USER MOD reduce.3.24.130724 H: found=0, std=0, add=769, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 768 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 Single : A 42 HIS :FLIP no HD1:sc= -1.14 F(o=-2.8!,f=-1.1) USER MOD Single : A 43 ASN : amide:sc= -0.0122 K(o=-0.012,f=-1.9!) USER MOD Single : A 47 SER OG : rot 180:sc= 0.00228 USER MOD Single : A 55 SER OG : rot 28:sc= 0.556 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= -0.0629 X(o=-0.063,f=-0.0099) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 66:sc= 0.417 USER MOD Single : A 75 SER OG : rot -46:sc= 0.372 USER MOD Single : A 85 LYS NZ :NH3+ -152:sc= -5.57! (180deg=-6.79!) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 140:sc= -0.506 USER MOD Single : A 99 CYS SG : rot 180:sc= 0.161 USER MOD Single : A 100 HIS : no HE2:sc= 0.591 K(o=0.59,f=-4.1!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= -0.0159 USER MOD Single : A 106 GLN : amide:sc= -3.96! C(o=-4!,f=-4.8!) USER MOD Single : A 107 GLN : amide:sc= -0.46 K(o=-0.46,f=-2) USER MOD Single : A 109 GLN : amide:sc= -0.481 K(o=-0.48,f=-3.3!) USER MOD Single : A 112 THR OG1 : rot -160:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 161:sc= -1.75! (180deg=-2.54!) USER MOD Single : A 119 GLN :FLIP amide:sc= -4.22 F(o=-7.3!,f=-4.2) USER MOD Single : A 120 SER OG : rot 17:sc= -0.102 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot -56:sc= 0.706 USER MOD Single : A 137 GLN :FLIP amide:sc= -6! C(o=-12!,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 265 N ALA A 39 18.301 5.865 -1.330 1.00 0.00 N ATOM 266 CA ALA A 39 18.056 5.381 0.064 1.00 0.00 C ATOM 267 C ALA A 39 17.143 6.369 0.792 1.00 0.00 C ATOM 268 O ALA A 39 17.575 7.408 1.250 1.00 0.00 O ATOM 269 CB ALA A 39 19.391 5.281 0.803 1.00 0.00 C ATOM 0 HA ALA A 39 17.579 4.401 0.034 1.00 0.00 H new ATOM 0 HB1 ALA A 39 19.218 4.929 1.820 1.00 0.00 H new ATOM 0 HB2 ALA A 39 20.044 4.580 0.282 1.00 0.00 H new ATOM 0 HB3 ALA A 39 19.864 6.263 0.835 1.00 0.00 H new ATOM 275 N ALA A 40 15.878 6.056 0.898 1.00 0.00 N ATOM 276 CA ALA A 40 14.925 6.976 1.591 1.00 0.00 C ATOM 277 C ALA A 40 13.845 6.153 2.307 1.00 0.00 C ATOM 278 O ALA A 40 13.895 4.936 2.348 1.00 0.00 O ATOM 279 CB ALA A 40 14.285 7.909 0.552 1.00 0.00 C ATOM 0 H ALA A 40 15.461 5.199 0.533 1.00 0.00 H new ATOM 0 HA ALA A 40 15.456 7.574 2.332 1.00 0.00 H new ATOM 0 HB1 ALA A 40 13.588 8.584 1.049 1.00 0.00 H new ATOM 0 HB2 ALA A 40 15.063 8.491 0.057 1.00 0.00 H new ATOM 0 HB3 ALA A 40 13.749 7.316 -0.189 1.00 0.00 H new ATOM 285 N VAL A 41 12.876 6.815 2.881 1.00 0.00 N ATOM 286 CA VAL A 41 11.788 6.090 3.603 1.00 0.00 C ATOM 287 C VAL A 41 10.833 5.469 2.581 1.00 0.00 C ATOM 288 O VAL A 41 10.567 6.034 1.539 1.00 0.00 O ATOM 289 CB VAL A 41 11.018 7.077 4.489 1.00 0.00 C ATOM 290 CG1 VAL A 41 9.866 6.360 5.199 1.00 0.00 C ATOM 291 CG2 VAL A 41 11.962 7.671 5.539 1.00 0.00 C ATOM 0 H VAL A 41 12.790 7.831 2.881 1.00 0.00 H new ATOM 0 HA VAL A 41 12.219 5.306 4.225 1.00 0.00 H new ATOM 0 HB VAL A 41 10.616 7.872 3.861 1.00 0.00 H new ATOM 0 HG11 VAL A 41 9.326 7.070 5.825 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.186 5.941 4.457 1.00 0.00 H new ATOM 0 HG13 VAL A 41 10.264 5.558 5.820 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.412 8.372 6.167 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.368 6.871 6.158 1.00 0.00 H new ATOM 0 HG23 VAL A 41 12.778 8.194 5.040 1.00 0.00 H new ATOM 301 N HIS A 42 10.325 4.304 2.870 1.00 0.00 N ATOM 302 CA HIS A 42 9.393 3.626 1.920 1.00 0.00 C ATOM 303 C HIS A 42 8.429 2.724 2.699 1.00 0.00 C ATOM 304 O HIS A 42 8.805 2.079 3.658 1.00 0.00 O ATOM 305 CB HIS A 42 10.211 2.750 0.959 1.00 0.00 C ATOM 306 CG HIS A 42 10.750 3.572 -0.180 1.00 0.00 C ATOM 307 ND1 HIS A 42 11.757 4.501 -0.250 1.00 0.00 N flip ATOM 308 CD2 HIS A 42 10.249 3.460 -1.466 1.00 0.00 C flip ATOM 309 CE1 HIS A 42 11.882 4.960 -1.557 1.00 0.00 C flip ATOM 310 NE2 HIS A 42 10.950 4.299 -2.249 1.00 0.00 N flip ATOM 0 H HIS A 42 10.515 3.787 3.729 1.00 0.00 H new ATOM 0 HA HIS A 42 8.830 4.378 1.367 1.00 0.00 H new ATOM 0 HB2 HIS A 42 11.035 2.281 1.498 1.00 0.00 H new ATOM 0 HB3 HIS A 42 9.586 1.946 0.570 1.00 0.00 H new ATOM 0 HD2 HIS A 42 9.442 2.816 -1.783 1.00 0.00 H new ATOM 0 HE1 HIS A 42 12.582 5.693 -1.932 1.00 0.00 H new ATOM 0 HE2 HIS A 42 10.790 4.416 -3.249 1.00 0.00 H new ATOM 318 N ASN A 43 7.198 2.649 2.273 1.00 0.00 N ATOM 319 CA ASN A 43 6.225 1.761 2.964 1.00 0.00 C ATOM 320 C ASN A 43 6.416 0.338 2.437 1.00 0.00 C ATOM 321 O ASN A 43 5.893 -0.025 1.403 1.00 0.00 O ATOM 322 CB ASN A 43 4.804 2.232 2.657 1.00 0.00 C ATOM 323 CG ASN A 43 4.546 3.558 3.369 1.00 0.00 C ATOM 324 OD1 ASN A 43 5.343 3.993 4.176 1.00 0.00 O ATOM 325 ND2 ASN A 43 3.459 4.225 3.103 1.00 0.00 N ATOM 0 H ASN A 43 6.825 3.165 1.476 1.00 0.00 H new ATOM 0 HA ASN A 43 6.386 1.788 4.042 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.673 2.352 1.582 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.082 1.484 2.984 1.00 0.00 H new ATOM 0 HD21 ASN A 43 3.277 5.112 3.572 1.00 0.00 H new ATOM 0 HD22 ASN A 43 2.790 3.860 2.425 1.00 0.00 H new ATOM 332 N VAL A 44 7.175 -0.470 3.131 1.00 0.00 N ATOM 333 CA VAL A 44 7.413 -1.870 2.654 1.00 0.00 C ATOM 334 C VAL A 44 6.319 -2.798 3.238 1.00 0.00 C ATOM 335 O VAL A 44 6.129 -2.828 4.438 1.00 0.00 O ATOM 336 CB VAL A 44 8.818 -2.324 3.105 1.00 0.00 C ATOM 337 CG1 VAL A 44 8.817 -2.723 4.581 1.00 0.00 C ATOM 338 CG2 VAL A 44 9.271 -3.525 2.269 1.00 0.00 C ATOM 0 H VAL A 44 7.640 -0.224 4.005 1.00 0.00 H new ATOM 0 HA VAL A 44 7.364 -1.916 1.566 1.00 0.00 H new ATOM 0 HB VAL A 44 9.503 -1.488 2.963 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.819 -3.039 4.873 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.514 -1.870 5.188 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.118 -3.545 4.735 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.263 -3.840 2.593 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.568 -4.347 2.402 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.305 -3.244 1.216 1.00 0.00 H new ATOM 348 N PRO A 45 5.587 -3.545 2.420 1.00 0.00 N ATOM 349 CA PRO A 45 4.509 -4.451 2.932 1.00 0.00 C ATOM 350 C PRO A 45 4.955 -5.332 4.104 1.00 0.00 C ATOM 351 O PRO A 45 6.052 -5.851 4.129 1.00 0.00 O ATOM 352 CB PRO A 45 4.156 -5.324 1.720 1.00 0.00 C ATOM 353 CG PRO A 45 4.488 -4.486 0.530 1.00 0.00 C ATOM 354 CD PRO A 45 5.682 -3.616 0.938 1.00 0.00 C ATOM 0 HA PRO A 45 3.672 -3.873 3.325 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.729 -6.252 1.722 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.102 -5.600 1.726 1.00 0.00 H new ATOM 0 HG2 PRO A 45 4.737 -5.110 -0.328 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.638 -3.869 0.240 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.626 -4.059 0.620 1.00 0.00 H new ATOM 0 HD3 PRO A 45 5.626 -2.625 0.487 1.00 0.00 H new ATOM 362 N LEU A 46 4.094 -5.512 5.069 1.00 0.00 N ATOM 363 CA LEU A 46 4.445 -6.370 6.234 1.00 0.00 C ATOM 364 C LEU A 46 4.596 -7.817 5.768 1.00 0.00 C ATOM 365 O LEU A 46 5.352 -8.592 6.320 1.00 0.00 O ATOM 366 CB LEU A 46 3.310 -6.330 7.260 1.00 0.00 C ATOM 367 CG LEU A 46 3.114 -4.901 7.821 1.00 0.00 C ATOM 368 CD1 LEU A 46 1.634 -4.676 8.123 1.00 0.00 C ATOM 369 CD2 LEU A 46 3.913 -4.706 9.116 1.00 0.00 C ATOM 0 H LEU A 46 3.161 -5.100 5.100 1.00 0.00 H new ATOM 0 HA LEU A 46 5.373 -6.006 6.675 1.00 0.00 H new ATOM 0 HB2 LEU A 46 2.385 -6.672 6.796 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.530 -7.017 8.077 1.00 0.00 H new ATOM 0 HG LEU A 46 3.467 -4.189 7.075 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.492 -3.670 8.518 1.00 0.00 H new ATOM 0 HD12 LEU A 46 1.054 -4.791 7.207 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.298 -5.406 8.859 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.758 -3.694 9.490 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.576 -5.424 9.863 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.973 -4.861 8.916 1.00 0.00 H new ATOM 381 N SER A 47 3.838 -8.185 4.780 1.00 0.00 N ATOM 382 CA SER A 47 3.865 -9.589 4.276 1.00 0.00 C ATOM 383 C SER A 47 5.241 -9.982 3.719 1.00 0.00 C ATOM 384 O SER A 47 5.585 -11.148 3.708 1.00 0.00 O ATOM 385 CB SER A 47 2.817 -9.731 3.172 1.00 0.00 C ATOM 386 OG SER A 47 2.953 -8.660 2.250 1.00 0.00 O ATOM 0 H SER A 47 3.190 -7.567 4.290 1.00 0.00 H new ATOM 0 HA SER A 47 3.649 -10.253 5.113 1.00 0.00 H new ATOM 0 HB2 SER A 47 2.941 -10.685 2.659 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.816 -9.729 3.603 1.00 0.00 H new ATOM 0 HG SER A 47 2.283 -8.751 1.541 1.00 0.00 H new ATOM 392 N VAL A 48 6.023 -9.046 3.232 1.00 0.00 N ATOM 393 CA VAL A 48 7.361 -9.410 2.649 1.00 0.00 C ATOM 394 C VAL A 48 8.505 -9.075 3.616 1.00 0.00 C ATOM 395 O VAL A 48 9.630 -8.878 3.202 1.00 0.00 O ATOM 396 CB VAL A 48 7.566 -8.662 1.323 1.00 0.00 C ATOM 397 CG1 VAL A 48 6.333 -8.843 0.435 1.00 0.00 C ATOM 398 CG2 VAL A 48 7.801 -7.169 1.574 1.00 0.00 C ATOM 0 H VAL A 48 5.797 -8.052 3.212 1.00 0.00 H new ATOM 0 HA VAL A 48 7.373 -10.486 2.474 1.00 0.00 H new ATOM 0 HB VAL A 48 8.443 -9.074 0.824 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.481 -8.312 -0.505 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.183 -9.903 0.233 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.456 -8.443 0.944 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.944 -6.658 0.622 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.937 -6.746 2.087 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.689 -7.039 2.192 1.00 0.00 H new ATOM 408 N LEU A 49 8.250 -9.037 4.900 1.00 0.00 N ATOM 409 CA LEU A 49 9.348 -8.746 5.867 1.00 0.00 C ATOM 410 C LEU A 49 9.992 -10.068 6.282 1.00 0.00 C ATOM 411 O LEU A 49 9.317 -11.052 6.514 1.00 0.00 O ATOM 412 CB LEU A 49 8.787 -8.060 7.118 1.00 0.00 C ATOM 413 CG LEU A 49 8.305 -6.636 6.803 1.00 0.00 C ATOM 414 CD1 LEU A 49 7.755 -6.017 8.093 1.00 0.00 C ATOM 415 CD2 LEU A 49 9.464 -5.771 6.269 1.00 0.00 C ATOM 0 H LEU A 49 7.333 -9.194 5.317 1.00 0.00 H new ATOM 0 HA LEU A 49 10.078 -8.088 5.395 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.960 -8.647 7.517 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.555 -8.024 7.891 1.00 0.00 H new ATOM 0 HG LEU A 49 7.531 -6.677 6.036 1.00 0.00 H new ATOM 0 HD11 LEU A 49 7.407 -5.004 7.891 1.00 0.00 H new ATOM 0 HD12 LEU A 49 6.924 -6.620 8.460 1.00 0.00 H new ATOM 0 HD13 LEU A 49 8.542 -5.987 8.846 1.00 0.00 H new ATOM 0 HD21 LEU A 49 9.099 -4.767 6.053 1.00 0.00 H new ATOM 0 HD22 LEU A 49 10.253 -5.717 7.019 1.00 0.00 H new ATOM 0 HD23 LEU A 49 9.861 -6.217 5.357 1.00 0.00 H new ATOM 427 N ILE A 50 11.295 -10.097 6.374 1.00 0.00 N ATOM 428 CA ILE A 50 12.009 -11.352 6.771 1.00 0.00 C ATOM 429 C ILE A 50 12.518 -11.228 8.207 1.00 0.00 C ATOM 430 O ILE A 50 13.346 -10.390 8.516 1.00 0.00 O ATOM 431 CB ILE A 50 13.190 -11.569 5.830 1.00 0.00 C ATOM 432 CG1 ILE A 50 12.668 -11.666 4.397 1.00 0.00 C ATOM 433 CG2 ILE A 50 13.912 -12.866 6.201 1.00 0.00 C ATOM 434 CD1 ILE A 50 13.841 -11.660 3.417 1.00 0.00 C ATOM 0 H ILE A 50 11.903 -9.299 6.190 1.00 0.00 H new ATOM 0 HA ILE A 50 11.323 -12.197 6.708 1.00 0.00 H new ATOM 0 HB ILE A 50 13.888 -10.736 5.915 1.00 0.00 H new ATOM 0 HG12 ILE A 50 12.084 -12.578 