 8.280 1.00 0.00 H new ATOM 0 HA SER A 92 -14.711 6.542 9.718 1.00 0.00 H new ATOM 0 HB2 SER A 92 -16.996 5.081 10.561 1.00 0.00 H new ATOM 0 HB3 SER A 92 -15.606 4.229 11.203 1.00 0.00 H new ATOM 0 HG SER A 92 -14.870 6.440 11.924 1.00 0.00 H new ATOM 1326 N ASN A 93 -13.086 4.527 10.289 1.00 0.00 N ATOM 1327 CA ASN A 93 -11.956 3.616 10.210 1.00 0.00 C ATOM 1328 C ASN A 93 -12.472 2.179 10.105 1.00 0.00 C ATOM 1329 O ASN A 93 -11.820 1.324 9.508 1.00 0.00 O ATOM 1330 CB ASN A 93 -11.081 3.714 11.461 1.00 0.00 C ATOM 1331 CG ASN A 93 -10.734 5.171 11.775 1.00 0.00 C ATOM 1332 OD1 ASN A 93 -11.254 5.774 12.699 1.00 0.00 O ATOM 1333 ND2 ASN A 93 -9.830 5.700 10.956 1.00 0.00 N ATOM 0 H ASN A 93 -13.090 5.132 11.110 1.00 0.00 H new ATOM 0 HA ASN A 93 -11.365 3.886 9.335 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -11.602 3.270 12.309 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -10.165 3.142 11.314 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -9.532 6.667 11.082 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -9.435 5.138 10.202 1.00 0.00 H new ATOM 1340 N HIS A 94 -13.638 1.958 10.695 1.00 0.00 N ATOM 1341 CA HIS A 94 -14.248 0.640 10.675 1.00 0.00 C ATOM 1342 C HIS A 94 -14.957 0.422 9.337 1.00 0.00 C ATOM 1343 O HIS A 94 -14.498 -0.363 8.508 1.00 0.00 O ATOM 1344 CB HIS A 94 -15.179 0.454 11.875 1.00 0.00 C ATOM 1345 CG HIS A 94 -16.318 -0.506 11.627 1.00 0.00 C ATOM 1346 ND1 HIS A 94 -16.119 -1.821 11.242 1.00 0.00 N ATOM 1347 CD2 HIS A 94 -17.667 -0.330 11.714 1.00 0.00 C ATOM 1348 CE1 HIS A 94 -17.303 -2.400 11.105 1.00 0.00 C ATOM 1349 NE2 HIS A 94 -18.261 -1.474 11.397 1.00 0.00 N ATOM 0 H HIS A 94 -14.176 2.670 11.190 1.00 0.00 H new ATOM 0 HA HIS A 94 -13.475 -0.123 10.766 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -14.595 0.097 12.723 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -15.590 1.424 12.157 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -18.168 0.585 11.994 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -17.479 -3.425 10.813 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -19.268 -1.634 11.375 1.00 0.00 H new ATOM 1357 N GLU A 95 -16.063 1.131 9.167 1.00 0.00 N ATOM 1358 CA GLU A 95 -16.839 1.025 7.943 1.00 0.00 C ATOM 1359 C GLU A 95 -15.910 0.976 6.728 1.00 0.00 C ATOM 1360 O GLU A 95 -15.930 0.012 5.965 1.00 0.00 O ATOM 1361 CB GLU A 95 -17.837 2.178 7.825 1.00 0.00 C ATOM 1362 CG GLU A 95 -18.607 2.373 9.133 1.00 0.00 C ATOM 1363 CD GLU A 95 -20.035 2.852 8.862 1.00 0.00 C ATOM 1364 OE1 GLU A 95 -20.206 4.084 8.733 1.00 0.00 O ATOM 1365 OE2 GLU A 95 -20.923 1.976 8.790 1.00 0.00 O ATOM 0 H GLU A 95 -16.440 1.781 9.856 1.00 0.00 H new ATOM 0 HA GLU A 95 -17.410 0.097 7.977 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -17.308 3.096 7.570 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -18.536 1.977 7.014 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -18.633 1.435 9.687 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -18.089 3.099 9.760 1.00 0.00 H new ATOM 1372 N ALA A 96 -15.119 2.029 6.586 1.00 0.00 N ATOM 1373 CA ALA A 96 -14.184 2.119 5.477 1.00 0.00 C ATOM 1374 C ALA A 96 -13.552 0.747 5.236 1.00 0.00 C ATOM 1375 O ALA A 96 -13.851 0.088 4.241 1.00 0.00 O ATOM 1376 CB ALA A 96 -13.141 3.198 5.774 1.00 0.00 C ATOM 0 H ALA A 96 -15.106 2.828 7.221 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.701 2.409 4.562 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -12.440 3.265 4.942 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.639 4.158 5.907 