USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 989 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 123 THR OG1 : rot 180:sc= 1.07 USER MOD Set 1.2: A 142 TYR OH : rot 57:sc= 1.19 USER MOD Set 2.1: A 120 LYS NZ :NH3+ -124:sc= -0.0152 (180deg=-0.0438) USER MOD Set 2.2: A 141 THR OG1 : rot -80:sc= -0.247 USER MOD Set 3.1: A 65 THR OG1 : rot -30:sc= 0.0106 USER MOD Set 3.2: A 87 TYR OH : rot 150:sc= 0 USER MOD Set 4.1: A 23 ASN : amide:sc= 0.824 K(o=1.6,f=0.76) USER MOD Set 4.2: A 49 TYR OH : rot -142:sc= 0.753 USER MOD Single : A 28 TYR OH : rot 30:sc= -0.0173 USER MOD Single : A 32 CYS SG : rot 81:sc= 1.09 USER MOD Single : A 33 SER OG : rot -85:sc= 1.73 USER MOD Single : A 37 THR OG1 : rot -86:sc= 0.109 USER MOD Single : A 51 SER OG : rot -148:sc= 1.26 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc=-0.00689 X(o=-0.0069,f=-0.0084) USER MOD Single : A 58 SER OG : rot 29:sc= 0.239 USER MOD Single : A 59 LYS NZ :NH3+ -164:sc=-0.00681 (180deg=-0.146) USER MOD Single : A 68 LYS NZ :NH3+ 177:sc= 0.858 (180deg=0.851) USER MOD Single : A 80 THR OG1 : rot 146:sc= 1.26 USER MOD Single : A 81 SER OG : rot -1:sc= 0.325 USER MOD Single : A 84 MET CE :methyl -141:sc= -2.89! (180deg=-3.79!) USER MOD Single : A 94 TYR OH : rot 180:sc= -0.539 USER MOD Single : A 95 SER OG : rot -170:sc= -2.08! USER MOD Single : A 103 HIS : no HD1:sc= -0.964 K(o=-0.96,f=-2.8!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= -0.28 USER MOD Single : A 107 MET CE :methyl 142:sc= -0.173 (180deg=-2.54!) USER MOD Single : A 132 LYS NZ :NH3+ 137:sc= 0.00873 (180deg=-0.0483) USER MOD Single : A 133 MET CE :methyl 178:sc= -0.394 (180deg=-0.407) USER MOD Single : A 134 LYS NZ :NH3+ 161:sc= -1.4! (180deg=-2.13!) USER MOD Single : A 137 ASN : amide:sc= -1.13 K(o=-1.1,f=-2.2!) USER MOD Single : A 138 TYR OH : rot -130:sc= -0.0397 USER MOD Single : A 144 TYR OH : rot -106:sc= 1.11 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 305 N TRP A 22 -3.368 -13.451 0.986 1.00 0.00 N ATOM 306 CA TRP A 22 -3.842 -12.117 0.649 1.00 0.00 C ATOM 307 C TRP A 22 -4.645 -11.544 1.811 1.00 0.00 C ATOM 308 O TRP A 22 -4.633 -10.337 2.056 1.00 0.00 O ATOM 309 CB TRP A 22 -4.695 -12.145 -0.617 1.00 0.00 C ATOM 310 CG TRP A 22 -3.963 -12.667 -1.811 1.00 0.00 C ATOM 311 CD1 TRP A 22 -4.029 -13.928 -2.315 1.00 0.00 C ATOM 312 CD2 TRP A 22 -3.051 -11.946 -2.644 1.00 0.00 C ATOM 313 NE1 TRP A 22 -3.219 -14.042 -3.417 1.00 0.00 N ATOM 314 CE2 TRP A 22 -2.606 -12.837 -3.640 1.00 0.00 C ATOM 315 CE3 TRP A 22 -2.567 -10.635 -2.648 1.00 0.00 C ATOM 316 CZ2 TRP A 22 -1.700 -12.458 -4.627 1.00 0.00 C ATOM 317 CZ3 TRP A 22 -1.669 -10.259 -3.628 1.00 0.00 C ATOM 318 CH2 TRP A 22 -1.245 -11.166 -4.609 1.00 0.00 C ATOM 0 HA TRP A 22 -2.977 -11.481 0.461 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -5.575 -12.763 -0.440 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -5.051 -11.137 -0.830 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -4.632 -14.725 -1.907 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -3.094 -14.885 -3.978 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -2.889 -9.928 -1.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -1.368 -13.158 -5.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -1.287 -9.249 -3.639 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -0.546 -10.840 -5.365 1.00 0.00 H new ATOM 329 N ASN A 23 -5.328 -12.428 2.528 1.00 0.00 N ATOM 330 CA ASN A 23 -6.105 -12.041 3.700 1.00 0.00 C ATOM 331 C ASN A 23 -5.185 -11.542 4.806 1.00 0.00 C ATOM 332 O ASN A 23 -5.420 -10.483 5.390 1.00 0.00 O ATOM 333 CB ASN A 23 -6.927 -13.229 4.211 1.00 0.00 C ATOM 334 CG ASN A 23 -8.062 -13.613 3.279 1.00 0.00 C ATOM 335 OD1 ASN A 23 -7.863 -14.334 2.303 1.00 0.00 O ATOM 336 ND2 ASN A 23 -9.266 -13.157 3.588 1.00 0.00 N ATOM 0 H ASN A 23 -5.360 -13.425 2.316 1.00 0.00 H new ATOM 0 HA ASN A 23 -6.782 -11.237 3.411 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -6.269 -14.087 4.345 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -7.337 -12.985 5.191 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -10.068 -13.402 3.008 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -9.391 -12.561 4.406 1.00 0.00 H new ATOM 343 N ASP A 24 -4.135 -12.305 5.081 1.00 0.00 N ATOM 344 CA ASP A 24 -3.167 -11.931 6.111 1.00 0.00 C ATOM 345 C ASP A 24 -2.381 -10.694 5.707 1.00 0.00 C ATOM 346 O ASP A 24 -2.040 -9.868 6.556 1.00 0.00 O ATOM 347 CB ASP A 24 -2.210 -13.081 6.407 1.00 0.00 C ATOM 348 CG ASP A 24 -2.648 -13.915 7.594 1.00 0.00 C ATOM 349 OD1 ASP A 24 -2.333 -13.537 8.740 1.00 0.00 O ATOM 350 OD2 ASP A 24 -3.295 -14.961 7.393 1.00 0.00 O ATOM 0 H ASP A 24 -3.930 -13.185 4.608 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.730 -11.702 7.016 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -2.133 -13.720 5.527 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -1.214 -12.680 6.597 1.00 0.00 H new ATOM 355 N LEU A 25 -2.094 -10.567 4.411 1.00 0.00 N ATOM 356 CA LEU A 25 -1.467 -9.359 3.882 1.00 0.00 C ATOM 357 C LEU A 25 -2.252 -8.129 4.327 1.00 0.00 C ATOM 358 O LEU A 25 -1.688 -7.170 4.855 1.00 0.00 O ATOM 359 CB LEU A 25 -1.415 -9.405 2.352 1.00 0.00 C ATOM 360 CG LEU A 25 -0.912 -8.121 1.684 1.00 0.00 C ATOM 361 CD1 LEU A 25 0.555 -7.882 2.006 1.00 0.00 C ATOM 362 CD2 LEU A 25 -1.131 -8.177 0.180 1.00 0.00 C ATOM 0 H LEU A 25 -2.286 -11.284 3.712 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.449 -9.302 4.268 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.771 -10.231 2.050 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.414 -9.626 1.976 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.486 -7.284 2.082 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.889 -6.965 1.521 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.680 -7.788 3.085 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.148 -8.721 1.644 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.767 -7.256 -0.275 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.588 -9.026 -0.235 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.195 -8.289 -0.029 1.00 0.00 H new ATOM 374 N ALA A 26 -3.563 -8.184 4.122 1.00 0.00 N ATOM 375 CA ALA A 26 -4.458 -7.111 4.533 1.00 0.00 C ATOM 376 C ALA A 26 -4.394 -6.890 6.040 1.00 0.00 C ATOM 377 O ALA A 26 -4.291 -5.755 6.498 1.00 0.00 O ATOM 378 CB ALA A 26 -5.877 -7.424 4.099 1.00 0.00 C ATOM 0 H ALA A 26 -4.032 -8.968 3.669 1.00 0.00 H new ATOM 0 HA ALA A 26 -4.136 -6.190 4.048 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.539 -6.616 4.411 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.912 -7.524 3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -6.201 -8.357 4.560 1.00 0.00 H new ATOM 384 N VAL A 27 -4.437 -7.984 6.802 1.00 0.00 N ATOM 385 CA VAL A 27 -4.360 -7.918 8.264 1.00 0.00 C ATOM 386 C VAL A 27 -3.104 -7.174 8.710 1.00 0.00 C ATOM 387 O VAL A 27 -3.158 -6.333 9.609 1.00 0.00 O ATOM 388 CB VAL A 27 -4.366 -9.328 8.898 1.00 0.00 C ATOM 389 CG1 VAL A 27 -4.141 -9.252 10.405 1.00 0.00 C ATOM 390 CG2 VAL A 27 -5.671 -10.045 8.590 1.00 0.00 C ATOM 0 H VAL A 27 -4.525 -8.930 6.430 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.243 -7.377 8.604 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.545 -9.897 8.462 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -4.150 -10.258 10.825 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.178 -8.783 10.606 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.934 -8.661 10.862 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -5.658 -11.036 9.044 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.505 -9.472 8.994 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.787 -10.142 7.511 1.00 0.00 H new ATOM 400 N TYR A 28 -1.983 -7.480 8.067 1.00 0.00 N ATOM 401 CA TYR A 28 -0.715 -6.836 8.381 1.00 0.00 C ATOM 402 C TYR A 28 -0.818 -5.331 8.175 1.00 0.00 C ATOM 403 O TYR A 28 -0.351 -4.546 8.999 1.00 0.00 O ATOM 404 CB TYR A 28 0.398 -7.406 7.501 1.00 0.00 C ATOM 405 CG TYR A 28 1.782 -6.950 7.899 1.00 0.00 C ATOM 406 CD1 TYR A 28 2.348 -7.370 9.093 1.00 0.00 C ATOM 407 CD2 TYR A 28 2.528 -6.119 7.074 1.00 0.00 C ATOM 408 CE1 TYR A 28 3.617 -6.973 9.459 1.00 0.00 C ATOM 409 CE2 TYR A 28 3.798 -5.715 7.433 1.00 0.00 C ATOM 410 CZ TYR A 28 4.339 -6.146 8.628 1.00 0.00 C ATOM 411 OH TYR A 28 5.608 -5.761 8.987 1.00 0.00 O ATOM 0 H TYR A 28 -1.928 -8.174 7.321 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.478 -7.032 9.427 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.359 -8.495 7.541 1.00 0.00 H new ATOM 0 HB3 TYR A 28 0.214 -7.118 6.466 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.785 -8.019 9.748 1.00 0.00 H new ATOM 0 HD2 TYR A 28 2.108 -5.784 6.137 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.042 -7.309 10.393 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.365 -5.065 6.783 1.00 0.00 H new ATOM 0 HH TYR A 28 6.021 -6.463 9.531 1.00 0.00 H new ATOM 421 N ILE A 29 -1.451 -4.944 7.077 1.00 0.00 N ATOM 422 CA ILE A 29 -1.655 -3.538 6.756 1.00 0.00 C ATOM 423 C ILE A 29 -2.582 -2.886 7.781 1.00 0.00 C ATOM 424 O ILE A 29 -2.310 -1.788 8.268 1.00 0.00 O ATOM 425 CB ILE A 29 -2.249 -3.383 5.342 1.00 0.00 C ATOM 426 CG1 ILE A 29 -1.336 -4.065 4.320 1.00 0.00 C ATOM 427 CG2 ILE A 29 -2.441 -1.911 4.992 1.00 0.00 C ATOM 428 CD1 ILE A 29 -1.967 -4.244 2.959 1.00 0.00 C ATOM 0 H ILE A 29 -1.835 -5.590 6.388 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.686 -3.040 6.786 1.00 0.00 H new ATOM 0 HB ILE A 29 -3.228 -3.862 5.319 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.424 -3.477 4.213 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.042 -5.042 4.705 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.861 -1.827 3.990 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -3.121 -1.452 5.710 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -1.479 -1.400 5.026 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.258 -4.734 2.291 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.863 -4.858 3.051 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.236 -3.269 2.551 1.00 0.00 H new ATOM 440 N ILE A 30 -3.661 -3.589 8.113 1.00 0.00 N ATOM 441 CA ILE A 30 -4.633 -3.129 9.103 1.00 0.00 C ATOM 442 C ILE A 30 -3.960 -2.871 10.452 1.00 0.00 C ATOM 443 O ILE A 30 -4.176 -1.834 11.078 1.00 0.00 O ATOM 444 CB ILE A 30 -5.763 -4.172 9.282 1.00 0.00 C ATOM 445 CG1 ILE A 30 -6.525 -4.350 7.968 1.00 0.00 C ATOM 446 CG2 ILE A 30 -6.710 -3.755 10.401 1.00 0.00 C ATOM 447 CD1 ILE A 30 -7.415 -5.574 7.934 1.00 0.00 C ATOM 0 H ILE A 30 -3.887 -4.495 7.703 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.060 -2.195 8.738 1.00 0.00 H new ATOM 0 HB ILE A 30 -5.315 -5.127 9.558 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.135 -3.464 7.791 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -5.808 -4.412 7.149 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.496 -4.502 10.510 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.155 -3.674 11.336 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -7.157 -2.791 10.159 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.921 -5.630 6.970 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -6.809 -6.469 8.078 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -8.157 -5.506 8.729 1.00 0.00 H new ATOM 459 N ARG A 31 -3.123 -3.807 10.873 1.00 0.00 N ATOM 460 CA ARG A 31 -2.448 -3.718 12.161 1.00 0.00 C ATOM 461 C ARG A 31 -1.423 -2.586 12.178 1.00 0.00 C ATOM 462 O ARG A 31 -1.144 -1.993 13.222 1.00 0.00 O ATOM 463 CB ARG A 31 -1.773 -5.052 12.482 1.00 0.00 C ATOM 464 CG ARG A 31 -2.755 -6.166 12.805 1.00 0.00 C ATOM 465 CD ARG A 31 -2.044 -7.500 12.957 1.00 0.00 C ATOM 466 NE ARG A 31 -2.847 -8.480 13.687 1.00 0.00 N ATOM 467 CZ ARG A 31 -2.331 -9.511 14.356 1.00 0.00 C ATOM 468 NH1 ARG A 31 -1.014 -9.695 14.386 1.00 0.00 N ATOM 469 NH2 ARG A 31 -3.128 -10.353 15.005 1.00 0.00 N ATOM 0 H ARG A 31 -2.893 -4.644 10.337 1.00 0.00 H new ATOM 0 HA ARG A 31 -3.195 -3.497 12.924 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -1.160 -5.354 11.633 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -1.100 -4.915 13.328 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -3.288 -5.928 13.726 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.501 -6.237 12.014 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -1.803 -7.895 11.970 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -1.099 -7.348 13.479 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.861 -8.368 13.684 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.397 -9.047 13.897 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -0.621 -10.484 14.898 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.138 -10.211 14.992 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -2.730 -11.141 15.516 1.00 0.00 H new ATOM 483 N CYS A 32 -0.878 -2.280 11.013 1.00 0.00 N ATOM 484 CA CYS A 32 0.135 -1.242 10.895 1.00 0.00 C ATOM 485 C CYS A 32 -0.493 0.131 10.656 1.00 0.00 C ATOM 486 O CYS A 32 0.214 1.131 10.530 1.00 0.00 O ATOM 487 CB CYS A 32 1.100 -1.589 9.765 1.00 0.00 C ATOM 488 SG CYS A 32 2.001 -3.135 10.021 1.00 0.00 S ATOM 0 H CYS A 32 -1.120 -2.736 10.133 1.00 0.00 H new ATOM 0 HA CYS A 32 0.683 -1.193 11.836 1.00 0.00 H new ATOM 0 HB2 CYS A 32 0.542 -1.655 8.831 1.00 0.00 H new ATOM 0 HB3 CYS A 32 1.817 -0.776 9.650 1.00 0.00 H new ATOM 0 HG CYS A 32 1.246 -4.138 9.683 1.00 0.00 H new ATOM 494 N SER A 33 -1.815 0.176 10.585 1.00 0.00 N ATOM 495 CA SER A 33 -2.525 1.433 10.414 1.00 0.00 C ATOM 496 C SER A 33 -3.617 1.595 11.474 1.00 0.00 C ATOM 497 O SER A 33 -3.399 2.219 12.515 1.00 0.00 O ATOM 498 CB SER A 33 -3.115 1.516 9.005 1.00 0.00 C ATOM 499 OG SER A 33 -3.865 0.353 8.692 1.00 0.00 O ATOM 0 H SER A 33 -2.418 -0.645 10.643 1.00 0.00 H new ATOM 0 HA SER A 33 -1.816 2.251 10.543 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.754 2.396 8.927 1.00 0.00 H new ATOM 0 HB3 SER A 33 -2.312 1.640 8.279 1.00 0.00 H new ATOM 0 HG SER A 33 -3.265 -0.340 8.345 1.00 0.00 H new ATOM 505 N GLY A 34 -4.780 1.009 11.220 1.00 0.00 N ATOM 506 CA GLY A 34 -5.882 1.102 12.156 1.00 0.00 C ATOM 507 C GLY A 34 -6.993 2.001 11.647 1.00 0.00 C ATOM 508 O GLY A 34 -6.774 2.812 10.744 1.00 0.00 O ATOM 0 H GLY A 34 -4.980 0.469 10.378 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -6.281 0.105 12.345 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.516 1.484 13.109 1.00 0.00 H new ATOM 512 N PRO A 35 -8.207 1.871 12.205 1.00 0.00 N ATOM 513 CA PRO A 35 -9.354 2.697 11.817 1.00 0.00 C ATOM 514 C PRO A 35 -9.127 4.176 12.118 1.00 0.00 C ATOM 515 O PRO A 35 -8.464 