USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=24 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= -0.84 K(o=-2,f=-4.4!) USER MOD Set 1.2: A 529 ASN : amide:sc= 0 K(o=-2,f=-1.2) USER MOD Set 1.3: A 530 ASN : amide:sc= -1.15! C(o=-2!,f=-9.9!) USER MOD Set 2.1: A 514 ASN : amide:sc= -0.656 X(o=-0.66,f=-0.9!) USER MOD Set 2.2: A 534 THR OG1 : rot 180:sc=-0.00417 USER MOD Single : A 435 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 441 THR OG1 : rot 48:sc= 0.641 USER MOD Single : A 445 LYS NZ :NH3+ 169:sc= -0.0299 (180deg=-0.179) USER MOD Single : A 453 ASN : amide:sc= -2.72! X(o=-2.7!,f=-2.6) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -136:sc= 0.723 USER MOD Single : A 461 HIS : no HD1:sc= -0.241 K(o=-0.24,f=-1.9!) USER MOD Single : A 463 LYS NZ :NH3+ -149:sc= -1.42 (180deg=-2.29!) USER MOD Single : A 464 ASN : amide:sc= 0.403 K(o=0.4,f=-8.5!) USER MOD Single : A 472 SER OG : rot 180:sc= 0 USER MOD Single : A 473 THR OG1 : rot 97:sc= 0.494 USER MOD Single : A 474 LYS NZ :NH3+ -158:sc= 0.196 (180deg=-0.237) USER MOD Single : A 478 TYR OH : rot 33:sc= 0.773 USER MOD Single : A 480 ASN : amide:sc= 0.427 K(o=0.43,f=-4.8!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 55:sc= 0.876 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= -1.89! K(o=-1.9!,f=-0.0092) USER MOD Single : A 488 THR OG1 : rot 180:sc= -0.0506 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 168:sc= -0.0428 (180deg=-0.214) USER MOD Single : A 497 LYS NZ :NH3+ -110:sc= 1.32 (180deg=0.619) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 32:sc= 0.581 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0.0071 USER MOD Single : A 507 GLN : amide:sc= -0.0722 K(o=-0.072,f=-2.4!) USER MOD Single : A 510 MET CE :methyl 140:sc= -0.452 (180deg=-1.45!) USER MOD Single : A 511 TYR OH : rot 43:sc= -0.12 USER MOD Single : A 516 THR OG1 : rot -140:sc= -0.0516 USER MOD Single : A 521 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 522 THR OG1 : rot -47:sc= 0.342 USER MOD Single : A 531 ASN : amide:sc= -0.0836 K(o=-0.084,f=-3.7!) USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 435 -10.604 17.154 20.836 1.00 32.01 N ATOM 2 CA MET A 435 -10.900 16.660 19.462 1.00 22.15 C ATOM 3 C MET A 435 -9.856 15.631 19.008 1.00 75.54 C ATOM 4 O MET A 435 -8.653 15.854 19.148 1.00 63.24 O ATOM 5 CB MET A 435 -10.968 17.838 18.475 1.00 51.43 C ATOM 6 CG MET A 435 -9.716 18.708 18.449 1.00 2.41 C ATOM 7 SD MET A 435 -9.918 20.175 17.417 1.00 14.22 S ATOM 8 CE MET A 435 -8.335 20.985 17.651 1.00 74.41 C ATOM 0 HA MET A 435 -11.870 16.164 19.480 1.00 22.15 H new ATOM 0 HB2 MET A 435 -11.146 17.447 17.473 1.00 51.43 H new ATOM 0 HB3 MET A 435 -11.825 18.462 18.730 1.00 51.43 H new ATOM 0 HG2 MET A 435 -9.468 19.014 19.466 1.00 2.41 H new ATOM 0 HG3 MET A 435 -8.876 18.120 18.079 1.00 2.41 H new ATOM 0 HE1 MET A 435 -8.310 21.909 17.073 1.00 74.41 H new ATOM 0 HE2 MET A 435 -8.196 21.214 18.708 1.00 74.41 H new ATOM 0 HE3 MET A 435 -7.535 20.325 17.315 1.00 74.41 H new ATOM 20 N GLU A 436 -10.321 14.506 18.465 1.00 2.12 N ATOM 21 CA GLU A 436 -9.426 13.402 18.086 1.00 42.14 C ATOM 22 C GLU A 436 -8.939 13.531 16.635 1.00 31.34 C ATOM 23 O GLU A 436 -9.670 13.999 15.761 1.00 12.52 O ATOM 24 CB GLU A 436 -10.128 12.042 18.271 1.00 5.34 C ATOM 25 CG GLU A 436 -10.542 11.724 19.709 1.00 33.04 C ATOM 26 CD GLU A 436 -11.677 12.601 20.220 1.00 32.41 C ATOM 27 OE1 GLU A 436 -12.820 12.431 19.754 1.00 71.54 O ATOM 28 OE2 GLU A 436 -11.439 13.451 21.101 1.00 32.32 O ATOM 0 H GLU A 436 -11.308 14.331 18.276 1.00 2.12 H new ATOM 0 HA GLU A 436 -8.559 13.457 18.744 1.00 42.14 H new ATOM 0 HB2 GLU A 436 -11.015 12.018 17.639 1.00 5.34 H new ATOM 0 HB3 GLU A 436 -9.463 11.254 17.917 1.00 5.34 H new ATOM 0 HG2 GLU A 436 -10.845 10.679 19.769 1.00 33.04 H new ATOM 0 HG3 GLU A 436 -9.678 11.843 20.363 1.00 33.04 H new ATOM 35 N PHE A 437 -7.699 13.110 16.391 1.00 23.11 N ATOM 36 CA PHE A 437 -7.135 13.083 15.037 1.00 34.41 C ATOM 37 C PHE A 437 -6.612 11.675 14.690 1.00 61.10 C ATOM 38 O PHE A 437 -5.944 11.034 15.503 1.00 11.33 O ATOM 39 CB PHE A 437 -6.010 14.120 14.898 1.00 14.04 C ATOM 40 CG PHE A 437 -6.487 15.548 15.005 1.00 31.23 C ATOM 41 CD1 PHE A 437 -7.042 16.190 13.905 1.00 24.44 C ATOM 42 CD2 PHE A 437 -6.381 16.249 16.198 1.00 75.41 C ATOM 43 CE1 PHE A 437 -7.482 17.496 13.995 1.00 22.22 C ATOM 44 CE2 PHE A 437 -6.818 17.557 16.291 1.00 12.55 C ATOM 45 CZ PHE A 437 -7.370 18.180 15.189 1.00 63.33 C ATOM 0 H PHE A 437 -7.061 12.781 17.115 1.00 23.11 H new ATOM 0 HA PHE A 437 -7.929 13.337 14.335 1.00 34.41 H new ATOM 0 HB2 PHE A 437 -5.262 13.937 15.669 1.00 14.04 H new ATOM 0 HB3 PHE A 437 -5.517 13.982 13.936 1.00 14.04 H new ATOM 0 HD1 PHE A 437 -7.130 15.661 12.968 1.00 24.44 H new ATOM 0 HD2 PHE A 437 -5.952 15.767 17.064 1.00 75.41 H new ATOM 0 HE1 PHE A 437 -7.913 17.982 13.132 1.00 22.22 H new ATOM 0 HE2 PHE A 437 -6.728 18.092 17.225 1.00 12.55 H new ATOM 0 HZ PHE A 437 -7.714 19.201 15.261 1.00 63.33 H new ATOM 55 N PRO A 438 -6.930 11.175 13.480 1.00 33.55 N ATOM 56 CA PRO A 438 -6.547 9.820 13.041 1.00 55.41 C ATOM 57 C PRO A 438 -5.052 9.662 12.710 1.00 45.31 C ATOM 58 O PRO A 438 -4.277 10.617 12.774 1.00 53.32 O ATOM 59 CB PRO A 438 -7.416 9.594 11.798 1.00 52.43 C ATOM 60 CG PRO A 438 -7.683 10.959 11.261 1.00 14.41 C ATOM 61 CD PRO A 438 -7.704 11.891 12.444 1.00 55.22 C ATOM 0 HA PRO A 438 -6.705 9.090 13.835 1.00 55.41 H new ATOM 0 HB2 PRO A 438 -6.901 8.975 11.064 1.00 52.43 H new ATOM 0 HB3 PRO A 438 -8.344 9.082 12.053 1.00 52.43 H new ATOM 0 HG2 PRO A 438 -6.911 11.253 10.550 1.00 14.41 H new ATOM 0 HG3 PRO A 438 -8.634 10.987 10.729 1.00 14.41 H new ATOM 0 HD2 PRO A 438 -7.252 12.853 12.202 1.00 55.22 H new ATOM 0 HD3 PRO A 438 -8.723 12.092 12.775 1.00 55.22 H new ATOM 69 N ASP A 439 -4.659 8.427 12.398 1.00 72.02 N ATOM 70 CA ASP A 439 -3.271 8.105 12.052 1.00 53.11 C ATOM 71 C ASP A 439 -3.237 6.856 11.142 1.00 53.14 C ATOM 72 O ASP A 439 -3.155 5.724 11.627 1.00 53.44 O ATOM 73 CB ASP A 439 -2.463 7.874 13.340 1.00 61.44 C ATOM 74 CG ASP A 439 -0.959 7.925 13.128 1.00 20.24 C ATOM 75 OD1 ASP A 439 -0.372 6.905 12.716 1.00 32.02 O ATOM 76 OD2 ASP A 439 -0.352 8.981 13.419 1.00 44.23 O ATOM 0 H ASP A 439 -5.288 7.625 12.377 1.00 72.02 H new ATOM 0 HA ASP A 439 -2.822 8.935 11.507 1.00 53.11 H new ATOM 0 HB2 ASP A 439 -2.744 8.627 14.076 1.00 61.44 H new ATOM 0 HB3 ASP A 439 -2.731 6.904 13.758 1.00 61.44 H new ATOM 81 N LEU A 440 -3.367 7.067 9.832 1.00 64.22 N ATOM 82 CA LEU A 440 -3.441 5.959 8.865 1.00 34.34 C ATOM 83 C LEU A 440 -2.053 5.548 8.345 1.00 44.35 C ATOM 84 O LEU A 440 -1.423 6.271 7.576 1.00 32.23 O ATOM 85 CB LEU A 440 -4.339 6.351 7.679 1.00 30.54 C ATOM 86 CG LEU A 440 -5.798 6.685 8.034 1.00 62.04 C ATOM 87 CD1 LEU A 440 -6.553 7.187 6.803 1.00 3.10 C ATOM 88 CD2 LEU A 440 -6.499 5.474 8.650 1.00 32.23 C ATOM 0 H LEU A 440 -3.424 7.994 9.411 1.00 64.22 H new ATOM 0 HA LEU A 440 -3.868 5.103 9.388 1.00 34.34 H new ATOM 0 HB2 LEU A 440 -3.898 7.215 7.182 1.00 30.54 H new ATOM 0 HB3 LEU A 440 -4.337 5.533 6.959 1.00 30.54 H new ATOM 0 HG LEU A 440 -5.793 7.483 8.776 1.00 62.04 H new ATOM 0 HD11 LEU A 440 -7.583 7.417 7.077 1.00 3.10 H new ATOM 0 HD12 LEU A 440 -6.069 8.086 6.421 1.00 3.10 H new ATOM 0 HD13 LEU A 440 -6.546 6.416 6.033 1.00 3.10 H new ATOM 0 HD21 LEU A 440 -7.529 5.734 8.893 1.00 32.23 H new ATOM 0 HD22 LEU A 440 -6.491 4.648 7.938 1.00 32.23 H new ATOM 0 HD23 LEU A 440 -5.977 5.175 9.559 1.00 32.23 H new ATOM 100 N THR A 441 -1.586 4.369 8.751 1.00 11.12 N ATOM 101 CA THR A 441 -0.289 3.852 8.282 1.00 53.45 C ATOM 102 C THR A 441 -0.459 2.604 7.401 1.00 2.51 C ATOM 103 O THR A 441 -1.433 1.857 7.543 1.00 72.54 O ATOM 104 CB THR A 441 0.661 3.517 9.457 1.00 50.21 C ATOM 105 OG1 THR A 441 1.931 3.058 8.959 1.00 61.30 O ATOM 106 CG2 THR A 441 0.058 2.457 10.373 1.00 50.44 C ATOM 0 H THR A 441 -2.077 3.753 9.399 1.00 11.12 H new ATOM 0 HA THR A 441 0.156 4.650 7.688 1.00 53.45 H new ATOM 0 HB THR A 441 0.806 4.430 10.035 1.00 50.21 H new ATOM 0 HG1 THR A 441 2.252 3.672 8.265 1.00 61.30 H new ATOM 0 HG21 THR A 441 0.750 2.244 11.188 1.00 50.44 H new ATOM 0 HG22 THR A 441 -0.884 2.823 10.782 1.00 50.44 H new ATOM 0 HG23 THR A 441 -0.124 1.545 9.804 1.00 50.44 H new ATOM 114 N VAL A 442 0.497 2.380 6.495 1.00 12.30 N ATOM 115 CA VAL A 442 0.417 1.272 5.533 1.00 2.32 C ATOM 116 C VAL A 442 1.696 0.410 5.531 1.00 64.45 C ATOM 117 O VAL A 442 2.798 0.903 5.778 1.00 12.50 O ATOM 118 CB VAL A 442 0.164 1.802 4.095 1.00 13.55 C ATOM 119 CG1 VAL A 442 -1.130 2.614 4.027 1.00 42.32 C ATOM 120 CG2 VAL A 442 1.345 2.640 3.608 1.00 1.22 C ATOM 0 H VAL A 442 1.337 2.951 6.406 1.00 12.30 H new ATOM 0 HA VAL A 442 -0.420 0.649 5.849 1.00 2.32 H new ATOM 0 HB VAL A 442 0.059 0.939 3.437 1.00 13.55 H new ATOM 0 HG11 VAL A 442 -1.282 2.972 3.009 1.00 42.32 H new ATOM 0 HG12 VAL A 442 -1.970 1.984 4.319 1.00 42.32 H new ATOM 0 HG13 VAL A 442 -1.062 3.465 4.705 1.00 42.32 H new ATOM 0 HG21 VAL A 442 1.144 3.000 2.599 1.00 1.22 H new ATOM 0 HG22 VAL A 442 1.487 3.490 4.275 1.00 1.22 H new ATOM 0 HG23 VAL A 442 2.247 2.028 3.602 1.00 1.22 H new ATOM 130 N GLU A 443 1.534 -0.882 5.245 1.00 44.00 N ATOM 131 CA GLU A 443 2.667 -1.811 5.113 1.00 62.14 C ATOM 132 C GLU A 443 2.588 -2.611 3.806 1.00 52.24 C ATOM 133 O GLU A 443 1.497 -2.947 3.340 1.00 25.51 O ATOM 134 CB GLU A 443 2.702 -2.814 6.276 1.00 34.31 C ATOM 135 CG GLU A 443 3.016 -2.220 7.640 1.00 44.15 C ATOM 136 CD GLU A 443 3.143 -3.301 8.701 1.00 24.52 C ATOM 137 OE1 GLU A 443 4.207 -3.959 8.758 1.00 23.42 O ATOM 138 OE2 GLU A 443 2.177 -3.524 9.463 1.00 2.24 O ATOM 0 H GLU A 443 0.623 -1.316 5.098 1.00 44.00 H new ATOM 0 HA GLU A 443 3.569 -1.198 5.119 1.00 62.14 H new ATOM 0 HB2 GLU A 443 1.736 -3.315 6.331 1.00 34.31 H new ATOM 0 HB3 GLU A 443 3.446 -3.579 6.052 1.00 34.31 H new ATOM 0 HG2 GLU A 443 3.944 -1.651 7.586 1.00 44.15 H new ATOM 0 HG3 GLU A 443 2.229 -1.521 7.924 1.00 44.15 H new ATOM 145 N ILE A 444 3.745 -2.928 3.231 1.00 72.51 N ATOM 146 CA ILE A 444 3.812 -3.815 2.063 1.00 33.05 C ATOM 147 C ILE A 444 4.440 -5.165 2.441 1.00 51.25 C ATOM 148 O ILE A 444 5.448 -5.221 3.148 1.00 55.14 O ATOM 149 CB ILE A 444 4.627 -3.184 0.905 1.00 61.01 C ATOM 150 CG1 ILE A 444 4.013 -1.838 0.488 1.00 0.31 C ATOM 151 CG2 ILE A 444 4.695 -4.137 -0.293 1.00 2.51 C ATOM 152 CD1 ILE A 444 4.762 -1.143 -0.627 1.00 24.43 C ATOM 0 H ILE A 444 4.651 -2.586 3.551 1.00 72.51 H new ATOM 0 HA ILE A 444 2.788 -3.968 1.723 1.00 33.05 H new ATOM 0 HB ILE A 444 5.643 -3.007 1.258 1.00 61.01 H new ATOM 0 HG12 ILE A 444 2.982 -2.002 0.173 1.00 0.31 H new ATOM 0 HG13 ILE A 444 3.981 -1.180 1.356 1.00 0.31 H new ATOM 0 HG21 ILE A 444 5.271 -3.674 -1.094 1.00 2.51 H new ATOM 0 HG22 ILE A 444 5.176 -5.067 0.009 1.00 2.51 H new ATOM 0 HG23 ILE A 444 3.686 -4.348 -0.648 1.00 2.51 H new ATOM 0 HD11 ILE A 444 4.268 -0.201 -0.865 1.00 24.43 H new ATOM 0 HD12 ILE A 444 5.786 -0.946 -0.310 1.00 24.43 H new ATOM 0 HD13 ILE A 444 4.772 -1.781 -1.511 1.00 24.43 H new ATOM 164 N LYS A 445 3.832 -6.248 1.976 1.00 65.43 N ATOM 165 CA LYS A 445 4.333 -7.601 2.237 1.00 15.52 C ATOM 166 C LYS A 445 4.307 -8.442 0.952 1.00 62.41 C ATOM 167 O LYS A 445 3.417 -8.277 0.122 1.00 11.32 O ATOM 168 CB LYS A 445 3.478 -8.271 3.326 1.00 21.25 C ATOM 169 CG LYS A 445 3.917 -9.690 3.677 1.00 33.42 C ATOM 170 CD LYS A 445 3.022 -10.323 4.740 1.00 1.33 C ATOM 171 CE LYS A 445 3.447 -11.757 5.048 1.00 54.21 C ATOM 172 NZ LYS A 445 4.839 -11.831 5.561 1.00 52.24 N ATOM 0 H LYS A 445 2.983 -6.220 1.411 1.00 65.43 H new ATOM 0 HA LYS A 445 5.364 -7.533 2.583 1.00 15.52 H new ATOM 0 HB2 LYS A 445 3.511 -7.658 4.227 1.00 21.25 H new ATOM 0 HB3 LYS A 445 2.440 -8.295 2.995 1.00 21.25 H new ATOM 0 HG2 LYS A 445 3.902 -10.306 2.778 1.00 33.42 H new ATOM 0 HG3 LYS A 445 4.947 -9.672 4.035 1.00 33.42 H new ATOM 0 HD2 LYS A 445 3.061 -9.727 5.652 1.00 1.33 H new ATOM 0 HD3 LYS A 445 1.987 -10.315 4.398 1.00 1.33 H new ATOM 0 HE2 LYS A 445 2.767 -12.186 5.784 1.00 54.21 H new ATOM 0 HE3 LYS A 445 3.362 -12.362 4.145 1.00 54.21 H new ATOM 0 HZ1 LYS A 445 5.023 -12.786 5.930 1.00 52.24 H new ATOM 0 HZ2 LYS A 445 5.505 -11.624 4.789 1.00 52.24 H new ATOM 0 HZ3 LYS A 445 4.965 -11.135 6.323 1.00 