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 472 SER OG : rot -131:sc= 0.329 USER MOD Set 1.2: A 522 THR OG1 : rot -81:sc= 0.126 USER MOD Set 2.1: A 478 TYR OH : rot -17:sc= 0.251 USER MOD Set 2.2: A 516 THR OG1 : rot 69:sc= -0.598 USER MOD Set 3.1: A 514 ASN : amide:sc= -0.544 K(o=-0.56,f=1.3) USER MOD Set 3.2: A 534 THR OG1 : rot 180:sc= -0.0194 USER MOD Set 4.1: A 441 THR OG1 : rot 64:sc= 0.764 USER MOD Set 4.2: A 530 ASN : amide:sc= -1.68! C(o=-0.91!,f=-2.1!) USER MOD Single : A 435 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -3.07! K(o=-3.1!,f=-1.2) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -145:sc= 0.595 USER MOD Single : A 461 HIS : no HE2:sc= 0.874 K(o=0.87,f=-2.9!) USER MOD Single : A 463 LYS NZ :NH3+ -126:sc= -0.473 (180deg=-2.62!) USER MOD Single : A 464 ASN : amide:sc= -0.388 K(o=-0.39,f=-8.7!) USER MOD Single : A 473 THR OG1 : rot 96:sc= 0.0454 USER MOD Single : A 474 LYS NZ :NH3+ 166:sc= 1.27 (180deg=1.16) USER MOD Single : A 480 ASN : amide:sc= -0.339 K(o=-0.34,f=-6.5!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 170:sc= -0.23 USER MOD Single : A 485 LYS NZ :NH3+ -176:sc= 1.11 (180deg=1.11) USER MOD Single : A 486 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 488 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ 164:sc= 1.13 (180deg=0.944) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 44:sc= 0.394 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 510 MET CE :methyl -125:sc= -0.0079 (180deg=-0.864) USER MOD Single : A 511 TYR OH : rot 33:sc= 0.63 USER MOD Single : A 521 ASN : amide:sc= -0.273 X(o=-0.27,f=-0.18) USER MOD Single : A 527 ASN : amide:sc= -1.7 K(o=-1.7,f=-8.7!) USER MOD Single : A 529 ASN : amide:sc= -0.686 K(o=-0.69,f=0) USER MOD Single : A 531 ASN : amide:sc= -4.17! C(o=-4.2!,f=-3.5!) USER MOD Single : A 538 SER OG : rot 77:sc= 0.218 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 435 -9.791 17.173 21.021 1.00 54.22 N ATOM 2 CA MET A 435 -9.610 17.020 19.551 1.00 5.15 C ATOM 3 C MET A 435 -8.840 15.733 19.222 1.00 54.00 C ATOM 4 O MET A 435 -7.673 15.591 19.580 1.00 52.43 O ATOM 5 CB MET A 435 -8.860 18.232 18.975 1.00 12.31 C ATOM 6 CG MET A 435 -9.608 19.551 19.120 1.00 45.21 C ATOM 7 SD MET A 435 -11.208 19.520 18.290 1.00 74.40 S ATOM 8 CE MET A 435 -11.793 21.182 18.609 1.00 52.41 C ATOM 0 HA MET A 435 -10.599 16.960 19.097 1.00 5.15 H new ATOM 0 HB2 MET A 435 -7.894 18.318 19.472 1.00 12.31 H new ATOM 0 HB3 MET A 435 -8.660 18.054 17.918 1.00 12.31 H new ATOM 0 HG2 MET A 435 -9.753 19.770 20.178 1.00 45.21 H new ATOM 0 HG3 MET A 435 -9.002 20.358 18.708 1.00 45.21 H new ATOM 0 HE1 MET A 435 -12.775 21.315 18.156 1.00 52.41 H new ATOM 0 HE2 MET A 435 -11.865 21.342 19.685 1.00 52.41 H new ATOM 0 HE3 MET A 435 -11.095 21.902 18.181 1.00 52.41 H new ATOM 20 N GLU A 436 -9.505 14.792 18.555 1.00 65.53 N ATOM 21 CA GLU A 436 -8.870 13.533 18.141 1.00 3.21 C ATOM 22 C GLU A 436 -8.491 13.567 16.655 1.00 14.44 C ATOM 23 O GLU A 436 -9.306 13.927 15.803 1.00 13.12 O ATOM 24 CB GLU A 436 -9.804 12.336 18.399 1.00 62.21 C ATOM 25 CG GLU A 436 -10.025 12.007 19.875 1.00 55.44 C ATOM 26 CD GLU A 436 -10.696 13.133 20.647 1.00 75.31 C ATOM 27 OE1 GLU A 436 -11.873 13.440 20.356 1.00 74.23 O ATOM 28 OE2 GLU A 436 -10.049 13.724 21.541 1.00 63.43 O ATOM 0 H GLU A 436 -10.486 14.874 18.287 1.00 65.53 H new ATOM 0 HA GLU A 436 -7.964 13.417 18.736 1.00 3.21 H new ATOM 0 HB2 GLU A 436 -10.770 12.540 17.937 1.00 62.21 H new ATOM 0 HB3 GLU A 436 -9.392 11.457 17.902 1.00 62.21 H new ATOM 0 HG2 GLU A 436 -10.636 11.108 19.952 1.00 55.44 H new ATOM 0 HG3 GLU A 436 -9.064 11.780 20.338 1.00 55.44 H new ATOM 35 N PHE A 437 -7.253 13.194 16.349 1.00 42.54 N ATOM 36 CA PHE A 437 -6.797 13.098 14.960 1.00 71.05 C ATOM 37 C PHE A 437 -6.387 11.657 14.619 1.00 54.10 C ATOM 38 O PHE A 437 -5.844 10.943 15.464 1.00 21.41 O ATOM 39 CB PHE A 437 -5.630 14.061 14.707 1.00 20.34 C ATOM 40 CG PHE A 437 -5.997 15.512 14.910 1.00 71.42 C ATOM 41 CD1 PHE A 437 -6.523 16.262 13.866 1.00 12.00 C ATOM 42 CD2 PHE A 437 -5.826 16.121 16.145 1.00 12.04 C ATOM 43 CE1 PHE A 437 -6.869 17.588 14.052 1.00 73.21 C ATOM 44 CE2 PHE A 437 -6.170 17.447 16.334 1.00 33.41 C ATOM 45 CZ PHE A 437 -6.693 18.180 15.286 1.00 54.31 C ATOM 0 H PHE A 437 -6.544 12.952 17.042 1.00 42.54 H new ATOM 0 HA PHE A 437 -7.626 13.381 14.311 1.00 71.05 H new ATOM 0 HB2 PHE A 437 -4.806 13.805 15.373 1.00 20.34 H new ATOM 0 HB3 PHE A 437 -5.270 13.924 13.687 1.00 20.34 H new ATOM 0 HD1 PHE A 437 -6.663 15.804 12.898 1.00 12.00 H new ATOM 0 HD2 PHE A 437 -5.419 15.553 16.968 1.00 12.04 H new ATOM 0 HE1 PHE A 437 -7.277 18.160 13.232 1.00 73.21 H new ATOM 0 HE2 PHE A 437 -6.030 17.909 17.300 1.00 33.41 H new ATOM 0 HZ PHE A 437 -6.964 19.215 15.432 1.00 54.31 H new ATOM 55 N PRO A 438 -6.658 11.203 13.385 1.00 23.44 N ATOM 56 CA PRO A 438 -6.338 9.841 12.966 1.00 52.31 C ATOM 57 C PRO A 438 -4.862 9.648 12.581 1.00 41.21 C ATOM 58 O PRO A 438 -4.073 10.596 12.566 1.00 45.34 O ATOM 59 CB PRO A 438 -7.261 9.598 11.767 1.00 50.40 C ATOM 60 CG PRO A 438 -7.692 10.948 11.278 1.00 43.10 C ATOM 61 CD PRO A 438 -7.281 11.981 12.303 1.00 50.22 C ATOM 0 HA PRO A 438 -6.489 9.133 13.781 1.00 52.31 H new ATOM 0 HB2 PRO A 438 -6.740 9.050 10.982 1.00 50.40 H new ATOM 0 HB3 PRO A 438 -8.123 8.998 12.057 1.00 50.40 H new ATOM 0 HG2 PRO A 438 -7.232 11.167 10.314 1.00 43.10 H new ATOM 0 HG3 PRO A 438 -8.772 10.970 11.129 1.00 43.10 H new ATOM 0 HD2 PRO A 438 -6.582 12.702 11.880 1.00 50.22 H new ATOM 0 HD3 PRO A 438 -8.141 12.545 12.665 1.00 50.22 H new ATOM 69 N ASP A 439 -4.497 8.400 12.305 1.00 2.42 N ATOM 70 CA ASP A 439 -3.132 8.052 11.905 1.00 51.03 C ATOM 71 C ASP A 439 -3.159 6.833 10.964 1.00 21.13 C ATOM 72 O ASP A 439 -3.018 5.689 11.400 1.00 51.13 O ATOM 73 CB ASP A 439 -2.282 7.769 13.150 1.00 54.23 C ATOM 74 CG ASP A 439 -0.791 7.753 12.863 1.00 12.20 C ATOM 75 OD1 ASP A 439 -0.266 6.699 12.449 1.00 73.20 O ATOM 76 OD2 ASP A 439 -0.131 8.792 13.078 1.00 42.41 O ATOM 0 H ASP A 439 -5.132 7.603 12.351 1.00 2.42 H new ATOM 0 HA ASP A 439 -2.684 8.888 11.368 1.00 51.03 H new ATOM 0 HB2 ASP A 439 -2.492 8.526 13.906 1.00 54.23 H new ATOM 0 HB3 ASP A 439 -2.575 6.808 13.572 1.00 54.23 H new ATOM 81 N LEU A 440 -3.404 7.088 9.685 1.00 41.14 N ATOM 82 CA LEU A 440 -3.532 6.024 8.685 1.00 60.13 C ATOM 83 C LEU A 440 -2.165 5.591 8.136 1.00 32.53 C ATOM 84 O LEU A 440 -1.475 6.364 7.472 1.00 30.22 O ATOM 85 CB LEU A 440 -4.430 6.495 7.529 1.00 11.31 C ATOM 86 CG LEU A 440 -5.878 6.843 7.913 1.00 44.42 C ATOM 87 CD1 LEU A 440 -6.622 7.444 6.721 1.00 72.20 C ATOM 88 CD2 LEU A 440 -6.609 5.614 8.448 1.00 23.32 C ATOM 0 H LEU A 440 -3.520 8.029 9.309 1.00 41.14 H new ATOM 0 HA LEU A 440 -3.984 5.162 9.176 1.00 60.13 H new ATOM 0 HB2 LEU A 440 -3.973 7.373 7.072 1.00 11.31 H new ATOM 0 HB3 LEU A 440 -4.452 5.715 6.768 1.00 11.31 H new ATOM 0 HG LEU A 440 -5.850 7.589 8.707 1.00 44.42 H new ATOM 0 HD11 LEU A 440 -7.644 7.683 7.013 1.00 72.20 H new ATOM 0 HD12 LEU A 440 -6.115 8.353 6.396 1.00 72.20 H new ATOM 0 HD13 LEU A 440 -6.638 6.725 5.902 1.00 72.20 H new ATOM 0 HD21 LEU A 440 -7.631 5.885 8.713 1.00 23.32 H new ATOM 0 HD22 LEU A 440 -6.626 4.839 7.682 1.00 23.32 H new ATOM 0 HD23 LEU A 440 -6.092 5.239 9.332 1.00 23.32 H new ATOM 100 N THR A 441 -1.786 4.348 8.411 1.00 44.41 N ATOM 101 CA THR A 441 -0.533 3.787 7.891 1.00 34.03 C ATOM 102 C THR A 441 -0.776 2.467 7.153 1.00 45.24 C ATOM 103 O THR A 441 -1.790 1.794 7.369 1.00 31.40 O ATOM 104 CB THR A 441 0.508 3.555 9.012 1.00 21.32 C ATOM 105 OG1 THR A 441 1.729 3.036 8.455 1.00 63.13 O ATOM 106 CG2 THR A 441 -0.016 2.599 10.076 1.00 10.41 C ATOM 0 H THR A 441 -2.325 3.705 8.991 1.00 44.41 H new ATOM 0 HA THR A 441 -0.136 4.524 7.193 1.00 34.03 H new ATOM 0 HB THR A 441 0.701 4.517 9.486 1.00 21.32 H new ATOM 0 HG1 THR A 441 2.125 3.703 7.857 1.00 63.13 H new ATOM 0 HG21 THR A 441 0.743 2.461 10.846 1.00 10.41 H new ATOM 0 HG22 THR A 441 -0.918 3.014 10.526 1.00 10.41 H new ATOM 0 HG23 THR A 441 -0.248 1.637 9.619 1.00 10.41 H new ATOM 114 N VAL A 442 0.163 2.100 6.285 1.00 13.12 N ATOM 115 CA VAL A 442 0.041 0.892 5.465 1.00 21.24 C ATOM 116 C VAL A 442 1.333 0.050 5.511 1.00 65.32 C ATOM 117 O VAL A 442 2.435 0.590 5.644 1.00 61.14 O ATOM 118 CB VAL A 442 -0.293 1.254 3.989 1.00 62.32 C ATOM 119 CG1 VAL A 442 -1.621 2.008 3.892 1.00 22.40 C ATOM 120 CG2 VAL A 442 0.826 2.083 3.361 1.00 44.44 C ATOM 0 H VAL A 442 1.024 2.624 6.129 1.00 13.12 H new ATOM 0 HA VAL A 442 -0.775 0.301 5.880 1.00 21.24 H new ATOM 0 HB VAL A 442 -0.385 0.319 3.437 1.00 62.32 H new ATOM 0 HG11 VAL A 442 -1.828 2.248 2.849 1.00 22.40 H new ATOM 0 HG12 VAL A 442 -2.423 1.385 4.287 1.00 22.40 H new ATOM 0 HG13 VAL A 442 -1.559 2.930 4.471 1.00 22.40 H new ATOM 0 HG21 VAL A 442 0.567 2.322 2.330 1.00 44.44 H new ATOM 0 HG22 VAL A 442 0.956 3.006 3.926 1.00 44.44 H new ATOM 0 HG23 VAL A 442 1.755 1.513 3.379 1.00 44.44 H new ATOM 130 N GLU A 443 1.189 -1.273 5.406 1.00 13.50 N ATOM 131 CA GLU A 443 2.339 -2.194 5.390 1.00 5.54 C ATOM 132 C GLU A 443 2.308 -3.092 4.143 1.00 71.01 C ATOM 133 O GLU A 443 1.253 -3.612 3.774 1.00 12.40 O ATOM 134 CB GLU A 443 2.337 -3.088 6.645 1.00 43.12 C ATOM 135 CG GLU A 443 2.429 -2.336 7.969 1.00 11.54 C ATOM 136 CD GLU A 443 2.575 -3.279 9.160 1.00 61.15 C ATOM 137 OE1 GLU A 443 1.551 -3.819 9.635 1.00 31.00 O ATOM 138 OE2 GLU A 443 3.723 -3.502 9.612 1.00 3.34 O ATOM 0 H GLU A 443 0.284 -1.737 5.330 1.00 13.50 H new ATOM 0 HA GLU A 443 3.243 -1.586 5.374 1.00 5.54 H new ATOM 0 HB2 GLU A 443 1.426 -3.686 6.646 1.00 43.12 H new ATOM 0 HB3 GLU A 443 3.174 -3.783 6.580 1.00 43.12 H new ATOM 0 HG2 GLU A 443 3.280 -1.656 7.940 1.00 11.54 H new ATOM 0 HG3 GLU A 443 1.537 -1.724 8.100 1.00 11.54 H new ATOM 145 N ILE A 444 3.464 -3.287 3.505 1.00 33.24 N ATOM 146 CA ILE A 444 3.565 -4.160 2.325 1.00 5.52 C ATOM 147 C ILE A 444 4.321 -5.462 2.650 1.00 4.55 C ATOM 148 O ILE A 444 5.434 -5.433 3.181 1.00 2.11 O ATOM 149 CB ILE A 444 4.284 -3.445 1.149 1.00 41.03 C ATOM 150 CG1 ILE A 444 3.586 -2.116 0.810 1.00 20.12 C ATOM 151 CG2 ILE A 444 4.337 -4.352 -0.081 1.00 31.42 C ATOM 152 CD1 ILE A 444 4.282 -1.317 -0.278 1.00 3.11 C ATOM 0 H ILE A 444 4.345 -2.854 3.783 1.00 33.24 H new ATOM 0 HA ILE A 444 2.544 -4.401 2.030 1.00 5.52 H new ATOM 0 HB ILE A 444 5.306 -3.225 1.459 1.00 41.03 H new ATOM 0 HG12 ILE A 444 2.563 -2.324 0.497 1.00 20.12 H new ATOM 0 HG13 ILE A 444 3.526 -1.508 1.712 1.00 20.12 H new ATOM 0 HG21 ILE A 444 4.845 -3.833 -0.894 1.00 31.42 H new ATOM 0 HG22 ILE A 444 4.881 -5.264 0.163 1.00 31.42 H new ATOM 0 HG23 ILE A 444 3.323 -4.606 -0.390 1.00 31.42 H new ATOM 0 HD11 ILE A 444 3.731 -0.394 -0.461 1.00 3.11 H new ATOM 0 HD12 ILE A 444 5.297 -1.077 0.040 1.00 3.11 H new ATOM 0 HD13 ILE A 444 4.318 -1.905 -1.195 1.00 3.11 H new ATOM 164 N LYS A 445 3.715 -6.602 2.325 1.00 22.01 N ATOM 165 CA LYS A 445 4.338 -7.910 2.562 1.00 73.40 C ATOM 166 C LYS A 445 4.331 -8.769 1.283 1.00 41.24 C ATOM 167 O LYS A 