4.527 13.097 1.00 0.00 O ATOM 516 CB PRO A 35 -10.508 2.155 12.673 1.00 0.00 C ATOM 517 CG PRO A 35 -10.054 0.818 13.148 1.00 0.00 C ATOM 518 CD PRO A 35 -8.561 0.905 13.256 1.00 0.00 C ATOM 0 HA PRO A 35 -9.543 2.642 10.745 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -10.721 2.818 13.511 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.425 2.074 12.090 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -10.502 0.573 14.111 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -10.350 0.034 12.450 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -8.247 1.249 14.242 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -8.088 -0.063 13.090 1.00 0.00 H new ATOM 526 N GLY A 36 -9.668 5.038 11.269 1.00 0.00 N ATOM 527 CA GLY A 36 -9.533 6.467 11.471 1.00 0.00 C ATOM 528 C GLY A 36 -8.357 7.054 10.716 1.00 0.00 C ATOM 529 O GLY A 36 -8.333 8.249 10.421 1.00 0.00 O ATOM 0 H GLY A 36 -10.200 4.772 10.440 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -10.449 6.963 11.152 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.415 6.670 12.535 1.00 0.00 H new ATOM 533 N THR A 37 -7.381 6.210 10.398 1.00 0.00 N ATOM 534 CA THR A 37 -6.189 6.649 9.686 1.00 0.00 C ATOM 535 C THR A 37 -6.477 6.728 8.193 1.00 0.00 C ATOM 536 O THR A 37 -7.624 6.592 7.779 1.00 0.00 O ATOM 537 CB THR A 37 -5.009 5.682 9.927 1.00 0.00 C ATOM 538 OG1 THR A 37 -5.182 4.482 9.169 1.00 0.00 O ATOM 539 CG2 THR A 37 -4.920 5.318 11.392 1.00 0.00 C ATOM 0 H THR A 37 -7.394 5.215 10.624 1.00 0.00 H new ATOM 0 HA THR A 37 -5.915 7.634 10.064 1.00 0.00 H new ATOM 0 HB THR A 37 -4.094 6.185 9.614 1.00 0.00 H new ATOM 0 HG1 THR A 37 -5.736 3.852 9.676 1.00 0.00 H new ATOM 0 HG21 THR A 37 -4.084 4.636 11.547 1.00 0.00 H new ATOM 0 HG22 THR A 37 -4.766 6.221 11.983 1.00 0.00 H new ATOM 0 HG23 THR A 37 -5.846 4.834 11.704 1.00 0.00 H new ATOM 547 N ARG A 38 -5.450 6.952 7.391 1.00 0.00 N ATOM 548 CA ARG A 38 -5.596 6.915 5.951 1.00 0.00 C ATOM 549 C ARG A 38 -4.503 6.053 5.333 1.00 0.00 C ATOM 550 O ARG A 38 -3.324 6.197 5.654 1.00 0.00 O ATOM 551 CB ARG A 38 -5.583 8.328 5.366 1.00 0.00 C ATOM 552 CG ARG A 38 -4.357 9.141 5.720 1.00 0.00 C ATOM 553 CD ARG A 38 -4.459 10.568 5.201 1.00 0.00 C ATOM 554 NE ARG A 38 -4.448 10.637 3.739 1.00 0.00 N ATOM 555 CZ ARG A 38 -4.708 11.747 3.046 1.00 0.00 C ATOM 556 NH1 ARG A 38 -5.014 12.872 3.683 1.00 0.00 N ATOM 557 NH2 ARG A 38 -4.652 11.738 1.719 1.00 0.00 N ATOM 0 H ARG A 38 -4.506 7.161 7.716 1.00 0.00 H new ATOM 0 HA ARG A 38 -6.560 6.468 5.710 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -5.657 8.259 4.281 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -6.469 8.860 5.713 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -4.230 9.156 6.802 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -3.471 8.664 5.302 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -5.376 11.022 5.576 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -3.629 11.154 5.595 1.00 0.00 H new ATOM 0 HE ARG A 38 -4.229 9.787 3.220 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -5.050 12.887 4.702 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -5.213 13.720 3.153 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -4.409 10.879 1.225 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -4.852 12.590 1.194 1.00 0.00 H new ATOM 571 N VAL A 39 -4.909 5.145 4.466 1.00 0.00 N ATOM 572 CA VAL A 39 -3.993 4.215 3.821 1.00 0.00 C ATOM 573 C VAL A 39 -4.227 4.237 2.322 1.00 0.00 C ATOM 574 O VAL A 39 -5.367 4.206 1.879 1.00 0.00 O ATOM 575 CB VAL A 39 -4.181 2.775 4.352 1.00 0.00 C ATOM 576 CG1 VAL A 39 -3.268 1.800 3.628 1.00 0.00 C ATOM 577 CG2 VAL A 39 -3.932 2.720 5.849 1.00 0.00 C ATOM 0 H VAL A 39 -5.883 5.029 4.187 1.00 0.00 H new ATOM 0 HA VAL A 39 -2.974 4.528 4.048 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.212 2.480 4.159 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.422 0.796 4.022 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.497 1.810 2.562 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.229 2.094 3.779 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.069 1.698 6.203 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -2.913 3.044 6.060 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.635 3.379 6.359 1.00 0.00 H new ATOM 587 N VAL A 40 -3.160 4.304 1.544 1.00 0.00 N ATOM 588 CA VAL A 40 -3.292 4.429 0.101 1.00 0.00 C ATOM 589 C VAL A 40 -2.862 3.148 -0.612 1.00 0.00 C ATOM 590 O VAL A 40 -1.753 2.649 -0.406 1.00 0.00 O ATOM 591 CB VAL A 40 -2.470 5.619 -0.439 1.00 0.00 C ATOM 592 CG1 VAL A 40 -2.689 5.792 -1.935 1.00 0.00 C ATOM 593 CG2 VAL A 40 -2.822 6.901 0.302 1.00 0.00 C ATOM 0 H VAL A 40 -2.199 4.274 1.883 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.347 4.608 -0.104 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.415 5.404 -0.269 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.100 6.636 -2.294 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.379 4.886 -2.455 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -3.745 5.978 -2.129 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.230 7.725 -0.096 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.882 7.118 0.170 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.606 6.779 1.363 1.00 0.00 H new ATOM 603 N GLU A 41 -3.754 2.617 -1.440 1.00 0.00 N ATOM 604 CA GLU A 41 -3.444 1.457 -2.266 1.00 0.00 C ATOM 605 C GLU A 41 -3.155 1.906 -3.697 1.00 0.00 C ATOM 606 O GLU A 41 -3.996 2.535 -4.347 1.00 0.00 O ATOM 607 CB GLU A 41 -4.597 0.443 -2.252 1.00 0.00 C ATOM 608 CG GLU A 41 -4.335 -0.790 -3.108 1.00 0.00 C ATOM 609 CD GLU A 41 -5.454 -1.813 -3.037 1.00 0.00 C ATOM 610 OE1 GLU A 41 -6.540 -1.549 -3.587 1.00 0.00 O ATOM 611 OE2 GLU A 41 -5.243 -2.885 -2.440 1.00 0.00 O ATOM 0 H GLU A 41 -4.702 2.974 -1.557 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.561 0.967 -1.855 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -4.781 0.129 -1.225 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -5.505 0.933 -2.604 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.197 -0.483 -4.145 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.404 -1.256 -2.787 1.00 0.00 H new ATOM 618 N VAL A 42 -1.958 1.604 -4.173 1.00 0.00 N ATOM 619 CA VAL A 42 -1.552 1.985 -5.517 1.00 0.00 C ATOM 620 C VAL A 42 -1.730 0.812 -6.475 1.00 0.00 C ATOM 621 O VAL A 42 -1.181 -0.270 -6.255 1.00 0.00 O ATOM 622 CB VAL A 42 -0.083 2.460 -5.554 1.00 0.00 C ATOM 623 CG1 VAL A 42 0.293 2.956 -6.941 1.00 0.00 C ATOM 624 CG2 VAL A 42 0.150 3.549 -4.518 1.00 0.00 C ATOM 0 H VAL A 42 -1.248 1.094 -3.647 1.00 0.00 H new ATOM 0 HA VAL A 42 -2.188 2.814 -5.828 1.00 0.00 H new ATOM 0 HB VAL A 42 0.555 1.609 -5.314 1.00 0.00 H new ATOM 0 HG11 VAL A 42 1.332 3.285 -6.940 1.00 0.00 H new ATOM 0 HG12 VAL A 42 0.168 2.148 -7.662 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -0.352 3.791 -7.216 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.190 3.872 -4.558 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -0.502 4.397 -4.729 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -0.071 3.159 -3.524 1.00 0.00 H new ATOM 634 N GLY A 43 -2.503 1.032 -7.529 1.00 0.00 N ATOM 635 CA GLY A 43 -2.799 -0.031 -8.469 1.00 0.00 C ATOM 636 C GLY A 43 -4.135 -0.669 -8.170 1.00 0.00 C ATOM 637 O GLY A 43 -4.365 -1.839 -8.481 1.00 0.00 O ATOM 0 H GLY A 43 -2.932 1.931 -7.751 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.802 0.368 -9.483 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.015 -0.787 -8.426 1.00 0.00 H new ATOM 641 N ALA A 44 -5.018 0.114 -7.567 1.00 0.00 N ATOM 642 CA ALA A 44 -6.332 -0.361 -7.169 1.00 0.00 C ATOM 643 C ALA A 44 -7.317 -0.261 -8.324 1.00 0.00 C ATOM 644 O ALA A 44 -8.142 0.654 -8.380 1.00 0.00 O ATOM 645 CB ALA A 44 -6.833 0.429 -5.973 1.00 0.00 C ATOM 0 H ALA A 44 -4.843 1.093 -7.341 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.248 -1.410 -6.887 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -7.819 0.065 -5.683 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -6.141 0.306 -5.140 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -6.899 1.485 -6.236 1.00 0.00 H new ATOM 651 N GLY A 45 -7.205 -1.186 -9.259 1.00 0.00 N ATOM 652 CA GLY A 45 -8.082 -1.177 -10.406 1.00 0.00 C ATOM 653 C GLY A 45 -9.054 -2.334 -10.401 1.00 0.00 C ATOM 654 O GLY A 45 -10.252 -2.147 -10.188 1.00 0.00 O ATOM 0 H GLY A 45 -6.522 -1.944 -9.245 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -8.638 -0.240 -10.427 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -7.484 -1.213 -11.317 1.00 0.00 H new ATOM 658 N ARG A 46 -8.542 -3.537 -10.624 1.00 0.00 N ATOM 659 CA ARG A 46 -9.392 -4.715 -10.731 1.00 0.00 C ATOM 660 C ARG A 46 -9.054 -5.736 -9.651 1.00 0.00 C ATOM 661 O ARG A 46 -9.521 -6.874 -9.694 1.00 0.00 O ATOM 662 CB ARG A 46 -9.258 -5.367 -12.114 1.00 0.00 C ATOM 663 CG ARG A 46 -9.759 -4.506 -13.268 1.00 0.00 C ATOM 664 CD ARG A 46 -8.723 -3.485 -13.711 1.00 0.00 C ATOM 665 NE ARG A 46 -7.499 -4.125 -14.191 1.00 0.00 N ATOM 666 CZ ARG A 46 -6.507 -3.482 -14.805 1.00 0.00 C ATOM 667 NH1 ARG A 46 -6.565 -2.164 -14.985 1.00 0.00 N ATOM 668 NH2 ARG A 46 -5.443 -4.155 -15.218 1.00 0.00 N ATOM 0 H ARG A 46 -7.545 -3.723 -10.734 1.00 0.00 H new ATOM 0 HA ARG A 46 -10.422 -4.385 -10.594 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -8.210 -5.611 -12.287 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -9.808 -6.308 -12.113 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -10.020 -5.146 -14.111 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -10.670 -3.990 -12.966 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -9.142 -2.862 -14.502 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -8.485 -2.824 -12.878 1.00 0.00 H new ATOM 0 HE ARG A 46 -7.398 -5.130 -14.046 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -7.373 -1.639 -14.652 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -5.801 -1.680 -15.456 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -5.386 -5.162 -15.065 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -4.681 -3.666 -15.689 1.00 0.00 H new ATOM 682 N PHE A 47 -8.250 -5.333 -8.680 1.00 0.00 N ATOM 683 CA PHE A 47 -7.891 -6.218 -7.585 1.00 0.00 C ATOM 684 C PHE A 47 -8.114 -5.513 -6.253 1.00 0.00 C ATOM 685 O PHE A 47 -7.170 -5.136 -5.566 1.00 0.00 O ATOM 686 CB PHE A 47 -6.435 -6.680 -7.718 1.00 0.00 C ATOM 687 CG PHE A 47 -6.076 -7.832 -6.819 1.00 0.00 C ATOM 688 CD1 PHE A 47 -6.516 -9.115 -7.107 1.00 0.00 C ATOM 689 CD2 PHE A 47 -5.294 -7.635 -5.693 1.00 0.00 C ATOM 690 CE1 PHE A 47 -6.185 -10.178 -6.289 1.00 0.00 C ATOM 691 CE2 PHE A 47 -4.961 -8.694 -4.869 1.00 0.00 C ATOM 692 CZ PHE A 47 -5.407 -9.967 -5.168 1.00 0.00 C ATOM 0 H PHE A 47 -7.835 -4.403 -8.628 1.00 0.00 H new ATOM 0 HA PHE A 47 -8.528 -7.101 -7.624 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -6.249 -6.968 -8.753 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.776 -5.840 -7.497 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -7.125 -9.286 -7.982 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -4.940 -6.643 -5.456 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -6.534 -11.172 -6.526 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -4.353 -8.526 -3.992 1.00 0.00 H new ATOM 0 HZ PHE A 47 -5.148 -10.796 -4.526 1.00 0.00 H new ATOM 702 N LEU A 48 -9.379 -5.315 -5.907 1.00 0.00 N ATOM 703 CA LEU A 48 -9.739 -4.626 -4.671 1.00 0.00 C ATOM 704 C LEU A 48 -9.959 -5.625 -3.539 1.00 0.00 C ATOM 705 O LEU A 48 -10.596 -5.313 -2.535 1.00 0.00 O ATOM 706 CB LEU A 48 -11.007 -3.797 -4.892 1.00 0.00 C ATOM 707 CG LEU A 48 -10.921 -2.761 -6.016 1.00 0.00 C ATOM 708 CD1 LEU A 48 -12.257 -2.059 -6.200 1.00 0.00 C ATOM 709 CD2 LEU A 48 -9.823 -1.749 -5.724 1.00 0.00 C ATOM 0 H LEU A 48 -10.176 -5.622 -6.465 1.00 0.00 H new ATOM 0 HA LEU A 48 -8.919 -3.965 -4.390 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -11.832 -4.475 -5.107 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -11.252 -3.282 -3.963 1.00 0.00 H new ATOM 0 HG LEU A 48 -10.675 -3.279 -6.943 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -12.176 -1.327 -7.003 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -13.022 -2.793 -6.454 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -12.533 -1.553 -5.275 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -9.776 -1.020 -6.533 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -10.040 -1.237 -4.786 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.866 -2.264 -5.643 1.00 0.00 H new ATOM 721 N TYR A 49 -9.411 -6.823 -3.707 1.00 0.00 N ATOM 722 CA TYR A 49 -9.576 -7.893 -2.730 1.00 0.00 C ATOM 723 C TYR A 49 -8.943 -7.515 -1.395 1.00 0.00 C ATOM 724 O TYR A 49 -9.501 -7.795 -0.337 1.00 0.00 O ATOM 725 CB TYR A 49 -8.962 -9.192 -3.265 1.00 0.00 C ATOM 726 CG TYR A 49 -9.130 -10.390 -2.352 1.00 0.00 C ATOM 727 CD1 TYR A 49 -10.393 -10.831 -1.972 1.00 0.00 C ATOM 728 CD2 TYR A 49 -8.024 -11.092 -1.884 1.00 0.00 C ATOM 729 CE1 TYR A 49 -10.548 -11.934 -1.150 1.00 0.00 C ATOM 730 CE2 TYR A 49 -8.172 -12.193 -1.061 1.00 0.00 C ATOM 731 CZ TYR A 49 -9.433 -12.609 -0.697 1.00 0.00 C ATOM 732 OH TYR A 49 -9.585 -13.716 0.114 1.00 0.00 O ATOM 0 H TYR A 49 -8.845 -7.079 -4.516 1.00 0.00 H new ATOM 0 HA TYR A 49 -10.642 -8.047 -2.565 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -9.413 -9.421 -4.231 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -7.898 -9.031 -3.440 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -11.268 -10.304 -2.324 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -7.033 -10.771 -2.168 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -11.536 -12.264 -0.865 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -7.302 -12.725 -0.705 1.00 0.00 H new ATOM 0 HH TYR A 49 -8.880 -13.722 0.795 1.00 0.00 H new ATOM 742 N VAL A 50 -7.788 -6.869 -1.452 1.00 0.00 N ATOM 743 CA VAL A 50 -7.078 -6.471 -0.244 1.00 0.00 C ATOM 744 C VAL A 50 -7.750 -5.261 0.398 1.00 0.00 C ATOM 745 O VAL A 50 -8.132 -5.298 1.571 1.00 0.00 O ATOM 746 CB VAL A 50 -5.600 -6.140 -0.548 1.00 0.00 C ATOM 747 CG1 VAL A 50 -4.856 -5.749 0.719 1.00 0.00 C ATOM 748 CG2 VAL A 50 -4.915 -7.315 -1.231 1.00 0.00 C ATOM 0 H VAL A 50 -7.322 -6.609 -2.321 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.111 -7.312 0.449 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.580 -5.288 -1.227 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.818 -5.521 0.476 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.326 -4.871 1.161 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -4.889 -6.575 1.430 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.875 -7.061 -1.436 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -4.953 -8.188 -0.579 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.425 -7.539 -2.168 1.00 0.00 H new ATOM 758 N SER A 51 -7.918 -4.209 -0.390 1.00 0.00 N ATOM 759 CA SER A 51 -8.459 -2.953 0.099 1.00 0.00 C ATOM 760 C SER A 51 -9.877 -3.099 0.654 1.00 0.00 C ATOM 761 O SER A 51 -10.173 -2.602 1.745 1.00 0.00 O ATOM 762 CB SER A 51 -8.425 -1.923 -1.024 1.00 0.00 C ATOM 763 OG SER A 51 -8.644 -2.535 -2.284 1.00 0.00 O ATOM 0 H SER A 51 -7.684 -4.203 -1.383 1.00 0.00 H new ATOM 0 HA SER A 51 -7.837 -2.620 0.930 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.186 -1.163 -0.848 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.461 -1.414 -1.026 1.00 0.00 H new ATOM 0 HG SER A 51 -8.154 -2.044 -2.976 1.00 0.00 H new ATOM 769 N ASP A 52 -10.751 -3.783 -0.079 1.00 0.00 N ATOM 770 CA ASP A 52 -12.137 -3.936 0.357 1.00 0.00 C ATOM 771 C ASP A 52 -12.200 -4.725 1.658 1.00 0.00 C ATOM 772 O ASP A 52 -12.988 -4.412 2.547 1.00 0.00 O ATOM 773 CB ASP A 52 -12.985 -4.615 -0.721 1.00 0.00 C ATOM 774 CG ASP A 52 -14.457 -4.652 -0.359 1.00 0.00 C ATOM 775 OD1 ASP A 52 -15.046 -3.572 -0.134 1.00 0.00 O ATOM 776 OD2 ASP A 52 -15.043 -5.754 -0.328 1.00 0.00 O ATOM 0 H ASP A 52 -10.529 -4.235 -0.966 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.547 -2.941 0.529 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -12.859 -4.086 -1.666 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -12.626 -5.632 -0.875 1.00 0.00 H new ATOM 781 N TYR A 53 -11.340 -5.728 1.771 1.00 0.00 N ATOM 782 CA TYR A 53 -11.252 -6.541 2.978 1.00 0.00 C ATOM 783 C TYR A 53 -10.864 -5.674 4.177 1.00 0.00 C ATOM 784 O TYR A 53 -11.466 -5.768 5.252 1.00 0.00 O ATOM 785 CB TYR A 53 -10.230 -7.666 2.773 1.00 0.00 C ATOM 786 CG TYR A 53 -10.014 -8.547 3.985 1.00 0.00 C ATOM 787 CD1 TYR A 53 -10.783 -9.685 4.190 1.00 0.00 C ATOM 788 CD2 TYR A 53 -9.032 -8.243 4.917 1.00 0.00 C ATOM 789 CE1 TYR A 53 -10.579 -10.491 5.293 1.00 0.00 C ATOM 790 CE2 TYR A 53 -8.822 -9.044 6.021 1.00 0.00 C ATOM 791 CZ TYR A 53 -9.598 -10.166 6.204 1.00 0.00 C ATOM 792 OH TYR A 53 -9.392 -10.966 7.303 1.00 0.00 O ATOM 0 H TYR A 53 -10.688 -6.000 1.035 1.00 0.00 H new ATOM 0 HA TYR A 53 -12.227 -6.984 3.180 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -10.557 -8.289 1.940 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -9.276 -7.225 2.486 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -11.552 -9.944 3.477 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -8.421 -7.364 4.776 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -11.186 -11.372 5.441 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -8.054 -8.792 6.737 1.00 0.00 H new ATOM 0 HH TYR A 53 -8.663 -10.597 7.844 1.00 0.00 H new ATOM 802 N ILE A 54 -9.866 -4.820 3.977 1.00 0.00 N ATOM 803 CA ILE A 54 -9.372 -3.944 5.031 1.00 0.00 C ATOM 804 C ILE A 54 -10.477 -3.038 5.568 1.00 0.00 C ATOM 805 O ILE A 54 -10.677 -2.947 6.781 1.00 0.00 O ATOM 806 CB ILE A 54 -8.189 -3.082 4.532 1.00 0.00 C ATOM 807 CG1 ILE A 54 -7.010 -3.979 4.154 1.00 0.00 C ATOM 808 CG2 ILE A 54 -7.770 -2.071 5.590 1.00 0.00 C ATOM 809 CD1 ILE A 54 -5.836 -3.229 3.565 1.00 0.00 C ATOM 0 H ILE A 54 -9.380 -4.716 3.086 1.00 0.00 H new ATOM 0 HA ILE A 54 -9.024 -4.585 5.841 1.00 0.00 H new ATOM 0 HB ILE A 54 -8.512 -2.532 3.648 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -6.677 -4.518 5.041 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -7.349 -4.726 3.436 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.936 -1.477 5.216 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -8.610 -1.415 5.819 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -7.463 -2.597 6.494 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -5.040 -3.933 3.322 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -6.152 -2.712 2.659 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.469 -2.501 4.289 1.00 0.00 H new ATOM 821 N ARG A 55 -11.212 -2.396 4.667 1.00 0.00 N ATOM 822 CA ARG A 55 -12.238 -1.435 5.069 1.00 0.00 C ATOM 823 C ARG A 55 -13.464 -2.130 5.667 1.00 0.00 C ATOM 824 O ARG A 55 -14.287 -1.493 6.328 1.00 0.00 O ATOM 825 CB ARG A 55 -12.647 -0.542 3.892 1.00 0.00 C ATOM 826 CG ARG A 55 -13.281 -1.286 2.730 1.00 0.00 C ATOM 827 CD ARG A 55 -13.618 -0.342 1.589 1.00 0.00 C ATOM 828 NE ARG A 55 -14.322 -1.018 0.501 1.00 0.00 N ATOM 829 CZ ARG A 55 -14.858 -0.388 -0.542 1.00 0.00 C ATOM 830 NH1 ARG A 55 -14.747 0.931 -0.661 1.00 0.00 N ATOM 831 NH2 ARG A 55 -15.499 -1.084 -1.470 1.00 0.00 N ATOM 0 H ARG A 55 -11.119 -2.521 3.659 1.00 0.00 H new ATOM 0 HA ARG A 55 -11.802 -0.806 5.845 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.348 0.212 4.250 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -11.766 -0.012 3.531 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.600 -2.060 2.376 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -14.187 -1.789 3.068 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.234 0.475 1.966 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -12.700 0.102 1.204 1.00 0.00 H new ATOM 0 HE ARG A 55 -14.408 -2.034 0.543 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.249 1.467 0.049 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.160 1.407 -1.463 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -15.580 -2.097 -1.383 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -15.912 -0.607 -2.271 1.00 0.00 H new ATOM 845 N LYS A 56 -13.594 -3.433 5.433 1.00 0.00 N ATOM 846 CA LYS A 56 -14.666 -4.206 6.050 1.00 0.00 C ATOM 847 C LYS A 56 -14.381 -4.414 7.533 1.00 0.00 C ATOM 848 O LYS A 56 -15.274 -4.284 8.371 1.00 0.00 O ATOM 849 CB LYS A 56 -14.834 -5.561 5.354 1.00 0.00 C ATOM 850 CG LYS A 56 -15.423 -5.486 3.947 1.00 0.00 C ATOM 851 CD LYS A 56 -16.932 -5.245 3.951 1.00 0.00 C ATOM 852 CE LYS A 56 -17.296 -3.830 4.375 1.00 0.00 C ATOM 853 NZ LYS A 56 -18.767 -3.625 4.422 1.00 0.00 N ATOM 0 H LYS A 56 -12.976 -3.971 4.826 1.00 0.00 H new ATOM 0 HA LYS A 56 -15.594 -3.645 5.941 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -13.861 -6.050 5.301 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -15.475 -6.193 5.969 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -14.933 -4.684 3.395 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -15.209 -6.415 3.418 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -17.330 -5.435 2.954 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -17.408 -5.957 4.625 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -16.870 -3.625 5.357 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -16.853 -3.118 3.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -18.972 -2.648 4.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -19.172 -3.796 3.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -19.188 -4.287 5.105 1.00 0.00 H new ATOM 867 N HIS A 57 -13.129 -4.710 7.851 1.00 0.00 N ATOM 868 CA HIS A 57 -12.729 -4.958 9.232 1.00 0.00 C ATOM 869 C HIS A 57 -12.424 -3.655 9.960 1.00 0.00 C ATOM 870 O HIS A 57 -12.960 -3.393 11.037 1.00 0.00 O ATOM 871 CB HIS A 57 -11.510 -5.883 9.286 1.00 0.00 C ATOM 872 CG HIS A 57 -11.820 -7.307 8.935 1.00 0.00 C ATOM 873 ND1 HIS A 57 -11.735 -8.309 9.872 1.00 0.00 N ATOM 874 CD2 HIS A 57 -12.207 -7.841 7.750 1.00 0.00 C ATOM 875 CE1 HIS A 57 -12.076 -9.422 9.246 1.00 0.00 C ATOM 876 NE2 HIS A 57 -12.369 -9.187 7.958 1.00 0.00 N ATOM 0 H HIS A 57 -12.371 -4.785 7.172 1.00 0.00 H new ATOM 0 HA HIS A 57 -13.565 -5.446 9.734 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -10.749 -5.507 8.603 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -11.083 -5.849 10.288 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -12.358 -7.309 6.822 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -12.114 -10.396 9.712 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -12.657 -9.878 7.265 1.00 0.00 H new ATOM 884 N SER A 58 -11.565 -2.843 9.371 1.00 0.00 N ATOM 885 CA SER A 58 -11.164 -1.584 9.976 1.00 0.00 C ATOM 886 C SER A 58 -11.696 -0.404 9.187 1.00 0.00 C ATOM 887 O SER A 58 -11.519 -0.334 7.971 1.00 0.00 O ATOM 888 CB SER A 58 -9.642 -1.495 10.059 1.00 0.00 C ATOM 889 OG SER A 58 -9.039 -1.880 8.835 1.00 0.00 O ATOM 0 H SER A 58 -11.129 -3.034 8.469 1.00 0.00 H new ATOM 0 HA SER A 58 -11.585 -1.550 10.981 1.00 0.00 H new ATOM 0 HB2 SER A 58 -9.348 -0.475 10.308 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.281 -2.136 10.863 1.00 0.00 H new ATOM 0 HG SER A 58 -9.646 -1.677 8.093 1.00 0.00 H new ATOM 895 N LYS A 59 -12.340 0.528 9.874 1.00 0.00 N ATOM 896 CA LYS A 59 -12.812 1.733 9.221 1.00 0.00 C ATOM 897 C LYS A 59 -11.672 2.741 9.113 1.00 0.00 C ATOM 898 O LYS A 59 -11.693 3.817 9.713 1.00 0.00 O ATOM 899 CB LYS A 59 -14.019 2.332 9.955 1.00 0.00 C ATOM 900 CG LYS A 59 -15.023 3.016 9.026 1.00 0.00 C ATOM 901 CD LYS A 59 -14.485 4.319 8.451 1.00 0.00 C ATOM 902 CE LYS A 59 -14.593 5.457 9.455 1.00 0.00 C ATOM 903 NZ LYS A 59 -15.999 5.906 9.630 1.00 0.00 N ATOM 0 H LYS A 59 -12.544 0.472 10.872 1.00 0.00 H new ATOM 0 HA LYS A 59 -13.147 1.476 8.216 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -14.527 1.541 10.506 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -13.665 3.056 10.689 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -15.279 2.340 8.210 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -15.944 3.216 9.574 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -13.443 4.187 8.160 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -15.038 4.575 7.548 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -14.192 5.134 10.416 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -13.982 6.296 9.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -16.011 6.835 10.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -16.458 5.979 8.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -16.513 5.218 10.216 1.00 0.00 H new ATOM 917 N VAL A 60 -10.654 2.339 8.385 1.00 0.00 N ATOM 918 CA VAL A 60 -9.562 3.217 8.016 1.00 0.00 C ATOM 919 C VAL A 60 -9.939 3.936 6.722 1.00 0.00 C ATOM 920 O VAL A 60 -10.618 3.361 5.870 1.00 0.00 O ATOM 921 CB VAL A 60 -8.256 2.409 7.825 1.00 0.00 C ATOM 922 CG1 VAL A 60 -8.499 1.178 6.968 1.00 0.00 C ATOM 923 CG2 VAL A 60 -7.169 3.269 7.213 1.00 0.00 C ATOM 0 H VAL A 60 -10.558 1.388 8.029 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.389 3.945 8.809 1.00 0.00 H new ATOM 0 HB VAL A 60 -7.922 2.083 8.810 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -7.566 0.628 6.849 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.238 0.539 7.451 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.868 1.483 5.989 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.262 2.676 7.090 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.499 3.635 6.240 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.963 4.116 7.868 1.00 0.00 H new ATOM 933 N ASP A 61 -9.545 5.191 6.585 1.00 0.00 N ATOM 934 CA ASP A 61 -9.821 5.929 5.362 1.00 0.00 C ATOM 935 C ASP A 61 -8.876 5.462 4.265 1.00 0.00 C ATOM 936 O ASP A 61 -7.781 5.997 4.084 1.00 0.00 O ATOM 937 CB ASP A 61 -9.692 7.435 5.588 1.00 0.00 C ATOM 938 CG ASP A 61 -10.019 8.236 4.345 1.00 0.00 C ATOM 939 OD1 ASP A 61 -11.006 7.894 3.653 1.00 0.00 O ATOM 940 OD2 ASP A 61 -9.311 9.224 4.071 1.00 0.00 O ATOM 0 H ASP A 61 -9.038 5.717 7.297 1.00 0.00 H new ATOM 0 HA ASP A 61 -10.848 5.733 5.055 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -10.358 7.737 6.397 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.676 7.666 5.909 1.00 0.00 H new ATOM 945 N LEU A 62 -9.285 4.416 3.572 1.00 0.00 N ATOM 946 CA LEU A 62 -8.453 3.815 2.554 1.00 0.00 C ATOM 947 C LEU A 62 -8.643 4.541 1.230 1.00 0.00 C ATOM 948 O LEU A 62 -9.760 4.653 0.718 1.00 0.00 O ATOM 949 CB LEU A 62 -8.785 2.324 2.419 1.00 0.00 C ATOM 950 CG LEU A 62 -7.601 1.412 2.077 1.00 0.00 C ATOM 951 CD1 LEU A 62 -8.003 -0.045 2.210 1.00 0.00 C ATOM 952 CD2 LEU A 62 -7.084 1.686 0.674 1.00 0.00 C ATOM 0 H LEU A 62 -10.192 3.966 3.698 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.406 3.906 2.844 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.226 1.982 3.355 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.546 2.208 1.647 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.798 1.625 2.782 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.153 -0.681 1.964 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -8.320 -0.243 3.234 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.826 -0.259 1.528 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.245 1.024 0.460 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.880 1.507 -0.049 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.756 2.723 0.603 1.00 0.00 H new ATOM 964 N VAL A 63 -7.546 5.040 0.691 1.00 0.00 N ATOM 965 CA VAL A 63 -7.562 5.770 -0.556 1.00 0.00 C ATOM 966 C VAL A 63 -7.034 4.887 -1.675 1.00 0.00 C ATOM 967 O VAL A 63 -5.890 4.435 -1.639 1.00 0.00 O ATOM 968 CB VAL A 63 -6.708 7.052 -0.476 1.00 0.00 C ATOM 969 CG1 VAL A 63 -6.802 7.837 -1.775 1.00 0.00 C ATOM 970 CG2 VAL A 63 -7.132 7.912 0.708 1.00 0.00 C ATOM 0 H VAL A 63 -6.620 4.949 1.108 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.594 6.058 -0.758 1.00 0.00 H new ATOM 0 HB VAL A 63 -5.668 6.762 -0.326 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -6.193 8.738 -1.700 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -6.440 7.222 -2.599 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -7.840 8.114 -1.958 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -6.516 8.810 0.744 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -8.179 8.194 0.596 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -7.005 7.347 1.632 1.00 0.00 H new ATOM 980 N LEU A 64 -7.876 4.626 -2.651 1.00 0.00 N ATOM 981 CA LEU A 64 -7.506 3.779 -3.771 1.00 0.00 C ATOM 982 C LEU A 64 -7.034 4.634 -4.939 1.00 0.00 C ATOM 983 O LEU A 64 -7.678 5.622 -5.279 1.00 0.00 O ATOM 984 CB LEU A 64 -8.705 2.929 -4.188 1.00 0.00 C ATOM 985 CG LEU A 64 -9.304 2.066 -3.076 1.00 0.00 C ATOM 986 CD1 LEU A 64 -10.533 1.323 -3.576 1.00 0.00 C ATOM 987 CD2 LEU A 64 -8.267 1.090 -2.553 1.00 0.00 C ATOM 0 H LEU A 64 -8.828 4.989 -2.694 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.690 3.121 -3.471 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -9.482 3.589 -4.574 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -8.402 2.279 -5.009 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.611 2.719 -2.259 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.944 0.715 -2.770 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.283 