4.274 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.001 -10.830 4.186 1.00 0.00 H new ATOM 0 HG21 ILE A 50 14.755 -13.019 5.527 1.00 0.00 H new ATOM 0 HG22 ILE A 50 14.275 -12.800 7.227 1.00 0.00 H new ATOM 0 HG23 ILE A 50 13.221 -13.705 6.114 1.00 0.00 H new ATOM 0 HD11 ILE A 50 13.463 -11.729 2.397 1.00 0.00 H new ATOM 0 HD12 ILE A 50 14.407 -10.736 3.532 1.00 0.00 H new ATOM 0 HD13 ILE A 50 14.491 -12.511 3.622 1.00 0.00 H new ATOM 446 N ARG A 51 12.023 -12.063 9.088 1.00 0.00 N ATOM 447 CA ARG A 51 12.458 -12.021 10.518 1.00 0.00 C ATOM 448 C ARG A 51 12.770 -13.443 11.015 1.00 0.00 C ATOM 449 O ARG A 51 11.883 -14.153 11.445 1.00 0.00 O ATOM 450 CB ARG A 51 11.309 -11.454 11.357 1.00 0.00 C ATOM 451 CG ARG A 51 11.227 -9.946 11.149 1.00 0.00 C ATOM 452 CD ARG A 51 10.116 -9.367 12.027 1.00 0.00 C ATOM 453 NE ARG A 51 10.148 -7.879 11.950 1.00 0.00 N ATOM 454 CZ ARG A 51 11.034 -7.209 12.635 1.00 0.00 C ATOM 455 NH1 ARG A 51 11.893 -7.842 13.387 1.00 0.00 N ATOM 456 NH2 ARG A 51 11.062 -5.906 12.568 1.00 0.00 N ATOM 0 H ARG A 51 11.329 -12.779 8.874 1.00 0.00 H new ATOM 0 HA ARG A 51 13.350 -11.401 10.609 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.368 -11.924 11.070 1.00 0.00 H new ATOM 0 HB3 ARG A 51 11.469 -11.679 12.412 1.00 0.00 H new ATOM 0 HG2 ARG A 51 12.181 -9.482 11.399 1.00 0.00 H new ATOM 0 HG3 ARG A 51 11.029 -9.723 10.100 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.146 -9.738 11.697 1.00 0.00 H new ATOM 0 HD3 ARG A 51 10.247 -9.692 13.059 1.00 0.00 H new ATOM 0 HE ARG A 51 9.477 -7.384 11.362 1.00 0.00 H new ATOM 0 HH11 ARG A 51 11.872 -8.860 13.439 1.00 0.00 H new ATOM 0 HH12 ARG A 51 12.585 -7.318 13.922 1.00 0.00 H new ATOM 0 HH21 ARG A 51 10.391 -5.411 11.980 1.00 0.00 H new ATOM 0 HH22 ARG A 51 11.755 -5.383 13.104 1.00 0.00 H new ATOM 470 N PRO A 52 14.017 -13.850 10.994 1.00 0.00 N ATOM 471 CA PRO A 52 14.439 -15.186 11.484 1.00 0.00 C ATOM 472 C PRO A 52 14.959 -15.119 12.924 1.00 0.00 C ATOM 473 O PRO A 52 15.812 -15.889 13.320 1.00 0.00 O ATOM 474 CB PRO A 52 15.576 -15.518 10.529 1.00 0.00 C ATOM 475 CG PRO A 52 16.264 -14.199 10.314 1.00 0.00 C ATOM 476 CD PRO A 52 15.183 -13.106 10.480 1.00 0.00 C ATOM 0 HA PRO A 52 13.631 -15.917 11.502 1.00 0.00 H new ATOM 0 HB2 PRO A 52 16.254 -16.257 10.956 1.00 0.00 H new ATOM 0 HB3 PRO A 52 15.203 -15.932 9.592 1.00 0.00 H new ATOM 0 HG2 PRO A 52 17.070 -14.060 11.035 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.713 -14.153 9.322 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.501 -12.329 11.175 1.00 0.00 H new ATOM 0 HD3 PRO A 52 14.960 -12.615 9.533 1.00 0.00 H new ATOM 484 N LEU A 53 14.476 -14.180 13.700 1.00 0.00 N ATOM 485 CA LEU A 53 14.964 -14.028 15.108 1.00 0.00 C ATOM 486 C LEU A 53 13.771 -13.693 16.034 1.00 0.00 C ATOM 487 O LEU A 53 13.283 -12.580 16.013 1.00 0.00 O ATOM 488 CB LEU A 53 15.979 -12.864 15.114 1.00 0.00 C ATOM 489 CG LEU A 53 17.002 -13.006 16.260 1.00 0.00 C ATOM 490 CD1 LEU A 53 18.245 -12.172 15.932 1.00 0.00 C ATOM 491 CD2 LEU A 53 16.393 -12.494 17.569 1.00 0.00 C ATOM 0 H LEU A 53 13.761 -13.509 13.418 1.00 0.00 H new ATOM 0 HA LEU A 53 15.429 -14.947 15.465 1.00 0.00 H new ATOM 0 HB2 LEU A 53 16.504 -12.834 14.159 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.447 -11.918 15.216 1.00 0.00 H new ATOM 0 HG LEU A 53 17.272 -14.056 16.371 1.00 0.00 H new ATOM 0 HD11 LEU A 53 18.971 -12.269 16.739 1.00 0.00 H new ATOM 0 HD12 LEU A 53 18.687 -12.528 15.001 1.00 0.00 H new ATOM 0 HD13 LEU A 53 17.962 -11.125 15.822 1.00 0.00 H new ATOM 0 HD21 LEU A 53 17.121 -12.597 18.374 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.121 -11.444 17.458 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.503 -13.076 17.808 1.00 0.00 H new ATOM 503 N PRO A 54 13.287 -14.627 16.840 1.00 0.00 N ATOM 504 CA PRO A 54 12.131 -14.353 17.748 1.00 0.00 C ATOM 505 C PRO A 54 12.542 -13.512 18.965 1.00 0.00 C ATOM 506 O PRO A 54 13.711 -13.360 19.258 1.00 0.00 O ATOM 507 CB PRO A 54 11.661 -15.750 18.168 1.00 0.00 C ATOM 508 CG PRO A 54 12.891 -16.599 18.114 1.00 0.00 C ATOM 509 CD PRO A 54 13.767 -16.024 16.990 1.00 0.00 C ATOM 0 HA PRO A 54 11.350 -13.771 17.259 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.232 -15.738 19.170 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.890 -16.127 17.496 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.419 -16.578 19.067 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.636 -17.640 17.914 1.00 0.00 H new ATOM 0 HD2 PRO A 54 14.825 -16.057 17.252 1.00 0.00 H new ATOM 0 HD3 PRO A 54 13.650 -16.588 16.065 1.00 0.00 H new ATOM 517 N SER A 55 11.593 -12.958 19.673 1.00 0.00 N ATOM 518 CA SER A 55 11.941 -12.122 20.861 1.00 0.00 C ATOM 519 C SER A 55 10.782 -12.127 21.861 1.00 0.00 C ATOM 520 O SER A 55 9.680 -12.540 21.557 1.00 0.00 O ATOM 521 CB SER A 55 12.210 -10.684 20.399 1.00 0.00 C ATOM 522 OG SER A 55 13.565 -10.565 19.989 1.00 0.00 O ATOM 0 H SER A 55 10.595 -13.047 19.481 1.00 0.00 H new ATOM 0 HA SER A 55 12.829 -12.530 21.344 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.545 -10.425 19.575 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.001 -9.985 21.209 1.00 0.00 H new ATOM 0 HG SER A 55 13.889 -11.434 19.673 1.00 0.00 H new ATOM 528 N VAL A 56 11.027 -11.647 23.052 1.00 0.00 N ATOM 529 CA VAL A 56 9.953 -11.591 24.086 1.00 0.00 C ATOM 530 C VAL A 56 9.322 -10.200 24.053 1.00 0.00 C ATOM 531 O VAL A 56 9.934 -9.220 24.428 1.00 0.00 O ATOM 532 CB VAL A 56 10.560 -11.845 25.468 1.00 0.00 C ATOM 533 CG1 VAL A 56 9.467 -11.733 26.533 1.00 0.00 C ATOM 534 CG2 VAL A 56 11.170 -13.247 25.508 1.00 0.00 C ATOM 0 H VAL A 56 11.933 -11.289 23.354 1.00 0.00 H new ATOM 0 HA VAL A 56 9.198 -12.350 23.884 1.00 0.00 H new ATOM 0 HB VAL A 56 11.337 -11.106 25.665 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.898 -11.914 27.518 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.033 -10.734 26.505 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.690 -12.472 26.336 1.00 0.00 H new ATOM 0 HG21 VAL A 56 11.602 -13.428 26.492 1.00 0.00 H new ATOM 0 HG22 VAL A 56 10.394 -13.987 25.311 1.00 0.00 H new ATOM 0 HG23 VAL A 56 11.949 -13.327 24.750 1.00 0.00 H new ATOM 544 N LEU A 57 8.107 -10.103 23.588 1.00 0.00 N ATOM 545 CA LEU A 57 7.436 -8.775 23.505 1.00 0.00 C ATOM 546 C LEU A 57 6.708 -8.453 24.803 1.00 0.00 C ATOM 547 O LEU A 57 6.173 -9.313 25.474 1.00 0.00 O ATOM 548 CB LEU A 57 6.418 -8.782 22.374 1.00 0.00 C ATOM 549 CG LEU A 57 7.114 -9.112 21.047 1.00 0.00 C ATOM 550 CD1 LEU A 57 6.049 -9.306 19.962 1.00 0.00 C ATOM 551 CD2 LEU A 57 8.061 -7.967 20.649 1.00 0.00 C ATOM 0 H LEU A 57 7.547 -10.890 23.260 1.00 0.00 H new ATOM 0 HA LEU A 57 8.203 -8.022 23.324 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.639 -9.517 22.579 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.930 -7.810 22.307 1.00 0.00 H new ATOM 0 HG LEU A 57 7.698 -10.025 21.159 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.534 -9.541 19.014 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.387 -10.125 20.244 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.468 -8.390 19.855 1.00 0.00 H new ATOM 0 HD21 LEU A 57 8.550 -8.211 19.706 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.490 -7.046 20.534 1.00 0.00 H new ATOM 0 HD23 LEU A 57 8.815 -7.832 21.425 1.00 0.00 H new ATOM 563 N ASP A 58 6.677 -7.199 25.136 1.00 0.00 N ATOM 564 CA ASP A 58 5.980 -6.739 26.366 1.00 0.00 C ATOM 565 C ASP A 58 4.571 -6.254 25.957 1.00 0.00 C ATOM 566 O ASP A 58 4.437 -5.511 25.006 1.00 0.00 O ATOM 567 CB ASP A 58 6.796 -5.585 26.956 1.00 0.00 C ATOM 568 CG ASP A 58 5.955 -4.787 27.956 1.00 0.00 C ATOM 569 OD1 ASP A 58 4.977 -4.198 27.536 1.00 0.00 O ATOM 570 OD2 ASP A 58 6.306 -4.782 29.124 1.00 0.00 O ATOM 0 H ASP A 58 7.116 -6.454 24.595 1.00 0.00 H new ATOM 0 HA ASP A 58 5.886 -7.533 27.107 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.685 -5.977 27.451 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.139 -4.929 26.156 1.00 0.00 H new ATOM 575 N PRO A 59 3.523 -6.672 26.637 1.00 0.00 N ATOM 576 CA PRO A 59 2.129 -6.261 26.278 1.00 0.00 C ATOM 577 C PRO A 59 1.797 -4.822 26.699 1.00 0.00 C ATOM 578 O PRO A 59 0.836 -4.240 26.236 1.00 0.00 O ATOM 579 CB PRO A 59 1.259 -7.266 27.044 1.00 0.00 C ATOM 580 CG PRO A 59 2.064 -7.609 28.257 1.00 0.00 C ATOM 581 CD PRO A 59 3.532 -7.572 27.812 1.00 0.00 C ATOM 0 HA PRO A 59 1.972 -6.269 25.199 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.297 -6.832 27.316 1.00 0.00 H new ATOM 0 HB3 PRO A 59 1.051 -8.151 26.442 1.00 0.00 H new ATOM 0 HG2 PRO A 59 1.882 -6.896 29.061 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.796 -8.595 28.638 1.00 0.00 H new ATOM 0 HD2 PRO A 59 4.180 -7.192 28.602 1.00 0.00 H new ATOM 0 HD3 PRO A 59 3.896 -8.566 27.552 1.00 0.00 H new ATOM 589 N ALA A 60 2.572 -4.247 27.576 1.00 0.00 N ATOM 590 CA ALA A 60 2.289 -2.854 28.028 1.00 0.00 C ATOM 591 C ALA A 60 2.948 -1.850 27.076 1.00 0.00 C ATOM 592 O ALA A 60 2.363 -0.849 26.710 1.00 0.00 O ATOM 593 CB ALA A 60 2.844 -2.669 29.443 1.00 0.00 C ATOM 0 H ALA A 60 3.391 -4.682 28.001 1.00 0.00 H new ATOM 0 HA ALA A 60 1.213 -2.681 28.028 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.642 -1.653 29.783 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.365 -3.379 30.117 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.920 -2.843 29.437 1.00 0.00 H new ATOM 599 N LYS A 61 4.165 -2.104 26.682 1.00 0.00 N ATOM 600 CA LYS A 61 4.870 -1.166 25.770 1.00 0.00 C ATOM 601 C LYS A 61 4.230 -1.223 24.372 1.00 0.00 C ATOM 602 O LYS A 61 4.200 -0.240 23.658 1.00 0.00 O ATOM 603 CB LYS A 61 6.369 -1.555 25.709 1.00 0.00 C ATOM 604 CG LYS A 61 7.251 -0.309 25.840 1.00 0.00 C ATOM 605 CD LYS A 61 8.716 -0.682 25.586 1.00 0.00 C ATOM 606 CE LYS A 61 9.206 -1.654 26.667 1.00 0.00 C ATOM 607 NZ LYS A 61 10.694 -1.609 26.732 1.00 0.00 N ATOM 0 H LYS A 61 4.703 -2.926 26.955 1.00 0.00 H new ATOM 0 HA LYS A 61 4.785 -0.145 26.141 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.601 -2.258 26.509 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.582 -2.061 24.767 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.931 0.451 25.128 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.143 0.121 26.836 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.818 -1.139 24.602 1.00 0.00 H new ATOM 0 HD3 LYS A 61 9.334 0.216 25.586 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.780 -1.386 27.634 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.871 -2.666 26.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.030 -2.267 27.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.090 -1.885 25.