USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=29 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 120 LYS NZ :NH3+ 165:sc= 1.43 (180deg=0.862) USER MOD Set 1.2: A 141 THR OG1 : rot 50:sc= 0.977 USER MOD Set 2.1: A 103 HIS : no HD1:sc= 0.221 K(o=0.22,f=-2.7!) USER MOD Set 2.2: A 104 SER OG : rot 180:sc= 0.00285 USER MOD Set 3.1: A 23 ASN : amide:sc= 0.345 K(o=0.93,f=0.16) USER MOD Set 3.2: A 49 TYR OH : rot 120:sc= 0.316 USER MOD Set 3.3: A 53 TYR OH : rot -89:sc= 0.139 USER MOD Set 3.4: A 57 HIS : no HD1:sc= 0.129 X(o=0.93,f=0.66) USER MOD Single : A 28 TYR OH : rot -169:sc= 1.22 USER MOD Single : A 32 CYS SG : rot 82:sc= 1.27 USER MOD Single : A 33 SER OG : rot -65:sc= 1.18 USER MOD Single : A 37 THR OG1 : rot 130:sc= 0.0181 USER MOD Single : A 51 SER OG : rot -134:sc= 1.11 USER MOD Single : A 56 LYS NZ :NH3+ 179:sc= 1.17 (180deg=1.14) USER MOD Single : A 58 SER OG : rot -170:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot -160:sc= -0.0195 USER MOD Single : A 68 LYS NZ :NH3+ -167:sc= 1.05 (180deg=0.688) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl -169:sc= -2.55! (180deg=-3.31!) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 147:sc= 0.178 USER MOD Single : A 95 SER OG : rot 100:sc= -0.954 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 MET CE :methyl -120:sc= -2.37 (180deg=-5.3!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.0422 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 MET CE :methyl -125:sc= -0.199 (180deg=-1.36) USER MOD Single : A 134 LYS NZ :NH3+ -166:sc= 1.08 (180deg=0.912) USER MOD Single : A 137 ASN : amide:sc= -1.65 K(o=-1.7,f=-0.48) USER MOD Single : A 138 TYR OH : rot 180:sc= 1.02 USER MOD Single : A 142 TYR OH : rot -167:sc= 0.228 USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot -160:sc= 0.612 USER MOD ----------------------------------------------------------------- ATOM 305 N TRP A 22 -1.461 -14.097 0.511 1.00 0.00 N ATOM 306 CA TRP A 22 -1.694 -12.659 0.532 1.00 0.00 C ATOM 307 C TRP A 22 -2.449 -12.259 1.798 1.00 0.00 C ATOM 308 O TRP A 22 -2.452 -11.093 2.192 1.00 0.00 O ATOM 309 CB TRP A 22 -2.487 -12.226 -0.706 1.00 0.00 C ATOM 310 CG TRP A 22 -1.808 -12.552 -2.005 1.00 0.00 C ATOM 311 CD1 TRP A 22 -1.852 -13.737 -2.681 1.00 0.00 C ATOM 312 CD2 TRP A 22 -0.991 -11.677 -2.791 1.00 0.00 C ATOM 313 NE1 TRP A 22 -1.112 -13.653 -3.834 1.00 0.00 N ATOM 314 CE2 TRP A 22 -0.573 -12.400 -3.923 1.00 0.00 C ATOM 315 CE3 TRP A 22 -0.567 -10.352 -2.643 1.00 0.00 C ATOM 316 CZ2 TRP A 22 0.239 -11.841 -4.906 1.00 0.00 C ATOM 317 CZ3 TRP A 22 0.240 -9.799 -3.620 1.00 0.00 C ATOM 318 CH2 TRP A 22 0.637 -10.543 -4.736 1.00 0.00 C ATOM 0 HA TRP A 22 -0.727 -12.156 0.524 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -3.464 -12.708 -0.687 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -2.661 -11.151 -0.657 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -2.391 -14.614 -2.356 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -0.985 -14.403 -4.513 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -0.864 -9.772 -1.782 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 0.544 -12.411 -5.771 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 0.569 -8.775 -3.520 1.00 0.00 H new ATOM 0 HH2 TRP A 22 1.271 -10.083 -5.479 1.00 0.00 H new ATOM 329 N ASN A 23 -3.087 -13.242 2.427 1.00 0.00 N ATOM 330 CA ASN A 23 -3.910 -13.007 3.612 1.00 0.00 C ATOM 331 C ASN A 23 -3.099 -12.357 4.733 1.00 0.00 C ATOM 332 O ASN A 23 -3.488 -11.316 5.264 1.00 0.00 O ATOM 333 CB ASN A 23 -4.520 -14.323 4.105 1.00 0.00 C ATOM 334 CG ASN A 23 -5.498 -14.122 5.248 1.00 0.00 C ATOM 335 OD1 ASN A 23 -5.107 -14.052 6.411 1.00 0.00 O ATOM 336 ND2 ASN A 23 -6.781 -14.056 4.925 1.00 0.00 N ATOM 0 H ASN A 23 -3.050 -14.218 2.133 1.00 0.00 H new ATOM 0 HA ASN A 23 -4.710 -12.323 3.331 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -5.031 -14.815 3.277 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -3.721 -14.991 4.428 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -7.485 -13.943 5.654 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -7.065 -14.118 3.947 1.00 0.00 H new ATOM 343 N ASP A 24 -1.967 -12.970 5.076 1.00 0.00 N ATOM 344 CA ASP A 24 -1.099 -12.460 6.143 1.00 0.00 C ATOM 345 C ASP A 24 -0.622 -11.046 5.841 1.00 0.00 C ATOM 346 O ASP A 24 -0.482 -10.222 6.745 1.00 0.00 O ATOM 347 CB ASP A 24 0.114 -13.373 6.354 1.00 0.00 C ATOM 348 CG ASP A 24 -0.232 -14.661 7.072 1.00 0.00 C ATOM 349 OD1 ASP A 24 -0.186 -14.685 8.322 1.00 0.00 O ATOM 350 OD2 ASP A 24 -0.545 -15.656 6.389 1.00 0.00 O ATOM 0 H ASP A 24 -1.627 -13.822 4.631 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.694 -12.443 7.056 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.556 -13.610 5.386 1.00 0.00 H new ATOM 0 HB3 ASP A 24 0.870 -12.836 6.927 1.00 0.00 H new ATOM 355 N LEU A 25 -0.384 -10.771 4.564 1.00 0.00 N ATOM 356 CA LEU A 25 0.046 -9.448 4.128 1.00 0.00 C ATOM 357 C LEU A 25 -0.980 -8.398 4.533 1.00 0.00 C ATOM 358 O LEU A 25 -0.633 -7.362 5.100 1.00 0.00 O ATOM 359 CB LEU A 25 0.247 -9.433 2.610 1.00 0.00 C ATOM 360 CG LEU A 25 0.577 -8.065 2.006 1.00 0.00 C ATOM 361 CD1 LEU A 25 1.888 -7.533 2.562 1.00 0.00 C ATOM 362 CD2 LEU A 25 0.636 -8.156 0.488 1.00 0.00 C ATOM 0 H LEU A 25 -0.482 -11.450 3.809 1.00 0.00 H new ATOM 0 HA LEU A 25 0.994 -9.212 4.611 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.051 -10.125 2.360 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -0.659 -9.812 2.137 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.215 -7.368 2.280 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.103 -6.560 2.119 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.809 -7.430 3.644 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.693 -8.227 2.322 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.871 -7.176 0.074 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.408 -8.868 0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -0.329 -8.489 0.106 1.00 0.00 H new ATOM 374 N ALA A 26 -2.244 -8.687 4.257 1.00 0.00 N ATOM 375 CA ALA A 26 -3.332 -7.787 4.607 1.00 0.00 C ATOM 376 C ALA A 26 -3.402 -7.579 6.115 1.00 0.00 C ATOM 377 O ALA A 26 -3.482 -6.446 6.584 1.00 0.00 O ATOM 378 CB ALA A 26 -4.649 -8.324 4.077 1.00 0.00 C ATOM 0 H ALA A 26 -2.542 -9.543 3.789 1.00 0.00 H new ATOM 0 HA ALA A 26 -3.140 -6.819 4.144 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.455 -7.641 4.346 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -4.595 -8.413 2.992 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -4.844 -9.304 4.512 1.00 0.00 H new ATOM 384 N VAL A 27 -3.344 -8.676 6.869 1.00 0.00 N ATOM 385 CA VAL A 27 -3.397 -8.615 8.329 1.00 0.00 C ATOM 386 C VAL A 27 -2.264 -7.750 8.878 1.00 0.00 C ATOM 387 O VAL A 27 -2.473 -6.919 9.763 1.00 0.00 O ATOM 388 CB VAL A 27 -3.312 -10.024 8.960 1.00 0.00 C ATOM 389 CG1 VAL A 27 -3.385 -9.943 10.479 1.00 0.00 C ATOM 390 CG2 VAL A 27 -4.417 -10.922 8.419 1.00 0.00 C ATOM 0 H VAL A 27 -3.260 -9.620 6.492 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.356 -8.170 8.595 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.350 -10.459 8.688 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.323 -10.946 10.900 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.556 -9.341 10.852 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.328 -9.483 10.774 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.340 -11.909 8.875 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.388 -10.487 8.656 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.315 -11.013 7.338 1.00 0.00 H new ATOM 400 N TYR A 28 -1.071 -7.946 8.329 1.00 0.00 N ATOM 401 CA TYR A 28 0.107 -7.182 8.725 1.00 0.00 C ATOM 402 C TYR A 28 -0.151 -5.682 8.571 1.00 0.00 C ATOM 403 O TYR A 28 0.116 -4.895 9.481 1.00 0.00 O ATOM 404 CB TYR A 28 1.299 -7.609 7.858 1.00 0.00 C ATOM 405 CG TYR A 28 2.630 -7.017 8.264 1.00 0.00 C ATOM 406 CD1 TYR A 28 3.351 -7.554 9.319 1.00 0.00 C ATOM 407 CD2 TYR A 28 3.178 -5.943 7.576 1.00 0.00 C ATOM 408 CE1 TYR A 28 4.579 -7.040 9.680 1.00 0.00 C ATOM 409 CE2 TYR A 28 4.406 -5.419 7.933 1.00 0.00 C ATOM 410 CZ TYR A 28 5.102 -5.972 8.987 1.00 0.00 C ATOM 411 OH TYR A 28 6.336 -5.473 9.335 1.00 0.00 O ATOM 0 H TYR A 28 -0.893 -8.636 7.599 1.00 0.00 H new ATOM 0 HA TYR A 28 0.330 -7.382 9.773 1.00 0.00 H new ATOM 0 HB2 TYR A 28 1.378 -8.696 7.886 1.00 0.00 H new ATOM 0 HB3 TYR A 28 1.095 -7.331 6.824 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.944 -8.390 9.868 1.00 0.00 H new ATOM 0 HD2 TYR A 28 2.636 -5.510 6.748 1.00 0.00 H new ATOM 0 HE1 TYR A 28 5.128 -7.474 10.503 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.818 -4.581 7.390 1.00 0.00 H new ATOM 0 HH TYR A 28 6.486 -4.621 8.874 1.00 0.00 H new ATOM 421 N ILE A 29 -0.696 -5.303 7.421 1.00 0.00 N ATOM 422 CA ILE A 29 -1.022 -3.908 7.132 1.00 0.00 C ATOM 423 C ILE A 29 -2.087 -3.390 8.098 1.00 0.00 C ATOM 424 O ILE A 29 -1.990 -2.270 8.610 1.00 0.00 O ATOM 425 CB ILE A 29 -1.524 -3.752 5.681 1.00 0.00 C ATOM 426 CG1 ILE A 29 -0.457 -4.247 4.703 1.00 0.00 C ATOM 427 CG2 ILE A 29 -1.892 -2.302 5.386 1.00 0.00 C ATOM 428 CD1 ILE A 29 -0.948 -4.375 3.279 1.00 0.00 C ATOM 0 H ILE A 29 -0.924 -5.949 6.665 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.112 -3.322 7.258 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.422 -4.357 5.558 1.00 0.00 H new ATOM 0 HG12 ILE A 29 0.390 -3.561 4.725 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.090 -5.217 5.040 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.243 -2.218 4.357 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.681 -1.981 6.066 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -1.015 -1.669 5.523 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.136 -4.731 2.645 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.775 -5.084 3.242 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.287 -3.403 2.922 1.00 0.00 H new ATOM 440 N ILE A 30 -3.090 -4.226 8.345 1.00 0.00 N ATOM 441 CA ILE A 30 -4.175 -3.908 9.269 1.00 0.00 C ATOM 442 C ILE A 30 -3.633 -3.564 10.653 1.00 0.00 C ATOM 443 O ILE A 30 -4.051 -2.584 11.270 1.00 0.00 O ATOM 444 CB ILE A 30 -5.158 -5.096 9.384 1.00 0.00 C ATOM 445 CG1 ILE A 30 -5.879 -5.312 8.052 1.00 0.00 C ATOM 446 CG2 ILE A 30 -6.161 -4.870 10.508 1.00 0.00 C ATOM 447 CD1 ILE A 30 -6.573 -6.653 7.940 1.00 0.00 C ATOM 0 H ILE A 30 -3.174 -5.145 7.910 1.00 0.00 H new ATOM 0 HA ILE A 30 -4.702 -3.041 8.871 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.587 -5.993 9.624 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -6.616 -4.520 7.916 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -5.158 -5.218 7.240 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.840 -5.721 10.566 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -5.630 -4.764 11.454 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.732 -3.963 10.309 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.061 -6.730 6.968 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -5.839 -7.452 8.042 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -7.320 -6.743 8.729 1.00 0.00 H new ATOM 459 N ARG A 31 -2.679 -4.356 11.121 1.00 0.00 N ATOM 460 CA ARG A 31 -2.117 -4.170 12.453 1.00 0.00 C ATOM 461 C ARG A 31 -1.269 -2.906 12.515 1.00 0.00 C ATOM 462 O ARG A 31 -1.170 -2.264 13.560 1.00 0.00 O ATOM 463 CB ARG A 31 -1.270 -5.377 12.850 1.00 0.00 C ATOM 464 CG ARG A 31 -2.037 -6.684 12.858 1.00 0.00 C ATOM 465 CD ARG A 31 -1.153 -7.832 13.311 1.00 0.00 C ATOM 466 NE ARG A 31 -0.781 -7.702 14.721 1.00 0.00 N ATOM 467 CZ ARG A 31 0.102 -8.484 15.340 1.00 0.00 C ATOM 468 NH1 ARG A 31 0.698 -9.477 14.690 1.00 0.00 N ATOM 469 NH2 ARG A 31 0.380 -8.270 16.619 1.00 0.00 N ATOM 0 H ARG A 31 -2.277 -5.134 10.598 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.946 -4.069 13.153 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.430 -5.463 12.160 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -0.852 -5.206 13.842 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.898 -6.600 13.521 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.422 -6.890 11.859 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -1.675 -8.776 13.157 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.252 -7.862 12.698 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.227 -6.964 15.265 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.481 -9.646 13.708 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.373 -10.070 15.173 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.081 -7.511 17.121 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.055 -8.864 17.101 1.00 0.00 H new ATOM 483 N CYS A 32 -0.665 -2.553 11.391 1.00 0.00 N ATOM 484 CA CYS A 32 0.191 -1.378 11.323 1.00 0.00 C ATOM 485 C CYS A 32 -0.635 -0.093 11.298 1.00 0.00 C ATOM 486 O CYS A 32 -0.194 0.950 11.784 1.00 0.00 O ATOM 487 CB CYS A 32 1.083 -1.452 10.086 1.00 0.00 C ATOM 488 SG CYS A 32 2.201 -2.872 10.068 1.00 0.00 S ATOM 0 H CYS A 32 -0.752 -3.064 10.512 1.00 0.00 H new ATOM 0 HA CYS A 32 0.815 -1.361 12.217 1.00 0.00 H new ATOM 0 HB2 CYS A 32 0.452 -1.488 9.198 1.00 0.00 H new ATOM 0 HB3 CYS A 32 1.673 -0.538 10.021 1.00 0.00 H new ATOM 0 HG CYS A 32 1.564 -3.920 9.638 1.00 0.00 H new ATOM 494 N SER A 33 -1.838 -0.172 10.742 1.00 0.00 N ATOM 495 CA SER A 33 -2.703 0.992 10.640 1.00 0.00 C ATOM 496 C SER A 33 -3.942 0.845 11.528 1.00 0.00 C ATOM 497 O SER A 33 -3.880 1.085 12.737 1.00 0.00 O ATOM 498 CB SER A 33 -3.095 1.229 9.177 1.00 0.00 C ATOM 499 OG SER A 33 -3.594 0.041 8.580 1.00 0.00 O ATOM 0 H SER A 33 -2.234 -1.029 10.356 1.00 0.00 H new ATOM 0 HA SER A 33 -2.152 1.862 10.997 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.852 2.012 9.123 1.00 0.00 H new ATOM 0 HB3 SER A 33 -2.229 1.584 8.619 1.00 0.00 H new ATOM 0 HG SER A 33 -2.880 -0.629 8.537 1.00 0.00 H new ATOM 505 N GLY A 34 -5.051 0.418 10.939 1.00 0.00 N ATOM 506 CA GLY A 34 -6.288 0.286 11.683 1.00 0.00 C ATOM 507 C GLY A 34 -7.343 1.263 11.209 1.00 0.00 C ATOM 508 O GLY A 34 -7.100 2.031 10.280 1.00 0.00 O ATOM 0 H GLY A 34 -5.116 0.160 9.954 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -6.665 -0.732 11.582 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -6.093 0.450 12.743 1.00 0.00 H new ATOM 512 N PRO A 35 -8.531 1.260 11.830 1.00 0.00 N ATOM 513 CA PRO A 35 -9.631 2.151 11.450 1.00 0.00 C ATOM 514 C PRO A 35 -9.355 3.605 11.831 1.00 0.00 C ATOM 515 O PRO A 35 -8.657 3.882 12.810 1.00 0.00 O ATOM 516 CB PRO A 35 -10.835 1.613 12.242 1.00 0.00 C ATOM 517 CG PRO A 35 -10.394 0.305 12.815 1.00 0.00 C