USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=17 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 : amide:sc= -15.7! C(o=-15!,f=-9.2!) USER MOD Set 1.2: A 103 SER OG : rot 114:sc= 0.356! USER MOD Set 2.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 53 THR OG1 : rot 180:sc= -0.398 USER MOD Set 3.1: A 24 GLN : amide:sc= -2.49 K(o=-3,f=-15!) USER MOD Set 3.2: A 26 THR OG1 : rot 87:sc= -0.459 USER MOD Single : A 32 ASN : amide:sc= -1.88! K(o=-1.9!,f=-0.82) USER MOD Single : A 34 SER OG : rot -109:sc= -0.0483 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 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.29 K(o=-0.29,f=-2.9!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot -160:sc= -0.635 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= -2.97! C(o=-3!,f=-1.8!) 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 77 ASN : amide:sc= -2.52! C(o=-2.5!,f=-4.6!) USER MOD Single : A 79 GLN : amide:sc= -1.21 K(o=-1.2,f=-2.4) 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= -0.507 USER MOD Single : A 93 ASN : amide:sc= -2.65 K(o=-2.7,f=-6.6!) USER MOD Single : A 94 HIS : no HD1:sc= -0.261 X(o=-0.26,f=-0.0072) USER MOD Single : A 97 MET CE :methyl -164:sc= -6.56! (180deg=-7.34!) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl -115:sc= -6.04! (180deg=-8.29!) 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= -1.21 X(o=-1.2,f=-1.1) USER MOD Single : A 113 MET CE :methyl -127:sc= 0 (180deg=-0.0343) USER MOD Single : A 115 GLN : amide:sc= -6.61! C(o=-6.6!,f=-8.9!) USER MOD ----------------------------------------------------------------- ATOM 283 N GLU A 23 -1.523 15.788 -5.742 1.00 0.00 N ATOM 284 CA GLU A 23 -1.236 14.703 -6.664 1.00 0.00 C ATOM 285 C GLU A 23 -1.997 13.441 -6.253 1.00 0.00 C ATOM 286 O GLU A 23 -1.891 12.992 -5.113 1.00 0.00 O ATOM 287 CB GLU A 23 0.269 14.435 -6.744 1.00 0.00 C ATOM 288 CG GLU A 23 0.900 15.193 -7.913 1.00 0.00 C ATOM 289 CD GLU A 23 0.496 14.572 -9.252 1.00 0.00 C ATOM 290 OE1 GLU A 23 0.662 13.339 -9.378 1.00 0.00 O ATOM 291 OE2 GLU A 23 0.031 15.343 -10.118 1.00 0.00 O ATOM 0 HA GLU A 23 -1.572 14.998 -7.658 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.746 14.736 -5.811 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.446 13.366 -6.862 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.589 16.237 -7.884 1.00 0.00 H new ATOM 0 HG3 GLU A 23 1.986 15.181 -7.815 1.00 0.00 H new ATOM 298 N GLN A 24 -2.746 12.904 -7.205 1.00 0.00 N ATOM 299 CA GLN A 24 -3.524 11.702 -6.956 1.00 0.00 C ATOM 300 C GLN A 24 -3.020 10.553 -7.830 1.00 0.00 C ATOM 301 O GLN A 24 -2.681 10.756 -8.995 1.00 0.00 O ATOM 302 CB GLN A 24 -5.015 11.956 -7.190 1.00 0.00 C ATOM 303 CG GLN A 24 -5.814 10.654 -7.101 1.00 0.00 C ATOM 304 CD GLN A 24 -6.052 10.061 -8.491 1.00 0.00 C ATOM 305 OE1 GLN A 24 -5.161 9.516 -9.122 1.00 0.00 O ATOM 306 NE2 GLN A 24 -7.300 10.196 -8.930 1.00 0.00 N ATOM 0 H GLN A 24 -2.831 13.279 -8.150 1.00 0.00 H new ATOM 0 HA GLN A 24 -3.397 11.420 -5.911 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -5.387 12.666 -6.451 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.161 12.410 -8.170 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.277 9.935 -6.482 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -6.770 10.843 -6.613 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -7.997 10.663 -8.350 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -7.560 9.832 -9.847 1.00 0.00 H new ATOM 315 N LEU A 25 -2.986 9.369 -7.235 1.00 0.00 N ATOM 316 CA LEU A 25 -2.529 8.187 -7.945 1.00 0.00 C ATOM 317 C LEU A 25 -3.591 7.091 -7.838 1.00 0.00 C ATOM 318 O LEU A 25 -3.864 6.589 -6.749 1.00 0.00 O ATOM 319 CB LEU A 25 -1.150 7.758 -7.439 1.00 0.00 C ATOM 320 CG LEU A 25 0.040 8.547 -7.988 1.00 0.00 C ATOM 321 CD1 LEU A 25 1.282 8.342 -7.118 1.00 0.00 C ATOM 322 CD2 LEU A 25 0.303 8.195 -9.454 1.00 0.00 C ATOM 0 H LEU A 25 -3.268 9.204 -6.269 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.401 8.405 -9.005 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.143 7.837 -6.352 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.007 6.705 -7.683 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.208 9.608 -7.951 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.113 8.914 -7.530 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.076 8.682 -6.103 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.543 7.284 -7.100 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.154 8.770 -9.819 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.521 7.130 -9.539 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -0.578 8.434 -10.049 1.00 0.00 H new ATOM 334 N THR A 26 -4.162 6.751 -8.985 1.00 0.00 N ATOM 335 CA THR A 26 -5.188 5.724 -9.034 1.00 0.00 C ATOM 336 C THR A 26 -4.592 4.396 -9.507 1.00 0.00 C ATOM 337 O THR A 26 -4.196 4.267 -10.664 1.00 0.00 O ATOM 338 CB THR A 26 -6.323 6.231 -9.926 1.00 0.00 C ATOM 339 OG1 THR A 26 -6.596 7.539 -9.429 1.00 0.00 O ATOM 340 CG2 THR A 26 -7.630 5.468 -9.702 1.00 0.00 C ATOM 0 H THR A 26 -3.933 7.169 -9.887 1.00 0.00 H new ATOM 0 HA THR A 26 -5.597 5.527 -8.043 1.00 0.00 H new ATOM 0 HB THR A 26 -6.028 6.146 -10.972 1.00 0.00 H new ATOM 0 HG1 THR A 26 -6.006 8.186 -9.870 1.00 0.00 H new ATOM 0 HG21 THR A 26 -8.402 5.868 -10.360 1.00 0.00 H new ATOM 0 HG22 THR A 26 -7.477 4.412 -9.922 1.00 0.00 H new ATOM 0 HG23 THR A 26 -7.944 5.580 -8.664 1.00 0.00 H new ATOM 348 N LEU A 27 -4.547 3.444 -8.587 1.00 0.00 N ATOM 349 CA LEU A 27 -4.005 2.131 -8.895 1.00 0.00 C ATOM 350 C LEU A 27 -5.125 1.092 -8.820 1.00 0.00 C ATOM 351 O LEU A 27 -5.814 0.989 -7.806 1.00 0.00 O ATOM 352 CB LEU A 27 -2.813 1.817 -7.988 1.00 0.00 C ATOM 353 CG LEU A 27 -1.680 2.845 -7.990 1.00 0.00 C ATOM 354 CD1 LEU A 27 -0.996 2.905 -9.358 1.00 0.00 C ATOM 355 CD2 LEU A 27 -2.184 4.218 -7.541 1.00 0.00 C ATOM 0 H LEU A 27 -4.877 3.555 -7.628 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.616 2.108 -9.913 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.178 1.709 -6.966 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.402 0.852 -8.283 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.929 2.526 -7.268 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.195 3.643 -9.332 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.580 1.927 -9.600 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.725 3.188 -10.117 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.359 4.930 -7.551 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.966 4.559 -8.220 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.587 4.145 -6.531 1.00 0.00 H new ATOM 367 N GLU A 28 -5.272 0.348 -9.906 1.00 0.00 N ATOM 368 CA GLU A 28 -6.297 -0.680 -9.976 1.00 0.00 C ATOM 369 C GLU A 28 -5.681 -2.060 -9.737 1.00 0.00 C ATOM 370 O GLU A 28 -4.623 -2.375 -10.281 1.00 0.00 O ATOM 371 CB GLU A 28 -7.031 -0.632 -11.318 1.00 0.00 C ATOM 372 CG GLU A 28 -8.427 -0.028 -11.157 1.00 0.00 C ATOM 373 CD GLU A 28 -9.435 -1.089 -10.711 1.00 0.00 C ATOM 374 OE1 GLU A 28 -9.098 -1.829 -9.762 1.00 0.00 O ATOM 375 OE2 GLU A 28 -10.521 -1.137 -11.330 1.00 0.00 O ATOM 0 H GLU A 28 -4.699 0.436 -10.745 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.030 -0.490 -9.192 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.455 -0.042 -12.031 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.111 -1.638 -11.729 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.396 0.779 -10.425 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.749 0.410 -12.102 1.00 0.00 H new ATOM 382 N ILE A 29 -6.370 -2.848 -8.924 1.00 0.00 N ATOM 383 CA ILE A 29 -5.904 -4.187 -8.607 1.00 0.00 C ATOM 384 C ILE A 29 -7.016 -5.194 -8.908 1.00 0.00 C ATOM 385 O ILE A 29 -8.115 -5.092 -8.364 1.00 0.00 O ATOM 386 CB ILE A 29 -5.393 -4.249 -7.166 1.00 0.00 C ATOM 387 CG1 ILE A 29 -4.126 -3.407 -6.998 1.00 0.00 C ATOM 388 CG2 ILE A 29 -5.182 -5.697 -6.721 1.00 0.00 C ATOM 389 CD1 ILE A 29 -4.374 -2.226 -6.058 1.00 0.00 C ATOM 0 H ILE A 29 -7.247 -2.584 -8.475 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.054 -4.453 -9.235 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.154 -3.820 -6.514 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -3.322 -4.028 -6.603 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.797 -3.040 -7.970 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.819 -5.713 -5.693 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -6.127 -6.237 -6.780 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.450 -6.175 -7.372 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.458 -1.644 -5.956 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.162 -1.594 -6.468 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.679 -2.597 -5.080 1.00 0.00 H new ATOM 401 N PRO A 30 -6.684 -6.167 -9.798 1.00 0.00 N ATOM 402 CA PRO A 30 -7.642 -7.192 -10.178 1.00 0.00 C ATOM 403 C PRO A 30 -7.815 -8.223 -9.061 1.00 0.00 C ATOM 404 O PRO A 30 -6.869 -8.521 -8.334 1.00 0.00 O ATOM 405 CB PRO A 30 -7.088 -7.792 -11.460 1.00 0.00 C ATOM 406 CG PRO A 30 -5.618 -7.408 -11.498 1.00 0.00 C ATOM 407 CD PRO A 30 -5.393 -6.319 -10.462 1.00 0.00 C ATOM 0 HA PRO A 30 -8.643 -6.792 -10.341 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -7.209 -8.875 -11.469 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.615 -7.405 -12.332 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.992 -8.274 -11.283 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.342 -7.053 -12.491 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.614 -6.601 -9.754 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.076 -5.387 -10.930 1.00 0.00 H new ATOM 415 N LEU A 31 -9.031 -8.739 -8.959 1.00 0.00 N ATOM 416 CA LEU A 31 -9.340 -9.731 -7.943 1.00 0.00 C ATOM 417 C LEU A 31 -9.967 -10.958 -8.608 1.00 0.00 C ATOM 418 O LEU A 31 -11.031 -11.416 -8.195 1.00 0.00 O ATOM 419 CB LEU A 31 -10.208 -9.117 -6.842 1.00 0.00 C ATOM 420 CG LEU A 31 -9.635 -7.880 -6.148 1.00 0.00 C ATOM 421 CD1 LEU A 31 -10.503 -7.469 -4.957 1.00 0.00 C ATOM 422 CD2 LEU A 31 -8.177 -8.104 -5.744 1.00 0.00 C ATOM 0 H LEU A 31 -9.814 -8.489 -9.563 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.429 -10.067 -7.449 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -11.174 -8.853 -7.273 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.394 -9.880 -6.086 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.649 -7.053 -6.858 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.074 -6.587 -4.481 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -11.511 -7.240 -5.303 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.543 -8.286 -4.237 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.794 -7.209 -5.253 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.115 -8.949 -5.058 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.581 -8.313 -6.633 1.00 0.00 H new ATOM 434 N ASN A 32 -9.280 -11.455 -9.626 1.00 0.00 N ATOM 435 CA ASN A 32 -9.756 -12.620 -10.351 1.00 0.00 C ATOM 436 C ASN A 32 -9.156 -13.883 -9.730 1.00 0.00 C ATOM 437 O ASN A 32 -9.883 -14.740 -9.230 1.00 0.00 O ATOM 438 CB ASN A 32 -9.329 -12.567 -11.820 1.00 0.00 C ATOM 439 CG ASN A 32 -9.658 -11.207 -12.437 1.00 0.00 C ATOM 440 OD1 ASN A 32 -10.761 -10.953 -12.893 1.00 0.00 O ATOM 441 ND2 ASN A 32 -8.643 -10.348 -12.427 1.00 0.00 N ATOM 0 H ASN A 32 -8.398 -11.072 -9.966 1.00 0.00 H new ATOM 0 HA ASN A 32 -10.844 -12.632 -10.291 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -8.258 -12.757 -11.898 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.834 -13.355 -12.378 