USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=20 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 84 ASN :FLIP amide:sc= -18.4! C(o=-23!,f=-21!) USER MOD Set 1.2: A 103 SER OG : rot 89:sc= -2.79 USER MOD Set 2.1: A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 77 ASN :FLIP amide:sc= -2.75 F(o=-5.7!,f=-2.7) USER MOD Set 3.1: A 24 GLN : amide:sc= -0.581 K(o=-1.6,f=-9.4!) USER MOD Set 3.2: A 26 THR OG1 : rot 55:sc= -0.996! USER MOD Single : A 32 ASN :FLIP amide:sc= -0.717 F(o=-1.7!,f=-0.72) USER MOD Single : A 34 SER OG : rot -120:sc= -1.18 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= -0.372 K(o=-0.37,f=-3!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot -170:sc= -0.268 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.954 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.472 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 HE2:sc= -6.8! C(o=-6.8!,f=-6.9!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 180:sc= -0.404 (180deg=-0.404) USER MOD Single : A 79 GLN : amide:sc= -0.722 K(o=-0.72,f=-1.3) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 SER OG : rot 180:sc= -0.643 USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 MET CE :methyl 178:sc= -1.84 (180deg=-1.92) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl -114:sc= -11.4! (180deg=-17.2!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl -151:sc= -0.105 (180deg=-0.23) USER MOD Single : A 109 ASN : amide:sc= -0.555 K(o=-0.56,f=-1.1!) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= -6.02! C(o=-6!,f=-6.7!) USER MOD ----------------------------------------------------------------- ATOM 283 N GLU A 23 -1.635 15.634 -5.510 1.00 0.00 N ATOM 284 CA GLU A 23 -1.298 14.555 -6.423 1.00 0.00 C ATOM 285 C GLU A 23 -2.128 13.310 -6.104 1.00 0.00 C ATOM 286 O GLU A 23 -2.112 12.822 -4.975 1.00 0.00 O ATOM 287 CB GLU A 23 0.199 14.243 -6.374 1.00 0.00 C ATOM 288 CG GLU A 23 0.937 14.908 -7.538 1.00 0.00 C ATOM 289 CD GLU A 23 0.518 14.292 -8.875 1.00 0.00 C ATOM 290 OE1 GLU A 23 0.432 13.046 -8.923 1.00 0.00 O ATOM 291 OE2 GLU A 23 0.295 15.082 -9.818 1.00 0.00 O ATOM 0 HA GLU A 23 -1.536 14.876 -7.437 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.616 14.591 -5.429 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.351 13.164 -6.412 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.726 15.977 -7.544 1.00 0.00 H new ATOM 0 HG3 GLU A 23 2.013 14.796 -7.403 1.00 0.00 H new ATOM 298 N GLN A 24 -2.834 12.832 -7.118 1.00 0.00 N ATOM 299 CA GLN A 24 -3.669 11.654 -6.959 1.00 0.00 C ATOM 300 C GLN A 24 -3.260 10.574 -7.963 1.00 0.00 C ATOM 301 O GLN A 24 -2.939 10.879 -9.111 1.00 0.00 O ATOM 302 CB GLN A 24 -5.150 12.007 -7.107 1.00 0.00 C ATOM 303 CG GLN A 24 -6.028 10.763 -6.962 1.00 0.00 C ATOM 304 CD GLN A 24 -6.470 10.241 -8.331 1.00 0.00 C ATOM 305 OE1 GLN A 24 -5.700 9.671 -9.085 1.00 0.00 O ATOM 306 NE2 GLN A 24 -7.751 10.469 -8.609 1.00 0.00 N ATOM 0 H GLN A 24 -2.845 13.239 -8.053 1.00 0.00 H new ATOM 0 HA GLN A 24 -3.522 11.262 -5.953 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -5.429 12.743 -6.353 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.322 12.467 -8.080 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.478 9.985 -6.432 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -6.904 11.000 -6.359 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -8.342 10.952 -7.932 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.143 10.160 -9.499 1.00 0.00 H new ATOM 315 N LEU A 25 -3.284 9.335 -7.494 1.00 0.00 N ATOM 316 CA LEU A 25 -2.920 8.209 -8.337 1.00 0.00 C ATOM 317 C LEU A 25 -3.931 7.079 -8.136 1.00 0.00 C ATOM 318 O LEU A 25 -4.085 6.569 -7.027 1.00 0.00 O ATOM 319 CB LEU A 25 -1.471 7.792 -8.076 1.00 0.00 C ATOM 320 CG LEU A 25 -0.395 8.762 -8.566 1.00 0.00 C ATOM 321 CD1 LEU A 25 0.974 8.403 -7.984 1.00 0.00 C ATOM 322 CD2 LEU A 25 -0.369 8.827 -10.094 1.00 0.00 C ATOM 0 H LEU A 25 -3.550 9.086 -6.541 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.962 8.491 -9.389 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.342 7.650 -7.003 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.302 6.824 -8.548 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.646 9.760 -8.206 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.721 9.108 -8.349 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.931 8.451 -6.896 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.247 7.394 -8.292 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.405 9.524 -10.415 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.156 7.837 -10.497 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.338 9.167 -10.460 1.00 0.00 H new ATOM 334 N THR A 26 -4.595 6.721 -9.225 1.00 0.00 N ATOM 335 CA THR A 26 -5.587 5.660 -9.182 1.00 0.00 C ATOM 336 C THR A 26 -5.001 4.359 -9.734 1.00 0.00 C ATOM 337 O THR A 26 -4.800 4.227 -10.940 1.00 0.00 O ATOM 338 CB THR A 26 -6.825 6.140 -9.943 1.00 0.00 C ATOM 339 OG1 THR A 26 -6.914 7.526 -9.622 1.00 0.00 O ATOM 340 CG2 THR A 26 -8.121 5.545 -9.388 1.00 0.00 C ATOM 0 H THR A 26 -4.466 7.147 -10.143 1.00 0.00 H new ATOM 0 HA THR A 26 -5.883 5.437 -8.157 1.00 0.00 H new ATOM 0 HB THR A 26 -6.727 5.878 -10.997 1.00 0.00 H new ATOM 0 HG1 THR A 26 -6.069 7.969 -9.848 1.00 0.00 H new ATOM 0 HG21 THR A 26 -8.968 5.918 -9.963 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.083 4.458 -9.461 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.236 5.835 -8.344 1.00 0.00 H new ATOM 348 N LEU A 27 -4.745 3.431 -8.824 1.00 0.00 N ATOM 349 CA LEU A 27 -4.186 2.144 -9.205 1.00 0.00 C ATOM 350 C LEU A 27 -5.248 1.058 -9.021 1.00 0.00 C ATOM 351 O LEU A 27 -5.854 0.951 -7.956 1.00 0.00 O ATOM 352 CB LEU A 27 -2.891 1.875 -8.437 1.00 0.00 C ATOM 353 CG LEU A 27 -1.794 2.932 -8.579 1.00 0.00 C ATOM 354 CD1 LEU A 27 -1.449 3.169 -10.051 1.00 0.00 C ATOM 355 CD2 LEU A 27 -2.186 4.228 -7.867 1.00 0.00 C ATOM 0 H LEU A 27 -4.914 3.544 -7.824 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.910 2.145 -10.259 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.134 1.772 -7.379 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.489 0.917 -8.766 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.893 2.557 -8.093 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.667 3.925 -10.124 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.098 2.238 -10.497 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -2.337 3.513 -10.582 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.389 4.962 -7.983 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -3.106 4.619 -8.302 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.343 4.028 -6.807 1.00 0.00 H new ATOM 367 N GLU A 28 -5.440 0.279 -10.075 1.00 0.00 N ATOM 368 CA GLU A 28 -6.418 -0.796 -10.044 1.00 0.00 C ATOM 369 C GLU A 28 -5.714 -2.151 -9.943 1.00 0.00 C ATOM 370 O GLU A 28 -4.655 -2.350 -10.535 1.00 0.00 O ATOM 371 CB GLU A 28 -7.331 -0.742 -11.270 1.00 0.00 C ATOM 372 CG GLU A 28 -8.536 0.167 -11.017 1.00 0.00 C ATOM 373 CD GLU A 28 -8.227 1.611 -11.416 1.00 0.00 C ATOM 374 OE1 GLU A 28 -7.472 2.259 -10.659 1.00 0.00 O ATOM 375 OE2 GLU A 28 -8.752 2.034 -12.468 1.00 0.00 O ATOM 0 H GLU A 28 -4.935 0.371 -10.956 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.043 -0.667 -9.161 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.770 -0.377 -12.130 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.674 -1.747 -11.517 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -9.394 -0.195 -11.583 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.810 0.128 -9.963 1.00 0.00 H new ATOM 382 N ILE A 29 -6.332 -3.047 -9.188 1.00 0.00 N ATOM 383 CA ILE A 29 -5.778 -4.378 -9.002 1.00 0.00 C ATOM 384 C ILE A 29 -6.897 -5.414 -9.132 1.00 0.00 C ATOM 385 O ILE A 29 -7.967 -5.253 -8.548 1.00 0.00 O ATOM 386 CB ILE A 29 -5.015 -4.460 -7.679 1.00 0.00 C ATOM 387 CG1 ILE A 29 -3.642 -3.794 -7.795 1.00 0.00 C ATOM 388 CG2 ILE A 29 -4.910 -5.908 -7.195 1.00 0.00 C ATOM 389 CD1 ILE A 29 -2.676 -4.666 -8.600 1.00 0.00 C ATOM 0 H ILE A 29 -7.210 -2.878 -8.698 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.047 -4.599 -9.780 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.578 -3.909 -6.926 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -3.745 -2.821 -8.275 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.234 -3.617 -6.800 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.363 -5.938 -6.253 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -5.910 -6.316 -7.047 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.382 -6.503 -7.940 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.708 -4.170 -8.667 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.556 -5.629 -8.104 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.075 -4.821 -9.602 1.00 0.00 H new ATOM 401 N PRO A 30 -6.602 -6.481 -9.922 1.00 0.00 N ATOM 402 CA PRO A 30 -7.571 -7.543 -10.136 1.00 0.00 C ATOM 403 C PRO A 30 -7.680 -8.442 -8.902 1.00 0.00 C ATOM 404 O PRO A 30 -6.709 -8.614 -8.167 1.00 0.00 O ATOM 405 CB PRO A 30 -7.076 -8.283 -11.368 1.00 0.00 C ATOM 406 CG PRO A 30 -5.613 -7.904 -11.523 1.00 0.00 C ATOM 407 CD PRO A 30 -5.345 -6.704 -10.629 1.00 0.00 C ATOM 0 HA PRO A 30 -8.582 -7.166 -10.293 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -7.190 -9.360 -11.248 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.649 -7.998 -12.251 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.971 -8.739 -11.244 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.389 -7.663 -12.562 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.529 -6.902 -9.934 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.059 -5.830 -11.214 1.00 0.00 H new ATOM 415 N LEU A 31 -8.871 -8.991 -8.714 1.00 0.00 N ATOM 416 CA LEU A 31 -9.121 -9.868 -7.582 1.00 0.00 C ATOM 417 C LEU A 31 -9.794 -11.150 -8.075 1.00 0.00 C ATOM 418 O LEU A 31 -10.852 -11.531 -7.577 1.00 0.00 O ATOM 419 CB LEU A 31 -9.915 -9.133 -6.500 1.00 0.00 C ATOM 420 CG LEU A 31 -9.416 -7.733 -6.136 1.00 0.00 C ATOM 421 CD1 LEU A 31 -10.346 -7.066 -5.121 1.00 0.00 C ATOM 422 CD2 LEU A 31 -7.968 -7.778 -5.644 1.00 0.00 C ATOM 0 H LEU A 31 -9.674 -8.846 -9.326 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.182 -10.161 -7.112 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -10.951 -9.054 -6.829 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -9.913 -9.744 -5.597 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.431 -7.120 -7.037 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -9.968 -6.072 -4.880 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -11.346 -6.981 -5.545 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.387 -7.669 -4.214 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.638 -6.770 -5.392 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -7.904 -8.413 -4.760 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.329 -8.183 -6.429 1.00 0.00 H new ATOM 434 N ASN A 32 -9.152 -11.781 -9.047 1.00 0.00 N ATOM 435 CA ASN A 32 -9.676 -13.013 -9.613 1.00 0.00 C ATOM 436 C ASN A 32 -9.180 -14.201 -8.785 1.00 0.00 C ATOM 437 O ASN A 32 -9.981 -14.974 -8.261 1.00 0.00 O ATOM 438 CB ASN A 32 -9.194 -13.207 -11.052 1.00 0.00 C ATOM 439 CG ASN A 32 -9.518 -11.982 -11.909 1.00 0.00 C ATOM 440 OD1 ASN A 32 -8.557 -11.063 -11.924 1.00 0.00 O flip ATOM 441 ND2 ASN A 32 -10.572 -11.878 -12.515 1.00 0.00 N flip ATOM 0 H ASN A 32 -8.274 -11.463 -9.457 1.00 0.00 H new ATOM 0 HA ASN A 32 -10.764 -12.953 -9.602 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -8.119 -13.385 -11.058 