ATOM 518 CD PRO A 35 -8.903 0.389 12.950 1.00 0.00 C ATOM 0 HA PRO A 35 -9.787 2.158 10.371 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -11.126 2.307 13.030 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.703 1.484 11.595 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -10.863 0.126 13.783 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -10.680 -0.521 12.164 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -8.606 0.812 13.909 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -8.433 -0.592 12.875 1.00 0.00 H new ATOM 526 N GLY A 36 -9.911 4.531 11.058 1.00 0.00 N ATOM 527 CA GLY A 36 -9.727 5.943 11.339 1.00 0.00 C ATOM 528 C GLY A 36 -8.447 6.499 10.748 1.00 0.00 C ATOM 529 O GLY A 36 -7.737 7.269 11.396 1.00 0.00 O ATOM 0 H GLY A 36 -10.487 4.329 10.241 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -10.576 6.501 10.944 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.720 6.096 12.418 1.00 0.00 H new ATOM 533 N THR A 37 -8.150 6.100 9.522 1.00 0.00 N ATOM 534 CA THR A 37 -6.988 6.598 8.808 1.00 0.00 C ATOM 535 C THR A 37 -7.076 6.175 7.344 1.00 0.00 C ATOM 536 O THR A 37 -8.054 5.543 6.942 1.00 0.00 O ATOM 537 CB THR A 37 -5.664 6.095 9.441 1.00 0.00 C ATOM 538 OG1 THR A 37 -4.544 6.769 8.856 1.00 0.00 O ATOM 539 CG2 THR A 37 -5.498 4.591 9.266 1.00 0.00 C ATOM 0 H THR A 37 -8.705 5.425 8.997 1.00 0.00 H new ATOM 0 HA THR A 37 -6.983 7.686 8.876 1.00 0.00 H new ATOM 0 HB THR A 37 -5.707 6.315 10.508 1.00 0.00 H new ATOM 0 HG1 THR A 37 -3.966 7.119 9.566 1.00 0.00 H new ATOM 0 HG21 THR A 37 -4.560 4.273 9.721 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.328 4.075 9.748 1.00 0.00 H new ATOM 0 HG23 THR A 37 -5.487 4.347 8.204 1.00 0.00 H new ATOM 547 N ARG A 38 -6.073 6.528 6.556 1.00 0.00 N ATOM 548 CA ARG A 38 -6.063 6.210 5.136 1.00 0.00 C ATOM 549 C ARG A 38 -4.939 5.239 4.800 1.00 0.00 C ATOM 550 O ARG A 38 -3.820 5.378 5.293 1.00 0.00 O ATOM 551 CB ARG A 38 -5.912 7.490 4.308 1.00 0.00 C ATOM 552 CG ARG A 38 -7.146 8.377 4.335 1.00 0.00 C ATOM 553 CD ARG A 38 -6.890 9.732 3.688 1.00 0.00 C ATOM 554 NE ARG A 38 -6.420 9.626 2.304 1.00 0.00 N ATOM 555 CZ ARG A 38 -7.206 9.774 1.233 1.00 0.00 C ATOM 556 NH1 ARG A 38 -8.520 9.916 1.379 1.00 0.00 N ATOM 557 NH2 ARG A 38 -6.680 9.763 0.014 1.00 0.00 N ATOM 0 H ARG A 38 -5.250 7.038 6.878 1.00 0.00 H new ATOM 0 HA ARG A 38 -7.012 5.734 4.890 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -5.059 8.056 4.681 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.689 7.221 3.275 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -7.964 7.876 3.816 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -7.465 8.523 5.367 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -7.809 10.318 3.710 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -6.151 10.276 4.276 1.00 0.00 H new ATOM 0 HE ARG A 38 -5.432 9.427 2.148 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -8.933 9.912 2.312 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -9.115 10.029 0.558 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -5.674 9.641 -0.106 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -7.281 9.876 -0.802 1.00 0.00 H new ATOM 571 N VAL A 39 -5.249 4.241 3.988 1.00 0.00 N ATOM 572 CA VAL A 39 -4.238 3.323 3.475 1.00 0.00 C ATOM 573 C VAL A 39 -4.296 3.325 1.955 1.00 0.00 C ATOM 574 O VAL A 39 -5.373 3.217 1.379 1.00 0.00 O ATOM 575 CB VAL A 39 -4.443 1.877 3.983 1.00 0.00 C ATOM 576 CG1 VAL A 39 -3.306 0.977 3.526 1.00 0.00 C ATOM 577 CG2 VAL A 39 -4.572 1.838 5.495 1.00 0.00 C ATOM 0 H VAL A 39 -6.197 4.043 3.667 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.267 3.665 3.834 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.374 1.506 3.554 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.472 -0.035 3.895 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.268 0.964 2.437 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.362 1.356 3.918 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.715 0.808 5.822 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.666 2.240 5.948 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.428 2.438 5.803 1.00 0.00 H new ATOM 587 N VAL A 40 -3.150 3.452 1.306 1.00 0.00 N ATOM 588 CA VAL A 40 -3.121 3.552 -0.146 1.00 0.00 C ATOM 589 C VAL A 40 -2.625 2.255 -0.780 1.00 0.00 C ATOM 590 O VAL A 40 -1.541 1.766 -0.451 1.00 0.00 O ATOM 591 CB VAL A 40 -2.236 4.731 -0.611 1.00 0.00 C ATOM 592 CG1 VAL A 40 -2.241 4.851 -2.128 1.00 0.00 C ATOM 593 CG2 VAL A 40 -2.698 6.031 0.029 1.00 0.00 C ATOM 0 H VAL A 40 -2.235 3.488 1.755 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.144 3.734 -0.474 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.213 4.532 -0.291 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.611 5.688 -2.429 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -1.856 3.931 -2.567 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -3.260 5.020 -2.476 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.063 6.849 -0.310 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.731 6.230 -0.257 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.632 5.946 1.114 1.00 0.00 H new ATOM 603 N GLU A 41 -3.434 1.699 -1.672 1.00 0.00 N ATOM 604 CA GLU A 41 -3.061 0.499 -2.412 1.00 0.00 C ATOM 605 C GLU A 41 -2.664 0.872 -3.839 1.00 0.00 C ATOM 606 O GLU A 41 -3.504 1.279 -4.647 1.00 0.00 O ATOM 607 CB GLU A 41 -4.218 -0.512 -2.424 1.00 0.00 C ATOM 608 CG GLU A 41 -3.899 -1.815 -3.150 1.00 0.00 C ATOM 609 CD GLU A 41 -5.027 -2.830 -3.066 1.00 0.00 C ATOM 610 OE1 GLU A 41 -6.050 -2.649 -3.756 1.00 0.00 O ATOM 611 OE2 GLU A 41 -4.896 -3.812 -2.306 1.00 0.00 O ATOM 0 H GLU A 41 -4.359 2.062 -1.902 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.209 0.033 -1.917 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -4.497 -0.741 -1.395 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -5.086 -0.049 -2.894 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -3.688 -1.599 -4.197 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -2.994 -2.249 -2.726 1.00 0.00 H new ATOM 618 N VAL A 42 -1.376 0.759 -4.131 1.00 0.00 N ATOM 619 CA VAL A 42 -0.856 1.074 -5.453 1.00 0.00 C ATOM 620 C VAL A 42 -0.727 -0.200 -6.278 1.00 0.00 C ATOM 621 O VAL A 42 -0.209 -1.210 -5.798 1.00 0.00 O ATOM 622 CB VAL A 42 0.521 1.775 -5.371 1.00 0.00 C ATOM 623 CG1 VAL A 42 1.013 2.168 -6.758 1.00 0.00 C ATOM 624 CG2 VAL A 42 0.451 2.993 -4.464 1.00 0.00 C ATOM 0 H VAL A 42 -0.668 0.449 -3.465 1.00 0.00 H new ATOM 0 HA VAL A 42 -1.559 1.757 -5.931 1.00 0.00 H new ATOM 0 HB VAL A 42 1.234 1.070 -4.944 1.00 0.00 H new ATOM 0 HG11 VAL A 42 1.983 2.659 -6.675 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.110 1.275 -7.376 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.299 2.851 -7.217 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.430 3.471 -4.420 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -0.280 3.699 -4.858 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.153 2.684 -3.462 1.00 0.00 H new ATOM 634 N GLY A 43 -1.204 -0.153 -7.512 1.00 0.00 N ATOM 635 CA GLY A 43 -1.154 -1.322 -8.363 1.00 0.00 C ATOM 636 C GLY A 43 -2.362 -2.209 -8.170 1.00 0.00 C ATOM 637 O GLY A 43 -2.328 -3.396 -8.499 1.00 0.00 O ATOM 0 H GLY A 43 -1.624 0.673 -7.939 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.095 -1.010 -9.406 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.248 -1.889 -8.148 1.00 0.00 H new ATOM 641 N ALA A 44 -3.427 -1.622 -7.628 1.00 0.00 N ATOM 642 CA ALA A 44 -4.677 -2.337 -7.404 1.00 0.00 C ATOM 643 C ALA A 44 -5.178 -2.947 -8.710 1.00 0.00 C ATOM 644 O ALA A 44 -5.181 -4.168 -8.875 1.00 0.00 O ATOM 645 CB ALA A 44 -5.715 -1.393 -6.814 1.00 0.00 C ATOM 0 H ALA A 44 -3.446 -0.645 -7.335 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.503 -3.147 -6.696 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -6.647 -1.934 -6.649 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.351 -0.999 -5.865 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -5.891 -0.569 -7.505 1.00 0.00 H new ATOM 651 N GLY A 45 -5.581 -2.077 -9.633 1.00 0.00 N ATOM 652 CA GLY A 45 -5.943 -2.496 -10.975 1.00 0.00 C ATOM 653 C GLY A 45 -7.064 -3.514 -11.024 1.00 0.00 C ATOM 654 O GLY A 45 -8.239 -3.155 -11.036 1.00 0.00 O ATOM 0 H GLY A 45 -5.664 -1.074 -9.470 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.238 -1.619 -11.551 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -5.063 -2.916 -11.463 1.00 0.00 H new ATOM 658 N ARG A 46 -6.692 -4.785 -11.046 1.00 0.00 N ATOM 659 CA ARG A 46 -7.641 -5.862 -11.260 1.00 0.00 C ATOM 660 C ARG A 46 -7.535 -6.904 -10.140 1.00 0.00 C ATOM 661 O ARG A 46 -8.099 -7.996 -10.225 1.00 0.00 O ATOM 662 CB ARG A 46 -7.350 -6.485 -12.626 1.00 0.00 C ATOM 663 CG ARG A 46 -8.461 -7.355 -13.186 1.00 0.00 C ATOM 664 CD ARG A 46 -8.110 -7.834 -14.584 1.00 0.00 C ATOM 665 NE ARG A 46 -9.108 -8.751 -15.128 1.00 0.00 N ATOM 666 CZ ARG A 46 -8.841 -10.007 -15.478 1.00 0.00 C ATOM 667 NH1 ARG A 46 -7.616 -10.498 -15.309 1.00 0.00 N ATOM 668 NH2 ARG A 46 -9.796 -10.776 -15.989 1.00 0.00 N ATOM 0 H ARG A 46 -5.729 -5.096 -10.917 1.00 0.00 H new ATOM 0 HA ARG A 46 -8.661 -5.477 -11.243 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -7.143 -5.685 -13.337 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -6.443 -7.085 -12.549 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -8.624 -8.212 -12.532 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -9.394 -6.792 -13.212 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.013 -6.973 -15.246 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -7.140 -8.330 -14.562 1.00 0.00 H new ATOM 0 HE ARG A 46 -10.062 -8.410 -15.246 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -6.882 -9.912 -14.911 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -7.411 -11.461 -15.577 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -10.738 -10.404 -16.114 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -9.588 -11.738 -16.256 1.00 0.00 H new ATOM 682 N PHE A 47 -6.807 -6.558 -9.084 1.00 0.00 N ATOM 683 CA PHE A 47 -6.639 -7.443 -7.937 1.00 0.00 C ATOM 684 C PHE A 47 -6.868 -6.659 -6.651 1.00 0.00 C ATOM 685 O PHE A 47 -5.977 -5.969 -6.169 1.00 0.00 O ATOM 686 CB PHE A 47 -5.237 -8.069 -7.942 1.00 0.00 C ATOM 687 CG PHE A 47 -5.045 -9.148 -6.911 1.00 0.00 C ATOM 688 CD1 PHE A 47 -5.446 -10.448 -7.173 1.00 0.00 C ATOM 689 CD2 PHE A 47 -4.460 -8.867 -5.686 1.00 0.00 C ATOM 690 CE1 PHE A 47 -5.270 -11.447 -6.235 1.00 0.00 C ATOM 691 CE2 PHE A 47 -4.282 -9.861 -4.742 1.00 0.00 C ATOM 692 CZ PHE A 47 -4.688 -11.153 -5.017 1.00 0.00 C ATOM 0 H PHE A 47 -6.321 -5.665 -8.999 1.00 0.00 H new ATOM 0 HA PHE A 47 -7.370 -8.249 -7.998 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.040 -8.485 -8.930 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -4.499 -7.284 -7.774 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -5.902 -10.684 -8.123 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -4.139 -7.859 -5.467 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -5.587 -12.456 -6.454 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -3.826 -9.628 -3.791 1.00 0.00 H new ATOM 0 HZ PHE A 47 -4.551 -11.931 -4.281 1.00 0.00 H new ATOM 702 N LEU A 48 -8.073 -6.762 -6.107 1.00 0.00 N ATOM 703 CA LEU A 48 -8.470 -5.932 -4.970 1.00 0.00 C ATOM 704 C LEU A 48 -8.684 -6.761 -3.705 1.00 0.00 C ATOM 705 O LEU A 48 -9.412 -6.346 -2.806 1.00 0.00 O ATOM 706 CB LEU A 48 -9.764 -5.187 -5.307 1.00 0.00 C ATOM 707 CG LEU A 48 -9.729 -4.361 -6.594 1.00 0.00 C ATOM 708 CD1 LEU A 48 -11.076 -3.701 -6.843 1.00 0.00 C ATOM 709 CD2 LEU A 48 -8.627 -3.317 -6.527 1.00 0.00 C ATOM 0 H LEU A 48 -8.793 -7.408 -6.431 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.662 -5.226 -4.778 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -10.572 -5.914 -5.384 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -10.009 -4.525 -4.477 1.00 0.00 H new ATOM 0 HG LEU A 48 -9.517 -5.032 -7.427 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -11.031 -3.118 -7.763 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -11.845 -4.468 -6.937 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -11.319 -3.043 -6.008 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.617 -2.739 -7.451 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -8.808 -2.650 -5.684 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -7.664 -3.812 -6.398 1.00 0.00 H new ATOM 721 N TYR A 49 -8.045 -7.924 -3.627 1.00 0.00 N ATOM 722 CA TYR A 49 -8.242 -8.814 -2.485 1.00 0.00 C ATOM 723 C TYR A 49 -7.740 -8.189 -1.187 1.00 0.00 C ATOM 724 O TYR A 49 -8.462 -8.157 -0.191 1.00 0.00 O ATOM 725 CB TYR A 49 -7.546 -10.164 -2.697 1.00 0.00 C ATOM 726 CG TYR A 49 -7.479 -10.992 -1.429 1.00 0.00 C ATOM 727 CD1 TYR A 49 -8.602 -11.652 -0.943 1.00 0.00 C ATOM 728 CD2 TYR A 49 -6.298 -11.086 -0.700 1.00 0.00 C ATOM 729 CE1 TYR A 49 -8.550 -12.380 0.234 1.00 0.00 C ATOM 730 CE2 TYR A 49 -6.237 -11.816 0.470 1.00 0.00 C ATOM 731 CZ TYR A 49 -7.364 -12.458 0.935 1.00 0.00 C ATOM 732 OH TYR A 49 -7.306 -13.168 2.112 1.00 0.00 O ATOM 0 H TYR A 49 -7.394 -8.271 -4.331 1.00 0.00 H new ATOM 0 HA TYR A 49 -9.317 -8.976 -2.404 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -8.077 -10.726 -3.465 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -6.536 -9.993 -3.068 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -9.530 -11.596 -1.492 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -5.413 -10.579 -1.056 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -9.432 -12.884 0.601 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -5.309 -11.884 1.019 1.00 0.00 H new ATOM 0 HH TYR A 49 -6.648 -13.889 2.027 1.00 0.00 H new ATOM 742 N VAL A 50 -6.505 -7.700 -1.202 1.00 0.00 N ATOM 743 CA VAL A 50 -5.862 -7.216 0.012 1.00 0.00 C ATOM 744 C VAL A 50 -6.641 -6.054 0.617 1.00 0.00 C ATOM 745 O VAL A 50 -7.051 -6.115 1.777 1.00 0.00 O ATOM 746 CB VAL A 50 -4.403 -6.786 -0.253 1.00 0.00 C ATOM 747 CG1 VAL A 50 -3.718 -6.375 1.043 1.00 0.00 C ATOM 748 CG2 VAL A 50 -3.633 -7.911 -0.930 1.00 0.00 C ATOM 0 H VAL A 50 -5.930 -7.629 -2.041 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.853 -8.043 0.722 1.00 0.00 H new ATOM 0 HB VAL A 50 -4.416 -5.924 -0.920 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.691 -6.076 0.833 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.256 -5.538 1.489 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.716 -7.216 1.736 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.606 -7.592 -1.110 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.632 -8.790 -0.286 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.108 -8.157 -1.880 1.00 0.00 H new ATOM 758 N SER A 51 -6.864 -5.017 -0.181 1.00 0.00 N ATOM 759 CA SER A 51 -7.603 -3.845 0.264 1.00 0.00 C ATOM 760 C SER A 51 -8.999 -4.207 0.769 1.00 0.00 C ATOM 761 O SER A 51 -9.443 -3.701 1.803 1.00 0.00 O ATOM 762 CB SER A 51 -7.699 -2.836 -0.877 1.00 0.00 C ATOM 763 OG SER A 51 -8.082 -3.461 -2.091 1.00 0.00 O ATOM 0 H SER A 51 -6.540 -4.966 -1.147 1.00 0.00 H new ATOM 0 HA SER A 51 -7.061 -3.404 1.100 1.00 0.00 H new ATOM 0 HB2 SER A 51 -8.423 -2.062 -0.620 1.00 0.00 H new ATOM 0 HB3 SER A 51 -6.737 -2.341 -1.009 1.00 0.00 H new ATOM 0 HG SER A 51 -7.503 -3.147 -2.817 1.00 0.00 H new ATOM 769 N ASP A 52 -9.684 -5.086 0.046 1.00 0.00 N ATOM 770 CA ASP A 52 -11.033 -5.499 0.425 1.00 0.00 C ATOM 771 C ASP A 52 -11.019 -6.254 1.752 1.00 0.00 C ATOM 772 O ASP A 52 -11.861 -6.019 2.618 1.00 0.00 O ATOM 773 CB ASP A 52 -11.664 -6.362 -0.670 1.00 0.00 C ATOM 774 CG ASP A 52 -13.077 -6.795 -0.330 1.00 0.00 C ATOM 775 OD1 ASP A 52 -13.967 -5.919 -0.224 1.00 0.00 O ATOM 776 OD2 ASP A 52 -13.305 -8.009 -0.163 1.00 0.00 O ATOM 0 H ASP A 52 -9.330 -5.526 -0.803 1.00 0.00 H new ATOM 0 HA ASP A 52 -11.636 -4.600 0.548 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -11.674 -5.804 -1.606 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -11.046 -7.245 -0.832 1.00 0.00 H new ATOM 781 N TYR A 53 -10.047 -7.143 1.912 1.00 0.00 N ATOM 782 CA TYR A 53 -9.884 -7.890 3.154 1.00 0.00 C ATOM 783 C TYR A 53 -9.622 -6.934 4.319 1.00 0.00 C ATOM 784 O TYR A 53 -10.177 -7.092 5.409 1.00 0.00 O ATOM 785 CB TYR A 53 -8.733 -8.892 3.013 1.00 0.00 C ATOM 786 CG TYR A 53 -8.521 -9.770 4.228 1.00 0.00 C ATOM 787 CD1 TYR A 53 -9.248 -10.940 4.402 1.00 0.00 C ATOM 788 CD2 TYR A 53 -7.588 -9.431 5.198 1.00 0.00 C ATOM 789 CE1 TYR A 53 -9.051 -11.744 5.507 1.00 0.00 C ATOM 790 CE2 TYR A 53 -7.385 -10.230 6.306 1.00 0.00 C ATOM 791 CZ TYR A 53 -8.119 -11.386 6.456 1.00 0.00 C ATOM 792 OH TYR A 53 -7.917 -12.190 7.555 1.00 0.00 O ATOM 0 H TYR A 53 -9.357 -7.365 1.195 1.00 0.00 H new ATOM 0 HA TYR A 53 -10.803 -8.438 3.360 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -8.924 -9.528 2.148 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -7.813 -8.345 2.809 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -9.980 -11.226 3.661 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -7.010 -8.526 5.084 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -9.626 -12.651 5.627 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -6.655 -9.950 7.051 1.00 0.00 H new ATOM 0 HH TYR A 53 -8.534 -11.928 8.270 1.00 0.00 H new ATOM 802 N ILE A 54 -8.786 -5.933 4.072 1.00 0.00 N ATOM 803 CA ILE A 54 -8.458 -4.937 5.084 1.00 0.00 C ATOM 804 C ILE A 54 -9.687 -4.114 5.472 1.00 0.00 C ATOM 805 O ILE A 54 -9.987 -3.970 6.655 1.00 0.00 O ATOM 806 CB ILE A 54 -7.337 -3.987 4.603 1.00 0.00 C ATOM 807 CG1 ILE A 54 -6.054 -4.776 4.328 1.00 0.00 C ATOM 808 CG2 ILE A 54 -7.077 -2.894 5.633 1.00 0.00 C ATOM 809 CD1 ILE A 54 -4.941 -3.943 3.736 1.00 0.00 C ATOM 0 H ILE A 54 -8.321 -5.789 3.176 1.00 0.00 H new ATOM 0 HA ILE A 54 -8.105 -5.483 5.959 1.00 0.00 H new ATOM 0 HB ILE A 54 -7.662 -3.513 3.677 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -5.706 -5.221 5.260 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.282 -5.597 3.648 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.285 -2.237 5.274 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.987 -2.314 5.786 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.773 -3.348 6.576 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -4.066 -4.571 3.569 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.269 -3.519 2.787 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -4.684 -3.138 4.424 1.00 0.00 H new ATOM 821 N ARG A 55 -10.409 -3.604 4.476 1.00 0.00 N ATOM 822 CA ARG A 55 -11.557 -2.729 4.731 1.00 0.00 C ATOM 823 C ARG A 55 -12.708 -3.495 5.392 1.00 0.00 C ATOM 824 O ARG A 55 -13.609 -2.896 5.984 1.00 0.00 O ATOM 825 CB ARG A 55 -12.036 -2.062 3.433 1.00 0.00 C ATOM 826 CG ARG A 55 -12.622 -3.027 2.416 1.00 0.00 C ATOM 827 CD ARG A 55 -13.015 -2.316 1.131 1.00 0.00 C ATOM 828 NE ARG A 55 -13.605 -3.234 0.157 1.00 0.00 N ATOM 829 CZ ARG A 55 -14.118 -2.859 -1.015 1.00 0.00 C ATOM 830 NH1 ARG A 55 -14.046 -1.594 -1.413 1.00 0.00 N ATOM 831 NH2 ARG A 55 -14.666 -3.768 -1.806 1.00 0.00 N ATOM 0 H ARG A 55 -10.223 -3.779 3.489 1.00 0.00 H new ATOM 0 HA ARG A 55 -11.229 -1.951 5.421 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.787 -1.311 3.679 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -11.197 -1.536 2.977 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -11.894 -3.807 2.193 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -13.496 -3.519 2.842 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -13.726 -1.522 1.359 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -12.136 -1.841 0.696 1.00 0.00 H new ATOM 0 HE ARG A 55 -13.625 -4.227 0.390 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -13.595 -0.898 -0.820 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -14.442 -1.319 -2.312 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -14.693 -4.746 -1.517 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -15.061 -3.491 -2.705 1.00 0.00 H new ATOM 845 N LYS A 56 -12.680 -4.817 5.284 1.00 0.00 N ATOM 846 CA LYS A 56 -13.671 -5.657 5.940 1.00 0.00 C ATOM 847 C LYS A 56 -13.278 -5.937 7.384 1.00 0.00 C ATOM 848 O LYS A 56 -14.134 -6.031 8.264 1.00 0.00 O ATOM 849 CB LYS A 56 -13.854 -6.959 5.173 1.00 0.00 C ATOM 850 CG LYS A 56 -14.699 -6.787 3.926 1.00 0.00 C ATOM 851 CD LYS A 56 -14.689 -8.038 3.078 1.00 0.00 C ATOM 852 CE LYS A 56 -15.667 -7.933 1.919 1.00 0.00 C ATOM 853 NZ LYS A 56 -15.445 -8.997 0.908 1.00 0.00 N ATOM 0 H LYS A 56 -11.981 -5.330 4.748 1.00 0.00 H new ATOM 0 HA LYS A 56 -14.620 -5.121 5.947 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -12.877 -7.352 4.894 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -14.321 -7.698 5.825 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -15.723 -6.545 4.209 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -14.323 -5.947 3.342 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -13.684 -8.210 2.693 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -14.945 -8.899 3.695 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -16.687 -7.999 2.298 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -15.566 -6.956 1.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -16.143 -8.900 0.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -14.486 -8.908 0.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -15.550 -9.929 1.356 1.00 0.00 H new ATOM 867 N HIS A 57 -11.981 -6.050 7.627 1.00 0.00 N ATOM 868 CA HIS A 57 -11.477 -6.291 8.973 1.00 0.00 C ATOM 869 C HIS A 57 -11.441 -5.004 9.788 1.00 0.00 C ATOM 870 O HIS A 57 -11.635 -5.018 11.003 1.00 0.00 O ATOM 871 CB HIS A 57 -10.084 -6.916 8.920 1.00 0.00 C ATOM 872 CG HIS A 57 -10.079 -8.388 9.187 1.00 0.00 C ATOM 873 ND1 HIS A 57 -9.632 -8.892 10.385 1.00 0.00 N ATOM 874 CD2 HIS A 57 -10.469 -9.414 8.392 1.00 0.00 C ATOM 875 CE1 HIS A 57 -9.760 -10.205 10.297 1.00 0.00 C ATOM 876 NE2 HIS A 57 -10.263 -10.569 9.108 1.00 0.00 N ATOM 0 H HIS A 57 -11.258 -5.979 6.911 1.00 0.00 H new ATOM 0 HA HIS A 57 -12.159 -6.986 9.463 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -9.649 -6.732 7.938 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -9.444 -6.420 9.650 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -10.865 -9.339 7.390 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -9.493 -10.897 11.083 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -10.456 -11.521 8.795 1.00 0.00 H new ATOM 884 N SER A 58 -11.174 -3.898 9.122 1.00 0.00 N ATOM 885 CA SER A 58 -11.151 -2.606 9.770 1.00 0.00 C ATOM 886 C SER A 58 -11.743 -1.546 8.862 1.00 0.00 C ATOM 887 O SER A 58 -11.455 -1.516 7.666 1.00 0.00 O ATOM 888 CB SER A 58 -9.718 -2.242 10.147 1.00 0.00 C ATOM 889 OG SER A 58 -9.188 -3.169 11.081 1.00 0.00 O ATOM 0 H SER A 58 -10.968 -3.871 8.123 1.00 0.00 H new ATOM 0 HA SER A 58 -11.755 -2.656 10.676 1.00 0.00 H new ATOM 0 HB2 SER A 58 -9.096 -2.225 9.252 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.693 -1.238 10.571 1.00 0.00 H new ATOM 0 HG SER A 58 -8.335 -2.833 11.427 1.00 0.00 H new ATOM 895 N LYS A 59 -12.582 -0.688 9.424 1.00 0.00 N ATOM 896 CA LYS A 59 -13.155 0.411 8.667 1.00 0.00 C ATOM 897 C LYS A 59 -12.107 1.503 8.489 1.00 0.00 C ATOM 898 O LYS A 59 -12.208 2.598 9.043 1.00 0.00 O ATOM 899 CB LYS A 59 -14.412 0.957 9.352 1.00 0.00 C ATOM 900 CG LYS A 59 -15.460 1.511 8.388 1.00 0.00 C ATOM 901 CD LYS A 59 -15.017 2.803 7.716 1.00 0.00 C ATOM 902 CE LYS A 59 -16.048 3.280 6.704 1.00 0.00 C ATOM 903 NZ LYS A 59 -15.735 4.637 6.176 1.00 0.00 N ATOM 0 H LYS A 59 -12.879 -0.733 10.399 1.00 0.00 H new ATOM 0 HA LYS A 59 -13.457 0.046 7.685 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -14.864 0.161 9.944 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -14.121 1.745 10.046 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -15.675 0.764 7.624 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -16.389 1.689 8.930 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -14.862 3.574 8.471 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -14.060 2.647 7.218 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -16.096 2.572 5.876 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -17.033 3.292 7.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -16.464 4.920 5.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -15.715 5.319 6.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -14.807 4.621 5.707 1.00 0.00 H new ATOM 917 N VAL A 60 -11.067 1.154 7.766 1.00 0.00 N ATOM 918 CA VAL A 60 -10.039 2.095 7.383 1.00 0.00 C ATOM 919 C VAL A 60 -10.349 2.634 5.991 1.00 0.00 C ATOM 920 O VAL A 60 -10.947 1.932 5.172 1.00 0.00 O ATOM 921 CB VAL A 60 -8.643 1.427 7.409 1.00 0.00 C ATOM 922 CG1 VAL A 60 -8.577 0.244 6.455 1.00 0.00 C ATOM 923 CG2 VAL A 60 -7.552 2.431 7.085 1.00 0.00 C ATOM 0 H VAL A 60 -10.910 0.205 7.426 1.00 0.00 H new ATOM 0 HA VAL A 60 -10.025 2.919 8.096 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.478 1.055 8.420 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -7.584 -0.203 6.497 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.321 -0.498 6.744 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.779 0.584 5.439 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.582 1.935 7.110 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.722 2.845 6.091 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -7.568 3.235 7.821 1.00 0.00 H new ATOM 933 N ASP A 61 -9.978 3.875 5.726 1.00 0.00 N ATOM 934 CA ASP A 61 -10.238 4.469 4.426 1.00 0.00 C ATOM 935 C ASP A 61 -9.207 3.972 3.428 1.00 0.00 C ATOM 936 O ASP A 61 -8.131 4.555 3.273 1.00 0.00 O ATOM 937 CB ASP A 61 -10.227 5.997 4.508 1.00 0.00 C ATOM 938 CG ASP A 61 -10.754 6.650 3.244 1.00 0.00 C ATOM 939 OD1 ASP A 61 -11.793 6.188 2.720 1.00 0.00 O ATOM 940 OD2 ASP A 61 -10.163 7.654 2.794 1.00 0.00 O ATOM 0 H ASP A 61 -9.500 4.487 6.388 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.231 4.168 4.092 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -10.831 6.316 5.357 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -9.209 6.340 4.693 1.00 0.00 H new ATOM 945 N LEU A 62 -9.518 2.851 2.797 1.00 0.00 N ATOM 946 CA LEU A 62 -8.608 2.232 1.856 1.00 0.00 C ATOM 947 C LEU A 62 -8.741 2.889 0.491 1.00 0.00 C ATOM 948 O LEU A 62 -9.781 2.791 -0.163 1.00 0.00 O ATOM 949 CB LEU A 62 -8.883 0.731 1.746 1.00 0.00 C ATOM 950 CG LEU A 62 -7.641 -0.154 1.598 1.00 0.00 C ATOM 951 CD1 LEU A 62 -6.754 0.319 0.453 1.00 0.00 C ATOM 952 CD2 LEU A 62 -6.858 -0.194 2.898 1.00 0.00 C ATOM 0 H LEU A 62 -10.399 2.352 2.923 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.590 2.370 2.219 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.432 0.413 2.633 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.535 0.560 0.889 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.978 -1.164 1.362 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -5.882 -0.331 0.376 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.316 0.285 -0.480 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.429 1.342 0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.979 -0.827 2.774 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.543 0.815 3.165 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.488 -0.599 3.690 1.00 0.00 H new ATOM 964 N VAL A 63 -7.673 3.537 0.067 1.00 0.00 N ATOM 965 CA VAL A 63 -7.659 4.258 -1.187 1.00 0.00 C ATOM 966 C VAL A 63 -6.903 3.465 -2.235 1.00 0.00 C ATOM 967 O VAL A 63 -5.699 3.239 -2.115 1.00 0.00 O ATOM 968 CB VAL A 63 -7.013 5.647 -1.041 1.00 0.00 C ATOM 969 CG1 VAL A 63 -7.097 6.409 -2.352 1.00 0.00 C ATOM 970 CG2 VAL A 63 -7.673 6.426 0.085 1.00 0.00 C ATOM 0 H VAL A 63 -6.794 3.577 0.582 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.696 4.394 -1.496 1.00 0.00 H new ATOM 0 HB VAL A 63 -5.960 5.518 -0.789 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -6.636 7.390 -2.233 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -6.573 5.854 -3.130 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -8.142 6.532 -2.635 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -7.203 7.406 0.174 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -8.734 6.550 -0.132 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -7.556 5.881 1.022 1.00 0.00 H new ATOM 980 N LEU A 64 -7.619 3.037 -3.252 1.00 0.00 N ATOM 981 CA LEU A 64 -7.031 2.260 -4.327 1.00 0.00 C ATOM 982 C LEU A 64 -6.570 3.189 -5.433 1.00 0.00 C ATOM 983 O LEU A 64 -7.283 4.118 -5.800 1.00 0.00 O ATOM 984 CB LEU A 64 -8.050 1.258 -4.874 1.00 0.00 C ATOM 985 CG LEU A 64 -8.821 0.480 -3.809 1.00 0.00 C ATOM 986 CD1 LEU A 64 -9.744 -0.543 -4.445 1.00 0.00 C ATOM 987 CD2 LEU A 64 -7.860 -0.195 -2.852 1.00 0.00 C ATOM 0 H LEU A 64 -8.618 3.215 -3.359 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.174 1.709 -3.940 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -8.764 1.793 -5.501 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -7.531 0.548 -5.517 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.435 1.186 -3.249 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.281 -1.083 -3.665 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -10.459 -0.035 -5.093 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.156 -1.247 -5.035 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.423 -0.746 -2.099 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -7.222 -0.885 -3.404 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -7.243 0.559 -2.364 1.00 0.00 H new ATOM 999 N THR A 65 -5.383 2.952 -5.958 1.00 0.00 N ATOM 1000 CA THR A 65 -4.846 3.799 -7.009 1.00 0.00 C ATOM 1001 C THR A 65 -4.330 2.971 -8.175 1.00 0.00 C ATOM 1002 O THR A 65 -3.567 2.019 -7.979 1.00 0.00 O ATOM 1003 CB THR A 65 -3.714 4.704 -6.482 1.00 0.00 C ATOM 1004 OG1 THR A 65 -2.804 3.938 -5.678 1.00 0.00 O ATOM 1005 CG2 THR A 65 -4.273 5.862 -5.664 1.00 0.00 C ATOM 0 H THR A 65 -4.774 2.184 -5.677 1.00 0.00 H new ATOM 0 HA THR A 65 -5.665 4.429 -7.356 1.00 0.00 H new ATOM 0 HB THR A 65 -3.183 5.114 -7.341 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.290 4.541 -5.101 1.00 0.00 H new ATOM 0 HG21 THR A 65 -3.453 6.483 -5.305 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.936 6.461 -6.288 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.831 5.471 -4.813 1.00 0.00 H new ATOM 1013 N ASP A 66 -4.771 3.319 -9.381 1.00 0.00 N ATOM 1014 CA ASP A 66 -4.291 2.671 -10.595 1.00 0.00 C ATOM 1015 C ASP A 66 -4.805 3.428 -11.807 1.00 0.00 C ATOM 1016 O ASP A 66 -5.829 4.111 -11.729 1.00 0.00 O ATOM 1017 CB ASP A 66 -4.745 1.208 -10.662 1.00 0.00 C ATOM 1018 CG ASP A 66 -3.868 0.374 -11.576 1.00 0.00 C ATOM 1019 OD1 ASP A 66 -4.158 0.295 -12.785 1.00 0.00 O ATOM 1020 OD2 ASP A 66 -2.881 -0.209 -11.086 1.00 0.00 O ATOM 0 H ASP A 66 -5.464 4.050 -9.542 1.00 0.00 H new ATOM 0 HA ASP A 66 -3.201 2.684 -10.585 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -4.732 0.780 -9.660 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -5.776 1.166 -11.013 1.00 0.00 H new ATOM 1025 N ILE A 67 -4.101 3.314 -12.919 1.00 0.00 N ATOM 1026 CA ILE A 67 -4.473 4.028 -14.127 1.00 0.00 C ATOM 1027 C ILE A 67 -5.636 3.331 -14.826 1.00 0.00 C ATOM 1028 O ILE A 67 -5.605 2.116 -15.026 1.00 0.00 O ATOM 1029 CB ILE A 67 -3.283 4.154 -15.106 1.00 0.00 C ATOM 1030 CG1 ILE A 67 -2.102 4.849 -14.421 1.00 0.00 C ATOM 1031 CG2 ILE A 67 -3.694 4.918 -16.360 1.00 0.00 C ATOM 1032 CD1 ILE A 67 -0.884 5.007 -15.310 1.00 0.00 C ATOM 0 H ILE A 67 -3.268 2.733 -13.010 1.00 0.00 H new ATOM 0 HA ILE A 67 -4.778 5.031 -13.827 1.00 0.00 H new ATOM 0 HB ILE A 67 -2.975 3.151 -15.402 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.421 5.834 -14.079 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.822 4.279 -13.535 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -2.842 4.995 -17.035 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -4.505 4.388 -16.859 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.029 5.918 -16.084 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.091 5.507 -14.755 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -0.538 4.025 -15.631 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -1.146 5.603 -16.184 1.00 0.00 H new ATOM 1044 N LYS A 68 -6.652 4.125 -15.182 1.00 0.00 N ATOM 1045 CA LYS A 68 -7.858 3.653 -15.879 1.00 0.00 C ATOM 1046 C LYS A 68 -8.389 2.324 -15.322 1.00 0.00 C ATOM 1047 O LYS A 68 -8.270 1.273 -15.961 1.00 0.00 O ATOM 1048 CB LYS A 68 -7.632 3.559 -17.402 1.00 0.00 C ATOM 1049 CG LYS A 68 -6.430 2.719 -17.821 1.00 0.00 C ATOM 1050 CD LYS A 68 -6.511 2.287 -19.276 1.00 0.00 C ATOM 1051 CE LYS A 68 -7.717 1.395 -19.523 1.00 0.00 C ATOM 1052 NZ LYS A 68 -7.784 0.270 -18.555 1.00 0.00 N ATOM 0 H LYS A 68 -6.662 5.127 -14.992 1.00 0.00 H new ATOM 0 HA LYS A 68 -8.627 4.403 -15.692 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -8.527 3.141 -17.863 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -7.509 4.566 -17.800 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -5.516 3.292 -17.664 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -6.366 1.836 -17.185 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.571 3.167 -19.916 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -5.600 1.755 -19.550 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -8.628 1.989 -19.452 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -7.673 0.998 -20.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -8.479 -0.430 -18.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -6.849 -0.179 -18.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -8.071 0.631 -17.623 1.00 0.00 H new ATOM 1066 N PRO A 69 -8.971 2.354 -14.112 1.00 0.00 N ATOM 1067 CA PRO A 69 -9.559 1.167 -13.492 1.00 0.00 C ATOM 1068 C PRO A 69 -10.941 0.845 -14.059 1.00 0.00 C ATOM 1069 O PRO A 69 -11.547 1.663 -14.755 1.00 0.00 O ATOM 1070 CB PRO A 69 -9.663 1.562 -12.020 1.00 0.00 C ATOM 1071 CG PRO A 69 -9.833 3.040 -12.036 1.00 0.00 C ATOM 1072 CD PRO A 69 -9.090 3.543 -13.247 1.00 0.00 C ATOM 0 HA PRO A 69 -8.964 0.271 -13.668 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -10.508 1.072 -11.537 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -8.769 1.272 -11.468 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -10.888 3.309 -12.089 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -9.436 3.486 -11.124 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -9.634 4.346 -13.744 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -8.111 3.941 -12.978 1.00 0.00 H new ATOM 1122 N ILE A 74 -11.562 2.562 -7.156 1.00 0.00 N ATOM 1123 CA ILE A 74 -10.176 2.872 -7.458 1.00 0.00 C ATOM 1124 C ILE A 74 -10.055 4.288 -8.008 1.00 0.00 C ATOM 1125 O ILE A 74 -10.736 4.647 -8.970 1.00 0.00 O ATOM 1126 CB ILE A 74 -9.588 1.875 -8.480 1.00 0.00 C ATOM 1127 CG1 ILE A 74 -9.819 0.434 -8.013 1.00 0.00 C ATOM 1128 CG2 ILE A 74 -8.101 2.137 -8.689 1.00 0.00 C ATOM 1129 CD1 ILE A 74 -9.339 -0.611 -8.999 1.00 0.00 C ATOM 0 HA ILE A 74 -9.612 2.792 -6.529 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.098 2.016 -9.433 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.309 0.284 -7.061 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -10.884 0.287 -7.831 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -7.704 1.425 -9.412 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -7.959 3.151 -9.063 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -7.575 2.023 -7.741 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -9.536 -1.606 -8.600 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -9.867 -0.489 -9.945 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.268 -0.492 -9.163 1.00 0.00 H new ATOM 1141 N VAL A 75 -9.200 5.087 -7.385 1.00 0.00 N ATOM 1142 CA VAL A 75 -8.939 6.439 -7.847 1.00 0.00 C ATOM 1143 C VAL A 75 -8.292 6.393 -9.218 1.00 0.00 C ATOM 1144 O VAL A 75 -7.192 5.860 -9.385 1.00 0.00 O ATOM 1145 CB VAL A 75 -8.031 7.215 -6.872 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -7.776 8.627 -7.378 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -8.646 7.251 -5.482 1.00 0.00 C ATOM 0 H VAL A 75 -8.674 4.818 -6.554 1.00 0.00 H new ATOM 0 HA VAL A 75 -9.894 6.962 -7.900 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.075 6.696 -6.813 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.133 9.155 -6.674 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.288 8.582 -8.352 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.724 9.157 -7.472 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.991 7.803 -4.808 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -9.618 7.743 -5.527 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -8.771 6.233 -5.113 1.00 0.00 H new ATOM 1157 N ARG A 76 -8.986 6.944 -10.197 1.00 0.00 N ATOM 1158 CA ARG A 76 -8.538 6.888 -11.577 1.00 0.00 C ATOM 1159 C ARG A 76 -7.553 8.013 -11.862 1.00 0.00 C ATOM 1160 O ARG A 76 -7.744 8.801 -12.795 1.00 0.00 O ATOM 1161 CB ARG A 76 -9.733 7.012 -12.523 1.00 0.00 C ATOM 1162 CG ARG A 76 -11.036 6.480 -11.949 1.00 0.00 C ATOM 1163 CD ARG A 76 -12.189 6.693 -12.913 1.00 0.00 C ATOM 1164 NE ARG A 76 -13.487 6.455 -12.284 1.00 0.00 N ATOM 1165 CZ ARG A 76 -14.579 6.095 -12.955 1.00 0.00 C ATOM 1166 NH1 ARG A 76 -14.511 5.875 -14.265 1.00 0.00 N ATOM 1167 NH2 ARG A 76 -15.734 5.943 -12.317 1.00 0.00 N ATOM 0 H ARG A 76 -9.868 7.438 -10.061 1.00 0.00 H new ATOM 0 HA ARG A 76 -8.044 5.930 -11.738 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -9.866 8.061 -12.787 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -9.509 6.477 -13.446 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -10.933 5.417 -11.731 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -11.251 6.980 -11.005 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -12.155 7.712 -13.297 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -12.074 6.026 -13.767 1.00 0.00 H new ATOM 0 HE ARG A 76 -13.560 6.571 -11.273 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -13.623 5.982 -14.755 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -15.347 5.599 -14.780 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -15.786 6.102 -11.311 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -16.569 5.667 -12.833 1.00 0.00 H new ATOM 1181 N ASP A 77 -6.515 8.100 -11.053 1.00 0.00 N ATOM 1182 CA ASP A 77 -5.510 9.136 -11.228 1.00 0.00 C ATOM 1183 C ASP A 77 -4.301 8.570 -11.971 1.00 0.00 C ATOM 1184 O ASP A 77 -4.393 7.518 -12.607 1.00 0.00 O ATOM 1185 CB ASP A 77 -5.097 9.718 -9.873 1.00 0.00 C ATOM 1186 CG ASP A 77 -4.654 11.166 -9.982 1.00 0.00 C ATOM 1187 OD1 ASP A 77 -3.454 11.412 -10.223 1.00 0.00 O ATOM 1188 OD2 ASP A 77 -5.515 12.062 -9.839 1.00 0.00 O ATOM 0 H ASP A 77 -6.344 7.469 -10.270 1.00 0.00 H new ATOM 0 HA ASP A 77 -5.935 9.944 -11.824 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.934 9.647 -9.179 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -4.285 9.122 -9.456 1.00 0.00 H new ATOM 1193 N ASP A 78 -3.176 9.262 -11.894 1.00 0.00 N ATOM 1194 CA ASP A 78 -1.987 8.874 -12.638 1.00 0.00 C ATOM 1195 C ASP A 78 -0.823 8.568 -11.700 1.00 0.00 C ATOM 1196 O ASP A 78 -0.683 9.189 -10.647 1.00 0.00 O ATOM 1197 CB ASP A 78 -1.615 9.984 -13.621 1.00 0.00 C ATOM 1198 CG ASP A 78 -0.295 9.741 -14.314 1.00 0.00 C ATOM 1199 OD1 ASP A 78 -0.021 8.588 -14.703 1.00 0.00 O ATOM 1200 OD2 ASP A 78 0.470 10.710 -14.483 1.00 0.00 O ATOM 0 H ASP A 78 -3.060 10.098 -11.322 1.00 0.00 H new ATOM 0 HA ASP A 78 -2.205 7.962 -13.194 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -2.401 10.076 -14.371 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -1.570 10.934 -13.088 1.00 0.00 H new ATOM 1205 N ILE A 79 0.008 7.608 -12.094 1.00 0.00 N ATOM 1206 CA ILE A 79 1.114 7.160 -11.258 1.00 0.00 C ATOM 1207 C ILE A 79 2.460 7.631 -11.817 1.00 0.00 C ATOM 1208 O ILE A 79 3.452 7.703 -11.088 1.00 0.00 O ATOM 1209 CB ILE A 79 1.113 5.617 -11.106 1.00 0.00 C ATOM 1210 CG1 ILE A 79 2.145 5.165 -10.063 1.00 0.00 C ATOM 1211 CG2 ILE A 79 1.382 4.940 -12.443 1.00 0.00 C ATOM 1212 CD1 ILE A 79 1.872 5.683 -8.665 1.00 0.00 C ATOM 0 H ILE A 79 -0.065 7.125 -12.989 1.00 0.00 H new ATOM 0 HA ILE A 79 0.975 7.605 -10.273 1.00 0.00 H new ATOM 0 HB ILE A 79 0.123 5.319 -10.760 1.00 0.00 H new ATOM 0 HG12 ILE A 79 2.169 4.076 -10.038 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.134 5.498 -10.377 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.376 3.858 -12.311 1.00 0.00 H new ATOM 0 HG22 ILE A 79 0.608 5.222 -13.156 1.00 0.00 H new ATOM 0 HG23 ILE A 79 2.355 5.254 -12.821 1.00 0.00 H new ATOM 0 HD11 ILE A 79 2.644 5.321 -7.986 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.878 6.773 -8.673 1.00 0.00 H new ATOM 0 HD13 ILE A 79 0.898 5.328 -8.329 1.00 0.00 H new ATOM 1224 N THR A 80 2.505 7.969 -13.105 1.00 0.00 N ATOM 1225 CA THR A 80 3.748 8.448 -13.695 1.00 0.00 C ATOM 1226 C THR A 80 3.943 9.922 -13.337 1.00 0.00 C ATOM 1227 O THR A 80 5.060 10.438 -13.314 1.00 0.00 O ATOM 1228 CB THR A 80 3.796 8.232 -15.229 1.00 0.00 C ATOM 1229 OG1 THR A 80 5.117 8.487 -15.720 1.00 0.00 O ATOM 1230 CG2 THR A 80 2.810 9.127 -15.962 1.00 0.00 C ATOM 0 H THR A 80 1.713 7.921 -13.746 1.00 0.00 H new ATOM 0 HA THR A 80 4.569 7.862 -13.281 1.00 0.00 H new ATOM 0 HB THR A 80 3.518 7.195 -15.417 1.00 0.00 H new ATOM 0 HG1 THR A 80 5.138 8.347 -16.690 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.878 8.942 -17.034 1.00 0.00 H new ATOM 0 HG22 THR A 80 1.798 8.910 -15.620 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.046 10.172 -15.758 1.00 0.00 H new ATOM 1238 N SER A 81 2.834 10.590 -13.070 1.00 0.00 N ATOM 1239 CA SER A 81 2.842 11.893 -12.434 1.00 0.00 C ATOM 1240 C SER A 81 1.815 11.883 -11.304 1.00 0.00 C ATOM 1241 O SER A 81 0.686 12.346 -11.468 1.00 0.00 O ATOM 1242 CB SER A 81 2.532 12.996 -13.448 1.00 0.00 C ATOM 1243 OG SER A 81 3.427 12.937 -14.547 1.00 0.00 O ATOM 0 H SER A 81 1.901 10.242 -13.289 1.00 0.00 H new ATOM 0 HA SER A 81 3.832 12.100 -12.028 1.00 0.00 H new ATOM 0 HB2 SER A 81 1.507 12.892 -13.803 1.00 0.00 H new ATOM 0 HB3 SER A 81 2.605 13.971 -12.966 1.00 0.00 H new ATOM 0 HG SER A 81 3.210 13.650 -15.184 1.00 0.00 H new ATOM 1249 N PRO A 82 2.191 11.307 -10.152 1.00 0.00 N ATOM 1250 CA PRO A 82 1.265 11.070 -9.046 1.00 0.00 C ATOM 1251 C PRO A 82 0.918 12.337 -8.280 1.00 0.00 C ATOM 1252 O PRO A 82 1.741 13.245 -8.139 1.00 0.00 O ATOM 1253 CB PRO A 82 2.031 10.096 -8.150 1.00 0.00 C ATOM 1254 CG PRO A 82 3.465 10.410 -8.396 1.00 0.00 C ATOM 1255 CD PRO A 82 3.558 10.849 -9.833 1.00 0.00 C ATOM 0 HA PRO A 82 0.306 10.691 -9.399 1.00 0.00 H new ATOM 0 HB2 PRO A 82 1.769 10.233 -7.101 1.00 0.00 H new ATOM 0 HB3 PRO A 82 1.803 9.061 -8.403 1.00 0.00 H new ATOM 0 HG2 PRO A 82 3.812 11.196 -7.726 1.00 0.00 H new ATOM 0 HG3 PRO A 82 4.091 9.537 -8.214 1.00 0.00 H new ATOM 0 HD2 PRO A 82 4.287 11.649 -9.960 1.00 0.00 H new ATOM 0 HD3 PRO A 82 3.867 10.030 -10.482 1.00 0.00 H new ATOM 1263 N ARG A 83 -0.312 12.393 -7.798 1.00 0.00 N ATOM 1264 CA ARG A 83 -0.760 13.498 -6.971 1.00 0.00 C ATOM 1265 C ARG A 83 -0.601 13.151 -5.499 1.00 0.00 C ATOM 1266 O ARG A 83 -1.347 12.334 -4.954 1.00 0.00 O ATOM 1267 CB ARG A 83 -2.211 13.853 -7.293 1.00 0.00 C ATOM 1268 CG ARG A 83 -2.351 14.643 -8.582 1.00 0.00 C ATOM 1269 CD ARG A 83 -3.801 14.769 -9.019 1.00 0.00 C ATOM 1270 NE ARG A 83 -3.944 15.624 -10.201 1.00 0.00 N ATOM 1271 CZ ARG A 83 -4.892 15.465 -11.124 1.00 0.00 C ATOM 1272 NH1 ARG A 83 -5.688 14.409 -11.094 1.00 0.00 N ATOM 1273 NH2 ARG A 83 -5.009 16.336 -12.118 1.00 0.00 N ATOM 0 H ARG A 83 -1.022 11.680 -7.967 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.143 14.370 -7.187 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.796 12.937 -7.368 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.630 14.432 -6.470 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.926 