52.24 H new ATOM 186 N GLY A 446 5.283 -9.330 0.776 1.00 63.13 N ATOM 187 CA GLY A 446 5.273 -10.214 -0.385 1.00 31.43 C ATOM 188 C GLY A 446 6.653 -10.719 -0.804 1.00 51.14 C ATOM 189 O GLY A 446 7.622 -10.610 -0.050 1.00 63.14 O ATOM 0 H GLY A 446 6.074 -9.455 1.408 1.00 63.13 H new ATOM 0 HA2 GLY A 446 4.636 -11.071 -0.168 1.00 31.43 H new ATOM 0 HA3 GLY A 446 4.822 -9.686 -1.225 1.00 31.43 H new ATOM 193 N PRO A 447 6.752 -11.313 -2.010 1.00 53.43 N ATOM 194 CA PRO A 447 8.023 -11.830 -2.558 1.00 23.14 C ATOM 195 C PRO A 447 9.068 -10.730 -2.852 1.00 1.43 C ATOM 196 O PRO A 447 8.732 -9.650 -3.345 1.00 4.42 O ATOM 197 CB PRO A 447 7.604 -12.523 -3.871 1.00 2.11 C ATOM 198 CG PRO A 447 6.115 -12.652 -3.817 1.00 53.33 C ATOM 199 CD PRO A 447 5.621 -11.552 -2.921 1.00 43.34 C ATOM 0 HA PRO A 447 8.512 -12.487 -1.839 1.00 23.14 H new ATOM 0 HB2 PRO A 447 7.913 -11.937 -4.736 1.00 2.11 H new ATOM 0 HB3 PRO A 447 8.077 -13.501 -3.963 1.00 2.11 H new ATOM 0 HG2 PRO A 447 5.682 -12.564 -4.813 1.00 53.33 H new ATOM 0 HG3 PRO A 447 5.825 -13.628 -3.428 1.00 53.33 H new ATOM 0 HD2 PRO A 447 5.367 -10.657 -3.488 1.00 43.34 H new ATOM 0 HD3 PRO A 447 4.724 -11.850 -2.377 1.00 43.34 H new ATOM 207 N ASP A 448 10.337 -11.029 -2.565 1.00 40.22 N ATOM 208 CA ASP A 448 11.453 -10.106 -2.826 1.00 12.13 C ATOM 209 C ASP A 448 12.012 -10.294 -4.252 1.00 73.33 C ATOM 210 O ASP A 448 12.146 -9.335 -5.010 1.00 24.22 O ATOM 211 CB ASP A 448 12.552 -10.338 -1.778 1.00 74.24 C ATOM 212 CG ASP A 448 13.772 -9.451 -1.970 1.00 61.33 C ATOM 213 OD1 ASP A 448 13.723 -8.267 -1.576 1.00 22.55 O ATOM 214 OD2 ASP A 448 14.799 -9.937 -2.493 1.00 62.34 O ATOM 0 H ASP A 448 10.623 -11.914 -2.146 1.00 40.22 H new ATOM 0 HA ASP A 448 11.089 -9.081 -2.753 1.00 12.13 H new ATOM 0 HB2 ASP A 448 12.138 -10.163 -0.785 1.00 74.24 H new ATOM 0 HB3 ASP A 448 12.863 -11.382 -1.814 1.00 74.24 H new ATOM 219 N VAL A 449 12.345 -11.536 -4.606 1.00 52.24 N ATOM 220 CA VAL A 449 12.831 -11.862 -5.955 1.00 52.12 C ATOM 221 C VAL A 449 11.854 -12.811 -6.671 1.00 51.45 C ATOM 222 O VAL A 449 11.496 -13.861 -6.137 1.00 60.10 O ATOM 223 CB VAL A 449 14.233 -12.525 -5.910 1.00 60.00 C ATOM 224 CG1 VAL A 449 14.738 -12.838 -7.318 1.00 2.02 C ATOM 225 CG2 VAL A 449 15.232 -11.644 -5.163 1.00 3.11 C ATOM 0 H VAL A 449 12.288 -12.338 -3.978 1.00 52.24 H new ATOM 0 HA VAL A 449 12.902 -10.923 -6.504 1.00 52.12 H new ATOM 0 HB VAL A 449 14.138 -13.466 -5.367 1.00 60.00 H new ATOM 0 HG11 VAL A 449 15.722 -13.302 -7.257 1.00 2.02 H new ATOM 0 HG12 VAL A 449 14.045 -13.521 -7.810 1.00 2.02 H new ATOM 0 HG13 VAL A 449 14.807 -11.915 -7.893 1.00 2.02 H new ATOM 0 HG21 VAL A 449 16.206 -12.132 -5.146 1.00 3.11 H new ATOM 0 HG22 VAL A 449 15.317 -10.682 -5.668 1.00 3.11 H new ATOM 0 HG23 VAL A 449 14.887 -11.488 -4.141 1.00 3.11 H new ATOM 235 N VAL A 450 11.428 -12.442 -7.877 1.00 43.24 N ATOM 236 CA VAL A 450 10.477 -13.256 -8.649 1.00 61.30 C ATOM 237 C VAL A 450 10.959 -13.493 -10.087 1.00 61.11 C ATOM 238 O VAL A 450 11.846 -12.796 -10.582 1.00 24.44 O ATOM 239 CB VAL A 450 9.070 -12.604 -8.692 1.00 54.55 C ATOM 240 CG1 VAL A 450 8.463 -12.525 -7.294 1.00 43.54 C ATOM 241 CG2 VAL A 450 9.129 -11.219 -9.337 1.00 20.50 C ATOM 0 H VAL A 450 11.723 -11.585 -8.345 1.00 43.24 H new ATOM 0 HA VAL A 450 10.414 -14.215 -8.135 1.00 61.30 H new ATOM 0 HB VAL A 450 8.427 -13.235 -9.305 1.00 54.55 H new ATOM 0 HG11 VAL A 450 7.477 -12.064 -7.351 1.00 43.54 H new ATOM 0 HG12 VAL A 450 8.371 -13.529 -6.880 1.00 43.54 H new ATOM 0 HG13 VAL A 450 9.107 -11.925 -6.651 1.00 43.54 H new ATOM 0 HG21 VAL A 450 8.130 -10.783 -9.355 1.00 20.50 H new ATOM 0 HG22 VAL A 450 9.795 -10.577 -8.760 1.00 20.50 H new ATOM 0 HG23 VAL A 450 9.505 -11.308 -10.356 1.00 20.50 H new ATOM 251 N GLY A 451 10.364 -14.482 -10.751 1.00 15.45 N ATOM 252 CA GLY A 451 10.719 -14.792 -12.132 1.00 74.22 C ATOM 253 C GLY A 451 9.885 -14.016 -13.149 1.00 23.30 C ATOM 254 O GLY A 451 8.767 -13.588 -12.856 1.00 2.20 O ATOM 0 H GLY A 451 9.637 -15.079 -10.356 1.00 15.45 H new ATOM 0 HA2 GLY A 451 11.774 -14.569 -12.289 1.00 74.22 H new ATOM 0 HA3 GLY A 451 10.590 -15.861 -12.304 1.00 74.22 H new ATOM 258 N VAL A 452 10.428 -13.839 -14.349 1.00 41.24 N ATOM 259 CA VAL A 452 9.734 -13.115 -15.418 1.00 3.51 C ATOM 260 C VAL A 452 8.496 -13.887 -15.925 1.00 10.41 C ATOM 261 O VAL A 452 8.498 -15.119 -15.997 1.00 71.24 O ATOM 262 CB VAL A 452 10.697 -12.822 -16.599 1.00 50.52 C ATOM 263 CG1 VAL A 452 11.149 -14.118 -17.270 1.00 72.24 C ATOM 264 CG2 VAL A 452 10.055 -11.869 -17.609 1.00 0.53 C ATOM 0 H VAL A 452 11.350 -14.187 -14.610 1.00 41.24 H new ATOM 0 HA VAL A 452 9.391 -12.171 -14.996 1.00 3.51 H new ATOM 0 HB VAL A 452 11.582 -12.329 -16.197 1.00 50.52 H new ATOM 0 HG11 VAL A 452 11.823 -13.885 -18.094 1.00 72.24 H new ATOM 0 HG12 VAL A 452 11.668 -14.743 -16.543 1.00 72.24 H new ATOM 0 HG13 VAL A 452 10.279 -14.652 -17.652 1.00 72.24 H new ATOM 0 HG21 VAL A 452 10.752 -11.681 -18.426 1.00 0.53 H new ATOM 0 HG22 VAL A 452 9.144 -12.318 -18.005 1.00 0.53 H new ATOM 0 HG23 VAL A 452 9.811 -10.928 -17.117 1.00 0.53 H new ATOM 274 N ASN A 453 7.440 -13.143 -16.264 1.00 41.22 N ATOM 275 CA ASN A 453 6.166 -13.721 -16.731 1.00 13.15 C ATOM 276 C ASN A 453 5.504 -14.617 -15.663 1.00 20.54 C ATOM 277 O ASN A 453 4.664 -15.460 -15.984 1.00 0.31 O ATOM 278 CB ASN A 453 6.356 -14.512 -18.038 1.00 33.43 C ATOM 279 CG ASN A 453 6.783 -13.633 -19.202 1.00 54.25 C ATOM 280 OD1 ASN A 453 5.953 -13.030 -19.877 1.00 22.43 O ATOM 281 ND2 ASN A 453 8.070 -13.571 -19.464 1.00 1.25 N ATOM 0 H ASN A 453 7.439 -12.124 -16.224 1.00 41.22 H new ATOM 0 HA ASN A 453 5.498 -12.881 -16.922 1.00 13.15 H new ATOM 0 HB2 ASN A 453 7.105 -15.289 -17.882 1.00 33.43 H new ATOM 0 HB3 ASN A 453 5.423 -15.015 -18.292 1.00 33.43 H new ATOM 0 HD21 ASN A 453 8.405 -13.010 -20.247 1.00 1.25 H new ATOM 0 HD22 ASN A 453 8.734 -14.084 -18.884 1.00 1.25 H new ATOM 288 N LYS A 454 5.871 -14.422 -14.396 1.00 72.21 N ATOM 289 CA LYS A 454 5.267 -15.174 -13.285 1.00 12.14 C ATOM 290 C LYS A 454 4.247 -14.326 -12.513 1.00 33.11 C ATOM 291 O LYS A 454 4.360 -13.104 -12.447 1.00 42.43 O ATOM 292 CB LYS A 454 6.352 -15.683 -12.322 1.00 12.35 C ATOM 293 CG LYS A 454 7.270 -16.744 -12.927 1.00 61.32 C ATOM 294 CD LYS A 454 6.492 -17.973 -13.401 1.00 73.21 C ATOM 295 CE LYS A 454 5.692 -18.617 -12.273 1.00 21.42 C ATOM 296 NZ LYS A 454 4.978 -19.840 -12.725 1.00 44.14 N ATOM 0 H LYS A 454 6.583 -13.751 -14.109 1.00 72.21 H new ATOM 0 HA LYS A 454 4.742 -16.025 -13.720 1.00 12.14 H new ATOM 0 HB2 LYS A 454 6.957 -14.838 -11.993 1.00 12.35 H new ATOM 0 HB3 LYS A 454 5.872 -16.096 -11.435 1.00 12.35 H new ATOM 0 HG2 LYS A 454 7.816 -16.315 -13.767 1.00 61.32 H new ATOM 0 HG3 LYS A 454 8.011 -17.047 -12.187 1.00 61.32 H new ATOM 0 HD2 LYS A 454 5.816 -17.685 -14.206 1.00 73.21 H new ATOM 0 HD3 LYS A 454 7.187 -18.704 -13.815 1.00 73.21 H new ATOM 0 HE2 LYS A 454 6.363 -18.871 -11.452 1.00 21.42 H new ATOM 0 HE3 LYS A 454 4.970 -17.899 -11.884 1.00 21.42 H new ATOM 0 HZ1 LYS A 454 4.447 -20.246 -11.928 1.00 44.14 H new ATOM 0 HZ2 LYS A 454 4.319 -19.594 -13.491 1.00 44.14 H new ATOM 0 HZ3 LYS A 454 5.668 -20.536 -13.072 1.00 44.14 H new ATOM 310 N LEU A 455 3.247 -14.987 -11.934 1.00 60.21 N ATOM 311 CA LEU A 455 2.216 -14.305 -11.143 1.00 63.42 C ATOM 312 C LEU A 455 2.573 -14.297 -9.644 1.00 54.53 C ATOM 313 O LEU A 455 2.712 -15.352 -9.020 1.00 50.31 O ATOM 314 CB LEU A 455 0.856 -14.989 -11.354 1.00 72.52 C ATOM 315 CG LEU A 455 -0.335 -14.303 -10.667 1.00 73.12 C ATOM 316 CD1 LEU A 455 -0.528 -12.891 -11.208 1.00 62.13 C ATOM 317 CD2 LEU A 455 -1.610 -15.127 -10.837 1.00 13.10 C ATOM 0 H LEU A 455 3.126 -15.998 -11.996 1.00 60.21 H new ATOM 0 HA LEU A 455 2.160 -13.271 -11.482 1.00 63.42 H new ATOM 0 HB2 LEU A 455 0.656 -15.042 -12.424 1.00 72.52 H new ATOM 0 HB3 LEU A 455 0.923 -16.015 -10.991 1.00 72.52 H new ATOM 0 HG LEU A 455 -0.118 -14.233 -9.601 1.00 73.12 H new ATOM 0 HD11 LEU A 455 -1.376 -12.423 -10.709 1.00 62.13 H new ATOM 0 HD12 LEU A 455 0.372 -12.304 -11.022 1.00 62.13 H new ATOM 0 HD13 LEU A 455 -0.718 -12.935 -12.280 1.00 62.13 H new ATOM 0 HD21 LEU A 455 -2.439 -14.621 -10.342 1.00 13.10 H new ATOM 0 HD22 LEU A 455 -1.833 -15.237 -11.898 1.00 13.10 H new ATOM 0 HD23 LEU A 455 -1.469 -16.112 -10.392 1.00 13.10 H new ATOM 329 N ALA A 456 2.719 -13.103 -9.068 1.00 15.44 N ATOM 330 CA ALA A 456 3.038 -12.962 -7.641 1.00 1.35 C ATOM 331 C ALA A 456 1.967 -12.144 -6.900 1.00 40.53 C ATOM 332 O ALA A 456 1.547 -11.085 -7.370 1.00 50.44 O ATOM 333 CB ALA A 456 4.410 -12.315 -7.477 1.00 31.02 C ATOM 0 H ALA A 456 2.622 -12.218 -9.565 1.00 15.44 H new ATOM 0 HA ALA A 456 3.055 -13.958 -7.198 1.00 1.35 H new ATOM 0 HB1 ALA A 456 4.640 -12.214 -6.416 1.00 31.02 H new ATOM 0 HB2 ALA A 456 5.166 -12.939 -7.954 1.00 31.02 H new ATOM 0 HB3 ALA A 456 4.406 -11.330 -7.943 1.00 31.02 H new ATOM 339 N GLU A 457 1.522 -12.644 -5.745 1.00 43.32 N ATOM 340 CA GLU A 457 0.568 -11.915 -4.897 1.00 22.45 C ATOM 341 C GLU A 457 1.267 -11.229 -3.719 1.00 40.25 C ATOM 342 O GLU A 457 2.149 -11.806 -3.077 1.00 0.23 O ATOM 343 CB GLU A 457 -0.540 -12.847 -4.372 1.00 10.42 C ATOM 344 CG GLU A 457 -1.617 -13.161 -5.402 1.00 10.01 C ATOM 345 CD GLU A 457 -2.767 -13.972 -4.827 1.00 2.23 C ATOM 346 OE1 GLU A 457 -2.589 -15.186 -4.587 1.00 65.32 O ATOM 347 OE2 GLU A 457 -3.858 -13.398 -4.618 1.00 61.42 O ATOM 0 H GLU A 457 1.805 -13.551 -5.373 1.00 43.32 H new ATOM 0 HA GLU A 457 0.114 -11.147 -5.524 1.00 22.45 H new ATOM 0 HB2 GLU A 457 -0.088 -13.780 -4.036 1.00 10.42 H new ATOM 0 HB3 GLU A 457 -1.006 -12.387 -3.501 1.00 10.42 H new ATOM 0 HG2 GLU A 457 -2.005 -12.228 -5.810 1.00 10.01 H new ATOM 0 HG3 GLU A 457 -1.171 -13.710 -6.231 1.00 10.01 H new ATOM 354 N TYR A 458 0.856 -9.994 -3.445 1.00 51.35 N ATOM 355 CA TYR A 458 1.405 -9.203 -2.337 1.00 65.11 C ATOM 356 C TYR A 458 0.290 -8.776 -1.367 1.00 21.43 C ATOM 357 O TYR A 458 -0.893 -8.789 -1.718 1.00 34.30 O ATOM 358 CB TYR A 458 2.125 -7.954 -2.878 1.00 61.35 C ATOM 359 CG TYR A 458 3.434 -8.239 -3.602 1.00 74.05 C ATOM 360 CD1 TYR A 458 3.462 -8.990 -4.772 1.00 73.32 C ATOM 361 CD2 TYR A 458 4.641 -7.746 -3.114 1.00 33.25 C ATOM 362 CE1 TYR A 458 4.651 -9.243 -5.431 1.00 52.53 C ATOM 363 CE2 TYR A 458 5.832 -7.995 -3.769 1.00 2.41 C ATOM 364 CZ TYR A 458 5.832 -8.744 -4.925 1.00 34.40 C ATOM 365 OH TYR A 458 7.016 -8.994 -5.578 1.00 73.34 O ATOM 0 H TYR A 458 0.135 -9.510 -3.981 1.00 51.35 H new ATOM 0 HA TYR A 458 2.120 -9.825 -1.799 1.00 65.11 H new ATOM 0 HB2 TYR A 458 1.454 -7.431 -3.560 1.00 61.35 H new ATOM 0 HB3 TYR A 458 2.325 -7.278 -2.047 1.00 61.35 H new ATOM 0 HD1 TYR A 458 2.539 -9.382 -5.173 1.00 73.32 H new ATOM 0 HD2 TYR A 458 4.647 -7.159 -2.208 1.00 33.25 H new ATOM 0 HE1 TYR A 458 4.654 -9.829 -6.338 1.00 52.53 H new ATOM 0 HE2 TYR A 458 6.759 -7.604 -3.376 1.00 2.41 H new ATOM 0 HH TYR A 458 7.706 -9.234 -4.924 1.00 73.34 H new ATOM 375 N GLU A 459 0.679 -8.382 -0.157 1.00 61.31 N ATOM 376 CA GLU A 459 -0.274 -7.961 0.876 1.00 60.53 C ATOM 377 C GLU A 459 -0.019 -6.517 1.327 1.00 42.33 C ATOM 378 O GLU A 459 1.095 -6.161 1.717 1.00 1.40 O ATOM 379 CB GLU A 459 -0.166 -8.870 2.108 1.00 62.32 C ATOM 380 CG GLU A 459 -0.546 -10.324 1.878 1.00 42.12 C ATOM 381 CD GLU A 459 -0.432 -11.143 3.154 1.00 32.25 C ATOM 382 OE1 GLU A 459 -1.095 -10.779 4.154 1.00 72.21 O ATOM 383 OE2 GLU A 459 0.323 -12.138 3.176 1.00 3.13 O ATOM 0 H GLU A 459 1.655 -8.344 0.137 1.00 61.31 H new ATOM 0 HA GLU A 459 -1.269 -8.031 0.435 1.00 60.53 H new ATOM 0 HB2 GLU A 459 0.859 -8.834 2.477 1.00 62.32 H new ATOM 0 HB3 GLU A 459 -0.803 -8.465 2.895 1.00 62.32 H new ATOM 0 HG2 GLU A 459 -1.567 -10.378 1.501 1.00 42.12 H new ATOM 0 HG3 GLU A 459 0.100 -10.752 1.112 1.00 42.12 H new ATOM 390 N VAL A 460 -1.062 -5.699 1.290 1.00 2.21 N ATOM 391 CA VAL A 460 -1.015 -4.352 1.854 1.00 44.24 C ATOM 392 C VAL A 460 -1.722 -4.331 3.216 1.00 2.34 C ATOM 393 O VAL A 460 -2.930 -4.550 3.300 1.00 60.22 O ATOM 394 CB VAL A 460 -1.686 -3.316 0.916 1.00 0.14 C ATOM 395 CG1 VAL A 460 -1.489 -1.897 1.450 1.00 32.02 C ATOM 396 CG2 VAL A 460 -1.146 -3.447 -0.507 1.00 3.15 C ATOM 0 H VAL A 460 -1.959 -5.945 0.872 1.00 2.21 H new ATOM 0 HA VAL A 460 0.034 -4.080 