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.762 -9.413 -12.817 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -7.745 -10.624 -12.030 1.00 0.00 H new ATOM 448 N ASP A 33 -7.834 -13.959 -9.782 1.00 0.00 N ATOM 449 CA ASP A 33 -7.128 -15.103 -9.231 1.00 0.00 C ATOM 450 C ASP A 33 -7.111 -14.999 -7.705 1.00 0.00 C ATOM 451 O ASP A 33 -7.425 -15.964 -7.010 1.00 0.00 O ATOM 452 CB ASP A 33 -5.678 -15.142 -9.718 1.00 0.00 C ATOM 453 CG ASP A 33 -5.442 -15.974 -10.980 1.00 0.00 C ATOM 454 OD1 ASP A 33 -5.676 -17.200 -10.904 1.00 0.00 O ATOM 455 OD2 ASP A 33 -5.033 -15.366 -11.993 1.00 0.00 O ATOM 0 H ASP A 33 -7.233 -13.247 -10.197 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.643 -16.007 -9.558 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -5.346 -14.121 -9.907 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -5.052 -15.538 -8.918 1.00 0.00 H new ATOM 460 N SER A 34 -6.741 -13.819 -7.228 1.00 0.00 N ATOM 461 CA SER A 34 -6.679 -13.577 -5.796 1.00 0.00 C ATOM 462 C SER A 34 -8.090 -13.382 -5.237 1.00 0.00 C ATOM 463 O SER A 34 -8.315 -13.544 -4.039 1.00 0.00 O ATOM 464 CB SER A 34 -5.810 -12.358 -5.481 1.00 0.00 C ATOM 465 OG SER A 34 -4.745 -12.678 -4.591 1.00 0.00 O ATOM 0 H SER A 34 -6.481 -13.021 -7.807 1.00 0.00 H new ATOM 0 HA SER A 34 -6.224 -14.446 -5.321 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.400 -11.956 -6.407 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.428 -11.576 -5.040 1.00 0.00 H new ATOM 0 HG SER A 34 -4.917 -12.272 -3.716 1.00 0.00 H new ATOM 471 N GLY A 35 -9.004 -13.036 -6.132 1.00 0.00 N ATOM 472 CA GLY A 35 -10.387 -12.817 -5.743 1.00 0.00 C ATOM 473 C GLY A 35 -10.812 -13.802 -4.652 1.00 0.00 C ATOM 474 O GLY A 35 -11.531 -13.434 -3.724 1.00 0.00 O ATOM 0 H GLY A 35 -8.814 -12.902 -7.125 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.510 -11.795 -5.384 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -11.035 -12.929 -6.612 1.00 0.00 H new ATOM 478 N SER A 36 -10.350 -15.035 -4.800 1.00 0.00 N ATOM 479 CA SER A 36 -10.674 -16.076 -3.839 1.00 0.00 C ATOM 480 C SER A 36 -10.332 -15.606 -2.424 1.00 0.00 C ATOM 481 O SER A 36 -11.197 -15.579 -1.550 1.00 0.00 O ATOM 482 CB SER A 36 -9.929 -17.373 -4.162 1.00 0.00 C ATOM 483 OG SER A 36 -10.478 -18.035 -5.298 1.00 0.00 O ATOM 0 H SER A 36 -9.754 -15.337 -5.571 1.00 0.00 H new ATOM 0 HA SER A 36 -11.743 -16.278 -3.899 1.00 0.00 H new ATOM 0 HB2 SER A 36 -8.878 -17.151 -4.345 1.00 0.00 H new ATOM 0 HB3 SER A 36 -9.969 -18.039 -3.300 1.00 0.00 H new ATOM 0 HG SER A 36 -9.974 -18.857 -5.473 1.00 0.00 H new ATOM 489 N ALA A 37 -9.070 -15.248 -2.242 1.00 0.00 N ATOM 490 CA ALA A 37 -8.604 -14.780 -0.947 1.00 0.00 C ATOM 491 C ALA A 37 -8.960 -13.301 -0.786 1.00 0.00 C ATOM 492 O ALA A 37 -9.580 -12.912 0.202 1.00 0.00 O ATOM 493 CB ALA A 37 -7.100 -15.035 -0.823 1.00 0.00 C ATOM 0 H ALA A 37 -8.355 -15.272 -2.969 1.00 0.00 H new ATOM 0 HA ALA A 37 -9.095 -15.327 -0.142 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -6.750 -14.684 0.148 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -6.903 -16.103 -0.915 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -6.574 -14.500 -1.613 1.00 0.00 H new ATOM 499 N GLY A 38 -8.551 -12.516 -1.772 1.00 0.00 N ATOM 500 CA GLY A 38 -8.819 -11.088 -1.752 1.00 0.00 C ATOM 501 C GLY A 38 -7.543 -10.287 -2.019 1.00 0.00 C ATOM 502 O GLY A 38 -6.497 -10.860 -2.319 1.00 0.00 O ATOM 0 H GLY A 38 -8.036 -12.842 -2.590 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.569 -10.845 -2.504 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.234 -10.806 -0.784 1.00 0.00 H new ATOM 506 N LEU A 39 -7.672 -8.973 -1.901 1.00 0.00 N ATOM 507 CA LEU A 39 -6.542 -8.088 -2.126 1.00 0.00 C ATOM 508 C LEU A 39 -5.284 -8.707 -1.514 1.00 0.00 C ATOM 509 O LEU A 39 -4.378 -9.121 -2.234 1.00 0.00 O ATOM 510 CB LEU A 39 -6.851 -6.682 -1.607 1.00 0.00 C ATOM 511 CG LEU A 39 -7.701 -5.800 -2.524 1.00 0.00 C ATOM 512 CD1 LEU A 39 -8.195 -4.556 -1.784 1.00 0.00 C ATOM 513 CD2 LEU A 39 -6.938 -5.442 -3.801 1.00 0.00 C ATOM 0 H LEU A 39 -8.541 -8.501 -1.653 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.354 -7.975 -3.194 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.362 -6.774 -0.649 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -5.907 -6.171 -1.417 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.582 -6.367 -2.823 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.796 -3.946 -2.458 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -8.801 -4.858 -0.930 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.340 -3.976 -1.436 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.564 -4.815 -4.435 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -6.028 -4.901 -3.542 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.678 -6.355 -4.337 1.00 0.00 H new ATOM 525 N GLY A 40 -5.269 -8.750 -0.189 1.00 0.00 N ATOM 526 CA GLY A 40 -4.138 -9.312 0.528 1.00 0.00 C ATOM 527 C GLY A 40 -3.162 -8.214 0.959 1.00 0.00 C ATOM 528 O GLY A 40 -1.969 -8.290 0.670 1.00 0.00 O ATOM 0 H GLY A 40 -6.022 -8.405 0.406 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.492 -9.854 1.405 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -3.623 -10.033 -0.106 1.00 0.00 H new ATOM 532 N VAL A 41 -3.706 -7.219 1.644 1.00 0.00 N ATOM 533 CA VAL A 41 -2.899 -6.107 2.118 1.00 0.00 C ATOM 534 C VAL A 41 -3.420 -5.649 3.481 1.00 0.00 C ATOM 535 O VAL A 41 -4.589 -5.853 3.804 1.00 0.00 O ATOM 536 CB VAL A 41 -2.888 -4.987 1.075 1.00 0.00 C ATOM 537 CG1 VAL A 41 -1.892 -5.292 -0.046 1.00 0.00 C ATOM 538 CG2 VAL A 41 -4.290 -4.748 0.513 1.00 0.00 C ATOM 0 H VAL A 41 -4.696 -7.159 1.882 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.863 -6.417 2.254 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.565 -4.071 1.570 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.904 -4.481 -0.774 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.891 -5.389 0.373 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -2.171 -6.224 -0.537 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.254 -3.947 -0.226 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.653 -5.661 0.041 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.963 -4.465 1.322 1.00 0.00 H new ATOM 548 N SER A 42 -2.526 -5.040 4.246 1.00 0.00 N ATOM 549 CA SER A 42 -2.880 -4.551 5.568 1.00 0.00 C ATOM 550 C SER A 42 -2.775 -3.025 5.607 1.00 0.00 C ATOM 551 O SER A 42 -1.785 -2.456 5.150 1.00 0.00 O ATOM 552 CB SER A 42 -1.986 -5.173 6.643 1.00 0.00 C ATOM 553 OG SER A 42 -2.618 -5.186 7.920 1.00 0.00 O ATOM 0 H SER A 42 -1.557 -4.874 3.976 1.00 0.00 H new ATOM 0 HA SER A 42 -3.909 -4.843 5.777 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.729 -6.192 6.355 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.052 -4.614 6.706 1.00 0.00 H new ATOM 0 HG SER A 42 -2.016 -5.592 8.579 1.00 0.00 H new ATOM 559 N LEU A 43 -3.809 -2.407 6.159 1.00 0.00 N ATOM 560 CA LEU A 43 -3.845 -0.958 6.264 1.00 0.00 C ATOM 561 C LEU A 43 -3.856 -0.558 7.741 1.00 0.00 C ATOM 562 O LEU A 43 -3.901 -1.418 8.620 1.00 0.00 O ATOM 563 CB LEU A 43 -5.021 -0.392 5.465 1.00 0.00 C ATOM 564 CG LEU A 43 -5.311 -1.072 4.126 1.00 0.00 C ATOM 565 CD1 LEU A 43 -6.139 -0.162 3.216 1.00 0.00 C ATOM 566 CD2 LEU A 43 -4.016 -1.531 3.452 1.00 0.00 C ATOM 0 H LEU A 43 -4.628 -2.883 6.538 1.00 0.00 H new ATOM 0 HA LEU A 43 -2.949 -0.522 5.822 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.917 -0.453 6.083 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.833 0.666 5.280 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.908 -1.964 4.319 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.331 -0.670 2.271 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.087 0.072 3.701 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.590 0.761 3.027 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.251 -2.011 2.502 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.373 -0.669 3.274 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.500 -2.240 4.099 1.00 0.00 H new ATOM 578 N LYS A 44 -3.815 0.746 7.968 1.00 0.00 N ATOM 579 CA LYS A 44 -3.820 1.270 9.324 1.00 0.00 C ATOM 580 C LYS A 44 -4.776 2.462 9.402 1.00 0.00 C ATOM 581 O LYS A 44 -4.879 3.243 8.457 1.00 0.00 O ATOM 582 CB LYS A 44 -2.395 1.594 9.778 1.00 0.00 C ATOM 583 CG LYS A 44 -1.986 3.001 9.338 1.00 0.00 C ATOM 584 CD LYS A 44 -0.510 3.265 9.646 1.00 0.00 C ATOM 585 CE LYS A 44 -0.030 4.550 8.969 1.00 0.00 C ATOM 586 NZ LYS A 44 0.583 5.460 9.962 1.00 0.00 N ATOM 0 H LYS A 44 -3.778 1.456 7.236 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.189 0.518 10.022 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -2.328 1.515 10.863 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.702 0.863 9.362 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -2.165 3.118 8.269 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.605 3.739 9.847 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -0.368 3.343 10.724 1.00 0.00 H new ATOM 0 HD3 LYS A 44 0.093 2.423 9.305 1.00 0.00 H new ATOM 0 HE2 LYS A 44 0.695 4.310 8.191 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -0.869 5.046 8.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 0.904 6.328 9.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -0.119 5.703 10.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.396 4.990 10.409 1.00 0.00 H new ATOM 600 N GLY A 45 -5.452 2.564 10.537 1.00 0.00 N ATOM 601 CA GLY A 45 -6.396 3.648 10.751 1.00 0.00 C ATOM 602 C GLY A 45 -5.752 4.789 11.541 1.00 0.00 C ATOM 603 O GLY A 45 -5.325 4.597 12.679 1.00 0.00 O ATOM 0 H GLY A 45 -5.365 1.914 11.318 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.750 4.021 9.790 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -7.267 3.275 11.289 1.00 0.00 H new ATOM 607 N ASN A 46 -5.701 5.950 10.906 1.00 0.00 N ATOM 608 CA ASN A 46 -5.116 7.122 11.535 1.00 0.00 C ATOM 609 C ASN A 46 -6.228 7.973 12.151 1.00 0.00 C ATOM 610 O ASN A 46 -7.235 8.250 11.501 1.00 0.00 O ATOM 611 CB ASN A 46 -4.373 7.984 10.512 1.00 0.00 C ATOM 612 CG ASN A 46 -2.934 8.248 10.960 1.00 0.00 C ATOM 613 OD1 ASN A 46 -2.531 7.924 12.065 1.00 0.00 O ATOM 614 ND2 ASN A 46 -2.185 8.853 10.043 1.00 0.00 N ATOM 0 H ASN A 46 -6.055 6.105 9.962 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.414 6.781 12.296 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.370 7.484 9.543 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.896 8.931 10.380 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -1.210 9.073 10.245 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -2.586 9.097 9.137 1.00 0.00 H new ATOM 621 N LYS A 47 -6.009 8.365 13.398 1.00 0.00 N ATOM 622 CA LYS A 47 -6.980 9.179 14.109 1.00 0.00 C ATOM 623 C LYS A 47 -6.317 10.484 14.553 1.00 0.00 C ATOM 624 O LYS A 47 -5.102 10.536 14.740 1.00 0.00 O ATOM 625 CB LYS A 47 -7.606 8.385 15.258 1.00 0.00 C ATOM 626 CG LYS A 47 -9.046 8.833 15.512 1.00 0.00 C ATOM 627 CD LYS A 47 -9.378 8.791 17.005 1.00 0.00 C ATOM 628 CE LYS A 47 -10.882 8.952 17.237 1.00 0.00 C ATOM 629 NZ LYS A 47 -11.200 8.827 18.677 1.00 0.00 N ATOM 0 H LYS A 47 -5.173 8.134 13.934 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.806 9.448 13.451 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.589 7.321 15.022 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.014 8.520 16.163 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.188 9.845 15.133 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.733 8.188 14.965 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -9.040 7.846 17.430 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -8.839 9.584 17.523 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -11.211 9.924 16.869 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -11.426 8.196 16.