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.666 -14.091 -11.481 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -11.267 -12.622 -12.460 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -10.758 -11.047 -13.077 1.00 0.00 H new ATOM 448 N ASP A 33 -7.863 -14.307 -8.691 1.00 0.00 N ATOM 449 CA ASP A 33 -7.252 -15.387 -7.935 1.00 0.00 C ATOM 450 C ASP A 33 -7.049 -14.939 -6.486 1.00 0.00 C ATOM 451 O ASP A 33 -7.263 -15.715 -5.557 1.00 0.00 O ATOM 452 CB ASP A 33 -5.884 -15.757 -8.511 1.00 0.00 C ATOM 453 CG ASP A 33 -5.675 -17.250 -8.775 1.00 0.00 C ATOM 454 OD1 ASP A 33 -6.488 -18.038 -8.247 1.00 0.00 O ATOM 455 OD2 ASP A 33 -4.706 -17.568 -9.498 1.00 0.00 O ATOM 0 H ASP A 33 -7.202 -13.663 -9.126 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.913 -16.252 -7.990 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -5.742 -15.215 -9.446 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -5.112 -15.414 -7.823 1.00 0.00 H new ATOM 460 N SER A 34 -6.638 -13.688 -6.340 1.00 0.00 N ATOM 461 CA SER A 34 -6.404 -13.127 -5.020 1.00 0.00 C ATOM 462 C SER A 34 -7.738 -12.810 -4.342 1.00 0.00 C ATOM 463 O SER A 34 -7.836 -12.831 -3.116 1.00 0.00 O ATOM 464 CB SER A 34 -5.539 -11.868 -5.102 1.00 0.00 C ATOM 465 OG SER A 34 -4.392 -11.952 -4.261 1.00 0.00 O ATOM 0 H SER A 34 -6.461 -13.047 -7.114 1.00 0.00 H new ATOM 0 HA SER A 34 -5.867 -13.866 -4.425 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.222 -11.713 -6.133 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.134 -11.000 -4.818 1.00 0.00 H new ATOM 0 HG SER A 34 -4.413 -11.224 -3.605 1.00 0.00 H new ATOM 471 N GLY A 35 -8.733 -12.524 -5.169 1.00 0.00 N ATOM 472 CA GLY A 35 -10.057 -12.204 -4.664 1.00 0.00 C ATOM 473 C GLY A 35 -10.495 -13.208 -3.596 1.00 0.00 C ATOM 474 O GLY A 35 -11.107 -12.830 -2.598 1.00 0.00 O ATOM 0 H GLY A 35 -8.649 -12.507 -6.185 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.056 -11.198 -4.244 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -10.773 -12.206 -5.485 1.00 0.00 H new ATOM 478 N SER A 36 -10.163 -14.467 -3.841 1.00 0.00 N ATOM 479 CA SER A 36 -10.514 -15.528 -2.913 1.00 0.00 C ATOM 480 C SER A 36 -10.351 -15.038 -1.472 1.00 0.00 C ATOM 481 O SER A 36 -11.299 -15.075 -0.689 1.00 0.00 O ATOM 482 CB SER A 36 -9.657 -16.773 -3.149 1.00 0.00 C ATOM 483 OG SER A 36 -10.233 -17.641 -4.121 1.00 0.00 O ATOM 0 H SER A 36 -9.654 -14.776 -4.669 1.00 0.00 H new ATOM 0 HA SER A 36 -11.556 -15.799 -3.083 1.00 0.00 H new ATOM 0 HB2 SER A 36 -8.662 -16.471 -3.476 1.00 0.00 H new ATOM 0 HB3 SER A 36 -9.534 -17.312 -2.209 1.00 0.00 H new ATOM 0 HG SER A 36 -9.655 -18.423 -4.245 1.00 0.00 H new ATOM 489 N ALA A 37 -9.143 -14.589 -1.167 1.00 0.00 N ATOM 490 CA ALA A 37 -8.844 -14.092 0.166 1.00 0.00 C ATOM 491 C ALA A 37 -9.035 -12.574 0.194 1.00 0.00 C ATOM 492 O ALA A 37 -9.304 -11.998 1.247 1.00 0.00 O ATOM 493 CB ALA A 37 -7.426 -14.509 0.560 1.00 0.00 C ATOM 0 H ALA A 37 -8.360 -14.559 -1.819 1.00 0.00 H new ATOM 0 HA ALA A 37 -9.526 -14.524 0.899 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.202 -14.136 1.559 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.351 -15.596 0.553 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -6.713 -14.092 -0.151 1.00 0.00 H new ATOM 499 N GLY A 38 -8.888 -11.970 -0.976 1.00 0.00 N ATOM 500 CA GLY A 38 -9.041 -10.530 -1.098 1.00 0.00 C ATOM 501 C GLY A 38 -7.736 -9.877 -1.559 1.00 0.00 C ATOM 502 O GLY A 38 -6.788 -10.569 -1.929 1.00 0.00 O ATOM 0 H GLY A 38 -8.665 -12.451 -1.847 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.836 -10.304 -1.809 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.343 -10.110 -0.138 1.00 0.00 H new ATOM 506 N LEU A 39 -7.729 -8.553 -1.522 1.00 0.00 N ATOM 507 CA LEU A 39 -6.556 -7.799 -1.931 1.00 0.00 C ATOM 508 C LEU A 39 -5.297 -8.520 -1.446 1.00 0.00 C ATOM 509 O LEU A 39 -4.526 -9.041 -2.251 1.00 0.00 O ATOM 510 CB LEU A 39 -6.657 -6.349 -1.453 1.00 0.00 C ATOM 511 CG LEU A 39 -7.519 -5.419 -2.308 1.00 0.00 C ATOM 512 CD1 LEU A 39 -7.852 -4.131 -1.553 1.00 0.00 C ATOM 513 CD2 LEU A 39 -6.851 -5.138 -3.656 1.00 0.00 C ATOM 0 H LEU A 39 -8.517 -7.983 -1.215 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.496 -7.748 -3.018 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.054 -6.349 -0.438 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -5.651 -5.934 -1.401 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.463 -5.923 -2.515 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.466 -3.488 -2.184 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -8.399 -4.374 -0.642 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.929 -3.612 -1.294 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.484 -4.474 -4.245 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -5.883 -4.664 -3.491 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.709 -6.075 -4.194 1.00 0.00 H new ATOM 525 N GLY A 40 -5.126 -8.527 -0.132 1.00 0.00 N ATOM 526 CA GLY A 40 -3.974 -9.176 0.470 1.00 0.00 C ATOM 527 C GLY A 40 -2.971 -8.143 0.986 1.00 0.00 C ATOM 528 O GLY A 40 -1.766 -8.285 0.781 1.00 0.00 O ATOM 0 H GLY A 40 -5.767 -8.093 0.533 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.300 -9.814 1.292 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -3.491 -9.822 -0.263 1.00 0.00 H new ATOM 532 N VAL A 41 -3.504 -7.125 1.646 1.00 0.00 N ATOM 533 CA VAL A 41 -2.670 -6.068 2.193 1.00 0.00 C ATOM 534 C VAL A 41 -3.252 -5.606 3.530 1.00 0.00 C ATOM 535 O VAL A 41 -4.440 -5.791 3.792 1.00 0.00 O ATOM 536 CB VAL A 41 -2.532 -4.932 1.177 1.00 0.00 C ATOM 537 CG1 VAL A 41 -1.482 -5.270 0.116 1.00 0.00 C ATOM 538 CG2 VAL A 41 -3.880 -4.608 0.530 1.00 0.00 C ATOM 0 H VAL A 41 -4.503 -7.010 1.814 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.663 -6.437 2.387 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.195 -4.044 1.711 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.404 -4.446 -0.594 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.517 -5.428 0.597 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -1.777 -6.177 -0.412 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.754 -3.797 -0.188 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.259 -5.492 0.016 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.589 -4.304 1.300 1.00 0.00 H new ATOM 548 N SER A 42 -2.389 -5.013 4.342 1.00 0.00 N ATOM 549 CA SER A 42 -2.802 -4.523 5.646 1.00 0.00 C ATOM 550 C SER A 42 -2.752 -2.994 5.670 1.00 0.00 C ATOM 551 O SER A 42 -1.830 -2.391 5.122 1.00 0.00 O ATOM 552 CB SER A 42 -1.922 -5.101 6.756 1.00 0.00 C ATOM 553 OG SER A 42 -2.643 -5.278 7.972 1.00 0.00 O ATOM 0 H SER A 42 -1.405 -4.861 4.122 1.00 0.00 H new ATOM 0 HA SER A 42 -3.826 -4.849 5.825 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.515 -6.059 6.434 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.075 -4.437 6.930 1.00 0.00 H new ATOM 0 HG SER A 42 -2.047 -5.650 8.655 1.00 0.00 H new ATOM 559 N LEU A 43 -3.754 -2.411 6.311 1.00 0.00 N ATOM 560 CA LEU A 43 -3.836 -0.964 6.414 1.00 0.00 C ATOM 561 C LEU A 43 -3.794 -0.559 7.889 1.00 0.00 C ATOM 562 O LEU A 43 -3.787 -1.415 8.772 1.00 0.00 O ATOM 563 CB LEU A 43 -5.065 -0.442 5.668 1.00 0.00 C ATOM 564 CG LEU A 43 -5.397 -1.144 4.349 1.00 0.00 C ATOM 565 CD1 LEU A 43 -6.318 -0.280 3.485 1.00 0.00 C ATOM 566 CD2 LEU A 43 -4.121 -1.543 3.604 1.00 0.00 C ATOM 0 H LEU A 43 -4.516 -2.915 6.764 1.00 0.00 H new ATOM 0 HA LEU A 43 -2.977 -0.499 5.930 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.928 -0.525 6.328 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.919 0.619 5.465 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.937 -2.063 4.577 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.538 -0.802 2.554 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.247 -0.088 4.022 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.826 0.667 3.263 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.385 -2.040 2.670 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.533 -0.652 3.387 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.535 -2.222 4.223 1.00 0.00 H new ATOM 578 N LYS A 44 -3.768 0.747 8.110 1.00 0.00 N ATOM 579 CA LYS A 44 -3.727 1.276 9.463 1.00 0.00 C ATOM 580 C LYS A 44 -4.710 2.443 9.580 1.00 0.00 C ATOM 581 O LYS A 44 -4.817 3.263 8.669 1.00 0.00 O ATOM 582 CB LYS A 44 -2.293 1.639 9.853 1.00 0.00 C ATOM 583 CG LYS A 44 -1.921 3.032 9.340 1.00 0.00 C ATOM 584 CD LYS A 44 -0.518 3.431 9.804 1.00 0.00 C ATOM 585 CE LYS A 44 -0.067 4.728 9.131 1.00 0.00 C ATOM 586 NZ LYS A 44 1.011 5.371 9.915 1.00 0.00 N ATOM 0 H LYS A 44 -3.775 1.454 7.375 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.045 0.518 10.178 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -2.188 1.607 10.937 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.603 0.901 9.444 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -1.965 3.046 8.251 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.648 3.761 9.698 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -0.511 3.557 10.887 1.00 0.00 H new ATOM 0 HD3 LYS A 44 0.187 2.632 9.572 1.00 0.00 H new ATOM 0 HE2 LYS A 44 0.286 4.517 8.121 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -0.913 5.409 9.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 1.306 6.250 9.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 0.662 5.590 10.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.824 4.725 9.982 1.00 0.00 H new ATOM 600 N GLY A 45 -5.404 2.480 10.708 1.00 0.00 N ATOM 601 CA GLY A 45 -6.375 3.532 10.955 1.00 0.00 C ATOM 602 C GLY A 45 -5.792 4.611 11.870 1.00 0.00 C ATOM 603 O GLY A 45 -5.442 4.336 13.016 1.00 0.00 O ATOM 0 H GLY A 45 -5.313 1.798 11.461 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.681 3.979 10.009 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -7.269 3.107 11.411 1.00 0.00 H new ATOM 607 N ASN A 46 -5.707 5.818 11.329 1.00 0.00 N ATOM 608 CA ASN A 46 -5.173 6.940 12.082 1.00 0.00 C ATOM 609 C ASN A 46 -6.328 7.810 12.580 1.00 0.00 C ATOM 610 O ASN A 46 -7.255 8.108 11.829 1.00 0.00 O ATOM 611 CB ASN A 46 -4.269 7.811 11.206 1.00 0.00 C ATOM 612 CG ASN A 46 -2.879 7.956 11.828 1.00 0.00 C ATOM 613 OD1 ASN A 46 -2.613 7.505 12.930 1.00 0.00 O ATOM 614 ND2 ASN A 46 -2.010 8.609 11.062 1.00 0.00 N ATOM 0 H ASN A 46 -5.999 6.043 10.378 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.593 6.542 12.915 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.183 7.369 10.213 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.719 8.796 11.079 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -1.055 8.758 11.387 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -2.299 8.961 10.149 1.00 0.00 H new ATOM 621 N LYS A 47 -6.235 8.193 13.845 1.00 0.00 N ATOM 622 CA LYS A 47 -7.262 9.023 14.454 1.00 0.00 C ATOM 623 C LYS A 47 -6.598 10.181 15.200 1.00 0.00 C ATOM 624 O LYS A 47 -5.493 10.037 15.721 1.00 0.00 O ATOM 625 CB LYS A 47 -8.186 8.175 15.330 1.00 0.00 C ATOM 626 CG LYS A 47 -9.568 8.821 15.454 1.00 0.00 C ATOM 627 CD LYS A 47 -10.292 8.330 16.709 1.00 0.00 C ATOM 628 CE LYS A 47 -11.769 8.729 16.681 1.00 0.00 C ATOM 629 NZ LYS A 47 -12.352 8.653 18.039 1.00 0.00 N ATOM 0 H LYS A 47 -5.465 7.944 14.465 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.902 9.462 13.689 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -8.284 7.177 14.902 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.746 8.056 16.320 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.465 9.905 15.490 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -10.163 8.587 14.571 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -10.206 7.246 16.782 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.815 8.748 17.595 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -11.871 9.742 16.291 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -12.317 8.071 16.