445 3.305 -8.883 0.611 1.00 71.20 O ATOM 168 CB LYS A 445 3.590 -8.642 3.688 1.00 34.33 C ATOM 169 CG LYS A 445 4.244 -9.953 4.126 1.00 2.12 C ATOM 170 CD LYS A 445 5.609 -9.720 4.773 1.00 75.33 C ATOM 171 CE LYS A 445 6.251 -11.021 5.240 1.00 24.22 C ATOM 172 NZ LYS A 445 7.559 -10.781 5.909 1.00 31.32 N ATOM 0 H LYS A 445 2.791 -6.650 1.896 1.00 22.01 H new ATOM 0 HA LYS A 445 5.375 -7.748 2.856 1.00 73.40 H new ATOM 0 HB2 LYS A 445 3.517 -7.980 4.551 1.00 34.33 H new ATOM 0 HB3 LYS A 445 2.572 -8.849 3.358 1.00 34.33 H new ATOM 0 HG2 LYS A 445 3.591 -10.467 4.831 1.00 2.12 H new ATOM 0 HG3 LYS A 445 4.359 -10.608 3.262 1.00 2.12 H new ATOM 0 HD2 LYS A 445 6.269 -9.226 4.059 1.00 75.33 H new ATOM 0 HD3 LYS A 445 5.497 -9.046 5.622 1.00 75.33 H new ATOM 0 HE2 LYS A 445 5.578 -11.532 5.929 1.00 24.22 H new ATOM 0 HE3 LYS A 445 6.395 -11.683 4.386 1.00 24.22 H new ATOM 0 HZ1 LYS A 445 7.965 -11.689 6.213 1.00 31.32 H new ATOM 0 HZ2 LYS A 445 8.209 -10.316 5.244 1.00 31.32 H new ATOM 0 HZ3 LYS A 445 7.418 -10.170 6.739 1.00 31.32 H new ATOM 186 N GLY A 446 5.474 -9.363 0.944 1.00 21.23 N ATOM 187 CA GLY A 446 5.543 -10.231 -0.229 1.00 75.13 C ATOM 188 C GLY A 446 6.963 -10.676 -0.581 1.00 42.33 C ATOM 189 O GLY A 446 7.906 -10.408 0.166 1.00 11.14 O ATOM 0 H GLY A 446 6.351 -9.262 1.455 1.00 21.23 H new ATOM 0 HA2 GLY A 446 4.928 -11.114 -0.054 1.00 75.13 H new ATOM 0 HA3 GLY A 446 5.113 -9.708 -1.083 1.00 75.13 H new ATOM 193 N PRO A 447 7.144 -11.373 -1.720 1.00 2.12 N ATOM 194 CA PRO A 447 8.467 -11.852 -2.161 1.00 42.13 C ATOM 195 C PRO A 447 9.376 -10.729 -2.702 1.00 1.52 C ATOM 196 O PRO A 447 8.939 -9.873 -3.476 1.00 2.25 O ATOM 197 CB PRO A 447 8.119 -12.847 -3.275 1.00 32.43 C ATOM 198 CG PRO A 447 6.824 -12.350 -3.828 1.00 73.30 C ATOM 199 CD PRO A 447 6.072 -11.767 -2.658 1.00 30.04 C ATOM 0 HA PRO A 447 9.035 -12.281 -1.335 1.00 42.13 H new ATOM 0 HB2 PRO A 447 8.894 -12.873 -4.041 1.00 32.43 H new ATOM 0 HB3 PRO A 447 8.022 -13.861 -2.886 1.00 32.43 H new ATOM 0 HG2 PRO A 447 6.991 -11.598 -4.599 1.00 73.30 H new ATOM 0 HG3 PRO A 447 6.260 -13.160 -4.290 1.00 73.30 H new ATOM 0 HD2 PRO A 447 5.466 -10.912 -2.957 1.00 30.04 H new ATOM 0 HD3 PRO A 447 5.396 -12.496 -2.212 1.00 30.04 H new ATOM 207 N ASP A 448 10.648 -10.761 -2.298 1.00 32.44 N ATOM 208 CA ASP A 448 11.638 -9.763 -2.718 1.00 2.45 C ATOM 209 C ASP A 448 12.012 -9.915 -4.205 1.00 45.13 C ATOM 210 O ASP A 448 12.050 -8.939 -4.952 1.00 30.01 O ATOM 211 CB ASP A 448 12.902 -9.900 -1.862 1.00 4.34 C ATOM 212 CG ASP A 448 12.630 -9.736 -0.375 1.00 65.45 C ATOM 213 OD1 ASP A 448 12.000 -10.632 0.226 1.00 23.34 O ATOM 214 OD2 ASP A 448 13.074 -8.725 0.208 1.00 52.02 O ATOM 0 H ASP A 448 11.021 -11.476 -1.673 1.00 32.44 H new ATOM 0 HA ASP A 448 11.192 -8.778 -2.581 1.00 2.45 H new ATOM 0 HB2 ASP A 448 13.350 -10.878 -2.039 1.00 4.34 H new ATOM 0 HB3 ASP A 448 13.631 -9.154 -2.177 1.00 4.34 H new ATOM 219 N VAL A 449 12.306 -11.145 -4.624 1.00 35.33 N ATOM 220 CA VAL A 449 12.724 -11.419 -6.004 1.00 32.45 C ATOM 221 C VAL A 449 11.726 -12.349 -6.709 1.00 23.43 C ATOM 222 O VAL A 449 11.422 -13.439 -6.216 1.00 14.50 O ATOM 223 CB VAL A 449 14.137 -12.057 -6.049 1.00 72.11 C ATOM 224 CG1 VAL A 449 14.574 -12.325 -7.490 1.00 22.13 C ATOM 225 CG2 VAL A 449 15.155 -11.170 -5.328 1.00 21.45 C ATOM 0 H VAL A 449 12.263 -11.972 -4.028 1.00 35.33 H new ATOM 0 HA VAL A 449 12.751 -10.462 -6.525 1.00 32.45 H new ATOM 0 HB VAL A 449 14.090 -13.014 -5.530 1.00 72.11 H new ATOM 0 HG11 VAL A 449 15.568 -12.772 -7.492 1.00 22.13 H new ATOM 0 HG12 VAL A 449 13.868 -13.008 -7.963 1.00 22.13 H new ATOM 0 HG13 VAL A 449 14.598 -11.386 -8.044 1.00 22.13 H new ATOM 0 HG21 VAL A 449 16.139 -11.636 -5.372 1.00 21.45 H new ATOM 0 HG22 VAL A 449 15.194 -10.194 -5.812 1.00 21.45 H new ATOM 0 HG23 VAL A 449 14.858 -11.047 -4.287 1.00 21.45 H new ATOM 235 N VAL A 450 11.225 -11.921 -7.865 1.00 15.14 N ATOM 236 CA VAL A 450 10.230 -12.698 -8.615 1.00 23.53 C ATOM 237 C VAL A 450 10.702 -13.003 -10.047 1.00 53.14 C ATOM 238 O VAL A 450 11.598 -12.343 -10.578 1.00 73.41 O ATOM 239 CB VAL A 450 8.867 -11.962 -8.663 1.00 54.30 C ATOM 240 CG1 VAL A 450 8.334 -11.722 -7.251 1.00 41.15 C ATOM 241 CG2 VAL A 450 8.981 -10.646 -9.433 1.00 4.31 C ATOM 0 H VAL A 450 11.489 -11.040 -8.307 1.00 15.14 H new ATOM 0 HA VAL A 450 10.107 -13.643 -8.086 1.00 23.53 H new ATOM 0 HB VAL A 450 8.158 -12.598 -9.192 1.00 54.30 H new ATOM 0 HG11 VAL A 450 7.376 -11.204 -7.307 1.00 41.15 H new ATOM 0 HG12 VAL A 450 8.201 -12.678 -6.745 1.00 41.15 H new ATOM 0 HG13 VAL A 450 9.044 -11.112 -6.693 1.00 41.15 H new ATOM 0 HG21 VAL A 450 8.011 -10.150 -9.451 1.00 4.31 H new ATOM 0 HG22 VAL A 450 9.710 -10.000 -8.943 1.00 4.31 H new ATOM 0 HG23 VAL A 450 9.304 -10.849 -10.454 1.00 4.31 H new ATOM 251 N GLY A 451 10.084 -14.007 -10.665 1.00 63.14 N ATOM 252 CA GLY A 451 10.468 -14.412 -12.013 1.00 43.10 C ATOM 253 C GLY A 451 9.672 -13.705 -13.106 1.00 22.11 C ATOM 254 O GLY A 451 8.502 -13.359 -12.917 1.00 61.21 O ATOM 0 H GLY A 451 9.323 -14.550 -10.258 1.00 63.14 H new ATOM 0 HA2 GLY A 451 11.529 -14.209 -12.157 1.00 43.10 H new ATOM 0 HA3 GLY A 451 10.333 -15.489 -12.114 1.00 43.10 H new ATOM 258 N VAL A 452 10.310 -13.489 -14.252 1.00 44.41 N ATOM 259 CA VAL A 452 9.653 -12.863 -15.400 1.00 72.10 C ATOM 260 C VAL A 452 8.506 -13.744 -15.938 1.00 11.40 C ATOM 261 O VAL A 452 8.633 -14.966 -16.019 1.00 12.32 O ATOM 262 CB VAL A 452 10.678 -12.574 -16.529 1.00 3.31 C ATOM 263 CG1 VAL A 452 11.218 -13.873 -17.133 1.00 33.31 C ATOM 264 CG2 VAL A 452 10.073 -11.675 -17.603 1.00 10.43 C ATOM 0 H VAL A 452 11.286 -13.739 -14.413 1.00 44.41 H new ATOM 0 HA VAL A 452 9.227 -11.918 -15.061 1.00 72.10 H new ATOM 0 HB VAL A 452 11.520 -12.042 -16.086 1.00 3.31 H new ATOM 0 HG11 VAL A 452 11.934 -13.638 -17.921 1.00 33.31 H new ATOM 0 HG12 VAL A 452 11.712 -14.457 -16.357 1.00 33.31 H new ATOM 0 HG13 VAL A 452 10.393 -14.450 -17.552 1.00 33.31 H new ATOM 0 HG21 VAL A 452 10.813 -11.489 -18.381 1.00 10.43 H new ATOM 0 HG22 VAL A 452 9.203 -12.165 -18.040 1.00 10.43 H new ATOM 0 HG23 VAL A 452 9.770 -10.728 -17.157 1.00 10.43 H new ATOM 274 N ASN A 453 7.384 -13.113 -16.288 1.00 21.33 N ATOM 275 CA ASN A 453 6.183 -13.820 -16.771 1.00 4.01 C ATOM 276 C ASN A 453 5.587 -14.748 -15.692 1.00 23.54 C ATOM 277 O ASN A 453 4.806 -15.654 -15.999 1.00 72.14 O ATOM 278 CB ASN A 453 6.487 -14.626 -18.045 1.00 54.52 C ATOM 279 CG ASN A 453 7.017 -13.759 -19.173 1.00 54.32 C ATOM 280 OD1 ASN A 453 6.254 -13.152 -19.915 1.00 41.34 O ATOM 281 ND2 ASN A 453 8.324 -13.709 -19.320 1.00 14.22 N ATOM 0 H ASN A 453 7.276 -12.100 -16.247 1.00 21.33 H new ATOM 0 HA ASN A 453 5.443 -13.055 -17.006 1.00 4.01 H new ATOM 0 HB2 ASN A 453 7.217 -15.401 -17.814 1.00 54.52 H new ATOM 0 HB3 ASN A 453 5.580 -15.131 -18.376 1.00 54.52 H new ATOM 0 HD21 ASN A 453 8.732 -13.152 -20.071 1.00 14.22 H new ATOM 0 HD22 ASN A 453 8.929 -14.227 -18.683 1.00 14.22 H new ATOM 288 N LYS A 454 5.948 -14.517 -14.431 1.00 15.33 N ATOM 289 CA LYS A 454 5.420 -15.317 -13.317 1.00 22.05 C ATOM 290 C LYS A 454 4.440 -14.509 -12.455 1.00 41.00 C ATOM 291 O LYS A 454 4.425 -13.278 -12.490 1.00 32.33 O ATOM 292 CB LYS A 454 6.564 -15.855 -12.448 1.00 4.33 C ATOM 293 CG LYS A 454 7.497 -16.821 -13.181 1.00 21.12 C ATOM 294 CD LYS A 454 6.753 -18.042 -13.725 1.00 71.21 C ATOM 295 CE LYS A 454 6.104 -18.861 -12.615 1.00 51.25 C ATOM 296 NZ LYS A 454 5.401 -20.057 -13.149 1.00 33.14 N ATOM 0 H LYS A 454 6.602 -13.786 -14.151 1.00 15.33 H new ATOM 0 HA LYS A 454 4.876 -16.157 -13.749 1.00 22.05 H new ATOM 0 HB2 LYS A 454 7.148 -15.015 -12.073 1.00 4.33 H new ATOM 0 HB3 LYS A 454 6.141 -16.362 -11.580 1.00 4.33 H new ATOM 0 HG2 LYS A 454 7.985 -16.298 -14.004 1.00 21.12 H new ATOM 0 HG3 LYS A 454 8.283 -17.150 -12.502 1.00 21.12 H new ATOM 0 HD2 LYS A 454 5.987 -17.715 -14.429 1.00 71.21 H new ATOM 0 HD3 LYS A 454 7.448 -18.672 -14.280 1.00 71.21 H new ATOM 0 HE2 LYS A 454 6.866 -19.176 -11.903 1.00 51.25 H new ATOM 0 HE3 LYS A 454 5.396 -18.237 -12.069 1.00 51.25 H new ATOM 0 HZ1 LYS A 454 4.973 -20.588 -12.364 1.00 33.14 H new ATOM 0 HZ2 LYS A 454 4.656 -19.756 -13.810 1.00 33.14 H new ATOM 0 HZ3 LYS A 454 6.081 -20.665 -13.648 1.00 33.14 H new ATOM 310 N LEU A 455 3.628 -15.217 -11.677 1.00 22.33 N ATOM 311 CA LEU A 455 2.600 -14.593 -10.835 1.00 54.41 C ATOM 312 C LEU A 455 3.066 -14.453 -9.377 1.00 34.22 C ATOM 313 O LEU A 455 3.486 -15.430 -8.750 1.00 55.04 O ATOM 314 CB LEU A 455 1.314 -15.432 -10.891 1.00 11.23 C ATOM 315 CG LEU A 455 0.091 -14.816 -10.188 1.00 34.40 C ATOM 316 CD1 LEU A 455 -0.270 -13.476 -10.822 1.00 21.23 C ATOM 317 CD2 LEU A 455 -1.100 -15.774 -10.233 1.00 15.11 C ATOM 0 H LEU A 455 3.659 -16.234 -11.609 1.00 22.33 H new ATOM 0 HA LEU A 455 2.410 -13.591 -11.220 1.00 54.41 H new ATOM 0 HB2 LEU A 455 1.060 -15.607 -11.936 1.00 11.23 H new ATOM 0 HB3 LEU A 455 1.516 -16.406 -10.444 1.00 11.23 H new ATOM 0 HG LEU A 455 0.347 -14.644 -9.143 1.00 34.40 H new ATOM 0 HD11 LEU A 455 -1.137 -13.054 -10.313 1.00 21.23 H new ATOM 0 HD12 LEU A 455 0.573 -12.791 -10.731 1.00 21.23 H new ATOM 0 HD13 LEU A 455 -0.505 -13.624 -11.876 1.00 21.23 H new ATOM 0 HD21 LEU A 455 -1.953 -15.318 -9.730 1.00 15.11 H new ATOM 0 HD22 LEU A 455 -1.360 -15.983 -11.271 1.00 15.11 H new ATOM 0 HD23 LEU A 455 -0.838 -16.705 -9.730 1.00 15.11 H new ATOM 329 N ALA A 456 2.995 -13.237 -8.840 1.00 43.32 N ATOM 330 CA ALA A 456 3.362 -12.985 -7.440 1.00 54.21 C ATOM 331 C ALA A 456 2.275 -12.182 -6.706 1.00 41.05 C ATOM 332 O ALA A 456 1.775 -11.181 -7.220 1.00 24.35 O ATOM 333 CB ALA A 456 4.701 -12.259 -7.372 1.00 32.11 C ATOM 0 H ALA A 456 2.687 -12.408 -9.349 1.00 43.32 H new ATOM 0 HA ALA A 456 3.453 -13.948 -6.938 1.00 54.21 H new ATOM 0 HB1 ALA A 456 4.964 -12.077 -6.330 1.00 32.11 H new ATOM 0 HB2 ALA A 456 5.472 -12.873 -7.839 1.00 32.11 H new ATOM 0 HB3 ALA A 456 4.626 -11.308 -7.899 1.00 32.11 H new ATOM 339 N GLU A 457 1.901 -12.631 -5.508 1.00 2.31 N ATOM 340 CA GLU A 457 0.903 -11.926 -4.692 1.00 30.20 C ATOM 341 C GLU A 457 1.544 -11.170 -3.523 1.00 72.15 C ATOM 342 O GLU A 457 2.452 -11.669 -2.856 1.00 61.30 O ATOM 343 CB GLU A 457 -0.161 -12.903 -4.164 1.00 21.31 C ATOM 344 CG GLU A 457 -1.266 -13.203 -5.170 1.00 2.41 C ATOM 345 CD GLU A 457 -2.265 -14.226 -4.662 1.00 23.13 C ATOM 346 OE1 GLU A 457 -1.924 -15.428 -4.627 1.00 52.01 O ATOM 347 OE2 GLU A 457 -3.398 -13.835 -4.309 1.00 44.22 O ATOM 0 H GLU A 457 2.272 -13.479 -5.078 1.00 2.31 H new ATOM 0 HA GLU A 457 0.425 -11.193 -5.341 1.00 30.20 H new ATOM 0 HB2 GLU A 457 0.324 -13.837 -3.880 1.00 21.31 H new ATOM 0 HB3 GLU A 457 -0.607 -12.488 -3.260 1.00 21.31 H new ATOM 0 HG2 GLU A 457 -1.791 -12.279 -5.412 1.00 2.41 H new ATOM 0 HG3 GLU A 457 -0.819 -13.567 -6.095 1.00 2.41 H new ATOM 354 N TYR A 458 1.051 -9.960 -3.284 1.00 71.55 N ATOM 355 CA TYR A 458 1.504 -9.129 -2.168 1.00 43.44 C ATOM 356 C TYR A 458 0.319 -8.753 -1.269 1.00 41.53 C ATOM 357 O TYR A 458 -0.819 -8.649 -1.735 1.00 