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -12.224 8.939 18.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -10.904 7.890 19.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -10.695 9.564 19.209 1.00 0.00 H new ATOM 643 N SER A 48 -7.144 11.507 14.710 1.00 0.00 N ATOM 644 CA SER A 48 -6.653 12.809 15.128 1.00 0.00 C ATOM 645 C SER A 48 -7.253 13.183 16.485 1.00 0.00 C ATOM 646 O SER A 48 -8.396 12.836 16.780 1.00 0.00 O ATOM 647 CB SER A 48 -6.982 13.882 14.089 1.00 0.00 C ATOM 648 OG SER A 48 -5.834 14.268 13.338 1.00 0.00 O ATOM 0 H SER A 48 -8.151 11.461 14.555 1.00 0.00 H new ATOM 0 HA SER A 48 -5.568 12.752 15.220 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.749 13.507 13.411 1.00 0.00 H new ATOM 0 HB3 SER A 48 -7.398 14.756 14.590 1.00 0.00 H new ATOM 0 HG SER A 48 -5.992 15.143 12.925 1.00 0.00 H new ATOM 654 N ARG A 49 -6.455 13.886 17.276 1.00 0.00 N ATOM 655 CA ARG A 49 -6.893 14.311 18.594 1.00 0.00 C ATOM 656 C ARG A 49 -7.588 15.672 18.510 1.00 0.00 C ATOM 657 O ARG A 49 -8.671 15.855 19.063 1.00 0.00 O ATOM 658 CB ARG A 49 -5.712 14.408 19.562 1.00 0.00 C ATOM 659 CG ARG A 49 -5.919 13.496 20.773 1.00 0.00 C ATOM 660 CD ARG A 49 -5.698 14.261 22.080 1.00 0.00 C ATOM 661 NE ARG A 49 -6.787 13.958 23.035 1.00 0.00 N ATOM 662 CZ ARG A 49 -6.786 14.337 24.320 1.00 0.00 C ATOM 663 NH1 ARG A 49 -5.754 15.036 24.812 1.00 0.00 N ATOM 664 NH2 ARG A 49 -7.818 14.017 25.113 1.00 0.00 N ATOM 0 H ARG A 49 -5.508 14.172 17.029 1.00 0.00 H new ATOM 0 HA ARG A 49 -7.594 13.564 18.967 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.792 14.132 19.047 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -5.594 15.439 19.895 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -6.928 13.085 20.755 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.230 12.653 20.720 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -4.736 13.986 22.513 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -5.664 15.332 21.882 1.00 0.00 H new ATOM 0 HE ARG A 49 -7.588 13.427 22.694 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -4.969 15.280 24.208 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -5.754 15.324 25.790 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -8.604 13.485 24.738 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -7.818 14.305 26.091 1.00 0.00 H new ATOM 678 N GLU A 50 -6.936 16.591 17.814 1.00 0.00 N ATOM 679 CA GLU A 50 -7.477 17.929 17.651 1.00 0.00 C ATOM 680 C GLU A 50 -8.939 17.860 17.204 1.00 0.00 C ATOM 681 O GLU A 50 -9.839 18.243 17.951 1.00 0.00 O ATOM 682 CB GLU A 50 -6.640 18.743 16.661 1.00 0.00 C ATOM 683 CG GLU A 50 -5.183 18.830 17.118 1.00 0.00 C ATOM 684 CD GLU A 50 -4.850 20.235 17.624 1.00 0.00 C ATOM 685 OE1 GLU A 50 -4.531 21.086 16.767 1.00 0.00 O ATOM 686 OE2 GLU A 50 -4.922 20.425 18.858 1.00 0.00 O ATOM 0 H GLU A 50 -6.038 16.435 17.356 1.00 0.00 H new ATOM 0 HA GLU A 50 -7.435 18.436 18.615 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -6.689 18.283 15.674 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -7.056 19.746 16.566 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.002 18.102 17.909 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -4.522 18.572 16.290 1.00 0.00 H new ATOM 693 N THR A 51 -9.131 17.367 15.990 1.00 0.00 N ATOM 694 CA THR A 51 -10.469 17.242 15.435 1.00 0.00 C ATOM 695 C THR A 51 -11.267 16.185 16.201 1.00 0.00 C ATOM 696 O THR A 51 -12.496 16.175 16.153 1.00 0.00 O ATOM 697 CB THR A 51 -10.335 16.939 13.942 1.00 0.00 C ATOM 698 OG1 THR A 51 -11.638 17.185 13.419 1.00 0.00 O ATOM 699 CG2 THR A 51 -10.097 15.453 13.665 1.00 0.00 C ATOM 0 H THR A 51 -8.383 17.049 15.374 1.00 0.00 H new ATOM 0 HA THR A 51 -11.031 18.170 15.543 1.00 0.00 H new ATOM 0 HB THR A 51 -9.513 17.522 13.526 1.00 0.00 H new ATOM 0 HG1 THR A 51 -11.641 17.014 12.454 1.00 0.00 H new ATOM 0 HG21 THR A 51 -10.009 15.293 12.590 1.00 0.00 H new ATOM 0 HG22 THR A 51 -9.177 15.134 14.156 1.00 0.00 H new ATOM 0 HG23 THR A 51 -10.935 14.872 14.051 1.00 0.00 H new ATOM 707 N GLY A 52 -10.535 15.322 16.890 1.00 0.00 N ATOM 708 CA GLY A 52 -11.159 14.263 17.665 1.00 0.00 C ATOM 709 C GLY A 52 -12.008 13.357 16.771 1.00 0.00 C ATOM 710 O GLY A 52 -13.022 12.817 17.212 1.00 0.00 O ATOM 0 H GLY A 52 -9.516 15.334 16.928 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.391 13.672 18.164 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -11.783 14.698 18.445 1.00 0.00 H new ATOM 714 N THR A 53 -11.562 13.217 15.531 1.00 0.00 N ATOM 715 CA THR A 53 -12.268 12.385 14.572 1.00 0.00 C ATOM 716 C THR A 53 -11.274 11.595 13.718 1.00 0.00 C ATOM 717 O THR A 53 -10.138 12.026 13.523 1.00 0.00 O ATOM 718 CB THR A 53 -13.190 13.289 13.751 1.00 0.00 C ATOM 719 OG1 THR A 53 -13.721 14.203 14.706 1.00 0.00 O ATOM 720 CG2 THR A 53 -14.419 12.546 13.223 1.00 0.00 C ATOM 0 H THR A 53 -10.721 13.666 15.169 1.00 0.00 H new ATOM 0 HA THR A 53 -12.883 11.638 15.074 1.00 0.00 H new ATOM 0 HB THR A 53 -12.633 13.711 12.914 1.00 0.00 H new ATOM 0 HG1 THR A 53 -14.329 14.828 14.258 1.00 0.00 H new ATOM 0 HG21 THR A 53 -15.040 13.233 12.648 1.00 0.00 H new ATOM 0 HG22 THR A 53 -14.100 11.723 12.584 1.00 0.00 H new ATOM 0 HG23 THR A 53 -14.994 12.152 14.061 1.00 0.00 H new ATOM 728 N ASP A 54 -11.737 10.453 13.232 1.00 0.00 N ATOM 729 CA ASP A 54 -10.903 9.599 12.404 1.00 0.00 C ATOM 730 C ASP A 54 -10.429 10.387 11.182 1.00 0.00 C ATOM 731 O ASP A 54 -11.214 11.094 10.552 1.00 0.00 O ATOM 732 CB ASP A 54 -11.684 8.380 11.908 1.00 0.00 C ATOM 733 CG ASP A 54 -12.391 7.576 13.000 1.00 0.00 C ATOM 734 OD1 ASP A 54 -13.364 8.119 13.566 1.00 0.00 O ATOM 735 OD2 ASP A 54 -11.942 6.435 13.245 1.00 0.00 O ATOM 0 H ASP A 54 -12.679 10.099 13.396 1.00 0.00 H new ATOM 0 HA ASP A 54 -10.059 9.265 13.007 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -12.428 8.714 11.185 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -10.998 7.719 11.378 1.00 0.00 H new ATOM 740 N LEU A 55 -9.147 10.238 10.883 1.00 0.00 N ATOM 741 CA LEU A 55 -8.558 10.927 9.747 1.00 0.00 C ATOM 742 C LEU A 55 -8.960 10.209 8.456 1.00 0.00 C ATOM 743 O LEU A 55 -9.349 10.850 7.481 1.00 0.00 O ATOM 744 CB LEU A 55 -7.046 11.065 9.928 1.00 0.00 C ATOM 745 CG LEU A 55 -6.581 12.194 10.850 1.00 0.00 C ATOM 746 CD1 LEU A 55 -5.087 12.073 11.156 1.00 0.00 C ATOM 747 CD2 LEU A 55 -6.937 13.562 10.265 1.00 0.00 C ATOM 0 H LEU A 55 -8.499 9.650 11.408 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.941 11.945 9.679 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.659 10.123 10.316 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.595 11.215 8.947 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.112 12.101 11.797 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -4.783 12.888 11.813 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -4.892 11.119 11.647 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.520 12.126 10.227 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.595 14.347 10.940 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.452 13.681 9.296 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.018 13.635 10.141 1.00 0.00 H new ATOM 759 N GLY A 56 -8.851 8.889 8.493 1.00 0.00 N ATOM 760 CA GLY A 56 -9.198 8.078 7.339 1.00 0.00 C ATOM 761 C GLY A 56 -8.525 6.706 7.411 1.00 0.00 C ATOM 762 O GLY A 56 -8.552 6.051 8.453 1.00 0.00 O ATOM 0 H GLY A 56 -8.527 8.361 9.304 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -10.280 7.954 7.289 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -8.893 8.589 6.426 1.00 0.00 H new ATOM 766 N ILE A 57 -7.937 6.310 6.292 1.00 0.00 N ATOM 767 CA ILE A 57 -7.259 5.027 6.215 1.00 0.00 C ATOM 768 C ILE A 57 -5.904 5.212 5.528 1.00 0.00 C ATOM 769 O ILE A 57 -5.778 6.010 4.601 1.00 0.00 O ATOM 770 CB ILE A 57 -8.154 3.987 5.540 1.00 0.00 C ATOM 771 CG1 ILE A 57 -9.485 3.844 6.282 1.00 0.00 C ATOM 772 CG2 ILE A 57 -7.429 2.647 5.400 1.00 0.00 C ATOM 773 CD1 ILE A 57 -9.298 3.094 7.603 1.00 0.00 C ATOM 0 H ILE A 57 -7.916 6.855 5.430 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.060 4.641 7.215 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.383 4.336 4.533 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -9.905 4.831 6.476 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -10.200 3.311 5.655 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -8.088 1.926 4.917 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -6.532 2.780 4.796 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.150 2.279 6.387 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -10.259 3.006 8.111 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.901 2.099 7.403 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -8.601 3.642 8.237 1.00 0.00 H new ATOM 785 N PHE A 58 -4.925 4.460 6.010 1.00 0.00 N ATOM 786 CA PHE A 58 -3.585 4.531 5.454 1.00 0.00 C ATOM 787 C PHE A 58 -2.994 3.132 5.266 1.00 0.00 C ATOM 788 O PHE A 58 -3.051 2.304 6.174 1.00 0.00 O ATOM 789 CB PHE A 58 -2.725 5.305 6.455 1.00 0.00 C ATOM 790 CG PHE A 58 -3.071 6.792 6.554 1.00 0.00 C ATOM 791 CD1 PHE A 58 -4.243 7.181 7.124 1.00 0.00 C ATOM 792 CD2 PHE A 58 -2.207 7.725 6.071 1.00 0.00 C ATOM 793 CE1 PHE A 58 -4.564 8.561 7.215 1.00 0.00 C ATOM 794 CE2 PHE A 58 -2.528 9.105 6.163 1.00 0.00 C ATOM 795 CZ PHE A 58 -3.700 9.494 6.733 1.00 0.00 C ATOM 0 H PHE A 58 -5.033 3.799 6.779 1.00 0.00 H new ATOM 0 HA PHE A 58 -3.612 5.018 4.479 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.834 4.851 7.440 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.677 5.204 6.172 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.929 6.440 7.507 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.277 7.416 5.618 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.495 8.870 7.667 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.842 9.846 5.780 1.00 0.00 H new ATOM 0 HZ PHE A 58 -3.944 10.544 6.803 1.00 0.00 H new ATOM 805 N ILE A 59 -2.441 2.912 4.083 1.00 0.00 N ATOM 806 CA ILE A 59 -1.840 1.627 3.765 1.00 0.00 C ATOM 807 C ILE A 59 -0.714 1.336 4.758 1.00 0.00 C ATOM 808 O ILE A 59 -0.036 2.253 5.220 1.00 0.00 O ATOM 809 CB ILE A 59 -1.395 1.591 2.302 1.00 0.00 C ATOM 810 CG1 ILE A 59 -2.570 1.872 1.364 1.00 0.00 C ATOM 811 CG2 ILE A 59 -0.702 0.268 1.972 1.00 0.00 C ATOM 812 CD1 ILE A 59 -2.151 1.724 -0.100 1.00 0.00 C ATOM 0 H ILE A 59 -2.396 3.601 3.333 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.573 0.827 3.871 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.664 2.385 2.148 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -3.387 1.185 1.583 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -2.946 2.880 1.538 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.396 0.269 0.926 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.176 0.149 2.607 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -1.392 -0.558 2.148 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -3.005 1.929 -0.745 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.350 2.429 -0.322 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.799 0.708 -0.277 1.00 0.00 H new ATOM 824 N LYS A 60 -0.549 0.056 5.059 1.00 0.00 N ATOM 825 CA LYS A 60 0.484 -0.367 5.989 1.00 0.00 C ATOM 826 C LYS A 60 1.696 -0.873 5.203 1.00 0.00 C ATOM 827 O LYS A 60 2.818 -0.419 5.426 1.00 0.00 O ATOM 828 CB LYS A 60 -0.075 -1.389 6.982 1.00 0.00 C ATOM 829 CG LYS A 60 0.395 -1.083 8.405 1.00 0.00 C ATOM 830 CD LYS A 60 -0.176 -2.095 9.400 1.00 0.00 C ATOM 831 CE LYS A 60 0.934 -2.958 10.003 1.00 0.00 C ATOM 832 NZ LYS A 60 0.705 -3.159 11.452 1.00 0.00 N ATOM 0 H LYS A 60 -1.114 -0.702 4.675 1.00 0.00 H new ATOM 0 HA LYS A 60 0.823 0.476 6.591 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.164 -1.379 6.945 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.245 -2.391 6.697 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.484 -1.103 8.444 1.00 0.00 H new ATOM 0 HG3 LYS A 60 0.085 -0.077 8.686 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -0.705 -1.570 10.195 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -0.905 -2.732 8.899 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.968 -3.923 9.497 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.901 -2.480 9.