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 11.002 -0.644 26.967 1.00 0.00 H new ATOM 621 N VAL A 62 3.718 -2.358 23.975 1.00 0.00 N ATOM 622 CA VAL A 62 3.086 -2.454 22.628 1.00 0.00 C ATOM 623 C VAL A 62 1.798 -1.626 22.618 1.00 0.00 C ATOM 624 O VAL A 62 1.454 -1.010 21.629 1.00 0.00 O ATOM 625 CB VAL A 62 2.760 -3.920 22.309 1.00 0.00 C ATOM 626 CG1 VAL A 62 1.898 -3.993 21.044 1.00 0.00 C ATOM 627 CG2 VAL A 62 4.059 -4.698 22.083 1.00 0.00 C ATOM 0 H VAL A 62 3.710 -3.218 24.523 1.00 0.00 H new ATOM 0 HA VAL A 62 3.774 -2.072 21.874 1.00 0.00 H new ATOM 0 HB VAL A 62 2.215 -4.356 23.146 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.668 -5.035 20.820 1.00 0.00 H new ATOM 0 HG12 VAL A 62 0.971 -3.443 21.203 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.441 -3.553 20.208 1.00 0.00 H new ATOM 0 HG21 VAL A 62 3.825 -5.738 21.857 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.606 -4.259 21.248 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.672 -4.651 22.983 1.00 0.00 H new ATOM 637 N GLN A 63 1.084 -1.603 23.710 1.00 0.00 N ATOM 638 CA GLN A 63 -0.176 -0.810 23.749 1.00 0.00 C ATOM 639 C GLN A 63 0.174 0.677 23.626 1.00 0.00 C ATOM 640 O GLN A 63 -0.512 1.435 22.970 1.00 0.00 O ATOM 641 CB GLN A 63 -0.918 -1.072 25.074 1.00 0.00 C ATOM 642 CG GLN A 63 -1.819 -2.315 24.947 1.00 0.00 C ATOM 643 CD GLN A 63 -3.159 -1.934 24.305 1.00 0.00 C ATOM 644 OE1 GLN A 63 -3.520 -2.458 23.269 1.00 0.00 O ATOM 645 NE2 GLN A 63 -3.917 -1.039 24.881 1.00 0.00 N ATOM 0 H GLN A 63 1.317 -2.096 24.572 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.825 -1.103 22.924 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -0.198 -1.218 25.879 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -1.521 -0.203 25.339 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -1.321 -3.074 24.344 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.990 -2.752 25.931 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -3.616 -0.599 25.750 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -4.810 -0.781 24.461 1.00 0.00 H new ATOM 654 N SER A 64 1.242 1.097 24.250 1.00 0.00 N ATOM 655 CA SER A 64 1.639 2.530 24.164 1.00 0.00 C ATOM 656 C SER A 64 1.929 2.887 22.705 1.00 0.00 C ATOM 657 O SER A 64 1.612 3.965 22.243 1.00 0.00 O ATOM 658 CB SER A 64 2.894 2.764 25.006 1.00 0.00 C ATOM 659 OG SER A 64 3.189 4.153 25.042 1.00 0.00 O ATOM 0 H SER A 64 1.855 0.509 24.815 1.00 0.00 H new ATOM 0 HA SER A 64 0.830 3.156 24.540 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.741 2.388 26.018 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.735 2.214 24.585 1.00 0.00 H new ATOM 0 HG SER A 64 3.992 4.303 25.583 1.00 0.00 H new ATOM 665 N LEU A 65 2.525 1.984 21.973 1.00 0.00 N ATOM 666 CA LEU A 65 2.831 2.261 20.545 1.00 0.00 C ATOM 667 C LEU A 65 1.522 2.212 19.748 1.00 0.00 C ATOM 668 O LEU A 65 1.232 3.087 18.957 1.00 0.00 O ATOM 669 CB LEU A 65 3.819 1.190 20.041 1.00 0.00 C ATOM 670 CG LEU A 65 5.273 1.692 20.192 1.00 0.00 C ATOM 671 CD1 LEU A 65 6.227 0.496 20.274 1.00 0.00 C ATOM 672 CD2 LEU A 65 5.654 2.567 18.990 1.00 0.00 C ATOM 0 H LEU A 65 2.813 1.064 22.306 1.00 0.00 H new ATOM 0 HA LEU A 65 3.283 3.245 20.422 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.685 0.267 20.605 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.613 0.958 18.996 1.00 0.00 H new ATOM 0 HG LEU A 65 5.350 2.283 21.105 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.251 0.854 20.380 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.966 -0.119 21.135 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.143 -0.099 19.365 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.680 2.916 19.105 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.570 1.983 18.074 1.00 0.00 H new ATOM 0 HD23 LEU A 65 4.983 3.424 18.937 1.00 0.00 H new ATOM 684 N VAL A 66 0.726 1.205 19.969 1.00 0.00 N ATOM 685 CA VAL A 66 -0.570 1.102 19.249 1.00 0.00 C ATOM 686 C VAL A 66 -1.364 2.388 19.502 1.00 0.00 C ATOM 687 O VAL A 66 -2.143 2.825 18.680 1.00 0.00 O ATOM 688 CB VAL A 66 -1.330 -0.116 19.799 1.00 0.00 C ATOM 689 CG1 VAL A 66 -2.818 -0.032 19.453 1.00 0.00 C ATOM 690 CG2 VAL A 66 -0.738 -1.395 19.203 1.00 0.00 C ATOM 0 H VAL A 66 0.919 0.445 20.621 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.420 0.978 18.176 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.228 -0.129 20.884 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.334 -0.905 19.853 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.243 0.872 19.889 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.939 -0.003 18.370 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.275 -2.260 19.592 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.831 -1.368 18.117 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.315 -1.470 19.475 1.00 0.00 H new ATOM 700 N ASP A 67 -1.160 2.994 20.639 1.00 0.00 N ATOM 701 CA ASP A 67 -1.888 4.256 20.964 1.00 0.00 C ATOM 702 C ASP A 67 -1.267 5.419 20.190 1.00 0.00 C ATOM 703 O ASP A 67 -1.953 6.303 19.718 1.00 0.00 O ATOM 704 CB ASP A 67 -1.775 4.533 22.469 1.00 0.00 C ATOM 705 CG ASP A 67 -2.881 5.499 22.903 1.00 0.00 C ATOM 706 OD1 ASP A 67 -4.031 5.229 22.596 1.00 0.00 O ATOM 707 OD2 ASP A 67 -2.560 6.491 23.536 1.00 0.00 O ATOM 0 H ASP A 67 -0.517 2.669 21.361 1.00 0.00 H new ATOM 0 HA ASP A 67 -2.937 4.152 20.686 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -1.855 3.600 23.027 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -0.798 4.958 22.697 1.00 0.00 H new ATOM 712 N THR A 68 0.030 5.428 20.067 1.00 0.00 N ATOM 713 CA THR A 68 0.705 6.535 19.335 1.00 0.00 C ATOM 714 C THR A 68 0.279 6.505 17.868 1.00 0.00 C ATOM 715 O THR A 68 -0.147 7.497 17.311 1.00 0.00 O ATOM 716 CB THR A 68 2.222 6.353 19.432 1.00 0.00 C ATOM 717 OG1 THR A 68 2.573 6.028 20.769 1.00 0.00 O ATOM 718 CG2 THR A 68 2.920 7.648 19.020 1.00 0.00 C ATOM 0 H THR A 68 0.654 4.714 20.443 1.00 0.00 H new ATOM 0 HA THR A 68 0.424 7.492 19.775 1.00 0.00 H new ATOM 0 HB THR A 68 2.535 5.548 18.768 1.00 0.00 H new ATOM 0 HG1 THR A 68 2.201 5.152 21.001 1.00 0.00 H new ATOM 0 HG21 THR A 68 4.000 7.517 19.089 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.650 7.896 17.994 1.00 0.00 H new ATOM 0 HG23 THR A 68 2.609 8.456 19.683 1.00 0.00 H new ATOM 726 N ILE A 69 0.389 5.369 17.241 1.00 0.00 N ATOM 727 CA ILE A 69 -0.009 5.260 15.811 1.00 0.00 C ATOM 728 C ILE A 69 -1.484 5.653 15.663 1.00 0.00 C ATOM 729 O ILE A 69 -1.868 6.317 14.721 1.00 0.00 O ATOM 730 CB ILE A 69 0.202 3.812 15.344 1.00 0.00 C ATOM 731 CG1 ILE A 69 1.664 3.411 15.608 1.00 0.00 C ATOM 732 CG2 ILE A 69 -0.105 3.699 13.843 1.00 0.00 C ATOM 733 CD1 ILE A 69 1.986 2.077 14.927 1.00 0.00 C ATOM 0 H ILE A 69 0.739 4.507 17.659 1.00 0.00 H new ATOM 0 HA ILE A 69 0.598 5.928 15.200 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.467 3.148 15.891 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.333 4.187 15.236 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.837 3.329 16.681 1.00 0.00 H new ATOM 0 HG21 ILE A 69 0.046 2.670 13.517 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.140 3.989 13.660 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.560 4.358 13.285 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.024 1.809 15.124 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.330 1.300 15.320 1.00 0.00 H new ATOM 0 HD13 ILE A 69 1.834 2.171 13.852 1.00 0.00 H new ATOM 745 N ARG A 70 -2.313 5.236 16.580 1.00 0.00 N ATOM 746 CA ARG A 70 -3.767 5.570 16.491 1.00 0.00 C ATOM 747 C ARG A 70 -4.010 7.028 16.922 1.00 0.00 C ATOM 748 O ARG A 70 -4.917 7.677 16.440 1.00 0.00 O ATOM 749 CB ARG A 70 -4.558 4.610 17.407 1.00 0.00 C ATOM 750 CG ARG A 70 -5.023 3.384 16.612 1.00 0.00 C ATOM 751 CD ARG A 70 -5.690 2.384 17.560 1.00 0.00 C ATOM 752 NE ARG A 70 -6.278 1.266 16.769 1.00 0.00 N ATOM 753 CZ ARG A 70 -7.414 1.432 16.150 1.00 0.00 C ATOM 754 NH1 ARG A 70 -8.037 2.577 16.224 1.00 0.00 N ATOM 755 NH2 ARG A 70 -7.929 0.453 15.458 1.00 0.00 N ATOM 0 H ARG A 70 -2.047 4.676 17.390 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.102 5.457 15.460 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -3.933 4.295 18.243 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -5.420 5.126 17.830 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -5.724 3.686 15.834 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.174 2.917 16.113 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -4.959 1.996 18.270 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -6.467 2.880 18.141 1.00 0.00 H new ATOM 0 HE ARG A 70 -5.792 0.371 16.712 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -7.635 3.342 16.766 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -8.925 2.706 15.740 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -7.443 -0.442 15.401 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -8.817 0.583 14.974 1.00 0.00 H new ATOM 769 N GLU A 71 -3.226 7.544 17.830 1.00 0.00 N ATOM 770 CA GLU A 71 -3.436 8.950 18.290 1.00 0.00 C ATOM 771 C GLU A 71 -2.680 9.918 17.380 1.00 0.00 C ATOM 772 O GLU A 71 -3.139 11.007 17.099 1.00 0.00 O ATOM 773 CB GLU A 71 -2.917 9.095 19.722 1.00 0.00 C ATOM 774 CG GLU A 71 -3.305 10.471 20.266 1.00 0.00 C ATOM 775 CD GLU A 71 -2.779 10.622 21.695 1.00 0.00 C ATOM 776 OE1 GLU A 71 -1.571 10.608 21.865 1.00 0.00 O ATOM 777 OE2 GLU A 71 -3.594 10.748 22.594 1.00 0.00 O ATOM 0 H GLU A 71 -2.449 7.054 18.274 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.500 9.183 18.254 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -3.335 8.311 20.353 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.834 8.976 19.742 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -2.892 11.255 19.631 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -4.389 10.587 20.252 1.00 0.00 H new ATOM 784 N ASP A 72 -1.519 9.535 16.924 1.00 0.00 N ATOM 785 CA ASP A 72 -0.727 10.441 16.039 1.00 0.00 C ATOM 786 C ASP A 72 0.233 9.609 15.173 1.00 0.00 C ATOM 787 O ASP A 72 1.319 9.282 15.608 1.00 0.00 O ATOM 788 CB ASP A 72 0.091 11.393 16.914 1.00 0.00 C ATOM 789 CG ASP A 72 0.651 12.526 16.051 1.00 0.00 C ATOM 790 OD1 ASP A 72 1.293 12.225 15.058 1.00 0.00 O ATOM 791 OD2 ASP A 72 0.428 13.674 16.398 1.00 0.00 O ATOM 0 H ASP A 72 -1.083 8.635 17.125 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.401 11.005 15.394 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.534 11.801 17.708 1.00 0.00 H new ATOM 0 HB3 ASP A 72 0.905 10.852 17.396 1.00 0.00 H new ATOM 796 N PRO A 73 -0.147 9.247 13.962 1.00 0.00 N ATOM 797 CA PRO A 73 0.736 8.425 13.078 1.00 0.00 C ATOM 798 C PRO A 73 1.940 9.211 12.523 1.00 0.00 C ATOM 799 O PRO A 73 2.870 8.634 11.995 1.00 0.00 O ATOM 800 CB PRO A 73 -0.202 7.968 11.950 1.00 0.00 C ATOM 801 CG PRO A 73 -1.262 9.021 11.877 1.00 0.00 C ATOM 802 CD PRO A 73 -1.437 9.561 13.301 1.00 0.00 C ATOM 0 HA PRO A 73 1.191 7.598 13.624 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.332 7.880 11.004 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -0.632 6.990 12.166 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -0.971 9.818 11.193 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -2.197 8.605 11.502 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -1.635 10.633 13.300 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.274 9.082 13.810 1.00 0.00 H new ATOM 810 N ASP A 74 1.935 10.516 12.632 1.00 0.00 N ATOM 811 CA ASP A 74 3.081 11.321 12.105 1.00 0.00 C ATOM 812 C ASP A 74 4.108 11.565 13.218 1.00 0.00 C ATOM 813 O ASP A 74 5.103 12.233 13.016 1.00 0.00 O ATOM 814 CB ASP A 74 2.560 12.667 11.597 1.00 0.00 C ATOM 815 CG ASP A 74 1.993 13.470 12.769 1.00 0.00 C ATOM 816 OD1 ASP A 74 2.778 13.932 13.581 1.00 0.00 O ATOM 817 OD2 ASP A 74 0.783 13.610 12.836 1.00 0.00 O ATOM 0 H ASP A 74 1.187 11.059 13.063 1.00 0.00 H new ATOM 0 HA ASP A 74 3.558 10.775 11.291 1.00 0.00 H new