2.041 -3.907 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -10.255 0.679 -4.410 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.706 0.482 -1.762 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -7.933 0.444 -3.365 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -7.415 1.642 -2.156 1.00 0.00 H new ATOM 999 N THR A 65 -5.912 4.265 -5.543 1.00 0.00 N ATOM 1000 CA THR A 65 -5.377 5.014 -6.678 1.00 0.00 C ATOM 1001 C THR A 65 -5.056 4.088 -7.848 1.00 0.00 C ATOM 1002 O THR A 65 -4.468 3.019 -7.657 1.00 0.00 O ATOM 1003 CB THR A 65 -4.109 5.808 -6.291 1.00 0.00 C ATOM 1004 OG1 THR A 65 -3.173 4.960 -5.610 1.00 0.00 O ATOM 1005 CG2 THR A 65 -4.455 6.997 -5.408 1.00 0.00 C ATOM 0 H THR A 65 -5.355 3.456 -5.269 1.00 0.00 H new ATOM 0 HA THR A 65 -6.151 5.719 -6.981 1.00 0.00 H new ATOM 0 HB THR A 65 -3.656 6.177 -7.211 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.658 4.262 -5.123 1.00 0.00 H new ATOM 0 HG21 THR A 65 -3.544 7.537 -5.151 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.133 7.662 -5.943 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.937 6.645 -4.496 1.00 0.00 H new ATOM 1013 N ASP A 66 -5.451 4.498 -9.052 1.00 0.00 N ATOM 1014 CA ASP A 66 -5.185 3.722 -10.264 1.00 0.00 C ATOM 1015 C ASP A 66 -5.419 4.593 -11.498 1.00 0.00 C ATOM 1016 O ASP A 66 -5.886 5.729 -11.376 1.00 0.00 O ATOM 1017 CB ASP A 66 -6.078 2.470 -10.307 1.00 0.00 C ATOM 1018 CG ASP A 66 -5.698 1.501 -11.416 1.00 0.00 C ATOM 1019 OD1 ASP A 66 -4.658 0.822 -11.290 1.00 0.00 O ATOM 1020 OD2 ASP A 66 -6.430 1.420 -12.424 1.00 0.00 O ATOM 0 H ASP A 66 -5.959 5.367 -9.215 1.00 0.00 H new ATOM 0 HA ASP A 66 -4.145 3.397 -10.256 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.018 1.956 -9.348 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -7.116 2.776 -10.440 1.00 0.00 H new ATOM 1025 N ILE A 67 -5.096 4.078 -12.677 1.00 0.00 N ATOM 1026 CA ILE A 67 -5.280 4.825 -13.912 1.00 0.00 C ATOM 1027 C ILE A 67 -6.728 4.742 -14.384 1.00 0.00 C ATOM 1028 O ILE A 67 -7.132 3.768 -15.022 1.00 0.00 O ATOM 1029 CB ILE A 67 -4.342 4.324 -15.036 1.00 0.00 C ATOM 1030 CG1 ILE A 67 -2.873 4.495 -14.634 1.00 0.00 C ATOM 1031 CG2 ILE A 67 -4.623 5.062 -16.341 1.00 0.00 C ATOM 1032 CD1 ILE A 67 -2.447 5.939 -14.478 1.00 0.00 C ATOM 0 H ILE A 67 -4.705 3.144 -12.803 1.00 0.00 H new ATOM 0 HA ILE A 67 -5.028 5.863 -13.694 1.00 0.00 H new ATOM 0 HB ILE A 67 -4.536 3.263 -15.190 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.700 3.971 -13.694 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -2.243 4.019 -15.385 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -3.953 4.695 -17.118 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.656 4.889 -16.642 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.461 6.130 -16.197 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -1.396 5.979 -14.193 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -2.587 6.464 -15.423 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -3.051 6.415 -13.706 1.00 0.00 H new ATOM 1044 N LYS A 68 -7.498 5.770 -14.038 1.00 0.00 N ATOM 1045 CA LYS A 68 -8.902 5.895 -14.445 1.00 0.00 C ATOM 1046 C LYS A 68 -9.706 4.642 -14.082 1.00 0.00 C ATOM 1047 O LYS A 68 -10.155 3.902 -14.960 1.00 0.00 O ATOM 1048 CB LYS A 68 -9.013 6.174 -15.951 1.00 0.00 C ATOM 1049 CG LYS A 68 -8.071 7.265 -16.447 1.00 0.00 C ATOM 1050 CD LYS A 68 -8.233 8.565 -15.673 1.00 0.00 C ATOM 1051 CE LYS A 68 -7.211 9.597 -16.115 1.00 0.00 C ATOM 1052 NZ LYS A 68 -7.258 10.825 -15.281 1.00 0.00 N ATOM 0 H LYS A 68 -7.167 6.546 -13.464 1.00 0.00 H new ATOM 0 HA LYS A 68 -9.323 6.739 -13.899 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -8.807 5.254 -16.497 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.039 6.460 -16.183 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -7.041 6.919 -16.360 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -8.257 7.449 -17.505 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -9.239 8.958 -15.823 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -8.122 8.373 -14.606 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.213 9.163 -16.063 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -7.390 9.860 -17.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.510 11.480 -15.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -8.185 11.283 -15.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -7.111 10.573 -14.283 1.00 0.00 H new ATOM 1066 N PRO A 69 -9.885 4.389 -12.777 1.00 0.00 N ATOM 1067 CA PRO A 69 -10.597 3.207 -12.279 1.00 0.00 C ATOM 1068 C PRO A 69 -12.089 3.267 -12.577 1.00 0.00 C ATOM 1069 O PRO A 69 -12.694 4.342 -12.564 1.00 0.00 O ATOM 1070 CB PRO A 69 -10.354 3.246 -10.765 1.00 0.00 C ATOM 1071 CG PRO A 69 -9.251 4.228 -10.575 1.00 0.00 C ATOM 1072 CD PRO A 69 -9.408 5.224 -11.675 1.00 0.00 C ATOM 0 HA PRO A 69 -10.244 2.292 -12.754 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -11.252 3.553 -10.229 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -10.077 2.263 -10.385 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -9.317 4.708 -9.599 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -8.278 3.739 -10.624 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -10.122 6.007 -11.418 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -8.467 5.718 -11.915 1.00 0.00 H new ATOM 1122 N ILE A 74 -12.692 5.376 -6.672 1.00 0.00 N ATOM 1123 CA ILE A 74 -11.245 5.219 -6.707 1.00 0.00 C ATOM 1124 C ILE A 74 -10.600 6.425 -7.389 1.00 0.00 C ATOM 1125 O ILE A 74 -11.113 6.925 -8.392 1.00 0.00 O ATOM 1126 CB ILE A 74 -10.846 3.930 -7.453 1.00 0.00 C ATOM 1127 CG1 ILE A 74 -11.580 2.721 -6.867 1.00 0.00 C ATOM 1128 CG2 ILE A 74 -9.342 3.715 -7.386 1.00 0.00 C ATOM 1129 CD1 ILE A 74 -11.225 1.410 -7.537 1.00 0.00 C ATOM 0 HA ILE A 74 -10.890 5.150 -5.679 1.00 0.00 H new ATOM 0 HB ILE A 74 -11.134 4.039 -8.499 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -11.352 2.649 -5.804 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -12.655 2.883 -6.952 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -9.081 2.800 -7.918 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -8.833 4.561 -7.847 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.033 3.629 -6.344 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -11.783 0.599 -7.069 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -11.479 1.462 -8.596 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -10.156 1.224 -7.429 1.00 0.00 H new ATOM 1141 N VAL A 75 -9.492 6.902 -6.831 1.00 0.00 N ATOM 1142 CA VAL A 75 -8.793 8.058 -7.374 1.00 0.00 C ATOM 1143 C VAL A 75 -8.248 7.750 -8.763 1.00 0.00 C ATOM 1144 O VAL A 75 -7.577 6.738 -8.972 1.00 0.00 O ATOM 1145 CB VAL A 75 -7.641 8.502 -6.449 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -6.920 9.711 -7.022 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -8.164 8.806 -5.051 1.00 0.00 C ATOM 0 H VAL A 75 -9.058 6.502 -5.999 1.00 0.00 H new ATOM 0 HA VAL A 75 -9.512 8.874 -7.444 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.927 7.681 -6.381 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.112 10.005 -6.351 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.507 9.459 -7.999 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.623 10.538 -7.127 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.337 9.117 -4.413 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.902 9.606 -5.105 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -8.628 7.912 -4.634 1.00 0.00 H new ATOM 1157 N ARG A 76 -8.535 8.640 -9.698 1.00 0.00 N ATOM 1158 CA ARG A 76 -8.204 8.435 -11.100 1.00 0.00 C ATOM 1159 C ARG A 76 -6.996 9.274 -11.495 1.00 0.00 C ATOM 1160 O ARG A 76 -6.846 9.649 -12.660 1.00 0.00 O ATOM 1161 CB ARG A 76 -9.408 8.817 -11.963 1.00 0.00 C ATOM 1162 CG ARG A 76 -9.943 10.207 -11.655 1.00 0.00 C ATOM 1163 CD ARG A 76 -11.105 10.582 -12.555 1.00 0.00 C ATOM 1164 NE ARG A 76 -12.210 9.631 -12.461 1.00 0.00 N ATOM 1165 CZ ARG A 76 -13.461 9.967 -12.154 1.00 0.00 C ATOM 1166 NH1 ARG A 76 -13.755 11.214 -11.808 1.00 0.00 N ATOM 1167 NH2 ARG A 76 -14.411 9.042 -12.169 1.00 0.00 N ATOM 0 H ARG A 76 -9.004 9.525 -9.508 1.00 0.00 H new ATOM 0 HA ARG A 76 -7.957 7.385 -11.256 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -9.125 8.768 -13.014 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -10.203 8.086 -11.812 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -10.263 10.250 -10.614 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -9.143 10.938 -11.773 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -11.462 11.577 -12.288 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -10.760 10.633 -13.588 1.00 0.00 H new ATOM 0 HE ARG A 76 -12.010 8.647 -12.642 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -13.021 11.921 -11.776 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -14.715 11.465 -11.574 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -14.181 8.079 -12.415 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -15.371 9.293 -11.935 1.00 0.00 H new ATOM 1181 N ASP A 77 -6.128 9.531 -10.525 1.00 0.00 N ATOM 1182 CA ASP A 77 -5.005 10.445 -10.711 1.00 0.00 C ATOM 1183 C ASP A 77 -3.959 9.853 -11.653 1.00 0.00 C ATOM 1184 O ASP A 77 -3.980 10.116 -12.858 1.00 0.00 O ATOM 1185 CB ASP A 77 -4.375 10.781 -9.359 1.00 0.00 C ATOM 1186 CG ASP A 77 -3.474 11.996 -9.424 1.00 0.00 C ATOM 1187 OD1 ASP A 77 -3.983 13.121 -9.232 1.00 0.00 O ATOM 1188 OD2 ASP A 77 -2.260 11.836 -9.656 1.00 0.00 O ATOM 0 H ASP A 77 -6.180 9.117 -9.594 1.00 0.00 H new ATOM 0 HA ASP A 77 -5.383 11.360 -11.166 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.164 10.957 -8.628 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -3.800 9.925 -9.007 1.00 0.00 H new ATOM 1193 N ASP A 78 -3.063 9.044 -11.108 1.00 0.00 N ATOM 1194 CA ASP A 78 -2.010 8.411 -11.894 1.00 0.00 C ATOM 1195 C ASP A 78 -1.421 7.248 -11.096 1.00 0.00 C ATOM 1196 O ASP A 78 -1.971 6.867 -10.064 1.00 0.00 O ATOM 1197 CB ASP A 78 -0.922 9.438 -12.250 1.00 0.00 C ATOM 1198 CG ASP A 78 -0.068 9.015 -13.433 1.00 0.00 C ATOM 1199 OD1 ASP A 78 0.927 8.288 -13.226 1.00 0.00 O ATOM 1200 OD2 ASP A 78 -0.382 9.408 -14.573 1.00 0.00 O ATOM 0 H ASP A 78 -3.043 8.808 -10.116 1.00 0.00 H new ATOM 0 HA ASP A 78 -2.427 8.028 -12.826 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -1.393 10.395 -12.473 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -0.280 9.594 -11.383 1.00 0.00 H new ATOM 1205 N ILE A 79 -0.315 6.694 -11.567 1.00 0.00 N ATOM 1206 CA ILE A 79 0.324 5.568 -10.901 1.00 0.00 C ATOM 1207 C ILE A 79 1.846 5.665 -11.013 1.00 0.00 C ATOM 1208 O ILE A 79 2.577 5.195 -10.142 1.00 0.00 O ATOM 1209 CB ILE A 79 -0.163 4.223 -11.478 1.00 0.00 C ATOM 1210 CG1 ILE A 79 0.363 3.073 -10.624 1.00 0.00 C ATOM 1211 CG2 ILE A 79 0.277 4.061 -12.926 1.00 0.00 C ATOM 1212 CD1 ILE A 79 -0.459 1.821 -10.746 1.00 0.00 C ATOM 0 H ILE A 79 0.162 7.007 -12.413 1.00 0.00 H new ATOM 0 HA ILE A 79 0.044 5.609 -9.848 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.253 4.209 -11.458 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.391 2.855 -10.913 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.385 3.385 -9.580 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -0.079 3.105 -13.310 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -0.140 4.870 -13.526 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.365 4.092 -12.981 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -0.032 1.042 -10.114 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.482 2.025 -10.429 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -0.460 1.486 -11.783 1.00 0.00 H new ATOM 1224 N THR A 80 2.321 6.304 -12.075 1.00 0.00 N ATOM 1225 CA THR A 80 3.746 6.426 -12.315 1.00 0.00 C ATOM 1226 C THR A 80 4.221 7.835 -11.951 1.00 0.00 C ATOM 1227 O THR A 80 5.393 8.054 -11.633 1.00 0.00 O ATOM 1228 CB THR A 80 4.093 6.077 -13.787 1.00 0.00 C ATOM 1229 OG1 THR A 80 5.513 6.038 -13.979 1.00 0.00 O ATOM 1230 CG2 THR A 80 3.478 7.078 -14.754 1.00 0.00 C ATOM 0 H THR A 80 1.735 6.746 -12.783 1.00 0.00 H new ATOM 0 HA THR A 80 4.270 5.712 -11.679 1.00 0.00 H new ATOM 0 HB THR A 80 3.675 5.092 -13.993 1.00 0.00 H new ATOM 0 HG1 THR A 80 5.734 5.354 -14.645 1.00 0.00 H new ATOM 0 HG21 THR A 80 3.740 6.805 -15.776 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.394 7.072 -14.643 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.859 8.076 -14.536 1.00 0.00 H new ATOM 1238 N SER A 81 3.298 8.789 -11.990 1.00 0.00 N ATOM 1239 CA SER A 81 3.558 10.148 -11.525 1.00 0.00 C ATOM 1240 C SER A 81 2.271 10.782 -10.995 1.00 0.00 C ATOM 1241 O SER A 81 1.646 11.608 -11.665 1.00 0.00 O ATOM 1242 CB SER A 81 4.148 11.000 -12.653 1.00 0.00 C ATOM 1243 OG SER A 81 5.394 10.478 -13.092 1.00 0.00 O ATOM 0 H SER A 81 2.352 8.644 -12.343 1.00 0.00 H new ATOM 0 HA SER A 81 4.285 10.103 -10.714 1.00 0.00 H new ATOM 0 HB2 SER A 81 3.450 11.035 -13.490 1.00 0.00 H new ATOM 0 HB3 SER A 81 4.282 12.025 -12.307 1.00 0.00 H new ATOM 0 HG SER A 81 5.622 9.686 -12.561 1.00 0.00 H new ATOM 1249 N PRO A 82 1.837 10.374 -9.793 1.00 0.00 N ATOM 1250 CA PRO A 82 0.599 10.842 -9.191 1.00 0.00 C ATOM 1251 C PRO A 82 0.789 12.097 -8.341 1.00 0.00 C ATOM 1252 O PRO A 82 1.914 12.566 -8.142 1.00 0.00 O ATOM 1253 CB PRO A 82 0.170 9.657 -8.311 1.00 0.00 C ATOM 1254 CG PRO A 82 1.338 8.709 -8.273 1.00 0.00 C ATOM 1255 CD PRO A 82 2.503 9.412 -8.914 1.00 0.00 C ATOM 0 HA PRO A 82 -0.135 11.128 -9.944 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -0.090 9.993 -7.307 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.713 9.168 -8.722 1.00 0.00 H new ATOM 0 HG2 PRO A 82 1.574 8.431 -7.246 1.00 0.00 H new ATOM 0 HG3 PRO A 82 1.103 7.788 -8.807 1.00 0.00 H new ATOM 0 HD2 PRO A 82 3.137 9.905 -8.177 1.00 0.00 H new ATOM 0 HD3 PRO A 82 3.138 8.723 -9.471 1.00 0.00 H new ATOM 1263 N ARG A 83 -0.319 12.646 -7.864 1.00 0.00 N ATOM 1264 CA ARG A 83 -0.284 13.802 -6.981 1.00 0.00 C ATOM 1265 C ARG A 83 0.073 13.396 -5.559 1.00 0.00 C ATOM 1266 O ARG A 83 -0.656 12.643 -4.909 1.00 0.00 O ATOM 1267 CB ARG A 83 -1.622 14.538 -7.004 1.00 0.00 C ATOM 1268 CG ARG A 83 -1.822 15.372 -8.253 1.00 0.00 C ATOM 1269 CD ARG A 83 -3.194 16.025 -8.283 1.00 0.00 C ATOM 1270 NE ARG A 83 -3.361 16.896 -9.447 1.00 0.00 N ATOM 1271 CZ ARG A 83 -3.703 16.464 -10.660 1.00 0.00 C ATOM 1272 NH1 ARG A 83 -3.931 15.174 -10.874 1.00 0.00 N ATOM 1273 NH2 ARG A 83 -3.831 17.331 -11.656 1.00 0.00 N ATOM 0 H ARG A 83 -1.258 12.307 -8.075 1.00 0.00 H new ATOM 0 HA ARG A 83 0.491 14.477 -7.345 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.431 