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.467 -3.747 11.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 0.695 -2.237 11.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -0.209 -3.635 11.596 1.00 0.00 H new ATOM 846 N SER A 61 1.429 -1.805 4.300 1.00 0.00 N ATOM 847 CA SER A 61 2.483 -2.377 3.481 1.00 0.00 C ATOM 848 C SER A 61 1.880 -3.304 2.424 1.00 0.00 C ATOM 849 O SER A 61 0.717 -3.693 2.525 1.00 0.00 O ATOM 850 CB SER A 61 3.496 -3.138 4.338 1.00 0.00 C ATOM 851 OG SER A 61 3.214 -4.534 4.385 1.00 0.00 O ATOM 0 H SER A 61 0.497 -2.178 4.118 1.00 0.00 H new ATOM 0 HA SER A 61 3.009 -1.562 2.983 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.498 -2.984 3.937 1.00 0.00 H new ATOM 0 HB3 SER A 61 3.491 -2.733 5.350 1.00 0.00 H new ATOM 0 HG SER A 61 3.884 -4.985 4.940 1.00 0.00 H new ATOM 857 N ILE A 62 2.697 -3.632 1.434 1.00 0.00 N ATOM 858 CA ILE A 62 2.259 -4.506 0.359 1.00 0.00 C ATOM 859 C ILE A 62 2.950 -5.864 0.498 1.00 0.00 C ATOM 860 O ILE A 62 4.174 -5.934 0.596 1.00 0.00 O ATOM 861 CB ILE A 62 2.482 -3.839 -0.999 1.00 0.00 C ATOM 862 CG1 ILE A 62 1.819 -2.460 -1.049 1.00 0.00 C ATOM 863 CG2 ILE A 62 2.009 -4.743 -2.139 1.00 0.00 C ATOM 864 CD1 ILE A 62 2.869 -1.349 -1.116 1.00 0.00 C ATOM 0 H ILE A 62 3.661 -3.308 1.354 1.00 0.00 H new ATOM 0 HA ILE A 62 1.186 -4.685 0.427 1.00 0.00 H new ATOM 0 HB ILE A 62 3.553 -3.687 -1.132 1.00 0.00 H new ATOM 0 HG12 ILE A 62 1.164 -2.399 -1.918 1.00 0.00 H new ATOM 0 HG13 ILE A 62 1.193 -2.321 -0.167 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.179 -4.244 -3.093 1.00 0.00 H new ATOM 0 HG22 ILE A 62 2.565 -5.680 -2.115 1.00 0.00 H new ATOM 0 HG23 ILE A 62 0.945 -4.949 -2.022 1.00 0.00 H new ATOM 0 HD11 ILE A 62 2.371 -0.380 -1.151 1.00 0.00 H new ATOM 0 HD12 ILE A 62 3.507 -1.398 -0.234 1.00 0.00 H new ATOM 0 HD13 ILE A 62 3.477 -1.477 -2.011 1.00 0.00 H new ATOM 876 N ILE A 63 2.135 -6.909 0.503 1.00 0.00 N ATOM 877 CA ILE A 63 2.653 -8.261 0.628 1.00 0.00 C ATOM 878 C ILE A 63 3.009 -8.796 -0.760 1.00 0.00 C ATOM 879 O ILE A 63 2.128 -9.022 -1.587 1.00 0.00 O ATOM 880 CB ILE A 63 1.665 -9.144 1.393 1.00 0.00 C ATOM 881 CG1 ILE A 63 1.529 -8.683 2.846 1.00 0.00 C ATOM 882 CG2 ILE A 63 2.057 -10.619 1.293 1.00 0.00 C ATOM 883 CD1 ILE A 63 0.581 -7.487 2.956 1.00 0.00 C ATOM 0 H ILE A 63 1.120 -6.847 0.423 1.00 0.00 H new ATOM 0 HA ILE A 63 3.570 -8.265 1.216 1.00 0.00 H new ATOM 0 HB ILE A 63 0.684 -9.040 0.930 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.157 -9.504 3.458 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.509 -8.412 3.238 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.339 -11.225 1.845 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.061 -10.924 0.247 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.052 -10.761 1.716 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.502 -7.180 3.999 1.00 0.00 H new ATOM 0 HD12 ILE A 63 0.969 -6.659 2.362 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.405 -7.769 2.586 1.00 0.00 H new ATOM 895 N HIS A 64 4.304 -8.984 -0.972 1.00 0.00 N ATOM 896 CA HIS A 64 4.787 -9.489 -2.246 1.00 0.00 C ATOM 897 C HIS A 64 4.296 -10.924 -2.449 1.00 0.00 C ATOM 898 O HIS A 64 3.838 -11.567 -1.506 1.00 0.00 O ATOM 899 CB HIS A 64 6.310 -9.365 -2.336 1.00 0.00 C ATOM 900 CG HIS A 64 6.987 -10.561 -2.962 1.00 0.00 C ATOM 901 ND1 HIS A 64 7.697 -10.485 -4.147 1.00 0.00 N ATOM 902 CD2 HIS A 64 7.056 -11.861 -2.555 1.00 0.00 C ATOM 903 CE1 HIS A 64 8.167 -11.691 -4.431 1.00 0.00 C ATOM 904 NE2 HIS A 64 7.768 -12.543 -3.443 1.00 0.00 N ATOM 0 H HIS A 64 5.033 -8.796 -0.283 1.00 0.00 H new ATOM 0 HA HIS A 64 4.382 -8.885 -3.058 1.00 0.00 H new ATOM 0 HB2 HIS A 64 6.558 -8.475 -2.915 1.00 0.00 H new ATOM 0 HB3 HIS A 64 6.712 -9.216 -1.334 1.00 0.00 H new ATOM 0 HD1 HIS A 64 7.835 -9.644 -4.707 1.00 0.00 H new ATOM 0 HD2 HIS A 64 6.607 -12.267 -1.661 1.00 0.00 H new ATOM 0 HE1 HIS A 64 8.762 -11.953 -5.293 1.00 0.00 H new ATOM 912 N GLY A 65 4.408 -11.384 -3.687 1.00 0.00 N ATOM 913 CA GLY A 65 3.981 -12.730 -4.026 1.00 0.00 C ATOM 914 C GLY A 65 2.455 -12.845 -3.997 1.00 0.00 C ATOM 915 O GLY A 65 1.912 -13.949 -4.013 1.00 0.00 O ATOM 0 H GLY A 65 4.788 -10.848 -4.467 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.350 -12.994 -5.017 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.416 -13.441 -3.324 1.00 0.00 H new ATOM 919 N GLY A 66 1.807 -11.690 -3.954 1.00 0.00 N ATOM 920 CA GLY A 66 0.355 -11.648 -3.922 1.00 0.00 C ATOM 921 C GLY A 66 -0.197 -10.868 -5.118 1.00 0.00 C ATOM 922 O GLY A 66 0.500 -10.675 -6.113 1.00 0.00 O ATOM 0 H GLY A 66 2.261 -10.777 -3.941 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.042 -12.663 -3.930 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.021 -11.183 -2.994 1.00 0.00 H new ATOM 926 N ALA A 67 -1.443 -10.441 -4.980 1.00 0.00 N ATOM 927 CA ALA A 67 -2.097 -9.687 -6.036 1.00 0.00 C ATOM 928 C ALA A 67 -1.750 -8.204 -5.887 1.00 0.00 C ATOM 929 O ALA A 67 -1.538 -7.510 -6.881 1.00 0.00 O ATOM 930 CB ALA A 67 -3.605 -9.941 -5.987 1.00 0.00 C ATOM 0 H ALA A 67 -2.017 -10.603 -4.153 1.00 0.00 H new ATOM 0 HA ALA A 67 -1.744 -10.012 -7.015 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.095 -9.375 -6.779 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -3.800 -11.004 -6.127 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.996 -9.625 -5.020 1.00 0.00 H new ATOM 936 N ALA A 68 -1.704 -7.762 -4.639 1.00 0.00 N ATOM 937 CA ALA A 68 -1.386 -6.374 -4.348 1.00 0.00 C ATOM 938 C ALA A 68 0.051 -6.082 -4.782 1.00 0.00 C ATOM 939 O ALA A 68 0.363 -4.969 -5.201 1.00 0.00 O ATOM 940 CB ALA A 68 -1.613 -6.100 -2.860 1.00 0.00 C ATOM 0 H ALA A 68 -1.882 -8.340 -3.818 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.041 -5.705 -4.907 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.375 -5.059 -2.641 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.656 -6.294 -2.609 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -0.970 -6.752 -2.268 1.00 0.00 H new ATOM 946 N PHE A 69 0.889 -7.102 -4.668 1.00 0.00 N ATOM 947 CA PHE A 69 2.286 -6.969 -5.044 1.00 0.00 C ATOM 948 C PHE A 69 2.430 -6.189 -6.352 1.00 0.00 C ATOM 949 O PHE A 69 3.328 -5.359 -6.488 1.00 0.00 O ATOM 950 CB PHE A 69 2.832 -8.384 -5.245 1.00 0.00 C ATOM 951 CG PHE A 69 4.249 -8.428 -5.821 1.00 0.00 C ATOM 952 CD1 PHE A 69 5.197 -7.568 -5.360 1.00 0.00 C ATOM 953 CD2 PHE A 69 4.561 -9.327 -6.792 1.00 0.00 C ATOM 954 CE1 PHE A 69 6.512 -7.609 -5.894 1.00 0.00 C ATOM 955 CE2 PHE A 69 5.876 -9.368 -7.326 1.00 0.00 C ATOM 956 CZ PHE A 69 6.824 -8.508 -6.866 1.00 0.00 C ATOM 0 H PHE A 69 0.627 -8.024 -4.320 1.00 0.00 H new ATOM 0 HA PHE A 69 2.830 -6.429 -4.269 1.00 0.00 H new ATOM 0 HB2 PHE A 69 2.824 -8.905 -4.288 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.163 -8.929 -5.911 1.00 0.00 H new ATOM 0 HD1 PHE A 69 4.949 -6.854 -4.588 1.00 0.00 H new ATOM 0 HD2 PHE A 69 3.808 -10.010 -7.157 1.00 0.00 H new ATOM 0 HE1 PHE A 69 7.265 -6.926 -5.528 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.123 -10.082 -8.097 1.00 0.00 H new ATOM 0 HZ PHE A 69 7.824 -8.539 -7.272 1.00 0.00 H new ATOM 966 N LYS A 70 1.532 -6.482 -7.281 1.00 0.00 N ATOM 967 CA LYS A 70 1.547 -5.819 -8.573 1.00 0.00 C ATOM 968 C LYS A 70 1.455 -4.306 -8.366 1.00 0.00 C ATOM 969 O LYS A 70 2.157 -3.541 -9.025 1.00 0.00 O ATOM 970 CB LYS A 70 0.451 -6.383 -9.479 1.00 0.00 C ATOM 971 CG LYS A 70 0.730 -7.847 -9.829 1.00 0.00 C ATOM 972 CD LYS A 70 -0.543 -8.547 -10.311 1.00 0.00 C ATOM 973 CE LYS A 70 -0.297 -9.287 -11.627 1.00 0.00 C ATOM 974 NZ LYS A 70 -0.668 -10.714 -11.496 1.00 0.00 N ATOM 0 H LYS A 70 0.789 -7.171 -7.164 1.00 0.00 H new ATOM 0 HA LYS A 70 2.487 -6.015 -9.090 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.515 -6.302 -8.981 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.389 -5.792 -10.393 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.494 -7.900 -10.604 1.00 0.00 H new ATOM 0 HG3 LYS A 70 1.126 -8.365 -8.955 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.885 -9.251 -9.552 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -1.337 -7.813 -10.445 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -0.879 -8.826 -12.425 1.00 0.00 H new ATOM 0 HE3 LYS A 70 0.753 -9.202 -11.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -0.495 -11.202 -12.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.095 -11.155 -10.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -1.675 -10.790 -11.249 1.00 0.00 H new ATOM 988 N ASP A 71 0.582 -3.919 -7.447 1.00 0.00 N ATOM 989 CA ASP A 71 0.388 -2.511 -7.144 1.00 0.00 C ATOM 990 C ASP A 71 1.380 -2.086 -6.060 1.00 0.00 C ATOM 991 O ASP A 71 1.571 -0.894 -5.821 1.00 0.00 O ATOM 992 CB ASP A 71 -1.025 -2.250 -6.620 1.00 0.00 C ATOM 993 CG ASP A 71 -1.308 -0.801 -6.217 1.00 0.00 C ATOM 994 OD1 ASP A 71 -0.803 0.094 -6.928 1.00 0.00 O ATOM 995 OD2 ASP A 71 -2.023 -0.622 -5.207 1.00 0.00 O ATOM 0 H ASP A 71 0.001 -4.556 -6.902 1.00 0.00 H new ATOM 0 HA ASP A 71 0.543 -1.944 -8.062 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.741 -2.544 -7.387 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.201 -2.892 -5.757 1.00 0.00 H new ATOM 1000 N GLY A 72 1.987 -3.083 -5.433 1.00 0.00 N ATOM 1001 CA GLY A 72 2.955 -2.827 -4.380 1.00 0.00 C ATOM 1002 C GLY A 72 3.809 -1.601 -4.707 1.00 0.00 C ATOM 1003 O GLY A 72 4.267 -0.900 -3.806 1.00 0.00 O ATOM 0 H GLY A 72 1.827 -4.070 -5.634 1.00 0.00 H new ATOM 0 HA2 GLY A 72 2.436 -2.671 -3.434 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.597 -3.698 -4.252 1.00 0.00 H new ATOM 1007 N ARG A 73 3.998 -1.378 -6.000 1.00 0.00 N ATOM 1008 CA ARG A 73 4.790 -0.249 -6.457 1.00 0.00 C ATOM 1009 C ARG A 73 4.532 0.973 -5.572 1.00 0.00 C ATOM 1010 O ARG A 73 5.414 1.811 -5.393 1.00 0.00 O ATOM 1011 CB ARG A 73 4.460 0.103 -7.909 1.00 0.00 C ATOM 1012 CG ARG A 73 2.953 0.286 -8.100 1.00 0.00 C ATOM 1013 CD ARG A 73 2.655 1.105 -9.358 1.00 0.00 C ATOM 1014 NE ARG A 73 2.658 2.549 -9.034 1.00 0.00 N ATOM 1015 CZ ARG A 73 2.315 3.513 -9.899 1.00 0.00 C ATOM 1016 NH1 ARG A 73 1.939 3.194 -11.145 1.00 0.00 N ATOM 1017 NH2 ARG A 73 2.348 4.798 -9.518 1.00 0.00 N ATOM 0 H ARG A 73 3.616 -1.960 -6.745 1.00 0.00 H new ATOM 0 HA ARG A 73 5.840 -0.533 -6.393 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.980 1.018 -8.192 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.821 -0.686 -8.569 1.00 0.00 H new ATOM 0 HG2 ARG A 73 2.471 -0.689 -8.174 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.530 0.785 -7.228 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.401 0.894 -10.124 1.00 0.00 H new ATOM 0 HD3 ARG A 73 1.687 0.818 -9.768 1.00 0.00 H new