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.600 2.940 6.684 1.00 0.00 H new ATOM 1382 N MET A 97 -12.690 0.357 6.164 1.00 0.00 N ATOM 1383 CA MET A 97 -12.013 -0.925 6.065 1.00 0.00 C ATOM 1384 C MET A 97 -13.004 -2.044 5.737 1.00 0.00 C ATOM 1385 O MET A 97 -12.713 -2.915 4.918 1.00 0.00 O ATOM 1386 CB MET A 97 -11.312 -1.236 7.388 1.00 0.00 C ATOM 1387 CG MET A 97 -9.982 -0.486 7.493 1.00 0.00 C ATOM 1388 SD MET A 97 -8.868 -1.038 6.211 1.00 0.00 S ATOM 1389 CE MET A 97 -7.776 -2.071 7.173 1.00 0.00 C ATOM 0 H MET A 97 -12.445 0.906 6.988 1.00 0.00 H new ATOM 0 HA MET A 97 -11.280 -0.866 5.260 1.00 0.00 H new ATOM 0 HB2 MET A 97 -11.958 -0.957 8.220 1.00 0.00 H new ATOM 0 HB3 MET A 97 -11.136 -2.309 7.467 1.00 0.00 H new ATOM 0 HG2 MET A 97 -10.152 0.587 7.402 1.00 0.00 H new ATOM 0 HG3 MET A 97 -9.535 -0.656 8.473 1.00 0.00 H new ATOM 0 HE1 MET A 97 -7.080 -2.583 6.508 1.00 0.00 H new ATOM 0 HE2 MET A 97 -7.218 -1.454 7.877 1.00 0.00 H new ATOM 0 HE3 MET A 97 -8.362 -2.808 7.722 1.00 0.00 H new ATOM 1399 N GLU A 98 -14.153 -1.985 6.393 1.00 0.00 N ATOM 1400 CA GLU A 98 -15.188 -2.983 6.181 1.00 0.00 C ATOM 1401 C GLU A 98 -15.676 -2.942 4.732 1.00 0.00 C ATOM 1402 O GLU A 98 -16.085 -3.964 4.182 1.00 0.00 O ATOM 1403 CB GLU A 98 -16.350 -2.783 7.156 1.00 0.00 C ATOM 1404 CG GLU A 98 -17.625 -2.378 6.414 1.00 0.00 C ATOM 1405 CD GLU A 98 -18.237 -3.574 5.682 1.00 0.00 C ATOM 1406 OE1 GLU A 98 -18.435 -4.609 6.354 1.00 0.00 O ATOM 1407 OE2 GLU A 98 -18.493 -3.426 4.468 1.00 0.00 O ATOM 0 H GLU A 98 -14.391 -1.262 7.072 1.00 0.00 H new ATOM 0 HA GLU A 98 -14.761 -3.967 6.372 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -16.526 -3.704 7.712 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -16.090 -2.015 7.885 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -18.348 -1.971 7.121 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -17.398 -1.587 5.699 1.00 0.00 H new ATOM 1414 N THR A 99 -15.616 -1.752 4.153 1.00 0.00 N ATOM 1415 CA THR A 99 -16.046 -1.565 2.778 1.00 0.00 C ATOM 1416 C THR A 99 -14.990 -2.104 1.811 1.00 0.00 C ATOM 1417 O THR A 99 -15.326 -2.716 0.798 1.00 0.00 O ATOM 1418 CB THR A 99 -16.353 -0.080 2.576 1.00 0.00 C ATOM 1419 OG1 THR A 99 -17.761 0.013 2.772 1.00 0.00 O ATOM 1420 CG2 THR A 99 -16.148 0.369 1.128 1.00 0.00 C ATOM 0 H THR A 99 -15.276 -0.907 4.612 1.00 0.00 H new ATOM 0 HA THR A 99 -16.954 -2.131 2.567 1.00 0.00 H new ATOM 0 HB THR A 99 -15.718 0.514 3.233 1.00 0.00 H new ATOM 0 HG1 THR A 99 -18.046 0.944 2.661 1.00 0.00 H new ATOM 0 HG21 THR A 99 -16.380 1.430 1.040 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.111 0.198 0.837 1.00 0.00 H new ATOM 0 HG23 THR A 99 -16.807 -0.202 0.473 1.00 0.00 H new ATOM 1428 N LEU A 100 -13.735 -1.858 2.158 1.00 0.00 N ATOM 1429 CA LEU A 100 -12.628 -2.311 1.333 1.00 0.00 C ATOM 1430 C LEU A 100 -12.823 -3.789 0.992 1.00 0.00 C ATOM 1431 O LEU A 100 -13.130 -4.132 -0.148 1.00 0.00 O ATOM 1432 CB LEU A 100 -11.293 -2.008 2.016 1.00 0.00 C ATOM 1433 CG LEU A 100 -10.063 -1.988 1.105 1.00 0.00 C ATOM 1434 CD1 LEU A 100 -10.241 -0.984 -0.035 1.00 0.00 C ATOM 1435 CD2 LEU A 100 -8.789 -1.722 1.909 1.00 0.00 C ATOM 0 H LEU A 100 -13.460 -1.351 2.999 1.00 0.00 H new ATOM 0 HA LEU A 100 -12.608 -1.766 0.389 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.371 -1.039 2.509 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.130 -2.751 2.797 1.00 0.00 H new ATOM 0 HG LEU A 100 -9.958 -2.974 0.652 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.353 -0.990 -0.667 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -11.112 -1.260 -0.630 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.385 0.014 0.378 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -7.930 -1.713 1.238 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -8.869 -0.757 2.409 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.659 -2.507 2.654 1.00 0.00 H new ATOM 1447 N ARG A 101 -12.637 -4.626 2.003 1.00 0.00 N ATOM 1448 CA ARG A 101 -12.789 -6.060 1.825 1.00 0.00 C ATOM 1449 C ARG A 101 -14.040 -6.363 0.998 1.00 0.00 C ATOM 1450 O ARG A 101 -14.113 -7.393 0.330 1.00 0.00 O ATOM 1451 CB ARG A 101 -12.892 -6.775 3.174 1.00 0.00 C ATOM 1452 CG ARG A 101 -14.326 -6.734 3.707 1.00 0.00 C ATOM 1453 CD ARG A 101 -14.378 -7.174 5.172 1.00 0.00 C ATOM 1454 NE ARG A 101 -13.773 -6.134 6.034 1.00 0.00 N ATOM 1455 CZ ARG A 101 -13.918 -6.084 7.365 1.00 0.00 C ATOM 1456 NH1 ARG A 101 -14.649 -7.014 7.995 1.00 0.00 N ATOM 1457 NH2 ARG A 101 -13.332 -5.104 8.067 1.00 0.00 N ATOM 0 H ARG A 101 -12.382 -4.338 2.948 1.00 0.00 H new ATOM 0 HA ARG A 101 -11.906 -6.424 1.300 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -12.569 -7.811 3.067 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -12.220 -6.305 3.891 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -14.724 -5.724 3.612 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -14.960 -7.385 3.105 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -15.411 -7.350 5.471 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -13.845 -8.117 5.296 1.00 0.00 H new ATOM 0 HE ARG A 101 -13.211 -5.410 5.587 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -15.095 -7.760 7.461 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -14.759 -6.976 9.008 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -12.776 -4.396 7.588 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -13.443 -5.066 9.080 1.00 0.00 H new ATOM 1471 N ARG A 102 -14.993 -5.446 1.069 1.00 0.00 N ATOM 1472 CA ARG A 102 -16.238 -5.601 0.335 1.00 0.00 C ATOM 1473 C ARG A 102 -16.038 -5.225 -1.135 1.00 0.00 C ATOM 1474 O ARG A 102 -16.306 -6.028 -2.027 1.00 0.00 O ATOM 1475 CB ARG A 102 -17.343 -4.728 0.932 1.00 0.00 C ATOM 1476 CG ARG A 102 -18.717 -5.373 0.738 1.00 0.00 C ATOM 1477 CD ARG A 102 -19.675 -4.971 1.861 1.00 0.00 C ATOM 1478 NE ARG A 102 -20.196 -6.179 2.538 1.00 0.00 N ATOM 1479 CZ ARG A 102 -20.989 -6.152 3.618 1.00 0.00 C ATOM 1480 NH1 ARG A 102 -21.356 -4.978 4.151 1.00 0.00 N ATOM 1481 NH2 ARG A 102 -21.414 -7.298 4.166 1.00 0.00 N ATOM 0 H ARG A 102 -14.929 -4.592 1.624 1.00 0.00 H new ATOM 0 HA ARG A 102 -16.538 -6.646 0.409 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -17.156 -4.575 1.995 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -17.329 -3.745 0.461 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -19.132 -5.071 -0.224 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -18.613 -6.458 0.714 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -19.159 -4.335 2.580 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -20.501 -4.387 1.454 1.00 0.00 H new ATOM 0 HE ARG A 102 -19.935 -7.089 2.159 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -21.032 -4.105 3.735 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -21.960 -4.958 4.973 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -21.134 -8.191 3.761 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -22.018 -7.277 4.988 1.00 0.00 H new ATOM 1495 N SER A 103 -15.569 -4.003 -1.341 1.00 0.00 N ATOM 1496 CA SER A 103 -15.331 -3.510 -2.687 1.00 0.00 C ATOM 1497 C SER A 103 -14.366 -4.443 -3.422 1.00 0.00 C ATOM 1498 O SER A 