USER MOD reduce.3.24.130724 H: found=0, std=0, add=576, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 577 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 470 TYR OH : rot 180:sc= 0.042 USER MOD Set 1.2: A 474 LYS NZ :NH3+ -178:sc= 0.834 (180deg=0.624) USER MOD Set 2.1: A 473 THR OG1 : rot -35:sc= 1.01 USER MOD Set 2.2: A 479 TYR OH : rot 64:sc= 0.59 USER MOD Set 3.1: A 424 LYS NZ :NH3+ -152:sc= 0.971 (180deg=0) USER MOD Set 3.2: A 427 GLN : amide:sc= -2.85 K(o=-1.9,f=-8.8!) USER MOD Set 4.1: A 421 LYS NZ :NH3+ -118:sc= -0.0344 (180deg=-0.0374) USER MOD Set 4.2: A 423 TYR OH : rot 180:sc= 0 USER MOD Single : A 413 ASN : amide:sc= 0 X(o=0,f=0.19) USER MOD Single : A 416 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 420 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 429 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 431 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 433 SER OG : rot 180:sc= 0.0187 USER MOD Single : A 435 GLN : amide:sc= -0.0457 X(o=-0.046,f=-0.0071) USER MOD Single : A 437 LYS NZ :NH3+ 141:sc= 0.00574 (180deg=-0.263) USER MOD Single : A 439 THR OG1 : rot -93:sc= -2.27 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.417 X(o=-0.42,f=-0.045) USER MOD Single : A 447 HIS :FLIP no HE2:sc= -11.9! C(o=-13!,f=-12!) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 ASN : amide:sc= -3.68! C(o=-3.7!,f=-13!) USER MOD Single : A 456 SER OG : rot 92:sc= 1.15 USER MOD Single : A 461 LYS NZ :NH3+ 153:sc= -0.41 (180deg=-2.31!) USER MOD Single : A 462 THR OG1 : rot 180:sc= -2.58 USER MOD Single : A 466 CYS SG : rot -29:sc= 0.294 USER MOD Single : A 469 TYR OH : rot -98:sc= -3.12! USER MOD Single : A 471 TYR OH : rot 180:sc= 0 USER MOD Single : A 475 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0986) USER MOD Single : A 476 ASN : amide:sc= -0.0338 X(o=-0.034,f=0) USER MOD Single : A 478 ASN : amide:sc= -0.0628 K(o=-0.063,f=-1.2) USER MOD Single : A 480 LYS NZ :NH3+ -146:sc= 0.645 (180deg=0.16) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 413 1.315 1.368 21.793 1.00 10.00 N ATOM 2 CA ASN A 413 2.610 0.992 21.235 1.00 10.00 C ATOM 3 C ASN A 413 2.779 -0.524 21.227 1.00 10.00 C ATOM 4 O ASN A 413 2.825 -1.159 22.279 1.00 10.00 O ATOM 5 CB ASN A 413 3.741 1.639 22.037 1.00 10.00 C ATOM 6 CG ASN A 413 5.005 1.808 21.218 1.00 10.00 C ATOM 7 OD1 ASN A 413 5.667 0.832 20.866 1.00 10.00 O ATOM 8 ND2 ASN A 413 5.348 3.054 20.911 1.00 10.00 N ATOM 0 HA ASN A 413 2.653 1.350 20.206 1.00 10.00 H new ATOM 0 HB2 ASN A 413 3.414 2.613 22.401 1.00 10.00 H new ATOM 0 HB3 ASN A 413 3.958 1.028 22.913 1.00 10.00 H new ATOM 0 HD21 ASN A 413 6.190 3.231 20.363 1.00 10.00 H new ATOM 0 HD22 ASN A 413 4.770 3.834 21.224 1.00 10.00 H new ATOM 15 N GLY A 414 2.870 -1.097 20.031 1.00 10.00 N ATOM 16 CA GLY A 414 3.033 -2.533 19.908 1.00 10.00 C ATOM 17 C GLY A 414 4.387 -3.008 20.397 1.00 10.00 C ATOM 18 O GLY A 414 5.237 -2.200 20.771 1.00 10.00 O ATOM 0 H GLY A 414 2.834 -0.592 19.145 1.00 10.00 H new ATOM 0 HA2 GLY A 414 2.249 -3.034 20.476 1.00 10.00 H new ATOM 0 HA3 GLY A 414 2.905 -2.822 18.865 1.00 10.00 H new ATOM 22 N LEU A 415 4.588 -4.321 20.395 1.00 10.00 N ATOM 23 CA LEU A 415 5.849 -4.903 20.841 1.00 10.00 C ATOM 24 C LEU A 415 6.312 -5.996 19.885 1.00 10.00 C ATOM 25 O LEU A 415 7.475 -6.031 19.482 1.00 10.00 O ATOM 26 CB LEU A 415 5.699 -5.472 22.253 1.00 10.00 C ATOM 27 CG LEU A 415 5.554 -4.428 23.362 1.00 10.00 C ATOM 28 CD1 LEU A 415 4.816 -5.014 24.554 1.00 10.00 C ATOM 29 CD2 LEU A 415 6.920 -3.905 23.782 1.00 10.00 C ATOM 0 H LEU A 415 3.894 -5.003 20.089 1.00 10.00 H new ATOM 0 HA LEU A 415 6.602 -4.115 20.852 1.00 10.00 H new ATOM 0 HB2 LEU A 415 4.827 -6.125 22.274 1.00 10.00 H new ATOM 0 HB3 LEU A 415 6.567 -6.093 22.472 1.00 10.00 H new ATOM 0 HG LEU A 415 4.970 -3.593 22.975 1.00 10.00 H new ATOM 0 HD11 LEU A 415 4.723 -4.257 25.332 1.00 10.00 H new ATOM 0 HD12 LEU A 415 3.823 -5.339 24.243 1.00 10.00 H new ATOM 0 HD13 LEU A 415 5.372 -5.867 24.943 1.00 10.00 H new ATOM 0 HD21 LEU A 415 6.799 -3.163 24.572 1.00 10.00 H new ATOM 0 HD22 LEU A 415 7.528 -4.731 24.150 1.00 10.00 H new ATOM 0 HD23 LEU A 415 7.413 -3.445 22.925 1.00 10.00 H new ATOM 41 N MET A 416 5.396 -6.890 19.528 1.00 10.00 N ATOM 42 CA MET A 416 5.712 -7.986 18.618 1.00 10.00 C ATOM 43 C MET A 416 5.133 -7.726 17.231 1.00 10.00 C ATOM 44 O MET A 416 5.871 -7.494 16.273 1.00 10.00 O ATOM 45 CB MET A 416 5.170 -9.306 19.170 1.00 10.00 C ATOM 46 CG MET A 416 6.071 -9.944 20.214 1.00 10.00 C ATOM 47 SD MET A 416 7.330 -11.010 19.486 1.00 10.00 S ATOM 48 CE MET A 416 6.426 -12.548 19.332 1.00 10.00 C ATOM 0 H MET A 416 4.430 -6.878 19.854 1.00 10.00 H new ATOM 0 HA MET A 416 6.797 -8.053 18.532 1.00 10.00 H new ATOM 0 HB2 MET A 416 4.187 -9.131 19.608 1.00 10.00 H new ATOM 0 HB3 MET A 416 5.031 -10.005 18.346 1.00 10.00 H new ATOM 0 HG2 MET A 416 6.556 -9.161 20.797 1.00 10.00 H new ATOM 0 HG3 MET A 416 5.463 -10.527 20.906 1.00 10.00 H new ATOM 0 HE1 MET A 416 7.073 -13.308 18.895 1.00 10.00 H new ATOM 0 HE2 MET A 416 6.095 -12.876 20.317 1.00 10.00 H new ATOM 0 HE3 MET A 416 5.559 -12.397 18.689 1.00 10.00 H new ATOM 58 N ALA A 417 3.808 -7.766 17.131 1.00 10.00 N ATOM 59 CA ALA A 417 3.130 -7.536 15.861 1.00 10.00 C ATOM 60 C ALA A 417 2.542 -6.131 15.801 1.00 10.00 C ATOM 61 O ALA A 417 1.343 -5.940 16.006 1.00 10.00 O ATOM 62 CB ALA A 417 2.042 -8.576 15.648 1.00 10.00 C ATOM 0 H ALA A 417 3.183 -7.956 17.914 1.00 10.00 H new ATOM 0 HA ALA A 417 3.865 -7.628 15.062 1.00 10.00 H new ATOM 0 HB1 ALA A 417 1.544 -8.392 14.696 1.00 10.00 H new ATOM 0 HB2 ALA A 417 2.487 -9.571 15.639 1.00 10.00 H new ATOM 0 HB3 ALA A 417 1.314 -8.512 16.457 1.00 10.00 H new ATOM 68 N ASP A 418 3.392 -5.150 15.520 1.00 10.00 N ATOM 69 CA ASP A 418 2.956 -3.761 15.433 1.00 10.00 C ATOM 70 C ASP A 418 2.110 -3.532 14.181 1.00 10.00 C ATOM 71 O ASP A 418 0.944 -3.151 14.273 1.00 10.00 O ATOM 72 CB ASP A 418 4.166 -2.822 15.429 1.00 10.00 C ATOM 73 CG ASP A 418 4.160 -1.866 16.605 1.00 10.00 C ATOM 74 OD1 ASP A 418 3.101 -1.260 16.873 1.00 10.00 O ATOM 75 OD2 ASP A 418 5.214 -1.722 17.259 1.00 10.00 O ATOM 0 H ASP A 418 4.388 -5.291 15.348 1.00 10.00 H new ATOM 0 HA ASP A 418 2.342 -3.544 16.307 1.00 10.00 H new ATOM 0 HB2 ASP A 418 5.081 -3.413 15.450 1.00 10.00 H new ATOM 0 HB3 ASP A 418 4.176 -2.251 14.500 1.00 10.00 H new ATOM 80 N PRO A 419 2.690 -3.764 12.990 1.00 10.00 N ATOM 81 CA PRO A 419 1.982 -3.580 11.720 1.00 10.00 C ATOM 82 C PRO A 419 0.933 -4.661 11.480 1.00 10.00 C ATOM 83 O PRO A 419 0.982 -5.732 12.085 1.00 10.00 O ATOM 84 CB PRO A 419 3.096 -3.676 10.677 1.00 10.00 C ATOM 85 CG PRO A 419 4.139 -4.525 11.316 1.00 10.00 C ATOM 86 CD PRO A 419 4.079 -4.221 12.788 1.00 10.00 C ATOM 0 HA PRO A 419 1.432 -2.639 11.692 1.00 10.00 H new ATOM 0 HB2 PRO A 419 2.734 -4.123 9.751 1.00 10.00 H new ATOM 0 HB3 PRO A 419 3.488 -2.691 10.424 1.00 10.00 H new ATOM 0 HG2 PRO A 419 3.950 -5.582 11.128 1.00 10.00 H new ATOM 0 HG3 PRO A 419 5.126 -4.301 10.911 1.00 10.00 H new ATOM 0 HD2 PRO A 419 4.303 -5.102 13.389 1.00 10.00 H new ATOM 0 HD3 PRO A 419 4.799 -3.452 13.069 1.00 10.00 H new ATOM 94 N MET A 420 -0.014 -4.373 10.593 1.00 10.00 N ATOM 95 CA MET A 420 -1.074 -5.318 10.272 1.00 10.00 C ATOM 96 C MET A 420 -1.189 -5.503 8.768 1.00 10.00 C ATOM 97 O MET A 420 -0.615 -6.433 8.213 1.00 10.00 O ATOM 98 CB MET A 420 -2.405 -4.834 10.852 1.00 10.00 C ATOM 99 CG MET A 420 -3.577 -5.753 10.543 1.00 10.00 C ATOM 100 SD MET A 420 -4.862 -5.686 11.806 1.00 10.00 S ATOM 101 CE MET A 420 -5.534 -7.343 11.692 1.00 10.00 C ATOM 0 H MET A 420 -0.068 -3.491 10.084 1.00 10.00 H new ATOM 0 HA MET A 420 -0.826 -6.281 10.718 1.00 10.00 H new ATOM 0 HB2 MET A 420 -2.306 -4.737 11.933 1.00 10.00 H new ATOM 0 HB3 MET A 420 -2.621 -3.840 10.461 1.00 10.00 H new ATOM 0 HG2 MET A 420 -4.005 -5.478 9.579 1.00 10.00 H new ATOM 0 HG3 MET A 420 -3.216 -6.777 10.451 1.00 10.00 H new ATOM 0 HE1 MET A 420 -6.342 -7.458 12.414 1.00 10.00 H new ATOM 0 HE2 MET A 420 -5.919 -7.511 10.686 1.00 10.00 H new ATOM 0 HE3 MET A 420 -4.750 -8.069 11.906 1.00 10.00 H new ATOM 111 N LYS A 421 -1.921 -4.613 8.107 1.00 10.00 N ATOM 112 CA LYS A 421 -2.088 -4.704 6.662 1.00 10.00 C ATOM 113 C LYS A 421 -0.741 -4.878 5.979 1.00 10.00 C ATOM 114 O LYS A 421 0.005 -3.917 5.794 1.00 10.00 O ATOM 115 CB LYS A 421 -2.796 -3.474 6.108 1.00 10.00 C ATOM 116 CG LYS A 421 -2.980 -3.540 