ATOM 0 HB2 ASP A 74 3.365 13.223 11.117 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.789 12.509 10.843 1.00 0.00 H new ATOM 822 N SER A 75 3.873 11.031 14.391 1.00 0.00 N ATOM 823 CA SER A 75 4.828 11.227 15.529 1.00 0.00 C ATOM 824 C SER A 75 5.601 9.928 15.778 1.00 0.00 C ATOM 825 O SER A 75 6.157 9.726 16.840 1.00 0.00 O ATOM 826 CB SER A 75 4.038 11.588 16.789 1.00 0.00 C ATOM 827 OG SER A 75 4.930 12.063 17.787 1.00 0.00 O ATOM 0 H SER A 75 3.055 10.463 14.612 1.00 0.00 H new ATOM 0 HA SER A 75 5.527 12.027 15.285 1.00 0.00 H new ATOM 0 HB2 SER A 75 3.294 12.350 16.559 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.497 10.715 17.155 1.00 0.00 H new ATOM 0 HG SER A 75 5.703 11.464 17.847 1.00 0.00 H new ATOM 833 N VAL A 76 5.634 9.042 14.807 1.00 0.00 N ATOM 834 CA VAL A 76 6.363 7.740 14.970 1.00 0.00 C ATOM 835 C VAL A 76 7.393 7.614 13.823 1.00 0.00 C ATOM 836 O VAL A 76 7.013 7.557 12.670 1.00 0.00 O ATOM 837 CB VAL A 76 5.333 6.594 14.884 1.00 0.00 C ATOM 838 CG1 VAL A 76 5.844 5.348 15.624 1.00 0.00 C ATOM 839 CG2 VAL A 76 4.018 7.053 15.523 1.00 0.00 C ATOM 0 H VAL A 76 5.183 9.167 13.901 1.00 0.00 H new ATOM 0 HA VAL A 76 6.879 7.694 15.929 1.00 0.00 H new ATOM 0 HB VAL A 76 5.177 6.340 13.836 1.00 0.00 H new ATOM 0 HG11 VAL A 76 5.103 4.552 15.551 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.779 5.015 15.174 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.013 5.592 16.673 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.285 6.248 15.466 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.192 7.312 16.567 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.640 7.926 14.991 1.00 0.00 H new ATOM 849 N PRO A 77 8.683 7.595 14.109 1.00 0.00 N ATOM 850 CA PRO A 77 9.724 7.504 13.038 1.00 0.00 C ATOM 851 C PRO A 77 9.850 6.093 12.435 1.00 0.00 C ATOM 852 O PRO A 77 9.408 5.122 13.016 1.00 0.00 O ATOM 853 CB PRO A 77 11.020 7.918 13.752 1.00 0.00 C ATOM 854 CG PRO A 77 10.805 7.585 15.198 1.00 0.00 C ATOM 855 CD PRO A 77 9.292 7.658 15.454 1.00 0.00 C ATOM 0 HA PRO A 77 9.476 8.137 12.186 1.00 0.00 H new ATOM 0 HB2 PRO A 77 11.879 7.381 13.349 1.00 0.00 H new ATOM 0 HB3 PRO A 77 11.218 8.982 13.620 1.00 0.00 H new ATOM 0 HG2 PRO A 77 11.187 6.590 15.426 1.00 0.00 H new ATOM 0 HG3 PRO A 77 11.339 8.286 15.839 1.00 0.00 H new ATOM 0 HD2 PRO A 77 8.956 6.832 16.081 1.00 0.00 H new ATOM 0 HD3 PRO A 77 9.021 8.580 15.969 1.00 0.00 H new ATOM 863 N PRO A 78 10.460 5.989 11.274 1.00 0.00 N ATOM 864 CA PRO A 78 10.659 4.681 10.578 1.00 0.00 C ATOM 865 C PRO A 78 11.788 3.861 11.206 1.00 0.00 C ATOM 866 O PRO A 78 12.528 4.341 12.042 1.00 0.00 O ATOM 867 CB PRO A 78 11.022 5.090 9.146 1.00 0.00 C ATOM 868 CG PRO A 78 11.693 6.418 9.291 1.00 0.00 C ATOM 869 CD PRO A 78 11.030 7.108 10.491 1.00 0.00 C ATOM 0 HA PRO A 78 9.776 4.045 10.639 1.00 0.00 H new ATOM 0 HB2 PRO A 78 11.685 4.360 8.681 1.00 0.00 H new ATOM 0 HB3 PRO A 78 10.135 5.161 8.517 1.00 0.00 H new ATOM 0 HG2 PRO A 78 12.764 6.297 9.455 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.575 7.014 8.386 1.00 0.00 H new ATOM 0 HD2 PRO A 78 11.754 7.677 11.075 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.257 7.808 10.173 1.00 0.00 H new ATOM 877 N ILE A 79 11.921 2.626 10.799 1.00 0.00 N ATOM 878 CA ILE A 79 13.000 1.746 11.353 1.00 0.00 C ATOM 879 C ILE A 79 14.057 1.494 10.276 1.00 0.00 C ATOM 880 O ILE A 79 13.849 1.772 9.113 1.00 0.00 O ATOM 881 CB ILE A 79 12.384 0.411 11.780 1.00 0.00 C ATOM 882 CG1 ILE A 79 11.410 -0.064 10.694 1.00 0.00 C ATOM 883 CG2 ILE A 79 11.633 0.588 13.108 1.00 0.00 C ATOM 884 CD1 ILE A 79 11.110 -1.548 10.895 1.00 0.00 C ATOM 0 H ILE A 79 11.324 2.183 10.100 1.00 0.00 H new ATOM 0 HA ILE A 79 13.466 2.231 12.211 1.00 0.00 H new ATOM 0 HB ILE A 79 13.173 -0.330 11.913 1.00 0.00 H new ATOM 0 HG12 ILE A 79 10.487 0.514 10.740 1.00 0.00 H new ATOM 0 HG13 ILE A 79 11.841 0.101 9.706 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.196 -0.364 13.409 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.328 0.927 13.876 1.00 0.00 H new ATOM 0 HG23 ILE A 79 10.842 1.327 12.983 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.418 -1.887 10.124 1.00 0.00 H new ATOM 0 HD12 ILE A 79 12.036 -2.119 10.828 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.661 -1.699 11.877 1.00 0.00 H new ATOM 896 N ASP A 80 15.188 0.961 10.654 1.00 0.00 N ATOM 897 CA ASP A 80 16.258 0.679 9.652 1.00 0.00 C ATOM 898 C ASP A 80 16.066 -0.738 9.112 1.00 0.00 C ATOM 899 O ASP A 80 15.783 -1.659 9.853 1.00 0.00 O ATOM 900 CB ASP A 80 17.631 0.791 10.321 1.00 0.00 C ATOM 901 CG ASP A 80 18.717 0.903 9.248 1.00 0.00 C ATOM 902 OD1 ASP A 80 18.795 1.945 8.619 1.00 0.00 O ATOM 903 OD2 ASP A 80 19.452 -0.055 9.075 1.00 0.00 O ATOM 0 H ASP A 80 15.418 0.708 11.615 1.00 0.00 H new ATOM 0 HA ASP A 80 16.199 1.399 8.835 1.00 0.00 H new ATOM 0 HB2 ASP A 80 17.659 1.664 10.973 1.00 0.00 H new ATOM 0 HB3 ASP A 80 17.814 -0.082 10.948 1.00 0.00 H new ATOM 908 N VAL A 81 16.204 -0.919 7.825 1.00 0.00 N ATOM 909 CA VAL A 81 16.017 -2.277 7.224 1.00 0.00 C ATOM 910 C VAL A 81 17.098 -2.524 6.168 1.00 0.00 C ATOM 911 O VAL A 81 17.434 -1.655 5.388 1.00 0.00 O ATOM 912 CB VAL A 81 14.613 -2.339 6.595 1.00 0.00 C ATOM 913 CG1 VAL A 81 14.505 -3.505 5.606 1.00 0.00 C ATOM 914 CG2 VAL A 81 13.577 -2.529 7.706 1.00 0.00 C ATOM 0 H VAL A 81 16.439 -0.183 7.160 1.00 0.00 H new ATOM 0 HA VAL A 81 16.106 -3.050 7.987 1.00 0.00 H new ATOM 0 HB VAL A 81 14.432 -1.409 6.056 1.00 0.00 H new ATOM 0 HG11 VAL A 81 13.504 -3.526 5.176 1.00 0.00 H new ATOM 0 HG12 VAL A 81 15.239 -3.376 4.810 1.00 0.00 H new ATOM 0 HG13 VAL A 81 14.696 -4.443 6.127 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.579 -2.574 7.269 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.782 -3.457 8.240 1.00 0.00 H new ATOM 0 HG23 VAL A 81 13.631 -1.691 8.401 1.00 0.00 H new ATOM 924 N LEU A 82 17.641 -3.712 6.140 1.00 0.00 N ATOM 925 CA LEU A 82 18.700 -4.035 5.140 1.00 0.00 C ATOM 926 C LEU A 82 18.040 -4.511 3.845 1.00 0.00 C ATOM 927 O LEU A 82 17.147 -5.336 3.855 1.00 0.00 O ATOM 928 CB LEU A 82 19.609 -5.143 5.684 1.00 0.00 C ATOM 929 CG LEU A 82 20.139 -4.761 7.075 1.00 0.00 C ATOM 930 CD1 LEU A 82 20.729 -6.001 7.749 1.00 0.00 C ATOM 931 CD2 LEU A 82 21.230 -3.692 6.954 1.00 0.00 C ATOM 0 H LEU A 82 17.395 -4.476 6.770 1.00 0.00 H new ATOM 0 HA LEU A 82 19.297 -3.144 4.946 1.00 0.00 H new ATOM 0 HB2 LEU A 82 19.056 -6.081 5.743 1.00 0.00 H new ATOM 0 HB3 LEU A 82 20.443 -5.307 5.002 1.00 0.00 H new ATOM 0 HG LEU A 82 19.315 -4.366 7.670 1.00 0.00 H new ATOM 0 HD11 LEU A 82 21.106 -5.734 8.736 1.00 0.00 H new ATOM 0 HD12 LEU A 82 19.956 -6.763 7.850 1.00 0.00 H new ATOM 0 HD13 LEU A 82 21.546 -6.391 7.142 1.00 0.00 H new ATOM 0 HD21 LEU A 82 21.596 -3.431 7.947 1.00 0.00 H new ATOM 0 HD22 LEU A 82 22.054 -4.079 6.354 1.00 0.00 H new ATOM 0 HD23 LEU A 82 20.818 -2.804 6.475 1.00 0.00 H new ATOM 943 N TRP A 83 18.473 -3.983 2.731 1.00 0.00 N ATOM 944 CA TRP A 83 17.891 -4.368 1.408 1.00 0.00 C ATOM 945 C TRP A 83 18.963 -5.105 0.599 1.00 0.00 C ATOM 946 O TRP A 83 19.958 -4.528 0.207 1.00 0.00 O ATOM 947 CB TRP A 83 17.475 -3.073 0.709 1.00 0.00 C ATOM 948 CG TRP A 83 17.093 -3.293 -0.724 1.00 0.00 C ATOM 949 CD1 TRP A 83 16.634 -4.450 -1.270 1.00 0.00 C ATOM 950 CD2 TRP A 83 17.118 -2.316 -1.802 1.00 0.00 C ATOM 951 NE1 TRP A 83 16.380 -4.234 -2.617 1.00 0.00 N ATOM 952 CE2 TRP A 83 16.666 -2.935 -2.989 1.00 0.00 C ATOM 953 CE3 TRP A 83 17.492 -0.959 -1.860 1.00 0.00 C ATOM 954 CZ2 TRP A 83 16.585 -2.231 -4.192 1.00 0.00 C ATOM 955 CZ3 TRP A 83 17.413 -0.252 -3.067 1.00 0.00 C ATOM 956 CH2 TRP A 83 16.960 -0.886 -4.231 1.00 0.00 C ATOM 0 H TRP A 83 19.219 -3.289 2.680 1.00 0.00 H new ATOM 0 HA TRP A 83 17.028 -5.026 1.514 1.00 0.00 H new ATOM 0 HB2 TRP A 83 16.634 -2.630 1.242 1.00 0.00 H new ATOM 0 HB3 TRP A 83 18.296 -2.358 0.757 1.00 0.00 H new ATOM 0 HD1 TRP A 83 16.491 -5.382 -0.743 1.00 0.00 H new ATOM 0 HE1 TRP A 83 16.026 -4.947 -3.254 1.00 0.00 H new ATOM 0 HE3 TRP A 83 17.842 -0.460 -0.968 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 16.235 -2.723 -5.087 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 17.703 0.788 -3.100 1.00 0.00 H new ATOM 0 HH2 TRP A 83 16.901 -0.335 -5.158 1.00 0.00 H new ATOM 967 N ILE A 84 18.777 -6.386 0.368 1.00 0.00 N ATOM 968 CA ILE A 84 19.795 -7.185 -0.394 1.00 0.00 C ATOM 969 C ILE A 84 19.114 -7.947 -1.533 1.00 0.00 C ATOM 970 O ILE A 84 17.987 -8.386 -1.418 1.00 0.00 O ATOM 971 CB ILE A 84 20.469 -8.179 0.560 1.00 0.00 C ATOM 972 CG1 ILE A 84 20.957 -7.435 1.805 1.00 0.00 C ATOM 973 CG2 ILE A 84 21.668 -8.831 -0.134 1.00 0.00 C ATOM 974 CD1 ILE A 84 21.727 -8.402 2.706 1.00 0.00 C ATOM 0 H ILE A 84 17.961 -6.914 0.676 1.00 0.00 H new ATOM 0 HA ILE A 84 20.543 -6.513 -0.815 1.00 0.00 H new ATOM 0 HB ILE A 84 19.750 -8.948 0.844 1.00 0.00 H new ATOM 0 HG12 ILE A 84 21.597 -6.602 1.516 1.00 0.00 H new ATOM 0 HG13 ILE A 84 20.110 -7.013 2.346 1.00 0.00 H new ATOM 0 HG21 ILE A 84 22.144 -9.536 0.548 1.00 0.00 H new ATOM 0 HG22 ILE A 84 21.329 -9.360 -1.025 1.00 0.00 H new ATOM 0 HG23 ILE A 84 22.386 -8.062 -0.419 1.00 0.00 H new ATOM 0 HD11 ILE A 84 22.075 -7.873 3.593 1.00 0.00 H new ATOM 0 HD12 ILE A 84 21.072 -9.221 3.005 1.00 0.00 H new ATOM 0 HD13 ILE A 84 22.583 -8.802 2.163 1.00 0.00 H new ATOM 986 N LYS A 85 19.797 -8.090 -2.641 1.00 0.00 N ATOM 987 CA LYS A 85 19.225 -8.802 -3.825 1.00 0.00 C ATOM 988 C LYS A 85 19.869 -10.190 -3.949 1.00 0.00 C ATOM 989 O LYS A 85 20.951 -10.433 -3.451 1.00 0.00 O ATOM 990 CB LYS A 85 19.519 -7.945 -5.083 1.00 0.00 C ATOM 991 CG LYS A 85 18.220 -7.578 -5.812 1.00 0.00 C ATOM 992 CD LYS A 85 18.495 -6.478 -6.845 1.00 0.00 C ATOM 993 CE LYS A 85 17.175 -5.829 -7.266 1.00 0.00 C ATOM 994 NZ LYS A 85 16.565 -5.151 -6.090 1.00 0.00 N ATOM 0 H LYS A 85 20.744 -7.737 -2.777 1.00 0.00 H new ATOM 0 HA LYS A 85 18.149 -8.937 -3.716 1.00 0.00 H new ATOM 0 HB2 LYS A 85 20.047 -7.037 -4.794 1.00 0.00 H new ATOM 0 HB3 LYS A 85 20.176 -8.495 -5.757 1.00 0.00 H new ATOM 0 HG2 LYS A 85 17.809 -8.458 -6.306 1.00 0.00 H new ATOM 0 HG3 LYS A 85 17.474 -7.237 -5.094 1.00 0.00 H new ATOM 0 HD2 LYS A 85 19.163 -5.727 -6.423 1.00 0.00 H new ATOM 0 HD3 LYS A 85 18.999 -6.899 -7.715 1.00 0.00 H new ATOM 0 HE2 LYS A 85 17.349 -5.109 -8.066 1.00 0.00 H new ATOM 0 HE3 LYS A 85 16.494 -6.584 -7.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 15.531 -5.129 -6.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 16.810 -5.671 -5.