1.971 1.00 44.24 H new ATOM 0 HB VAL A 460 -2.756 -3.520 0.889 1.00 0.14 H new ATOM 0 HG11 VAL A 460 -1.967 -1.185 0.777 1.00 32.02 H new ATOM 0 HG12 VAL A 460 -1.936 -1.816 2.441 1.00 32.02 H new ATOM 0 HG13 VAL A 460 -0.423 -1.677 1.513 1.00 32.02 H new ATOM 0 HG21 VAL A 460 -1.630 -2.711 -1.149 1.00 3.15 H new ATOM 0 HG22 VAL A 460 -0.070 -3.275 -0.505 1.00 3.15 H new ATOM 0 HG23 VAL A 460 -1.353 -4.449 -0.884 1.00 3.15 H new ATOM 406 N HIS A 461 -0.966 -4.090 4.280 1.00 23.43 N ATOM 407 CA HIS A 461 -1.527 -4.061 5.638 1.00 23.33 C ATOM 408 C HIS A 461 -1.731 -2.615 6.111 1.00 11.35 C ATOM 409 O HIS A 461 -0.767 -1.892 6.353 1.00 74.51 O ATOM 410 CB HIS A 461 -0.610 -4.821 6.611 1.00 41.31 C ATOM 411 CG HIS A 461 -0.516 -6.299 6.347 1.00 52.54 C ATOM 412 ND1 HIS A 461 -0.625 -7.248 7.340 1.00 54.01 N ATOM 413 CD2 HIS A 461 -0.316 -6.992 5.200 1.00 51.22 C ATOM 414 CE1 HIS A 461 -0.501 -8.452 6.821 1.00 71.44 C ATOM 415 NE2 HIS A 461 -0.314 -8.330 5.523 1.00 23.01 N ATOM 0 H HIS A 461 0.037 -3.911 4.236 1.00 23.43 H new ATOM 0 HA HIS A 461 -2.499 -4.553 5.619 1.00 23.33 H new ATOM 0 HB2 HIS A 461 0.390 -4.391 6.560 1.00 41.31 H new ATOM 0 HB3 HIS A 461 -0.972 -4.668 7.628 1.00 41.31 H new ATOM 0 HD2 HIS A 461 -0.183 -6.572 4.214 1.00 51.22 H new ATOM 0 HE1 HIS A 461 -0.545 -9.382 7.368 1.00 71.44 H new ATOM 0 HE2 HIS A 461 -0.188 -9.100 4.866 1.00 23.01 H new ATOM 424 N VAL A 462 -2.989 -2.195 6.236 1.00 22.33 N ATOM 425 CA VAL A 462 -3.318 -0.815 6.603 1.00 65.13 C ATOM 426 C VAL A 462 -4.116 -0.772 7.911 1.00 14.01 C ATOM 427 O VAL A 462 -5.005 -1.592 8.140 1.00 74.11 O ATOM 428 CB VAL A 462 -4.112 -0.100 5.476 1.00 61.34 C ATOM 429 CG1 VAL A 462 -3.357 -0.198 4.152 1.00 44.00 C ATOM 430 CG2 VAL A 462 -5.524 -0.670 5.333 1.00 13.34 C ATOM 0 H VAL A 462 -3.802 -2.793 6.088 1.00 22.33 H new ATOM 0 HA VAL A 462 -2.376 -0.286 6.746 1.00 65.13 H new ATOM 0 HB VAL A 462 -4.208 0.950 5.751 1.00 61.34 H new ATOM 0 HG11 VAL A 462 -3.925 0.307 3.371 1.00 44.00 H new ATOM 0 HG12 VAL A 462 -2.380 0.275 4.254 1.00 44.00 H new ATOM 0 HG13 VAL A 462 -3.226 -1.247 3.885 1.00 44.00 H new ATOM 0 HG21 VAL A 462 -6.049 -0.145 4.535 1.00 13.34 H new ATOM 0 HG22 VAL A 462 -5.465 -1.731 5.092 1.00 13.34 H new ATOM 0 HG23 VAL A 462 -6.065 -0.540 6.270 1.00 13.34 H new ATOM 440 N LYS A 463 -3.779 0.169 8.781 1.00 43.30 N ATOM 441 CA LYS A 463 -4.421 0.263 10.095 1.00 62.35 C ATOM 442 C LYS A 463 -4.507 1.716 10.584 1.00 64.41 C ATOM 443 O LYS A 463 -3.690 2.561 10.215 1.00 22.33 O ATOM 444 CB LYS A 463 -3.646 -0.586 11.114 1.00 75.32 C ATOM 445 CG LYS A 463 -2.136 -0.364 11.057 1.00 22.50 C ATOM 446 CD LYS A 463 -1.431 -0.759 12.358 1.00 23.11 C ATOM 447 CE LYS A 463 -1.130 -2.255 12.439 1.00 74.35 C ATOM 448 NZ LYS A 463 -2.349 -3.099 12.312 1.00 0.15 N ATOM 0 H LYS A 463 -3.067 0.879 8.607 1.00 43.30 H new ATOM 0 HA LYS A 463 -5.439 -0.115 9.997 1.00 62.35 H new ATOM 0 HB2 LYS A 463 -4.003 -0.354 12.117 1.00 75.32 H new ATOM 0 HB3 LYS A 463 -3.859 -1.640 10.936 1.00 75.32 H new ATOM 0 HG2 LYS A 463 -1.719 -0.942 10.232 1.00 22.50 H new ATOM 0 HG3 LYS A 463 -1.935 0.686 10.844 1.00 22.50 H new ATOM 0 HD2 LYS A 463 -0.499 -0.201 12.445 1.00 23.11 H new ATOM 0 HD3 LYS A 463 -2.054 -0.472 13.205 1.00 23.11 H new ATOM 0 HE2 LYS A 463 -0.426 -2.522 11.651 1.00 74.35 H new ATOM 0 HE3 LYS A 463 -0.642 -2.471 13.389 1.00 74.35 H new ATOM 0 HZ1 LYS A 463 -2.225 -3.973 12.862 1.00 0.15 H new ATOM 0 HZ2 LYS A 463 -3.172 -2.576 12.673 1.00 0.15 H new ATOM 0 HZ3 LYS A 463 -2.503 -3.338 11.312 1.00 0.15 H new ATOM 462 N ASN A 464 -5.504 1.993 11.421 1.00 22.13 N ATOM 463 CA ASN A 464 -5.673 3.321 12.017 1.00 33.43 C ATOM 464 C ASN A 464 -5.120 3.331 13.453 1.00 25.11 C ATOM 465 O ASN A 464 -5.499 2.502 14.277 1.00 21.55 O ATOM 466 CB ASN A 464 -7.166 3.683 12.018 1.00 75.30 C ATOM 467 CG ASN A 464 -7.455 5.116 12.442 1.00 14.12 C ATOM 468 OD1 ASN A 464 -6.722 5.722 13.220 1.00 44.02 O ATOM 469 ND2 ASN A 464 -8.547 5.662 11.943 1.00 61.34 N ATOM 0 H ASN A 464 -6.211 1.314 11.704 1.00 22.13 H new ATOM 0 HA ASN A 464 -5.122 4.057 11.432 1.00 33.43 H new ATOM 0 HB2 ASN A 464 -7.569 3.523 11.018 1.00 75.30 H new ATOM 0 HB3 ASN A 464 -7.694 3.003 12.687 1.00 75.30 H new ATOM 0 HD21 ASN A 464 -8.804 6.615 12.201 1.00 61.34 H new ATOM 0 HD22 ASN A 464 -9.134 5.132 11.299 1.00 61.34 H new ATOM 476 N LEU A 465 -4.242 4.282 13.756 1.00 24.21 N ATOM 477 CA LEU A 465 -3.618 4.362 15.084 1.00 22.02 C ATOM 478 C LEU A 465 -4.116 5.578 15.881 1.00 50.32 C ATOM 479 O LEU A 465 -3.823 5.713 17.070 1.00 21.21 O ATOM 480 CB LEU A 465 -2.089 4.415 14.942 1.00 52.22 C ATOM 481 CG LEU A 465 -1.458 3.220 14.206 1.00 11.20 C ATOM 482 CD1 LEU A 465 0.060 3.369 14.133 1.00 4.15 C ATOM 483 CD2 LEU A 465 -1.842 1.903 14.881 1.00 43.03 C ATOM 0 H LEU A 465 -3.943 5.009 13.106 1.00 24.21 H new ATOM 0 HA LEU A 465 -3.904 3.468 15.638 1.00 22.02 H new ATOM 0 HB2 LEU A 465 -1.821 5.330 14.413 1.00 52.22 H new ATOM 0 HB3 LEU A 465 -1.650 4.481 15.937 1.00 52.22 H new ATOM 0 HG LEU A 465 -1.847 3.205 13.188 1.00 11.20 H new ATOM 0 HD11 LEU A 465 0.485 2.513 13.609 1.00 4.15 H new ATOM 0 HD12 LEU A 465 0.310 4.284 13.596 1.00 4.15 H new ATOM 0 HD13 LEU A 465 0.470 3.416 15.142 1.00 4.15 H new ATOM 0 HD21 LEU A 465 -1.385 1.072 14.344 1.00 43.03 H new ATOM 0 HD22 LEU A 465 -1.489 1.906 15.912 1.00 43.03 H new ATOM 0 HD23 LEU A 465 -2.926 1.790 14.869 1.00 43.03 H new ATOM 495 N GLY A 466 -4.881 6.449 15.229 1.00 41.02 N ATOM 496 CA GLY A 466 -5.384 7.656 15.886 1.00 14.34 C ATOM 497 C GLY A 466 -6.554 7.391 16.830 1.00 15.32 C ATOM 498 O GLY A 466 -6.814 8.172 17.744 1.00 41.40 O ATOM 0 H GLY A 466 -5.165 6.345 14.255 1.00 41.02 H new ATOM 0 HA2 GLY A 466 -4.573 8.120 16.447 1.00 14.34 H new ATOM 0 HA3 GLY A 466 -5.696 8.372 15.125 1.00 14.34 H new ATOM 502 N GLY A 467 -7.265 6.287 16.604 1.00 34.33 N ATOM 503 CA GLY A 467 -8.392 5.925 17.467 1.00 2.44 C ATOM 504 C GLY A 467 -9.704 6.609 17.078 1.00 42.03 C ATOM 505 O GLY A 467 -10.609 6.752 17.897 1.00 72.12 O ATOM 0 H GLY A 467 -7.085 5.634 15.841 1.00 34.33 H new ATOM 0 HA2 GLY A 467 -8.531 4.844 17.435 1.00 2.44 H new ATOM 0 HA3 GLY A 467 -8.148 6.184 18.497 1.00 2.44 H new ATOM 509 N ILE A 468 -9.800 7.032 15.822 1.00 51.34 N ATOM 510 CA ILE A 468 -11.014 7.682 15.293 1.00 43.21 C ATOM 511 C ILE A 468 -11.327 7.206 13.860 1.00 30.05 C ATOM 512 O ILE A 468 -10.426 7.095 13.028 1.00 14.42 O ATOM 513 CB ILE A 468 -10.894 9.232 15.338 1.00 3.22 C ATOM 514 CG1 ILE A 468 -12.055 9.904 14.580 1.00 30.14 C ATOM 515 CG2 ILE A 468 -9.549 9.681 14.779 1.00 21.35 C ATOM 516 CD1 ILE A 468 -12.063 11.416 14.683 1.00 14.11 C ATOM 0 H ILE A 468 -9.049 6.939 15.138 1.00 51.34 H new ATOM 0 HA ILE A 468 -11.843 7.388 15.937 1.00 43.21 H new ATOM 0 HB ILE A 468 -10.955 9.544 16.381 1.00 3.22 H new ATOM 0 HG12 ILE A 468 -12.001 9.622 13.529 1.00 30.14 H new ATOM 0 HG13 ILE A 468 -12.999 9.518 14.965 1.00 30.14 H new ATOM 0 HG21 ILE A 468 -9.483 10.768 14.819 1.00 21.35 H new ATOM 0 HG22 ILE A 468 -8.745 9.247 15.373 1.00 21.35 H new ATOM 0 HG23 ILE A 468 -9.456 9.349 13.745 1.00 21.35 H new ATOM 0 HD11 ILE A 468 -12.910 11.814 14.124 1.00 14.11 H new ATOM 0 HD12 ILE A 468 -12.149 11.709 15.729 1.00 14.11 H new ATOM 0 HD13 ILE A 468 -11.136 11.814 14.270 1.00 14.11 H new ATOM 528 N GLY A 469 -12.604 6.934 13.585 1.00 52.54 N ATOM 529 CA GLY A 469 -13.014 6.386 12.288 1.00 55.43 C ATOM 530 C GLY A 469 -12.891 7.356 11.109 1.00 61.55 C ATOM 531 O GLY A 469 -13.276 8.523 11.204 1.00 74.12 O ATOM 0 H GLY A 469 -13.371 7.083 14.240 1.00 52.54 H new ATOM 0 HA2 GLY A 469 -12.412 5.502 12.077 1.00 55.43 H new ATOM 0 HA3 GLY A 469 -14.050 6.056 12.361 1.00 55.43 H new ATOM 535 N VAL A 470 -12.353 6.859 9.987 1.00 42.14 N ATOM 536 CA VAL A 470 -12.185 7.656 8.763 1.00 63.22 C ATOM 537 C VAL A 470 -12.714 6.907 7.518 1.00 33.15 C ATOM 538 O VAL A 470 -12.180 5.858 7.140 1.00 21.12 O ATOM 539 CB VAL A 470 -10.694 8.020 8.532 1.00 44.22 C ATOM 540 CG1 VAL A 470 -10.519 8.856 7.264 1.00 24.44 C ATOM 541 CG2 VAL A 470 -10.121 8.752 9.744 1.00 42.13 C ATOM 0 H VAL A 470 -12.023 5.898 9.902 1.00 42.14 H new ATOM 0 HA VAL A 470 -12.766 8.568 8.903 1.00 63.22 H new ATOM 0 HB VAL A 470 -10.141 7.090 8.399 1.00 44.22 H new ATOM 0 HG11 VAL A 470 -9.464 9.096 7.129 1.00 24.44 H new ATOM 0 HG12 VAL A 470 -10.876 8.291 6.403 1.00 24.44 H new ATOM 0 HG13 VAL A 470 -11.092 9.779 7.355 1.00 24.44 H new ATOM 0 HG21 VAL A 470 -9.075 8.997 9.560 1.00 42.13 H new ATOM 0 HG22 VAL A 470 -10.684 9.669 9.915 1.00 42.13 H new ATOM 0 HG23 VAL A 470 -10.194 8.112 10.624 1.00 42.13 H new ATOM 551 N PRO A 471 -13.773 7.434 6.864 1.00 1.32 N ATOM 552 CA PRO A 471 -14.327 6.850 5.625 1.00 11.25 C ATOM 553 C PRO A 471 -13.558 7.270 4.358 1.00 64.32 C ATOM 554 O PRO A 471 -13.750 6.707 3.280 1.00 24.21 O ATOM 555 CB PRO A 471 -15.746 7.418 5.599 1.00 34.14 C ATOM 556 CG PRO A 471 -15.629 8.755 6.256 1.00 5.44 C ATOM 557 CD PRO A 471 -14.535 8.629 7.293 1.00 41.21 C ATOM 0 HA PRO A 471 -14.270 5.761 5.626 1.00 11.25 H new ATOM 0 HB2 PRO A 471 -16.118 7.509 4.578 1.00 34.14 H new ATOM 0 HB3 PRO A 471 -16.441 6.772 6.135 1.00 34.14 H new ATOM 0 HG2 PRO A 471 -15.384 9.526 5.526 1.00 5.44 H new ATOM 0 HG3 PRO A 471 -16.572 9.043 6.720 1.00 5.44 H new ATOM 0 HD2 PRO A 471 -13.904 9.517 7.318 1.00 41.21 H new ATOM 0 HD3 PRO A 471 -14.946 8.502 8.294 1.00 41.21 H new ATOM 565 N SER A 472 -12.683 8.255 4.507 1.00 22.52 N ATOM 566 CA SER A 472 -11.937 8.850 3.384 1.00 34.32 C ATOM 567 C SER A 472 -10.712 8.013 2.979 1.00 10.12 C ATOM 568 O SER A 472 -9.903 8.446 2.155 1.00 42.12 O ATOM 569 CB SER A 472 -11.484 10.270 3.747 1.00 31.44 C ATOM 570 OG SER A 472 -12.588 11.097 4.090 1.00 13.30 O ATOM 0 H SER A 472 -12.463 8.673 5.411 1.00 22.52 H new ATOM 0 HA SER A 472 -12.616 8.876 2.532 1.00 34.32 H new ATOM 0 HB2 SER A 472 -10.786 10.228 4.583 1.00 31.44 H new ATOM 0 HB3 SER A 472 -10.947 10.708 2.906 1.00 31.44 H new ATOM 0 HG SER A 472 -12.266 11.994 4.318 1.00 13.30 H new ATOM 576 N THR A 473 -10.606 6.792 3.496 1.00 11.42 N ATOM 577 CA THR A 473 -9.332 6.061 3.490 1.00 33.12 C ATOM 578 C THR A 473 -9.129 5.272 2.190 1.00 13.02 C ATOM 579 O THR A 473 -9.671 4.184 2.000 1.00 15.20 O ATOM 580 CB THR A 473 -9.263 5.070 4.682 1.00 5.32 C ATOM 581 OG1 THR A 473 -9.476 5.764 5.920 1.00 1.41 O ATOM 582 CG2 THR A 473 -7.920 4.341 4.731 1.00 10.44 C ATOM 0 H THR A 473 -11.381 6.285 3.924 1.00 11.42 H new ATOM 0 HA THR A 473 -8.544 6.809 3.576 1.00 33.12 H new ATOM 0 HB THR A 473 -10.050 4.329 4.537 1.00 5.32 H new ATOM 0 HG1 THR A 473 -10.417 5.683 6.183 1.00 1.41 H new ATOM 0 HG21 THR A 473 -7.909 3.656 5.579 1.00 10.44 H new ATOM 0 HG22 THR A 473 -7.777 3.779 3.808 1.00 10.44 H new ATOM 0 HG23 THR A 473 -7.115 5.068 4.841 1.00 10.44 H new ATOM 590 N LYS A 474 -8.350 5.862 1.287 1.00 30.13 N ATOM 591 CA LYS A 474 -8.005 5.240 0.005 1.00 13.23 C ATOM 592 C LYS A 474 -6.534 4.793 -0.018 1.00 64.22 C ATOM 593 O LYS A 474 -5.626 5.604 0.181 1.00 12.11 O ATOM 594 CB LYS A 474 -8.264 6.228 -1.143 1.00 71.22 C ATOM 595 CG LYS A 474 -9.733 6.581 -1.339 1.00 25.53 C ATOM 596 CD LYS A 474 -9.911 7.670 -2.394 1.00 74.41 C ATOM 597 CE LYS A 474 -9.560 9.055 -1.861 1.00 3.41 C ATOM 598 NZ LYS A 474 -10.460 9.471 -0.753 1.00 1.52 N ATOM 0 H LYS A 474 -7.938 6.786 1.421 1.00 30.13 H new ATOM 0 HA LYS A 474 -8.633 4.358 -0.123 1.00 13.23 H new ATOM 0 HB2 LYS A 474 -7.703 7.143 -0.954 1.00 71.22 H new ATOM 0 HB3 LYS A 474 -7.877 5.803 -2.069 1.00 71.22 H new ATOM 0 HG2 LYS A 474 -10.286 5.690 -1.637 1.00 25.53 H new ATOM 0 HG3 LYS A 474 -10.157 6.917 -0.393 1.00 25.53 H new ATOM 0 HD2 LYS A 474 -9.282 7.445 -3.255 1.00 74.41 H new ATOM 0 HD3 LYS A 474 -10.943 7.669 -2.744 1.00 74.41 H new ATOM 0 HE2 LYS A 474 -8.528 9.057 -1.510 1.00 3.41 H new ATOM 0 HE3 LYS A 474 -9.623 9.782 -2.671 1.00 3.41 H new ATOM 0 HZ1 LYS A 474 -10.451 10.508 -0.669 1.00 1.52 H new ATOM 0 HZ2 LYS A 474 -11.428 9.148 -0.952 1.00 1.52 H new ATOM 0 HZ3 LYS A 474 -10.131 9.049 0.139 1.00 1.52 H new ATOM 612 N VAL A 475 -6.311 3.505 -0.271 1.00 55.21 N ATOM 613 CA VAL A 475 -4.960 2.936 -0.335 1.00 22.43 C ATOM 614 C VAL A 475 -4.545 2.684 -1.792 1.00 34.32 C ATOM 615 O VAL A 475 -5.230 1.975 -2.529 1.00 33.20 O ATOM 616 CB VAL A 475 -4.882 