13.811 -6.927 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -1.689 15.184 -6.129 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.052 16.142 -8.303 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -1.700 14.742 -9.134 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.963 15.253 -8.295 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.339 16.605 -7.372 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.206 17.896 -9.322 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.845 14.507 -10.107 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.193 14.850 -11.805 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -3.668 18.324 -11.492 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -4.093 17.004 -12.586 1.00 0.00 H new ATOM 1287 N MET A 84 1.197 13.919 -5.085 1.00 0.00 N ATOM 1288 CA MET A 84 1.714 13.609 -3.754 1.00 0.00 C ATOM 1289 C MET A 84 0.744 14.039 -2.663 1.00 0.00 C ATOM 1290 O MET A 84 0.770 13.501 -1.557 1.00 0.00 O ATOM 1291 CB MET A 84 3.065 14.294 -3.537 1.00 0.00 C ATOM 1292 CG MET A 84 4.175 13.768 -4.433 1.00 0.00 C ATOM 1293 SD MET A 84 4.527 12.021 -4.150 1.00 0.00 S ATOM 1294 CE MET A 84 4.959 12.036 -2.412 1.00 0.00 C ATOM 0 H MET A 84 1.778 14.571 -5.612 1.00 0.00 H new ATOM 0 HA MET A 84 1.838 12.528 -3.694 1.00 0.00 H new ATOM 0 HB2 MET A 84 2.950 15.364 -3.708 1.00 0.00 H new ATOM 0 HB3 MET A 84 3.362 14.168 -2.496 1.00 0.00 H new ATOM 0 HG2 MET A 84 3.895 13.914 -5.476 1.00 0.00 H new ATOM 0 HG3 MET A 84 5.081 14.350 -4.262 1.00 0.00 H new ATOM 0 HE1 MET A 84 5.788 11.350 -2.237 1.00 0.00 H new ATOM 0 HE2 MET A 84 5.254 13.044 -2.119 1.00 0.00 H new ATOM 0 HE3 MET A 84 4.098 11.724 -1.820 1.00 0.00 H new ATOM 1304 N GLU A 85 -0.111 15.007 -2.979 1.00 0.00 N ATOM 1305 CA GLU A 85 -1.102 15.512 -2.028 1.00 0.00 C ATOM 1306 C GLU A 85 -2.003 14.389 -1.511 1.00 0.00 C ATOM 1307 O GLU A 85 -2.486 14.438 -0.382 1.00 0.00 O ATOM 1308 CB GLU A 85 -1.960 16.593 -2.687 1.00 0.00 C ATOM 1309 CG GLU A 85 -2.668 16.115 -3.944 1.00 0.00 C ATOM 1310 CD GLU A 85 -3.696 17.101 -4.450 1.00 0.00 C ATOM 1311 OE1 GLU A 85 -4.840 17.078 -3.952 1.00 0.00 O ATOM 1312 OE2 GLU A 85 -3.370 17.896 -5.356 1.00 0.00 O ATOM 0 H GLU A 85 -0.139 15.461 -3.892 1.00 0.00 H new ATOM 0 HA GLU A 85 -0.563 15.937 -1.181 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -2.703 16.944 -1.971 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -1.329 17.446 -2.936 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.929 15.935 -4.725 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -3.156 15.162 -3.740 1.00 0.00 H new ATOM 1319 N ILE A 86 -2.204 13.373 -2.339 1.00 0.00 N ATOM 1320 CA ILE A 86 -3.103 12.275 -2.010 1.00 0.00 C ATOM 1321 C ILE A 86 -2.429 11.286 -1.061 1.00 0.00 C ATOM 1322 O ILE A 86 -3.092 10.579 -0.299 1.00 0.00 O ATOM 1323 CB ILE A 86 -3.550 11.544 -3.295 1.00 0.00 C ATOM 1324 CG1 ILE A 86 -4.119 12.551 -4.299 1.00 0.00 C ATOM 1325 CG2 ILE A 86 -4.584 10.473 -2.975 1.00 0.00 C ATOM 1326 CD1 ILE A 86 -4.433 11.952 -5.651 1.00 0.00 C ATOM 0 H ILE A 86 -1.753 13.286 -3.250 1.00 0.00 H new ATOM 0 HA ILE A 86 -3.978 12.693 -1.513 1.00 0.00 H new ATOM 0 HB ILE A 86 -2.681 11.056 -3.736 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -5.028 12.988 -3.886 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.405 13.364 -4.429 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.885 9.971 -3.895 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.153 9.745 -2.288 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.456 10.936 -2.513 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -4.832 12.725 -6.308 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.523 11.540 -6.087 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.171 11.159 -5.535 1.00 0.00 H new ATOM 1338 N TYR A 87 -1.106 11.257 -1.099 1.00 0.00 N ATOM 1339 CA TYR A 87 -0.338 10.320 -0.293 1.00 0.00 C ATOM 1340 C TYR A 87 0.098 10.953 1.021 1.00 0.00 C ATOM 1341 O TYR A 87 0.299 10.256 2.014 1.00 0.00 O ATOM 1342 CB TYR A 87 0.896 9.841 -1.062 1.00 0.00 C ATOM 1343 CG TYR A 87 0.570 9.128 -2.355 1.00 0.00 C ATOM 1344 CD1 TYR A 87 0.342 7.758 -2.373 1.00 0.00 C ATOM 1345 CD2 TYR A 87 0.489 9.824 -3.555 1.00 0.00 C ATOM 1346 CE1 TYR A 87 0.040 7.102 -3.549 1.00 0.00 C ATOM 1347 CE2 TYR A 87 0.185 9.173 -4.735 1.00 0.00 C ATOM 1348 CZ TYR A 87 -0.037 7.810 -4.727 1.00 0.00 C ATOM 1349 OH TYR A 87 -0.344 7.155 -5.898 1.00 0.00 O ATOM 0 H TYR A 87 -0.540 11.874 -1.682 1.00 0.00 H new ATOM 0 HA TYR A 87 -0.982 9.468 -0.073 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.532 10.699 -1.281 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.473 9.171 -0.424 1.00 0.00 H new ATOM 0 HD1 TYR A 87 0.402 7.197 -1.452 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.666 10.889 -3.565 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -0.135 6.036 -3.545 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.121 9.728 -5.660 1.00 0.00 H new ATOM 0 HH TYR A 87 -0.817 7.766 -6.500 1.00 0.00 H new ATOM 1359 N ARG A 88 0.255 12.271 1.024 1.00 0.00 N ATOM 1360 CA ARG A 88 0.741 12.966 2.208 1.00 0.00 C ATOM 1361 C ARG A 88 -0.248 12.869 3.353 1.00 0.00 C ATOM 1362 O ARG A 88 -1.445 13.101 3.190 1.00 0.00 O ATOM 1363 CB ARG A 88 1.057 14.427 1.908 1.00 0.00 C ATOM 1364 CG ARG A 88 2.252 14.595 0.995 1.00 0.00 C ATOM 1365 CD ARG A 88 2.639 16.056 0.821 1.00 0.00 C ATOM 1366 NE ARG A 88 3.333 16.571 2.001 1.00 0.00 N ATOM 1367 CZ ARG A 88 3.662 17.850 2.187 1.00 0.00 C ATOM 1368 NH1 ARG A 88 3.330 18.767 1.286 1.00 0.00 N ATOM 1369 NH2 ARG A 88 4.323 18.206 3.283 1.00 0.00 N ATOM 0 H ARG A 88 0.055 12.875 0.227 1.00 0.00 H new ATOM 0 HA ARG A 88 1.664 12.471 2.510 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.186 14.895 1.449 1.00 0.00 H new ATOM 0 HB3 ARG A 88 1.245 14.953 2.844 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.099 14.042 1.402 1.00 0.00 H new ATOM 0 HG3 ARG A 88 2.027 14.162 0.021 1.00 0.00 H new ATOM 0 HD2 ARG A 88 3.280 16.162 -0.054 1.00 0.00 H new ATOM 0 HD3 ARG A 88 1.745 16.651 0.635 1.00 0.00 H new ATOM 0 HE ARG A 88 3.583 15.906 2.733 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.820 18.495 0.445 1.00 0.00 H new ATOM 0 HH12 ARG A 88 3.585 19.743 1.434 1.00 0.00 H new ATOM 0 HH21 ARG A 88 4.576 17.503 3.977 1.00 0.00 H new ATOM 0 HH22 ARG A 88 4.577 19.183 3.431 1.00 0.00 H new ATOM 1383 N GLY A 89 0.276 12.506 4.507 1.00 0.00 N ATOM 1384 CA GLY A 89 -0.548 12.369 5.690 1.00 0.00 C ATOM 1385 C GLY A 89 -1.046 10.950 5.885 1.00 0.00 C ATOM 1386 O GLY A 89 -1.679 10.644 6.898 1.00 0.00 O ATOM 0 H GLY A 89 1.265 12.301 4.650 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.025 12.674 6.566 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.401 13.044 5.616 1.00 0.00 H new ATOM 1390 N ALA A 90 -0.770 10.085 4.913 1.00 0.00 N ATOM 1391 CA ALA A 90 -1.183 8.689 4.987 1.00 0.00 C ATOM 1392 C ALA A 90 -0.325 7.928 5.989 1.00 0.00 C ATOM 1393 O ALA A 90 0.820 8.291 6.242 1.00 0.00 O ATOM 1394 CB ALA A 90 -1.107 8.028 3.617 1.00 0.00 C ATOM 0 H ALA A 90 -0.261 10.328 4.063 1.00 0.00 H new ATOM 0 HA ALA A 90 -2.219 8.661 5.325 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -1.420 6.987 3.697 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -1.765 8.552 2.923 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.082 8.071 3.248 1.00 0.00 H new ATOM 1400 N ALA A 91 -0.888 6.872 6.554 1.00 0.00 N ATOM 1401 CA ALA A 91 -0.184 6.066 7.536 1.00 0.00 C ATOM 1402 C ALA A 91 0.507 4.883 6.870 1.00 0.00 C ATOM 1403 O ALA A 91 1.450 4.308 7.418 1.00 0.00 O ATOM 1404 CB ALA A 91 -1.147 5.578 8.610 1.00 0.00 C ATOM 0 H ALA A 91 -1.835 6.553 6.348 1.00 0.00 H new ATOM 0 HA ALA A 91 0.578 6.689 8.005 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -0.605 4.975 9.339 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.598 6.435 9.111 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.929 4.974 8.150 1.00 0.00 H new ATOM 1410 N LEU A 92 0.042 4.525 5.678 1.00 0.00 N ATOM 1411 CA LEU A 92 0.577 3.370 4.980 1.00 0.00 C ATOM 1412 C LEU A 92 0.242 3.438 3.490 1.00 0.00 C ATOM 1413 O LEU A 92 -0.829 3.907 3.103 1.00 0.00 O ATOM 1414 CB LEU A 92 0.014 2.090 5.613 1.00 0.00 C ATOM 1415 CG LEU A 92 0.861 0.830 5.428 1.00 0.00 C ATOM 1416 CD1 LEU A 92 0.563 -0.163 6.542 1.00 0.00 C ATOM 1417 CD2 LEU A 92 0.599 0.182 4.076 1.00 0.00 C ATOM 0 H LEU A 92 -0.700 5.017 5.180 1.00 0.00 H new ATOM 0 HA LEU A 92 1.663 3.363 5.073 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.118 2.263 6.681 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.975 1.905 5.195 1.00 0.00 H new ATOM 0 HG LEU A 92 1.911 1.120 5.468 1.00 0.00 H new ATOM 0 HD11 LEU A 92 1.170 -1.058 6.404 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.798 0.290 7.505 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.493 -0.433 6.516 1.00 0.00 H new ATOM 0 HD21 LEU A 92 1.216 -0.711 3.975 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.453 -0.093 4.002 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.846 0.886 3.281 1.00 0.00 H new ATOM 1429 N ILE A 93 1.183 2.996 2.665 1.00 0.00 N ATOM 1430 CA ILE A 93 1.003 2.935 1.221 1.00 0.00 C ATOM 1431 C ILE A 93 1.452 1.565 0.717 1.00 0.00 C ATOM 1432 O ILE A 93 2.566 1.132 1.009 1.00 0.00 O ATOM 1433 CB ILE A 93 1.826 4.030 0.499 1.00 0.00 C ATOM 1434 CG1 ILE A 93 1.474 5.420 1.042 1.00 0.00 C ATOM 1435 CG2 ILE A 93 1.584 3.970 -1.006 1.00 0.00 C ATOM 1436 CD1 ILE A 93 2.346 6.527 0.489 1.00 0.00 C ATOM 0 H ILE A 93 2.096 2.669 2.981 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.052 3.100 1.004 1.00 0.00 H new ATOM 0 HB ILE A 93 2.883 3.846 0.690 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.432 5.639 0.808 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.561 5.409 2.128 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.169 4.746 -1.500 1.00 0.00 H new ATOM 0 HG22 ILE A 93 1.884 2.993 -1.384 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.525 4.129 -1.211 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.039 7.481 0.918 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.387 6.332 0.746 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.241 6.566 -0.595 1.00 0.00 H new ATOM 1448 N TYR A 94 0.599 0.871 -0.018 1.00 0.00 N ATOM 1449 CA TYR A 94 0.948 -0.461 -0.498 1.00 0.00 C ATOM 1450 C TYR A 94 0.528 -0.663 -1.948 1.00 0.00 C ATOM 1451 O TYR A 94 -0.305 0.074 -2.475 1.00 0.00 O ATOM 1452 CB TYR A 94 0.345 -1.545 0.406 1.00 0.00 C ATOM 1453 CG TYR A 94 -1.166 -1.564 0.474 1.00 0.00 C ATOM 1454 CD1 TYR A 94 -1.865 -0.600 1.187 1.00 0.00 C ATOM 1455 CD2 TYR A 94 -1.892 -2.563 -0.159 1.00 0.00 C ATOM 1456 CE1 TYR A 94 -3.242 -0.631 1.264 1.00 0.00 C ATOM 1457 CE2 TYR A 94 -3.269 -2.602 -0.083 1.00 0.00 C ATOM 1458 CZ TYR A 94 -3.939 -1.634 0.630 1.00 0.00 C ATOM 1459 OH TYR A 94 -5.309 -1.666 0.712 1.00 0.00 O ATOM 0 H TYR A 94 -0.327 1.199 -0.293 1.00 0.00 H new ATOM 0 HA TYR A 94 2.034 -0.550 -0.457 1.00 0.00 H new ATOM 0 HB2 TYR A 94 0.689 -2.519 0.057 1.00 0.00 H new ATOM 0 HB3 TYR A 94 0.736 -1.412 1.415 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -1.322 0.187 1.690 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -1.370 -3.323 -0.721 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -3.771 0.129 1.820 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -3.818 -3.388 -0.580 1.00 0.00 H new ATOM 0 HH TYR A 94 -5.649 -2.436 0.210 1.00 0.00 H new ATOM 1469 N SER A 95 1.131 -1.654 -2.594 1.00 0.00 N ATOM 1470 CA SER A 95 0.851 -1.943 -3.994 1.00 0.00 C ATOM 1471 C SER A 95 0.950 -3.442 -4.268 1.00 0.00 C ATOM 1472 O SER A 95 1.834 -4.124 -3.741 1.00 0.00 O ATOM 1473 CB SER A 95 1.835 -1.188 -4.891 1.00 0.00 C ATOM 1474 OG SER A 95 1.867 0.188 -4.565 1.00 0.00 O ATOM 0 H SER A 95 1.820 -2.273 -2.167 1.00 0.00 H new ATOM 0 HA SER A 95 -0.165 -1.616 -4.215 1.00 0.00 H new ATOM 0 HB2 SER A 95 2.832 -1.614 -4.782 1.00 0.00 H new ATOM 0 HB3 SER A 95 1.548 -1.311 -5.935 1.00 0.00 H new ATOM 0 HG SER A 95 2.377 0.674 -5.246 1.00 0.00 H new ATOM 1480 N ILE A 96 0.044 -3.953 -5.091 1.00 0.00 N ATOM 1481 CA ILE A 96 0.052 -5.362 -5.450 1.00 0.00 C ATOM 1482 C ILE A 96 0.709 -5.550 -6.816 1.00 0.00 C ATOM 1483 O ILE A 96 0.069 -5.362 -7.852 1.00 0.00 O ATOM 1484 CB ILE A 96 -1.373 -5.987 -5.462 1.00 0.00 C ATOM 1485 CG1 ILE A 96 -2.011 -5.965 -4.062 1.00 0.00 C ATOM 1486 CG2 ILE A 96 -1.329 -7.418 -5.986 1.00 0.00 C ATOM 1487 CD1 ILE A 96 -2.525 -4.607 -3.628 1.00 0.00 C ATOM 0 H ILE A 96 -0.705 -3.411 -5.522 1.00 0.00 H new ATOM 0 HA ILE A 96 0.627 -5.882 -4.683 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.988 -5.381 -6.128 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -2.837 -6.676 -4.042 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -1.275 -6.310 -3.336 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.335 -7.837 -5.986 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -0.934 -7.421 -7.002 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -0.686 -8.021 -5.345 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.958 -4.684 -2.631 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.701 -3.894 -3.612 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -3.287 -4.265 -4.329 1.00 0.00 H new ATOM 1499 N ARG A 97 1.996 -5.896 -6.789 1.00 0.00 N ATOM 1500 CA ARG A 97 2.793 -6.129 -8.000 1.00 0.00 C ATOM 1501 C ARG A 97 2.729 -4.938 -8.962 1.00 0.00 C ATOM 1502 O ARG A 97 2.013 -4.972 -9.963 1.00 0.00 O ATOM 1503 CB ARG A 97 2.347 -7.405 -8.720 1.00 0.00 C ATOM 1504 CG ARG A 97 2.419 -8.657 -7.863 1.00 0.00 C ATOM 1505 CD ARG A 97 2.052 -9.897 -8.664 1.00 0.00 C ATOM 1506 NE ARG A 97 0.717 -9.794 -9.254 1.00 0.00 N ATOM 1507 CZ ARG A 97 0.488 -9.673 -10.567 1.00 0.00 C ATOM 1508 NH1 ARG A 97 1.503 -9.622 -11.422 1.00 0.00 N ATOM 1509 NH2 ARG A 97 -0.757 -9.605 -11.024 1.00 0.00 N ATOM 0 H ARG A 97 2.520 -6.024 -5.924 1.00 0.00 H new ATOM 0 HA ARG A 97 3.827 -6.250 -7.677 1.00 0.00 H new ATOM 0 HB2 ARG A 97 1.322 -7.274 -9.068 1.00 0.00 H new ATOM 0 HB3 ARG A 97 2.968 -7.547 -9.604 1.00 0.00 H new ATOM 0 HG2 ARG A 97 3.426 -8.767 -7.460 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.744 -8.558 -7.013 1.00 0.00 H new ATOM 0 HD2 ARG A 97 2.787 -10.048 -9.455 1.00 0.00 H new ATOM 0 HD3 ARG A 97 2.095 -10.773 -8.016 1.00 0.00 H new ATOM 0 HE ARG A 97 -0.087 -9.816 -8.627 1.00 0.00 H new ATOM 0 HH11 ARG A 97 2.462 -9.675 -11.079 1.00 0.00 H new ATOM 0 HH12 ARG A 97 1.323 -9.530 -12.422 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -1.542 -9.645 -10.374 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -0.928 -9.513 -12.025 1.00 0.00 H new ATOM 1523 N PRO A 98 3.472 -3.865 -8.660 1.00 0.00 N ATOM 1524 CA PRO A 98 3.505 -2.668 -9.494 1.00 0.00 C ATOM 1525 C PRO A 98 4.575 -2.747 -10.587 1.00 0.00 C ATOM 1526 O PRO A 98 5.519 -3.535 -10.484 1.00 0.00 O ATOM 1527 CB PRO A 98 3.848 -1.583 -8.479 1.00 0.00 C ATOM 1528 CG PRO A 98 4.723 -2.264 -7.475 1.00 0.00 C ATOM 1529 CD PRO A 98 4.339 -3.724 -7.478 1.00 0.00 C ATOM 0 HA PRO A 98 2.574 -2.502 -10.035 1.00 0.00 H new ATOM 0 HB2 PRO A 98 4.364 -0.748 -8.952 1.00 0.00 H new ATOM 0 HB3 PRO A 98 2.950 -1.179 -8.012 1.00 0.00 H new ATOM 0 HG2 PRO A 98 5.775 -2.141 -7.733 1.00 0.00 H new ATOM 0 HG3 PRO A 98 4.585 -1.830 -6.485 1.00 0.00 H new ATOM 0 HD2 PRO A 98 5.216 -4.367 -7.548 1.00 0.00 H new ATOM 0 HD3 PRO A 98 3.814 -4.000 -6.563 1.00 0.00 H new ATOM 1537 N PRO A 99 4.434 -1.936 -11.654 1.00 0.00 N ATOM 1538 CA PRO A 99 5.431 -1.850 -12.728 1.00 0.00 C ATOM 1539 C PRO A 99 6.829 -1.547 -12.192 1.00 0.00 C ATOM 1540 O PRO A 99 6.981 -0.827 -11.204 1.00 0.00 O ATOM 1541 CB PRO A 99 4.932 -0.691 -13.593 1.00 0.00 C ATOM 1542 CG PRO A 99 3.470 -0.627 -13.335 1.00 0.00 C ATOM 1543 CD PRO A 99 3.282 -1.052 -11.905 1.00 0.00 C ATOM 0 HA PRO A 99 5.526 -2.791 -13.270 1.00 0.00 H new ATOM 0 HB2 PRO A 99 5.423 0.244 -13.323 1.00 0.00 H new ATOM 0 HB3 PRO A 99 5.140 -0.867 -14.648 1.00 0.00 H new ATOM 0 HG2 PRO A 99 3.089 0.382 -13.495 1.00 0.00 H new ATOM 0 HG3 PRO A 99 2.925 -1.285 -14.012 1.00 0.00 H new ATOM 0 HD2 PRO A 99 3.278 -0.197 -11.229 1.00 0.00 H new ATOM 0 HD3 PRO A 99 2.336 -1.575 -11.763 1.00 0.00 H new ATOM 1551 N ALA A 100 7.844 -2.068 -12.867 1.00 0.00 N ATOM 1552 CA ALA A 100 9.221 -1.982 -12.386 1.00 0.00 C ATOM 1553 C ALA A 100 9.732 -0.544 -12.391 1.00 0.00 C ATOM 1554 O ALA A 100 10.691 -0.214 -11.694 1.00 0.00 O ATOM 1555 CB ALA A 100 10.126 -2.868 -13.228 1.00 0.00 C ATOM 0 H ALA A 100 7.741 -2.558 -13.755 1.00 0.00 H new ATOM 0 HA ALA A 100 9.236 -2.332 -11.354 1.00 0.00 H new ATOM 0 HB1 ALA A 100 11.150 -2.796 -12.861 1.00 0.00 H new ATOM 0 HB2 ALA A 100 9.788 -3.902 -13.160 1.00 0.00 H new ATOM 0 HB3 ALA A 100 10.090 -2.542 -14.267 1.00 0.00 H new ATOM 1561 N GLU A 101 9.077 0.309 -13.166 1.00 0.00 N ATOM 1562 CA GLU A 101 9.497 1.698 -13.306 1.00 0.00 C ATOM 1563 C GLU A 101 9.178 2.519 -12.055 1.00 0.00 C ATOM 1564 O GLU A 101 9.806 3.548 -11.807 1.00 0.00 O ATOM 1565 CB GLU A 101 8.830 2.331 -14.532 1.00 0.00 C ATOM 1566 CG GLU A 101 7.310 2.278 -14.503 1.00 0.00 C ATOM 1567 CD GLU A 101 6.686 2.910 -15.728 1.00 0.00 C ATOM 1568 OE1 GLU A 101 6.905 2.388 -16.841 1.00 0.00 O ATOM 1569 OE2 GLU A 101 5.965 3.921 -15.584 1.00 0.00 O ATOM 0 H GLU A 101 8.250 0.063 -13.710 1.00 0.00 H new ATOM 0 HA GLU A 101 10.579 1.702 -13.438 1.00 0.00 H new ATOM 0 HB2 GLU A 101 9.146 3.371 -14.609 1.00 0.00 H new ATOM 0 HB3 GLU A 101 9.184 1.823 -15.429 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.987 1.240 -14.429 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.949 2.789 -13.610 1.00 0.00 H new ATOM 1576 N ILE A 102 8.217 2.064 -11.259 1.00 0.00 N ATOM 1577 CA ILE A 102 7.773 2.845 -10.109 1.00 0.00 C ATOM 1578 C ILE A 102 8.199 2.227 -8.786 1.00 0.00 C ATOM 1579 O ILE A 102 7.826 2.719 -7.723 1.00 0.00 O ATOM 1580 CB ILE A 102 6.250 3.038 -10.089 1.00 0.00 C ATOM 1581 CG1 ILE A 102 5.525 1.692 -10.075 1.00 0.00 C ATOM 1582 CG2 ILE A 102 5.808 3.880 -11.276 1.00 0.00 C ATOM 1583 CD1 ILE A 102 4.028 1.815 -9.899 1.00 0.00 C ATOM 0 H ILE A 102 7.737 1.173 -11.385 1.00 0.00 H new ATOM 0 HA ILE A 102 8.258 3.815 -10.222 1.00 0.00 H new ATOM 0 HB ILE A 102 5.985 3.566 -9.173 1.00 0.00 H new ATOM 0 HG12 ILE A 102 5.731 1.167 -11.008 1.00 0.00 H new ATOM 0 HG13 ILE A 102 5.929 1.079 -9.269 1.00 0.00 H new ATOM 0 HG21 ILE A 102 4.726 4.008 -11.248 1.00 0.00 H new ATOM 0 HG22 ILE A 102 6.290 4.856 -11.229 1.00 0.00 H new ATOM 0 HG23 ILE A 102 6.090 3.380 -12.202 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.579 0.822 -9.898 1.00 0.00 H new ATOM 0 HD12 ILE A 102 3.812 2.311 -8.953 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.612 2.401 -10.719 1.00 0.00 H new ATOM 1595 N HIS A 103 8.985 1.167 -8.852 1.00 0.00 N ATOM 1596 CA HIS A 103 9.477 0.507 -7.642 1.00 0.00 C ATOM 1597 C HIS A 103 10.266 1.488 -6.777 1.00 0.00 C ATOM 1598 O HIS A 103 10.080 1.553 -5.559 1.00 0.00 O ATOM 1599 CB HIS A 103 10.349 -0.705 -7.991 1.00 0.00 C ATOM 1600 CG HIS A 103 9.573 -1.883 -8.500 1.00 0.00 C ATOM 1601 ND1 HIS A 103 10.199 -3.041 -8.890 1.00 0.00 N ATOM 1602 CD2 HIS A 103 8.236 -2.029 -8.656 1.00 0.00 C ATOM 1603 CE1 HIS A 103 9.233 -3.862 -9.271 1.00 0.00 C ATOM 1604 NE2 HIS A 103 8.027 -3.291 -9.146 1.00 0.00 N ATOM 0 H HIS A 103 9.299 0.741 -9.724 1.00 0.00 H new ATOM 0 HA HIS A 103 8.612 0.157 -7.078 1.00 0.00 H new ATOM 0 HB2 HIS A 103 11.080 -0.410 -8.744 1.00 0.00 H new ATOM 0 HB3 HIS A 103 10.908 -1.006 -7.105 1.00 0.00 H new ATOM 0 HD2 HIS A 103 7.479 -1.291 -8.436 1.00 0.00 H new ATOM 0 HE1 HIS A 103 9.396 -4.865 -9.636 1.00 0.00 H new ATOM 0 HE2 HIS A 103 7.127 -3.714 -9.372 1.00 0.00 H new ATOM 1612 N SER A 104 11.140 2.257 -7.412 1.00 0.00 N ATOM 1613 CA SER A 104 11.912 3.272 -6.711 1.00 0.00 C ATOM 1614 C SER A 104 11.036 4.485 -6.389 1.00 0.00 C ATOM 1615 O SER A 104 11.261 5.186 -5.399 1.00 0.00 O ATOM 1616 CB SER A 104 13.114 3.685 -7.565 1.00 0.00 C ATOM 1617 OG SER A 104 13.863 2.547 -7.958 1.00 0.00 O ATOM 0 H SER A 104 11.332 2.197 -8.412 1.00 0.00 H new ATOM 0 HA SER A 104 12.273 2.858 -5.770 1.00 0.00 H new ATOM 0 HB2 SER A 104 12.771 4.224 -8.448 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.749 4.368 -7.002 1.00 0.00 H new ATOM 0 HG SER A 104 14.626 2.830 -8.504 1.00 0.00 H new ATOM 1623 N SER A 105 10.018 4.705 -7.212 1.00 0.00 N ATOM 1624 CA SER A 105 9.131 5.846 -7.053 1.00 0.00 C ATOM 1625 C SER A 105 8.256 5.687 -5.811 1.00 0.00 C ATOM 1626 O SER A 105 8.101 6.618 -5.028 1.00 0.00 O ATOM 1627 CB SER A 105 8.262 5.998 -8.298 1.00 0.00 C ATOM 1628 OG SER A 105 9.055 5.940 -9.471 1.00 0.00 O ATOM 0 H SER A 105 9.787 4.102 -8.001 1.00 0.00 H new ATOM 0 HA SER A 105 9.736 6.743 -6.925 1.00 0.00 H new ATOM 0 HB2 SER A 105 7.510 5.209 -8.322 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.727 6.947 -8.261 1.00 0.00 H new ATOM 0 HG SER A 105 8.481 6.037 -10.259 1.00 0.00 H new ATOM 1634 N LEU A 106 7.697 4.497 -5.633 1.00 0.00 N ATOM 1635 CA LEU A 106 6.862 4.202 -4.476 1.00 0.00 C ATOM 1636 C LEU A 106 7.623 4.457 -3.179 1.00 0.00 C ATOM 1637 O LEU A 106 7.066 4.970 -2.205 1.00 0.00 O ATOM 1638 CB LEU A 106 6.398 2.747 -4.533 1.00 0.00 C ATOM 1639 CG LEU A 106 5.408 2.427 -5.655 1.00 0.00 C ATOM 1640 CD1 LEU A 106 5.058 0.949 -5.655 1.00 0.00 C ATOM 1641 CD2 LEU A 106 4.151 3.273 -5.518 1.00 0.00 C ATOM 0 H LEU A 106 7.808 3.716 -6.280 1.00 0.00 H new ATOM 0 HA LEU A 106 5.993 4.860 -4.497 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.273 2.107 -4.647 1.00 0.00 H new ATOM 0 HB3 LEU A 106 5.938 2.491 -3.579 1.00 0.00 H new ATOM 0 HG LEU A 106 5.882 2.667 -6.607 1.00 0.00 H new ATOM 0 HD11 LEU A 106 4.353 0.742 -6.460 1.00 0.00 H new ATOM 0 HD12 LEU A 106 5.963 0.361 -5.805 1.00 0.00 H new ATOM 0 HD13 LEU A 106 4.606 0.682 -4.700 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.460 3.031 -6.325 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.676 3.066 -4.559 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.416 4.329 -5.572 1.00 0.00 H new ATOM 1653 N MET A 107 8.905 4.117 -3.185 1.00 0.00 N ATOM 1654 CA MET A 107 9.747 4.283 -2.008 1.00 0.00 C ATOM 1655 C MET A 107 9.984 5.761 -1.693 1.00 0.00 C ATOM 1656 O MET A 107 9.920 6.164 -0.531 1.00 0.00 O ATOM 1657 CB MET A 107 11.083 3.554 -2.192 1.00 0.00 C ATOM 1658 CG MET A 107 12.035 3.718 -1.019 1.00 0.00 C ATOM 1659 SD MET A 107 13.542 2.737 -1.200 1.00 0.00 S ATOM 1660 CE MET A 107 12.984 1.115 -0.681 1.00 0.00 C ATOM 0 H MET A 107 9.386 3.724 -3.994 1.00 0.00 H new ATOM 0 HA MET A 107 9.221 3.841 -1.161 1.00 0.00 H new ATOM 0 HB2 MET A 107 10.889 2.492 -2.346 1.00 0.00 H new ATOM 0 HB3 MET A 107 11.567 3.924 -3.096 1.00 0.00 H new ATOM 0 HG2 MET A 107 12.301 4.770 -0.917 1.00 0.00 H new ATOM 0 HG3 MET A 107 11.526 3.428 -0.100 1.00 0.00 H new ATOM 0 HE1 MET A 107 13.452 0.353 -1.304 1.00 0.00 H new ATOM 0 HE2 MET A 107 13.259 0.952 0.361 1.00 0.00 H new ATOM 0 HE3 MET A 107 11.901 1.053 -0.784 1.00 0.00 H new ATOM 1670 N ARG A 108 10.243 6.573 -2.720 1.00 0.00 N ATOM 1671 CA ARG A 108 10.469 8.000 -2.498 1.00 0.00 C ATOM 1672 C ARG A 108 9.177 8.683 -2.054 1.00 0.00 C ATOM 1673 O ARG A 108 9.210 9.664 -1.316 1.00 0.00 O ATOM 1674 CB ARG A 108 11.036 8.702 -3.741 1.00 0.00 C ATOM 1675 CG ARG A 108 10.092 8.744 -4.928 1.00 0.00 C ATOM 1676 CD ARG A 108 10.597 9.682 -6.008 1.00 0.00 C ATOM 1677 NE ARG A 108 10.498 11.085 -5.606 1.00 0.00 N ATOM 1678 CZ ARG A 108 9.866 12.024 -6.315 1.00 0.00 C ATOM 1679 NH1 ARG A 108 9.270 11.717 -7.460 1.00 0.00 N ATOM 1680 NH2 ARG A 108 9.823 13.275 -5.871 1.00 0.00 N ATOM 0 H ARG A 108 10.301 6.274 -3.694 1.00 0.00 H new ATOM 0 HA ARG A 108 11.214 8.085 -1.707 1.00 0.00 H new ATOM 0 HB2 ARG A 108 11.308 9.723 -3.473 1.00 0.00 H new ATOM 0 HB3 ARG A 108 11.954 8.196 -4.041 1.00 0.00 H new ATOM 0 HG2 ARG A 108 9.979 7.741 -5.340 1.00 0.00 H new ATOM 0 HG3 ARG A 108 9.105 9.066 -4.598 1.00 0.00 H new ATOM 0 HD2 ARG A 108 11.635 9.443 -6.239 1.00 0.00 H new ATOM 0 HD3 ARG A 108 10.023 9.525 -6.921 1.00 0.00 H new ATOM 0 HE ARG A 108 10.939 11.364 -4.730 1.00 0.00 H new ATOM 0 HH11 ARG A 108 9.292 10.757 -7.805 1.00 0.00 H new ATOM 0 HH12 ARG A 108 8.790 12.441 -7.995 1.00 0.00 H new ATOM 0 HH21 ARG A 108 10.273 13.519 -4.989 1.00 0.00 H new ATOM 0 HH22 ARG A 108 9.340 13.992 -6.413 1.00 0.00 H new ATOM 1694 N VAL A 109 8.041 8.154 -2.505 1.00 0.00 N ATOM 1695 CA VAL A 109 6.742 8.666 -2.085 1.00 0.00 C ATOM 1696 C VAL A 109 6.528 8.407 -0.602 1.00 0.00 C ATOM 1697 O VAL A 109 6.132 9.307 0.141 1.00 0.00 O ATOM 1698 CB VAL A 109 5.582 8.034 -2.889 1.00 0.00 C ATOM 1699 CG1 VAL A 109 4.234 8.473 -2.334 1.00 0.00 C ATOM 1700 CG2 VAL A 109 5.686 8.398 -4.361 1.00 0.00 C ATOM 0 H VAL A 109 7.996 7.373 -3.160 1.00 0.00 H new ATOM 0 HA VAL A 109 6.742 9.739 -2.278 1.00 0.00 H new ATOM 0 HB VAL A 109 5.659 6.951 -2.792 1.00 0.00 H new ATOM 0 HG11 VAL A 109 3.434 8.015 -2.916 1.00 0.00 H new ATOM 0 HG12 VAL A 109 4.150 8.160 -1.293 1.00 0.00 H new ATOM 0 HG13 VAL A 109 4.152 9.558 -2.395 1.00 0.00 H new ATOM 0 HG21 VAL A 109 4.860 7.943 -4.908 1.00 0.00 H new ATOM 0 HG22 VAL A 109 5.641 9.481 -4.472 1.00 0.00 H new ATOM 0 HG23 VAL A 109 6.631 8.031 -4.761 1.00 0.00 H new ATOM 1710 N ALA A 110 6.800 7.178 -0.177 1.00 0.00 N ATOM 1711 CA ALA A 110 6.687 6.816 1.228 1.00 0.00 C ATOM 1712 C ALA A 110 7.577 7.708 2.078 1.00 0.00 C ATOM 1713 O ALA A 110 7.159 8.196 3.123 1.00 0.00 O ATOM 1714 CB ALA A 110 7.053 5.354 1.443 1.00 0.00 C ATOM 0 H ALA A 110 7.100 6.417 -0.786 1.00 0.00 H new ATOM 0 HA ALA A 110 5.650 6.959 1.532 1.00 0.00 H new ATOM 0 HB1 ALA A 110 6.961 5.108 2.501 1.00 0.00 H new ATOM 0 HB2 ALA A 110 6.381 4.722 0.863 1.00 0.00 H new ATOM 0 HB3 ALA A 110 8.080 5.185 1.119 1.00 0.00 H new ATOM 1720 N ASP A 111 8.798 7.926 1.599 1.00 0.00 N ATOM 1721 CA ASP A 111 9.775 8.765 2.293 1.00 0.00 C ATOM 1722 C ASP A 111 9.266 10.198 2.419 1.00 0.00 C ATOM 1723 O ASP A 111 9.425 10.838 3.456 1.00 0.00 O ATOM 1724 CB ASP A 111 11.103 8.745 1.526 1.00 0.00 C ATOM 1725 CG ASP A 111 12.191 9.565 2.196 1.00 0.00 C ATOM 1726 OD1 ASP A 111 12.920 9.008 3.045 1.00 0.00 O ATOM 1727 OD2 ASP A 111 12.348 10.753 1.853 1.00 0.00 O ATOM 0 H ASP A 111 9.139 7.529 0.723 1.00 0.00 H new ATOM 0 HA ASP A 111 9.928 8.368 3.297 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.443 7.714 1.427 1.00 0.00 H new ATOM 0 HB3 ASP A 111 10.939 9.125 0.518 1.00 0.00 H new ATOM 1732 N ALA A 112 8.640 10.678 1.354 1.00 0.00 N ATOM 1733 CA ALA A 112 8.134 12.044 1.295 1.00 0.00 C ATOM 1734 C ALA A 112 6.947 12.256 2.229 1.00 0.00 C ATOM 1735 O ALA A 112 6.824 13.303 2.867 1.00 0.00 O ATOM 1736 CB ALA A 112 7.731 12.385 -0.128 1.00 0.00 C ATOM 0 H ALA A 112 8.468 10.134 0.508 1.00 0.00 H new ATOM 0 HA ALA A 112 8.937 12.704 1.623 1.00 0.00 H new ATOM 0 HB1 ALA A 112 7.354 13.407 -0.164 1.00 0.00 H new ATOM 0 HB2 ALA A 112 8.597 12.294 -0.783 1.00 0.00 H new ATOM 0 HB3 ALA A 112 6.952 11.699 -0.460 1.00 0.00 H new ATOM 1742 N VAL A 113 6.069 11.269 2.303 1.00 0.00 N ATOM 1743 CA VAL A 113 4.840 11.411 3.071 1.00 0.00 C ATOM 1744 C VAL A 113 5.008 10.910 4.503 1.00 0.00 C ATOM 1745 O VAL A 113 4.330 11.382 5.418 1.00 0.00 O ATOM 1746 CB VAL A 113 3.668 10.676 2.391 1.00 0.00 C ATOM 1747 CG1 VAL A 113 3.519 11.147 0.955 1.00 0.00 C ATOM 1748 CG2 VAL A 113 3.851 9.167 2.440 1.00 0.00 C ATOM 0 H VAL A 113 6.182 10.365 1.844 1.00 0.00 H new ATOM 0 HA VAL A 113 4.611 12.476 3.107 1.00 0.00 H new ATOM 0 HB VAL A 113 2.757 10.915 2.941 1.00 0.00 H new ATOM 0 HG11 VAL A 113 2.688 10.621 0.484 1.00 0.00 H new ATOM 0 HG12 VAL A 113 3.324 12.219 0.942 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.438 10.939 0.407 1.00 0.00 H new ATOM 0 HG21 VAL A 113 3.006 8.682 1.951 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.773 8.895 1.925 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.906 8.841 3.479 1.00 0.00 H new ATOM 1758 N GLY A 114 5.921 9.969 4.689 1.00 0.00 N ATOM 1759 CA GLY A 114 6.161 9.417 6.008 1.00 0.00 C ATOM 1760 C GLY A 114 5.230 8.263 6.334 1.00 0.00 C ATOM 1761 O GLY A 114 4.588 8.251 7.387 1.00 0.00 O ATOM 0 H GLY A 114 6.502 9.576 3.949 1.00 0.00 H new ATOM 0 HA2 GLY A 114 7.194 9.075 6.073 1.00 0.00 H new ATOM 0 HA3 GLY A 114 6.037 10.201 6.755 1.00 0.00 H new ATOM 1765 N ALA A 115 5.161 7.287 5.438 1.00 0.00 N ATOM 1766 CA ALA A 115 4.281 6.141 5.627 1.00 0.00 C ATOM 1767 C ALA A 115 5.018 4.837 5.378 1.00 0.00 C ATOM 1768 O ALA A 115 6.109 4.823 4.810 1.00 0.00 O ATOM 1769 CB ALA A 115 3.081 6.227 4.700 1.00 0.00 C ATOM 0 H ALA A 115 5.703 7.266 4.574 1.00 0.00 H new ATOM 0 HA ALA A 115 3.939 6.159 6.662 1.00 0.00 H new ATOM 0 HB1 ALA A 115 2.437 5.362 4.857 1.00 0.00 H new ATOM 0 HB2 ALA A 115 2.522 7.139 4.912 1.00 0.00 H new ATOM 0 HB3 ALA A 115 3.421 6.242 3.665 1.00 0.00 H new ATOM 1775 N ARG A 116 4.417 3.740 5.801 1.00 0.00 N ATOM 1776 CA ARG A 116 4.984 2.427 5.555 1.00 0.00 C ATOM 1777 C ARG A 116 4.630 1.961 4.150 1.00 0.00 C ATOM 1778 O ARG A 116 3.466 1.993 3.757 1.00 0.00 O ATOM 1779 CB ARG A 116 4.466 1.417 6.576 1.00 0.00 C ATOM 1780 CG ARG A 116 5.064 0.026 6.428 1.00 0.00 C ATOM 1781 CD ARG A 116 4.465 -0.941 7.435 1.00 0.00 C ATOM 1782 NE ARG A 116 4.554 -0.431 