4.602 1.00 10.00 C ATOM 117 CD LYS A 421 -4.072 -4.510 4.197 1.00 10.00 C ATOM 118 CE LYS A 421 -5.376 -4.247 4.935 1.00 10.00 C ATOM 119 NZ LYS A 421 -5.609 -5.238 6.022 1.00 10.00 N ATOM 0 H LYS A 421 -2.404 -3.828 8.544 1.00 10.00 H new ATOM 0 HA LYS A 421 -2.707 -5.577 6.456 1.00 10.00 H new ATOM 0 HB2 LYS A 421 -3.770 -3.373 6.586 1.00 10.00 H new ATOM 0 HB3 LYS A 421 -2.222 -2.583 6.362 1.00 10.00 H new ATOM 0 HG2 LYS A 421 -3.221 -2.547 4.224 1.00 10.00 H new ATOM 0 HG3 LYS A 421 -2.041 -3.839 4.136 1.00 10.00 H new ATOM 0 HD2 LYS A 421 -4.243 -4.435 3.123 1.00 10.00 H new ATOM 0 HD3 LYS A 421 -3.743 -5.530 4.397 1.00 10.00 H new ATOM 0 HE2 LYS A 421 -5.358 -3.242 5.358 1.00 10.00 H new ATOM 0 HE3 LYS A 421 -6.206 -4.281 4.229 1.00 10.00 H new ATOM 0 HZ1 LYS A 421 -6.478 -5.773 5.823 1.00 10.00 H new ATOM 0 HZ2 LYS A 421 -4.803 -5.893 6.073 1.00 10.00 H new ATOM 0 HZ3 LYS A 421 -5.708 -4.741 6.930 1.00 10.00 H new ATOM 133 N VAL A 422 -0.441 -6.117 5.618 1.00 10.00 N ATOM 134 CA VAL A 422 0.814 -6.444 4.968 1.00 10.00 C ATOM 135 C VAL A 422 0.879 -7.942 4.676 1.00 10.00 C ATOM 136 O VAL A 422 1.183 -8.369 3.565 1.00 10.00 O ATOM 137 CB VAL A 422 2.003 -5.998 5.842 1.00 10.00 C ATOM 138 CG1 VAL A 422 2.289 -6.992 6.961 1.00 10.00 C ATOM 139 CG2 VAL A 422 3.239 -5.768 4.990 1.00 10.00 C ATOM 0 H VAL A 422 -1.057 -6.916 5.767 1.00 10.00 H new ATOM 0 HA VAL A 422 0.873 -5.908 4.021 1.00 10.00 H new ATOM 0 HB VAL A 422 1.728 -5.054 6.312 1.00 10.00 H new ATOM 0 HG11 VAL A 422 3.134 -6.640 7.553 1.00 10.00 H new ATOM 0 HG12 VAL A 422 1.411 -7.083 7.600 1.00 10.00 H new ATOM 0 HG13 VAL A 422 2.527 -7.965 6.531 1.00 10.00 H new ATOM 0 HG21 VAL A 422 4.066 -5.454 5.626 1.00 10.00 H new ATOM 0 HG22 VAL A 422 3.506 -6.693 4.478 1.00 10.00 H new ATOM 0 HG23 VAL A 422 3.033 -4.992 4.253 1.00 10.00 H new ATOM 149 N TYR A 423 0.545 -8.720 5.693 1.00 10.00 N ATOM 150 CA TYR A 423 0.496 -10.174 5.613 1.00 10.00 C ATOM 151 C TYR A 423 -0.138 -10.620 4.298 1.00 10.00 C ATOM 152 O TYR A 423 0.229 -11.650 3.733 1.00 10.00 O ATOM 153 CB TYR A 423 -0.334 -10.695 6.795 1.00 10.00 C ATOM 154 CG TYR A 423 -1.683 -10.014 6.906 1.00 10.00 C ATOM 155 CD1 TYR A 423 -1.758 -8.649 7.125 1.00 10.00 C ATOM 156 CD2 TYR A 423 -2.873 -10.720 6.781 1.00 10.00 C ATOM 157 CE1 TYR A 423 -2.954 -7.996 7.217 1.00 10.00 C ATOM 158 CE2 TYR A 423 -4.094 -10.072 6.872 1.00 10.00 C ATOM 159 CZ TYR A 423 -4.129 -8.707 7.088 1.00 10.00 C ATOM 160 OH TYR A 423 -5.338 -8.057 7.180 1.00 10.00 O ATOM 0 H TYR A 423 0.296 -8.355 6.612 1.00 10.00 H new ATOM 0 HA TYR A 423 1.508 -10.576 5.653 1.00 10.00 H new ATOM 0 HB2 TYR A 423 -0.482 -11.769 6.685 1.00 10.00 H new ATOM 0 HB3 TYR A 423 0.223 -10.543 7.720 1.00 10.00 H new ATOM 0 HD1 TYR A 423 -0.843 -8.084 7.226 1.00 10.00 H new ATOM 0 HD2 TYR A 423 -2.846 -11.786 6.611 1.00 10.00 H new ATOM 0 HE1 TYR A 423 -2.980 -6.930 7.390 1.00 10.00 H new ATOM 0 HE2 TYR A 423 -5.013 -10.630 6.775 1.00 10.00 H new ATOM 0 HH TYR A 423 -6.066 -8.703 7.066 1.00 10.00 H new ATOM 170 N LYS A 424 -1.090 -9.824 3.815 1.00 10.00 N ATOM 171 CA LYS A 424 -1.776 -10.121 2.564 1.00 10.00 C ATOM 172 C LYS A 424 -1.109 -9.387 1.405 1.00 10.00 C ATOM 173 O LYS A 424 -1.153 -9.839 0.261 1.00 10.00 O ATOM 174 CB LYS A 424 -3.250 -9.723 2.657 1.00 10.00 C ATOM 175 CG LYS A 424 -4.162 -10.865 3.078 1.00 10.00 C ATOM 176 CD LYS A 424 -4.888 -11.468 1.886 1.00 10.00 C ATOM 177 CE LYS A 424 -3.911 -12.040 0.870 1.00 10.00 C ATOM 178 NZ LYS A 424 -4.502 -13.174 0.109 1.00 10.00 N ATOM 0 H LYS A 424 -1.402 -8.968 4.273 1.00 10.00 H new ATOM 0 HA LYS A 424 -1.713 -11.194 2.383 1.00 10.00 H new ATOM 0 HB2 LYS A 424 -3.353 -8.905 3.370 1.00 10.00 H new ATOM 0 HB3 LYS A 424 -3.578 -9.345 1.689 1.00 10.00 H new ATOM 0 HG2 LYS A 424 -3.574 -11.637 3.576 1.00 10.00 H new ATOM 0 HG3 LYS A 424 -4.890 -10.502 3.803 1.00 10.00 H new ATOM 0 HD2 LYS A 424 -5.561 -12.254 2.228 1.00 10.00 H new ATOM 0 HD3 LYS A 424 -5.505 -10.705 1.410 1.00 10.00 H new ATOM 0 HE2 LYS A 424 -3.608 -11.256 0.176 1.00 10.00 H new ATOM 0 HE3 LYS A 424 -3.010 -12.377 1.383 1.00 10.00 H new ATOM 0 HZ1 LYS A 424 -3.745 -13.819 -0.197 1.00 10.00 H new ATOM 0 HZ2 LYS A 424 -5.171 -13.689 0.717 1.00 10.00 H new ATOM 0 HZ3 LYS A 424 -5.003 -12.808 -0.726 1.00 10.00 H new ATOM 192 N ASP A 425 -0.488 -8.251 1.714 1.00 10.00 N ATOM 193 CA ASP A 425 0.196 -7.448 0.708 1.00 10.00 C ATOM 194 C ASP A 425 1.192 -8.289 -0.085 1.00 10.00 C ATOM 195 O ASP A 425 1.489 -7.989 -1.239 1.00 10.00 O ATOM 196 CB ASP A 425 0.918 -6.271 1.364 1.00 10.00 C ATOM 197 CG ASP A 425 0.004 -5.080 1.578 1.00 10.00 C ATOM 198 OD1 ASP A 425 -0.652 -5.018 2.639 1.00 10.00 O ATOM 199 OD2 ASP A 425 -0.056 -4.210 0.685 1.00 10.00 O ATOM 0 H ASP A 425 -0.445 -7.866 2.658 1.00 10.00 H new ATOM 0 HA ASP A 425 -0.558 -7.066 0.019 1.00 10.00 H new ATOM 0 HB2 ASP A 425 1.328 -6.588 2.323 1.00 10.00 H new ATOM 0 HB3 ASP A 425 1.761 -5.972 0.741 1.00 10.00 H new ATOM 204 N ARG A 426 1.705 -9.345 0.538 1.00 10.00 N ATOM 205 CA ARG A 426 2.664 -10.223 -0.124 1.00 10.00 C ATOM 206 C ARG A 426 2.132 -10.669 -1.483 1.00 10.00 C ATOM 207 O ARG A 426 2.894 -10.857 -2.430 1.00 10.00 O ATOM 208 CB ARG A 426 2.979 -11.434 0.761 1.00 10.00 C ATOM 209 CG ARG A 426 4.466 -11.655 0.981 1.00 10.00 C ATOM 210 CD ARG A 426 5.104 -12.368 -0.201 1.00 10.00 C ATOM 211 NE ARG A 426 4.603 -13.734 -0.350 1.00 10.00 N ATOM 212 CZ ARG A 426 4.927 -14.736 0.464 1.00 10.00 C ATOM 213 NH1 ARG A 426 5.751 -14.530 1.485 1.00 10.00 N ATOM 214 NH2 ARG A 426 4.427 -15.945 0.258 1.00 10.00 N ATOM 0 H ARG A 426 1.475 -9.613 1.495 1.00 10.00 H new ATOM 0 HA ARG A 426 3.588 -9.668 -0.286 1.00 10.00 H new ATOM 0 HB2 ARG A 426 2.492 -11.304 1.728 1.00 10.00 H new ATOM 0 HB3 ARG A 426 2.551 -12.327 0.306 1.00 10.00 H new ATOM 0 HG2 ARG A 426 4.958 -10.695 1.137 1.00 10.00 H new ATOM 0 HG3 ARG A 426 4.618 -12.242 1.887 1.00 10.00 H new ATOM 0 HD2 ARG A 426 4.905 -11.807 -1.114 1.00 10.00 H new ATOM 0 HD3 ARG A 426 6.186 -12.390 -0.070 1.00 10.00 H new ATOM 0 HE ARG A 426 3.968 -13.930 -1.123 1.00 10.00 H new ATOM 0 HH11 ARG A 426 6.139 -13.601 1.648 1.00 10.00 H new ATOM 0 HH12 ARG A 426 5.996 -15.301 2.106 1.00 10.00 H new ATOM 0 HH21 ARG A 426 3.794 -16.108 -0.525 1.00 10.00 H new ATOM 0 HH22 ARG A 426 4.675 -16.713 0.882 1.00 10.00 H new ATOM 228 N GLN A 427 0.813 -10.807 -1.575 1.00 10.00 N ATOM 229 CA GLN A 427 0.168 -11.194 -2.824 1.00 10.00 C ATOM 230 C GLN A 427 -0.524 -9.985 -3.435 1.00 10.00 C ATOM 231 O GLN A 427 -1.541 -10.105 -4.118 1.00 10.00 O ATOM 232 CB GLN A 427 -0.837 -12.323 -2.586 1.00 10.00 C ATOM 233 CG GLN A 427 -0.324 -13.409 -1.652 1.00 10.00 C ATOM 234 CD GLN A 427 -0.908 -13.304 -0.256 1.00 10.00 C ATOM 235 OE1 GLN A 427 -1.980 -13.841 0.024 1.00 10.00 O ATOM 236 NE2 GLN A 427 -0.202 -12.609 0.630 1.00 10.00 N ATOM 0 H GLN A 427 0.170 -10.656 -0.798 1.00 10.00 H new ATOM 0 HA GLN A 427 0.927 -11.559 -3.516 1.00 10.00 H new ATOM 0 HB2 GLN A 427 -1.753 -11.901 -2.171 1.00 10.00 H new ATOM 0 HB3 GLN A 427 -1.099 -12.773 -3.544 1.00 10.00 H new ATOM 0 HG2 GLN A 427 -0.566 -14.386 -2.070 1.00 10.00 H new ATOM 0 HG3 GLN A 427 0.763 -13.348 -1.592 1.00 10.00 H new ATOM 0 HE21 GLN A 427 0.682 -12.181 0.355 1.00 10.00 H new ATOM 0 HE22 GLN A 427 -0.544 -12.504 1.585 1.00 10.00 H new ATOM 245 N VAL A 428 0.053 -8.820 -3.173 1.00 10.00 N ATOM 246 CA VAL A 428 -0.468 -7.558 -3.675 1.00 10.00 C ATOM 247 C VAL A 428 0.560 -6.875 -4.560 1.00 10.00 C ATOM 248 O VAL A 428 0.205 -6.194 -5.521 1.00 10.00 O ATOM 249 CB VAL A 428 -0.853 -6.617 -2.523 1.00 10.00 C ATOM 250 CG1 VAL A 428 -1.078 -5.202 -3.029 1.00 10.00 C ATOM 251 CG2 VAL A 428 -2.085 -7.137 -1.806 1.00 10.00 C ATOM 0 H VAL A 428 0.896 -8.724 -2.606 1.00 10.00 H new ATOM 0 HA VAL A 428 -1.362 -7.780 -4.258 1.00 10.00 H new ATOM 0 HB VAL A 428 -0.027 -6.589 -1.812 1.00 10.00 H new ATOM 0 HG11 VAL A 428 -1.349 -4.556 -2.194 1.00 10.00 H new ATOM 0 HG12 VAL A 428 -0.164 -4.832 -3.492 1.00 10.00 H new ATOM 0 HG13 VAL A 428 -1.883 -5.202 -3.764 1.00 10.00 H new ATOM 0 HG21 VAL A 428 -2.345 -6.460 -0.993 1.00 10.00 H new ATOM 0 HG22 VAL A 428 -2.916 -7.197 -2.508 1.00 10.00 H new ATOM 0 HG23 VAL A 428 -1.879 -8.128 -1.401 1.00 10.00 H new ATOM 261 N MET A 429 1.836 -7.073 -4.244 1.00 10.00 N ATOM 262 CA MET A 429 2.911 -6.484 -5.037 1.00 10.00 C ATOM 263 C MET A 429 2.648 -6.702 -6.528 1.00 10.00 C ATOM 264 O MET A 429 3.095 -5.925 -7.372 1.00 10.00 O ATOM 265 CB MET A 429 4.259 -7.093 -4.649 1.00 10.00 C ATOM 266 CG MET A 429 4.263 -8.613 -4.652 1.00 10.00 C ATOM 267 SD MET A 429 5.730 -9.305 -3.863 1.00 10.00 S ATOM 268 CE MET A 429 6.951 -9.070 -5.151 1.00 10.00 C ATOM 0 H MET A 429 2.150 -7.632 -3.451 1.00 10.00 H new ATOM 0 HA MET A 429 2.941 -5.413 -4.835 1.00 10.00 H new ATOM 0 HB2 MET A 429 5.022 -6.735 -5.339 1.00 10.00 H new ATOM 0 HB3 MET A 429 4.536 -6.739 -3.656 1.00 10.00 H new ATOM 0 HG2 MET A 429 3.373 -8.976 -4.138 1.00 10.00 H new ATOM 0 HG3 MET A 429 4.205 -8.971 -5.680 1.00 10.00 H new ATOM 0 HE1 MET A 429 7.915 -9.450 -4.812 1.00 10.00 H new ATOM 0 HE2 MET A 429 6.643 -9.609 -6.047 1.00 10.00 H new ATOM 0 HE3 MET A 429 7.039 -8.008 -5.379 1.00 10.00 H new ATOM 278 N ASN A 430 1.908 -7.766 -6.835 1.00 10.00 N ATOM 279 CA ASN A 430 1.565 -8.100 -8.210 1.00 10.00 C ATOM 280 C ASN A 430 0.052 -8.239 -8.376 1.00 10.00 C ATOM 281 O ASN A 430 -0.420 -8.917 -9.288 1.00 10.00 O ATOM 282 CB ASN A 430 2.253 -9.404 -8.613 1.00 10.00 C ATOM 283 CG ASN A 430 3.677 -9.187 -9.084 1.00 10.00 C ATOM 284 OD1 ASN A 430 4.514 -8.664 -8.347 1.00 10.00 O ATOM 285 ND2 ASN A 430 3.960 -9.585 -10.319 1.00 10.00 N ATOM 0 H ASN A 430 1.534 -8.414 -6.142 1.00 10.00 H new ATOM 0 HA ASN A 430 1.909 -7.292 -8.856 1.00 10.00 H new ATOM 0 HB2 ASN A 430 2.255 -10.088 -7.764 1.00 10.00 H new ATOM 0 HB3 ASN A 430 1.680 -9.883 -9.407 1.00 10.00 H new ATOM 0 HD21 ASN A 430 4.902 -9.462 -10.691 1.00 10.00 H new ATOM 0 HD22 ASN A 430 3.236 -10.014 -10.895 1.00 10.00 H new ATOM 292 N MET A 431 -0.704 -7.590 -7.491 1.00 10.00 N ATOM 293 CA MET A 431 -2.164 -7.639 -7.538 1.00 10.00 C ATOM 294 C MET A 431 -2.782 -7.038 -6.281 1.00 10.00 C ATOM 295 O MET A 431 -3.146 -7.759 -5.352 1.00 10.00 O ATOM 296 CB MET A 431 -2.657 -9.075 -7.693 1.00 10.00 C ATOM 297 CG MET A 431 -3.097 -9.423 -9.106 1.00 10.00 C ATOM 298 SD MET A 431 -2.678 -11.115 -9.566 1.00 10.00 S ATOM 299 CE MET A 431 -4.172 -11.978 -9.085 1.00 10.00 C ATOM 0 H MET A 431 -0.328 -7.023 -6.731 1.00 10.00 H new ATOM 0 HA MET A 431 -2.474 -7.052 -8.403 1.00 10.00 H new ATOM 0 HB2 MET A 431 -1.862 -9.757 -7.392 1.00 10.00 H new ATOM 0 HB3 MET A 431 -3.492 -9.238 -7.012 1.00 10.00 H new ATOM 0 HG2 MET A 431 -4.175 -9.283 -9.192 1.00 10.00 H new ATOM 0 HG3 MET A 431 -2.629 -8.733 -9.808 1.00 10.00 H new ATOM 0 HE1 MET A 431 -4.067 -13.040 -9.308 1.00 10.00 H new ATOM 0 HE2 MET A 431 -4.340 -11.846 -8.016 1.00 10.00 H new ATOM 0 HE3 MET A 431 -5.020 -11.574 -9.638 1.00 10.00 H new ATOM 309 N TRP A 432 -2.931 -5.724 -6.271 1.00 10.00 N ATOM 310 CA TRP A 432 -3.537 -5.038 -5.141 1.00 10.00 C ATOM 311 C TRP A 432 -5.046 -5.168 -5.239 1.00 10.00 C ATOM 312 O TRP A 432 -5.698 -4.493 -6.035 1.00 10.00 O ATOM 313 CB TRP A 432 -3.120 -3.566 -5.103 1.00 10.00 C ATOM 314 CG TRP A 432 -1.692 -3.307 -5.506 1.00 10.00 C ATOM 315 CD1 TRP A 432 -1.127 -3.534 -6.726 1.00 10.00 C ATOM 316 CD2 TRP A 432 -0.649 -2.755 -4.687 1.00 10.00 C ATOM 317 NE1 TRP A 432 0.181 -3.124 -6.727 1.00 10.00 N ATOM 318 CE2 TRP A 432 0.501 -2.651 -5.489 1.00 10.00 C ATOM 319 CE3 TRP A 432 -0.578 -2.329 -3.364 1.00 10.00 C ATOM 320 CZ2 TRP A 432 1.701 -2.133 -5.012 1.00 10.00 C ATOM 321 CZ3 TRP A 432 0.615 -1.824 -2.884 1.00 10.00 C ATOM 322 CH2 TRP A 432 1.739 -1.723 -3.709 1.00 10.00 C ATOM 0 H TRP A 432 -2.641 -5.110 -7.032 1.00 10.00 H new ATOM 0 HA TRP A 432 -3.191 -5.497 -4.215 1.00 10.00 H new ATOM 0 HB2 TRP A 432 -3.778 -2.999 -5.761 1.00 10.00 H new ATOM 0 HB3 TRP A 432 -3.273 -3.185 -4.093 1.00 10.00 H new ATOM 0 HD1 TRP A 432 -1.637 -3.974 -7.570 1.00 10.00 H new ATOM 0 HE1 TRP A 432 0.814 -3.166 -7.526 1.00 10.00 H new ATOM 0 HE3 TRP A 432 -1.444 -2.392 -2.721 1.00 10.00 H new ATOM 0 HZ2 TRP A 432 2.570 -2.058 -5.648 1.00 10.00 H new ATOM 0 HZ3 TRP A 432 0.680 -1.502 -1.855 1.00 10.00 H new ATOM 0 HH2 TRP A 432 2.655 -1.313 -3.309 1.00 10.00 H new ATOM 333 N SER A 433 -5.583 -6.073 -4.438 1.00 10.00 N ATOM 334 CA SER A 433 -7.016 -6.348 -4.432 1.00 10.00 C ATOM 335 C SER A 433 -7.823 -5.106 -4.086 1.00 10.00 C ATOM 336 O SER A 433 -7.369 -4.248 -3.331 1.00 10.00 O ATOM 337 CB SER A 433 -7.334 -7.467 -3.439 1.00 10.00 C ATOM 338 OG SER A 433 -6.359 -8.494 -3.498 1.00 10.00 O ATOM 0 H SER A 433 -5.046 -6.635 -3.778 1.00 10.00 H new ATOM 0 HA SER A 433 -7.297 -6.663 -5.437 1.00 10.00 H new ATOM 0 HB2 SER A 433 -7.377 -7.060 -2.429 1.00 10.00 H new ATOM 0 HB3 SER A 433 -8.318 -7.882 -3.657 1.00 10.00 H new ATOM 0 HG SER A 433 -6.584 -9.196 -2.853 1.00 10.00 H new ATOM 344 N GLU A 434 -9.036 -5.025 -4.631 1.00 10.00 N ATOM 345 CA GLU A 434 -9.916 -3.893 -4.362 1.00 10.00 C ATOM 346 C GLU A 434 -10.012 -3.652 -2.860 1.00 10.00 C ATOM 347 O GLU A 434 -10.206 -2.523 -2.409 1.00 10.00 O ATOM 348 CB GLU A 434 -11.308 -4.149 -4.944 1.00 10.00 C ATOM 349 CG GLU A 434 -11.444 -3.734 -6.399 1.00 10.00 C ATOM 350 CD GLU A 434 -12.882 -3.456 -6.793 1.00 10.00 C ATOM 351 OE1 GLU A 434 -13.698 -4.401 -6.764 1.00 10.00 O ATOM 352 OE2 GLU A 434 -13.191 -2.294 -7.131 1.00 10.00 O ATOM 0 H GLU A 434 -9.429 -5.727 -5.258 1.00 10.00 H new ATOM 0 HA GLU A 434 -9.498 -3.006 -4.838 1.00 10.00 H new ATOM 0 HB2 GLU A 434 -11.541 -5.210 -4.854 1.00 10.00 H new ATOM 0 HB3 GLU A 434 -12.046 -3.609 -4.350 1.00 10.00 H new ATOM 0 HG2 GLU A 434 -10.843 -2.842 -6.576 1.00 10.00 H new ATOM 0 HG3 GLU A 434 -11.042 -4.521 -7.037 1.00 10.00 H new ATOM 359 N GLN A 435 -9.857 -4.727 -2.093 1.00 10.00 N ATOM 360 CA GLN A 435 -9.905 -4.648 -0.641 1.00 10.00 C ATOM 361 C GLN A 435 -8.524 -4.325 -0.086 1.00 10.00 C ATOM 362 O GLN A 435 -8.398 -3.680 0.954 1.00 10.00 O ATOM 363 CB GLN A 435 -10.414 -5.963 -0.050 1.00 10.00 C ATOM 364 CG GLN A 435 -11.787 -6.370 -0.561 1.00 10.00 C ATOM 365 CD GLN A 435 -12.881 -5.426 -0.105 1.00 10.00 C ATOM 366 OE1 GLN A 435 -13.488 -5.624 0.949 1.00 10.00 O ATOM 367 NE2 GLN A 435 -13.141 -4.392 -0.897 1.00 10.00 N ATOM 0 H GLN A 435 -9.696 -5.666 -2.457 1.00 10.00 H new ATOM 0 HA GLN A 435 -10.594 -3.851 -0.361 1.00 10.00 H new ATOM 0 HB2 GLN A 435 -9.701 -6.755 -0.280 1.00 10.00 H new ATOM 0 HB3 GLN A 435 -10.452 -5.873 1.036 1.00 10.00 H new ATOM 0 HG2 GLN A 435 -11.770 -6.402 -1.650 1.00 10.00 H new ATOM 0 HG3 GLN A 435 -12.015 -7.378 -0.216 1.00 10.00 H new ATOM 0 HE21 GLN A 435 -12.614 -4.266 -1.761 1.00 10.00 H new ATOM 0 HE22 GLN A 435 -13.868 -3.724 -0.641 1.00 10.00 H new ATOM 376 N GLU A 436 -7.487 -4.765 -0.797 1.00 10.00 N ATOM 377 CA GLU A 436 -6.125 -4.511 -0.388 1.00 10.00 C ATOM 378 C GLU A 436 -5.781 -3.062 -0.673 1.00 10.00 C ATOM 379 O GLU A 436 -5.462 -2.300 0.240 1.00 10.00 O ATOM 380 CB GLU A 436 -5.196 -5.479 -1.123 1.00 10.00 C ATOM 381 CG GLU A 436 -4.582 -6.544 -0.222 1.00 10.00 C ATOM 382 CD GLU A 436 -5.559 -7.088 0.805 1.00 10.00 C ATOM 383 OE1 GLU A 436 -6.479 -7.836 0.411 1.00 10.00 O ATOM 384 OE2 GLU A 436 -5.405 -6.765 2.002 1.00 10.00 O ATOM 0 H GLU A 436 -7.575 -5.300 -1.661 1.00 10.00 H new ATOM 0 HA GLU A 436 -6.003 -4.676 0.682 1.00 10.00 H new ATOM 0 HB2 GLU A 436 -5.754 -5.969 -1.921 1.00 10.00 H new ATOM 0 HB3 GLU A 436 -4.395 -4.911 -1.597 1.00 10.00 H new ATOM 0 HG2 GLU A 436 -4.216 -7.366 -0.838 1.00 10.00 H new ATOM 0 HG3 GLU A 436 -3.719 -6.122 0.293 1.00 10.00 H new ATOM 391 N LYS A 437 -5.901 -2.666 -1.932 1.00 10.00 N ATOM 392 CA LYS A 437 -5.656 -1.281 -2.319 1.00 10.00 C ATOM 393 C LYS A 437 -6.517 -0.364 -1.462 1.00 10.00 C ATOM 394 O LYS A 437 -6.229 0.816 -1.309 1.00 10.00 O ATOM 395 CB LYS A 437 -5.984 -1.078 -3.800 1.00 10.00 C ATOM 396 CG LYS A 437 -5.005 -0.169 -4.523 1.00 10.00 C ATOM 397 CD LYS A 437 -5.654 0.510 -5.718 1.00 10.00 C ATOM 398 CE LYS A 437 -5.523 -0.335 -6.976 1.00 10.00 C ATOM 399 NZ LYS A 437 -6.574 -1.388 -7.050 1.00 10.00 N ATOM 0 H LYS A 437 -6.166 -3.281 -2.702 1.00 10.00 H new ATOM 0 HA LYS A 437 -4.604 -1.043 -2.164 1.00 10.00 H new ATOM 0 HB2 LYS A 437 -5.999 -2.048 -4.296 1.00 10.00 H new ATOM 0 HB3 LYS A 437 -6.987 -0.660 -3.887 1.00 10.00 H new ATOM 0 HG2 LYS A 437 -4.631 0.587 -3.833 1.00 10.00 H new ATOM 0 HG3 LYS A 437 -4.145 -0.750 -4.856 1.00 10.00 H new ATOM 0 HD2 LYS A 437 -6.708 0.691 -5.507 1.00 10.00 H new ATOM 0 HD3 LYS A 437 -5.190 1.483 -5.882 1.00 10.00 H new ATOM 0 HE2 LYS A 437 -5.591 0.308 -7.854 1.00 10.00 H new ATOM 0 HE3 LYS A 437 -4.539 -0.802 -6.998 1.00 10.00 H new ATOM 0 HZ1 LYS A 437 -6.902 -1.482 -8.032 1.00 10.00 H new ATOM 0 HZ2 LYS A 437 -6.180 -2.295 -6.728 