43.52 O ATOM 358 CB TYR A 458 2.190 -7.860 -2.694 1.00 54.51 C ATOM 359 CG TYR A 458 3.485 -8.121 -3.447 1.00 33.31 C ATOM 360 CD1 TYR A 458 3.477 -8.592 -4.759 1.00 61.40 C ATOM 361 CD2 TYR A 458 4.719 -7.900 -2.843 1.00 51.33 C ATOM 362 CE1 TYR A 458 4.656 -8.832 -5.441 1.00 62.41 C ATOM 363 CE2 TYR A 458 5.900 -8.135 -3.521 1.00 4.22 C ATOM 364 CZ TYR A 458 5.864 -8.604 -4.816 1.00 71.24 C ATOM 365 OH TYR A 458 7.040 -8.844 -5.489 1.00 44.05 O ATOM 0 H TYR A 458 0.327 -9.525 -3.856 1.00 71.55 H new ATOM 0 HA TYR A 458 2.223 -9.699 -1.580 1.00 43.44 H new ATOM 0 HB2 TYR A 458 1.499 -7.333 -3.352 1.00 54.51 H new ATOM 0 HB3 TYR A 458 2.398 -7.197 -1.854 1.00 54.51 H new ATOM 0 HD1 TYR A 458 2.533 -8.773 -5.252 1.00 61.40 H new ATOM 0 HD2 TYR A 458 4.754 -7.538 -1.826 1.00 51.33 H new ATOM 0 HE1 TYR A 458 4.631 -9.196 -6.458 1.00 62.41 H new ATOM 0 HE2 TYR A 458 6.848 -7.952 -3.037 1.00 4.22 H new ATOM 0 HH TYR A 458 7.715 -9.174 -4.860 1.00 44.05 H new ATOM 375 N GLU A 459 0.591 -8.539 0.013 1.00 61.41 N ATOM 376 CA GLU A 459 -0.459 -8.261 0.997 1.00 62.32 C ATOM 377 C GLU A 459 -0.248 -6.892 1.655 1.00 13.43 C ATOM 378 O GLU A 459 0.828 -6.596 2.177 1.00 42.53 O ATOM 379 CB GLU A 459 -0.463 -9.351 2.078 1.00 75.22 C ATOM 380 CG GLU A 459 -0.585 -10.767 1.526 1.00 60.12 C ATOM 381 CD GLU A 459 -0.495 -11.828 2.613 1.00 2.41 C ATOM 382 OE1 GLU A 459 0.599 -11.997 3.194 1.00 64.14 O ATOM 383 OE2 GLU A 459 -1.512 -12.493 2.895 1.00 44.34 O ATOM 0 H GLU A 459 1.534 -8.552 0.401 1.00 61.41 H new ATOM 0 HA GLU A 459 -1.417 -8.253 0.477 1.00 62.32 H new ATOM 0 HB2 GLU A 459 0.456 -9.276 2.659 1.00 75.22 H new ATOM 0 HB3 GLU A 459 -1.290 -9.166 2.764 1.00 75.22 H new ATOM 0 HG2 GLU A 459 -1.536 -10.868 1.002 1.00 60.12 H new ATOM 0 HG3 GLU A 459 0.203 -10.936 0.792 1.00 60.12 H new ATOM 390 N VAL A 460 -1.287 -6.064 1.628 1.00 23.41 N ATOM 391 CA VAL A 460 -1.238 -4.729 2.228 1.00 2.33 C ATOM 392 C VAL A 460 -2.021 -4.687 3.552 1.00 70.33 C ATOM 393 O VAL A 460 -3.240 -4.867 3.570 1.00 42.25 O ATOM 394 CB VAL A 460 -1.818 -3.658 1.268 1.00 75.21 C ATOM 395 CG1 VAL A 460 -1.584 -2.251 1.816 1.00 31.23 C ATOM 396 CG2 VAL A 460 -1.233 -3.801 -0.138 1.00 12.31 C ATOM 0 H VAL A 460 -2.181 -6.293 1.194 1.00 23.41 H new ATOM 0 HA VAL A 460 -0.188 -4.507 2.421 1.00 2.33 H new ATOM 0 HB VAL A 460 -2.894 -3.820 1.199 1.00 75.21 H new ATOM 0 HG11 VAL A 460 -2.000 -1.518 1.125 1.00 31.23 H new ATOM 0 HG12 VAL A 460 -2.071 -2.153 2.786 1.00 31.23 H new ATOM 0 HG13 VAL A 460 -0.514 -2.078 1.928 1.00 31.23 H new ATOM 0 HG21 VAL A 460 -1.658 -3.037 -0.789 1.00 12.31 H new ATOM 0 HG22 VAL A 460 -0.151 -3.680 -0.096 1.00 12.31 H new ATOM 0 HG23 VAL A 460 -1.473 -4.788 -0.533 1.00 12.31 H new ATOM 406 N HIS A 461 -1.316 -4.464 4.654 1.00 74.31 N ATOM 407 CA HIS A 461 -1.960 -4.282 5.960 1.00 41.30 C ATOM 408 C HIS A 461 -2.224 -2.791 6.221 1.00 52.45 C ATOM 409 O HIS A 461 -1.298 -2.021 6.474 1.00 74.22 O ATOM 410 CB HIS A 461 -1.093 -4.879 7.080 1.00 73.21 C ATOM 411 CG HIS A 461 -1.093 -6.380 7.112 1.00 74.43 C ATOM 412 ND1 HIS A 461 -1.776 -7.118 8.058 1.00 51.54 N ATOM 413 CD2 HIS A 461 -0.477 -7.285 6.312 1.00 33.34 C ATOM 414 CE1 HIS A 461 -1.578 -8.403 7.839 1.00 10.15 C ATOM 415 NE2 HIS A 461 -0.796 -8.531 6.789 1.00 33.53 N ATOM 0 H HIS A 461 -0.298 -4.404 4.675 1.00 74.31 H new ATOM 0 HA HIS A 461 -2.915 -4.808 5.950 1.00 41.30 H new ATOM 0 HB2 HIS A 461 -0.068 -4.528 6.960 1.00 73.21 H new ATOM 0 HB3 HIS A 461 -1.448 -4.504 8.040 1.00 73.21 H new ATOM 0 HD1 HIS A 461 -2.345 -6.729 8.810 1.00 51.54 H new ATOM 0 HD2 HIS A 461 0.148 -7.066 5.459 1.00 33.34 H new ATOM 0 HE1 HIS A 461 -1.988 -9.213 8.423 1.00 10.15 H new ATOM 424 N VAL A 462 -3.487 -2.391 6.151 1.00 65.52 N ATOM 425 CA VAL A 462 -3.871 -0.994 6.354 1.00 41.40 C ATOM 426 C VAL A 462 -4.529 -0.821 7.724 1.00 14.21 C ATOM 427 O VAL A 462 -5.388 -1.611 8.118 1.00 11.33 O ATOM 428 CB VAL A 462 -4.825 -0.500 5.234 1.00 64.32 C ATOM 429 CG1 VAL A 462 -4.176 -0.693 3.864 1.00 71.43 C ATOM 430 CG2 VAL A 462 -6.178 -1.212 5.293 1.00 53.35 C ATOM 0 H VAL A 462 -4.269 -3.016 5.954 1.00 65.52 H new ATOM 0 HA VAL A 462 -2.966 -0.388 6.313 1.00 41.40 H new ATOM 0 HB VAL A 462 -5.006 0.563 5.393 1.00 64.32 H new ATOM 0 HG11 VAL A 462 -4.855 -0.343 3.087 1.00 71.43 H new ATOM 0 HG12 VAL A 462 -3.247 -0.124 3.818 1.00 71.43 H new ATOM 0 HG13 VAL A 462 -3.962 -1.750 3.709 1.00 71.43 H new ATOM 0 HG21 VAL A 462 -6.820 -0.841 4.494 1.00 53.35 H new ATOM 0 HG22 VAL A 462 -6.030 -2.285 5.171 1.00 53.35 H new ATOM 0 HG23 VAL A 462 -6.649 -1.018 6.257 1.00 53.35 H new ATOM 440 N LYS A 463 -4.112 0.198 8.460 1.00 10.02 N ATOM 441 CA LYS A 463 -4.556 0.367 9.845 1.00 12.42 C ATOM 442 C LYS A 463 -4.649 1.841 10.258 1.00 13.42 C ATOM 443 O LYS A 463 -3.940 2.700 9.731 1.00 61.25 O ATOM 444 CB LYS A 463 -3.598 -0.374 10.788 1.00 4.21 C ATOM 445 CG LYS A 463 -2.130 -0.137 10.455 1.00 13.41 C ATOM 446 CD LYS A 463 -1.201 -0.449 11.627 1.00 55.41 C ATOM 447 CE LYS A 463 -1.011 -1.946 11.844 1.00 33.11 C ATOM 448 NZ LYS A 463 -2.233 -2.616 12.359 1.00 42.21 N ATOM 0 H LYS A 463 -3.471 0.919 8.129 1.00 10.02 H new ATOM 0 HA LYS A 463 -5.559 -0.053 9.917 1.00 12.42 H new ATOM 0 HB2 LYS A 463 -3.788 -0.056 11.813 1.00 4.21 H new ATOM 0 HB3 LYS A 463 -3.807 -1.443 10.742 1.00 4.21 H new ATOM 0 HG2 LYS A 463 -1.851 -0.755 9.601 1.00 13.41 H new ATOM 0 HG3 LYS A 463 -1.993 0.902 10.155 1.00 13.41 H new ATOM 0 HD2 LYS A 463 -0.231 0.014 11.450 1.00 55.41 H new ATOM 0 HD3 LYS A 463 -1.606 -0.003 12.535 1.00 55.41 H new ATOM 0 HE2 LYS A 463 -0.718 -2.410 10.902 1.00 33.11 H new ATOM 0 HE3 LYS A 463 -0.192 -2.105 12.546 1.00 33.11 H new ATOM 0 HZ1 LYS A 463 -2.002 -3.139 13.228 1.00 42.21 H new ATOM 0 HZ2 LYS A 463 -2.959 -1.901 12.568 1.00 42.21 H new ATOM 0 HZ3 LYS A 463 -2.594 -3.278 11.642 1.00 42.21 H new ATOM 462 N ASN A 464 -5.536 2.117 11.210 1.00 34.30 N ATOM 463 CA ASN A 464 -5.679 3.455 11.791 1.00 15.52 C ATOM 464 C ASN A 464 -5.115 3.457 13.222 1.00 73.52 C ATOM 465 O ASN A 464 -5.511 2.639 14.047 1.00 52.00 O ATOM 466 CB ASN A 464 -7.172 3.830 11.797 1.00 32.11 C ATOM 467 CG ASN A 464 -7.460 5.257 12.239 1.00 44.13 C ATOM 468 OD1 ASN A 464 -6.712 5.862 13.005 1.00 22.44 O ATOM 469 ND2 ASN A 464 -8.572 5.795 11.776 1.00 4.12 N ATOM 0 H ASN A 464 -6.175 1.425 11.601 1.00 34.30 H new ATOM 0 HA ASN A 464 -5.125 4.186 11.202 1.00 15.52 H new ATOM 0 HB2 ASN A 464 -7.575 3.685 10.795 1.00 32.11 H new ATOM 0 HB3 ASN A 464 -7.704 3.144 12.456 1.00 32.11 H new ATOM 0 HD21 ASN A 464 -8.834 6.741 12.052 1.00 4.12 H new ATOM 0 HD22 ASN A 464 -9.170 5.265 11.142 1.00 4.12 H new ATOM 476 N LEU A 465 -4.214 4.387 13.526 1.00 14.42 N ATOM 477 CA LEU A 465 -3.557 4.423 14.845 1.00 62.05 C ATOM 478 C LEU A 465 -3.984 5.647 15.673 1.00 35.33 C ATOM 479 O LEU A 465 -3.537 5.823 16.808 1.00 4.52 O ATOM 480 CB LEU A 465 -2.029 4.413 14.672 1.00 23.01 C ATOM 481 CG LEU A 465 -1.460 3.227 13.869 1.00 5.13 C ATOM 482 CD1 LEU A 465 0.056 3.349 13.721 1.00 11.01 C ATOM 483 CD2 LEU A 465 -1.833 1.893 14.519 1.00 1.42 C ATOM 0 H LEU A 465 -3.918 5.125 12.887 1.00 14.42 H new ATOM 0 HA LEU A 465 -3.871 3.533 15.391 1.00 62.05 H new ATOM 0 HB2 LEU A 465 -1.730 5.339 14.180 1.00 23.01 H new ATOM 0 HB3 LEU A 465 -1.569 4.414 15.660 1.00 23.01 H new ATOM 0 HG LEU A 465 -1.904 3.253 12.874 1.00 5.13 H new ATOM 0 HD11 LEU A 465 0.435 2.501 13.151 1.00 11.01 H new ATOM 0 HD12 LEU A 465 0.297 4.275 13.198 1.00 11.01 H new ATOM 0 HD13 LEU A 465 0.518 3.359 14.708 1.00 11.01 H new ATOM 0 HD21 LEU A 465 -1.419 1.074 13.932 1.00 1.42 H new ATOM 0 HD22 LEU A 465 -1.428 1.855 15.530 1.00 1.42 H new ATOM 0 HD23 LEU A 465 -2.918 1.798 14.559 1.00 1.42 H new ATOM 495 N GLY A 466 -4.858 6.482 15.114 1.00 41.32 N ATOM 496 CA GLY A 466 -5.299 7.690 15.815 1.00 54.21 C ATOM 497 C GLY A 466 -6.429 7.441 16.813 1.00 55.00 C ATOM 498 O GLY A 466 -6.593 8.191 17.774 1.00 23.13 O ATOM 0 H GLY A 466 -5.271 6.349 14.191 1.00 41.32 H new ATOM 0 HA2 GLY A 466 -4.450 8.125 16.342 1.00 54.21 H new ATOM 0 HA3 GLY A 466 -5.629 8.425 15.081 1.00 54.21 H new ATOM 502 N GLY A 467 -7.212 6.387 16.586 1.00 73.20 N ATOM 503 CA GLY A 467 -8.328 6.068 17.478 1.00 15.32 C ATOM 504 C GLY A 467 -9.632 6.774 17.103 1.00 41.31 C ATOM 505 O GLY A 467 -10.522 6.944 17.937 1.00 61.13 O ATOM 0 H GLY A 467 -7.097 5.745 15.801 1.00 73.20 H new ATOM 0 HA2 GLY A 467 -8.492 4.991 17.470 1.00 15.32 H new ATOM 0 HA3 GLY A 467 -8.057 6.341 18.498 1.00 15.32 H new ATOM 509 N ILE A 468 -9.749 7.176 15.841 1.00 0.31 N ATOM 510 CA ILE A 468 -10.972 7.810 15.322 1.00 63.14 C ATOM 511 C ILE A 468 -11.313 7.272 13.919 1.00 41.23 C ATOM 512 O ILE A 468 -10.416 6.984 13.128 1.00 22.05 O ATOM 513 CB ILE A 468 -10.828 9.359 15.286 1.00 32.40 C ATOM 514 CG1 ILE A 468 -12.058 10.019 14.634 1.00 22.11 C ATOM 515 CG2 ILE A 468 -9.547 9.764 14.562 1.00 40.40 C ATOM 516 CD1 ILE A 468 -12.024 11.535 14.650 1.00 31.43 C ATOM 0 H ILE A 468 -9.008 7.076 15.147 1.00 0.31 H new ATOM 0 HA ILE A 468 -11.789 7.559 15.998 1.00 63.14 H new ATOM 0 HB ILE A 468 -10.767 9.714 16.315 1.00 32.40 H new ATOM 0 HG12 ILE A 468 -12.136 9.678 13.602 1.00 22.11 H new ATOM 0 HG13 ILE A 468 -12.956 9.680 15.150 1.00 22.11 H new ATOM 0 HG21 ILE A 468 -9.465 10.851 14.548 1.00 40.40 H new ATOM 0 HG22 ILE A 468 -8.687 9.342 15.081 1.00 40.40 H new ATOM 0 HG23 ILE A 468 -9.573 9.389 13.539 1.00 40.40 H new ATOM 0 HD11 ILE A 468 -12.924 11.924 14.173 1.00 31.43 H new ATOM 0 HD12 ILE A 468 -11.978 11.887 15.681 1.00 31.43 H new ATOM 0 HD13 ILE A 468 -11.146 11.885 14.108 1.00 31.43 H new ATOM 528 N GLY A 469 -12.604 7.126 13.620 1.00 62.14 N ATOM 529 CA GLY A 469 -13.025 6.563 12.336 1.00 11.11 C ATOM 530 C GLY A 469 -12.802 7.495 11.143 1.00 54.41 C ATOM 531 O GLY A 469 -13.057 8.698 11.221 1.00 23.12 O ATOM 0 H GLY A 469 -13.370 7.386 14.242 1.00 62.14 H new ATOM 0 HA2 GLY A 469 -12.483 5.633 12.164 1.00 11.11 H new ATOM 0 HA3 GLY A 469 -14.083 6.309 12.392 1.00 11.11 H new ATOM 535 N VAL A 470 -12.336 6.927 10.027 1.00 5.31 N ATOM 536 CA VAL A 470 -12.024 7.706 8.822 1.00 72.51 C ATOM 537 C VAL A 470 -12.675 7.111 7.553 1.00 34.45 C ATOM 538 O VAL A 470 -12.381 5.976 7.167 1.00 63.02 O ATOM 539 CB VAL A 470 -10.491 7.789 8.595 1.00 31.53 C ATOM 540 CG1 VAL A 470 -10.160 8.695 7.410 1.00 4.23 C ATOM 541 CG2 VAL A 470 -9.777 8.268 9.857 1.00 45.52 C ATOM 0 H VAL A 470 -12.165 5.926 9.932 1.00 5.31 H new ATOM 0 HA VAL A 470 -12.433 8.702 8.992 1.00 72.51 H new ATOM 0 HB VAL A 470 -10.134 6.786 8.363 1.00 31.53 H new ATOM 0 HG11 VAL A 470 -9.079 8.735 7.273 1.00 4.23 H new ATOM 0 HG12 VAL A 470 -10.625 8.298 6.508 1.00 4.23 H new ATOM 0 HG13 VAL A 470 -10.539 9.699 7.602 1.00 4.23 H new ATOM 0 HG21 VAL A 470 -8.704 8.317 9.671 1.00 45.52 H new ATOM 0 HG22 VAL A 470 -10.144 9.257 10.129 1.00 45.52 H new ATOM 0 HG23 VAL A 470 -9.972 7.571 10.672 1.00 45.52 H new ATOM 551 N PRO A 471 -13.582 7.869 6.897 1.00 41.55 N ATOM 552 CA PRO A 471 -14.142 7.499 5.581 1.00 73.24 C ATOM 553 C PRO A 471 -13.237 