103 -14.221 -4.356 -4.641 1.00 0.00 O ATOM 1499 CB SER A 103 -14.776 -2.085 -2.661 1.00 0.00 C ATOM 1500 OG SER A 103 -15.589 -1.209 -1.886 1.00 0.00 O ATOM 0 H SER A 103 -15.347 -3.340 -0.598 1.00 0.00 H new ATOM 0 HA SER A 103 -16.283 -3.490 -3.218 1.00 0.00 H new ATOM 0 HB2 SER A 103 -13.765 -2.097 -2.253 1.00 0.00 H new ATOM 0 HB3 SER A 103 -14.704 -1.706 -3.680 1.00 0.00 H new ATOM 0 HG SER A 103 -15.505 -1.438 -0.937 1.00 0.00 H new ATOM 1506 N MET A 104 -13.731 -5.313 -2.651 1.00 0.00 N ATOM 1507 CA MET A 104 -12.784 -6.260 -3.213 1.00 0.00 C ATOM 1508 C MET A 104 -13.505 -7.351 -4.007 1.00 0.00 C ATOM 1509 O MET A 104 -13.261 -7.519 -5.201 1.00 0.00 O ATOM 1510 CB MET A 104 -11.972 -6.901 -2.086 1.00 0.00 C ATOM 1511 CG MET A 104 -10.826 -5.987 -1.648 1.00 0.00 C ATOM 1512 SD MET A 104 -9.904 -6.755 -0.326 1.00 0.00 S ATOM 1513 CE MET A 104 -9.694 -5.354 0.760 1.00 0.00 C ATOM 0 H MET A 104 -13.854 -5.382 -1.641 1.00 0.00 H new ATOM 0 HA MET A 104 -12.120 -5.722 -3.890 1.00 0.00 H new ATOM 0 HB2 MET A 104 -12.623 -7.107 -1.236 1.00 0.00 H new ATOM 0 HB3 MET A 104 -11.571 -7.858 -2.420 1.00 0.00 H new ATOM 0 HG2 MET A 104 -10.167 -5.786 -2.493 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.222 -5.027 -1.317 1.00 0.00 H new ATOM 0 HE1 MET A 104 -8.648 -5.048 0.761 1.00 0.00 H new ATOM 0 HE2 MET A 104 -10.314 -4.528 0.412 1.00 0.00 H new ATOM 0 HE3 MET A 104 -9.992 -5.630 1.772 1.00 0.00 H new ATOM 1523 N SER A 105 -14.380 -8.064 -3.312 1.00 0.00 N ATOM 1524 CA SER A 105 -15.138 -9.133 -3.937 1.00 0.00 C ATOM 1525 C SER A 105 -16.533 -8.632 -4.318 1.00 0.00 C ATOM 1526 O SER A 105 -17.055 -8.984 -5.375 1.00 0.00 O ATOM 1527 CB SER A 105 -15.245 -10.347 -3.011 1.00 0.00 C ATOM 1528 OG SER A 105 -14.026 -11.081 -2.951 1.00 0.00 O ATOM 0 H SER A 105 -14.580 -7.922 -2.322 1.00 0.00 H new ATOM 0 HA SER A 105 -14.611 -9.443 -4.839 1.00 0.00 H new ATOM 0 HB2 SER A 105 -15.519 -10.016 -2.009 1.00 0.00 H new ATOM 0 HB3 SER A 105 -16.045 -11.000 -3.360 1.00 0.00 H new ATOM 0 HG SER A 105 -14.134 -11.847 -2.349 1.00 0.00 H new ATOM 1534 N MET A 106 -17.096 -7.820 -3.437 1.00 0.00 N ATOM 1535 CA MET A 106 -18.420 -7.267 -3.668 1.00 0.00 C ATOM 1536 C MET A 106 -18.457 -6.455 -4.964 1.00 0.00 C ATOM 1537 O MET A 106 -19.409 -6.555 -5.736 1.00 0.00 O ATOM 1538 CB MET A 106 -18.811 -6.369 -2.492 1.00 0.00 C ATOM 1539 CG MET A 106 -20.327 -6.364 -2.286 1.00 0.00 C ATOM 1540 SD MET A 106 -21.033 -4.878 -2.977 1.00 0.00 S ATOM 1541 CE MET A 106 -22.363 -5.583 -3.936 1.00 0.00 C ATOM 0 H MET A 106 -16.660 -7.531 -2.561 1.00 0.00 H new ATOM 0 HA MET A 106 -19.127 -8.092 -3.758 1.00 0.00 H new ATOM 0 HB2 MET A 106 -18.318 -6.717 -1.584 1.00 0.00 H new ATOM 0 HB3 MET A 106 -18.462 -5.353 -2.674 1.00 0.00 H new ATOM 0 HG2 MET A 106 -20.769 -7.241 -2.759 1.00 0.00 H new ATOM 0 HG3 MET A 106 -20.558 -6.425 -1.222 1.00 0.00 H new ATOM 0 HE1 MET A 106 -22.912 -4.786 -4.438 1.00 0.00 H new ATOM 0 HE2 MET A 106 -21.953 -6.266 -4.680 1.00 0.00 H new ATOM 0 HE3 MET A 106 -23.038 -6.128 -3.276 1.00 0.00 H new ATOM 1551 N GLU A 107 -17.408 -5.670 -5.163 1.00 0.00 N ATOM 1552 CA GLU A 107 -17.309 -4.841 -6.353 1.00 0.00 C ATOM 1553 C GLU A 107 -16.429 -5.523 -7.402 1.00 0.00 C ATOM 1554 O GLU A 107 -16.521 -5.216 -8.589 1.00 0.00 O ATOM 1555 CB GLU A 107 -16.774 -3.450 -6.009 1.00 0.00 C ATOM 1556 CG GLU A 107 -17.920 -2.472 -5.743 1.00 0.00 C ATOM 1557 CD GLU A 107 -18.681 -2.156 -7.033 1.00 0.00 C ATOM 1558 OE1 GLU A 107 -18.175 -1.305 -7.796 1.00 0.00 O ATOM 1559 OE2 GLU A 107 -19.751 -2.773 -7.226 1.00 0.00 O