1.00 10.00 H new ATOM 0 HZ3 LYS A 437 -7.374 -1.123 -6.441 1.00 10.00 H new ATOM 413 N GLU A 438 -7.572 -0.934 -0.893 1.00 10.00 N ATOM 414 CA GLU A 438 -8.479 -0.186 -0.042 1.00 10.00 C ATOM 415 C GLU A 438 -7.761 0.362 1.183 1.00 10.00 C ATOM 416 O GLU A 438 -8.164 1.382 1.736 1.00 10.00 O ATOM 417 CB GLU A 438 -9.638 -1.076 0.400 1.00 10.00 C ATOM 418 CG GLU A 438 -10.965 -0.343 0.504 1.00 10.00 C ATOM 419 CD GLU A 438 -10.896 0.860 1.424 1.00 10.00 C ATOM 420 OE1 GLU A 438 -11.144 0.696 2.636 1.00 10.00 O ATOM 421 OE2 GLU A 438 -10.593 1.967 0.931 1.00 10.00 O ATOM 0 H GLU A 438 -7.818 -1.917 -1.009 1.00 10.00 H new ATOM 0 HA GLU A 438 -8.863 0.654 -0.620 1.00 10.00 H new ATOM 0 HB2 GLU A 438 -9.742 -1.900 -0.306 1.00 10.00 H new ATOM 0 HB3 GLU A 438 -9.399 -1.515 1.368 1.00 10.00 H new ATOM 0 HG2 GLU A 438 -11.276 -0.019 -0.489 1.00 10.00 H new ATOM 0 HG3 GLU A 438 -11.728 -1.031 0.868 1.00 10.00 H new ATOM 428 N THR A 439 -6.707 -0.319 1.618 1.00 10.00 N ATOM 429 CA THR A 439 -5.967 0.126 2.793 1.00 10.00 C ATOM 430 C THR A 439 -4.839 1.086 2.420 1.00 10.00 C ATOM 431 O THR A 439 -4.722 2.167 2.995 1.00 10.00 O ATOM 432 CB THR A 439 -5.415 -1.072 3.564 1.00 10.00 C ATOM 433 OG1 THR A 439 -6.459 -1.959 3.921 1.00 10.00 O ATOM 434 CG2 THR A 439 -4.691 -0.678 4.835 1.00 10.00 C ATOM 0 H THR A 439 -6.349 -1.169 1.182 1.00 10.00 H new ATOM 0 HA THR A 439 -6.663 0.667 3.434 1.00 10.00 H new ATOM 0 HB THR A 439 -4.703 -1.551 2.892 1.00 10.00 H new ATOM 0 HG1 THR A 439 -6.784 -1.738 4.819 1.00 10.00 H new ATOM 0 HG21 THR A 439 -4.323 -1.573 5.336 1.00 10.00 H new ATOM 0 HG22 THR A 439 -3.851 -0.029 4.589 1.00 10.00 H new ATOM 0 HG23 THR A 439 -5.378 -0.148 5.496 1.00 10.00 H new ATOM 442 N PHE A 440 -4.010 0.691 1.461 1.00 10.00 N ATOM 443 CA PHE A 440 -2.899 1.522 1.025 1.00 10.00 C ATOM 444 C PHE A 440 -3.404 2.724 0.232 1.00 10.00 C ATOM 445 O PHE A 440 -2.791 3.791 0.250 1.00 10.00 O ATOM 446 CB PHE A 440 -1.916 0.704 0.180 1.00 10.00 C ATOM 447 CG PHE A 440 -2.288 -0.735 0.020 1.00 10.00 C ATOM 448 CD1 PHE A 440 -2.248 -1.622 1.083 1.00 10.00 C ATOM 449 CD2 PHE A 440 -2.694 -1.193 -1.207 1.00 10.00 C ATOM 450 CE1 PHE A 440 -2.611 -2.937 0.905 1.00 10.00 C ATOM 451 CE2 PHE A 440 -3.053 -2.500 -1.390 1.00 10.00 C ATOM 452 CZ PHE A 440 -3.012 -3.367 -0.340 1.00 10.00 C ATOM 0 H PHE A 440 -4.088 -0.200 0.971 1.00 10.00 H new ATOM 0 HA PHE A 440 -2.378 1.886 1.910 1.00 10.00 H new ATOM 0 HB2 PHE A 440 -1.839 1.159 -0.808 1.00 10.00 H new ATOM 0 HB3 PHE A 440 -0.928 0.763 0.636 1.00 10.00 H new ATOM 0 HD1 PHE A 440 -1.930 -1.280 2.057 1.00 10.00 H new ATOM 0 HD2 PHE A 440 -2.731 -0.510 -2.043 1.00 10.00 H new ATOM 0 HE1 PHE A 440 -2.582 -3.627 1.736 1.00 10.00 H new ATOM 0 HE2 PHE A 440 -3.368 -2.844 -2.364 1.00 10.00 H new ATOM 0 HZ PHE A 440 -3.296 -4.399 -0.485 1.00 10.00 H new ATOM 462 N ARG A 441 -4.528 2.552 -0.459 1.00 10.00 N ATOM 463 CA ARG A 441 -5.106 3.638 -1.248 1.00 10.00 C ATOM 464 C ARG A 441 -5.924 4.572 -0.363 1.00 10.00 C ATOM 465 O ARG A 441 -5.990 5.776 -0.615 1.00 10.00 O ATOM 466 CB ARG A 441 -5.979 3.097 -2.381 1.00 10.00 C ATOM 467 CG ARG A 441 -6.234 4.109 -3.487 1.00 10.00 C ATOM 468 CD ARG A 441 -7.643 4.676 -3.412 1.00 10.00 C ATOM 469 NE ARG A 441 -8.211 4.910 -4.738 1.00 10.00 N ATOM 470 CZ ARG A 441 -8.480 3.942 -5.611 1.00 10.00 C ATOM 471 NH1 ARG A 441 -8.238 2.674 -5.302 1.00 10.00 N ATOM 472 NH2 ARG A 441 -8.994 4.241 -6.795 1.00 10.00 N ATOM 0 H ARG A 441 -5.054 1.678 -0.489 1.00 10.00 H new ATOM 0 HA ARG A 441 -4.281 4.199 -1.688 1.00 10.00 H new ATOM 0 HB2 ARG A 441 -5.500 2.216 -2.809 1.00 10.00 H new ATOM 0 HB3 ARG A 441 -6.935 2.772 -1.969 1.00 10.00 H new ATOM 0 HG2 ARG A 441 -5.510 4.920 -3.413 1.00 10.00 H new ATOM 0 HG3 ARG A 441 -6.083 3.635 -4.457 1.00 10.00 H new ATOM 0 HD2 ARG A 441 -8.282 3.987 -2.860 1.00 10.00 H new ATOM 0 HD3 ARG A 441 -7.628 5.612 -2.854 1.00 10.00 H new ATOM 0 HE ARG A 441 -8.413 5.872 -5.011 1.00 10.00 H new ATOM 0 HH11 ARG A 441 -7.844 2.437 -4.391 1.00 10.00 H new ATOM 0 HH12 ARG A 441 -8.446 1.936 -5.975 1.00 10.00 H new ATOM 0 HH21 ARG A 441 -9.184 5.213 -7.038 1.00 10.00 H new ATOM 0 HH22 ARG A 441 -9.200 3.499 -7.464 1.00 10.00 H new ATOM 486 N GLU A 442 -6.542 4.018 0.679 1.00 10.00 N ATOM 487 CA GLU A 442 -7.346 4.821 1.595 1.00 10.00 C ATOM 488 C GLU A 442 -6.452 5.578 2.563 1.00 10.00 C ATOM 489 O GLU A 442 -6.747 6.715 2.936 1.00 10.00 O ATOM 490 CB GLU A 442 -8.329 3.945 2.371 1.00 10.00 C ATOM 491 CG GLU A 442 -9.214 4.726 3.329 1.00 10.00 C ATOM 492 CD GLU A 442 -10.611 4.946 2.785 1.00 10.00 C ATOM 493 OE1 GLU A 442 -11.233 3.962 2.331 1.00 10.00 O ATOM 494 OE2 GLU A 442 -11.085 6.101 2.813 1.00 10.00 O ATOM 0 H GLU A 442 -6.502 3.025 0.908 1.00 10.00 H new ATOM 0 HA GLU A 442 -7.915 5.538 1.002 1.00 10.00 H new ATOM 0 HB2 GLU A 442 -8.960 3.407 1.664 1.00 10.00 H new ATOM 0 HB3 GLU A 442 -7.770 3.197 2.933 1.00 10.00 H new ATOM 0 HG2 GLU A 442 -9.277 4.191 4.277 1.00 10.00 H new ATOM 0 HG3 GLU A 442 -8.753 5.692 3.538 1.00 10.00 H new ATOM 501 N LYS A 443 -5.349 4.952 2.961 1.00 10.00 N ATOM 502 CA LYS A 443 -4.415 5.584 3.872 1.00 10.00 C ATOM 503 C LYS A 443 -3.768 6.779 3.194 1.00 10.00 C ATOM 504 O LYS A 443 -3.583 7.828 3.804 1.00 10.00 O ATOM 505 CB LYS A 443 -3.347 4.587 4.326 1.00 10.00 C ATOM 506 CG LYS A 443 -3.794 3.703 5.481 1.00 10.00 C ATOM 507 CD LYS A 443 -2.623 3.301 6.365 1.00 10.00 C ATOM 508 CE LYS A 443 -2.832 3.739 7.807 1.00 10.00 C ATOM 509 NZ LYS A 443 -3.209 2.597 8.684 1.00 10.00 N ATOM 0 H LYS A 443 -5.085 4.012 2.666 1.00 10.00 H new ATOM 0 HA LYS A 443 -4.958 5.925 4.753 1.00 10.00 H new ATOM 0 HB2 LYS A 443 -3.069 3.956 3.482 1.00 10.00 H new ATOM 0 HB3 LYS A 443 -2.453 5.135 4.623 1.00 10.00 H new ATOM 0 HG2 LYS A 443 -4.537 4.232 6.078 1.00 10.00 H new ATOM 0 HG3 LYS A 443 -4.278 2.809 5.089 1.00 10.00 H new ATOM 0 HD2 LYS A 443 -2.493 2.219 6.328 1.00 10.00 H new ATOM 0 HD3 LYS A 443 -1.706 3.745 5.979 1.00 10.00 H new ATOM 0 HE2 LYS A 443 -1.918 4.199 8.183 1.00 10.00 H new ATOM 0 HE3 LYS A 443 -3.612 4.500 7.846 1.00 10.00 H new ATOM 0 HZ1 LYS A 443 -3.342 2.937 9.658 1.00 10.00 H new ATOM 0 HZ2 LYS A 443 -4.095 2.173 8.341 1.00 10.00 H new ATOM 0 HZ3 LYS A 443 -2.454 1.882 8.667 1.00 10.00 H new ATOM 523 N PHE A 444 -3.451 6.624 1.911 1.00 10.00 N ATOM 524 CA PHE A 444 -2.852 7.700 1.144 1.00 10.00 C ATOM 525 C PHE A 444 -3.851 8.834 1.023 1.00 10.00 C ATOM 526 O PHE A 444 -3.480 10.005 0.959 1.00 10.00 O ATOM 527 CB PHE A 444 -2.409 7.194 -0.227 1.00 10.00 C ATOM 528 CG PHE A 444 -1.700 8.226 -1.055 1.00 10.00 C ATOM 529 CD1 PHE A 444 -2.378 9.328 -1.550 1.00 10.00 C ATOM 530 CD2 PHE A 444 -0.353 8.088 -1.339 1.00 10.00 C ATOM 531 CE1 PHE A 444 -1.722 10.276 -2.312 1.00 10.00 C ATOM 532 CE2 PHE A 444 0.309 9.032 -2.100 1.00 10.00 C ATOM 533 CZ PHE A 444 -0.376 10.128 -2.588 1.00 10.00 C ATOM 0 H PHE A 444 -3.601 5.763 1.386 1.00 10.00 H new ATOM 0 HA PHE A 444 -1.963 8.070 1.655 1.00 10.00 H new ATOM 0 HB2 PHE A 444 -1.751 6.336 -0.092 1.00 10.00 H new ATOM 0 HB3 PHE A 444 -3.284 6.842 -0.774 1.00 10.00 H new ATOM 0 HD1 PHE A 444 -3.430 9.447 -1.338 1.00 10.00 H new ATOM 0 HD2 PHE A 444 0.187 7.232 -0.961 1.00 10.00 H new ATOM 0 HE1 PHE A 444 -2.261 11.132 -2.691 1.00 10.00 H new ATOM 0 HE2 PHE A 444 1.361 8.913 -2.313 1.00 10.00 H new ATOM 0 HZ PHE A 444 0.139 10.867 -3.184 1.00 10.00 H new ATOM 543 N MET A 445 -5.128 8.475 1.051 1.00 10.00 N ATOM 544 CA MET A 445 -6.184 9.462 1.010 1.00 10.00 C ATOM 545 C MET A 445 -6.319 10.074 2.400 1.00 10.00 C ATOM 546 O MET A 445 -6.740 11.220 2.562 1.00 10.00 O ATOM 547 CB MET A 445 -7.505 8.826 0.573 1.00 10.00 C ATOM 548 CG MET A 445 -8.596 9.839 0.265 1.00 10.00 C ATOM 549 SD MET A 445 -8.100 11.031 -0.994 1.00 10.00 S ATOM 550 CE MET A 445 -9.635 11.230 -1.896 1.00 10.00 C ATOM 0 H MET A 445 -5.451 7.509 1.102 1.00 10.00 H new ATOM 0 HA MET A 445 -5.938 10.236 0.283 1.00 10.00 H new ATOM 0 HB2 MET A 445 -7.329 8.214 -0.312 1.00 10.00 H new ATOM 0 HB3 MET A 445 -7.854 8.157 1.359 1.00 10.00 H new ATOM 0 HG2 MET A 445 -9.490 9.314 -0.070 1.00 10.00 H new ATOM 0 HG3 MET A 445 -8.862 10.371 1.179 1.00 10.00 H new ATOM 0 HE1 MET A 445 -9.489 11.940 -2.710 1.00 10.00 H new ATOM 0 HE2 MET A 445 -9.944 10.268 -2.305 1.00 10.00 H new ATOM 0 HE3 MET A 445 -10.407 11.603 -1.223 1.00 10.00 H new ATOM 560 N GLN A 446 -5.925 9.282 3.399 1.00 10.00 N ATOM 561 CA GLN A 446 -5.952 