USER MOD reduce.3.24.130724 H: found=0, std=0, add=772, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 774 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 450 THR OG1 : rot -30:sc= 0.571 USER MOD Set 1.2: A 461 THR OG1 : rot 180:sc= 0.727 USER MOD Set 2.1: A 414 SER OG : rot 98:sc= 0.443 USER MOD Set 2.2: A 469 TYR OH : rot 68:sc= 0.567 USER MOD Single : A 375 THR OG1 : rot -117:sc= -1.79! USER MOD Single : A 379 CYS SG : rot 180:sc= -0.0531 USER MOD Single : A 381 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 382 ASN : amide:sc= -0.265 K(o=-0.26,f=-2.3!) USER MOD Single : A 383 MET CE :methyl -178:sc= -0.854 (180deg=-0.871) USER MOD Single : A 395 TYR OH : rot -13:sc= 1.27 USER MOD Single : A 406 CYS SG : rot 110:sc= -0.51 USER MOD Single : A 407 SER OG : rot 180:sc= -0.0372 USER MOD Single : A 408 LYS NZ :NH3+ -150:sc= -0.0956 (180deg=-0.605) USER MOD Single : A 409 TYR OH : rot 180:sc= -0.0869 USER MOD Single : A 413 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 429 CYS SG : rot 110:sc= -0.638 USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 438 SER OG : rot 180:sc= 0 USER MOD Single : A 442 CYS SG : rot 150:sc= -0.978 USER MOD Single : A 443 GLN : amide:sc= -1.46! K(o=-1.5!,f=-0.065) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 MET CE :methyl 153:sc= -0.131 (180deg=-0.662) USER MOD Single : A 447 GLN : amide:sc= -0.216 K(o=-0.22,f=-1.2) USER MOD Single : A 453 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0211) USER MOD Single : A 456 ASN : amide:sc=-0.00932 X(o=-0.0093,f=-0.2) USER MOD Single : A 462 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 TYR OH : rot -120:sc= -0.266 USER MOD Single : A 464 CYS SG : rot 180:sc= 0 USER MOD Single : A 468 SER OG : rot 34:sc= 1.05 USER MOD Single : A 470 HIS : no HE2:sc= -0.0651 K(o=-0.065,f=-0.65) USER MOD Single : B 23 ASN : amide:sc= -0.158 X(o=-0.16,f=-0.035) USER MOD ----------------------------------------------------------------- ATOM 26 N PRO A 374 0.446 12.737 -8.974 1.00 0.00 N ATOM 27 CA PRO A 374 0.456 12.901 -7.517 1.00 0.00 C ATOM 28 C PRO A 374 -0.879 13.411 -6.988 1.00 0.00 C ATOM 29 O PRO A 374 -1.455 14.352 -7.537 1.00 0.00 O ATOM 30 CB PRO A 374 1.557 13.943 -7.271 1.00 0.00 C ATOM 31 CG PRO A 374 2.314 14.026 -8.546 1.00 0.00 C ATOM 32 CD PRO A 374 1.325 13.717 -9.628 1.00 0.00 C ATOM 0 HA PRO A 374 0.630 11.954 -7.006 1.00 0.00 H new ATOM 0 HB2 PRO A 374 1.130 14.910 -7.004 1.00 0.00 H new ATOM 0 HB3 PRO A 374 2.205 13.642 -6.448 1.00 0.00 H new ATOM 0 HG2 PRO A 374 2.745 15.018 -8.681 1.00 0.00 H new ATOM 0 HG3 PRO A 374 3.141 13.316 -8.557 1.00 0.00 H new ATOM 0 HD2 PRO A 374 0.779 14.605 -9.946 1.00 0.00 H new ATOM 0 HD3 PRO A 374 1.807 13.304 -10.514 1.00 0.00 H new ATOM 40 N THR A 375 -1.367 12.788 -5.922 1.00 0.00 N ATOM 41 CA THR A 375 -2.634 13.186 -5.320 1.00 0.00 C ATOM 42 C THR A 375 -2.426 13.735 -3.913 1.00 0.00 C ATOM 43 O THR A 375 -2.562 14.938 -3.689 1.00 0.00 O ATOM 44 CB THR A 375 -3.638 12.017 -5.273 1.00 0.00 C ATOM 45 OG1 THR A 375 -4.323 12.010 -4.019 1.00 0.00 O ATOM 46 CG2 THR A 375 -2.936 10.685 -5.478 1.00 0.00 C ATOM 0 H THR A 375 -0.905 12.006 -5.457 1.00 0.00 H new ATOM 0 HA THR A 375 -3.048 13.971 -5.952 1.00 0.00 H new ATOM 0 HB THR A 375 -4.357 12.157 -6.081 1.00 0.00 H new ATOM 0 HG1 THR A 375 -4.112 11.184 -3.535 1.00 0.00 H new ATOM 0 HG21 THR A 375 -3.668 9.878 -5.440 1.00 0.00 H new ATOM 0 HG22 THR A 375 -2.441 10.680 -6.449 1.00 0.00 H new ATOM 0 HG23 THR A 375 -2.195 10.540 -4.692 1.00 0.00 H new ATOM 54 N GLU A 376 -2.092 12.855 -2.966 1.00 0.00 N ATOM 55 CA GLU A 376 -1.861 13.276 -1.587 1.00 0.00 C ATOM 56 C GLU A 376 -1.418 12.117 -0.699 1.00 0.00 C ATOM 57 O GLU A 376 -0.468 12.255 0.072 1.00 0.00 O ATOM 58 CB GLU A 376 -3.120 13.920 -1.005 1.00 0.00 C ATOM 59 CG GLU A 376 -2.855 14.758 0.235 1.00 0.00 C ATOM 60 CD GLU A 376 -2.308 16.133 -0.097 1.00 0.00 C ATOM 61 OE1 GLU A 376 -1.113 16.226 -0.449 1.00 0.00 O ATOM 62 OE2 GLU A 376 -3.074 17.115 -0.005 1.00 0.00 O ATOM 0 H GLU A 376 -1.977 11.855 -3.129 1.00 0.00 H new ATOM 0 HA GLU A 376 -1.054 14.008 -1.608 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -3.582 14.548 -1.766 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -3.838 13.138 -0.758 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -3.780 14.866 0.801 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -2.147 14.235 0.878 1.00 0.00 H new ATOM 69 N VAL A 377 -2.097 10.974 -0.801 1.00 0.00 N ATOM 70 CA VAL A 377 -1.744 9.821 0.024 1.00 0.00 C ATOM 71 C VAL A 377 -1.027 8.751 -0.793 1.00 0.00 C ATOM 72 O VAL A 377 -1.249 8.622 -1.997 1.00 0.00 O ATOM 73 CB VAL A 377 -2.981 9.218 0.730 1.00 0.00 C ATOM 74 CG1 VAL A 377 -3.790 10.314 1.406 1.00 0.00 C ATOM 75 CG2 VAL A 377 -3.852 8.438 -0.243 1.00 0.00 C ATOM 0 H VAL A 377 -2.881 10.823 -1.436 1.00 0.00 H new ATOM 0 HA VAL A 377 -1.061 10.182 0.793 1.00 0.00 H new ATOM 0 HB VAL A 377 -2.626 8.521 1.489 1.00 0.00 H new ATOM 0 HG11 VAL A 377 -4.657 9.875 1.899 1.00 0.00 H new ATOM 0 HG12 VAL A 377 -3.170 10.820 2.146 1.00 0.00 H new ATOM 0 HG13 VAL A 377 -4.123 11.034 0.658 1.00 0.00 H new ATOM 0 HG21 VAL A 377 -4.712 8.028 0.287 1.00 0.00 H new ATOM 0 HG22 VAL A 377 -4.197 9.102 -1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 377 -3.272 7.624 -0.678 1.00 0.00 H new ATOM 85 N LEU A 378 -0.162 7.985 -0.130 1.00 0.00 N ATOM 86 CA LEU A 378 0.605 6.937 -0.796 1.00 0.00 C ATOM 87 C LEU A 378 -0.133 5.606 -0.760 1.00 0.00 C ATOM 88 O LEU A 378 -0.923 5.351 0.146 1.00 0.00 O ATOM 89 CB LEU A 378 1.978 6.786 -0.136 1.00 0.00 C ATOM 90 CG LEU A 378 3.170 6.840 -1.093 1.00 0.00 C ATOM 91 CD1 LEU A 378 4.372 7.471 -0.409 1.00 0.00 C ATOM 92 CD2 LEU A 378 3.513 5.445 -1.594 1.00 0.00 C ATOM 0 H LEU A 378 0.024 8.072 0.869 1.00 0.00 H new ATOM 0 HA LEU A 378 0.735 7.229 -1.838 1.00 0.00 H new ATOM 0 HB2 LEU A 378 2.094 7.574 0.608 1.00 0.00 H new ATOM 0 HB3 LEU A 378 2.004 5.836 0.398 1.00 0.00 H new ATOM 0 HG LEU A 378 2.898 7.457 -1.950 1.00 0.00 H new ATOM 0 HD11 LEU A 378 5.211 7.502 -1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 378 4.122 8.485 -0.097 1.00 0.00 H new ATOM 0 HD13 LEU A 378 4.646 6.879 0.465 1.00 0.00 H new ATOM 0 HD21 LEU A 378 4.363 5.501 -2.274 1.00 0.00 H new ATOM 0 HD22 LEU A 378 3.767 4.807 -0.748 1.00 0.00 H new ATOM 0 HD23 LEU A 378 2.655 5.026 -2.120 1.00 0.00 H new ATOM 104 N CYS A 379 0.135 4.761 -1.752 1.00 0.00 N ATOM 105 CA CYS A 379 -0.495 3.449 -1.840 1.00 0.00 C ATOM 106 C CYS A 379 0.544 2.343 -1.699 1.00 0.00 C ATOM 107 O CYS A 379 1.664 2.464 -2.196 1.00 0.00 O ATOM 108 CB CYS A 379 -1.237 3.304 -3.171 1.00 0.00 C ATOM 109 SG CYS A 379 -2.001 1.684 -3.417 1.00 0.00 S ATOM 0 H CYS A 379 0.788 4.964 -2.509 1.00 0.00 H new ATOM 0 HA CYS A 379 -1.212 3.359 -1.024 1.00 0.00 H new ATOM 0 HB2 CYS A 379 -2.009 4.071 -3.230 1.00 0.00 H new ATOM 0 HB3 CYS A 379 -0.539 3.492 -3.986 1.00 0.00 H new ATOM 0 HG CYS A 379 -2.605 1.659 -4.568 1.00 0.00 H new ATOM 115 N LEU A 380 0.167 1.263 -1.021 1.00 0.00 N ATOM 116 CA LEU A 380 1.071 0.137 -0.812 1.00 0.00 C ATOM 117 C LEU A 380 0.380 -1.187 -1.127 1.00 0.00 C ATOM 118 O LEU A 380 -0.406 -1.697 -0.328 1.00 0.00 O ATOM 119 CB LEU A 380 1.581 0.131 0.631 1.00 0.00 C ATOM 120 CG LEU A 380 1.958 1.503 1.192 1.00 0.00 C ATOM 121 CD1 LEU A 380 1.915 1.486 2.712 1.00 0.00 C ATOM 122 CD2 LEU A 380 3.338 1.917 0.700 1.00 0.00 C ATOM 0 H LEU A 380 -0.758 1.144 -0.607 1.00 0.00 H new ATOM 0 HA LEU A 380 1.916 0.251 -1.491 1.00 0.00 H new ATOM 0 HB2 LEU A 380 0.814 -0.307 1.269 1.00 0.00 H new ATOM 0 HB3 LEU A 380 2.453 -0.520 0.689 1.00 0.00 H new ATOM 0 HG LEU A 380 1.232 2.234 0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 380 2.186 2.470 3.095 1.00 0.00 H new ATOM 0 HD12 LEU A 380 0.909 1.232 3.045 1.00 0.00 H new ATOM 0 HD13 LEU A 380 2.620 0.744 3.088 1.00 0.00 H new ATOM 0 HD21 LEU A 380 3.591 2.895 1.108 1.00 0.00 H new ATOM 0 HD22 LEU A 380 4.076 1.185 1.028 1.00 0.00 H new ATOM 0 HD23 LEU A 380 3.336 1.968 -0.389 1.00 0.00 H new ATOM 134 N MET A 381 0.684 -1.739 -2.299 1.00 0.00 N ATOM 135 CA MET A 381 0.095 -3.002 -2.726 1.00 0.00 C ATOM 136 C MET A 381 1.161 -4.079 -2.895 1.00 0.00 C ATOM 137 O MET A 381 2.358 -3.788 -2.899 1.00 0.00 O ATOM 138 CB MET A 381 -0.656 -2.807 -4.042 1.00 0.00 C ATOM 139 CG MET A 381 -2.144 -3.088 -3.938 1.00 0.00 C ATOM 140 SD MET A 381 -3.152 -1.657 -4.371 1.00 0.00 S ATOM 141 CE MET A 381 -2.854 -1.553 -6.134 1.00 0.00 C ATOM 0 H MET A 381 1.335 -1.330 -2.969 1.00 0.00 H new ATOM 0 HA MET A 381 -0.601 -3.329 -1.953 1.00 0.00 H new ATOM 0 HB2 MET A 381 -0.511 -1.783 -4.385 1.00 0.00 H new ATOM 0 HB3 MET A 381 -0.223 -3.461 -4.799 1.00 0.00 H new ATOM 0 HG2 MET A 381 -2.400 -3.920 -4.594 1.00 0.00 H new ATOM 0 HG3 MET A 381 -2.381 -3.400 -2.921 1.00 0.00 H new ATOM 0 HE1 MET A 381 -3.411 -0.713 -6.548 1.00 0.00 H new ATOM 0 HE2 MET A 381 -1.789 -1.407 -6.315 1.00 0.00 H new ATOM 0 HE3 MET A 381 -3.180 -2.476 -6.613 1.00 0.00 H new ATOM 151 N ASN A 382 0.713 -5.324 -3.031 1.00 0.00 N ATOM 152 CA ASN A 382 1.616 -6.457 -3.211 1.00 0.00 C ATOM 153 C ASN A 382 2.624 -6.552 -2.067 1.00 0.00 C ATOM 154 O ASN A 382 3.831 -6.649 -2.297 1.00 0.00 O ATOM 155 CB ASN A 382 2.348 -6.343 -4.550 1.00 0.00 C ATOM 156 CG ASN A 382 2.589 -7.695 -5.194 1.00 0.00 C ATOM 157 OD1 ASN A 382 1.922 -8.679 -4.874 1.00 0.00 O ATOM 158 ND2 ASN A 382 3.549 -7.750 -6.111 1.00 0.00 N ATOM 0 H ASN A 382 -0.276 -5.575 -3.020 1.00 0.00 H new ATOM 0 HA ASN A 382 1.016 -7.367 -3.208 1.00 0.00 H new ATOM 0 HB2 ASN A 382 1.765 -5.719 -5.228 1.00 0.00 H new ATOM 0 HB3 ASN A 382 3.303 -5.841 -4.397 1.00 0.00 H new ATOM 0 HD21 ASN A 382 3.757 -8.632 -6.579 1.00 0.00 H new ATOM 0 HD22 ASN A 382 4.078 -6.910 -6.346 1.00 0.00 H new ATOM 165 N MET A 383 2.123 -6.527 -0.834 1.00 0.00 N ATOM 166 CA MET A 383 2.984 -6.619 0.342 1.00 0.00 C ATOM 167 C MET A 383 2.175 -6.940 1.597 1.00 0.00 C ATOM 168 O MET A 383 2.671 -6.802 2.715 1.00 0.00 O ATOM 169 CB MET A 383 3.764 -5.318 0.541 1.00 0.00 C ATOM 170 CG MET A 383 2.921 -4.065 0.369 1.00 0.00 C ATOM 171 SD MET A 383 3.456 -2.719 1.444 1.00 0.00 S ATOM 172 CE MET A 383 2.908 -3.318 3.041 1.00 0.00 C ATOM 0 H MET A 383 1.128 -6.444 -0.624 1.00 0.00 H new ATOM 0 HA MET A 383 3.689 -7.433 0.172 1.00 0.00 H new ATOM 0 HB2 MET A 383 4.201 -5.316 1.540 1.00 0.00 H new ATOM 0 HB3 MET A 383 4.591 -5.289 -0.169 1.00 0.00 H new ATOM 0 HG2 MET A 383 2.970 -3.738 -0.670 1.00 0.00 H new ATOM 0 HG3 MET A 383 1.878 -4.301 0.580 1.00 0.00 H new ATOM 0 HE1 MET A 383 3.136 -2.576 3.806 1.00 0.00 H new ATOM 0 HE2 MET A 383 1.832 -3.493 3.015 1.00 0.00 H new ATOM 0 HE3 MET A 383 3.421 -4.251 3.276 1.00 0.00 H new ATOM 182 N VAL A 384 0.930 -7.372 1.408 1.00 0.00 N ATOM 183 CA VAL A 384 0.061 -7.713 2.530 1.00 0.00 C ATOM 184 C VAL A 384 -0.971 -8.763 2.133 1.00 0.00 C ATOM 185 O VAL A 384 -1.720 -8.580 1.172 1.00 0.00 O ATOM 186 CB VAL A 384 -0.681 -6.478 3.078 1.00 0.00 C ATOM 187 CG1 VAL A 384 0.175 -5.744 4.098 1.00 0.00 C ATOM 188 CG2 VAL A 384 -1.089 -5.548 1.946 1.00 0.00 C ATOM 0 H VAL A 384 0.502 -7.494 0.490 1.00 0.00 H new ATOM 0 HA VAL A 384 0.711 -8.113 3.308 1.00 0.00 H new ATOM 0 HB VAL A 384 -1.587 -6.820 3.579 1.00 0.00 H new ATOM 0 HG11 VAL A 384 -0.368 -4.876 