1.607 0.457 1.00 33.32 C ATOM 617 CG1 VAL A 475 -3.457 1.054 0.465 1.00 14.11 C ATOM 618 CG2 VAL A 475 -5.402 1.803 1.881 1.00 32.24 C ATOM 0 H VAL A 475 -7.055 2.827 -0.437 1.00 55.21 H new ATOM 0 HA VAL A 475 -4.277 3.658 0.113 1.00 22.43 H new ATOM 0 HB VAL A 475 -5.517 0.875 -0.042 1.00 33.32 H new ATOM 0 HG11 VAL A 475 -3.432 0.121 1.028 1.00 14.11 H new ATOM 0 HG12 VAL A 475 -3.133 0.869 -0.559 1.00 14.11 H new ATOM 0 HG13 VAL A 475 -2.789 1.777 0.932 1.00 14.11 H new ATOM 0 HG21 VAL A 475 -5.340 0.860 2.424 1.00 32.24 H new ATOM 0 HG22 VAL A 475 -4.797 2.554 2.389 1.00 32.24 H new ATOM 0 HG23 VAL A 475 -6.440 2.135 1.847 1.00 32.24 H new ATOM 628 N ARG A 476 -3.420 3.265 -2.201 1.00 51.22 N ATOM 629 CA ARG A 476 -2.953 3.176 -3.591 1.00 21.14 C ATOM 630 C ARG A 476 -1.631 2.400 -3.699 1.00 43.11 C ATOM 631 O ARG A 476 -0.784 2.475 -2.810 1.00 4.34 O ATOM 632 CB ARG A 476 -2.763 4.585 -4.164 1.00 13.45 C ATOM 633 CG ARG A 476 -4.026 5.442 -4.141 1.00 35.44 C ATOM 634 CD ARG A 476 -3.745 6.858 -4.627 1.00 3.33 C ATOM 635 NE ARG A 476 -4.936 7.708 -4.601 1.00 4.25 N ATOM 636 CZ ARG A 476 -4.915 8.992 -4.365 1.00 74.23 C ATOM 637 NH1 ARG A 476 -3.796 9.591 -4.101 1.00 21.42 N ATOM 638 NH2 ARG A 476 -6.015 9.673 -4.398 1.00 51.32 N ATOM 0 H ARG A 476 -2.809 3.806 -1.590 1.00 51.22 H new ATOM 0 HA ARG A 476 -3.710 2.637 -4.161 1.00 21.14 H new ATOM 0 HB2 ARG A 476 -1.982 5.093 -3.599 1.00 13.45 H new ATOM 0 HB3 ARG A 476 -2.411 4.503 -5.192 1.00 13.45 H new ATOM 0 HG2 ARG A 476 -4.790 4.984 -4.770 1.00 35.44 H new ATOM 0 HG3 ARG A 476 -4.426 5.476 -3.128 1.00 35.44 H new ATOM 0 HD2 ARG A 476 -2.970 7.305 -4.004 1.00 3.33 H new ATOM 0 HD3 ARG A 476 -3.353 6.818 -5.643 1.00 3.33 H new ATOM 0 HE ARG A 476 -5.840 7.270 -4.778 1.00 4.25 H new ATOM 0 HH11 ARG A 476 -2.926 9.059 -4.077 1.00 21.42 H new ATOM 0 HH12 ARG A 476 -3.786 10.594 -3.917 1.00 21.42 H new ATOM 0 HH21 ARG A 476 -6.897 9.207 -4.608 1.00 51.32 H new ATOM 0 HH22 ARG A 476 -6.000 10.676 -4.214 1.00 51.32 H new ATOM 652 N VAL A 477 -1.463 1.666 -4.800 1.00 11.52 N ATOM 653 CA VAL A 477 -0.232 0.910 -5.060 1.00 63.54 C ATOM 654 C VAL A 477 0.419 1.350 -6.384 1.00 11.31 C ATOM 655 O VAL A 477 -0.182 1.236 -7.457 1.00 32.41 O ATOM 656 CB VAL A 477 -0.509 -0.615 -5.113 1.00 0.03 C ATOM 657 CG1 VAL A 477 0.757 -1.394 -5.469 1.00 51.33 C ATOM 658 CG2 VAL A 477 -1.089 -1.105 -3.786 1.00 52.13 C ATOM 0 H VAL A 477 -2.168 1.577 -5.532 1.00 11.52 H new ATOM 0 HA VAL A 477 0.451 1.120 -4.237 1.00 63.54 H new ATOM 0 HB VAL A 477 -1.244 -0.795 -5.897 1.00 0.03 H new ATOM 0 HG11 VAL A 477 0.532 -2.460 -5.499 1.00 51.33 H new ATOM 0 HG12 VAL A 477 1.120 -1.072 -6.445 1.00 51.33 H new ATOM 0 HG13 VAL A 477 1.523 -1.206 -4.717 1.00 51.33 H new ATOM 0 HG21 VAL A 477 -1.276 -2.177 -3.844 1.00 52.13 H new ATOM 0 HG22 VAL A 477 -0.380 -0.904 -2.983 1.00 52.13 H new ATOM 0 HG23 VAL A 477 -2.025 -0.584 -3.583 1.00 52.13 H new ATOM 668 N TYR A 478 1.650 1.844 -6.301 1.00 55.11 N ATOM 669 CA TYR A 478 2.397 2.307 -7.475 1.00 11.53 C ATOM 670 C TYR A 478 3.596 1.395 -7.763 1.00 23.35 C ATOM 671 O TYR A 478 4.217 0.865 -6.843 1.00 31.24 O ATOM 672 CB TYR A 478 2.897 3.743 -7.257 1.00 73.55 C ATOM 673 CG TYR A 478 1.790 4.767 -7.074 1.00 10.00 C ATOM 674 CD1 TYR A 478 1.169 4.939 -5.841 1.00 52.21 C ATOM 675 CD2 TYR A 478 1.366 5.559 -8.137 1.00 2.43 C ATOM 676 CE1 TYR A 478 0.163 5.872 -5.673 1.00 31.13 C ATOM 677 CE2 TYR A 478 0.363 6.493 -7.976 1.00 21.21 C ATOM 678 CZ TYR A 478 -0.238 6.644 -6.745 1.00 22.15 C ATOM 679 OH TYR A 478 -1.245 7.570 -6.583 1.00 44.32 O ATOM 0 H TYR A 478 2.160 1.936 -5.423 1.00 55.11 H new ATOM 0 HA TYR A 478 1.720 2.279 -8.329 1.00 11.53 H new ATOM 0 HB2 TYR A 478 3.543 3.762 -6.379 1.00 73.55 H new ATOM 0 HB3 TYR A 478 3.510 4.036 -8.109 1.00 73.55 H new ATOM 0 HD1 TYR A 478 1.478 4.334 -5.002 1.00 52.21 H new ATOM 0 HD2 TYR A 478 1.830 5.441 -9.105 1.00 2.43 H new ATOM 0 HE1 TYR A 478 -0.307 5.996 -4.708 1.00 31.13 H new ATOM 0 HE2 TYR A 478 0.050 7.103 -8.811 1.00 21.21 H new ATOM 0 HH TYR A 478 -1.208 7.938 -5.675 1.00 44.32 H new ATOM 689 N ILE A 479 3.906 1.211 -9.042 1.00 34.03 N ATOM 690 CA ILE A 479 5.101 0.469 -9.456 1.00 1.14 C ATOM 691 C ILE A 479 5.997 1.362 -10.325 1.00 22.32 C ATOM 692 O ILE A 479 5.655 1.675 -11.469 1.00 23.45 O ATOM 693 CB ILE A 479 4.725 -0.818 -10.237 1.00 74.12 C ATOM 694 CG1 ILE A 479 3.827 -1.722 -9.372 1.00 14.15 C ATOM 695 CG2 ILE A 479 5.986 -1.567 -10.680 1.00 51.42 C ATOM 696 CD1 ILE A 479 3.364 -2.983 -10.070 1.00 70.32 C ATOM 0 H ILE A 479 3.346 1.566 -9.817 1.00 34.03 H new ATOM 0 HA ILE A 479 5.642 0.174 -8.557 1.00 1.14 H new ATOM 0 HB ILE A 479 4.169 -0.534 -11.131 1.00 74.12 H new ATOM 0 HG12 ILE A 479 4.371 -1.998 -8.469 1.00 14.15 H new ATOM 0 HG13 ILE A 479 2.953 -1.152 -9.056 1.00 14.15 H new ATOM 0 HG21 ILE A 479 5.702 -2.467 -11.226 1.00 51.42 H new ATOM 0 HG22 ILE A 479 6.583 -0.924 -11.326 1.00 51.42 H new ATOM 0 HG23 ILE A 479 6.571 -1.844 -9.803 1.00 51.42 H new ATOM 0 HD11 ILE A 479 2.737 -3.564 -9.394 1.00 70.32 H new ATOM 0 HD12 ILE A 479 2.791 -2.718 -10.958 1.00 70.32 H new ATOM 0 HD13 ILE A 479 4.230 -3.577 -10.361 1.00 70.32 H new ATOM 708 N ASN A 480 7.125 1.796 -9.761 1.00 15.25 N ATOM 709 CA ASN A 480 8.040 2.726 -10.440 1.00 20.22 C ATOM 710 C ASN A 480 7.318 4.021 -10.854 1.00 21.13 C ATOM 711 O ASN A 480 7.645 4.634 -11.874 1.00 65.13 O ATOM 712 CB ASN A 480 8.675 2.063 -11.673 1.00 75.45 C ATOM 713 CG ASN A 480 9.529 0.858 -11.324 1.00 45.33 C ATOM 714 OD1 ASN A 480 10.087 0.764 -10.237 1.00 12.24 O ATOM 715 ND2 ASN A 480 9.648 -0.067 -12.251 1.00 30.21 N ATOM 0 H ASN A 480 7.432 1.518 -8.829 1.00 15.25 H new ATOM 0 HA ASN A 480 8.828 2.984 -9.732 1.00 20.22 H new ATOM 0 HB2 ASN A 480 7.887 1.756 -12.360 1.00 75.45 H new ATOM 0 HB3 ASN A 480 9.288 2.796 -12.198 1.00 75.45 H new ATOM 0 HD21 ASN A 480 10.218 -0.894 -12.076 1.00 30.21 H new ATOM 0 HD22 ASN A 480 9.170 0.043 -13.145 1.00 30.21 H new ATOM 722 N GLY A 481 6.353 4.446 -10.041 1.00 3.54 N ATOM 723 CA GLY A 481 5.597 5.662 -10.327 1.00 23.34 C ATOM 724 C GLY A 481 4.225 5.400 -10.951 1.00 41.32 C ATOM 725 O GLY A 481 3.281 6.162 -10.731 1.00 21.43 O ATOM 0 H GLY A 481 6.077 3.968 -9.183 1.00 3.54 H new ATOM 0 HA2 GLY A 481 5.465 6.223 -9.402 1.00 23.34 H new ATOM 0 HA3 GLY A 481 6.179 6.291 -11.001 1.00 23.34 H new ATOM 729 N THR A 482 4.105 4.318 -11.720 1.00 62.13 N ATOM 730 CA THR A 482 2.851 4.004 -12.425 1.00 32.44 C ATOM 731 C THR A 482 1.841 3.301 -11.506 1.00 41.44 C ATOM 732 O THR A 482 2.103 2.209 -10.995 1.00 50.32 O ATOM 733 CB THR A 482 3.104 3.108 -13.665 1.00 1.41 C ATOM 734 OG1 THR A 482 4.008 3.758 -14.573 1.00 51.34 O ATOM 735 CG2 THR A 482 1.801 2.787 -14.396 1.00 74.02 C ATOM 0 H THR A 482 4.854 3.643 -11.874 1.00 62.13 H new ATOM 0 HA THR A 482 2.436 4.959 -12.747 1.00 32.44 H new ATOM 0 HB THR A 482 3.544 2.175 -13.312 1.00 1.41 H new ATOM 0 HG1 THR A 482 4.161 3.182 -15.351 1.00 51.34 H new ATOM 0 HG21 THR A 482 2.014 2.158 -15.260 1.00 74.02 H new ATOM 0 HG22 THR A 482 1.125 2.261 -13.721 1.00 74.02 H new ATOM 0 HG23 THR A 482 1.333 3.713 -14.729 1.00 74.02 H new ATOM 743 N LEU A 483 0.683 3.928 -11.312 1.00 74.33 N ATOM 744 CA LEU A 483 -0.370 3.375 -10.454 1.00 64.00 C ATOM 745 C LEU A 483 -0.888 2.033 -10.998 1.00 24.02 C ATOM 746 O LEU A 483 -1.478 1.970 -12.077 1.00 42.22 O ATOM 747 CB LEU A 483 -1.532 4.374 -10.328 1.00 23.00 C ATOM 748 CG LEU A 483 -2.701 3.924 -9.431 1.00 20.02 C ATOM 749 CD1 LEU A 483 -2.245 3.719 -7.987 1.00 73.42 C ATOM 750 CD2 LEU A 483 -3.846 4.933 -9.493 1.00 23.43 C ATOM 0 H LEU A 483 0.447 4.824 -11.738 1.00 74.33 H new ATOM 0 HA LEU A 483 0.061 3.198 -9.469 1.00 64.00 H new ATOM 0 HB2 LEU A 483 -1.140 5.314 -9.939 1.00 23.00 H new ATOM 0 HB3 LEU A 483 -1.921 4.580 -11.325 1.00 23.00 H new ATOM 0 HG LEU A 483 -3.061 2.967 -9.808 1.00 20.02 H new ATOM 0 HD11 LEU A 483 -3.093 3.402 -7.379 1.00 73.42 H new ATOM 0 HD12 LEU A 483 -1.469 2.954 -7.956 1.00 73.42 H new ATOM 0 HD13 LEU A 483 -1.847 4.655 -7.595 1.00 73.42 H new ATOM 0 HD21 LEU A 483 -4.662 4.597 -8.853 1.00 23.43 H new ATOM 0 HD22 LEU A 483 -3.493 5.906 -9.151 1.00 23.43 H new ATOM 0 HD23 LEU A 483 -4.202 5.017 -10.520 1.00 23.43 H new ATOM 762 N TYR A 484 -0.663 0.963 -10.242 1.00 52.24 N ATOM 763 CA TYR A 484 -1.114 -0.374 -10.638 1.00 5.12 C ATOM 764 C TYR A 484 -2.556 -0.654 -10.173 1.00 1.50 C ATOM 765 O TYR A 484 -3.368 -1.195 -10.928 1.00 61.03 O ATOM 766 CB TYR A 484 -0.154 -1.439 -10.072 1.00 14.43 C ATOM 767 CG TYR A 484 -0.746 -2.839 -10.025 1.00 4.32 C ATOM 768 CD1 TYR A 484 -0.875 -3.610 -11.177 1.00 4.21 C ATOM 769 CD2 TYR A 484 -1.199 -3.379 -8.825 1.00 72.50 C ATOM 770 CE1 TYR A 484 -1.436 -4.874 -11.131 1.00 31.41 C ATOM 771 CE2 TYR A 484 -1.765 -4.637 -8.776 1.00 35.24 C ATOM 772 CZ TYR A 484 -1.879 -5.381 -9.925 1.00 11.42 C ATOM 773 OH TYR A 484 -2.459 -6.628 -9.868 1.00 65.12 O ATOM 0 H TYR A 484 -0.170 0.992 -9.349 1.00 52.24 H new ATOM 0 HA TYR A 484 -1.108 -0.420 -11.727 1.00 5.12 H new ATOM 0 HB2 TYR A 484 0.751 -1.458 -10.679 1.00 14.43 H new ATOM 0 HB3 TYR A 484 0.144 -1.147 -9.065 1.00 14.43 H new ATOM 0 HD1 TYR A 484 -0.532 -3.215 -12.122 1.00 4.21 H new ATOM 0 HD2 TYR A 484 -1.106 -2.803 -7.916 1.00 72.50 H new ATOM 0 HE1 TYR A 484 -1.527 -5.461 -12.033 1.00 31.41 H new ATOM 0 HE2 TYR A 484 -2.118 -5.035 -7.836 1.00 35.24 H new ATOM 0 HH TYR A 484 -1.852 -7.289 -10.261 1.00 65.12 H new ATOM 783 N LYS A 485 -2.873 -0.282 -8.933 1.00 25.44 N ATOM 784 CA LYS A 485 -4.189 -0.584 -8.351 1.00 72.40 C ATOM 785 C LYS A 485 -4.434 0.230 -7.071 1.00 33.53 C ATOM 786 O LYS A 485 -3.493 0.747 -6.469 1.00 24.11 O ATOM 787 CB LYS A 485 -4.284 -2.093 -8.052 1.00 32.55 C ATOM 788 CG LYS A 485 -5.674 -2.579 -7.648 1.00 60.44 C ATOM 789 CD LYS A 485 -5.723 -4.100 -7.516 1.00 13.22 C ATOM 790 CE LYS A 485 -7.131 -4.596 -7.199 1.00 62.15 C ATOM 791 NZ LYS A 485 -7.193 -6.078 -7.110 1.00 70.02 N ATOM 0 H LYS A 485 -2.244 0.226 -8.312 1.00 25.44 H new ATOM 0 HA LYS A 485 -4.958 -0.306 -9.071 1.00 72.40 H new ATOM 0 HB2 LYS A 485 -3.964 -2.645 -8.936 1.00 32.55 H new ATOM 0 HB3 LYS A 485 -3.583 -2.336 -7.253 1.00 32.55 H new ATOM 0 HG2 LYS A 485 -5.958 -2.122 -6.700 1.00 60.44 H new ATOM 0 HG3 LYS A 485 -6.403 -2.254 -8.390 1.00 60.44 H new ATOM 0 HD2 LYS A 485 -5.377 -4.557 -8.443 1.00 13.22 H new ATOM 0 HD3 LYS A 485 -5.039 -4.419 -6.729 1.00 13.22 H new ATOM 0 HE2 LYS A 485 -7.464 -4.162 -6.256 1.00 62.15 H new ATOM 0 HE3 LYS A 485 -7.819 -4.250 -7.970 1.00 62.15 H new ATOM 0 HZ1 LYS A 485 -8.167 -6.372 -6.893 1.00 70.02 H new ATOM 0 HZ2 LYS A 485 -6.900 -6.493 -8.017 1.00 70.02 H new ATOM 0 HZ3 LYS A 485 -6.556 -6.407 -6.357 1.00 70.02 H new ATOM 805 N ASN A 486 -5.698 0.353 -6.663 1.00 14.24 N ATOM 806 CA ASN A 486 -6.041 1.058 -5.421 1.00 72.34 C ATOM 807 C ASN A 486 -7.385 0.573 -4.846 1.00 61.32 C ATOM 808 O ASN A 486 -8.200 -0.016 -5.558 1.00 3.52 O ATOM 809 CB ASN A 486 -6.066 2.584 -5.640 1.00 3.31 C ATOM 810 CG ASN A 486 -7.263 3.087 -6.437 1.00 75.32 C ATOM 811 OD1 ASN A 486 -7.759 4.179 -6.193 1.00 42.23 O ATOM 812 ND2 ASN A 486 -7.722 2.323 -7.406 1.00 43.25 N ATOM 0 H ASN A 486 -6.499 -0.023 -7.169 1.00 14.24 H new ATOM 0 HA ASN A 486 -5.264 0.827 -4.692 1.00 72.34 H new ATOM 0 HB2 ASN A 486 -6.058 3.078 -4.668 1.00 3.31 H new ATOM 0 HB3 ASN A 486 -5.152 2.880 -6.155 1.00 3.31 H new ATOM 0 HD21 ASN A 486 -8.509 2.637 -7.974 1.00 43.25 H new ATOM 0 HD22 ASN A 486 -7.291 1.417 -7.589 1.00 43.25 H new ATOM 819 N TRP A 487 -7.596 0.814 -3.551 1.00 54.45 N ATOM 820 CA TRP A 487 -8.834 0.417 -2.863 1.00 54.31 C ATOM 821 C TRP A 487 -9.383 1.566 -2.005 1.00 14.35 C ATOM 822 O TRP A 487 -8.622 2.390 -1.489 1.00 52.14 O ATOM 823 CB TRP A 487 -8.587 -0.795 -1.950 1.00 3.22 C ATOM 824 CG TRP A 487 -8.026 -1.999 -2.650 1.00 4.12 C ATOM 825 CD1 TRP A 487 -8.730 -3.019 -3.226 1.00 64.41 C ATOM 826 CD2 TRP A 487 -6.641 -2.318 -2.827 1.00 22.03 C ATOM 827 NE1 TRP A 487 -7.865 -3.950 -3.749 1.00 52.22 N ATOM 828 CE2 TRP A 487 -6.578 -3.543 -3.515 1.00 22.23 C ATOM 829 CE3 TRP A 487 -5.448 -1.683 -2.467 1.00 1.40 C ATOM 830 CZ2 TRP A 487 -5.369 -4.145 -3.853 1.00 12.31 C ATOM 831 CZ3 TRP A 487 -4.250 -2.282 -2.801 1.00 45.35 C ATOM 832 CH2 TRP A 487 -4.218 -3.503 -3.487 1.00 33.30 C