ATOM 0 H GLU A 107 -16.620 -5.590 -4.521 1.00 0.00 H new ATOM 0 HA GLU A 107 -18.308 -4.717 -6.770 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -16.132 -3.511 -5.130 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -16.159 -3.080 -6.829 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -18.603 -2.898 -5.008 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -17.525 -1.551 -5.315 1.00 0.00 H new ATOM 1566 N GLY A 108 -15.595 -6.436 -6.926 1.00 0.00 N ATOM 1567 CA GLY A 108 -14.699 -7.164 -7.808 1.00 0.00 C ATOM 1568 C GLY A 108 -15.363 -8.438 -8.334 1.00 0.00 C ATOM 1569 O GLY A 108 -14.831 -9.096 -9.228 1.00 0.00 O ATOM 0 H GLY A 108 -15.521 -6.688 -5.940 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -14.410 -6.528 -8.645 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -13.785 -7.420 -7.273 1.00 0.00 H new ATOM 1573 N ASN A 109 -16.514 -8.749 -7.757 1.00 0.00 N ATOM 1574 CA ASN A 109 -17.256 -9.932 -8.157 1.00 0.00 C ATOM 1575 C ASN A 109 -17.753 -9.757 -9.593 1.00 0.00 C ATOM 1576 O ASN A 109 -17.661 -10.679 -10.403 1.00 0.00 O ATOM 1577 CB ASN A 109 -18.476 -10.147 -7.258 1.00 0.00 C ATOM 1578 CG ASN A 109 -19.199 -8.826 -6.989 1.00 0.00 C ATOM 1579 OD1 ASN A 109 -18.956 -7.815 -7.628 1.00 0.00 O ATOM 1580 ND2 ASN A 109 -20.098 -8.890 -6.012 1.00 0.00 N ATOM 0 H ASN A 109 -16.951 -8.202 -7.015 1.00 0.00 H new ATOM 0 HA ASN A 109 -16.590 -10.791 -8.074 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -19.161 -10.851 -7.731 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -18.162 -10.593 -6.314 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -20.634 -8.060 -5.757 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -20.252 -9.769 -5.517 1.00 0.00 H new ATOM 1587 N ILE A 110 -18.268 -8.567 -9.867 1.00 0.00 N ATOM 1588 CA ILE A 110 -18.779 -8.259 -11.192 1.00 0.00 C ATOM 1589 C ILE A 110 -17.701 -7.524 -11.991 1.00 0.00 C ATOM 1590 O ILE A 110 -17.576 -7.721 -13.199 1.00 0.00 O ATOM 1591 CB ILE A 110 -20.100 -7.494 -11.092 1.00 0.00 C ATOM 1592 CG1 ILE A 110 -19.854 -6.008 -10.825 1.00 0.00 C ATOM 1593 CG2 ILE A 110 -21.019 -8.120 -10.041 1.00 0.00 C ATOM 1594 CD1 ILE A 110 -19.559 -5.758 -9.345 1.00 0.00 C ATOM 0 H ILE A 110 -18.342 -7.805 -9.194 1.00 0.00 H new ATOM 0 HA ILE A 110 -19.009 -9.176 -11.735 1.00 0.00 H new ATOM 0 HB ILE A 110 -20.611 -7.569 -12.052 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -19.017 -5.660 -11.430 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -20.728 -5.431 -11.128 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -21.951 -7.557 -9.991 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -21.234 -9.153 -10.314 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -20.528 -8.097 -9.068 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -19.388 -4.694 -9.183 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -20.408 -6.085 -8.745 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -18.671 -6.317 -9.052 1.00 0.00 H new ATOM 1606 N ARG A 111 -16.950 -6.692 -11.285 1.00 0.00 N ATOM 1607 CA ARG A 111 -15.887 -5.926 -11.913 1.00 0.00 C ATOM 1608 C ARG A 111 -14.705 -6.837 -12.251 1.00 0.00 C ATOM 1609 O ARG A 111 -14.265 -6.889 -13.398 1.00 0.00 O ATOM 1610 CB ARG A 111 -15.407 -4.797 -10.999 1.00 0.00 C ATOM 1611 CG ARG A 111 -14.509 -3.820 -11.761 1.00 0.00 C ATOM 1612 CD ARG A 111 -15.193 -2.462 -11.926 1.00 0.00 C ATOM 1613 NE ARG A 111 -14.240 -1.480 -12.491 1.00 0.00 N ATOM 1614 CZ ARG A 111 -13.955 -1.375 -13.796 1.00 0.00 C ATOM 1615 NH1 ARG A 111 -14.548 -2.191 -14.679 1.00 0.00 N ATOM 1616 NH2 ARG A 