4.472 1.00 0.00 H new ATOM 0 HG12 VAL A 384 0.406 -6.412 4.928 1.00 0.00 H new ATOM 0 HG13 VAL A 384 1.102 -5.417 3.627 1.00 0.00 H new ATOM 0 HG21 VAL A 384 -1.611 -4.683 2.356 1.00 0.00 H new ATOM 0 HG22 VAL A 384 -0.200 -5.215 1.410 1.00 0.00 H new ATOM 0 HG23 VAL A 384 -1.749 -6.078 1.259 1.00 0.00 H new ATOM 198 N LEU A 385 -1.006 -9.860 2.881 1.00 0.00 N ATOM 199 CA LEU A 385 -1.953 -10.937 2.617 1.00 0.00 C ATOM 200 C LEU A 385 -3.001 -11.008 3.727 1.00 0.00 C ATOM 201 O LEU A 385 -2.726 -10.634 4.866 1.00 0.00 O ATOM 202 CB LEU A 385 -1.218 -12.275 2.501 1.00 0.00 C ATOM 203 CG LEU A 385 -0.613 -12.569 1.126 1.00 0.00 C ATOM 204 CD1 LEU A 385 0.319 -13.769 1.199 1.00 0.00 C ATOM 205 CD2 LEU A 385 -1.710 -12.809 0.099 1.00 0.00 C ATOM 0 H LEU A 385 -0.389 -10.027 3.676 1.00 0.00 H new ATOM 0 HA LEU A 385 -2.457 -10.731 1.673 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -0.421 -12.299 3.244 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -1.913 -13.076 2.753 1.00 0.00 H new ATOM 0 HG LEU A 385 -0.033 -11.700 0.814 1.00 0.00 H new ATOM 0 HD11 LEU A 385 0.740 -13.963 0.212 1.00 0.00 H new ATOM 0 HD12 LEU A 385 1.125 -13.561 1.903 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -0.239 -14.643 1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -1.260 -13.016 -0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.317 -13.660 0.407 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -2.340 -11.922 0.025 1.00 0.00 H new ATOM 217 N PRO A 386 -4.220 -11.488 3.414 1.00 0.00 N ATOM 218 CA PRO A 386 -5.299 -11.593 4.403 1.00 0.00 C ATOM 219 C PRO A 386 -4.957 -12.559 5.532 1.00 0.00 C ATOM 220 O PRO A 386 -5.508 -12.466 6.630 1.00 0.00 O ATOM 221 CB PRO A 386 -6.490 -12.113 3.593 1.00 0.00 C ATOM 222 CG PRO A 386 -5.892 -12.746 2.385 1.00 0.00 C ATOM 223 CD PRO A 386 -4.643 -11.967 2.085 1.00 0.00 C ATOM 0 HA PRO A 386 -5.492 -10.638 4.893 1.00 0.00 H new ATOM 0 HB2 PRO A 386 -7.073 -12.833 4.167 1.00 0.00 H new ATOM 0 HB3 PRO A 386 -7.165 -11.302 3.320 1.00 0.00 H new ATOM 0 HG2 PRO A 386 -5.663 -13.796 2.568 1.00 0.00 H new ATOM 0 HG3 PRO A 386 -6.584 -12.713 1.544 1.00 0.00 H new ATOM 0 HD2 PRO A 386 -3.880 -12.592 1.620 1.00 0.00 H new ATOM 0 HD3 PRO A 386 -4.838 -11.140 1.402 1.00 0.00 H new ATOM 231 N GLU A 387 -4.046 -13.487 5.256 1.00 0.00 N ATOM 232 CA GLU A 387 -3.626 -14.465 6.253 1.00 0.00 C ATOM 233 C GLU A 387 -2.631 -13.843 7.225 1.00 0.00 C ATOM 234 O GLU A 387 -2.227 -14.470 8.205 1.00 0.00 O ATOM 235 CB GLU A 387 -3.002 -15.685 5.573 1.00 0.00 C ATOM 236 CG GLU A 387 -3.855 -16.939 5.666 1.00 0.00 C ATOM 237 CD GLU A 387 -4.797 -17.093 4.488 1.00 0.00 C ATOM 238 OE1 GLU A 387 -4.369 -17.647 3.454 1.00 0.00 O ATOM 239 OE2 GLU A 387 -5.963 -16.658 4.599 1.00 0.00 O ATOM 0 H GLU A 387 -3.585 -13.582 4.351 1.00 0.00 H new ATOM 0 HA GLU A 387 -4.506 -14.785 6.811 1.00 0.00 H new ATOM 0 HB2 GLU A 387 -2.825 -15.454 4.523 1.00 0.00 H new ATOM 0 HB3 GLU A 387 -2.030 -15.883 6.024 1.00 0.00 H new ATOM 0 HG2 GLU A 387 -3.205 -17.812 5.723 1.00 0.00 H new ATOM 0 HG3 GLU A 387 -4.435 -16.912 6.589 1.00 0.00 H new ATOM 246 N GLU A 388 -2.239 -12.603 6.945 1.00 0.00 N ATOM 247 CA GLU A 388 -1.291 -11.886 7.789 1.00 0.00 C ATOM 248 C GLU A 388 -1.981 -10.747 8.533 1.00 0.00 C ATOM 249 O GLU A 388 -1.659 -10.464 9.688 1.00 0.00 O ATOM 250 CB GLU A 388 -0.136 -11.341 6.949 1.00 0.00 C ATOM 251 CG GLU A 388 0.644 -12.419 6.216 1.00 0.00 C ATOM 252 CD GLU A 388 2.037 -11.967 5.824 1.00 0.00 C ATOM 253 OE1 GLU A 388 2.956 -12.078 6.663 1.00 0.00 O ATOM 254 OE2 GLU A 388 2.208 -11.500 4.678 1.00 0.00 O ATOM 0 H GLU A 388 -2.565 -12.073 6.137 1.00 0.00 H new ATOM 0 HA GLU A 388 -0.893 -12.587 8.523 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -0.530 -10.631 6.222 1.00 0.00 H new ATOM 0 HB3 GLU A 388 0.545 -10.789 7.597 1.00 0.00 H new ATOM 0 HG2 GLU A 388 0.718 -13.303 6.849 1.00 0.00 H new ATOM 0 HG3 GLU A 388 0.096 -12.713 5.321 1.00 0.00 H new ATOM 261 N LEU A 389 -2.929 -10.094 7.868 1.00 0.00 N ATOM 262 CA LEU A 389 -3.664 -8.989 8.476 1.00 0.00 C ATOM 263 C LEU A 389 -4.810 -9.513 9.335 1.00 0.00 C ATOM 264 O LEU A 389 -5.874 -8.898 9.415 1.00 0.00 O ATOM 265 CB LEU A 389 -4.207 -8.039 7.402 1.00 0.00 C ATOM 266 CG LEU A 389 -3.271 -7.772 6.218 1.00 0.00 C ATOM 267 CD1 LEU A 389 -3.805 -6.630 5.368 1.00 0.00 C ATOM 268 CD2 LEU A 389 -1.862 -7.457 6.698 1.00 0.00 C ATOM 0 H LEU A 389 -3.206 -10.310 6.910 1.00 0.00 H new ATOM 0 HA LEU A 389 -2.972 -8.437 9.112 1.00 0.00 H new ATOM 0 HB2 LEU A 389 -5.141 -8.450 7.018 1.00 0.00 H new ATOM 0 HB3 LEU A 389 -4.448 -7.086 7.874 1.00 0.00 H new ATOM 0 HG LEU A 389 -3.230 -8.675 5.609 1.00 0.00 H new ATOM 0 HD11 LEU A 389 -3.129 -6.452 4.531 1.00 0.00 H new ATOM 0 HD12 LEU A 389 -4.793 -6.890 4.988 1.00 0.00 H new ATOM 0 HD13 LEU A 389 -3.876 -5.727 5.975 1.00 0.00 H new ATOM 0 HD21 LEU A 389 -1.218 -7.272 5.839 1.00 0.00 H new ATOM 0 HD22 LEU A 389 -1.883 -6.571 7.333 1.00 0.00 H new ATOM 0 HD23 LEU A 389 -1.474 -8.302 7.267 1.00 0.00 H new ATOM 280 N LEU A 390 -4.581 -10.654 9.975 1.00 0.00 N ATOM 281 CA LEU A 390 -5.587 -11.272 10.830 1.00 0.00 C ATOM 282 C LEU A 390 -5.017 -11.549 12.216 1.00 0.00 C ATOM 283 O LEU A 390 -5.760 -11.795 13.167 1.00 0.00 O ATOM 284 CB LEU A 390 -6.087 -12.571 10.197 1.00 0.00 C ATOM 285 CG LEU A 390 -7.529 -12.536 9.702 1.00 0.00 C ATOM 286 CD1 LEU A 390 -7.753 -13.600 8.639 1.00 0.00 C ATOM 287 CD2 LEU A 390 -8.495 -12.723 10.861 1.00 0.00 C ATOM 0 H LEU A 390 -3.704 -11.171 9.917 1.00 0.00 H new ATOM 0 HA LEU A 390 -6.424 -10.582 10.933 1.00 0.00 H new ATOM 0 HB2 LEU A 390 -5.437 -12.822 9.359 1.00 0.00 H new ATOM 0 HB3 LEU A 390 -5.989 -13.374 10.927 1.00 0.00 H new ATOM 0 HG LEU A 390 -7.717 -11.560 9.254 1.00 0.00 H new ATOM 0 HD11 LEU A 390 -8.787 -13.561 8.297 1.00 0.00 H new ATOM 0 HD12 LEU A 390 -7.085 -13.419 7.797 1.00 0.00 H new ATOM 0 HD13 LEU A 390 -7.547 -14.584 9.060 1.00 0.00 H new ATOM 0 HD21 LEU A 390 -9.519 -12.695 10.489 1.00 0.00 H new ATOM 0 HD22 LEU A 390 -8.308 -13.685 11.339 1.00 0.00 H new ATOM 0 HD23 LEU A 390 -8.351 -11.923 11.587 1.00 0.00 H new ATOM 299 N ASP A 391 -3.693 -11.507 12.321 1.00 0.00 N ATOM 300 CA ASP A 391 -3.014 -11.747 13.590 1.00 0.00 C ATOM 301 C ASP A 391 -2.649 -10.426 14.260 1.00 0.00 C ATOM 302 O ASP A 391 -2.382 -9.433 13.585 1.00 0.00 O ATOM 303 CB ASP A 391 -1.756 -12.589 13.367 1.00 0.00 C ATOM 304 CG ASP A 391 -2.065 -14.067 13.226 1.00 0.00 C ATOM 305 OD1 ASP A 391 -2.887 -14.580 14.015 1.00 0.00 O ATOM 306 OD2 ASP A 391 -1.486 -14.711 12.327 1.00 0.00 O ATOM 0 H ASP A 391 -3.067 -11.308 11.541 1.00 0.00 H new ATOM 0 HA ASP A 391 -3.692 -12.293 14.246 1.00 0.00 H new ATOM 0 HB2 ASP A 391 -1.244 -12.241 12.470 1.00 0.00 H new ATOM 0 HB3 ASP A 391 -1.071 -12.442 14.202 1.00 0.00 H new ATOM 311 N ASP A 392 -2.637 -10.422 15.590 1.00 0.00 N ATOM 312 CA ASP A 392 -2.309 -9.217 16.346 1.00 0.00 C ATOM 313 C ASP A 392 -0.815 -8.911 16.276 1.00 0.00 C ATOM 314 O ASP A 392 -0.408 -7.750 16.331 1.00 0.00 O ATOM 315 CB ASP A 392 -2.741 -9.371 17.805 1.00 0.00 C ATOM 316 CG ASP A 392 -4.168 -9.867 17.937 1.00 0.00 C ATOM 317 OD1 ASP A 392 -5.065 -9.270 17.304 1.00 0.00 O ATOM 318 OD2 ASP A 392 -4.388 -10.851 18.674 1.00 0.00 O ATOM 0 H ASP A 392 -2.850 -11.237 16.165 1.00 0.00 H new ATOM 0 HA ASP A 392 -2.850 -8.384 15.898 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -2.070 -10.067 18.308 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -2.645 -8.411 18.313 1.00 0.00 H new ATOM 323 N GLU A 393 -0.005 -9.958 16.150 1.00 0.00 N ATOM 324 CA GLU A 393 1.441 -9.800 16.077 1.00 0.00 C ATOM 325 C GLU A 393 1.858 -9.283 14.706 1.00 0.00 C ATOM 326 O GLU A 393 2.644 -8.341 14.595 1.00 0.00 O ATOM 327 CB GLU A 393 2.136 -11.131 16.367 1.00 0.00 C ATOM 328 CG GLU A 393 1.981 -11.599 17.804 1.00 0.00 C ATOM 329 CD GLU A 393 2.936 -10.897 18.750 1.00 0.00 C ATOM 330 OE1 GLU A 393 4.163 -11.061 18.583 1.00 0.00 O ATOM 331 OE2 GLU A 393 2.457 -10.184 19.657 1.00 0.00 O ATOM 0 H GLU A 393 -0.327 -10.924 16.096 1.00 0.00 H new ATOM 0 HA GLU A 393 1.743 -9.071 16.829 1.00 0.00 H new ATOM 0 HB2 GLU A 393 1.734 -11.894 15.700 1.00 0.00 H new ATOM 0 HB3 GLU A 393 3.197 -11.034 16.138 1.00 0.00 H new ATOM 0 HG2 GLU A 393 0.956 -11.424 18.131 1.00 0.00 H new ATOM 0 HG3 GLU A 393 2.151 -12.674 17.853 1.00 0.00 H new ATOM 338 N GLU A 394 1.321 -9.906 13.663 1.00 0.00 N ATOM 339 CA GLU A 394 1.632 -9.513 12.295 1.00 0.00 C ATOM 340 C GLU A 394 1.132 -8.101 12.010 1.00 0.00 C ATOM 341 O GLU A 394 1.841 -7.291 11.410 1.00 0.00 O ATOM 342 CB GLU A 394 1.010 -10.499 11.305 1.00 0.00 C ATOM 343 CG GLU A 394 1.818 -10.671 10.028 1.00 0.00 C ATOM 344 CD GLU A 394 3.205 -11.226 10.285 1.00 0.00 C ATOM 345 OE1 GLU A 394 3.319 -12.442 10.549 1.00 0.00 O ATOM 346 OE2 GLU A 394 4.178 -10.444 10.223 1.00 0.00 O ATOM 0 H GLU A 394 0.668 -10.686 13.740 1.00 0.00 H new ATOM 0 HA GLU A 394 2.715 -9.526 12.175 1.00 0.00 H new ATOM 0 HB2 GLU A 394 0.902 -11.469 11.790 1.00 0.00 H new ATOM 0 HB3 GLU A 394 0.007 -10.158 11.047 1.00 0.00 H new ATOM 0 HG2 GLU A 394 1.284 -11.338 9.352 1.00 0.00 H new ATOM 0 HG3 GLU A 394 1.904 -9.708 9.524 1.00 0.00 H new ATOM 353 N TYR A 395 -0.093 -7.812 12.443 1.00 0.00 N ATOM 354 CA TYR A 395 -0.690 -6.498 12.241 1.00 0.00 C ATOM 355 C TYR A 395 0.187 -5.397 12.827 1.00 0.00 C ATOM 356 O TYR A 395 0.626 -4.496 12.112 1.00 0.00 O ATOM 357 CB TYR A 395 -2.076 -6.449 12.881 1.00 0.00 C ATOM 358 CG TYR A 395 -2.938 -5.331 12.355 1.00 0.00 C ATOM 359 CD1 TYR A 395 -3.430 -5.364 11.058 1.00 0.00 C ATOM 360 CD2 TYR A 395 -3.259 -4.241 13.151 1.00 0.00 C ATOM 361 CE1 TYR A 395 -4.216 -4.343 10.568 1.00 0.00 C ATOM 362 CE2 TYR A 395 -4.047 -3.215 12.670 1.00 0.00 C ATOM 363 CZ TYR A 395 -4.524 -3.269 11.377 1.00 0.00 C ATOM 364 OH TYR A 395 -5.307 -2.246 10.895 1.00 0.00 O ATOM 0 H TYR A 395 -0.692 -8.474 12.937 1.00 0.00 H new ATOM 0 HA TYR A 395 -0.778 -6.330 11.168 1.00 0.00 H new ATOM 0 HB2 TYR A 395 -2.581 -7.399 12.709 1.00 0.00 H new ATOM 0 HB3 TYR A 395 -1.966 -6.337 13.960 1.00 0.00 H new ATOM 0 HD1 TYR A 395 -3.193 -6.204 10.422 1.00 0.00 H new ATOM 0 HD2 TYR A 395 -2.886 -4.195 14.164 1.00 0.00 H new ATOM 0 HE1 TYR A 395 -4.589 -4.384 9.555 1.00 0.00 H new ATOM 0 HE2 TYR A 395 -4.289 -2.374 13.303 1.00 0.00 H new ATOM 0 HH TYR A 395 -5.386 -2.326 9.921 1.00 0.00 H new ATOM 374 N GLU A 396 0.437 -5.476 14.132 1.00 0.00 N ATOM 375 CA GLU A 396 1.256 -4.480 14.815 1.00 0.00 C ATOM 376 C GLU A 396 2.640 -4.374 14.180 1.00 0.00 C ATOM 377 O GLU A 396 3.279 -3.324 14.236 1.00 0.00 O ATOM 378 CB GLU A 396 1.389 -4.829 16.298 1.00 0.00 C ATOM 379 CG GLU A 396 0.536 -3.959 17.206 1.00 0.00 C ATOM 380 CD GLU A 396 1.282 -2.738 17.711 1.00 0.00 C ATOM 381 OE1 GLU A 396 1.791 -1.965 16.872 1.00 0.00 O ATOM 382 OE2 GLU A 396 1.354 -2.554 18.944 1.00 0.00 O ATOM 0 H GLU A 396 0.084 -6.218 14.736 1.00 0.00 H new ATOM 0 HA GLU A 396 0.760 -3.514 14.717 1.00 0.00 H new ATOM 0 HB2 GLU A 396 1.112 -5.873 16.443 1.00 0.00 H new ATOM 0 HB3 GLU A 396 2.434 -4.733 16.593 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -0.354 -3.639 16.665 1.00 0.00 H new ATOM 0 HG3 GLU A 396 0.197 -4.551 18.056 1.00 0.00 H new ATOM 389 N GLU A 397 3.095 -5.465 13.572 1.00 0.00 N ATOM 390 CA