ATOM 0 H TRP A 487 -6.921 1.286 -2.950 1.00 54.45 H new ATOM 0 HA TRP A 487 -9.560 0.158 -3.634 1.00 54.31 H new ATOM 0 HB2 TRP A 487 -7.902 -0.501 -1.155 1.00 3.22 H new ATOM 0 HB3 TRP A 487 -9.527 -1.073 -1.474 1.00 3.22 H new ATOM 0 HD1 TRP A 487 -9.807 -3.084 -3.264 1.00 64.41 H new ATOM 0 HE1 TRP A 487 -8.137 -4.806 -4.233 1.00 52.22 H new ATOM 0 HE3 TRP A 487 -5.464 -0.742 -1.938 1.00 1.40 H new ATOM 0 HZ2 TRP A 487 -5.341 -5.085 -4.385 1.00 12.31 H new ATOM 0 HZ3 TRP A 487 -3.322 -1.801 -2.529 1.00 45.35 H new ATOM 0 HH2 TRP A 487 -3.264 -3.947 -3.732 1.00 33.30 H new ATOM 843 N THR A 488 -10.703 1.618 -1.851 1.00 53.31 N ATOM 844 CA THR A 488 -11.343 2.592 -0.955 1.00 21.11 C ATOM 845 C THR A 488 -12.048 1.877 0.203 1.00 51.21 C ATOM 846 O THR A 488 -12.978 1.095 -0.008 1.00 25.12 O ATOM 847 CB THR A 488 -12.379 3.469 -1.704 1.00 62.24 C ATOM 848 OG1 THR A 488 -11.767 4.089 -2.846 1.00 31.30 O ATOM 849 CG2 THR A 488 -12.955 4.551 -0.791 1.00 72.44 C ATOM 0 H THR A 488 -11.355 0.999 -2.333 1.00 53.31 H new ATOM 0 HA THR A 488 -10.552 3.235 -0.570 1.00 21.11 H new ATOM 0 HB THR A 488 -13.192 2.819 -2.027 1.00 62.24 H new ATOM 0 HG1 THR A 488 -12.429 4.639 -3.314 1.00 31.30 H new ATOM 0 HG21 THR A 488 -13.678 5.149 -1.346 1.00 72.44 H new ATOM 0 HG22 THR A 488 -13.449 4.083 0.061 1.00 72.44 H new ATOM 0 HG23 THR A 488 -12.150 5.194 -0.436 1.00 72.44 H new ATOM 857 N VAL A 489 -11.614 2.156 1.427 1.00 51.32 N ATOM 858 CA VAL A 489 -12.169 1.508 2.621 1.00 71.21 C ATOM 859 C VAL A 489 -12.380 2.516 3.759 1.00 72.34 C ATOM 860 O VAL A 489 -11.989 3.680 3.661 1.00 62.42 O ATOM 861 CB VAL A 489 -11.248 0.364 3.136 1.00 22.22 C ATOM 862 CG1 VAL A 489 -11.086 -0.733 2.085 1.00 14.11 C ATOM 863 CG2 VAL A 489 -9.886 0.911 3.563 1.00 52.20 C ATOM 0 H VAL A 489 -10.875 2.830 1.624 1.00 51.32 H new ATOM 0 HA VAL A 489 -13.130 1.089 2.322 1.00 71.21 H new ATOM 0 HB VAL A 489 -11.727 -0.079 4.009 1.00 22.22 H new ATOM 0 HG11 VAL A 489 -10.437 -1.517 2.475 1.00 14.11 H new ATOM 0 HG12 VAL A 489 -12.062 -1.155 1.846 1.00 14.11 H new ATOM 0 HG13 VAL A 489 -10.643 -0.310 1.183 1.00 14.11 H new ATOM 0 HG21 VAL A 489 -9.261 0.092 3.919 1.00 52.20 H new ATOM 0 HG22 VAL A 489 -9.404 1.392 2.712 1.00 52.20 H new ATOM 0 HG23 VAL A 489 -10.021 1.639 4.363 1.00 52.20 H new ATOM 873 N SER A 490 -13.003 2.063 4.839 1.00 41.33 N ATOM 874 CA SER A 490 -13.166 2.887 6.042 1.00 31.45 C ATOM 875 C SER A 490 -12.505 2.205 7.241 1.00 15.25 C ATOM 876 O SER A 490 -12.708 1.013 7.475 1.00 55.31 O ATOM 877 CB SER A 490 -14.652 3.132 6.341 1.00 43.13 C ATOM 878 OG SER A 490 -15.322 1.927 6.691 1.00 50.12 O ATOM 0 H SER A 490 -13.406 1.129 4.912 1.00 41.33 H new ATOM 0 HA SER A 490 -12.685 3.848 5.862 1.00 31.45 H new ATOM 0 HB2 SER A 490 -14.746 3.851 7.155 1.00 43.13 H new ATOM 0 HB3 SER A 490 -15.131 3.575 5.468 1.00 43.13 H new ATOM 0 HG SER A 490 -16.265 2.119 6.877 1.00 50.12 H new ATOM 884 N LEU A 491 -11.719 2.957 8.002 1.00 34.11 N ATOM 885 CA LEU A 491 -11.047 2.406 9.181 1.00 70.20 C ATOM 886 C LEU A 491 -11.507 3.119 10.457 1.00 15.01 C ATOM 887 O LEU A 491 -11.314 4.325 10.610 1.00 64.54 O ATOM 888 CB LEU A 491 -9.519 2.526 9.034 1.00 14.22 C ATOM 889 CG LEU A 491 -8.895 1.741 7.864 1.00 44.55 C ATOM 890 CD1 LEU A 491 -7.387 1.971 7.794 1.00 51.13 C ATOM 891 CD2 LEU A 491 -9.203 0.249 7.984 1.00 72.34 C ATOM 0 H LEU A 491 -11.530 3.944 7.829 1.00 34.11 H new ATOM 0 HA LEU A 491 -11.314 1.352 9.259 1.00 70.20 H new ATOM 0 HB2 LEU A 491 -9.266 3.580 8.916 1.00 14.22 H new ATOM 0 HB3 LEU A 491 -9.056 2.189 9.961 1.00 14.22 H new ATOM 0 HG LEU A 491 -9.340 2.110 6.940 1.00 44.55 H new ATOM 0 HD11 LEU A 491 -6.971 1.406 6.960 1.00 51.13 H new ATOM 0 HD12 LEU A 491 -7.187 3.033 7.649 1.00 51.13 H new ATOM 0 HD13 LEU A 491 -6.925 1.639 8.724 1.00 51.13 H new ATOM 0 HD21 LEU A 491 -8.752 -0.284 7.147 1.00 72.34 H new ATOM 0 HD22 LEU A 491 -8.794 -0.133 8.920 1.00 72.34 H new ATOM 0 HD23 LEU A 491 -10.282 0.098 7.971 1.00 72.34 H new ATOM 903 N GLY A 492 -12.099 2.356 11.369 1.00 24.01 N ATOM 904 CA GLY A 492 -12.541 2.903 12.645 1.00 50.34 C ATOM 905 C GLY A 492 -11.410 3.041 13.661 1.00 43.55 C ATOM 906 O GLY A 492 -10.228 2.937 13.307 1.00 44.43 O ATOM 0 H GLY A 492 -12.283 1.360 11.249 1.00 24.01 H new ATOM 0 HA2 GLY A 492 -12.992 3.881 12.478 1.00 50.34 H new ATOM 0 HA3 GLY A 492 -13.318 2.260 13.060 1.00 50.34 H new ATOM 910 N PRO A 493 -11.736 3.280 14.943 1.00 65.14 N ATOM 911 CA PRO A 493 -10.730 3.383 16.010 1.00 71.23 C ATOM 912 C PRO A 493 -9.902 2.094 16.163 1.00 42.25 C ATOM 913 O PRO A 493 -10.396 1.078 16.661 1.00 4.32 O ATOM 914 CB PRO A 493 -11.565 3.657 17.274 1.00 73.20 C ATOM 915 CG PRO A 493 -12.940 3.193 16.930 1.00 3.32 C ATOM 916 CD PRO A 493 -13.103 3.467 15.460 1.00 53.30 C ATOM 0 HA PRO A 493 -9.995 4.161 15.802 1.00 71.23 H new ATOM 0 HB2 PRO A 493 -11.169 3.117 18.134 1.00 73.20 H new ATOM 0 HB3 PRO A 493 -11.558 4.716 17.531 1.00 73.20 H new ATOM 0 HG2 PRO A 493 -13.061 2.132 17.147 1.00 3.32 H new ATOM 0 HG3 PRO A 493 -13.691 3.725 17.514 1.00 3.32 H new ATOM 0 HD2 PRO A 493 -13.809 2.779 14.996 1.00 53.30 H new ATOM 0 HD3 PRO A 493 -13.472 4.476 15.274 1.00 53.30 H new ATOM 924 N LYS A 494 -8.647 2.143 15.699 1.00 75.32 N ATOM 925 CA LYS A 494 -7.719 1.004 15.793 1.00 23.15 C ATOM 926 C LYS A 494 -8.170 -0.168 14.894 1.00 11.14 C ATOM 927 O LYS A 494 -7.897 -1.338 15.179 1.00 43.32 O ATOM 928 CB LYS A 494 -7.576 0.570 17.262 1.00 12.24 C ATOM 929 CG LYS A 494 -7.076 1.689 18.177 1.00 2.22 C ATOM 930 CD LYS A 494 -5.621 2.051 17.892 1.00 44.21 C ATOM 931 CE LYS A 494 -5.135 3.189 18.783 1.00 30.31 C ATOM 932 NZ LYS A 494 -5.290 2.878 20.229 1.00 45.14 N ATOM 0 H LYS A 494 -8.246 2.967 15.250 1.00 75.32 H new ATOM 0 HA LYS A 494 -6.741 1.319 15.429 1.00 23.15 H new ATOM 0 HB2 LYS A 494 -8.541 0.217 17.625 1.00 12.24 H new ATOM 0 HB3 LYS A 494 -6.887 -0.272 17.319 1.00 12.24 H new ATOM 0 HG2 LYS A 494 -7.702 2.572 18.046 1.00 2.22 H new ATOM 0 HG3 LYS A 494 -7.176 1.379 19.217 1.00 2.22 H new ATOM 0 HD2 LYS A 494 -4.992 1.175 18.046 1.00 44.21 H new ATOM 0 HD3 LYS A 494 -5.516 2.338 16.846 1.00 44.21 H new ATOM 0 HE2 LYS A 494 -4.086 3.394 18.568 1.00 30.31 H new ATOM 0 HE3 LYS A 494 -5.692 4.096 18.547 1.00 30.31 H new ATOM 0 HZ1 LYS A 494 -4.768 3.579 20.793 1.00 45.14 H new ATOM 0 HZ2 LYS A 494 -6.298 2.909 20.485 1.00 45.14 H new ATOM 0 HZ3 LYS A 494 -4.913 1.928 20.422 1.00 45.14 H new ATOM 946 N GLU A 495 -8.842 0.177 13.795 1.00 22.30 N ATOM 947 CA GLU A 495 -9.298 -0.800 12.794 1.00 23.44 C ATOM 948 C GLU A 495 -8.173 -1.141 11.798 1.00 1.20 C ATOM 949 O GLU A 495 -7.283 -0.324 11.547 1.00 1.24 O ATOM 950 CB GLU A 495 -10.515 -0.224 12.048 1.00 54.53 C ATOM 951 CG GLU A 495 -11.030 -1.069 10.881 1.00 35.41 C ATOM 952 CD GLU A 495 -11.648 -2.388 11.314 1.00 54.24 C ATOM 953 OE1 GLU A 495 -12.829 -2.393 11.724 1.00 12.14 O ATOM 954 OE2 GLU A 495 -10.960 -3.425 11.235 1.00 62.03 O ATOM 0 H GLU A 495 -9.088 1.141 13.570 1.00 22.30 H new ATOM 0 HA GLU A 495 -9.580 -1.722 13.303 1.00 23.44 H new ATOM 0 HB2 GLU A 495 -11.327 -0.089 12.762 1.00 54.53 H new ATOM 0 HB3 GLU A 495 -10.254 0.765 11.671 1.00 54.53 H new ATOM 0 HG2 GLU A 495 -11.772 -0.494 10.326 1.00 35.41 H new ATOM 0 HG3 GLU A 495 -10.206 -1.270 10.197 1.00 35.41 H new ATOM 961 N GLU A 496 -8.224 -2.345 11.228 1.00 54.31 N ATOM 962 CA GLU A 496 -7.190 -2.817 10.294 1.00 61.02 C ATOM 963 C GLU A 496 -7.808 -3.487 9.052 1.00 72.12 C ATOM 964 O GLU A 496 -8.895 -4.058 9.119 1.00 73.10 O ATOM 965 CB GLU A 496 -6.268 -3.812 11.008 1.00 43.02 C ATOM 966 CG GLU A 496 -5.174 -4.396 10.119 1.00 33.21 C ATOM 967 CD GLU A 496 -4.450 -5.557 10.778 1.00 3.13 C ATOM 968 OE1 GLU A 496 -4.966 -6.693 10.719 1.00 15.23 O ATOM 969 OE2 GLU A 496 -3.368 -5.339 11.360 1.00 44.05 O ATOM 0 H GLU A 496 -8.973 -3.017 11.395 1.00 54.31 H new ATOM 0 HA GLU A 496 -6.619 -1.951 9.960 1.00 61.02 H new ATOM 0 HB2 GLU A 496 -5.803 -3.314 11.859 1.00 43.02 H new ATOM 0 HB3 GLU A 496 -6.871 -4.628 11.407 1.00 43.02 H new ATOM 0 HG2 GLU A 496 -5.614 -4.732 9.180 1.00 33.21 H new ATOM 0 HG3 GLU A 496 -4.454 -3.615 9.873 1.00 33.21 H new ATOM 976 N LYS A 497 -7.103 -3.408 7.922 1.00 51.21 N ATOM 977 CA LYS A 497 -7.521 -4.069 6.679 1.00 23.11 C ATOM 978 C LYS A 497 -6.310 -4.565 5.876 1.00 12.20 C ATOM 979 O LYS A 497 -5.375 -3.811 5.605 1.00 24.23 O ATOM 980 CB LYS A 497 -8.378 -3.117 5.823 1.00 11.22 C ATOM 981 CG LYS A 497 -9.796 -2.954 6.345 1.00 73.51 C ATOM 982 CD LYS A 497 -10.611 -4.219 6.093 1.00 72.34 C ATOM 983 CE LYS A 497 -11.777 -4.344 7.051 1.00 34.43 C ATOM 984 NZ LYS A 497 -11.331 -4.711 8.427 1.00 33.23 N ATOM 0 H LYS A 497 -6.230 -2.887 7.840 1.00 51.21 H new ATOM 0 HA LYS A 497 -8.123 -4.936 6.949 1.00 23.11 H new ATOM 0 HB2 LYS A 497 -7.897 -2.140 5.786 1.00 11.22 H new ATOM 0 HB3 LYS A 497 -8.415 -3.493 4.800 1.00 11.22 H new ATOM 0 HG2 LYS A 497 -9.773 -2.737 7.413 1.00 73.51 H new ATOM 0 HG3 LYS A 497 -10.273 -2.104 5.857 1.00 73.51 H new ATOM 0 HD2 LYS A 497 -10.983 -4.212 5.068 1.00 72.34 H new ATOM 0 HD3 LYS A 497 -9.965 -5.092 6.192 1.00 72.34 H new ATOM 0 HE2 LYS A 497 -12.321 -3.400 7.086 1.00 34.43 H new ATOM 0 HE3 LYS A 497 -12.471 -5.099 6.681 1.00 34.43 H new ATOM 0 HZ1 LYS A 497 -11.625 -5.686 8.639 1.00 33.23 H new ATOM 0 HZ2 LYS A 497 -10.295 -4.641 8.486 1.00 33.23 H new ATOM 0 HZ3 LYS A 497 -11.762 -4.062 9.116 1.00 33.23 H new ATOM 998 N VAL A 498 -6.322 -5.846 5.514 1.00 24.13 N ATOM 999 CA VAL A 498 -5.255 -6.431 4.694 1.00 60.25 C ATOM 1000 C VAL A 498 -5.751 -6.703 3.267 1.00 3.34 C ATOM 1001 O VAL A 498 -6.602 -7.565 3.042 1.00 33.00 O ATOM 1002 CB VAL A 498 -4.725 -7.744 5.319 1.00 52.44 C ATOM 1003 CG1 VAL A 498 -3.605 -8.346 4.467 1.00 42.05 C ATOM 1004 CG2 VAL A 498 -4.252 -7.495 6.751 1.00 2.51 C ATOM 0 H VAL A 498 -7.058 -6.502 5.774 1.00 24.13 H new ATOM 0 HA VAL A 498 -4.439 -5.709 4.656 1.00 60.25 H new ATOM 0 HB VAL A 498 -5.541 -8.466 5.347 1.00 52.44 H new ATOM 0 HG11 VAL A 498 -3.251 -9.268 4.929 1.00 42.05 H new ATOM 0 HG12 VAL A 498 -3.984 -8.563 3.468 1.00 42.05 H new ATOM 0 HG13 VAL A 498 -2.781 -7.636 4.396 1.00 42.05 H new ATOM 0 HG21 VAL A 498 -3.882 -8.427 7.179 1.00 2.51 H new ATOM 0 HG22 VAL A 498 -3.452 -6.755 6.746 1.00 2.51 H new ATOM 0 HG23 VAL A 498 -5.084 -7.126 7.350 1.00 2.51 H new ATOM 1014 N LEU A 499 -5.202 -5.967 2.309 1.00 33.44 N ATOM 1015 CA LEU A 499 -5.652 -6.028 0.914 1.00 32.04 C ATOM 1016 C LEU A 499 -4.618 -6.744 0.026 1.00 73.04 C ATOM 1017 O LEU A 499 -3.421 -6.504 0.151 1.00 0.40 O ATOM 1018 CB LEU A 499 -5.888 -4.597 0.407 1.00 42.22 C ATOM 1019 CG LEU A 499 -6.744 -3.712 1.338 1.00 1.23 C ATOM 1020 CD1 LEU A 499 -6.757 -2.263 0.859 1.00 11.10 C ATOM 1021 CD2 LEU A 499 -8.167 -4.257 1.456 1.00 34.20 C ATOM 0 H LEU A 499 -4.436 -5.313 2.470 1.00 33.44 H new ATOM 0 HA LEU A 499 -6.579 -6.599 0.864 1.00 32.04 H new ATOM 0 HB2 LEU A 499 -4.921 -4.115 0.259 1.00 42.22 H new ATOM 0 HB3 LEU A 499 -6.372 -4.648 -0.568 1.00 42.22 H new ATOM 0 HG LEU A 499 -6.290 -3.735 2.329 1.00 1.23 H new ATOM 0 HD11 LEU A 499 -7.367 -1.662 1.533 1.00 11.10 H new ATOM 0 HD12 LEU A 499 -5.739 -1.874 0.848 1.00 11.10 H new ATOM 0 HD13 LEU A 499 -7.174 -2.216 -0.147 1.00 11.10 H new ATOM 0 HD21 LEU A 499 -8.749 -3.615 2.117 1.00 34.20 H new ATOM 0 HD22 LEU A 499 -8.631 -4.278 0.470 1.00 34.20 H new ATOM 0 HD23 LEU A 499 -8.137 -5.267 1.865 1.00 34.20 H new ATOM 1033 N THR A 500 -5.075 -7.615 -0.871 1.00 20.13 N ATOM 1034 CA THR A 500 -4.164 -8.382 -1.741 1.00 72.50 C ATOM 1035 C THR A 500 -4.286 -7.987 -3.219 1.00 21.01 C ATOM 1036 O THR A 500 -5.355 -7.583 -3.686 1.00 24.53 O ATOM 1037 CB THR A 500 -4.423 -9.907 -1.638 1.00 53.25 C ATOM 1038 OG1 THR A 500 -5.826 -10.185 -1.787 1.00 63.11 O ATOM 1039 CG2 THR A 500 -3.922 -10.473 -0.316 1.00 1.34 C ATOM 0 H THR A 500 -6.065 -7.812 -1.020 1.00 20.13 H new ATOM 0 HA THR A 500 -3.162 -8.143 -1.385 1.00 72.50 H new ATOM 0 HB THR A 500 -3.870 -10.390 -2.443 1.00 53.25 H new ATOM 0 HG1 THR A 500 -5.977 -11.151 -1.722 1.00 63.11 H new ATOM 0 HG21 THR A 500 -4.121 -11.544 -0.280 1.00 1.34 H new ATOM 0 HG22 THR A 500 -2.849 -10.300 -0.229 1.00 1.34 H new ATOM 0 HG23 THR A 500 -4.437 -9.981 0.509 1.00 1.34 H new ATOM 1047 N PHE A 501 -3.174 -8.108 -3.945 1.00 13.35 N ATOM 