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 16.927 -4.178 -6.024 1.00 0.00 H new ATOM 1008 N GLY A 86 19.198 -11.106 -4.602 1.00 0.00 N ATOM 1009 CA GLY A 86 19.746 -12.488 -4.756 1.00 0.00 C ATOM 1010 C GLY A 86 20.414 -12.653 -6.121 1.00 0.00 C ATOM 1011 O GLY A 86 20.650 -11.701 -6.838 1.00 0.00 O ATOM 0 H GLY A 86 18.288 -10.954 -5.038 1.00 0.00 H new ATOM 0 HA2 GLY A 86 20.468 -12.689 -3.965 1.00 0.00 H new ATOM 0 HA3 GLY A 86 18.943 -13.217 -4.647 1.00 0.00 H new ATOM 1015 N ALA A 87 20.732 -13.870 -6.471 1.00 0.00 N ATOM 1016 CA ALA A 87 21.404 -14.140 -7.773 1.00 0.00 C ATOM 1017 C ALA A 87 20.431 -13.940 -8.948 1.00 0.00 C ATOM 1018 O ALA A 87 20.834 -13.987 -10.093 1.00 0.00 O ATOM 1019 CB ALA A 87 21.917 -15.587 -7.773 1.00 0.00 C ATOM 0 H ALA A 87 20.552 -14.698 -5.903 1.00 0.00 H new ATOM 0 HA ALA A 87 22.232 -13.442 -7.895 1.00 0.00 H new ATOM 0 HB1 ALA A 87 22.411 -15.798 -8.721 1.00 0.00 H new ATOM 0 HB2 ALA A 87 22.626 -15.722 -6.956 1.00 0.00 H new ATOM 0 HB3 ALA A 87 21.078 -16.270 -7.641 1.00 0.00 H new ATOM 1025 N GLN A 88 19.158 -13.731 -8.684 1.00 0.00 N ATOM 1026 CA GLN A 88 18.167 -13.545 -9.801 1.00 0.00 C ATOM 1027 C GLN A 88 17.384 -12.241 -9.614 1.00 0.00 C ATOM 1028 O GLN A 88 16.283 -12.093 -10.106 1.00 0.00 O ATOM 1029 CB GLN A 88 17.205 -14.733 -9.814 1.00 0.00 C ATOM 1030 CG GLN A 88 18.022 -16.022 -9.902 1.00 0.00 C ATOM 1031 CD GLN A 88 17.087 -17.229 -9.981 1.00 0.00 C ATOM 1032 OE1 GLN A 88 15.889 -17.079 -10.118 1.00 0.00 O ATOM 1033 NE2 GLN A 88 17.589 -18.433 -9.899 1.00 0.00 N ATOM 0 H GLN A 88 18.763 -13.681 -7.745 1.00 0.00 H new ATOM 0 HA GLN A 88 18.701 -13.490 -10.750 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.593 -14.734 -8.912 1.00 0.00 H new ATOM 0 HB3 GLN A 88 16.524 -14.659 -10.661 1.00 0.00 H new ATOM 0 HG2 GLN A 88 18.668 -15.994 -10.780 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.671 -16.111 -9.031 1.00 0.00 H new ATOM 0 HE21 GLN A 88 18.595 -18.560 -9.784 1.00 0.00 H new ATOM 0 HE22 GLN A 88 16.975 -19.246 -9.950 1.00 0.00 H new ATOM 1042 N GLY A 89 17.952 -11.283 -8.933 1.00 0.00 N ATOM 1043 CA GLY A 89 17.252 -9.977 -8.746 1.00 0.00 C ATOM 1044 C GLY A 89 16.217 -10.060 -7.618 1.00 0.00 C ATOM 1045 O GLY A 89 15.707 -9.057 -7.165 1.00 0.00 O ATOM 0 H GLY A 89 18.872 -11.347 -8.497 1.00 0.00 H new ATOM 0 HA2 GLY A 89 17.981 -9.200 -8.518 1.00 0.00 H new ATOM 0 HA3 GLY A 89 16.759 -9.689 -9.675 1.00 0.00 H new ATOM 1049 N GLY A 90 15.896 -11.237 -7.164 1.00 0.00 N ATOM 1050 CA GLY A 90 14.892 -11.367 -6.077 1.00 0.00 C ATOM 1051 C GLY A 90 15.262 -10.442 -4.920 1.00 0.00 C ATOM 1052 O GLY A 90 16.237 -10.648 -4.226 1.00 0.00 O ATOM 0 H GLY A 90 16.287 -12.117 -7.500 1.00 0.00 H new ATOM 0 HA2 GLY A 90 13.900 -11.116 -6.453 1.00 0.00 H new ATOM 0 HA3 GLY A 90 14.849 -12.399 -5.730 1.00 0.00 H new ATOM 1056 N ASP A 91 14.485 -9.425 -4.708 1.00 0.00 N ATOM 1057 CA ASP A 91 14.770 -8.484 -3.596 1.00 0.00 C ATOM 1058 C ASP A 91 14.332 -9.121 -2.277 1.00 0.00 C ATOM 1059 O ASP A 91 13.248 -9.661 -2.170 1.00 0.00 O ATOM 1060 CB ASP A 91 13.992 -7.185 -3.809 1.00 0.00 C ATOM 1061 CG ASP A 91 14.477 -6.490 -5.080 1.00 0.00 C ATOM 1062 OD1 ASP A 91 14.981 -7.176 -5.950 1.00 0.00 O ATOM 1063 OD2 ASP A 91 14.333 -5.281 -5.161 1.00 0.00 O ATOM 0 H ASP A 91 13.657 -9.202 -5.261 1.00 0.00 H new ATOM 0 HA ASP A 91 15.838 -8.267 -3.568 1.00 0.00 H new ATOM 0 HB2 ASP A 91 12.926 -7.398 -3.885 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.125 -6.526 -2.951 1.00 0.00 H new ATOM 1068 N TYR A 92 15.167 -9.056 -1.274 1.00 0.00 N ATOM 1069 CA TYR A 92 14.821 -9.648 0.058 1.00 0.00 C ATOM 1070 C TYR A 92 15.033 -8.579 1.134 1.00 0.00 C ATOM 1071 O TYR A 92 16.100 -8.010 1.251 1.00 0.00 O ATOM 1072 CB TYR A 92 15.731 -10.852 0.320 1.00 0.00 C ATOM 1073 CG TYR A 92 15.488 -11.902 -0.744 1.00 0.00 C ATOM 1074 CD1 TYR A 92 14.475 -12.855 -0.572 1.00 0.00 C ATOM 1075 CD2 TYR A 92 16.272 -11.921 -1.904 1.00 0.00 C ATOM 1076 CE1 TYR A 92 14.248 -13.823 -1.558 1.00 0.00 C ATOM 1077 CE2 TYR A 92 16.044 -12.890 -2.888 1.00 0.00 C ATOM 1078 CZ TYR A 92 15.033 -13.841 -2.715 1.00 0.00 C ATOM 1079 OH TYR A 92 14.810 -14.795 -3.686 1.00 0.00 O ATOM 0 H TYR A 92 16.085 -8.614 -1.319 1.00 0.00 H new ATOM 0 HA TYR A 92 13.783 -9.979 0.075 1.00 0.00 H new ATOM 0 HB2 TYR A 92 16.776 -10.542 0.310 1.00 0.00 H new ATOM 0 HB3 TYR A 92 15.531 -11.266 1.308 1.00 0.00 H new ATOM 0 HD1 TYR A 92 13.869 -12.843 0.322 1.00 0.00 H new ATOM 0 HD2 TYR A 92 17.053 -11.188 -2.040 1.00 0.00 H new ATOM 0 HE1 TYR A 92 13.466 -14.556 -1.425 1.00 0.00 H new ATOM 0 HE2 TYR A 92 16.650 -12.903 -3.782 1.00 0.00 H new ATOM 0 HH TYR A 92 15.442 -14.665 -4.424 1.00 0.00 H new ATOM 1089 N PHE A 93 14.015 -8.282 1.908 1.00 0.00 N ATOM 1090 CA PHE A 93 14.139 -7.231 2.961 1.00 0.00 C ATOM 1091 C PHE A 93 14.374 -7.880 4.328 1.00 0.00 C ATOM 1092 O PHE A 93 13.585 -8.674 4.801 1.00 0.00 O ATOM 1093 CB PHE A 93 12.848 -6.399 2.984 1.00 0.00 C ATOM 1094 CG PHE A 93 12.595 -5.811 1.608 1.00 0.00 C ATOM 1095 CD1 PHE A 93 13.332 -4.701 1.166 1.00 0.00 C ATOM 1096 CD2 PHE A 93 11.632 -6.384 0.765 1.00 0.00 C ATOM 1097 CE1 PHE A 93 13.105 -4.171 -0.110 1.00 0.00 C ATOM 1098 CE2 PHE A 93 11.410 -5.853 -0.512 1.00 0.00 C ATOM 1099 CZ PHE A 93 12.147 -4.747 -0.949 1.00 0.00 C ATOM 0 H PHE A 93 13.099 -8.727 1.852 1.00 0.00 H new ATOM 0 HA PHE A 93 14.988 -6.585 2.738 1.00 0.00 H new ATOM 0 HB2 PHE A 93 12.006 -7.024 3.284 1.00 0.00 H new ATOM 0 HB3 PHE A 93 12.931 -5.601 3.722 1.00 0.00 H new ATOM 0 HD1 PHE A 93 14.075 -4.255 1.811 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.060 -7.236 1.101 1.00 0.00 H new ATOM 0 HE1 PHE A 93 13.671 -3.315 -0.447 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.669 -6.298 -1.160 1.00 0.00 H new ATOM 0 HZ PHE A 93 11.976 -4.339 -1.934 1.00 0.00 H new ATOM 1109 N TYR A 94 15.472 -7.541 4.956 1.00 0.00 N ATOM 1110 CA TYR A 94 15.817 -8.112 6.293 1.00 0.00 C ATOM 1111 C TYR A 94 15.674 -7.027 7.363 1.00 0.00 C ATOM 1112 O TYR A 94 16.205 -5.943 7.228 1.00 0.00 O ATOM 1113 CB TYR A 94 17.280 -8.600 6.255 1.00 0.00 C ATOM 1114 CG TYR A 94 17.328 -10.065 5.910 1.00 0.00 C ATOM 1115 CD1 TYR A 94 17.322 -10.469 4.573 1.00 0.00 C ATOM 1116 CD2 TYR A 94 17.371 -11.015 6.932 1.00 0.00 C ATOM 1117 CE1 TYR A 94 17.361 -11.829 4.256 1.00 0.00 C ATOM 1118 CE2 TYR A 94 17.409 -12.376 6.616 1.00 0.00 C ATOM 1119 CZ TYR A 94 17.404 -12.784 5.277 1.00 0.00 C ATOM 1120 OH TYR A 94 17.441 -14.128 4.965 1.00 0.00 O ATOM 0 H TYR A 94 16.157 -6.879 4.590 1.00 0.00 H new ATOM 0 HA TYR A 94 15.149 -8.941 6.529 1.00 0.00 H new ATOM 0 HB2 TYR A 94 17.844 -8.027 5.519 1.00 0.00 H new ATOM 0 HB3 TYR A 94 17.753 -8.430 7.222 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.287 -9.731 3.785 1.00 0.00 H new ATOM 0 HD2 TYR A 94 17.375 -10.699 7.965 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.358 -12.143 3.223 1.00 0.00 H new ATOM 0 HE2 TYR A 94 17.442 -13.113 7.405 1.00 0.00 H new ATOM 0 HH TYR A 94 17.469 -14.655 5.791 1.00 0.00 H new ATOM 1130 N SER A 95 14.979 -7.324 8.433 1.00 0.00 N ATOM 1131 CA SER A 95 14.810 -6.325 9.536 1.00 0.00 C ATOM 1132 C SER A 95 15.357 -6.917 10.838 1.00 0.00 C ATOM 1133 O SER A 95 15.016 -8.016 11.226 1.00 0.00 O ATOM 1134 CB SER A 95 13.320 -5.985 9.698 1.00 0.00 C ATOM 1135 OG SER A 95 13.187 -4.647 10.152 1.00 0.00 O ATOM 0 H SER A 95 14.519 -8.220 8.592 1.00 0.00 H new ATOM 0 HA SER A 95 15.357 -5.413 9.296 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.802 -6.111 8.747 1.00 0.00 H new ATOM 0 HB3 SER A 95 12.855 -6.669 10.408 1.00 0.00 H new ATOM 0 HG SER A 95 12.435 -4.219 9.692 1.00 0.00 H new ATOM 1141 N PHE A 96 16.185 -6.175 11.524 1.00 0.00 N ATOM 1142 CA PHE A 96 16.749 -6.644 12.818 1.00 0.00 C ATOM 1143 C PHE A 96 16.518 -5.531 13.837 1.00 0.00 C ATOM 1144 O PHE A 96 17.329 -4.643 14.006 1.00 0.00 O ATOM 1145 CB PHE A 96 18.247 -6.869 12.676 1.00 0.00 C ATOM 1146 CG PHE A 96 18.500 -8.149 11.915 1.00 0.00 C ATOM 1147 CD1 PHE A 96 18.255 -9.382 12.523 1.00 0.00 C ATOM 1148 CD2 PHE A 96 18.996 -8.102 10.611 1.00 0.00 C ATOM 1149 CE1 PHE A 96 18.502 -10.570 11.825 1.00 0.00 C ATOM 1150 CE2 PHE A 96 19.247 -9.285 9.913 1.00 0.00 C ATOM 1151 CZ PHE A 96 19.000 -10.521 10.519 1.00 0.00 C ATOM 0 H PHE A 96 16.498 -5.248 11.235 1.00 0.00 H new ATOM 0 HA PHE A 96 16.277 -7.577 13.126 1.00 0.00 H new ATOM 0 HB2 PHE A 96 18.703 -6.028 12.154 1.00 0.00 H new ATOM 0 HB3 PHE A 96 18.711 -6.922 13.661 1.00 0.00 H new ATOM 0 HD1 PHE A 96 17.874 -9.419 13.533 1.00 0.00 H new ATOM 0 HD2 PHE A 96 19.186 -7.148 10.141 1.00 0.00 H new ATOM 0 HE1 PHE A 96 18.308 -11.523 12.294 1.00 0.00 H new ATOM 0 HE2 PHE A 96 19.632 -9.246 8.905 1.00 0.00 H new ATOM 0 HZ PHE A 96 19.194 -11.436 9.979 1.00 0.00 H new ATOM 1161 N GLY A 97 15.406 -5.573 14.498 1.00 0.00 N ATOM 1162 CA GLY A 97 15.060 -4.527 15.506 1.00 0.00 C ATOM 1163 C GLY A 97 13.608 -4.104 15.270 1.00 0.00 C ATOM 1164 O GLY A 97 12.849 -4.808 14.634 1.00 0.00 O ATOM 0 H GLY A 97 14.701 -6.302 14.385 1.00 0.00 H new ATOM 0 HA2 GLY A 97 15.184 -4.916 16.517 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.727 -3.670 15.410 1.00 0.00 H new ATOM 1168 N GLY A 98 13.218 -2.958 15.756 1.00 0.00 N ATOM 1169 CA GLY A 98 11.816 -2.495 15.533 1.00 0.00 C ATOM 1170 C GLY A 98 10.829 -3.639 15.807 1.00 0.00 C ATOM 1171 O GLY A 98 9.751 -3.684 15.248 1.00 0.00 O ATOM 0 H GLY A 98 13.806 -2.323 16.296 1.00 0.00 H new ATOM 0 HA2 GLY A 98 11.596 -1.651 16.187 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.700 -2.143 14.508 1.00 0.00 H new ATOM 1175 N CYS A 99 11.192 -4.572 16.646 1.00 0.00 N ATOM 1176 CA CYS A 99 10.280 -5.716 16.932 1.00 0.00 C ATOM 1177 C CYS A 99 8.995 -5.217 17.607 1.00 0.00 C ATOM 1178 O CYS A 99 7.904 -5.449 17.128 1.00 0.00 O ATOM 1179 CB CYS A 99 10.997 -6.715 17.848 1.00 0.00 C ATOM 1180 SG CYS A 99 12.748 -6.793 17.394 1.00 0.00 S ATOM 0 H CYS A 99 12.081 -4.591 17.146 1.00 0.00 H new ATOM 0 HA CYS A 99 10.012 -6.205 15.995 1.00 0.00 H new ATOM 0 HB2 CYS A 99 10.893 -6.411 18.889 1.00 0.00 H new ATOM 0 HB3 CYS A 99 10.542 -7.701 17.757 1.00 0.00 H new ATOM 0 HG CYS A 99 13.360 -7.638 18.170 1.00 0.00 H new ATOM 1186 N HIS A 100 9.111 -4.542 18.717 1.00 0.00 N ATOM 1187 CA HIS A 100 7.891 -4.044 19.413 1.00 0.00 C ATOM 1188 C HIS A 100 7.069 -3.174 18.456 1.00 0.00 C ATOM 1189 O HIS A 100 5.854 -3.195 18.479 1.00 0.00 O ATOM 1190 CB HIS A 100 8.305 -3.231 20.650 1.00 0.00 C ATOM 1191 CG HIS A 100 8.602 -4.166 21.800 1.00 0.00 C ATOM 1192 ND1 HIS A 100 9.726 -4.979 21.819 1.00 0.00 N ATOM 1193 CD2 HIS A 100 7.926 -4.436 22.968 1.00 0.00 C ATOM 1194 CE1 HIS A 100 9.693 -5.692 22.962 1.00 0.00 C ATOM 1195 NE2 HIS A 100 8.618 -5.398 23.698 1.00 0.00 N ATOM 0 H HIS A 100 9.995 -4.314 19.171 1.00 0.00 H new ATOM 0 HA HIS A 100 7.280 -4.889 19.731 1.00 0.00 H new ATOM 0 HB2 HIS A 100 9.184 -2.628 20.423 1.00 0.00 H new ATOM 0 HB3 HIS A 100 7.508 -2.541 20.927 1.00 0.00 H new ATOM 0 HD1 HIS A 100 10.446 -5.028 21.099 1.00 0.00 H new ATOM 0 HD2 HIS A 100 6.999 -3.972 23.272 1.00 0.00 H new ATOM 0 HE1 HIS A 100 10.444 -6.413 23.248 1.00 0.00 H new ATOM 1203 N ARG A 101 7.711 -2.411 17.615 1.00 0.00 N ATOM 1204 CA ARG A 101 6.942 -1.554 16.667 1.00 0.00 C ATOM 1205 C ARG A 101 6.241 -2.437 15.629 1.00 0.00 C ATOM 1206 O ARG A 101 5.175 -2.110 15.147 1.00 0.00 O ATOM 1207 CB ARG A 101 7.884 -0.562 15.978 1.00 0.00 C ATOM 1208 CG ARG A 101 8.311 0.509 16.991 1.00 0.00 C ATOM 1209 CD ARG A 101 9.141 1.597 16.299 1.00 0.00 C ATOM 1210 NE ARG A 101 10.560 1.148 16.198 1.00 0.00 N ATOM 1211 CZ ARG A 101 11.522 2.027 16.095 1.00 0.00 C ATOM 1212 NH1 ARG A 101 11.241 3.301 16.056 1.00 0.00 N ATOM 1213 NH2 ARG A 101 12.764 1.631 16.029 1.00 0.00 N ATOM 0 H ARG A 101 8.726 -2.343 17.542 1.00 0.00 H new ATOM 0 HA ARG A 101 6.188 -0.991 17.217 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.759 -1.082 15.589 1.00 0.00 H new ATOM 0 HB3 ARG A 101 7.385 -0.098 15.127 1.00 0.00 H new ATOM 0 HG2 ARG A 101 7.430 0.954 17.453 1.00 0.00 H new ATOM 