15.637 -8.446 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -1.776 14.156 -9.370 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.202 13.779 -9.237 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.392 15.179 -8.201 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.278 16.387 -10.324 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.579 13.709 -10.360 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -6.411 14.295 -11.804 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.372 17.131 -12.178 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -5.736 16.211 -12.823 1.00 0.00 H new ATOM 1287 N MET A 84 0.376 13.785 -4.863 1.00 0.00 N ATOM 1288 CA MET A 84 0.716 13.507 -3.473 1.00 0.00 C ATOM 1289 C MET A 84 -0.464 13.761 -2.547 1.00 0.00 C ATOM 1290 O MET A 84 -0.543 13.174 -1.471 1.00 0.00 O ATOM 1291 CB MET A 84 1.905 14.357 -3.031 1.00 0.00 C ATOM 1292 CG MET A 84 3.180 14.076 -3.809 1.00 0.00 C ATOM 1293 SD MET A 84 3.729 12.364 -3.651 1.00 0.00 S ATOM 1294 CE MET A 84 3.981 12.250 -1.882 1.00 0.00 C ATOM 0 H MET A 84 0.954 14.505 -5.295 1.00 0.00 H new ATOM 0 HA MET A 84 0.982 12.452 -3.409 1.00 0.00 H new ATOM 0 HB2 MET A 84 1.648 15.411 -3.141 1.00 0.00 H new ATOM 0 HB3 MET A 84 2.091 14.183 -1.971 1.00 0.00 H new ATOM 0 HG2 MET A 84 3.016 14.305 -4.862 1.00 0.00 H new ATOM 0 HG3 MET A 84 3.969 14.740 -3.457 1.00 0.00 H new ATOM 0 HE1 MET A 84 4.503 11.322 -1.648 1.00 0.00 H new ATOM 0 HE2 MET A 84 4.577 13.098 -1.544 1.00 0.00 H new ATOM 0 HE3 MET A 84 3.016 12.261 -1.376 1.00 0.00 H new ATOM 1304 N GLU A 85 -1.383 14.620 -2.978 1.00 0.00 N ATOM 1305 CA GLU A 85 -2.573 14.945 -2.191 1.00 0.00 C ATOM 1306 C GLU A 85 -3.361 13.686 -1.824 1.00 0.00 C ATOM 1307 O GLU A 85 -4.016 13.634 -0.785 1.00 0.00 O ATOM 1308 CB GLU A 85 -3.475 15.910 -2.964 1.00 0.00 C ATOM 1309 CG GLU A 85 -3.884 15.399 -4.336 1.00 0.00 C ATOM 1310 CD GLU A 85 -4.899 16.294 -5.011 1.00 0.00 C ATOM 1311 OE1 GLU A 85 -4.500 17.346 -5.554 1.00 0.00 O ATOM 1312 OE2 GLU A 85 -6.100 15.952 -4.999 1.00 0.00 O ATOM 0 H GLU A 85 -1.328 15.107 -3.873 1.00 0.00 H new ATOM 0 HA GLU A 85 -2.239 15.421 -1.269 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -4.372 16.104 -2.376 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -2.958 16.862 -3.080 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -3.000 15.318 -4.968 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -4.298 14.396 -4.237 1.00 0.00 H new ATOM 1319 N ILE A 86 -3.280 12.674 -2.679 1.00 0.00 N ATOM 1320 CA ILE A 86 -4.008 11.431 -2.467 1.00 0.00 C ATOM 1321 C ILE A 86 -3.300 10.557 -1.434 1.00 0.00 C ATOM 1322 O ILE A 86 -3.944 9.881 -0.627 1.00 0.00 O ATOM 1323 CB ILE A 86 -4.155 10.643 -3.789 1.00 0.00 C ATOM 1324 CG1 ILE A 86 -4.829 11.518 -4.850 1.00 0.00 C ATOM 1325 CG2 ILE A 86 -4.950 9.361 -3.568 1.00 0.00 C ATOM 1326 CD1 ILE A 86 -4.917 10.865 -6.211 1.00 0.00 C ATOM 0 H ILE A 86 -2.715 12.691 -3.528 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.000 11.692 -2.097 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.161 10.368 -4.142 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -5.834 11.772 -4.513 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -4.277 12.453 -4.941 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.041 8.822 -4.511 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.435 8.734 -2.840 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.943 9.609 -3.194 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.406 11.544 -6.909 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.914 10.636 -6.570 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.495 9.944 -6.136 1.00 0.00 H new ATOM 1338 N TYR A 87 -1.973 10.597 -1.448 1.00 0.00 N ATOM 1339 CA TYR A 87 -1.169 9.739 -0.586 1.00 0.00 C ATOM 1340 C TYR A 87 -0.970 10.368 0.786 1.00 0.00 C ATOM 1341 O TYR A 87 -0.745 9.669 1.772 1.00 0.00 O ATOM 1342 CB TYR A 87 0.195 9.471 -1.222 1.00 0.00 C ATOM 1343 CG TYR A 87 0.122 8.989 -2.654 1.00 0.00 C ATOM 1344 CD1 TYR A 87 -0.184 7.667 -2.951 1.00 0.00 C ATOM 1345 CD2 TYR A 87 0.362 9.859 -3.710 1.00 0.00 C ATOM 1346 CE1 TYR A 87 -0.248 7.228 -4.260 1.00 0.00 C ATOM 1347 CE2 TYR A 87 0.299 9.427 -5.019 1.00 0.00 C ATOM 1348 CZ TYR A 87 -0.006 8.112 -5.289 1.00 0.00 C ATOM 1349 OH TYR A 87 -0.073 7.681 -6.592 1.00 0.00 O ATOM 0 H TYR A 87 -1.429 11.217 -2.049 1.00 0.00 H new ATOM 0 HA TYR A 87 -1.706 8.798 -0.465 1.00 0.00 H new ATOM 0 HB2 TYR A 87 0.787 10.386 -1.187 1.00 0.00 H new ATOM 0 HB3 TYR A 87 0.723 8.727 -0.625 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -0.375 6.972 -2.147 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.602 10.891 -3.503 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -0.487 6.197 -4.475 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.488 10.117 -5.828 1.00 0.00 H new ATOM 0 HH TYR A 87 0.123 8.429 -7.194 1.00 0.00 H new ATOM 1359 N ARG A 88 -1.040 11.691 0.847 1.00 0.00 N ATOM 1360 CA ARG A 88 -0.834 12.398 2.102 1.00 0.00 C ATOM 1361 C ARG A 88 -1.995 12.161 3.046 1.00 0.00 C ATOM 1362 O ARG A 88 -3.159 12.155 2.642 1.00 0.00 O ATOM 1363 CB ARG A 88 -0.627 13.895 1.873 1.00 0.00 C ATOM 1364 CG ARG A 88 0.649 14.200 1.116 1.00 0.00 C ATOM 1365 CD ARG A 88 0.895 15.693 0.996 1.00 0.00 C ATOM 1366 NE ARG A 88 1.312 16.270 2.271 1.00 0.00 N ATOM 1367 CZ ARG A 88 1.515 17.570 2.475 1.00 0.00 C ATOM 1368 NH1 ARG A 88 1.320 18.442 1.492 1.00 0.00 N ATOM 1369 NH2 ARG A 88 1.928 17.992 3.664 1.00 0.00 N ATOM 0 H ARG A 88 -1.237 12.292 0.047 1.00 0.00 H new ATOM 0 HA ARG A 88 0.073 12.002 2.559 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -1.477 14.295 1.320 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -0.604 14.406 2.836 1.00 0.00 H new ATOM 0 HG2 ARG A 88 1.493 13.733 1.624 1.00 0.00 H new ATOM 0 HG3 ARG A 88 0.594 13.760 0.120 1.00 0.00 H new ATOM 0 HD2 ARG A 88 1.662 15.877 0.244 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.014 16.186 0.652 1.00 0.00 H new ATOM 0 HE ARG A 88 1.457 15.636 3.057 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.013 18.117 0.575 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.477 19.437 1.654 1.00 0.00 H new ATOM 0 HH21 ARG A 88 2.088 17.321 4.416 1.00 0.00 H new ATOM 0 HH22 ARG A 88 2.085 18.987 3.826 1.00 0.00 H new ATOM 1383 N GLY A 89 -1.660 11.953 4.303 1.00 0.00 N ATOM 1384 CA GLY A 89 -2.662 11.641 5.304 1.00 0.00 C ATOM 1385 C GLY A 89 -2.845 10.148 5.477 1.00 0.00 C ATOM 1386 O GLY A 89 -3.645 9.701 6.298 1.00 0.00 O ATOM 0 H GLY A 89 -0.704 11.994 4.656 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.372 12.084 6.257 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -3.612 12.092 5.019 1.00 0.00 H new ATOM 1390 N ALA A 90 -2.105 9.374 4.696 1.00 0.00 N ATOM 1391 CA ALA A 90 -2.164 7.926 4.784 1.00 0.00 C ATOM 1392 C ALA A 90 -1.202 7.413 5.845 1.00 0.00 C ATOM 1393 O ALA A 90 -0.145 8.003 6.080 1.00 0.00 O ATOM 1394 CB ALA A 90 -1.850 7.296 3.435 1.00 0.00 C ATOM 0 H ALA A 90 -1.456 9.728 3.993 1.00 0.00 H new ATOM 0 HA ALA A 90 -3.176 7.643 5.072 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -1.899 6.210 3.520 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -2.577 7.635 2.697 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.849 7.590 3.120 1.00 0.00 H new ATOM 1400 N ALA A 91 -1.576 6.321 6.489 1.00 0.00 N ATOM 1401 CA ALA A 91 -0.744 5.717 7.516 1.00 0.00 C ATOM 1402 C ALA A 91 0.185 4.673 6.914 1.00 0.00 C ATOM 1403 O ALA A 91 1.269 4.408 7.440 1.00 0.00 O ATOM 1404 CB ALA A 91 -1.614 5.092 8.594 1.00 0.00 C ATOM 0 H ALA A 91 -2.455 5.832 6.318 1.00 0.00 H new ATOM 0 HA ALA A 91 -0.132 6.498 7.966 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -0.980 4.642 9.358 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -2.240 5.861 9.048 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -2.247 4.324 8.150 1.00 0.00 H new ATOM 1410 N LEU A 92 -0.238 4.085 5.802 1.00 0.00 N ATOM 1411 CA LEU A 92 0.536 3.040 5.154 1.00 0.00 C ATOM 1412 C LEU A 92 0.243 3.021 3.656 1.00 0.00 C ATOM 1413 O LEU A 92 -0.889 3.268 3.230 1.00 0.00 O ATOM 1414 CB LEU A 92 0.208 1.684 5.799 1.00 0.00 C ATOM 1415 CG LEU A 92 1.217 0.556 5.550 1.00 0.00 C ATOM 1416 CD1 LEU A 92 1.143 -0.469 6.669 1.00 0.00 C ATOM 1417 CD2 LEU A 92 0.963 -0.128 4.215 1.00 0.00 C ATOM 0 H LEU A 92 -1.113 4.316 5.332 1.00 0.00 H new ATOM 0 HA LEU A 92 1.600 3.239 5.285 1.00 0.00 H new ATOM 0 HB2 LEU A 92 0.115 1.830 6.875 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.767 1.358 5.436 1.00 0.00 H new ATOM 0 HG LEU A 92 2.213 0.999 5.526 1.00 0.00 H new ATOM 0 HD11 LEU A 92 1.864 -1.265 6.482 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.373 0.013 7.619 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.139 -0.891 6.710 1.00 0.00 H new ATOM 0 HD21 LEU A 92 1.695 -0.923 4.068 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.041 -0.553 4.209 1.00 0.00 H new ATOM 0 HD23 LEU A 92 1.053 0.601 3.410 1.00 0.00 H new ATOM 1429 N ILE A 93 1.272 2.749 2.866 1.00 0.00 N ATOM 1430 CA ILE A 93 1.141 2.665 1.419 1.00 0.00 C ATOM 1431 C ILE A 93 1.807 1.388 0.922 1.00 0.00 C ATOM 1432 O ILE A 93 2.988 1.157 1.177 1.00 0.00 O ATOM 1433 CB ILE A 93 1.786 3.884 0.718 1.00 0.00 C ATOM 1434 CG1 ILE A 93 1.157 5.188 1.220 1.00 0.00 C ATOM 1435 CG2 ILE A 93 1.637 3.770 -0.793 1.00 0.00 C ATOM 1436 CD1 ILE A 93 1.819 6.433 0.672 1.00 0.00 C ATOM 0 H ILE A 93 2.218 2.581 3.209 1.00 0.00 H new ATOM 0 HA ILE A 93 0.078 2.657 1.177 1.00 0.00 H new ATOM 0 HB ILE A 93 2.848 3.898 0.961 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.101 5.199 0.949 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.207 5.210 2.309 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.096 4.636 -1.270 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.129 2.861 -1.140 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.579 3.731 -1.052 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.320 7.316 1.071 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.869 6.446 0.965 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.746 6.435 -0.416 1.00 0.00 H new ATOM 1448 N TYR A 94 1.054 0.548 0.234 1.00 0.00 N ATOM 1449 CA TYR A 94 1.596 -0.709 -0.256 1.00 0.00 C ATOM 1450 C TYR A 94 1.293 -0.890 -1.733 1.00 0.00 C ATOM 1451 O TYR A 94 0.374 -0.273 -2.270 1.00 0.00 O ATOM 1452 CB TYR A 94 1.074 -1.897 0.562 1.00 0.00 C ATOM 1453 CG TYR A 94 -0.426 -2.088 0.540 1.00 0.00 C ATOM 1454 CD1 TYR A 94 -1.267 -1.228 1.232 1.00 0.00 C ATOM 1455 CD2 TYR A 94 -0.999 -3.146 -0.155 1.00 0.00 C ATOM 1456 CE1 TYR A 94 -2.634 -1.415 1.232 1.00 0.00 C ATOM 1457 CE2 TYR A 94 -2.366 -3.342 -0.154 1.00 0.00 C ATOM 1458 CZ TYR A 94 -3.179 -2.473 0.541 1.00 0.00 C ATOM 1459 OH TYR A 94 -4.539 -2.665 0.551 1.00 0.00 O ATOM 0 H TYR A 94 0.074 0.710 0.003 1.00 0.00 H new ATOM 0 HA TYR A 94 2.679 -0.674 -0.135 1.00 0.00 H new ATOM 0 HB2 TYR A 94 1.545 -2.807 0.191 1.00 0.00 H new ATOM 0 HB3 TYR A 94 1.393 -1.772 1.597 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -0.844 -0.399 1.780 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.365 -3.826 -0.705 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -3.274 -0.733 1.772 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -2.796 -4.172 -0.695 1.00 0.00 H new ATOM 0 HH TYR A 94 -4.822 -3.049 -0.305 1.00 0.00 H new ATOM 1469 N SER A 95 2.085 -1.723 -2.389 1.00 0.00 N ATOM 1470 CA SER A 95 1.954 -1.937 -3.818 1.00 0.00 C ATOM 1471 C SER A 95 1.850 -3.424 -4.140 1.00 0.00 C ATOM 1472 O SER A 95 2.676 -4.231 -3.699 1.00 0.00 O ATOM 1473 CB SER A 95 3.147 -1.316 -4.542 1.00 0.00 C ATOM 1474 OG SER A 95 3.313 0.038 -4.157 1.00 0.00 O ATOM 0 H SER A 95 2.829 -2.264 -1.949 1.00 0.00 H new ATOM 0 HA SER A 95 1.037 -1.457 -4.160 1.00 0.00 H new ATOM 0 HB2 SER A 95 4.052 -1.879 -4.313 1.00 0.00 H new ATOM 0 HB3 SER A 95 2.998 -1.378 -5.620 1.00 0.00 H new ATOM 0 HG SER A 95 4.024 0.102 -3.486 1.00 0.00 H new ATOM 1480 N ILE A 96 0.829 -3.779 -4.904 1.00 0.00 N ATOM 1481 CA ILE A 96 0.604 -5.163 -5.287 1.00 0.00 C ATOM 1482 C ILE A 96 1.292 -5.467 -6.614 1.00 0.00 C ATOM 1483 O ILE A 96 0.849 -5.012 -7.669 1.00 0.00 O ATOM 1484 CB ILE A 96 -0.906 -5.479 -5.403 1.00 0.00 C ATOM 1485 CG1 ILE A 96 -1.623 -5.169 -4.082 1.00 0.00 C ATOM 1486 CG2 ILE A 96 -1.125 -6.935 -5.798 1.00 0.00 C ATOM 1487 CD1 ILE A 96 -1.093 -5.949 -2.897 1.00 0.00 C ATOM 0 H ILE A 96 0.140 -3.124 -5.273 1.00 0.00 H new ATOM 0 HA ILE A 96 1.029 -5.792 -4.505 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.327 -4.846 -6.184 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -1.532 -4.103 -3.872 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -2.686 -5.382 -4.198 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.194 -7.135 -5.874 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -0.651 -7.126 -6.761 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -0.687 -7.587 -5.042 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -1.651 -5.674 -2.002 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.209 -7.017 -3.083 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -0.038 -5.718 -2.752 1.00 0.00 H new ATOM 1499 N ARG A 97 2.390 -6.217 -6.543 1.00 0.00 N ATOM 1500 CA ARG A 97 3.152 -6.619 -7.727 1.00 0.00 C ATOM 1501 C ARG A 97 3.608 -5.394 -8.532 1.00 0.00 C ATOM 1502 O ARG A 97 3.102 -5.135 -9.627 1.00 0.00 O ATOM 1503 CB ARG A 97 2.313 -7.549 -8.617 1.00 0.00 C ATOM 1504 CG ARG A 97 3.115 -8.254 -9.697 1.00 0.00 C ATOM 1505 CD ARG A 97 3.757 -9.529 -9.173 1.00 0.00 C ATOM 1506 NE ARG A 97 2.755 -10.552 -8.867 1.00 0.00 N ATOM 1507 CZ ARG A 97 3.015 -11.857 -8.772 1.00 0.00 C ATOM 1508 NH1 ARG A 97 4.252 -12.310 -8.944 1.00 0.00 N ATOM 1509 NH2 ARG A 97 2.027 -12.706 -8.514 1.00 0.00 N ATOM 0 H ARG A 97 2.777 -6.563 -5.665 1.00 0.00 H new ATOM 0 HA ARG A 97 4.037 -7.157 -7.388 1.00 0.00 H new ATOM 0 HB2 ARG A 97 1.830 -8.298 -7.990 1.00 0.00 H new ATOM 0 HB3 ARG A 97 1.520 -6.968 -9.088 1.00 0.00 H new ATOM 0 HG2 ARG A 97 2.464 -8.493 -10.538 1.00 0.00 H new ATOM 0 HG3 ARG A 97 3.888 -7.584 -10.073 1.00 0.00 H new ATOM 0 HD2 ARG A 97 4.457 -9.915 -9.914 1.00 0.00 H new ATOM 0 HD3 ARG A 97 4.334 -9.304 -8.276 1.00 0.00 H new ATOM 0 HE ARG A 97 1.794 -10.246 -8.716 1.00 0.00 H new ATOM 0 HH11 ARG A 97 5.010 -11.659 -9.150 1.00 0.00 H new ATOM 0 HH12 ARG A 97 4.444 -13.309 -8.870 1.00 0.00 H new ATOM 0 HH21 ARG A 97 1.076 -12.359 -8.390 1.00 0.00 H new ATOM 0 HH22 ARG A 97 2.219 -13.705 -8.440 1.00 0.00 H new ATOM 1523 N PRO A 98 4.556 -4.610 -7.994 1.00 0.00 N ATOM 1524 CA PRO A 98 5.055 -3.412 -8.652 1.00 0.00 C ATOM 1525 C PRO