ATOM 0 HE ARG A 73 2.939 2.828 -8.094 1.00 0.00 H new ATOM 0 HH11 ARG A 73 1.914 2.217 -11.436 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.678 3.929 -11.803 1.00 0.00 H new ATOM 0 HH21 ARG A 73 2.634 5.042 -8.570 1.00 0.00 H new ATOM 0 HH22 ARG A 73 2.087 5.532 -10.176 1.00 0.00 H new ATOM 1031 N LEU A 74 3.319 1.035 -5.043 1.00 0.00 N ATOM 1032 CA LEU A 74 2.934 2.139 -4.181 1.00 0.00 C ATOM 1033 C LEU A 74 3.787 2.111 -2.911 1.00 0.00 C ATOM 1034 O LEU A 74 4.697 1.293 -2.788 1.00 0.00 O ATOM 1035 CB LEU A 74 1.428 2.109 -3.911 1.00 0.00 C ATOM 1036 CG LEU A 74 0.535 2.636 -5.036 1.00 0.00 C ATOM 1037 CD1 LEU A 74 -0.945 2.469 -4.685 1.00 0.00 C ATOM 1038 CD2 LEU A 74 0.882 4.085 -5.380 1.00 0.00 C ATOM 0 H LEU A 74 2.590 0.338 -5.195 1.00 0.00 H new ATOM 0 HA LEU A 74 3.127 3.092 -4.674 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.138 1.081 -3.695 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.228 2.692 -3.012 1.00 0.00 H new ATOM 0 HG LEU A 74 0.724 2.040 -5.929 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.558 2.851 -5.501 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.165 1.413 -4.530 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.168 3.024 -3.773 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.232 4.434 -6.182 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.740 4.712 -4.500 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.921 4.143 -5.703 1.00 0.00 H new ATOM 1050 N ARG A 75 3.461 3.015 -1.998 1.00 0.00 N ATOM 1051 CA ARG A 75 4.186 3.104 -0.742 1.00 0.00 C ATOM 1052 C ARG A 75 3.208 3.243 0.426 1.00 0.00 C ATOM 1053 O ARG A 75 2.328 4.102 0.405 1.00 0.00 O ATOM 1054 CB ARG A 75 5.143 4.297 -0.742 1.00 0.00 C ATOM 1055 CG ARG A 75 5.924 4.375 -2.055 1.00 0.00 C ATOM 1056 CD ARG A 75 7.118 3.417 -2.041 1.00 0.00 C ATOM 1057 NE ARG A 75 8.376 4.180 -1.883 1.00 0.00 N ATOM 1058 CZ ARG A 75 9.562 3.623 -1.601 1.00 0.00 C ATOM 1059 NH1 ARG A 75 9.658 2.296 -1.445 1.00 0.00 N ATOM 1060 NH2 ARG A 75 10.651 4.393 -1.476 1.00 0.00 N ATOM 0 H ARG A 75 2.705 3.692 -2.103 1.00 0.00 H new ATOM 0 HA ARG A 75 4.766 2.188 -0.628 1.00 0.00 H new ATOM 0 HB2 ARG A 75 4.580 5.219 -0.594 1.00 0.00 H new ATOM 0 HB3 ARG A 75 5.838 4.210 0.094 1.00 0.00 H new ATOM 0 HG2 ARG A 75 5.266 4.130 -2.889 1.00 0.00 H new ATOM 0 HG3 ARG A 75 6.274 5.395 -2.214 1.00 0.00 H new ATOM 0 HD2 ARG A 75 7.012 2.702 -1.225 1.00 0.00 H new ATOM 0 HD3 ARG A 75 7.145 2.843 -2.967 1.00 0.00 H new ATOM 0 HE ARG A 75 8.338 5.193 -1.996 1.00 0.00 H new ATOM 0 HH11 ARG A 75 8.829 1.710 -1.541 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.560 1.872 -1.230 1.00 0.00 H new ATOM 0 HH21 ARG A 75 10.578 5.403 -1.595 1.00 0.00 H new ATOM 0 HH22 ARG A 75 11.554 3.969 -1.261 1.00 0.00 H new ATOM 1074 N MET A 76 3.396 2.385 1.419 1.00 0.00 N ATOM 1075 CA MET A 76 2.541 2.401 2.594 1.00 0.00 C ATOM 1076 C MET A 76 2.290 3.833 3.069 1.00 0.00 C ATOM 1077 O MET A 76 2.957 4.766 2.622 1.00 0.00 O ATOM 1078 CB MET A 76 3.201 1.598 3.716 1.00 0.00 C ATOM 1079 CG MET A 76 4.559 2.193 4.091 1.00 0.00 C ATOM 1080 SD MET A 76 5.785 0.900 4.198 1.00 0.00 S ATOM 1081 CE MET A 76 6.876 1.396 2.875 1.00 0.00 C ATOM 0 H MET A 76 4.128 1.675 1.434 1.00 0.00 H new ATOM 0 HA MET A 76 1.583 1.953 2.330 1.00 0.00 H new ATOM 0 HB2 MET A 76 2.551 1.587 4.591 1.00 0.00 H new ATOM 0 HB3 MET A 76 3.328 0.563 3.400 1.00 0.00 H new ATOM 0 HG2 MET A 76 4.860 2.930 3.347 1.00 0.00 H new ATOM 0 HG3 MET A 76 4.485 2.715 5.045 1.00 0.00 H new ATOM 0 HE1 MET A 76 7.704 0.691 2.802 1.00 0.00 H new ATOM 0 HE2 MET A 76 6.325 1.407 1.934 1.00 0.00 H new ATOM 0 HE3 MET A 76 7.266 2.393 3.079 1.00 0.00 H new ATOM 1091 N ASN A 77 1.328 3.964 3.971 1.00 0.00 N ATOM 1092 CA ASN A 77 0.981 5.267 4.512 1.00 0.00 C ATOM 1093 C ASN A 77 0.288 6.096 3.430 1.00 0.00 C ATOM 1094 O ASN A 77 0.277 7.324 3.495 1.00 0.00 O ATOM 1095 CB ASN A 77 2.231 6.027 4.962 1.00 0.00 C ATOM 1096 CG ASN A 77 3.281 5.069 5.528 1.00 0.00 C ATOM 1097 OD1 ASN A 77 2.973 4.028 6.086 1.00 0.00 O ATOM 1098 ND2 ASN A 77 4.535 5.477 5.355 1.00 0.00 N ATOM 0 H ASN A 77 0.778 3.189 4.341 1.00 0.00 H new ATOM 0 HA ASN A 77 0.325 5.112 5.368 1.00 0.00 H new ATOM 0 HB2 ASN A 77 2.651 6.575 4.119 1.00 0.00 H new ATOM 0 HB3 ASN A 77 1.960 6.764 5.718 1.00 0.00 H new ATOM 0 HD21 ASN A 77 5.309 4.908 5.698 1.00 0.00 H new ATOM 0 HD22 ASN A 77 4.723 6.359 4.879 1.00 0.00 H new ATOM 1105 N ASP A 78 -0.274 5.391 2.459 1.00 0.00 N ATOM 1106 CA ASP A 78 -0.968 6.047 1.363 1.00 0.00 C ATOM 1107 C ASP A 78 -2.441 6.231 1.736 1.00 0.00 C ATOM 1108 O ASP A 78 -3.227 5.289 1.656 1.00 0.00 O ATOM 1109 CB ASP A 78 -0.905 5.204 0.088 1.00 0.00 C ATOM 1110 CG ASP A 78 0.243 5.553 -0.861 1.00 0.00 C ATOM 1111 OD1 ASP A 78 0.784 6.670 -0.712 1.00 0.00 O ATOM 1112 OD2 ASP A 78 0.554 4.694 -1.715 1.00 0.00 O ATOM 0 H ASP A 78 -0.263 4.372 2.408 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.485 7.008 1.184 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.819 4.154 0.368 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -1.847 5.314 -0.449 1.00 0.00 H new ATOM 1117 N GLN A 79 -2.769 7.451 2.135 1.00 0.00 N ATOM 1118 CA GLN A 79 -4.133 7.771 2.520 1.00 0.00 C ATOM 1119 C GLN A 79 -5.099 7.428 1.384 1.00 0.00 C ATOM 1120 O GLN A 79 -4.838 7.746 0.225 1.00 0.00 O ATOM 1121 CB GLN A 79 -4.259 9.242 2.922 1.00 0.00 C ATOM 1122 CG GLN A 79 -5.360 9.432 3.967 1.00 0.00 C ATOM 1123 CD GLN A 79 -5.385 10.873 4.480 1.00 0.00 C ATOM 1124 OE1 GLN A 79 -4.372 11.547 4.567 1.00 0.00 O ATOM 1125 NE2 GLN A 79 -6.597 11.307 4.814 1.00 0.00 N ATOM 0 H GLN A 79 -2.114 8.230 2.200 1.00 0.00 H new ATOM 0 HA GLN A 79 -4.396 7.168 3.389 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -3.309 9.596 3.321 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -4.480 9.846 2.042 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.327 9.180 3.532 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.198 8.748 4.800 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -7.404 10.691 4.717 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -6.719 12.256 5.167 1.00 0.00 H new ATOM 1134 N LEU A 80 -6.196 6.785 1.757 1.00 0.00 N ATOM 1135 CA LEU A 80 -7.203 6.396 0.784 1.00 0.00 C ATOM 1136 C LEU A 80 -8.277 7.483 0.705 1.00 0.00 C ATOM 1137 O LEU A 80 -8.782 7.937 1.731 1.00 0.00 O ATOM 1138 CB LEU A 80 -7.756 5.007 1.111 1.00 0.00 C ATOM 1139 CG LEU A 80 -6.717 3.904 1.320 1.00 0.00 C ATOM 1140 CD1 LEU A 80 -5.985 4.084 2.651 1.00 0.00 C ATOM 1141 CD2 LEU A 80 -7.356 2.519 1.200 1.00 0.00 C ATOM 0 H LEU A 80 -6.410 6.524 2.720 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.761 6.312 -0.209 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.363 5.083 2.013 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.422 4.703 0.303 1.00 0.00 H new ATOM 0 HG LEU A 80 -5.971 3.984 0.529 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.252 3.286 2.774 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.477 5.048 2.659 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.704 4.046 3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.596 1.753 1.353 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -8.136 2.412 1.954 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -7.792 2.404 0.208 1.00 0.00 H new ATOM 1153 N ILE A 81 -8.594 7.869 -0.522 1.00 0.00 N ATOM 1154 CA ILE A 81 -9.599 8.894 -0.748 1.00 0.00 C ATOM 1155 C ILE A 81 -10.776 8.288 -1.515 1.00 0.00 C ATOM 1156 O ILE A 81 -11.677 9.006 -1.944 1.00 0.00 O ATOM 1157 CB ILE A 81 -8.977 10.111 -1.436 1.00 0.00 C ATOM 1158 CG1 ILE A 81 -8.423 9.739 -2.813 1.00 0.00 C ATOM 1159 CG2 ILE A 81 -7.915 10.760 -0.547 1.00 0.00 C ATOM 1160 CD1 ILE A 81 -8.241 10.983 -3.685 1.00 0.00 C ATOM 0 H ILE A 81 -8.173 7.490 -1.370 1.00 0.00 H new ATOM 0 HA ILE A 81 -9.991 9.259 0.201 1.00 0.00 H new ATOM 0 HB ILE A 81 -9.761 10.852 -1.594 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.467 9.228 -2.698 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -9.101 9.041 -3.305 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.489 11.622 -1.060 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -8.372 11.083 0.389 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -7.127 10.038 -0.335 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -7.846 10.691 -4.658 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -9.203 11.478 -3.818 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -7.544 11.668 -3.201 1.00 0.00 H new ATOM 1172 N ALA A 82 -10.729 6.972 -1.665 1.00 0.00 N ATOM 1173 CA ALA A 82 -11.780 6.262 -2.373 1.00 0.00 C ATOM 1174 C ALA A 82 -11.271 4.876 -2.776 1.00 0.00 C ATOM 1175 O ALA A 82 -10.064 4.650 -2.844 1.00 0.00 O ATOM 1176 CB ALA A 82 -12.233 7.089 -3.578 1.00 0.00 C ATOM 0 H ALA A 82 -9.979 6.379 -1.308 1.00 0.00 H new ATOM 0 HA ALA A 82 -12.648 6.121 -1.729 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -13.022 6.556 -4.109 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.612 8.052 -3.236 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -11.388 7.249 -4.248 1.00 0.00 H new ATOM 1182 N VAL A 83 -12.217 3.984 -3.031 1.00 0.00 N ATOM 1183 CA VAL A 83 -11.880 2.627 -3.425 1.00 0.00 C ATOM 1184 C VAL A 83 -12.944 2.101 -4.390 1.00 0.00 C ATOM 1185 O VAL A 83 -14.121 2.028 -4.042 1.00 0.00 O ATOM 1186 CB VAL A 83 -11.712 1.748 -2.183 1.00 0.00 C ATOM 1187 CG1 VAL A 83 -12.804 2.042 -1.153 1.00 0.00 C ATOM 1188 CG2 VAL A 83 -11.698 0.265 -2.559 1.00 0.00 C ATOM 0 H VAL A 83 -13.217 4.175 -2.972 1.00 0.00 H new ATOM 0 HA VAL A 83 -10.926 2.608 -3.952 1.00 0.00 H new ATOM 0 HB VAL A 83 -10.750 1.988 -1.730 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -12.662 1.405 -0.280 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -12.748 3.088 -0.851 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -13.782 1.843 -1.592 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -11.577 -0.337 -1.659 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -12.637 0.004 -3.047 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -10.869 0.070 -3.240 1.00 0.00 H new ATOM 1198 N ASN A 84 -12.491 1.749 -5.585 1.00 0.00 N ATOM 1199 CA ASN A 84 -13.390 1.232 -6.603 1.00 0.00 C ATOM 1200 C ASN A 84 -14.599 2.161 -6.729 1.00 0.00 C ATOM 1201 O ASN A 84 -15.660 1.745 -7.192 1.00 0.00 O ATOM 1202 CB ASN A 84 -13.901 -0.161 -6.231 1.00 0.00 C ATOM 1203 CG ASN A 84 -14.954 -0.082 -5.124 1.00 0.00 C ATOM 1204 OD1 ASN A 84 -16.090 0.308 -5.339 1.00 0.00 O ATOM 1205 ND2 ASN A 84 -14.515 -0.472 -3.931 1.00 0.00 N ATOM 0 H ASN A 84 -11.514 1.812 -5.871 1.00 0.00 H new ATOM 0 HA ASN A 84 -12.839 1.175 -7.542 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -14.329 -0.642 -7.111 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -13.068 -0.782 -5.901 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -15.142 -0.456 -3.127 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -13.551 -0.787 -3.820 1.00 0.00 H new ATOM 1212 N GLY A 85 -14.399 3.401 -6.308 1.00 0.00 N ATOM 1213 CA GLY A 85 -15.460 4.392 -6.368 1.00 0.00 C ATOM 1214 C GLY A 85 -16.016 4.685 -4.972 1.00 0.00 C ATOM 1215 O GLY A 85 -16.507 5.783 -4.714 1.00 0.00 O ATOM 0 H GLY A 85 -13.518 3.742 -5.924 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -15.079 5.312 -6.812 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.261 4.034 -7.015 1.00 0.00 H new ATOM 1219 N GLU A 86 -15.920 3.684 -4.110 1.00 0.00 N ATOM 1220 CA GLU A 86 -16.407 3.820 -2.748 1.00 0.00 C ATOM 1221 C GLU A 86 -15.620 4.904 -2.009 1.00 0.00 C ATOM 1222 O GLU A 86 -14.412 