USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 842 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 527 ASN : amide:sc= 0.371 K(o=0.56,f=-3.3!) USER MOD Set 1.2: A 529 ASN : amide:sc= 0.191 X(o=0.56,f=0.18) USER MOD Set 2.1: A 514 ASN : amide:sc= 0.604 K(o=0.14,f=-3.4!) USER MOD Set 2.2: A 534 THR OG1 : rot 180:sc= -0.462 USER MOD Set 3.1: A 506 THR OG1 : rot 40:sc= 0.812 USER MOD Set 3.2: A 507 GLN : amide:sc= 0.395 K(o=1.2,f=-1.3) USER MOD Set 4.1: A 472 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 522 THR OG1 : rot -39:sc= -0.305 USER MOD Single : A 435 MET CE :methyl -147:sc= 0 (180deg=-0.569) USER MOD Single : A 441 THR OG1 : rot 180:sc= 0 USER MOD Single : A 445 LYS NZ :NH3+ -172:sc=-0.00786 (180deg=-0.153) USER MOD Single : A 453 ASN : amide:sc= -0.465 K(o=-0.47,f=-3.1) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -148:sc= -0.0384 USER MOD Single : A 461 HIS : no HE2:sc= 0.847 K(o=0.85,f=-3.2!) USER MOD Single : A 463 LYS NZ :NH3+ 133:sc= 1.26 (180deg=-0.0749) USER MOD Single : A 464 ASN : amide:sc= -0.299 K(o=-0.3,f=-8.6!) USER MOD Single : A 473 THR OG1 : rot 95:sc= 0.088 USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 478 TYR OH : rot 35:sc= 0.752 USER MOD Single : A 480 ASN : amide:sc= 0.477 K(o=0.48,f=-8.8!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 61:sc= -0.145 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 488 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 172:sc= 1.03 (180deg=0.934) USER MOD Single : A 497 LYS NZ :NH3+ 154:sc= -1.65! (180deg=-2.96!) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 27:sc= 0.601 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 510 MET CE :methyl -147:sc= -0.515 (180deg=-2.55!) USER MOD Single : A 511 TYR OH : rot 165:sc= -0.168 USER MOD Single : A 516 THR OG1 : rot 138:sc= 0.0187 USER MOD Single : A 521 ASN : amide:sc= -1.01 K(o=-1,f=0) USER MOD Single : A 530 ASN : amide:sc= -4.41! C(o=-4.4!,f=-5.1!) USER MOD Single : A 531 ASN : amide:sc= -0.828 K(o=-0.83,f=-0.12) USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 435 -11.087 16.866 20.232 1.00 0.00 N ATOM 2 CA MET A 435 -10.568 16.906 18.838 1.00 52.33 C ATOM 3 C MET A 435 -9.426 15.897 18.654 1.00 65.23 C ATOM 4 O MET A 435 -8.270 16.172 18.992 1.00 15.33 O ATOM 5 CB MET A 435 -10.092 18.328 18.486 1.00 21.12 C ATOM 6 CG MET A 435 -9.692 18.505 17.026 1.00 64.03 C ATOM 7 SD MET A 435 -9.203 20.199 16.638 1.00 74.21 S ATOM 8 CE MET A 435 -8.885 20.074 14.877 1.00 74.44 C ATOM 0 HA MET A 435 -11.377 16.631 18.162 1.00 52.33 H new ATOM 0 HB2 MET A 435 -10.887 19.035 18.722 1.00 21.12 H new ATOM 0 HB3 MET A 435 -9.241 18.582 19.118 1.00 21.12 H new ATOM 0 HG2 MET A 435 -8.867 17.831 16.795 1.00 64.03 H new ATOM 0 HG3 MET A 435 -10.527 18.217 16.387 1.00 64.03 H new ATOM 0 HE1 MET A 435 -8.079 20.755 14.604 1.00 74.44 H new ATOM 0 HE2 MET A 435 -8.596 19.052 14.631 1.00 74.44 H new ATOM 0 HE3 MET A 435 -9.787 20.339 14.325 1.00 74.44 H new ATOM 20 N GLU A 436 -9.765 14.718 18.135 1.00 54.23 N ATOM 21 CA GLU A 436 -8.799 13.626 17.956 1.00 3.23 C ATOM 22 C GLU A 436 -8.240 13.604 16.529 1.00 53.32 C ATOM 23 O GLU A 436 -8.875 14.089 15.589 1.00 43.24 O ATOM 24 CB GLU A 436 -9.451 12.264 18.260 1.00 73.31 C ATOM 25 CG GLU A 436 -10.020 12.128 19.672 1.00 73.24 C ATOM 26 CD GLU A 436 -11.222 13.028 19.918 1.00 10.52 C ATOM 27 OE1 GLU A 436 -12.303 12.743 19.358 1.00 21.01 O ATOM 28 OE2 GLU A 436 -11.089 14.031 20.656 1.00 41.11 O ATOM 0 H GLU A 436 -10.710 14.490 17.827 1.00 54.23 H new ATOM 0 HA GLU A 436 -7.981 13.803 18.655 1.00 3.23 H new ATOM 0 HB2 GLU A 436 -10.253 12.092 17.542 1.00 73.31 H new ATOM 0 HB3 GLU A 436 -8.710 11.479 18.104 1.00 73.31 H new ATOM 0 HG2 GLU A 436 -10.309 11.091 19.843 1.00 73.24 H new ATOM 0 HG3 GLU A 436 -9.241 12.366 20.396 1.00 73.24 H new ATOM 35 N PHE A 437 -7.056 13.025 16.366 1.00 4.25 N ATOM 36 CA PHE A 437 -6.434 12.905 15.046 1.00 52.40 C ATOM 37 C PHE A 437 -6.091 11.441 14.732 1.00 4.35 C ATOM 38 O PHE A 437 -5.467 10.753 15.542 1.00 14.34 O ATOM 39 CB PHE A 437 -5.176 13.777 14.969 1.00 52.04 C ATOM 40 CG PHE A 437 -5.446 15.236 15.239 1.00 13.14 C ATOM 41 CD1 PHE A 437 -5.932 16.064 14.236 1.00 24.20 C ATOM 42 CD2 PHE A 437 -5.224 15.778 16.498 1.00 53.51 C ATOM 43 CE1 PHE A 437 -6.191 17.398 14.485 1.00 71.43 C ATOM 44 CE2 PHE A 437 -5.481 17.113 16.749 1.00 52.24 C ATOM 45 CZ PHE A 437 -5.963 17.922 15.741 1.00 0.10 C ATOM 0 H PHE A 437 -6.505 12.631 17.129 1.00 4.25 H new ATOM 0 HA PHE A 437 -7.148 13.253 14.300 1.00 52.40 H new ATOM 0 HB2 PHE A 437 -4.443 13.411 15.688 1.00 52.04 H new ATOM 0 HB3 PHE A 437 -4.730 13.674 13.980 1.00 52.04 H new ATOM 0 HD1 PHE A 437 -6.110 15.661 13.250 1.00 24.20 H new ATOM 0 HD2 PHE A 437 -4.846 15.149 17.291 1.00 53.51 H new ATOM 0 HE1 PHE A 437 -6.572 18.031 13.697 1.00 71.43 H new ATOM 0 HE2 PHE A 437 -5.305 17.522 17.733 1.00 52.24 H new ATOM 0 HZ PHE A 437 -6.162 18.966 15.935 1.00 0.10 H new ATOM 55 N PRO A 438 -6.525 10.936 13.564 1.00 34.01 N ATOM 56 CA PRO A 438 -6.230 9.563 13.132 1.00 32.02 C ATOM 57 C PRO A 438 -4.768 9.366 12.719 1.00 23.14 C ATOM 58 O PRO A 438 -3.974 10.305 12.703 1.00 10.21 O ATOM 59 CB PRO A 438 -7.170 9.357 11.942 1.00 1.42 C ATOM 60 CG PRO A 438 -7.386 10.724 11.395 1.00 4.55 C ATOM 61 CD PRO A 438 -7.339 11.662 12.571 1.00 53.52 C ATOM 0 HA PRO A 438 -6.379 8.845 13.938 1.00 32.02 H new ATOM 0 HB2 PRO A 438 -6.727 8.697 11.196 1.00 1.42 H new ATOM 0 HB3 PRO A 438 -8.110 8.901 12.253 1.00 1.42 H new ATOM 0 HG2 PRO A 438 -6.617 10.977 10.665 1.00 4.55 H new ATOM 0 HG3 PRO A 438 -8.346 10.791 10.883 1.00 4.55 H new ATOM 0 HD2 PRO A 438 -6.887 12.617 12.304 1.00 53.52 H new ATOM 0 HD3 PRO A 438 -8.337 11.877 12.952 1.00 53.52 H new ATOM 69 N ASP A 439 -4.414 8.124 12.419 1.00 2.24 N ATOM 70 CA ASP A 439 -3.053 7.795 12.005 1.00 12.10 C ATOM 71 C ASP A 439 -3.073 6.588 11.052 1.00 15.34 C ATOM 72 O ASP A 439 -2.874 5.444 11.469 1.00 34.12 O ATOM 73 CB ASP A 439 -2.197 7.523 13.251 1.00 14.12 C ATOM 74 CG ASP A 439 -0.709 7.495 12.958 1.00 23.24 C ATOM 75 OD1 ASP A 439 -0.154 8.545 12.572 1.00 62.30 O ATOM 76 OD2 ASP A 439 -0.082 6.430 13.134 1.00 1.02 O ATOM 0 H ASP A 439 -5.049 7.326 12.454 1.00 2.24 H new ATOM 0 HA ASP A 439 -2.612 8.633 11.465 1.00 12.10 H new ATOM 0 HB2 ASP A 439 -2.399 8.291 13.998 1.00 14.12 H new ATOM 0 HB3 ASP A 439 -2.493 6.569 13.686 1.00 14.12 H new ATOM 81 N LEU A 440 -3.367 6.856 9.782 1.00 64.22 N ATOM 82 CA LEU A 440 -3.506 5.812 8.762 1.00 33.23 C ATOM 83 C LEU A 440 -2.142 5.421 8.166 1.00 3.34 C ATOM 84 O LEU A 440 -1.562 6.161 7.371 1.00 15.13 O ATOM 85 CB LEU A 440 -4.434 6.294 7.632 1.00 12.22 C ATOM 86 CG LEU A 440 -5.804 6.837 8.078 1.00 60.01 C ATOM 87 CD1 LEU A 440 -6.558 7.432 6.887 1.00 54.41 C ATOM 88 CD2 LEU A 440 -6.635 5.746 8.749 1.00 24.34 C ATOM 0 H LEU A 440 -3.516 7.801 9.428 1.00 64.22 H new ATOM 0 HA LEU A 440 -3.936 4.935 9.246 1.00 33.23 H new ATOM 0 HB2 LEU A 440 -3.919 7.075 7.072 1.00 12.22 H new ATOM 0 HB3 LEU A 440 -4.599 5.465 6.944 1.00 12.22 H new ATOM 0 HG LEU A 440 -5.633 7.627 8.810 1.00 60.01 H new ATOM 0 HD11 LEU A 440 -7.524 7.811 7.220 1.00 54.41 H new ATOM 0 HD12 LEU A 440 -5.976 8.248 6.459 1.00 54.41 H new ATOM 0 HD13 LEU A 440 -6.712 6.661 6.132 1.00 54.41 H new ATOM 0 HD21 LEU A 440 -7.597 6.157 9.054 1.00 24.34 H new ATOM 0 HD22 LEU A 440 -6.796 4.928 8.047 1.00 24.34 H new ATOM 0 HD23 LEU A 440 -6.106 5.373 9.626 1.00 24.34 H new ATOM 100 N THR A 441 -1.638 4.255 8.548 1.00 64.35 N ATOM 101 CA THR A 441 -0.364 3.757 8.014 1.00 5.04 C ATOM 102 C THR A 441 -0.571 2.514 7.152 1.00 22.41 C ATOM 103 O THR A 441 -1.485 1.718 7.390 1.00 43.13 O ATOM 104 CB THR A 441 0.649 3.437 9.141 1.00 74.33 C ATOM 105 OG1 THR A 441 1.879 2.940 8.589 1.00 44.23 O ATOM 106 CG2 THR A 441 0.087 2.430 10.135 1.00 54.12 C ATOM 0 H THR A 441 -2.085 3.634 9.223 1.00 64.35 H new ATOM 0 HA THR A 441 0.045 4.556 7.396 1.00 5.04 H new ATOM 0 HB THR A 441 0.843 4.368 9.674 1.00 74.33 H new ATOM 0 HG1 THR A 441 2.508 2.745 9.315 1.00 44.23 H new ATOM 0 HG21 THR A 441 0.827 2.232 10.910 1.00 54.12 H new ATOM 0 HG22 THR A 441 -0.816 2.835 10.591 1.00 54.12 H new ATOM 0 HG23 THR A 441 -0.153 1.502 9.616 1.00 54.12 H new ATOM 114 N VAL A 442 0.275 2.354 6.139 1.00 24.34 N ATOM 115 CA VAL A 442 0.174 1.227 5.215 1.00 44.24 C ATOM 116 C VAL A 442 1.465 0.393 5.216 1.00 71.14 C ATOM 117 O VAL A 442 2.566 0.926 5.380 1.00 70.24 O ATOM 118 CB VAL A 442 -0.134 1.717 3.775 1.00 45.11 C ATOM 119 CG1 VAL A 442 -1.500 2.396 3.714 1.00 41.32 C ATOM 120 CG2 VAL A 442 0.953 2.669 3.282 1.00 75.14 C ATOM 0 H VAL A 442 1.043 2.994 5.936 1.00 24.34 H new ATOM 0 HA VAL A 442 -0.648 0.597 5.556 1.00 44.24 H new ATOM 0 HB VAL A 442 -0.152 0.845 3.121 1.00 45.11 H new ATOM 0 HG11 VAL A 442 -1.694 2.731 2.695 1.00 41.32 H new ATOM 0 HG12 VAL A 442 -2.272 1.688 4.017 1.00 41.32 H new ATOM 0 HG13 VAL A 442 -1.510 3.254 4.386 1.00 41.32 H new ATOM 0 HG21 VAL A 442 0.716 2.999 2.271 1.00 75.14 H new ATOM 0 HG22 VAL A 442 1.006 3.534 3.943 1.00 75.14 H new ATOM 0 HG23 VAL A 442 1.914 2.154 3.280 1.00 75.14 H new ATOM 130 N GLU A 443 1.321 -0.915 5.017 1.00 11.21 N ATOM 131 CA GLU A 443 2.457 -1.847 5.080 1.00 63.40 C ATOM 132 C GLU A 443 2.403 -2.871 3.936 1.00 2.41 C ATOM 133 O GLU A 443 1.345 -3.420 3.638 1.00 53.42 O ATOM 134 CB GLU A 443 2.454 -2.577 6.433 1.00 2.51 C ATOM 135 CG GLU A 443 2.519 -1.644 7.641 1.00 13.44 C ATOM 136 CD GLU A 443 2.513 -2.385 8.969 1.00 15.12 C ATOM 137 OE1 GLU A 443 1.436 -2.853 9.395 1.00 55.14 O ATOM 138 OE2 GLU A 443 3.589 -2.503 9.594 1.00 65.41 O ATOM 0 H GLU A 443 0.427 -1.360 4.810 1.00 11.21 H new ATOM 0 HA GLU A 443 3.376 -1.271 4.975 1.00 63.40 H new ATOM 0 HB2 GLU A 443 1.552 -3.185 6.504 1.00 2.51 H new ATOM 0 HB3 GLU A 443 3.303 -3.260 6.468 1.00 2.51 H new ATOM 0 HG2 GLU A 443 3.422 -1.036 7.575 1.00 13.44 H new ATOM 0 HG3 GLU A 443 1.671 -0.960 7.610 1.00 13.44 H new ATOM 145 N ILE A 444 3.545 -3.131 3.302 1.00 21.52 N ATOM 146 CA ILE A 444 3.613 -4.086 2.185 1.00 12.34 C ATOM 147 C ILE A 444 4.377 -5.364 2.577 1.00 74.44 C ATOM 148 O ILE A 444 5.460 -5.300 3.164 1.00 52.14 O ATOM 149 CB ILE A 444 4.292 -3.451 0.942 1.00 62.14 C ATOM 150 CG1 ILE A 444 3.562 -2.161 0.528 1.00 21.51 C ATOM 151 CG2 ILE A 444 4.330 -4.446 -0.222 1.00 74.23 C ATOM 152 CD1 ILE A 444 4.195 -1.449 -0.652 1.00 70.43 C ATOM 0 H ILE A 444 4.437 -2.697 3.538 1.00 21.52 H new ATOM 0 HA ILE A 444 2.585 -4.350 1.938 1.00 12.34 H new ATOM 0 HB ILE A 444 5.318 -3.196 1.206 1.00 62.14 H new ATOM 0 HG12 ILE A 444 2.528 -2.403 0.282 1.00 21.51 H new ATOM 0 HG13 ILE A 444 3.536 -1.481 1.379 1.00 21.51 H new ATOM 0 HG21 ILE A 444 4.810 -3.981 -1.083 1.00 74.23 H new ATOM 0 HG22 ILE A 444 4.894 -5.331 0.074 1.00 74.23 H new ATOM 0 HG23 ILE A 444 3.313 -4.736 -0.486 1.00 74.23 H new ATOM 0 HD11 ILE A 444 3.624 -0.550 -0.883 1.00 70.43 H new ATOM 0 HD12 ILE A 444 5.220 -1.174 -0.404 1.00 70.43 H new ATOM 0 HD13 ILE A 444 4.197 -2.111 -1.518 1.00 70.43 H new ATOM 164 N LYS A 445 3.801 -6.521 2.257 1.00 52.11 N ATOM 165 CA LYS A 445 4.445 -7.815 2.518 1.00 65.22 C ATOM 166 C LYS A 445 4.293 -8.761 1.316 1.00 3.41 C ATOM 167 O LYS A 445 3.221 -8.858 0.723 1.00 33.24 O ATOM 168 CB LYS A 445 3.844 -8.464 3.774 1.00 45.25 C ATOM 169 CG LYS A 445 4.445 -9.830 4.111 1.00 32.10 C ATOM 170 CD LYS A 445 5.946 -9.749 4.391 1.00 34.41 C ATOM 171 CE LYS A 445 6.566 -11.129 4.591 1.00 74.04 C ATOM 172 NZ LYS A 445 5.877 -11.903 5.655 1.00 64.02 N ATOM 0 H LYS A 445 2.885 -6.593 1.814 1.00 52.11 H new ATOM 0 HA LYS A 445 5.508 -7.635 2.681 1.00 65.22 H new ATOM 0 HB2 LYS A 445 3.989 -7.795 4.622 1.00 45.25 H new ATOM 0 HB3 LYS A 445 2.769 -8.575 3.635 1.00 45.25 H new ATOM 0 HG2 LYS A 445 3.937 -10.243 4.982 1.00 32.10 H new ATOM 0 HG3 LYS A 445 4.268 -10.517 3.283 1.00 32.10 H new ATOM 0 HD2 LYS A 445 6.443 -9.245 3.562 1.00 34.41 H new ATOM 0 HD3 LYS A 445 6.117 -9.143 5.281 1.00 34.41 H new ATOM 0 HE2 LYS A 445 6.523 -11.684 3.654 1.00 74.04 H new ATOM 0 HE3 LYS A 445 7.619 -11.019 4.848 1.00 74.04 H new ATOM 0 HZ1 LYS A 445 6.410 -12.774 5.851 1.00 64.02 H new ATOM 0 HZ2 LYS A 445 5.821 -11.329 6.520 1.00 64.02 H new ATOM 0 HZ3 LYS A 445 4.917 -12.149 5.339 1.00 64.02 H new ATOM 186 N GLY A 446 5.375 -9.450 0.961 1.00 73.22 N ATOM 187 CA GLY A 446 5.338 -10.398 -0.150 1.00 41.54 C ATOM 188 C GLY A 446 6.729 -10.798 -0.639 1.00 40.11 C ATOM 189 O GLY A 446 7.728 -10.468 0.001 1.00 30.35 O ATOM 0 H GLY A 446 6.281 -9.371 1.422 1.00 73.22 H new ATOM 0 HA2 GLY A 446 4.797 -11.292 0.160 1.00 41.54 H new ATOM 0 HA3 GLY A 446 4.780 -9.959 -0.977 1.00 41.54 H new ATOM 193 N PRO A 447 6.823 -11.516 -1.776 1.00 41.23 N ATOM 194 CA PRO A 447 8.117 -11.960 -2.331 1.00 72.42 C ATOM 195 C PRO A 447 8.951 -10.801 -2.910 1.00 13.23 C ATOM 196 O PRO A 447 8.510 -10.095 -3.821 1.00 41.32 O ATOM 197 CB PRO A 447 7.703 -12.946 -3.435 1.00 22.52 C ATOM 198 CG PRO A 447 6.345 -12.489 -3.855 1.00 2.05 C ATOM 199 CD PRO A 447 5.684 -11.954 -2.611 1.00 34.30 C ATOM 0 HA PRO A 447 8.760 -12.398 -1.567 1.00 72.42 H new ATOM 0 HB2 PRO A 447 8.404 -12.925 -4.269 1.00 22.52 H new ATOM 0 HB3 PRO A 447 7.680 -13.971 -3.064 1.00 22.52 H new ATOM 0 HG2 PRO A 447 6.413 -11.719 -4.623 1.00 2.05 H new ATOM 0 HG3 PRO A 447 5.770 -13.312 -4.279 1.00 2.05 H new ATOM 0 HD2 PRO A 447 5.011 -11.127 -2.838 1.00 34.30 H new ATOM 0 HD3 PRO A 447 5.091 -12.719 -2.111 1.00 34.30 H new ATOM 207 N ASP A 448 10.159 -10.613 -2.376 1.00 23.53 N ATOM 208 CA ASP A 448 11.053 -9.535 -2.825 1.00 31.25 C ATOM 209 C ASP A 448 11.856 -9.934 -4.080 1.00 73.52 C ATOM 210 O ASP A 448 12.418 -9.079 -4.764 1.00 61.13 O ATOM 211 CB ASP A 448 11.999 -9.127 -1.684 1.00 23.20 C ATOM 212 CG ASP A 448 12.848 -10.281 -1.180 1.00 21.14 C ATOM 213 OD1 ASP A 448 12.291 -11.208 -0.549 1.00 61.25 O ATOM 214 OD2 ASP A 448 14.075 -10.273 -1.405 1.00 60.55 O ATOM 0 H ASP A 448 10.545 -11.192 -1.630 1.00 23.53 H new ATOM 0 HA ASP A 448 10.433 -8.682 -3.100 1.00 31.25 H new ATOM 0 HB2 ASP A 448 12.652 -8.326 -2.029 1.00 23.20 H new ATOM 0 HB3 ASP A 448 11.412 -8.726 -0.858 1.00 23.20 H new ATOM 219 N VAL A 449 11.914 -11.234 -4.373 1.00 72.24 N ATOM 220 CA VAL A 449 12.566 -11.735 -5.593 1.00 4.51 C ATOM 221 C VAL A 449 11.634 -12.694 -6.352 1.00 20.42 C ATOM 222 O VAL A 449 11.164 -13.687 -5.794 1.00 5.34 O ATOM 223 CB VAL A 449 13.898 -12.467 -5.276 1.00 65.22 C ATOM 224 CG1 VAL A 449 14.555 -12.980 -6.559 1.00 64.12 C ATOM 225 CG2 VAL A 449 14.853 -11.553 -4.507 1.00 61.34 C ATOM 0 H VAL A 449 11.517 -11.965 -3.782 1.00 72.24 H new ATOM 0 HA VAL A 449 12.786 -10.867 -6.214 1.00 4.51 H new ATOM 0 HB VAL A 449 13.669 -13.325 -4.644 1.00 65.22 H new ATOM 0 HG11 VAL A 449 15.487 -13.489 -6.312 1.00 64.12 H new ATOM 0 HG12 VAL A 449 13.882 -13.677 -7.059 1.00 64.12 H new ATOM 0 HG13 VAL A 449 14.765 -12.140 -7.221 1.00 64.12 H new ATOM 0 HG21 VAL A 449 15.779 -12.088 -4.297 1.00 61.34 H new ATOM 0 HG22 VAL A 449 15.073 -10.670 -5.106 1.00 61.34 H new ATOM 0 HG23 VAL A 449 14.389 -11.249 -3.569 1.00 61.34 H new ATOM 235 N VAL A 450 11.368 -12.394 -7.624 1.00 14.33 N ATOM 236 CA VAL A 450 10.462 -13.216 -8.442 1.00 62.44 C ATOM 237 C VAL A 450 11.026 -13.482 -9.848 1.00 44.11 C ATOM 238 O VAL A 450 11.922 -12.778 -10.323 1.00 45.44 O ATOM 239 CB VAL A 450 9.061 -12.557 -8.579 1.00 74.53 C ATOM 240 CG1 VAL A 450 8.363 -12.461 -7.222 1.00 14.30 C ATOM 241 CG2 VAL A 450 9.171 -11.179 -9.231 1.00 12.04 C ATOM 0 H VAL A 450 11.764 -11.591 -8.113 1.00 14.33 H new ATOM 0 HA VAL A 450 10.367 -14.167 -7.918 1.00 62.44 H new ATOM 0 HB VAL A 450 8.454 -13.192 -9.224 1.00 74.53 H new ATOM 0 HG11 VAL A 450 7.385 -11.996 -7.348 1.00 14.30 H new ATOM 0 HG12 VAL A 450 8.239 -13.460 -6.805 1.00 14.30 H new ATOM 0 HG13 VAL A 450 8.967 -11.858 -6.544 1.00 14.30 H new ATOM 0 HG21 VAL A 450 8.178 -10.737 -9.317 1.00 12.04 H new ATOM 0 HG22 VAL A 450 9.803 -10.536 -8.618 1.00 12.04 H new ATOM 0 HG23 VAL A 450 9.610 -11.280 -10.224 1.00 12.04 H new ATOM 251 N GLY A 451 10.493 -14.508 -10.507 1.00 54.32 N ATOM 252 CA GLY A 451 10.894 -14.824 -11.875 1.00 4.11 C ATOM 253 C GLY A 451 10.035 -14.117 -12.922 1.00 23.23 C ATOM 254 O GLY A 451 8.904 -13.711 -12.644 1.00 62.12 O ATOM 0 H GLY A 451 9.786 -15.132 -10.118 1.00 54.32 H new ATOM 0 HA2 GLY A 451 11.937 -14.542 -12.017 1.00 4.11 H new ATOM 0 HA3 GLY A 451 10.831 -15.901 -12.027 1.00 4.11 H new ATOM 258 N VAL A 452 10.569 -13.973 -14.131 1.00 61.23 N ATOM 259 CA VAL A 452 9.858 -13.290 -15.217 1.00 20.14 C ATOM 260 C VAL A 452 8.643 -14.103 -15.712 1.00 22.23 C ATOM 261 O VAL A 452 8.699 -15.332 -15.810 1.00 62.12 O ATOM 262 CB VAL A 452 10.811 -12.987 -16.404 1.00 15.50 C ATOM 263 CG1 VAL A 452 11.352 -14.274 -17.022 1.00 63.00 C ATOM 264 CG2 VAL A 452 10.116 -12.125 -17.456 1.00 3.31 C ATOM 0 H VAL A 452 11.493 -14.319 -14.388 1.00 61.23 H new ATOM 0 HA VAL A 452 9.490 -12.348 -14.809 1.00 20.14 H new ATOM 0 HB VAL A 452 11.659 -12.425 -16.014 1.00 15.50 H new ATOM 0 HG11 VAL A 452 12.016 -14.029 -17.851 1.00 63.00 H new ATOM 0 HG12 VAL A 452 11.904 -14.835 -16.268 1.00 63.00 H new ATOM 0 HG13 VAL A 452 10.522 -14.878 -17.389 1.00 63.00 H new ATOM 0 HG21 VAL A 452 10.805 -11.927 -18.277 1.00 3.31 H new ATOM 0 HG22 VAL A 452 9.240 -12.651 -17.836 1.00 3.31 H new ATOM 0 HG23 VAL A 452 9.806 -11.181 -17.007 1.00 3.31 H new ATOM 274 N ASN A 453 7.545 -13.395 -16.009 1.00 3.23 N ATOM 275 CA ASN A 453 6.300 -14.008 -16.509 1.00 62.34 C ATOM 276 C ASN A 453 5.603 -14.875 -15.443 1.00 73.52 C ATOM 277 O ASN A 453 4.672 -15.626 -15.751 1.00 72.33 O ATOM 278 CB ASN A 453 6.570 -14.833 -17.775 1.00 53.10 C ATOM 279 CG ASN A 453 7.077 -13.980 -18.924 1.00 43.43 C ATOM 280 OD1 ASN A 453 6.674 -12.833 -19.088 1.00 34.43 O ATOM 281 ND2 ASN A 453 7.972 -14.523 -19.719 1.00 62.43 N ATOM 0 H ASN A 453 7.492 -12.381 -15.911 1.00 3.23 H new ATOM 0 HA ASN A 453 5.622 -13.191 -16.755 1.00 62.34 H new ATOM 0 HB2 ASN A 453 7.303 -15.608 -17.551 1.00 53.10 H new ATOM 0 HB3 ASN A 453 5.653 -15.339 -18.078 1.00 53.10 H new ATOM 0 HD21 ASN A 453 8.352 -13.988 -20.500 1.00 62.43 H new ATOM 0 HD22 ASN A 453 8.286 -15.479 -19.555 1.00 62.43 H new ATOM 288 N LYS A 454 6.040 -14.761 -14.190 1.00 71.23 N ATOM 289 CA LYS A 454 5.418 -15.501 -13.081 1.00 54.43 C ATOM 290 C LYS A 454 4.334 -14.663 -12.383 1.00 72.10 C ATOM 291 O LYS A 454 4.147 -13.487 -12.690 1.00 4.40 O ATOM 292 CB LYS A 454 6.478 -15.935 -12.059 1.00 21.32 C ATOM 293 CG LYS A 454 7.571 -16.831 -12.637 1.00 32.45 C ATOM 294 CD LYS A 454 7.000 -18.073 -13.320 1.00 20.40 C ATOM 295 CE LYS A 454 6.151 -18.917 -12.373 1.00 15.04 C ATOM 296 NZ LYS A 454 5.606 -20.126 -13.047 1.00 24.20 N ATOM 0 H LYS A 454 6.820 -14.166 -13.912 1.00 71.23 H new ATOM 0 HA LYS A 454 4.945 -16.387 -13.505 1.00 54.43 H new ATOM 0 HB2 LYS A 454 6.941 -15.045 -11.631 1.00 21.32 H new ATOM 0 HB3 LYS A 454 5.985 -16.462 -11.242 1.00 21.32 H new ATOM 0 HG2 LYS A 454 8.162 -16.263 -13.356 1.00 32.45 H new ATOM 0 HG3 LYS A 454 8.248 -17.136 -11.839 1.00 32.45 H new ATOM 0 HD2 LYS A 454 6.394 -17.769 -14.174 1.00 20.40 H new ATOM 0 HD3 LYS A 454 7.818 -18.679 -13.709 1.00 20.40 H new ATOM 0 HE2 LYS A 454 6.754 -19.219 -11.516 1.00 15.04 H new ATOM 0 HE3 LYS A 454 5.329 -18.314 -11.987 1.00 15.04 H new ATOM 0 HZ1 LYS A 454 5.035 -20.673 -12.371 1.00 24.20 H new ATOM 0 HZ2 LYS A 454 5.010 -19.837 -13.849 1.00 24.20 H new ATOM 0 HZ3 LYS A 454 6.391 -20.714 -13.393 1.00 24.20 H new ATOM 310 N LEU A 455 3.630 -15.277 -11.435 1.00 74.24 N ATOM 311 CA LEU A 455 2.556 -14.599 -10.702 1.00 73.33 C ATOM 312 C LEU A 455 2.971 -14.299 -9.252 1.00 15.55 C ATOM 313 O LEU A 455 3.269 -15.211 -8.477 1.00 50.51 O ATOM 314 CB LEU A 455 1.290 -15.467 -10.711 1.00 14.53 C ATOM 315 CG LEU A 455 0.037 -14.808 -10.110 1.00 11.24 C ATOM 316 CD1 LEU A 455 -0.377 -13.590 -10.934 1.00 54.20 C ATOM 317 CD2 LEU A 455 -1.109 -15.814 -10.009 1.00 52.12 C ATOM 0 H LEU A 455 3.782 -16.246 -11.154 1.00 74.24 H new ATOM 0 HA LEU A 455 2.354 -13.651 -11.200 1.00 73.33 H new ATOM 0 HB2 LEU A 455 1.072 -15.752 -11.740 1.00 14.53 H new ATOM 0 HB3 LEU A 455 1.496 -16.386 -10.162 1.00 14.53 H new ATOM 0 HG LEU A 455 0.278 -14.470 -9.102 1.00 11.24 H new ATOM 0 HD11 LEU A 455 -1.265 -13.137 -10.493 1.00 54.20 H new ATOM 0 HD12 LEU A 455 0.435 -12.863 -10.942 1.00 54.20 H new ATOM 0 HD13 LEU A 455 -0.597 -13.900 -11.956 1.00 54.20 H new ATOM 0 HD21 LEU A 455 -1.985 -15.326 -9.581 1.00 52.12 H new ATOM 0 HD22 LEU A 455 -1.352 -16.190 -11.003 1.00 52.12 H new ATOM 0 HD23 LEU A 455 -0.809 -16.645 -9.371 1.00 52.12 H new ATOM 329 N ALA A 456 2.989 -13.019 -8.886 1.00 64.31 N ATOM 330 CA ALA A 456 3.356 -12.611 -7.524 1.00 15.25 C ATOM 331 C ALA A 456 2.165 -11.982 -6.783 1.00 4.42 C ATOM 332 O ALA A 456 1.485 -11.101 -7.308 1.00 14.02 O ATOM 333 CB ALA A 456 4.530 -11.636 -7.572 1.00 34.51 C ATOM 0 H ALA A 456 2.755 -12.246 -9.509 1.00 64.31 H new ATOM 0 HA ALA A 456 3.652 -13.503 -6.972 1.00 15.25 H new ATOM 0 HB1 ALA A 456 4.797 -11.338 -6.558 1.00 34.51 H new ATOM 0 HB2 ALA A 456 5.385 -12.119 -8.045 1.00 34.51 H new ATOM 0 HB3 ALA A 456 4.247 -10.754 -8.147 1.00 34.51 H new ATOM 339 N GLU A 457 1.923 -12.435 -5.554 1.00 2.50 N ATOM 340 CA GLU A 457 0.846 -11.892 -4.714 1.00 41.33 C ATOM 341 C GLU A 457 1.398 -11.226 -3.445 1.00 3.44 C ATOM 342 O GLU A 457 2.210 -11.806 -2.718 1.00 3.02 O ATOM 343 CB GLU A 457 -0.156 -12.999 -4.340 1.00 24.25 C ATOM 344 CG GLU A 457 -1.234 -13.229 -5.396 1.00 53.41 C ATOM 345 CD GLU A 457 -2.084 -14.460 -5.126 1.00 1.04 C ATOM 346 OE1 GLU A 457 -2.813 -14.475 -4.113 1.00 22.34 O ATOM 347 OE2 GLU A 457 -2.038 -15.413 -5.933 1.00 24.35 O ATOM 0 H GLU A 457 2.460 -13.181 -5.112 1.00 2.50 H new ATOM 0 HA GLU A 457 0.331 -11.127 -5.295 1.00 41.33 H new ATOM 0 HB2 GLU A 457 0.387 -13.930 -4.179 1.00 24.25 H new ATOM 0 HB3 GLU A 457 -0.634 -12.741 -3.395 1.00 24.25 H new ATOM 0 HG2 GLU A 457 -1.880 -12.352 -5.443 1.00 53.41 H new ATOM 0 HG3 GLU A 457 -0.761 -13.329 -6.373 1.00 53.41 H new ATOM 354 N TYR A 458 0.939 -10.005 -3.186 1.00 14.24 N ATOM 355 CA TYR A 458 1.391 -9.222 -2.026 1.00 1.22 C ATOM 356 C TYR A 458 0.207 -8.825 -1.132 1.00 1.33 C ATOM 357 O TYR A 458 -0.948 -8.853 -1.564 1.00 70.22 O ATOM 358 CB TYR A 458 2.119 -7.951 -2.494 1.00 75.23 C ATOM 359 CG TYR A 458 3.343 -8.212 -3.356 1.00 3.11 C ATOM 360 CD1 TYR A 458 3.213 -8.538 -4.704 1.00 42.32 C ATOM 361 CD2 TYR A 458 4.626 -8.135 -2.825 1.00 74.12 C ATOM 362 CE1 TYR A 458 4.321 -8.781 -5.490 1.00 73.30 C ATOM 363 CE2 TYR A 458 5.739 -8.373 -3.607 1.00 41.32 C ATOM 364 CZ TYR A 458 5.581 -8.698 -4.939 1.00 1.40 C ATOM 365 OH TYR A 458 6.686 -8.943 -5.720 1.00 43.23 O ATOM 0 H TYR A 458 0.248 -9.528 -3.766 1.00 14.24 H new ATOM 0 HA TYR A 458 2.074 -9.846 -1.449 1.00 1.22 H new ATOM 0 HB2 TYR A 458 1.419 -7.332 -3.055 1.00 75.23 H new ATOM 0 HB3 TYR A 458 2.422 -7.377 -1.618 1.00 75.23 H new ATOM 0 HD1 TYR A 458 2.228 -8.602 -5.142 1.00 42.32 H new ATOM 0 HD2 TYR A 458 4.754 -7.885 -1.782 1.00 74.12 H new ATOM 0 HE1 TYR A 458 4.201 -9.035 -6.533 1.00 73.30 H new ATOM 0 HE2 TYR A 458 6.728 -8.305 -3.178 1.00 41.32 H new ATOM 0 HH TYR A 458 7.392 -9.344 -5.171 1.00 43.23 H new ATOM 375 N GLU A 459 0.503 -8.441 0.109 1.00 4.43 N ATOM 376 CA GLU A 459 -0.526 -7.985 1.048 1.00 31.14 C ATOM 377 C GLU A 459 -0.255 -6.550 1.511 1.00 42.44 C ATOM 378 O GLU A 459 0.842 -6.233 1.979 1.00 63.21 O ATOM 379 CB GLU A 459 -0.586 -8.885 2.292 1.00 71.02 C ATOM 380 CG GLU A 459 -0.937 -10.340 2.017 1.00 71.41 C ATOM 381 CD GLU A 459 -1.199 -11.113 3.302 1.00 72.54 C ATOM 382 OE1 GLU A 459 -0.263 -11.263 4.115 1.00 42.44 O ATOM 383 OE2 GLU A 459 -2.344 -11.569 3.508 1.00 51.42 O ATOM 0 H GLU A 459 1.449 -8.436 0.490 1.00 4.43 H new ATOM 0 HA GLU A 459 -1.476 -8.030 0.515 1.00 31.14 H new ATOM 0 HB2 GLU A 459 0.380 -8.849 2.795 1.00 71.02 H new ATOM 0 HB3 GLU A 459 -1.321 -8.474 2.984 1.00 71.02 H new ATOM 0 HG2 GLU A 459 -1.820 -10.386 1.379 1.00 71.41 H new ATOM 0 HG3 GLU A 459 -0.122 -10.813 1.469 1.00 71.41 H new ATOM 390 N VAL A 460 -1.256 -5.691 1.382 1.00 12.42 N ATOM 391 CA VAL A 460 -1.191 -4.340 1.931 1.00 53.01 C ATOM 392 C VAL A 460 -1.966 -4.269 3.254 1.00 43.01 C ATOM 393 O VAL A 460 -3.188 -4.421 3.284 1.00 1.20 O ATOM 394 CB VAL A 460 -1.774 -3.293 0.945 1.00 13.41 C ATOM 395 CG1 VAL A 460 -1.576 -1.872 1.477 1.00 71.23 C ATOM 396 CG2 VAL A 460 -1.154 -3.448 -0.444 1.00 35.40 C ATOM 0 H VAL A 460 -2.129 -5.905 0.899 1.00 12.42 H new ATOM 0 HA VAL A 460 -0.140 -4.108 2.101 1.00 53.01 H new ATOM 0 HB VAL