9.690 4.795 1.00 10.00 C ATOM 562 C GLN A 446 -4.801 10.640 5.087 1.00 10.00 C ATOM 563 O GLN A 446 -4.990 11.723 5.642 1.00 10.00 O ATOM 564 CB GLN A 446 -5.818 8.451 5.687 1.00 10.00 C ATOM 565 CG GLN A 446 -6.233 8.688 7.129 1.00 10.00 C ATOM 566 CD GLN A 446 -7.302 7.717 7.595 1.00 10.00 C ATOM 567 OE1 GLN A 446 -8.240 8.098 8.295 1.00 10.00 O ATOM 568 NE2 GLN A 446 -7.164 6.454 7.206 1.00 10.00 N ATOM 0 H GLN A 446 -5.577 8.334 3.256 1.00 10.00 H new ATOM 0 HA GLN A 446 -6.895 10.197 4.998 1.00 10.00 H new ATOM 0 HB2 GLN A 446 -6.426 7.647 5.271 1.00 10.00 H new ATOM 0 HB3 GLN A 446 -4.783 8.111 5.668 1.00 10.00 H new ATOM 0 HG2 GLN A 446 -5.359 8.598 7.774 1.00 10.00 H new ATOM 0 HG3 GLN A 446 -6.603 9.708 7.234 1.00 10.00 H new ATOM 0 HE21 GLN A 446 -6.370 6.183 6.626 1.00 10.00 H new ATOM 0 HE22 GLN A 446 -7.852 5.756 7.488 1.00 10.00 H new ATOM 577 N HIS A 447 -3.607 10.206 4.710 1.00 10.00 N ATOM 578 CA HIS A 447 -2.395 10.980 4.920 1.00 10.00 C ATOM 579 C HIS A 447 -2.018 11.744 3.653 1.00 10.00 C ATOM 580 O HIS A 447 -2.051 11.189 2.556 1.00 10.00 O ATOM 581 CB HIS A 447 -1.253 10.043 5.329 1.00 10.00 C ATOM 582 CG HIS A 447 -1.685 8.948 6.260 1.00 10.00 C ATOM 583 ND1 HIS A 447 -2.024 7.651 6.026 1.00 10.00 N flip ATOM 584 CD2 HIS A 447 -1.816 9.133 7.620 1.00 10.00 C flip ATOM 585 CE1 HIS A 447 -2.350 7.094 7.237 1.00 10.00 C flip ATOM 586 NE2 HIS A 447 -2.215 8.006 8.181 1.00 10.00 N flip ATOM 0 H HIS A 447 -3.453 9.308 4.251 1.00 10.00 H new ATOM 0 HA HIS A 447 -2.573 11.704 5.716 1.00 10.00 H new ATOM 0 HB2 HIS A 447 -0.819 9.598 4.433 1.00 10.00 H new ATOM 0 HB3 HIS A 447 -0.467 10.627 5.807 1.00 10.00 H new ATOM 0 HD1 HIS A 447 -2.034 7.181 5.121 1.00 10.00 H new ATOM 0 HD2 HIS A 447 -1.622 10.057 8.145 1.00 10.00 H new ATOM 0 HE1 HIS A 447 -2.666 6.073 7.392 1.00 10.00 H new ATOM 595 N PRO A 448 -1.647 13.031 3.781 1.00 10.00 N ATOM 596 CA PRO A 448 -1.262 13.857 2.634 1.00 10.00 C ATOM 597 C PRO A 448 -0.224 13.161 1.761 1.00 10.00 C ATOM 598 O PRO A 448 0.334 12.137 2.151 1.00 10.00 O ATOM 599 CB PRO A 448 -0.673 15.127 3.268 1.00 10.00 C ATOM 600 CG PRO A 448 -0.532 14.826 4.726 1.00 10.00 C ATOM 601 CD PRO A 448 -1.564 13.782 5.039 1.00 10.00 C ATOM 0 HA PRO A 448 -2.107 14.062 1.977 1.00 10.00 H new ATOM 0 HB2 PRO A 448 0.292 15.374 2.825 1.00 10.00 H new ATOM 0 HB3 PRO A 448 -1.327 15.984 3.107 1.00 10.00 H new ATOM 0 HG2 PRO A 448 0.470 14.463 4.954 1.00 10.00 H new ATOM 0 HG3 PRO A 448 -0.690 15.722 5.326 1.00 10.00 H new ATOM 0 HD2 PRO A 448 -1.260 13.147 5.871 1.00 10.00 H new ATOM 0 HD3 PRO A 448 -2.522 14.226 5.310 1.00 10.00 H new ATOM 609 N LYS A 449 0.030 13.718 0.579 1.00 10.00 N ATOM 610 CA LYS A 449 1.005 13.142 -0.347 1.00 10.00 C ATOM 611 C LYS A 449 2.298 12.775 0.375 1.00 10.00 C ATOM 612 O LYS A 449 3.176 13.617 0.562 1.00 10.00 O ATOM 613 CB LYS A 449 1.302 14.125 -1.481 1.00 10.00 C ATOM 614 CG LYS A 449 0.310 14.047 -2.631 1.00 10.00 C ATOM 615 CD LYS A 449 0.972 14.372 -3.960 1.00 10.00 C ATOM 616 CE LYS A 449 1.375 15.836 -4.039 1.00 10.00 C ATOM 617 NZ LYS A 449 2.611 16.029 -4.846 1.00 10.00 N ATOM 0 H LYS A 449 -0.424 14.566 0.239 1.00 10.00 H new ATOM 0 HA LYS A 449 0.576 12.231 -0.765 1.00 10.00 H new ATOM 0 HB2 LYS A 449 1.302 15.139 -1.081 1.00 10.00 H new ATOM 0 HB3 LYS A 449 2.304 13.933 -1.864 1.00 10.00 H new ATOM 0 HG2 LYS A 449 -0.122 13.047 -2.673 1.00 10.00 H new ATOM 0 HG3 LYS A 449 -0.511 14.742 -2.453 1.00 10.00 H new ATOM 0 HD2 LYS A 449 1.853 13.744 -4.092 1.00 10.00 H new ATOM 0 HD3 LYS A 449 0.288 14.137 -4.775 1.00 10.00 H new ATOM 0 HE2 LYS A 449 0.561 16.413 -4.478 1.00 10.00 H new ATOM 0 HE3 LYS A 449 1.534 16.223 -3.033 1.00 10.00 H new ATOM 0 HZ1 LYS A 449 2.852 17.040 -4.875 1.00 10.00 H new ATOM 0 HZ2 LYS A 449 3.394 15.499 -4.414 1.00 10.00 H new ATOM 0 HZ3 LYS A 449 2.451 15.683 -5.814 1.00 10.00 H new ATOM 631 N ASN A 450 2.404 11.515 0.788 1.00 10.00 N ATOM 632 CA ASN A 450 3.587 11.043 1.498 1.00 10.00 C ATOM 633 C ASN A 450 4.154 9.780 0.862 1.00 10.00 C ATOM 634 O ASN A 450 5.314 9.747 0.452 1.00 10.00 O ATOM 635 CB ASN A 450 3.260 10.785 2.975 1.00 10.00 C ATOM 636 CG ASN A 450 1.999 9.958 3.165 1.00 10.00 C ATOM 637 OD1 ASN A 450 1.175 9.845 2.258 1.00 10.00 O ATOM 638 ND2 ASN A 450 1.845 9.368 4.346 1.00 10.00 N ATOM 0 H ASN A 450 1.686 10.805 0.643 1.00 10.00 H new ATOM 0 HA ASN A 450 4.344 11.824 1.431 1.00 10.00 H new ATOM 0 HB2 ASN A 450 4.099 10.271 3.444 1.00 10.00 H new ATOM 0 HB3 ASN A 450 3.143 11.739 3.488 1.00 10.00 H new ATOM 0 HD21 ASN A 450 1.020 8.796 4.527 1.00 10.00 H new ATOM 0 HD22 ASN A 450 2.552 9.487 5.072 1.00 10.00 H new ATOM 645 N PHE A 451 3.336 8.735 0.798 1.00 10.00 N ATOM 646 CA PHE A 451 3.759 7.459 0.232 1.00 10.00 C ATOM 647 C PHE A 451 4.789 6.775 1.131 1.00 10.00 C ATOM 648 O PHE A 451 5.292 5.700 0.806 1.00 10.00 O ATOM 649 CB PHE A 451 4.318 7.656 -1.183 1.00 10.00 C ATOM 650 CG PHE A 451 3.699 6.747 -2.211 1.00 10.00 C ATOM 651 CD1 PHE A 451 2.360 6.403 -2.131 1.00 10.00 C ATOM 652 CD2 PHE A 451 4.453 6.242 -3.258 1.00 10.00 C ATOM 653 CE1 PHE A 451 1.783 5.574 -3.070 1.00 10.00 C ATOM 654 CE2 PHE A 451 3.882 5.409 -4.202 1.00 10.00 C ATOM 655 CZ PHE A 451 2.544 5.075 -4.108 1.00 10.00 C ATOM 0 H PHE A 451 2.372 8.747 1.133 1.00 10.00 H new ATOM 0 HA PHE A 451 2.885 6.810 0.169 1.00 10.00 H new ATOM 0 HB2 PHE A 451 4.161 8.691 -1.485 1.00 10.00 H new ATOM 0 HB3 PHE A 451 5.395 7.489 -1.165 1.00 10.00 H new ATOM 0 HD1 PHE A 451 1.759 6.790 -1.321 1.00 10.00 H new ATOM 0 HD2 PHE A 451 5.498 6.502 -3.337 1.00 10.00 H new ATOM 0 HE1 PHE A 451 0.737 5.316 -2.993 1.00 10.00 H new ATOM 0 HE2 PHE A 451 4.481 5.020 -5.012 1.00 10.00 H new ATOM 0 HZ PHE A 451 2.095 4.425 -4.845 1.00 10.00 H new ATOM 665 N GLY A 452 5.076 7.392 2.277 1.00 10.00 N ATOM 666 CA GLY A 452 6.015 6.821 3.219 1.00 10.00 C ATOM 667 C GLY A 452 5.294 6.030 4.286 1.00 10.00 C ATOM 668 O GLY A 452 5.760 4.973 4.713 1.00 10.00 O ATOM 0 H GLY A 452 4.670 8.282 2.567 1.00 10.00 H new ATOM 0 HA2 GLY A 452 6.717 6.174 2.693 1.00 10.00 H new ATOM 0 HA3 GLY A 452 6.600 7.615 3.682 1.00 10.00 H new ATOM 672 N LEU A 453 4.134 6.537 4.700 1.00 10.00 N ATOM 673 CA LEU A 453 3.324 5.864 5.703 1.00 10.00 C ATOM 674 C LEU A 453 2.692 4.624 5.101 1.00 10.00 C ATOM 675 O LEU A 453 2.842 3.518 5.618 1.00 10.00 O ATOM 676 CB LEU A 453 2.226 6.791 6.234 1.00 10.00 C ATOM 677 CG LEU A 453 1.152 6.099 7.077 1.00 10.00 C ATOM 678 CD1 LEU A 453 0.569 7.066 8.092 1.00 10.00 C ATOM 679 CD2 LEU A 453 0.054 5.521 6.187 1.00 10.00 C ATOM 0 H LEU A 453 3.738 7.411 4.354 1.00 10.00 H new ATOM 0 HA LEU A 453 3.971 5.583 6.534 1.00 10.00 H new ATOM 0 HB2 LEU A 453 2.690 7.574 6.834 1.00 10.00 H new ATOM 0 HB3 LEU A 453 1.744 7.281 5.388 1.00 10.00 H new ATOM 0 HG LEU A 453 1.618 5.274 7.617 1.00 10.00 H new ATOM 0 HD11 LEU A 453 -0.193 6.558 8.683 1.00 10.00 H new ATOM 0 HD12 LEU A 453 1.361 7.423 8.751 1.00 10.00 H new ATOM 0 HD13 LEU A 453 0.120 7.912 7.572 1.00 10.00 H new ATOM 0 HD21 LEU A 453 -0.698 5.034 6.807 1.00 10.00 H new ATOM 0 HD22 LEU A 453 -0.411 6.324 5.615 1.00 10.00 H new ATOM 0 HD23 LEU A 453 0.487 4.792 5.502 1.00 10.00 H new ATOM 691 N ILE A 454 1.984 4.820 3.997 1.00 10.00 N ATOM 692 CA ILE A 454 1.330 3.723 3.313 1.00 10.00 C ATOM 693 C ILE A 454 2.345 2.672 2.916 1.00 10.00 C ATOM 694 O ILE A 454 2.072 1.480 2.983 1.00 10.00 O ATOM 695 CB ILE A 454 0.550 4.231 2.093 1.00 10.00 C ATOM 696 CG1 ILE A 454 -0.762 4.803 2.579 1.00 10.00 C ATOM 697 CG2 ILE A 454 0.321 3.129 1.065 1.00 10.00 C ATOM 698 CD1 ILE A 454 -0.704 6.301 2.756 1.00 10.00 C ATOM 0 H ILE A 454 1.850 5.731 3.559 1.00 10.00 H new ATOM 0 HA ILE A 454 0.615 3.264 3.995 1.00 10.00 H new ATOM 0 HB ILE A 454 1.132 5.002 1.588 1.00 10.00 H new ATOM 0 HG12 ILE A 454 -1.550 4.554 1.868 1.00 10.00 H new ATOM 0 HG13 ILE A 454 -1.029 4.337 3.528 1.00 10.00 H new ATOM 0 HG21 ILE A 454 -0.235 3.531 0.218 1.00 10.00 H new ATOM 0 HG22 ILE A 454 1.282 2.747 0.720 1.00 10.00 H new ATOM 0 HG23 ILE A 454 -0.249 2.319 1.521 1.00 10.00 H new ATOM 0 HD11 ILE A 454 -1.670 6.664 3.106 1.00 10.00 H new ATOM 0 HD12 ILE A 454 0.064 6.551 3.487 1.00 10.00 H new ATOM 0 HD13 ILE A 454 -0.464 6.771 1.802 1.00 10.00 H new ATOM 710 N ALA A 455 3.532 3.127 2.551 1.00 10.00 N ATOM 711 CA ALA A 455 4.609 2.223 2.199 1.00 10.00 C ATOM 712 C ALA A 455 5.362 1.807 3.460 1.00 10.00 C ATOM 713 O ALA A 455 6.456 1.250 3.388 1.00 10.00 O ATOM 