8.801 1.00 0.00 N ATOM 1783 CZ ARG A 116 5.145 -1.082 9.797 1.00 0.00 C ATOM 1784 NH1 ARG A 116 5.723 -2.255 9.575 1.00 0.00 N ATOM 1785 NH2 ARG A 116 5.172 -0.553 11.015 1.00 0.00 N ATOM 0 H ARG A 116 3.537 3.732 6.316 1.00 0.00 H new ATOM 0 HA ARG A 116 6.067 2.498 5.651 1.00 0.00 H new ATOM 0 HB2 ARG A 116 4.678 1.788 7.579 1.00 0.00 H new ATOM 0 HB3 ARG A 116 3.382 1.347 6.485 1.00 0.00 H new ATOM 0 HG2 ARG A 116 4.888 -0.342 5.417 1.00 0.00 H new ATOM 0 HG3 ARG A 116 6.144 0.075 6.566 1.00 0.00 H new ATOM 0 HD2 ARG A 116 3.420 -1.125 7.184 1.00 0.00 H new ATOM 0 HD3 ARG A 116 4.982 -1.898 7.371 1.00 0.00 H new ATOM 0 HE ARG A 116 4.138 0.478 9.002 1.00 0.00 H new ATOM 0 HH11 ARG A 116 5.714 -2.659 8.638 1.00 0.00 H new ATOM 0 HH12 ARG A 116 6.176 -2.753 10.341 1.00 0.00 H new ATOM 0 HH21 ARG A 116 4.739 0.354 11.187 1.00 0.00 H new ATOM 0 HH22 ARG A 116 5.626 -1.054 11.779 1.00 0.00 H new ATOM 1799 N LEU A 117 5.632 1.544 3.399 1.00 0.00 N ATOM 1800 CA LEU A 117 5.423 1.030 2.054 1.00 0.00 C ATOM 1801 C LEU A 117 5.422 -0.493 2.077 1.00 0.00 C ATOM 1802 O LEU A 117 6.337 -1.104 2.621 1.00 0.00 O ATOM 1803 CB LEU A 117 6.524 1.541 1.122 1.00 0.00 C ATOM 1804 CG LEU A 117 6.417 1.081 -0.333 1.00 0.00 C ATOM 1805 CD1 LEU A 117 5.202 1.703 -1.007 1.00 0.00 C ATOM 1806 CD2 LEU A 117 7.687 1.424 -1.088 1.00 0.00 C ATOM 0 H LEU A 117 6.607 1.551 3.699 1.00 0.00 H new ATOM 0 HA LEU A 117 4.459 1.380 1.685 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.517 2.631 1.142 1.00 0.00 H new ATOM 0 HB3 LEU A 117 7.488 1.221 1.517 1.00 0.00 H new ATOM 0 HG LEU A 117 6.291 -0.002 -0.345 1.00 0.00 H new ATOM 0 HD11 LEU A 117 5.145 1.362 -2.041 1.00 0.00 H new ATOM 0 HD12 LEU A 117 4.298 1.404 -0.476 1.00 0.00 H new ATOM 0 HD13 LEU A 117 5.291 2.789 -0.987 1.00 0.00 H new ATOM 0 HD21 LEU A 117 7.597 1.091 -2.122 1.00 0.00 H new ATOM 0 HD22 LEU A 117 7.843 2.503 -1.067 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.535 0.925 -0.619 1.00 0.00 H new ATOM 1818 N ILE A 118 4.391 -1.102 1.513 1.00 0.00 N ATOM 1819 CA ILE A 118 4.297 -2.556 1.467 1.00 0.00 C ATOM 1820 C ILE A 118 4.030 -3.031 0.044 1.00 0.00 C ATOM 1821 O ILE A 118 3.081 -2.589 -0.602 1.00 0.00 O ATOM 1822 CB ILE A 118 3.184 -3.087 2.397 1.00 0.00 C ATOM 1823 CG1 ILE A 118 3.454 -2.675 3.849 1.00 0.00 C ATOM 1824 CG2 ILE A 118 3.072 -4.603 2.285 1.00 0.00 C ATOM 1825 CD1 ILE A 118 2.371 -3.098 4.821 1.00 0.00 C ATOM 0 H ILE A 118 3.607 -0.614 1.080 1.00 0.00 H new ATOM 0 HA ILE A 118 5.253 -2.949 1.812 1.00 0.00 H new ATOM 0 HB ILE A 118 2.237 -2.647 2.085 1.00 0.00 H new ATOM 0 HG12 ILE A 118 4.403 -3.106 4.168 1.00 0.00 H new ATOM 0 HG13 ILE A 118 3.565 -1.592 3.894 1.00 0.00 H new ATOM 0 HG21 ILE A 118 2.283 -4.959 2.947 1.00 0.00 H new ATOM 0 HG22 ILE A 118 2.833 -4.875 1.257 1.00 0.00 H new ATOM 0 HG23 ILE A 118 4.019 -5.060 2.571 1.00 0.00 H new ATOM 0 HD11 ILE A 118 2.636 -2.770 5.826 1.00 0.00 H new ATOM 0 HD12 ILE A 118 1.423 -2.645 4.529 1.00 0.00 H new ATOM 0 HD13 ILE A 118 2.274 -4.184 4.808 1.00 0.00 H new ATOM 1837 N ILE A 119 4.873 -3.923 -0.448 1.00 0.00 N ATOM 1838 CA ILE A 119 4.696 -4.480 -1.777 1.00 0.00 C ATOM 1839 C ILE A 119 4.784 -6.000 -1.728 1.00 0.00 C ATOM 1840 O ILE A 119 5.713 -6.560 -1.143 1.00 0.00 O ATOM 1841 CB ILE A 119 5.740 -3.941 -2.782 1.00 0.00 C ATOM 1842 CG1 ILE A 119 5.712 -2.410 -2.830 1.00 0.00 C ATOM 1843 CG2 ILE A 119 5.483 -4.517 -4.170 1.00 0.00 C ATOM 1844 CD1 ILE A 119 6.761 -1.819 -3.746 1.00 0.00 C ATOM 0 H ILE A 119 5.687 -4.277 0.054 1.00 0.00 H new ATOM 0 HA ILE A 119 3.708 -4.173 -2.121 1.00 0.00 H new ATOM 0 HB ILE A 119 6.729 -4.254 -2.447 1.00 0.00 H new ATOM 0 HG12 ILE A 119 4.726 -2.082 -3.159 1.00 0.00 H new ATOM 0 HG13 ILE A 119 5.858 -2.019 -1.823 1.00 0.00 H new ATOM 0 HG21 ILE A 119 6.225 -4.129 -4.868 1.00 0.00 H new ATOM 0 HG22 ILE A 119 5.554 -5.604 -4.132 1.00 0.00 H new ATOM 0 HG23 ILE A 119 4.486 -4.230 -4.504 1.00 0.00 H new ATOM 0 HD11 ILE A 119 6.685 -0.732 -3.733 1.00 0.00 H new ATOM 0 HD12 ILE A 119 7.752 -2.118 -3.405 1.00 0.00 H new ATOM 0 HD13 ILE A 119 6.603 -2.181 -4.762 1.00 0.00 H new ATOM 1856 N LYS A 120 3.809 -6.662 -2.332 1.00 0.00 N ATOM 1857 CA LYS A 120 3.788 -8.116 -2.371 1.00 0.00 C ATOM 1858 C LYS A 120 3.908 -8.608 -3.814 1.00 0.00 C ATOM 1859 O LYS A 120 2.911 -8.676 -4.534 1.00 0.00 O ATOM 1860 CB LYS A 120 2.494 -8.644 -1.743 1.00 0.00 C ATOM 1861 CG LYS A 120 2.513 -10.137 -1.459 1.00 0.00 C ATOM 1862 CD LYS A 120 1.139 -10.642 -1.053 1.00 0.00 C ATOM 1863 CE LYS A 120 1.191 -12.064 -0.520 1.00 0.00 C ATOM 1864 NZ LYS A 120 1.790 -13.016 -1.497 1.00 0.00 N ATOM 0 H LYS A 120 3.022 -6.215 -2.802 1.00 0.00 H new ATOM 0 HA LYS A 120 4.636 -8.492 -1.799 1.00 0.00 H new ATOM 0 HB2 LYS A 120 2.309 -8.109 -0.812 1.00 0.00 H new ATOM 0 HB3 LYS A 120 1.661 -8.421 -2.409 1.00 0.00 H new ATOM 0 HG2 LYS A 120 2.852 -10.673 -2.345 1.00 0.00 H new ATOM 0 HG3 LYS A 120 3.229 -10.349 -0.665 1.00 0.00 H new ATOM 0 HD2 LYS A 120 0.721 -9.984 -0.291 1.00 0.00 H new ATOM 0 HD3 LYS A 120 0.469 -10.601 -1.912 1.00 0.00 H new ATOM 0 HE2 LYS A 120 1.771 -12.082 0.403 1.00 0.00 H new ATOM 0 HE3 LYS A 120 0.182 -12.392 -0.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 1.122 -13.792 -1.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 1.994 -12.518 -2.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.673 -13.404 -1.107 1.00 0.00 H new ATOM 1878 N PRO A 121 5.134 -8.911 -4.268 1.00 0.00 N ATOM 1879 CA PRO A 121 5.374 -9.428 -5.611 1.00 0.00 C ATOM 1880 C PRO A 121 5.323 -10.950 -5.673 1.00 0.00 C ATOM 1881 O PRO A 121 4.747 -11.607 -4.798 1.00 0.00 O ATOM 1882 CB PRO A 121 6.786 -8.946 -5.903 1.00 0.00 C ATOM 1883 CG PRO A 121 7.470 -8.937 -4.571 1.00 0.00 C ATOM 1884 CD PRO A 121 6.396 -8.753 -3.522 1.00 0.00 C ATOM 0 HA PRO A 121 4.619 -9.090 -6.321 1.00 0.00 H new ATOM 0 HB2 PRO A 121 7.293 -9.609 -6.604 1.00 0.00 H new ATOM 0 HB3 PRO A 121 6.780 -7.953 -6.351 1.00 0.00 H new ATOM 0 HG2 PRO A 121 8.011 -9.869 -4.409 1.00 0.00 H new ATOM 0 HG3 PRO A 121 8.202 -8.131 -4.519 1.00 0.00 H new ATOM 0 HD2 PRO A 121 6.484 -9.493 -2.727 1.00 0.00 H new ATOM 0 HD3 PRO A 121 6.461 -7.771 -3.052 1.00 0.00 H new ATOM 1892 N LEU A 122 5.926 -11.499 -6.716 1.00 0.00 N ATOM 1893 CA LEU A 122 6.016 -12.938 -6.893 1.00 0.00 C ATOM 1894 C LEU A 122 7.077 -13.523 -5.961 1.00 0.00 C ATOM 1895 O LEU A 122 7.909 -12.793 -5.423 1.00 0.00 O ATOM 1896 CB LEU A 122 6.372 -13.252 -8.347 1.00 0.00 C ATOM 1897 CG LEU A 122 5.908 -14.612 -8.857 1.00 0.00 C ATOM 1898 CD1 LEU A 122 4.398 -14.727 -8.748 1.00 0.00 C ATOM 1899 CD2 LEU A 122 6.363 -14.809 -10.293 1.00 0.00 C ATOM 0 H LEU A 122 6.366 -10.960 -7.462 1.00 0.00 H new ATOM 0 HA LEU A 122 5.053 -13.386 -6.649 1.00 0.00 H new ATOM 0 HB2 LEU A 122 5.942 -12.479 -8.983 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.455 -13.191 -8.459 1.00 0.00 H new ATOM 0 HG LEU A 122 6.353 -15.395 -8.243 1.00 0.00 H new ATOM 0 HD11 LEU A 122 4.080 -15.703 -9.115 1.00 0.00 H new ATOM 0 HD12 LEU A 122 4.099 -14.617 -7.706 1.00 0.00 H new ATOM 0 HD13 LEU A 122 3.929 -13.944 -9.345 1.00 0.00 H new ATOM 0 HD21 LEU A 122 6.028 -15.783 -10.651 1.00 0.00 H new ATOM 0 HD22 LEU A 122 5.937 -14.026 -10.920 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.451 -14.760 -10.340 1.00 0.00 H new ATOM 1911 N THR A 123 7.051 -14.837 -5.773 1.00 0.00 N ATOM 1912 CA THR A 123 8.034 -15.496 -4.923 1.00 0.00 C ATOM 1913 C THR A 123 9.397 -15.532 -5.615 1.00 0.00 C ATOM 1914 O THR A 123 10.440 -15.521 -4.962 1.00 0.00 O ATOM 1915 CB THR A 123 7.585 -16.926 -4.531 1.00 0.00 C ATOM 1916 OG1 THR A 123 8.515 -17.508 -3.606 1.00 0.00 O ATOM 1917 CG2 THR A 123 7.451 -17.818 -5.754 1.00 0.00 C ATOM 0 H THR A 123 6.365 -15.463 -6.194 1.00 0.00 H new ATOM 0 HA THR A 123 8.120 -14.916 -4.004 1.00 0.00 H new ATOM 0 HB THR A 123 6.607 -16.846 -4.056 1.00 0.00 H new ATOM 0 HG1 THR A 123 8.217 -18.410 -3.367 1.00 0.00 H new ATOM 0 HG21 THR A 123 7.135 -18.814 -5.445 1.00 0.00 H new ATOM 0 HG22 THR A 123 6.710 -17.396 -6.433 1.00 0.00 H new ATOM 0 HG23 THR A 123 8.413 -17.884 -6.263 1.00 0.00 H new ATOM 1925 N GLY A 124 9.379 -15.552 -6.944 1.00 0.00 N ATOM 1926 CA GLY A 124 10.608 -15.524 -7.711 1.00 0.00 C ATOM 1927 C GLY A 124 10.777 -14.197 -8.413 1.00 0.00 C ATOM 1928 O GLY A 124 11.132 -14.136 -9.591 1.00 0.00 O ATOM 0 H GLY A 124 8.528 -15.587 -7.505 1.00 0.00 H new ATOM 0 HA2 GLY A 124 11.457 -15.701 -7.051 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.601 -16.330 -8.445 1.00 0.00 H new ATOM 1932 N GLU A 125 10.513 -13.132 -7.678 1.00 0.00 N ATOM 1933 CA GLU A 125 10.511 -11.787 -8.222 1.00 0.00 C ATOM 1934 C GLU A 125 10.969 -10.806 -7.149 1.00 0.00 C ATOM 1935 O GLU A 125 10.617 -10.953 -5.980 1.00 0.00 O ATOM 1936 CB GLU A 125 9.098 -11.463 -8.716 1.00 0.00 C ATOM 1937 CG GLU A 125 8.856 -10.013 -9.067 1.00 0.00 C ATOM 1938 CD GLU A 125 7.513 -9.816 -9.735 1.00 0.00 C ATOM 1939 OE1 GLU A 125 6.480 -9.883 -9.037 1.00 0.00 O ATOM 1940 OE2 GLU A 125 7.487 -9.615 -10.966 1.00 0.00 O ATOM 0 H GLU A 125 10.293 -13.176 -6.683 1.00 0.00 H new ATOM 0 HA GLU A 125 11.201 -11.707 -9.062 1.00 0.00 H new ATOM 0 HB2 GLU A 125 8.889 -12.073 -9.595 1.00 0.00 H new ATOM 0 HB3 GLU A 125 8.385 -11.758 -7.946 1.00 0.00 H new ATOM 0 HG2 GLU A 125 8.905 -9.407 -8.163 1.00 0.00 H new ATOM 0 HG3 GLU A 125 9.647 -9.662 -9.730 1.00 0.00 H new ATOM 1947 N ASP A 126 11.785 -9.834 -7.535 1.00 0.00 N ATOM 1948 CA ASP A 126 12.302 -8.862 -6.577 1.00 0.00 C ATOM 1949 C ASP A 126 11.863 -7.454 -6.937 1.00 0.00 C ATOM 1950 O ASP A 126 11.476 -7.179 -8.077 1.00 0.00 O ATOM 1951 CB ASP A 126 13.830 -8.904 -6.516 1.00 0.00 C ATOM 1952 CG ASP A 126 14.379 -8.206 -5.283 1.00 0.00 C ATOM 1953 OD1 ASP A 126 14.183 -8.719 -4.161 1.00 0.00 O ATOM 1954 OD2 ASP A 126 14.996 -7.132 -5.429 1.00 0.00 O ATOM 0 H ASP A 126 12.102 -9.697 -8.495 1.00 0.00 H new ATOM 0 HA ASP A 126 11.896 -9.129 -5.601 1.00 0.00 H new ATOM 0 HB2 ASP A 126 14.163 -9.942 -6.521 1.00 0.00 H new ATOM 0 HB3 ASP A 126 14.240 -8.433 -7.410 1.00 0.00 H new ATOM 1959 N ILE A 127 11.948 -6.569 -5.962 1.00 0.00 N ATOM 1960 CA ILE A 127 11.617 -5.173 -6.154 1.00 0.00 C ATOM 1961 C ILE A 127 12.892 -4.384 -6.406 1.00 0.00 C ATOM 1962 O ILE A 127 13.705 -4.192 -5.497 1.00 0.00 O ATOM 1963 CB ILE A 127 10.887 -4.589 -4.927 1.00 0.00 C ATOM 1964 CG1 ILE A 127 9.659 -5.434 -4.590 1.00 0.00 C ATOM 1965 CG2 ILE A 127 10.487 -3.143 -5.182 1.00 0.00 C ATOM 1966 CD1 ILE A 127 8.957 -5.000 -3.324 1.00 0.00 C ATOM 0 H ILE A 127 12.249 -6.799 -5.015 1.00 0.00 H new ATOM 0 HA ILE A 127 10.949 -5.098 -7.012 1.00 0.00 H new ATOM 0 HB ILE A 127 11.567 -4.610 -4.076 1.00 0.00 H new ATOM 0 HG12 ILE A 127 8.955 -5.385 -5.421 1.00 0.00 H new ATOM 0 HG13 ILE A 127 9.962 -6.476 -4.489 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.973 -2.748 -4.306 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.379 -2.548 -5.379 1.00 0.00 H new ATOM 0 HG23 ILE A 127 9.822 -3.096 -6.044 1.00 0.00 H new ATOM 0 HD11 ILE A 127 8.095 -5.644 -3.147 1.00 0.00 H new ATOM 0 HD12 ILE A 127 9.645 -5.075 -2.482 1.00 0.00 H new ATOM 0 HD13 ILE A 127 8.623 -3.968 -3.429 1.00 0.00 H new ATOM 2047 N LYS A 132 16.083 -0.211 -1.456 1.00 0.00 N ATOM 2048 CA LYS A 132 15.747 -1.602 -1.142 1.00 0.00 C ATOM 2049 C LYS A 132 14.782 -1.703 0.043 1.00 0.00 C ATOM 2050 O LYS A 132 14.798 -0.881 0.961 1.00 0.00 O ATOM 2051 CB LYS A 132 17.026 -2.423 -0.911 1.00 0.00 C ATOM 2052 CG LYS A 132 16.933 -3.481 0.183 1.00 0.00 C ATOM 2053 CD LYS A 132 17.327 -2.911 1.537 1.00 0.00 C ATOM 2054 CE LYS A 132 16.665 -3.663 2.676 1.00 0.00 C ATOM 2055 NZ LYS A 132 16.992 -5.112 2.659 1.00 0.00 N ATOM 0 HA LYS A 132 15.225 -2.025 -2.001 1.00 0.00 H new ATOM 0 HB2 LYS A 132 17.297 -2.914 -1.846 1.00 0.00 H new ATOM 0 HB3 LYS A 132 17.837 -1.739 -0.664 1.00 0.00 H new ATOM 0 HG2 LYS A 132 15.916 -3.869 0.231 1.00 0.00 H new ATOM 0 HG3 LYS A 132 17.583 -4.321 -0.064 1.00 0.00 H new ATOM 0 HD2 LYS A 132 18.410 -2.958 1.651 1.00 0.00 H new ATOM 0 HD3 LYS A 132 17.047 -1.859 1.584 1.00 0.00 H new ATOM 0 HE2 LYS A 132 16.982 -3.232 3.626 1.00 0.00 H new ATOM 0 HE3 LYS A 132 15.584 -3.536 2.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 17.199 -5.433 3.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 16.183 -5.646 2.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 17.824 -5.273 2.056 1.00 0.00 H new ATOM 2069 N MET A 133 13.936 -2.718 0.002 1.00 0.00 N ATOM 2070 CA MET A 133 12.939 -2.938 1.037 1.00 0.00 C ATOM 2071 C MET A 133 13.305 -4.162 1.856 1.00 0.00 C ATOM 2072 O MET A 133 14.097 -4.995 1.414 1.00 0.00 O ATOM 2073 CB MET A 133 11.556 -3.108 0.409 1.00 0.00 C ATOM 2074 CG MET A 133 11.137 -1.908 -0.417 1.00 0.00 C ATOM 2075 SD MET A 133 9.546 -2.124 -1.239 1.00 0.00 S ATOM 2076 CE MET A 133 8.434 -2.059 0.158 1.00 0.00 C ATOM 0 H MET A 133 13.920 -3.411 -0.746 1.00 0.00 H new ATOM 0 HA MET A 133 12.914 -2.071 1.697 1.00 0.00 H new ATOM 0 HB2 MET A 133 11.555 -3.997 -0.222 1.00 0.00 H new ATOM 0 HB3 MET A 133 10.822 -3.276 1.197 1.00 0.00 H new ATOM 0 HG2 MET A 133 11.088 -1.031 0.229 1.00 0.00 H new ATOM 0 HG3 MET A 133 11.901 -1.708 -1.168 1.00 0.00 H new ATOM 0 HE1 MET A 133 7.405 -2.143 -0.192 1.00 0.00 H new ATOM 0 HE2 MET A 133 8.654 -2.883 0.837 1.00 0.00 H new ATOM 0 HE3 MET A 133 8.563 -1.112 0.682 1.00 0.00 H new ATOM 2086 N LYS A 134 12.740 -4.269 3.049 1.00 0.00 N ATOM 2087 CA LYS A 134 13.083 -5.355 3.951 1.00 0.00 C ATOM 2088 C LYS A 134 12.089 -6.494 3.825 1.00 0.00 C ATOM 2089 O LYS A 134 10.890 -6.275 3.642 1.00 0.00 O ATOM 2090 CB LYS A 134 13.139 -4.876 5.405 1.00 0.00 C ATOM 2091 CG LYS A 134 11.860 -4.214 5.887 1.00 0.00 C ATOM 2092 CD LYS A 134 11.837 -4.059 7.402 1.00 0.00 C ATOM 2093 CE LYS A 134 11.309 -5.305 8.106 1.00 0.00 C ATOM 2094 NZ LYS A 134 12.162 -6.502 7.875 1.00 0.00 N ATOM 0 H LYS A 134 12.044 -3.618 3.413 1.00 0.00 H new ATOM 0 HA LYS A 134 14.073 -5.713 3.667 1.00 0.00 H new ATOM 0 HB2 LYS A 134 13.360 -5.727 6.049 1.00 0.00 H new ATOM 0 HB3 LYS A 134 13.964 -4.172 5.513 1.00 0.00 H new ATOM 0 HG2 LYS A 134 11.760 -3.234 5.420 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.002 -4.807 5.570 1.00 0.00 H new ATOM 0 HD2 LYS A 134 12.844 -3.843 7.758 1.00 0.00 H new ATOM 0 HD3 LYS A 134 11.215 -3.204 7.668 1.00 0.00 H new ATOM 0 HE2 LYS A 134 11.244 -5.112 9.177 1.00 0.00 H new ATOM 0 HE3 LYS A 134 10.297 -5.513 7.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 11.962 -7.216 8.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 11.956 -6.899 6.