5.038 -2.199 1.00 0.00 O ATOM 1223 CB GLU A 86 -16.334 2.486 -2.003 1.00 0.00 C ATOM 1224 CG GLU A 86 -17.715 1.834 -1.910 1.00 0.00 C ATOM 1225 CD GLU A 86 -18.724 2.779 -1.253 1.00 0.00 C ATOM 1226 OE1 GLU A 86 -18.795 2.755 -0.005 1.00 0.00 O ATOM 1227 OE2 GLU A 86 -19.401 3.503 -2.014 1.00 0.00 O ATOM 0 H GLU A 86 -15.512 2.775 -4.328 1.00 0.00 H new ATOM 0 HA GLU A 86 -17.454 4.120 -2.786 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -15.645 1.816 -2.517 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -15.935 2.646 -1.001 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -18.061 1.563 -2.907 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -17.647 0.911 -1.334 1.00 0.00 H new ATOM 1234 N THR A 87 -16.336 5.650 -1.181 1.00 0.00 N ATOM 1235 CA THR A 87 -15.720 6.718 -0.412 1.00 0.00 C ATOM 1236 C THR A 87 -15.304 6.209 0.970 1.00 0.00 C ATOM 1237 O THR A 87 -16.020 5.422 1.586 1.00 0.00 O ATOM 1238 CB THR A 87 -16.703 7.890 -0.358 1.00 0.00 C ATOM 1239 OG1 THR A 87 -15.905 9.027 -0.678 1.00 0.00 O ATOM 1240 CG2 THR A 87 -17.200 8.172 1.061 1.00 0.00 C ATOM 0 H THR A 87 -17.338 5.536 -1.026 1.00 0.00 H new ATOM 0 HA THR A 87 -14.802 7.067 -0.885 1.00 0.00 H new ATOM 0 HB THR A 87 -17.554 7.680 -1.006 1.00 0.00 H new ATOM 0 HG1 THR A 87 -16.464 9.832 -0.668 1.00 0.00 H new ATOM 0 HG21 THR A 87 -17.894 9.012 1.043 1.00 0.00 H new ATOM 0 HG22 THR A 87 -17.708 7.290 1.451 1.00 0.00 H new ATOM 0 HG23 THR A 87 -16.352 8.415 1.702 1.00 0.00 H new ATOM 1248 N LEU A 88 -14.149 6.680 1.415 1.00 0.00 N ATOM 1249 CA LEU A 88 -13.629 6.283 2.713 1.00 0.00 C ATOM 1250 C LEU A 88 -13.593 7.501 3.638 1.00 0.00 C ATOM 1251 O LEU A 88 -13.905 7.395 4.823 1.00 0.00 O ATOM 1252 CB LEU A 88 -12.275 5.587 2.558 1.00 0.00 C ATOM 1253 CG LEU A 88 -12.247 4.374 1.626 1.00 0.00 C ATOM 1254 CD1 LEU A 88 -10.848 3.759 1.568 1.00 0.00 C ATOM 1255 CD2 LEU A 88 -13.308 3.348 2.029 1.00 0.00 C ATOM 0 H LEU A 88 -13.558 7.333 0.900 1.00 0.00 H new ATOM 0 HA LEU A 88 -14.287 5.549 3.178 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.553 6.317 2.193 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -11.937 5.270 3.545 1.00 0.00 H new ATOM 0 HG LEU A 88 -12.492 4.712 0.619 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -10.856 2.899 0.899 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.140 4.500 1.198 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -10.550 3.439 2.566 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.267 2.496 1.350 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -13.119 3.010 3.048 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.296 3.806 1.976 1.00 0.00 H new ATOM 1267 N LEU A 89 -13.208 8.630 3.061 1.00 0.00 N ATOM 1268 CA LEU A 89 -13.126 9.867 3.819 1.00 0.00 C ATOM 1269 C LEU A 89 -14.442 10.090 4.567 1.00 0.00 C ATOM 1270 O LEU A 89 -14.444 10.292 5.780 1.00 0.00 O ATOM 1271 CB LEU A 89 -12.733 11.030 2.905 1.00 0.00 C ATOM 1272 CG LEU A 89 -11.644 10.734 1.873 1.00 0.00 C ATOM 1273 CD1 LEU A 89 -11.049 12.029 1.316 1.00 0.00 C ATOM 1274 CD2 LEU A 89 -10.569 9.815 2.458 1.00 0.00 C ATOM 0 H LEU A 89 -12.950 8.714 2.078 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.339 9.802 4.570 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.624 11.368 2.376 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -12.399 11.859 3.529 1.00 0.00 H new ATOM 0 HG LEU A 89 -12.101 10.204 1.037 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -10.277 11.790 0.584 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -11.834 12.614 0.837 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -10.611 12.608 2.129 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.807 9.620 1.704 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -10.110 10.296 3.322 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.024 8.873 2.766 1.00 0.00 H new ATOM 1286 N GLY A 90 -15.529 10.046 3.812 1.00 0.00 N ATOM 1287 CA GLY A 90 -16.849 10.240 4.388 1.00 0.00 C ATOM 1288 C GLY A 90 -17.108 9.239 5.516 1.00 0.00 C ATOM 1289 O GLY A 90 -17.880 9.517 6.432 1.00 0.00 O ATOM 0 H GLY A 90 -15.523 9.879 2.806 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -16.936 11.256 4.772 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -17.608 10.125 3.614 1.00 0.00 H new ATOM 1293 N LYS A 91 -16.447 8.096 5.412 1.00 0.00 N ATOM 1294 CA LYS A 91 -16.595 7.052 6.412 1.00 0.00 C ATOM 1295 C LYS A 91 -15.570 7.269 7.526 1.00 0.00 C ATOM 1296 O LYS A 91 -15.142 8.396 7.770 1.00 0.00 O ATOM 1297 CB LYS A 91 -16.512 5.670 5.760 1.00 0.00 C ATOM 1298 CG LYS A 91 -17.029 5.710 4.321 1.00 0.00 C ATOM 1299 CD LYS A 91 -17.186 4.298 3.755 1.00 0.00 C ATOM 1300 CE LYS A 91 -18.217 4.271 2.625 1.00 0.00 C ATOM 1301 NZ LYS A 91 -19.582 4.108 3.174 1.00 0.00 N ATOM 0 H LYS A 91 -15.807 7.870 4.650 1.00 0.00 H new ATOM 0 HA LYS A 91 -17.582 7.103 6.873 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -15.479 5.321 5.769 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -17.095 4.955 6.340 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -17.988 6.227 4.290 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -16.339 6.280 3.699 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -16.225 3.942 3.384 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -17.493 3.617 4.548 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -18.158 5.194 2.049 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -17.994 3.453 1.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -20.270 4.092 2.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -19.638 3.215 3.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -19.798 4.903 3.809 1.00 0.00 H new ATOM 1315 N SER A 92 -15.205 6.172 8.173 1.00 0.00 N ATOM 1316 CA SER A 92 -14.238 6.228 9.256 1.00 0.00 C ATOM 1317 C SER A 92 -13.184 5.134 9.074 1.00 0.00 C ATOM 1318 O SER A 92 -12.881 4.740 7.949 1.00 0.00 O ATOM 1319 CB SER A 92 -14.924 6.083 10.616 1.00 0.00 C ATOM 1320 OG SER A 92 -15.365 4.749 10.852 1.00 0.00 O ATOM 0 H SER A 92 -15.562 5.239 7.968 1.00 0.00 H new ATOM 0 HA SER A 92 -13.750 7.202 9.228 1.00 0.00 H new ATOM 0 HB2 SER A 92 -14.233 6.381 11.404 1.00 0.00 H new ATOM 0 HB3 SER A 92 -15.776 6.761 10.666 1.00 0.00 H new ATOM 0 HG SER A 92 -15.796 4.698 11.731 1.00 0.00 H new ATOM 1326 N ASN A 93 -12.654 4.674 10.198 1.00 0.00 N ATOM 1327 CA ASN A 93 -11.640 3.634 10.176 1.00 0.00 C ATOM 1328 C ASN A 93 -12.317 2.272 10.003 1.00 0.00 C ATOM 1329 O ASN A 93 -11.950 1.501 9.118 1.00 0.00 O ATOM 1330 CB ASN A 93 -10.851 3.606 11.487 1.00 0.00 C ATOM 1331 CG ASN A 93 -9.762 4.681 11.494 1.00 0.00 C ATOM 1332 OD1 ASN A 93 -9.062 4.899 10.519 1.00 0.00 O ATOM 1333 ND2 ASN A 93 -9.660 5.340 12.645 1.00 0.00 N ATOM 0 H ASN A 93 -12.908 5.003 11.130 1.00 0.00 H new ATOM 0 HA ASN A 93 -10.960 3.843 9.350 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -11.528 3.764 12.327 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -10.398 2.624 11.622 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -8.964 6.078 12.750 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -10.278 5.107 13.422 1.00 0.00 H new ATOM 1340 N HIS A 94 -13.293 2.019 10.862 1.00 0.00 N ATOM 1341 CA HIS A 94 -14.024 0.764 10.815 1.00 0.00 C ATOM 1342 C HIS A 94 -14.825 0.685 9.514 1.00 0.00 C ATOM 1343 O HIS A 94 -14.532 -0.138 8.649 1.00 0.00 O ATOM 1344 CB HIS A 94 -14.897 0.598 12.061 1.00 0.00 C ATOM 1345 CG HIS A 94 -15.859 -0.564 11.985 1.00 0.00 C ATOM 1346 ND1 HIS A 94 -15.620 -1.777 12.607 1.00 0.00 N ATOM 1347 CD2 HIS A 94 -17.064 -0.685 11.356 1.00 0.00 C ATOM 1348 CE1 HIS A 94 -16.640 -2.584 12.356 1.00 0.00 C ATOM 1349 NE2 HIS A 94 -17.534 -1.906 11.581 1.00 0.00 N ATOM 0 H HIS A 94 -13.595 2.661 11.595 1.00 0.00 H new ATOM 0 HA HIS A 94 -13.323 -0.071 10.820 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -14.252 0.466 12.930 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -15.463 1.516 12.221 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -17.552 0.082 10.774 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -16.745 -3.601 12.704 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -18.418 -2.276 11.232 1.00 0.00 H new ATOM 1357 N GLU A 95 -15.822 1.553 9.417 1.00 0.00 N ATOM 1358 CA GLU A 95 -16.668 1.592 8.236 1.00 0.00 C ATOM 1359 C GLU A 95 -15.829 1.377 6.975 1.00 0.00 C ATOM 1360 O GLU A 95 -15.991 0.374 6.282 1.00 0.00 O ATOM 1361 CB GLU A 95 -17.443 2.909 8.160 1.00 0.00 C ATOM 1362 CG GLU A 95 -18.091 3.242 9.506 1.00 0.00 C ATOM 1363 CD GLU A 95 -19.323 4.130 9.316 1.00 0.00 C ATOM 1364 OE1 GLU A 95 -20.264 3.658 8.641 1.00 0.00 O ATOM 1365 OE2 GLU A 95 -19.296 5.260 9.850 1.00 0.00 O ATOM 0 H GLU A 95 -16.063 2.234 10.137 1.00 0.00 H new ATOM 0 HA GLU A 95 -17.396 0.784 8.307 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -16.770 3.715 7.867 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -18.211 2.839 7.390 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -18.377 2.321 10.014 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -17.369 3.748 10.146 1.00 0.00 H new ATOM 1372 N ALA A 96 -14.950 2.334 6.716 1.00 0.00 N ATOM 1373 CA ALA A 96 -14.086 2.262 5.551 1.00 0.00 C ATOM 1374 C ALA A 96 -13.622 0.817 5.355 1.00 0.00 C ATOM 1375 O ALA A 96 -14.021 0.157 4.396 1.00 0.00 O ATOM 1376 CB ALA A 96 -12.915 3.232 5.722 1.00 0.00 C ATOM 0 H ALA A 96 -14.818 3.164 7.294 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.627 2.560 4.653 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -12.267 3.178 4.847 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.296 4.248 5.828 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.347 2.963 6.612 1.00 0.00 H new ATOM 1382 N MET A 97 -12.785 0.367 6.278 1.00 0.00 N ATOM 1383 CA MET A 97 -12.262 -0.987 6.219 1.00 0.00 C ATOM 1384 C MET A 97 -13.371 -1.989 5.890 1.00 0.00 C ATOM 1385 O MET A 97 -13.226 -2.805 4.982 1.00 0.00 O ATOM 1386 CB MET A 97 -11.628 -1.349 7.564 1.00 0.00 C ATOM 1387 CG MET A 97 -10.217 -0.770 7.678 1.00 0.00 C ATOM 1388 SD MET A 97 -9.058 -1.809 6.805 1.00 0.00 S ATOM 1389 CE MET A 97 -8.339 -0.609 5.696 1.00 0.00 C ATOM 0 H MET A 97 -12.456 0.917 7.072 1.00 0.00 H new ATOM 0 HA MET A 97 -11.511 -1.033 5.430 1.00 0.00 H new ATOM 0 HB2 MET A 97 -12.248 -0.969 8.376 1.00 0.00 H new ATOM 0 HB3 MET A 97 -11.590 -2.433 7.672 1.00 0.00 H new ATOM 0 HG2 MET A 97 -10.195 0.239 7.266 1.00 0.00 H new ATOM 0 HG3 MET A 97 -9.930 -0.693 8.727 1.00 0.00 H new ATOM 0 HE1 MET A 97 -7.810 -1.125 4.895 1.00 0.00 H new ATOM 0 HE2 MET A 97 -9.128 0.011 5.270 1.00 0.00 H new ATOM 0 HE3 MET A 97 -7.640 0.021 6.245 1.00 0.00 H new ATOM 1399 N GLU A 98 -14.454 -1.893 6.648 1.00 0.00 N ATOM 1400 CA GLU A 98 -15.587 -2.781 6.449 1.00 0.00 C ATOM 1401 C GLU A 98 -16.072 -2.705 5.000 1.00 0.00 C ATOM 1402 O GLU A 98 -16.610 -3.677 4.470 1.00 0.00 O ATOM 1403 CB GLU A 98 -16.719 -2.453 7.424 1.00 0.00 C ATOM 1404 CG GLU A 98 -17.916 -1.845 6.690 1.00 0.00 C ATOM 1405 CD GLU A 98 -18.727 -2.927 5.974 1.00 0.00 C ATOM 1406 OE1 GLU A 98 -18.380 -4.114 6.161 1.00 0.00 O ATOM 1407 OE2 GLU A 98 -19.675 -2.544 5.256 1.00 0.00 O ATOM 0 H GLU A 98 -14.571 -1.214 7.400 1.00 0.00 H new ATOM 0 HA GLU A 98 -15.263 -3.802 6.651 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -17.029 -3.359 7.945 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -16.361 -1.756 8.182 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -18.553 -1.318 7.400 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -17.567 -1.108 5.966 1.00 0.00 H new ATOM 1414 N THR A 99 -15.866 -1.542 4.400 