A 460 -2.846 -3.473 0.857 1.00 13.41 H new ATOM 0 HG11 VAL A 460 -1.993 -1.157 0.768 1.00 71.23 H new ATOM 0 HG12 VAL A 460 -2.082 -1.769 2.437 1.00 71.23 H new ATOM 0 HG13 VAL A 460 -0.511 -1.677 1.606 1.00 71.23 H new ATOM 0 HG21 VAL A 460 -1.579 -2.703 -1.117 1.00 35.40 H new ATOM 0 HG22 VAL A 460 -0.075 -3.305 -0.379 1.00 35.40 H new ATOM 0 HG23 VAL A 460 -1.365 -4.446 -0.828 1.00 35.40 H new ATOM 406 N HIS A 461 -1.246 -4.053 4.345 1.00 32.45 N ATOM 407 CA HIS A 461 -1.855 -3.917 5.667 1.00 14.42 C ATOM 408 C HIS A 461 -2.100 -2.440 5.991 1.00 51.42 C ATOM 409 O HIS A 461 -1.160 -1.694 6.268 1.00 62.32 O ATOM 410 CB HIS A 461 -0.954 -4.556 6.734 1.00 63.42 C ATOM 411 CG HIS A 461 -0.859 -6.053 6.632 1.00 3.20 C ATOM 412 ND1 HIS A 461 -1.479 -6.904 7.519 1.00 11.24 N ATOM 413 CD2 HIS A 461 -0.213 -6.853 5.743 1.00 65.44 C ATOM 414 CE1 HIS A 461 -1.225 -8.153 7.187 1.00 74.22 C ATOM 415 NE2 HIS A 461 -0.460 -8.153 6.114 1.00 23.32 N ATOM 0 H HIS A 461 -0.230 -3.967 4.343 1.00 32.45 H new ATOM 0 HA HIS A 461 -2.814 -4.435 5.665 1.00 14.42 H new ATOM 0 HB2 HIS A 461 0.047 -4.132 6.652 1.00 63.42 H new ATOM 0 HB3 HIS A 461 -1.333 -4.292 7.721 1.00 63.42 H new ATOM 0 HD1 HIS A 461 -2.049 -6.612 8.313 1.00 11.24 H new ATOM 0 HD2 HIS A 461 0.383 -6.528 4.903 1.00 65.44 H new ATOM 0 HE1 HIS A 461 -1.583 -9.029 7.707 1.00 74.22 H new ATOM 424 N VAL A 462 -3.361 -2.017 5.933 1.00 2.51 N ATOM 425 CA VAL A 462 -3.725 -0.628 6.213 1.00 52.11 C ATOM 426 C VAL A 462 -4.410 -0.524 7.584 1.00 4.45 C ATOM 427 O VAL A 462 -5.407 -1.194 7.849 1.00 14.24 O ATOM 428 CB VAL A 462 -4.638 -0.043 5.095 1.00 54.31 C ATOM 429 CG1 VAL A 462 -4.010 -0.282 3.723 1.00 52.15 C ATOM 430 CG2 VAL A 462 -6.049 -0.630 5.137 1.00 53.32 C ATOM 0 H VAL A 462 -4.150 -2.617 5.694 1.00 2.51 H new ATOM 0 HA VAL A 462 -2.810 -0.037 6.233 1.00 52.11 H new ATOM 0 HB VAL A 462 -4.725 1.029 5.274 1.00 54.31 H new ATOM 0 HG11 VAL A 462 -4.657 0.131 2.950 1.00 52.15 H new ATOM 0 HG12 VAL A 462 -3.036 0.205 3.679 1.00 52.15 H new ATOM 0 HG13 VAL A 462 -3.888 -1.353 3.560 1.00 52.15 H new ATOM 0 HG21 VAL A 462 -6.649 -0.192 4.339 1.00 53.32 H new ATOM 0 HG22 VAL A 462 -5.998 -1.710 5.002 1.00 53.32 H new ATOM 0 HG23 VAL A 462 -6.508 -0.406 6.100 1.00 53.32 H new ATOM 440 N LYS A 463 -3.856 0.300 8.461 1.00 4.22 N ATOM 441 CA LYS A 463 -4.329 0.381 9.847 1.00 3.15 C ATOM 442 C LYS A 463 -4.371 1.823 10.363 1.00 64.00 C ATOM 443 O LYS A 463 -3.550 2.659 9.985 1.00 33.32 O ATOM 444 CB LYS A 463 -3.429 -0.471 10.756 1.00 61.04 C ATOM 445 CG LYS A 463 -1.937 -0.269 10.499 1.00 2.41 C ATOM 446 CD LYS A 463 -1.092 -0.597 11.726 1.00 61.02 C ATOM 447 CE LYS A 463 -1.174 -2.071 12.098 1.00 54.04 C ATOM 448 NZ LYS A 463 -0.659 -2.954 11.016 1.00 3.32 N ATOM 0 H LYS A 463 -3.079 0.924 8.244 1.00 4.22 H new ATOM 0 HA LYS A 463 -5.349 -0.003 9.866 1.00 3.15 H new ATOM 0 HB2 LYS A 463 -3.646 -0.231 11.797 1.00 61.04 H new ATOM 0 HB3 LYS A 463 -3.675 -1.523 10.614 1.00 61.04 H new ATOM 0 HG2 LYS A 463 -1.625 -0.899 9.666 1.00 2.41 H new ATOM 0 HG3 LYS A 463 -1.758 0.764 10.202 1.00 2.41 H new ATOM 0 HD2 LYS A 463 -0.053 -0.329 11.533 1.00 61.02 H new ATOM 0 HD3 LYS A 463 -1.426 0.009 12.569 1.00 61.02 H new ATOM 0 HE2 LYS A 463 -0.603 -2.246 13.010 1.00 54.04 H new ATOM 0 HE3 LYS A 463 -2.210 -2.332 12.315 1.00 54.04 H new ATOM 0 HZ1 LYS A 463 -0.015 -3.662 11.423 1.00 3.32 H new ATOM 0 HZ2 LYS A 463 -1.456 -3.436 10.553 1.00 3.32 H new ATOM 0 HZ3 LYS A 463 -0.146 -2.382 10.315 1.00 3.32 H new ATOM 462 N ASN A 464 -5.340 2.099 11.234 1.00 62.12 N ATOM 463 CA ASN A 464 -5.460 3.409 11.886 1.00 71.31 C ATOM 464 C ASN A 464 -4.986 3.312 13.345 1.00 40.24 C ATOM 465 O ASN A 464 -5.474 2.482 14.101 1.00 35.43 O ATOM 466 CB ASN A 464 -6.929 3.861 11.839 1.00 71.43 C ATOM 467 CG ASN A 464 -7.147 5.286 12.328 1.00 53.35 C ATOM 468 OD1 ASN A 464 -6.407 5.808 13.160 1.00 64.03 O ATOM 469 ND2 ASN A 464 -8.178 5.927 11.821 1.00 31.13 N ATOM 0 H ASN A 464 -6.060 1.430 11.508 1.00 62.12 H new ATOM 0 HA ASN A 464 -4.838 4.136 11.364 1.00 71.31 H new ATOM 0 HB2 ASN A 464 -7.293 3.778 10.815 1.00 71.43 H new ATOM 0 HB3 ASN A 464 -7.528 3.182 12.446 1.00 71.43 H new ATOM 0 HD21 ASN A 464 -8.380 6.882 12.117 1.00 31.13 H new ATOM 0 HD22 ASN A 464 -8.775 5.469 11.132 1.00 31.13 H new ATOM 476 N LEU A 465 -4.060 4.176 13.749 1.00 63.33 N ATOM 477 CA LEU A 465 -3.525 4.143 15.119 1.00 23.32 C ATOM 478 C LEU A 465 -4.104 5.270 15.990 1.00 61.30 C ATOM 479 O LEU A 465 -4.107 5.177 17.220 1.00 55.03 O ATOM 480 CB LEU A 465 -1.993 4.232 15.082 1.00 52.43 C ATOM 481 CG LEU A 465 -1.293 3.101 14.304 1.00 72.33 C ATOM 482 CD1 LEU A 465 0.221 3.298 14.291 1.00 32.03 C ATOM 483 CD2 LEU A 465 -1.649 1.736 14.890 1.00 42.12 C ATOM 0 H LEU A 465 -3.662 4.905 13.157 1.00 63.33 H new ATOM 0 HA LEU A 465 -3.825 3.197 15.571 1.00 23.32 H new ATOM 0 HB2 LEU A 465 -1.710 5.187 14.638 1.00 52.43 H new ATOM 0 HB3 LEU A 465 -1.619 4.233 16.106 1.00 52.43 H new ATOM 0 HG LEU A 465 -1.649 3.137 13.274 1.00 72.33 H new ATOM 0 HD11 LEU A 465 0.689 2.485 13.735 1.00 32.03 H new ATOM 0 HD12 LEU A 465 0.460 4.249 13.814 1.00 32.03 H new ATOM 0 HD13 LEU A 465 0.596 3.301 15.314 1.00 32.03 H new ATOM 0 HD21 LEU A 465 -1.143 0.954 14.324 1.00 42.12 H new ATOM 0 HD22 LEU A 465 -1.331 1.693 15.932 1.00 42.12 H new ATOM 0 HD23 LEU A 465 -2.727 1.585 14.833 1.00 42.12 H new ATOM 495 N GLY A 466 -4.621 6.316 15.347 1.00 60.31 N ATOM 496 CA GLY A 466 -5.134 7.480 16.075 1.00 53.23 C ATOM 497 C GLY A 466 -6.292 7.162 17.019 1.00 74.14 C ATOM 498 O GLY A 466 -6.498 7.858 18.011 1.00 42.34 O ATOM 0 H GLY A 466 -4.696 6.384 14.332 1.00 60.31 H new ATOM 0 HA2 GLY A 466 -4.321 7.923 16.650 1.00 53.23 H new ATOM 0 HA3 GLY A 466 -5.461 8.230 15.355 1.00 53.23 H new ATOM 502 N GLY A 467 -7.040 6.102 16.722 1.00 23.14 N ATOM 503 CA GLY A 467 -8.173 5.718 17.567 1.00 65.43 C ATOM 504 C GLY A 467 -9.479 6.411 17.185 1.00 54.23 C ATOM 505 O GLY A 467 -10.429 6.447 17.967 1.00 12.20 O ATOM 0 H GLY A 467 -6.887 5.499 15.914 1.00 23.14 H new ATOM 0 HA2 GLY A 467 -8.312 4.639 17.506 1.00 65.43 H new ATOM 0 HA3 GLY A 467 -7.937 5.951 18.605 1.00 65.43 H new ATOM 509 N ILE A 468 -9.526 6.941 15.971 1.00 3.41 N ATOM 510 CA ILE A 468 -10.727 7.601 15.441 1.00 25.03 C ATOM 511 C ILE A 468 -10.976 7.186 13.979 1.00 14.00 C ATOM 512 O ILE A 468 -10.053 7.170 13.162 1.00 64.11 O ATOM 513 CB ILE A 468 -10.613 9.148 15.555 1.00 73.40 C ATOM 514 CG1 ILE A 468 -11.769 9.848 14.814 1.00 42.51 C ATOM 515 CG2 ILE A 468 -9.263 9.629 15.033 1.00 12.22 C ATOM 516 CD1 ILE A 468 -11.777 11.358 14.975 1.00 20.01 C ATOM 0 H ILE A 468 -8.739 6.930 15.322 1.00 3.41 H new ATOM 0 HA ILE A 468 -11.577 7.279 16.042 1.00 25.03 H new ATOM 0 HB ILE A 468 -10.686 9.413 16.610 1.00 73.40 H new ATOM 0 HG12 ILE A 468 -11.707 9.606 13.753 1.00 42.51 H new ATOM 0 HG13 ILE A 468 -12.716 9.448 15.178 1.00 42.51 H new ATOM 0 HG21 ILE A 468 -9.204 10.714 15.122 1.00 12.22 H new ATOM 0 HG22 ILE A 468 -8.464 9.173 15.617 1.00 12.22 H new ATOM 0 HG23 ILE A 468 -9.155 9.344 13.986 1.00 12.22 H new ATOM 0 HD11 ILE A 468 -12.619 11.778 14.425 1.00 20.01 H new ATOM 0 HD12 ILE A 468 -11.871 11.611 16.031 1.00 20.01 H new ATOM 0 HD13 ILE A 468 -10.847 11.770 14.584 1.00 20.01 H new ATOM 528 N GLY A 469 -12.225 6.846 13.663 1.00 52.22 N ATOM 529 CA GLY A 469 -12.563 6.312 12.345 1.00 62.41 C ATOM 530 C GLY A 469 -12.473 7.325 11.202 1.00 62.01 C ATOM 531 O GLY A 469 -12.768 8.510 11.377 1.00 61.12 O ATOM 0 H GLY A 469 -13.017 6.931 14.300 1.00 52.22 H new ATOM 0 HA2 GLY A 469 -11.898 5.477 12.125 1.00 62.41 H new ATOM 0 HA3 GLY A 469 -13.576 5.912 12.379 1.00 62.41 H new ATOM 535 N VAL A 470 -12.062 6.840 10.028 1.00 50.42 N ATOM 536 CA VAL A 470 -11.943 7.670 8.821 1.00 42.55 C ATOM 537 C VAL A 470 -12.610 6.994 7.603 1.00 63.11 C ATOM 538 O VAL A 470 -12.209 5.902 7.194 1.00 54.31 O ATOM 539 CB VAL A 470 -10.452 7.951 8.483 1.00 60.22 C ATOM 540 CG1 VAL A 470 -10.328 8.844 7.250 1.00 12.11 C ATOM 541 CG2 VAL A 470 -9.731 8.578 9.674 1.00 44.55 C ATOM 0 H VAL A 470 -11.802 5.864 9.885 1.00 50.42 H new ATOM 0 HA VAL A 470 -12.453 8.610 9.032 1.00 42.55 H new ATOM 0 HB VAL A 470 -9.976 6.996 8.260 1.00 60.22 H new ATOM 0 HG11 VAL A 470 -9.275 9.025 7.036 1.00 12.11 H new ATOM 0 HG12 VAL A 470 -10.793 8.351 6.396 1.00 12.11 H new ATOM 0 HG13 VAL A 470 -10.828 9.794 7.437 1.00 12.11 H new ATOM 0 HG21 VAL A 470 -8.690 8.765 9.412 1.00 44.55 H new ATOM 0 HG22 VAL A 470 -10.213 9.519 9.937 1.00 44.55 H new ATOM 0 HG23 VAL A 470 -9.775 7.898 10.525 1.00 44.55 H new ATOM 551 N PRO A 471 -13.652 7.622 7.017 1.00 52.13 N ATOM 552 CA PRO A 471 -14.278 7.138 5.766 1.00 25.33 C ATOM 553 C PRO A 471 -13.501 7.571 4.510 1.00 35.14 C ATOM 554 O PRO A 471 -13.721 7.061 3.412 1.00 30.02 O ATOM 555 CB PRO A 471 -15.653 7.814 5.804 1.00 50.24 C ATOM 556 CG PRO A 471 -15.411 9.107 6.513 1.00 55.41 C ATOM 557 CD PRO A 471 -14.336 8.830 7.539 1.00 72.33 C ATOM 0 HA PRO A 471 -14.310 6.050 5.710 1.00 25.33 H new ATOM 0 HB2 PRO A 471 -16.043 7.978 4.800 1.00 50.24 H new ATOM 0 HB3 PRO A 471 -16.383 7.201 6.333 1.00 50.24 H new ATOM 0 HG2 PRO A 471 -15.092 9.880 5.814 1.00 55.41 H new ATOM 0 HG3 PRO A 471 -16.323 9.465 6.991 1.00 55.41 H new ATOM 0 HD2 PRO A 471 -13.648 9.670 7.634 1.00 72.33 H new ATOM 0 HD3 PRO A 471 -14.762 8.653 8.527 1.00 72.33 H new ATOM 565 N SER A 472 -12.568 8.495 4.704 1.00 74.02 N ATOM 566 CA SER A 472 -11.800 9.126 3.616 1.00 52.24 C ATOM 567 C SER A 472 -10.626 8.255 3.131 1.00 21.11 C ATOM 568 O SER A 472 -9.778 8.718 2.366 1.00 22.53 O ATOM 569 CB SER A 472 -11.263 10.485 4.083 1.00 61.44 C ATOM 570 OG SER A 472 -12.297 11.305 4.608 1.00 34.30 O ATOM 0 H SER A 472 -12.314 8.838 5.630 1.00 74.02 H new ATOM 0 HA SER A 472 -12.483 9.251 2.775 1.00 52.24 H new ATOM 0 HB2 SER A 472 -10.498 10.332 4.844 1.00 61.44 H new ATOM 0 HB3 SER A 472 -10.784 10.994 3.247 1.00 61.44 H new ATOM 0 HG SER A 472 -11.920 12.162 4.897 1.00 34.30 H new ATOM 576 N THR A 473 -10.583 6.992 3.550 1.00 40.34 N ATOM 577 CA THR A 473 -9.373 6.170 3.402 1.00 51.22 C ATOM 578 C THR A 473 -9.323 5.430 2.056 1.00 14.24 C ATOM 579 O THR A 473 -9.874 4.341 1.890 1.00 2.12 O ATOM 580 CB THR A 473 -9.281 5.126 4.547 1.00 54.32 C ATOM 581 OG1 THR A 473 -9.304 5.784 5.822 1.00 15.04 O ATOM 582 CG2 THR A 473 -8.017 4.280 4.436 1.00 23.41 C ATOM 0 H THR A 473 -11.366 6.512 3.994 1.00 40.34 H new ATOM 0 HA THR A 473 -8.528 6.857 3.445 1.00 51.22 H new ATOM 0 HB THR A 473 -10.144 4.466 4.458 1.00 54.32 H new ATOM 0 HG1 THR A 473 -10.221 5.796 6.167 1.00 15.04 H new ATOM 0 HG21 THR A 473 -7.988 3.561 5.254 1.00 23.41 H new ATOM 0 HG22 THR A 473 -8.018 3.748 3.485 1.00 23.41 H new ATOM 0 HG23 THR A 473 -7.141 4.926 4.489 1.00 23.41 H new ATOM 590 N LYS A 474 -8.659 6.059 1.087 1.00 40.05 N ATOM 591 CA LYS A 474 -8.381 5.437 -0.215 1.00 55.10 C ATOM 592 C LYS A 474 -6.945 4.886 -0.244 1.00 20.14 C ATOM 593 O LYS A 474 -5.992 5.613 0.039 1.00 34.40 O ATOM 594 CB LYS A 474 -8.565 6.458 -1.350 1.00 12.03 C ATOM 595 CG LYS A 474 -9.946 7.104 -1.386 1.00 73.35 C ATOM 596 CD LYS A 474 -10.025 8.202 -2.446 1.00 63.50 C ATOM 597 CE LYS A 474 -11.414 8.829 -2.513 1.00 13.33 C ATOM 598 NZ LYS A 474 -11.468 9.959 -3.478 1.00 65.11 N ATOM 0 H LYS A 474 -8.299 7.009 1.177 1.00 40.05 H new ATOM 0 HA LYS A 474 -9.084 4.617 -0.360 1.00 55.10 H new ATOM 0 HB2 LYS A 474 -7.812 7.240 -1.247 1.00 12.03 H new ATOM 0 HB3 LYS A 474 -8.382 5.963 -2.304 1.00 12.03 H new ATOM 0 HG2 LYS A 474 -10.699 6.343 -1.592 1.00 73.35 H new ATOM 0 HG3 LYS A 474 -10.177 7.525 -0.407 1.00 73.35 H new ATOM 0 HD2 LYS A 474 -9.288 8.974 -2.224 1.00 63.50 H new ATOM 0 HD3 LYS A 474 -9.767 7.786 -3.420 1.00 63.50 H new ATOM 0 HE2 LYS A 474 -12.141 8.070 -2.802 1.00 13.33 H new ATOM 0 HE3 LYS A 474 -11.700 9.184 -1.523 1.00 13.33 H new ATOM 0 HZ1 LYS A 474 -12.429 10.357 -3.493 1.00 65.11 H new ATOM 0 HZ2 LYS A 474 -10.793 10.695 -3.189 1.00 65.11 H new ATOM 0 HZ3 LYS A 474 -11.220 9.616 -4.428 1.00 65.11 H new ATOM 612 N VAL A 475 -6.800 3.606 -0.582 1.00 31.02 N ATOM 613 CA VAL A 475 -5.485 2.946 -0.626 1.00 54.44 C ATOM 614 C VAL A 475 -5.097 2.589 -2.069 1.00 53.23 C ATOM 615 O VAL A 475 -5.786 1.813 -2.733 1.00 42.23 O ATOM 616 CB VAL A 475 -5.485 1.658 0.232 1.00 