A 98 6.205 -3.713 -9.609 1.00 0.00 C ATOM 1526 O PRO A 98 7.109 -4.485 -9.283 1.00 0.00 O ATOM 1527 CB PRO A 98 5.549 -2.540 -7.486 1.00 0.00 C ATOM 1528 CG PRO A 98 5.477 -3.397 -6.255 1.00 0.00 C ATOM 1529 CD PRO A 98 5.223 -4.807 -6.707 1.00 0.00 C ATOM 0 HA PRO A 98 4.288 -2.937 -9.263 1.00 0.00 H new ATOM 0 HB2 PRO A 98 6.569 -2.198 -7.662 1.00 0.00 H new ATOM 0 HB3 PRO A 98 4.929 -1.650 -7.377 1.00 0.00 H new ATOM 0 HG2 PRO A 98 6.407 -3.336 -5.690 1.00 0.00 H new ATOM 0 HG3 PRO A 98 4.680 -3.055 -5.595 1.00 0.00 H new ATOM 0 HD2 PRO A 98 6.149 -5.373 -6.812 1.00 0.00 H new ATOM 0 HD3 PRO A 98 4.594 -5.352 -6.003 1.00 0.00 H new ATOM 1537 N PRO A 99 6.173 -3.117 -10.812 1.00 0.00 N ATOM 1538 CA PRO A 99 7.270 -3.231 -11.775 1.00 0.00 C ATOM 1539 C PRO A 99 8.582 -2.703 -11.201 1.00 0.00 C ATOM 1540 O PRO A 99 8.596 -1.689 -10.494 1.00 0.00 O ATOM 1541 CB PRO A 99 6.821 -2.360 -12.951 1.00 0.00 C ATOM 1542 CG PRO A 99 5.344 -2.234 -12.805 1.00 0.00 C ATOM 1543 CD PRO A 99 5.065 -2.300 -11.331 1.00 0.00 C ATOM 0 HA PRO A 99 7.461 -4.268 -12.052 1.00 0.00 H new ATOM 0 HB2 PRO A 99 7.304 -1.383 -12.924 1.00 0.00 H new ATOM 0 HB3 PRO A 99 7.084 -2.819 -13.904 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.989 -1.294 -13.227 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.830 -3.036 -13.335 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.051 -1.308 -10.880 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.097 -2.757 -11.125 1.00 0.00 H new ATOM 1551 N ALA A 100 9.678 -3.372 -11.538 1.00 0.00 N ATOM 1552 CA ALA A 100 10.998 -3.040 -11.002 1.00 0.00 C ATOM 1553 C ALA A 100 11.589 -1.801 -11.677 1.00 0.00 C ATOM 1554 O ALA A 100 12.779 -1.760 -12.006 1.00 0.00 O ATOM 1555 CB ALA A 100 11.932 -4.229 -11.164 1.00 0.00 C ATOM 0 H ALA A 100 9.680 -4.158 -12.188 1.00 0.00 H new ATOM 0 HA ALA A 100 10.884 -2.810 -9.943 1.00 0.00 H new ATOM 0 HB1 ALA A 100 12.914 -3.977 -10.764 1.00 0.00 H new ATOM 0 HB2 ALA A 100 11.528 -5.085 -10.624 1.00 0.00 H new ATOM 0 HB3 ALA A 100 12.024 -4.478 -12.221 1.00 0.00 H new ATOM 1561 N GLU A 101 10.752 -0.790 -11.867 1.00 0.00 N ATOM 1562 CA GLU A 101 11.175 0.458 -12.471 1.00 0.00 C ATOM 1563 C GLU A 101 10.531 1.663 -11.781 1.00 0.00 C ATOM 1564 O GLU A 101 11.156 2.717 -11.649 1.00 0.00 O ATOM 1565 CB GLU A 101 10.833 0.446 -13.958 1.00 0.00 C ATOM 1566 CG GLU A 101 9.353 0.253 -14.257 1.00 0.00 C ATOM 1567 CD GLU A 101 9.068 0.224 -15.742 1.00 0.00 C ATOM 1568 OE1 GLU A 101 9.176 -0.862 -16.350 1.00 0.00 O ATOM 1569 OE2 GLU A 101 8.744 1.285 -16.309 1.00 0.00 O ATOM 0 H GLU A 101 9.766 -0.815 -11.607 1.00 0.00 H new ATOM 0 HA GLU A 101 12.254 0.552 -12.348 1.00 0.00 H new ATOM 0 HB2 GLU A 101 11.162 1.385 -14.403 1.00 0.00 H new ATOM 0 HB3 GLU A 101 11.397 -0.351 -14.443 1.00 0.00 H new ATOM 0 HG2 GLU A 101 9.011 -0.678 -13.805 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.783 1.059 -13.795 1.00 0.00 H new ATOM 1576 N ILE A 102 9.290 1.500 -11.325 1.00 0.00 N ATOM 1577 CA ILE A 102 8.549 2.605 -10.716 1.00 0.00 C ATOM 1578 C ILE A 102 8.669 2.591 -9.197 1.00 0.00 C ATOM 1579 O ILE A 102 8.125 3.458 -8.513 1.00 0.00 O ATOM 1580 CB ILE A 102 7.054 2.574 -11.084 1.00 0.00 C ATOM 1581 CG1 ILE A 102 6.407 1.266 -10.623 1.00 0.00 C ATOM 1582 CG2 ILE A 102 6.869 2.772 -12.584 1.00 0.00 C ATOM 1583 CD1 ILE A 102 4.899 1.263 -10.750 1.00 0.00 C ATOM 0 H ILE A 102 8.778 0.619 -11.365 1.00 0.00 H new ATOM 0 HA ILE A 102 8.997 3.516 -11.113 1.00 0.00 H new ATOM 0 HB ILE A 102 6.557 3.395 -10.567 1.00 0.00 H new ATOM 0 HG12 ILE A 102 6.815 0.442 -11.208 1.00 0.00 H new ATOM 0 HG13 ILE A 102 6.677 1.083 -9.583 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.806 2.747 -12.826 1.00 0.00 H new ATOM 0 HG22 ILE A 102 7.286 3.735 -12.878 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.382 1.975 -13.122 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.507 0.306 -10.406 1.00 0.00 H new ATOM 0 HD12 ILE A 102 4.481 2.066 -10.143 1.00 0.00 H new ATOM 0 HD13 ILE A 102 4.621 1.415 -11.793 1.00 0.00 H new ATOM 1595 N HIS A 103 9.387 1.605 -8.682 1.00 0.00 N ATOM 1596 CA HIS A 103 9.575 1.441 -7.242 1.00 0.00 C ATOM 1597 C HIS A 103 10.163 2.702 -6.612 1.00 0.00 C ATOM 1598 O HIS A 103 9.792 3.085 -5.505 1.00 0.00 O ATOM 1599 CB HIS A 103 10.477 0.231 -6.962 1.00 0.00 C ATOM 1600 CG HIS A 103 11.800 0.278 -7.668 1.00 0.00 C ATOM 1601 ND1 HIS A 103 11.907 -0.027 -9.001 1.00 0.00 N ATOM 1602 CD2 HIS A 103 13.026 0.594 -7.189 1.00 0.00 C ATOM 1603 CE1 HIS A 103 13.186 0.109 -9.302 1.00 0.00 C ATOM 1604 NE2 HIS A 103 13.905 0.482 -8.237 1.00 0.00 N ATOM 0 H HIS A 103 9.856 0.896 -9.245 1.00 0.00 H new ATOM 0 HA HIS A 103 8.598 1.268 -6.790 1.00 0.00 H new ATOM 0 HB2 HIS A 103 10.652 0.163 -5.888 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.951 -0.677 -7.258 1.00 0.00 H new ATOM 0 HD2 HIS A 103 13.267 0.880 -6.176 1.00 0.00 H new ATOM 0 HE1 HIS A 103 13.600 -0.060 -10.285 1.00 0.00 H new ATOM 0 HE2 HIS A 103 14.911 0.650 -8.209 1.00 0.00 H new ATOM 1612 N SER A 104 11.060 3.355 -7.340 1.00 0.00 N ATOM 1613 CA SER A 104 11.713 4.565 -6.862 1.00 0.00 C ATOM 1614 C SER A 104 10.690 5.670 -6.592 1.00 0.00 C ATOM 1615 O SER A 104 10.786 6.399 -5.600 1.00 0.00 O ATOM 1616 CB SER A 104 12.727 5.029 -7.903 1.00 0.00 C ATOM 1617 OG SER A 104 13.524 3.943 -8.348 1.00 0.00 O ATOM 0 H SER A 104 11.353 3.063 -8.272 1.00 0.00 H new ATOM 0 HA SER A 104 12.222 4.345 -5.924 1.00 0.00 H new ATOM 0 HB2 SER A 104 12.207 5.476 -8.750 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.365 5.803 -7.476 1.00 0.00 H new ATOM 0 HG SER A 104 14.167 4.261 -9.016 1.00 0.00 H new ATOM 1623 N SER A 105 9.693 5.766 -7.465 1.00 0.00 N ATOM 1624 CA SER A 105 8.653 6.773 -7.335 1.00 0.00 C ATOM 1625 C SER A 105 7.817 6.497 -6.091 1.00 0.00 C ATOM 1626 O SER A 105 7.382 7.415 -5.406 1.00 0.00 O ATOM 1627 CB SER A 105 7.761 6.773 -8.578 1.00 0.00 C ATOM 1628 OG SER A 105 8.541 6.838 -9.763 1.00 0.00 O ATOM 0 H SER A 105 9.586 5.154 -8.274 1.00 0.00 H new ATOM 0 HA SER A 105 9.120 7.753 -7.239 1.00 0.00 H new ATOM 0 HB2 SER A 105 7.148 5.872 -8.590 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.078 7.622 -8.540 1.00 0.00 H new ATOM 0 HG SER A 105 7.950 6.835 -10.544 1.00 0.00 H new ATOM 1634 N LEU A 106 7.622 5.220 -5.802 1.00 0.00 N ATOM 1635 CA LEU A 106 6.840 4.797 -4.651 1.00 0.00 C ATOM 1636 C LEU A 106 7.569 5.106 -3.347 1.00 0.00 C ATOM 1637 O LEU A 106 6.965 5.563 -2.373 1.00 0.00 O ATOM 1638 CB LEU A 106 6.560 3.300 -4.755 1.00 0.00 C ATOM 1639 CG LEU A 106 5.661 2.899 -5.924 1.00 0.00 C ATOM 1640 CD1 LEU A 106 5.558 1.386 -6.026 1.00 0.00 C ATOM 1641 CD2 LEU A 106 4.283 3.525 -5.767 1.00 0.00 C ATOM 0 H LEU A 106 7.999 4.451 -6.356 1.00 0.00 H new ATOM 0 HA LEU A 106 5.899 5.348 -4.646 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.509 2.772 -4.846 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.097 2.965 -3.827 1.00 0.00 H new ATOM 0 HG LEU A 106 6.105 3.270 -6.848 1.00 0.00 H new ATOM 0 HD11 LEU A 106 4.914 1.121 -6.864 1.00 0.00 H new ATOM 0 HD12 LEU A 106 6.550 0.964 -6.183 1.00 0.00 H new ATOM 0 HD13 LEU A 106 5.136 0.987 -5.104 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.652 3.232 -6.606 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.831 3.182 -4.836 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.377 4.611 -5.746 1.00 0.00 H new ATOM 1653 N MET A 107 8.873 4.870 -3.345 1.00 0.00 N ATOM 1654 CA MET A 107 9.684 5.063 -2.151 1.00 0.00 C ATOM 1655 C MET A 107 9.679 6.520 -1.702 1.00 0.00 C ATOM 1656 O MET A 107 9.556 6.804 -0.510 1.00 0.00 O ATOM 1657 CB MET A 107 11.120 4.587 -2.387 1.00 0.00 C ATOM 1658 CG MET A 107 11.220 3.115 -2.757 1.00 0.00 C ATOM 1659 SD MET A 107 12.911 2.496 -2.700 1.00 0.00 S ATOM 1660 CE MET A 107 13.242 2.648 -0.948 1.00 0.00 C ATOM 0 H MET A 107 9.393 4.544 -4.159 1.00 0.00 H new ATOM 0 HA MET A 107 9.242 4.463 -1.355 1.00 0.00 H new ATOM 0 HB2 MET A 107 11.566 5.184 -3.182 1.00 0.00 H new ATOM 0 HB3 MET A 107 11.706 4.767 -1.486 1.00 0.00 H new ATOM 0 HG2 MET A 107 10.601 2.531 -2.076 1.00 0.00 H new ATOM 0 HG3 MET A 107 10.818 2.969 -3.759 1.00 0.00 H new ATOM 0 HE1 MET A 107 14.089 3.317 -0.794 1.00 0.00 H new ATOM 0 HE2 MET A 107 12.364 3.053 -0.446 1.00 0.00 H new ATOM 0 HE3 MET A 107 13.476 1.667 -0.535 1.00 0.00 H new ATOM 1670 N ARG A 108 9.791 7.443 -2.653 1.00 0.00 N ATOM 1671 CA ARG A 108 9.805 8.863 -2.317 1.00 0.00 C ATOM 1672 C ARG A 108 8.437 9.326 -1.825 1.00 0.00 C ATOM 1673 O ARG A 108 8.344 10.241 -1.013 1.00 0.00 O ATOM 1674 CB ARG A 108 10.255 9.721 -3.501 1.00 0.00 C ATOM 1675 CG ARG A 108 9.416 9.547 -4.750 1.00 0.00 C ATOM 1676 CD ARG A 108 9.656 10.678 -5.731 1.00 0.00 C ATOM 1677 NE ARG A 108 9.024 11.925 -5.292 1.00 0.00 N ATOM 1678 CZ ARG A 108 9.060 13.070 -5.976 1.00 0.00 C ATOM 1679 NH1 ARG A 108 9.760 13.155 -7.100 1.00 0.00 N ATOM 1680 NH2 ARG A 108 8.414 14.136 -5.518 1.00 0.00 N ATOM 0 H ARG A 108 9.872 7.238 -3.649 1.00 0.00 H new ATOM 0 HA ARG A 108 10.528 8.992 -1.512 1.00 0.00 H new ATOM 0 HB2 ARG A 108 10.232 10.770 -3.205 1.00 0.00 H new ATOM 0 HB3 ARG A 108 11.291 9.479 -3.737 1.00 0.00 H new ATOM 0 HG2 ARG A 108 9.655 8.594 -5.223 1.00 0.00 H new ATOM 0 HG3 ARG A 108 8.360 9.513 -4.481 1.00 0.00 H new ATOM 0 HD2 ARG A 108 10.728 10.836 -5.848 1.00 0.00 H new ATOM 0 HD3 ARG A 108 9.266 10.398 -6.710 1.00 0.00 H new ATOM 0 HE ARG A 108 8.523 11.917 -4.404 1.00 0.00 H new ATOM 0 HH11 ARG A 108 10.273 12.343 -7.444 1.00 0.00 H new ATOM 0 HH12 ARG A 108 9.785 14.032 -7.620 1.00 0.00 H new ATOM 0 HH21 ARG A 108 7.891 14.079 -4.644 1.00 0.00 H new ATOM 0 HH22 ARG A 108 8.441 15.012 -6.040 1.00 0.00 H new ATOM 1694 N VAL A 109 7.376 8.689 -2.311 1.00 0.00 N ATOM 1695 CA VAL A 109 6.029 9.036 -1.875 1.00 0.00 C ATOM 1696 C VAL A 109 5.833 8.678 -0.410 1.00 0.00 C ATOM 1697 O VAL A 109 5.356 9.496 0.380 1.00 0.00 O ATOM 1698 CB VAL A 109 4.944 8.334 -2.721 1.00 0.00 C ATOM 1699 CG1 VAL A 109 3.565 8.581 -2.129 1.00 0.00 C ATOM 1700 CG2 VAL A 109 4.994 8.811 -4.163 1.00 0.00 C ATOM 0 H VAL A 109 7.422 7.938 -2.999 1.00 0.00 H new ATOM 0 HA VAL A 109 5.921 10.112 -2.010 1.00 0.00 H new ATOM 0 HB VAL A 109 5.141 7.262 -2.707 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.813 8.079 -2.738 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.530 8.189 -1.112 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.363 9.652 -2.112 1.00 0.00 H new ATOM 0 HG21 VAL A 109 4.221 8.304 -4.741 1.00 0.00 H new ATOM 0 HG22 VAL A 109 4.824 9.887 -4.196 1.00 0.00 H new ATOM 0 HG23 VAL A 109 5.972 8.585 -4.587 1.00 0.00 H new ATOM 1710 N ALA A 110 6.210 7.456 -0.052 1.00 0.00 N ATOM 1711 CA ALA A 110 6.121 7.010 1.328 1.00 0.00 C ATOM 1712 C ALA A 110 6.921 7.933 2.232 1.00 0.00 C ATOM 1713 O ALA A 110 6.433 8.375 3.273 1.00 0.00 O ATOM 1714 CB ALA A 110 6.623 5.582 1.468 1.00 0.00 C ATOM 0 H ALA A 110 6.579 6.759 -0.699 1.00 0.00 H new ATOM 0 HA ALA A 110 5.073 7.039 1.628 1.00 0.00 H new ATOM 0 HB1 ALA A 110 6.547 5.270 2.510 1.00 0.00 H new ATOM 0 HB2 ALA A 110 6.019 4.921 0.846 1.00 0.00 H new ATOM 0 HB3 ALA A 110 7.664 5.529 1.149 1.00 0.00 H new ATOM 1720 N ASP A 111 8.139 8.243 1.801 1.00 0.00 N ATOM 1721 CA ASP A 111 9.054 9.081 2.571 1.00 0.00 C ATOM 1722 C ASP A 111 8.485 10.488 2.741 1.00 0.00 C ATOM 1723 O ASP A 111 8.673 11.131 3.777 1.00 0.00 O ATOM 1724 CB ASP A 111 10.409 9.142 1.861 1.00 0.00 C ATOM 1725 CG ASP A 111 11.519 9.678 2.739 1.00 0.00 C ATOM 1726 OD1 ASP A 111 12.181 8.865 3.421 1.00 0.00 O ATOM 1727 OD2 ASP A 111 11.759 10.904 2.730 1.00 0.00 O ATOM 0 H ASP A 111 8.520 7.922 0.911 1.00 0.00 H new ATOM 0 HA ASP A 111 9.183 8.645 3.562 1.00 0.00 H new ATOM 0 HB2 ASP A 111 10.677 8.143 1.517 1.00 0.00 H new ATOM 0 HB3 ASP A 111 10.320 9.771 0.975 1.00 0.00 H new ATOM 1732 N ALA A 112 7.774 10.951 1.720 1.00 0.00 N ATOM 1733 CA ALA A 112 7.174 12.277 1.737 1.00 0.00 C ATOM 1734 C ALA A 112 6.011 12.360 2.721 1.00 0.00 C ATOM 1735 O ALA A 112 5.924 13.300 3.515 1.00 0.00 O ATOM 1736 CB ALA A 112 6.698 12.648 0.343 1.00 0.00 C ATOM 0 H ALA A 112 7.599 10.423 0.865 1.00 0.00 H new ATOM 0 HA ALA A 112 7.938 12.982 2.065 1.00 0.00 H new ATOM 0 HB1 ALA A 112 6.250 13.642 0.364 1.00 0.00 H new ATOM 0 HB2 ALA A 112 7.545 12.646 -0.343 1.00 0.00 H new ATOM 0 HB3 ALA A 112 5.957 11.923 0.007 1.00 0.00 H new ATOM 1742 N VAL A 113 5.125 11.374 2.672 1.00 0.00 N ATOM 1743 CA VAL A 113 3.901 11.409 3.467 1.00 0.00 C ATOM 1744 C VAL A 113 4.128 10.879 4.883 1.00 0.00 C ATOM 1745 O VAL A 113 3.422 11.259 5.818 1.00 0.00 O ATOM 1746 CB VAL A 113 2.760 10.616 2.783 1.00 0.00 C ATOM 1747 CG1 VAL A 113 2.493 11.166 1.392 1.00 0.00 C ATOM 1748 CG2 VAL A 113 3.084 9.132 2.712 1.00 0.00 C ATOM 0 H VAL A 113 5.229 10.541 2.092 1.00 0.00 H new ATOM 0 HA VAL A 113 3.604 12.455 3.538 1.00 0.00 H new ATOM 0 HB VAL A 113 1.861 10.734 3.388 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.689 10.598 0.924 1.00 0.00 H new ATOM 0 HG12 VAL A 113 2.203 12.214 1.465 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.396 11.081 0.788 1.00 0.00 H new ATOM 0 HG21 VAL A 113 2.264 8.603 2.227 1.00 0.00 H new ATOM 0 HG22 VAL A 113 3.999 8.986 2.138 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.222 8.741 3.720 1.00 0.00 H new ATOM 1758 N GLY A 114 5.120 10.014 5.039 1.00 0.00 N ATOM 1759 CA GLY A 114 5.422 9.463 6.346 1.00 0.00 C ATOM 1760 C GLY A 114 4.649 8.192 6.620 1.00 0.00 C ATOM 1761 O GLY A 114 4.116 7.997 7.717 1.00 0.00 O ATOM 0 H GLY A 114 5.722 9.683 4.284 1.00 0.00 H new ATOM 0 HA2 GLY A 114 6.491 9.259 6.415 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.188 10.201 7.113 1.00 0.00 H new ATOM 1765 N ALA A 115 4.582 7.326 5.621 1.00 0.00 N ATOM 1766 CA ALA A 115 3.845 6.080 5.738 1.00 0.00 C ATOM 1767 C ALA A 115 4.748 4.897 5.433 1.00 0.00 C ATOM 1768 O ALA A 115 5.738 5.032 4.716 1.00 0.00 O ATOM 1769 CB ALA A 115 2.653 6.083 4.797 1.00 0.00 C ATOM 0 H ALA A 115 5.032 7.465 4.716 1.00 0.00 H new ATOM 0 HA ALA A 115 3.485 5.988 6.763 1.00 0.00 H new ATOM 0 HB1 ALA A 115 2.110 5.143 4.895 1.00 0.00 H new ATOM 0 HB2 ALA A 115 1.992 6.912 5.049 1.00 0.00 H new ATOM 0 HB3 ALA A 115 3.000 6.196 3.770 1.00 0.00 H new ATOM 1775 N ARG A 116 4.410 3.742 5.983 1.00 0.00 N ATOM 1776 CA ARG A 116 5.179 2.535 5.727 1.00 0.00 C ATOM 1777 C ARG A 116 4.896 2.029 4.319 1.00 0.00 C ATOM 1778 O ARG A 116 3.741 1.814 3.953 1.00 0.00 O ATOM 1779 CB ARG A 116 4.845 1.448 6.751 1.00 0.00 C ATOM 1780 CG ARG A 116 5.800 0.262 6.713 1.00 0.00 C ATOM 1781 CD ARG A 116 5.406 -0.814 7.713 1.00 0.00 C ATOM 1782 NE ARG A 116 