1048 CA PHE A 501 -3.160 -7.897 -5.397 1.00 15.11 C ATOM 1049 C PHE A 501 -2.178 -8.861 -6.082 1.00 14.32 C ATOM 1050 O PHE A 501 -1.158 -9.241 -5.502 1.00 23.25 O ATOM 1051 CB PHE A 501 -2.813 -6.436 -5.737 1.00 13.40 C ATOM 1052 CG PHE A 501 -1.444 -5.978 -5.275 1.00 2.41 C ATOM 1053 CD1 PHE A 501 -1.264 -5.436 -4.010 1.00 24.32 C ATOM 1054 CD2 PHE A 501 -0.342 -6.076 -6.117 1.00 41.34 C ATOM 1055 CE1 PHE A 501 -0.018 -5.002 -3.597 1.00 20.24 C ATOM 1056 CE2 PHE A 501 0.904 -5.646 -5.706 1.00 14.22 C ATOM 1057 CZ PHE A 501 1.066 -5.107 -4.446 1.00 33.31 C ATOM 0 H PHE A 501 -2.266 -8.352 -3.551 1.00 13.35 H new ATOM 0 HA PHE A 501 -4.161 -8.105 -5.775 1.00 15.11 H new ATOM 0 HB2 PHE A 501 -2.878 -6.305 -6.817 1.00 13.40 H new ATOM 0 HB3 PHE A 501 -3.566 -5.786 -5.291 1.00 13.40 H new ATOM 0 HD1 PHE A 501 -2.107 -5.352 -3.340 1.00 24.32 H new ATOM 0 HD2 PHE A 501 -0.462 -6.494 -7.106 1.00 41.34 H new ATOM 0 HE1 PHE A 501 0.108 -4.581 -2.610 1.00 20.24 H new ATOM 0 HE2 PHE A 501 1.751 -5.731 -6.370 1.00 14.22 H new ATOM 0 HZ PHE A 501 2.040 -4.768 -4.124 1.00 33.31 H new ATOM 1067 N SER A 502 -2.491 -9.252 -7.316 1.00 34.21 N ATOM 1068 CA SER A 502 -1.660 -10.205 -8.068 1.00 31.30 C ATOM 1069 C SER A 502 -1.055 -9.549 -9.318 1.00 21.53 C ATOM 1070 O SER A 502 -1.772 -9.171 -10.242 1.00 71.13 O ATOM 1071 CB SER A 502 -2.496 -11.428 -8.472 1.00 4.33 C ATOM 1072 OG SER A 502 -3.587 -11.061 -9.306 1.00 5.03 O ATOM 0 H SER A 502 -3.315 -8.926 -7.822 1.00 34.21 H new ATOM 0 HA SER A 502 -0.842 -10.523 -7.421 1.00 31.30 H new ATOM 0 HB2 SER A 502 -1.863 -12.146 -8.994 1.00 4.33 H new ATOM 0 HB3 SER A 502 -2.872 -11.925 -7.577 1.00 4.33 H new ATOM 0 HG SER A 502 -3.333 -10.292 -9.857 1.00 5.03 H new ATOM 1078 N TRP A 503 0.270 -9.435 -9.345 1.00 12.33 N ATOM 1079 CA TRP A 503 0.980 -8.751 -10.436 1.00 73.31 C ATOM 1080 C TRP A 503 1.896 -9.714 -11.215 1.00 50.32 C ATOM 1081 O TRP A 503 2.564 -10.564 -10.625 1.00 53.44 O ATOM 1082 CB TRP A 503 1.793 -7.577 -9.863 1.00 35.13 C ATOM 1083 CG TRP A 503 2.640 -6.863 -10.877 1.00 32.11 C ATOM 1084 CD1 TRP A 503 2.218 -6.278 -12.038 1.00 43.23 C ATOM 1085 CD2 TRP A 503 4.055 -6.643 -10.809 1.00 20.51 C ATOM 1086 NE1 TRP A 503 3.284 -5.724 -12.699 1.00 51.03 N ATOM 1087 CE2 TRP A 503 4.422 -5.932 -11.965 1.00 32.21 C ATOM 1088 CE3 TRP A 503 5.048 -6.985 -9.884 1.00 11.42 C ATOM 1089 CZ2 TRP A 503 5.738 -5.551 -12.219 1.00 12.12 C ATOM 1090 CZ3 TRP A 503 6.352 -6.606 -10.137 1.00 0.23 C ATOM 1091 CH2 TRP A 503 6.687 -5.897 -11.297 1.00 23.02 C ATOM 0 H TRP A 503 0.883 -9.809 -8.620 1.00 12.33 H new ATOM 0 HA TRP A 503 0.239 -8.372 -11.140 1.00 73.31 H new ATOM 0 HB2 TRP A 503 1.107 -6.861 -9.410 1.00 35.13 H new ATOM 0 HB3 TRP A 503 2.437 -7.950 -9.066 1.00 35.13 H new ATOM 0 HD1 TRP A 503 1.195 -6.255 -12.384 1.00 43.23 H new ATOM 0 HE1 TRP A 503 3.237 -5.236 -13.593 1.00 51.03 H new ATOM 0 HE3 TRP A 503 4.799 -7.535 -8.989 1.00 11.42 H new ATOM 0 HZ2 TRP A 503 5.999 -5.002 -13.112 1.00 12.12 H new ATOM 0 HZ3 TRP A 503 7.126 -6.861 -9.428 1.00 0.23 H new ATOM 0 HH2 TRP A 503 7.716 -5.618 -11.467 1.00 23.02 H new ATOM 1102 N THR A 504 1.899 -9.590 -12.545 1.00 42.13 N ATOM 1103 CA THR A 504 2.780 -10.402 -13.403 1.00 51.05 C ATOM 1104 C THR A 504 3.862 -9.545 -14.078 1.00 13.35 C ATOM 1105 O THR A 504 3.593 -8.857 -15.066 1.00 74.10 O ATOM 1106 CB THR A 504 1.986 -11.138 -14.515 1.00 32.24 C ATOM 1107 OG1 THR A 504 0.989 -11.992 -13.935 1.00 63.40 O ATOM 1108 CG2 THR A 504 2.913 -11.971 -15.400 1.00 52.14 C ATOM 0 H THR A 504 1.304 -8.937 -13.055 1.00 42.13 H new ATOM 0 HA THR A 504 3.247 -11.133 -12.742 1.00 51.05 H new ATOM 0 HB THR A 504 1.504 -10.380 -15.132 1.00 32.24 H new ATOM 0 HG1 THR A 504 0.495 -12.449 -14.647 1.00 63.40 H new ATOM 0 HG21 THR A 504 2.327 -12.474 -16.169 1.00 52.14 H new ATOM 0 HG22 THR A 504 3.648 -11.319 -15.872 1.00 52.14 H new ATOM 0 HG23 THR A 504 3.426 -12.715 -14.791 1.00 52.14 H new ATOM 1116 N PRO A 505 5.102 -9.561 -13.555 1.00 74.23 N ATOM 1117 CA PRO A 505 6.229 -8.871 -14.195 1.00 23.43 C ATOM 1118 C PRO A 505 6.691 -9.573 -15.486 1.00 53.13 C ATOM 1119 O PRO A 505 7.556 -10.447 -15.460 1.00 21.31 O ATOM 1120 CB PRO A 505 7.325 -8.912 -13.122 1.00 74.53 C ATOM 1121 CG PRO A 505 7.005 -10.123 -12.310 1.00 43.30 C ATOM 1122 CD PRO A 505 5.503 -10.222 -12.293 1.00 24.21 C ATOM 0 HA PRO A 505 5.967 -7.861 -14.510 1.00 23.43 H new ATOM 0 HB2 PRO A 505 8.316 -8.984 -13.569 1.00 74.53 H new ATOM 0 HB3 PRO A 505 7.316 -8.010 -12.510 1.00 74.53 H new ATOM 0 HG2 PRO A 505 7.451 -11.016 -12.748 1.00 43.30 H new ATOM 0 HG3 PRO A 505 7.402 -10.032 -11.299 1.00 43.30 H new ATOM 0 HD2 PRO A 505 5.169 -11.259 -12.259 1.00 24.21 H new ATOM 0 HD3 PRO A 505 5.077 -9.721 -11.424 1.00 24.21 H new ATOM 1130 N THR A 506 6.086 -9.202 -16.611 1.00 54.04 N ATOM 1131 CA THR A 506 6.460 -9.759 -17.922 1.00 1.22 C ATOM 1132 C THR A 506 7.772 -9.158 -18.453 1.00 15.15 C ATOM 1133 O THR A 506 8.250 -9.531 -19.525 1.00 61.33 O ATOM 1134 CB THR A 506 5.339 -9.546 -18.967 1.00 54.21 C ATOM 1135 OG1 THR A 506 4.885 -8.183 -18.933 1.00 51.32 O ATOM 1136 CG2 THR A 506 4.161 -10.483 -18.714 1.00 1.02 C ATOM 0 H THR A 506 5.332 -8.516 -16.648 1.00 54.04 H new ATOM 0 HA THR A 506 6.608 -10.828 -17.768 1.00 1.22 H new ATOM 0 HB THR A 506 5.752 -9.770 -19.951 1.00 54.21 H new ATOM 0 HG1 THR A 506 4.177 -8.057 -19.599 1.00 51.32 H new ATOM 0 HG21 THR A 506 3.390 -10.309 -19.465 1.00 1.02 H new ATOM 0 HG22 THR A 506 4.499 -11.517 -18.774 1.00 1.02 H new ATOM 0 HG23 THR A 506 3.751 -10.293 -17.722 1.00 1.02 H new ATOM 1144 N GLN A 507 8.355 -8.235 -17.690 1.00 23.42 N ATOM 1145 CA GLN A 507 9.652 -7.641 -18.037 1.00 63.54 C ATOM 1146 C GLN A 507 10.612 -7.706 -16.835 1.00 53.11 C ATOM 1147 O GLN A 507 10.223 -7.404 -15.707 1.00 44.35 O ATOM 1148 CB GLN A 507 9.464 -6.185 -18.492 1.00 3.43 C ATOM 1149 CG GLN A 507 10.742 -5.526 -18.999 1.00 34.35 C ATOM 1150 CD GLN A 507 11.320 -6.225 -20.217 1.00 34.11 C ATOM 1151 OE1 GLN A 507 12.133 -7.141 -20.100 1.00 62.25 O ATOM 1152 NE2 GLN A 507 10.900 -5.811 -21.394 1.00 41.24 N ATOM 0 H GLN A 507 7.951 -7.879 -16.824 1.00 23.42 H new ATOM 0 HA GLN A 507 10.087 -8.211 -18.858 1.00 63.54 H new ATOM 0 HB2 GLN A 507 8.714 -6.156 -19.282 1.00 3.43 H new ATOM 0 HB3 GLN A 507 9.072 -5.602 -17.659 1.00 3.43 H new ATOM 0 HG2 GLN A 507 10.535 -4.485 -19.247 1.00 34.35 H new ATOM 0 HG3 GLN A 507 11.485 -5.522 -18.201 1.00 34.35 H new ATOM 0 HE21 GLN A 507 10.225 -5.049 -21.455 1.00 41.24 H new ATOM 0 HE22 GLN A 507 11.249 -6.253 -22.244 1.00 41.24 H new ATOM 1161 N GLU A 508 11.864 -8.089 -17.085 1.00 1.35 N ATOM 1162 CA GLU A 508 12.844 -8.306 -16.005 1.00 44.05 C ATOM 1163 C GLU A 508 13.521 -7.001 -15.543 1.00 45.11 C ATOM 1164 O GLU A 508 13.657 -6.046 -16.310 1.00 64.03 O ATOM 1165 CB GLU A 508 13.889 -9.351 -16.439 1.00 33.13 C ATOM 1166 CG GLU A 508 14.672 -9.003 -17.710 1.00 34.42 C ATOM 1167 CD GLU A 508 15.876 -8.102 -17.461 1.00 31.50 C ATOM 1168 OE1 GLU A 508 16.700 -8.433 -16.583 1.00 4.53 O ATOM 1169 OE2 GLU A 508 16.021 -7.078 -18.162 1.00 1.23 O ATOM 0 H GLU A 508 12.229 -8.257 -18.022 1.00 1.35 H new ATOM 0 HA GLU A 508 12.297 -8.687 -15.143 1.00 44.05 H new ATOM 0 HB2 GLU A 508 14.597 -9.493 -15.623 1.00 33.13 H new ATOM 0 HB3 GLU A 508 13.384 -10.304 -16.593 1.00 33.13 H new ATOM 0 HG2 GLU A 508 15.011 -9.926 -18.181 1.00 34.42 H new ATOM 0 HG3 GLU A 508 14.002 -8.512 -18.416 1.00 34.42 H new ATOM 1176 N GLY A 509 13.925 -6.970 -14.272 1.00 24.42 N ATOM 1177 CA GLY A 509 14.548 -5.781 -13.687 1.00 63.10 C ATOM 1178 C GLY A 509 14.115 -5.545 -12.241 1.00 64.05 C ATOM 1179 O GLY A 509 13.335 -6.321 -11.690 1.00 23.12 O ATOM 0 H GLY A 509 13.832 -7.755 -13.627 1.00 24.42 H new ATOM 0 HA2 GLY A 509 15.632 -5.887 -13.726 1.00 63.10 H new ATOM 0 HA3 GLY A 509 14.291 -4.908 -14.287 1.00 63.10 H new ATOM 1183 N MET A 510 14.621 -4.485 -11.613 1.00 62.24 N ATOM 1184 CA MET A 510 14.219 -4.148 -10.240 1.00 64.03 C ATOM 1185 C MET A 510 13.052 -3.150 -10.220 1.00 5.33 C ATOM 1186 O MET A 510 13.190 -2.004 -10.652 1.00 41.41 O ATOM 1187 CB MET A 510 15.396 -3.577 -9.442 1.00 4.24 C ATOM 1188 CG MET A 510 16.510 -4.580 -9.184 1.00 60.21 C ATOM 1189 SD MET A 510 17.630 -4.035 -7.880 1.00 74.43 S ATOM 1190 CE MET A 510 16.492 -3.922 -6.494 1.00 2.42 C ATOM 0 H MET A 510 15.303 -3.848 -12.024 1.00 62.24 H new ATOM 0 HA MET A 510 13.890 -5.076 -9.772 1.00 64.03 H new ATOM 0 HB2 MET A 510 15.807 -2.723 -9.980 1.00 4.24 H new ATOM 0 HB3 MET A 510 15.028 -3.204 -8.486 1.00 4.24 H new ATOM 0 HG2 MET A 510 16.075 -5.541 -8.909 1.00 60.21 H new ATOM 0 HG3 MET A 510 17.075 -4.738 -10.103 1.00 60.21 H new ATOM 0 HE1 MET A 510 16.978 -4.296 -5.593 1.00 2.42 H new ATOM 0 HE2 MET A 510 16.202 -2.882 -6.345 1.00 2.42 H new ATOM 0 HE3 MET A 510 15.605 -4.520 -6.702 1.00 2.42 H new ATOM 1200 N TYR A 511 11.913 -3.590 -9.696 1.00 23.42 N ATOM 1201 CA TYR A 511 10.697 -2.767 -9.647 1.00 24.22 C ATOM 1202 C TYR A 511 10.359 -2.357 -8.209 1.00 22.24 C ATOM 1203 O TYR A 511 10.312 -3.192 -7.307 1.00 40.35 O ATOM 1204 CB TYR A 511 9.517 -3.528 -10.268 1.00 15.04 C ATOM 1205 CG TYR A 511 9.678 -3.782 -11.757 1.00 51.13 C ATOM 1206 CD1 TYR A 511 10.566 -4.743 -12.226 1.00 14.13 C ATOM 1207 CD2 TYR A 511 8.953 -3.052 -12.691 1.00 34.21 C ATOM 1208 CE1 TYR A 511 10.726 -4.968 -13.578 1.00 52.23 C ATOM 1209 CE2 TYR A 511 9.110 -3.270 -14.045 1.00 71.52 C ATOM 1210 CZ TYR A 511 9.996 -4.229 -14.483 1.00 41.50 C ATOM 1211 OH TYR A 511 10.160 -4.449 -15.831 1.00 63.01 O ATOM 0 H TYR A 511 11.801 -4.521 -9.294 1.00 23.42 H new ATOM 0 HA TYR A 511 10.883 -1.860 -10.222 1.00 24.22 H new ATOM 0 HB2 TYR A 511 9.400 -4.483 -9.755 1.00 15.04 H new ATOM 0 HB3 TYR A 511 8.601 -2.962 -10.101 1.00 15.04 H new ATOM 0 HD1 TYR A 511 11.141 -5.324 -11.520 1.00 14.13 H new ATOM 0 HD2 TYR A 511 8.255 -2.301 -12.352 1.00 34.21 H new ATOM 0 HE1 TYR A 511 11.420 -5.719 -13.925 1.00 52.23 H new ATOM 0 HE2 TYR A 511 8.541 -2.691 -14.757 1.00 71.52 H new ATOM 0 HH TYR A 511 10.206 -5.413 -16.002 1.00 63.01 H new ATOM 1221 N ARG A 512 10.124 -1.068 -8.003 1.00 23.42 N ATOM 1222 CA ARG A 512 9.816 -0.545 -6.672 1.00 72.23 C ATOM 1223 C ARG A 512 8.308 -0.340 -6.481 1.00 43.24 C ATOM 1224 O ARG A 512 7.683 0.465 -7.174 1.00 21.13 O ATOM 1225 CB ARG A 512 10.574 0.768 -6.440 1.00 2.33 C ATOM 1226 CG ARG A 512 10.293 1.421 -5.089 1.00 62.44 C ATOM 1227 CD ARG A 512 11.332 2.485 -4.762 1.00 61.43 C ATOM 1228 NE ARG A 512 12.668 1.909 -4.675 1.00 25.42 N ATOM 1229 CZ ARG A 512 13.776 2.590 -4.679 1.00 74.50 C ATOM 1230 NH1 ARG A 512 13.772 3.885 -4.745 1.00 63.21 N ATOM 1231 NH2 ARG A 512 14.897 1.958 -4.620 1.00 22.53 N ATOM 0 H ARG A 512 10.140 -0.362 -8.739 1.00 23.42 H new ATOM 0 HA ARG A 512 10.140 -1.280 -5.935 1.00 72.23 H new ATOM 0 HB2 ARG A 512 11.644 0.577 -6.523 1.00 2.33 H new ATOM 0 HB3 ARG A 512 10.313 1.470 -7.232 1.00 2.33 H new ATOM 0 HG2 ARG A 512 9.300 1.870 -5.099 1.00 62.44 H new ATOM 0 HG3 ARG A 512 10.290 0.660 -4.308 1.00 62.44 H new ATOM 0 HD2 ARG A 512 11.317 3.260 -5.529 1.00 61.43 H new ATOM 0 HD3 ARG A 512 11.079 2.966 -3.817 1.00 61.43 H new ATOM 0 HE ARG A 512 12.739 0.894 -4.606 1.00 25.42 H new ATOM 0 HH11 ARG A 512 12.887 4.390 -4.795 1.00 63.21 H new ATOM 0 HH12 ARG A 512 14.653 4.398 -4.747 1.00 63.21 H new ATOM 0 HH21 ARG A 512 14.906 0.939 -4.571 1.00 22.53 H new ATOM 0 HH22 ARG A 512 15.775 2.476 -4.622 1.00 22.53 H new ATOM 1245 N ILE A 513 7.735 -1.088 -5.540 1.00 64.11 N ATOM 1246 CA ILE A 513 6.315 -0.973 -5.204 1.00 31.42 C ATOM 1247 C ILE A 513 6.109 -0.040 -4.000 1.00 13.54 C ATOM 1248 O ILE A 513 6.739 -0.209 -2.952 1.00 14.32 O ATOM 1249 CB ILE A 513 5.701 -2.363 -4.883 1.00 10.44 C ATOM 1250 CG1 ILE A 513 5.852 -3.307 -6.090 1.00 10.43 C ATOM 1251 CG2 ILE A 513 4.230 -2.229 -4.479 1.00 54.52 C ATOM 1252 CD1 ILE A 513 5.309 -4.704 -5.850 1.00 64.34 C ATOM 0 H ILE A 513 8.237 -1.787 -4.992 1.00 64.11 H new ATOM 0 HA ILE A 513 5.811 -0.553 -6.074 1.00 31.42 H new ATOM 0 HB ILE A 513 6.243 -2.792 -4.040 1.00 10.44 H new ATOM 0 HG12 ILE A 513 5.339 -2.870 -6.947 1.00 10.43 H new ATOM 0 HG13 ILE A 513 6.907 -3.378 -6.353 1.00 10.43 H new ATOM 0 HG21 ILE A 513 3.822 -3.215 -4.259 1.00 54.52 H new ATOM 0 HG22 ILE A 513 4.152 -1.598 -3.593 1.00 54.52 H new