GLU A 397 4.405 -5.494 12.931 1.00 0.00 C ATOM 391 C GLU A 397 4.414 -4.675 11.642 1.00 0.00 C ATOM 392 O GLU A 397 5.374 -3.958 11.360 1.00 0.00 O ATOM 393 CB GLU A 397 4.816 -6.934 12.630 1.00 0.00 C ATOM 394 CG GLU A 397 6.317 -7.119 12.498 1.00 0.00 C ATOM 395 CD GLU A 397 6.947 -7.695 13.751 1.00 0.00 C ATOM 396 OE1 GLU A 397 6.583 -8.827 14.132 1.00 0.00 O ATOM 397 OE2 GLU A 397 7.806 -7.014 14.350 1.00 0.00 O ATOM 0 H GLU A 397 2.576 -6.341 13.510 1.00 0.00 H new ATOM 0 HA GLU A 397 5.121 -5.050 13.622 1.00 0.00 H new ATOM 0 HB2 GLU A 397 4.446 -7.583 13.424 1.00 0.00 H new ATOM 0 HB3 GLU A 397 4.335 -7.255 11.706 1.00 0.00 H new ATOM 0 HG2 GLU A 397 6.525 -7.778 11.655 1.00 0.00 H new ATOM 0 HG3 GLU A 397 6.779 -6.158 12.272 1.00 0.00 H new ATOM 404 N ILE A 398 3.341 -4.784 10.864 1.00 0.00 N ATOM 405 CA ILE A 398 3.236 -4.056 9.603 1.00 0.00 C ATOM 406 C ILE A 398 2.946 -2.576 9.832 1.00 0.00 C ATOM 407 O ILE A 398 3.657 -1.714 9.323 1.00 0.00 O ATOM 408 CB ILE A 398 2.135 -4.655 8.702 1.00 0.00 C ATOM 409 CG1 ILE A 398 2.516 -6.076 8.280 1.00 0.00 C ATOM 410 CG2 ILE A 398 1.900 -3.774 7.481 1.00 0.00 C ATOM 411 CD1 ILE A 398 1.483 -6.746 7.399 1.00 0.00 C ATOM 0 H ILE A 398 2.534 -5.368 11.084 1.00 0.00 H new ATOM 0 HA ILE A 398 4.200 -4.153 9.104 1.00 0.00 H new ATOM 0 HB ILE A 398 1.205 -4.698 9.270 1.00 0.00 H new ATOM 0 HG12 ILE A 398 3.468 -6.045 7.750 1.00 0.00 H new ATOM 0 HG13 ILE A 398 2.668 -6.683 9.173 1.00 0.00 H new ATOM 0 HG21 ILE A 398 1.120 -4.214 6.859 1.00 0.00 H new ATOM 0 HG22 ILE A 398 1.589 -2.780 7.804 1.00 0.00 H new ATOM 0 HG23 ILE A 398 2.822 -3.696 6.905 1.00 0.00 H new ATOM 0 HD11 ILE A 398 1.821 -7.749 7.140 1.00 0.00 H new ATOM 0 HD12 ILE A 398 0.535 -6.809 7.933 1.00 0.00 H new ATOM 0 HD13 ILE A 398 1.348 -6.162 6.488 1.00 0.00 H new ATOM 423 N VAL A 399 1.896 -2.290 10.592 1.00 0.00 N ATOM 424 CA VAL A 399 1.513 -0.911 10.881 1.00 0.00 C ATOM 425 C VAL A 399 2.681 -0.106 11.449 1.00 0.00 C ATOM 426 O VAL A 399 2.943 1.013 11.010 1.00 0.00 O ATOM 427 CB VAL A 399 0.335 -0.854 11.873 1.00 0.00 C ATOM 428 CG1 VAL A 399 -0.068 0.588 12.145 1.00 0.00 C ATOM 429 CG2 VAL A 399 -0.846 -1.652 11.343 1.00 0.00 C ATOM 0 H VAL A 399 1.294 -2.993 11.020 1.00 0.00 H new ATOM 0 HA VAL A 399 1.209 -0.469 9.932 1.00 0.00 H new ATOM 0 HB VAL A 399 0.656 -1.300 12.814 1.00 0.00 H new ATOM 0 HG11 VAL A 399 -0.901 0.607 12.848 1.00 0.00 H new ATOM 0 HG12 VAL A 399 0.778 1.128 12.571 1.00 0.00 H new ATOM 0 HG13 VAL A 399 -0.370 1.064 11.212 1.00 0.00 H new ATOM 0 HG21 VAL A 399 -1.669 -1.601 12.056 1.00 0.00 H new ATOM 0 HG22 VAL A 399 -1.167 -1.236 10.388 1.00 0.00 H new ATOM 0 HG23 VAL A 399 -0.550 -2.692 11.205 1.00 0.00 H new ATOM 439 N GLU A 400 3.380 -0.680 12.424 1.00 0.00 N ATOM 440 CA GLU A 400 4.511 -0.004 13.055 1.00 0.00 C ATOM 441 C GLU A 400 5.649 0.229 12.063 1.00 0.00 C ATOM 442 O GLU A 400 6.045 1.369 11.819 1.00 0.00 O ATOM 443 CB GLU A 400 5.020 -0.820 14.245 1.00 0.00 C ATOM 444 CG GLU A 400 5.804 0.003 15.255 1.00 0.00 C ATOM 445 CD GLU A 400 5.616 -0.483 16.680 1.00 0.00 C ATOM 446 OE1 GLU A 400 4.787 -1.393 16.894 1.00 0.00 O ATOM 447 OE2 GLU A 400 6.297 0.047 17.582 1.00 0.00 O ATOM 0 H GLU A 400 3.184 -1.610 12.794 1.00 0.00 H new ATOM 0 HA GLU A 400 4.161 0.967 13.405 1.00 0.00 H new ATOM 0 HB2 GLU A 400 4.171 -1.284 14.747 1.00 0.00 H new ATOM 0 HB3 GLU A 400 5.653 -1.628 13.877 1.00 0.00 H new ATOM 0 HG2 GLU A 400 6.863 -0.031 15.001 1.00 0.00 H new ATOM 0 HG3 GLU A 400 5.493 1.046 15.187 1.00 0.00 H new ATOM 454 N ASP A 401 6.173 -0.856 11.502 1.00 0.00 N ATOM 455 CA ASP A 401 7.273 -0.774 10.543 1.00 0.00 C ATOM 456 C ASP A 401 6.940 0.178 9.394 1.00 0.00 C ATOM 457 O ASP A 401 7.667 1.137 9.142 1.00 0.00 O ATOM 458 CB ASP A 401 7.598 -2.163 9.993 1.00 0.00 C ATOM 459 CG ASP A 401 8.855 -2.172 9.147 1.00 0.00 C ATOM 460 OD1 ASP A 401 8.775 -1.792 7.960 1.00 0.00 O ATOM 461 OD2 ASP A 401 9.920 -2.561 9.672 1.00 0.00 O ATOM 0 H ASP A 401 5.854 -1.805 11.695 1.00 0.00 H new ATOM 0 HA ASP A 401 8.144 -0.381 11.066 1.00 0.00 H new ATOM 0 HB2 ASP A 401 7.717 -2.860 10.822 1.00 0.00 H new ATOM 0 HB3 ASP A 401 6.759 -2.519 9.395 1.00 0.00 H new ATOM 466 N VAL A 402 5.840 -0.103 8.702 1.00 0.00 N ATOM 467 CA VAL A 402 5.402 0.720 7.577 1.00 0.00 C ATOM 468 C VAL A 402 5.319 2.196 7.965 1.00 0.00 C ATOM 469 O VAL A 402 5.570 3.077 7.142 1.00 0.00 O ATOM 470 CB VAL A 402 4.030 0.244 7.044 1.00 0.00 C ATOM 471 CG1 VAL A 402 3.382 1.302 6.161 1.00 0.00 C ATOM 472 CG2 VAL A 402 4.183 -1.064 6.283 1.00 0.00 C ATOM 0 H VAL A 402 5.233 -0.898 8.901 1.00 0.00 H new ATOM 0 HA VAL A 402 6.147 0.610 6.789 1.00 0.00 H new ATOM 0 HB VAL A 402 3.376 0.078 7.900 1.00 0.00 H new ATOM 0 HG11 VAL A 402 2.420 0.937 5.802 1.00 0.00 H new ATOM 0 HG12 VAL A 402 3.232 2.215 6.737 1.00 0.00 H new ATOM 0 HG13 VAL A 402 4.030 1.513 5.310 1.00 0.00 H new ATOM 0 HG21 VAL A 402 3.209 -1.386 5.914 1.00 0.00 H new ATOM 0 HG22 VAL A 402 4.860 -0.918 5.441 1.00 0.00 H new ATOM 0 HG23 VAL A 402 4.590 -1.826 6.948 1.00 0.00 H new ATOM 482 N ARG A 403 4.974 2.462 9.222 1.00 0.00 N ATOM 483 CA ARG A 403 4.862 3.835 9.709 1.00 0.00 C ATOM 484 C ARG A 403 6.235 4.486 9.839 1.00 0.00 C ATOM 485 O ARG A 403 6.496 5.530 9.241 1.00 0.00 O ATOM 486 CB ARG A 403 4.144 3.866 11.059 1.00 0.00 C ATOM 487 CG ARG A 403 3.764 5.266 11.512 1.00 0.00 C ATOM 488 CD ARG A 403 2.982 5.236 12.815 1.00 0.00 C ATOM 489 NE ARG A 403 1.709 5.942 12.706 1.00 0.00 N ATOM 490 CZ ARG A 403 1.322 6.902 13.541 1.00 0.00 C ATOM 491 NH1 ARG A 403 2.107 7.270 14.544 1.00 0.00 N ATOM 492 NH2 ARG A 403 0.148 7.495 13.371 1.00 0.00 N ATOM 0 H ARG A 403 4.768 1.748 9.920 1.00 0.00 H new ATOM 0 HA ARG A 403 4.280 4.400 8.981 1.00 0.00 H new ATOM 0 HB2 ARG A 403 3.243 3.256 10.996 1.00 0.00 H new ATOM 0 HB3 ARG A 403 4.786 3.410 11.813 1.00 0.00 H new ATOM 0 HG2 ARG A 403 4.665 5.865 11.641 1.00 0.00 H new ATOM 0 HG3 ARG A 403 3.167 5.750 10.739 1.00 0.00 H new ATOM 0 HD2 ARG A 403 2.799 4.201 13.104 1.00 0.00 H new ATOM 0 HD3 ARG A 403 3.580 5.687 13.607 1.00 0.00 H new ATOM 0 HE ARG A 403 1.080 5.684 11.946 1.00 0.00 H new ATOM 0 HH11 ARG A 403 3.011 6.816 14.677 1.00 0.00 H new ATOM 0 HH12 ARG A 403 1.807 8.007 15.183 1.00 0.00 H new ATOM 0 HH21 ARG A 403 -0.458 7.215 12.600 1.00 0.00 H new ATOM 0 HH22 ARG A 403 -0.149 8.231 14.011 1.00 0.00 H new ATOM 506 N ASP A 404 7.106 3.864 10.628 1.00 0.00 N ATOM 507 CA ASP A 404 8.454 4.382 10.843 1.00 0.00 C ATOM 508 C ASP A 404 9.190 4.565 9.519 1.00 0.00 C ATOM 509 O ASP A 404 9.997 5.483 9.370 1.00 0.00 O ATOM 510 CB ASP A 404 9.246 3.438 11.749 1.00 0.00 C ATOM 511 CG ASP A 404 10.643 3.953 12.039 1.00 0.00 C ATOM 512 OD1 ASP A 404 10.809 4.700 13.026 1.00 0.00 O ATOM 513 OD2 ASP A 404 11.571 3.611 11.276 1.00 0.00 O ATOM 0 H ASP A 404 6.902 3.000 11.130 1.00 0.00 H new ATOM 0 HA ASP A 404 8.366 5.355 11.326 1.00 0.00 H new ATOM 0 HB2 ASP A 404 8.709 3.304 12.688 1.00 0.00 H new ATOM 0 HB3 ASP A 404 9.314 2.458 11.278 1.00 0.00 H new ATOM 518 N GLU A 405 8.907 3.687 8.563 1.00 0.00 N ATOM 519 CA GLU A 405 9.547 3.751 7.253 1.00 0.00 C ATOM 520 C GLU A 405 8.996 4.912 6.432 1.00 0.00 C ATOM 521 O GLU A 405 9.754 5.680 5.839 1.00 0.00 O ATOM 522 CB GLU A 405 9.339 2.435 6.499 1.00 0.00 C ATOM 523 CG GLU A 405 10.189 1.290 7.023 1.00 0.00 C ATOM 524 CD GLU A 405 11.674 1.592 6.970 1.00 0.00 C ATOM 525 OE1 GLU A 405 12.285 1.385 5.901 1.00 0.00 O ATOM 526 OE2 GLU A 405 12.225 2.036 7.999 1.00 0.00 O ATOM 0 H GLU A 405 8.239 2.923 8.670 1.00 0.00 H new ATOM 0 HA GLU A 405 10.614 3.913 7.405 1.00 0.00 H new ATOM 0 HB2 GLU A 405 8.288 2.153 6.561 1.00 0.00 H new ATOM 0 HB3 GLU A 405 9.566 2.591 5.444 1.00 0.00 H new ATOM 0 HG2 GLU A 405 9.903 1.072 8.052 1.00 0.00 H new ATOM 0 HG3 GLU A 405 9.984 0.393 6.438 1.00 0.00 H new ATOM 533 N CYS A 406 7.673 5.034 6.405 1.00 0.00 N ATOM 534 CA CYS A 406 7.016 6.101 5.658 1.00 0.00 C ATOM 535 C CYS A 406 7.376 7.471 6.224 1.00 0.00 C ATOM 536 O CYS A 406 7.310 8.480 5.523 1.00 0.00 O ATOM 537 CB CYS A 406 5.500 5.907 5.687 1.00 0.00 C ATOM 538 SG CYS A 406 4.864 4.858 4.359 1.00 0.00 S ATOM 0 H CYS A 406 7.034 4.406 6.892 1.00 0.00 H new ATOM 0 HA CYS A 406 7.365 6.055 4.626 1.00 0.00 H new ATOM 0 HB2 CYS A 406 5.219 5.471 6.646 1.00 0.00 H new ATOM 0 HB3 CYS A 406 5.018 6.883 5.627 1.00 0.00 H new ATOM 0 HG CYS A 406 4.456 3.728 4.856 1.00 0.00 H new ATOM 544 N SER A 407 7.759 7.499 7.498 1.00 0.00 N ATOM 545 CA SER A 407 8.127 8.747 8.158 1.00 0.00 C ATOM 546 C SER A 407 9.620 9.027 8.002 1.00 0.00 C ATOM 547 O SER A 407 10.238 9.652 8.865 1.00 0.00 O ATOM 548 CB SER A 407 7.757 8.689 9.641 1.00 0.00 C ATOM 549 OG SER A 407 6.818 9.698 9.972 1.00 0.00 O ATOM 0 H SER A 407 7.822 6.673 8.093 1.00 0.00 H new ATOM 0 HA SER A 407 7.574 9.558 7.684 1.00 0.00 H new ATOM 0 HB2 SER A 407 7.341 7.709 9.877 1.00 0.00 H new ATOM 0 HB3 SER A 407 8.654 8.810 10.248 1.00 0.00 H new ATOM 0 HG SER A 407 6.596 9.639 10.925 1.00 0.00 H new ATOM 555 N LYS A 408 10.191 8.566 6.894 1.00 0.00 N ATOM 556 CA LYS A 408 11.611 8.766 6.624 1.00 0.00 C ATOM 557 C LYS A 408 11.810 9.690 5.429 1.00 0.00 C ATOM 558 O LYS A 408 12.896 10.235 5.225 1.00 0.00 O ATOM 559 CB LYS A 408 12.298 7.424 6.363 1.00 0.00 C ATOM 560 CG LYS A 408 12.351 6.521 7.583 1.00 0.00 C ATOM 561 CD LYS A 408 13.600 5.655 7.579 1.00 0.00 C ATOM 562 CE LYS A 408 14.348 5.749 8.900 1.00 0.00 C ATOM 563 NZ LYS A 408 14.759 7.147 9.206 1.00 0.00 N ATOM 0 H LYS A 408 9.692 8.051 6.168 1.00 0.00 H new ATOM 0 HA LYS A 408 12.060 9.231 7.502 1.00 0.00 H new ATOM 0 HB2 LYS A 408 11.772 6.906 5.561 1.00 0.00 H new ATOM 0 HB3 LYS A 408 13.314 7.607 6.013 1.00 0.00 H new ATOM 0 HG2 LYS A 408 12.331 7.128 8.488 1.00 0.00 H new ATOM 0 HG3 LYS A 408 11.466 5.885 7.606 1.00 0.00 H new ATOM 0 HD2 LYS A 408 13.324 4.618 7.389 1.00 0.00 H new ATOM 0 HD3 LYS A 408 14.256 5.965 6.765 1.00 0.00 H new ATOM 0 HE2 LYS A 408 13.715 5.372 9.703 1.00 0.00 H new ATOM 0 HE3 LYS A 408 15.231 5.111 8.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 15.635 7.137 9.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 14.923 7.663 8.