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.355 8.927 18.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -12.272 7.680 18.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -11.840 9.299 18.673 1.00 0.00 H new ATOM 643 N SER A 48 -7.300 11.305 15.229 1.00 0.00 N ATOM 644 CA SER A 48 -6.793 12.487 15.903 1.00 0.00 C ATOM 645 C SER A 48 -7.655 12.801 17.128 1.00 0.00 C ATOM 646 O SER A 48 -8.881 12.726 17.064 1.00 0.00 O ATOM 647 CB SER A 48 -6.758 13.689 14.957 1.00 0.00 C ATOM 648 OG SER A 48 -5.436 13.979 14.510 1.00 0.00 O ATOM 0 H SER A 48 -8.216 11.421 14.796 1.00 0.00 H new ATOM 0 HA SER A 48 -5.772 12.284 16.227 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.397 13.491 14.096 1.00 0.00 H new ATOM 0 HB3 SER A 48 -7.169 14.562 15.465 1.00 0.00 H new ATOM 0 HG SER A 48 -5.431 14.839 14.040 1.00 0.00 H new ATOM 654 N ARG A 49 -6.979 13.147 18.214 1.00 0.00 N ATOM 655 CA ARG A 49 -7.668 13.472 19.452 1.00 0.00 C ATOM 656 C ARG A 49 -7.986 14.968 19.504 1.00 0.00 C ATOM 657 O ARG A 49 -9.035 15.366 20.009 1.00 0.00 O ATOM 658 CB ARG A 49 -6.821 13.095 20.669 1.00 0.00 C ATOM 659 CG ARG A 49 -7.692 12.509 21.782 1.00 0.00 C ATOM 660 CD ARG A 49 -6.841 11.748 22.801 1.00 0.00 C ATOM 661 NE ARG A 49 -7.677 10.763 23.523 1.00 0.00 N ATOM 662 CZ ARG A 49 -8.612 11.090 24.425 1.00 0.00 C ATOM 663 NH1 ARG A 49 -8.837 12.377 24.722 1.00 0.00 N ATOM 664 NH2 ARG A 49 -9.323 10.129 25.032 1.00 0.00 N ATOM 0 H ARG A 49 -5.962 13.209 18.262 1.00 0.00 H new ATOM 0 HA ARG A 49 -8.595 12.898 19.477 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -6.061 12.370 20.377 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -6.296 13.976 21.039 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -8.236 13.310 22.283 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -8.436 11.839 21.352 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -6.021 11.239 22.295 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -6.395 12.447 23.509 1.00 0.00 H new ATOM 0 HE ARG A 49 -7.532 9.774 23.321 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -8.296 13.109 24.261 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -9.549 12.625 25.409 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -9.152 9.149 24.807 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -10.035 10.378 25.719 1.00 0.00 H new ATOM 678 N GLU A 50 -7.061 15.756 18.976 1.00 0.00 N ATOM 679 CA GLU A 50 -7.229 17.199 18.957 1.00 0.00 C ATOM 680 C GLU A 50 -8.501 17.575 18.194 1.00 0.00 C ATOM 681 O GLU A 50 -9.377 18.249 18.734 1.00 0.00 O ATOM 682 CB GLU A 50 -6.004 17.886 18.351 1.00 0.00 C ATOM 683 CG GLU A 50 -4.986 18.247 19.435 1.00 0.00 C ATOM 684 CD GLU A 50 -5.364 19.557 20.129 1.00 0.00 C ATOM 685 OE1 GLU A 50 -6.104 19.474 21.133 1.00 0.00 O ATOM 686 OE2 GLU A 50 -4.906 20.612 19.639 1.00 0.00 O ATOM 0 H GLU A 50 -6.192 15.422 18.558 1.00 0.00 H new ATOM 0 HA GLU A 50 -7.328 17.547 19.985 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.540 17.228 17.616 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -6.313 18.788 17.822 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.933 17.444 20.170 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -3.995 18.339 18.991 1.00 0.00 H new ATOM 693 N THR A 51 -8.563 17.121 16.950 1.00 0.00 N ATOM 694 CA THR A 51 -9.713 17.401 16.108 1.00 0.00 C ATOM 695 C THR A 51 -10.878 16.479 16.473 1.00 0.00 C ATOM 696 O THR A 51 -12.036 16.803 16.212 1.00 0.00 O ATOM 697 CB THR A 51 -9.272 17.275 14.648 1.00 0.00 C ATOM 698 OG1 THR A 51 -8.632 16.004 14.588 1.00 0.00 O ATOM 699 CG2 THR A 51 -8.166 18.268 14.283 1.00 0.00 C ATOM 0 H THR A 51 -7.835 16.561 16.506 1.00 0.00 H new ATOM 0 HA THR A 51 -10.081 18.415 16.265 1.00 0.00 H new ATOM 0 HB THR A 51 -10.130 17.432 13.994 1.00 0.00 H new ATOM 0 HG1 THR A 51 -8.316 15.840 13.675 1.00 0.00 H new ATOM 0 HG21 THR A 51 -7.890 18.137 13.237 1.00 0.00 H new ATOM 0 HG22 THR A 51 -8.525 19.285 14.439 1.00 0.00 H new ATOM 0 HG23 THR A 51 -7.295 18.090 14.913 1.00 0.00 H new ATOM 707 N GLY A 52 -10.531 15.348 17.069 1.00 0.00 N ATOM 708 CA GLY A 52 -11.534 14.377 17.472 1.00 0.00 C ATOM 709 C GLY A 52 -12.273 13.815 16.256 1.00 0.00 C ATOM 710 O GLY A 52 -13.491 13.647 16.288 1.00 0.00 O ATOM 0 H GLY A 52 -9.570 15.082 17.283 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -11.058 13.564 18.021 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -12.247 14.845 18.151 1.00 0.00 H new ATOM 714 N THR A 53 -11.505 13.540 15.212 1.00 0.00 N ATOM 715 CA THR A 53 -12.072 13.001 13.988 1.00 0.00 C ATOM 716 C THR A 53 -11.136 11.951 13.384 1.00 0.00 C ATOM 717 O THR A 53 -9.945 11.926 13.691 1.00 0.00 O ATOM 718 CB THR A 53 -12.361 14.171 13.045 1.00 0.00 C ATOM 719 OG1 THR A 53 -12.818 15.208 13.909 1.00 0.00 O ATOM 720 CG2 THR A 53 -13.553 13.900 12.124 1.00 0.00 C ATOM 0 H THR A 53 -10.495 13.680 15.189 1.00 0.00 H new ATOM 0 HA THR A 53 -13.011 12.482 14.182 1.00 0.00 H new ATOM 0 HB THR A 53 -11.477 14.379 12.442 1.00 0.00 H new ATOM 0 HG1 THR A 53 -13.027 16.006 13.380 1.00 0.00 H new ATOM 0 HG21 THR A 53 -13.715 14.761 11.476 1.00 0.00 H new ATOM 0 HG22 THR A 53 -13.349 13.020 11.514 1.00 0.00 H new ATOM 0 HG23 THR A 53 -14.445 13.726 12.725 1.00 0.00 H new ATOM 728 N ASP A 54 -11.711 11.110 12.536 1.00 0.00 N ATOM 729 CA ASP A 54 -10.943 10.061 11.887 1.00 0.00 C ATOM 730 C ASP A 54 -10.182 10.653 10.699 1.00 0.00 C ATOM 731 O ASP A 54 -10.790 11.090 9.723 1.00 0.00 O ATOM 732 CB ASP A 54 -11.859 8.956 11.358 1.00 0.00 C ATOM 733 CG ASP A 54 -13.155 9.445 10.709 1.00 0.00 C ATOM 734 OD1 ASP A 54 -13.105 9.744 9.496 1.00 0.00 O ATOM 735 OD2 ASP A 54 -14.167 9.509 11.440 1.00 0.00 O ATOM 0 H ASP A 54 -12.699 11.134 12.284 1.00 0.00 H new ATOM 0 HA ASP A 54 -10.257 9.640 12.622 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -11.306 8.365 10.628 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -12.112 8.289 12.182 1.00 0.00 H new ATOM 740 N LEU A 55 -8.862 10.649 10.821 1.00 0.00 N ATOM 741 CA LEU A 55 -8.012 11.180 9.769 1.00 0.00 C ATOM 742 C LEU A 55 -8.283 10.421 8.468 1.00 0.00 C ATOM 743 O LEU A 55 -8.265 11.009 7.388 1.00 0.00 O ATOM 744 CB LEU A 55 -6.545 11.153 10.202 1.00 0.00 C ATOM 745 CG LEU A 55 -6.210 11.915 11.486 1.00 0.00 C ATOM 746 CD1 LEU A 55 -4.775 11.631 11.934 1.00 0.00 C ATOM 747 CD2 LEU A 55 -6.472 13.413 11.319 1.00 0.00 C ATOM 0 H LEU A 55 -8.361 10.287 11.632 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.247 12.228 9.582 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.244 10.113 10.331 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.940 11.562 9.392 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.871 11.559 12.276 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -4.563 12.185 12.849 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -4.657 10.564 12.120 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.082 11.942 11.153 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.226 13.931 12.246 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.854 13.803 10.510 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.524 13.574 11.082 1.00 0.00 H new ATOM 759 N GLY A 56 -8.528 9.128 8.615 1.00 0.00 N ATOM 760 CA GLY A 56 -8.802 8.283 7.465 1.00 0.00 C ATOM 761 C GLY A 56 -8.038 6.961 7.561 1.00 0.00 C ATOM 762 O GLY A 56 -7.521 6.614 8.621 1.00 0.00 O ATOM 0 H GLY A 56 -8.543 8.644 9.513 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -9.872 8.085 7.402 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -8.520 8.805 6.551 1.00 0.00 H new ATOM 766 N ILE A 57 -7.991 6.259 6.438 1.00 0.00 N ATOM 767 CA ILE A 57 -7.299 4.983 6.382 1.00 0.00 C ATOM 768 C ILE A 57 -5.969 5.160 5.646 1.00 0.00 C ATOM 769 O ILE A 57 -5.870 5.968 4.723 1.00 0.00 O ATOM 770 CB ILE A 57 -8.202 3.910 5.770 1.00 0.00 C ATOM 771 CG1 ILE A 57 -9.494 3.757 6.575 1.00 0.00 C ATOM 772 CG2 ILE A 57 -7.456 2.582 5.627 1.00 0.00 C ATOM 773 CD1 ILE A 57 -9.214 3.152 7.953 1.00 0.00 C ATOM 0 H ILE A 57 -8.421 6.550 5.560 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.063 4.634 7.387 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.483 4.231 4.767 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -9.971 4.730 6.691 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -10.193 3.122 6.030 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -8.120 1.837 5.190 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -6.589 2.719 4.981 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.126 2.242 6.609 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -10.149 3.054 8.504 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.759 2.169 7.833 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -8.534 3.802 8.504 1.00 0.00 H new ATOM 785 N PHE A 58 -4.981 4.393 6.081 1.00 0.00 N ATOM 786 CA PHE A 58 -3.662 4.455 5.475 1.00 0.00 C ATOM 787 C PHE A 58 -3.081 3.053 5.281 1.00 0.00 C ATOM 788 O PHE A 58 -3.240 2.187 6.140 1.00 0.00 O ATOM 789 CB PHE A 58 -2.765 5.238 6.436 1.00 0.00 C ATOM 790 CG PHE A 58 -3.238 6.668 6.703 1.00 0.00 C ATOM 791 CD1 PHE A 58 -4.367 6.887 7.430 1.00 0.00 C ATOM 792 CD2 PHE A 58 -2.530 7.721 6.214 1.00 0.00 C ATOM 793 CE1 PHE A 58 -4.806 8.214 7.678 1.00 0.00 C ATOM 794 CE2 PHE A 58 -2.969 9.049 6.462 1.00 0.00 C ATOM 795 CZ PHE A 58 -4.098 9.267 7.189 1.00 0.00 C ATOM 0 H PHE A 58 -5.067 3.725 6.847 1.00 0.00 H new ATOM 0 HA PHE A 58 -3.724 4.932 4.497 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.710 4.702 7.383 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.755 5.271 6.029 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.929 6.051 7.819 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.634 7.548 5.637 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.702 8.387 8.255 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.407 9.885 6.074 1.00 0.00 H new ATOM 0 HZ PHE A 58 -4.432 10.277 7.378 1.00 0.00 H new ATOM 805 N ILE A 59 -2.419 2.874 4.148 1.00 0.00 N ATOM 806 CA ILE A 59 -1.813 1.592 3.830 1.00 0.00 C ATOM 807 C ILE A 59 -0.691 1.301 4.829 1.00 0.00 C ATOM 808 O ILE A 59 -0.019 2.219 5.297 1.00 0.00 O ATOM 809 CB ILE A 59 -1.358 1.561 2.369 1.00 0.00 C ATOM 810 CG1 ILE A 59 -2.516 1.898 1.428 1.00 0.00 C ATOM 811 CG2 ILE A 59 -0.711 0.219 2.025 1.00 0.00 C ATOM 812 CD1 ILE A 59 -2.081 1.794 -0.036 1.00 0.00 C ATOM 0 H ILE A 59 -2.289 3.595 3.439 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.545 0.790 3.929 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.597 2.329 2.231 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -3.349 1.219 1.613 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -2.875 2.906 1.634 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.397 0.223 0.981 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.157 0.059 2.665 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -1.431 -0.583 2.184 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -2.923 2.038 -0.684 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.264 2.491 -0.223 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.746 0.778 -0.245 1.00 0.00 H new ATOM 824 N LYS A 60 -0.523 0.021 5.126 1.00 0.00 N ATOM 825 CA LYS A 60 0.505 -0.402 6.061 1.00 0.00 C ATOM 826 C LYS A 60 1.744 -0.847 5.282 1.00 0.00 C ATOM 827 O LYS A 60 2.838 -0.327 5.499 1.00 0.00 O ATOM 828 CB LYS A 60 -0.040 -1.470 7.011 1.00 0.00 C ATOM 829 CG LYS A 60 0.427 -1.218 8.446 1.00 0.00 C ATOM 830 CD LYS A 60 0.136 -2.426 9.338 1.00 0.00 C ATOM 831 CE LYS A 60 1.425 -3.173 9.687 1.00 0.00 C ATOM 832 NZ LYS A 60 1.272 -3.899 10.968 1.00 0.00 N ATOM 0 H LYS A 60 -1.082 -0.737 4.735 1.00 0.00 H new ATOM 0 HA LYS A 60 0.808 0.431 6.696 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.129 -1.472 6.975 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.292 -2.456 6.685 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.496 -1.006 8.452 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -0.075 -0.337 8.846 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -0.357 -2.097 10.253 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -0.553 -3.100 8.830 1.00 0.00 H new ATOM 0 HE2 LYS A 60 1.672 -3.876 8.891 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.253 -2.468 9.