0 HG3 ARG A 101 8.894 0.051 17.790 1.00 0.00 H new ATOM 0 HD2 ARG A 101 8.740 1.799 15.306 1.00 0.00 H new ATOM 0 HD3 ARG A 101 9.082 2.528 16.862 1.00 0.00 H new ATOM 0 HE ARG A 101 10.780 0.152 16.209 1.00 0.00 H new ATOM 0 HH11 ARG A 101 10.271 3.611 16.106 1.00 0.00 H new ATOM 0 HH12 ARG A 101 11.992 3.987 15.976 1.00 0.00 H new ATOM 0 HH21 ARG A 101 12.984 0.635 16.058 1.00 0.00 H new ATOM 0 HH22 ARG A 101 13.514 2.317 15.949 1.00 0.00 H new ATOM 1227 N TYR A 102 6.815 -3.562 15.289 1.00 0.00 N ATOM 1228 CA TYR A 102 6.158 -4.459 14.298 1.00 0.00 C ATOM 1229 C TYR A 102 4.849 -4.976 14.906 1.00 0.00 C ATOM 1230 O TYR A 102 3.826 -5.024 14.254 1.00 0.00 O ATOM 1231 CB TYR A 102 7.098 -5.631 13.972 1.00 0.00 C ATOM 1232 CG TYR A 102 6.345 -6.722 13.245 1.00 0.00 C ATOM 1233 CD1 TYR A 102 5.654 -7.685 13.983 1.00 0.00 C ATOM 1234 CD2 TYR A 102 6.344 -6.778 11.845 1.00 0.00 C ATOM 1235 CE1 TYR A 102 4.957 -8.704 13.330 1.00 0.00 C ATOM 1236 CE2 TYR A 102 5.647 -7.801 11.188 1.00 0.00 C ATOM 1237 CZ TYR A 102 4.953 -8.764 11.931 1.00 0.00 C ATOM 1238 OH TYR A 102 4.267 -9.772 11.285 1.00 0.00 O ATOM 0 H TYR A 102 7.707 -3.896 15.654 1.00 0.00 H new ATOM 0 HA TYR A 102 5.942 -3.919 13.376 1.00 0.00 H new ATOM 0 HB2 TYR A 102 7.927 -5.281 13.357 1.00 0.00 H new ATOM 0 HB3 TYR A 102 7.528 -6.028 14.892 1.00 0.00 H new ATOM 0 HD1 TYR A 102 5.659 -7.642 15.062 1.00 0.00 H new ATOM 0 HD2 TYR A 102 6.879 -6.034 11.273 1.00 0.00 H new ATOM 0 HE1 TYR A 102 4.421 -9.446 13.904 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.645 -7.847 10.109 1.00 0.00 H new ATOM 0 HH TYR A 102 4.366 -9.666 10.316 1.00 0.00 H new ATOM 1248 N ALA A 103 4.877 -5.354 16.155 1.00 0.00 N ATOM 1249 CA ALA A 103 3.639 -5.859 16.818 1.00 0.00 C ATOM 1250 C ALA A 103 2.554 -4.785 16.762 1.00 0.00 C ATOM 1251 O ALA A 103 1.413 -5.060 16.457 1.00 0.00 O ATOM 1252 CB ALA A 103 3.941 -6.184 18.282 1.00 0.00 C ATOM 0 H ALA A 103 5.707 -5.335 16.748 1.00 0.00 H new ATOM 0 HA ALA A 103 3.296 -6.756 16.303 1.00 0.00 H new ATOM 0 HB1 ALA A 103 3.037 -6.553 18.767 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.717 -6.947 18.333 1.00 0.00 H new ATOM 0 HB3 ALA A 103 4.284 -5.283 18.791 1.00 0.00 H new ATOM 1258 N ALA A 104 2.896 -3.563 17.062 1.00 0.00 N ATOM 1259 CA ALA A 104 1.874 -2.482 17.031 1.00 0.00 C ATOM 1260 C ALA A 104 1.283 -2.381 15.623 1.00 0.00 C ATOM 1261 O ALA A 104 0.085 -2.272 15.449 1.00 0.00 O ATOM 1262 CB ALA A 104 2.521 -1.150 17.420 1.00 0.00 C ATOM 0 H ALA A 104 3.836 -3.268 17.326 1.00 0.00 H new ATOM 0 HA ALA A 104 1.079 -2.712 17.740 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.770 -0.360 17.396 1.00 0.00 H new ATOM 0 HB2 ALA A 104 2.936 -1.227 18.425 1.00 0.00 H new ATOM 0 HB3 ALA A 104 3.319 -0.914 16.716 1.00 0.00 H new ATOM 1268 N TYR A 105 2.110 -2.425 14.616 1.00 0.00 N ATOM 1269 CA TYR A 105 1.596 -2.340 13.226 1.00 0.00 C ATOM 1270 C TYR A 105 0.804 -3.617 12.912 1.00 0.00 C ATOM 1271 O TYR A 105 -0.255 -3.573 12.318 1.00 0.00 O ATOM 1272 CB TYR A 105 2.794 -2.201 12.264 1.00 0.00 C ATOM 1273 CG TYR A 105 3.073 -0.742 11.972 1.00 0.00 C ATOM 1274 CD1 TYR A 105 3.870 0.009 12.843 1.00 0.00 C ATOM 1275 CD2 TYR A 105 2.529 -0.145 10.830 1.00 0.00 C ATOM 1276 CE1 TYR A 105 4.125 1.359 12.570 1.00 0.00 C ATOM 1277 CE2 TYR A 105 2.782 1.204 10.557 1.00 0.00 C ATOM 1278 CZ TYR A 105 3.580 1.956 11.427 1.00 0.00 C ATOM 1279 OH TYR A 105 3.830 3.287 11.158 1.00 0.00 O ATOM 0 H TYR A 105 3.123 -2.516 14.699 1.00 0.00 H new ATOM 0 HA TYR A 105 0.941 -1.477 13.109 1.00 0.00 H new ATOM 0 HB2 TYR A 105 3.677 -2.665 12.704 1.00 0.00 H new ATOM 0 HB3 TYR A 105 2.585 -2.730 11.334 1.00 0.00 H new ATOM 0 HD1 TYR A 105 4.288 -0.452 13.725 1.00 0.00 H new ATOM 0 HD2 TYR A 105 1.913 -0.725 10.159 1.00 0.00 H new ATOM 0 HE1 TYR A 105 4.742 1.939 13.241 1.00 0.00 H new ATOM 0 HE2 TYR A 105 2.362 1.665 9.675 1.00 0.00 H new ATOM 0 HH TYR A 105 3.379 3.543 10.327 1.00 0.00 H new ATOM 1289 N GLN A 106 1.312 -4.751 13.308 1.00 0.00 N ATOM 1290 CA GLN A 106 0.601 -6.027 13.039 1.00 0.00 C ATOM 1291 C GLN A 106 -0.761 -6.007 13.738 1.00 0.00 C ATOM 1292 O GLN A 106 -1.776 -6.333 13.155 1.00 0.00 O ATOM 1293 CB GLN A 106 1.444 -7.185 13.583 1.00 0.00 C ATOM 1294 CG GLN A 106 0.838 -8.526 13.153 1.00 0.00 C ATOM 1295 CD GLN A 106 -0.358 -8.872 14.051 1.00 0.00 C ATOM 1296 OE1 GLN A 106 -1.489 -8.614 13.693 1.00 0.00 O ATOM 1297 NE2 GLN A 106 -0.163 -9.452 15.208 1.00 0.00 N ATOM 0 H GLN A 106 2.195 -4.847 13.809 1.00 0.00 H new ATOM 0 HA GLN A 106 0.451 -6.153 11.967 1.00 0.00 H new ATOM 0 HB2 GLN A 106 2.467 -7.105 13.215 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.492 -7.131 14.671 1.00 0.00 H new ATOM 0 HG2 GLN A 106 0.519 -8.473 12.112 1.00 0.00 H new ATOM 0 HG3 GLN A 106 1.591 -9.312 13.216 1.00 0.00 H new ATOM 0 HE21 GLN A 106 0.785 -9.672 15.515 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -0.959 -9.684 15.803 1.00 0.00 H new ATOM 1306 N GLN A 107 -0.787 -5.627 14.987 1.00 0.00 N ATOM 1307 CA GLN A 107 -2.074 -5.586 15.735 1.00 0.00 C ATOM 1308 C GLN A 107 -3.063 -4.661 15.022 1.00 0.00 C ATOM 1309 O GLN A 107 -4.232 -4.969 14.896 1.00 0.00 O ATOM 1310 CB GLN A 107 -1.818 -5.067 17.155 1.00 0.00 C ATOM 1311 CG GLN A 107 -3.151 -4.930 17.908 1.00 0.00 C ATOM 1312 CD GLN A 107 -2.905 -4.974 19.420 1.00 0.00 C ATOM 1313 OE1 GLN A 107 -1.892 -4.501 19.898 1.00 0.00 O ATOM 1314 NE2 GLN A 107 -3.797 -5.528 20.197 1.00 0.00 N ATOM 0 H GLN A 107 0.033 -5.342 15.523 1.00 0.00 H new ATOM 0 HA GLN A 107 -2.496 -6.590 15.781 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.157 -5.751 17.688 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -1.312 -4.102 17.114 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.637 -3.992 17.637 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -3.827 -5.734 17.617 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -4.647 -5.925 19.796 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -3.644 -5.564 21.205 1.00 0.00 H new ATOM 1323 N LEU A 108 -2.610 -3.530 14.556 1.00 0.00 N ATOM 1324 CA LEU A 108 -3.534 -2.592 13.856 1.00 0.00 C ATOM 1325 C LEU A 108 -3.873 -3.147 12.471 1.00 0.00 C ATOM 1326 O LEU A 108 -4.505 -2.493 11.666 1.00 0.00 O ATOM 1327 CB LEU A 108 -2.862 -1.224 13.716 1.00 0.00 C ATOM 1328 CG LEU A 108 -2.697 -0.583 15.106 1.00 0.00 C ATOM 1329 CD1 LEU A 108 -1.859 0.697 14.982 1.00 0.00 C ATOM 1330 CD2 LEU A 108 -4.078 -0.249 15.710 1.00 0.00 C ATOM 0 H LEU A 108 -1.643 -3.215 14.629 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.452 -2.485 14.434 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.889 -1.333 13.237 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -3.462 -0.577 13.075 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.190 -1.288 15.765 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.742 1.152 15.966 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.878 0.451 14.576 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -2.362 1.398 14.316 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -3.945 0.204 16.693 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -4.602 0.449 15.057 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.663 -1.163 15.808 1.00 0.00 H new ATOM 1342 N GLN A 109 -3.464 -4.355 12.193 1.00 0.00 N ATOM 1343 CA GLN A 109 -3.767 -4.965 10.867 1.00 0.00 C ATOM 1344 C GLN A 109 -3.478 -3.960 9.747 1.00 0.00 C ATOM 1345 O GLN A 109 -4.218 -3.858 8.788 1.00 0.00 O ATOM 1346 CB GLN A 109 -5.245 -5.375 10.825 1.00 0.00 C ATOM 1347 CG GLN A 109 -5.467 -6.407 9.714 1.00 0.00 C ATOM 1348 CD GLN A 109 -4.919 -7.764 10.161 1.00 0.00 C ATOM 1349 OE1 GLN A 109 -4.274 -7.865 11.186 1.00 0.00 O ATOM 1350 NE2 GLN A 109 -5.149 -8.820 9.429 1.00 0.00 N ATOM 0 H GLN A 109 -2.931 -4.948 12.830 1.00 0.00 H new ATOM 0 HA GLN A 109 -3.138 -5.843 10.723 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -5.543 -5.793 11.787 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -5.870 -4.499 10.650 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -6.530 -6.489 9.486 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -4.969 -6.085 8.799 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -5.690 -8.736 8.569 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -4.787 -9.729 9.717 1.00 0.00 H new ATOM 1359 N ARG A 110 -2.406 -3.224 9.850 1.00 0.00 N ATOM 1360 CA ARG A 110 -2.075 -2.244 8.784 1.00 0.00 C ATOM 1361 C ARG A 110 -1.561 -3.004 7.565 1.00 0.00 C ATOM 1362 O ARG A 110 -1.145 -4.141 7.660 1.00 0.00 O ATOM 1363 CB ARG A 110 -0.997 -1.281 9.292 1.00 0.00 C ATOM 1364 CG ARG A 110 -1.579 -0.357 10.382 1.00 0.00 C ATOM 1365 CD ARG A 110 -2.289 0.843 9.741 1.00 0.00 C ATOM 1366 NE ARG A 110 -2.697 1.802 10.807 1.00 0.00 N ATOM 1367 CZ ARG A 110 -3.789 1.594 11.492 1.00 0.00 C ATOM 1368 NH1 ARG A 110 -4.527 0.547 11.242 1.00 0.00 N ATOM 1369 NH2 ARG A 110 -4.144 2.434 12.426 1.00 0.00 N ATOM 0 H ARG A 110 -1.746 -3.261 10.627 1.00 0.00 H new ATOM 0 HA ARG A 110 -2.961 -1.670 8.513 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -0.156 -1.845 9.694 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -0.614 -0.683 8.465 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -2.281 -0.914 11.003 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -0.780 -0.008 11.037 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -1.626 1.334 9.029 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -3.164 0.507 9.184 1.00 0.00 H new ATOM 0 HE ARG A 110 -2.122 2.622 11.002 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -4.251 -0.109 10.511 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -5.380 0.385 11.777 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -3.568 3.253 12.621 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -4.997 2.271 12.961 1.00 0.00 H new ATOM 1383 N GLU A 111 -1.608 -2.394 6.418 1.00 0.00 N ATOM 1384 CA GLU A 111 -1.140 -3.087 5.181 1.00 0.00 C ATOM 1385 C GLU A 111 0.389 -2.986 5.059 1.00 0.00 C ATOM 1386 O GLU A 111 1.045 -3.944 4.694 1.00 0.00 O ATOM 1387 CB GLU A 111 -1.807 -2.442 3.952 1.00 0.00 C ATOM 1388 CG GLU A 111 -3.207 -3.032 3.744 1.00 0.00 C ATOM 1389 CD GLU A 111 -3.833 -2.428 2.485 1.00 0.00 C ATOM 1390 OE1 GLU A 111 -4.228 -1.275 2.539 1.00 0.00 O ATOM 1391 OE2 GLU A 111 -3.906 -3.129 1.490 1.00 0.00 O ATOM 0 H GLU A 111 -1.950 -1.443 6.279 1.00 0.00 H new ATOM 0 HA GLU A 111 -1.415 -4.140 5.235 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -1.875 -1.363 4.090 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -1.196 -2.612 3.065 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -3.146 -4.116 3.649 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -3.834 -2.823 4.611 1.00 0.00 H new ATOM 1398 N THR A 112 0.964 -1.837 5.335 1.00 0.00 N ATOM 1399 CA THR A 112 2.453 -1.684 5.204 1.00 0.00 C ATOM 1400 C THR A 112 3.029 -0.969 6.423 1.00 0.00 C ATOM 1401 O THR A 112 2.311 -0.547 7.308 1.00 0.00 O ATOM 1402 CB THR A 112 2.753 -0.836 3.966 1.00 0.00 C ATOM 1403 OG1 THR A 112 2.001 0.368 4.037 1.00 0.00 O ATOM 1404 CG2 THR A 112 2.373 -1.596 2.684 1.00 0.00 C ATOM 0 H THR A 112 0.469 -1.000 5.644 1.00 0.00 H new ATOM 0 HA THR A 112 2.902 -2.674 5.121 1.00 0.00 H new ATOM 0 HB THR A 112 3.820 -0.615 3.938 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.929 