111 -13.078 -0.455 -14.218 1.00 0.00 N ATOM 0 H ARG A 111 -17.057 -6.531 -10.283 1.00 0.00 H new ATOM 0 HA ARG A 111 -16.288 -5.491 -12.828 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -16.266 -4.264 -10.591 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -14.860 -5.216 -10.154 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -13.567 -3.694 -11.227 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -14.268 -4.231 -12.741 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -16.059 -2.559 -12.581 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -15.560 -2.111 -10.962 1.00 0.00 H new ATOM 0 HE ARG A 111 -13.771 -0.844 -11.847 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -15.216 -2.892 -14.357 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -14.331 -2.111 -15.673 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -12.627 0.166 -13.546 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -12.861 -0.375 -15.211 1.00 0.00 H new ATOM 1630 N GLY A 112 -14.225 -7.534 -11.231 1.00 0.00 N ATOM 1631 CA GLY A 112 -13.103 -8.440 -11.405 1.00 0.00 C ATOM 1632 C GLY A 112 -11.795 -7.785 -10.957 1.00 0.00 C ATOM 1633 O GLY A 112 -10.713 -8.217 -11.353 1.00 0.00 O ATOM 0 H GLY A 112 -14.593 -7.489 -10.281 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -13.274 -9.350 -10.830 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -13.027 -8.734 -12.452 1.00 0.00 H new ATOM 1637 N MET A 113 -11.937 -6.753 -10.138 1.00 0.00 N ATOM 1638 CA MET A 113 -10.780 -6.034 -9.632 1.00 0.00 C ATOM 1639 C MET A 113 -11.205 -4.900 -8.698 1.00 0.00 C ATOM 1640 O MET A 113 -12.391 -4.598 -8.582 1.00 0.00 O ATOM 1641 CB MET A 113 -9.983 -5.459 -10.805 1.00 0.00 C ATOM 1642 CG MET A 113 -10.764 -4.344 -11.503 1.00 0.00 C ATOM 1643 SD MET A 113 -10.067 -4.028 -13.116 1.00 0.00 S ATOM 1644 CE MET A 113 -11.333 -2.972 -13.799 1.00 0.00 C ATOM 0 H MET A 113 -12.836 -6.398 -9.812 1.00 0.00 H new ATOM 0 HA MET A 113 -10.160 -6.731 -9.068 1.00 0.00 H new ATOM 0 HB2 MET A 113 -9.030 -5.071 -10.446 1.00 0.00 H new ATOM 0 HB3 MET A 113 -9.756 -6.251 -11.519 1.00 0.00 H new ATOM 0 HG2 MET A 113 -11.812 -4.628 -11.600 1.00 0.00 H new ATOM 0 HG3 MET A 113 -10.734 -3.436 -10.901 1.00 0.00 H new ATOM 0 HE1 MET A 113 -10.986 -2.551 -14.743 1.00 0.00 H new ATOM 0 HE2 MET A 113 -12.238 -3.554 -13.973 1.00 0.00 H new ATOM 0 HE3 MET A 113 -11.550 -2.165 -13.100 1.00 0.00 H new ATOM 1654 N ILE A 114 -10.212 -4.302 -8.055 1.00 0.00 N ATOM 1655 CA ILE A 114 -10.468 -3.208 -7.135 1.00 0.00 C ATOM 1656 C ILE A 114 -9.545 -2.035 -7.474 1.00 0.00 C ATOM 1657 O ILE A 114 -8.513 -2.219 -8.116 1.00 0.00 O ATOM 1658 CB ILE A 114 -10.347 -3.686 -5.686 1.00 0.00 C ATOM 1659 CG1 ILE A 114 -10.599 -2.539 -4.707 1.00 0.00 C ATOM 1660 CG2 ILE A 114 -8.995 -4.361 -5.443 1.00 0.00 C ATOM 1661 CD1 ILE A 114 -10.722 -3.058 -3.273 1.00 0.00 C ATOM 0 H ILE A 114 -9.229 -4.555 -8.154 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.492 -2.851 -7.244 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.118 -4.435 -5.508 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -9.783 -1.819 -4.768 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -11.511 -2.012 -4.986 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -8.934 -4.691 -4.406 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -8.894 -5.221 -6.105 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -8.193 -3.652 -5.645 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -10.901 -2.222 -2.597 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -11.554 -3.760 -3.210 