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.155 -4.401 11.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 1.058 -3.222 11.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.495 -4.586 10.887 1.00 0.00 H new ATOM 846 N SER A 61 1.532 -1.805 4.392 1.00 0.00 N ATOM 847 CA SER A 61 2.618 -2.326 3.579 1.00 0.00 C ATOM 848 C SER A 61 2.084 -3.377 2.604 1.00 0.00 C ATOM 849 O SER A 61 1.135 -4.094 2.917 1.00 0.00 O ATOM 850 CB SER A 61 3.722 -2.924 4.454 1.00 0.00 C ATOM 851 OG SER A 61 3.594 -4.338 4.582 1.00 0.00 O ATOM 0 H SER A 61 0.624 -2.234 4.216 1.00 0.00 H new ATOM 0 HA SER A 61 3.048 -1.500 3.012 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.695 -2.685 4.024 1.00 0.00 H new ATOM 0 HB3 SER A 61 3.689 -2.466 5.443 1.00 0.00 H new ATOM 0 HG SER A 61 4.318 -4.682 5.146 1.00 0.00 H new ATOM 857 N ILE A 62 2.719 -3.437 1.443 1.00 0.00 N ATOM 858 CA ILE A 62 2.320 -4.389 0.420 1.00 0.00 C ATOM 859 C ILE A 62 3.029 -5.722 0.666 1.00 0.00 C ATOM 860 O ILE A 62 4.217 -5.748 0.983 1.00 0.00 O ATOM 861 CB ILE A 62 2.564 -3.811 -0.975 1.00 0.00 C ATOM 862 CG1 ILE A 62 1.905 -2.438 -1.123 1.00 0.00 C ATOM 863 CG2 ILE A 62 2.106 -4.786 -2.061 1.00 0.00 C ATOM 864 CD1 ILE A 62 2.957 -1.331 -1.211 1.00 0.00 C ATOM 0 H ILE A 62 3.507 -2.842 1.188 1.00 0.00 H new ATOM 0 HA ILE A 62 1.249 -4.582 0.476 1.00 0.00 H new ATOM 0 HB ILE A 62 3.637 -3.669 -1.102 1.00 0.00 H new ATOM 0 HG12 ILE A 62 1.282 -2.424 -2.017 1.00 0.00 H new ATOM 0 HG13 ILE A 62 1.247 -2.253 -0.274 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.291 -4.350 -3.043 1.00 0.00 H new ATOM 0 HG22 ILE A 62 2.660 -5.720 -1.968 1.00 0.00 H new ATOM 0 HG23 ILE A 62 1.040 -4.984 -1.947 1.00 0.00 H new ATOM 0 HD11 ILE A 62 2.462 -0.366 -1.316 1.00 0.00 H new ATOM 0 HD12 ILE A 62 3.563 -1.332 -0.305 1.00 0.00 H new ATOM 0 HD13 ILE A 62 3.598 -1.506 -2.075 1.00 0.00 H new ATOM 876 N ILE A 63 2.270 -6.797 0.510 1.00 0.00 N ATOM 877 CA ILE A 63 2.812 -8.131 0.711 1.00 0.00 C ATOM 878 C ILE A 63 3.383 -8.649 -0.610 1.00 0.00 C ATOM 879 O ILE A 63 2.637 -9.086 -1.485 1.00 0.00 O ATOM 880 CB ILE A 63 1.755 -9.050 1.327 1.00 0.00 C ATOM 881 CG1 ILE A 63 1.458 -8.653 2.774 1.00 0.00 C ATOM 882 CG2 ILE A 63 2.171 -10.518 1.209 1.00 0.00 C ATOM 883 CD1 ILE A 63 0.491 -7.469 2.830 1.00 0.00 C ATOM 0 H ILE A 63 1.285 -6.772 0.247 1.00 0.00 H new ATOM 0 HA ILE A 63 3.635 -8.105 1.425 1.00 0.00 H new ATOM 0 HB ILE A 63 0.829 -8.931 0.765 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.030 -9.502 3.307 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.387 -8.393 3.282 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.403 -11.151 1.654 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.291 -10.779 0.157 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.115 -10.672 1.731 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.297 -7.207 3.870 1.00 0.00 H new ATOM 0 HD12 ILE A 63 0.932 -6.614 2.317 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.446 -7.741 2.343 1.00 0.00 H new ATOM 895 N HIS A 64 4.703 -8.583 -0.713 1.00 0.00 N ATOM 896 CA HIS A 64 5.383 -9.040 -1.913 1.00 0.00 C ATOM 897 C HIS A 64 5.186 -10.549 -2.071 1.00 0.00 C ATOM 898 O HIS A 64 4.951 -11.254 -1.091 1.00 0.00 O ATOM 899 CB HIS A 64 6.858 -8.634 -1.889 1.00 0.00 C ATOM 900 CG HIS A 64 7.690 -9.276 -2.974 1.00 0.00 C ATOM 901 ND1 HIS A 64 8.262 -8.553 -4.006 1.00 0.00 N ATOM 902 CD2 HIS A 64 8.039 -10.579 -3.176 1.00 0.00 C ATOM 903 CE1 HIS A 64 8.923 -9.393 -4.788 1.00 0.00 C ATOM 904 NE2 HIS A 64 8.784 -10.648 -4.272 1.00 0.00 N ATOM 0 H HIS A 64 5.319 -8.220 0.015 1.00 0.00 H new ATOM 0 HA HIS A 64 4.948 -8.558 -2.788 1.00 0.00 H new ATOM 0 HB2 HIS A 64 6.928 -7.550 -1.985 1.00 0.00 H new ATOM 0 HB3 HIS A 64 7.280 -8.896 -0.919 1.00 0.00 H new ATOM 0 HD1 HIS A 64 8.187 -7.545 -4.141 1.00 0.00 H new ATOM 0 HD2 HIS A 64 7.757 -11.413 -2.550 1.00 0.00 H new ATOM 0 HE1 HIS A 64 9.475 -9.130 -5.678 1.00 0.00 H new ATOM 912 N GLY A 65 5.290 -11.000 -3.313 1.00 0.00 N ATOM 913 CA GLY A 65 5.126 -12.412 -3.612 1.00 0.00 C ATOM 914 C GLY A 65 3.645 -12.784 -3.709 1.00 0.00 C ATOM 915 O GLY A 65 3.298 -13.964 -3.737 1.00 0.00 O ATOM 0 H GLY A 65 5.486 -10.412 -4.123 1.00 0.00 H new ATOM 0 HA2 GLY A 65 5.626 -12.649 -4.551 1.00 0.00 H new ATOM 0 HA3 GLY A 65 5.605 -13.010 -2.836 1.00 0.00 H new ATOM 919 N GLY A 66 2.812 -11.755 -3.758 1.00 0.00 N ATOM 920 CA GLY A 66 1.376 -11.959 -3.852 1.00 0.00 C ATOM 921 C GLY A 66 0.780 -11.143 -5.001 1.00 0.00 C ATOM 922 O GLY A 66 1.454 -10.883 -5.997 1.00 0.00 O ATOM 0 H GLY A 66 3.104 -10.778 -3.734 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.165 -13.017 -4.005 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.902 -11.672 -2.913 1.00 0.00 H new ATOM 926 N ALA A 67 -0.477 -10.762 -4.825 1.00 0.00 N ATOM 927 CA ALA A 67 -1.171 -9.981 -5.834 1.00 0.00 C ATOM 928 C ALA A 67 -0.805 -8.505 -5.671 1.00 0.00 C ATOM 929 O ALA A 67 -0.184 -7.914 -6.554 1.00 0.00 O ATOM 930 CB ALA A 67 -2.677 -10.225 -5.722 1.00 0.00 C ATOM 0 H ALA A 67 -1.033 -10.980 -3.998 1.00 0.00 H new ATOM 0 HA ALA A 67 -0.865 -10.287 -6.834 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -3.198 -9.639 -6.479 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -2.886 -11.284 -5.875 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.021 -9.926 -4.732 1.00 0.00 H new ATOM 936 N ALA A 68 -1.206 -7.951 -4.536 1.00 0.00 N ATOM 937 CA ALA A 68 -0.928 -6.554 -4.246 1.00 0.00 C ATOM 938 C ALA A 68 0.506 -6.226 -4.667 1.00 0.00 C ATOM 939 O ALA A 68 0.786 -5.116 -5.116 1.00 0.00 O ATOM 940 CB ALA A 68 -1.176 -6.282 -2.762 1.00 0.00 C ATOM 0 H ALA A 68 -1.721 -8.444 -3.806 1.00 0.00 H new ATOM 0 HA ALA A 68 -1.595 -5.904 -4.813 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -0.968 -5.234 -2.544 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.216 -6.503 -2.520 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -0.522 -6.914 -2.162 1.00 0.00 H new ATOM 946 N PHE A 69 1.376 -7.212 -4.507 1.00 0.00 N ATOM 947 CA PHE A 69 2.774 -7.042 -4.865 1.00 0.00 C ATOM 948 C PHE A 69 2.917 -6.209 -6.140 1.00 0.00 C ATOM 949 O PHE A 69 3.705 -5.267 -6.186 1.00 0.00 O ATOM 950 CB PHE A 69 3.345 -8.439 -5.116 1.00 0.00 C ATOM 951 CG PHE A 69 4.622 -8.448 -5.958 1.00 0.00 C ATOM 952 CD1 PHE A 69 5.707 -7.733 -5.555 1.00 0.00 C ATOM 953 CD2 PHE A 69 4.673 -9.170 -7.109 1.00 0.00 C ATOM 954 CE1 PHE A 69 6.893 -7.741 -6.337 1.00 0.00 C ATOM 955 CE2 PHE A 69 5.858 -9.177 -7.891 1.00 0.00 C ATOM 956 CZ PHE A 69 6.943 -8.463 -7.488 1.00 0.00 C ATOM 0 H PHE A 69 1.140 -8.132 -4.134 1.00 0.00 H new ATOM 0 HA PHE A 69 3.302 -6.524 -4.064 1.00 0.00 H new ATOM 0 HB2 PHE A 69 3.551 -8.913 -4.157 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.589 -9.045 -5.615 1.00 0.00 H new ATOM 0 HD1 PHE A 69 5.667 -7.159 -4.641 1.00 0.00 H new ATOM 0 HD2 PHE A 69 3.812 -9.738 -7.428 1.00 0.00 H new ATOM 0 HE1 PHE A 69 7.755 -7.174 -6.017 1.00 0.00 H new ATOM 0 HE2 PHE A 69 5.898 -9.749 -8.806 1.00 0.00 H new ATOM 0 HZ PHE A 69 7.845 -8.469 -8.082 1.00 0.00 H new ATOM 966 N LYS A 70 2.141 -6.588 -7.146 1.00 0.00 N ATOM 967 CA LYS A 70 2.170 -5.888 -8.419 1.00 0.00 C ATOM 968 C LYS A 70 2.086 -4.381 -8.169 1.00 0.00 C ATOM 969 O LYS A 70 3.067 -3.662 -8.353 1.00 0.00 O ATOM 970 CB LYS A 70 1.077 -6.420 -9.348 1.00 0.00 C ATOM 971 CG LYS A 70 1.248 -7.920 -9.594 1.00 0.00 C ATOM 972 CD LYS A 70 0.007 -8.511 -10.266 1.00 0.00 C ATOM 973 CE LYS A 70 -1.272 -8.012 -9.591 1.00 0.00 C ATOM 974 NZ LYS A 70 -2.356 -9.010 -9.734 1.00 0.00 N ATOM 0 H LYS A 70 1.489 -7.371 -7.105 1.00 0.00 H new ATOM 0 HA LYS A 70 3.112 -6.074 -8.935 1.00 0.00 H new ATOM 0 HB2 LYS A 70 0.098 -6.229 -8.909 1.00 0.00 H new ATOM 0 HB3 LYS A 70 1.110 -5.886 -10.298 1.00 0.00 H new ATOM 0 HG2 LYS A 70 2.122 -8.092 -10.222 1.00 0.00 H new ATOM 0 HG3 LYS A 70 1.430 -8.429 -8.647 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.004 -8.238 -11.321 1.00 0.00 H new ATOM 0 HD3 LYS A 70 0.047 -9.599 -10.219 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -1.082 -7.821 -8.535 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -1.580 -7.066 -10.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.217 -8.656 -9.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -2.548 -9.172 -10.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.066 -9.904 -9.289 1.00 0.00 H new ATOM 988 N ASP A 71 0.905 -3.947 -7.754 1.00 0.00 N ATOM 989 CA ASP A 71 0.680 -2.539 -7.477 1.00 0.00 C ATOM 990 C ASP A 71 1.578 -2.101 -6.319 1.00 0.00 C ATOM 991 O ASP A 71 1.732 -0.908 -6.064 1.00 0.00 O ATOM 992 CB ASP A 71 -0.773 -2.282 -7.073 1.00 0.00 C ATOM 993 CG ASP A 71 -1.419 -1.058 -7.725 1.00 0.00 C ATOM 994 OD1 ASP A 71 -1.041 -0.764 -8.879 1.00 0.00 O ATOM 995 OD2 ASP A 71 -2.278 -0.445 -7.055 1.00 0.00 O ATOM 0 H ASP A 71 0.094 -4.546 -7.603 1.00 0.00 H new ATOM 0 HA ASP A 71 0.907 -1.977 -8.383 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.365 -3.163 -7.323 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.818 -2.164 -5.990 1.00 0.00 H new ATOM 1000 N GLY A 72 2.147 -3.091 -5.646 1.00 0.00 N ATOM 1001 CA GLY A 72 3.025 -2.823 -4.521 1.00 0.00 C ATOM 1002 C GLY A 72 3.881 -1.581 -4.776 1.00 0.00 C ATOM 1003 O GLY A 72 4.258 -0.879 -3.839 1.00 0.00 O ATOM 0 H GLY A 72 2.016 -4.080 -5.859 1.00 0.00 H new ATOM 0 HA2 GLY A 72 2.431 -2.681 -3.618 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.670 -3.684 -4.346 1.00 0.00 H new ATOM 1007 N ARG A 73 4.163 -1.347 -6.049 1.00 0.00 N ATOM 1008 CA ARG A 73 4.967 -0.202 -6.440 1.00 0.00 C ATOM 1009 C ARG A 73 4.598 1.019 -5.594 1.00 0.00 C ATOM 1010 O ARG A 73 5.430 1.895 -5.367 1.00 0.00 O ATOM 1011 CB ARG A 73 4.768 0.132 -7.920 1.00 0.00 C ATOM 1012 CG ARG A 73 3.405 0.787 -8.155 1.00 0.00 C ATOM 1013 CD ARG A 73 2.758 0.259 -9.437 1.00 0.00 C ATOM 1014 NE ARG A 73 2.997 1.203 -10.551 1.00 0.00 N ATOM 1015 CZ ARG A 73 2.784 0.912 -11.842 1.00 0.00 C ATOM 1016 NH1 ARG A 73 2.325 -0.298 -12.188 1.00 0.00 N ATOM 1017 NH2 ARG A 73 3.029 1.831 -12.785 1.00 0.00 N ATOM 0 H ARG A 73 3.849 -1.931 -6.824 1.00 0.00 H new ATOM 0 HA ARG A 73 6.013 -0.460 -6.276 1.00 0.00 H new ATOM 0 HB2 ARG A 73 5.560 0.802 -8.255 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.846 -0.778 -8.516 1.00 0.00 H new ATOM 0 HG2 ARG A 73 2.751 0.590 -7.305 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.524 1.868 -8.222 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.169 -0.720 -9.685 1.00 0.00 H new ATOM 0 HD3 ARG A 73 1.687 0.126 -9.285 1.00 0.00 H new ATOM 0 HE ARG A 73 3.346 2.134 -10.322 