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 13.164 -6.229 7.923 1.00 0.00 H new ATOM 2108 N LEU A 135 12.600 -7.705 3.922 1.00 0.00 N ATOM 2109 CA LEU A 135 11.774 -8.895 3.847 1.00 0.00 C ATOM 2110 C LEU A 135 11.003 -9.087 5.148 1.00 0.00 C ATOM 2111 O LEU A 135 11.568 -9.002 6.241 1.00 0.00 O ATOM 2112 CB LEU A 135 12.639 -10.128 3.557 1.00 0.00 C ATOM 2113 CG LEU A 135 11.865 -11.424 3.313 1.00 0.00 C ATOM 2114 CD1 LEU A 135 10.993 -11.295 2.076 1.00 0.00 C ATOM 2115 CD2 LEU A 135 12.820 -12.600 3.172 1.00 0.00 C ATOM 0 H LEU A 135 13.594 -7.892 4.054 1.00 0.00 H new ATOM 0 HA LEU A 135 11.060 -8.771 3.033 1.00 0.00 H new ATOM 0 HB2 LEU A 135 13.256 -9.922 2.682 1.00 0.00 H new ATOM 0 HB3 LEU A 135 13.318 -10.281 4.396 1.00 0.00 H new ATOM 0 HG LEU A 135 11.221 -11.608 4.173 1.00 0.00 H new ATOM 0 HD11 LEU A 135 10.449 -12.226 1.916 1.00 0.00 H new ATOM 0 HD12 LEU A 135 10.284 -10.479 2.214 1.00 0.00 H new ATOM 0 HD13 LEU A 135 11.620 -11.088 1.209 1.00 0.00 H new ATOM 0 HD21 LEU A 135 12.250 -13.513 2.999 1.00 0.00 H new ATOM 0 HD22 LEU A 135 13.490 -12.426 2.330 1.00 0.00 H new ATOM 0 HD23 LEU A 135 13.405 -12.705 4.086 1.00 0.00 H new ATOM 2127 N VAL A 136 9.712 -9.322 5.018 1.00 0.00 N ATOM 2128 CA VAL A 136 8.847 -9.557 6.163 1.00 0.00 C ATOM 2129 C VAL A 136 8.048 -10.835 5.974 1.00 0.00 C ATOM 2130 O VAL A 136 7.545 -11.112 4.886 1.00 0.00 O ATOM 2131 CB VAL A 136 7.872 -8.388 6.406 1.00 0.00 C ATOM 2132 CG1 VAL A 136 8.361 -7.507 7.536 1.00 0.00 C ATOM 2133 CG2 VAL A 136 7.693 -7.564 5.146 1.00 0.00 C ATOM 0 H VAL A 136 9.232 -9.356 4.119 1.00 0.00 H new ATOM 0 HA VAL A 136 9.497 -9.648 7.033 1.00 0.00 H new ATOM 0 HB VAL A 136 6.907 -8.811 6.685 1.00 0.00 H new ATOM 0 HG11 VAL A 136 7.658 -6.689 7.690 1.00 0.00 H new ATOM 0 HG12 VAL A 136 8.438 -8.096 8.450 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.340 -7.101 7.283 1.00 0.00 H new ATOM 0 HG21 VAL A 136 7.001 -6.745 5.342 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.656 -7.159 4.836 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.293 -8.195 4.352 1.00 0.00 H new ATOM 2143 N ASN A 137 7.945 -11.607 7.039 1.00 0.00 N ATOM 2144 CA ASN A 137 7.214 -12.863 7.017 1.00 0.00 C ATOM 2145 C ASN A 137 5.972 -12.759 7.883 1.00 0.00 C ATOM 2146 O ASN A 137 6.058 -12.734 9.114 1.00 0.00 O ATOM 2147 CB ASN A 137 8.106 -14.008 7.504 1.00 0.00 C ATOM 2148 CG ASN A 137 9.090 -14.470 6.446 1.00 0.00 C ATOM 2149 OD1 ASN A 137 8.835 -15.438 5.726 1.00 0.00 O ATOM 2150 ND2 ASN A 137 10.212 -13.776 6.320 1.00 0.00 N ATOM 0 H ASN A 137 8.364 -11.384 7.942 1.00 0.00 H new ATOM 0 HA ASN A 137 6.911 -13.073 5.991 1.00 0.00 H new ATOM 0 HB2 ASN A 137 8.654 -13.685 8.389 1.00 0.00 H new ATOM 0 HB3 ASN A 137 7.481 -14.848 7.805 1.00 0.00 H new ATOM 0 HD21 ASN A 137 10.896 -14.037 5.610 1.00 0.00 H new ATOM 0 HD22 ASN A 137 10.391 -12.980 6.933 1.00 0.00 H new ATOM 2157 N TYR A 138 4.819 -12.676 7.240 1.00 0.00 N ATOM 2158 CA TYR A 138 3.566 -12.538 7.958 1.00 0.00 C ATOM 2159 C TYR A 138 2.429 -13.200 7.197 1.00 0.00 C ATOM 2160 O TYR A 138 2.222 -12.929 6.017 1.00 0.00 O ATOM 2161 CB TYR A 138 3.235 -11.061 8.188 1.00 0.00 C ATOM 2162 CG TYR A 138 2.014 -10.851 9.057 1.00 0.00 C ATOM 2163 CD1 TYR A 138 2.127 -10.775 10.439 1.00 0.00 C ATOM 2164 CD2 TYR A 138 0.748 -10.740 8.497 1.00 0.00 C ATOM 2165 CE1 TYR A 138 1.012 -10.596 11.234 1.00 0.00 C ATOM 2166 CE2 TYR A 138 -0.368 -10.563 9.285 1.00 0.00 C ATOM 2167 CZ TYR A 138 -0.232 -10.490 10.651 1.00 0.00 C ATOM 2168 OH TYR A 138 -1.344 -10.317 11.434 1.00 0.00 O ATOM 0 H TYR A 138 4.726 -12.702 6.225 1.00 0.00 H new ATOM 0 HA TYR A 138 3.681 -13.033 8.922 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.091 -10.572 8.652 1.00 0.00 H new ATOM 0 HB3 TYR A 138 3.075 -10.577 7.225 1.00 0.00 H new ATOM 0 HD1 TYR A 138 3.101 -10.857 10.899 1.00 0.00 H new ATOM 0 HD2 TYR A 138 0.636 -10.793 7.424 1.00 0.00 H new ATOM 0 HE1 TYR A 138 1.115 -10.539 12.308 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -1.345 -10.482 8.832 1.00 0.00 H new ATOM 0 HH TYR A 138 -2.030 -10.968 11.176 1.00 0.00 H new ATOM 2178 N GLY A 139 1.703 -14.067 7.885 1.00 0.00 N ATOM 2179 CA GLY A 139 0.485 -14.624 7.343 1.00 0.00 C ATOM 2180 C GLY A 139 0.697 -15.546 6.167 1.00 0.00 C ATOM 2181 O GLY A 139 0.148 -15.320 5.091 1.00 0.00 O ATOM 0 H GLY A 139 1.941 -14.397 8.820 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -0.033 -15.171 8.131 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -0.170 -13.808 7.037 1.00 0.00 H new ATOM 2185 N ARG A 140 1.487 -16.596 6.381 1.00 0.00 N ATOM 2186 CA ARG A 140 1.687 -17.652 5.385 1.00 0.00 C ATOM 2187 C ARG A 140 2.338 -17.120 4.106 1.00 0.00 C ATOM 2188 O ARG A 140 2.406 -17.826 3.101 1.00 0.00 O ATOM 2189 CB ARG A 140 0.356 -18.351 5.048 1.00 0.00 C ATOM 2190 CG ARG A 140 -0.299 -19.058 6.230 1.00 0.00 C ATOM 2191 CD ARG A 140 -1.035 -18.086 7.141 1.00 0.00 C ATOM 2192 NE ARG A 140 -1.315 -18.666 8.449 1.00 0.00 N ATOM 2193 CZ ARG A 140 -1.942 -18.030 9.435 1.00 0.00 C ATOM 2194 NH1 ARG A 140 -2.433 -16.808 9.249 1.00 0.00 N ATOM 2195 NH2 ARG A 140 -2.094 -18.627 10.610 1.00 0.00 N ATOM 0 H ARG A 140 2.006 -16.741 7.247 1.00 0.00 H new ATOM 0 HA ARG A 140 2.367 -18.379 5.828 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -0.339 -17.611 4.652 1.00 0.00 H new ATOM 0 HB3 ARG A 140 0.532 -19.079 4.256 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -0.998 -19.809 5.861 1.00 0.00 H new ATOM 0 HG3 ARG A 140 0.463 -19.586 6.804 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -0.437 -17.183 7.266 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.971 -17.786 6.670 1.00 0.00 H new ATOM 0 HE ARG A 140 -1.010 -19.624 8.620 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -2.331 -16.350 8.344 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -2.912 -16.329 10.012 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -1.731 -19.569 10.754 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -2.574 -18.144 11.369 1.00 0.00 H new ATOM 2209 N THR A 141 2.823 -15.889 4.152 1.00 0.00 N ATOM 2210 CA THR A 141 3.457 -15.279 3.003 1.00 0.00 C ATOM 2211 C THR A 141 4.590 -14.363 3.448 1.00 0.00 C ATOM 2212 O THR A 141 4.583 -13.843 4.563 1.00 0.00 O ATOM 2213 CB THR A 141 2.439 -14.476 2.153 1.00 0.00 C ATOM 2214 OG1 THR A 141 3.074 -13.968 0.970 1.00 0.00 O ATOM 2215 CG2 THR A 141 1.838 -13.311 2.940 1.00 0.00 C ATOM 0 H THR A 141 2.787 -15.293 4.979 1.00 0.00 H new ATOM 0 HA THR A 141 3.860 -16.081 2.385 1.00 0.00 H new ATOM 0 HB THR A 141 1.634 -15.158 1.880 1.00 0.00 H new ATOM 0 HG1 THR A 141 3.581 -13.159 1.192 1.00 0.00 H new ATOM 0 HG21 THR A 141 1.130 -12.773 2.310 1.00 0.00 H new ATOM 0 HG22 THR A 141 1.322 -13.694 3.820 1.00 0.00 H new ATOM 0 HG23 THR A 141 2.633 -12.634 3.252 1.00 0.00 H new ATOM 2223 N TYR A 142 5.569 -14.187 2.579 1.00 0.00 N ATOM 2224 CA TYR A 142 6.642 -13.251 2.834 1.00 0.00 C ATOM 2225 C TYR A 142 6.704 -12.222 1.712 1.00 0.00 C ATOM 2226 O TYR A 142 6.535 -12.553 0.537 1.00 0.00 O ATOM 2227 CB TYR A 142 7.989 -13.973 3.027 1.00 0.00 C ATOM 2228 CG TYR A 142 8.479 -14.786 1.846 1.00 0.00 C ATOM 2229 CD1 TYR A 142 7.809 -15.929 1.425 1.00 0.00 C ATOM 2230 CD2 TYR A 142 9.637 -14.422 1.172 1.00 0.00 C ATOM 2231 CE1 TYR A 142 8.279 -16.683 0.366 1.00 0.00 C ATOM 2232 CE2 TYR A 142 10.110 -15.167 0.110 1.00 0.00 C ATOM 2233 CZ TYR A 142 9.430 -16.295 -0.289 1.00 0.00 C ATOM 2234 OH TYR A 142 9.914 -17.051 -1.337 1.00 0.00 O ATOM 0 H TYR A 142 5.641 -14.682 1.690 1.00 0.00 H new ATOM 0 HA TYR A 142 6.436 -12.728 3.768 1.00 0.00 H new ATOM 0 HB2 TYR A 142 8.747 -13.228 3.270 1.00 0.00 H new ATOM 0 HB3 TYR A 142 7.904 -14.635 3.889 1.00 0.00 H new ATOM 0 HD1 TYR A 142 6.906 -16.233 1.934 1.00 0.00 H new ATOM 0 HD2 TYR A 142 10.177 -13.540 1.484 1.00 0.00 H new ATOM 0 HE1 TYR A 142 7.749 -17.570 0.053 1.00 0.00 H new ATOM 0 HE2 TYR A 142 11.010 -14.866 -0.405 1.00 0.00 H new ATOM 0 HH TYR A 142 9.221 -17.139 -2.024 1.00 0.00 H new ATOM 2244 N PHE A 143 6.902 -10.975 2.096 1.00 0.00 N ATOM 2245 CA PHE A 143 6.861 -9.854 1.168 1.00 0.00 C ATOM 2246 C PHE A 143 7.874 -8.799 1.589 1.00 0.00 C ATOM 2247 O PHE A 143 8.703 -9.049 2.465 1.00 0.00 O ATOM 2248 CB PHE A 143 5.440 -9.263 1.123 1.00 0.00 C ATOM 2249 CG PHE A 143 4.834 -9.027 2.481 1.00 0.00 C ATOM 2250 CD1 PHE A 143 5.015 -7.820 3.137 1.00 0.00 C ATOM 2251 CD2 PHE A 143 4.087 -10.018 3.106 1.00 0.00 C ATOM 2252 CE1 PHE A 143 4.462 -7.604 4.386 1.00 0.00 C ATOM 2253 CE2 PHE A 143 3.533 -9.804 4.353 1.00 0.00 C ATOM 2254 CZ PHE A 143 3.724 -8.599 4.994 1.00 0.00 C ATOM 0 H PHE A 143 7.096 -10.707 3.061 1.00 0.00 H new ATOM 0 HA PHE A 143 7.120 -10.201 0.168 1.00 0.00 H new ATOM 0 HB2 PHE A 143 5.467 -8.319 0.579 1.00 0.00 H new ATOM 0 HB3 PHE A 143 4.794 -9.937 0.560 1.00 0.00 H new ATOM 0 HD1 PHE A 143 5.595 -7.039 2.668 1.00 0.00 H new ATOM 0 HD2 PHE A 143 3.938 -10.966 2.611 1.00 0.00 H new ATOM 0 HE1 PHE A 143 4.608 -6.657 4.885 1.00 0.00 H new ATOM 0 HE2 PHE A 143 2.950 -10.581 4.826 1.00 0.00 H new ATOM 0 HZ PHE A 143 3.296 -8.433 5.972 1.00 0.00 H new ATOM 2264 N TYR A 144 7.815 -7.629 0.975 1.00 0.00 N ATOM 2265 CA TYR A 144 8.739 -6.558 1.310 1.00 0.00 C ATOM 2266 C TYR A 144 7.996 -5.353 1.863 1.00 0.00 C ATOM 2267 O TYR A 144 6.941 -4.970 1.347 1.00 0.00 O ATOM 2268 CB TYR A 144 9.545 -6.132 0.084 1.00 0.00 C ATOM 2269 CG TYR A 144 10.455 -7.203 -0.473 1.00 0.00 C ATOM 2270 CD1 TYR A 144 11.624 -7.563 0.185 1.00 0.00 C ATOM 2271 CD2 TYR A 144 10.153 -7.838 -1.670 1.00 0.00 C ATOM 2272 CE1 TYR A 144 12.465 -8.528 -0.335 1.00 0.00 C ATOM 2273 CE2 TYR A 144 10.991 -8.799 -2.199 1.00 0.00 C ATOM 2274 CZ TYR A 144 12.145 -9.141 -1.528 1.00 0.00 C ATOM 2275 OH TYR A 144 12.984 -10.090 -2.059 1.00 0.00 O ATOM 0 H TYR A 144 7.141 -7.397 0.246 1.00 0.00 H new ATOM 0 HA TYR A 144 9.419 -6.939 2.072 1.00 0.00 H new ATOM 0 HB2 TYR A 144 8.854 -5.818 -0.698 1.00 0.00 H new ATOM 0 HB3 TYR A 144 10.147 -5.262 0.345 1.00 0.00 H new ATOM 0 HD1 TYR A 144 11.879 -7.081 1.117 1.00 0.00 H new ATOM 0 HD2 TYR A 144 9.247 -7.576 -2.196 1.00 0.00 H new ATOM 0 HE1 TYR A 144 13.368 -8.801 0.190 1.00 0.00 H new ATOM 0 HE2 TYR A 144 10.744 -9.280 -3.134 1.00 0.00 H new ATOM 0 HH TYR A 144 13.467 -9.710 -2.822 1.00 0.00 H new ATOM 2285 N GLU A 145 8.542 -4.763 2.916 1.00 0.00 N ATOM 2286 CA GLU A 145 8.005 -3.526 3.455 1.00 0.00 C ATOM 2287 C GLU A 145 9.131 -2.513 3.640 1.00 0.00 C ATOM 2288 O GLU A 145 10.312 -2.869 3.625 1.00 0.00 O ATOM 2289 CB GLU A 145 7.275 -3.755 4.790 1.00 0.00 C ATOM 2290 CG GLU A 145 8.203 -3.950 5.981 1.00 0.00 C ATOM 2291 CD GLU A 145 7.468 -3.976 7.311 1.00 0.00 C ATOM 2292 OE1 GLU A 145 6.270 -3.628 7.349 1.00 0.00 O ATOM 2293 OE2 GLU A 145 8.095 -4.328 8.334 1.00 0.00 O ATOM 0 H GLU A 145 9.357 -5.122 3.413 1.00 0.00 H new ATOM 0 HA GLU A 145 7.276 -3.138 2.744 1.00 0.00 H new ATOM 0 HB2 GLU A 145 6.624 -2.903 4.986 1.00 0.00 H new ATOM 0 HB3 GLU A 145 6.634 -4.631 4.695 1.00 0.00 H new ATOM 0 HG2 GLU A 145 8.752 -4.884 5.858 1.00 0.00 H new ATOM 0 HG3 GLU A 145 8.940 -3.147 5.995 1.00 0.00 H new ATOM 2300 N TYR A 146 8.762 -1.256 3.774 1.00 0.00 N ATOM 2301 CA TYR A 146 9.711 -0.198 4.070 1.00 0.00 C ATOM 2302 C TYR A 146 9.078 0.802 5.018 1.00 0.00 C ATOM 2303 O TYR A 146 8.009 1.345 4.737 1.00 0.00 O ATOM 2304 CB TYR A 146 10.176 0.506 2.788 1.00 0.00 C ATOM 2305 CG TYR A 146 11.032 1.728 3.051 1.00 0.00 C ATOM 2306 CD1 TYR A 146 12.236 1.621 3.735 1.00 0.00 C ATOM 2307 CD2 TYR A 146 10.626 2.989 2.629 1.00 0.00 C ATOM 2308 CE1 TYR A 146 13.014 2.734 3.991 1.00 0.00 C ATOM 2309 CE2 TYR A 146 11.400 4.109 2.879 1.00 0.00 C ATOM 2310 CZ TYR A 146 12.593 3.977 3.561 1.00 0.00 C ATOM 2311 OH TYR A 146 13.368 5.092 3.818 1.00 0.00 O ATOM 0 H TYR A 146 7.798 -0.937 3.681 1.00 0.00 H new ATOM 0 HA TYR A 146 10.587 -0.642 4.542 1.00 0.00 H new ATOM 0 HB2 TYR A 146 10.740 -0.200 2.179 1.00 0.00 H new ATOM 0 HB3 TYR A 146 9.302 0.801 2.207 1.00 0.00 H new ATOM 0 HD1 TYR A 146 12.570 0.651 4.073 1.00 0.00 H new ATOM 0 HD2 TYR A 146 9.692 3.096 2.098 1.00 0.00 H new ATOM 0 HE1 TYR A 146 13.947 2.632 4.525 1.00 0.00 H new ATOM 0 HE2 TYR A 146 11.072 5.081 2.542 1.00 0.00 H new ATOM 0 HH TYR A 146 12.930 5.887 3.448 1.00 0.00 H new ATOM 2321 N ILE A 147 9.727 1.035 6.144 1.00 0.00 N ATOM 2322 CA ILE A 147 9.199 1.964 7.124 1.00 0.00 C ATOM 2323 C ILE A 147 9.801 3.340 6.895 1.00 0.00 C ATOM 2324 O ILE A 147 10.936 3.610 7.287 1.00 0.00 O ATOM 2325 CB ILE A 147 9.452 1.520 8.591 1.00 0.00 C ATOM 2326 CG1 ILE A 147 8.626 0.279 8.948 1.00 0.00 C ATOM 2327 CG2 ILE A 147 9.122 2.652 9.560 1.00 0.00 C ATOM 2328 CD1 ILE A 147 9.092 -0.998 8.285 1.00 0.00 C ATOM 0 H ILE A 147 10.612 0.598 6.401 1.00 0.00 H new ATOM 0 HA ILE A 147 8.118 1.988 6.986 1.00 0.00 H new ATOM 0 HB ILE A 147 10.509 1.269 8.679 1.00 0.00 H new ATOM 0 HG12 ILE A 147 8.649 0.141 10.029 1.00 0.00 H new ATOM 0 HG13 ILE A 147 7.587 0.458 8.672 1.00 0.00 H new ATOM 0 HG21 ILE A 147 9.306 2.321 10.582 1.00 0.00 H new ATOM 0 HG22 ILE A 147 9.751 3.515 9.339 1.00 0.00 H new ATOM 0 HG23 ILE A 147 8.074 2.930 9.452 1.00 0.00 H new ATOM 0 HD11 ILE A 147 8.451 -1.823 8.594 1.00 0.00 H new ATOM 0 HD12 ILE A 147 9.041 -0.885 7.202 1.00 0.00 H new ATOM 0 HD13 ILE A 147 10.120 -1.207 8.580 1.00 0.00 H new ATOM 2340 N ALA A 148 9.050 4.190 6.219 1.00 0.00 N ATOM 2341 CA ALA A 148 9.475 5.555 5.994 1.00 0.00 C ATOM 2342 C ALA A 148 9.051 6.420 7.165 1.00 0.00 C ATOM 2343 O ALA A 148 7.861 6.674 7.367 1.00 0.00 O ATOM 2344 CB ALA A 148 8.902 6.088 4.698 1.00 0.00 C ATOM 0 H ALA A 148 8.142 3.957 5.817 1.00 0.00 H new ATOM 0 HA ALA A 148 10.562 5.579 5.912 1.00 0.00 H new ATOM 0 HB1 ALA A 148 9.234 7.115 4.549 1.00 0.00 H new ATOM 0 HB2 ALA A 148 9.245 5.471 3.867 1.00 0.00 H new ATOM 0 HB3 ALA A 148 7.813 6.062 4.743 1.00 0.00 H new ATOM 2350 N GLU A 149 10.018 6.837 7.960 1.00 0.00 N ATOM 2351 CA GLU A 149 9.735 7.658 9.119 1.00 0.00 C ATOM 2352 C GLU A 149 9.417 9.086 8.699 1.00 0.00 C ATOM 2353 O GLU A 149 9.666 9.486 7.559 1.00 0.00 O ATOM 2354 CB GLU A 149 10.925 7.657 10.077 1.00 0.00 C ATOM 2355 CG GLU A 149 12.165 8.323 9.507 1.00 0.00 C ATOM 2356 CD GLU A 149 13.298 8.392 10.506 1.00 0.00 C ATOM 2357 OE1 GLU A 149 13.975 7.366 10.717 1.00 0.00 O ATOM 2358 OE2 GLU A 149 13.520 9.472 11.084 1.00 0.00 O ATOM 0 H GLU A 149 11.005 6.620 7.824 1.00 0.00 H new ATOM 0 HA GLU A 149 8.868 7.238 9.628 1.00 0.00 H new ATOM 0 HB2 GLU A 149 10.640 8.166 10.998 1.00 0.00 H new ATOM 0 HB3 GLU A 149 11.165 6.628 10.343 1.00 0.00 H new ATOM 0 HG2 GLU A 149 12.495 7.774 8.625 1.00 0.00 H new ATOM 0 HG3 GLU A 149 11.913 9.331 9.178 1.00 0.00 H new