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -9.799 -3.563 -2.988 1.00 0.00 H new ATOM 1673 N GLN A 115 -9.951 -0.856 -7.027 1.00 0.00 N ATOM 1674 CA GLN A 115 -9.174 0.346 -7.276 1.00 0.00 C ATOM 1675 C GLN A 115 -8.838 1.043 -5.955 1.00 0.00 C ATOM 1676 O GLN A 115 -9.603 0.964 -4.995 1.00 0.00 O ATOM 1677 CB GLN A 115 -9.915 1.292 -8.222 1.00 0.00 C ATOM 1678 CG GLN A 115 -9.216 2.651 -8.298 1.00 0.00 C ATOM 1679 CD GLN A 115 -10.063 3.662 -9.073 1.00 0.00 C ATOM 1680 OE1 GLN A 115 -10.555 4.641 -8.536 1.00 0.00 O ATOM 1681 NE2 GLN A 115 -10.206 3.371 -10.363 1.00 0.00 N ATOM 0 H GLN A 115 -10.808 -0.707 -6.494 1.00 0.00 H new ATOM 0 HA GLN A 115 -8.241 0.059 -7.761 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -9.967 0.850 -9.217 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -10.941 1.425 -7.878 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -9.029 3.024 -7.291 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -8.246 2.538 -8.781 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -9.767 2.535 -10.749 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -10.754 3.984 -10.966 1.00 0.00 H new ATOM 1690 N LEU A 116 -7.694 1.711 -5.950 1.00 0.00 N ATOM 1691 CA LEU A 116 -7.247 2.421 -4.764 1.00 0.00 C ATOM 1692 C LEU A 116 -6.902 3.864 -5.138 1.00 0.00 C ATOM 1693 O LEU A 116 -6.052 4.100 -5.995 1.00 0.00 O ATOM 1694 CB LEU A 116 -6.098 1.669 -4.090 1.00 0.00 C ATOM 1695 CG LEU A 116 -6.386 0.221 -3.692 1.00 0.00 C ATOM 1696 CD1 LEU A 116 -5.127 -0.461 -3.151 1.00 0.00 C ATOM 1697 CD2 LEU A 116 -7.549 0.145 -2.700 1.00 0.00 C ATOM 0 H LEU A 116 -7.063 1.776 -6.749 1.00 0.00 H new ATOM 0 HA LEU A 116 -8.046 2.465 -4.024 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.241 1.676 -4.764 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.805 2.219 -3.196 1.00 0.00 H new ATOM 0 HG LEU A 116 -6.689 -0.324 -4.586 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.360 -1.490 -2.876 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -4.353 -0.457 -3.918 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.770 0.078 -2.273 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -7.733 -0.896 -2.434 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -7.299 0.711 -1.802 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -8.445 0.566 -3.157 1.00 0.00 H new ATOM 1709 N VAL A 117 -7.581 4.791 -4.478 1.00 0.00 N ATOM 1710 CA VAL A 117 -7.357 6.204 -4.731 1.00 0.00 C ATOM 1711 C VAL A 117 -6.547 6.802 -3.579 1.00 0.00 C ATOM 1712 O VAL A 117 -7.044 6.916 -2.460 1.00 0.00 O ATOM 1713 CB VAL A 117 -8.694 6.915 -4.953 1.00 0.00 C ATOM 1714 CG1 VAL A 117 -8.486 8.286 -5.599 1.00 0.00 C ATOM 1715 CG2 VAL A 117 -9.640 6.052 -5.790 1.00 0.00 C ATOM 0 H VAL A 117 -8.286 4.591 -3.769 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.776 6.341 -5.643 1.00 0.00 H new ATOM 0 HB VAL A 117 -9.156 7.072 -3.978 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -9.452 8.769 -5.746 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.866 8.904 -4.950 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.992 8.163 -6.563 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.583 6.580 -5.933 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.186 5.850 -6.760 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.826 5.110 -5.274 1.00 0.00 H new ATOM 1725 N ILE A 118 -5.313 7.168 -3.893 1.00 0.00 N ATOM 1726 CA ILE A 118 -4.429 7.751 -2.898 1.00 0.00 C ATOM 1727 C ILE A 118 -4.317 9.258 -3.142 1.00 0.00 C ATOM 1728 O ILE A 118 -4.464 9.720 -4.272 1.00 0.00 O ATOM 1729 CB