5.262 -0.285 9.068 1.00 0.00 N ATOM 1783 CZ ARG A 116 5.513 -0.983 10.172 1.00 0.00 C ATOM 1784 NH1 ARG A 116 6.059 -2.191 10.093 1.00 0.00 N ATOM 1785 NH2 ARG A 116 5.255 -0.448 11.358 1.00 0.00 N ATOM 0 H ARG A 116 3.613 3.615 6.606 1.00 0.00 H new ATOM 0 HA ARG A 116 6.238 2.776 5.817 1.00 0.00 H new ATOM 0 HB2 ARG A 116 4.860 1.884 7.750 1.00 0.00 H new ATOM 0 HB3 ARG A 116 3.830 1.093 6.574 1.00 0.00 H new ATOM 0 HG2 ARG A 116 5.813 -0.162 5.709 1.00 0.00 H new ATOM 0 HG3 ARG A 116 6.813 0.604 6.927 1.00 0.00 H new ATOM 0 HD2 ARG A 116 4.466 -1.270 7.401 1.00 0.00 H new ATOM 0 HD3 ARG A 116 6.159 -1.602 7.711 1.00 0.00 H new ATOM 0 HE ARG A 116 4.949 0.680 9.174 1.00 0.00 H new ATOM 0 HH11 ARG A 116 6.288 -2.588 9.182 1.00 0.00 H new ATOM 0 HH12 ARG A 116 6.249 -2.721 10.943 1.00 0.00 H new ATOM 0 HH21 ARG A 116 4.867 0.493 11.419 1.00 0.00 H new ATOM 0 HH22 ARG A 116 5.445 -0.978 12.209 1.00 0.00 H new ATOM 1799 N LEU A 117 5.949 1.865 3.533 1.00 0.00 N ATOM 1800 CA LEU A 117 5.819 1.358 2.175 1.00 0.00 C ATOM 1801 C LEU A 117 6.011 -0.150 2.163 1.00 0.00 C ATOM 1802 O LEU A 117 7.048 -0.648 2.591 1.00 0.00 O ATOM 1803 CB LEU A 117 6.850 2.019 1.254 1.00 0.00 C ATOM 1804 CG LEU A 117 6.825 1.544 -0.203 1.00 0.00 C ATOM 1805 CD1 LEU A 117 5.531 1.961 -0.884 1.00 0.00 C ATOM 1806 CD2 LEU A 117 8.021 2.089 -0.959 1.00 0.00 C ATOM 0 H LEU A 117 6.907 2.076 3.813 1.00 0.00 H new ATOM 0 HA LEU A 117 4.820 1.597 1.810 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.689 3.097 1.270 1.00 0.00 H new ATOM 0 HB3 LEU A 117 7.845 1.839 1.661 1.00 0.00 H new ATOM 0 HG LEU A 117 6.878 0.455 -0.208 1.00 0.00 H new ATOM 0 HD11 LEU A 117 5.535 1.613 -1.917 1.00 0.00 H new ATOM 0 HD12 LEU A 117 4.684 1.522 -0.357 1.00 0.00 H new ATOM 0 HD13 LEU A 117 5.445 3.047 -0.867 1.00 0.00 H new ATOM 0 HD21 LEU A 117 7.988 1.742 -1.992 1.00 0.00 H new ATOM 0 HD22 LEU A 117 7.997 3.179 -0.941 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.940 1.739 -0.488 1.00 0.00 H new ATOM 1818 N ILE A 118 5.013 -0.876 1.693 1.00 0.00 N ATOM 1819 CA ILE A 118 5.106 -2.327 1.629 1.00 0.00 C ATOM 1820 C ILE A 118 4.983 -2.817 0.191 1.00 0.00 C ATOM 1821 O ILE A 118 3.984 -2.574 -0.484 1.00 0.00 O ATOM 1822 CB ILE A 118 4.035 -3.011 2.509 1.00 0.00 C ATOM 1823 CG1 ILE A 118 4.217 -2.605 3.976 1.00 0.00 C ATOM 1824 CG2 ILE A 118 4.108 -4.526 2.361 1.00 0.00 C ATOM 1825 CD1 ILE A 118 3.191 -3.210 4.912 1.00 0.00 C ATOM 0 H ILE A 118 4.133 -0.490 1.351 1.00 0.00 H new ATOM 0 HA ILE A 118 6.088 -2.600 2.016 1.00 0.00 H new ATOM 0 HB ILE A 118 3.050 -2.682 2.176 1.00 0.00 H new ATOM 0 HG12 ILE A 118 5.213 -2.902 4.304 1.00 0.00 H new ATOM 0 HG13 ILE A 118 4.167 -1.519 4.051 1.00 0.00 H new ATOM 0 HG21 ILE A 118 3.347 -4.990 2.988 1.00 0.00 H new ATOM 0 HG22 ILE A 118 3.936 -4.799 1.320 1.00 0.00 H new ATOM 0 HG23 ILE A 118 5.094 -4.875 2.669 1.00 0.00 H new ATOM 0 HD11 ILE A 118 3.386 -2.876 5.931 1.00 0.00 H new ATOM 0 HD12 ILE A 118 2.192 -2.893 4.611 1.00 0.00 H new ATOM 0 HD13 ILE A 118 3.255 -4.297 4.868 1.00 0.00 H new ATOM 1837 N ILE A 119 6.016 -3.496 -0.274 1.00 0.00 N ATOM 1838 CA ILE A 119 6.035 -4.047 -1.617 1.00 0.00 C ATOM 1839 C ILE A 119 6.014 -5.569 -1.574 1.00 0.00 C ATOM 1840 O ILE A 119 6.783 -6.192 -0.839 1.00 0.00 O ATOM 1841 CB ILE A 119 7.276 -3.567 -2.409 1.00 0.00 C ATOM 1842 CG1 ILE A 119 7.104 -2.098 -2.811 1.00 0.00 C ATOM 1843 CG2 ILE A 119 7.528 -4.440 -3.636 1.00 0.00 C ATOM 1844 CD1 ILE A 119 8.191 -1.591 -3.733 1.00 0.00 C ATOM 0 H ILE A 119 6.862 -3.680 0.266 1.00 0.00 H new ATOM 0 HA ILE A 119 5.141 -3.689 -2.127 1.00 0.00 H new ATOM 0 HB ILE A 119 8.149 -3.656 -1.762 1.00 0.00 H new ATOM 0 HG12 ILE A 119 6.138 -1.975 -3.300 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.087 -1.483 -1.911 1.00 0.00 H new ATOM 0 HG21 ILE A 119 8.406 -4.075 -4.168 1.00 0.00 H new ATOM 0 HG22 ILE A 119 7.697 -5.470 -3.321 1.00 0.00 H new ATOM 0 HG23 ILE A 119 6.661 -4.400 -4.296 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.004 -0.545 -3.975 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.159 -1.682 -3.239 1.00 0.00 H new ATOM 0 HD13 ILE A 119 8.195 -2.181 -4.650 1.00 0.00 H new ATOM 1856 N LYS A 120 5.118 -6.159 -2.349 1.00 0.00 N ATOM 1857 CA LYS A 120 5.063 -7.603 -2.486 1.00 0.00 C ATOM 1858 C LYS A 120 5.609 -8.001 -3.856 1.00 0.00 C ATOM 1859 O LYS A 120 4.886 -7.965 -4.854 1.00 0.00 O ATOM 1860 CB LYS A 120 3.622 -8.101 -2.319 1.00 0.00 C ATOM 1861 CG LYS A 120 3.501 -9.453 -1.625 1.00 0.00 C ATOM 1862 CD LYS A 120 4.225 -10.562 -2.377 1.00 0.00 C ATOM 1863 CE LYS A 120 4.050 -11.906 -1.685 1.00 0.00 C ATOM 1864 NZ LYS A 120 4.508 -11.864 -0.270 1.00 0.00 N ATOM 0 H LYS A 120 4.417 -5.657 -2.894 1.00 0.00 H new ATOM 0 HA LYS A 120 5.673 -8.062 -1.708 1.00 0.00 H new ATOM 0 HB2 LYS A 120 3.058 -7.362 -1.750 1.00 0.00 H new ATOM 0 HB3 LYS A 120 3.157 -8.168 -3.303 1.00 0.00 H new ATOM 0 HG2 LYS A 120 3.907 -9.378 -0.616 1.00 0.00 H new ATOM 0 HG3 LYS A 120 2.447 -9.714 -1.526 1.00 0.00 H new ATOM 0 HD2 LYS A 120 3.843 -10.623 -3.396 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.286 -10.323 -2.448 1.00 0.00 H new ATOM 0 HE2 LYS A 120 3.000 -12.198 -1.719 1.00 0.00 H new ATOM 0 HE3 LYS A 120 4.610 -12.669 -2.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 4.148 -12.698 0.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 5.548 -11.864 -0.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 4.149 -11.001 0.185 1.00 0.00 H new ATOM 1878 N PRO A 121 6.905 -8.341 -3.928 1.00 0.00 N ATOM 1879 CA PRO A 121 7.551 -8.731 -5.178 1.00 0.00 C ATOM 1880 C PRO A 121 7.380 -10.216 -5.488 1.00 0.00 C ATOM 1881 O PRO A 121 6.514 -10.888 -4.923 1.00 0.00 O ATOM 1882 CB PRO A 121 9.016 -8.407 -4.903 1.00 0.00 C ATOM 1883 CG PRO A 121 9.185 -8.661 -3.444 1.00 0.00 C ATOM 1884 CD PRO A 121 7.854 -8.360 -2.798 1.00 0.00 C ATOM 0 HA PRO A 121 7.130 -8.219 -6.043 1.00 0.00 H new ATOM 0 HB2 PRO A 121 9.680 -9.037 -5.495 1.00 0.00 H new ATOM 0 HB3 PRO A 121 9.248 -7.372 -5.156 1.00 0.00 H new ATOM 0 HG2 PRO A 121 9.479 -9.695 -3.262 1.00 0.00 H new ATOM 0 HG3 PRO A 121 9.969 -8.028 -3.029 1.00 0.00 H new ATOM 0 HD2 PRO A 121 7.586 -9.120 -2.064 1.00 0.00 H new ATOM 0 HD3 PRO A 121 7.871 -7.404 -2.275 1.00 0.00 H new ATOM 1892 N LEU A 122 8.212 -10.718 -6.387 1.00 0.00 N ATOM 1893 CA LEU A 122 8.169 -12.117 -6.775 1.00 0.00 C ATOM 1894 C LEU A 122 9.007 -12.959 -5.823 1.00 0.00 C ATOM 1895 O LEU A 122 9.885 -12.444 -5.133 1.00 0.00 O ATOM 1896 CB LEU A 122 8.660 -12.295 -8.219 1.00 0.00 C ATOM 1897 CG LEU A 122 7.628 -11.985 -9.309 1.00 0.00 C ATOM 1898 CD1 LEU A 122 7.327 -10.494 -9.367 1.00 0.00 C ATOM 1899 CD2 LEU A 122 8.118 -12.481 -10.659 1.00 0.00 C ATOM 0 H LEU A 122 8.930 -10.172 -6.864 1.00 0.00 H new ATOM 0 HA LEU A 122 7.134 -12.455 -6.720 1.00 0.00 H new ATOM 0 HB2 LEU A 122 9.528 -11.653 -8.371 1.00 0.00 H new ATOM 0 HB3 LEU A 122 8.998 -13.323 -8.345 1.00 0.00 H new ATOM 0 HG LEU A 122 6.704 -12.507 -9.060 1.00 0.00 H new ATOM 0 HD11 LEU A 122 6.592 -10.301 -10.149 1.00 0.00 H new ATOM 0 HD12 LEU A 122 6.930 -10.165 -8.407 1.00 0.00 H new ATOM 0 HD13 LEU A 122 8.243 -9.946 -9.588 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.374 -12.253 -11.422 1.00 0.00 H new ATOM 0 HD22 LEU A 122 9.057 -11.987 -10.909 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.275 -13.559 -10.616 1.00 0.00 H new ATOM 1911 N THR A 123 8.728 -14.255 -5.797 1.00 0.00 N ATOM 1912 CA THR A 123 9.423 -15.183 -4.914 1.00 0.00 C ATOM 1913 C THR A 123 10.907 -15.281 -5.257 1.00 0.00 C ATOM 1914 O THR A 123 11.749 -15.462 -4.378 1.00 0.00 O ATOM 1915 CB THR A 123 8.781 -16.578 -4.996 1.00 0.00 C ATOM 1916 OG1 THR A 123 8.455 -16.878 -6.362 1.00 0.00 O ATOM 1917 CG2 THR A 123 7.524 -16.646 -4.145 1.00 0.00 C ATOM 0 H THR A 123 8.017 -14.692 -6.384 1.00 0.00 H new ATOM 0 HA THR A 123 9.333 -14.798 -3.898 1.00 0.00 H new ATOM 0 HB THR A 123 9.494 -17.310 -4.618 1.00 0.00 H new ATOM 0 HG1 THR A 123 8.048 -17.768 -6.413 1.00 0.00 H new ATOM 0 HG21 THR A 123 7.088 -17.642 -4.219 1.00 0.00 H new ATOM 0 HG22 THR A 123 7.777 -16.437 -3.105 1.00 0.00 H new ATOM 0 HG23 THR A 123 6.805 -15.908 -4.499 1.00 0.00 H new ATOM 1925 N GLY A 124 11.214 -15.160 -6.540 1.00 0.00 N ATOM 1926 CA GLY A 124 12.589 -15.232 -6.986 1.00 0.00 C ATOM 1927 C GLY A 124 12.941 -14.106 -7.930 1.00 0.00 C ATOM 1928 O GLY A 124 13.587 -14.327 -8.957 1.00 0.00 O ATOM 0 H GLY A 124 10.531 -15.013 -7.283 1.00 0.00 H new ATOM 0 HA2 GLY A 124 13.252 -15.200 -6.121 1.00 0.00 H new ATOM 0 HA3 GLY A 124 12.759 -16.187 -7.483 1.00 0.00 H new ATOM 1932 N GLU A 125 12.510 -12.900 -7.591 1.00 0.00 N ATOM 1933 CA GLU A 125 12.797 -11.731 -8.409 1.00 0.00 C ATOM 1934 C GLU A 125 12.994 -10.506 -7.520 1.00 0.00 C ATOM 1935 O GLU A 125 12.167 -10.216 -6.655 1.00 0.00 O ATOM 1936 CB GLU A 125 11.669 -11.490 -9.417 1.00 0.00 C ATOM 1937 CG GLU A 125 11.952 -10.359 -10.390 1.00 0.00 C ATOM 1938 CD GLU A 125 10.866 -10.181 -11.432 1.00 0.00 C ATOM 1939 OE1 GLU A 125 10.772 -11.022 -12.353 1.00 0.00 O ATOM 1940 OE2 GLU A 125 10.113 -9.188 -11.346 1.00 0.00 O ATOM 0 H GLU A 125 11.960 -12.705 -6.754 1.00 0.00 H new ATOM 0 HA GLU A 125 13.717 -11.910 -8.965 1.00 0.00 H new ATOM 0 HB2 GLU A 125 11.495 -12.407 -9.980 1.00 0.00 H new ATOM 0 HB3 GLU A 125 10.750 -11.269 -8.874 1.00 0.00 H new ATOM 0 HG2 GLU A 125 12.067 -9.429 -9.833 1.00 0.00 H new ATOM 0 HG3 GLU A 125 12.900 -10.549 -10.892 1.00 0.00 H new ATOM 1947 N ASP A 126 14.095 -9.802 -7.741 1.00 0.00 N ATOM 1948 CA ASP A 126 14.465 -8.658 -6.916 1.00 0.00 C ATOM 1949 C ASP A 126 13.780 -7.387 -7.420 1.00 0.00 C ATOM 1950 O ASP A 126 13.230 -7.363 -8.523 1.00 0.00 O ATOM 1951 CB ASP A 126 15.991 -8.483 -6.930 1.00 0.00 C ATOM 1952 CG ASP A 126 16.506 -7.548 -5.851 1.00 0.00 C ATOM 1953 OD1 ASP A 126 16.576 -6.329 -6.100 1.00 0.00 O ATOM 1954 OD2 ASP A 126 16.861 -8.034 -4.758 1.00 0.00 O ATOM 0 H ASP A 126 14.754 -10.005 -8.492 1.00 0.00 H new ATOM 0 HA ASP A 126 14.135 -8.840 -5.893 1.00 0.00 H new ATOM 0 HB2 ASP A 126 16.461 -9.459 -6.808 1.00 0.00 H new ATOM 0 HB3 ASP A 126 16.296 -8.102 -7.905 1.00 0.00 H new ATOM 1959 N ILE A 127 13.828 -6.335 -6.615 1.00 0.00 N ATOM 1960 CA ILE A 127 13.189 -5.067 -6.955 1.00 0.00 C ATOM 1961 C ILE A 127 14.138 -4.203 -7.783 1.00 0.00 C ATOM 1962 O ILE A 127 13.710 -3.309 -8.513 1.00 0.00 O ATOM 1963 CB ILE A 127 12.774 -4.289 -5.680 1.00 0.00 C ATOM 1964 CG1 ILE A 127 11.993 -5.196 -4.719 1.00 0.00 C ATOM 1965 CG2 ILE A 127 11.936 -3.071 -6.047 1.00 0.00 C ATOM 1966 CD1 ILE A 127 11.611 -4.519 -3.417 1.00 0.00 C ATOM 0 H ILE A 127 14.306 -6.333 -5.714 1.00 0.00 H new ATOM 0 HA ILE A 127 12.294 -5.292 -7.535 1.00 0.00 H new ATOM 0 HB ILE A 127 13.681 -3.953 -5.178 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.088 -5.544 -5.217 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.594 -6.078 -4.497 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.654 -2.537 -5.140 1.00 0.00 H new ATOM 0 HG22 ILE A 127 12.517 -2.411 -6.691 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.037 -3.393 -6.573 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.062 -5.221 -2.789 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.513 -4.196 -2.897 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.983 -3.653 -3.628 1.00 0.00 H new ATOM 2047 N LYS A 132 17.575 0.003 0.760 1.00 0.00 N ATOM 2048 CA LYS A 132 16.742 0.846 1.601 1.00 0.00 C ATOM 2049 C LYS A 132 15.633 0.023 2.249 1.00 0.00 C ATOM 2050 O LYS A 132 15.289 0.228 3.412 1.00 0.00 O ATOM 2051 CB LYS A 132 16.116 1.961 0.759 1.00 0.00 C ATOM 2052 CG LYS A 132 17.122 2.809 -0.009 1.00 0.00 C ATOM 2053 CD LYS A 132 17.857 3.783 0.898 1.00 0.00 C ATOM 2054 CE LYS A 132 16.899 4.778 1.532 1.00 0.00 C ATOM 2055 NZ LYS A 132 17.613 5.856 2.262 1.00 0.00 N ATOM 0 HA LYS A 132 17.366 1.280 2.382 1.00 0.00 H new ATOM 0 HB2 LYS A 132 15.418 1.516 0.050 1.00 0.00 H new ATOM 0 HB3 LYS A 132 15.535 2.611 1.413 1.00 0.00 H new ATOM 0 HG2 LYS A 132 17.844 2.158 -0.502 1.00 0.00 H new ATOM 0 HG3 LYS A 132 16.605 3.363 -0.793 1.00 0.00 H new ATOM 0 HD2 LYS A 132 18.381 3.232 1.679 1.00 0.00 H new ATOM 0 HD3 LYS A 132 18.613 4.318 0.324 1.00 0.00 H new ATOM 0 HE2 LYS A 132 16.271 5.220 0.758 1.00 0.00 H new ATOM 0 HE3 LYS A 132 16.235 4.254 2.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 16.921 6.511 2.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 18.192 5.438 3.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 18.227 6.375 1.602 1.00 0.00 H new ATOM 2069 N MET A 133 15.077 -0.911 1.485 1.00 0.00 N ATOM 2070 CA MET A 133 13.945 -1.698 1.952 1.00 0.00 C ATOM 2071 C MET A 133 14.412 -2.968 2.641 1.00 0.00 C ATOM 2072 O MET A 133 15.514 -3.459 2.394 1.00 0.00 O ATOM 2073 CB MET A 133 13.006 -2.043 0.794 1.00 0.00 C ATOM 2074 CG MET A 133 12.473 -0.820 0.070 1.00 0.00 C ATOM 2075 SD MET A 133 11.168 -1.211 -1.111 1.00 0.00 S ATOM 2076 CE MET A 133 9.816 -1.596 -0.002 1.00 0.00 C ATOM 0 H MET A 133 15.392 -1.140 0.542 1.00 0.00 H new ATOM 0 HA MET A 133 13.398 -1.094 2.676 1.00 0.00 H new ATOM 0 HB2 MET A 133 13.535 -2.676 0.082 1.00 0.00 H new ATOM 0 HB3 MET A 133 12.167 -2.625 1.176 1.00 0.00 H new ATOM 0 HG2 MET A 133 12.091 -0.109 0.803 1.00 0.00 H new ATOM 0 HG3 MET A 133 13.293 -0.329 -0.453 1.00 0.00 H new ATOM 0 HE1 MET A 133 9.428 -2.588 -0.232 1.00 0.00 H new ATOM 0 HE2 MET A 133 10.173 -1.576 1.028 1.00 0.00 H new ATOM 0 HE3 MET A 133 9.023 -0.858 -0.125 1.00 0.00 H new ATOM 2086 N LYS A 134 13.557 -3.500 3.493 1.00 0.00 N ATOM 2087 CA LYS A 134 13.895 -4.662 4.300 1.00 0.00 C ATOM 2088 C LYS A 134 12.941 -5.817 4.018 1.00 0.00 C ATOM 2089 O LYS A 134 11.742 -5.610 3.823 1.00 0.00 O ATOM 2090 CB LYS A 134 13.845 -4.289 5.783 1.00 0.00 C ATOM 2091 CG LYS A 134 12.589 -3.520 6.151 1.00 0.00 C ATOM 2092 CD LYS A 134 12.512 -3.202 7.631 1.00 0.00 C ATOM 2093 CE LYS A 134 12.411 -4.464 8.471 1.00 0.00 C ATOM 2094 NZ LYS A 134 11.815 -4.191 9.803 1.00 0.00 N ATOM 0 H LYS A 134 12.614 -3.144 3.647 1.00 0.00 H new ATOM 0 HA LYS A 134 14.903 -4.985 4.040 1.00 0.00 H new ATOM 0 HB2 LYS A 134 13.900 -5.197 6.384 1.00 0.00 H new ATOM 0 HB3 LYS A 134 14.720 -3.689 6.032 1.00 0.00 H new ATOM 0 HG2 LYS A 134 12.556 -2.591 5.582 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.714 -4.102 5.862 1.00 0.00 H new ATOM 0 HD2 LYS A 134 13.395 -2.636 7.928 1.00 0.00 H new ATOM 0 HD3 LYS A 134 11.647 -2.567 7.823 1.00 0.00 H new ATOM 0 HE2 LYS A 134 11.806 -5.203 7.946 1.00 0.00 H new ATOM 0 HE3 LYS A 134 13.403 -4.897 8.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 11.976 -5.006 10.