7.930 4.403 1.00 63.02 C ATOM 554 O PRO A 471 -13.440 7.524 3.260 1.00 22.34 O ATOM 555 CB PRO A 471 -15.465 8.269 5.556 1.00 33.01 C ATOM 556 CG PRO A 471 -15.198 9.501 6.359 1.00 1.03 C ATOM 557 CD PRO A 471 -14.169 9.130 7.402 1.00 52.23 C ATOM 0 HA PRO A 471 -14.247 6.420 5.463 1.00 73.24 H new ATOM 0 HB2 PRO A 471 -15.761 8.516 4.536 1.00 33.01 H new ATOM 0 HB3 PRO A 471 -16.274 7.681 5.989 1.00 33.01 H new ATOM 0 HG2 PRO A 471 -14.830 10.305 5.722 1.00 1.03 H new ATOM 0 HG3 PRO A 471 -16.113 9.861 6.830 1.00 1.03 H new ATOM 0 HD2 PRO A 471 -13.412 9.907 7.509 1.00 52.23 H new ATOM 0 HD3 PRO A 471 -14.626 8.993 8.382 1.00 52.23 H new ATOM 565 N SER A 472 -12.235 8.748 4.708 1.00 31.22 N ATOM 566 CA SER A 472 -11.314 9.318 3.703 1.00 35.45 C ATOM 567 C SER A 472 -10.201 8.337 3.294 1.00 22.50 C ATOM 568 O SER A 472 -9.250 8.722 2.616 1.00 2.24 O ATOM 569 CB SER A 472 -10.674 10.608 4.237 1.00 34.45 C ATOM 570 OG SER A 472 -11.621 11.660 4.360 1.00 45.32 O ATOM 0 H SER A 472 -12.029 9.042 5.663 1.00 31.22 H new ATOM 0 HA SER A 472 -11.914 9.531 2.818 1.00 35.45 H new ATOM 0 HB2 SER A 472 -10.221 10.413 5.209 1.00 34.45 H new ATOM 0 HB3 SER A 472 -9.872 10.919 3.568 1.00 34.45 H new ATOM 0 HG SER A 472 -11.261 12.474 3.950 1.00 45.32 H new ATOM 576 N THR A 473 -10.318 7.069 3.680 1.00 41.52 N ATOM 577 CA THR A 473 -9.189 6.137 3.586 1.00 31.03 C ATOM 578 C THR A 473 -9.131 5.421 2.226 1.00 51.04 C ATOM 579 O THR A 473 -9.743 4.374 2.021 1.00 12.33 O ATOM 580 CB THR A 473 -9.259 5.061 4.705 1.00 23.34 C ATOM 581 OG1 THR A 473 -9.358 5.687 5.993 1.00 63.23 O ATOM 582 CG2 THR A 473 -8.032 4.152 4.680 1.00 30.01 C ATOM 0 H THR A 473 -11.174 6.662 4.058 1.00 41.52 H new ATOM 0 HA THR A 473 -8.290 6.742 3.702 1.00 31.03 H new ATOM 0 HB THR A 473 -10.146 4.454 4.522 1.00 23.34 H new ATOM 0 HG1 THR A 473 -10.299 5.732 6.263 1.00 63.23 H new ATOM 0 HG21 THR A 473 -8.112 3.411 5.475 1.00 30.01 H new ATOM 0 HG22 THR A 473 -7.974 3.646 3.716 1.00 30.01 H new ATOM 0 HG23 THR A 473 -7.133 4.750 4.831 1.00 30.01 H new ATOM 590 N LYS A 474 -8.399 6.024 1.291 1.00 13.35 N ATOM 591 CA LYS A 474 -8.081 5.388 0.005 1.00 21.23 C ATOM 592 C LYS A 474 -6.694 4.741 0.065 1.00 62.31 C ATOM 593 O LYS A 474 -5.742 5.365 0.509 1.00 44.41 O ATOM 594 CB LYS A 474 -8.104 6.416 -1.135 1.00 71.32 C ATOM 595 CG LYS A 474 -9.439 7.125 -1.318 1.00 14.32 C ATOM 596 CD LYS A 474 -9.393 8.101 -2.492 1.00 14.31 C ATOM 597 CE LYS A 474 -10.738 8.780 -2.718 1.00 1.11 C ATOM 598 NZ LYS A 474 -10.718 9.671 -3.905 1.00 61.21 N ATOM 0 H LYS A 474 -8.010 6.961 1.398 1.00 13.35 H new ATOM 0 HA LYS A 474 -8.836 4.626 -0.187 1.00 21.23 H new ATOM 0 HB2 LYS A 474 -7.332 7.163 -0.949 1.00 71.32 H new ATOM 0 HB3 LYS A 474 -7.843 5.913 -2.066 1.00 71.32 H new ATOM 0 HG2 LYS A 474 -10.225 6.388 -1.486 1.00 14.32 H new ATOM 0 HG3 LYS A 474 -9.696 7.663 -0.405 1.00 14.32 H new ATOM 0 HD2 LYS A 474 -8.631 8.858 -2.306 1.00 14.31 H new ATOM 0 HD3 LYS A 474 -9.099 7.568 -3.396 1.00 14.31 H new ATOM 0 HE2 LYS A 474 -11.510 8.021 -2.847 1.00 1.11 H new ATOM 0 HE3 LYS A 474 -11.005 9.359 -1.834 1.00 1.11 H new ATOM 0 HZ1 LYS A 474 -11.692 9.925 -4.165 1.00 61.21 H new ATOM 0 HZ2 LYS A 474 -10.183 10.534 -3.682 1.00 61.21 H new ATOM 0 HZ3 LYS A 474 -10.265 9.179 -4.701 1.00 61.21 H new ATOM 612 N VAL A 475 -6.580 3.491 -0.363 1.00 61.00 N ATOM 613 CA VAL A 475 -5.285 2.801 -0.374 1.00 31.11 C ATOM 614 C VAL A 475 -4.886 2.420 -1.804 1.00 14.11 C ATOM 615 O VAL A 475 -5.588 1.663 -2.469 1.00 60.15 O ATOM 616 CB VAL A 475 -5.319 1.524 0.504 1.00 14.24 C ATOM 617 CG1 VAL A 475 -3.947 0.844 0.536 1.00 13.11 C ATOM 618 CG2 VAL A 475 -5.800 1.855 1.918 1.00 43.42 C ATOM 0 H VAL A 475 -7.361 2.931 -0.707 1.00 61.00 H new ATOM 0 HA VAL A 475 -4.548 3.490 0.037 1.00 31.11 H new ATOM 0 HB VAL A 475 -6.027 0.824 0.060 1.00 14.24 H new ATOM 0 HG11 VAL A 475 -3.998 -0.049 1.159 1.00 13.11 H new ATOM 0 HG12 VAL A 475 -3.656 0.564 -0.476 1.00 13.11 H new ATOM 0 HG13 VAL A 475 -3.209 1.532 0.949 1.00 13.11 H new ATOM 0 HG21 VAL A 475 -5.817 0.946 2.519 1.00 43.42 H new ATOM 0 HG22 VAL A 475 -5.123 2.578 2.373 1.00 43.42 H new ATOM 0 HG23 VAL A 475 -6.804 2.278 1.871 1.00 43.42 H new ATOM 628 N ARG A 476 -3.767 2.953 -2.286 1.00 21.21 N ATOM 629 CA ARG A 476 -3.314 2.672 -3.655 1.00 52.03 C ATOM 630 C ARG A 476 -1.865 2.154 -3.690 1.00 50.22 C ATOM 631 O ARG A 476 -1.057 2.451 -2.806 1.00 21.10 O ATOM 632 CB ARG A 476 -3.463 3.929 -4.532 1.00 23.23 C ATOM 633 CG ARG A 476 -4.828 4.610 -4.395 1.00 13.20 C ATOM 634 CD ARG A 476 -5.101 5.598 -5.524 1.00 63.23 C ATOM 635 NE ARG A 476 -4.006 6.545 -5.722 1.00 55.04 N ATOM 636 CZ ARG A 476 -3.998 7.468 -6.644 1.00 44.02 C ATOM 637 NH1 ARG A 476 -5.032 7.648 -7.405 1.00 45.13 N ATOM 638 NH2 ARG A 476 -2.954 8.220 -6.791 1.00 14.43 N ATOM 0 H ARG A 476 -3.158 3.578 -1.758 1.00 21.21 H new ATOM 0 HA ARG A 476 -3.947 1.880 -4.056 1.00 52.03 H new ATOM 0 HB2 ARG A 476 -2.682 4.642 -4.268 1.00 23.23 H new ATOM 0 HB3 ARG A 476 -3.305 3.656 -5.575 1.00 23.23 H new ATOM 0 HG2 ARG A 476 -5.610 3.851 -4.383 1.00 13.20 H new ATOM 0 HG3 ARG A 476 -4.876 5.132 -3.439 1.00 13.20 H new ATOM 0 HD2 ARG A 476 -5.272 5.048 -6.449 1.00 63.23 H new ATOM 0 HD3 ARG A 476 -6.017 6.148 -5.307 1.00 63.23 H new ATOM 0 HE ARG A 476 -3.199 6.481 -5.102 1.00 55.04 H new ATOM 0 HH11 ARG A 476 -5.861 7.066 -7.285 1.00 45.13 H new ATOM 0 HH12 ARG A 476 -5.017 8.372 -8.123 1.00 45.13 H new ATOM 0 HH21 ARG A 476 -2.142 8.089 -6.187 1.00 14.43 H new ATOM 0 HH22 ARG A 476 -2.943 8.943 -7.511 1.00 14.43 H new ATOM 652 N VAL A 477 -1.546 1.380 -4.727 1.00 14.22 N ATOM 653 CA VAL A 477 -0.221 0.767 -4.877 1.00 13.50 C ATOM 654 C VAL A 477 0.456 1.223 -6.177 1.00 1.12 C ATOM 655 O VAL A 477 -0.173 1.263 -7.239 1.00 75.14 O ATOM 656 CB VAL A 477 -0.322 -0.781 -4.877 1.00 43.23 C ATOM 657 CG1 VAL A 477 1.047 -1.421 -5.096 1.00 53.53 C ATOM 658 CG2 VAL A 477 -0.951 -1.285 -3.580 1.00 52.10 C ATOM 0 H VAL A 477 -2.193 1.159 -5.484 1.00 14.22 H new ATOM 0 HA VAL A 477 0.380 1.090 -4.027 1.00 13.50 H new ATOM 0 HB VAL A 477 -0.967 -1.073 -5.706 1.00 43.23 H new ATOM 0 HG11 VAL A 477 0.946 -2.506 -5.091 1.00 53.53 H new ATOM 0 HG12 VAL A 477 1.450 -1.098 -6.056 1.00 53.53 H new ATOM 0 HG13 VAL A 477 1.723 -1.116 -4.297 1.00 53.53 H new ATOM 0 HG21 VAL A 477 -1.011 -2.373 -3.604 1.00 52.10 H new ATOM 0 HG22 VAL A 477 -0.339 -0.974 -2.734 1.00 52.10 H new ATOM 0 HG23 VAL A 477 -1.953 -0.868 -3.476 1.00 52.10 H new ATOM 668 N TYR A 478 1.740 1.558 -6.084 1.00 4.25 N ATOM 669 CA TYR A 478 2.511 2.047 -7.230 1.00 62.13 C ATOM 670 C TYR A 478 3.767 1.195 -7.458 1.00 23.31 C ATOM 671 O TYR A 478 4.413 0.756 -6.508 1.00 21.31 O ATOM 672 CB TYR A 478 2.929 3.507 -7.006 1.00 74.41 C ATOM 673 CG TYR A 478 1.803 4.407 -6.545 1.00 74.13 C ATOM 674 CD1 TYR A 478 1.535 4.570 -5.190 1.00 71.43 C ATOM 675 CD2 TYR A 478 1.009 5.092 -7.457 1.00 22.21 C ATOM 676 CE1 TYR A 478 0.512 5.387 -4.760 1.00 23.15 C ATOM 677 CE2 TYR A 478 -0.018 5.915 -7.032 1.00 10.53 C ATOM 678 CZ TYR A 478 -0.261 6.056 -5.680 1.00 74.20 C ATOM 679 OH TYR A 478 -1.280 6.873 -5.246 1.00 53.43 O ATOM 0 H TYR A 478 2.276 1.500 -5.218 1.00 4.25 H new ATOM 0 HA TYR A 478 1.873 1.977 -8.111 1.00 62.13 H new ATOM 0 HB2 TYR A 478 3.729 3.535 -6.266 1.00 74.41 H new ATOM 0 HB3 TYR A 478 3.340 3.903 -7.935 1.00 74.41 H new ATOM 0 HD1 TYR A 478 2.139 4.048 -4.463 1.00 71.43 H new ATOM 0 HD2 TYR A 478 1.197 4.980 -8.515 1.00 22.21 H new ATOM 0 HE1 TYR A 478 0.318 5.502 -3.704 1.00 23.15 H new ATOM 0 HE2 TYR A 478 -0.625 6.443 -7.752 1.00 10.53 H new ATOM 0 HH TYR A 478 -1.494 6.661 -4.313 1.00 53.43 H new ATOM 689 N ILE A 479 4.101 0.966 -8.723 1.00 31.42 N ATOM 690 CA ILE A 479 5.327 0.256 -9.096 1.00 0.51 C ATOM 691 C ILE A 479 6.274 1.203 -9.851 1.00 74.13 C ATOM 692 O ILE A 479 5.974 1.631 -10.969 1.00 34.23 O ATOM 693 CB ILE A 479 5.009 -0.980 -9.977 1.00 31.01 C ATOM 694 CG1 ILE A 479 4.036 -1.921 -9.242 1.00 52.01 C ATOM 695 CG2 ILE A 479 6.294 -1.715 -10.360 1.00 5.13 C ATOM 696 CD1 ILE A 479 3.619 -3.130 -10.053 1.00 62.24 C ATOM 0 H ILE A 479 3.535 1.264 -9.518 1.00 31.42 H new ATOM 0 HA ILE A 479 5.811 -0.089 -8.182 1.00 0.51 H new ATOM 0 HB ILE A 479 4.531 -0.640 -10.895 1.00 31.01 H new ATOM 0 HG12 ILE A 479 4.503 -2.260 -8.317 1.00 52.01 H new ATOM 0 HG13 ILE A 479 3.145 -1.359 -8.962 1.00 52.01 H new ATOM 0 HG21 ILE A 479 6.049 -2.579 -10.978 1.00 5.13 H new ATOM 0 HG22 ILE A 479 6.945 -1.043 -10.918 1.00 5.13 H new ATOM 0 HG23 ILE A 479 6.805 -2.048 -9.457 1.00 5.13 H new ATOM 0 HD11 ILE A 479 2.934 -3.743 -9.467 1.00 62.24 H new ATOM 0 HD12 ILE A 479 3.122 -2.802 -10.966 1.00 62.24 H new ATOM 0 HD13 ILE A 479 4.501 -3.717 -10.311 1.00 62.24 H new ATOM 708 N ASN A 480 7.401 1.547 -9.223 1.00 54.30 N ATOM 709 CA ASN A 480 8.330 2.555 -9.762 1.00 14.32 C ATOM 710 C ASN A 480 7.606 3.883 -10.054 1.00 72.21 C ATOM 711 O ASN A 480 7.960 4.613 -10.984 1.00 21.32 O ATOM 712 CB ASN A 480 9.027 2.040 -11.035 1.00 43.41 C ATOM 713 CG ASN A 480 10.030 0.932 -10.754 1.00 54.44 C ATOM 714 OD1 ASN A 480 10.593 0.845 -9.668 1.00 4.34 O ATOM 715 ND2 ASN A 480 10.290 0.091 -11.738 1.00 43.44 N ATOM 0 H ASN A 480 7.697 1.142 -8.335 1.00 54.30 H new ATOM 0 HA ASN A 480 9.088 2.738 -9.001 1.00 14.32 H new ATOM 0 HB2 ASN A 480 8.274 1.673 -11.732 1.00 43.41 H new ATOM 0 HB3 ASN A 480 9.537 2.869 -11.525 1.00 43.41 H new ATOM 0 HD21 ASN A 480 10.974 -0.654 -11.605 1.00 43.44 H new ATOM 0 HD22 ASN A 480 9.807 0.186 -12.631 1.00 43.44 H new ATOM 722 N GLY A 481 6.611 4.204 -9.228 1.00 5.52 N ATOM 723 CA GLY A 481 5.849 5.440 -9.391 1.00 21.51 C ATOM 724 C GLY A 481 4.521 5.253 -10.127 1.00 72.34 C ATOM 725 O GLY A 481 3.584 6.030 -9.929 1.00 44.25 O ATOM 0 H GLY A 481 6.315 3.626 -8.441 1.00 5.52 H new ATOM 0 HA2 GLY A 481 5.652 5.867 -8.408 1.00 21.51 H new ATOM 0 HA3 GLY A 481 6.457 6.162 -9.936 1.00 21.51 H new ATOM 729 N THR A 482 4.426 4.222 -10.964 1.00 14.43 N ATOM 730 CA THR A 482 3.236 4.007 -11.808 1.00 32.23 C ATOM 731 C THR A 482 2.106 3.309 -11.036 1.00 74.15 C ATOM 732 O THR A 482 2.321 2.276 -10.405 1.00 25.12 O ATOM 733 CB THR A 482 3.585 3.154 -13.055 1.00 41.25 C ATOM 734 OG1 THR A 482 4.709 3.728 -13.744 1.00 45.30 O ATOM 735 CG2 THR A 482 2.396 3.053 -14.012 1.00 32.11 C ATOM 0 H THR A 482 5.155 3.518 -11.081 1.00 14.43 H new ATOM 0 HA THR A 482 2.895 4.994 -12.119 1.00 32.23 H new ATOM 0 HB THR A 482 3.836 2.150 -12.713 1.00 41.25 H new ATOM 0 HG1 THR A 482 4.924 3.183 -14.529 1.00 45.30 H new ATOM 0 HG21 THR A 482 2.674 2.449 -14.875 1.00 32.11 H new ATOM 0 HG22 THR A 482 1.555 2.587 -13.499 1.00 32.11 H new ATOM 0 HG23 THR A 482 2.111 4.051 -14.345 1.00 32.11 H new ATOM 743 N LEU A 483 0.898 3.873 -11.103 1.00 43.44 N ATOM 744 CA LEU A 483 -0.268 3.306 -10.406 1.00 45.15 C ATOM 745 C LEU A 483 -0.611 1.898 -10.924 1.00 15.14 C ATOM 746 O LEU A 483 -0.823 1.694 -12.122 1.00 43.51 O ATOM 747 CB LEU A 483 -1.484 4.231 -10.564 1.00 14.43 C ATOM 748 CG LEU A 483 -2.780 3.742 -9.882 1.00 22.01 C ATOM 749 