714 CB ALA A 455 5.553 2.883 1.209 1.00 10.00 C ATOM 0 H ALA A 455 3.772 4.117 2.491 1.00 10.00 H new ATOM 0 HA ALA A 455 4.189 1.335 1.727 1.00 10.00 H new ATOM 0 HB1 ALA A 455 6.356 2.191 0.955 1.00 10.00 H new ATOM 0 HB2 ALA A 455 5.005 3.150 0.306 1.00 10.00 H new ATOM 0 HB3 ALA A 455 5.977 3.783 1.655 1.00 10.00 H new ATOM 720 N SER A 456 4.763 2.094 4.620 1.00 10.00 N ATOM 721 CA SER A 456 5.372 1.763 5.899 1.00 10.00 C ATOM 722 C SER A 456 4.514 0.779 6.688 1.00 10.00 C ATOM 723 O SER A 456 5.043 -0.068 7.407 1.00 10.00 O ATOM 724 CB SER A 456 5.599 3.033 6.723 1.00 10.00 C ATOM 725 OG SER A 456 6.915 3.526 6.547 1.00 10.00 O ATOM 0 H SER A 456 3.856 2.555 4.693 1.00 10.00 H new ATOM 0 HA SER A 456 6.332 1.288 5.696 1.00 10.00 H new ATOM 0 HB2 SER A 456 4.879 3.796 6.427 1.00 10.00 H new ATOM 0 HB3 SER A 456 5.424 2.822 7.778 1.00 10.00 H new ATOM 0 HG SER A 456 6.926 4.175 5.813 1.00 10.00 H new ATOM 731 N PHE A 457 3.188 0.879 6.557 1.00 10.00 N ATOM 732 CA PHE A 457 2.306 -0.036 7.278 1.00 10.00 C ATOM 733 C PHE A 457 2.282 -1.401 6.591 1.00 10.00 C ATOM 734 O PHE A 457 2.004 -2.422 7.222 1.00 10.00 O ATOM 735 CB PHE A 457 0.893 0.550 7.422 1.00 10.00 C ATOM 736 CG PHE A 457 0.049 0.469 6.183 1.00 10.00 C ATOM 737 CD1 PHE A 457 -0.431 -0.752 5.733 1.00 10.00 C ATOM 738 CD2 PHE A 457 -0.271 1.616 5.473 1.00 10.00 C ATOM 739 CE1 PHE A 457 -1.209 -0.827 4.596 1.00 10.00 C ATOM 740 CE2 PHE A 457 -1.050 1.546 4.337 1.00 10.00 C ATOM 741 CZ PHE A 457 -1.518 0.327 3.897 1.00 10.00 C ATOM 0 H PHE A 457 2.713 1.567 5.973 1.00 10.00 H new ATOM 0 HA PHE A 457 2.699 -0.172 8.285 1.00 10.00 H new ATOM 0 HB2 PHE A 457 0.379 0.029 8.230 1.00 10.00 H new ATOM 0 HB3 PHE A 457 0.977 1.595 7.720 1.00 10.00 H new ATOM 0 HD1 PHE A 457 -0.193 -1.653 6.278 1.00 10.00 H new ATOM 0 HD2 PHE A 457 0.093 2.574 5.813 1.00 10.00 H new ATOM 0 HE1 PHE A 457 -1.576 -1.783 4.253 1.00 10.00 H new ATOM 0 HE2 PHE A 457 -1.293 2.446 3.792 1.00 10.00 H new ATOM 0 HZ PHE A 457 -2.126 0.272 3.006 1.00 10.00 H new ATOM 751 N LEU A 458 2.611 -1.411 5.302 1.00 10.00 N ATOM 752 CA LEU A 458 2.667 -2.645 4.524 1.00 10.00 C ATOM 753 C LEU A 458 4.111 -2.893 4.090 1.00 10.00 C ATOM 754 O LEU A 458 4.385 -3.213 2.935 1.00 10.00 O ATOM 755 CB LEU A 458 1.738 -2.561 3.309 1.00 10.00 C ATOM 756 CG LEU A 458 1.640 -1.179 2.670 1.00 10.00 C ATOM 757 CD1 LEU A 458 2.981 -0.793 2.068 1.00 10.00 C ATOM 758 CD2 LEU A 458 0.535 -1.139 1.616 1.00 10.00 C ATOM 0 H LEU A 458 2.844 -0.572 4.771 1.00 10.00 H new ATOM 0 HA LEU A 458 2.328 -3.479 5.139 1.00 10.00 H new ATOM 0 HB2 LEU A 458 2.083 -3.270 2.556 1.00 10.00 H new ATOM 0 HB3 LEU A 458 0.740 -2.877 3.611 1.00 10.00 H new ATOM 0 HG LEU A 458 1.382 -0.455 3.442 1.00 10.00 H new ATOM 0 HD11 LEU A 458 2.905 0.195 1.613 1.00 10.00 H new ATOM 0 HD12 LEU A 458 3.739 -0.775 2.851 1.00 10.00 H new ATOM 0 HD13 LEU A 458 3.262 -1.522 1.308 1.00 10.00 H new ATOM 0 HD21 LEU A 458 0.487 -0.143 1.177 1.00 10.00 H new ATOM 0 HD22 LEU A 458 0.750 -1.870 0.836 1.00 10.00 H new ATOM 0 HD23 LEU A 458 -0.421 -1.376 2.082 1.00 10.00 H new ATOM 770 N GLU A 459 5.015 -2.709 5.055 1.00 10.00 N ATOM 771 CA GLU A 459 6.468 -2.868 4.875 1.00 10.00 C ATOM 772 C GLU A 459 6.839 -3.795 3.721 1.00 10.00 C ATOM 773 O GLU A 459 7.754 -3.497 2.956 1.00 10.00 O ATOM 774 CB GLU A 459 7.095 -3.389 6.169 1.00 10.00 C ATOM 775 CG GLU A 459 6.750 -2.554 7.391 1.00 10.00 C ATOM 776 CD GLU A 459 7.630 -2.876 8.583 1.00 10.00 C ATOM 777 OE1 GLU A 459 8.107 -4.027 8.677 1.00 10.00 O ATOM 778 OE2 GLU A 459 7.844 -1.976 9.423 1.00 10.00 O ATOM 0 H GLU A 459 4.757 -2.440 6.004 1.00 10.00 H new ATOM 0 HA GLU A 459 6.860 -1.882 4.626 1.00 10.00 H new ATOM 0 HB2 GLU A 459 6.766 -4.415 6.335 1.00 10.00 H new ATOM 0 HB3 GLU A 459 8.178 -3.417 6.052 1.00 10.00 H new ATOM 0 HG2 GLU A 459 6.850 -1.497 7.145 1.00 10.00 H new ATOM 0 HG3 GLU A 459 5.707 -2.721 7.658 1.00 10.00 H new ATOM 785 N ARG A 460 6.133 -4.915 3.597 1.00 10.00 N ATOM 786 CA ARG A 460 6.402 -5.872 2.526 1.00 10.00 C ATOM 787 C ARG A 460 6.598 -5.150 1.196 1.00 10.00 C ATOM 788 O ARG A 460 7.320 -5.622 0.317 1.00 10.00 O ATOM 789 CB ARG A 460 5.255 -6.880 2.412 1.00 10.00 C ATOM 790 CG ARG A 460 5.554 -8.219 3.068 1.00 10.00 C ATOM 791 CD ARG A 460 5.886 -8.057 4.542 1.00 10.00 C ATOM 792 NE ARG A 460 6.963 -8.950 4.962 1.00 10.00 N ATOM 793 CZ ARG A 460 6.860 -10.277 4.984 1.00 10.00 C ATOM 794 NH1 ARG A 460 5.730 -10.867 4.613 1.00 10.00 N ATOM 795 NH2 ARG A 460 7.888 -11.014 5.379 1.00 10.00 N ATOM 0 H ARG A 460 5.373 -5.183 4.222 1.00 10.00 H new ATOM 0 HA ARG A 460 7.320 -6.408 2.769 1.00 10.00 H new ATOM 0 HB2 ARG A 460 4.361 -6.454 2.867 1.00 10.00 H new ATOM 0 HB3 ARG A 460 5.029 -7.043 1.358 1.00 10.00 H new ATOM 0 HG2 ARG A 460 4.693 -8.879 2.959 1.00 10.00 H new ATOM 0 HG3 ARG A 460 6.389 -8.697 2.557 1.00 10.00 H new ATOM 0 HD2 ARG A 460 6.175 -7.024 4.737 1.00 10.00 H new ATOM 0 HD3 ARG A 460 4.996 -8.257 5.138 1.00 10.00 H new ATOM 0 HE ARG A 460 7.846 -8.532 5.256 1.00 10.00 H new ATOM 0 HH11 ARG A 460 4.936 -10.303 4.309 1.00 10.00 H new ATOM 0 HH12 ARG A 460 5.656 -11.884 4.632 1.00 10.00 H new ATOM 0 HH21 ARG A 460 8.757 -10.564 5.666 1.00 10.00 H new ATOM 0 HH22 ARG A 460 7.810 -12.031 5.396 1.00 10.00 H new ATOM 809 N LYS A 461 5.952 -3.995 1.065 1.00 10.00 N ATOM 810 CA LYS A 461 6.048 -3.187 -0.143 1.00 10.00 C ATOM 811 C LYS A 461 7.091 -2.084 0.034 1.00 10.00 C ATOM 812 O LYS A 461 7.939 -2.158 0.923 1.00 10.00 O ATOM 813 CB LYS A 461 4.685 -2.570 -0.483 1.00 10.00 C ATOM 814 CG LYS A 461 3.493 -3.422 -0.067 1.00 10.00 C ATOM 815 CD LYS A 461 3.121 -4.425 -1.150 1.00 10.00 C ATOM 816 CE LYS A 461 4.234 -5.434 -1.388 1.00 10.00 C ATOM 817 NZ LYS A 461 3.737 -6.835 -1.333 1.00 10.00 N ATOM 0 H LYS A 461 5.352 -3.597 1.788 1.00 10.00 H new ATOM 0 HA LYS A 461 6.357 -3.833 -0.965 1.00 10.00 H new ATOM 0 HB2 LYS A 461 4.608 -1.597 0.001 1.00 10.00 H new ATOM 0 HB3 LYS A 461 4.635 -2.396 -1.558 1.00 10.00 H new ATOM 0 HG2 LYS A 461 3.727 -3.952 0.856 1.00 10.00 H new ATOM 0 HG3 LYS A 461 2.639 -2.778 0.143 1.00 10.00 H new ATOM 0 HD2 LYS A 461 2.210 -4.949 -0.863 1.00 10.00 H new ATOM 0 HD3 LYS A 461 2.905 -3.895 -2.078 1.00 10.00 H new ATOM 0 HE2 LYS A 461 4.689 -5.249 -2.361 1.00 10.00 H new ATOM 0 HE3 LYS A 461 5.014 -5.296 -0.639 1.00 10.00 H new ATOM 0 HZ1 LYS A 461 4.346 -7.443 -1.918 1.00 10.00 H new ATOM 0 HZ2 LYS A 461 3.755 -7.171 -0.349 1.00 10.00 H new ATOM 0 HZ3 LYS A 461 2.762 -6.872 -1.694 1.00 10.00 H new ATOM 831 N THR A 462 7.023 -1.062 -0.811 1.00 10.00 N ATOM 832 CA THR A 462 7.961 0.052 -0.737 1.00 10.00 C ATOM 833 C THR A 462 7.321 1.327 -1.275 1.00 10.00 C ATOM 834 O THR A 462 6.290 1.277 -1.946 1.00 10.00 O ATOM 835 CB THR A 462 9.238 -0.267 -1.520 1.00 10.00 C ATOM 836 OG1 THR A 462 9.172 -1.564 -2.086 1.00 10.00 O ATOM 837 CG2 THR A 462 10.490 -0.201 -0.672 1.00 10.00 C ATOM 0 H THR A 462 6.329 -0.981 -1.554 1.00 10.00 H new ATOM 0 HA THR A 462 8.223 0.208 0.309 1.00 10.00 H new ATOM 0 HB THR A 462 9.299 0.498 -2.294 1.00 10.00 H new ATOM 0 HG1 THR A 462 9.997 -1.746 -2.583 1.00 10.00 H new ATOM 0 HG21 THR A 462 11.359 -0.437 -1.287 1.00 10.00 H new ATOM 0 HG22 THR A 462 10.599 0.803 -0.261 1.00 10.00 H new ATOM 0 HG23 THR A 462 10.416 -0.921 0.143 1.00 10.00 H new ATOM 845 N VAL A 463 7.936 2.467 -0.983 1.00 10.00 N ATOM 846 CA VAL A 463 7.417 3.747 -1.446 1.00 10.00 C ATOM 847 C VAL A 463 7.458 3.822 -2.967 1.00 10.00 C ATOM 848 O VAL A 463 6.453 4.127 -3.610 1.00 10.00 O ATOM 849 CB VAL A 463 8.209 4.930 -0.852 1.00 10.00 C ATOM 850 CG1 VAL A 463 7.540 6.251 -1.198 1.00 10.00 C ATOM 851 CG2 VAL A 463 8.349 4.777 0.656 1.00 10.00 C ATOM 0 H VAL A 463 8.791 2.531 -0.430 1.00 10.00 H new ATOM 0 HA VAL A 463 6.384 3.819 -1.106 1.00 10.00 H new ATOM 0 HB VAL A 463 9.207 4.928 -1.290 1.00 10.00 H new ATOM 0 HG11 VAL A 463 8.114 7.073 -0.770 1.00 10.00 H new ATOM 0 HG12 VAL A 463 7.497 6.364 -2.281 1.00 10.00 H new ATOM 0 HG13 VAL A 463 6.529 6.264 -0.791 1.00 10.00 H new ATOM 0 HG21 VAL A 463 8.911 5.621 1.057 1.00 10.00 H new ATOM 0 HG22 VAL A 463 7.360 4.750 1.112 1.00 10.00 H new ATOM 0 HG23 VAL A 463 8.877 3.850 0.880 1.00 10.00 H new ATOM 861 N ALA A 464 8.619 3.525 -3.538 1.00 10.00 N ATOM 862 CA ALA A 464 8.782 3.540 -4.984 1.00 10.00 C ATOM 863 C ALA A 464 8.111 2.321 -5.607 1.00 10.00 C ATOM 864 O ALA A 464 7.714 2.343 -6.772 1.00 10.00 O ATOM 865 CB ALA A 464 10.257 