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 14.007 7.619 9.747 1.00 0.00 H new ATOM 577 N TYR A 409 10.754 9.862 4.642 1.00 0.00 N ATOM 578 CA TYR A 409 10.806 10.719 3.465 1.00 0.00 C ATOM 579 C TYR A 409 10.041 12.013 3.712 1.00 0.00 C ATOM 580 O TYR A 409 10.188 12.985 2.971 1.00 0.00 O ATOM 581 CB TYR A 409 10.226 9.994 2.249 1.00 0.00 C ATOM 582 CG TYR A 409 10.537 8.514 2.215 1.00 0.00 C ATOM 583 CD1 TYR A 409 9.694 7.593 2.825 1.00 0.00 C ATOM 584 CD2 TYR A 409 11.673 8.039 1.572 1.00 0.00 C ATOM 585 CE1 TYR A 409 9.975 6.240 2.795 1.00 0.00 C ATOM 586 CE2 TYR A 409 11.960 6.687 1.537 1.00 0.00 C ATOM 587 CZ TYR A 409 11.108 5.792 2.149 1.00 0.00 C ATOM 588 OH TYR A 409 11.391 4.447 2.116 1.00 0.00 O ATOM 0 H TYR A 409 9.849 9.418 4.799 1.00 0.00 H new ATOM 0 HA TYR A 409 11.850 10.961 3.266 1.00 0.00 H new ATOM 0 HB2 TYR A 409 9.144 10.129 2.239 1.00 0.00 H new ATOM 0 HB3 TYR A 409 10.613 10.458 1.342 1.00 0.00 H new ATOM 0 HD1 TYR A 409 8.805 7.940 3.331 1.00 0.00 H new ATOM 0 HD2 TYR A 409 12.343 8.737 1.092 1.00 0.00 H new ATOM 0 HE1 TYR A 409 9.310 5.537 3.275 1.00 0.00 H new ATOM 0 HE2 TYR A 409 12.847 6.334 1.033 1.00 0.00 H new ATOM 0 HH TYR A 409 12.224 4.300 1.621 1.00 0.00 H new ATOM 598 N GLY A 410 9.222 12.014 4.759 1.00 0.00 N ATOM 599 CA GLY A 410 8.442 13.191 5.088 1.00 0.00 C ATOM 600 C GLY A 410 7.540 12.975 6.286 1.00 0.00 C ATOM 601 O GLY A 410 7.938 12.346 7.267 1.00 0.00 O ATOM 0 H GLY A 410 9.085 11.220 5.385 1.00 0.00 H new ATOM 0 HA2 GLY A 410 9.115 14.024 5.290 1.00 0.00 H new ATOM 0 HA3 GLY A 410 7.836 13.473 4.227 1.00 0.00 H new ATOM 605 N LEU A 411 6.321 13.498 6.204 1.00 0.00 N ATOM 606 CA LEU A 411 5.354 13.366 7.288 1.00 0.00 C ATOM 607 C LEU A 411 4.162 12.516 6.859 1.00 0.00 C ATOM 608 O LEU A 411 3.595 12.723 5.786 1.00 0.00 O ATOM 609 CB LEU A 411 4.864 14.748 7.731 1.00 0.00 C ATOM 610 CG LEU A 411 5.475 15.281 9.028 1.00 0.00 C ATOM 611 CD1 LEU A 411 5.270 14.295 10.169 1.00 0.00 C ATOM 612 CD2 LEU A 411 6.952 15.577 8.833 1.00 0.00 C ATOM 0 H LEU A 411 5.979 14.018 5.396 1.00 0.00 H new ATOM 0 HA LEU A 411 5.851 12.872 8.122 1.00 0.00 H new ATOM 0 HB2 LEU A 411 5.072 15.461 6.933 1.00 0.00 H new ATOM 0 HB3 LEU A 411 3.781 14.709 7.850 1.00 0.00 H new ATOM 0 HG LEU A 411 4.967 16.209 9.290 1.00 0.00 H new ATOM 0 HD11 LEU A 411 5.713 14.696 11.081 1.00 0.00 H new ATOM 0 HD12 LEU A 411 4.203 14.135 10.324 1.00 0.00 H new ATOM 0 HD13 LEU A 411 5.747 13.347 9.921 1.00 0.00 H new ATOM 0 HD21 LEU A 411 7.373 15.956 9.764 1.00 0.00 H new ATOM 0 HD22 LEU A 411 7.471 14.663 8.545 1.00 0.00 H new ATOM 0 HD23 LEU A 411 7.073 16.325 8.050 1.00 0.00 H new ATOM 624 N VAL A 412 3.785 11.559 7.704 1.00 0.00 N ATOM 625 CA VAL A 412 2.651 10.690 7.413 1.00 0.00 C ATOM 626 C VAL A 412 1.551 10.873 8.458 1.00 0.00 C ATOM 627 O VAL A 412 1.743 10.581 9.639 1.00 0.00 O ATOM 628 CB VAL A 412 3.068 9.203 7.344 1.00 0.00 C ATOM 629 CG1 VAL A 412 3.731 8.759 8.639 1.00 0.00 C ATOM 630 CG2 VAL A 412 1.868 8.324 7.028 1.00 0.00 C ATOM 0 H VAL A 412 4.248 11.367 8.593 1.00 0.00 H new ATOM 0 HA VAL A 412 2.268 10.977 6.434 1.00 0.00 H new ATOM 0 HB VAL A 412 3.796 9.096 6.540 1.00 0.00 H new ATOM 0 HG11 VAL A 412 4.014 7.709 8.562 1.00 0.00 H new ATOM 0 HG12 VAL A 412 4.621 9.362 8.817 1.00 0.00 H new ATOM 0 HG13 VAL A 412 3.034 8.887 9.467 1.00 0.00 H new ATOM 0 HG21 VAL A 412 2.182 7.281 6.984 1.00 0.00 H new ATOM 0 HG22 VAL A 412 1.115 8.443 7.807 1.00 0.00 H new ATOM 0 HG23 VAL A 412 1.446 8.617 6.067 1.00 0.00 H new ATOM 640 N LYS A 413 0.402 11.370 8.013 1.00 0.00 N ATOM 641 CA LYS A 413 -0.731 11.605 8.902 1.00 0.00 C ATOM 642 C LYS A 413 -1.135 10.328 9.629 1.00 0.00 C ATOM 643 O LYS A 413 -1.076 10.257 10.857 1.00 0.00 O ATOM 644 CB LYS A 413 -1.921 12.151 8.114 1.00 0.00 C ATOM 645 CG LYS A 413 -1.783 13.618 7.744 1.00 0.00 C ATOM 646 CD LYS A 413 -2.482 13.932 6.433 1.00 0.00 C ATOM 647 CE LYS A 413 -3.455 15.091 6.582 1.00 0.00 C ATOM 648 NZ LYS A 413 -4.416 15.158 5.447 1.00 0.00 N ATOM 0 H LYS A 413 0.230 11.619 7.039 1.00 0.00 H new ATOM 0 HA LYS A 413 -0.424 12.341 9.645 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -2.043 11.565 7.203 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -2.828 12.017 8.703 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -2.203 14.235 8.538 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -0.727 13.876 7.665 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -1.739 14.175 5.673 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -3.018 13.049 6.085 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -4.005 14.986 7.517 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -2.899 16.026 6.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -5.062 15.961 5.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -3.893 15.284 4.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -4.965 14.276 5.404 1.00 0.00 H new ATOM 662 N SER A 414 -1.545 9.320 8.867 1.00 0.00 N ATOM 663 CA SER A 414 -1.962 8.049 9.449 1.00 0.00 C ATOM 664 C SER A 414 -1.750 6.901 8.469 1.00 0.00 C ATOM 665 O SER A 414 -1.102 7.066 7.436 1.00 0.00 O ATOM 666 CB SER A 414 -3.433 8.116 9.863 1.00 0.00 C ATOM 667 OG SER A 414 -4.211 8.769 8.876 1.00 0.00 O ATOM 0 H SER A 414 -1.598 9.357 7.849 1.00 0.00 H new ATOM 0 HA SER A 414 -1.348 7.864 10.331 1.00 0.00 H new ATOM 0 HB2 SER A 414 -3.815 7.108 10.024 1.00 0.00 H new ATOM 0 HB3 SER A 414 -3.523 8.646 10.811 1.00 0.00 H new ATOM 0 HG SER A 414 -4.651 8.100 8.311 1.00 0.00 H new ATOM 673 N ILE A 415 -2.295 5.735 8.806 1.00 0.00 N ATOM 674 CA ILE A 415 -2.174 4.554 7.958 1.00 0.00 C ATOM 675 C ILE A 415 -3.440 3.705 8.026 1.00 0.00 C ATOM 676 O ILE A 415 -3.914 3.368 9.112 1.00 0.00 O ATOM 677 CB ILE A 415 -0.967 3.682 8.365 1.00 0.00 C ATOM 678 CG1 ILE A 415 0.327 4.500 8.325 1.00 0.00 C ATOM 679 CG2 ILE A 415 -0.863 2.464 7.457 1.00 0.00 C ATOM 680 CD1 ILE A 415 1.566 3.695 8.658 1.00 0.00 C ATOM 0 H ILE A 415 -2.826 5.583 9.663 1.00 0.00 H new ATOM 0 HA ILE A 415 -2.024 4.911 6.939 1.00 0.00 H new ATOM 0 HB ILE A 415 -1.119 3.337 9.388 1.00 0.00 H new ATOM 0 HG12 ILE A 415 0.442 4.933 7.331 1.00 0.00 H new ATOM 0 HG13 ILE A 415 0.244 5.330 9.027 1.00 0.00 H new ATOM 0 HG21 ILE A 415 -0.007 1.859 7.756 1.00 0.00 H new ATOM 0 HG22 ILE A 415 -1.774 1.870 7.539 1.00 0.00 H new ATOM 0 HG23 ILE A 415 -0.734 2.790 6.425 1.00 0.00 H new ATOM 0 HD11 ILE A 415 2.443 4.340 8.610 1.00 0.00 H new ATOM 0 HD12 ILE A 415 1.473 3.283 9.663 1.00 0.00 H new ATOM 0 HD13 ILE A 415 1.675 2.881 7.941 1.00 0.00 H new ATOM 692 N GLU A 416 -3.983 3.361 6.861 1.00 0.00 N ATOM 693 CA GLU A 416 -5.192 2.547 6.792 1.00 0.00 C ATOM 694 C GLU A 416 -4.879 1.163 6.239 1.00 0.00 C ATOM 695 O GLU A 416 -4.592 1.007 5.051 1.00 0.00 O ATOM 696 CB GLU A 416 -6.248 3.230 5.923 1.00 0.00 C ATOM 697 CG GLU A 416 -7.621 3.297 6.571 1.00 0.00 C ATOM 698 CD GLU A 416 -7.683 4.302 7.706 1.00 0.00 C ATOM 699 OE1 GLU A 416 -7.203 3.979 8.811 1.00 0.00 O ATOM 700 OE2 GLU A 416 -8.213 5.411 7.487 1.00 0.00 O ATOM 0 H GLU A 416 -3.605 3.633 5.953 1.00 0.00 H new ATOM 0 HA GLU A 416 -5.584 2.437 7.803 1.00 0.00 H new ATOM 0 HB2 GLU A 416 -5.916 4.242 5.691 1.00 0.00 H new ATOM 0 HB3 GLU A 416 -6.328 2.695 4.976 1.00 0.00 H new ATOM 0 HG2 GLU A 416 -8.362 3.561 5.816 1.00 0.00 H new ATOM 0 HG3 GLU A 416 -7.888 2.310 6.949 1.00 0.00 H new ATOM 707 N ILE A 417 -4.935 0.161 7.108 1.00 0.00 N ATOM 708 CA ILE A 417 -4.656 -1.214 6.717 1.00 0.00 C ATOM 709 C ILE A 417 -5.788 -2.144 7.164 1.00 0.00 C ATOM 710 O ILE A 417 -5.940 -2.406 8.356 1.00 0.00 O ATOM 711 CB ILE A 417 -3.317 -1.693 7.316 1.00 0.00 C ATOM 712 CG1 ILE A 417 -2.206 -0.716 6.932 1.00 0.00 C ATOM 713 CG2 ILE A 417 -2.978 -3.101 6.844 1.00 0.00 C ATOM 714 CD1 ILE A 417 -0.894 -0.967 7.641 1.00 0.00 C ATOM 0 H ILE A 417 -5.172 0.277 8.093 1.00 0.00 H new ATOM 0 HA ILE A 417 -4.584 -1.244 5.630 1.00 0.00 H new ATOM 0 HB ILE A 417 -3.410 -1.722 8.402 1.00 0.00 H new ATOM 0 HG12 ILE A 417 -2.042 -0.773 5.856 1.00 0.00 H new ATOM 0 HG13 ILE A 417 -2.537 0.299 7.151 1.00 0.00 H new ATOM 0 HG21 ILE A 417 -2.030 -3.413 7.281 1.00 0.00 H new ATOM 0 HG22 ILE A 417 -3.765 -3.788 7.155 1.00 0.00 H new ATOM 0 HG23 ILE A 417 -2.897 -3.111 5.757 1.00 0.00 H new ATOM 0 HD11 ILE A 417 -0.158 -0.233 7.315 1.00 0.00 H new ATOM 0 HD12 ILE A 417 -1.040 -0.881 8.718 1.00 0.00 H new ATOM 0 HD13 ILE A 417 -0.537 -1.969 7.402 1.00 0.00 H new ATOM 726 N PRO A 418 -6.605 -2.654 6.214 1.00 0.00 N ATOM 727 CA PRO A 418 -7.730 -3.542 6.531 1.00 0.00 C ATOM 728 C PRO A 418 -7.341 -4.680 7.467 1.00 0.00 C ATOM 729 O PRO A 418 -6.213 -5.172 7.434 1.00 0.00 O ATOM 730 CB PRO A 418 -8.165 -4.098 5.165 1.00 0.00 C ATOM 731 CG PRO A 418 -7.117 -3.665 4.195 1.00 0.00 C ATOM 732 CD PRO A 418 -6.507 -2.420 4.767 1.00 0.00 C ATOM 0 HA PRO A 418 -8.520 -3.004 7.055 1.00 0.00 H new ATOM 0 HB2 PRO A 418 -8.246 -5.185 5.193 1.00 0.00 H new ATOM 0 HB3 PRO A 418 -9.144 -3.713 4.880 1.00 0.00 H new ATOM 0 HG2 PRO A 418 -6.364 -4.442 4.063 1.00 0.00 H new ATOM 0 HG3 PRO A 418 -7.551 -3.471 3.214 1.00 0.00 H new ATOM 0 HD2 PRO A 418 -5.473 -2.290 4.446 1.00 0.00 H new ATOM 0 HD3 PRO A 418 -7.050 -1.525 4.463 1.00 0.00 H new ATOM 740 N ARG A 419 -8.291 -5.090 8.300 1.00 0.00 N ATOM 741 CA ARG A 419 -8.071 -6.170 9.253 1.00 0.00 C ATOM 742 C ARG A 419 -9.326 -7.033 9.367 1.00 0.00 C ATOM 743 O ARG A 419 -10.059 -6.948 10.353 1.00 0.00 O ATOM 744 CB ARG A 419 -7.695 -5.605 10.624 1.00 0.00 C ATOM 745 CG ARG A 419 -7.069 -6.630 11.556 1.00 0.00 C ATOM 746 CD ARG A 419 -8.035 -7.049 12.654 1.00 0.00 C ATOM 747 NE ARG A 419 -8.217 -8.498 12.700 1.00 0.00 N ATOM 748 CZ ARG A 419 -8.479 -9.174 13.815 1.00 0.00 C ATOM 749 NH1 ARG A 419 -8.586 -8.536 14.973 1.00 0.00 N ATOM 750 NH2 ARG A 419 -8.633 -10.490 13.773 1.00 0.00 N ATOM 0 H ARG A 419 -9.227 -4.687 8.334 1.00 0.00 H new ATOM 0 HA ARG A 419 -7.248 -6.788 8.894 1.00 0.00 H new ATOM 0 HB2 ARG A 419 -6.999 -4.778 10.488 1.00 0.00 H new ATOM 0 HB3 ARG A 419 -8.588 -5.195 11.096 1.00 0.00 H new ATOM 0 HG2 ARG A 419 -6.765 -7.506 10.983 1.00 0.00 H new ATOM 0 HG3 ARG A 419 -6.167 -6.213 12.003 1.00 0.00 H new ATOM 0 HD2 ARG A 419 -7.663 -6.700 13.617 1.00 0.00 H new ATOM 0 HD3 ARG A 419 -8.999 -6.568 12.492 1.00 0.00 H new ATOM 0 HE ARG A 419 -8.139 -9.021 11.828 1.00 0.00 H new ATOM 0 HH11 ARG A 419 -8.467 -7.524 15.010 1.00 0.00 H new ATOM 0 HH12 ARG A 419 -8.787 -9.058 15.826 1.00 0.00 H new ATOM 0 HH21 ARG A 419 -8.551 -10.985 12.885 1.00 0.00 H new ATOM 0 HH22 ARG A 419 -8.834 -11.008 14.629 1.00 0.00 H new ATOM 764 N PRO A 420 -9.590 -7.871 8.347 1.00 0.00 N ATOM 765 CA PRO A 420 -10.764 -8.750 8.327 1.00 0.00 C ATOM 766 C PRO A 420 -10.951 -9.500 9.639 1.00 0.00 C ATOM 767 O PRO A 420 -10.102 -10.299 10.033 1.00 0.00 O ATOM 768 CB PRO A 420 -10.448 -9.724 7.194 1.00 0.00 C ATOM 769 CG PRO A 420 -9.580 -8.947 6.266 1.00 0.00 C ATOM 770 CD PRO A 420 -8.762 -8.030 7.134 1.00 0.00 C ATOM 0 HA PRO A 420 -11.691 -8.194 8.187 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -9.937 -10.612 7.565 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -11.357 -10.063 6.697 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -8.938 -9.610 5.685 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -10.179 -8.379 5.554 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -7.788 -8.461 7.367 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -8.579 -7.073 6.645 1.00 0.00 H new ATOM 778 N VAL A 421 -12.066 -9.238 10.313 1.00 0.00 N ATOM 779 CA VAL A 421 -12.355 -9.888 11.583 1.00 0.00 C ATOM 780 C VAL A 421 -12.772 -11.338 11.378 1.00 0.00 C ATOM 781 O VAL A 421 -13.930 -11.626 11.074 1.00 0.00 O ATOM 782 CB VAL A 421 -13.449 -9.138 12.369 1.00 0.00 C ATOM 783 CG1 VAL A 421 -13.806 -9.883 13.648 1.00 0.00 C ATOM 784 CG2 VAL A 421 -12.997 -7.718 12.683 1.00 0.00 C ATOM 0 H VAL A 421 -12.782 -8.582 10.001 1.00 0.00 H new ATOM 0 HA VAL A 421 -11.434 -9.865 12.166 1.00 0.00 H new ATOM 0 HB VAL A 421 -14.343 -9.088 11.748 1.00 0.00 H new ATOM 0 HG11 VAL A 421 -14.580 -9.334 14.185 1.00 0.00 H new ATOM 0 HG12 VAL A 421 -14.174 -10.878 13.399 1.00 0.00 H new ATOM 0 HG13 VAL A 421 -12.920 -9.971 14.277 1.00 0.00 H new ATOM 0 HG21 VAL A 421 -13.780 -7.201 13.238 1.00 0.00 H new ATOM 0 HG22 VAL A 421 -12.088 -7.750 13.283 1.00 0.00 H new ATOM 0 HG23 VAL A 421 -12.800 -7.185 11.753 1.00 0.00 H new ATOM 794 N ASP A 422 -11.813 -12.247 11.544 1.00 0.00 N ATOM 795 CA ASP A 422 -12.069 -13.670 11.367 1.00 0.00 C ATOM 796 C ASP A 422 -12.573 -13.917 9.957 1.00 0.00 C ATOM 797 O ASP A 422 -13.217 -14.927 9.671 1.00 0.00 O ATOM 798 CB ASP A 422 -13.090 -14.168 12.393 1.00 0.00 C ATOM 799 CG ASP A 422 -12.629 -15.427 13.102 1.00 0.00 C ATOM 800 OD1 ASP A 422 -12.180 -16.366 12.411 1.00 0.00 O ATOM 801 OD2 ASP A 422 -12.718 -15.473 14.346 1.00 0.00 O ATOM 0 H ASP A 422 -10.852 -12.021 11.801 1.00 0.00 H new ATOM 0 HA ASP A 422 -11.141 -14.221 11.522 1.00 0.00 H new ATOM 0 HB2 ASP A 422 -13.272 -13.385 13.129 1.00 0.00 H new ATOM 0 HB3 ASP A 422 -14.039 -14.362 11.893 1.00 0.00 H new ATOM 806 N GLY A 423 -12.261 -12.972 9.081 1.00 0.00 N ATOM 807 CA GLY A 423 -12.686 -13.052 7.704 1.00 0.00 C ATOM 808 C GLY A 423 -13.867 -12.145 7.439 1.00 0.00 C ATOM 809 O GLY A 423 -14.694 -12.423 6.570 1.00 0.00 O ATOM 0 H GLY A 423 -11.713 -12.142 9.307 1.00 0.00 H new ATOM 0 HA2 GLY A 423 -11.859 -12.776 7.050 1.00 0.00 H new ATOM 0 HA3 GLY A 423 -12.954 -14.081 7.463 1.00 0.00 H new ATOM 813 N VAL A 424 -13.942 -11.054 8.198 1.00 0.00 N ATOM 814 CA VAL A 424 -15.034 -10.103 8.067 1.00 0.00 C ATOM 815 C VAL A 424 -14.867 -9.214 6.834 1.00 0.00 C ATOM 816 O VAL A 424 -15.845 -8.886 6.160 1.00 0.00 O ATOM 817 CB VAL A 424 -15.173 -9.225 9.333 1.00 0.00 C ATOM 818 CG1 VAL A 424 -15.524 -7.783 8.984 1.00 0.00 C ATOM 819 CG2 VAL A 424 -16.220 -9.816 10.265 1.00 0.00 C ATOM 0 H VAL A 424 -13.255 -10.810 8.911 1.00 0.00 H new ATOM 0 HA VAL A 424 -15.945 -10.688 7.946 1.00 0.00 H new ATOM 0 HB VAL A 424 -14.208 -9.213 9.839 1.00 0.00 H new ATOM 0 HG11 VAL A 424 -15.613 -7.198 9.900 1.00 0.00 H new ATOM 0 HG12 VAL A 424 -14.739 -7.359 8.357 1.00 0.00 H new ATOM 0 HG13 VAL A 424 -16.471 -7.759 8.445 1.00 0.00 H new ATOM 0 HG21 VAL A 424 -16.311 -9.191 11.153 1.00 0.00 H new ATOM 0 HG22 VAL A 424 -17.181 -9.859 9.752 1.00 0.00 H new ATOM 0 HG23 VAL A 424 -15.920 -10.822 10.558 1.00 0.00 H new ATOM 874 N GLY A 428 -11.834 -8.224 -0.435 1.00 0.00 N ATOM 875 CA GLY A 428 -11.323 -6.902 -0.729 1.00 0.00 C ATOM 876 C GLY A 428 -9.991 -6.661 -0.046 1.00 0.00 C ATOM 877 O GLY A 428 -9.267 -5.727 -0.390 1.00 0.00 O ATOM 0 HA2 GLY A 428 -11.208 -6.786 -1.807 1.00 0.00 H new ATOM 0 HA3 GLY A 428 -12.042 -6.151 -0.403 1.00 0.00 H new ATOM 881 N CYS A 429 -9.673 -7.513 0.929 1.00 0.00 N ATOM 882 CA CYS A 429 -8.418 -7.403 1.665 1.00 0.00 C ATOM 883 C CYS A 429 -7.230 -7.714 0.760 1.00 0.00 C ATOM 884 O CYS A 429 -7.345 -8.506 -0.177 1.00 0.00 O ATOM 885 CB CYS A 429 -8.423 -8.356 2.863 1.00 0.00 C ATOM 886 SG CYS A 429 -6.876 -8.371 3.799 1.00 0.00 S ATOM 0 H CYS A 429 -10.269 -8.286 1.226 1.00 0.00 H new ATOM 0 HA CYS A 429 -8.322 -6.378 2.023 1.00 0.00 H new ATOM 0 HB2 CYS A 429 -9.237 -8.078 3.532 1.00 0.00 H new ATOM 0 HB3 CYS A 429 -8.632 -9.366 2.510 1.00 0.00 H new ATOM 0 HG CYS A 429 -7.064 -7.810 4.957 1.00 0.00 H new ATOM 892 N GLY A 430 -6.091 -7.088 1.042 1.00 0.00 N ATOM 893 CA GLY A 430 -4.901 -7.318 0.242 1.00 0.00 C ATOM 894 C GLY A 430 -4.208 -6.033 -0.167 1.00 0.00 C ATOM 895 O GLY A 430 -3.062 -6.057 -0.618 1.00 0.00 O ATOM 0 H GLY A 430 -5.971 -6.427 1.809 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -4.204 -7.937 0.807 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -5.173 -7.879 -0.652 1.00 0.00 H new ATOM 899 N LYS A 431 -4.900 -4.909 -0.013 1.00 0.00 N ATOM 900 CA LYS A 431 -4.338 -3.611 -0.374 1.00 0.00 C ATOM 901 C LYS A 431 -4.399 -2.641 0.802 1.00 0.00 C ATOM 902 O LYS A 431 -5.462 -2.421 1.383 1.00 0.00 O ATOM 903 CB LYS A 431 -5.087 -3.022 -1.571 1.00 0.00 C ATOM 904 CG LYS A 431 -5.279 -4.007 -2.712 1.00 0.00 C ATOM 905 CD LYS A 431 -6.751 -4.302 -2.950 1.00 0.00 C ATOM 906 CE LYS A 431 -7.000 -4.771 -4.374 1.00 0.00 C ATOM 907 NZ LYS A 431 -7.812 -3.792 -5.148 1.00 0.00 N ATOM 0 H LYS A 431 -5.849 -4.870 0.359 1.00 0.00 H new ATOM 0 HA LYS A 431 -3.293 -3.761 -0.643 1.00 0.00 H new ATOM 0 HB2 LYS A 431 -6.063 -2.668 -1.240 1.00 0.00 H new ATOM 0 HB3 LYS A 431 -4.541 -2.154 -1.939 1.00 0.00 H new ATOM 0 HG2 LYS A 431 -4.836 -3.602 -3.622 1.00 0.00 H new ATOM 0 HG3 LYS A 431 -4.753 -4.934 -2.486 1.00 0.00 H new ATOM 0 HD2 LYS A 431 -7.088 -5.066 -2.250 1.00 0.00 H new ATOM 0 HD3 LYS A 431 -7.340 -3.406 -2.752 1.00 0.00 H new ATOM 0 HE2 LYS A 431 -6.046 -4.928 -4.876 1.00 0.00 H new ATOM 0 HE3 LYS A 431 -7.512 -5.733 -4.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 -7.959 -4.149 -6.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 -8.733 -3.661 -4.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 -7.312 -2.881 -5.189 1.00 0.00 H new ATOM 921 N ILE A 432 -3.251 -2.065 1.149 1.00 0.00 N ATOM 922 CA ILE A 432 -3.176 -1.115 2.252 1.00 0.00 C ATOM 923 C ILE A 432 -2.426 0.139 1.819 1.00 0.00 C ATOM 924 O ILE A 432 -1.877 0.186 0.718 1.00 0.00 O ATOM 925 CB ILE A 432 -2.511 -1.742 3.500 1.00 0.00 C ATOM 926 CG1 ILE A 432 -0.985 -1.770 3.371 1.00 0.00 C ATOM 927 CG2 ILE A 432 -3.045 -3.149 3.706 1.00 0.00 C ATOM 928 CD1 ILE A 432 -0.253 -2.189 4.628 1.00 0.00 C ATOM 0 H ILE A 432 -2.361 -2.240 0.682 1.00 0.00 H new ATOM 0 HA ILE A 432 -4.195 -0.841 2.526 1.00 0.00 H new ATOM 0 HB ILE A 432 -2.757 -1.125 4.364 1.00 0.00 H new ATOM 0 HG12 ILE A 432 -0.714 -2.452 2.565 1.00 0.00 H new ATOM 0 HG13 ILE A 432 -0.640 -0.778 3.079 1.00 0.00 H new ATOM 0 HG21 ILE A 432 -2.576 -3.591 4.585 1.00 0.00 H new ATOM 0 HG22 ILE A 432 -4.125 -3.111 3.851 1.00 0.00 H new ATOM 0 HG23 ILE A 432 -2.818 -3.756 2.830 1.00 0.00 H new ATOM 0 HD11 ILE A 432 0.821 -2.180 4.444 1.00 0.00 H new ATOM 0 HD12 ILE A 432 -0.489 -1.495 5.435 1.00 0.00 H new ATOM 0 HD13 ILE A 432 -0.564 -3.194 4.912 1.00 0.00 H new ATOM 940 N PHE A 433 -2.404 1.154 2.675 1.00 0.00 N ATOM 941 CA PHE A 433 -1.730 2.404 2.332 1.00 0.00 C ATOM 942 C PHE A 433 -1.581 3.320 3.540 1.00 0.00 C ATOM 943 O PHE A 433 -1.942 2.958 4.659 1.00 0.00 O ATOM 944 CB PHE A 433 -2.505 3.130 1.231 1.00 0.00 C ATOM 945 CG PHE A 433 -3.995 2.989 1.344 1.00 0.00 C ATOM 946 CD1 PHE A 433 -4.684 3.610 2.370 1.00 0.00 C ATOM 947 CD2 PHE A 433 -4.705 2.233 0.425 1.00 0.00 C ATOM 948 CE1 PHE A 433 -6.053 3.485 2.479 1.00 0.00 C ATOM 949 CE2 PHE A 433 -6.077 2.103 0.528 1.00 0.00 C ATOM 950 CZ PHE A 433 -6.752 2.729 1.557 1.00 0.00 C ATOM 0 H PHE A 433 -2.837 1.140 3.598 1.00 0.00 H new ATOM 0 HA PHE A 433 -0.731 2.151 1.978 1.00 0.00 H new ATOM 0 HB2 PHE A 433 -2.247 4.189 1.256 1.00 0.00 H new ATOM 0 HB3 PHE A 433 -2.186 2.747 0.262 1.00 0.00 H new ATOM 0 HD1 PHE A 433 -4.143 4.200 3.095 1.00 0.00 H new ATOM 0 HD2 PHE A 433 -4.181 1.740 -0.380 1.00 0.00 H new ATOM 0 HE1 PHE A 433 -6.578 3.977 3.284 1.00 0.00 H new ATOM 0 HE2 PHE A 433 -6.620 1.513 -0.195 1.00 0.00 H new ATOM 0 HZ PHE A 433 -7.824 2.628 1.641 1.00 0.00 H new ATOM 960 N VAL A 434 -1.042 4.514 3.295 1.00 0.00 N ATOM 961 CA VAL A 434 -0.834 5.497 4.352 1.00 0.00 C ATOM 962 C VAL A 434 -1.264 6.892 3.902 1.00 0.00 C ATOM 963 O VAL A 434 -1.063 7.277 2.748 1.00 0.00 O ATOM 964 CB VAL A 434 0.644 5.543 4.799 1.00 0.00 C ATOM 965 CG1 VAL A 434 1.191 4.138 4.987 1.00 0.00 C ATOM 966 CG2 VAL A 434 1.495 6.315 3.801 1.00 0.00 C ATOM 0 H VAL A 434 -0.742 4.822 2.370 1.00 0.00 H new ATOM 0 HA VAL A 434 -1.450 5.186 5.196 1.00 0.00 H new ATOM 0 HB VAL A 434 0.688 6.064 5.756 1.00 0.00 H new ATOM 0 HG11 VAL A 434 2.233 4.192 5.302 1.00 0.00 H new ATOM 0 HG12 VAL A 434 0.608 3.620 5.749 1.00 0.00 H new ATOM 0 HG13 VAL A 434 1.124 3.593 4.046 1.00 0.00 H new ATOM 0 HG21 VAL A 434 2.530 6.331 4.141 1.00 0.00 H new ATOM 0 HG22 VAL A 434 1.441 5.831 2.826 1.00 0.00 H new ATOM 0 HG23 VAL A 434 1.124 7.337 3.720 1.00 0.00 H new ATOM 976 N GLU A 435 -1.864 7.638 4.822 1.00 0.00 N ATOM 977 CA GLU A 435 -2.310 8.993 4.538 1.00 0.00 C ATOM 978 C GLU A 435 -1.157 9.964 4.723 1.00 0.00 C ATOM 979 O GLU A 435 -0.731 10.227 5.848 1.00 0.00 O ATOM 980 CB GLU A 435 -3.467 9.382 5.457 1.00 0.00 C ATOM 981 CG GLU A 435 -4.162 10.670 5.049 1.00 0.00 C ATOM 982 CD GLU A 435 -5.343 11.006 5.938 1.00 0.00 C ATOM 983 OE1 GLU A 435 -5.317 10.628 7.130 1.00 0.00 O ATOM 984 OE2 GLU A 435 -6.296 11.645 5.445 1.00 0.00 O ATOM 0 H GLU A 435 -2.053 7.324 5.774 1.00 0.00 H new ATOM 0 HA GLU A 435 -2.657 9.035 3.506 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -4.198 8.573 5.470 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -3.092 9.488 6.475 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -3.445 11.490 5.080 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -4.503 10.583 4.017 1.00 0.00 H new ATOM 991 N PHE A 436 -0.655 10.490 3.615 1.00 0.00 N ATOM 992 CA PHE A 436 0.459 11.423 3.657 1.00 0.00 C ATOM 993 C PHE A 436 -0.030 12.862 3.804 1.00 0.00 C ATOM 994 O PHE A 436 -1.219 13.142 3.656 1.00 0.00 O ATOM 995 CB PHE A 436 1.302 11.288 2.388 1.00 0.00 C ATOM 996 CG PHE A 436 2.716 10.850 2.637 1.00 0.00 C ATOM 997 CD1 PHE A 436 2.988 9.702 3.363 1.00 0.00 C ATOM 998 CD2 PHE A 436 3.776 11.585 2.133 1.00 0.00 C ATOM 999 CE1 PHE A 436 4.290 9.296 3.584 1.00 0.00 C ATOM 1000 CE2 PHE A 436 5.079 11.185 2.350 1.00 0.00 C ATOM 1001 CZ PHE A 436 5.338 10.039 3.076 1.00 0.00 C ATOM 0 H PHE A 436 -1.002 10.286 2.678 1.00 0.00 H new ATOM 0 HA PHE A 436 1.070 11.181 4.527 1.00 0.00 H new ATOM 0 HB2 PHE A 436 0.823 10.572 1.721 1.00 0.00 H new ATOM 0 HB3 PHE A 436 1.316 12.247 1.870 1.00 0.00 H new ATOM 0 HD1 PHE A 436 2.172 9.117 3.761 1.00 0.00 H new ATOM 0 HD2 PHE A 436 3.581 12.482 1.564 1.00 0.00 H new ATOM 0 HE1 PHE A 436 4.488 8.400 4.153 1.00 0.00 H new ATOM 0 HE2 PHE A 436 5.896 11.768 1.952 1.00 0.00 H new ATOM 0 HZ PHE A 436 6.357 9.725 3.246 1.00 0.00 H new ATOM 1011 N THR A 437 0.900 13.769 4.093 1.00 0.00 N ATOM 1012 CA THR A 437 0.569 15.180 4.266 1.00 0.00 C ATOM 1013 C THR A 437 0.772 15.965 2.974 1.00 0.00 C ATOM 1014 O THR A 437 -0.078 16.768 2.587 1.00 0.00 O ATOM 1015 CB THR A 437 1.420 15.827 5.376 1.00 0.00 C ATOM 1016 OG1 THR A 437 2.776 15.971 4.935 1.00 0.00 O ATOM 1017 CG2 THR A 437 1.384 14.992 6.647 1.00 0.00 C ATOM 0 H THR A 437 1.889 13.551 4.212 1.00 0.00 H new ATOM 0 HA THR A 437 -0.483 15.217 4.549 1.00 0.00 H new ATOM 0 HB THR A 437 1.001 16.809 5.594 1.00 0.00 H new ATOM 0 HG1 THR A 437 3.309 16.384 5.646 1.00 0.00 H new ATOM 0 HG21 THR A 437 1.992 15.471 7.414 1.00 0.00 H new ATOM 0 HG22 THR A 437 0.356 14.909 6.999 1.00 0.00 H new ATOM 0 HG23 THR A 437 1.778 13.997 6.440 1.00 0.00 H new ATOM 1025 N SER A 438 1.901 15.729 2.312 1.00 0.00 N ATOM 1026 CA SER A 438 2.215 16.425 1.068 1.00 0.00 C ATOM 1027 C SER A 438 2.672 15.449 -0.011 1.00 0.00 C ATOM 1028 O SER A 438 3.317 14.439 0.279 1.00 0.00 O ATOM 1029 CB SER A 438 3.299 17.476 1.311 1.00 0.00 C ATOM 1030 OG SER A 438 3.037 18.659 0.577 1.00 0.00 O ATOM 0 H SER A 438 2.612 15.063 2.615 1.00 0.00 H new ATOM 0 HA SER A 438 1.307 16.917 0.720 1.00 0.00 H new ATOM 0 HB2 SER A 438 3.352 17.709 2.375 1.00 0.00 H new ATOM 0 HB3 SER A 438 4.271 17.074 1.024 1.00 0.00 H new ATOM 0 HG SER A 438 3.744 19.315 0.751 1.00 0.00 H new ATOM 1036 N VAL A 439 2.337 15.762 -1.259 1.00 0.00 N ATOM 1037 CA VAL A 439 2.708 14.916 -2.387 1.00 0.00 C ATOM 1038 C VAL A 439 4.201 15.011 -2.680 1.00 0.00 C ATOM 1039 O VAL A 439 4.746 14.208 -3.438 1.00 0.00 O ATOM 1040 CB VAL A 439 1.929 15.296 -3.657 1.00 0.00 