ATOM 0 HG23 ILE A 513 3.668 -1.778 -5.297 1.00 54.52 H new ATOM 0 HD11 ILE A 513 5.452 -5.309 -6.746 1.00 64.34 H new ATOM 0 HD12 ILE A 513 5.839 -5.162 -5.015 1.00 64.34 H new ATOM 0 HD13 ILE A 513 4.246 -4.646 -5.617 1.00 64.34 H new ATOM 1264 N ASN A 514 5.234 0.947 -4.158 1.00 74.15 N ATOM 1265 CA ASN A 514 4.923 1.894 -3.081 1.00 23.25 C ATOM 1266 C ASN A 514 3.424 1.894 -2.748 1.00 25.31 C ATOM 1267 O ASN A 514 2.582 1.987 -3.639 1.00 31.14 O ATOM 1268 CB ASN A 514 5.363 3.309 -3.473 1.00 23.45 C ATOM 1269 CG ASN A 514 6.870 3.437 -3.604 1.00 61.14 C ATOM 1270 OD1 ASN A 514 7.438 3.223 -4.668 1.00 1.23 O ATOM 1271 ND2 ASN A 514 7.531 3.789 -2.515 1.00 73.03 N ATOM 0 H ASN A 514 4.723 1.117 -5.024 1.00 74.15 H new ATOM 0 HA ASN A 514 5.471 1.575 -2.194 1.00 23.25 H new ATOM 0 HB2 ASN A 514 4.895 3.582 -4.419 1.00 23.45 H new ATOM 0 HB3 ASN A 514 5.006 4.017 -2.725 1.00 23.45 H new ATOM 0 HD21 ASN A 514 8.546 3.890 -2.545 1.00 73.03 H new ATOM 0 HD22 ASN A 514 7.027 3.960 -1.645 1.00 73.03 H new ATOM 1278 N ALA A 515 3.099 1.797 -1.461 1.00 22.43 N ATOM 1279 CA ALA A 515 1.705 1.877 -1.008 1.00 75.23 C ATOM 1280 C ALA A 515 1.477 3.164 -0.209 1.00 63.25 C ATOM 1281 O ALA A 515 2.269 3.508 0.668 1.00 65.11 O ATOM 1282 CB ALA A 515 1.335 0.661 -0.165 1.00 74.34 C ATOM 0 H ALA A 515 3.778 1.663 -0.712 1.00 22.43 H new ATOM 0 HA ALA A 515 1.063 1.890 -1.889 1.00 75.23 H new ATOM 0 HB1 ALA A 515 0.297 0.744 0.158 1.00 74.34 H new ATOM 0 HB2 ALA A 515 1.458 -0.245 -0.759 1.00 74.34 H new ATOM 0 HB3 ALA A 515 1.985 0.613 0.709 1.00 74.34 H new ATOM 1288 N THR A 516 0.399 3.872 -0.520 1.00 53.15 N ATOM 1289 CA THR A 516 0.102 5.161 0.121 1.00 32.41 C ATOM 1290 C THR A 516 -1.362 5.246 0.559 1.00 55.43 C ATOM 1291 O THR A 516 -2.224 4.557 0.013 1.00 13.21 O ATOM 1292 CB THR A 516 0.382 6.343 -0.839 1.00 53.33 C ATOM 1293 OG1 THR A 516 -0.493 6.266 -1.978 1.00 65.21 O ATOM 1294 CG2 THR A 516 1.832 6.344 -1.314 1.00 64.42 C ATOM 0 H THR A 516 -0.290 3.580 -1.213 1.00 53.15 H new ATOM 0 HA THR A 516 0.752 5.227 0.993 1.00 32.41 H new ATOM 0 HB THR A 516 0.199 7.268 -0.292 1.00 53.33 H new ATOM 0 HG1 THR A 516 0.002 6.510 -2.788 1.00 65.21 H new ATOM 0 HG21 THR A 516 1.994 7.187 -1.986 1.00 64.42 H new ATOM 0 HG22 THR A 516 2.496 6.432 -0.454 1.00 64.42 H new ATOM 0 HG23 THR A 516 2.043 5.414 -1.841 1.00 64.42 H new ATOM 1302 N VAL A 517 -1.645 6.091 1.549 1.00 14.42 N ATOM 1303 CA VAL A 517 -3.029 6.355 1.956 1.00 43.45 C ATOM 1304 C VAL A 517 -3.315 7.865 2.048 1.00 3.00 C ATOM 1305 O VAL A 517 -2.468 8.642 2.490 1.00 33.43 O ATOM 1306 CB VAL A 517 -3.357 5.672 3.311 1.00 24.12 C ATOM 1307 CG1 VAL A 517 -2.457 6.199 4.425 1.00 22.13 C ATOM 1308 CG2 VAL A 517 -4.830 5.849 3.672 1.00 71.50 C ATOM 0 H VAL A 517 -0.942 6.602 2.082 1.00 14.42 H new ATOM 0 HA VAL A 517 -3.672 5.930 1.185 1.00 43.45 H new ATOM 0 HB VAL A 517 -3.163 4.605 3.200 1.00 24.12 H new ATOM 0 HG11 VAL A 517 -2.709 5.703 5.362 1.00 22.13 H new ATOM 0 HG12 VAL A 517 -1.415 5.997 4.177 1.00 22.13 H new ATOM 0 HG13 VAL A 517 -2.603 7.274 4.533 1.00 22.13 H new ATOM 0 HG21 VAL A 517 -5.032 5.361 4.625 1.00 71.50 H new ATOM 0 HG22 VAL A 517 -5.060 6.911 3.752 1.00 71.50 H new ATOM 0 HG23 VAL A 517 -5.451 5.401 2.896 1.00 71.50 H new ATOM 1318 N ASP A 518 -4.516 8.254 1.602 1.00 41.43 N ATOM 1319 CA ASP A 518 -4.997 9.651 1.642 1.00 14.53 C ATOM 1320 C ASP A 518 -3.897 10.676 1.256 1.00 62.21 C ATOM 1321 O ASP A 518 -3.677 11.661 1.959 1.00 30.35 O ATOM 1322 CB ASP A 518 -5.567 9.981 3.034 1.00 62.21 C ATOM 1323 CG ASP A 518 -6.764 10.923 2.957 1.00 61.23 C ATOM 1324 OD1 ASP A 518 -6.586 12.110 2.608 1.00 21.41 O ATOM 1325 OD2 ASP A 518 -7.897 10.469 3.210 1.00 54.14 O ATOM 0 H ASP A 518 -5.192 7.605 1.198 1.00 41.43 H new ATOM 0 HA ASP A 518 -5.786 9.735 0.895 1.00 14.53 H new ATOM 0 HB2 ASP A 518 -5.865 9.058 3.531 1.00 62.21 H new ATOM 0 HB3 ASP A 518 -4.788 10.436 3.646 1.00 62.21 H new ATOM 1330 N GLU A 519 -3.225 10.446 0.122 1.00 70.24 N ATOM 1331 CA GLU A 519 -2.153 11.348 -0.352 1.00 42.01 C ATOM 1332 C GLU A 519 -2.625 12.806 -0.454 1.00 64.23 C ATOM 1333 O GLU A 519 -1.846 13.741 -0.262 1.00 71.42 O ATOM 1334 CB GLU A 519 -1.647 10.909 -1.730 1.00 62.14 C ATOM 1335 CG GLU A 519 -1.001 9.535 -1.759 1.00 74.02 C ATOM 1336 CD GLU A 519 -0.440 9.202 -3.129 1.00 63.34 C ATOM 1337 OE1 GLU A 519 0.725 9.561 -3.406 1.00 24.44 O ATOM 1338 OE2 GLU A 519 -1.164 8.601 -3.942 1.00 22.32 O ATOM 0 H GLU A 519 -3.399 9.647 -0.487 1.00 70.24 H new ATOM 0 HA GLU A 519 -1.352 11.288 0.385 1.00 42.01 H new ATOM 0 HB2 GLU A 519 -2.483 10.917 -2.429 1.00 62.14 H new ATOM 0 HB3 GLU A 519 -0.925 11.643 -2.088 1.00 62.14 H new ATOM 0 HG2 GLU A 519 -0.201 9.494 -1.020 1.00 74.02 H new ATOM 0 HG3 GLU A 519 -1.736 8.782 -1.475 1.00 74.02 H new ATOM 1345 N GLU A 520 -3.896 12.979 -0.786 1.00 32.24 N ATOM 1346 CA GLU A 520 -4.481 14.307 -1.003 1.00 52.22 C ATOM 1347 C GLU A 520 -4.878 15.003 0.316 1.00 60.24 C ATOM 1348 O GLU A 520 -5.429 16.107 0.305 1.00 15.21 O ATOM 1349 CB GLU A 520 -5.677 14.191 -1.964 1.00 44.25 C ATOM 1350 CG GLU A 520 -6.677 13.091 -1.607 1.00 2.05 C ATOM 1351 CD GLU A 520 -7.683 12.835 -2.716 1.00 63.02 C ATOM 1352 OE1 GLU A 520 -7.379 12.030 -3.625 1.00 74.30 O ATOM 1353 OE2 GLU A 520 -8.772 13.449 -2.702 1.00 20.31 O ATOM 0 H GLU A 520 -4.554 12.210 -0.914 1.00 32.24 H new ATOM 0 HA GLU A 520 -3.719 14.941 -1.456 1.00 52.22 H new ATOM 0 HB2 GLU A 520 -6.201 15.146 -1.988 1.00 44.25 H new ATOM 0 HB3 GLU A 520 -5.301 14.009 -2.971 1.00 44.25 H new ATOM 0 HG2 GLU A 520 -6.136 12.169 -1.392 1.00 2.05 H new ATOM 0 HG3 GLU A 520 -7.208 13.369 -0.697 1.00 2.05 H new ATOM 1360 N ASN A 521 -4.592 14.346 1.442 1.00 15.43 N ATOM 1361 CA ASN A 521 -4.726 14.942 2.783 1.00 14.12 C ATOM 1362 C ASN A 521 -6.137 15.490 3.071 1.00 61.53 C ATOM 1363 O ASN A 521 -6.288 16.501 3.764 1.00 50.45 O ATOM 1364 CB ASN A 521 -3.690 16.060 2.973 1.00 53.32 C ATOM 1365 CG ASN A 521 -2.259 15.591 2.774 1.00 42.43 C ATOM 1366 OD1 ASN A 521 -1.936 14.423 2.951 1.00 22.20 O ATOM 1367 ND2 ASN A 521 -1.382 16.509 2.424 1.00 24.13 N ATOM 0 H ASN A 521 -4.259 13.382 1.455 1.00 15.43 H new ATOM 0 HA ASN A 521 -4.548 14.136 3.495 1.00 14.12 H new ATOM 0 HB2 ASN A 521 -3.902 16.866 2.271 1.00 53.32 H new ATOM 0 HB3 ASN A 521 -3.793 16.475 3.975 1.00 53.32 H new ATOM 0 HD21 ASN A 521 -0.403 16.255 2.293 1.00 24.13 H new ATOM 0 HD22 ASN A 521 -1.682 17.474 2.284 1.00 24.13 H new ATOM 1374 N THR A 522 -7.170 14.811 2.573 1.00 64.43 N ATOM 1375 CA THR A 522 -8.562 15.227 2.830 1.00 32.35 C ATOM 1376 C THR A 522 -8.894 15.153 4.324 1.00 21.23 C ATOM 1377 O THR A 522 -9.778 15.861 4.816 1.00 73.54 O ATOM 1378 CB THR A 522 -9.587 14.364 2.060 1.00 31.34 C ATOM 1379 OG1 THR A 522 -9.476 12.983 2.442 1.00 71.22 O ATOM 1380 CG2 THR A 522 -9.400 14.502 0.554 1.00 43.41 C ATOM 0 H THR A 522 -7.078 13.977 1.993 1.00 64.43 H new ATOM 0 HA THR A 522 -8.636 16.256 2.479 1.00 32.35 H new ATOM 0 HB THR A 522 -10.583 14.724 2.319 1.00 31.34 H new ATOM 0 HG1 THR A 522 -8.533 12.715 2.430 1.00 71.22 H new ATOM 0 HG21 THR A 522 -10.135 13.884 0.038 1.00 43.41 H new ATOM 0 HG22 THR A 522 -9.535 15.544 0.265 1.00 43.41 H new ATOM 0 HG23 THR A 522 -8.396 14.177 0.281 1.00 43.41 H new ATOM 1388 N VAL A 523 -8.184 14.287 5.041 1.00 11.43 N ATOM 1389 CA VAL A 523 -8.328 14.169 6.493 1.00 51.24 C ATOM 1390 C VAL A 523 -7.106 14.758 7.226 1.00 43.15 C ATOM 1391 O VAL A 523 -5.969 14.625 6.770 1.00 60.04 O ATOM 1392 CB VAL A 523 -8.536 12.689 6.912 1.00 14.24 C ATOM 1393 CG1 VAL A 523 -7.338 11.826 6.517 1.00 64.13 C ATOM 1394 CG2 VAL A 523 -8.822 12.584 8.409 1.00 70.43 C ATOM 0 H VAL A 523 -7.497 13.650 4.638 1.00 11.43 H new ATOM 0 HA VAL A 523 -9.210 14.741 6.780 1.00 51.24 H new ATOM 0 HB VAL A 523 -9.405 12.308 6.375 1.00 14.24 H new ATOM 0 HG11 VAL A 523 -7.515 10.795 6.824 1.00 64.13 H new ATOM 0 HG12 VAL A 523 -7.203 11.864 5.436 1.00 64.13 H new ATOM 0 HG13 VAL A 523 -6.441 12.202 7.008 1.00 64.13 H new ATOM 0 HG21 VAL A 523 -8.964 11.538 8.680 1.00 70.43 H new ATOM 0 HG22 VAL A 523 -7.981 12.993 8.970 1.00 70.43 H new ATOM 0 HG23 VAL A 523 -9.725 13.146 8.647 1.00 70.43 H new ATOM 1404 N VAL A 524 -7.346 15.443 8.342 1.00 31.10 N ATOM 1405 CA VAL A 524 -6.258 15.972 9.176 1.00 51.20 C ATOM 1406 C VAL A 524 -5.857 14.947 10.249 1.00 60.31 C ATOM 1407 O VAL A 524 -6.654 14.617 11.130 1.00 11.11 O ATOM 1408 CB VAL A 524 -6.662 17.305 9.857 1.00 33.53 C ATOM 1409 CG1 VAL A 524 -5.529 17.836 10.735 1.00 53.04 C ATOM 1410 CG2 VAL A 524 -7.073 18.342 8.810 1.00 30.04 C ATOM 0 H VAL A 524 -8.282 15.647 8.693 1.00 31.10 H new ATOM 0 HA VAL A 524 -5.408 16.164 8.522 1.00 51.20 H new ATOM 0 HB VAL A 524 -7.520 17.111 10.500 1.00 33.53 H new ATOM 0 HG11 VAL A 524 -5.838 18.772 11.201 1.00 53.04 H new ATOM 0 HG12 VAL A 524 -5.295 17.105 11.509 1.00 53.04 H new ATOM 0 HG13 VAL A 524 -4.645 18.011 10.122 1.00 53.04 H new ATOM 0 HG21 VAL A 524 -7.353 19.270 9.308 1.00 30.04 H new ATOM 0 HG22 VAL A 524 -6.237 18.529 8.136 1.00 30.04 H new ATOM 0 HG23 VAL A 524 -7.922 17.966 8.239 1.00 30.04 H new ATOM 1420 N GLU A 525 -4.625 14.445 10.170 1.00 1.13 N ATOM 1421 CA GLU A 525 -4.169 13.369 11.060 1.00 53.42 C ATOM 1422 C GLU A 525 -3.070 13.824 12.036 1.00 21.32 C ATOM 1423 O GLU A 525 -2.732 15.008 12.120 1.00 63.23 O ATOM 1424 CB GLU A 525 -3.649 12.191 10.228 1.00 1.21 C ATOM 1425 CG GLU A 525 -4.661 11.643 9.228 1.00 14.53 C ATOM 1426 CD GLU A 525 -4.404 10.185 8.895 1.00 20.51 C ATOM 1427 OE1 GLU A 525 -3.569 9.906 8.012 1.00 34.40 O ATOM 1428 OE2 GLU A 525 -5.028 9.317 9.541 1.00 65.25 O ATOM 0 H GLU A 525 -3.923 14.763 9.501 1.00 1.13 H new ATOM 0 HA GLU A 525 -5.030 13.068 11.656 1.00 53.42 H new ATOM 0 HB2 GLU A 525 -2.756 12.507 9.689 1.00 1.21 H new ATOM 0 HB3 GLU A 525 -3.348 11.389 10.902 1.00 1.21 H new ATOM 0 HG2 GLU A 525 -5.666 11.749 9.635 1.00 14.53 H new ATOM 0 HG3 GLU A 525 -4.623 12.235 8.314 1.00 14.53 H new ATOM 1435 N LEU A 526 -2.529 12.861 12.784 1.00 25.43 N ATOM 1436 CA LEU A 526 -1.429 13.113 13.721 1.00 52.43 C ATOM 1437 C LEU A 526 -0.070 13.115 12.999 1.00 63.13 C ATOM 1438 O LEU A 526 0.812 13.923 13.306 1.00 44.10 O ATOM 1439 CB LEU A 526 -1.422 12.036 14.819 1.00 45.31 C ATOM 1440 CG LEU A 526 -2.696 11.955 15.678 1.00 32.23 C ATOM 1441 CD1 LEU A 526 -2.628 10.772 16.643 1.00 53.40 C ATOM 1442 CD2 LEU A 526 -2.914 13.262 16.438 1.00 53.23 C ATOM 0 H LEU A 526 -2.838 11.889 12.759 1.00 25.43 H new ATOM 0 HA LEU A 526 -1.584 14.096 14.166 1.00 52.43 H new ATOM 0 HB2 LEU A 526 -1.259 11.066 14.350 1.00 45.31 H new ATOM 0 HB3 LEU A 526 -0.573 12.219 15.477 1.00 45.31 H new ATOM 0 HG LEU A 526 -3.546 11.799 15.013 1.00 32.23 H new ATOM 0 HD11 LEU A 526 -3.540 10.736 17.239 1.00 53.40 H new ATOM 0 HD12 LEU A 526 -2.528 9.846 16.077 1.00 53.40 H new ATOM 0 HD13 LEU A 526 -1.768 10.889 17.302 1.00 53.40 H new ATOM 0 HD21 LEU A 526 -3.819 13.186 17.040 1.00 53.23 H new ATOM 0 HD22 LEU A 526 -2.060 13.451 17.089 1.00 53.23 H new ATOM 0 HD23 LEU A 526 -3.018 14.083 15.728 1.00 53.23 H new ATOM 1454 N ASN A 527 0.088 12.210 12.036 1.00 64.20 N ATOM 1455 CA ASN A 527 1.344 12.069 11.293 1.00 64.01 C ATOM 1456 C ASN A 527 1.075 11.840 9.799 1.00 42.01 C ATOM 1457 O ASN A 527 -0.013 11.428 9.409 1.00 63.13 O ATOM 1458 CB ASN A 527 2.164 10.903 11.870 1.00 23.44 C ATOM 1459 CG ASN A 527 3.549 10.790 11.255 1.00 44.44 C ATOM 1460 OD1 ASN A 527 4.148 11.780 10.852 1.00 2.43 O ATOM 1461 ND2 ASN A 527 4.069 9.583 11.171 1.00 21.54 N ATOM 0 H ASN A 527 -0.642 11.558 11.748 1.00 64.20 H new ATOM 0 HA ASN A 527 1.912 12.993 11.397 1.00 64.01 H new ATOM 0 HB2 ASN A 527 2.261 11.032 12.948 1.00 23.44 H new ATOM 0 HB3 ASN A 527 1.623 9.971 11.708 1.00 23.44 H new ATOM 0 HD21 ASN A 527 4.994 9.454 10.762 1.00 21.54 H new ATOM 0 HD22 ASN A 527 3.546 8.777 11.515 1.00 21.54 H new ATOM 1468 N GLU A 528 2.073 12.131 8.969 1.00 62.24 N ATOM 1469 CA GLU A 528 1.972 11.916 7.520 1.00 32.43 C ATOM 1470 C GLU A 528 3.181 11.130 6.979 1.00 3.42 C ATOM 1471 O GLU A 528 3.205 10.725 5.816 1.00 72.24 O ATOM 1472 CB GLU A 528 1.865 13.265 6.797 1.00 54.51 C ATOM 1473 CG GLU A 528 2.978 14.243 7.159 1.00 3.52 C ATOM 1474 CD GLU A 528 2.947 15.506 6.315 1.00 73.43 C ATOM 1475 OE1 GLU A 528 2.035 16.337 6.506 1.00 44.44 O