3.585 -5.353 1.00 10.00 C ATOM 0 H ALA A 464 9.461 3.271 -3.021 1.00 10.00 H new ATOM 0 HA ALA A 464 8.302 4.436 -5.377 1.00 10.00 H new ATOM 0 HB1 ALA A 464 10.360 3.596 -6.438 1.00 10.00 H new ATOM 0 HB2 ALA A 464 10.709 4.485 -4.936 1.00 10.00 H new ATOM 0 HB3 ALA A 464 10.760 2.706 -4.949 1.00 10.00 H new ATOM 871 N GLU A 465 7.982 1.258 -4.817 1.00 10.00 N ATOM 872 CA GLU A 465 7.353 0.030 -5.280 1.00 10.00 C ATOM 873 C GLU A 465 5.833 0.151 -5.232 1.00 10.00 C ATOM 874 O GLU A 465 5.128 -0.470 -6.026 1.00 10.00 O ATOM 875 CB GLU A 465 7.810 -1.157 -4.429 1.00 10.00 C ATOM 876 CG GLU A 465 7.385 -2.505 -4.987 1.00 10.00 C ATOM 877 CD GLU A 465 7.535 -3.627 -3.978 1.00 10.00 C ATOM 878 OE1 GLU A 465 8.621 -3.738 -3.371 1.00 10.00 O ATOM 879 OE2 GLU A 465 6.568 -4.395 -3.794 1.00 10.00 O ATOM 0 H GLU A 465 8.307 1.225 -3.851 1.00 10.00 H new ATOM 0 HA GLU A 465 7.656 -0.138 -6.313 1.00 10.00 H new ATOM 0 HB2 GLU A 465 8.896 -1.135 -4.343 1.00 10.00 H new ATOM 0 HB3 GLU A 465 7.408 -1.047 -3.422 1.00 10.00 H new ATOM 0 HG2 GLU A 465 6.346 -2.449 -5.311 1.00 10.00 H new ATOM 0 HG3 GLU A 465 7.982 -2.733 -5.870 1.00 10.00 H new ATOM 886 N CYS A 466 5.335 0.959 -4.300 1.00 10.00 N ATOM 887 CA CYS A 466 3.898 1.161 -4.162 1.00 10.00 C ATOM 888 C CYS A 466 3.333 1.823 -5.413 1.00 10.00 C ATOM 889 O CYS A 466 2.152 1.672 -5.725 1.00 10.00 O ATOM 890 CB CYS A 466 3.587 2.005 -2.922 1.00 10.00 C ATOM 891 SG CYS A 466 2.865 1.067 -1.555 1.00 10.00 S ATOM 0 H CYS A 466 5.903 1.482 -3.633 1.00 10.00 H new ATOM 0 HA CYS A 466 3.424 0.187 -4.040 1.00 10.00 H new ATOM 0 HB2 CYS A 466 4.506 2.479 -2.578 1.00 10.00 H new ATOM 0 HB3 CYS A 466 2.901 2.805 -3.202 1.00 10.00 H new ATOM 0 HG CYS A 466 2.189 0.062 -2.028 1.00 10.00 H new ATOM 897 N VAL A 467 4.191 2.534 -6.144 1.00 10.00 N ATOM 898 CA VAL A 467 3.776 3.188 -7.378 1.00 10.00 C ATOM 899 C VAL A 467 3.126 2.174 -8.314 1.00 10.00 C ATOM 900 O VAL A 467 2.352 2.532 -9.200 1.00 10.00 O ATOM 901 CB VAL A 467 4.973 3.853 -8.095 1.00 10.00 C ATOM 902 CG1 VAL A 467 4.590 4.311 -9.499 1.00 10.00 C ATOM 903 CG2 VAL A 467 5.500 5.021 -7.276 1.00 10.00 C ATOM 0 H VAL A 467 5.173 2.670 -5.902 1.00 10.00 H new ATOM 0 HA VAL A 467 3.057 3.964 -7.116 1.00 10.00 H new ATOM 0 HB VAL A 467 5.764 3.109 -8.191 1.00 10.00 H new ATOM 0 HG11 VAL A 467 5.452 4.775 -9.978 1.00 10.00 H new ATOM 0 HG12 VAL A 467 4.267 3.452 -10.087 1.00 10.00 H new ATOM 0 HG13 VAL A 467 3.777 5.034 -9.437 1.00 10.00 H new ATOM 0 HG21 VAL A 467 6.343 5.478 -7.795 1.00 10.00 H new ATOM 0 HG22 VAL A 467 4.710 5.760 -7.146 1.00 10.00 H new ATOM 0 HG23 VAL A 467 5.826 4.663 -6.300 1.00 10.00 H new ATOM 913 N LEU A 468 3.448 0.902 -8.107 1.00 10.00 N ATOM 914 CA LEU A 468 2.900 -0.166 -8.925 1.00 10.00 C ATOM 915 C LEU A 468 1.400 -0.340 -8.691 1.00 10.00 C ATOM 916 O LEU A 468 0.753 -1.120 -9.383 1.00 10.00 O ATOM 917 CB LEU A 468 3.637 -1.476 -8.635 1.00 10.00 C ATOM 918 CG LEU A 468 4.138 -2.225 -9.871 1.00 10.00 C ATOM 919 CD1 LEU A 468 5.170 -1.394 -10.616 1.00 10.00 C ATOM 920 CD2 LEU A 468 4.722 -3.573 -9.475 1.00 10.00 C ATOM 0 H LEU A 468 4.088 0.588 -7.377 1.00 10.00 H new ATOM 0 HA LEU A 468 3.042 0.105 -9.971 1.00 10.00 H new ATOM 0 HB2 LEU A 468 4.489 -1.261 -7.990 1.00 10.00 H new ATOM 0 HB3 LEU A 468 2.971 -2.133 -8.076 1.00 10.00 H new ATOM 0 HG LEU A 468 3.292 -2.398 -10.536 1.00 10.00 H new ATOM 0 HD11 LEU A 468 5.515 -1.943 -11.492 1.00 10.00 H new ATOM 0 HD12 LEU A 468 4.720 -0.453 -10.931 1.00 10.00 H new ATOM 0 HD13 LEU A 468 6.016 -1.190 -9.959 1.00 10.00 H new ATOM 0 HD21 LEU A 468 5.074 -4.093 -10.366 1.00 10.00 H new ATOM 0 HD22 LEU A 468 5.556 -3.421 -8.790 1.00 10.00 H new ATOM 0 HD23 LEU A 468 3.955 -4.172 -8.985 1.00 10.00 H new ATOM 932 N TYR A 469 0.855 0.390 -7.718 1.00 10.00 N ATOM 933 CA TYR A 469 -0.566 0.318 -7.404 1.00 10.00 C ATOM 934 C TYR A 469 -1.258 1.658 -7.668 1.00 10.00 C ATOM 935 O TYR A 469 -2.485 1.751 -7.624 1.00 10.00 O ATOM 936 CB TYR A 469 -0.760 -0.135 -5.945 1.00 10.00 C ATOM 937 CG TYR A 469 -1.211 0.917 -4.951 1.00 10.00 C ATOM 938 CD1 TYR A 469 -0.723 2.215 -5.009 1.00 10.00 C ATOM 939 CD2 TYR A 469 -2.115 0.599 -3.938 1.00 10.00 C ATOM 940 CE1 TYR A 469 -1.120 3.171 -4.098 1.00 10.00 C ATOM 941 CE2 TYR A 469 -2.518 1.554 -3.026 1.00 10.00 C ATOM 942 CZ TYR A 469 -2.018 2.838 -3.111 1.00 10.00 C ATOM 943 OH TYR A 469 -2.409 3.788 -2.201 1.00 10.00 O ATOM 0 H TYR A 469 1.381 1.039 -7.133 1.00 10.00 H new ATOM 0 HA TYR A 469 -1.031 -0.419 -8.058 1.00 10.00 H new ATOM 0 HB2 TYR A 469 -1.490 -0.944 -5.936 1.00 10.00 H new ATOM 0 HB3 TYR A 469 0.183 -0.552 -5.592 1.00 10.00 H new ATOM 0 HD1 TYR A 469 -0.018 2.482 -5.783 1.00 10.00 H new ATOM 0 HD2 TYR A 469 -2.504 -0.406 -3.866 1.00 10.00 H new ATOM 0 HE1 TYR A 469 -0.728 4.175 -4.159 1.00 10.00 H new ATOM 0 HE2 TYR A 469 -3.222 1.297 -2.248 1.00 10.00 H new ATOM 0 HH TYR A 469 -1.890 3.684 -1.376 1.00 10.00 H new ATOM 953 N TYR A 470 -0.461 2.699 -7.923 1.00 10.00 N ATOM 954 CA TYR A 470 -1.001 4.027 -8.168 1.00 10.00 C ATOM 955 C TYR A 470 -1.274 4.242 -9.653 1.00 10.00 C ATOM 956 O TYR A 470 -2.184 4.988 -10.018 1.00 10.00 O ATOM 957 CB TYR A 470 -0.046 5.099 -7.610 1.00 10.00 C ATOM 958 CG TYR A 470 0.593 5.997 -8.650 1.00 10.00 C ATOM 959 CD1 TYR A 470 1.399 5.470 -9.649 1.00 10.00 C ATOM 960 CD2 TYR A 470 0.391 7.370 -8.629 1.00 10.00 C ATOM 961 CE1 TYR A 470 1.987 6.282 -10.596 1.00 10.00 C ATOM 962 CE2 TYR A 470 0.976 8.193 -9.574 1.00 10.00 C ATOM 963 CZ TYR A 470 1.773 7.643 -10.556 1.00 10.00 C ATOM 964 OH TYR A 470 2.357 8.457 -11.499 1.00 10.00 O ATOM 0 H TYR A 470 0.557 2.642 -7.964 1.00 10.00 H new ATOM 0 HA TYR A 470 -1.955 4.116 -7.648 1.00 10.00 H new ATOM 0 HB2 TYR A 470 -0.596 5.721 -6.904 1.00 10.00 H new ATOM 0 HB3 TYR A 470 0.744 4.602 -7.047 1.00 10.00 H new ATOM 0 HD1 TYR A 470 1.569 4.404 -9.686 1.00 10.00 H new ATOM 0 HD2 TYR A 470 -0.234 7.803 -7.862 1.00 10.00 H new ATOM 0 HE1 TYR A 470 2.612 5.853 -11.365 1.00 10.00 H new ATOM 0 HE2 TYR A 470 0.810 9.260 -9.543 1.00 10.00 H new ATOM 0 HH TYR A 470 2.104 9.388 -11.329 1.00 10.00 H new ATOM 974 N TYR A 471 -0.494 3.587 -10.510 1.00 10.00 N ATOM 975 CA TYR A 471 -0.695 3.731 -11.944 1.00 10.00 C ATOM 976 C TYR A 471 -2.003 3.071 -12.369 1.00 10.00 C ATOM 977 O TYR A 471 -2.511 3.326 -13.460 1.00 10.00 O ATOM 978 CB TYR A 471 0.497 3.173 -12.731 1.00 10.00 C ATOM 979 CG TYR A 471 0.622 1.665 -12.714 1.00 10.00 C ATOM 980 CD1 TYR A 471 -0.289 0.862 -13.388 1.00 10.00 C ATOM 981 CD2 TYR A 471 1.667 1.044 -12.038 1.00 10.00 C ATOM 982 CE1 TYR A 471 -0.168 -0.514 -13.387 1.00 10.00 C ATOM 983 CE2 TYR A 471 1.796 -0.333 -12.037 1.00 10.00 C ATOM 984 CZ TYR A 471 0.876 -1.106 -12.711 1.00 10.00 C ATOM 985 OH TYR A 471 1.002 -2.477 -12.711 1.00 10.00 O ATOM 0 H TYR A 471 0.268 2.964 -10.241 1.00 10.00 H new ATOM 0 HA TYR A 471 -0.764 4.794 -12.174 1.00 10.00 H new ATOM 0 HB2 TYR A 471 0.418 3.505 -13.766 1.00 10.00 H new ATOM 0 HB3 TYR A 471 1.414 3.604 -12.328 1.00 10.00 H new ATOM 0 HD1 TYR A 471 -1.107 1.322 -13.923 1.00 10.00 H new ATOM 0 HD2 TYR A 471 2.389 1.646 -11.506 1.00 10.00 H new ATOM 0 HE1 TYR A 471 -0.888 -1.123 -13.914 1.00 10.00 H new ATOM 0 HE2 TYR A 471 2.615 -0.800 -11.510 1.00 10.00 H new ATOM 0 HH TYR A 471 1.791 -2.733 -12.189 1.00 10.00 H new ATOM 995 N LEU A 472 -2.565 2.251 -11.481 1.00 10.00 N ATOM 996 CA LEU A 472 -3.838 1.594 -11.749 1.00 10.00 C ATOM 997 C LEU A 472 -4.973 2.457 -11.218 1.00 10.00 C ATOM 998 O LEU A 472 -6.070 2.486 -11.776 1.00 10.00 O ATOM 999 CB LEU A 472 -3.888 0.215 -11.091 1.00 10.00 C ATOM 1000 CG LEU A 472 -2.693 -0.685 -11.384 1.00 10.00 C ATOM 1001 CD1 LEU A 472 -1.544 -0.371 -10.438 1.00 10.00 C ATOM 1002 CD2 LEU A 472 -3.091 -2.150 -11.279 1.00 10.00 C ATOM 0 H LEU A 472 -2.158 2.028 -10.573 1.00 10.00 H new ATOM 0 HA LEU A 472 -3.944 1.464 -12.826 1.00 10.00 H new ATOM 0 HB2 LEU A 472 -3.968 0.347 -10.012 1.00 10.00 H new ATOM 0 HB3 LEU A 472 -4.795 -0.294 -11.418 1.00 10.00 H new ATOM 0 HG LEU A 472 -2.358 -0.493 -12.403 1.00 10.00 H new ATOM 0 HD11 LEU A 472 -0.700 -1.023 -10.662 1.00 10.00 H new ATOM 0 HD12 LEU A 472 -1.243 0.669 -10.564 1.00 10.00 H new ATOM 0 HD13 LEU A 472 -1.865 -0.533 -9.409 1.00 10.00 H new ATOM 0 HD21 LEU A 472 -2.226 -2.778 -11.491 1.00 10.00 H new ATOM 0 HD22 LEU A 472 -3.452 -2.358 -10.272 1.00 10.00 H new ATOM 0 HD23 LEU A 472 -3.881 -2.365 -11.999 1.00 10.00 H new ATOM 1014 N THR A 