C ATOM 1041 CG1 VAL A 439 0.440 15.107 -3.440 1.00 0.00 C ATOM 1042 CG2 VAL A 439 2.239 16.726 -4.071 1.00 0.00 C ATOM 0 H VAL A 439 1.809 16.596 -1.514 1.00 0.00 H new ATOM 0 HA VAL A 439 2.457 13.893 -2.106 1.00 0.00 H new ATOM 0 HB VAL A 439 2.244 14.636 -4.466 1.00 0.00 H new ATOM 0 HG11 VAL A 439 -0.098 15.380 -4.348 1.00 0.00 H new ATOM 0 HG12 VAL A 439 0.237 14.064 -3.198 1.00 0.00 H new ATOM 0 HG13 VAL A 439 0.109 15.741 -2.618 1.00 0.00 H new ATOM 0 HG21 VAL A 439 1.677 16.974 -4.972 1.00 0.00 H new ATOM 0 HG22 VAL A 439 1.956 17.407 -3.268 1.00 0.00 H new ATOM 0 HG23 VAL A 439 3.306 16.824 -4.271 1.00 0.00 H new ATOM 1052 N PHE A 440 4.856 15.998 -2.078 1.00 0.00 N ATOM 1053 CA PHE A 440 6.285 16.199 -2.280 1.00 0.00 C ATOM 1054 C PHE A 440 7.061 15.015 -1.727 1.00 0.00 C ATOM 1055 O PHE A 440 7.852 14.386 -2.432 1.00 0.00 O ATOM 1056 CB PHE A 440 6.745 17.491 -1.603 1.00 0.00 C ATOM 1057 CG PHE A 440 7.349 18.484 -2.554 1.00 0.00 C ATOM 1058 CD1 PHE A 440 8.674 18.370 -2.944 1.00 0.00 C ATOM 1059 CD2 PHE A 440 6.594 19.531 -3.058 1.00 0.00 C ATOM 1060 CE1 PHE A 440 9.234 19.280 -3.819 1.00 0.00 C ATOM 1061 CE2 PHE A 440 7.148 20.444 -3.934 1.00 0.00 C ATOM 1062 CZ PHE A 440 8.470 20.319 -4.315 1.00 0.00 C ATOM 0 H PHE A 440 4.420 16.670 -1.447 1.00 0.00 H new ATOM 0 HA PHE A 440 6.477 16.281 -3.350 1.00 0.00 H new ATOM 0 HB2 PHE A 440 5.894 17.952 -1.101 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.476 17.247 -0.832 1.00 0.00 H new ATOM 0 HD1 PHE A 440 9.276 17.560 -2.559 1.00 0.00 H new ATOM 0 HD2 PHE A 440 5.560 19.634 -2.762 1.00 0.00 H new ATOM 0 HE1 PHE A 440 10.268 19.180 -4.115 1.00 0.00 H new ATOM 0 HE2 PHE A 440 6.548 21.255 -4.321 1.00 0.00 H new ATOM 0 HZ PHE A 440 8.906 21.032 -4.999 1.00 0.00 H new ATOM 1072 N ASP A 441 6.823 14.716 -0.457 1.00 0.00 N ATOM 1073 CA ASP A 441 7.483 13.600 0.197 1.00 0.00 C ATOM 1074 C ASP A 441 6.866 12.288 -0.273 1.00 0.00 C ATOM 1075 O ASP A 441 7.533 11.255 -0.316 1.00 0.00 O ATOM 1076 CB ASP A 441 7.372 13.731 1.716 1.00 0.00 C ATOM 1077 CG ASP A 441 7.904 15.057 2.222 1.00 0.00 C ATOM 1078 OD1 ASP A 441 9.006 15.458 1.791 1.00 0.00 O ATOM 1079 OD2 ASP A 441 7.220 15.695 3.049 1.00 0.00 O ATOM 0 H ASP A 441 6.177 15.233 0.139 1.00 0.00 H new ATOM 0 HA ASP A 441 8.540 13.608 -0.069 1.00 0.00 H new ATOM 0 HB2 ASP A 441 6.328 13.625 2.012 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.922 12.918 2.189 1.00 0.00 H new ATOM 1084 N CYS A 442 5.582 12.342 -0.627 1.00 0.00 N ATOM 1085 CA CYS A 442 4.868 11.166 -1.113 1.00 0.00 C ATOM 1086 C CYS A 442 5.503 10.659 -2.402 1.00 0.00 C ATOM 1087 O CYS A 442 5.501 9.461 -2.683 1.00 0.00 O ATOM 1088 CB CYS A 442 3.395 11.500 -1.355 1.00 0.00 C ATOM 1089 SG CYS A 442 2.246 10.227 -0.784 1.00 0.00 S ATOM 0 H CYS A 442 5.016 13.190 -0.585 1.00 0.00 H new ATOM 0 HA CYS A 442 4.932 10.385 -0.355 1.00 0.00 H new ATOM 0 HB2 CYS A 442 3.159 12.438 -0.853 1.00 0.00 H new ATOM 0 HB3 CYS A 442 3.241 11.661 -2.422 1.00 0.00 H new ATOM 0 HG CYS A 442 1.127 10.782 -0.424 1.00 0.00 H new ATOM 1095 N GLN A 443 6.046 11.590 -3.180 1.00 0.00 N ATOM 1096 CA GLN A 443 6.692 11.258 -4.443 1.00 0.00 C ATOM 1097 C GLN A 443 8.092 10.708 -4.204 1.00 0.00 C ATOM 1098 O GLN A 443 8.468 9.676 -4.761 1.00 0.00 O ATOM 1099 CB GLN A 443 6.760 12.498 -5.335 1.00 0.00 C ATOM 1100 CG GLN A 443 7.007 12.185 -6.801 1.00 0.00 C ATOM 1101 CD GLN A 443 7.235 13.432 -7.634 1.00 0.00 C ATOM 1102 OE1 GLN A 443 6.920 13.464 -8.822 1.00 0.00 O ATOM 1103 NE2 GLN A 443 7.789 14.468 -7.012 1.00 0.00 N ATOM 0 H GLN A 443 6.051 12.585 -2.955 1.00 0.00 H new ATOM 0 HA GLN A 443 6.102 10.489 -4.942 1.00 0.00 H new ATOM 0 HB2 GLN A 443 5.826 13.052 -5.244 1.00 0.00 H new ATOM 0 HB3 GLN A 443 7.554 13.151 -4.974 1.00 0.00 H new ATOM 0 HG2 GLN A 443 7.875 11.531 -6.888 1.00 0.00 H new ATOM 0 HG3 GLN A 443 6.154 11.637 -7.200 1.00 0.00 H new ATOM 0 HE21 GLN A 443 8.035 14.398 -6.025 1.00 0.00 H new ATOM 0 HE22 GLN A 443 7.968 15.333 -7.522 1.00 0.00 H new ATOM 1112 N LYS A 444 8.860 11.406 -3.372 1.00 0.00 N ATOM 1113 CA LYS A 444 10.221 10.985 -3.054 1.00 0.00 C ATOM 1114 C LYS A 444 10.214 9.689 -2.251 1.00 0.00 C ATOM 1115 O LYS A 444 11.253 9.052 -2.072 1.00 0.00 O ATOM 1116 CB LYS A 444 10.943 12.083 -2.270 1.00 0.00 C ATOM 1117 CG LYS A 444 12.457 12.017 -2.386 1.00 0.00 C ATOM 1118 CD LYS A 444 13.027 13.300 -2.969 1.00 0.00 C ATOM 1119 CE LYS A 444 13.250 14.350 -1.893 1.00 0.00 C ATOM 1120 NZ LYS A 444 13.423 15.710 -2.473 1.00 0.00 N ATOM 0 H LYS A 444 8.564 12.264 -2.907 1.00 0.00 H new ATOM 0 HA LYS A 444 10.751 10.807 -3.990 1.00 0.00 H new ATOM 0 HB2 LYS A 444 10.602 13.056 -2.625 1.00 0.00 H new ATOM 0 HB3 LYS A 444 10.664 12.011 -1.219 1.00 0.00 H new ATOM 0 HG2 LYS A 444 12.891 11.839 -1.402 1.00 0.00 H new ATOM 0 HG3 LYS A 444 12.738 11.173 -3.016 1.00 0.00 H new ATOM 0 HD2 LYS A 444 13.971 13.085 -3.470 1.00 0.00 H new ATOM 0 HD3 LYS A 444 12.346 13.691 -3.725 1.00 0.00 H new ATOM 0 HE2 LYS A 444 12.403 14.353 -1.207 1.00 0.00 H new ATOM 0 HE3 LYS A 444 14.132 14.089 -1.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 13.573 16.398 -1.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 14.247 15.714 -3.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 12.571 15.970 -3.010 1.00 0.00 H new ATOM 1134 N ALA A 445 9.037 9.304 -1.768 1.00 0.00 N ATOM 1135 CA ALA A 445 8.892 8.084 -0.985 1.00 0.00 C ATOM 1136 C ALA A 445 8.619 6.887 -1.887 1.00 0.00 C ATOM 1137 O ALA A 445 9.345 5.894 -1.855 1.00 0.00 O ATOM 1138 CB ALA A 445 7.777 8.240 0.038 1.00 0.00 C ATOM 0 H ALA A 445 8.169 9.821 -1.906 1.00 0.00 H new ATOM 0 HA ALA A 445 9.829 7.906 -0.458 1.00 0.00 H new ATOM 0 HB1 ALA A 445 7.681 7.320 0.615 1.00 0.00 H new ATOM 0 HB2 ALA A 445 8.012 9.066 0.709 1.00 0.00 H new ATOM 0 HB3 ALA A 445 6.838 8.445 -0.476 1.00 0.00 H new ATOM 1144 N MET A 446 7.567 6.989 -2.692 1.00 0.00 N ATOM 1145 CA MET A 446 7.196 5.916 -3.605 1.00 0.00 C ATOM 1146 C MET A 446 8.298 5.666 -4.630 1.00 0.00 C ATOM 1147 O MET A 446 8.469 4.546 -5.111 1.00 0.00 O ATOM 1148 CB MET A 446 5.882 6.252 -4.315 1.00 0.00 C ATOM 1149 CG MET A 446 5.993 7.406 -5.298 1.00 0.00 C ATOM 1150 SD MET A 446 6.024 6.856 -7.015 1.00 0.00 S ATOM 1151 CE MET A 446 4.382 6.159 -7.177 1.00 0.00 C ATOM 0 H MET A 446 6.956 7.805 -2.730 1.00 0.00 H new ATOM 0 HA MET A 446 7.060 5.006 -3.020 1.00 0.00 H new ATOM 0 HB2 MET A 446 5.530 5.367 -4.846 1.00 0.00 H new ATOM 0 HB3 MET A 446 5.128 6.496 -3.567 1.00 0.00 H new ATOM 0 HG2 MET A 446 5.152 8.084 -5.153 1.00 0.00 H new ATOM 0 HG3 MET A 446 6.899 7.973 -5.086 1.00 0.00 H new ATOM 0 HE1 MET A 446 4.063 6.217 -8.218 1.00 0.00 H new ATOM 0 HE2 MET A 446 4.396 5.116 -6.859 1.00 0.00 H new ATOM 0 HE3 MET A 446 3.686 6.719 -6.553 1.00 0.00 H new ATOM 1161 N GLN A 447 9.047 6.715 -4.959 1.00 0.00 N ATOM 1162 CA GLN A 447 10.136 6.606 -5.925 1.00 0.00 C ATOM 1163 C GLN A 447 11.270 5.754 -5.365 1.00 0.00 C ATOM 1164 O GLN A 447 12.137 5.292 -6.107 1.00 0.00 O ATOM 1165 CB GLN A 447 10.660 7.993 -6.297 1.00 0.00 C ATOM 1166 CG GLN A 447 11.386 8.031 -7.631 1.00 0.00 C ATOM 1167 CD GLN A 447 12.759 8.668 -7.531 1.00 0.00 C ATOM 1168 OE1 GLN A 447 13.013 9.490 -6.651 1.00 0.00 O ATOM 1169 NE2 GLN A 447 13.654 8.289 -8.437 1.00 0.00 N ATOM 0 H GLN A 447 8.920 7.650 -4.571 1.00 0.00 H new ATOM 0 HA GLN A 447 9.748 6.123 -6.822 1.00 0.00 H new ATOM 0 HB2 GLN A 447 9.824 8.692 -6.328 1.00 0.00 H new ATOM 0 HB3 GLN A 447 11.336 8.339 -5.515 1.00 0.00 H new ATOM 0 HG2 GLN A 447 11.488 7.016 -8.014 1.00 0.00 H new ATOM 0 HG3 GLN A 447 10.785 8.585 -8.352 1.00 0.00 H new ATOM 0 HE21 GLN A 447 13.400 7.604 -9.149 1.00 0.00 H new ATOM 0 HE22 GLN A 447 14.595 8.683 -8.420 1.00 0.00 H new ATOM 1178 N GLY A 448 11.254 5.554 -4.051 1.00 0.00 N ATOM 1179 CA GLY A 448 12.283 4.757 -3.409 1.00 0.00 C ATOM 1180 C GLY A 448 11.747 3.446 -2.868 1.00 0.00 C ATOM 1181 O GLY A 448 12.515 2.586 -2.436 1.00 0.00 O ATOM 0 H GLY A 448 10.547 5.930 -3.419 1.00 0.00 H new ATOM 0 HA2 GLY A 448 13.080 4.553 -4.125 1.00 0.00 H new ATOM 0 HA3 GLY A 448 12.726 5.329 -2.594 1.00 0.00 H new ATOM 1185 N LEU A 449 10.425 3.293 -2.893 1.00 0.00 N ATOM 1186 CA LEU A 449 9.787 2.076 -2.401 1.00 0.00 C ATOM 1187 C LEU A 449 9.511 1.105 -3.545 1.00 0.00 C ATOM 1188 O LEU A 449 9.339 -0.094 -3.325 1.00 0.00 O ATOM 1189 CB LEU A 449 8.482 2.413 -1.675 1.00 0.00 C ATOM 1190 CG LEU A 449 8.646 3.189 -0.365 1.00 0.00 C ATOM 1191 CD1 LEU A 449 7.289 3.597 0.185 1.00 0.00 C ATOM 1192 CD2 LEU A 449 9.408 2.359 0.657 1.00 0.00 C ATOM 0 H LEU A 449 9.776 3.996 -3.248 1.00 0.00 H new ATOM 0 HA LEU A 449 10.470 1.598 -1.699 1.00 0.00 H new ATOM 0 HB2 LEU A 449 7.851 2.995 -2.347 1.00 0.00 H new ATOM 0 HB3 LEU A 449 7.952 1.484 -1.464 1.00 0.00 H new ATOM 0 HG LEU A 449 9.221 4.092 -0.570 1.00 0.00 H new ATOM 0 HD11 LEU A 449 7.424 4.147 1.116 1.00 0.00 H new ATOM 0 HD12 LEU A 449 6.778 4.230 -0.540 1.00 0.00 H new ATOM 0 HD13 LEU A 449 6.690 2.706 0.374 1.00 0.00 H new ATOM 0 HD21 LEU A 449 9.514 2.927 1.581 1.00 0.00 H new ATOM 0 HD22 LEU A 449 8.861 1.438 0.859 1.00 0.00 H new ATOM 0 HD23 LEU A 449 10.396 2.116 0.265 1.00 0.00 H new ATOM 1204 N THR A 450 9.469 1.632 -4.765 1.00 0.00 N ATOM 1205 CA THR A 450 9.215 0.812 -5.943 1.00 0.00 C ATOM 1206 C THR A 450 10.460 0.028 -6.345 1.00 0.00 C ATOM 1207 O THR A 450 11.525 0.607 -6.562 1.00 0.00 O ATOM 1208 CB THR A 450 8.757 1.671 -7.138 1.00 0.00 C ATOM 1209 OG1 THR A 450 7.734 2.583 -6.723 1.00 0.00 O ATOM 1210 CG2 THR A 450 8.233 0.794 -8.266 1.00 0.00 C ATOM 0 H THR A 450 9.608 2.623 -4.963 1.00 0.00 H new ATOM 0 HA THR A 450 8.419 0.116 -5.678 1.00 0.00 H new ATOM 0 HB THR A 450 9.617 2.232 -7.504 1.00 0.00 H new ATOM 0 HG1 THR A 450 7.226 2.190 -5.983 1.00 0.00 H new ATOM 0 HG21 THR A 450 7.916 1.422 -9.098 1.00 0.00 H new ATOM 0 HG22 THR A 450 9.022 0.121 -8.600 1.00 0.00 H new ATOM 0 HG23 THR A 450 7.385 0.210 -7.909 1.00 0.00 H new ATOM 1218 N GLY A 451 10.317 -1.290 -6.441 1.00 0.00 N ATOM 1219 CA GLY A 451 11.438 -2.132 -6.817 1.00 0.00 C ATOM 1220 C GLY A 451 12.027 -2.878 -5.637 1.00 0.00 C ATOM 1221 O GLY A 451 12.812 -3.810 -5.812 1.00 0.00 O ATOM 0 H GLY A 451 9.445 -1.790 -6.265 1.00 0.00 H new ATOM 0 HA2 GLY A 451 11.112 -2.850 -7.570 1.00 0.00 H new ATOM 0 HA3 GLY A 451 12.212 -1.517 -7.276 1.00 0.00 H new ATOM 1225 N ARG A 452 11.648 -2.467 -4.430 1.00 0.00 N ATOM 1226 CA ARG A 452 12.142 -3.104 -3.216 1.00 0.00 C ATOM 1227 C ARG A 452 11.467 -4.460 -3.008 1.00 0.00 C ATOM 1228 O ARG A 452 11.056 -5.107 -3.971 1.00 0.00 O ATOM 1229 CB ARG A 452 11.901 -2.197 -2.007 1.00 0.00 C ATOM 1230 CG ARG A 452 12.253 -0.738 -2.261 1.00 0.00 C ATOM 1231 CD ARG A 452 13.758 -0.520 -2.271 1.00 0.00 C ATOM 1232 NE ARG A 452 14.360 -0.798 -0.970 1.00 0.00 N ATOM 1233 CZ ARG A 452 15.329 -0.061 -0.433 1.00 0.00 C ATOM 1234 NH1 ARG A 452 15.800 0.996 -1.081 1.00 0.00 N ATOM 1235 NH2 ARG A 452 15.826 -0.382 0.753 1.00 0.00 N ATOM 0 H ARG A 452 11.000 -1.696 -4.268 1.00 0.00 H new ATOM 0 HA ARG A 452 13.214 -3.267 -3.322 1.00 0.00 H new ATOM 0 HB2 ARG A 452 10.853 -2.264 -1.716 1.00 0.00 H new ATOM 0 HB3 ARG A 452 12.489 -2.563 -1.166 1.00 0.00 H new ATOM 0 HG2 ARG A 452 11.832 -0.422 -3.216 1.00 0.00 H new ATOM 0 HG3 ARG A 452 11.799 -0.114 -1.491 1.00 0.00 H new ATOM 0 HD2 ARG A 452 14.212 -1.162 -3.025 1.00 0.00 H new ATOM 0 HD3 ARG A 452 13.973 0.509 -2.557 1.00 0.00 H new ATOM 0 HE ARG A 452 14.019 -1.602 -0.443 1.00 0.00 H new ATOM 0 HH11 ARG A 452 15.419 1.246 -1.994 1.00 0.00 H new ATOM 0 HH12 ARG A 452 16.543 1.559 -0.667 1.00 0.00 H new ATOM 0 HH21 ARG A 452 15.466 -1.194 1.254 1.00 0.00 H new ATOM 0 HH22 ARG A 452 16.569 0.183 1.165 1.00 0.00 H new ATOM 1249 N LYS A 453 11.356 -4.886 -1.752 1.00 0.00 N ATOM 1250 CA LYS A 453 10.731 -6.168 -1.438 1.00 0.00 C ATOM 1251 C LYS A 453 10.298 -6.229 0.023 1.00 0.00 C ATOM 1252 O LYS A 453 11.127 -6.164 0.931 1.00 0.00 O ATOM 1253 CB LYS A 453 11.697 -7.314 -1.745 1.00 0.00 C ATOM 1254 CG LYS A 453 11.090 -8.409 -2.606 1.00 0.00 C ATOM 1255 CD LYS A 453 12.160 -9.234 -3.299 1.00 0.00 C ATOM 1256 CE LYS A 453 11.821 -9.468 -4.761 1.00 0.00 C ATOM 1257 NZ LYS A 453 11.391 -10.871 -5.015 1.00 0.00 N ATOM 0 H LYS A 453 11.688 -4.366 -0.940 1.00 0.00 H new ATOM 0 HA LYS A 453 9.842 -6.270 -2.060 1.00 0.00 H new ATOM 0 HB2 LYS A 453 12.575 -6.912 -2.250 1.00 0.00 H new ATOM 0 HB3 LYS A 453 12.040 -7.750 -0.807 1.00 0.00 H new ATOM 0 HG2 LYS A 453 10.473 -9.060 -1.986 1.00 0.00 H new ATOM 0 HG3 LYS A 453 10.433 -7.963 -3.353 1.00 0.00 H new ATOM 0 HD2 LYS A 453 13.120 -8.724 -3.224 1.00 0.00 H new ATOM 0 HD3 LYS A 453 12.268 -10.192 -2.791 1.00 0.00 H new ATOM 0 HE2 LYS A 453 11.027 -8.785 -5.063 1.00 0.00 H new ATOM 0 HE3 LYS A 453 12.691 -9.238 -5.