20.34 C ATOM 617 CG1 VAL A 475 -4.100 1.008 0.253 1.00 4.12 C ATOM 618 CG2 VAL A 475 -5.974 1.954 1.651 1.00 31.13 C ATOM 0 H VAL A 475 -7.579 2.997 -0.832 1.00 31.02 H new ATOM 0 HA VAL A 475 -4.755 3.648 -0.222 1.00 54.44 H new ATOM 0 HB VAL A 475 -6.176 0.949 -0.224 1.00 20.34 H new ATOM 0 HG11 VAL A 475 -4.131 0.105 0.863 1.00 4.12 H new ATOM 0 HG12 VAL A 475 -3.804 0.749 -0.764 1.00 4.12 H new ATOM 0 HG13 VAL A 475 -3.377 1.706 0.674 1.00 4.12 H new ATOM 0 HG21 VAL A 475 -5.966 1.035 2.238 1.00 31.13 H new ATOM 0 HG22 VAL A 475 -5.316 2.688 2.117 1.00 31.13 H new ATOM 0 HG23 VAL A 475 -6.989 2.350 1.611 1.00 31.13 H new ATOM 628 N ARG A 476 -3.992 3.150 -2.555 1.00 33.20 N ATOM 629 CA ARG A 476 -3.557 2.919 -3.938 1.00 50.20 C ATOM 630 C ARG A 476 -2.112 2.394 -4.002 1.00 25.04 C ATOM 631 O ARG A 476 -1.297 2.662 -3.117 1.00 24.12 O ATOM 632 CB ARG A 476 -3.713 4.208 -4.763 1.00 4.54 C ATOM 633 CG ARG A 476 -5.145 4.750 -4.765 1.00 32.11 C ATOM 634 CD ARG A 476 -5.351 5.867 -5.784 1.00 55.34 C ATOM 635 NE ARG A 476 -4.574 7.067 -5.478 1.00 21.53 N ATOM 636 CZ ARG A 476 -4.919 8.277 -5.845 1.00 31.03 C ATOM 637 NH1 ARG A 476 -6.027 8.483 -6.481 1.00 72.21 N ATOM 638 NH2 ARG A 476 -4.155 9.279 -5.568 1.00 44.31 N ATOM 0 H ARG A 476 -3.381 3.766 -2.018 1.00 33.20 H new ATOM 0 HA ARG A 476 -4.196 2.147 -4.368 1.00 50.20 H new ATOM 0 HB2 ARG A 476 -3.043 4.970 -4.365 1.00 4.54 H new ATOM 0 HB3 ARG A 476 -3.402 4.015 -5.790 1.00 4.54 H new ATOM 0 HG2 ARG A 476 -5.837 3.936 -4.980 1.00 32.11 H new ATOM 0 HG3 ARG A 476 -5.390 5.122 -3.770 1.00 32.11 H new ATOM 0 HD2 ARG A 476 -5.075 5.504 -6.774 1.00 55.34 H new ATOM 0 HD3 ARG A 476 -6.409 6.126 -5.823 1.00 55.34 H new ATOM 0 HE ARG A 476 -3.711 6.956 -4.946 1.00 21.53 H new ATOM 0 HH11 ARG A 476 -6.642 7.700 -6.701 1.00 72.21 H new ATOM 0 HH12 ARG A 476 -6.286 9.429 -6.762 1.00 72.21 H new ATOM 0 HH21 ARG A 476 -3.281 9.130 -5.063 1.00 44.31 H new ATOM 0 HH22 ARG A 476 -4.424 10.220 -5.854 1.00 44.31 H new ATOM 652 N VAL A 477 -1.807 1.641 -5.061 1.00 11.12 N ATOM 653 CA VAL A 477 -0.491 1.004 -5.222 1.00 43.33 C ATOM 654 C VAL A 477 0.196 1.462 -6.514 1.00 32.51 C ATOM 655 O VAL A 477 -0.396 1.426 -7.597 1.00 31.50 O ATOM 656 CB VAL A 477 -0.613 -0.544 -5.237 1.00 21.44 C ATOM 657 CG1 VAL A 477 0.743 -1.203 -5.490 1.00 11.44 C ATOM 658 CG2 VAL A 477 -1.225 -1.053 -3.934 1.00 3.01 C ATOM 0 H VAL A 477 -2.455 1.455 -5.826 1.00 11.12 H new ATOM 0 HA VAL A 477 0.113 1.309 -4.368 1.00 43.33 H new ATOM 0 HB VAL A 477 -1.277 -0.817 -6.057 1.00 21.44 H new ATOM 0 HG11 VAL A 477 0.626 -2.287 -5.495 1.00 11.44 H new ATOM 0 HG12 VAL A 477 1.132 -0.876 -6.454 1.00 11.44 H new ATOM 0 HG13 VAL A 477 1.439 -0.917 -4.702 1.00 11.44 H new ATOM 0 HG21 VAL A 477 -1.301 -2.140 -3.968 1.00 3.01 H new ATOM 0 HG22 VAL A 477 -0.593 -0.759 -3.096 1.00 3.01 H new ATOM 0 HG23 VAL A 477 -2.219 -0.624 -3.807 1.00 3.01 H new ATOM 668 N TYR A 478 1.455 1.882 -6.391 1.00 74.04 N ATOM 669 CA TYR A 478 2.227 2.391 -7.528 1.00 71.40 C ATOM 670 C TYR A 478 3.532 1.604 -7.723 1.00 43.24 C ATOM 671 O TYR A 478 4.239 1.312 -6.761 1.00 63.21 O ATOM 672 CB TYR A 478 2.553 3.876 -7.316 1.00 24.24 C ATOM 673 CG TYR A 478 1.322 4.748 -7.154 1.00 20.51 C ATOM 674 CD1 TYR A 478 0.696 4.883 -5.919 1.00 71.02 C ATOM 675 CD2 TYR A 478 0.781 5.422 -8.241 1.00 22.34 C ATOM 676 CE1 TYR A 478 -0.430 5.666 -5.775 1.00 44.42 C ATOM 677 CE2 TYR A 478 -0.345 6.206 -8.102 1.00 63.32 C ATOM 678 CZ TYR A 478 -0.946 6.322 -6.870 1.00 71.42 C ATOM 679 OH TYR A 478 -2.067 7.102 -6.733 1.00 65.33 O ATOM 0 H TYR A 478 1.967 1.880 -5.509 1.00 74.04 H new ATOM 0 HA TYR A 478 1.618 2.268 -8.424 1.00 71.40 H new ATOM 0 HB2 TYR A 478 3.181 3.979 -6.431 1.00 24.24 H new ATOM 0 HB3 TYR A 478 3.135 4.237 -8.164 1.00 24.24 H new ATOM 0 HD1 TYR A 478 1.098 4.367 -5.060 1.00 71.02 H new ATOM 0 HD2 TYR A 478 1.249 5.331 -9.210 1.00 22.34 H new ATOM 0 HE1 TYR A 478 -0.904 5.764 -4.810 1.00 44.42 H new ATOM 0 HE2 TYR A 478 -0.753 6.726 -8.956 1.00 63.32 H new ATOM 0 HH TYR A 478 -2.055 7.540 -5.857 1.00 65.33 H new ATOM 689 N ILE A 479 3.846 1.275 -8.972 1.00 41.40 N ATOM 690 CA ILE A 479 5.116 0.628 -9.317 1.00 4.15 C ATOM 691 C ILE A 479 6.019 1.611 -10.079 1.00 50.32 C ATOM 692 O ILE A 479 5.708 2.013 -11.204 1.00 64.14 O ATOM 693 CB ILE A 479 4.883 -0.645 -10.173 1.00 13.43 C ATOM 694 CG1 ILE A 479 3.958 -1.623 -9.424 1.00 5.12 C ATOM 695 CG2 ILE A 479 6.215 -1.317 -10.520 1.00 61.54 C ATOM 696 CD1 ILE A 479 3.608 -2.871 -10.211 1.00 13.42 C ATOM 0 H ILE A 479 3.235 1.446 -9.771 1.00 41.40 H new ATOM 0 HA ILE A 479 5.606 0.331 -8.390 1.00 4.15 H new ATOM 0 HB ILE A 479 4.401 -0.354 -11.106 1.00 13.43 H new ATOM 0 HG12 ILE A 479 4.438 -1.918 -8.491 1.00 5.12 H new ATOM 0 HG13 ILE A 479 3.037 -1.104 -9.158 1.00 5.12 H new ATOM 0 HG21 ILE A 479 6.028 -2.207 -11.120 1.00 61.54 H new ATOM 0 HG22 ILE A 479 6.837 -0.622 -11.085 1.00 61.54 H new ATOM 0 HG23 ILE A 479 6.730 -1.600 -9.602 1.00 61.54 H new ATOM 0 HD11 ILE A 479 2.954 -3.506 -9.614 1.00 13.42 H new ATOM 0 HD12 ILE A 479 3.098 -2.589 -11.132 1.00 13.42 H new ATOM 0 HD13 ILE A 479 4.520 -3.416 -10.454 1.00 13.42 H new ATOM 708 N ASN A 480 7.122 2.013 -9.448 1.00 54.00 N ATOM 709 CA ASN A 480 8.036 3.024 -10.009 1.00 64.22 C ATOM 710 C ASN A 480 7.285 4.318 -10.382 1.00 11.40 C ATOM 711 O ASN A 480 7.643 5.005 -11.339 1.00 11.34 O ATOM 712 CB ASN A 480 8.778 2.472 -11.241 1.00 52.11 C ATOM 713 CG ASN A 480 9.567 1.208 -10.941 1.00 12.34 C ATOM 714 OD1 ASN A 480 9.170 0.393 -10.121 1.00 52.32 O ATOM 715 ND2 ASN A 480 10.698 1.040 -11.594 1.00 52.23 N ATOM 0 H ASN A 480 7.411 1.653 -8.539 1.00 54.00 H new ATOM 0 HA ASN A 480 8.767 3.264 -9.237 1.00 64.22 H new ATOM 0 HB2 ASN A 480 8.056 2.264 -12.031 1.00 52.11 H new ATOM 0 HB3 ASN A 480 9.456 3.235 -11.622 1.00 52.11 H new ATOM 0 HD21 ASN A 480 11.269 0.212 -11.421 1.00 52.23 H new ATOM 0 HD22 ASN A 480 11.004 1.738 -12.273 1.00 52.23 H new ATOM 722 N GLY A 481 6.252 4.652 -9.604 1.00 22.35 N ATOM 723 CA GLY A 481 5.486 5.876 -9.843 1.00 31.44 C ATOM 724 C GLY A 481 4.173 5.649 -10.596 1.00 32.23 C ATOM 725 O GLY A 481 3.247 6.454 -10.490 1.00 22.21 O ATOM 0 H GLY A 481 5.930 4.098 -8.811 1.00 22.35 H new ATOM 0 HA2 GLY A 481 5.267 6.349 -8.886 1.00 31.44 H new ATOM 0 HA3 GLY A 481 6.102 6.574 -10.410 1.00 31.44 H new ATOM 729 N THR A 482 4.083 4.558 -11.352 1.00 64.32 N ATOM 730 CA THR A 482 2.882 4.268 -12.153 1.00 12.51 C ATOM 731 C THR A 482 1.786 3.595 -11.313 1.00 13.11 C ATOM 732 O THR A 482 2.054 2.658 -10.566 1.00 75.22 O ATOM 733 CB THR A 482 3.210 3.355 -13.360 1.00 51.33 C ATOM 734 OG1 THR A 482 4.197 3.978 -14.197 1.00 54.40 O ATOM 735 CG2 THR A 482 1.961 3.055 -14.185 1.00 41.41 C ATOM 0 H THR A 482 4.821 3.858 -11.431 1.00 64.32 H new ATOM 0 HA THR A 482 2.518 5.230 -12.514 1.00 12.51 H new ATOM 0 HB THR A 482 3.600 2.415 -12.969 1.00 51.33 H new ATOM 0 HG1 THR A 482 4.399 3.392 -14.956 1.00 54.40 H new ATOM 0 HG21 THR A 482 2.225 2.412 -15.025 1.00 41.41 H new ATOM 0 HG22 THR A 482 1.224 2.551 -13.560 1.00 41.41 H new ATOM 0 HG23 THR A 482 1.540 3.988 -14.561 1.00 41.41 H new ATOM 743 N LEU A 483 0.552 4.076 -11.442 1.00 10.45 N ATOM 744 CA LEU A 483 -0.592 3.491 -10.730 1.00 62.11 C ATOM 745 C LEU A 483 -0.920 2.082 -11.252 1.00 31.21 C ATOM 746 O LEU A 483 -1.273 1.904 -12.417 1.00 70.15 O ATOM 747 CB LEU A 483 -1.825 4.399 -10.868 1.00 21.14 C ATOM 748 CG LEU A 483 -3.108 3.895 -10.181 1.00 74.44 C ATOM 749 CD1 LEU A 483 -2.898 3.730 -8.676 1.00 1.05 C ATOM 750 CD2 LEU A 483 -4.279 4.838 -10.466 1.00 23.14 C ATOM 0 H LEU A 483 0.314 4.872 -12.034 1.00 10.45 H new ATOM 0 HA LEU A 483 -0.320 3.407 -9.678 1.00 62.11 H new ATOM 0 HB2 LEU A 483 -1.578 5.379 -10.461 1.00 21.14 H new ATOM 0 HB3 LEU A 483 -2.034 4.538 -11.929 1.00 21.14 H new ATOM 0 HG LEU A 483 -3.349 2.915 -10.594 1.00 74.44 H new ATOM 0 HD11 LEU A 483 -3.820 3.373 -8.217 1.00 1.05 H new ATOM 0 HD12 LEU A 483 -2.101 3.009 -8.497 1.00 1.05 H new ATOM 0 HD13 LEU A 483 -2.623 4.690 -8.240 1.00 1.05 H new ATOM 0 HD21 LEU A 483 -5.176 4.464 -9.972 1.00 23.14 H new ATOM 0 HD22 LEU A 483 -4.045 5.833 -10.088 1.00 23.14 H new ATOM 0 HD23 LEU A 483 -4.452 4.889 -11.541 1.00 23.14 H new ATOM 762 N TYR A 484 -0.790 1.082 -10.384 1.00 64.22 N ATOM 763 CA TYR A 484 -1.124 -0.303 -10.740 1.00 64.43 C ATOM 764 C TYR A 484 -2.547 -0.686 -10.291 1.00 3.42 C ATOM 765 O TYR A 484 -3.299 -1.315 -11.043 1.00 35.43 O ATOM 766 CB TYR A 484 -0.100 -1.269 -10.118 1.00 12.53 C ATOM 767 CG TYR A 484 -0.540 -2.726 -10.145 1.00 41.01 C ATOM 768 CD1 TYR A 484 -0.523 -3.465 -11.325 1.00 71.35 C ATOM 769 CD2 TYR A 484 -1.004 -3.351 -8.992 1.00 50.10 C ATOM 770 CE1 TYR A 484 -0.948 -4.782 -11.349 1.00 31.22 C ATOM 771 CE2 TYR A 484 -1.432 -4.661 -9.012 1.00 32.01 C ATOM 772 CZ TYR A 484 -1.407 -5.372 -10.188 1.00 42.40 C ATOM 773 OH TYR A 484 -1.850 -6.673 -10.202 1.00 1.44 O ATOM 0 H TYR A 484 -0.456 1.200 -9.428 1.00 64.22 H new ATOM 0 HA TYR A 484 -1.088 -0.380 -11.827 1.00 64.43 H new ATOM 0 HB2 TYR A 484 0.846 -1.174 -10.651 1.00 12.53 H new ATOM 0 HB3 TYR A 484 0.085 -0.973 -9.085 1.00 12.53 H new ATOM 0 HD1 TYR A 484 -0.173 -3.003 -12.236 1.00 71.35 H new ATOM 0 HD2 TYR A 484 -1.029 -2.799 -8.064 1.00 50.10 H new ATOM 0 HE1 TYR A 484 -0.921 -5.345 -12.270 1.00 31.22 H new ATOM 0 HE2 TYR A 484 -1.786 -5.128 -8.105 1.00 32.01 H new ATOM 0 HH TYR A 484 -1.121 -7.264 -10.484 1.00 1.44 H new ATOM 783 N LYS A 485 -2.910 -0.301 -9.072 1.00 20.42 N ATOM 784 CA LYS A 485 -4.192 -0.703 -8.471 1.00 53.24 C ATOM 785 C LYS A 485 -4.698 0.372 -7.490 1.00 3.44 C ATOM 786 O LYS A 485 -3.908 1.145 -6.948 1.00 23.34 O ATOM 787 CB LYS A 485 -4.016 -2.039 -7.725 1.00 2.30 C ATOM 788 CG LYS A 485 -5.320 -2.650 -7.199 1.00 21.53 C ATOM 789 CD LYS A 485 -5.974 -3.608 -8.195 1.00 42.04 C ATOM 790 CE LYS A 485 -5.149 -4.879 -8.376 1.00 61.41 C ATOM 791 NZ LYS A 485 -5.845 -5.886 -9.221 1.00 22.13 N ATOM 0 H LYS A 485 -2.336 0.292 -8.472 1.00 20.42 H new ATOM 0 HA LYS A 485 -4.927 -0.819 -9.268 1.00 53.24 H new ATOM 0 HB2 LYS A 485 -3.539 -2.754 -8.395 1.00 2.30 H new ATOM 0 HB3 LYS A 485 -3.337 -1.886 -6.886 1.00 2.30 H new ATOM 0 HG2 LYS A 485 -5.117 -3.183 -6.270 1.00 21.53 H new ATOM 0 HG3 LYS A 485 -6.020 -1.849 -6.960 1.00 21.53 H new ATOM 0 HD2 LYS A 485 -6.974 -3.869 -7.847 1.00 42.04 H new ATOM 0 HD3 LYS A 485 -6.091 -3.109 -9.157 1.00 42.04 H new ATOM 0 HE2 LYS A 485 -4.191 -4.626 -8.830 1.00 61.41 H new ATOM 0 HE3 LYS A 485 -4.934 -5.313 -7.399 1.00 61.41 H new ATOM 0 HZ1 LYS A 485 -5.247 -6.732 -9.316 1.00 22.13 H new ATOM 0 HZ2 LYS A 485 -6.748 -6.148 -8.776 1.00 22.13 H new ATOM 0 HZ3 LYS A 485 -6.027 -5.483 -10.162 1.00 22.13 H new ATOM 805 N ASN A 486 -6.012 0.417 -7.265 1.00 44.22 N ATOM 806 CA ASN A 486 -6.601 1.361 -6.303 1.00 64.12 C ATOM 807 C ASN A 486 -7.796 0.738 -5.560 1.00 64.15 C ATOM 808 O ASN A 486 -8.586 -0.011 -6.142 1.00 21.44 O ATOM 809 CB ASN A 486 -7.037 2.649 -7.017 1.00 64.42 C ATOM 810 CG ASN A 486 -8.102 2.398 -8.072 1.00 74.35 C ATOM 811 OD1 ASN A 486 -9.297 2.465 -7.796 1.00 34.42 O ATOM 812 ND2 ASN A 486 -7.684 2.106 -9.288 1.00 73.45 N ATOM 0 H ASN A 486 -6.690 -0.185 -7.732 1.00 44.22 H new ATOM 0 HA ASN A 486 -5.836 1.602 -5.565 1.00 64.12 H new ATOM 0 HB2 ASN A 486 -7.419 3.357 -6.281 1.00 64.42 H new ATOM 0 HB3 ASN A 486 -6.169 3.113 -7.485 1.00 64.42 H new ATOM 0 HD21 ASN A 486 -8.360 1.928 -10.031 1.00 73.45 H new ATOM 0 HD22 ASN A 486 -6.685 2.058 -9.486 1.00 73.45 H new ATOM 819 N TRP A 487 -7.914 1.052 -4.270 1.00 62.05 N ATOM 820 CA TRP A 487 -9.022 0.572 -3.432 1.00 23.20 C ATOM 821 C TRP A 487 -9.627 1.718 -2.603 1.00 50.44 C ATOM 822 O TRP A 487 -8.928 2.653 -2.210 1.00 73.33 O ATOM 823 CB TRP A 487 -8.544 -0.525 -2.466 1.00 42.25 C ATOM 824 CG TRP A 487 -8.014 -1.763 -3.129 1.00 12.33 C ATOM 825 CD1 TRP A 487 -8.733 -2.714 -3.792 1.00 2.32 C ATOM 826 CD2 TRP A 487 -6.651 -2.198 -3.156 1.00 21.23 C ATOM 827 NE1 TRP A 487 -7.898 -3.711 -4.235 1.00 71.00 N ATOM 828 CE2 TRP A 487 -6.615 -3.416 -3.858 1.00 41.23 C ATOM 829 CE3 TRP A 487 -5.456 -1.671 -2.658 1.00 43.35 C ATOM 830 CZ2 TRP A 487 -5.433 -4.117 -4.070 1.00 53.45 C ATOM 831 CZ3 TRP A 487 -4.284 -2.367 -2.869 1.00 32.20 C ATOM 832 CH2 TRP A 487 -4.278 -3.578 -3.571 1.00 72.24 C