ATOM 1476 OE2 GLU A 528 3.840 15.673 5.456 1.00 40.20 O ATOM 0 H GLU A 528 2.967 12.518 9.272 1.00 62.24 H new ATOM 0 HA GLU A 528 1.075 11.326 7.332 1.00 32.43 H new ATOM 0 HB2 GLU A 528 1.880 13.093 5.721 1.00 54.51 H new ATOM 0 HB3 GLU A 528 0.903 13.719 7.034 1.00 54.51 H new ATOM 0 HG2 GLU A 528 2.891 14.512 8.212 1.00 3.52 H new ATOM 0 HG3 GLU A 528 3.943 13.751 7.034 1.00 3.52 H new ATOM 1483 N ASN A 529 4.183 10.918 7.832 1.00 23.23 N ATOM 1484 CA ASN A 529 5.420 10.238 7.425 1.00 55.23 C ATOM 1485 C ASN A 529 5.242 8.712 7.321 1.00 0.30 C ATOM 1486 O ASN A 529 6.020 8.037 6.649 1.00 73.32 O ATOM 1487 CB ASN A 529 6.547 10.561 8.412 1.00 14.44 C ATOM 1488 CG ASN A 529 6.955 12.023 8.378 1.00 62.24 C ATOM 1489 OD1 ASN A 529 6.419 12.853 9.108 1.00 70.13 O ATOM 1490 ND2 ASN A 529 7.911 12.348 7.532 1.00 22.22 N ATOM 0 H ASN A 529 4.166 11.206 8.810 1.00 23.23 H new ATOM 0 HA ASN A 529 5.678 10.607 6.432 1.00 55.23 H new ATOM 0 HB2 ASN A 529 6.226 10.301 9.421 1.00 14.44 H new ATOM 0 HB3 ASN A 529 7.414 9.941 8.183 1.00 14.44 H new ATOM 0 HD21 ASN A 529 8.228 13.315 7.468 1.00 22.22 H new ATOM 0 HD22 ASN A 529 8.334 11.632 6.941 1.00 22.22 H new ATOM 1497 N ASN A 530 4.223 8.175 7.982 1.00 21.40 N ATOM 1498 CA ASN A 530 3.987 6.720 7.998 1.00 1.21 C ATOM 1499 C ASN A 530 2.860 6.303 7.034 1.00 10.04 C ATOM 1500 O ASN A 530 2.478 5.131 6.985 1.00 4.34 O ATOM 1501 CB ASN A 530 3.666 6.253 9.425 1.00 34.23 C ATOM 1502 CG ASN A 530 2.487 6.987 10.036 1.00 52.03 C ATOM 1503 OD1 ASN A 530 2.247 8.151 9.742 1.00 64.02 O ATOM 1504 ND2 ASN A 530 1.755 6.320 10.903 1.00 24.41 N ATOM 0 H ASN A 530 3.543 8.717 8.516 1.00 21.40 H new ATOM 0 HA ASN A 530 4.902 6.237 7.655 1.00 1.21 H new ATOM 0 HB2 ASN A 530 3.455 5.184 9.413 1.00 34.23 H new ATOM 0 HB3 ASN A 530 4.544 6.398 10.055 1.00 34.23 H new ATOM 0 HD21 ASN A 530 0.959 6.772 11.353 1.00 24.41 H new ATOM 0 HD22 ASN A 530 1.984 5.351 11.125 1.00 24.41 H new ATOM 1511 N ASN A 531 2.348 7.257 6.257 1.00 4.23 N ATOM 1512 CA ASN A 531 1.268 6.985 5.298 1.00 70.30 C ATOM 1513 C ASN A 531 1.798 6.395 3.977 1.00 55.42 C ATOM 1514 O ASN A 531 1.024 6.134 3.053 1.00 42.12 O ATOM 1515 CB ASN A 531 0.472 8.267 5.005 1.00 44.42 C ATOM 1516 CG ASN A 531 -0.137 8.880 6.255 1.00 41.52 C ATOM 1517 OD1 ASN A 531 0.472 8.884 7.317 1.00 33.51 O ATOM 1518 ND2 ASN A 531 -1.349 9.388 6.135 1.00 45.41 N ATOM 0 H ASN A 531 2.662 8.228 6.270 1.00 4.23 H new ATOM 0 HA ASN A 531 0.615 6.244 5.759 1.00 70.30 H new ATOM 0 HB2 ASN A 531 1.129 8.997 4.531 1.00 44.42 H new ATOM 0 HB3 ASN A 531 -0.322 8.042 4.293 1.00 44.42 H new ATOM 0 HD21 ASN A 531 -1.811 9.803 6.944 1.00 45.41 H new ATOM 0 HD22 ASN A 531 -1.824 9.366 5.233 1.00 45.41 H new ATOM 1525 N VAL A 532 3.116 6.191 3.887 1.00 42.35 N ATOM 1526 CA VAL A 532 3.741 5.636 2.675 1.00 41.30 C ATOM 1527 C VAL A 532 4.701 4.477 3.010 1.00 13.10 C ATOM 1528 O VAL A 532 5.583 4.609 3.859 1.00 14.44 O ATOM 1529 CB VAL A 532 4.530 6.721 1.889 1.00 35.34 C ATOM 1530 CG1 VAL A 532 5.160 6.135 0.622 1.00 32.43 C ATOM 1531 CG2 VAL A 532 3.636 7.914 1.550 1.00 53.12 C ATOM 0 H VAL A 532 3.774 6.401 4.638 1.00 42.35 H new ATOM 0 HA VAL A 532 2.925 5.262 2.056 1.00 41.30 H new ATOM 0 HB VAL A 532 5.335 7.076 2.532 1.00 35.34 H new ATOM 0 HG11 VAL A 532 5.705 6.916 0.092 1.00 32.43 H new ATOM 0 HG12 VAL A 532 5.847 5.334 0.894 1.00 32.43 H new ATOM 0 HG13 VAL A 532 4.377 5.738 -0.024 1.00 32.43 H new ATOM 0 HG21 VAL A 532 4.214 8.657 1.001 1.00 53.12 H new ATOM 0 HG22 VAL A 532 2.799 7.579 0.937 1.00 53.12 H new ATOM 0 HG23 VAL A 532 3.257 8.358 2.471 1.00 53.12 H new ATOM 1541 N ALA A 533 4.533 3.352 2.320 1.00 1.14 N ATOM 1542 CA ALA A 533 5.421 2.194 2.473 1.00 32.45 C ATOM 1543 C ALA A 533 6.189 1.921 1.170 1.00 31.45 C ATOM 1544 O ALA A 533 5.612 1.964 0.082 1.00 34.12 O ATOM 1545 CB ALA A 533 4.619 0.964 2.884 1.00 54.43 C ATOM 0 H ALA A 533 3.784 3.214 1.642 1.00 1.14 H new ATOM 0 HA ALA A 533 6.145 2.418 3.256 1.00 32.45 H new ATOM 0 HB1 ALA A 533 5.290 0.112 2.994 1.00 54.43 H new ATOM 0 HB2 ALA A 533 4.118 1.156 3.833 1.00 54.43 H new ATOM 0 HB3 ALA A 533 3.874 0.743 2.119 1.00 54.43 H new ATOM 1551 N THR A 534 7.489 1.647 1.282 1.00 55.40 N ATOM 1552 CA THR A 534 8.341 1.402 0.106 1.00 15.04 C ATOM 1553 C THR A 534 8.928 -0.019 0.120 1.00 61.24 C ATOM 1554 O THR A 534 9.497 -0.453 1.121 1.00 60.53 O ATOM 1555 CB THR A 534 9.502 2.428 0.038 1.00 53.24 C ATOM 1556 OG1 THR A 534 8.982 3.770 0.035 1.00 74.33 O ATOM 1557 CG2 THR A 534 10.361 2.213 -1.206 1.00 23.31 C ATOM 0 H THR A 534 7.980 1.588 2.174 1.00 55.40 H new ATOM 0 HA THR A 534 7.706 1.513 -0.773 1.00 15.04 H new ATOM 0 HB THR A 534 10.126 2.280 0.919 1.00 53.24 H new ATOM 0 HG1 THR A 534 9.724 4.408 -0.007 1.00 74.33 H new ATOM 0 HG21 THR A 534 11.166 2.948 -1.224 1.00 23.31 H new ATOM 0 HG22 THR A 534 10.786 1.210 -1.185 1.00 23.31 H new ATOM 0 HG23 THR A 534 9.745 2.328 -2.098 1.00 23.31 H new ATOM 1565 N PHE A 535 8.789 -0.740 -0.992 1.00 33.11 N ATOM 1566 CA PHE A 535 9.313 -2.111 -1.100 1.00 4.21 C ATOM 1567 C PHE A 535 9.937 -2.362 -2.484 1.00 14.24 C ATOM 1568 O PHE A 535 9.319 -2.090 -3.512 1.00 42.45 O ATOM 1569 CB PHE A 535 8.182 -3.119 -0.834 1.00 62.04 C ATOM 1570 CG PHE A 535 8.636 -4.558 -0.760 1.00 2.02 C ATOM 1571 CD1 PHE A 535 9.153 -5.075 0.419 1.00 21.20 C ATOM 1572 CD2 PHE A 535 8.540 -5.394 -1.867 1.00 34.32 C ATOM 1573 CE1 PHE A 535 9.568 -6.392 0.493 1.00 74.23 C ATOM 1574 CE2 PHE A 535 8.956 -6.712 -1.796 1.00 62.43 C ATOM 1575 CZ PHE A 535 9.468 -7.212 -0.615 1.00 52.24 C ATOM 0 H PHE A 535 8.319 -0.403 -1.832 1.00 33.11 H new ATOM 0 HA PHE A 535 10.097 -2.240 -0.354 1.00 4.21 H new ATOM 0 HB2 PHE A 535 7.690 -2.857 0.103 1.00 62.04 H new ATOM 0 HB3 PHE A 535 7.435 -3.026 -1.623 1.00 62.04 H new ATOM 0 HD1 PHE A 535 9.232 -4.441 1.290 1.00 21.20 H new ATOM 0 HD2 PHE A 535 8.136 -5.011 -2.792 1.00 34.32 H new ATOM 0 HE1 PHE A 535 9.970 -6.780 1.417 1.00 74.23 H new ATOM 0 HE2 PHE A 535 8.880 -7.350 -2.664 1.00 62.43 H new ATOM 0 HZ PHE A 535 9.790 -8.241 -0.557 1.00 52.24 H new ATOM 1585 N ASP A 536 11.168 -2.879 -2.500 1.00 12.24 N ATOM 1586 CA ASP A 536 11.870 -3.187 -3.756 1.00 72.21 C ATOM 1587 C ASP A 536 11.697 -4.664 -4.158 1.00 24.53 C ATOM 1588 O ASP A 536 11.787 -5.559 -3.317 1.00 2.13 O ATOM 1589 CB ASP A 536 13.367 -2.872 -3.626 1.00 71.02 C ATOM 1590 CG ASP A 536 13.644 -1.396 -3.396 1.00 53.23 C ATOM 1591 OD1 ASP A 536 13.774 -0.649 -4.386 1.00 35.21 O ATOM 1592 OD2 ASP A 536 13.750 -0.977 -2.225 1.00 71.32 O ATOM 0 H ASP A 536 11.703 -3.095 -1.658 1.00 12.24 H new ATOM 0 HA ASP A 536 11.428 -2.563 -4.533 1.00 72.21 H new ATOM 0 HB2 ASP A 536 13.784 -3.448 -2.799 1.00 71.02 H new ATOM 0 HB3 ASP A 536 13.881 -3.196 -4.531 1.00 71.02 H new ATOM 1597 N VAL A 537 11.461 -4.912 -5.445 1.00 43.14 N ATOM 1598 CA VAL A 537 11.336 -6.280 -5.975 1.00 60.11 C ATOM 1599 C VAL A 537 12.343 -6.524 -7.118 1.00 2.43 C ATOM 1600 O VAL A 537 12.586 -5.644 -7.945 1.00 11.22 O ATOM 1601 CB VAL A 537 9.901 -6.546 -6.505 1.00 40.21 C ATOM 1602 CG1 VAL A 537 9.759 -7.984 -7.006 1.00 23.21 C ATOM 1603 CG2 VAL A 537 8.855 -6.238 -5.434 1.00 54.53 C ATOM 0 H VAL A 537 11.351 -4.182 -6.149 1.00 43.14 H new ATOM 0 HA VAL A 537 11.548 -6.963 -5.152 1.00 60.11 H new ATOM 0 HB VAL A 537 9.728 -5.877 -7.348 1.00 40.21 H new ATOM 0 HG11 VAL A 537 8.745 -8.143 -7.372 1.00 23.21 H new ATOM 0 HG12 VAL A 537 10.468 -8.159 -7.815 1.00 23.21 H new ATOM 0 HG13 VAL A 537 9.963 -8.676 -6.189 1.00 23.21 H new ATOM 0 HG21 VAL A 537 7.859 -6.433 -5.832 1.00 54.53 H new ATOM 0 HG22 VAL A 537 9.028 -6.871 -4.563 1.00 54.53 H new ATOM 0 HG23 VAL A 537 8.931 -5.191 -5.142 1.00 54.53 H new ATOM 1613 N SER A 538 12.923 -7.721 -7.161 1.00 44.22 N ATOM 1614 CA SER A 538 13.903 -8.083 -8.199 1.00 72.10 C ATOM 1615 C SER A 538 13.348 -9.165 -9.137 1.00 1.23 C ATOM 1616 O SER A 538 13.088 -10.292 -8.718 1.00 51.53 O ATOM 1617 CB SER A 538 15.202 -8.579 -7.547 1.00 74.31 C ATOM 1618 OG SER A 538 16.177 -8.949 -8.514 1.00 33.45 O ATOM 0 H SER A 538 12.734 -8.464 -6.489 1.00 44.22 H new ATOM 0 HA SER A 538 14.109 -7.191 -8.791 1.00 72.10 H new ATOM 0 HB2 SER A 538 15.607 -7.797 -6.905 1.00 74.31 H new ATOM 0 HB3 SER A 538 14.983 -9.434 -6.908 1.00 74.31 H new ATOM 0 HG SER A 538 16.988 -9.257 -8.059 1.00 33.45 H new ATOM 1624 N VAL A 539 13.158 -8.814 -10.407 1.00 5.00 N ATOM 1625 CA VAL A 539 12.632 -9.756 -11.404 1.00 14.13 C ATOM 1626 C VAL A 539 13.761 -10.350 -12.264 1.00 33.32 C ATOM 1627 O VAL A 539 14.531 -9.618 -12.896 1.00 54.44 O ATOM 1628 CB VAL A 539 11.590 -9.074 -12.327 1.00 1.44 C ATOM 1629 CG1 VAL A 539 10.960 -10.088 -13.285 1.00 54.23 C ATOM 1630 CG2 VAL A 539 10.520 -8.362 -11.499 1.00 73.43 C ATOM 0 H VAL A 539 13.359 -7.884 -10.775 1.00 5.00 H new ATOM 0 HA VAL A 539 12.146 -10.561 -10.853 1.00 14.13 H new ATOM 0 HB VAL A 539 12.106 -8.325 -12.928 1.00 1.44 H new ATOM 0 HG11 VAL A 539 10.233 -9.584 -13.921 1.00 54.23 H new ATOM 0 HG12 VAL A 539 11.737 -10.534 -13.905 1.00 54.23 H new ATOM 0 HG13 VAL A 539 10.461 -10.869 -12.711 1.00 54.23 H new ATOM 0 HG21 VAL A 539 9.798 -7.890 -12.166 1.00 73.43 H new ATOM 0 HG22 VAL A 539 10.009 -9.086 -10.865 1.00 73.43 H new ATOM 0 HG23 VAL A 539 10.989 -7.601 -10.875 1.00 73.43 H new ATOM 1640 N VAL A 540 13.848 -11.676 -12.290 1.00 11.42 N ATOM 1641 CA VAL A 540 14.902 -12.379 -13.033 1.00 74.52 C ATOM 1642 C VAL A 540 14.332 -13.241 -14.176 1.00 61.02 C ATOM 1643 O VAL A 540 13.142 -13.555 -14.208 1.00 75.22 O ATOM 1644 CB VAL A 540 15.744 -13.273 -12.084 1.00 22.35 C ATOM 1645 CG1 VAL A 540 16.499 -12.421 -11.064 1.00 51.40 C ATOM 1646 CG2 VAL A 540 14.855 -14.294 -11.379 1.00 10.01 C ATOM 0 H VAL A 540 13.199 -12.294 -11.803 1.00 11.42 H new ATOM 0 HA VAL A 540 15.539 -11.611 -13.472 1.00 74.52 H new ATOM 0 HB VAL A 540 16.476 -13.812 -12.685 1.00 22.35 H new ATOM 0 HG11 VAL A 540 17.082 -13.069 -10.409 1.00 51.40 H new ATOM 0 HG12 VAL A 540 17.167 -11.736 -11.586 1.00 51.40 H new ATOM 0 HG13 VAL A 540 15.787 -11.850 -10.468 1.00 51.40 H new ATOM 0 HG21 VAL A 540 15.463 -14.911 -10.718 1.00 10.01 H new ATOM 0 HG22 VAL A 540 14.097 -13.774 -10.794 1.00 10.01 H new ATOM 0 HG23 VAL A 540 14.369 -14.927 -12.121 1.00 10.01 H new ATOM 1656 N LEU A 541 15.202 -13.631 -15.107 1.00 52.02 N ATOM 1657 CA LEU A 541 14.808 -14.447 -16.269 1.00 2.10 C ATOM 1658 C LEU A 541 14.929 -15.953 -15.978 1.00 23.22 C ATOM 1659 O LEU A 541 14.892 -16.775 -16.894 1.00 52.51 O ATOM 1660 CB LEU A 541 15.698 -14.096 -17.471 1.00 75.02 C ATOM 1661 CG LEU A 541 15.536 -12.674 -18.030 1.00 13.11 C ATOM 1662 CD1 LEU A 541 16.597 -12.383 -19.089 1.00 1.10 C ATOM 1663 CD2 LEU A 541 14.132 -12.480 -18.605 1.00 24.33 C ATOM 0 H LEU A 541 16.194 -13.396 -15.083 1.00 52.02 H new ATOM 0 HA LEU A 541 13.764 -14.225 -16.489 1.00 2.10 H new ATOM 0 HB2 LEU A 541 16.739 -14.236 -17.181 1.00 75.02 H new ATOM 0 HB3 LEU A 541 15.492 -14.807 -18.272 1.00 75.02 H new ATOM 0 HG LEU A 541 15.673 -11.968 -17.211 1.00 13.11 H new ATOM 0 HD11 LEU A 541 16.462 -11.371 -19.470 1.00 1.10 H new ATOM 0 HD12 LEU A 541 17.588 -12.475 -18.646 1.00 1.10 H new ATOM 0 HD13 LEU A 541 16.498 -13.095 -19.908 1.00 1.10 H new ATOM 0 HD21 LEU A 541 14.036 -11.467 -18.996 1.00 24.33 H new ATOM 0 HD22 LEU A 541 13.966 -13.197 -19.409 1.00 24.33 H new ATOM 0 HD23 LEU A 541 13.392 -12.637 -17.820 1.00 24.33 H new ATOM 1675 N GLU A 542 15.056 -16.306 -14.705 1.00 54.00 N ATOM 1676 CA GLU A 542 15.350 -17.691 -14.306 1.00 12.42 C ATOM 1677 C GLU A 542 14.647 -18.092 -12.989 1.00 40.54 C ATOM 1678 O GLU A 542 14.859 -17.418 -11.959 1.00 37.19 O ATOM 1679 CB GLU A 542 16.871 -17.853 -14.191 1.00 13.24 C ATOM 1680 CG GLU A 542 17.541 -16.757 -13.366 1.00 75.43 C ATOM 1681 CD GLU A 542 19.033 -16.657 -13.623 1.00 21.20 C ATOM 1682 OE1 GLU A 542 19.428 -15.945 -14.573 1.00 2.24 O ATOM 1683 OE2 GLU A 542 19.819 -17.282 -12.879 1.00 51.23 O ATOM 0 H GLU A 542 14.961 -15.656 -13.924 1.00 54.00 H new ATOM 0 HA GLU A 542 14.958 -18.362 -15.070 1.00 12.42 H new ATOM 0 HB2 GLU A 542 17.092 -18.821 -13.742 1.00 13.24 H new ATOM 0 HB3 GLU A 542 17.304 -17.860 -15.191 1.00 13.24 H new ATOM 0 HG2 GLU A 542 17.073 -15.799 -13.594 1.00 75.43 H new ATOM 0 HG3 GLU A 542 17.372 -16.951 -12.307 1.00 75.43 H new TER 1690 GLU A 542