0.762 3.143 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.594 -0.976 1.815 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.947 -2.521 2.626 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.309 -1.830 2.702 1.00 0.00 H new ATOM 1412 N ILE A 113 4.334 -0.820 6.462 1.00 0.00 N ATOM 1413 CA ILE A 113 4.984 -0.113 7.617 1.00 0.00 C ATOM 1414 C ILE A 113 6.134 0.778 7.104 1.00 0.00 C ATOM 1415 O ILE A 113 6.867 0.366 6.226 1.00 0.00 O ATOM 1416 CB ILE A 113 5.566 -1.141 8.597 1.00 0.00 C ATOM 1417 CG1 ILE A 113 5.986 -0.421 9.883 1.00 0.00 C ATOM 1418 CG2 ILE A 113 6.794 -1.827 7.978 1.00 0.00 C ATOM 1419 CD1 ILE A 113 6.358 -1.451 10.951 1.00 0.00 C ATOM 0 H ILE A 113 4.977 -1.157 5.745 1.00 0.00 H new ATOM 0 HA ILE A 113 4.233 0.497 8.119 1.00 0.00 H new ATOM 0 HB ILE A 113 4.811 -1.895 8.817 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.834 0.234 9.684 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.173 0.210 10.240 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.198 -2.554 8.682 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.502 -2.335 7.059 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.554 -1.079 7.753 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.656 -0.936 11.864 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.498 -2.088 11.158 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.185 -2.064 10.593 1.00 0.00 H new ATOM 1431 N PRO A 114 6.341 1.971 7.646 1.00 0.00 N ATOM 1432 CA PRO A 114 7.474 2.832 7.196 1.00 0.00 C ATOM 1433 C PRO A 114 8.821 2.209 7.584 1.00 0.00 C ATOM 1434 O PRO A 114 9.023 1.797 8.710 1.00 0.00 O ATOM 1435 CB PRO A 114 7.260 4.177 7.928 1.00 0.00 C ATOM 1436 CG PRO A 114 5.867 4.120 8.477 1.00 0.00 C ATOM 1437 CD PRO A 114 5.561 2.643 8.711 1.00 0.00 C ATOM 0 HA PRO A 114 7.494 2.951 6.113 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.991 4.310 8.726 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.378 5.018 7.245 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.791 4.685 9.406 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.155 4.559 7.778 1.00 0.00 H new ATOM 0 HD2 PRO A 114 5.871 2.319 9.704 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.495 2.433 8.625 1.00 0.00 H new ATOM 1445 N ALA A 115 9.738 2.136 6.665 1.00 0.00 N ATOM 1446 CA ALA A 115 11.069 1.538 6.978 1.00 0.00 C ATOM 1447 C ALA A 115 12.130 2.142 6.058 1.00 0.00 C ATOM 1448 O ALA A 115 11.943 2.248 4.862 1.00 0.00 O ATOM 1449 CB ALA A 115 11.013 0.025 6.763 1.00 0.00 C ATOM 0 H ALA A 115 9.626 2.465 5.706 1.00 0.00 H new ATOM 0 HA ALA A 115 11.325 1.749 8.016 1.00 0.00 H new ATOM 0 HB1 ALA A 115 11.985 -0.411 6.992 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.258 -0.408 7.419 1.00 0.00 H new ATOM 0 HB3 ALA A 115 10.756 -0.186 5.725 1.00 0.00 H new ATOM 1455 N LYS A 116 13.244 2.536 6.610 1.00 0.00 N ATOM 1456 CA LYS A 116 14.322 3.131 5.774 1.00 0.00 C ATOM 1457 C LYS A 116 15.061 2.006 5.038 1.00 0.00 C ATOM 1458 O LYS A 116 15.717 1.185 5.648 1.00 0.00 O ATOM 1459 CB LYS A 116 15.302 3.902 6.691 1.00 0.00 C ATOM 1460 CG LYS A 116 15.829 5.153 5.976 1.00 0.00 C ATOM 1461 CD LYS A 116 16.682 5.986 6.942 1.00 0.00 C ATOM 1462 CE LYS A 116 17.856 5.151 7.469 1.00 0.00 C ATOM 1463 NZ LYS A 116 18.364 4.256 6.391 1.00 0.00 N ATOM 0 H LYS A 116 13.454 2.471 7.606 1.00 0.00 H new ATOM 0 HA LYS A 116 13.899 3.820 5.043 1.00 0.00 H new ATOM 0 HB2 LYS A 116 14.798 4.188 7.614 1.00 0.00 H new ATOM 0 HB3 LYS A 116 16.135 3.256 6.969 1.00 0.00 H new ATOM 0 HG2 LYS A 116 16.423 4.864 5.109 1.00 0.00 H new ATOM 0 HG3 LYS A 116 14.995 5.750 5.606 1.00 0.00 H new ATOM 0 HD2 LYS A 116 17.058 6.874 6.433 1.00 0.00 H new ATOM 0 HD3 LYS A 116 16.069 6.331 7.775 1.00 0.00 H new ATOM 0 HE2 LYS A 116 18.654 5.807 7.815 1.00 0.00 H new ATOM 0 HE3 LYS A 116 17.536 4.558 8.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 19.326 3.939 6.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 17.739 3.429 6.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 18.382 4.774 5.489 1.00 0.00 H new ATOM 1477 N LEU A 117 14.969 1.961 3.736 1.00 0.00 N ATOM 1478 CA LEU A 117 15.683 0.882 2.993 1.00 0.00 C ATOM 1479 C LEU A 117 17.179 1.189 2.978 1.00 0.00 C ATOM 1480 O LEU A 117 17.590 2.316 2.784 1.00 0.00 O ATOM 1481 CB LEU A 117 15.172 0.791 1.550 1.00 0.00 C ATOM 1482 CG LEU A 117 13.651 0.566 1.523 1.00 0.00 C ATOM 1483 CD1 LEU A 117 13.199 0.375 0.068 1.00 0.00 C ATOM 1484 CD2 LEU A 117 13.279 -0.683 2.337 1.00 0.00 C ATOM 0 H LEU A 117 14.438 2.615 3.161 1.00 0.00 H new ATOM 0 HA LEU A 117 15.498 -0.070 3.491 1.00 0.00 H new ATOM 0 HB2 LEU A 117 15.418 1.707 1.014 1.00 0.00 H new ATOM 0 HB3 LEU A 117 15.674 -0.026 1.032 1.00 0.00 H new ATOM 0 HG LEU A 117 13.155 1.432 1.961 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.121 0.215 0.040 1.00 0.00 H new ATOM 0 HD12 LEU A 117 13.449 1.264 -0.510 1.00 0.00 H new ATOM 0 HD13 LEU A 117 13.706 -0.490 -0.360 1.00 0.00 H new ATOM 0 HD21 LEU A 117 12.199 -0.828 2.308 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.774 -1.556 1.911 1.00 0.00 H new ATOM 0 HD23 LEU A 117 13.600 -0.553 3.371 1.00 0.00 H new ATOM 1496 N VAL A 118 17.994 0.188 3.186 1.00 0.00 N ATOM 1497 CA VAL A 118 19.474 0.391 3.195 1.00 0.00 C ATOM 1498 C VAL A 118 20.133 -0.705 2.354 1.00 0.00 C ATOM 1499 O VAL A 118 20.292 -1.827 2.794 1.00 0.00 O ATOM 1500 CB VAL A 118 19.970 0.308 4.643 1.00 0.00 C ATOM 1501 CG1 VAL A 118 21.498 0.264 4.674 1.00 0.00 C ATOM 1502 CG2 VAL A 118 19.485 1.535 5.418 1.00 0.00 C ATOM 0 H VAL A 118 17.694 -0.773 3.352 1.00 0.00 H new ATOM 0 HA VAL A 118 19.728 1.365 2.777 1.00 0.00 H new ATOM 0 HB VAL A 118 19.576 -0.599 5.101 1.00 0.00 H new ATOM 0 HG11 VAL A 118 21.839 0.205 5.707 1.00 0.00 H new ATOM 0 HG12 VAL A 118 21.848 -0.611 4.126 1.00 0.00 H new ATOM 0 HG13 VAL A 118 21.897 1.166 4.211 1.00 0.00 H new ATOM 0 HG21 VAL A 118 19.837 1.477 6.448 1.00 0.00 H new ATOM 0 HG22 VAL A 118 19.877 2.439 4.951 1.00 0.00 H new ATOM 0 HG23 VAL A 118 18.395 1.564 5.408 1.00 0.00 H new ATOM 1512 N GLN A 119 20.520 -0.389 1.148 1.00 0.00 N ATOM 1513 CA GLN A 119 21.171 -1.416 0.284 1.00 0.00 C ATOM 1514 C GLN A 119 22.360 -2.019 1.039 1.00 0.00 C ATOM 1515 O GLN A 119 23.204 -1.310 1.549 1.00 0.00 O ATOM 1516 CB GLN A 119 21.650 -0.762 -1.022 1.00 0.00 C ATOM 1517 CG GLN A 119 22.156 -1.836 -2.004 1.00 0.00 C ATOM 1518 CD GLN A 119 23.628 -2.144 -1.728 1.00 0.00 C ATOM 1519 OE1 GLN A 119 23.937 -3.191 -1.024 1.00 0.00 O flip ATOM 1520 NE2 GLN A 119 24.504 -1.422 -2.161 1.00 0.00 N flip ATOM 0 H GLN A 119 20.414 0.533 0.724 1.00 0.00 H new ATOM 0 HA GLN A 119 20.458 -2.204 0.041 1.00 0.00 H new ATOM 0 HB2 GLN A 119 20.834 -0.200 -1.476 1.00 0.00 H new ATOM 0 HB3 GLN A 119 22.447 -0.050 -0.809 1.00 0.00 H new ATOM 0 HG2 GLN A 119 21.561 -2.743 -1.902 1.00 0.00 H new ATOM 0 HG3 GLN A 119 22.035 -1.489 -3.030 1.00 0.00 H new ATOM 0 HE21 GLN A 119 24.261 -0.600 -2.714 1.00 0.00 H new ATOM 0 HE22 GLN A 119 25.483 -1.638 -1.972 1.00 0.00 H new ATOM 1529 N SER A 120 22.420 -3.327 1.129 1.00 0.00 N ATOM 1530 CA SER A 120 23.540 -3.996 1.867 1.00 0.00 C ATOM 1531 C SER A 120 24.089 -5.152 1.028 1.00 0.00 C ATOM 1532 O SER A 120 23.646 -5.395 -0.078 1.00 0.00 O ATOM 1533 CB SER A 120 23.004 -4.532 3.199 1.00 0.00 C ATOM 1534 OG SER A 120 22.960 -3.476 4.146 1.00 0.00 O ATOM 0 H SER A 120 21.736 -3.964 0.720 1.00 0.00 H new ATOM 0 HA SER A 120 24.341 -3.281 2.053 1.00 0.00 H new ATOM 0 HB2 SER A 120 22.008 -4.953 3.060 1.00 0.00 H new ATOM 0 HB3 SER A 120 23.643 -5.337 3.564 1.00 0.00 H new ATOM 0 HG SER A 120 23.017 -2.616 3.680 1.00 0.00 H new ATOM 1540 N THR A 121 25.057 -5.865 1.551 1.00 0.00 N ATOM 1541 CA THR A 121 25.663 -7.013 0.804 1.00 0.00 C ATOM 1542 C THR A 121 25.530 -8.288 1.638 1.00 0.00 C ATOM 1543 O THR A 121 25.316 -8.243 2.834 1.00 0.00 O ATOM 1544 CB THR A 121 27.145 -6.722 0.556 1.00 0.00 C ATOM 1545 OG1 THR A 121 27.730 -6.208 1.744 1.00 0.00 O ATOM 1546 CG2 THR A 121 27.286 -5.696 -0.569 1.00 0.00 C ATOM 0 H THR A 121 25.458 -5.699 2.474 1.00 0.00 H new ATOM 0 HA THR A 121 25.149 -7.146 -0.148 1.00 0.00 H new ATOM 0 HB THR A 121 27.652 -7.643 0.269 1.00 0.00 H new ATOM 0 HG1 THR A 121 28.679 -6.023 1.587 1.00 0.00 H new ATOM 0 HG21 THR A 121 28.342 -5.490 -0.744 1.00 0.00 H new ATOM 0 HG22 THR A 121 26.838 -6.091 -1.480 1.00 0.00 H new ATOM 0 HG23 THR A 121 26.779 -4.774 -0.286 1.00 0.00 H new ATOM 1554 N LEU A 122 25.645 -9.428 1.019 1.00 0.00 N ATOM 1555 CA LEU A 122 25.515 -10.699 1.790 1.00 0.00 C ATOM 1556 C LEU A 122 26.528 -10.710 2.947 1.00 0.00 C ATOM 1557 O LEU A 122 26.248 -11.213 4.017 1.00 0.00 O ATOM 1558 CB LEU A 122 25.759 -11.902 0.865 1.00 0.00 C ATOM 1559 CG LEU A 122 25.397 -13.213 1.587 1.00 0.00 C ATOM 1560 CD1 LEU A 122 23.877 -13.297 1.832 1.00 0.00 C ATOM 1561 CD2 LEU A 122 25.837 -14.397 0.721 1.00 0.00 C ATOM 0 H LEU A 122 25.822 -9.537 0.020 1.00 0.00 H new ATOM 0 HA LEU A 122 24.507 -10.768 2.198 1.00 0.00 H new ATOM 0 HB2 LEU A 122 25.161 -11.800 -0.041 1.00 0.00 H new ATOM 0 HB3 LEU A 122 26.804 -11.926 0.556 1.00 0.00 H new ATOM 0 HG LEU A 122 25.907 -13.239 2.550 1.00 0.00 H new ATOM 0 HD11 LEU A 122 23.642 -14.231 2.343 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.561 -12.456 2.449 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.352 -13.264 0.877 1.00 0.00 H new ATOM 0 HD21 LEU A 122 25.584 -15.330 1.225 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.326 -14.354 -0.241 1.00 0.00 H new ATOM 0 HD23 LEU A 122 26.914 -14.351 0.562 1.00 0.00 H new ATOM 1573 N SER A 123 27.700 -10.159 2.748 1.00 0.00 N ATOM 1574 CA SER A 123 28.713 -10.143 3.845 1.00 0.00 C ATOM 1575 C SER A 123 28.110 -9.488 5.091 1.00 0.00 C ATOM 1576 O SER A 123 28.354 -9.909 6.204 1.00 0.00 O ATOM 1577 CB SER A 123 29.939 -9.347 3.394 1.00 0.00 C ATOM 1578 OG SER A 123 30.537 -9.991 2.279 1.00 0.00 O ATOM 0 H SER A 123 27.997 -9.721 1.876 1.00 0.00 H new ATOM 0 HA SER A 123 29.008 -11.165 4.080 1.00 0.00 H new ATOM 0 HB2 SER A 123 29.648 -8.331 3.128 1.00 0.00 H new ATOM 0 HB3 SER A 123 30.656 -9.270 4.211 1.00 0.00 H new ATOM 0 HG SER A 123 31.322 -9.481 1.988 1.00 0.00 H new ATOM 1584 N ASP A 124 27.320 -8.465 4.918 1.00 0.00 N ATOM 1585 CA ASP A 124 26.701 -7.797 6.090 1.00 0.00 C ATOM 1586 C ASP A 124 25.747 -8.788 6.771 1.00 0.00 C ATOM 1587 O ASP A 124 25.729 -8.934 7.984 1.00 0.00 O ATOM 1588 CB ASP A 124 25.928 -6.565 5.598 1.00 0.00 C ATOM 1589 CG ASP A 124 26.881 -5.374 5.452 1.00 0.00 C ATOM 1590 OD1 ASP A 124 27.661 -5.150 6.364 1.00 0.00 O ATOM 1591 OD2 ASP A 124 26.814 -4.708 4.432 1.00 0.00 O ATOM 0 H ASP A 124 27.078 -8.064 4.012 1.00 0.00 H new ATOM 0 HA ASP A 124 27.461 -7.482 6.805 1.00 0.00 H new ATOM 0 HB2 ASP A 124 25.453 -6.781 4.641 1.00 0.00 H new ATOM 0 HB3 ASP A 124 25.132 -6.320 6.301 1.00 0.00 H new ATOM 1596 N LEU A 125 24.958 -9.479 5.999 1.00 0.00 N ATOM 1597 CA LEU A 125 24.014 -10.457 6.598 1.00 0.00 C ATOM 1598 C LEU A 125 24.812 -11.504 7.388 1.00 0.00 C ATOM 1599 O LEU A 125 24.415 -11.920 8.455 1.00 0.00 O ATOM 1600 CB LEU A 125 23.193 -11.126 5.480 1.00 0.00 C ATOM 1601 CG LEU A 125 21.814 -11.566 6.010 1.00 0.00 C ATOM 1602 CD1 LEU A 125 20.885 -10.350 6.200 1.00 0.00 C ATOM 1603 CD2 LEU A 125 21.181 -12.532 5.008 1.00 0.00 C ATOM 0 H LEU