CD1 LEU A 483 -2.590 3.618 -8.371 1.00 71.42 C ATOM 750 CD2 LEU A 483 -3.946 4.673 -10.211 1.00 60.03 C ATOM 0 H LEU A 483 0.698 4.722 -11.632 1.00 43.44 H new ATOM 0 HA LEU A 483 -0.011 3.222 -9.350 1.00 45.15 H new ATOM 0 HB2 LEU A 483 -1.229 5.211 -10.161 1.00 14.43 H new ATOM 0 HB3 LEU A 483 -1.681 4.365 -11.628 1.00 14.43 H new ATOM 0 HG LEU A 483 -3.015 2.751 -10.271 1.00 22.01 H new ATOM 0 HD11 LEU A 483 -3.518 3.272 -7.915 1.00 71.42 H new ATOM 0 HD12 LEU A 483 -1.794 2.903 -8.162 1.00 71.42 H new ATOM 0 HD13 LEU A 483 -2.323 4.590 -7.957 1.00 71.42 H new ATOM 0 HD21 LEU A 483 -4.850 4.311 -9.721 1.00 60.03 H new ATOM 0 HD22 LEU A 483 -3.719 5.679 -9.857 1.00 60.03 H new ATOM 0 HD23 LEU A 483 -4.102 4.694 -11.290 1.00 60.03 H new ATOM 762 N TYR A 484 -0.658 0.928 -10.014 1.00 12.15 N ATOM 763 CA TYR A 484 -0.982 -0.458 -10.373 1.00 21.44 C ATOM 764 C TYR A 484 -2.407 -0.861 -9.945 1.00 63.43 C ATOM 765 O TYR A 484 -3.132 -1.506 -10.708 1.00 2.21 O ATOM 766 CB TYR A 484 0.040 -1.416 -9.746 1.00 54.23 C ATOM 767 CG TYR A 484 -0.314 -2.878 -9.943 1.00 33.14 C ATOM 768 CD1 TYR A 484 -0.128 -3.498 -11.175 1.00 73.45 C ATOM 769 CD2 TYR A 484 -0.865 -3.628 -8.908 1.00 53.20 C ATOM 770 CE1 TYR A 484 -0.476 -4.819 -11.366 1.00 51.32 C ATOM 771 CE2 TYR A 484 -1.221 -4.949 -9.097 1.00 62.12 C ATOM 772 CZ TYR A 484 -1.023 -5.538 -10.326 1.00 31.12 C ATOM 773 OH TYR A 484 -1.391 -6.849 -10.522 1.00 74.02 O ATOM 0 H TYR A 484 -0.476 1.072 -9.021 1.00 12.15 H new ATOM 0 HA TYR A 484 -0.938 -0.526 -11.460 1.00 21.44 H new ATOM 0 HB2 TYR A 484 1.022 -1.225 -10.180 1.00 54.23 H new ATOM 0 HB3 TYR A 484 0.117 -1.208 -8.679 1.00 54.23 H new ATOM 0 HD1 TYR A 484 0.295 -2.936 -11.994 1.00 73.45 H new ATOM 0 HD2 TYR A 484 -1.017 -3.170 -7.942 1.00 53.20 H new ATOM 0 HE1 TYR A 484 -0.320 -5.288 -12.327 1.00 51.32 H new ATOM 0 HE2 TYR A 484 -1.652 -5.517 -8.286 1.00 62.12 H new ATOM 0 HH TYR A 484 -1.606 -7.261 -9.659 1.00 74.02 H new ATOM 783 N LYS A 485 -2.800 -0.491 -8.729 1.00 34.34 N ATOM 784 CA LYS A 485 -4.111 -0.880 -8.185 1.00 71.24 C ATOM 785 C LYS A 485 -4.560 0.120 -7.108 1.00 63.20 C ATOM 786 O LYS A 485 -3.726 0.747 -6.458 1.00 51.42 O ATOM 787 CB LYS A 485 -4.036 -2.306 -7.605 1.00 74.31 C ATOM 788 CG LYS A 485 -5.390 -2.933 -7.289 1.00 11.23 C ATOM 789 CD LYS A 485 -5.233 -4.382 -6.828 1.00 2.13 C ATOM 790 CE LYS A 485 -6.573 -5.055 -6.544 1.00 43.13 C ATOM 791 NZ LYS A 485 -6.403 -6.458 -6.073 1.00 1.52 N ATOM 0 H LYS A 485 -2.235 0.077 -8.098 1.00 34.34 H new ATOM 0 HA LYS A 485 -4.847 -0.868 -8.989 1.00 71.24 H new ATOM 0 HB2 LYS A 485 -3.510 -2.946 -8.314 1.00 74.31 H new ATOM 0 HB3 LYS A 485 -3.439 -2.283 -6.693 1.00 74.31 H new ATOM 0 HG2 LYS A 485 -5.890 -2.354 -6.513 1.00 11.23 H new ATOM 0 HG3 LYS A 485 -6.026 -2.897 -8.173 1.00 11.23 H new ATOM 0 HD2 LYS A 485 -4.701 -4.947 -7.593 1.00 2.13 H new ATOM 0 HD3 LYS A 485 -4.619 -4.409 -5.928 1.00 2.13 H new ATOM 0 HE2 LYS A 485 -7.114 -4.482 -5.791 1.00 43.13 H new ATOM 0 HE3 LYS A 485 -7.182 -5.047 -7.448 1.00 43.13 H new ATOM 0 HZ1 LYS A 485 -7.337 -6.901 -5.956 1.00 1.52 H new ATOM 0 HZ2 LYS A 485 -5.850 -6.994 -6.772 1.00 1.52 H new ATOM 0 HZ3 LYS A 485 -5.903 -6.460 -5.161 1.00 1.52 H new ATOM 805 N ASN A 486 -5.872 0.273 -6.916 1.00 30.00 N ATOM 806 CA ASN A 486 -6.392 1.262 -5.959 1.00 50.13 C ATOM 807 C ASN A 486 -7.613 0.739 -5.178 1.00 75.04 C ATOM 808 O ASN A 486 -8.407 -0.050 -5.691 1.00 1.14 O ATOM 809 CB ASN A 486 -6.748 2.561 -6.695 1.00 74.04 C ATOM 810 CG ASN A 486 -7.833 2.366 -7.739 1.00 1.42 C ATOM 811 OD1 ASN A 486 -9.015 2.524 -7.463 1.00 14.30 O ATOM 812 ND2 ASN A 486 -7.444 2.020 -8.950 1.00 51.43 N ATOM 0 H ASN A 486 -6.589 -0.266 -7.402 1.00 30.00 H new ATOM 0 HA ASN A 486 -5.606 1.456 -5.229 1.00 50.13 H new ATOM 0 HB2 ASN A 486 -7.077 3.306 -5.970 1.00 74.04 H new ATOM 0 HB3 ASN A 486 -5.854 2.958 -7.176 1.00 74.04 H new ATOM 0 HD21 ASN A 486 -8.135 1.877 -9.686 1.00 51.43 H new ATOM 0 HD22 ASN A 486 -6.452 1.895 -9.151 1.00 51.43 H new ATOM 819 N TRP A 487 -7.744 1.189 -3.933 1.00 2.23 N ATOM 820 CA TRP A 487 -8.877 0.833 -3.068 1.00 20.31 C ATOM 821 C TRP A 487 -9.462 2.079 -2.390 1.00 62.40 C ATOM 822 O TRP A 487 -8.746 3.035 -2.101 1.00 53.33 O ATOM 823 CB TRP A 487 -8.442 -0.142 -1.960 1.00 21.21 C ATOM 824 CG TRP A 487 -8.004 -1.495 -2.439 1.00 72.03 C ATOM 825 CD1 TRP A 487 -8.808 -2.543 -2.773 1.00 32.42 C ATOM 826 CD2 TRP A 487 -6.656 -1.953 -2.596 1.00 62.41 C ATOM 827 NE1 TRP A 487 -8.044 -3.619 -3.151 1.00 53.53 N ATOM 828 CE2 TRP A 487 -6.720 -3.283 -3.047 1.00 74.54 C ATOM 829 CE3 TRP A 487 -5.402 -1.365 -2.408 1.00 13.50 C ATOM 830 CZ2 TRP A 487 -5.577 -4.033 -3.308 1.00 31.23 C ATOM 831 CZ3 TRP A 487 -4.271 -2.112 -2.665 1.00 11.35 C ATOM 832 CH2 TRP A 487 -4.364 -3.434 -3.113 1.00 64.14 C ATOM 0 H TRP A 487 -7.069 1.812 -3.490 1.00 2.23 H new ATOM 0 HA TRP A 487 -9.626 0.365 -3.706 1.00 20.31 H new ATOM 0 HB2 TRP A 487 -7.624 0.311 -1.400 1.00 21.21 H new ATOM 0 HB3 TRP A 487 -9.271 -0.271 -1.265 1.00 21.21 H new ATOM 0 HD1 TRP A 487 -9.888 -2.529 -2.745 1.00 32.42 H new ATOM 0 HE1 TRP A 487 -8.404 -4.522 -3.459 1.00 53.53 H new ATOM 0 HE3 TRP A 487 -5.320 -0.343 -2.067 1.00 13.50 H new ATOM 0 HZ2 TRP A 487 -5.646 -5.054 -3.653 1.00 31.23 H new ATOM 0 HZ3 TRP A 487 -3.297 -1.669 -2.518 1.00 11.35 H new ATOM 0 HH2 TRP A 487 -3.460 -3.992 -3.308 1.00 64.14 H new ATOM 843 N THR A 488 -10.762 2.060 -2.132 1.00 70.24 N ATOM 844 CA THR A 488 -11.393 3.061 -1.264 1.00 1.52 C ATOM 845 C THR A 488 -12.147 2.358 -0.137 1.00 44.25 C ATOM 846 O THR A 488 -13.108 1.626 -0.380 1.00 5.31 O ATOM 847 CB THR A 488 -12.370 3.973 -2.046 1.00 53.21 C ATOM 848 OG1 THR A 488 -11.667 4.658 -3.094 1.00 51.21 O ATOM 849 CG2 THR A 488 -13.033 4.999 -1.123 1.00 21.22 C ATOM 0 H THR A 488 -11.406 1.364 -2.509 1.00 70.24 H new ATOM 0 HA THR A 488 -10.603 3.691 -0.856 1.00 1.52 H new ATOM 0 HB THR A 488 -13.148 3.341 -2.474 1.00 53.21 H new ATOM 0 HG1 THR A 488 -12.291 5.232 -3.586 1.00 51.21 H new ATOM 0 HG21 THR A 488 -13.713 5.624 -1.702 1.00 21.22 H new ATOM 0 HG22 THR A 488 -13.592 4.480 -0.344 1.00 21.22 H new ATOM 0 HG23 THR A 488 -12.267 5.625 -0.665 1.00 21.22 H new ATOM 857 N VAL A 489 -11.723 2.593 1.097 1.00 74.11 N ATOM 858 CA VAL A 489 -12.253 1.861 2.252 1.00 72.23 C ATOM 859 C VAL A 489 -12.442 2.781 3.465 1.00 60.22 C ATOM 860 O VAL A 489 -12.068 3.954 3.439 1.00 75.41 O ATOM 861 CB VAL A 489 -11.317 0.685 2.655 1.00 21.30 C ATOM 862 CG1 VAL A 489 -11.183 -0.328 1.517 1.00 63.52 C ATOM 863 CG2 VAL A 489 -9.942 1.201 3.085 1.00 64.54 C ATOM 0 H VAL A 489 -11.012 3.286 1.330 1.00 74.11 H new ATOM 0 HA VAL A 489 -13.222 1.465 1.949 1.00 72.23 H new ATOM 0 HB VAL A 489 -11.770 0.177 3.506 1.00 21.30 H new ATOM 0 HG11 VAL A 489 -10.523 -1.138 1.827 1.00 63.52 H new ATOM 0 HG12 VAL A 489 -12.165 -0.733 1.273 1.00 63.52 H new ATOM 0 HG13 VAL A 489 -10.765 0.164 0.639 1.00 63.52 H new ATOM 0 HG21 VAL A 489 -9.308 0.359 3.361 1.00 64.54 H new ATOM 0 HG22 VAL A 489 -9.483 1.745 2.260 1.00 64.54 H new ATOM 0 HG23 VAL A 489 -10.055 1.867 3.941 1.00 64.54 H new ATOM 873 N SER A 490 -13.053 2.248 4.514 1.00 70.35 N ATOM 874 CA SER A 490 -13.206 2.979 5.776 1.00 54.12 C ATOM 875 C SER A 490 -12.456 2.261 6.901 1.00 10.22 C ATOM 876 O SER A 490 -12.542 1.037 7.035 1.00 64.21 O ATOM 877 CB SER A 490 -14.692 3.113 6.145 1.00 32.55 C ATOM 878 OG SER A 490 -15.432 3.733 5.100 1.00 33.01 O ATOM 0 H SER A 490 -13.454 1.310 4.521 1.00 70.35 H new ATOM 0 HA SER A 490 -12.784 3.976 5.647 1.00 54.12 H new ATOM 0 HB2 SER A 490 -15.108 2.127 6.352 1.00 32.55 H new ATOM 0 HB3 SER A 490 -14.790 3.698 7.059 1.00 32.55 H new ATOM 0 HG SER A 490 -16.374 3.803 5.363 1.00 33.01 H new ATOM 884 N LEU A 491 -11.701 3.016 7.694 1.00 5.41 N ATOM 885 CA LEU A 491 -10.999 2.455 8.853 1.00 74.41 C ATOM 886 C LEU A 491 -11.447 3.139 10.150 1.00 52.31 C ATOM 887 O LEU A 491 -11.300 4.351 10.310 1.00 34.21 O ATOM 888 CB LEU A 491 -9.476 2.587 8.689 1.00 45.31 C ATOM 889 CG LEU A 491 -8.857 1.745 7.561 1.00 23.32 C ATOM 890 CD1 LEU A 491 -7.343 1.932 7.520 1.00 20.34 C ATOM 891 CD2 LEU A 491 -9.214 0.268 7.724 1.00 73.52 C ATOM 0 H LEU A 491 -11.557 4.017 7.559 1.00 5.41 H new ATOM 0 HA LEU A 491 -11.253 1.397 8.912 1.00 74.41 H new ATOM 0 HB2 LEU A 491 -9.237 3.635 8.510 1.00 45.31 H new ATOM 0 HB3 LEU A 491 -9.001 2.308 9.630 1.00 45.31 H new ATOM 0 HG LEU A 491 -9.272 2.090 6.614 1.00 23.32 H new ATOM 0 HD11 LEU A 491 -6.923 1.328 6.715 1.00 20.34 H new ATOM 0 HD12 LEU A 491 -7.111 2.982 7.344 1.00 20.34 H new ATOM 0 HD13 LEU A 491 -6.912 1.619 8.471 1.00 20.34 H new ATOM 0 HD21 LEU A 491 -8.765 -0.306 6.914 1.00 73.52 H new ATOM 0 HD22 LEU A 491 -8.835 -0.095 8.680 1.00 73.52 H new ATOM 0 HD23 LEU A 491 -10.297 0.150 7.695 1.00 73.52 H new ATOM 903 N GLY A 492 -11.985 2.351 11.075 1.00 1.53 N ATOM 904 CA GLY A 492 -12.450 2.889 12.346 1.00 2.23 C ATOM 905 C GLY A 492 -11.324 3.103 13.355 1.00 51.50 C ATOM 906 O GLY A 492 -10.141 3.023 13.005 1.00 34.21 O ATOM 0 H GLY A 492 -12.109 1.344 10.969 1.00 1.53 H new ATOM 0 HA2 GLY A 492 -12.956 3.838 12.168 1.00 2.23 H new ATOM 0 HA3 GLY A 492 -13.188 2.210 12.773 1.00 2.23 H new ATOM 910 N PRO A 493 -11.658 3.376 14.628 1.00 32.32 N ATOM 911 CA PRO A 493 -10.653 3.584 15.680 1.00 3.24 C ATOM 912 C PRO A 493 -9.800 2.327 15.930 1.00 23.55 C ATOM 913 O PRO A 493 -10.294 1.324 16.448 1.00 1.32 O ATOM 914 CB PRO A 493 -11.489 3.939 16.925 1.00 0.22 C ATOM 915 CG PRO A 493 -12.842 4.304 16.403 1.00 34.10 C ATOM 916 CD PRO A 493 -13.032 3.503 15.145 1.00 71.20 C ATOM 0 HA PRO A 493 -9.937 4.359 15.409 1.00 3.24 H new ATOM 0 HB2 PRO A 493 -11.548 3.095 17.613 1.00 0.22 H new ATOM 0 HB3 PRO A 493 -11.043 4.768 17.475 1.00 0.22 H new ATOM 0 HG2 PRO A 493 -13.617 4.073 17.133 1.00 34.10 H new ATOM 0 HG3 PRO A 493 -12.906 5.373 16.198 1.00 34.10 H new ATOM 0 HD2 PRO A 493 -13.479 2.530 15.349 1.00 71.20 H new ATOM 0 HD3 PRO A 493 -13.685 4.012 14.436 1.00 71.20 H new ATOM 924 N LYS A 494 -8.521 2.389 15.540 1.00 24.51 N ATOM 925 CA LYS A 494 -7.595 1.253 15.691 1.00 2.21 C ATOM 926 C LYS A 494 -8.049 0.047 14.847 1.00 42.20 C ATOM 927 O LYS A 494 -7.909 -1.112 15.247 1.00 14.11 O ATOM 928 CB LYS A 494 -7.442 0.882 17.175 1.00 21.15 C ATOM 929 CG LYS A 494 -6.794 1.990 18.004 1.00 73.25 C ATOM 930 CD LYS A 494 -6.719 1.633 19.485 1.00 72.23 C ATOM 931 CE LYS A 494 -5.985 2.707 20.283 1.00 12.42 C ATOM 932 NZ LYS A 494 -5.949 2.396 21.734 1.00 75.45 N ATOM 0 H LYS A 494 -8.100 3.216 15.116 1.00 24.51 H new ATOM 0 HA LYS A 494 -6.616 1.554 15.317 1.00 2.21 H new ATOM 0 HB2 LYS A 494 -8.424 0.653 17.589 1.00 21.15 H new ATOM 0 HB3 LYS A 494 -6.842 -0.024 17.257 1.00 21.15 H new ATOM 0 HG2 LYS A 494 -5.790 2.183 17.627 1.00 73.25 H new ATOM 0 HG3 LYS A 494 -7.363 2.912 17.883 1.00 73.25 H new ATOM 0 HD2 LYS A 494 -7.727 1.508 19.882 1.00 72.23 H new ATOM 0 HD3 LYS A 494 -6.209 0.677 19.605 1.00 72.23 H new ATOM 0 HE2 LYS A 494 -4.966 2.804 19.908 1.00 12.42 H new ATOM 0 HE3 LYS A 494 -6.474 3.669 20.131 1.00 