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.138 -0.997 -11.469 1.00 0.00 H new ATOM 0 HH12 ARG A 73 2.163 -0.520 -13.170 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.378 2.752 -12.521 1.00 0.00 H new ATOM 0 HH22 ARG A 73 2.867 1.609 -13.767 1.00 0.00 H new ATOM 1031 N LEU A 74 3.349 1.036 -5.152 1.00 0.00 N ATOM 1032 CA LEU A 74 2.860 2.135 -4.337 1.00 0.00 C ATOM 1033 C LEU A 74 3.608 2.147 -3.002 1.00 0.00 C ATOM 1034 O LEU A 74 4.357 1.220 -2.698 1.00 0.00 O ATOM 1035 CB LEU A 74 1.339 2.056 -4.188 1.00 0.00 C ATOM 1036 CG LEU A 74 0.521 2.587 -5.366 1.00 0.00 C ATOM 1037 CD1 LEU A 74 -0.944 2.159 -5.254 1.00 0.00 C ATOM 1038 CD2 LEU A 74 0.667 4.104 -5.495 1.00 0.00 C ATOM 0 H LEU A 74 2.662 0.307 -5.343 1.00 0.00 H new ATOM 0 HA LEU A 74 3.061 3.089 -4.824 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.064 1.015 -4.021 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.052 2.609 -3.294 1.00 0.00 H new ATOM 0 HG LEU A 74 0.915 2.147 -6.282 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.503 2.550 -6.104 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.006 1.071 -5.248 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.368 2.551 -4.330 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.075 4.456 -6.340 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.315 4.582 -4.581 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.715 4.356 -5.656 1.00 0.00 H new ATOM 1050 N ARG A 75 3.381 3.208 -2.242 1.00 0.00 N ATOM 1051 CA ARG A 75 4.024 3.354 -0.948 1.00 0.00 C ATOM 1052 C ARG A 75 2.975 3.393 0.165 1.00 0.00 C ATOM 1053 O ARG A 75 2.013 4.156 0.089 1.00 0.00 O ATOM 1054 CB ARG A 75 4.866 4.630 -0.891 1.00 0.00 C ATOM 1055 CG ARG A 75 5.713 4.785 -2.156 1.00 0.00 C ATOM 1056 CD ARG A 75 6.999 3.963 -2.059 1.00 0.00 C ATOM 1057 NE ARG A 75 8.170 4.818 -2.355 1.00 0.00 N ATOM 1058 CZ ARG A 75 8.621 5.073 -3.591 1.00 0.00 C ATOM 1059 NH1 ARG A 75 8.002 4.541 -4.653 1.00 0.00 N ATOM 1060 NH2 ARG A 75 9.691 5.861 -3.764 1.00 0.00 N ATOM 0 H ARG A 75 2.760 3.975 -2.498 1.00 0.00 H new ATOM 0 HA ARG A 75 4.679 2.494 -0.805 1.00 0.00 H new ATOM 0 HB2 ARG A 75 4.214 5.496 -0.778 1.00 0.00 H new ATOM 0 HB3 ARG A 75 5.515 4.603 -0.016 1.00 0.00 H new ATOM 0 HG2 ARG A 75 5.137 4.465 -3.025 1.00 0.00 H new ATOM 0 HG3 ARG A 75 5.960 5.836 -2.306 1.00 0.00 H new ATOM 0 HD2 ARG A 75 7.093 3.536 -1.060 1.00 0.00 H new ATOM 0 HD3 ARG A 75 6.961 3.129 -2.760 1.00 0.00 H new ATOM 0 HE ARG A 75 8.665 5.240 -1.569 1.00 0.00 H new ATOM 0 HH11 ARG A 75 7.187 3.942 -4.521 1.00 0.00 H new ATOM 0 HH12 ARG A 75 8.345 4.735 -5.594 1.00 0.00 H new ATOM 0 HH21 ARG A 75 10.162 6.266 -2.955 1.00 0.00 H new ATOM 0 HH22 ARG A 75 10.035 6.055 -4.705 1.00 0.00 H new ATOM 1074 N MET A 76 3.197 2.563 1.173 1.00 0.00 N ATOM 1075 CA MET A 76 2.283 2.493 2.300 1.00 0.00 C ATOM 1076 C MET A 76 2.004 3.887 2.868 1.00 0.00 C ATOM 1077 O MET A 76 2.459 4.887 2.316 1.00 0.00 O ATOM 1078 CB MET A 76 2.885 1.608 3.393 1.00 0.00 C ATOM 1079 CG MET A 76 4.279 2.100 3.791 1.00 0.00 C ATOM 1080 SD MET A 76 4.143 3.409 4.997 1.00 0.00 S ATOM 1081 CE MET A 76 5.404 4.519 4.393 1.00 0.00 C ATOM 0 H MET A 76 3.997 1.933 1.233 1.00 0.00 H new ATOM 0 HA MET A 76 1.342 2.067 1.953 1.00 0.00 H new ATOM 0 HB2 MET A 76 2.233 1.608 4.266 1.00 0.00 H new ATOM 0 HB3 MET A 76 2.946 0.579 3.040 1.00 0.00 H new ATOM 0 HG2 MET A 76 4.861 1.275 4.202 1.00 0.00 H new ATOM 0 HG3 MET A 76 4.812 2.459 2.911 1.00 0.00 H new ATOM 0 HE1 MET A 76 5.454 5.398 5.036 1.00 0.00 H new ATOM 0 HE2 MET A 76 6.368 4.011 4.398 1.00 0.00 H new ATOM 0 HE3 MET A 76 5.161 4.827 3.376 1.00 0.00 H new ATOM 1091 N ASN A 77 1.259 3.907 3.963 1.00 0.00 N ATOM 1092 CA ASN A 77 0.915 5.161 4.611 1.00 0.00 C ATOM 1093 C ASN A 77 0.114 6.030 3.638 1.00 0.00 C ATOM 1094 O ASN A 77 -0.055 7.227 3.865 1.00 0.00 O ATOM 1095 CB ASN A 77 2.171 5.936 5.013 1.00 0.00 C ATOM 1096 CG ASN A 77 2.527 5.681 6.479 1.00 0.00 C ATOM 1097 OD1 ASN A 77 2.233 4.455 6.901 1.00 0.00 O flip ATOM 1098 ND2 ASN A 77 3.035 6.540 7.180 1.00 0.00 N flip ATOM 0 H ASN A 77 0.884 3.075 4.418 1.00 0.00 H new ATOM 0 HA ASN A 77 0.332 4.931 5.503 1.00 0.00 H new ATOM 0 HB2 ASN A 77 3.005 5.640 4.376 1.00 0.00 H new ATOM 0 HB3 ASN A 77 2.011 7.002 4.854 1.00 0.00 H new ATOM 0 HD21 ASN A 77 3.235 7.462 6.792 1.00 0.00 H new ATOM 0 HD22 ASN A 77 3.260 6.336 8.154 1.00 0.00 H new ATOM 1105 N ASP A 78 -0.356 5.393 2.576 1.00 0.00 N ATOM 1106 CA ASP A 78 -1.135 6.092 1.568 1.00 0.00 C ATOM 1107 C ASP A 78 -2.585 6.213 2.043 1.00 0.00 C ATOM 1108 O ASP A 78 -3.206 5.217 2.409 1.00 0.00 O ATOM 1109 CB ASP A 78 -1.133 5.329 0.243 1.00 0.00 C ATOM 1110 CG ASP A 78 -0.311 5.974 -0.874 1.00 0.00 C ATOM 1111 OD1 ASP A 78 0.132 7.123 -0.662 1.00 0.00 O ATOM 1112 OD2 ASP A 78 -0.143 5.303 -1.916 1.00 0.00 O ATOM 0 H ASP A 78 -0.212 4.400 2.391 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.688 7.075 1.418 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.751 4.324 0.421 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.162 5.223 -0.099 1.00 0.00 H new ATOM 1117 N GLN A 79 -3.081 7.441 2.021 1.00 0.00 N ATOM 1118 CA GLN A 79 -4.445 7.705 2.444 1.00 0.00 C ATOM 1119 C GLN A 79 -5.426 7.350 1.325 1.00 0.00 C ATOM 1120 O GLN A 79 -5.240 7.758 0.179 1.00 0.00 O ATOM 1121 CB GLN A 79 -4.613 9.162 2.879 1.00 0.00 C ATOM 1122 CG GLN A 79 -5.857 9.334 3.753 1.00 0.00 C ATOM 1123 CD GLN A 79 -5.904 10.734 4.369 1.00 0.00 C ATOM 1124 OE1 GLN A 79 -4.968 11.511 4.282 1.00 0.00 O ATOM 1125 NE2 GLN A 79 -7.045 11.011 4.995 1.00 0.00 N ATOM 0 H GLN A 79 -2.562 8.265 1.717 1.00 0.00 H new ATOM 0 HA GLN A 79 -4.665 7.076 3.307 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -3.730 9.485 3.430 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -4.691 9.801 1.999 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.752 9.166 3.155 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.857 8.584 4.544 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -7.789 10.314 5.031 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -7.175 11.920 5.439 1.00 0.00 H new ATOM 1134 N LEU A 80 -6.449 6.595 1.695 1.00 0.00 N ATOM 1135 CA LEU A 80 -7.460 6.181 0.736 1.00 0.00 C ATOM 1136 C LEU A 80 -8.544 7.256 0.648 1.00 0.00 C ATOM 1137 O LEU A 80 -9.459 7.289 1.471 1.00 0.00 O ATOM 1138 CB LEU A 80 -7.997 4.793 1.090 1.00 0.00 C ATOM 1139 CG LEU A 80 -6.976 3.653 1.074 1.00 0.00 C ATOM 1140 CD1 LEU A 80 -5.970 3.803 2.217 1.00 0.00 C ATOM 1141 CD2 LEU A 80 -7.673 2.292 1.099 1.00 0.00 C ATOM 0 H LEU A 80 -6.600 6.259 2.646 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.025 6.085 -0.259 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.443 4.841 2.083 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.798 4.547 0.393 1.00 0.00 H new ATOM 0 HG LEU A 80 -6.415 3.710 0.141 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.256 2.980 2.183 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.439 4.749 2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.498 3.786 3.171 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.925 1.500 1.087 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -8.276 2.208 2.003 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.316 2.197 0.224 1.00 0.00 H new ATOM 1153 N ILE A 81 -8.407 8.109 -0.356 1.00 0.00 N ATOM 1154 CA ILE A 81 -9.363 9.183 -0.562 1.00 0.00 C ATOM 1155 C ILE A 81 -10.633 8.615 -1.198 1.00 0.00 C ATOM 1156 O ILE A 81 -11.616 9.332 -1.380 1.00 0.00 O ATOM 1157 CB ILE A 81 -8.728 10.320 -1.366 1.00 0.00 C ATOM 1158 CG1 ILE A 81 -8.331 9.845 -2.766 1.00 0.00 C ATOM 1159 CG2 ILE A 81 -7.547 10.932 -0.612 1.00 0.00 C ATOM 1160 CD1 ILE A 81 -8.158 11.030 -3.718 1.00 0.00 C ATOM 0 H ILE A 81 -7.648 8.078 -1.036 1.00 0.00 H new ATOM 0 HA ILE A 81 -9.653 9.622 0.392 1.00 0.00 H new ATOM 0 HB ILE A 81 -9.472 11.107 -1.491 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.401 9.279 -2.712 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -9.093 9.170 -3.155 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.114 11.737 -1.206 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -7.891 11.330 0.343 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.792 10.166 -0.435 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -7.876 10.665 -4.706 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -9.096 11.580 -3.789 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -7.378 11.690 -3.339 1.00 0.00 H new ATOM 1172 N ALA A 82 -10.572 7.330 -1.519 1.00 0.00 N ATOM 1173 CA ALA A 82 -11.704 6.657 -2.131 1.00 0.00 C ATOM 1174 C ALA A 82 -11.259 5.289 -2.650 1.00 0.00 C ATOM 1175 O ALA A 82 -10.071 4.971 -2.633 1.00 0.00 O ATOM 1176 CB ALA A 82 -12.286 7.539 -3.237 1.00 0.00 C ATOM 0 H ALA A 82 -9.756 6.738 -1.366 1.00 0.00 H new ATOM 0 HA ALA A 82 -12.493 6.491 -1.398 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -13.136 7.034 -3.696 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.615 8.487 -2.811 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -11.523 7.726 -3.993 1.00 0.00 H new ATOM 1182 N VAL A 83 -12.236 4.515 -3.100 1.00 0.00 N ATOM 1183 CA VAL A 83 -11.959 3.188 -3.624 1.00 0.00 C ATOM 1184 C VAL A 83 -13.119 2.746 -4.519 1.00 0.00 C ATOM 1185 O VAL A 83 -14.283 2.933 -4.171 1.00 0.00 O ATOM 1186 CB VAL A 83 -11.690 2.217 -2.473 1.00 0.00 C ATOM 1187 CG1 VAL A 83 -12.844 2.223 -1.469 1.00 0.00 C ATOM 1188 CG2 VAL A 83 -11.426 0.805 -2.997 1.00 0.00 C ATOM 0 H VAL A 83 -13.220 4.781 -3.113 1.00 0.00 H new ATOM 0 HA VAL A 83 -11.059 3.200 -4.239 1.00 0.00 H new ATOM 0 HB VAL A 83 -10.793 2.554 -1.954 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -12.627 1.524 -0.661 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -12.964 3.226 -1.059 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -13.764 1.923 -1.971 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -11.238 0.135 -2.158 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -12.296 0.455 -3.553 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -10.556 0.817 -3.654 1.00 0.00 H new ATOM 1198 N ASN A 84 -12.759 2.169 -5.657 1.00 0.00 N ATOM 1199 CA ASN A 84 -13.754 1.699 -6.605 1.00 0.00 C ATOM 1200 C ASN A 84 -14.854 2.754 -6.748 1.00 0.00 C ATOM 1201 O ASN A 84 -16.036 2.447 -6.601 1.00 0.00 O ATOM 1202 CB ASN A 84 -14.405 0.401 -6.122 1.00 0.00 C ATOM 1203 CG ASN A 84 -14.699 0.460 -4.622 1.00 0.00 C ATOM 1204 OD1 ASN A 84 -13.796 -0.163 -3.869 1.00 0.00 O flip ATOM 1205 ND2 ASN A 84 -15.680 1.032 -4.178 1.00 0.00 N flip ATOM 0 H ASN A 84 -11.792 2.017 -5.943 1.00 0.00 H new ATOM 0 HA ASN A 84 -13.255 1.520 -7.557 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -15.331 0.228 -6.671 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -13.746 -0.441 -6.334 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -16.334 1.491 -4.813 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -15.847 1.052 -3.172 1.00 0.00 H new ATOM 1212 N GLY A 85 -14.424 3.974 -7.034 1.00 0.00 N ATOM 1213 CA GLY A 85 -15.357 5.076 -7.200 1.00 0.00 C ATOM 1214 C GLY A 85 -16.217 5.258 -5.947 1.00 0.00 C ATOM 1215 O GLY A 85 -17.310 5.818 -6.017 1.00 0.00 O ATOM 0 H GLY A 85 -13.443 4.224 -7.155 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.808 5.995 -7.405 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -15.998 4.888 -8.062 1.00 0.00 H new ATOM 1219 N GLU A 86 -15.691 4.775 -4.831 1.00 0.00 N ATOM 1220 CA GLU A 86 -16.397 4.878 -3.566 1.00 0.00 C ATOM 1221 C GLU A 86 -15.638 5.799 -2.608 1.00 0.00 C ATOM 1222 O GLU A 86 -14.409 5.833 -2.618 