1.00 0.00 N ATOM 1415 CA THR A 99 -16.276 -1.327 3.023 1.00 0.00 C ATOM 1416 C THR A 99 -15.240 -1.912 2.060 1.00 0.00 C ATOM 1417 O THR A 99 -15.585 -2.681 1.164 1.00 0.00 O ATOM 1418 CB THR A 99 -16.507 0.173 2.827 1.00 0.00 C ATOM 1419 OG1 THR A 99 -17.923 0.318 2.897 1.00 0.00 O ATOM 1420 CG2 THR A 99 -16.154 0.641 1.414 1.00 0.00 C ATOM 0 H THR A 99 -15.420 -0.738 4.843 1.00 0.00 H new ATOM 0 HA THR A 99 -17.209 -1.846 2.803 1.00 0.00 H new ATOM 0 HB THR A 99 -15.913 0.729 3.552 1.00 0.00 H new ATOM 0 HG1 THR A 99 -18.161 1.262 2.781 1.00 0.00 H new ATOM 0 HG21 THR A 99 -16.336 1.712 1.329 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.102 0.435 1.215 1.00 0.00 H new ATOM 0 HG23 THR A 99 -16.771 0.110 0.690 1.00 0.00 H new ATOM 1428 N LEU A 100 -13.992 -1.526 2.279 1.00 0.00 N ATOM 1429 CA LEU A 100 -12.904 -2.004 1.442 1.00 0.00 C ATOM 1430 C LEU A 100 -13.125 -3.483 1.120 1.00 0.00 C ATOM 1431 O LEU A 100 -13.355 -3.843 -0.034 1.00 0.00 O ATOM 1432 CB LEU A 100 -11.554 -1.713 2.101 1.00 0.00 C ATOM 1433 CG LEU A 100 -10.342 -1.695 1.167 1.00 0.00 C ATOM 1434 CD1 LEU A 100 -10.240 -0.360 0.427 1.00 0.00 C ATOM 1435 CD2 LEU A 100 -9.058 -2.027 1.930 1.00 0.00 C ATOM 0 H LEU A 100 -13.710 -0.888 3.023 1.00 0.00 H new ATOM 0 HA LEU A 100 -12.891 -1.470 0.492 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.617 -0.746 2.601 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.381 -2.461 2.874 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.479 -2.471 0.414 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.370 -0.374 -0.230 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -11.141 -0.203 -0.167 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.136 0.449 1.150 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.212 -2.008 1.244 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -8.903 -1.291 2.719 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -9.144 -3.020 2.372 1.00 0.00 H new ATOM 1447 N ARG A 101 -13.048 -4.300 2.160 1.00 0.00 N ATOM 1448 CA ARG A 101 -13.237 -5.732 2.002 1.00 0.00 C ATOM 1449 C ARG A 101 -14.569 -6.018 1.306 1.00 0.00 C ATOM 1450 O ARG A 101 -14.679 -6.971 0.537 1.00 0.00 O ATOM 1451 CB ARG A 101 -13.214 -6.443 3.357 1.00 0.00 C ATOM 1452 CG ARG A 101 -14.539 -6.255 4.098 1.00 0.00 C ATOM 1453 CD ARG A 101 -14.377 -6.538 5.592 1.00 0.00 C ATOM 1454 NE ARG A 101 -15.199 -7.708 5.978 1.00 0.00 N ATOM 1455 CZ ARG A 101 -15.396 -8.103 7.243 1.00 0.00 C ATOM 1456 NH1 ARG A 101 -14.832 -7.425 8.252 1.00 0.00 N ATOM 1457 NH2 ARG A 101 -16.157 -9.176 7.499 1.00 0.00 N ATOM 0 H ARG A 101 -12.857 -3.998 3.115 1.00 0.00 H new ATOM 0 HA ARG A 101 -12.416 -6.110 1.392 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -13.023 -7.506 3.211 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -12.396 -6.053 3.963 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -14.899 -5.236 3.954 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -15.292 -6.921 3.678 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -13.329 -6.728 5.823 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -14.678 -5.665 6.171 1.00 0.00 H new ATOM 0 HE ARG A 101 -15.643 -8.247 5.234 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -14.253 -6.608 8.057 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -14.982 -7.726 9.215 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -16.586 -9.692 6.731 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -16.307 -9.477 8.462 1.00 0.00 H new ATOM 1471 N ARG A 102 -15.548 -5.176 1.602 1.00 0.00 N ATOM 1472 CA ARG A 102 -16.868 -5.326 1.015 1.00 0.00 C ATOM 1473 C ARG A 102 -16.776 -5.298 -0.512 1.00 0.00 C ATOM 1474 O ARG A 102 -17.290 -6.190 -1.185 1.00 0.00 O ATOM 1475 CB ARG A 102 -17.809 -4.214 1.483 1.00 0.00 C ATOM 1476 CG ARG A 102 -19.271 -4.658 1.390 1.00 0.00 C ATOM 1477 CD ARG A 102 -20.077 -4.141 2.583 1.00 0.00 C ATOM 1478 NE ARG A 102 -20.905 -5.232 3.145 1.00 0.00 N ATOM 1479 CZ ARG A 102 -21.949 -5.785 2.513 1.00 0.00 C ATOM 1480 NH1 ARG A 102 -22.299 -5.352 1.294 1.00 0.00 N ATOM 1481 NH2 ARG A 102 -22.642 -6.770 3.099 1.00 0.00 N ATOM 0 H ARG A 102 -15.453 -4.387 2.241 1.00 0.00 H new ATOM 0 HA ARG A 102 -17.269 -6.286 1.341 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -17.573 -3.941 2.512 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -17.656 -3.323 0.874 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -19.709 -4.288 0.463 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -19.323 -5.746 1.355 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -19.403 -3.754 3.347 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -20.714 -3.313 2.271 1.00 0.00 H new ATOM 0 HE ARG A 102 -20.666 -5.585 4.072 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -21.771 -4.602 0.848 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -23.094 -5.772 0.812 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -22.375 -7.099 4.027 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -23.437 -7.191 2.618 1.00 0.00 H new ATOM 1495 N SER A 103 -16.117 -4.264 -1.014 1.00 0.00 N ATOM 1496 CA SER A 103 -15.951 -4.108 -2.449 1.00 0.00 C ATOM 1497 C SER A 103 -15.192 -5.307 -3.022 1.00 0.00 C ATOM 1498 O SER A 103 -15.526 -5.801 -4.098 1.00 0.00 O ATOM 1499 CB SER A 103 -15.217 -2.807 -2.781 1.00 0.00 C ATOM 1500 OG SER A 103 -15.863 -1.670 -2.214 1.00 0.00 O ATOM 0 H SER A 103 -15.692 -3.526 -0.453 1.00 0.00 H new ATOM 0 HA SER A 103 -16.940 -4.061 -2.904 1.00 0.00 H new ATOM 0 HB2 SER A 103 -14.193 -2.864 -2.412 1.00 0.00 H new ATOM 0 HB3 SER A 103 -15.159 -2.689 -3.863 1.00 0.00 H new ATOM 0 HG SER A 103 -15.283 -1.270 -1.532 1.00 0.00 H new ATOM 1506 N MET A 104 -14.185 -5.739 -2.277 1.00 0.00 N ATOM 1507 CA MET A 104 -13.376 -6.871 -2.697 1.00 0.00 C ATOM 1508 C MET A 104 -14.249 -8.095 -2.978 1.00 0.00 C ATOM 1509 O MET A 104 -13.891 -8.944 -3.793 1.00 0.00 O ATOM 1510 CB MET A 104 -12.362 -7.207 -1.602 1.00 0.00 C ATOM 1511 CG MET A 104 -11.215 -6.195 -1.587 1.00 0.00 C ATOM 1512 SD MET A 104 -9.952 -6.720 -0.440 1.00 0.00 S ATOM 1513 CE MET A 104 -9.871 -5.279 0.611 1.00 0.00 C ATOM 0 H MET A 104 -13.911 -5.326 -1.386 1.00 0.00 H new ATOM 0 HA MET A 104 -12.856 -6.601 -3.616 1.00 0.00 H new ATOM 0 HB2 MET A 104 -12.858 -7.214 -0.632 1.00 0.00 H new ATOM 0 HB3 MET A 104 -11.965 -8.209 -1.764 1.00 0.00 H new ATOM 0 HG2 MET A 104 -10.792 -6.098 -2.587 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.590 -5.212 -1.303 1.00 0.00 H new ATOM 0 HE1 MET A 104 -8.892 -4.810 0.511 1.00 0.00 H new ATOM 0 HE2 MET A 104 -10.645 -4.570 0.316 1.00 0.00 H new ATOM 0 HE3 MET A 104 -10.027 -5.576 1.648 1.00 0.00 H new ATOM 1523 N SER A 105 -15.379 -8.148 -2.287 1.00 0.00 N ATOM 1524 CA SER A 105 -16.306 -9.254 -2.453 1.00 0.00 C ATOM 1525 C SER A 105 -17.417 -8.864 -3.430 1.00 0.00 C ATOM 1526 O SER A 105 -17.832 -9.673 -4.259 1.00 0.00 O ATOM 1527 CB SER A 105 -16.905 -9.676 -1.109 1.00 0.00 C ATOM 1528 OG SER A 105 -17.718 -10.841 -1.229 1.00 0.00 O ATOM 0 H SER A 105 -15.673 -7.443 -1.611 1.00 0.00 H new ATOM 0 HA SER A 105 -15.756 -10.103 -2.859 1.00 0.00 H new ATOM 0 HB2 SER A 105 -16.101 -9.866 -0.398 1.00 0.00 H new ATOM 0 HB3 SER A 105 -17.501 -8.858 -0.705 1.00 0.00 H new ATOM 0 HG SER A 105 -18.080 -11.079 -0.350 1.00 0.00 H new ATOM 1534 N MET A 106 -17.868 -7.625 -3.300 1.00 0.00 N ATOM 1535 CA MET A 106 -18.923 -7.119 -4.162 1.00 0.00 C ATOM 1536 C MET A 106 -18.363 -6.691 -5.520 1.00 0.00 C ATOM 1537 O MET A 106 -18.705 -7.274 -6.548 1.00 0.00 O ATOM 1538 CB MET A 106 -19.601 -5.923 -3.490 1.00 0.00 C ATOM 1539 CG MET A 106 -21.082 -6.207 -3.230 1.00 0.00 C ATOM 1540 SD MET A 106 -22.031 -5.897 -4.710 1.00 0.00 S ATOM 1541 CE MET A 106 -22.308 -4.142 -4.538 1.00 0.00 C ATOM 0 H MET A 106 -17.522 -6.957 -2.611 1.00 0.00 H new ATOM 0 HA MET A 106 -19.648 -7.916 -4.324 1.00 0.00 H new ATOM 0 HB2 MET A 106 -19.100 -5.698 -2.549 1.00 0.00 H new ATOM 0 HB3 MET A 106 -19.502 -5.041 -4.123 1.00 0.00 H new ATOM 0 HG2 MET A 106 -21.212 -7.242 -2.914 1.00 0.00 H new ATOM 0 HG3 MET A 106 -21.444 -5.578 -2.417 1.00 0.00 H new ATOM 0 HE1 MET A 106 -22.891 -3.781 -5.385 1.00 0.00 H new ATOM 0 HE2 MET A 106 -22.853 -3.948 -3.614 1.00 0.00 H new ATOM 0 HE3 MET A 106 -21.350 -3.623 -4.510 1.00 0.00 H new ATOM 1551 N GLU A 107 -17.512 -5.677 -5.481 1.00 0.00 N ATOM 1552 CA GLU A 107 -16.901 -5.164 -6.696 1.00 0.00 C ATOM 1553 C GLU A 107 -16.085 -6.261 -7.383 1.00 0.00 C ATOM 1554 O GLU A 107 -15.693 -6.115 -8.540 1.00 0.00 O ATOM 1555 CB GLU A 107 -16.034 -3.939 -6.400 1.00 0.00 C ATOM 1556 CG GLU A 107 -16.867 -2.657 -6.433 1.00 0.00 C ATOM 1557 CD GLU A 107 -17.116 -2.201 -7.872 1.00 0.00 C ATOM 1558 OE1 GLU A 107 -17.724 -2.995 -8.621 1.00 0.00 O ATOM 1559 OE2 GLU A 107 -16.691 -1.069 -8.190 1.00 0.00 O ATOM 0 H GLU A 107 -17.231 -5.196 -4.627 1.00 0.00 H new ATOM 0 HA GLU A 107 -17.695 -4.850 -7.374 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -15.566 -4.048 -5.421 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -15.229 -3.873 -7.132 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -17.820 -2.825 -5.931 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -16.352 -1.870 -5.883 1.00 0.00 H new ATOM 1566 N GLY A 108 -15.853 -7.334 -6.642 1.00 0.00 N ATOM 1567 CA GLY A 108 -15.091 -8.455 -7.165 1.00 0.00 C ATOM 1568 C GLY A 108 -16.016 -9.516 -7.765 1.00 0.00 C ATOM 1569 O GLY A 108 -15.552 -10.474 -8.380 1.00 0.00 O ATOM 0 H GLY A 108 -16.180 -7.451 -5.683 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -14.395 -8.102 -7.926 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -14.494 -8.897 -6.367 1.00 0.00 H new ATOM 1573 N ASN A 109 -17.310 -9.308 -7.564 1.00 0.00 N ATOM 1574 CA ASN A 109 -18.304 -10.235 -8.078 1.00 0.00 C ATOM 1575 C ASN A 109 -18.784 -9.753 -9.449 1.00 0.00 C ATOM 1576 O ASN A 109 -18.648 -10.465 -10.443 1.00 0.00 O ATOM 1577 CB ASN A 109 -19.520 -10.307 -7.151 1.00 0.00 C ATOM 1578 CG ASN A 109 -19.408 -11.495 -6.193 1.00 0.00 C ATOM 1579 OD1 ASN A 109 -18.972 -12.576 -6.552 1.00 0.00 O ATOM 1580 ND2 ASN A 109 -19.827 -11.235 -4.958 1.00 0.00 N ATOM 0 H ASN A 109 -17.692 -8.512 -7.053 1.00 0.00 H new ATOM 0 HA ASN A 109 -17.843 -11.220 -8.147 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -19.603 -9.382 -6.581 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -20.430 -10.398 -7.745 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -19.795 -11.963 -4.245 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -20.181 -10.307 -4.724 1.00 0.00 H new ATOM 1587 N ILE A 110 -19.334 -8.548 -9.458 1.00 0.00 N ATOM 1588 CA ILE A 110 -19.834 -7.963 -10.691 1.00 0.00 C ATOM 1589 C ILE A 110 -18.653 -7.505 -11.549 1.00 0.00 C ATOM 1590 O ILE A 110 -18.670 -7.661 -12.769 1.00 0.00 O ATOM 1591 CB ILE A 110 -20.841 -6.852 -10.387 1.00 0.00 C ATOM 1592 CG1 ILE A 110 -20.129 -5.574 -9.939 1.00 0.00 C ATOM 1593 CG2 ILE A 110 -21.880 -7.318 -9.365 1.00 0.00 C ATOM 1594 CD1 ILE A 110 -19.677 -5.681 -8.481 1.00 0.00 C ATOM 0 H ILE A 110 -19.445 -7.961 -8.632 1.00 0.00 H new ATOM 0 HA ILE A 110 -20.380 -8.707 -11.271 1.00 0.00 H new ATOM 0 HB ILE A 110 -21.377 -6.616 -11.306 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -19.266 -5.391 -10.579 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -20.798 -4.721 -10.055 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -22.584 -6.509 -9.167 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -22.419 -8.179 -9.761 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -21.379 -7.598 -8.438 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -19.174 -4.760 -8.188 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -20.545 -5.840 -7.842 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -18.989 -6.520 -8.374 1.00 0.00 H new ATOM 1606 N ARG A 111 -17.656 -6.949 -10.877 1.00 0.00 N ATOM 1607 CA ARG A 111 -16.469 -6.467 -11.562 1.00 0.00 C ATOM 1608 C ARG A 111 -15.373 -7.534 -11.541 1.00 0.00 C ATOM 1609 O ARG A 111 -15.079 -8.148 -12.566 1.00 0.00 O ATOM 1610 CB ARG A 111 -15.938 -5.188 -10.912 1.00 0.00 C ATOM 1611 CG ARG A 111 -15.825 -4.057 -11.936 1.00 0.00 C ATOM 1612 CD ARG A 111 -17.168 -3.348 -12.120 1.00 0.00 C ATOM 1613 NE ARG A 111 -16.947 -1.918 -12.430 1.00 0.00 N ATOM 1614 CZ ARG A 111 -17.903 -1.087 -12.867 1.00 0.00 C ATOM 1615 NH1 ARG A 111 -19.152 -1.539 -13.049 1.00 0.00 N ATOM 1616 NH2 ARG A 111 -17.612 0.196 -13.123 1.00 0.00 N ATOM 0 H ARG A 111 -17.646 -6.822 -9.865 1.00 0.00 H new ATOM 0 HA ARG A 111 -16.748 -6.248 -12.593 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -16.602 -4.885 -10.102 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -14.961 -5.380 -10.468 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -15.073 -3.339 -11.609 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -15.488 -4.459 -12.891 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -17.731 -3.820 -12.925 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -17.766 -3.444 -11.214 1.00 0.00 H new ATOM 0 HE ARG A 111 -16.008 -1.541 -12.303 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -19.374 -2.515 -12.855 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -19.880 -0.907 -13.382 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -16.662 0.541 -12.985 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -18.341 0.828 -13.456 1.00 0.00 H new ATOM 1630 N GLY A 112 -14.798 -7.723 -10.362 1.00 0.00 N ATOM 1631 CA GLY A 112 -13.741 -8.706 -10.194 1.00 0.00 C ATOM 1632 C GLY A 112 -12.402 -8.026 -9.899 1.00 0.00 C ATOM 1633 O GLY A 112 -11.343 -8.600 -10.148 1.00 0.00 O ATOM 0 H GLY A 112 -15.044 -7.212 -9.514 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -13.996 -9.384 -9.379 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -13.655 -9.311 -11.097 1.00 0.00 H new ATOM 1637 N MET A 113 -12.494 -6.814 -9.374 1.00 0.00 N ATOM 1638 CA MET A 113 -11.303 -6.050 -9.043 1.00 0.00 C ATOM 1639 C MET A 113 -11.635 -4.903 -8.086 1.00 0.00 C ATOM 1640 O MET A 113 -12.804 -4.640 -7.809 1.00 0.00 O ATOM 1641 CB MET A 113 -10.687 -5.484 -10.324 1.00 0.00 C ATOM 1642 CG MET A 113 -11.510 -4.309 -10.855 1.00 0.00 C ATOM 1643 SD MET A 113 -11.803 -4.510 -12.604 1.00 0.00 S ATOM 1644 CE MET A 113 -10.214 -4.010 -13.245 1.00 0.00 C ATOM 0 H MET A 113 -13.375 -6.342 -9.169 1.00 0.00 H new ATOM 0 HA MET A 113 -10.593 -6.715 -8.551 1.00 0.00 H new ATOM 0 HB2 MET A 113 -9.666 -5.158 -10.127 1.00 0.00 H new ATOM 0 HB3 MET A 113 -10.632 -6.266 -11.082 1.00 0.00 H new ATOM 0 HG2 MET A 113 -12.460 -4.250 -10.323 1.00 0.00 H new ATOM 0 HG3 MET A 113 -10.983 -3.373 -10.671 1.00 0.00 H new ATOM 0 HE1 MET A 113 -10.353 -3.233 -13.997 1.00 0.00 H new ATOM 0 HE2 MET A 113 -9.599 -3.623 -12.432 1.00 0.00 H new ATOM 0 HE3 MET A 113 -9.718 -4.868 -13.698 1.00 0.00 H new ATOM 1654 N ILE A 114 -10.586 -4.251 -7.608 1.00 0.00 N ATOM 1655 CA ILE A 114 -10.751 -3.138 -6.688 1.00 0.00 C ATOM 1656 C ILE A 114 -9.704 -2.067 -6.997 1.00 0.00 C ATOM 1657 O ILE A 114 -8.539 -2.382 -7.235 1.00 0.00 O ATOM 1658 CB ILE A 114 -10.718 -3.631 -5.240 1.00 0.00 C ATOM 1659 CG1 ILE A 114 -11.039 -2.495 -4.266 1.00 0.00 C ATOM 1660 CG2 ILE A 114 -9.381 -4.301 -4.919 1.00 0.00 C ATOM 1661 CD1 ILE A 114 -11.399 -3.042 -2.884 1.00 0.00 C ATOM 0 H ILE A 114 -9.618 -4.472 -7.840 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.729 -2.675 -6.821 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.494 -4.387 -5.119 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -10.181 -1.828 -4.185 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -11.868 -1.902 -4.654 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -9.384 -4.642 -3.884 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -9.233 -5.154 -5.582 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -8.572 -3.585 -5.063 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -11.622 -2.214 -2.212 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -12.272 -3.689 -2.965 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -10.559 -3.614 -2.489 1.00 0.00 H new ATOM 1673 N GLN A 115 -10.156 -0.821 -6.982 1.00 0.00 N ATOM 1674 CA GLN A 115 -9.273 0.299 -7.258 1.00 0.00 C ATOM 1675 C GLN A 115 -8.944 1.047 -5.964 1.00 0.00 C ATOM 1676 O GLN A 115 -9.713 1.001 -5.004 1.00 0.00 O ATOM 1677 CB GLN A 115 -9.889 1.241 -8.294 1.00 0.00 C ATOM 1678 CG GLN A 115 -9.016 2.481 -8.495 1.00 0.00 C ATOM 1679 CD GLN A 115 -9.352 3.180 -9.814 1.00 0.00 C ATOM 1680 OE1 GLN A 115 -8.718 2.973 -10.836 1.00 0.00 O ATOM 1681 NE2 GLN A 115 -10.383 4.018 -9.735 1.00 0.00 N ATOM 0 H GLN A 115 -11.123 -0.563 -6.783 1.00 0.00 H new ATOM 0 HA GLN A 115 -8.345 -0.090 -7.676 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -10.007 0.717 -9.243 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -10.885 1.542 -7.970 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -9.163 3.172 -7.665 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -7.964 2.195 -8.489 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -10.870 4.145 -8.848 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -10.686 4.533 -10.562 1.00 0.00 H new ATOM 1690 N LEU A 116 -7.802 1.718 -5.979 1.00 0.00 N ATOM 1691 CA LEU A 116 -7.362 2.474 -4.819 1.00 0.00 C ATOM 1692 C LEU A 116 -6.951 3.881 -5.259 1.00 0.00 C ATOM 1693 O LEU A 116 -6.130 4.038 -6.161 1.00 0.00 O ATOM 1694 CB LEU A 116 -6.263 1.717 -4.071 1.00 0.00 C ATOM 1695 CG LEU A 116 -6.540 0.240 -3.787 1.00 0.00 C ATOM 1696 CD1 LEU A 116 -5.255 -0.494 -3.397 1.00 0.00 C ATOM 1697 CD2 LEU A 116 -7.634 0.081 -2.729 1.00 0.00 C ATOM 0 H LEU A 116 -7.168 1.754 -6.777 1.00 0.00 H new ATOM 0 HA LEU A 116 -8.179 2.588 -4.106 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.342 1.789 -4.649 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -6.083 2.222 -3.122 1.00 0.00 H new ATOM 0 HG LEU A 116 -6.909 -0.221 -4.704 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.480 -1.542 -3.200 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -4.534 -0.424 -4.212 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.834 -0.039 -2.500 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -7.812 -0.979 -2.546 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -7.317 0.561 -1.803 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -8.553 0.547 -3.083 1.00 0.00 H new ATOM 1709 N VAL A 117 -7.540 4.868 -4.600 1.00 0.00 N ATOM 1710 CA VAL A 117 -7.245 6.256 -4.912 1.00 0.00 C ATOM 1711 C VAL A 117 -6.446 6.874 -3.762 1.00 0.00 C ATOM 1712 O VAL A 117 -6.980 7.085 -2.674 1.00 0.00 O ATOM 1713 CB VAL A 117 -8.541 7.012 -5.213 1.00 0.00 C ATOM 1714 CG1 VAL A 117 -8.249 8.363 -5.869 1.00 0.00 C ATOM 1715 CG2 VAL A 117 -9.477 6.171 -6.084 1.00 0.00 C ATOM 0 H VAL A 117 -8.220 4.734 -3.852 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.629 6.323 -5.809 1.00 0.00 H new ATOM 0 HB VAL A 117 -9.045 7.202 -4.265 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -9.187 8.879 -6.072 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.639 8.969 -5.199 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.712 8.205 -6.804 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.390 6.732 -6.283 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -8.983 5.936 -7.027 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.725 5.246 -5.563 1.00 0.00 H new ATOM 1725 N ILE A 118 -5.181 7.146 -4.043 1.00 0.00 N ATOM 1726 CA ILE A 118 -4.303 7.735 -3.046 1.00 0.00 C ATOM 1727 C ILE A 118 -4.102 9.219 -3.363 1.00 0.00 C ATOM 1728 O ILE A 118 -4.385 9.664 -4.474 1.00 0.00 O ATOM 1729 CB ILE A 118 -2.996 6.945 -2.948 1.00 0.00 C ATOM 1730 CG1 ILE A 118 -1.999 7.400 -4.016 1.00 0.00 C ATOM 1731 CG2 ILE A 118 -3.260 5.439 -3.014 1.00 0.00 C ATOM 1732 CD1 ILE A 118 -1.060 8.476 -3.467 1.00 0.00 C ATOM 0 H ILE A 118 -4.742 6.970 -4.947 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.758 7.678 -2.057 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.544 7.150 -1.978 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -1.416 6.546 -4.362 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -2.538 7.789 -4.880 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -2.315 4.900 -2.942 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.908 5.147 -2.188 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -3.745 5.196 -3.959 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -0.362 8.782 -4.246 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -1.644 9.338 -3.144 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -0.505 8.076 -2.619 1.00 0.00 H new ATOM 1744 N LEU A 119 -3.616 9.943 -2.365 1.00 0.00 N ATOM 1745 CA LEU A 119 -3.374 11.367 -2.524 1.00 0.00 C ATOM 1746 C LEU A 119 -2.042 11.730 -1.863 1.00 0.00 C ATOM 1747 O LEU A 119 -1.748 11.273 -0.760 1.00 0.00 O ATOM 1748 CB LEU A 119 -4.562 12.174 -1.997 1.00 0.00 C ATOM 1749 CG LEU A 119 -4.481 13.690 -2.188 1.00 0.00 C ATOM 1750 CD1 LEU A 119 -3.577 14.328 -1.131 1.00 0.00 C ATOM 1751 CD2 LEU A 119 -4.036 14.040 -3.609 1.00 0.00 C ATOM 0 H LEU A 119 -3.384 9.571 -1.444 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.287 11.624 -3.580 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -5.466 11.814 -2.487 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -4.673 11.967 -0.933 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.479 14.106 -2.051 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.537 15.406 -1.289 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -3.977 14.122 -0.138 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.573 13.912 -1.212 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -3.987 15.123 -3.718 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.052 13.611 -3.798 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.752 13.635 -4.324 1.00 0.00 H new ATOM 1763 N ARG A 120 -1.273 12.549 -2.566 1.00 0.00 N ATOM 1764 CA ARG A 120 0.020 12.978 -2.061 1.00 0.00 C ATOM 1765 C ARG A 120 0.289 14.431 -2.460 1.00 0.00 C ATOM 1766 O ARG A 120 -0.114 14.868 -3.537 1.00 0.00 O ATOM 1767 CB ARG A 120 1.144 12.092 -2.602 1.00 0.00 C ATOM 1768 CG ARG A 120 2.323 12.047 -1.628 1.00 0.00 C ATOM 1769 CD ARG A 120 3.189 10.809 -1.872 1.00 0.00 C ATOM 1770 NE ARG A 120 4.356 11.166 -2.708 1.00 0.00 N ATOM 1771 CZ ARG A 120 5.361 10.326 -2.993 1.00 0.00 C ATOM 1772 NH1 ARG A 120 5.346 9.076 -2.511 1.00 0.00 N ATOM 1773 NH2 ARG A 120 6.380 10.736 -3.760 1.00 0.00 N ATOM 0 H ARG A 120 -1.521 12.927 -3.481 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.003 12.893 -0.975 1.00 0.00 H new ATOM 0 HB2 ARG A 120 0.768 11.083 -2.770 1.00 0.00 H new ATOM 0 HB3 ARG A 120 1.479 12.472 -3.567 1.00 0.00 H new ATOM 0 HG2 ARG A 120 2.928 12.947 -1.742 1.00 0.00 H new ATOM 0 HG3 ARG A 120 1.952 12.040 -0.603 1.00 0.00 H new ATOM 0 HD2 ARG A 120 3.525 10.397 -0.921 1.00 0.00 H new ATOM 0 HD3 ARG A 120 2.601 10.035 -2.365 1.00 0.00 H new ATOM 0 HE ARG A 120 4.399 12.110 -3.091 1.00 0.00 H new ATOM 0 HH11 ARG A 120 4.570 8.764 -1.927 1.00 0.00 H new ATOM 0 HH12 ARG A 120 6.111 8.437 -2.728 1.00 0.00 H new ATOM 0 HH21 ARG A 120 6.391 11.688 -4.127 1.00 0.00 H new ATOM 0 HH22 ARG A 120 7.145 10.097 -3.977 1.00 0.00 H new