ATOM 0 H TRP A 487 -7.248 1.644 -3.774 1.00 62.05 H new ATOM 0 HA TRP A 487 -9.779 0.168 -4.105 1.00 23.20 H new ATOM 0 HB2 TRP A 487 -7.765 -0.111 -1.826 1.00 42.25 H new ATOM 0 HB3 TRP A 487 -9.374 -0.805 -1.817 1.00 42.25 H new ATOM 0 HD1 TRP A 487 -9.802 -2.687 -3.946 1.00 2.32 H new ATOM 0 HE1 TRP A 487 -8.187 -4.537 -4.759 1.00 71.00 H new ATOM 0 HE3 TRP A 487 -5.450 -0.736 -2.118 1.00 43.35 H new ATOM 0 HZ2 TRP A 487 -5.426 -5.053 -4.609 1.00 53.45 H new ATOM 0 HZ3 TRP A 487 -3.355 -1.971 -2.486 1.00 32.20 H new ATOM 0 HH2 TRP A 487 -3.343 -4.098 -3.722 1.00 72.24 H new ATOM 843 N THR A 488 -10.926 1.635 -2.329 1.00 51.21 N ATOM 844 CA THR A 488 -11.593 2.594 -1.437 1.00 14.42 C ATOM 845 C THR A 488 -12.213 1.862 -0.239 1.00 0.54 C ATOM 846 O THR A 488 -13.083 1.007 -0.408 1.00 74.53 O ATOM 847 CB THR A 488 -12.696 3.391 -2.180 1.00 12.34 C ATOM 848 OG1 THR A 488 -12.140 4.061 -3.323 1.00 0.21 O ATOM 849 CG2 THR A 488 -13.349 4.422 -1.265 1.00 50.20 C ATOM 0 H THR A 488 -11.542 0.916 -2.709 1.00 51.21 H new ATOM 0 HA THR A 488 -10.837 3.297 -1.088 1.00 14.42 H new ATOM 0 HB THR A 488 -13.456 2.679 -2.502 1.00 12.34 H new ATOM 0 HG1 THR A 488 -12.846 4.560 -3.785 1.00 0.21 H new ATOM 0 HG21 THR A 488 -14.118 4.963 -1.817 1.00 50.20 H new ATOM 0 HG22 THR A 488 -13.803 3.916 -0.412 1.00 50.20 H new ATOM 0 HG23 THR A 488 -12.594 5.124 -0.911 1.00 50.20 H new ATOM 857 N VAL A 489 -11.763 2.200 0.970 1.00 60.33 N ATOM 858 CA VAL A 489 -12.212 1.518 2.195 1.00 3.03 C ATOM 859 C VAL A 489 -12.362 2.503 3.365 1.00 42.13 C ATOM 860 O VAL A 489 -12.061 3.691 3.240 1.00 25.12 O ATOM 861 CB VAL A 489 -11.236 0.381 2.619 1.00 62.51 C ATOM 862 CG1 VAL A 489 -11.149 -0.710 1.551 1.00 23.54 C ATOM 863 CG2 VAL A 489 -9.847 0.941 2.932 1.00 23.11 C ATOM 0 H VAL A 489 -11.085 2.945 1.132 1.00 60.33 H new ATOM 0 HA VAL A 489 -13.183 1.082 1.960 1.00 3.03 H new ATOM 0 HB VAL A 489 -11.636 -0.072 3.526 1.00 62.51 H new ATOM 0 HG11 VAL A 489 -10.459 -1.487 1.880 1.00 23.54 H new ATOM 0 HG12 VAL A 489 -12.136 -1.144 1.393 1.00 23.54 H new ATOM 0 HG13 VAL A 489 -10.789 -0.277 0.617 1.00 23.54 H new ATOM 0 HG21 VAL A 489 -9.184 0.127 3.226 1.00 23.11 H new ATOM 0 HG22 VAL A 489 -9.446 1.434 2.047 1.00 23.11 H new ATOM 0 HG23 VAL A 489 -9.920 1.661 3.747 1.00 23.11 H new ATOM 873 N SER A 490 -12.865 2.013 4.492 1.00 30.12 N ATOM 874 CA SER A 490 -12.953 2.816 5.717 1.00 52.13 C ATOM 875 C SER A 490 -12.180 2.140 6.853 1.00 22.31 C ATOM 876 O SER A 490 -12.226 0.918 6.999 1.00 4.34 O ATOM 877 CB SER A 490 -14.418 3.012 6.140 1.00 61.24 C ATOM 878 OG SER A 490 -15.026 1.781 6.504 1.00 20.15 O ATOM 0 H SER A 490 -13.220 1.062 4.588 1.00 30.12 H new ATOM 0 HA SER A 490 -12.513 3.792 5.511 1.00 52.13 H new ATOM 0 HB2 SER A 490 -14.465 3.704 6.981 1.00 61.24 H new ATOM 0 HB3 SER A 490 -14.976 3.466 5.321 1.00 61.24 H new ATOM 0 HG SER A 490 -15.956 1.941 6.769 1.00 20.15 H new ATOM 884 N LEU A 491 -11.463 2.927 7.651 1.00 54.15 N ATOM 885 CA LEU A 491 -10.743 2.391 8.817 1.00 11.42 C ATOM 886 C LEU A 491 -11.272 3.000 10.120 1.00 61.50 C ATOM 887 O LEU A 491 -11.226 4.214 10.314 1.00 42.52 O ATOM 888 CB LEU A 491 -9.233 2.658 8.699 1.00 34.31 C ATOM 889 CG LEU A 491 -8.497 1.840 7.626 1.00 12.43 C ATOM 890 CD1 LEU A 491 -7.017 2.212 7.584 1.00 23.13 C ATOM 891 CD2 LEU A 491 -8.663 0.345 7.881 1.00 64.24 C ATOM 0 H LEU A 491 -11.361 3.933 7.518 1.00 54.15 H new ATOM 0 HA LEU A 491 -10.913 1.314 8.839 1.00 11.42 H new ATOM 0 HB2 LEU A 491 -9.085 3.717 8.488 1.00 34.31 H new ATOM 0 HB3 LEU A 491 -8.770 2.457 9.665 1.00 34.31 H new ATOM 0 HG LEU A 491 -8.938 2.076 6.658 1.00 12.43 H new ATOM 0 HD11 LEU A 491 -6.515 1.621 6.818 1.00 23.13 H new ATOM 0 HD12 LEU A 491 -6.915 3.272 7.350 1.00 23.13 H new ATOM 0 HD13 LEU A 491 -6.563 2.009 8.554 1.00 23.13 H new ATOM 0 HD21 LEU A 491 -8.135 -0.216 7.110 1.00 64.24 H new ATOM 0 HD22 LEU A 491 -8.251 0.095 8.859 1.00 64.24 H new ATOM 0 HD23 LEU A 491 -9.722 0.087 7.856 1.00 64.24 H new ATOM 903 N GLY A 492 -11.763 2.148 11.013 1.00 22.24 N ATOM 904 CA GLY A 492 -12.269 2.610 12.301 1.00 42.24 C ATOM 905 C GLY A 492 -11.170 2.776 13.347 1.00 12.54 C ATOM 906 O GLY A 492 -9.979 2.712 13.021 1.00 20.22 O ATOM 0 H GLY A 492 -11.822 1.140 10.871 1.00 22.24 H new ATOM 0 HA2 GLY A 492 -12.780 3.563 12.164 1.00 42.24 H new ATOM 0 HA3 GLY A 492 -13.010 1.901 12.670 1.00 42.24 H new ATOM 910 N PRO A 493 -11.531 2.985 14.626 1.00 2.14 N ATOM 911 CA PRO A 493 -10.546 3.151 15.706 1.00 44.33 C ATOM 912 C PRO A 493 -9.653 1.909 15.886 1.00 25.23 C ATOM 913 O PRO A 493 -10.127 0.842 16.279 1.00 74.24 O ATOM 914 CB PRO A 493 -11.413 3.396 16.955 1.00 60.22 C ATOM 915 CG PRO A 493 -12.760 2.852 16.604 1.00 44.25 C ATOM 916 CD PRO A 493 -12.918 3.073 15.123 1.00 34.41 C ATOM 0 HA PRO A 493 -9.849 3.963 15.499 1.00 44.33 H new ATOM 0 HB2 PRO A 493 -10.999 2.891 17.828 1.00 60.22 H new ATOM 0 HB3 PRO A 493 -11.467 4.458 17.196 1.00 60.22 H new ATOM 0 HG2 PRO A 493 -12.830 1.793 16.851 1.00 44.25 H new ATOM 0 HG3 PRO A 493 -13.545 3.362 17.162 1.00 44.25 H new ATOM 0 HD2 PRO A 493 -13.559 2.318 14.668 1.00 34.41 H new ATOM 0 HD3 PRO A 493 -13.364 4.043 14.905 1.00 34.41 H new ATOM 924 N LYS A 494 -8.361 2.055 15.560 1.00 60.32 N ATOM 925 CA LYS A 494 -7.375 0.971 15.713 1.00 54.53 C ATOM 926 C LYS A 494 -7.658 -0.207 14.758 1.00 21.55 C ATOM 927 O LYS A 494 -7.138 -1.309 14.947 1.00 3.21 O ATOM 928 CB LYS A 494 -7.338 0.485 17.173 1.00 35.33 C ATOM 929 CG LYS A 494 -6.854 1.540 18.171 1.00 30.05 C ATOM 930 CD LYS A 494 -5.356 1.822 18.034 1.00 74.41 C ATOM 931 CE LYS A 494 -4.809 2.608 19.225 1.00 23.51 C ATOM 932 NZ LYS A 494 -5.441 3.945 19.367 1.00 50.43 N ATOM 0 H LYS A 494 -7.970 2.920 15.186 1.00 60.32 H new ATOM 0 HA LYS A 494 -6.399 1.376 15.447 1.00 54.53 H new ATOM 0 HB2 LYS A 494 -8.337 0.159 17.462 1.00 35.33 H new ATOM 0 HB3 LYS A 494 -6.687 -0.387 17.238 1.00 35.33 H new ATOM 0 HG2 LYS A 494 -7.411 2.464 18.019 1.00 30.05 H new ATOM 0 HG3 LYS A 494 -7.067 1.203 19.185 1.00 30.05 H new ATOM 0 HD2 LYS A 494 -4.817 0.879 17.944 1.00 74.41 H new ATOM 0 HD3 LYS A 494 -5.175 2.382 17.116 1.00 74.41 H new ATOM 0 HE2 LYS A 494 -4.970 2.035 20.138 1.00 23.51 H new ATOM 0 HE3 LYS A 494 -3.732 2.730 19.111 1.00 23.51 H new ATOM 0 HZ1 LYS A 494 -5.136 4.380 20.261 1.00 50.43 H new ATOM 0 HZ2 LYS A 494 -5.154 4.551 18.572 1.00 50.43 H new ATOM 0 HZ3 LYS A 494 -6.476 3.842 19.367 1.00 50.43 H new ATOM 946 N GLU A 495 -8.451 0.044 13.715 1.00 63.20 N ATOM 947 CA GLU A 495 -8.861 -1.011 12.775 1.00 53.51 C ATOM 948 C GLU A 495 -7.831 -1.214 11.648 1.00 4.33 C ATOM 949 O GLU A 495 -7.150 -0.272 11.238 1.00 41.30 O ATOM 950 CB GLU A 495 -10.235 -0.667 12.180 1.00 14.41 C ATOM 951 CG GLU A 495 -10.808 -1.750 11.267 1.00 4.33 C ATOM 952 CD GLU A 495 -12.238 -1.459 10.835 1.00 43.50 C ATOM 953 OE1 GLU A 495 -12.448 -0.517 10.042 1.00 30.41 O ATOM 954 OE2 GLU A 495 -13.160 -2.176 11.284 1.00 52.53 O ATOM 0 H GLU A 495 -8.824 0.968 13.496 1.00 63.20 H new ATOM 0 HA GLU A 495 -8.922 -1.947 13.330 1.00 53.51 H new ATOM 0 HB2 GLU A 495 -10.936 -0.485 12.994 1.00 14.41 H new ATOM 0 HB3 GLU A 495 -10.153 0.262 11.616 1.00 14.41 H new ATOM 0 HG2 GLU A 495 -10.178 -1.844 10.383 1.00 4.33 H new ATOM 0 HG3 GLU A 495 -10.777 -2.709 11.784 1.00 4.33 H new ATOM 961 N GLU A 496 -7.732 -2.452 11.154 1.00 4.33 N ATOM 962 CA GLU A 496 -6.797 -2.796 10.072 1.00 40.15 C ATOM 963 C GLU A 496 -7.477 -3.649 8.984 1.00 75.33 C ATOM 964 O GLU A 496 -8.213 -4.591 9.286 1.00 65.32 O ATOM 965 CB GLU A 496 -5.593 -3.562 10.633 1.00 74.25 C ATOM 966 CG GLU A 496 -4.533 -3.896 9.586 1.00 34.32 C ATOM 967 CD GLU A 496 -3.462 -4.836 10.111 1.00 1.23 C ATOM 968 OE1 GLU A 496 -2.784 -4.484 11.093 1.00 1.15 O ATOM 969 OE2 GLU A 496 -3.293 -5.935 9.544 1.00 62.24 O ATOM 0 H GLU A 496 -8.290 -3.238 11.487 1.00 4.33 H new ATOM 0 HA GLU A 496 -6.464 -1.861 9.621 1.00 40.15 H new ATOM 0 HB2 GLU A 496 -5.134 -2.970 11.425 1.00 74.25 H new ATOM 0 HB3 GLU A 496 -5.944 -4.488 11.090 1.00 74.25 H new ATOM 0 HG2 GLU A 496 -5.015 -4.349 8.720 1.00 34.32 H new ATOM 0 HG3 GLU A 496 -4.064 -2.974 9.243 1.00 34.32 H new ATOM 976 N LYS A 497 -7.223 -3.312 7.722 1.00 33.45 N ATOM 977 CA LYS A 497 -7.742 -4.077 6.579 1.00 20.34 C ATOM 978 C LYS A 497 -6.587 -4.568 5.687 1.00 2.42 C ATOM 979 O LYS A 497 -5.670 -3.807 5.372 1.00 13.32 O ATOM 980 CB LYS A 497 -8.709 -3.210 5.752 1.00 23.21 C ATOM 981 CG LYS A 497 -9.891 -2.664 6.555 1.00 14.12 C ATOM 982 CD LYS A 497 -10.877 -3.757 6.979 1.00 41.32 C ATOM 983 CE LYS A 497 -11.857 -4.131 5.867 1.00 50.05 C ATOM 984 NZ LYS A 497 -11.183 -4.734 4.690 1.00 50.34 N ATOM 0 H LYS A 497 -6.655 -2.507 7.458 1.00 33.45 H new ATOM 0 HA LYS A 497 -8.280 -4.943 6.963 1.00 20.34 H new ATOM 0 HB2 LYS A 497 -8.156 -2.374 5.323 1.00 23.21 H new ATOM 0 HB3 LYS A 497 -9.090 -3.801 4.919 1.00 23.21 H new ATOM 0 HG2 LYS A 497 -9.517 -2.155 7.443 1.00 14.12 H new ATOM 0 HG3 LYS A 497 -10.417 -1.919 5.958 1.00 14.12 H new ATOM 0 HD2 LYS A 497 -10.321 -4.645 7.282 1.00 41.32 H new ATOM 0 HD3 LYS A 497 -11.436 -3.418 7.851 1.00 41.32 H new ATOM 0 HE2 LYS A 497 -12.594 -4.833 6.258 1.00 50.05 H new ATOM 0 HE3 LYS A 497 -12.401 -3.240 5.553 1.00 50.05 H new ATOM 0 HZ1 LYS A 497 -11.852 -5.350 4.185 1.00 50.34 H new ATOM 0 HZ2 LYS A 497 -10.857 -3.980 4.052 1.00 50.34 H new ATOM 0 HZ3 LYS A 497 -10.367 -5.296 5.007 1.00 50.34 H new ATOM 998 N VAL A 498 -6.629 -5.837 5.289 1.00 30.33 N ATOM 999 CA VAL A 498 -5.600 -6.407 4.410 1.00 33.44 C ATOM 1000 C VAL A 498 -6.089 -6.480 2.954 1.00 22.51 C ATOM 1001 O VAL A 498 -7.044 -7.195 2.640 1.00 62.45 O ATOM 1002 CB VAL A 498 -5.176 -7.823 4.877 1.00 42.43 C ATOM 1003 CG1 VAL A 498 -4.055 -8.373 3.994 1.00 44.24 C ATOM 1004 CG2 VAL A 498 -4.752 -7.805 6.346 1.00 44.51 C ATOM 0 H VAL A 498 -7.362 -6.493 5.558 1.00 30.33 H new ATOM 0 HA VAL A 498 -4.737 -5.744 4.464 1.00 33.44 H new ATOM 0 HB VAL A 498 -6.037 -8.484 4.781 1.00 42.43 H new ATOM 0 HG11 VAL A 498 -3.774 -9.367 4.340 1.00 44.24 H new ATOM 0 HG12 VAL A 498 -4.401 -8.433 2.962 1.00 44.24 H new ATOM 0 HG13 VAL A 498 -3.190 -7.712 4.049 1.00 44.24 H new ATOM 0 HG21 VAL A 498 -4.459 -8.809 6.652 1.00 44.51 H new ATOM 0 HG22 VAL A 498 -3.909 -7.126 6.473 1.00 44.51 H new ATOM 0 HG23 VAL A 498 -5.586 -7.467 6.961 1.00 44.51 H new ATOM 1014 N LEU A 499 -5.432 -5.728 2.074 1.00 4.51 N ATOM 1015 CA LEU A 499 -5.788 -5.685 0.651 1.00 61.44 C ATOM 1016 C LEU A 499 -4.735 -6.418 -0.198 1.00 61.41 C ATOM 1017 O LEU A 499 -3.543 -6.150 -0.079 1.00 30.10 O ATOM 1018 CB LEU A 499 -5.915 -4.222 0.204 1.00 52.10 C ATOM 1019 CG LEU A 499 -6.946 -3.393 0.990 1.00 2.43 C ATOM 1020 CD1 LEU A 499 -6.879 -1.918 0.605 1.00 44.44 C ATOM 1021 CD2 LEU A 499 -8.354 -3.942 0.771 1.00 5.43 C ATOM 0 H LEU A 499 -4.641 -5.133 2.322 1.00 4.51 H new ATOM 0 HA LEU A 499 -6.743 -6.191 0.508 1.00 61.44 H new ATOM 0 HB2 LEU A 499 -4.940 -3.743 0.295 1.00 52.10 H new ATOM 0 HB3 LEU A 499 -6.183 -4.202 -0.852 1.00 52.10 H new ATOM 0 HG LEU A 499 -6.703 -3.473 2.049 1.00 2.43 H new ATOM 0 HD11 LEU A 499 -7.619 -1.359 1.177 1.00 44.44 H new ATOM 0 HD12 LEU A 499 -5.884 -1.530 0.822 1.00 44.44 H new ATOM 0 HD13 LEU A 499 -7.086 -1.810 -0.460 1.00 44.44 H new ATOM 0 HD21 LEU A 499 -9.070 -3.343 1.334 1.00 5.43 H new ATOM 0 HD22 LEU A 499 -8.600 -3.899 -0.290 1.00 5.43 H new ATOM 0 HD23 LEU A 499 -8.398 -4.976 1.112 1.00 5.43 H new ATOM 1033 N THR A 500 -5.174 -7.336 -1.056 1.00 12.04 N ATOM 1034 CA THR A 500 -4.244 -8.156 -1.855 1.00 2.04 C ATOM 1035 C THR A 500 -4.326 -7.849 -3.352 1.00 74.14 C ATOM 1036 O THR A 500 -5.374 -7.463 -3.875 1.00 64.52 O ATOM 1037 CB THR A 500 -4.500 -9.671 -1.668 1.00 31.24 C ATOM 1038 OG1 THR A 500 -5.882 -9.980 -1.910 1.00 13.12 O ATOM 1039 CG2 THR A 500 -4.108 -10.132 -0.270 1.00 1.25 C ATOM 0 H THR A 500 -6.161 -7.536 -1.221 1.00 12.04 H new ATOM 0 HA THR A 500 -3.252 -7.896 -1.486 1.00 2.04 H new ATOM 0 HB THR A 500 -3.880 -10.201 -2.391 1.00 31.24 H new ATOM 0 HG1 THR A 500 -6.028 -10.942 -1.790 1.00 13.12 H new ATOM 0 HG21 THR A 500 -4.300 -11.200 -0.172 1.00 1.25 H new ATOM 0 HG22 THR A 500 -3.048 -9.938 -0.107 1.00 1.25 H new ATOM 0 HG23 THR A 500 -4.695 -9.588 0.470 1.00 1.25 H new ATOM 1047 N PHE A 501 -3.199 -8.027 -4.038 1.00 32.23 N ATOM 1048 