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 453 11.267 -11.016 -6.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 453 12.115 -11.526 -4.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 453 10.490 -11.052 -4.528 1.00 0.00 H new ATOM 1271 N PHE A 454 8.991 -6.357 0.243 1.00 0.00 N ATOM 1272 CA PHE A 454 8.443 -6.433 1.593 1.00 0.00 C ATOM 1273 C PHE A 454 9.031 -7.623 2.345 1.00 0.00 C ATOM 1274 O PHE A 454 9.277 -7.550 3.549 1.00 0.00 O ATOM 1275 CB PHE A 454 6.916 -6.546 1.539 1.00 0.00 C ATOM 1276 CG PHE A 454 6.266 -6.660 2.889 1.00 0.00 C ATOM 1277 CD1 PHE A 454 5.987 -5.527 3.639 1.00 0.00 C ATOM 1278 CD2 PHE A 454 5.929 -7.900 3.409 1.00 0.00 C ATOM 1279 CE1 PHE A 454 5.386 -5.630 4.878 1.00 0.00 C ATOM 1280 CE2 PHE A 454 5.329 -8.009 4.648 1.00 0.00 C ATOM 1281 CZ PHE A 454 5.056 -6.872 5.384 1.00 0.00 C ATOM 0 H PHE A 454 8.292 -6.410 -0.498 1.00 0.00 H new ATOM 0 HA PHE A 454 8.711 -5.520 2.125 1.00 0.00 H new ATOM 0 HB2 PHE A 454 6.515 -5.672 1.026 1.00 0.00 H new ATOM 0 HB3 PHE A 454 6.647 -7.417 0.942 1.00 0.00 H new ATOM 0 HD1 PHE A 454 6.243 -4.553 3.249 1.00 0.00 H new ATOM 0 HD2 PHE A 454 6.138 -8.792 2.838 1.00 0.00 H new ATOM 0 HE1 PHE A 454 5.174 -4.740 5.451 1.00 0.00 H new ATOM 0 HE2 PHE A 454 5.073 -8.982 5.041 1.00 0.00 H new ATOM 0 HZ PHE A 454 4.586 -6.954 6.353 1.00 0.00 H new ATOM 1291 N ALA A 455 9.254 -8.716 1.623 1.00 0.00 N ATOM 1292 CA ALA A 455 9.816 -9.925 2.213 1.00 0.00 C ATOM 1293 C ALA A 455 10.393 -10.837 1.136 1.00 0.00 C ATOM 1294 O ALA A 455 11.538 -11.281 1.231 1.00 0.00 O ATOM 1295 CB ALA A 455 8.757 -10.660 3.020 1.00 0.00 C ATOM 0 H ALA A 455 9.053 -8.789 0.626 1.00 0.00 H new ATOM 0 HA ALA A 455 10.626 -9.634 2.882 1.00 0.00 H new ATOM 0 HB1 ALA A 455 9.191 -11.561 3.455 1.00 0.00 H new ATOM 0 HB2 ALA A 455 8.392 -10.012 3.817 1.00 0.00 H new ATOM 0 HB3 ALA A 455 7.928 -10.935 2.368 1.00 0.00 H new ATOM 1301 N ASN A 456 9.591 -11.111 0.111 1.00 0.00 N ATOM 1302 CA ASN A 456 10.019 -11.969 -0.988 1.00 0.00 C ATOM 1303 C ASN A 456 9.201 -11.687 -2.244 1.00 0.00 C ATOM 1304 O ASN A 456 9.061 -12.547 -3.115 1.00 0.00 O ATOM 1305 CB ASN A 456 9.888 -13.443 -0.597 1.00 0.00 C ATOM 1306 CG ASN A 456 8.443 -13.888 -0.490 1.00 0.00 C ATOM 1307 OD1 ASN A 456 7.886 -14.458 -1.428 1.00 0.00 O ATOM 1308 ND2 ASN A 456 7.828 -13.628 0.658 1.00 0.00 N ATOM 0 H ASN A 456 8.641 -10.751 0.019 1.00 0.00 H new ATOM 0 HA ASN A 456 11.066 -11.752 -1.200 1.00 0.00 H new ATOM 0 HB2 ASN A 456 10.401 -14.059 -1.336 1.00 0.00 H new ATOM 0 HB3 ASN A 456 10.388 -13.608 0.358 1.00 0.00 H new ATOM 0 HD21 ASN A 456 6.855 -13.903 0.789 1.00 0.00 H new ATOM 0 HD22 ASN A 456 8.329 -13.153 1.409 1.00 0.00 H new ATOM 1315 N ARG A 457 8.664 -10.474 -2.331 1.00 0.00 N ATOM 1316 CA ARG A 457 7.859 -10.067 -3.476 1.00 0.00 C ATOM 1317 C ARG A 457 8.000 -8.570 -3.715 1.00 0.00 C ATOM 1318 O ARG A 457 7.930 -7.775 -2.778 1.00 0.00 O ATOM 1319 CB ARG A 457 6.384 -10.427 -3.263 1.00 0.00 C ATOM 1320 CG ARG A 457 6.041 -10.814 -1.831 1.00 0.00 C ATOM 1321 CD ARG A 457 5.950 -9.592 -0.932 1.00 0.00 C ATOM 1322 NE ARG A 457 4.637 -9.472 -0.301 1.00 0.00 N ATOM 1323 CZ ARG A 457 4.296 -10.101 0.819 1.00 0.00 C ATOM 1324 NH1 ARG A 457 5.165 -10.895 1.432 1.00 0.00 N ATOM 1325 NH2 ARG A 457 3.082 -9.936 1.330 1.00 0.00 N ATOM 0 H ARG A 457 8.773 -9.753 -1.618 1.00 0.00 H new ATOM 0 HA ARG A 457 8.221 -10.603 -4.353 1.00 0.00 H new ATOM 0 HB2 ARG A 457 5.767 -9.577 -3.556 1.00 0.00 H new ATOM 0 HB3 ARG A 457 6.123 -11.253 -3.924 1.00 0.00 H new ATOM 0 HG2 ARG A 457 5.092 -11.351 -1.815 1.00 0.00 H new ATOM 0 HG3 ARG A 457 6.799 -11.495 -1.445 1.00 0.00 H new ATOM 0 HD2 ARG A 457 6.718 -9.651 -0.161 1.00 0.00 H new ATOM 0 HD3 ARG A 457 6.154 -8.695 -1.517 1.00 0.00 H new ATOM 0 HE ARG A 457 3.943 -8.871 -0.746 1.00 0.00 H new ATOM 0 HH11 ARG A 457 6.099 -11.025 1.044 1.00 0.00 H new ATOM 0 HH12 ARG A 457 4.899 -11.376 2.291 1.00 0.00 H new ATOM 0 HH21 ARG A 457 2.411 -9.326 0.863 1.00 0.00 H new ATOM 0 HH22 ARG A 457 2.821 -10.419 2.190 1.00 0.00 H new ATOM 1339 N VAL A 458 8.203 -8.191 -4.971 1.00 0.00 N ATOM 1340 CA VAL A 458 8.363 -6.785 -5.324 1.00 0.00 C ATOM 1341 C VAL A 458 7.154 -5.969 -4.886 1.00 0.00 C ATOM 1342 O VAL A 458 6.016 -6.295 -5.222 1.00 0.00 O ATOM 1343 CB VAL A 458 8.579 -6.587 -6.837 1.00 0.00 C ATOM 1344 CG1 VAL A 458 9.426 -5.352 -7.086 1.00 0.00 C ATOM 1345 CG2 VAL A 458 9.226 -7.816 -7.460 1.00 0.00 C ATOM 0 H VAL A 458 8.261 -8.835 -5.760 1.00 0.00 H new ATOM 0 HA VAL A 458 9.252 -6.436 -4.798 1.00 0.00 H new ATOM 0 HB VAL A 458 7.606 -6.446 -7.308 1.00 0.00 H new ATOM 0 HG11 VAL A 458 9.573 -5.221 -8.158 1.00 0.00 H new ATOM 0 HG12 VAL A 458 8.920 -4.476 -6.680 1.00 0.00 H new ATOM 0 HG13 VAL A 458 10.394 -5.471 -6.599 1.00 0.00 H new ATOM 0 HG21 VAL A 458 9.368 -7.651 -8.528 1.00 0.00 H new ATOM 0 HG22 VAL A 458 10.193 -7.996 -6.989 1.00 0.00 H new ATOM 0 HG23 VAL A 458 8.582 -8.682 -7.309 1.00 0.00 H new ATOM 1355 N VAL A 459 7.411 -4.906 -4.132 1.00 0.00 N ATOM 1356 CA VAL A 459 6.345 -4.042 -3.641 1.00 0.00 C ATOM 1357 C VAL A 459 5.839 -3.116 -4.740 1.00 0.00 C ATOM 1358 O VAL A 459 6.625 -2.475 -5.438 1.00 0.00 O ATOM 1359 CB VAL A 459 6.812 -3.191 -2.444 1.00 0.00 C ATOM 1360 CG1 VAL A 459 5.622 -2.748 -1.609 1.00 0.00 C ATOM 1361 CG2 VAL A 459 7.811 -3.962 -1.594 1.00 0.00 C ATOM 0 H VAL A 459 8.349 -4.622 -3.848 1.00 0.00 H new ATOM 0 HA VAL A 459 5.535 -4.696 -3.316 1.00 0.00 H new ATOM 0 HB VAL A 459 7.310 -2.301 -2.828 1.00 0.00 H new ATOM 0 HG11 VAL A 459 5.971 -2.148 -0.768 1.00 0.00 H new ATOM 0 HG12 VAL A 459 4.947 -2.153 -2.224 1.00 0.00 H new ATOM 0 HG13 VAL A 459 5.094 -3.625 -1.235 1.00 0.00 H new ATOM 0 HG21 VAL A 459 8.128 -3.343 -0.754 1.00 0.00 H new ATOM 0 HG22 VAL A 459 7.343 -4.872 -1.218 1.00 0.00 H new ATOM 0 HG23 VAL A 459 8.679 -4.224 -2.200 1.00 0.00 H new ATOM 1371 N VAL A 460 4.520 -3.055 -4.890 1.00 0.00 N ATOM 1372 CA VAL A 460 3.903 -2.206 -5.902 1.00 0.00 C ATOM 1373 C VAL A 460 3.278 -0.966 -5.269 1.00 0.00 C ATOM 1374 O VAL A 460 2.107 -0.975 -4.887 1.00 0.00 O ATOM 1375 CB VAL A 460 2.824 -2.972 -6.693 1.00 0.00 C ATOM 1376 CG1 VAL A 460 2.193 -2.079 -7.750 1.00 0.00 C ATOM 1377 CG2 VAL A 460 3.416 -4.223 -7.325 1.00 0.00 C ATOM 0 H VAL A 460 3.857 -3.584 -4.323 1.00 0.00 H new ATOM 0 HA VAL A 460 4.693 -1.899 -6.588 1.00 0.00 H new ATOM 0 HB VAL A 460 2.041 -3.276 -5.999 1.00 0.00 H new ATOM 0 HG11 VAL A 460 1.435 -2.641 -8.295 1.00 0.00 H new ATOM 0 HG12 VAL A 460 1.730 -1.217 -7.269 1.00 0.00 H new ATOM 0 HG13 VAL A 460 2.961 -1.738 -8.444 1.00 0.00 H new ATOM 0 HG21 VAL A 460 2.641 -4.752 -7.880 1.00 0.00 H new ATOM 0 HG22 VAL A 460 4.221 -3.942 -8.004 1.00 0.00 H new ATOM 0 HG23 VAL A 460 3.811 -4.873 -6.544 1.00 0.00 H new ATOM 1387 N THR A 461 4.068 0.097 -5.158 1.00 0.00 N ATOM 1388 CA THR A 461 3.591 1.346 -4.574 1.00 0.00 C ATOM 1389 C THR A 461 2.997 2.257 -5.642 1.00 0.00 C ATOM 1390 O THR A 461 3.480 2.300 -6.774 1.00 0.00 O ATOM 1391 CB THR A 461 4.722 2.098 -3.848 1.00 0.00 C ATOM 1392 OG1 THR A 461 5.786 2.387 -4.762 1.00 0.00 O ATOM 1393 CG2 THR A 461 5.258 1.277 -2.684 1.00 0.00 C ATOM 0 H THR A 461 5.041 0.119 -5.464 1.00 0.00 H new ATOM 0 HA THR A 461 2.819 1.082 -3.851 1.00 0.00 H new ATOM 0 HB THR A 461 4.315 3.031 -3.459 1.00 0.00 H new ATOM 0 HG1 THR A 461 6.500 2.867 -4.292 1.00 0.00 H new ATOM 0 HG21 THR A 461 6.056 1.829 -2.187 1.00 0.00 H new ATOM 0 HG22 THR A 461 4.454 1.083 -1.974 1.00 0.00 H new ATOM 0 HG23 THR A 461 5.649 0.330 -3.056 1.00 0.00 H new ATOM 1401 N LYS A 462 1.947 2.984 -5.275 1.00 0.00 N ATOM 1402 CA LYS A 462 1.284 3.892 -6.204 1.00 0.00 C ATOM 1403 C LYS A 462 0.746 5.122 -5.476 1.00 0.00 C ATOM 1404 O LYS A 462 1.136 5.405 -4.345 1.00 0.00 O ATOM 1405 CB LYS A 462 0.143 3.167 -6.921 1.00 0.00 C ATOM 1406 CG LYS A 462 0.550 2.550 -8.248 1.00 0.00 C ATOM 1407 CD LYS A 462 0.159 3.438 -9.418 1.00 0.00 C ATOM 1408 CE LYS A 462 1.289 4.377 -9.805 1.00 0.00 C ATOM 1409 NZ LYS A 462 0.843 5.797 -9.839 1.00 0.00 N ATOM 0 H LYS A 462 1.537 2.962 -4.341 1.00 0.00 H new ATOM 0 HA LYS A 462 2.017 4.224 -6.939 1.00 0.00 H new ATOM 0 HB2 LYS A 462 -0.244 2.383 -6.270 1.00 0.00 H new ATOM 0 HB3 LYS A 462 -0.672 3.870 -7.092 1.00 0.00 H new ATOM 0 HG2 LYS A 462 1.627 2.386 -8.259 1.00 0.00 H new ATOM 0 HG3 LYS A 462 0.077 1.574 -8.357 1.00 0.00 H new ATOM 0 HD2 LYS A 462 -0.109 2.818 -10.273 1.00 0.00 H new ATOM 0 HD3 LYS A 462 -0.725 4.019 -9.156 1.00 0.00 H new ATOM 0 HE2 LYS A 462 2.109 4.271 -9.095 1.00 0.00 H new ATOM 0 HE3 LYS A 462 1.677 4.095 -10.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 462 1.643 6.406 -10.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 462 0.078 5.904 -10.