12.42 H new ATOM 0 HZ1 LYS A 494 -5.442 3.151 22.238 1.00 75.45 H new ATOM 0 HZ2 LYS A 494 -6.921 2.328 22.099 1.00 75.45 H new ATOM 0 HZ3 LYS A 494 -5.460 1.490 21.883 1.00 75.45 H new ATOM 946 N GLU A 495 -8.575 0.350 13.662 1.00 30.35 N ATOM 947 CA GLU A 495 -9.053 -0.664 12.711 1.00 15.31 C ATOM 948 C GLU A 495 -7.910 -1.182 11.820 1.00 4.13 C ATOM 949 O GLU A 495 -6.969 -0.445 11.526 1.00 71.10 O ATOM 950 CB GLU A 495 -10.132 -0.041 11.815 1.00 13.33 C ATOM 951 CG GLU A 495 -10.911 -1.042 10.970 1.00 54.04 C ATOM 952 CD GLU A 495 -11.975 -1.766 11.772 1.00 22.03 C ATOM 953 OE1 GLU A 495 -13.110 -1.250 11.849 1.00 4.22 O ATOM 954 OE2 GLU A 495 -11.672 -2.837 12.346 1.00 45.23 O ATOM 0 H GLU A 495 -8.684 1.308 13.329 1.00 30.35 H new ATOM 0 HA GLU A 495 -9.456 -1.502 13.280 1.00 15.31 H new ATOM 0 HB2 GLU A 495 -10.834 0.509 12.442 1.00 13.33 H new ATOM 0 HB3 GLU A 495 -9.661 0.685 11.152 1.00 13.33 H new ATOM 0 HG2 GLU A 495 -11.380 -0.522 10.135 1.00 54.04 H new ATOM 0 HG3 GLU A 495 -10.221 -1.771 10.545 1.00 54.04 H new ATOM 961 N GLU A 496 -7.993 -2.444 11.393 1.00 1.25 N ATOM 962 CA GLU A 496 -7.040 -2.990 10.411 1.00 43.20 C ATOM 963 C GLU A 496 -7.757 -3.819 9.331 1.00 11.33 C ATOM 964 O GLU A 496 -8.754 -4.489 9.607 1.00 44.04 O ATOM 965 CB GLU A 496 -5.969 -3.855 11.094 1.00 71.12 C ATOM 966 CG GLU A 496 -4.860 -4.312 10.140 1.00 42.21 C ATOM 967 CD GLU A 496 -3.842 -5.233 10.793 1.00 21.55 C ATOM 968 OE1 GLU A 496 -3.331 -4.886 11.880 1.00 10.31 O ATOM 969 OE2 GLU A 496 -3.523 -6.289 10.207 1.00 42.22 O ATOM 0 H GLU A 496 -8.703 -3.106 11.706 1.00 1.25 H new ATOM 0 HA GLU A 496 -6.555 -2.138 9.934 1.00 43.20 H new ATOM 0 HB2 GLU A 496 -5.524 -3.290 11.913 1.00 71.12 H new ATOM 0 HB3 GLU A 496 -6.445 -4.732 11.533 1.00 71.12 H new ATOM 0 HG2 GLU A 496 -5.311 -4.825 9.291 1.00 42.21 H new ATOM 0 HG3 GLU A 496 -4.346 -3.435 9.746 1.00 42.21 H new ATOM 976 N LYS A 497 -7.237 -3.761 8.103 1.00 34.02 N ATOM 977 CA LYS A 497 -7.749 -4.559 6.977 1.00 72.30 C ATOM 978 C LYS A 497 -6.598 -5.061 6.088 1.00 60.23 C ATOM 979 O LYS A 497 -5.574 -4.388 5.950 1.00 44.00 O ATOM 980 CB LYS A 497 -8.736 -3.735 6.138 1.00 53.21 C ATOM 981 CG LYS A 497 -10.078 -3.545 6.822 1.00 73.22 C ATOM 982 CD LYS A 497 -11.015 -2.643 6.033 1.00 12.12 C ATOM 983 CE LYS A 497 -12.385 -2.612 6.683 1.00 24.21 C ATOM 984 NZ LYS A 497 -13.270 -1.562 6.110 1.00 64.52 N ATOM 0 H LYS A 497 -6.450 -3.161 7.857 1.00 34.02 H new ATOM 0 HA LYS A 497 -8.269 -5.423 7.390 1.00 72.30 H new ATOM 0 HB2 LYS A 497 -8.300 -2.759 5.928 1.00 53.21 H new ATOM 0 HB3 LYS A 497 -8.890 -4.229 5.178 1.00 53.21 H new ATOM 0 HG2 LYS A 497 -10.550 -4.517 6.964 1.00 73.22 H new ATOM 0 HG3 LYS A 497 -9.919 -3.120 7.813 1.00 73.22 H new ATOM 0 HD2 LYS A 497 -10.605 -1.634 5.984 1.00 12.12 H new ATOM 0 HD3 LYS A 497 -11.099 -3.003 5.007 1.00 12.12 H new ATOM 0 HE2 LYS A 497 -12.860 -3.586 6.565 1.00 24.21 H new ATOM 0 HE3 LYS A 497 -12.271 -2.440 7.753 1.00 24.21 H new ATOM 0 HZ1 LYS A 497 -14.255 -1.752 6.383 1.00 64.52 H new ATOM 0 HZ2 LYS A 497 -12.983 -0.630 6.473 1.00 64.52 H new ATOM 0 HZ3 LYS A 497 -13.191 -1.569 5.073 1.00 64.52 H new ATOM 998 N VAL A 498 -6.757 -6.247 5.494 1.00 22.32 N ATOM 999 CA VAL A 498 -5.724 -6.811 4.613 1.00 2.11 C ATOM 1000 C VAL A 498 -6.189 -6.843 3.144 1.00 20.13 C ATOM 1001 O VAL A 498 -7.101 -7.587 2.779 1.00 23.05 O ATOM 1002 CB VAL A 498 -5.316 -8.239 5.058 1.00 31.10 C ATOM 1003 CG1 VAL A 498 -4.168 -8.770 4.199 1.00 25.11 C ATOM 1004 CG2 VAL A 498 -4.939 -8.255 6.540 1.00 33.13 C ATOM 0 H VAL A 498 -7.584 -6.834 5.604 1.00 22.32 H new ATOM 0 HA VAL A 498 -4.856 -6.157 4.691 1.00 2.11 H new ATOM 0 HB VAL A 498 -6.174 -8.897 4.918 1.00 31.10 H new ATOM 0 HG11 VAL A 498 -3.900 -9.773 4.530 1.00 25.11 H new ATOM 0 HG12 VAL A 498 -4.480 -8.804 3.155 1.00 25.11 H new ATOM 0 HG13 VAL A 498 -3.305 -8.112 4.298 1.00 25.11 H new ATOM 0 HG21 VAL A 498 -4.656 -9.266 6.833 1.00 33.13 H new ATOM 0 HG22 VAL A 498 -4.100 -7.580 6.709 1.00 33.13 H new ATOM 0 HG23 VAL A 498 -5.792 -7.930 7.136 1.00 33.13 H new ATOM 1014 N LEU A 499 -5.542 -6.040 2.307 1.00 32.22 N ATOM 1015 CA LEU A 499 -5.899 -5.930 0.885 1.00 74.23 C ATOM 1016 C LEU A 499 -4.780 -6.527 0.005 1.00 74.04 C ATOM 1017 O LEU A 499 -3.617 -6.161 0.153 1.00 14.52 O ATOM 1018 CB LEU A 499 -6.125 -4.448 0.534 1.00 31.42 C ATOM 1019 CG LEU A 499 -6.919 -3.630 1.581 1.00 2.30 C ATOM 1020 CD1 LEU A 499 -7.028 -2.168 1.155 1.00 31.33 C ATOM 1021 CD2 LEU A 499 -8.311 -4.221 1.829 1.00 32.13 C ATOM 0 H LEU A 499 -4.760 -5.448 2.586 1.00 32.22 H new ATOM 0 HA LEU A 499 -6.815 -6.489 0.696 1.00 74.23 H new ATOM 0 HB2 LEU A 499 -5.154 -3.975 0.389 1.00 31.42 H new ATOM 0 HB3 LEU A 499 -6.651 -4.394 -0.419 1.00 31.42 H new ATOM 0 HG LEU A 499 -6.367 -3.681 2.520 1.00 2.30 H new ATOM 0 HD11 LEU A 499 -7.590 -1.611 1.905 1.00 31.33 H new ATOM 0 HD12 LEU A 499 -6.029 -1.742 1.059 1.00 31.33 H new ATOM 0 HD13 LEU A 499 -7.543 -2.106 0.196 1.00 31.33 H new ATOM 0 HD21 LEU A 499 -8.836 -3.618 2.570 1.00 32.13 H new ATOM 0 HD22 LEU A 499 -8.876 -4.224 0.897 1.00 32.13 H new ATOM 0 HD23 LEU A 499 -8.212 -5.242 2.197 1.00 32.13 H new ATOM 1033 N THR A 500 -5.120 -7.443 -0.908 1.00 73.22 N ATOM 1034 CA THR A 500 -4.095 -8.136 -1.721 1.00 0.21 C ATOM 1035 C THR A 500 -4.159 -7.772 -3.209 1.00 11.43 C ATOM 1036 O THR A 500 -5.156 -7.234 -3.703 1.00 65.15 O ATOM 1037 CB THR A 500 -4.207 -9.680 -1.619 1.00 23.15 C ATOM 1038 OG1 THR A 500 -5.480 -10.125 -2.116 1.00 15.30 O ATOM 1039 CG2 THR A 500 -4.015 -10.163 -0.187 1.00 15.11 C ATOM 0 H THR A 500 -6.080 -7.724 -1.107 1.00 73.22 H new ATOM 0 HA THR A 500 -3.148 -7.796 -1.303 1.00 0.21 H new ATOM 0 HB THR A 500 -3.412 -10.106 -2.230 1.00 23.15 H new ATOM 0 HG1 THR A 500 -5.535 -11.101 -2.047 1.00 15.30 H new ATOM 0 HG21 THR A 500 -4.100 -11.249 -0.155 1.00 15.11 H new ATOM 0 HG22 THR A 500 -3.028 -9.866 0.168 1.00 15.11 H new ATOM 0 HG23 THR A 500 -4.779 -9.720 0.452 1.00 15.11 H new ATOM 1047 N PHE A 501 -3.071 -8.075 -3.917 1.00 13.10 N ATOM 1048 CA PHE A 501 -3.014 -7.941 -5.377 1.00 72.45 C ATOM 1049 C PHE A 501 -2.010 -8.938 -5.981 1.00 35.44 C ATOM 1050 O PHE A 501 -1.004 -9.280 -5.352 1.00 20.04 O ATOM 1051 CB PHE A 501 -2.649 -6.503 -5.785 1.00 74.34 C ATOM 1052 CG PHE A 501 -1.322 -6.004 -5.253 1.00 52.35 C ATOM 1053 CD1 PHE A 501 -1.237 -5.435 -3.991 1.00 71.12 C ATOM 1054 CD2 PHE A 501 -0.168 -6.088 -6.023 1.00 73.21 C ATOM 1055 CE1 PHE A 501 -0.032 -4.958 -3.510 1.00 4.22 C ATOM 1056 CE2 PHE A 501 1.039 -5.614 -5.544 1.00 51.14 C ATOM 1057 CZ PHE A 501 1.108 -5.048 -4.286 1.00 51.02 C ATOM 0 H PHE A 501 -2.206 -8.419 -3.499 1.00 13.10 H new ATOM 0 HA PHE A 501 -4.005 -8.168 -5.770 1.00 72.45 H new ATOM 0 HB2 PHE A 501 -2.633 -6.443 -6.873 1.00 74.34 H new ATOM 0 HB3 PHE A 501 -3.437 -5.833 -5.441 1.00 74.34 H new ATOM 0 HD1 PHE A 501 -2.123 -5.364 -3.377 1.00 71.12 H new ATOM 0 HD2 PHE A 501 -0.215 -6.529 -7.008 1.00 73.21 H new ATOM 0 HE1 PHE A 501 0.019 -4.514 -2.527 1.00 4.22 H new ATOM 0 HE2 PHE A 501 1.928 -5.686 -6.153 1.00 51.14 H new ATOM 0 HZ PHE A 501 2.050 -4.677 -3.910 1.00 51.02 H new ATOM 1067 N SER A 502 -2.285 -9.402 -7.201 1.00 63.23 N ATOM 1068 CA SER A 502 -1.405 -10.364 -7.886 1.00 14.21 C ATOM 1069 C SER A 502 -0.779 -9.742 -9.143 1.00 30.12 C ATOM 1070 O SER A 502 -1.473 -9.431 -10.111 1.00 12.14 O ATOM 1071 CB SER A 502 -2.180 -11.640 -8.254 1.00 64.04 C ATOM 1072 OG SER A 502 -3.282 -11.362 -9.106 1.00 21.14 O ATOM 0 H SER A 502 -3.108 -9.131 -7.739 1.00 63.23 H new ATOM 0 HA SER A 502 -0.601 -10.629 -7.199 1.00 14.21 H new ATOM 0 HB2 SER A 502 -1.509 -12.343 -8.746 1.00 64.04 H new ATOM 0 HB3 SER A 502 -2.537 -12.123 -7.345 1.00 64.04 H new ATOM 0 HG SER A 502 -3.004 -10.736 -9.807 1.00 21.14 H new ATOM 1078 N TRP A 503 0.542 -9.585 -9.121 1.00 13.23 N ATOM 1079 CA TRP A 503 1.286 -8.902 -10.188 1.00 3.05 C ATOM 1080 C TRP A 503 2.099 -9.892 -11.041 1.00 23.32 C ATOM 1081 O TRP A 503 2.711 -10.826 -10.519 1.00 52.44 O ATOM 1082 CB TRP A 503 2.205 -7.843 -9.553 1.00 54.41 C ATOM 1083 CG TRP A 503 3.127 -7.141 -10.513 1.00 44.40 C ATOM 1084 CD1 TRP A 503 2.807 -6.581 -11.718 1.00 31.15 C ATOM 1085 CD2 TRP A 503 4.526 -6.900 -10.320 1.00 3.34 C ATOM 1086 NE1 TRP A 503 3.926 -6.026 -12.290 1.00 14.33 N ATOM 1087 CE2 TRP A 503 4.992 -6.204 -11.449 1.00 43.43 C ATOM 1088 CE3 TRP A 503 5.430 -7.211 -9.299 1.00 45.35 C ATOM 1089 CZ2 TRP A 503 6.321 -5.815 -11.586 1.00 64.12 C ATOM 1090 CZ3 TRP A 503 6.748 -6.825 -9.436 1.00 13.25 C ATOM 1091 CH2 TRP A 503 7.183 -6.130 -10.572 1.00 75.14 C ATOM 0 H TRP A 503 1.133 -9.927 -8.363 1.00 13.23 H new ATOM 0 HA TRP A 503 0.575 -8.420 -10.859 1.00 3.05 H new ATOM 0 HB2 TRP A 503 1.585 -7.096 -9.057 1.00 54.41 H new ATOM 0 HB3 TRP A 503 2.806 -8.322 -8.780 1.00 54.41 H new ATOM 0 HD1 TRP A 503 1.820 -6.576 -12.156 1.00 31.15 H new ATOM 0 HE1 TRP A 503 3.958 -5.557 -13.195 1.00 14.33 H new ATOM 0 HE3 TRP A 503 5.102 -7.744 -8.419 1.00 45.35 H new ATOM 0 HZ2 TRP A 503 6.660 -5.283 -12.463 1.00 64.12 H new ATOM 0 HZ3 TRP A 503 7.455 -7.062 -8.655 1.00 13.25 H new ATOM 0 HH2 TRP A 503 8.220 -5.837 -10.649 1.00 75.14 H new ATOM 1102 N THR A 504 2.074 -9.698 -12.360 1.00 73.30 N ATOM 1103 CA THR A 504 2.856 -10.526 -13.294 1.00 50.12 C ATOM 1104 C THR A 504 3.740 -9.651 -14.200 1.00 24.21 C ATOM 1105 O THR A 504 3.259 -9.055 -15.163 1.00 60.05 O ATOM 1106 CB THR A 504 1.942 -11.408 -14.185 1.00 2.40 C ATOM 1107 OG1 THR A 504 1.187 -12.319 -13.369 1.00 22.42 O ATOM 1108 CG2 THR A 504 2.755 -12.200 -15.206 1.00 0.21 C ATOM 0 H THR A 504 1.519 -8.972 -12.813 1.00 73.30 H new ATOM 0 HA THR A 504 3.485 -11.174 -12.684 1.00 50.12 H new ATOM 0 HB THR A 504 1.265 -10.744 -14.723 1.00 2.40 H new ATOM 0 HG1 THR A 504 0.612 -12.870 -13.940 1.00 22.42 H new ATOM 0 HG21 THR A 504 2.084 -12.807 -15.814 1.00 0.21 H new ATOM 0 HG22 THR A 504 3.303 -11.511 -15.849 1.00 0.21 H new ATOM 0 HG23 THR A 504 3.460 -12.849 -14.686 1.00 0.21 H new ATOM 1116 N PRO A 505 5.050 -9.553 -13.895 1.00 15.21 N ATOM 1117 CA PRO A 505 5.992 -8.762 -14.700 1.00 33.04 C ATOM 1118 C PRO A 505 6.509 -9.510 -15.944 1.00 24.12 C ATOM 1119 O PRO A 505 7.378 -10.377 -15.848 1.00 1.33 O ATOM 1120 CB PRO A 505 7.133 -8.499 -13.712 1.00 64.34 C ATOM 1121 CG PRO A 505 7.145 -9.701 -12.825 1.00 34.21 C ATOM 1122 CD PRO A 505 5.713 -10.183 -12.734 1.00 74.21 C ATOM 0 HA PRO A 505 5.528 -7.863 -15.106 1.00 33.04 H new ATOM 0 HB2 PRO A 505 8.085 -8.378 -14.229 1.00 64.34 H new ATOM 0 HB3 PRO A 505 6.961 -7.586 -13.141 1.00 64.34 H new ATOM 0 HG2 PRO A 505 7.791 -10.478 -13.234 1.00 34.21 H new ATOM 0 HG3 PRO A 505 7.533 -9.451 -11.838 1.00 34.21 H new ATOM 0 HD2 PRO A 505 5.654 -11.270 -12.782 1.00 74.21 H new ATOM 0 HD3 PRO A 505 5.248 -9.880 -11.796 1.00 74.21 H new ATOM 1130 N THR A 506 5.962 -9.179 -17.114 1.00 64.23 N ATOM 1131 CA THR A 506 6.396 -9.802 -18.373 1.00 52.35 C ATOM 1132 C THR A 506 7.736 -9.227 -18.842 1.00 3.23 C ATOM 1133 O THR A 506 8.451 -9.851 -19.625 1.00 43.34 O ATOM 1134 CB THR A 506 