CA PHE A 501 -3.133 -7.867 -5.492 1.00 31.33 C ATOM 1049 C PHE A 501 -2.138 -8.858 -6.109 1.00 42.44 C ATOM 1050 O PHE A 501 -1.138 -9.224 -5.485 1.00 62.11 O ATOM 1051 CB PHE A 501 -2.745 -6.424 -5.864 1.00 13.04 C ATOM 1052 CG PHE A 501 -1.397 -5.977 -5.340 1.00 74.11 C ATOM 1053 CD1 PHE A 501 -1.267 -5.472 -4.054 1.00 54.05 C ATOM 1054 CD2 PHE A 501 -0.263 -6.055 -6.140 1.00 2.11 C ATOM 1055 CE1 PHE A 501 -0.040 -5.053 -3.578 1.00 52.22 C ATOM 1056 CE2 PHE A 501 0.967 -5.639 -5.668 1.00 41.23 C ATOM 1057 CZ PHE A 501 1.079 -5.137 -4.385 1.00 0.51 C ATOM 0 H PHE A 501 -2.311 -8.284 -3.607 1.00 32.23 H new ATOM 0 HA PHE A 501 -4.123 -8.077 -5.896 1.00 31.33 H new ATOM 0 HB2 PHE A 501 -2.747 -6.330 -6.950 1.00 13.04 H new ATOM 0 HB3 PHE A 501 -3.510 -5.747 -5.484 1.00 13.04 H new ATOM 0 HD1 PHE A 501 -2.137 -5.406 -3.417 1.00 54.05 H new ATOM 0 HD2 PHE A 501 -0.344 -6.446 -7.143 1.00 2.11 H new ATOM 0 HE1 PHE A 501 0.045 -4.660 -2.576 1.00 52.22 H new ATOM 0 HE2 PHE A 501 1.840 -5.706 -6.301 1.00 41.23 H new ATOM 0 HZ PHE A 501 2.039 -4.811 -4.014 1.00 0.51 H new ATOM 1067 N SER A 502 -2.421 -9.287 -7.337 1.00 43.24 N ATOM 1068 CA SER A 502 -1.541 -10.217 -8.059 1.00 12.22 C ATOM 1069 C SER A 502 -0.872 -9.531 -9.258 1.00 42.42 C ATOM 1070 O SER A 502 -1.529 -9.172 -10.235 1.00 24.21 O ATOM 1071 CB SER A 502 -2.341 -11.430 -8.546 1.00 11.15 C ATOM 1072 OG SER A 502 -3.399 -11.037 -9.409 1.00 22.14 O ATOM 0 H SER A 502 -3.253 -9.008 -7.857 1.00 43.24 H new ATOM 0 HA SER A 502 -0.763 -10.544 -7.369 1.00 12.22 H new ATOM 0 HB2 SER A 502 -1.678 -12.119 -9.070 1.00 11.15 H new ATOM 0 HB3 SER A 502 -2.748 -11.968 -7.690 1.00 11.15 H new ATOM 0 HG SER A 502 -3.162 -10.198 -9.857 1.00 22.14 H new ATOM 1078 N TRP A 503 0.444 -9.376 -9.190 1.00 55.34 N ATOM 1079 CA TRP A 503 1.213 -8.702 -10.241 1.00 20.30 C ATOM 1080 C TRP A 503 2.060 -9.708 -11.034 1.00 42.22 C ATOM 1081 O TRP A 503 2.717 -10.575 -10.456 1.00 1.21 O ATOM 1082 CB TRP A 503 2.103 -7.620 -9.609 1.00 71.23 C ATOM 1083 CG TRP A 503 3.014 -6.918 -10.579 1.00 22.42 C ATOM 1084 CD1 TRP A 503 2.652 -6.255 -11.717 1.00 62.31 C ATOM 1085 CD2 TRP A 503 4.438 -6.792 -10.479 1.00 31.21 C ATOM 1086 NE1 TRP A 503 3.763 -5.735 -12.333 1.00 11.44 N ATOM 1087 CE2 TRP A 503 4.872 -6.051 -11.592 1.00 14.35 C ATOM 1088 CE3 TRP A 503 5.389 -7.239 -9.556 1.00 41.40 C ATOM 1089 CZ2 TRP A 503 6.212 -5.745 -11.808 1.00 23.34 C ATOM 1090 CZ3 TRP A 503 6.720 -6.935 -9.770 1.00 51.31 C ATOM 1091 CH2 TRP A 503 7.122 -6.194 -10.889 1.00 23.10 C ATOM 0 H TRP A 503 1.011 -9.710 -8.411 1.00 55.34 H new ATOM 0 HA TRP A 503 0.520 -8.233 -10.940 1.00 20.30 H new ATOM 0 HB2 TRP A 503 1.466 -6.879 -9.127 1.00 71.23 H new ATOM 0 HB3 TRP A 503 2.709 -8.077 -8.826 1.00 71.23 H new ATOM 0 HD1 TRP A 503 1.640 -6.155 -12.079 1.00 62.31 H new ATOM 0 HE1 TRP A 503 3.763 -5.200 -13.201 1.00 11.44 H new ATOM 0 HE3 TRP A 503 5.088 -7.812 -8.691 1.00 41.40 H new ATOM 0 HZ2 TRP A 503 6.523 -5.174 -12.670 1.00 23.34 H new ATOM 0 HZ3 TRP A 503 7.463 -7.274 -9.063 1.00 51.31 H new ATOM 0 HH2 TRP A 503 8.170 -5.973 -11.029 1.00 23.10 H new ATOM 1102 N THR A 504 2.031 -9.590 -12.360 1.00 34.12 N ATOM 1103 CA THR A 504 2.814 -10.471 -13.234 1.00 2.51 C ATOM 1104 C THR A 504 3.948 -9.696 -13.921 1.00 13.14 C ATOM 1105 O THR A 504 3.720 -8.982 -14.901 1.00 3.45 O ATOM 1106 CB THR A 504 1.928 -11.132 -14.321 1.00 63.25 C ATOM 1107 OG1 THR A 504 0.861 -11.878 -13.710 1.00 5.43 O ATOM 1108 CG2 THR A 504 2.748 -12.059 -15.217 1.00 53.40 C ATOM 0 H THR A 504 1.475 -8.894 -12.856 1.00 34.12 H new ATOM 0 HA THR A 504 3.235 -11.250 -12.599 1.00 2.51 H new ATOM 0 HB THR A 504 1.510 -10.335 -14.936 1.00 63.25 H new ATOM 0 HG1 THR A 504 0.308 -12.289 -14.407 1.00 5.43 H new ATOM 0 HG21 THR A 504 2.098 -12.507 -15.969 1.00 53.40 H new ATOM 0 HG22 THR A 504 3.533 -11.487 -15.711 1.00 53.40 H new ATOM 0 HG23 THR A 504 3.198 -12.846 -14.612 1.00 53.40 H new ATOM 1116 N PRO A 505 5.189 -9.815 -13.414 1.00 62.15 N ATOM 1117 CA PRO A 505 6.347 -9.131 -14.006 1.00 73.31 C ATOM 1118 C PRO A 505 6.809 -9.778 -15.323 1.00 50.24 C ATOM 1119 O PRO A 505 7.646 -10.680 -15.327 1.00 23.25 O ATOM 1120 CB PRO A 505 7.420 -9.263 -12.918 1.00 51.32 C ATOM 1121 CG PRO A 505 7.066 -10.519 -12.194 1.00 72.10 C ATOM 1122 CD PRO A 505 5.561 -10.608 -12.223 1.00 5.14 C ATOM 0 HA PRO A 505 6.122 -8.100 -14.278 1.00 73.31 H new ATOM 0 HB2 PRO A 505 8.419 -9.322 -13.351 1.00 51.32 H new ATOM 0 HB3 PRO A 505 7.414 -8.403 -12.248 1.00 51.32 H new ATOM 0 HG2 PRO A 505 7.517 -11.387 -12.675 1.00 72.10 H new ATOM 0 HG3 PRO A 505 7.435 -10.495 -11.169 1.00 72.10 H new ATOM 0 HD2 PRO A 505 5.222 -11.641 -12.307 1.00 5.14 H new ATOM 0 HD3 PRO A 505 5.118 -10.200 -11.315 1.00 5.14 H new ATOM 1130 N THR A 506 6.235 -9.330 -16.439 1.00 43.24 N ATOM 1131 CA THR A 506 6.599 -9.852 -17.765 1.00 50.42 C ATOM 1132 C THR A 506 7.973 -9.340 -18.235 1.00 41.52 C ATOM 1133 O THR A 506 8.548 -9.862 -19.189 1.00 74.34 O ATOM 1134 CB THR A 506 5.523 -9.504 -18.823 1.00 70.13 C ATOM 1135 OG1 THR A 506 5.192 -8.106 -18.757 1.00 45.44 O ATOM 1136 CG2 THR A 506 4.261 -10.342 -18.617 1.00 53.22 C ATOM 0 H THR A 506 5.516 -8.607 -16.456 1.00 43.24 H new ATOM 0 HA THR A 506 6.658 -10.935 -17.662 1.00 50.42 H new ATOM 0 HB THR A 506 5.934 -9.731 -19.807 1.00 70.13 H new ATOM 0 HG1 THR A 506 6.007 -7.584 -18.605 1.00 45.44 H new ATOM 0 HG21 THR A 506 3.521 -10.078 -19.373 1.00 53.22 H new ATOM 0 HG22 THR A 506 4.508 -11.400 -18.705 1.00 53.22 H new ATOM 0 HG23 THR A 506 3.852 -10.146 -17.626 1.00 53.22 H new ATOM 1144 N GLN A 507 8.489 -8.312 -17.564 1.00 51.11 N ATOM 1145 CA GLN A 507 9.852 -7.816 -17.809 1.00 23.45 C ATOM 1146 C GLN A 507 10.732 -8.010 -16.566 1.00 3.13 C ATOM 1147 O GLN A 507 10.251 -7.924 -15.435 1.00 62.51 O ATOM 1148 CB GLN A 507 9.843 -6.328 -18.201 1.00 2.10 C ATOM 1149 CG GLN A 507 9.272 -6.033 -19.587 1.00 21.32 C ATOM 1150 CD GLN A 507 7.767 -6.219 -19.679 1.00 74.15 C ATOM 1151 OE1 GLN A 507 7.040 -6.040 -18.707 1.00 10.54 O ATOM 1152 NE2 GLN A 507 7.282 -6.577 -20.851 1.00 2.20 N ATOM 0 H GLN A 507 7.984 -7.800 -16.841 1.00 51.11 H new ATOM 0 HA GLN A 507 10.264 -8.393 -18.637 1.00 23.45 H new ATOM 0 HB2 GLN A 507 9.265 -5.775 -17.460 1.00 2.10 H new ATOM 0 HB3 GLN A 507 10.864 -5.949 -18.156 1.00 2.10 H new ATOM 0 HG2 GLN A 507 9.520 -5.008 -19.862 1.00 21.32 H new ATOM 0 HG3 GLN A 507 9.755 -6.684 -20.316 1.00 21.32 H new ATOM 0 HE21 GLN A 507 7.911 -6.719 -21.641 1.00 2.20 H new ATOM 0 HE22 GLN A 507 6.278 -6.712 -20.968 1.00 2.20 H new ATOM 1161 N GLU A 508 12.018 -8.280 -16.778 1.00 4.52 N ATOM 1162 CA GLU A 508 12.967 -8.465 -15.667 1.00 31.54 C ATOM 1163 C GLU A 508 13.738 -7.171 -15.350 1.00 51.15 C ATOM 1164 O GLU A 508 13.978 -6.347 -16.233 1.00 42.13 O ATOM 1165 CB GLU A 508 13.930 -9.633 -15.969 1.00 13.12 C ATOM 1166 CG GLU A 508 14.552 -9.623 -17.371 1.00 42.14 C ATOM 1167 CD GLU A 508 15.649 -8.584 -17.557 1.00 45.20 C ATOM 1168 OE1 GLU A 508 16.742 -8.762 -16.977 1.00 34.40 O ATOM 1169 OE2 GLU A 508 15.432 -7.598 -18.301 1.00 24.22 O ATOM 0 H GLU A 508 12.433 -8.377 -17.705 1.00 4.52 H new ATOM 0 HA GLU A 508 12.392 -8.716 -14.776 1.00 31.54 H new ATOM 0 HB2 GLU A 508 14.734 -9.619 -15.233 1.00 13.12 H new ATOM 0 HB3 GLU A 508 13.391 -10.571 -15.835 1.00 13.12 H new ATOM 0 HG2 GLU A 508 14.962 -10.611 -17.582 1.00 42.14 H new ATOM 0 HG3 GLU A 508 13.766 -9.441 -18.104 1.00 42.14 H new ATOM 1176 N GLY A 509 14.115 -6.994 -14.083 1.00 15.41 N ATOM 1177 CA GLY A 509 14.827 -5.785 -13.671 1.00 3.31 C ATOM 1178 C GLY A 509 14.487 -5.334 -12.250 1.00 63.35 C ATOM 1179 O GLY A 509 13.867 -6.076 -11.482 1.00 4.44 O ATOM 0 H GLY A 509 13.942 -7.663 -13.333 1.00 15.41 H new ATOM 0 HA2 GLY A 509 15.900 -5.963 -13.741 1.00 3.31 H new ATOM 0 HA3 GLY A 509 14.592 -4.979 -14.366 1.00 3.31 H new ATOM 1183 N MET A 510 14.896 -4.112 -11.902 1.00 24.24 N ATOM 1184 CA MET A 510 14.655 -3.551 -10.565 1.00 51.32 C ATOM 1185 C MET A 510 13.329 -2.771 -10.511 1.00 51.15 C ATOM 1186 O MET A 510 13.219 -1.674 -11.063 1.00 52.34 O ATOM 1187 CB MET A 510 15.821 -2.625 -10.184 1.00 33.41 C ATOM 1188 CG MET A 510 15.670 -1.897 -8.846 1.00 53.22 C ATOM 1189 SD MET A 510 16.124 -2.901 -7.409 1.00 14.31 S ATOM 1190 CE MET A 510 14.692 -3.959 -7.205 1.00 33.42 C ATOM 0 H MET A 510 15.399 -3.486 -12.531 1.00 24.24 H new ATOM 0 HA MET A 510 14.586 -4.375 -9.855 1.00 51.32 H new ATOM 0 HB2 MET A 510 16.737 -3.215 -10.156 1.00 33.41 H new ATOM 0 HB3 MET A 510 15.944 -1.881 -10.971 1.00 33.41 H new ATOM 0 HG2 MET A 510 16.289 -1.000 -8.860 1.00 53.22 H new ATOM 0 HG3 MET A 510 14.636 -1.570 -8.736 1.00 53.22 H new ATOM 0 HE1 MET A 510 14.543 -4.170 -6.146 1.00 33.42 H new ATOM 0 HE2 MET A 510 13.810 -3.458 -7.602 1.00 33.42 H new ATOM 0 HE3 MET A 510 14.851 -4.894 -7.742 1.00 33.42 H new ATOM 1200 N TYR A 511 12.320 -3.332 -9.845 1.00 24.01 N ATOM 1201 CA TYR A 511 11.020 -2.659 -9.700 1.00 1.33 C ATOM 1202 C TYR A 511 10.735 -2.294 -8.237 1.00 42.14 C ATOM 1203 O TYR A 511 11.143 -3.000 -7.321 1.00 51.43 O ATOM 1204 CB TYR A 511 9.895 -3.539 -10.260 1.00 51.34 C ATOM 1205 CG TYR A 511 9.983 -3.727 -11.764 1.00 34.14 C ATOM 1206 CD1 TYR A 511 9.438 -2.785 -12.631 1.00 3.44 C ATOM 1207 CD2 TYR A 511 10.619 -4.835 -12.316 1.00 34.33 C ATOM 1208 CE1 TYR A 511 9.526 -2.941 -14.000 1.00 11.12 C ATOM 1209 CE2 TYR A 511 10.709 -4.997 -13.686 1.00 31.32 C ATOM 1210 CZ TYR A 511 10.161 -4.046 -14.523 1.00 3.24 C ATOM 1211 OH TYR A 511 10.251 -4.199 -15.885 1.00 13.03 O ATOM 0 H TYR A 511 12.373 -4.247 -9.397 1.00 24.01 H new ATOM 0 HA TYR A 511 11.061 -1.732 -10.272 1.00 1.33 H new ATOM 0 HB2 TYR A 511 9.928 -4.514 -9.775 1.00 51.34 H new ATOM 0 HB3 TYR A 511 8.933 -3.092 -10.011 1.00 51.34 H new ATOM 0 HD1 TYR A 511 8.938 -1.917 -12.226 1.00 3.44 H new ATOM 0 HD2 TYR A 511 11.049 -5.580 -11.664 1.00 34.33 H new ATOM 0 HE1 TYR A 511 9.099 -2.199 -14.659 1.00 11.12 H new ATOM 0 HE2 TYR A 511 11.205 -5.863 -14.099 1.00 31.32 H new ATOM 0 HH TYR A 511 10.921 -4.883 -16.094 1.00 13.03 H new ATOM 1221 N ARG A 512 10.041 -1.181 -8.027 1.00 72.24 N ATOM 1222 CA ARG A 512 9.739 -0.695 -6.675 1.00 23.43 C ATOM 1223 C ARG A 512 8.225 -0.503 -6.476 1.00 42.14 C ATOM 1224 O ARG A 512 7.603 0.328 -7.142 1.00 54.43 O ATOM 1225 CB ARG A 512 10.464 0.634 -6.421 1.00 23.24 C ATOM 1226 CG ARG A 512 10.544 1.028 -4.947 1.00 71.21 C ATOM 1227 CD ARG A 512 11.019 2.468 -4.774 1.00 24.25 C ATOM 1228 NE ARG A 512 9.964 3.433 -5.082 1.00 64.55 N ATOM 1229 CZ ARG A 512 10.135 4.532 -5.765 1.00 61.01 C ATOM 1230 NH1 ARG A 512 11.255 4.780 -6.366 1.00 44.51 N ATOM 1231 NH2 ARG A 512 9.157 5.368 -5.880 1.00 10.41 N ATOM 0 H ARG A 512 9.674 -0.593 -8.775 1.00 72.24 H new ATOM 0 HA ARG A 512 10.086 -1.444 -5.964 1.00 23.43 H new ATOM 0 HB2 ARG A 512 11.475 0.567 -6.824 1.00 23.24 H new ATOM 0 HB3 ARG A 512 9.954 1.425 -6.970 1.00 23.24 H new ATOM 0 HG2 ARG A 512 9.564 0.910 -4.485 1.00 71.21 H new ATOM 0 HG3 ARG A 512 11.225 0.355 -4.427 1.00 71.21 H new ATOM 0 HD2 ARG A 512 11.359 2.617 -3.749 1.00 24.25 H new ATOM 0 HD3 ARG A 512 11.876 2.648 -5.423 1.00 24.25 H new ATOM 0 HE ARG A 512 9.025 3.232 -4.738 1.00 64.55 H new ATOM 0 HH11 ARG A 512 12.023 4.111 -6.310 1.00 44.51 H new ATOM 0 HH12 ARG A 512 11.369 5.645 -6.895 1.00 44.51 H new ATOM 0 HH21 ARG A 512 8.260 5.167 -5.439 1.00 10.41 H new ATOM 0 HH22 ARG A 512 9.282 6.229 -6.412 1.00 10.41 H new ATOM 1245 N ILE A 513 7.640 -1.263 -5.557 1.00 43.33 N ATOM 1246 CA ILE A 513 6.207 -1.167 -5.257 1.00 3.14 C ATOM 1247 C ILE A 513 5.951 -0.257 -4.041 1.00 32.41 C ATOM 1248 O ILE A 513 6.582 -0.409 -2.995 1.00 53.12 O ATOM 1249 CB ILE A 513 5.600 -2.569 -4.986 1.00 20.33 C ATOM 1250 CG1 ILE A 513 5.807 -3.487 -6.204 1.00 41.43 C ATOM 1251 CG2 ILE A 513 4.115 -2.461 -4.637 1.00 23.43 C ATOM 1252 CD1 ILE A 513 5.262 -4.889 -6.019 1.00 60.25 C ATOM 0 H ILE A 513 8.136 -1.959 -5.000 1.00 43.33 H new ATOM 0 HA ILE A 513 5.724 -0.731 -6.132 1.00 3.14 H new ATOM 0 HB ILE A 513 6.116 -3.007 -4.131 1.00 20.33 H new ATOM 0 HG12 ILE A 513 5.329 -3.034 -7.073 1.00 41.43 H new ATOM 0 HG13 ILE A 513 6.873 -3.549 -6.423 1.00 41.43 H new ATOM 0 HG21 ILE A 513 3.712 -3.456 -4.451 1.00 23.43 H new ATOM 0 HG22 ILE A 513 3.995 -1.848 -3.744 1.00 23.43 H new ATOM 0 HG23 