ILE A 118 -3.081 7.028 -2.889 1.00 0.00 C ATOM 1730 CG1 ILE A 118 -2.200 7.496 -4.050 1.00 0.00 C ATOM 1731 CG2 ILE A 118 -3.273 5.510 -2.891 1.00 0.00 C ATOM 1732 CD1 ILE A 118 -1.118 8.462 -3.563 1.00 0.00 C ATOM 0 H ILE A 118 -4.904 7.072 -4.823 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.842 7.619 -1.898 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.561 7.286 -1.966 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -1.734 6.634 -4.528 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -2.816 7.985 -4.805 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -2.299 5.020 -2.885 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.835 5.213 -2.005 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -3.822 5.214 -3.785 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -0.506 8.779 -4.408 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -1.587 9.334 -3.107 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -0.489 7.962 -2.827 1.00 0.00 H new ATOM 1744 N LEU A 119 -4.058 9.982 -2.063 1.00 0.00 N ATOM 1745 CA LEU A 119 -3.925 11.426 -2.145 1.00 0.00 C ATOM 1746 C LEU A 119 -2.724 11.872 -1.309 1.00 0.00 C ATOM 1747 O LEU A 119 -2.684 11.642 -0.101 1.00 0.00 O ATOM 1748 CB LEU A 119 -5.236 12.109 -1.750 1.00 0.00 C ATOM 1749 CG LEU A 119 -5.300 13.621 -1.976 1.00 0.00 C ATOM 1750 CD1 LEU A 119 -4.450 14.365 -0.944 1.00 0.00 C ATOM 1751 CD2 LEU A 119 -4.905 13.979 -3.410 1.00 0.00 C ATOM 0 H LEU A 119 -3.937 9.595 -1.127 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.730 11.732 -3.173 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -6.048 11.644 -2.309 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.422 11.911 -0.694 1.00 0.00 H new ATOM 0 HG LEU A 119 -6.332 13.944 -1.837 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -4.512 15.438 -1.127 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -4.819 14.145 0.058 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.412 14.043 -1.027 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.959 15.059 -3.543 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.887 13.640 -3.602 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.587 13.493 -4.107 1.00 0.00 H new ATOM 1763 N ARG A 120 -1.774 12.502 -1.984 1.00 0.00 N ATOM 1764 CA ARG A 120 -0.575 12.982 -1.319 1.00 0.00 C ATOM 1765 C ARG A 120 -0.513 14.510 -1.373 1.00 0.00 C ATOM 1766 O ARG A 120 -1.032 15.123 -2.304 1.00 0.00 O ATOM 1767 CB ARG A 120 0.684 12.405 -1.968 1.00 0.00 C ATOM 1768 CG ARG A 120 1.889 12.527 -1.033 1.00 0.00 C ATOM 1769 CD ARG A 120 2.681 11.219 -0.984 1.00 0.00 C ATOM 1770 NE ARG A 120 4.071 11.452 -1.434 1.00 0.00 N ATOM 1771 CZ ARG A 120 5.076 10.585 -1.249 1.00 0.00 C ATOM 1772 NH1 ARG A 120 4.851 9.423 -0.620 1.00 0.00 N ATOM 1773 NH2 ARG A 120 6.306 10.880 -1.691 1.00 0.00 N ATOM 0 H ARG A 120 -1.811 12.691 -2.986 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.618 12.653 -0.281 1.00 0.00 H new ATOM 0 HB2 ARG A 120 0.520 11.357 -2.220 1.00 0.00 H new ATOM 0 HB3 ARG A 120 0.889 12.929 -2.901 1.00 0.00 H new ATOM 0 HG2 ARG A 120 2.536 13.336 -1.372 1.00 0.00 H new ATOM 0 HG3 ARG A 120 1.551 12.789 -0.031 1.00 0.00 H new ATOM 0 HD2 ARG A 120 2.680 10.822 0.031 1.00 0.00 H new ATOM 0 HD3 ARG A 120 2.205 10.472 -1.619 1.00 0.00 H new ATOM 0 HE ARG A 120 4.277 12.327 -1.915 1.00 0.00 H new ATOM 0 HH11 ARG A 120 3.915 9.199 -0.282 1.00 0.00 H new ATOM 0 HH12 ARG A 120 5.616 8.763 -0.479 1.00 0.00 H new ATOM 0 HH21 ARG A 120 6.478 11.765 -2.169 1.00 0.00 H new ATOM 0 HH22 ARG A 120 7.071 10.220 -1.550 1.00 0.00 H new