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 12.258 -3.345 10.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 10.793 -4.031 9.700 1.00 0.00 H new ATOM 2108 N LEU A 135 13.482 -7.026 3.985 1.00 0.00 N ATOM 2109 CA LEU A 135 12.682 -8.222 3.768 1.00 0.00 C ATOM 2110 C LEU A 135 12.059 -8.681 5.081 1.00 0.00 C ATOM 2111 O LEU A 135 12.767 -8.973 6.045 1.00 0.00 O ATOM 2112 CB LEU A 135 13.547 -9.342 3.180 1.00 0.00 C ATOM 2113 CG LEU A 135 12.807 -10.650 2.888 1.00 0.00 C ATOM 2114 CD1 LEU A 135 11.805 -10.460 1.762 1.00 0.00 C ATOM 2115 CD2 LEU A 135 13.790 -11.755 2.547 1.00 0.00 C ATOM 0 H LEU A 135 14.479 -7.205 4.107 1.00 0.00 H new ATOM 0 HA LEU A 135 11.887 -7.985 3.061 1.00 0.00 H new ATOM 0 HB2 LEU A 135 13.998 -8.984 2.255 1.00 0.00 H new ATOM 0 HB3 LEU A 135 14.363 -9.551 3.872 1.00 0.00 H new ATOM 0 HG LEU A 135 12.261 -10.941 3.785 1.00 0.00 H new ATOM 0 HD11 LEU A 135 11.290 -11.401 1.570 1.00 0.00 H new ATOM 0 HD12 LEU A 135 11.078 -9.700 2.047 1.00 0.00 H new ATOM 0 HD13 LEU A 135 12.328 -10.142 0.860 1.00 0.00 H new ATOM 0 HD21 LEU A 135 13.245 -12.677 2.343 1.00 0.00 H new ATOM 0 HD22 LEU A 135 14.366 -11.471 1.666 1.00 0.00 H new ATOM 0 HD23 LEU A 135 14.466 -11.912 3.387 1.00 0.00 H new ATOM 2127 N VAL A 136 10.740 -8.739 5.114 1.00 0.00 N ATOM 2128 CA VAL A 136 10.017 -9.123 6.320 1.00 0.00 C ATOM 2129 C VAL A 136 9.192 -10.376 6.077 1.00 0.00 C ATOM 2130 O VAL A 136 8.678 -10.589 4.979 1.00 0.00 O ATOM 2131 CB VAL A 136 9.080 -8.002 6.819 1.00 0.00 C ATOM 2132 CG1 VAL A 136 9.515 -7.512 8.189 1.00 0.00 C ATOM 2133 CG2 VAL A 136 9.028 -6.845 5.832 1.00 0.00 C ATOM 0 H VAL A 136 10.142 -8.524 4.316 1.00 0.00 H new ATOM 0 HA VAL A 136 10.770 -9.313 7.085 1.00 0.00 H new ATOM 0 HB VAL A 136 8.076 -8.419 6.900 1.00 0.00 H new ATOM 0 HG11 VAL A 136 8.842 -6.722 8.523 1.00 0.00 H new ATOM 0 HG12 VAL A 136 9.484 -8.339 8.898 1.00 0.00 H new ATOM 0 HG13 VAL A 136 10.531 -7.122 8.130 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.360 -6.072 6.212 1.00 0.00 H new ATOM 0 HG22 VAL A 136 10.028 -6.430 5.705 1.00 0.00 H new ATOM 0 HG23 VAL A 136 8.659 -7.203 4.871 1.00 0.00 H new ATOM 2143 N ASN A 137 9.071 -11.201 7.105 1.00 0.00 N ATOM 2144 CA ASN A 137 8.322 -12.446 7.006 1.00 0.00 C ATOM 2145 C ASN A 137 7.165 -12.422 7.989 1.00 0.00 C ATOM 2146 O ASN A 137 7.376 -12.304 9.198 1.00 0.00 O ATOM 2147 CB ASN A 137 9.223 -13.646 7.322 1.00 0.00 C ATOM 2148 CG ASN A 137 10.526 -13.629 6.546 1.00 0.00 C ATOM 2149 OD1 ASN A 137 11.502 -13.015 6.974 1.00 0.00 O ATOM 2150 ND2 ASN A 137 10.564 -14.311 5.413 1.00 0.00 N ATOM 0 H ASN A 137 9.484 -11.031 8.022 1.00 0.00 H new ATOM 0 HA ASN A 137 7.946 -12.543 5.987 1.00 0.00 H new ATOM 0 HB2 ASN A 137 9.442 -13.657 8.390 1.00 0.00 H new ATOM 0 HB3 ASN A 137 8.685 -14.567 7.097 1.00 0.00 H new ATOM 0 HD21 ASN A 137 11.423 -14.339 4.863 1.00 0.00 H new ATOM 0 HD22 ASN A 137 9.735 -14.808 5.089 1.00 0.00 H new ATOM 2157 N TYR A 138 5.947 -12.518 7.486 1.00 0.00 N ATOM 2158 CA TYR A 138 4.782 -12.536 8.354 1.00 0.00 C ATOM 2159 C TYR A 138 3.965 -13.793 8.095 1.00 0.00 C ATOM 2160 O TYR A 138 3.464 -14.009 6.987 1.00 0.00 O ATOM 2161 CB TYR A 138 3.931 -11.279 8.154 1.00 0.00 C ATOM 2162 CG TYR A 138 2.895 -11.073 9.237 1.00 0.00 C ATOM 2163 CD1 TYR A 138 3.272 -10.655 10.506 1.00 0.00 C ATOM 2164 CD2 TYR A 138 1.547 -11.293 8.993 1.00 0.00 C ATOM 2165 CE1 TYR A 138 2.336 -10.462 11.502 1.00 0.00 C ATOM 2166 CE2 TYR A 138 0.603 -11.102 9.983 1.00 0.00 C ATOM 2167 CZ TYR A 138 1.004 -10.687 11.235 1.00 0.00 C ATOM 2168 OH TYR A 138 0.068 -10.494 12.224 1.00 0.00 O ATOM 0 H TYR A 138 5.739 -12.584 6.490 1.00 0.00 H new ATOM 0 HA TYR A 138 5.118 -12.544 9.391 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.586 -10.408 8.118 1.00 0.00 H new ATOM 0 HB3 TYR A 138 3.429 -11.340 7.189 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.316 -10.478 10.718 1.00 0.00 H new ATOM 0 HD2 TYR A 138 1.231 -11.619 8.013 1.00 0.00 H new ATOM 0 HE1 TYR A 138 2.646 -10.137 12.484 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -0.443 -11.277 9.778 1.00 0.00 H new ATOM 0 HH TYR A 138 -0.825 -10.695 11.873 1.00 0.00 H new ATOM 2178 N GLY A 139 3.854 -14.625 9.120 1.00 0.00 N ATOM 2179 CA GLY A 139 3.188 -15.898 8.985 1.00 0.00 C ATOM 2180 C GLY A 139 3.996 -16.857 8.143 1.00 0.00 C ATOM 2181 O GLY A 139 4.812 -17.627 8.659 1.00 0.00 O ATOM 0 H GLY A 139 4.219 -14.435 10.053 1.00 0.00 H new ATOM 0 HA2 GLY A 139 3.022 -16.330 9.972 1.00 0.00 H new ATOM 0 HA3 GLY A 139 2.208 -15.751 8.532 1.00 0.00 H new ATOM 2185 N ARG A 140 3.786 -16.784 6.845 1.00 0.00 N ATOM 2186 CA ARG A 140 4.461 -17.640 5.898 1.00 0.00 C ATOM 2187 C ARG A 140 4.871 -16.840 4.660 1.00 0.00 C ATOM 2188 O ARG A 140 5.684 -17.287 3.851 1.00 0.00 O ATOM 2189 CB ARG A 140 3.526 -18.792 5.531 1.00 0.00 C ATOM 2190 CG ARG A 140 4.072 -19.735 4.486 1.00 0.00 C ATOM 2191 CD ARG A 140 5.446 -20.266 4.858 1.00 0.00 C ATOM 2192 NE ARG A 140 5.537 -20.683 6.257 1.00 0.00 N ATOM 2193 CZ ARG A 140 6.673 -21.080 6.835 1.00 0.00 C ATOM 2194 NH1 ARG A 140 7.780 -21.200 6.109 1.00 0.00 N ATOM 2195 NH2 ARG A 140 6.701 -21.358 8.130 1.00 0.00 N ATOM 0 H ARG A 140 3.137 -16.124 6.417 1.00 0.00 H new ATOM 0 HA ARG A 140 5.371 -18.046 6.339 1.00 0.00 H new ATOM 0 HB2 ARG A 140 3.300 -19.361 6.433 1.00 0.00 H new ATOM 0 HB3 ARG A 140 2.584 -18.378 5.171 1.00 0.00 H new ATOM 0 HG2 ARG A 140 3.384 -20.570 4.357 1.00 0.00 H new ATOM 0 HG3 ARG A 140 4.130 -19.219 3.528 1.00 0.00 H new ATOM 0 HD2 ARG A 140 5.689 -21.112 4.216 1.00 0.00 H new ATOM 0 HD3 ARG A 140 6.192 -19.495 4.665 1.00 0.00 H new ATOM 0 HE ARG A 140 4.687 -20.670 6.821 1.00 0.00 H new ATOM 0 HH11 ARG A 140 7.761 -20.989 5.111 1.00 0.00 H new ATOM 0 HH12 ARG A 140 8.648 -21.503 6.550 1.00 0.00 H new ATOM 0 HH21 ARG A 140 5.853 -21.269 8.689 1.00 0.00 H new ATOM 0 HH22 ARG A 140 7.571 -21.661 8.568 1.00 0.00 H new ATOM 2209 N THR A 141 4.330 -15.638 4.534 1.00 0.00 N ATOM 2210 CA THR A 141 4.584 -14.816 3.369 1.00 0.00 C ATOM 2211 C THR A 141 5.685 -13.798 3.669 1.00 0.00 C ATOM 2212 O THR A 141 5.770 -13.265 4.777 1.00 0.00 O ATOM 2213 CB THR A 141 3.287 -14.101 2.912 1.00 0.00 C ATOM 2214 OG1 THR A 141 3.418 -13.600 1.572 1.00 0.00 O ATOM 2215 CG2 THR A 141 2.919 -12.951 3.840 1.00 0.00 C ATOM 0 H THR A 141 3.713 -15.213 5.226 1.00 0.00 H new ATOM 0 HA THR A 141 4.920 -15.460 2.557 1.00 0.00 H new ATOM 0 HB THR A 141 2.492 -14.846 2.945 1.00 0.00 H new ATOM 0 HG1 THR A 141 3.754 -14.312 0.988 1.00 0.00 H new ATOM 0 HG21 THR A 141 2.004 -12.476 3.485 1.00 0.00 H new ATOM 0 HG22 THR A 141 2.762 -13.333 4.849 1.00 0.00 H new ATOM 0 HG23 THR A 141 3.727 -12.220 3.851 1.00 0.00 H new ATOM 2223 N TYR A 142 6.551 -13.557 2.698 1.00 0.00 N ATOM 2224 CA TYR A 142 7.599 -12.567 2.865 1.00 0.00 C ATOM 2225 C TYR A 142 7.455 -11.459 1.835 1.00 0.00 C ATOM 2226 O TYR A 142 6.987 -11.686 0.714 1.00 0.00 O ATOM 2227 CB TYR A 142 8.993 -13.207 2.803 1.00 0.00 C ATOM 2228 CG TYR A 142 9.314 -13.942 1.518 1.00 0.00 C ATOM 2229 CD1 TYR A 142 9.017 -15.292 1.374 1.00 0.00 C ATOM 2230 CD2 TYR A 142 9.934 -13.291 0.460 1.00 0.00 C ATOM 2231 CE1 TYR A 142 9.329 -15.971 0.211 1.00 0.00 C ATOM 2232 CE2 TYR A 142 10.245 -13.960 -0.706 1.00 0.00 C ATOM 2233 CZ TYR A 142 9.942 -15.300 -0.825 1.00 0.00 C ATOM 2234 OH TYR A 142 10.255 -15.974 -1.983 1.00 0.00 O ATOM 0 H TYR A 142 6.549 -14.029 1.794 1.00 0.00 H new ATOM 0 HA TYR A 142 7.491 -12.127 3.856 1.00 0.00 H new ATOM 0 HB2 TYR A 142 9.739 -12.427 2.951 1.00 0.00 H new ATOM 0 HB3 TYR A 142 9.091 -13.904 3.635 1.00 0.00 H new ATOM 0 HD1 TYR A 142 8.535 -15.819 2.184 1.00 0.00 H new ATOM 0 HD2 TYR A 142 10.177 -12.243 0.551 1.00 0.00 H new ATOM 0 HE1 TYR A 142 9.094 -17.021 0.115 1.00 0.00 H new ATOM 0 HE2 TYR A 142 10.723 -13.437 -1.521 1.00 0.00 H new ATOM 0 HH TYR A 142 10.861 -15.427 -2.526 1.00 0.00 H new ATOM 2244 N PHE A 143 7.832 -10.260 2.239 1.00 0.00 N ATOM 2245 CA PHE A 143 7.690 -9.072 1.413 1.00 0.00 C ATOM 2246 C PHE A 143 8.708 -8.025 1.838 1.00 0.00 C ATOM 2247 O PHE A 143 9.525 -8.275 2.721 1.00 0.00 O ATOM 2248 CB PHE A 143 6.265 -8.517 1.534 1.00 0.00 C ATOM 2249 CG PHE A 143 5.759 -8.460 2.951 1.00 0.00 C ATOM 2250 CD1 PHE A 143 6.081 -7.397 3.778 1.00 0.00 C ATOM 2251 CD2 PHE A 143 4.964 -9.479 3.455 1.00 0.00 C ATOM 2252 CE1 PHE A 143 5.620 -7.350 5.080 1.00 0.00 C ATOM 2253 CE2 PHE A 143 4.500 -9.436 4.754 1.00 0.00 C ATOM 2254 CZ PHE A 143 4.828 -8.371 5.567 1.00 0.00 C ATOM 0 H PHE A 143 8.247 -10.080 3.153 1.00 0.00 H new ATOM 0 HA PHE A 143 7.872 -9.334 0.371 1.00 0.00 H new ATOM 0 HB2 PHE A 143 6.237 -7.515 1.106 1.00 0.00 H new ATOM 0 HB3 PHE A 143 5.591 -9.136 0.941 1.00 0.00 H new ATOM 0 HD1 PHE A 143 6.699 -6.596 3.401 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.705 -10.316 2.823 1.00 0.00 H new ATOM 0 HE1 PHE A 143 5.879 -6.516 5.716 1.00 0.00 H new ATOM 0 HE2 PHE A 143 3.881 -10.235 5.134 1.00 0.00 H new ATOM 0 HZ PHE A 143 4.466 -8.336 6.584 1.00 0.00 H new ATOM 2264 N TYR A 144 8.661 -6.861 1.217 1.00 0.00 N ATOM 2265 CA TYR A 144 9.583 -5.789 1.550 1.00 0.00 C ATOM 2266 C TYR A 144 8.840 -4.603 2.134 1.00 0.00 C ATOM 2267 O TYR A 144 7.901 -4.097 1.527 1.00 0.00 O ATOM 2268 CB TYR A 144 10.362 -5.349 0.311 1.00 0.00 C ATOM 2269 CG TYR A 144 11.563 -6.212 0.011 1.00 0.00 C ATOM 2270 CD1 TYR A 144 11.446 -7.375 -0.741 1.00 0.00 C ATOM 2271 CD2 TYR A 144 12.818 -5.856 0.479 1.00 0.00 C ATOM 2272 CE1 TYR A 144 12.552 -8.158 -1.015 1.00 0.00 C ATOM 2273 CE2 TYR A 144 13.924 -6.632 0.211 1.00 0.00 C ATOM 2274 CZ TYR A 144 13.787 -7.781 -0.535 1.00 0.00 C ATOM 2275 OH TYR A 144 14.894 -8.552 -0.801 1.00 0.00 O ATOM 0 H TYR A 144 7.995 -6.633 0.479 1.00 0.00 H new ATOM 0 HA TYR A 144 10.283 -6.167 2.295 1.00 0.00 H new ATOM 0 HB2 TYR A 144 9.694 -5.360 -0.550 1.00 0.00 H new ATOM 0 HB3 TYR A 144 10.691 -4.319 0.446 1.00 0.00 H new ATOM 0 HD1 TYR A 144 10.478 -7.671 -1.117 1.00 0.00 H new ATOM 0 HD2 TYR A 144 12.931 -4.955 1.064 1.00 0.00 H new ATOM 0 HE1 TYR A 144 12.448 -9.059 -1.601 1.00 0.00 H new ATOM 0 HE2 TYR A 144 14.895 -6.340 0.584 1.00 0.00 H new ATOM 0 HH TYR A 144 15.684 -8.143 -0.390 1.00 0.00 H new ATOM 2285 N GLU A 145 9.249 -4.167 3.313 1.00 0.00 N ATOM 2286 CA GLU A 145 8.660 -2.983 3.912 1.00 0.00 C ATOM 2287 C GLU A 145 9.708 -1.880 4.015 1.00 0.00 C ATOM 2288 O GLU A 145 10.913 -2.137 3.941 1.00 0.00 O ATOM 2289 CB GLU A 145 8.066 -3.283 5.299 1.00 0.00 C ATOM 2290 CG GLU A 145 9.104 -3.388 6.406 1.00 0.00 C ATOM 2291 CD GLU A 145 8.502 -3.573 7.790 1.00 0.00 C ATOM 2292 OE1 GLU A 145 7.283 -3.344 7.959 1.00 0.00 O ATOM 2293 OE2 GLU A 145 9.258 -3.930 8.723 1.00 0.00 O ATOM 0 H GLU A 145 9.980 -4.610 3.870 1.00 0.00 H new ATOM 0 HA GLU A 145 7.844 -2.651 3.270 1.00 0.00 H new ATOM 0 HB2 GLU A 145 7.354 -2.499 5.556 1.00 0.00 H new ATOM 0 HB3 GLU A 145 7.507 -4.217 5.249 1.00 0.00 H new ATOM 0 HG2 GLU A 145 9.767 -4.226 6.192 1.00 0.00 H new ATOM 0 HG3 GLU A 145 9.718 -2.487 6.403 1.00 0.00 H new ATOM 2300 N TYR A 146 9.239 -0.657 4.147 1.00 0.00 N ATOM 2301 CA TYR A 146 10.101 0.487 4.360 1.00 0.00 C ATOM 2302 C TYR A 146 9.422 1.467 5.297 1.00 0.00 C ATOM 2303 O TYR A 146 8.316 1.936 5.023 1.00 0.00 O ATOM 2304 CB TYR A 146 10.438 1.165 3.030 1.00 0.00 C ATOM 2305 CG TYR A 146 11.128 2.504 3.193 1.00 0.00 C ATOM 2306 CD1 TYR A 146 12.321 2.610 3.896 1.00 0.00 C ATOM 2307 CD2 TYR A 146 10.581 3.662 2.651 1.00 0.00 C ATOM 2308 CE1 TYR A 146 12.950 3.828 4.055 1.00 0.00 C ATOM 2309 CE2 TYR A 146 11.206 4.887 2.804 1.00 0.00 C ATOM 2310 CZ TYR A 146 12.391 4.965 3.509 1.00 0.00 C ATOM 2311 OH TYR A 146 13.024 6.181 3.660 1.00 0.00 O ATOM 0 H TYR A 146 8.246 -0.427 4.109 1.00 0.00 H new ATOM 0 HA TYR A 146 11.033 0.148 4.811 1.00 0.00 H new ATOM 0 HB2 TYR A 146 11.078 0.504 2.446 1.00 0.00 H new ATOM 0 HB3 TYR A 146 9.520 1.305 2.460 1.00 0.00 H new ATOM 0 HD1 TYR A 146 12.764 1.724 4.326 1.00 0.00 H new ATOM 0 HD2 TYR A 146 9.653 3.604 2.102 1.00 0.00 H new ATOM 0 HE1 TYR A 146 13.877 3.891 4.605 1.00 0.00 H new ATOM 0 HE2 TYR A 146 10.770 5.777 2.375 1.00 0.00 H new ATOM 0 HH TYR A 146 12.382 6.905 3.505 1.00 0.00 H new ATOM 2321 N ILE A 147 10.076 1.769 6.405 1.00 0.00 N ATOM 2322 CA ILE A 147 9.509 2.678 7.381 1.00 0.00 C ATOM 2323 C ILE A 147 9.936 4.103 7.063 1.00 0.00 C ATOM 2324 O ILE A 147 11.079 4.493 7.307 1.00 0.00 O ATOM 2325 CB ILE A 147 9.906 2.319 8.840 1.00 0.00 C ATOM 2326 CG1 ILE A 147 9.303 0.972 9.266 1.00 0.00 C ATOM 2327 CG2 ILE A 147 9.454 3.410 9.805 1.00 0.00 C ATOM 2328 CD1 ILE A 147 9.968 -0.239 8.644 1.00 0.00 C ATOM 0 H ILE A 147 10.995 1.400 6.649 1.00 0.00 H new ATOM 0 HA ILE A 147 8.425 2.586 7.315 1.00 0.00 H new ATOM 0 HB ILE A 147 10.993 2.239 8.873 1.00 0.00 H new ATOM 0 HG12 ILE A 147 9.365 0.887 10.351 1.00 0.00 H new ATOM 0 HG13 ILE A 147 8.245 0.963 9.005 1.00 0.00 H new ATOM 0 HG21 ILE A 147 9.742 3.139 10.821 1.00 0.00 H new ATOM 0 HG22 ILE A 147 9.926 4.354 9.534 1.00 0.00 H new ATOM 0 HG23 ILE A 147 8.371 3.517 9.751 1.00 0.00 H new ATOM 0 HD11 ILE A 147 9.479 -1.146 9.000 1.00 0.00 H new ATOM 0 HD12 ILE A 147 9.883 -0.183 7.559 1.00 0.00 H new ATOM 0 HD13 ILE A 147 11.021 -0.260 8.925 1.00 0.00 H new ATOM 2340 N ALA A 148 9.025 4.860 6.473 1.00 0.00 N ATOM 2341 CA ALA A 148 9.284 6.252 6.167 1.00 0.00 C ATOM 2342 C ALA A 148 9.278 7.072 7.445 1.00 0.00 C ATOM 2343 O ALA A 148 8.249 7.193 8.111 1.00 0.00 O ATOM 2344 CB ALA A 148 8.256 6.781 5.190 1.00 0.00 C ATOM 0 H ALA A 148 8.100 4.531 6.197 1.00 0.00 H new ATOM 0 HA ALA A 148 10.267 6.333 5.702 1.00 0.00 H new ATOM 0 HB1 ALA A 148 8.466 7.828 4.972 1.00 0.00 H new ATOM 0 HB2 ALA A 148 8.299 6.202 4.267 1.00 0.00 H new ATOM 0 HB3 ALA A 148 7.261 6.694 5.626 1.00 0.00 H new ATOM 2350 N GLU A 149 10.432 7.615 7.792 1.00 0.00 N ATOM 2351 CA GLU A 149 10.579 8.355 9.029 1.00 0.00 C ATOM 2352 C GLU A 149 9.879 9.708 8.940 1.00 0.00 C ATOM 2353 O GLU A 149 9.773 10.308 7.863 1.00 0.00 O ATOM 2354 CB GLU A 149 12.062 8.530 9.355 1.00 0.00 C ATOM 2355 CG GLU A 149 12.805 9.363 8.330 1.00 0.00 C ATOM 2356 CD GLU A 149 14.298 9.117 8.345 1.00 0.00 C ATOM 2357 OE1 GLU A 149 14.733 8.069 7.820 1.00 0.00 O ATOM 2358 OE2 GLU A 149 15.046 9.969 8.869 1.00 0.00 O ATOM 0 H GLU A 149 11.282 7.556 7.231 1.00 0.00 H new ATOM 0 HA GLU A 149 10.107 7.791 9.833 1.00 0.00 H new ATOM 0 HB2 GLU A 149 12.159 8.999 10.334 1.00 0.00 H new ATOM 0 HB3 GLU A 149 12.530 7.548 9.424 1.00 0.00 H new ATOM 0 HG2 GLU A 149 12.415 9.141 7.337 1.00 0.00 H new ATOM 0 HG3 GLU A 149 12.614 10.419 8.519 1.00 0.00 H new