A 125 24.927 -9.408 4.982 1.00 0.00 H new ATOM 0 HA LEU A 125 23.327 -9.951 7.277 1.00 0.00 H new ATOM 0 HB2 LEU A 125 23.065 -10.431 4.650 1.00 0.00 H new ATOM 0 HB3 LEU A 125 23.732 -11.990 5.092 1.00 0.00 H new ATOM 0 HG LEU A 125 21.948 -12.054 6.976 1.00 0.00 H new ATOM 0 HD11 LEU A 125 19.918 -10.686 6.575 1.00 0.00 H new ATOM 0 HD12 LEU A 125 21.331 -9.659 6.915 1.00 0.00 H new ATOM 0 HD13 LEU A 125 20.748 -9.844 5.244 1.00 0.00 H new ATOM 0 HD21 LEU A 125 20.205 -12.849 5.375 1.00 0.00 H new ATOM 0 HD22 LEU A 125 21.063 -12.033 4.046 1.00 0.00 H new ATOM 0 HD23 LEU A 125 21.824 -13.404 4.888 1.00 0.00 H new ATOM 1615 N ARG A 126 25.942 -11.918 6.877 1.00 0.00 N ATOM 1616 CA ARG A 126 26.771 -12.923 7.609 1.00 0.00 C ATOM 1617 C ARG A 126 27.082 -12.383 9.005 1.00 0.00 C ATOM 1618 O ARG A 126 27.040 -13.106 9.981 1.00 0.00 O ATOM 1619 CB ARG A 126 28.072 -13.171 6.816 1.00 0.00 C ATOM 1620 CG ARG A 126 29.172 -13.816 7.705 1.00 0.00 C ATOM 1621 CD ARG A 126 30.141 -12.752 8.245 1.00 0.00 C ATOM 1622 NE ARG A 126 31.305 -13.426 8.885 1.00 0.00 N ATOM 1623 CZ ARG A 126 32.367 -12.736 9.199 1.00 0.00 C ATOM 1624 NH1 ARG A 126 32.409 -11.455 8.953 1.00 0.00 N ATOM 1625 NH2 ARG A 126 33.387 -13.326 9.760 1.00 0.00 N ATOM 0 H ARG A 126 26.327 -11.605 5.986 1.00 0.00 H new ATOM 0 HA ARG A 126 26.235 -13.867 7.708 1.00 0.00 H new ATOM 0 HB2 ARG A 126 27.862 -13.821 5.967 1.00 0.00 H new ATOM 0 HB3 ARG A 126 28.438 -12.227 6.412 1.00 0.00 H new ATOM 0 HG2 ARG A 126 28.708 -14.345 8.537 1.00 0.00 H new ATOM 0 HG3 ARG A 126 29.725 -14.555 7.126 1.00 0.00 H new ATOM 0 HD2 ARG A 126 30.480 -12.107 7.434 1.00 0.00 H new ATOM 0 HD3 ARG A 126 29.633 -12.114 8.968 1.00 0.00 H new ATOM 0 HE ARG A 126 31.272 -14.427 9.078 1.00 0.00 H new ATOM 0 HH11 ARG A 126 31.612 -10.993 8.515 1.00 0.00 H new ATOM 0 HH12 ARG A 126 33.239 -10.916 9.198 1.00 0.00 H new ATOM 0 HH21 ARG A 126 33.354 -14.327 9.953 1.00 0.00 H new ATOM 0 HH22 ARG A 126 34.217 -12.786 10.005 1.00 0.00 H new ATOM 1639 N VAL A 127 27.384 -11.119 9.116 1.00 0.00 N ATOM 1640 CA VAL A 127 27.683 -10.554 10.459 1.00 0.00 C ATOM 1641 C VAL A 127 26.522 -10.889 11.395 1.00 0.00 C ATOM 1642 O VAL A 127 26.705 -11.104 12.577 1.00 0.00 O ATOM 1643 CB VAL A 127 27.844 -9.035 10.364 1.00 0.00 C ATOM 1644 CG1 VAL A 127 28.110 -8.468 11.759 1.00 0.00 C ATOM 1645 CG2 VAL A 127 29.026 -8.704 9.454 1.00 0.00 C ATOM 0 H VAL A 127 27.436 -10.458 8.341 1.00 0.00 H new ATOM 0 HA VAL A 127 28.610 -10.981 10.841 1.00 0.00 H new ATOM 0 HB VAL A 127 26.934 -8.597 9.955 1.00 0.00 H new ATOM 0 HG11 VAL A 127 28.225 -7.386 11.696 1.00 0.00 H new ATOM 0 HG12 VAL A 127 27.272 -8.706 12.414 1.00 0.00 H new ATOM 0 HG13 VAL A 127 29.022 -8.907 12.162 1.00 0.00 H new ATOM 0 HG21 VAL A 127 29.141 -7.622 9.386 1.00 0.00 H new ATOM 0 HG22 VAL A 127 29.936 -9.141 9.866 1.00 0.00 H new ATOM 0 HG23 VAL A 127 28.845 -9.113 8.460 1.00 0.00 H new ATOM 1655 N TYR A 128 25.319 -10.932 10.873 1.00 0.00 N ATOM 1656 CA TYR A 128 24.138 -11.252 11.740 1.00 0.00 C ATOM 1657 C TYR A 128 23.871 -12.762 11.770 1.00 0.00 C ATOM 1658 O TYR A 128 23.659 -13.342 12.816 1.00 0.00 O ATOM 1659 CB TYR A 128 22.885 -10.574 11.184 1.00 0.00 C ATOM 1660 CG TYR A 128 22.991 -9.076 11.305 1.00 0.00 C ATOM 1661 CD1 TYR A 128 22.634 -8.441 12.500 1.00 0.00 C ATOM 1662 CD2 TYR A 128 23.427 -8.320 10.214 1.00 0.00 C ATOM 1663 CE1 TYR A 128 22.714 -7.048 12.602 1.00 0.00 C ATOM 1664 CE2 TYR A 128 23.511 -6.928 10.315 1.00 0.00 C ATOM 1665 CZ TYR A 128 23.153 -6.291 11.510 1.00 0.00 C ATOM 1666 OH TYR A 128 23.233 -4.917 11.610 1.00 0.00 O ATOM 0 H TYR A 128 25.104 -10.761 9.891 1.00 0.00 H new ATOM 0 HA TYR A 128 24.362 -10.895 12.745 1.00 0.00 H new ATOM 0 HB2 TYR A 128 22.750 -10.851 10.138 1.00 0.00 H new ATOM 0 HB3 TYR A 128 22.006 -10.926 11.723 1.00 0.00 H new ATOM 0 HD1 TYR A 128 22.297 -9.026 13.343 1.00 0.00 H new ATOM 0 HD2 TYR A 128 23.699 -8.811 9.292 1.00 0.00 H new ATOM 0 HE1 TYR A 128 22.437 -6.557 13.523 1.00 0.00 H new ATOM 0 HE2 TYR A 128 23.852 -6.344 9.472 1.00 0.00 H new ATOM 0 HH TYR A 128 23.557 -4.546 10.763 1.00 0.00 H new ATOM 1676 N LEU A 129 23.836 -13.390 10.621 1.00 0.00 N ATOM 1677 CA LEU A 129 23.532 -14.851 10.545 1.00 0.00 C ATOM 1678 C LEU A 129 24.721 -15.622 9.980 1.00 0.00 C ATOM 1679 O LEU A 129 24.556 -16.475 9.137 1.00 0.00 O ATOM 1680 CB LEU A 129 22.362 -15.048 9.588 1.00 0.00 C ATOM 1681 CG LEU A 129 21.104 -14.325 10.088 1.00 0.00 C ATOM 1682 CD1 LEU A 129 19.948 -14.632 9.124 1.00 0.00 C ATOM 1683 CD2 LEU A 129 20.737 -14.792 11.507 1.00 0.00 C ATOM 0 H LEU A 129 24.008 -12.945 9.720 1.00 0.00 H new ATOM 0 HA LEU A 129 23.304 -15.214 11.547 1.00 0.00 H new ATOM 0 HB2 LEU A 129 22.631 -14.674 8.600 1.00 0.00 H new ATOM 0 HB3 LEU A 129 22.153 -16.112 9.480 1.00 0.00 H new ATOM 0 HG LEU A 129 21.293 -13.252 10.122 1.00 0.00 H new ATOM 0 HD11 LEU A 129 19.045 -14.125 9.465 1.00 0.00 H new ATOM 0 HD12 LEU A 129 20.205 -14.282 8.124 1.00 0.00 H new ATOM 0 HD13 LEU A 129 19.772 -15.707 9.097 1.00 0.00 H new ATOM 0 HD21 LEU A 129 19.843 -14.267 11.843 1.00 0.00 H new ATOM 0 HD22 LEU A 129 20.547 -15.865 11.499 1.00 0.00 H new ATOM 0 HD23 LEU A 129 21.561 -14.575 12.186 1.00 0.00 H new ATOM 1695 N GLY A 130 25.907 -15.334 10.418 1.00 0.00 N ATOM 1696 CA GLY A 130 27.090 -16.064 9.885 1.00 0.00 C ATOM 1697 C GLY A 130 27.014 -17.557 10.252 1.00 0.00 C ATOM 1698 O GLY A 130 28.012 -18.169 10.575 1.00 0.00 O ATOM 0 H GLY A 130 26.113 -14.625 11.122 1.00 0.00 H new ATOM 0 HA2 GLY A 130 27.136 -15.952 8.802 1.00 0.00 H new ATOM 0 HA3 GLY A 130 28.005 -15.630 10.289 1.00 0.00 H new ATOM 1702 N ALA A 131 25.847 -18.155 10.197 1.00 0.00 N ATOM 1703 CA ALA A 131 25.733 -19.605 10.535 1.00 0.00 C ATOM 1704 C ALA A 131 24.536 -20.211 9.790 1.00 0.00 C ATOM 1705 O ALA A 131 24.683 -21.147 9.029 1.00 0.00 O ATOM 1706 CB ALA A 131 25.548 -19.767 12.048 1.00 0.00 C ATOM 0 H ALA A 131 24.973 -17.701 9.933 1.00 0.00 H new ATOM 0 HA ALA A 131 26.642 -20.124 10.231 1.00 0.00 H new ATOM 0 HB1 ALA A 131 25.465 -20.826 12.293 1.00 0.00 H new ATOM 0 HB2 ALA A 131 26.406 -19.341 12.567 1.00 0.00 H new ATOM 0 HB3 ALA A 131 24.641 -19.250 12.361 1.00 0.00 H new ATOM 1712 N SER A 132 23.354 -19.686 9.997 1.00 0.00 N ATOM 1713 CA SER A 132 22.148 -20.231 9.297 1.00 0.00 C ATOM 1714 C SER A 132 21.821 -19.346 8.093 1.00 0.00 C ATOM 1715 O SER A 132 20.672 -19.094 7.788 1.00 0.00 O ATOM 1716 CB SER A 132 20.960 -20.232 10.261 1.00 0.00 C ATOM 1717 OG SER A 132 21.133 -21.261 11.225 1.00 0.00 O ATOM 0 H SER A 132 23.171 -18.901 10.622 1.00 0.00 H new ATOM 0 HA SER A 132 22.348 -21.249 8.961 1.00 0.00 H new ATOM 0 HB2 SER A 132 20.879 -19.265 10.757 1.00 0.00 H new ATOM 0 HB3 SER A 132 20.032 -20.387 9.711 1.00 0.00 H new ATOM 0 HG SER A 132 20.373 -21.261 11.844 1.00 0.00 H new ATOM 1723 N THR A 133 22.824 -18.861 7.414 1.00 0.00 N ATOM 1724 CA THR A 133 22.574 -17.978 6.238 1.00 0.00 C ATOM 1725 C THR A 133 22.133 -18.832 5.022 1.00 0.00 C ATOM 1726 O THR A 133 22.887 -19.666 4.562 1.00 0.00 O ATOM 1727 CB THR A 133 23.887 -17.231 5.889 1.00 0.00 C ATOM 1728 OG1 THR A 133 24.781 -17.322 6.985 1.00 0.00 O ATOM 1729 CG2 THR A 133 23.603 -15.755 5.586 1.00 0.00 C ATOM 0 H THR A 133 23.807 -19.038 7.622 1.00 0.00 H new ATOM 0 HA THR A 133 21.786 -17.264 6.477 1.00 0.00 H new ATOM 0 HB THR A 133 24.330 -17.691 5.005 1.00 0.00 H new ATOM 0 HG1 THR A 133 24.347 -16.973 7.791 1.00 0.00 H new ATOM 0 HG21 THR A 133 24.536 -15.247 5.343 1.00 0.00 H new ATOM 0 HG22 THR A 133 22.920 -15.682 4.740 1.00 0.00 H new ATOM 0 HG23 THR A 133 23.151 -15.285 6.459 1.00 0.00 H new ATOM 1737 N PRO A 134 20.950 -18.622 4.479 1.00 0.00 N ATOM 1738 CA PRO A 134 20.482 -19.385 3.288 1.00 0.00 C ATOM 1739 C PRO A 134 21.071 -18.812 1.994 1.00 0.00 C ATOM 1740 O PRO A 134 21.887 -17.912 2.020 1.00 0.00 O ATOM 1741 CB PRO A 134 18.963 -19.204 3.326 1.00 0.00 C ATOM 1742 CG PRO A 134 18.761 -17.857 3.944 1.00 0.00 C ATOM 1743 CD PRO A 134 19.927 -17.654 4.925 1.00 0.00 C ATOM 0 HA PRO A 134 20.788 -20.431 3.309 1.00 0.00 H new ATOM 0 HB2 PRO A 134 18.533 -19.250 2.326 1.00 0.00 H new ATOM 0 HB3 PRO A 134 18.485 -19.987 3.915 1.00 0.00 H new ATOM 0 HG2 PRO A 134 18.753 -17.077 3.183 1.00 0.00 H new ATOM 0 HG3 PRO A 134 17.803 -17.806 4.462 1.00 0.00 H new ATOM 0 HD2 PRO A 134 20.304 -16.632 4.889 1.00 0.00 H new ATOM 0 HD3 PRO A 134 19.620 -17.845 5.953 1.00 0.00 H new ATOM 1751 N ASP A 135 20.658 -19.327 0.867 1.00 0.00 N ATOM 1752 CA ASP A 135 21.175 -18.827 -0.440 1.00 0.00 C ATOM 1753 C ASP A 135 20.093 -17.995 -1.116 1.00 0.00 C ATOM 1754 O ASP A 135 18.959 -18.410 -1.251 1.00 0.00 O ATOM 1755 CB ASP A 135 21.534 -20.015 -1.329 1.00 0.00 C ATOM 1756 CG ASP A 135 22.383 -19.537 -2.509 1.00 0.00 C ATOM 1757 OD1 ASP A 135 22.458 -18.336 -2.711 1.00 0.00 O ATOM 1758 OD2 ASP A 135 22.944 -20.380 -3.189 1.00 0.00 O ATOM 0 H ASP A 135 19.976 -20.082 0.796 1.00 0.00 H new ATOM 0 HA ASP A 135 22.062 -18.215 -0.278 1.00 0.00 H new ATOM 0 HB2 ASP A 135 22.082 -20.761 -0.753 1.00 0.00 H new ATOM 0 HB3 ASP A 135 20.627 -20.497 -1.693 1.00 0.00 H new ATOM 1763 N LEU A 136 20.441 -16.818 -1.528 1.00 0.00 N ATOM 1764 CA LEU A 136 19.449 -15.920 -2.192 1.00 0.00 C ATOM 1765 C LEU A 136 19.426 -16.179 -3.701 1.00 0.00 C ATOM 1766 O LEU A 136 20.453 -16.311 -4.337 1.00 0.00 O ATOM 1767 CB LEU A 136 19.836 -14.462 -1.942 1.00 0.00 C ATOM 1768 CG LEU A 136 19.837 -14.159 -0.439 1.00 0.00 C ATOM 1769 CD1 LEU A 136 20.272 -12.705 -0.230 1.00 0.00 C ATOM 1770 CD2 LEU A 136 18.429 -14.365 0.145 1.00 0.00 C ATOM 0 H LEU A 136 21.379 -16.428 -1.436 1.00 0.00 H new ATOM 0 HA LEU A 136 18.461 -16.121 -1.778 1.00 0.00 H new ATOM 0 HB2 LEU A 136 20.823 -14.264 -2.360 1.00 0.00 H new ATOM 0 HB3 LEU A 136 19.136 -13.801 -2.452 1.00 0.00 H new ATOM 0 HG LEU A 136 20.527 -14.833 0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 136 20.277 -12.476 0.836 1.00 0.00 H new ATOM 0 HD12 LEU A 136 21.273 -12.563 -0.636 1.00 0.00 H new ATOM 0 HD13 LEU A 136 19.576 -12.040 -0.741 1.00 0.00 H new ATOM 0 HD21 LEU A 136 18.443 -14.147 1.213 1.00 0.00 H new ATOM 0 HD22 LEU A 136 17.727 -13.696 -0.353 1.00 0.00 H new ATOM 0 HD23 LEU A 136 18.118 -15.398 -0.010 1.00 0.00 H new ATOM 1782 N GLN A 137 18.249 -16.241 -4.271 1.00 0.00 N ATOM 1783 CA GLN A 137 18.107 -16.483 -5.740 1.00 0.00 C ATOM 1784 C GLN A 137 17.194 -15.410 -6.341 1.00 0.00 C ATOM 1785 O GLN A 137 17.563 -14.248 -6.286 1.00 0.00 O ATOM 1786 CB GLN A 137 17.489 -17.867 -5.962 1.00 0.00 C ATOM 1787 CG GLN A 137 18.141 -18.878 -5.017 1.00 0.00 C ATOM 1788 CD GLN A 137 19.663 -18.839 -5.197 1.00 0.00 C ATOM 1789 OE1 GLN A 137 20.437 -18.720 -4.150 1.00 0.00 O flip ATOM 1790 NE2 GLN A 137 20.154 -18.918 -6.305 1.00 0.00 N flip ATOM 1791 OXT GLN A 137 16.142 -15.767 -6.845 1.00 0.00 O ATOM 0 H GLN A 137 17.366 -16.132 -3.772 1.00 0.00 H new ATOM 0 HA GLN A 137 19.084 -16.439 -6.221 1.00 0.00 H new ATOM 0 HB2 GLN A 137 16.414 -17.829 -5.785 1.00 0.00 H new ATOM 0 HB3 GLN A 137 17.631 -18.178 -6.997 1.00 0.00 H new ATOM 0 HG2 GLN A 137 17.880 -18.647 -3.984 1.00 0.00 H new ATOM 0 HG3 GLN A 137 17.765 -19.880 -5.224 1.00 0.00 H new ATOM 0 HE21 GLN A 137 19.553 -19.011 -7.124 1.00 0.00 H new ATOM 0 HE22 GLN A 137 21.168 -18.891 -6.417 1.00 0.00 H new