ILE A 513 3.579 -2.001 -5.467 1.00 23.43 H new ATOM 0 HD11 ILE A 513 5.447 -5.473 -6.920 1.00 60.25 H new ATOM 0 HD12 ILE A 513 5.757 -5.363 -5.172 1.00 60.25 H new ATOM 0 HD13 ILE A 513 4.189 -4.841 -5.832 1.00 60.25 H new ATOM 1264 N ASN A 514 5.030 0.693 -4.188 1.00 14.54 N ATOM 1265 CA ASN A 514 4.666 1.606 -3.098 1.00 21.42 C ATOM 1266 C ASN A 514 3.156 1.586 -2.826 1.00 53.43 C ATOM 1267 O ASN A 514 2.353 1.396 -3.738 1.00 31.24 O ATOM 1268 CB ASN A 514 5.097 3.042 -3.429 1.00 63.32 C ATOM 1269 CG ASN A 514 6.600 3.226 -3.417 1.00 71.34 C ATOM 1270 OD1 ASN A 514 7.267 3.120 -4.440 1.00 3.21 O ATOM 1271 ND2 ASN A 514 7.143 3.497 -2.251 1.00 42.10 N ATOM 0 H ASN A 514 4.518 0.854 -5.055 1.00 14.54 H new ATOM 0 HA ASN A 514 5.187 1.263 -2.204 1.00 21.42 H new ATOM 0 HB2 ASN A 514 4.711 3.314 -4.411 1.00 63.32 H new ATOM 0 HB3 ASN A 514 4.647 3.726 -2.709 1.00 63.32 H new ATOM 0 HD21 ASN A 514 8.152 3.627 -2.176 1.00 42.10 H new ATOM 0 HD22 ASN A 514 6.555 3.578 -1.421 1.00 42.10 H new ATOM 1278 N ALA A 515 2.781 1.789 -1.566 1.00 22.10 N ATOM 1279 CA ALA A 515 1.371 1.924 -1.180 1.00 41.11 C ATOM 1280 C ALA A 515 1.126 3.274 -0.494 1.00 33.10 C ATOM 1281 O ALA A 515 1.894 3.688 0.376 1.00 41.55 O ATOM 1282 CB ALA A 515 0.947 0.780 -0.266 1.00 60.32 C ATOM 0 H ALA A 515 3.435 1.865 -0.787 1.00 22.10 H new ATOM 0 HA ALA A 515 0.767 1.880 -2.086 1.00 41.11 H new ATOM 0 HB1 ALA A 515 -0.101 0.902 0.007 1.00 60.32 H new ATOM 0 HB2 ALA A 515 1.079 -0.169 -0.786 1.00 60.32 H new ATOM 0 HB3 ALA A 515 1.560 0.788 0.635 1.00 60.32 H new ATOM 1288 N THR A 516 0.064 3.960 -0.899 1.00 3.32 N ATOM 1289 CA THR A 516 -0.273 5.280 -0.348 1.00 20.42 C ATOM 1290 C THR A 516 -1.723 5.335 0.147 1.00 14.03 C ATOM 1291 O THR A 516 -2.621 4.747 -0.461 1.00 11.13 O ATOM 1292 CB THR A 516 -0.082 6.388 -1.411 1.00 44.33 C ATOM 1293 OG1 THR A 516 -0.893 6.103 -2.564 1.00 52.34 O ATOM 1294 CG2 THR A 516 1.381 6.509 -1.832 1.00 12.21 C ATOM 0 H THR A 516 -0.586 3.627 -1.611 1.00 3.32 H new ATOM 0 HA THR A 516 0.401 5.446 0.492 1.00 20.42 H new ATOM 0 HB THR A 516 -0.389 7.335 -0.968 1.00 44.33 H new ATOM 0 HG1 THR A 516 -1.321 6.928 -2.875 1.00 52.34 H new ATOM 0 HG21 THR A 516 1.481 7.296 -2.579 1.00 12.21 H new ATOM 0 HG22 THR A 516 1.991 6.755 -0.963 1.00 12.21 H new ATOM 0 HG23 THR A 516 1.717 5.562 -2.255 1.00 12.21 H new ATOM 1302 N VAL A 517 -1.950 6.041 1.256 1.00 72.51 N ATOM 1303 CA VAL A 517 -3.310 6.271 1.756 1.00 74.34 C ATOM 1304 C VAL A 517 -3.598 7.777 1.924 1.00 53.42 C ATOM 1305 O VAL A 517 -2.745 8.532 2.386 1.00 60.44 O ATOM 1306 CB VAL A 517 -3.551 5.531 3.098 1.00 24.25 C ATOM 1307 CG1 VAL A 517 -2.535 5.959 4.155 1.00 72.42 C ATOM 1308 CG2 VAL A 517 -4.979 5.751 3.594 1.00 51.41 C ATOM 0 H VAL A 517 -1.215 6.462 1.824 1.00 72.51 H new ATOM 0 HA VAL A 517 -3.997 5.868 1.012 1.00 74.34 H new ATOM 0 HB VAL A 517 -3.416 4.464 2.918 1.00 24.25 H new ATOM 0 HG11 VAL A 517 -2.729 5.424 5.084 1.00 72.42 H new ATOM 0 HG12 VAL A 517 -1.528 5.728 3.807 1.00 72.42 H new ATOM 0 HG13 VAL A 517 -2.621 7.032 4.329 1.00 72.42 H new ATOM 0 HG21 VAL A 517 -5.122 5.222 4.536 1.00 51.41 H new ATOM 0 HG22 VAL A 517 -5.151 6.816 3.746 1.00 51.41 H new ATOM 0 HG23 VAL A 517 -5.684 5.372 2.854 1.00 51.41 H new ATOM 1318 N ASP A 518 -4.818 8.181 1.551 1.00 62.23 N ATOM 1319 CA ASP A 518 -5.258 9.591 1.578 1.00 34.34 C ATOM 1320 C ASP A 518 -4.145 10.570 1.132 1.00 42.43 C ATOM 1321 O ASP A 518 -3.637 11.371 1.924 1.00 14.34 O ATOM 1322 CB ASP A 518 -5.807 9.981 2.965 1.00 63.25 C ATOM 1323 CG ASP A 518 -6.565 11.308 2.947 1.00 3.51 C ATOM 1324 OD1 ASP A 518 -6.717 11.906 1.858 1.00 12.02 O ATOM 1325 OD2 ASP A 518 -7.019 11.760 4.017 1.00 23.43 O ATOM 0 H ASP A 518 -5.537 7.538 1.219 1.00 62.23 H new ATOM 0 HA ASP A 518 -6.067 9.675 0.852 1.00 34.34 H new ATOM 0 HB2 ASP A 518 -6.470 9.193 3.324 1.00 63.25 H new ATOM 0 HB3 ASP A 518 -4.981 10.049 3.673 1.00 63.25 H new ATOM 1330 N GLU A 519 -3.769 10.488 -0.143 1.00 23.20 N ATOM 1331 CA GLU A 519 -2.767 11.394 -0.724 1.00 4.43 C ATOM 1332 C GLU A 519 -3.231 12.857 -0.677 1.00 63.45 C ATOM 1333 O GLU A 519 -2.415 13.776 -0.576 1.00 32.02 O ATOM 1334 CB GLU A 519 -2.451 10.988 -2.171 1.00 52.22 C ATOM 1335 CG GLU A 519 -1.678 9.680 -2.285 1.00 34.00 C ATOM 1336 CD GLU A 519 -1.468 9.248 -3.726 1.00 32.24 C ATOM 1337 OE1 GLU A 519 -0.694 9.910 -4.448 1.00 44.01 O ATOM 1338 OE2 GLU A 519 -2.095 8.257 -4.151 1.00 31.43 O ATOM 0 H GLU A 519 -4.142 9.802 -0.800 1.00 23.20 H new ATOM 0 HA GLU A 519 -1.862 11.310 -0.123 1.00 4.43 H new ATOM 0 HB2 GLU A 519 -3.385 10.897 -2.726 1.00 52.22 H new ATOM 0 HB3 GLU A 519 -1.875 11.783 -2.644 1.00 52.22 H new ATOM 0 HG2 GLU A 519 -0.709 9.792 -1.798 1.00 34.00 H new ATOM 0 HG3 GLU A 519 -2.215 8.897 -1.750 1.00 34.00 H new ATOM 1345 N GLU A 520 -4.543 13.065 -0.781 1.00 12.55 N ATOM 1346 CA GLU A 520 -5.124 14.412 -0.732 1.00 74.14 C ATOM 1347 C GLU A 520 -5.036 15.000 0.686 1.00 34.15 C ATOM 1348 O GLU A 520 -5.130 16.216 0.870 1.00 45.02 O ATOM 1349 CB GLU A 520 -6.595 14.383 -1.188 1.00 52.23 C ATOM 1350 CG GLU A 520 -6.854 13.544 -2.439 1.00 1.34 C ATOM 1351 CD GLU A 520 -5.960 13.914 -3.614 1.00 54.34 C ATOM 1352 OE1 GLU A 520 -6.298 14.860 -4.357 1.00 23.21 O ATOM 1353 OE2 GLU A 520 -4.923 13.243 -3.811 1.00 2.14 O ATOM 0 H GLU A 520 -5.227 12.318 -0.900 1.00 12.55 H new ATOM 0 HA GLU A 520 -4.551 15.045 -1.409 1.00 74.14 H new ATOM 0 HB2 GLU A 520 -7.207 13.996 -0.373 1.00 52.23 H new ATOM 0 HB3 GLU A 520 -6.924 15.405 -1.377 1.00 52.23 H new ATOM 0 HG2 GLU A 520 -6.706 12.491 -2.198 1.00 1.34 H new ATOM 0 HG3 GLU A 520 -7.897 13.660 -2.735 1.00 1.34 H new ATOM 1360 N ASN A 521 -4.858 14.124 1.681 1.00 45.34 N ATOM 1361 CA ASN A 521 -4.799 14.526 3.091 1.00 21.14 C ATOM 1362 C ASN A 521 -6.098 15.221 3.517 1.00 43.14 C ATOM 1363 O ASN A 521 -6.087 16.324 4.066 1.00 71.33 O ATOM 1364 CB ASN A 521 -3.585 15.430 3.358 1.00 20.24 C ATOM 1365 CG ASN A 521 -2.254 14.750 3.071 1.00 20.41 C ATOM 1366 OD1 ASN A 521 -1.278 15.404 2.715 1.00 62.42 O ATOM 1367 ND2 ASN A 521 -2.191 13.440 3.223 1.00 53.35 N ATOM 0 H ASN A 521 -4.751 13.120 1.533 1.00 45.34 H new ATOM 0 HA ASN A 521 -4.684 13.623 3.690 1.00 21.14 H new ATOM 0 HB2 ASN A 521 -3.667 16.327 2.744 1.00 20.24 H new ATOM 0 HB3 ASN A 521 -3.603 15.753 4.399 1.00 20.24 H new ATOM 0 HD21 ASN A 521 -1.316 12.947 3.044 1.00 53.35 H new ATOM 0 HD22 ASN A 521 -3.017 12.921 3.520 1.00 53.35 H new ATOM 1374 N THR A 522 -7.221 14.562 3.248 1.00 60.33 N ATOM 1375 CA THR A 522 -8.541 15.091 3.608 1.00 73.15 C ATOM 1376 C THR A 522 -8.723 15.139 5.129 1.00 53.24 C ATOM 1377 O THR A 522 -9.461 15.977 5.656 1.00 11.00 O ATOM 1378 CB THR A 522 -9.680 14.239 3.005 1.00 42.22 C ATOM 1379 OG1 THR A 522 -9.657 12.918 3.566 1.00 4.45 O ATOM 1380 CG2 THR A 522 -9.558 14.155 1.487 1.00 20.00 C ATOM 0 H THR A 522 -7.247 13.656 2.780 1.00 60.33 H new ATOM 0 HA THR A 522 -8.591 16.100 3.199 1.00 73.15 H new ATOM 0 HB THR A 522 -10.627 14.721 3.248 1.00 42.22 H new ATOM 0 HG1 THR A 522 -8.728 12.625 3.674 1.00 4.45 H new ATOM 0 HG21 THR A 522 -10.372 13.549 1.089 1.00 20.00 H new ATOM 0 HG22 THR A 522 -9.610 15.157 1.062 1.00 20.00 H new ATOM 0 HG23 THR A 522 -8.604 13.698 1.223 1.00 20.00 H new ATOM 1388 N VAL A 523 -8.051 14.228 5.826 1.00 11.43 N ATOM 1389 CA VAL A 523 -8.092 14.165 7.288 1.00 42.41 C ATOM 1390 C VAL A 523 -6.710 14.470 7.893 1.00 12.24 C ATOM 1391 O VAL A 523 -5.679 14.108 7.326 1.00 12.23 O ATOM 1392 CB VAL A 523 -8.594 12.781 7.772 1.00 11.25 C ATOM 1393 CG1 VAL A 523 -7.585 11.675 7.453 1.00 43.25 C ATOM 1394 CG2 VAL A 523 -8.925 12.819 9.261 1.00 4.21 C ATOM 0 H VAL A 523 -7.463 13.513 5.397 1.00 11.43 H new ATOM 0 HA VAL A 523 -8.794 14.925 7.630 1.00 42.41 H new ATOM 0 HB VAL A 523 -9.509 12.548 7.228 1.00 11.25 H new ATOM 0 HG11 VAL A 523 -7.970 10.718 7.807 1.00 43.25 H new ATOM 0 HG12 VAL A 523 -7.427 11.627 6.376 1.00 43.25 H new ATOM 0 HG13 VAL A 523 -6.639 11.891 7.949 1.00 43.25 H new ATOM 0 HG21 VAL A 523 -9.276 11.838 9.581 1.00 4.21 H new ATOM 0 HG22 VAL A 523 -8.032 13.087 9.826 1.00 4.21 H new ATOM 0 HG23 VAL A 523 -9.704 13.559 9.442 1.00 4.21 H new ATOM 1404 N VAL A 524 -6.690 15.163 9.034 1.00 70.33 N ATOM 1405 CA VAL A 524 -5.428 15.535 9.687 1.00 51.33 C ATOM 1406 C VAL A 524 -4.879 14.377 10.539 1.00 61.14 C ATOM 1407 O VAL A 524 -5.506 13.949 11.511 1.00 23.54 O ATOM 1408 CB VAL A 524 -5.598 16.791 10.577 1.00 43.45 C ATOM 1409 CG1 VAL A 524 -4.265 17.201 11.205 1.00 42.21 C ATOM 1410 CG2 VAL A 524 -6.197 17.944 9.773 1.00 30.11 C ATOM 0 H VAL A 524 -7.527 15.477 9.524 1.00 70.33 H new ATOM 0 HA VAL A 524 -4.717 15.761 8.893 1.00 51.33 H new ATOM 0 HB VAL A 524 -6.287 16.543 11.384 1.00 43.45 H new ATOM 0 HG11 VAL A 524 -4.412 18.085 11.825 1.00 42.21 H new ATOM 0 HG12 VAL A 524 -3.887 16.385 11.821 1.00 42.21 H new ATOM 0 HG13 VAL A 524 -3.546 17.425 10.418 1.00 42.21 H new ATOM 0 HG21 VAL A 524 -6.308 18.817 10.416 1.00 30.11 H new ATOM 0 HG22 VAL A 524 -5.537 18.189 8.941 1.00 30.11 H new ATOM 0 HG23 VAL A 524 -7.173 17.650 9.388 1.00 30.11 H new ATOM 1420 N GLU A 525 -3.693 13.902 10.173 1.00 63.23 N ATOM 1421 CA GLU A 525 -3.081 12.719 10.794 1.00 21.01 C ATOM 1422 C GLU A 525 -2.158 13.080 11.971 1.00 53.45 C ATOM 1423 O GLU A 525 -1.715 14.224 12.108 1.00 41.42 O ATOM 1424 CB GLU A 525 -2.267 11.972 9.729 1.00 70.12 C ATOM 1425 CG GLU A 525 -3.090 11.511 8.529 1.00 64.21 C ATOM 1426 CD GLU A 525 -3.765 10.170 8.756 1.00 2.20 C ATOM 1427 OE1 GLU A 525 -4.792 10.113 9.465 1.00 1.51 O ATOM 1428 OE2 GLU A 525 -3.253 9.161 8.236 1.00 41.41 O ATOM 0 H GLU A 525 -3.124 14.322 9.438 1.00 63.23 H new ATOM 0 HA GLU A 525 -3.884 12.097 11.190 1.00 21.01 H new ATOM 0 HB2 GLU A 525 -1.464 12.621 9.378 1.00 70.12 H new ATOM 0 HB3 GLU A 525 -1.796 11.103 10.189 1.00 70.12 H new ATOM 0 HG2 GLU A 525 -3.849 12.261 8.306 1.00 64.21 H new ATOM 0 HG3 GLU A 525 -2.442 11.443 7.655 1.00 64.21 H new ATOM 1435 N LEU A 526 -1.862 12.086 12.813 1.00 24.54 N ATOM 1436 CA LEU A 526 -0.873 12.244 13.888 1.00 12.43 C ATOM 1437 C LEU A 526 0.545 12.348 13.313 1.00 3.12 C ATOM 1438 O LEU A 526 1.381 13.104 13.815 1.00 14.22 O ATOM 1439 CB LEU A 526 -0.947 11.065 14.870 1.00 71.10 C ATOM 1440 CG LEU A 526 -2.219 10.998 15.731 1.00 32.14 C ATOM 1441 CD1 LEU A 526 -2.228 9.732 16.586 1.00 54.32 C ATOM 1442 CD2 LEU A 526 -2.341 12.238 16.613 1.00 44.33 C ATOM 0 H LEU A 526 -2.292 11.162 12.773 1.00 24.54 H new ATOM 0 HA LEU A 526 -1.105 13.166 14.422 1.00 12.43 H new ATOM 0 HB2 LEU A 526 -0.864 10.138 14.304 1.00 71.10 H new ATOM 0 HB3 LEU A 526 -0.083 11.112 15.533 1.00 71.10 H new ATOM 0 HG LEU A 526 -3.079 10.967 15.062 1.00 32.14 H new ATOM 0 HD11 LEU A 526 -3.137 9.705 17.187 1.00 54.32 H new ATOM 0 HD12 LEU A 526 -2.195 8.856 15.939 1.00 54.32 H new ATOM 0 HD13 LEU A 526 -1.358 9.731 17.243 1.00 54.32 H new ATOM 0 HD21 LEU A 526 -3.248 12.169 17.214 1.00 44.33 H new ATOM 0 HD22 LEU A 526 -1.474 12.303 17.271 1.00 44.33 H new ATOM 0 HD23 LEU A 526 -2.388 13.128 15.985 1.00 44.33 H new ATOM 1454 N ASN A 527 0.811 11.569 12.264 1.00 70.13 N ATOM 1455 CA ASN A 527 2.094 11.613 11.555 1.00 63.34 C ATOM 1456 C ASN A 527 1.883 11.731 10.037 1.00 50.12 C ATOM 1457 O ASN A 527 1.318 10.845 9.404 1.00 15.20 O ATOM 1458 CB ASN A 527 2.921 10.362 11.886 1.00 63.10 C ATOM 1459 CG ASN A 527 4.240 10.306 11.133 1.00 33.22 C ATOM 1460 OD1 ASN A 527 4.823 11.330 10.780 1.00 14.12 O ATOM 1461 ND2 ASN A 527 4.726 9.108 10.882 1.00 74.34 N ATOM 0 H ASN A 527 0.149 10.893 11.882 1.00 70.13 H new ATOM 0 HA ASN A 527 2.639 12.497 11.887 1.00 63.34 H new ATOM 0 HB2 ASN A 527 3.119 10.337 12.958 1.00 63.10 H new ATOM 0 HB3 ASN A 527 2.336 9.473 11.650 1.00 63.10 H new ATOM 0 HD21 ASN A 527 5.610 9.011 10.382 1.00 74.34 H new ATOM 0 HD22 ASN A 527 4.219 8.278 11.188 1.00 74.34 H new ATOM 1468 N GLU A 528 2.368 12.826 9.457 1.00 35.21 N ATOM 1469 CA GLU A 528 2.206 13.087 8.019 1.00 41.20 C ATOM 1470 C GLU A 528 3.280 12.370 7.174 1.00 54.11 C ATOM 1471 O GLU A 528 3.334 12.524 5.953 1.00 73.20 O ATOM 1472 CB GLU A 528 2.247 14.599 7.774 1.00 34.04 C ATOM 1473 CG GLU A 528 3.510 15.265 8.307 1.00 43.50 C ATOM 1474 CD GLU A 528 3.395 16.776 8.366 1.00 51.24 C ATOM 1475 OE1 GLU A 528 2.901 17.300 9.386 1.00 11.11 O ATOM 