5.359 -9.612 -19.505 1.00 74.44 C ATOM 1135 OG1 THR A 506 5.199 -8.218 -19.805 1.00 13.41 O ATOM 1136 CG2 THR A 506 4.010 -10.212 -19.116 1.00 13.42 C ATOM 0 H THR A 506 5.221 -8.487 -17.220 1.00 64.23 H new ATOM 0 HA THR A 506 6.501 -10.866 -18.163 1.00 52.35 H new ATOM 0 HB THR A 506 5.728 -10.131 -20.390 1.00 74.44 H new ATOM 0 HG1 THR A 506 4.542 -8.111 -20.524 1.00 13.41 H new ATOM 0 HG21 THR A 506 3.299 -10.065 -19.929 1.00 13.42 H new ATOM 0 HG22 THR A 506 4.128 -11.279 -18.925 1.00 13.42 H new ATOM 0 HG23 THR A 506 3.639 -9.721 -18.216 1.00 13.42 H new ATOM 1144 N GLN A 507 8.064 -8.027 -18.365 1.00 64.43 N ATOM 1145 CA GLN A 507 9.347 -7.388 -18.679 1.00 44.44 C ATOM 1146 C GLN A 507 10.285 -7.384 -17.459 1.00 63.21 C ATOM 1147 O GLN A 507 9.923 -6.902 -16.382 1.00 22.00 O ATOM 1148 CB GLN A 507 9.117 -5.953 -19.179 1.00 60.23 C ATOM 1149 CG GLN A 507 10.406 -5.176 -19.437 1.00 65.43 C ATOM 1150 CD GLN A 507 10.170 -3.821 -20.082 1.00 62.25 C ATOM 1151 OE1 GLN A 507 9.125 -3.201 -19.903 1.00 3.45 O ATOM 1152 NE2 GLN A 507 11.145 -3.344 -20.828 1.00 41.00 N ATOM 0 H GLN A 507 7.459 -7.474 -17.758 1.00 64.43 H new ATOM 0 HA GLN A 507 9.827 -7.968 -19.468 1.00 44.44 H new ATOM 0 HB2 GLN A 507 8.534 -5.988 -20.100 1.00 60.23 H new ATOM 0 HB3 GLN A 507 8.520 -5.414 -18.444 1.00 60.23 H new ATOM 0 HG2 GLN A 507 10.932 -5.035 -18.493 1.00 65.43 H new ATOM 0 HG3 GLN A 507 11.057 -5.768 -20.080 1.00 65.43 H new ATOM 0 HE21 GLN A 507 12.000 -3.885 -20.956 1.00 41.00 H new ATOM 0 HE22 GLN A 507 11.045 -2.434 -21.277 1.00 41.00 H new ATOM 1161 N GLU A 508 11.492 -7.914 -17.644 1.00 34.43 N ATOM 1162 CA GLU A 508 12.491 -8.003 -16.568 1.00 55.40 C ATOM 1163 C GLU A 508 13.054 -6.624 -16.174 1.00 22.24 C ATOM 1164 O GLU A 508 13.109 -5.701 -16.989 1.00 40.41 O ATOM 1165 CB GLU A 508 13.637 -8.946 -16.979 1.00 41.53 C ATOM 1166 CG GLU A 508 14.546 -8.426 -18.100 1.00 74.31 C ATOM 1167 CD GLU A 508 13.821 -8.167 -19.415 1.00 3.54 C ATOM 1168 OE1 GLU A 508 13.185 -9.103 -19.953 1.00 12.15 O ATOM 1169 OE2 GLU A 508 13.885 -7.026 -19.925 1.00 5.12 O ATOM 0 H GLU A 508 11.809 -8.293 -18.536 1.00 34.43 H new ATOM 0 HA GLU A 508 11.983 -8.408 -15.692 1.00 55.40 H new ATOM 0 HB2 GLU A 508 14.251 -9.149 -16.101 1.00 41.53 H new ATOM 0 HB3 GLU A 508 13.207 -9.897 -17.294 1.00 41.53 H new ATOM 0 HG2 GLU A 508 15.020 -7.502 -17.770 1.00 74.31 H new ATOM 0 HG3 GLU A 508 15.343 -9.149 -18.273 1.00 74.31 H new ATOM 1176 N GLY A 509 13.458 -6.487 -14.912 1.00 43.03 N ATOM 1177 CA GLY A 509 14.022 -5.227 -14.433 1.00 74.10 C ATOM 1178 C GLY A 509 13.861 -5.034 -12.929 1.00 64.54 C ATOM 1179 O GLY A 509 13.422 -5.941 -12.219 1.00 2.33 O ATOM 0 H GLY A 509 13.406 -7.225 -14.210 1.00 43.03 H new ATOM 0 HA2 GLY A 509 15.081 -5.190 -14.687 1.00 74.10 H new ATOM 0 HA3 GLY A 509 13.541 -4.399 -14.953 1.00 74.10 H new ATOM 1183 N MET A 510 14.221 -3.852 -12.439 1.00 15.33 N ATOM 1184 CA MET A 510 14.110 -3.539 -11.010 1.00 12.21 C ATOM 1185 C MET A 510 12.841 -2.713 -10.730 1.00 52.43 C ATOM 1186 O MET A 510 12.618 -1.678 -11.359 1.00 74.55 O ATOM 1187 CB MET A 510 15.359 -2.776 -10.547 1.00 4.14 C ATOM 1188 CG MET A 510 15.615 -2.890 -9.055 1.00 63.41 C ATOM 1189 SD MET A 510 15.914 -4.598 -8.558 1.00 61.14 S ATOM 1190 CE MET A 510 16.148 -4.391 -6.799 1.00 54.32 C ATOM 0 H MET A 510 14.593 -3.091 -13.008 1.00 15.33 H new ATOM 0 HA MET A 510 14.036 -4.472 -10.452 1.00 12.21 H new ATOM 0 HB2 MET A 510 16.227 -3.153 -11.087 1.00 4.14 H new ATOM 0 HB3 MET A 510 15.252 -1.724 -10.811 1.00 4.14 H new ATOM 0 HG2 MET A 510 16.475 -2.277 -8.785 1.00 63.41 H new ATOM 0 HG3 MET A 510 14.759 -2.496 -8.508 1.00 63.41 H new ATOM 0 HE1 MET A 510 17.106 -4.820 -6.506 1.00 54.32 H new ATOM 0 HE2 MET A 510 16.136 -3.329 -6.553 1.00 54.32 H new ATOM 0 HE3 MET A 510 15.345 -4.897 -6.263 1.00 54.32 H new ATOM 1200 N TYR A 511 12.012 -3.168 -9.788 1.00 53.22 N ATOM 1201 CA TYR A 511 10.723 -2.514 -9.514 1.00 62.04 C ATOM 1202 C TYR A 511 10.489 -2.291 -8.012 1.00 43.24 C ATOM 1203 O TYR A 511 10.304 -3.237 -7.253 1.00 12.21 O ATOM 1204 CB TYR A 511 9.574 -3.353 -10.092 1.00 33.15 C ATOM 1205 CG TYR A 511 9.634 -3.533 -11.600 1.00 11.20 C ATOM 1206 CD1 TYR A 511 10.320 -4.601 -12.167 1.00 13.11 C ATOM 1207 CD2 TYR A 511 9.000 -2.637 -12.454 1.00 0.10 C ATOM 1208 CE1 TYR A 511 10.373 -4.770 -13.536 1.00 3.55 C ATOM 1209 CE2 TYR A 511 9.051 -2.800 -13.825 1.00 13.01 C ATOM 1210 CZ TYR A 511 9.738 -3.869 -14.360 1.00 75.33 C ATOM 1211 OH TYR A 511 9.796 -4.033 -15.730 1.00 42.31 O ATOM 0 H TYR A 511 12.205 -3.981 -9.203 1.00 53.22 H new ATOM 0 HA TYR A 511 10.751 -1.536 -9.994 1.00 62.04 H new ATOM 0 HB2 TYR A 511 9.582 -4.335 -9.619 1.00 33.15 H new ATOM 0 HB3 TYR A 511 8.627 -2.881 -9.831 1.00 33.15 H new ATOM 0 HD1 TYR A 511 10.820 -5.311 -11.525 1.00 13.11 H new ATOM 0 HD2 TYR A 511 8.459 -1.800 -12.039 1.00 0.10 H new ATOM 0 HE1 TYR A 511 10.911 -5.606 -13.959 1.00 3.55 H new ATOM 0 HE2 TYR A 511 8.555 -2.094 -14.474 1.00 13.01 H new ATOM 0 HH TYR A 511 9.823 -4.989 -15.944 1.00 42.31 H new ATOM 1221 N ARG A 512 10.490 -1.031 -7.590 1.00 43.20 N ATOM 1222 CA ARG A 512 10.194 -0.681 -6.196 1.00 42.23 C ATOM 1223 C ARG A 512 8.700 -0.368 -6.018 1.00 54.14 C ATOM 1224 O ARG A 512 8.173 0.568 -6.624 1.00 33.43 O ATOM 1225 CB ARG A 512 11.045 0.520 -5.754 1.00 41.23 C ATOM 1226 CG ARG A 512 10.870 0.893 -4.281 1.00 30.33 C ATOM 1227 CD ARG A 512 11.816 2.015 -3.859 1.00 15.04 C ATOM 1228 NE ARG A 512 11.559 3.262 -4.577 1.00 41.42 N ATOM 1229 CZ ARG A 512 12.441 4.213 -4.732 1.00 71.43 C ATOM 1230 NH1 ARG A 512 13.632 4.095 -4.240 1.00 74.23 N ATOM 1231 NH2 ARG A 512 12.125 5.289 -5.371 1.00 71.52 N ATOM 0 H ARG A 512 10.692 -0.231 -8.190 1.00 43.20 H new ATOM 0 HA ARG A 512 10.443 -1.537 -5.569 1.00 42.23 H new ATOM 0 HB2 ARG A 512 12.096 0.297 -5.940 1.00 41.23 H new ATOM 0 HB3 ARG A 512 10.788 1.382 -6.370 1.00 41.23 H new ATOM 0 HG2 ARG A 512 9.840 1.202 -4.105 1.00 30.33 H new ATOM 0 HG3 ARG A 512 11.050 0.015 -3.661 1.00 30.33 H new ATOM 0 HD2 ARG A 512 11.714 2.188 -2.788 1.00 15.04 H new ATOM 0 HD3 ARG A 512 12.846 1.704 -4.035 1.00 15.04 H new ATOM 0 HE ARG A 512 10.633 3.398 -4.982 1.00 41.42 H new ATOM 0 HH11 ARG A 512 13.890 3.253 -3.725 1.00 74.23 H new ATOM 0 HH12 ARG A 512 14.313 4.844 -4.367 1.00 74.23 H new ATOM 0 HH21 ARG A 512 11.186 5.397 -5.755 1.00 71.52 H new ATOM 0 HH22 ARG A 512 12.814 6.031 -5.492 1.00 71.52 H new ATOM 1245 N ILE A 513 8.024 -1.157 -5.188 1.00 62.41 N ATOM 1246 CA ILE A 513 6.586 -0.994 -4.953 1.00 20.21 C ATOM 1247 C ILE A 513 6.312 -0.143 -3.701 1.00 40.21 C ATOM 1248 O ILE A 513 6.839 -0.413 -2.620 1.00 32.23 O ATOM 1249 CB ILE A 513 5.889 -2.373 -4.794 1.00 34.44 C ATOM 1250 CG1 ILE A 513 6.086 -3.224 -6.063 1.00 11.40 C ATOM 1251 CG2 ILE A 513 4.401 -2.198 -4.485 1.00 74.21 C ATOM 1252 CD1 ILE A 513 5.449 -4.599 -5.990 1.00 34.24 C ATOM 0 H ILE A 513 8.449 -1.921 -4.662 1.00 62.41 H new ATOM 0 HA ILE A 513 6.178 -0.480 -5.824 1.00 20.21 H new ATOM 0 HB ILE A 513 6.348 -2.895 -3.954 1.00 34.44 H new ATOM 0 HG12 ILE A 513 5.670 -2.687 -6.916 1.00 11.40 H new ATOM 0 HG13 ILE A 513 7.154 -3.339 -6.248 1.00 11.40 H new ATOM 0 HG21 ILE A 513 3.934 -3.177 -4.378 1.00 74.21 H new ATOM 0 HG22 ILE A 513 4.286 -1.637 -3.557 1.00 74.21 H new ATOM 0 HG23 ILE A 513 3.922 -1.655 -5.299 1.00 74.21 H new ATOM 0 HD11 ILE A 513 5.632 -5.135 -6.921 1.00 34.24 H new ATOM 0 HD12 ILE A 513 5.881 -5.157 -5.159 1.00 34.24 H new ATOM 0 HD13 ILE A 513 4.375 -4.495 -5.837 1.00 34.24 H new ATOM 1264 N ASN A 514 5.488 0.889 -3.857 1.00 24.14 N ATOM 1265 CA ASN A 514 5.096 1.754 -2.737 1.00 1.32 C ATOM 1266 C ASN A 514 3.573 1.761 -2.548 1.00 22.14 C ATOM 1267 O ASN A 514 2.817 1.550 -3.496 1.00 73.40 O ATOM 1268 CB ASN A 514 5.589 3.189 -2.963 1.00 63.12 C ATOM 1269 CG ASN A 514 7.103 3.287 -3.013 1.00 71.12 C ATOM 1270 OD1 ASN A 514 7.713 3.199 -4.078 1.00 70.10 O ATOM 1271 ND2 ASN A 514 7.724 3.472 -1.865 1.00 71.01 N ATOM 0 H ASN A 514 5.074 1.152 -4.752 1.00 24.14 H new ATOM 0 HA ASN A 514 5.559 1.352 -1.836 1.00 1.32 H new ATOM 0 HB2 ASN A 514 5.173 3.569 -3.896 1.00 63.12 H new ATOM 0 HB3 ASN A 514 5.214 3.828 -2.164 1.00 63.12 H new ATOM 0 HD21 ASN A 514 8.741 3.547 -1.842 1.00 71.01 H new ATOM 0 HD22 ASN A 514 7.187 3.541 -1.000 1.00 71.01 H new ATOM 1278 N ALA A 515 3.127 2.003 -1.320 1.00 3.22 N ATOM 1279 CA ALA A 515 1.694 2.093 -1.016 1.00 41.12 C ATOM 1280 C ALA A 515 1.372 3.379 -0.245 1.00 34.45 C ATOM 1281 O ALA A 515 2.083 3.747 0.693 1.00 40.11 O ATOM 1282 CB ALA A 515 1.233 0.870 -0.227 1.00 21.33 C ATOM 0 H ALA A 515 3.735 2.141 -0.513 1.00 3.22 H new ATOM 0 HA ALA A 515 1.153 2.121 -1.962 1.00 41.12 H new ATOM 0 HB1 ALA A 515 0.168 0.956 -0.012 1.00 21.33 H new ATOM 0 HB2 ALA A 515 1.413 -0.031 -0.814 1.00 21.33 H new ATOM 0 HB3 ALA A 515 1.789 0.810 0.709 1.00 21.33 H new ATOM 1288 N THR A 516 0.303 4.055 -0.648 1.00 42.43 N ATOM 1289 CA THR A 516 -0.140 5.295 0.005 1.00 50.25 C ATOM 1290 C THR A 516 -1.588 5.188 0.483 1.00 54.21 C ATOM 1291 O THR A 516 -2.391 4.457 -0.100 1.00 0.35 O ATOM 1292 CB THR A 516 -0.033 6.516 -0.950 1.00 11.33 C ATOM 1293 OG1 THR A 516 -0.722 6.245 -2.181 1.00 71.24 O ATOM 1294 CG2 THR A 516 1.424 6.858 -1.245 1.00 41.41 C ATOM 0 H THR A 516 -0.283 3.767 -1.432 1.00 42.43 H new ATOM 0 HA THR A 516 0.521 5.441 0.859 1.00 50.25 H new ATOM 0 HB THR A 516 -0.496 7.369 -0.454 1.00 11.33 H new ATOM 0 HG1 THR A 516 -1.687 6.202 -2.013 1.00 71.24 H new ATOM 0 HG21 THR A 516 1.468 7.716 -1.916 1.00 41.41 H new ATOM 0 HG22 THR A 516 1.937 7.099 -0.314 1.00 41.41 H new ATOM 0 HG23 THR A 516 1.910 6.004 -1.717 1.00 41.41 H new ATOM 1302 N VAL A 517 -1.908 5.893 1.567 1.00 12.30 N ATOM 1303 CA VAL A 517 -3.298 6.032 2.008 1.00 13.41 C ATOM 1304 C VAL A 517 -3.743 7.512 2.017 1.00 61.21 C ATOM 1305 O VAL A 517 -2.989 8.393 2.436 1.00 71.10 O ATOM 1306 CB VAL A 517 -3.505 5.397 3.409 1.00 73.24 C ATOM 1307 CG1 VAL A 517 -2.549 5.999 4.433 1.00 33.43 C ATOM 1308 CG2 VAL A 517 -4.957 5.540 3.863 1.00 42.23 C ATOM 0 H VAL A 517 -1.228 6.375 2.155 1.00 12.30 H new ATOM 0 HA VAL A 517 -3.921 5.497 1.291 1.00 13.41 H new ATOM 0 HB VAL A 517 -3.280 4.333 3.331 1.00 73.24 H new ATOM 0 HG11 VAL A 517 -2.717 5.535 5.405 1.00 33.43 H new ATOM 0 HG12 VAL A 517 -1.520 5.821 4.119 1.00 33.43 H new ATOM 0 HG13 VAL A 517 -2.725 7.072 4.508 1.00 33.43 H new ATOM 0 HG21 VAL A 517 -5.077 5.087 4.847 1.00 42.23 H new ATOM 0 HG22 VAL A 517 -5.220 6.597 3.915 1.00 42.23 H new ATOM 0 HG23 VAL A 517 -5.612 5.038 3.151 1.00 42.23 H new ATOM 1318 N ASP A 518 -4.985 7.756 1.575 1.00 14.23 N ATOM 1319 CA ASP A 518 -5.533 9.115 1.384 1.00 32.12 C ATOM 1320 C ASP A 518 -4.516 10.048 0.697 1.00 32.41 C ATOM 1321 O ASP A 518 -3.967 10.969 1.309 1.00 62.12 O ATOM 1322 CB ASP A 518 -6.027 9.717 2.711 1.00 42.23 C ATOM 1323 CG ASP A 518 -6.780 11.032 2.511 1.00 42.34 C ATOM 1324 OD1 ASP A 518 -7.677 11.090 1.639 1.00 20.23 O ATOM 1325 OD2 ASP A 518 -6.487 12.012 3.225 1.00 63.01 O ATOM 0 H ASP A 518 -5.645 7.015 