473 -4.687 3.167 -10.130 1.00 10.00 N ATOM 1015 CA THR A 473 -5.657 4.048 -9.501 1.00 10.00 C ATOM 1016 C THR A 473 -6.008 5.211 -10.416 1.00 10.00 C ATOM 1017 O THR A 473 -7.164 5.629 -10.483 1.00 10.00 O ATOM 1018 CB THR A 473 -5.105 4.573 -8.173 1.00 10.00 C ATOM 1019 OG1 THR A 473 -4.015 5.450 -8.395 1.00 10.00 O ATOM 1020 CG2 THR A 473 -4.628 3.474 -7.245 1.00 10.00 C ATOM 0 H THR A 473 -3.780 3.146 -9.664 1.00 10.00 H new ATOM 0 HA THR A 473 -6.565 3.476 -9.311 1.00 10.00 H new ATOM 0 HB THR A 473 -5.939 5.090 -7.699 1.00 10.00 H new ATOM 0 HG1 THR A 473 -3.499 5.141 -9.168 1.00 10.00 H new ATOM 0 HG21 THR A 473 -4.249 3.915 -6.323 1.00 10.00 H new ATOM 0 HG22 THR A 473 -5.459 2.807 -7.014 1.00 10.00 H new ATOM 0 HG23 THR A 473 -3.832 2.908 -7.730 1.00 10.00 H new ATOM 1028 N LYS A 474 -5.009 5.743 -11.113 1.00 10.00 N ATOM 1029 CA LYS A 474 -5.236 6.868 -12.009 1.00 10.00 C ATOM 1030 C LYS A 474 -5.318 6.417 -13.466 1.00 10.00 C ATOM 1031 O LYS A 474 -5.347 7.245 -14.376 1.00 10.00 O ATOM 1032 CB LYS A 474 -4.134 7.921 -11.849 1.00 10.00 C ATOM 1033 CG LYS A 474 -3.583 8.045 -10.434 1.00 10.00 C ATOM 1034 CD LYS A 474 -2.079 8.268 -10.438 1.00 10.00 C ATOM 1035 CE LYS A 474 -1.701 9.526 -11.205 1.00 10.00 C ATOM 1036 NZ LYS A 474 -0.663 9.256 -12.239 1.00 10.00 N ATOM 0 H LYS A 474 -4.044 5.416 -11.075 1.00 10.00 H new ATOM 0 HA LYS A 474 -6.193 7.312 -11.736 1.00 10.00 H new ATOM 0 HB2 LYS A 474 -3.314 7.677 -12.525 1.00 10.00 H new ATOM 0 HB3 LYS A 474 -4.526 8.890 -12.159 1.00 10.00 H new ATOM 0 HG2 LYS A 474 -4.073 8.874 -9.923 1.00 10.00 H new ATOM 0 HG3 LYS A 474 -3.816 7.141 -9.871 1.00 10.00 H new ATOM 0 HD2 LYS A 474 -1.719 8.345 -9.412 1.00 10.00 H new ATOM 0 HD3 LYS A 474 -1.584 7.406 -10.885 1.00 10.00 H new ATOM 0 HE2 LYS A 474 -2.589 9.941 -11.682 1.00 10.00 H new ATOM 0 HE3 LYS A 474 -1.332 10.279 -10.508 1.00 10.00 H new ATOM 0 HZ1 LYS A 474 -0.409 10.145 -12.716 1.00 10.00 H new ATOM 0 HZ2 LYS A 474 0.182 8.852 -11.786 1.00 10.00 H new ATOM 0 HZ3 LYS A 474 -1.036 8.582 -12.938 1.00 10.00 H new ATOM 1050 N LYS A 475 -5.371 5.106 -13.683 1.00 10.00 N ATOM 1051 CA LYS A 475 -5.467 4.564 -15.031 1.00 10.00 C ATOM 1052 C LYS A 475 -6.918 4.564 -15.498 1.00 10.00 C ATOM 1053 O LYS A 475 -7.198 4.658 -16.694 1.00 10.00 O ATOM 1054 CB LYS A 475 -4.900 3.142 -15.077 1.00 10.00 C ATOM 1055 CG LYS A 475 -3.710 2.992 -16.012 1.00 10.00 C ATOM 1056 CD LYS A 475 -3.244 1.548 -16.092 1.00 10.00 C ATOM 1057 CE LYS A 475 -2.801 1.183 -17.500 1.00 10.00 C ATOM 1058 NZ LYS A 475 -1.775 2.127 -18.022 1.00 10.00 N ATOM 0 H LYS A 475 -5.349 4.403 -12.944 1.00 10.00 H new ATOM 0 HA LYS A 475 -4.882 5.195 -15.700 1.00 10.00 H new ATOM 0 HB2 LYS A 475 -4.601 2.846 -14.071 1.00 10.00 H new ATOM 0 HB3 LYS A 475 -5.687 2.456 -15.391 1.00 10.00 H new ATOM 0 HG2 LYS A 475 -3.981 3.344 -17.007 1.00 10.00 H new ATOM 0 HG3 LYS A 475 -2.891 3.621 -15.664 1.00 10.00 H new ATOM 0 HD2 LYS A 475 -2.418 1.392 -15.398 1.00 10.00 H new ATOM 0 HD3 LYS A 475 -4.052 0.886 -15.780 1.00 10.00 H new ATOM 0 HE2 LYS A 475 -2.397 0.171 -17.502 1.00 10.00 H new ATOM 0 HE3 LYS A 475 -3.665 1.183 -18.164 1.00 10.00 H new ATOM 0 HZ1 LYS A 475 -1.353 1.737 -18.889 1.00 10.00 H new ATOM 0 HZ2 LYS A 475 -2.222 3.042 -18.236 1.00 10.00 H new ATOM 0 HZ3 LYS A 475 -1.033 2.263 -17.307 1.00 10.00 H new ATOM 1072 N ASN A 476 -7.837 4.458 -14.543 1.00 10.00 N ATOM 1073 CA ASN A 476 -9.262 4.445 -14.847 1.00 10.00 C ATOM 1074 C ASN A 476 -10.002 5.556 -14.100 1.00 10.00 C ATOM 1075 O ASN A 476 -11.206 5.737 -14.284 1.00 10.00 O ATOM 1076 CB ASN A 476 -9.863 3.087 -14.482 1.00 10.00 C ATOM 1077 CG ASN A 476 -9.670 2.056 -15.576 1.00 10.00 C ATOM 1078 OD1 ASN A 476 -10.614 1.700 -16.283 1.00 10.00 O ATOM 1079 ND2 ASN A 476 -8.443 1.571 -15.722 1.00 10.00 N ATOM 0 H ASN A 476 -7.618 4.380 -13.550 1.00 10.00 H new ATOM 0 HA ASN A 476 -9.378 4.620 -15.917 1.00 10.00 H new ATOM 0 HB2 ASN A 476 -9.405 2.726 -13.561 1.00 10.00 H new ATOM 0 HB3 ASN A 476 -10.928 3.206 -14.283 1.00 10.00 H new ATOM 0 HD21 ASN A 476 -8.252 0.875 -16.442 1.00 10.00 H new ATOM 0 HD22 ASN A 476 -7.691 1.895 -15.114 1.00 10.00 H new ATOM 1086 N GLU A 477 -9.287 6.298 -13.255 1.00 10.00 N ATOM 1087 CA GLU A 477 -9.897 7.379 -12.489 1.00 10.00 C ATOM 1088 C GLU A 477 -9.270 8.725 -12.837 1.00 10.00 C ATOM 1089 O GLU A 477 -9.947 9.754 -12.832 1.00 10.00 O ATOM 1090 CB GLU A 477 -9.756 7.112 -10.989 1.00 10.00 C ATOM 1091 CG GLU A 477 -10.202 5.718 -10.575 1.00 10.00 C ATOM 1092 CD GLU A 477 -10.767 5.680 -9.169 1.00 10.00 C ATOM 1093 OE1 GLU A 477 -11.137 6.754 -8.648 1.00 10.00 O ATOM 1094 OE2 GLU A 477 -10.840 4.577 -8.588 1.00 10.00 O ATOM 0 H GLU A 477 -8.289 6.170 -13.085 1.00 10.00 H new ATOM 0 HA GLU A 477 -10.955 7.417 -12.750 1.00 10.00 H new ATOM 0 HB2 GLU A 477 -8.715 7.252 -10.700 1.00 10.00 H new ATOM 0 HB3 GLU A 477 -10.341 7.850 -10.440 1.00 10.00 H new ATOM 0 HG2 GLU A 477 -10.956 5.359 -11.275 1.00 10.00 H new ATOM 0 HG3 GLU A 477 -9.355 5.035 -10.641 1.00 10.00 H new ATOM 1101 N ASN A 478 -7.975 8.716 -13.134 1.00 10.00 N ATOM 1102 CA ASN A 478 -7.263 9.941 -13.478 1.00 10.00 C ATOM 1103 C ASN A 478 -7.310 10.933 -12.320 1.00 10.00 C ATOM 1104 O ASN A 478 -8.363 11.488 -12.008 1.00 10.00 O ATOM 1105 CB ASN A 478 -7.867 10.573 -14.733 1.00 10.00 C ATOM 1106 CG ASN A 478 -6.845 11.352 -15.538 1.00 10.00 C ATOM 1107 OD1 ASN A 478 -5.737 11.615 -15.068 1.00 10.00 O ATOM 1108 ND2 ASN A 478 -7.212 11.726 -16.758 1.00 10.00 N ATOM 0 H ASN A 478 -7.398 7.875 -13.143 1.00 10.00 H new ATOM 0 HA ASN A 478 -6.222 9.687 -13.677 1.00 10.00 H new ATOM 0 HB2 ASN A 478 -8.299 9.791 -15.358 1.00 10.00 H new ATOM 0 HB3 ASN A 478 -8.682 11.237 -14.446 1.00 10.00 H new ATOM 0 HD21 ASN A 478 -6.566 12.253 -17.346 1.00 10.00 H new ATOM 0 HD22 ASN A 478 -8.140 11.487 -17.107 1.00 10.00 H new ATOM 1115 N TYR A 479 -6.163 11.148 -11.683 1.00 10.00 N ATOM 1116 CA TYR A 479 -6.078 12.070 -10.558 1.00 10.00 C ATOM 1117 C TYR A 479 -4.635 12.212 -10.081 1.00 10.00 C ATOM 1118 O TYR A 479 -3.951 11.218 -9.840 1.00 10.00 O ATOM 1119 CB TYR A 479 -6.965 11.583 -9.408 1.00 10.00 C ATOM 1120 CG TYR A 479 -6.419 10.369 -8.690 1.00 10.00 C ATOM 1121 CD1 TYR A 479 -6.454 9.112 -9.279 1.00 10.00 C ATOM 1122 CD2 TYR A 479 -5.861 10.484 -7.422 1.00 10.00 C ATOM 1123 CE1 TYR A 479 -5.952 8.003 -8.626 1.00 10.00 C ATOM 1124 CE2 TYR A 479 -5.357 9.380 -6.762 1.00 10.00 C ATOM 1125 CZ TYR A 479 -5.404 8.142 -7.368 1.00 10.00 C ATOM 1126 OH TYR A 479 -4.903 7.041 -6.713 1.00 10.00 O ATOM 0 H TYR A 479 -5.281 10.697 -11.927 1.00 10.00 H new ATOM 0 HA TYR A 479 -6.429 13.047 -10.890 1.00 10.00 H new ATOM 0 HB2 TYR A 479 -7.090 12.393 -8.690 1.00 10.00 H new ATOM 0 HB3 TYR A 479 -7.955 11.348 -9.799 1.00 10.00 H new ATOM 0 HD1 TYR A 479 -6.881 8.999 -10.265 1.00 10.00 H new ATOM 0 HD2 TYR A 479 -5.821 11.452 -6.945 1.00 10.00 H new ATOM 0 HE1 TYR A 479 -5.988 7.032 -9.098 1.00 10.00 H new ATOM 0 HE2 TYR A 479 -4.928 9.486 -5.776 1.00 10.00 H new ATOM 0 HH TYR A 479 -4.136 6.686 -7.210 1.00 10.00 H new ATOM 1136 N LYS A 480 -4.181 13.452 -9.947 1.00 10.00 N ATOM 1137 CA LYS A 480 -2.821 13.721 -9.496 1.00 10.00 C ATOM 1138 C LYS A 480 -2.699 15.143 -8.955 1.00 10.00 C ATOM 1139 O LYS A 480 -3.609 15.955 -9.219 1.00 10.00 O ATOM 1140 CB LYS A 480 -1.830 13.511 -10.642 1.00 10.00 C ATOM 1141 CG LYS A 480 -2.242 14.194 -11.936 1.00 10.00 C ATOM 1142 CD LYS A 480 -1.649 15.590 -12.042 1.00 10.00 C ATOM 1143 CE LYS A 480 -2.585 16.538 -12.777 1.00 10.00 C ATOM 1144 NZ LYS A 480 -3.357 17.395 -11.836 1.00 10.00 N ATOM 1145 OXT LYS A 480 -1.693 15.430 -8.272 1.00 10.00 O ATOM 0 H LYS A 480 -4.734 14.286 -10.144 1.00 10.00 H new ATOM 0 HA LYS A 480 -2.587 13.024 -8.691 1.00 10.00 H new ATOM 0 HB2 LYS A 480 -0.852 13.885 -10.339 1.00 10.00 H new ATOM 0 HB3 LYS A 480 -1.720 12.442 -10.824 1.00 10.00 H new ATOM 0 HG2 LYS A 480 -1.916 13.594 -12.785 1.00 10.00 H new ATOM 0 HG3 LYS A 480 -3.329 14.254 -11.987 1.00 10.00 H new ATOM 0 HD2 LYS A 480 -1.447 15.978 -11.043 1.00 10.00 H new ATOM 0 HD3 LYS A 480 -0.694 15.542 -12.565 1.00 10.00 H new ATOM 0 HE2 LYS A 480 -2.006 17.169 -13.452 1.00 10.00 H new ATOM 0 HE3 LYS A 480 -3.275 15.962 -13.393 1.00 10.00 H new ATOM 0 HZ1 LYS A 480 -4.304 17.575 -12.227 1.00 10.00 H new ATOM 0 HZ2 LYS A 480 -3.447 16.911 -10.920 1.00 10.00 H new ATOM 0 HZ3 LYS A 480 -2.860 18.299 -11.702 1.00 10.00 H new TER 1159 LYS A 480