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 462 0.497 6.075 -8.899 1.00 0.00 H new ATOM 1423 N TYR A 463 -0.147 5.850 -6.139 1.00 0.00 N ATOM 1424 CA TYR A 463 -0.745 7.047 -5.560 1.00 0.00 C ATOM 1425 C TYR A 463 -2.236 6.838 -5.316 1.00 0.00 C ATOM 1426 O TYR A 463 -2.901 6.125 -6.068 1.00 0.00 O ATOM 1427 CB TYR A 463 -0.531 8.248 -6.483 1.00 0.00 C ATOM 1428 CG TYR A 463 0.581 9.169 -6.032 1.00 0.00 C ATOM 1429 CD1 TYR A 463 0.509 9.833 -4.813 1.00 0.00 C ATOM 1430 CD2 TYR A 463 1.702 9.376 -6.827 1.00 0.00 C ATOM 1431 CE1 TYR A 463 1.524 10.676 -4.400 1.00 0.00 C ATOM 1432 CE2 TYR A 463 2.719 10.216 -6.420 1.00 0.00 C ATOM 1433 CZ TYR A 463 2.625 10.864 -5.207 1.00 0.00 C ATOM 1434 OH TYR A 463 3.637 11.702 -4.798 1.00 0.00 O ATOM 0 H TYR A 463 -0.473 5.631 -7.080 1.00 0.00 H new ATOM 0 HA TYR A 463 -0.259 7.244 -4.604 1.00 0.00 H new ATOM 0 HB2 TYR A 463 -0.308 7.888 -7.488 1.00 0.00 H new ATOM 0 HB3 TYR A 463 -1.459 8.817 -6.546 1.00 0.00 H new ATOM 0 HD1 TYR A 463 -0.353 9.688 -4.179 1.00 0.00 H new ATOM 0 HD2 TYR A 463 1.779 8.871 -7.779 1.00 0.00 H new ATOM 0 HE1 TYR A 463 1.454 11.185 -3.450 1.00 0.00 H new ATOM 0 HE2 TYR A 463 3.584 10.365 -7.049 1.00 0.00 H new ATOM 0 HH TYR A 463 3.743 12.428 -5.447 1.00 0.00 H new ATOM 1444 N CYS A 464 -2.758 7.462 -4.262 1.00 0.00 N ATOM 1445 CA CYS A 464 -4.172 7.333 -3.926 1.00 0.00 C ATOM 1446 C CYS A 464 -4.774 8.681 -3.535 1.00 0.00 C ATOM 1447 O CYS A 464 -4.090 9.549 -2.983 1.00 0.00 O ATOM 1448 CB CYS A 464 -4.357 6.325 -2.790 1.00 0.00 C ATOM 1449 SG CYS A 464 -5.098 4.758 -3.308 1.00 0.00 S ATOM 0 H CYS A 464 -2.225 8.059 -3.629 1.00 0.00 H new ATOM 0 HA CYS A 464 -4.695 6.973 -4.812 1.00 0.00 H new ATOM 0 HB2 CYS A 464 -3.387 6.123 -2.336 1.00 0.00 H new ATOM 0 HB3 CYS A 464 -4.983 6.774 -2.019 1.00 0.00 H new ATOM 0 HG CYS A 464 -5.212 3.971 -2.280 1.00 0.00 H new ATOM 1455 N ASP A 465 -6.063 8.846 -3.824 1.00 0.00 N ATOM 1456 CA ASP A 465 -6.770 10.083 -3.516 1.00 0.00 C ATOM 1457 C ASP A 465 -7.211 10.119 -2.052 1.00 0.00 C ATOM 1458 O ASP A 465 -7.826 9.171 -1.565 1.00 0.00 O ATOM 1459 CB ASP A 465 -7.989 10.234 -4.428 1.00 0.00 C ATOM 1460 CG ASP A 465 -7.973 11.536 -5.207 1.00 0.00 C ATOM 1461 OD1 ASP A 465 -8.137 12.604 -4.580 1.00 0.00 O ATOM 1462 OD2 ASP A 465 -7.796 11.487 -6.441 1.00 0.00 O ATOM 0 H ASP A 465 -6.639 8.134 -4.273 1.00 0.00 H new ATOM 0 HA ASP A 465 -6.084 10.913 -3.687 1.00 0.00 H new ATOM 0 HB2 ASP A 465 -8.023 9.397 -5.126 1.00 0.00 H new ATOM 0 HB3 ASP A 465 -8.897 10.185 -3.827 1.00 0.00 H new ATOM 1467 N PRO A 466 -6.901 11.215 -1.328 1.00 0.00 N ATOM 1468 CA PRO A 466 -7.277 11.367 0.081 1.00 0.00 C ATOM 1469 C PRO A 466 -8.771 11.165 0.303 1.00 0.00 C ATOM 1470 O PRO A 466 -9.190 10.661 1.346 1.00 0.00 O ATOM 1471 CB PRO A 466 -6.878 12.811 0.421 1.00 0.00 C ATOM 1472 CG PRO A 466 -6.592 13.470 -0.883 1.00 0.00 C ATOM 1473 CD PRO A 466 -6.155 12.383 -1.815 1.00 0.00 C ATOM 0 HA PRO A 466 -6.786 10.623 0.709 1.00 0.00 H new ATOM 0 HB2 PRO A 466 -7.681 13.324 0.951 1.00 0.00 H new ATOM 0 HB3 PRO A 466 -6.003 12.832 1.070 1.00 0.00 H new ATOM 0 HG2 PRO A 466 -7.478 13.977 -1.265 1.00 0.00 H new ATOM 0 HG3 PRO A 466 -5.814 14.226 -0.775 1.00 0.00 H new ATOM 0 HD2 PRO A 466 -6.400 12.616 -2.851 1.00 0.00 H new ATOM 0 HD3 PRO A 466 -5.078 12.222 -1.771 1.00 0.00 H new ATOM 1481 N ASP A 467 -9.572 11.564 -0.680 1.00 0.00 N ATOM 1482 CA ASP A 467 -11.020 11.421 -0.591 1.00 0.00 C ATOM 1483 C ASP A 467 -11.407 9.951 -0.477 1.00 0.00 C ATOM 1484 O ASP A 467 -12.050 9.543 0.492 1.00 0.00 O ATOM 1485 CB ASP A 467 -11.696 12.047 -1.813 1.00 0.00 C ATOM 1486 CG ASP A 467 -11.907 13.540 -1.657 1.00 0.00 C ATOM 1487 OD1 ASP A 467 -10.902 14.275 -1.573 1.00 0.00 O ATOM 1488 OD2 ASP A 467 -13.078 13.973 -1.618 1.00 0.00 O ATOM 0 H ASP A 467 -9.242 11.989 -1.547 1.00 0.00 H new ATOM 0 HA ASP A 467 -11.360 11.942 0.304 1.00 0.00 H new ATOM 0 HB2 ASP A 467 -11.087 11.860 -2.697 1.00 0.00 H new ATOM 0 HB3 ASP A 467 -12.658 11.563 -1.980 1.00 0.00 H new ATOM 1493 N SER A 468 -11.010 9.161 -1.470 1.00 0.00 N ATOM 1494 CA SER A 468 -11.309 7.735 -1.478 1.00 0.00 C ATOM 1495 C SER A 468 -10.757 7.069 -0.222 1.00 0.00 C ATOM 1496 O SER A 468 -11.346 6.125 0.305 1.00 0.00 O ATOM 1497 CB SER A 468 -10.718 7.071 -2.723 1.00 0.00 C ATOM 1498 OG SER A 468 -9.539 7.736 -3.145 1.00 0.00 O ATOM 0 H SER A 468 -10.480 9.485 -2.279 1.00 0.00 H new ATOM 0 HA SER A 468 -12.392 7.612 -1.495 1.00 0.00 H new ATOM 0 HB2 SER A 468 -10.493 6.026 -2.510 1.00 0.00 H new ATOM 0 HB3 SER A 468 -11.453 7.081 -3.528 1.00 0.00 H new ATOM 0 HG SER A 468 -9.058 8.078 -2.362 1.00 0.00 H new ATOM 1504 N TYR A 469 -9.623 7.572 0.253 1.00 0.00 N ATOM 1505 CA TYR A 469 -8.992 7.039 1.445 1.00 0.00 C ATOM 1506 C TYR A 469 -9.934 7.158 2.637 1.00 0.00 C ATOM 1507 O TYR A 469 -10.174 6.186 3.355 1.00 0.00 O ATOM 1508 CB TYR A 469 -7.689 7.796 1.722 1.00 0.00 C ATOM 1509 CG TYR A 469 -7.154 7.595 3.119 1.00 0.00 C ATOM 1510 CD1 TYR A 469 -7.665 8.313 4.190 1.00 0.00 C ATOM 1511 CD2 TYR A 469 -6.147 6.678 3.365 1.00 0.00 C ATOM 1512 CE1 TYR A 469 -7.188 8.122 5.467 1.00 0.00 C ATOM 1513 CE2 TYR A 469 -5.663 6.478 4.640 1.00 0.00 C ATOM 1514 CZ TYR A 469 -6.187 7.201 5.690 1.00 0.00 C ATOM 1515 OH TYR A 469 -5.707 7.005 6.965 1.00 0.00 O ATOM 0 H TYR A 469 -9.123 8.352 -0.175 1.00 0.00 H new ATOM 0 HA TYR A 469 -8.764 5.985 1.287 1.00 0.00 H new ATOM 0 HB2 TYR A 469 -6.934 7.476 1.004 1.00 0.00 H new ATOM 0 HB3 TYR A 469 -7.856 8.860 1.556 1.00 0.00 H new ATOM 0 HD1 TYR A 469 -8.451 9.034 4.019 1.00 0.00 H new ATOM 0 HD2 TYR A 469 -5.734 6.110 2.545 1.00 0.00 H new ATOM 0 HE1 TYR A 469 -7.596 8.691 6.290 1.00 0.00 H new ATOM 0 HE2 TYR A 469 -4.877 5.758 4.815 1.00 0.00 H new ATOM 0 HH TYR A 469 -6.403 6.589 7.516 1.00 0.00 H new ATOM 1525 N HIS A 470 -10.455 8.363 2.839 1.00 0.00 N ATOM 1526 CA HIS A 470 -11.371 8.637 3.941 1.00 0.00 C ATOM 1527 C HIS A 470 -12.543 7.662 3.943 1.00 0.00 C ATOM 1528 O HIS A 470 -12.889 7.096 4.980 1.00 0.00 O ATOM 1529 CB HIS A 470 -11.891 10.072 3.854 1.00 0.00 C ATOM 1530 CG HIS A 470 -10.929 11.095 4.373 1.00 0.00 C ATOM 1531 ND1 HIS A 470 -10.339 12.049 3.570 1.00 0.00 N ATOM 1532 CD2 HIS A 470 -10.454 11.312 5.622 1.00 0.00 C ATOM 1533 CE1 HIS A 470 -9.544 12.808 4.303 1.00 0.00 C ATOM 1534 NE2 HIS A 470 -9.597 12.382 5.551 1.00 0.00 N ATOM 0 H HIS A 470 -10.257 9.171 2.249 1.00 0.00 H new ATOM 0 HA HIS A 470 -10.819 8.509 4.872 1.00 0.00 H new ATOM 0 HB2 HIS A 470 -12.125 10.301 2.814 1.00 0.00 H new ATOM 0 HB3 HIS A 470 -12.823 10.146 4.415 1.00 0.00 H new ATOM 0 HD1 HIS A 470 -10.493 12.152 2.567 1.00 0.00 H new ATOM 0 HD2 HIS A 470 -10.703 10.748 6.509 1.00 0.00 H new ATOM 0 HE1 HIS A 470 -8.952 13.636 3.942 1.00 0.00 H new ATOM 1543 N ARG A 471 -13.150 7.469 2.776 1.00 0.00 N ATOM 1544 CA ARG A 471 -14.289 6.564 2.651 1.00 0.00 C ATOM 1545 C ARG A 471 -13.833 5.116 2.522 1.00 0.00 C ATOM 1546 O ARG A 471 -14.658 4.204 2.442 1.00 0.00 O ATOM 1547 CB ARG A 471 -15.154 6.940 1.445 1.00 0.00 C ATOM 1548 CG ARG A 471 -14.372 7.534 0.288 1.00 0.00 C ATOM 1549 CD ARG A 471 -15.209 7.605 -0.982 1.00 0.00 C ATOM 1550 NE ARG A 471 -16.626 7.363 -0.724 1.00 0.00 N ATOM 1551 CZ ARG A 471 -17.576 8.279 -0.892 1.00 0.00 C ATOM 1552 NH1 ARG A 471 -17.263 9.495 -1.321 1.00 0.00 N ATOM 1553 NH2 ARG A 471 -18.841 7.979 -0.630 1.00 0.00 N ATOM 0 H ARG A 471 -12.874 7.925 1.906 1.00 0.00 H new ATOM 0 HA ARG A 471 -14.883 6.662 3.560 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -15.680 6.051 1.097 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -15.912 7.655 1.763 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -14.031 8.534 0.555 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -13.482 6.932 0.104 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -15.088 8.586 -1.441 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -14.841 6.871 -1.699 1.00 0.00 H new ATOM 0 HE ARG A 471 -16.903 6.438 -0.396 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -16.291 9.730 -1.523 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -17.994 10.195 -1.449 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -19.086 7.046 -0.300 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -19.569 8.682 -0.759 1.00 0.00 H new ATOM 1567 N ARG A 472 -12.519 4.908 2.496 1.00 0.00 N ATOM 1568 CA ARG A 472 -11.962 3.567 2.369 1.00 0.00 C ATOM 1569 C ARG A 472 -12.443 2.913 1.078 1.00 0.00 C ATOM 1570 O ARG A 472 -12.426 1.690 0.943 1.00 0.00 O ATOM 1571 CB ARG A 472 -12.350 2.703 3.572 1.00 0.00 C ATOM 1572 CG ARG A 472 -12.010 3.336 4.912 1.00 0.00 C ATOM 1573 CD ARG A 472 -11.218 2.383 5.792 1.00 0.00 C ATOM 1574 NE ARG A 472 -11.469 2.610 7.212 1.00 0.00 N ATOM 1575 CZ ARG A 472 -11.300 1.680 8.149 1.00 0.00 C ATOM 1576 NH1 ARG A 472 -10.889 0.464 7.813 1.00 0.00 N ATOM 1577 NH2 ARG A 472 -11.546 1.964 9.421 1.00 0.00 N ATOM 0 H ARG A 472 -11.822 5.650 2.561 1.00 0.00 H new ATOM 0 HA ARG A 472 -10.876 3.651 2.339 1.00 0.00 H new ATOM 0 HB2 ARG A 472 -13.421 2.504 3.535 1.00 0.00 H new ATOM 0 HB3 ARG A 472 -11.844 1.741 3.496 1.00 0.00 H new ATOM 0 HG2 ARG A 472 -11.434 4.247 4.750 1.00 0.00 H new ATOM 0 HG3 ARG A 472 -12.928 3.626 5.422 1.00 0.00 H new ATOM 0 HD2 ARG A 472 -11.478 1.355 5.538 1.00 0.00 H new ATOM 0 HD3 ARG A 472 -10.154 2.502 5.589 1.00 0.00 H new ATOM 0 HE ARG A 472 -11.792 3.533 7.502 1.00 0.00 H new ATOM 0 HH11 ARG A 472 -10.702 0.241 6.835 1.00 0.00 H new ATOM 0 HH12 ARG A 472 -10.760 -0.248 8.532 1.00 0.00 H new ATOM 0 HH21 ARG A 472 -11.865 2.897 9.683 1.00 0.00 H new ATOM 0 HH22 ARG A 472 -11.416 1.250 10.137 1.00 0.00 H new ATOM 1591 N ASP A 473 -12.882 3.745 0.134 1.00 0.00 N ATOM 1592 CA ASP A 473 -13.368 3.262 -1.153 1.00 0.00 C ATOM 1593 C ASP A 473 -12.310 2.416 -1.857 1.00 0.00 C ATOM 1594 O ASP A 473 -12.624 1.649 -2.767 1.00 0.00 O ATOM 1595 CB ASP A 473 -13.765 4.442 -2.043 1.00 0.00 C ATOM 1596 CG ASP A 473 -15.144 4.271 -2.651 1.00 0.00 C ATOM 1597 OD1 ASP A 473 -16.137 4.338 -1.898 1.00 0.00 O ATOM 1598 OD2 ASP A 473 -15.229 4.073 -3.882 1.00 0.00 O ATOM 0 H ASP A 473 -12.910 4.759 0.239 1.00 0.00 H new ATOM 0 HA ASP A 473 -14.242 2.637 -0.971 1.00 0.00 H new ATOM 0 HB2 ASP A 473 -13.741 5.360 -1.456 1.00 0.00 H new ATOM 0 HB3 ASP A 473 -13.031 4.555 -2.841 1.00 0.00 H new ATOM 1823 N TRP B 22 12.593 -4.135 2.994 1.00 0.00 N ATOM 1824 CA TRP B 22 12.657 -3.612 1.634 1.00 0.00 C ATOM 1825 C TRP B 22 13.888 -4.144 0.908 1.00 0.00 C ATOM 1826 O TRP B 22 14.683 -3.377 0.364 1.00 0.00 O ATOM 1827 CB TRP B 22 12.673 -2.081 1.653 1.00 0.00 C ATOM 1828 CG TRP B 22 11.518 -1.486 2.403 1.00 0.00 C ATOM 1829 CD1 TRP B 22 11.517 -1.059 3.699 1.00 0.00 C ATOM 1830 CD2 TRP B 22 10.196 -1.255 1.902 1.00 0.00 C ATOM 1831 NE1 TRP B 22 10.276 -0.578 4.036 1.00 0.00 N ATOM 1832 CE2 TRP B 22 9.447 -0.687 2.950 1.00 0.00 C ATOM 1833 CE3 TRP B 22 9.572 -1.474 0.671 1.00 0.00 C ATOM 1834 CZ2 TRP B 22 8.108 -0.333 2.803 1.00 0.00 C ATOM 1835 CZ3 TRP B 22 8.242 -1.123 0.526 1.00 0.00 C ATOM 1836 CH2 TRP B 22 7.524 -0.559 1.587 1.00 0.00 C ATOM 0 HA TRP B 22 11.770 -3.947 1.097 1.00 0.00 H new ATOM 0 HB2 TRP B 22 13.605 -1.740 2.104 1.00 0.00 H new ATOM 0 HB3 TRP B 22 12.661 -1.711 0.628 1.00 0.00 H new ATOM 0 HD1 TRP B 22 12.368 -1.094 4.363 1.00 0.00 H new ATOM 0 HE1 TRP B 22 10.014 -0.201 4.947 1.00 0.00 H new ATOM 0 HE3 TRP B 22 10.118 -1.910 -0.152 1.00 0.00 H new ATOM 0 HZ2 TRP B 22 7.551 0.104 3.619 1.00 0.00 H new ATOM 0 HZ3 TRP B 22 7.750 -1.287 -0.421 1.00 0.00 H new ATOM 0 HH2 TRP B 22 6.486 -0.297 1.442 1.00 0.00 H new ATOM 1847 N ASN B 23 14.038 -5.465 0.905 1.00 0.00 N ATOM 1848 CA ASN B 23 15.171 -6.108 0.246 1.00 0.00 C ATOM 1849 C ASN B 23 14.938 -6.212 -1.258 1.00 0.00 C ATOM 1850 O ASN B 23 14.165 -5.443 -1.830 1.00 0.00 O ATOM 1851 CB ASN B 23 15.407 -7.499 0.839 1.00 0.00 C ATOM 1852 CG ASN B 23 16.843 -7.705 1.278 1.00 0.00 C ATOM 1853 OD1 ASN B 23 17.491 -8.677 0.889 1.00 0.00 O ATOM 1854 ND2 ASN B 23 17.351 -6.786 2.092 1.00 0.00 N ATOM 0 H ASN B 23 13.389 -6.112 1.352 1.00 0.00 H new ATOM 0 HA ASN B 23 16.056 -5.495 0.414 1.00 0.00 H new ATOM 0 HB2 ASN B 23 14.745 -7.644 1.693 1.00 0.00 H new ATOM 0 HB3 ASN B 23 15.144 -8.255 0.100 1.00 0.00 H new ATOM 0 HD21 ASN B 23 18.313 -6.870 2.419 1.00 0.00 H new ATOM 0 HD22 ASN B 23 16.779 -5.996 2.390 1.00 0.00 H new