1.00 0.00 O ATOM 1223 CB GLU A 86 -16.612 3.497 -2.944 1.00 0.00 C ATOM 1224 CG GLU A 86 -17.673 3.550 -1.843 1.00 0.00 C ATOM 1225 CD GLU A 86 -18.347 2.188 -1.665 1.00 0.00 C ATOM 1226 OE1 GLU A 86 -17.734 1.190 -2.102 1.00 0.00 O ATOM 1227 OE2 GLU A 86 -19.460 2.175 -1.096 1.00 0.00 O ATOM 0 H GLU A 86 -14.784 4.311 -4.777 1.00 0.00 H new ATOM 0 HA GLU A 86 -17.379 5.312 -3.755 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -16.919 2.791 -3.715 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -15.672 3.130 -2.531 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -17.213 3.857 -0.904 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -18.423 4.301 -2.091 1.00 0.00 H new ATOM 1234 N THR A 87 -16.403 6.523 -1.804 1.00 0.00 N ATOM 1235 CA THR A 87 -15.818 7.442 -0.842 1.00 0.00 C ATOM 1236 C THR A 87 -15.417 6.696 0.432 1.00 0.00 C ATOM 1237 O THR A 87 -16.041 5.700 0.795 1.00 0.00 O ATOM 1238 CB THR A 87 -16.822 8.570 -0.596 1.00 0.00 C ATOM 1239 OG1 THR A 87 -16.056 9.760 -0.769 1.00 0.00 O ATOM 1240 CG2 THR A 87 -17.285 8.634 0.861 1.00 0.00 C ATOM 0 H THR A 87 -17.423 6.492 -1.799 1.00 0.00 H new ATOM 0 HA THR A 87 -14.898 7.884 -1.225 1.00 0.00 H new ATOM 0 HB THR A 87 -17.686 8.435 -1.246 1.00 0.00 H new ATOM 0 HG1 THR A 87 -16.630 10.542 -0.629 1.00 0.00 H new ATOM 0 HG21 THR A 87 -17.996 9.451 0.981 1.00 0.00 H new ATOM 0 HG22 THR A 87 -17.764 7.693 1.132 1.00 0.00 H new ATOM 0 HG23 THR A 87 -16.425 8.803 1.509 1.00 0.00 H new ATOM 1248 N LEU A 88 -14.378 7.207 1.076 1.00 0.00 N ATOM 1249 CA LEU A 88 -13.887 6.602 2.302 1.00 0.00 C ATOM 1250 C LEU A 88 -13.801 7.670 3.394 1.00 0.00 C ATOM 1251 O LEU A 88 -14.282 7.465 4.508 1.00 0.00 O ATOM 1252 CB LEU A 88 -12.565 5.875 2.048 1.00 0.00 C ATOM 1253 CG LEU A 88 -12.635 4.661 1.119 1.00 0.00 C ATOM 1254 CD1 LEU A 88 -11.247 4.295 0.590 1.00 0.00 C ATOM 1255 CD2 LEU A 88 -13.314 3.479 1.813 1.00 0.00 C ATOM 0 H LEU A 88 -13.863 8.033 0.772 1.00 0.00 H new ATOM 0 HA LEU A 88 -14.581 5.840 2.655 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.856 6.588 1.628 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.161 5.551 3.007 1.00 0.00 H new ATOM 0 HG LEU A 88 -13.249 4.924 0.257 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -11.325 3.429 -0.068 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.836 5.137 0.034 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -10.590 4.057 1.427 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.351 2.629 1.131 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -12.748 3.206 2.703 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.328 3.759 2.100 1.00 0.00 H new ATOM 1267 N LEU A 89 -13.185 8.788 3.038 1.00 0.00 N ATOM 1268 CA LEU A 89 -13.030 9.889 3.973 1.00 0.00 C ATOM 1269 C LEU A 89 -14.387 10.217 4.597 1.00 0.00 C ATOM 1270 O LEU A 89 -14.467 10.553 5.778 1.00 0.00 O ATOM 1271 CB LEU A 89 -12.362 11.083 3.289 1.00 0.00 C ATOM 1272 CG LEU A 89 -11.224 10.752 2.322 1.00 0.00 C ATOM 1273 CD1 LEU A 89 -10.332 11.973 2.087 1.00 0.00 C ATOM 1274 CD2 LEU A 89 -10.424 9.543 2.810 1.00 0.00 C ATOM 0 H LEU A 89 -12.787 8.955 2.114 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.364 9.606 4.788 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.126 11.638 2.744 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.975 11.748 4.061 1.00 0.00 H new ATOM 0 HG LEU A 89 -11.660 10.482 1.360 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.531 11.711 1.396 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -10.927 12.782 1.663 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -9.902 12.297 3.035 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.621 9.329 2.104 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -9.998 9.760 3.790 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.082 8.677 2.884 1.00 0.00 H new ATOM 1286 N GLY A 90 -15.422 10.108 3.777 1.00 0.00 N ATOM 1287 CA GLY A 90 -16.772 10.389 4.233 1.00 0.00 C ATOM 1288 C GLY A 90 -17.153 9.486 5.409 1.00 0.00 C ATOM 1289 O GLY A 90 -17.956 9.871 6.257 1.00 0.00 O ATOM 0 H GLY A 90 -15.352 9.829 2.798 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -16.848 11.434 4.533 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -17.475 10.241 3.413 1.00 0.00 H new ATOM 1293 N LYS A 91 -16.558 8.303 5.421 1.00 0.00 N ATOM 1294 CA LYS A 91 -16.824 7.342 6.478 1.00 0.00 C ATOM 1295 C LYS A 91 -15.695 7.398 7.509 1.00 0.00 C ATOM 1296 O LYS A 91 -14.881 8.320 7.494 1.00 0.00 O ATOM 1297 CB LYS A 91 -17.052 5.948 5.890 1.00 0.00 C ATOM 1298 CG LYS A 91 -17.564 6.036 4.451 1.00 0.00 C ATOM 1299 CD LYS A 91 -17.867 4.646 3.890 1.00 0.00 C ATOM 1300 CE LYS A 91 -18.762 4.736 2.653 1.00 0.00 C ATOM 1301 NZ LYS A 91 -19.998 3.946 2.849 1.00 0.00 N ATOM 0 H LYS A 91 -15.892 7.988 4.716 1.00 0.00 H new ATOM 0 HA LYS A 91 -17.746 7.597 7.001 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -16.120 5.383 5.914 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -17.771 5.404 6.503 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -18.465 6.649 4.419 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -16.820 6.530 3.826 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -16.935 4.143 3.633 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -18.356 4.041 4.653 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -19.016 5.777 2.456 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -18.223 4.369 1.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -20.594 4.018 2.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -19.751 2.950 3.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -20.519 4.315 3.670 1.00 0.00 H new ATOM 1315 N SER A 92 -15.681 6.399 8.379 1.00 0.00 N ATOM 1316 CA SER A 92 -14.665 6.323 9.415 1.00 0.00 C ATOM 1317 C SER A 92 -13.691 5.182 9.110 1.00 0.00 C ATOM 1318 O SER A 92 -13.827 4.500 8.096 1.00 0.00 O ATOM 1319 CB SER A 92 -15.298 6.126 10.794 1.00 0.00 C ATOM 1320 OG SER A 92 -16.065 4.928 10.863 1.00 0.00 O ATOM 0 H SER A 92 -16.357 5.635 8.388 1.00 0.00 H new ATOM 0 HA SER A 92 -14.118 7.266 9.428 1.00 0.00 H new ATOM 0 HB2 SER A 92 -14.515 6.099 11.552 1.00 0.00 H new ATOM 0 HB3 SER A 92 -15.936 6.979 11.025 1.00 0.00 H new ATOM 0 HG SER A 92 -16.451 4.838 11.759 1.00 0.00 H new ATOM 1326 N ASN A 93 -12.731 5.011 10.007 1.00 0.00 N ATOM 1327 CA ASN A 93 -11.736 3.965 9.847 1.00 0.00 C ATOM 1328 C ASN A 93 -12.441 2.619 9.665 1.00 0.00 C ATOM 1329 O ASN A 93 -12.112 1.860 8.755 1.00 0.00 O ATOM 1330 CB ASN A 93 -10.838 3.865 11.082 1.00 0.00 C ATOM 1331 CG ASN A 93 -10.019 5.144 11.268 1.00 0.00 C ATOM 1332 OD1 ASN A 93 -9.669 5.831 10.323 1.00 0.00 O ATOM 1333 ND2 ASN A 93 -9.733 5.423 12.537 1.00 0.00 N ATOM 0 H ASN A 93 -12.621 5.579 10.847 1.00 0.00 H new ATOM 0 HA ASN A 93 -11.127 4.210 8.977 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -11.449 3.688 11.967 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -10.168 3.011 10.981 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -9.189 6.255 12.766 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -10.057 4.805 13.281 1.00 0.00 H new ATOM 1340 N HIS A 94 -13.397 2.365 10.546 1.00 0.00 N ATOM 1341 CA HIS A 94 -14.152 1.124 10.494 1.00 0.00 C ATOM 1342 C HIS A 94 -14.928 1.049 9.177 1.00 0.00 C ATOM 1343 O HIS A 94 -14.553 0.304 8.273 1.00 0.00 O ATOM 1344 CB HIS A 94 -15.053 0.984 11.722 1.00 0.00 C ATOM 1345 CG HIS A 94 -15.749 -0.352 11.825 1.00 0.00 C ATOM 1346 ND1 HIS A 94 -15.201 -1.432 12.495 1.00 0.00 N ATOM 1347 CD2 HIS A 94 -16.951 -0.771 11.337 1.00 0.00 C ATOM 1348 CE1 HIS A 94 -16.045 -2.450 12.407 1.00 0.00 C ATOM 1349 NE2 HIS A 94 -17.129 -2.038 11.688 1.00 0.00 N ATOM 0 H HIS A 94 -13.666 2.997 11.300 1.00 0.00 H new ATOM 0 HA HIS A 94 -13.467 0.277 10.520 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -14.454 1.140 12.619 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -15.805 1.773 11.700 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -17.642 -0.172 10.762 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -15.900 -3.433 12.830 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -17.942 -2.610 11.458 1.00 0.00 H new ATOM 1357 N GLU A 95 -15.994 1.832 9.111 1.00 0.00 N ATOM 1358 CA GLU A 95 -16.826 1.865 7.920 1.00 0.00 C ATOM 1359 C GLU A 95 -15.956 1.807 6.663 1.00 0.00 C ATOM 1360 O GLU A 95 -16.045 0.859 5.885 1.00 0.00 O ATOM 1361 CB GLU A 95 -17.722 3.105 7.911 1.00 0.00 C ATOM 1362 CG GLU A 95 -18.471 3.250 9.238 1.00 0.00 C ATOM 1363 CD GLU A 95 -19.784 4.012 9.045 1.00 0.00 C ATOM 1364 OE1 GLU A 95 -20.509 3.660 8.090 1.00 0.00 O ATOM 1365 OE2 GLU A 95 -20.033 4.928 9.858 1.00 0.00 O ATOM 0 H GLU A 95 -16.301 2.449 9.863 1.00 0.00 H new ATOM 0 HA GLU A 95 -17.475 0.989 7.929 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -17.117 3.994 7.732 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -18.437 3.035 7.091 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -18.676 2.264 9.654 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -17.844 3.775 9.958 1.00 0.00 H new ATOM 1372 N ALA A 96 -15.134 2.835 6.504 1.00 0.00 N ATOM 1373 CA ALA A 96 -14.249 2.913 5.355 1.00 0.00 C ATOM 1374 C ALA A 96 -13.703 1.519 5.040 1.00 0.00 C ATOM 1375 O ALA A 96 -14.049 0.929 4.018 1.00 0.00 O ATOM 1376 CB ALA A 96 -13.136 3.925 5.636 1.00 0.00 C ATOM 0 H ALA A 96 -15.063 3.620 7.152 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.792 3.260 4.476 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -12.472 3.984 4.774 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.574 4.905 5.824 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.568 3.608 6.511 1.00 0.00 H new ATOM 1382 N MET A 97 -12.859 1.032 5.938 1.00 0.00 N ATOM 1383 CA MET A 97 -12.263 -0.282 5.770 1.00 0.00 C ATOM 1384 C MET A 97 -13.318 -1.317 5.374 1.00 0.00 C ATOM 1385 O MET A 97 -13.031 -2.244 4.618 1.00 0.00 O ATOM 1386 CB MET A 97 -11.592 -0.710 7.077 1.00 0.00 C ATOM 1387 CG MET A 97 -10.213 -0.065 7.222 1.00 0.00 C ATOM 1388 SD MET A 97 -9.151 -0.585 5.884 1.00 0.00 S ATOM 1389 CE MET A 97 -8.092 -1.728 6.756 1.00 0.00 C ATOM 0 H MET A 97 -12.574 1.524 6.785 1.00 0.00 H new ATOM 0 HA MET A 97 -11.522 -0.224 4.973 1.00 0.00 H new ATOM 0 HB2 MET A 97 -12.220 -0.428 7.922 1.00 0.00 H new ATOM 0 HB3 MET A 97 -11.494 -1.795 7.101 1.00 0.00 H new ATOM 0 HG2 MET A 97 -10.308 1.021 7.220 1.00 0.00 H new ATOM 0 HG3 MET A 97 -9.770 -0.345 8.178 1.00 0.00 H new ATOM 0 HE1 MET A 97 -7.386 -2.176 6.057 1.00 0.00 H new ATOM 0 HE2 MET A 97 -7.544 -1.196 7.534 1.00 0.00 H new ATOM 0 HE3 MET A 97 -8.698 -2.511 7.211 1.00 0.00 H new ATOM 1399 N GLU A 98 -14.517 -1.123 5.902 1.00 0.00 N ATOM 1400 CA GLU A 98 -15.617 -2.028 5.614 1.00 0.00 C ATOM 1401 C GLU A 98 -15.982 -1.964 4.130 1.00 0.00 C ATOM 1402 O GLU A 98 -16.408 -2.961 3.548 1.00 0.00 O ATOM 1403 CB GLU A 98 -16.831 -1.713 6.491 1.00 0.00 C ATOM 1404 CG GLU A 98 -17.976 -1.137 5.655 1.00 0.00 C ATOM 1405 CD GLU A 98 -19.039 -0.497 6.550 1.00 0.00 C ATOM 1406 OE1 GLU A 98 -19.729 -1.268 7.252 1.00 0.00 O ATOM 1407 OE2 GLU A 98 -19.138 0.748 6.512 1.00 0.00 O ATOM 0 H GLU A 98 -14.751 -0.352 6.528 1.00 0.00 H new ATOM 0 HA GLU A 98 -15.296 -3.044 5.846 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -17.165 -2.620 6.996 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -16.549 -1.002 7.267 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -17.585 -0.394 4.960 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -18.428 -1.928 5.056 1.00 0.00 H new ATOM 1414 N THR A 99 -15.800 -0.783 3.559 1.00 0.00 N ATOM 