1476 OE2 GLU A 528 3.807 17.447 7.397 1.00 33.10 O ATOM 0 H GLU A 528 2.879 13.553 9.958 1.00 35.21 H new ATOM 0 HA GLU A 528 1.241 12.688 7.706 1.00 41.20 H new ATOM 0 HB2 GLU A 528 2.170 14.788 6.703 1.00 34.04 H new ATOM 0 HB3 GLU A 528 1.377 15.059 8.243 1.00 34.04 H new ATOM 0 HG2 GLU A 528 3.724 14.882 9.305 1.00 43.50 H new ATOM 0 HG3 GLU A 528 4.354 14.993 7.673 1.00 43.50 H new ATOM 1483 N ASN A 529 4.133 11.588 7.836 1.00 0.00 N ATOM 1484 CA ASN A 529 5.118 10.733 7.151 1.00 71.22 C ATOM 1485 C ASN A 529 4.694 9.257 7.250 1.00 41.30 C ATOM 1486 O ASN A 529 5.485 8.342 7.015 1.00 32.25 O ATOM 1487 CB ASN A 529 6.504 10.919 7.782 1.00 31.40 C ATOM 1488 CG ASN A 529 6.945 12.371 7.803 1.00 44.50 C ATOM 1489 OD1 ASN A 529 7.572 12.859 6.868 1.00 33.31 O ATOM 1490 ND2 ASN A 529 6.621 13.075 8.871 1.00 51.55 N ATOM 0 H ASN A 529 4.166 11.525 8.854 1.00 0.00 H new ATOM 0 HA ASN A 529 5.163 11.021 6.101 1.00 71.22 H new ATOM 0 HB2 ASN A 529 6.490 10.532 8.801 1.00 31.40 H new ATOM 0 HB3 ASN A 529 7.234 10.329 7.227 1.00 31.40 H new ATOM 0 HD21 ASN A 529 6.893 14.056 8.937 1.00 51.55 H new ATOM 0 HD22 ASN A 529 6.099 12.638 9.631 1.00 51.55 H new ATOM 1497 N ASN A 530 3.425 9.047 7.587 1.00 54.53 N ATOM 1498 CA ASN A 530 2.902 7.719 7.927 1.00 24.51 C ATOM 1499 C ASN A 530 2.142 7.068 6.753 1.00 41.51 C ATOM 1500 O ASN A 530 2.019 5.846 6.675 1.00 3.41 O ATOM 1501 CB ASN A 530 1.963 7.882 9.128 1.00 35.11 C ATOM 1502 CG ASN A 530 1.658 6.584 9.835 1.00 32.34 C ATOM 1503 OD1 ASN A 530 2.498 5.694 9.914 1.00 0.43 O ATOM 1504 ND2 ASN A 530 0.460 6.471 10.365 1.00 25.02 N ATOM 0 H ASN A 530 2.727 9.789 7.633 1.00 54.53 H new ATOM 0 HA ASN A 530 3.738 7.060 8.161 1.00 24.51 H new ATOM 0 HB2 ASN A 530 2.412 8.576 9.838 1.00 35.11 H new ATOM 0 HB3 ASN A 530 1.029 8.331 8.790 1.00 35.11 H new ATOM 0 HD21 ASN A 530 0.201 5.620 10.864 1.00 25.02 H new ATOM 0 HD22 ASN A 530 -0.211 7.235 10.277 1.00 25.02 H new ATOM 1511 N ASN A 531 1.667 7.899 5.830 1.00 12.52 N ATOM 1512 CA ASN A 531 0.710 7.475 4.797 1.00 72.35 C ATOM 1513 C ASN A 531 1.365 6.769 3.588 1.00 15.22 C ATOM 1514 O ASN A 531 0.707 6.551 2.568 1.00 50.31 O ATOM 1515 CB ASN A 531 -0.060 8.707 4.308 1.00 34.42 C ATOM 1516 CG ASN A 531 -0.650 9.506 5.455 1.00 21.21 C ATOM 1517 OD1 ASN A 531 0.003 10.385 6.011 1.00 13.23 O ATOM 1518 ND2 ASN A 531 -1.882 9.216 5.811 1.00 31.13 N ATOM 0 H ASN A 531 1.930 8.883 5.772 1.00 12.52 H new ATOM 0 HA ASN A 531 0.049 6.741 5.258 1.00 72.35 H new ATOM 0 HB2 ASN A 531 0.608 9.345 3.729 1.00 34.42 H new ATOM 0 HB3 ASN A 531 -0.860 8.391 3.638 1.00 34.42 H new ATOM 0 HD21 ASN A 531 -2.327 9.728 6.573 1.00 31.13 H new ATOM 0 HD22 ASN A 531 -2.393 8.479 5.325 1.00 31.13 H new ATOM 1525 N VAL A 532 2.645 6.405 3.693 1.00 11.35 N ATOM 1526 CA VAL A 532 3.372 5.814 2.554 1.00 42.14 C ATOM 1527 C VAL A 532 4.141 4.536 2.944 1.00 4.42 C ATOM 1528 O VAL A 532 4.664 4.421 4.053 1.00 45.24 O ATOM 1529 CB VAL A 532 4.369 6.835 1.937 1.00 4.11 C ATOM 1530 CG1 VAL A 532 5.101 6.228 0.740 1.00 40.31 C ATOM 1531 CG2 VAL A 532 3.649 8.126 1.536 1.00 14.21 C ATOM 0 H VAL A 532 3.200 6.505 4.543 1.00 11.35 H new ATOM 0 HA VAL A 532 2.614 5.546 1.818 1.00 42.14 H new ATOM 0 HB VAL A 532 5.111 7.082 2.697 1.00 4.11 H new ATOM 0 HG11 VAL A 532 5.793 6.962 0.326 1.00 40.31 H new ATOM 0 HG12 VAL A 532 5.656 5.347 1.062 1.00 40.31 H new ATOM 0 HG13 VAL A 532 4.377 5.942 -0.022 1.00 40.31 H new ATOM 0 HG21 VAL A 532 4.367 8.825 1.107 1.00 14.21 H new ATOM 0 HG22 VAL A 532 2.879 7.899 0.799 1.00 14.21 H new ATOM 0 HG23 VAL A 532 3.188 8.574 2.416 1.00 14.21 H new ATOM 1541 N ALA A 533 4.188 3.576 2.018 1.00 44.31 N ATOM 1542 CA ALA A 533 4.989 2.352 2.182 1.00 42.41 C ATOM 1543 C ALA A 533 5.875 2.107 0.953 1.00 22.53 C ATOM 1544 O ALA A 533 5.461 2.364 -0.179 1.00 31.15 O ATOM 1545 CB ALA A 533 4.082 1.148 2.420 1.00 53.23 C ATOM 0 H ALA A 533 3.677 3.620 1.137 1.00 44.31 H new ATOM 0 HA ALA A 533 5.634 2.486 3.051 1.00 42.41 H new ATOM 0 HB1 ALA A 533 4.691 0.252 2.539 1.00 53.23 H new ATOM 0 HB2 ALA A 533 3.493 1.309 3.323 1.00 53.23 H new ATOM 0 HB3 ALA A 533 3.414 1.022 1.568 1.00 53.23 H new ATOM 1551 N THR A 534 7.092 1.611 1.180 1.00 2.35 N ATOM 1552 CA THR A 534 8.041 1.339 0.085 1.00 1.24 C ATOM 1553 C THR A 534 8.603 -0.090 0.156 1.00 43.31 C ATOM 1554 O THR A 534 9.188 -0.491 1.161 1.00 41.23 O ATOM 1555 CB THR A 534 9.224 2.344 0.091 1.00 23.02 C ATOM 1556 OG1 THR A 534 8.738 3.686 -0.089 1.00 0.11 O ATOM 1557 CG2 THR A 534 10.233 2.023 -1.012 1.00 12.14 C ATOM 0 H THR A 534 7.449 1.388 2.109 1.00 2.35 H new ATOM 0 HA THR A 534 7.476 1.453 -0.840 1.00 1.24 H new ATOM 0 HB THR A 534 9.723 2.258 1.056 1.00 23.02 H new ATOM 0 HG1 THR A 534 9.493 4.311 -0.082 1.00 0.11 H new ATOM 0 HG21 THR A 534 11.049 2.745 -0.980 1.00 12.14 H new ATOM 0 HG22 THR A 534 10.631 1.020 -0.860 1.00 12.14 H new ATOM 0 HG23 THR A 534 9.740 2.075 -1.983 1.00 12.14 H new ATOM 1565 N PHE A 535 8.428 -0.853 -0.923 1.00 65.50 N ATOM 1566 CA PHE A 535 8.942 -2.228 -1.002 1.00 35.24 C ATOM 1567 C PHE A 535 9.450 -2.537 -2.422 1.00 14.54 C ATOM 1568 O PHE A 535 8.687 -2.511 -3.384 1.00 11.00 O ATOM 1569 CB PHE A 535 7.836 -3.216 -0.600 1.00 74.21 C ATOM 1570 CG PHE A 535 8.293 -4.651 -0.496 1.00 60.33 C ATOM 1571 CD1 PHE A 535 8.961 -5.100 0.635 1.00 12.03 C ATOM 1572 CD2 PHE A 535 8.051 -5.552 -1.525 1.00 3.43 C ATOM 1573 CE1 PHE A 535 9.378 -6.413 0.738 1.00 30.50 C ATOM 1574 CE2 PHE A 535 8.465 -6.865 -1.426 1.00 14.41 C ATOM 1575 CZ PHE A 535 9.130 -7.296 -0.293 1.00 64.42 C ATOM 0 H PHE A 535 7.933 -0.544 -1.759 1.00 65.50 H new ATOM 0 HA PHE A 535 9.781 -2.332 -0.314 1.00 35.24 H new ATOM 0 HB2 PHE A 535 7.422 -2.908 0.360 1.00 74.21 H new ATOM 0 HB3 PHE A 535 7.029 -3.156 -1.330 1.00 74.21 H new ATOM 0 HD1 PHE A 535 9.157 -4.414 1.445 1.00 12.03 H new ATOM 0 HD2 PHE A 535 7.533 -5.221 -2.413 1.00 3.43 H new ATOM 0 HE1 PHE A 535 9.897 -6.748 1.624 1.00 30.50 H new ATOM 0 HE2 PHE A 535 8.270 -7.555 -2.233 1.00 14.41 H new ATOM 0 HZ PHE A 535 9.455 -8.323 -0.215 1.00 64.42 H new ATOM 1585 N ASP A 536 10.742 -2.826 -2.552 1.00 72.10 N ATOM 1586 CA ASP A 536 11.352 -3.085 -3.865 1.00 24.33 C ATOM 1587 C ASP A 536 11.462 -4.588 -4.179 1.00 14.44 C ATOM 1588 O ASP A 536 11.830 -5.398 -3.327 1.00 10.01 O ATOM 1589 CB ASP A 536 12.725 -2.402 -3.962 1.00 23.22 C ATOM 1590 CG ASP A 536 13.512 -2.463 -2.665 1.00 71.52 C ATOM 1591 OD1 ASP A 536 13.990 -3.553 -2.295 1.00 4.15 O ATOM 1592 OD2 ASP A 536 13.653 -1.415 -2.002 1.00 53.42 O ATOM 0 H ASP A 536 11.392 -2.888 -1.768 1.00 72.10 H new ATOM 0 HA ASP A 536 10.690 -2.657 -4.618 1.00 24.33 H new ATOM 0 HB2 ASP A 536 13.305 -2.875 -4.755 1.00 23.22 H new ATOM 0 HB3 ASP A 536 12.586 -1.359 -4.248 1.00 23.22 H new ATOM 1597 N VAL A 537 11.134 -4.944 -5.423 1.00 25.54 N ATOM 1598 CA VAL A 537 11.162 -6.338 -5.886 1.00 72.43 C ATOM 1599 C VAL A 537 12.108 -6.516 -7.092 1.00 63.31 C ATOM 1600 O VAL A 537 12.060 -5.747 -8.058 1.00 74.53 O ATOM 1601 CB VAL A 537 9.741 -6.815 -6.288 1.00 54.14 C ATOM 1602 CG1 VAL A 537 9.757 -8.274 -6.750 1.00 32.53 C ATOM 1603 CG2 VAL A 537 8.764 -6.616 -5.130 1.00 1.24 C ATOM 0 H VAL A 537 10.842 -4.278 -6.138 1.00 25.54 H new ATOM 0 HA VAL A 537 11.530 -6.940 -5.055 1.00 72.43 H new ATOM 0 HB VAL A 537 9.404 -6.209 -7.129 1.00 54.14 H new ATOM 0 HG11 VAL A 537 8.748 -8.580 -7.025 1.00 32.53 H new ATOM 0 HG12 VAL A 537 10.415 -8.375 -7.613 1.00 32.53 H new ATOM 0 HG13 VAL A 537 10.120 -8.908 -5.941 1.00 32.53 H new ATOM 0 HG21 VAL A 537 7.772 -6.955 -5.428 1.00 1.24 H new ATOM 0 HG22 VAL A 537 9.100 -7.191 -4.267 1.00 1.24 H new ATOM 0 HG23 VAL A 537 8.722 -5.559 -4.867 1.00 1.24 H new ATOM 1613 N SER A 538 12.964 -7.538 -7.033 1.00 33.41 N ATOM 1614 CA SER A 538 13.885 -7.850 -8.136 1.00 63.10 C ATOM 1615 C SER A 538 13.341 -8.993 -9.002 1.00 32.42 C ATOM 1616 O SER A 538 13.081 -10.094 -8.508 1.00 12.13 O ATOM 1617 CB SER A 538 15.273 -8.233 -7.603 1.00 33.03 C ATOM 1618 OG SER A 538 16.154 -8.570 -8.667 1.00 60.43 O ATOM 0 H SER A 538 13.041 -8.167 -6.233 1.00 33.41 H new ATOM 0 HA SER A 538 13.973 -6.952 -8.747 1.00 63.10 H new ATOM 0 HB2 SER A 538 15.688 -7.403 -7.032 1.00 33.03 H new ATOM 0 HB3 SER A 538 15.183 -9.077 -6.919 1.00 33.03 H new ATOM 0 HG SER A 538 17.032 -8.808 -8.302 1.00 60.43 H new ATOM 1624 N VAL A 539 13.166 -8.726 -10.294 1.00 10.34 N ATOM 1625 CA VAL A 539 12.667 -9.734 -11.237 1.00 1.11 C ATOM 1626 C VAL A 539 13.813 -10.282 -12.103 1.00 22.54 C ATOM 1627 O VAL A 539 14.610 -9.515 -12.646 1.00 23.35 O ATOM 1628 CB VAL A 539 11.570 -9.146 -12.161 1.00 62.04 C ATOM 1629 CG1 VAL A 539 10.944 -10.240 -13.027 1.00 61.02 C ATOM 1630 CG2 VAL A 539 10.506 -8.416 -11.341 1.00 71.43 C ATOM 0 H VAL A 539 13.362 -7.819 -10.717 1.00 10.34 H new ATOM 0 HA VAL A 539 12.236 -10.543 -10.647 1.00 1.11 H new ATOM 0 HB VAL A 539 12.037 -8.420 -12.827 1.00 62.04 H new ATOM 0 HG11 VAL A 539 10.177 -9.803 -13.667 1.00 61.02 H new ATOM 0 HG12 VAL A 539 11.715 -10.700 -13.646 1.00 61.02 H new ATOM 0 HG13 VAL A 539 10.493 -10.998 -12.386 1.00 61.02 H new ATOM 0 HG21 VAL A 539 9.746 -8.011 -12.009 1.00 71.43 H new ATOM 0 HG22 VAL A 539 10.042 -9.114 -10.644 1.00 71.43 H new ATOM 0 HG23 VAL A 539 10.971 -7.602 -10.784 1.00 71.43 H new ATOM 1640 N VAL A 540 13.895 -11.607 -12.230 1.00 24.13 N ATOM 1641 CA VAL A 540 14.973 -12.252 -13.000 1.00 23.20 C ATOM 1642 C VAL A 540 14.432 -13.279 -14.013 1.00 71.30 C ATOM 1643 O VAL A 540 13.282 -13.711 -13.928 1.00 31.03 O ATOM 1644 CB VAL A 540 15.983 -12.961 -12.060 1.00 35.52 C ATOM 1645 CG1 VAL A 540 16.741 -11.943 -11.206 1.00 30.21 C ATOM 1646 CG2 VAL A 540 15.269 -13.988 -11.180 1.00 1.55 C ATOM 0 H VAL A 540 13.231 -12.259 -11.812 1.00 24.13 H new ATOM 0 HA VAL A 540 15.475 -11.454 -13.548 1.00 23.20 H new ATOM 0 HB VAL A 540 16.711 -13.488 -12.677 1.00 35.52 H new ATOM 0 HG11 VAL A 540 17.443 -12.465 -10.555 1.00 30.21 H new ATOM 0 HG12 VAL A 540 17.288 -11.259 -11.855 1.00 30.21 H new ATOM 0 HG13 VAL A 540 16.033 -11.379 -10.598 1.00 30.21 H new ATOM 0 HG21 VAL A 540 15.994 -14.475 -10.528 1.00 1.55 H new ATOM 0 HG22 VAL A 540 14.515 -13.486 -10.574 1.00 1.55 H new ATOM 0 HG23 VAL A 540 14.789 -14.736 -11.811 1.00 1.55 H new ATOM 1656 N LEU A 541 15.280 -13.674 -14.968 1.00 63.53 N ATOM 1657 CA LEU A 541 14.908 -14.666 -15.996 1.00 60.21 C ATOM 1658 C LEU A 541 14.954 -16.110 -15.458 1.00 52.43 C ATOM 1659 O LEU A 541 14.637 -17.063 -16.181 1.00 65.52 O ATOM 1660 CB LEU A 541 15.847 -14.542 -17.208 1.00 2.34 C ATOM 1661 CG LEU A 541 15.783 -13.206 -17.968 1.00 11.35 C ATOM 1662 CD1 LEU A 541 16.865 -13.143 -19.043 1.00 32.42 C ATOM 1663 CD2 LEU A 541 14.404 -13.007 -18.590 1.00 41.13 C ATOM 0 H LEU A 541 16.234 -13.323 -15.055 1.00 63.53 H new ATOM 0 HA LEU A 541 13.881 -14.454 -16.292 1.00 60.21 H new ATOM 0 HB2 LEU A 541 16.871 -14.697 -16.868 1.00 2.34 H new ATOM 0 HB3 LEU A 541 15.618 -15.347 -17.906 1.00 2.34 H new ATOM 0 HG LEU A 541 15.960 -12.401 -17.254 1.00 11.35 H new ATOM 0 HD11 LEU A 541 16.801 -12.190 -19.568 1.00 32.42 H new ATOM 0 HD12 LEU A 541 17.846 -13.236 -18.578 1.00 32.42 H new ATOM 0 HD13 LEU A 541 16.721 -13.958 -19.752 1.00 32.42 H new ATOM 0 HD21 LEU A 541 14.379 -12.057 -19.123 1.00 41.13 H new ATOM 0 HD22 LEU A 541 14.199 -13.819 -19.287 1.00 41.13 H new ATOM 0 HD23 LEU A 541 13.648 -13.003 -17.805 1.00 41.13 H new ATOM 1675 N GLU A 542 15.347 -16.270 -14.197 1.00 71.30 N ATOM 1676 CA GLU A 542 15.522 -17.603 -13.595 1.00 75.33 C ATOM 1677 C GLU A 542 14.668 -17.791 -12.317 1.00 72.13 C ATOM 1678 O GLU A 542 15.118 -17.404 -11.212 1.00 37.31 O ATOM 1679 CB GLU A 542 17.018 -17.840 -13.309 1.00 61.04 C ATOM 1680 CG GLU A 542 17.704 -16.677 -12.593 1.00 60.50 C ATOM 1681 CD GLU A 542 19.205 -16.869 -12.461 1.00 43.41 C ATOM 1682 OE1 GLU A 542 19.928 -16.587 -13.438 1.00 64.50 O ATOM 1683 OE2 GLU A 542 19.669 -17.291 -11.380 1.00 22.23 O ATOM 0 H GLU A 542 15.552 -15.496 -13.565 1.00 71.30 H new ATOM 0 HA GLU A 542 15.167 -18.348 -14.307 1.00 75.33 H new ATOM 0 HB2 GLU A 542 17.124 -18.740 -12.703 1.00 61.04 H new ATOM 0 HB3 GLU A 542 17.533 -18.028 -14.251 1.00 61.04 H new ATOM 0 HG2 GLU A 542 17.507 -15.754 -13.138 1.00 60.50 H new ATOM 0 HG3 GLU A 542 17.269 -16.560 -11.601 1.00 60.50 H new TER 1690 GLU A 542