1415 CA THR A 99 -16.105 -0.576 2.153 1.00 0.00 C ATOM 1416 C THR A 99 -15.032 -1.222 1.274 1.00 0.00 C ATOM 1417 O THR A 99 -15.349 -1.913 0.308 1.00 0.00 O ATOM 1418 CB THR A 99 -16.257 0.928 1.919 1.00 0.00 C ATOM 1419 OG1 THR A 99 -17.611 1.199 2.271 1.00 0.00 O ATOM 1420 CG2 THR A 99 -16.176 1.301 0.437 1.00 0.00 C ATOM 0 H THR A 99 -15.445 0.041 4.044 1.00 0.00 H new ATOM 0 HA THR A 99 -17.042 -1.059 1.876 1.00 0.00 H new ATOM 0 HB THR A 99 -15.483 1.461 2.471 1.00 0.00 H new ATOM 0 HG1 THR A 99 -17.796 2.154 2.150 1.00 0.00 H new ATOM 0 HG21 THR A 99 -16.290 2.379 0.326 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.209 0.995 0.037 1.00 0.00 H new ATOM 0 HG23 THR A 99 -16.971 0.794 -0.110 1.00 0.00 H new ATOM 1428 N LEU A 100 -13.783 -0.974 1.642 1.00 0.00 N ATOM 1429 CA LEU A 100 -12.661 -1.523 0.899 1.00 0.00 C ATOM 1430 C LEU A 100 -12.886 -3.020 0.677 1.00 0.00 C ATOM 1431 O LEU A 100 -13.094 -3.459 -0.453 1.00 0.00 O ATOM 1432 CB LEU A 100 -11.342 -1.196 1.602 1.00 0.00 C ATOM 1433 CG LEU A 100 -10.087 -1.246 0.729 1.00 0.00 C ATOM 1434 CD1 LEU A 100 -9.947 0.030 -0.104 1.00 0.00 C ATOM 1435 CD2 LEU A 100 -8.841 -1.518 1.575 1.00 0.00 C ATOM 0 H LEU A 100 -13.524 -0.400 2.445 1.00 0.00 H new ATOM 0 HA LEU A 100 -12.593 -1.061 -0.086 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.421 -0.198 2.034 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.212 -1.892 2.430 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.190 -2.077 0.031 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.047 -0.032 -0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -10.818 0.140 -0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -9.877 0.892 0.560 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -7.963 -1.549 0.930 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -8.722 -0.725 2.313 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.950 -2.475 2.086 1.00 0.00 H new ATOM 1447 N ARG A 101 -12.836 -3.762 1.774 1.00 0.00 N ATOM 1448 CA ARG A 101 -13.031 -5.201 1.713 1.00 0.00 C ATOM 1449 C ARG A 101 -14.299 -5.532 0.923 1.00 0.00 C ATOM 1450 O ARG A 101 -14.235 -6.194 -0.111 1.00 0.00 O ATOM 1451 CB ARG A 101 -13.141 -5.801 3.116 1.00 0.00 C ATOM 1452 CG ARG A 101 -13.111 -7.330 3.062 1.00 0.00 C ATOM 1453 CD ARG A 101 -13.202 -7.930 4.467 1.00 0.00 C ATOM 1454 NE ARG A 101 -14.496 -7.571 5.088 1.00 0.00 N ATOM 1455 CZ ARG A 101 -14.918 -8.041 6.269 1.00 0.00 C ATOM 1456 NH1 ARG A 101 -14.152 -8.893 6.964 1.00 0.00 N ATOM 1457 NH2 ARG A 101 -16.108 -7.660 6.756 1.00 0.00 N ATOM 0 H ARG A 101 -12.663 -3.394 2.710 1.00 0.00 H new ATOM 0 HA ARG A 101 -12.164 -5.633 1.212 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -12.320 -5.439 3.736 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -14.066 -5.468 3.586 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -13.940 -7.692 2.454 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -12.192 -7.663 2.579 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -13.102 -9.014 4.415 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -12.380 -7.563 5.082 1.00 0.00 H new ATOM 0 HE ARG A 101 -15.105 -6.925 4.585 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -13.247 -9.184 6.594 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -14.474 -9.251 7.863 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -16.692 -7.012 6.227 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -16.429 -8.018 7.655 1.00 0.00 H new ATOM 1471 N ARG A 102 -15.422 -5.055 1.441 1.00 0.00 N ATOM 1472 CA ARG A 102 -16.702 -5.291 0.797 1.00 0.00 C ATOM 1473 C ARG A 102 -16.601 -5.014 -0.705 1.00 0.00 C ATOM 1474 O ARG A 102 -17.229 -5.700 -1.510 1.00 0.00 O ATOM 1475 CB ARG A 102 -17.794 -4.405 1.399 1.00 0.00 C ATOM 1476 CG ARG A 102 -19.082 -4.486 0.577 1.00 0.00 C ATOM 1477 CD ARG A 102 -20.260 -4.930 1.447 1.00 0.00 C ATOM 1478 NE ARG A 102 -20.187 -6.388 1.693 1.00 0.00 N ATOM 1479 CZ ARG A 102 -21.235 -7.143 2.047 1.00 0.00 C ATOM 1480 NH1 ARG A 102 -22.443 -6.584 2.200 1.00 0.00 N ATOM 1481 NH2 ARG A 102 -21.075 -8.458 2.250 1.00 0.00 N ATOM 0 H ARG A 102 -15.471 -4.506 2.299 1.00 0.00 H new ATOM 0 HA ARG A 102 -16.966 -6.336 0.960 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -17.993 -4.714 2.425 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -17.448 -3.372 1.439 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -19.298 -3.513 0.135 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -18.949 -5.187 -0.247 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -20.246 -4.392 2.395 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -21.200 -4.683 0.954 1.00 0.00 H new ATOM 0 HE ARG A 102 -19.282 -6.846 1.586 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -22.565 -5.583 2.047 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -23.241 -7.160 2.470 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -20.155 -8.884 2.135 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -21.873 -9.033 2.520 1.00 0.00 H new ATOM 1495 N SER A 103 -15.805 -4.008 -1.036 1.00 0.00 N ATOM 1496 CA SER A 103 -15.613 -3.632 -2.426 1.00 0.00 C ATOM 1497 C SER A 103 -14.845 -4.731 -3.164 1.00 0.00 C ATOM 1498 O SER A 103 -15.089 -4.978 -4.344 1.00 0.00 O ATOM 1499 CB SER A 103 -14.870 -2.299 -2.539 1.00 0.00 C ATOM 1500 OG SER A 103 -15.759 -1.213 -2.787 1.00 0.00 O ATOM 0 H SER A 103 -15.286 -3.442 -0.365 1.00 0.00 H new ATOM 0 HA SER A 103 -16.594 -3.511 -2.886 1.00 0.00 H new ATOM 0 HB2 SER A 103 -14.317 -2.112 -1.618 1.00 0.00 H new ATOM 0 HB3 SER A 103 -14.137 -2.359 -3.344 1.00 0.00 H new ATOM 0 HG SER A 103 -16.069 -0.843 -1.934 1.00 0.00 H new ATOM 1506 N MET A 104 -13.933 -5.361 -2.438 1.00 0.00 N ATOM 1507 CA MET A 104 -13.129 -6.428 -3.010 1.00 0.00 C ATOM 1508 C MET A 104 -13.999 -7.627 -3.390 1.00 0.00 C ATOM 1509 O MET A 104 -13.684 -8.353 -4.333 1.00 0.00 O ATOM 1510 CB MET A 104 -12.069 -6.867 -1.997 1.00 0.00 C ATOM 1511 CG MET A 104 -11.099 -5.724 -1.689 1.00 0.00 C ATOM 1512 SD MET A 104 -10.033 -6.178 -0.331 1.00 0.00 S ATOM 1513 CE MET A 104 -10.039 -4.650 0.592 1.00 0.00 C ATOM 0 H MET A 104 -13.733 -5.153 -1.460 1.00 0.00 H new ATOM 0 HA MET A 104 -12.648 -6.051 -3.913 1.00 0.00 H new ATOM 0 HB2 MET A 104 -12.553 -7.196 -1.077 1.00 0.00 H new ATOM 0 HB3 MET A 104 -11.517 -7.721 -2.389 1.00 0.00 H new ATOM 0 HG2 MET A 104 -10.501 -5.496 -2.571 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.656 -4.821 -1.439 1.00 0.00 H new ATOM 0 HE1 MET A 104 -9.041 -4.213 0.578 1.00 0.00 H new ATOM 0 HE2 MET A 104 -10.746 -3.954 0.140 1.00 0.00 H new ATOM 0 HE3 MET A 104 -10.334 -4.848 1.622 1.00 0.00 H new ATOM 1523 N SER A 105 -15.076 -7.799 -2.638 1.00 0.00 N ATOM 1524 CA SER A 105 -15.994 -8.898 -2.885 1.00 0.00 C ATOM 1525 C SER A 105 -17.156 -8.423 -3.760 1.00 0.00 C ATOM 1526 O SER A 105 -17.914 -9.236 -4.287 1.00 0.00 O ATOM 1527 CB SER A 105 -16.521 -9.481 -1.572 1.00 0.00 C ATOM 1528 OG SER A 105 -15.974 -10.769 -1.303 1.00 0.00 O ATOM 0 H SER A 105 -15.334 -7.196 -1.857 1.00 0.00 H new ATOM 0 HA SER A 105 -15.452 -9.685 -3.409 1.00 0.00 H new ATOM 0 HB2 SER A 105 -16.278 -8.805 -0.752 1.00 0.00 H new ATOM 0 HB3 SER A 105 -17.608 -9.551 -1.616 1.00 0.00 H new ATOM 0 HG SER A 105 -16.333 -11.107 -0.456 1.00 0.00 H new ATOM 1534 N MET A 106 -17.260 -7.108 -3.887 1.00 0.00 N ATOM 1535 CA MET A 106 -18.317 -6.515 -4.688 1.00 0.00 C ATOM 1536 C MET A 106 -17.824 -6.204 -6.102 1.00 0.00 C ATOM 1537 O MET A 106 -18.442 -6.614 -7.084 1.00 0.00 O ATOM 1538 CB MET A 106 -18.802 -5.227 -4.021 1.00 0.00 C ATOM 1539 CG MET A 106 -20.075 -5.475 -3.209 1.00 0.00 C ATOM 1540 SD MET A 106 -21.472 -5.660 -4.304 1.00 0.00 S ATOM 1541 CE MET A 106 -21.921 -7.351 -3.951 1.00 0.00 C ATOM 0 H MET A 106 -16.629 -6.437 -3.448 1.00 0.00 H new ATOM 0 HA MET A 106 -19.138 -7.229 -4.759 1.00 0.00 H new ATOM 0 HB2 MET A 106 -18.021 -4.835 -3.369 1.00 0.00 H new ATOM 0 HB3 MET A 106 -18.993 -4.469 -4.781 1.00 0.00 H new ATOM 0 HG2 MET A 106 -19.959 -6.372 -2.600 1.00 0.00 H new ATOM 0 HG3 MET A 106 -20.247 -4.645 -2.524 1.00 0.00 H new ATOM 0 HE1 MET A 106 -22.382 -7.796 -4.832 1.00 0.00 H new ATOM 0 HE2 MET A 106 -21.028 -7.916 -3.684 1.00 0.00 H new ATOM 0 HE3 MET A 106 -22.627 -7.374 -3.121 1.00 0.00 H new ATOM 1551 N GLU A 107 -16.715 -5.482 -6.162 1.00 0.00 N ATOM 1552 CA GLU A 107 -16.131 -5.111 -7.440 1.00 0.00 C ATOM 1553 C GLU A 107 -15.454 -6.321 -8.086 1.00 0.00 C ATOM 1554 O GLU A 107 -15.606 -6.557 -9.283 1.00 0.00 O ATOM 1555 CB GLU A 107 -15.145 -3.952 -7.277 1.00 0.00 C ATOM 1556 CG GLU A 107 -15.875 -2.659 -6.911 1.00 0.00 C ATOM 1557 CD GLU A 107 -16.419 -1.963 -8.160 1.00 0.00 C ATOM 1558 OE1 GLU A 107 -17.527 -2.351 -8.589 1.00 0.00 O ATOM 1559 OE2 GLU A 107 -15.714 -1.059 -8.659 1.00 0.00 O ATOM 0 H GLU A 107 -16.205 -5.144 -5.346 1.00 0.00 H new ATOM 0 HA GLU A 107 -16.931 -4.773 -8.098 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -14.418 -4.195 -6.502 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -14.589 -3.810 -8.204 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -16.695 -2.881 -6.228 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -15.194 -1.990 -6.385 1.00 0.00 H new ATOM 1566 N GLY A 108 -14.720 -7.057 -7.263 1.00 0.00 N ATOM 1567 CA GLY A 108 -14.019 -8.237 -7.739 1.00 0.00 C ATOM 1568 C GLY A 108 -15.004 -9.346 -8.115 1.00 0.00 C ATOM 1569 O GLY A 108 -14.607 -10.376 -8.656 1.00 0.00 O ATOM 0 H GLY A 108 -14.596 -6.859 -6.270 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -13.410 -7.978 -8.605 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -13.339 -8.596 -6.967 1.00 0.00 H new ATOM 1573 N ASN A 109 -16.269 -9.097 -7.812 1.00 0.00 N ATOM 1574 CA ASN A 109 -17.314 -10.062 -8.111 1.00 0.00 C ATOM 1575 C ASN A 109 -17.733 -9.915 -9.575 1.00 0.00 C ATOM 1576 O ASN A 109 -17.657 -10.872 -10.345 1.00 0.00 O ATOM 1577 CB ASN A 109 -18.549 -9.824 -7.240 1.00 0.00 C ATOM 1578 CG ASN A 109 -19.763 -10.572 -7.794 1.00 0.00 C ATOM 1579 OD1 ASN A 109 -19.649 -11.601 -8.439 1.00 0.00 O ATOM 1580 ND2 ASN A 109 -20.928 -10.000 -7.506 1.00 0.00 N ATOM 0 H ASN A 109 -16.595 -8.241 -7.363 1.00 0.00 H new ATOM 0 HA ASN A 109 -16.920 -11.059 -7.913 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -18.348 -10.154 -6.221 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -18.765 -8.757 -7.193 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -21.798 -10.423 -7.830 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -20.952 -9.138 -6.961 1.00 0.00 H new ATOM 1587 N ILE A 110 -18.167 -8.710 -9.916 1.00 0.00 N ATOM 1588 CA ILE A 110 -18.598 -8.426 -11.274 1.00 0.00 C ATOM 1589 C ILE A 110 -17.438 -7.803 -12.053 1.00 0.00 C ATOM 1590 O ILE A 110 -17.216 -8.137 -13.215 1.00 0.00 O ATOM 1591 CB ILE A 110 -19.865 -7.569 -11.265 1.00 0.00 C ATOM 1592 CG1 ILE A 110 -19.538 -6.110 -10.939 1.00 0.00 C ATOM 1593 CG2 ILE A 110 -20.913 -8.148 -10.313 1.00 0.00 C ATOM 1594 CD1 ILE A 110 -19.294 -5.925 -9.440 1.00 0.00 C ATOM 0 H ILE A 110 -18.229 -7.919 -9.275 1.00 0.00 H new ATOM 0 HA ILE A 110 -18.869 -9.348 -11.789 1.00 0.00 H new ATOM 0 HB ILE A 110 -20.296 -7.587 -12.266 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -18.655 -5.798 -11.496 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -20.359 -5.469 -11.259 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -21.803 -7.519 -10.326 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -21.176 -9.157 -10.632 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -20.507 -8.181 -9.302 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -19.064 -4.879 -9.235 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -20.188 -6.215 -8.887 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -18.456 -6.549 -9.128 1.00 0.00 H new ATOM 1606 N ARG A 111 -16.730 -6.907 -11.381 1.00 0.00 N ATOM 1607 CA ARG A 111 -15.599 -6.233 -11.996 1.00 0.00 C ATOM 1608 C ARG A 111 -14.391 -7.170 -12.054 1.00 0.00 C ATOM 1609 O ARG A 111 -13.754 -7.303 -13.098 1.00 0.00 O ATOM 1610 CB ARG A 111 -15.220 -4.972 -11.217 1.00 0.00 C ATOM 1611 CG ARG A 111 -14.952 -3.802 -12.166 1.00 0.00 C ATOM 1612 CD ARG A 111 -15.688 -2.542 -11.706 1.00 0.00 C ATOM 1613 NE ARG A 111 -15.402 -1.422 -12.631 1.00 0.00 N ATOM 1614 CZ ARG A 111 -15.801 -0.159 -12.427 1.00 0.00 C ATOM 1615 NH1 ARG A 111 -16.504 0.152 -11.330 1.00 0.00 N ATOM 1616 NH2 ARG A 111 -15.496 0.792 -13.320 1.00 0.00 N ATOM 0 H ARG A 111 -16.918 -6.632 -10.417 1.00 0.00 H new ATOM 0 HA ARG A 111 -15.892 -5.948 -13.007 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -16.024 -4.710 -10.529 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -14.333 -5.166 -10.613 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -13.881 -3.605 -12.213 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -15.272 -4.066 -13.174 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -16.761 -2.730 -11.671 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -15.377 -2.278 -10.695 1.00 0.00 H new ATOM 0 HE ARG A 111 -14.868 -1.624 -13.476 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -16.735 -0.572 -10.650 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -16.808 1.113 -11.174 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -14.960 0.555 -14.155 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -15.800 1.753 -13.165 1.00 0.00 H new ATOM 1630 N GLY A 112 -14.112 -7.796 -10.920 1.00 0.00 N ATOM 1631 CA GLY A 112 -12.992 -8.717 -10.829 1.00 0.00 C ATOM 1632 C GLY A 112 -11.720 -7.991 -10.387 1.00 0.00 C ATOM 1633 O GLY A 112 -10.622 -8.534 -10.495 1.00 0.00 O ATOM 0 H GLY A 112 -14.643 -7.683 -10.056 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -13.226 -9.511 -10.120 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -12.827 -9.191 -11.796 1.00 0.00 H new ATOM 1637 N MET A 113 -11.911 -6.774 -9.900 1.00 0.00 N ATOM 1638 CA MET A 113 -10.792 -5.968 -9.441 1.00 0.00 C ATOM 1639 C MET A 113 -11.262 -4.874 -8.480 1.00 0.00 C ATOM 1640 O MET A 113 -12.463 -4.690 -8.283 1.00 0.00 O ATOM 1641 CB MET A 113 -10.098 -5.326 -10.644 1.00 0.00 C ATOM 1642 CG MET A 113 -11.007 -4.298 -11.318 1.00 0.00 C ATOM 1643 SD MET A 113 -10.401 -3.926 -12.955 1.00 0.00 S ATOM 1644 CE MET A 113 -11.354 -5.094 -13.912 1.00 0.00 C ATOM 0 H MET A 113 -12.823 -6.326 -9.813 1.00 0.00 H new ATOM 0 HA MET A 113 -10.095 -6.617 -8.911 1.00 0.00 H new ATOM 0 HB2 MET A 113 -9.175 -4.844 -10.321 1.00 0.00 H new ATOM 0 HB3 MET A 113 -9.820 -6.097 -11.362 1.00 0.00 H new ATOM 0 HG2 MET A 113 -12.025 -4.684 -11.377 1.00 0.00 H new ATOM 0 HG3 MET A 113 -11.046 -3.387 -10.720 1.00 0.00 H new ATOM 0 HE1 MET A 113 -11.097 -4.996 -14.967 1.00 0.00 H new ATOM 0 HE2 MET A 113 -11.131 -6.107 -13.577 1.00 0.00 H new ATOM 0 HE3 MET A 113 -12.417 -4.893 -13.777 1.00 0.00 H new ATOM 1654 N ILE A 114 -10.292 -4.177 -7.908 1.00 0.00 N ATOM 1655 CA ILE A 114 -10.592 -3.106 -6.972 1.00 0.00 C ATOM 1656 C ILE A 114 -9.659 -1.924 -7.241 1.00 0.00 C ATOM 1657 O ILE A 114 -8.475 -2.113 -7.516 1.00 0.00 O ATOM 1658 CB ILE A 114 -10.533 -3.621 -5.532 1.00 0.00 C ATOM 1659 CG1 ILE A 114 -10.960 -2.534 -4.544 1.00 0.00 C ATOM 1660 CG2 ILE A 114 -9.147 -4.180 -5.206 1.00 0.00 C ATOM 1661 CD1 ILE A 114 -11.289 -3.136 -3.176 1.00 0.00 C ATOM 0 H ILE A 114 -9.298 -4.332 -8.074 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.611 -2.748 -7.116 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.242 -4.443 -5.433 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -10.162 -1.799 -4.439 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -11.831 -2.006 -4.932 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -9.132 -4.539 -4.177 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -8.919 -5.005 -5.881 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -8.400 -3.395 -5.327 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -11.590 -2.342 -2.492 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -12.103 -3.853 -3.280 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -10.409 -3.642 -2.780 1.00 0.00 H new ATOM 1673 N GLN A 115 -10.227 -0.730 -7.152 1.00 0.00 N ATOM 1674 CA GLN A 115 -9.461 0.483 -7.382 1.00 0.00 C ATOM 1675 C GLN A 115 -9.045 1.109 -6.049 1.00 0.00 C ATOM 1676 O GLN A 115 -9.718 0.924 -5.036 1.00 0.00 O ATOM 1677 CB GLN A 115 -10.253 1.478 -8.232 1.00 0.00 C ATOM 1678 CG GLN A 115 -9.529 2.823 -8.318 1.00 0.00 C ATOM 1679 CD GLN A 115 -10.361 3.845 -9.095 1.00 0.00 C ATOM 1680 OE1 GLN A 115 -10.777 4.868 -8.577 1.00 0.00 O ATOM 1681 NE2 GLN A 115 -10.580 3.512 -10.364 1.00 0.00 N ATOM 0 H GLN A 115 -11.209 -0.577 -6.924 1.00 0.00 H new ATOM 0 HA GLN A 115 -8.559 0.221 -7.935 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -10.396 1.073 -9.234 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -11.244 1.621 -7.802 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -9.331 3.198 -7.314 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -8.563 2.690 -8.805 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -10.203 2.640 -10.735 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -11.125 4.129 -10.966 1.00 0.00 H new ATOM 1690 N LEU A 116 -7.940 1.837 -6.094 1.00 0.00 N ATOM 1691 CA LEU A 116 -7.427 2.492 -4.902 1.00 0.00 C ATOM 1692 C LEU A 116 -6.966 3.906 -5.261 1.00 0.00 C ATOM 1693 O LEU A 116 -6.062 4.080 -6.077 1.00 0.00 O ATOM 1694 CB LEU A 116 -6.339 1.638 -4.248 1.00 0.00 C ATOM 1695 CG LEU A 116 -6.735 0.203 -3.893 1.00 0.00 C ATOM 1696 CD1 LEU A 116 -5.506 -0.630 -3.525 1.00 0.00 C ATOM 1697 CD2 LEU A 116 -7.792 0.184 -2.788 1.00 0.00 C ATOM 0 H LEU A 116 -7.385 1.988 -6.936 1.00 0.00 H new ATOM 0 HA LEU A 116 -8.213 2.593 -4.154 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.481 1.601 -4.919 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -6.010 2.139 -3.337 1.00 0.00 H new ATOM 0 HG LEU A 116 -7.182 -0.256 -4.775 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.816 -1.645 -3.277 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -4.818 -0.657 -4.370 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -5.007 -0.183 -2.665 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -8.056 -0.848 -2.555 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -7.394 0.668 -1.896 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -8.680 0.718 -3.125 1.00 0.00 H new ATOM 1709 N VAL A 117 -7.608 4.880 -4.634 1.00 0.00 N ATOM 1710 CA VAL A 117 -7.276 6.274 -4.877 1.00 0.00 C ATOM 1711 C VAL A 117 -6.403 6.792 -3.732 1.00 0.00 C ATOM 1712 O VAL A 117 -6.794 6.723 -2.568 1.00 0.00 O ATOM 1713 CB VAL A 117 -8.555 7.091 -5.071 1.00 0.00 C ATOM 1714 CG1 VAL A 117 -8.243 8.460 -5.680 1.00 0.00 C ATOM 1715 CG2 VAL A 117 -9.568 6.328 -5.927 1.00 0.00 C ATOM 0 H VAL A 117 -8.357 4.732 -3.958 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.700 6.375 -5.797 1.00 0.00 H new ATOM 0 HB VAL A 117 -9.001 7.254 -4.090 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -9.169 9.021 -5.808 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.574 9.009 -5.017 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.763 8.326 -6.650 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.468 6.931 -6.050 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.134 6.120 -6.905 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.824 5.389 -5.437 1.00 0.00 H new ATOM 1725 N ILE A 118 -5.237 7.301 -4.103 1.00 0.00 N ATOM 1726 CA ILE A 118 -4.306 7.831 -3.121 1.00 0.00 C ATOM 1727 C ILE A 118 -4.082 9.321 -3.390 1.00 0.00 C ATOM 1728 O ILE A 118 -4.188 9.772 -4.529 1.00 0.00 O ATOM 1729 CB ILE A 118 -3.016 7.008 -3.107 1.00 0.00 C ATOM 1730 CG1 ILE A 118 -2.244 7.176 -4.418 1.00 0.00 C ATOM 1731 CG2 ILE A 118 -3.307 5.538 -2.797 1.00 0.00 C ATOM 1732 CD1 ILE A 118 -0.975 8.003 -4.205 1.00 0.00 C ATOM 0 H ILE A 118 -4.916 7.358 -5.069 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.722 7.746 -2.117 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.378 7.385 -2.308 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -1.981 6.196 -4.817 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -2.879 7.662 -5.158 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -2.374 4.975 -2.793 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.782 5.460 -1.819 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -3.973 5.131 -3.558 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -0.445 8.107 -5.152 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -1.243 8.990 -3.829 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -0.331 7.502 -3.482 1.00 0.00 H new ATOM 1744 N LEU A 119 -3.777 10.042 -2.321 1.00 0.00 N ATOM 1745 CA LEU A 119 -3.537 11.471 -2.427 1.00 0.00 C ATOM 1746 C LEU A 119 -2.241 11.822 -1.695 1.00 0.00 C ATOM 1747 O LEU A 119 -2.145 11.655 -0.480 1.00 0.00 O ATOM 1748 CB LEU A 119 -4.754 12.257 -1.934 1.00 0.00 C ATOM 1749 CG LEU A 119 -4.785 13.743 -2.297 1.00 0.00 C ATOM 1750 CD1 LEU A 119 -3.778 14.533 -1.460 1.00 0.00 C ATOM 1751 CD2 LEU A 119 -4.568 13.945 -3.798 1.00 0.00 C ATOM 0 H LEU A 119 -3.691 9.663 -1.378 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.402 11.758 -3.470 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -5.652 11.787 -2.335 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -4.804 12.167 -0.849 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.775 14.132 -2.060 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.821 15.586 -1.738 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -4.021 14.427 -0.403 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.774 14.150 -1.642 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.595 15.010 -4.029 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.599 13.536 -4.084 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.356 13.434 -4.352 1.00 0.00 H new ATOM 1763 N ARG A 120 -1.275 12.303 -2.464 1.00 0.00 N ATOM 1764 CA ARG A 120 0.012 12.678 -1.904 1.00 0.00 C ATOM 1765 C ARG A 120 0.231 14.186 -2.042 1.00 0.00 C ATOM 1766 O ARG A 120 -0.009 14.757 -3.105 1.00 0.00 O ATOM 1767 CB ARG A 120 1.154 11.938 -2.601 1.00 0.00 C ATOM 1768 CG ARG A 120 2.481 12.166 -1.874 1.00 0.00 C ATOM 1769 CD ARG A 120 3.359 10.915 -1.929 1.00 0.00 C ATOM 1770 NE ARG A 120 4.374 11.055 -2.998 1.00 0.00 N ATOM 1771 CZ ARG A 120 5.350 10.166 -3.228 1.00 0.00 C ATOM 1772 NH1 ARG A 120 5.449 9.068 -2.467 1.00 0.00 N ATOM 1773 NH2 ARG A 120 6.226 10.376 -4.220 1.00 0.00 N ATOM 0 H ARG A 120 -1.358 12.442 -3.471 1.00 0.00 H new ATOM 0 HA ARG A 120 0.007 12.402 -0.849 1.00 0.00 H new ATOM 0 HB2 ARG A 120 0.933 10.871 -2.636 1.00 0.00 H new ATOM 0 HB3 ARG A 120 1.237 12.280 -3.633 1.00 0.00 H new ATOM 0 HG2 ARG A 120 3.009 13.005 -2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 120 2.289 12.434 -0.835 1.00 0.00 H new ATOM 0 HD2 ARG A 120 3.850 10.763 -0.968 1.00 0.00 H new ATOM 0 HD3 ARG A 120 2.742 10.036 -2.115 1.00 0.00 H new ATOM 0 HE ARG A 120 4.327 11.880 -3.597 1.00 0.00 H new ATOM 0 HH11 ARG A 120 4.781 8.909 -1.712 1.00 0.00 H new ATOM 0 HH12 ARG A 120 6.192 8.391 -2.642 1.00 0.00 H new ATOM 0 HH21 ARG A 120 6.150 11.212 -4.799 1.00 0.00 H new ATOM 0 HH22 ARG A 120 6.969 9.700 -4.396 1.00 0.00 H new