1.337 1.00 14.23 H new ATOM 0 HA ASP A 518 -6.394 9.022 0.722 1.00 32.12 H new ATOM 0 HB2 ASP A 518 -6.679 9.001 3.211 1.00 42.23 H new ATOM 0 HB3 ASP A 518 -5.175 9.886 3.369 1.00 42.23 H new ATOM 1330 N GLU A 519 -4.271 9.793 -0.587 1.00 34.33 N ATOM 1331 CA GLU A 519 -3.290 10.560 -1.366 1.00 70.42 C ATOM 1332 C GLU A 519 -3.681 12.043 -1.457 1.00 21.12 C ATOM 1333 O GLU A 519 -2.821 12.924 -1.508 1.00 42.51 O ATOM 1334 CB GLU A 519 -3.148 9.981 -2.786 1.00 71.24 C ATOM 1335 CG GLU A 519 -2.740 8.509 -2.849 1.00 14.33 C ATOM 1336 CD GLU A 519 -3.856 7.547 -2.457 1.00 23.22 C ATOM 1337 OE1 GLU A 519 -5.042 7.898 -2.639 1.00 1.25 O ATOM 1338 OE2 GLU A 519 -3.546 6.436 -1.986 1.00 54.35 O ATOM 0 H GLU A 519 -4.739 9.057 -1.116 1.00 34.33 H new ATOM 0 HA GLU A 519 -2.335 10.483 -0.847 1.00 70.42 H new ATOM 0 HB2 GLU A 519 -4.098 10.101 -3.307 1.00 71.24 H new ATOM 0 HB3 GLU A 519 -2.409 10.570 -3.330 1.00 71.24 H new ATOM 0 HG2 GLU A 519 -2.410 8.276 -3.861 1.00 14.33 H new ATOM 0 HG3 GLU A 519 -1.886 8.349 -2.190 1.00 14.33 H new ATOM 1345 N GLU A 520 -4.985 12.306 -1.489 1.00 54.42 N ATOM 1346 CA GLU A 520 -5.504 13.674 -1.608 1.00 3.33 C ATOM 1347 C GLU A 520 -5.255 14.514 -0.344 1.00 34.10 C ATOM 1348 O GLU A 520 -5.421 15.736 -0.369 1.00 64.11 O ATOM 1349 CB GLU A 520 -7.005 13.641 -1.897 1.00 22.24 C ATOM 1350 CG GLU A 520 -7.375 12.928 -3.189 1.00 44.35 C ATOM 1351 CD GLU A 520 -8.872 12.945 -3.448 1.00 72.33 C ATOM 1352 OE1 GLU A 520 -9.369 13.925 -4.040 1.00 24.22 O ATOM 1353 OE2 GLU A 520 -9.563 11.983 -3.051 1.00 65.23 O ATOM 0 H GLU A 520 -5.708 11.589 -1.434 1.00 54.42 H new ATOM 0 HA GLU A 520 -4.966 14.144 -2.431 1.00 3.33 H new ATOM 0 HB2 GLU A 520 -7.513 13.151 -1.066 1.00 22.24 H new ATOM 0 HB3 GLU A 520 -7.378 14.664 -1.940 1.00 22.24 H new ATOM 0 HG2 GLU A 520 -6.859 13.402 -4.024 1.00 44.35 H new ATOM 0 HG3 GLU A 520 -7.028 11.896 -3.144 1.00 44.35 H new ATOM 1360 N ASN A 521 -4.882 13.857 0.759 1.00 71.21 N ATOM 1361 CA ASN A 521 -4.652 14.541 2.040 1.00 62.52 C ATOM 1362 C ASN A 521 -5.908 15.330 2.462 1.00 64.12 C ATOM 1363 O ASN A 521 -5.866 16.544 2.674 1.00 54.14 O ATOM 1364 CB ASN A 521 -3.425 15.465 1.935 1.00 14.10 C ATOM 1365 CG ASN A 521 -2.948 15.985 3.283 1.00 15.30 C ATOM 1366 OD1 ASN A 521 -2.117 15.371 3.940 1.00 53.40 O ATOM 1367 ND2 ASN A 521 -3.464 17.121 3.701 1.00 34.02 N ATOM 0 H ASN A 521 -4.732 12.849 0.792 1.00 71.21 H new ATOM 0 HA ASN A 521 -4.451 13.795 2.809 1.00 62.52 H new ATOM 0 HB2 ASN A 521 -2.611 14.924 1.453 1.00 14.10 H new ATOM 0 HB3 ASN A 521 -3.669 16.311 1.293 1.00 14.10 H new ATOM 0 HD21 ASN A 521 -3.173 17.514 4.596 1.00 34.02 H new ATOM 0 HD22 ASN A 521 -4.155 17.608 3.130 1.00 34.02 H new ATOM 1374 N THR A 522 -7.032 14.628 2.551 1.00 4.42 N ATOM 1375 CA THR A 522 -8.310 15.243 2.931 1.00 62.13 C ATOM 1376 C THR A 522 -8.460 15.309 4.455 1.00 2.41 C ATOM 1377 O THR A 522 -9.088 16.222 4.997 1.00 3.33 O ATOM 1378 CB THR A 522 -9.520 14.469 2.350 1.00 21.02 C ATOM 1379 OG1 THR A 522 -9.585 13.147 2.910 1.00 70.34 O ATOM 1380 CG2 THR A 522 -9.437 14.375 0.828 1.00 24.53 C ATOM 0 H THR A 522 -7.090 13.627 2.365 1.00 4.42 H new ATOM 0 HA THR A 522 -8.300 16.251 2.516 1.00 62.13 H new ATOM 0 HB THR A 522 -10.423 15.020 2.615 1.00 21.02 H new ATOM 0 HG1 THR A 522 -8.960 12.560 2.435 1.00 70.34 H new ATOM 0 HG21 THR A 522 -10.300 13.827 0.450 1.00 24.53 H new ATOM 0 HG22 THR A 522 -9.429 15.378 0.401 1.00 24.53 H new ATOM 0 HG23 THR A 522 -8.523 13.853 0.545 1.00 24.53 H new ATOM 1388 N VAL A 523 -7.881 14.330 5.140 1.00 24.44 N ATOM 1389 CA VAL A 523 -7.920 14.268 6.603 1.00 24.41 C ATOM 1390 C VAL A 523 -6.520 14.509 7.205 1.00 3.33 C ATOM 1391 O VAL A 523 -5.509 14.088 6.641 1.00 32.33 O ATOM 1392 CB VAL A 523 -8.500 12.910 7.084 1.00 65.54 C ATOM 1393 CG1 VAL A 523 -7.674 11.734 6.561 1.00 42.22 C ATOM 1394 CG2 VAL A 523 -8.618 12.873 8.606 1.00 45.41 C ATOM 0 H VAL A 523 -7.374 13.560 4.704 1.00 24.44 H new ATOM 0 HA VAL A 523 -8.579 15.062 6.954 1.00 24.41 H new ATOM 0 HB VAL A 523 -9.504 12.813 6.670 1.00 65.54 H new ATOM 0 HG11 VAL A 523 -8.107 10.799 6.916 1.00 42.22 H new ATOM 0 HG12 VAL A 523 -7.676 11.744 5.471 1.00 42.22 H new ATOM 0 HG13 VAL A 523 -6.649 11.820 6.923 1.00 42.22 H new ATOM 0 HG21 VAL A 523 -9.027 11.911 8.916 1.00 45.41 H new ATOM 0 HG22 VAL A 523 -7.632 13.009 9.051 1.00 45.41 H new ATOM 0 HG23 VAL A 523 -9.280 13.673 8.939 1.00 45.41 H new ATOM 1404 N VAL A 524 -6.463 15.229 8.328 1.00 74.34 N ATOM 1405 CA VAL A 524 -5.184 15.585 8.958 1.00 21.42 C ATOM 1406 C VAL A 524 -4.724 14.506 9.951 1.00 52.51 C ATOM 1407 O VAL A 524 -5.327 14.325 11.014 1.00 52.31 O ATOM 1408 CB VAL A 524 -5.278 16.950 9.691 1.00 64.32 C ATOM 1409 CG1 VAL A 524 -3.932 17.333 10.310 1.00 23.25 C ATOM 1410 CG2 VAL A 524 -5.770 18.041 8.740 1.00 31.24 C ATOM 0 H VAL A 524 -7.285 15.578 8.821 1.00 74.34 H new ATOM 0 HA VAL A 524 -4.450 15.661 8.156 1.00 21.42 H new ATOM 0 HB VAL A 524 -6.003 16.851 10.499 1.00 64.32 H new ATOM 0 HG11 VAL A 524 -4.025 18.293 10.817 1.00 23.25 H new ATOM 0 HG12 VAL A 524 -3.632 16.570 11.029 1.00 23.25 H new ATOM 0 HG13 VAL A 524 -3.179 17.409 9.525 1.00 23.25 H new ATOM 0 HG21 VAL A 524 -5.829 18.990 9.274 1.00 31.24 H new ATOM 0 HG22 VAL A 524 -5.075 18.137 7.905 1.00 31.24 H new ATOM 0 HG23 VAL A 524 -6.757 17.776 8.362 1.00 31.24 H new ATOM 1420 N GLU A 525 -3.635 13.817 9.612 1.00 72.10 N ATOM 1421 CA GLU A 525 -3.126 12.707 10.430 1.00 73.13 C ATOM 1422 C GLU A 525 -2.097 13.178 11.468 1.00 3.42 C ATOM 1423 O GLU A 525 -1.558 14.285 11.379 1.00 4.22 O ATOM 1424 CB GLU A 525 -2.483 11.641 9.528 1.00 50.22 C ATOM 1425 CG GLU A 525 -3.394 11.136 8.416 1.00 21.31 C ATOM 1426 CD GLU A 525 -4.722 10.622 8.940 1.00 31.34 C ATOM 1427 OE1 GLU A 525 -4.784 9.455 9.373 1.00 32.40 O ATOM 1428 OE2 GLU A 525 -5.699 11.390 8.934 1.00 4.32 O ATOM 0 H GLU A 525 -3.084 14.006 8.775 1.00 72.10 H new ATOM 0 HA GLU A 525 -3.976 12.285 10.966 1.00 73.13 H new ATOM 0 HB2 GLU A 525 -1.579 12.055 9.082 1.00 50.22 H new ATOM 0 HB3 GLU A 525 -2.177 10.796 10.144 1.00 50.22 H new ATOM 0 HG2 GLU A 525 -3.575 11.942 7.705 1.00 21.31 H new ATOM 0 HG3 GLU A 525 -2.889 10.338 7.871 1.00 21.31 H new ATOM 1435 N LEU A 526 -1.837 12.328 12.458 1.00 61.14 N ATOM 1436 CA LEU A 526 -0.819 12.602 13.479 1.00 5.35 C ATOM 1437 C LEU A 526 0.595 12.478 12.889 1.00 11.43 C ATOM 1438 O LEU A 526 1.495 13.260 13.211 1.00 33.30 O ATOM 1439 CB LEU A 526 -0.984 11.617 14.645 1.00 43.52 C ATOM 1440 CG LEU A 526 -2.343 11.668 15.362 1.00 55.52 C ATOM 1441 CD1 LEU A 526 -2.485 10.503 16.339 1.00 72.34 C ATOM 1442 CD2 LEU A 526 -2.519 13.002 16.082 1.00 1.31 C ATOM 0 H LEU A 526 -2.319 11.437 12.578 1.00 61.14 H new ATOM 0 HA LEU A 526 -0.952 13.622 13.838 1.00 5.35 H new ATOM 0 HB2 LEU A 526 -0.828 10.606 14.269 1.00 43.52 H new ATOM 0 HB3 LEU A 526 -0.199 11.810 15.376 1.00 43.52 H new ATOM 0 HG LEU A 526 -3.129 11.577 14.612 1.00 55.52 H new ATOM 0 HD11 LEU A 526 -3.454 10.560 16.835 1.00 72.34 H new ATOM 0 HD12 LEU A 526 -2.410 9.561 15.796 1.00 72.34 H new ATOM 0 HD13 LEU A 526 -1.692 10.555 17.085 1.00 72.34 H new ATOM 0 HD21 LEU A 526 -3.487 13.020 16.584 1.00 1.31 H new ATOM 0 HD22 LEU A 526 -1.726 13.125 16.819 1.00 1.31 H new ATOM 0 HD23 LEU A 526 -2.471 13.815 15.358 1.00 1.31 H new ATOM 1454 N ASN A 527 0.779 11.487 12.025 1.00 31.02 N ATOM 1455 CA ASN A 527 2.055 11.267 11.343 1.00 41.31 C ATOM 1456 C ASN A 527 1.832 11.127 9.827 1.00 54.54 C ATOM 1457 O ASN A 527 1.282 10.130 9.365 1.00 54.42 O ATOM 1458 CB ASN A 527 2.729 10.005 11.903 1.00 13.25 C ATOM 1459 CG ASN A 527 4.151 9.810 11.403 1.00 21.01 C ATOM 1460 OD1 ASN A 527 4.528 10.290 10.340 1.00 1.12 O ATOM 1461 ND2 ASN A 527 4.946 9.080 12.153 1.00 54.33 N ATOM 0 H ASN A 527 0.054 10.814 11.776 1.00 31.02 H new ATOM 0 HA ASN A 527 2.705 12.124 11.517 1.00 41.31 H new ATOM 0 HB2 ASN A 527 2.738 10.059 12.992 1.00 13.25 H new ATOM 0 HB3 ASN A 527 2.133 9.133 11.632 1.00 13.25 H new ATOM 0 HD21 ASN A 527 5.905 8.900 11.855 1.00 54.33 H new ATOM 0 HD22 ASN A 527 4.604 8.694 13.033 1.00 54.33 H new ATOM 1468 N GLU A 528 2.278 12.119 9.051 1.00 12.11 N ATOM 1469 CA GLU A 528 2.063 12.110 7.596 1.00 4.30 C ATOM 1470 C GLU A 528 3.127 11.265 6.877 1.00 33.35 C ATOM 1471 O GLU A 528 2.916 10.799 5.755 1.00 3.54 O ATOM 1472 CB GLU A 528 2.063 13.539 7.032 1.00 22.35 C ATOM 1473 CG GLU A 528 3.374 14.291 7.237 1.00 14.43 C ATOM 1474 CD GLU A 528 3.408 15.606 6.475 1.00 34.51 C ATOM 1475 OE1 GLU A 528 2.757 16.576 6.917 1.00 54.33 O ATOM 1476 OE2 GLU A 528 4.075 15.670 5.422 1.00 62.43 O ATOM 0 H GLU A 528 2.786 12.932 9.399 1.00 12.11 H new ATOM 0 HA GLU A 528 1.087 11.660 7.416 1.00 4.30 H new ATOM 0 HB2 GLU A 528 1.844 13.497 5.965 1.00 22.35 H new ATOM 0 HB3 GLU A 528 1.256 14.103 7.501 1.00 22.35 H new ATOM 0 HG2 GLU A 528 3.517 14.485 8.300 1.00 14.43 H new ATOM 0 HG3 GLU A 528 4.205 13.664 6.913 1.00 14.43 H new ATOM 1483 N ASN A 529 4.268 11.066 7.532 1.00 51.30 N ATOM 1484 CA ASN A 529 5.331 10.209 6.996 1.00 43.13 C ATOM 1485 C ASN A 529 4.963 8.721 7.147 1.00 22.53 C ATOM 1486 O ASN A 529 5.592 7.846 6.552 1.00 72.01 O ATOM 1487 CB ASN A 529 6.653 10.501 7.719 1.00 72.33 C ATOM 1488 CG ASN A 529 7.082 11.957 7.602 1.00 20.51 C ATOM 1489 OD1 ASN A 529 7.692 12.510 8.512 1.00 10.01 O ATOM 1490 ND2 ASN A 529 6.786 12.589 6.481 1.00 3.54 N ATOM 0 H ASN A 529 4.484 11.486 8.436 1.00 51.30 H new ATOM 0 HA ASN A 529 5.447 10.427 5.934 1.00 43.13 H new ATOM 0 HB2 ASN A 529 6.550 10.241 8.773 1.00 72.33 H new ATOM 0 HB3 ASN A 529 7.435 9.863 7.308 1.00 72.33 H new ATOM 0 HD21 ASN A 529 7.065 13.562 6.355 1.00 3.54 H new ATOM 0 HD22 ASN A 529 6.278 12.104 5.741 1.00 3.54 H new ATOM 1497 N ASN A 530 3.923 8.454 7.934 1.00 44.10 N ATOM 1498 CA ASN A 530 3.476 7.084 8.213 1.00 62.42 C ATOM 1499 C ASN A 530 2.490 6.588 7.131 1.00 2.15 C ATOM 1500 O ASN A 530 2.229 5.391 7.015 1.00 51.33 O ATOM 1501 CB ASN A 530 2.819 7.046 9.604 1.00 41.30 C ATOM 1502 CG ASN A 530 2.872 5.678 10.258 1.00 74.14 C ATOM 1503 OD1 ASN A 530 3.769 4.883 9.998 1.00 65.05 O ATOM 1504 ND2 ASN A 530 1.924 5.402 11.131 1.00 50.13 N ATOM 0 H ASN A 530 3.367 9.174 8.396 1.00 44.10 H new ATOM 0 HA ASN A 530 4.338 6.417 8.197 1.00 62.42 H new ATOM 0 HB2 ASN A 530 3.314 7.770 10.252 1.00 41.30 H new ATOM 0 HB3 ASN A 530 1.778 7.358 9.515 1.00 41.30 H new ATOM 0 HD21 ASN A 530 1.922 4.504 11.614 1.00 50.13 H new ATOM 0 HD22 ASN A 530 1.193 6.087 11.323 1.00 50.13 H new ATOM 1511 N ASN A 531 1.973 7.521 6.328 1.00 42.10 N ATOM 1512 CA ASN A 531 0.980 7.213 5.281 1.00 32.30 C ATOM 1513 C ASN A 531 1.566 6.391 4.115 1.00 20.00 C ATOM 1514 O ASN A 531 0.819 5.847 3.297 1.00 12.54 O ATOM 1515 CB ASN A 531 0.401 8.523 4.728 1.00 25.52 C ATOM 1516 CG ASN A 531 -0.444 9.268 5.745 1.00 34.45 C ATOM 1517 OD1 ASN A 531 0.077 9.943 6.620 1.00 3.25 O ATOM 1518 ND2 ASN A 531 -1.755 9.195 5.607 1.00 62.14 N ATOM 0 H ASN A 531 2.225 8.508 6.380 1.00 42.10 H new ATOM 0 HA ASN A 531 0.204 6.606 5.748 1.00 32.30 H new ATOM 0 HB2 ASN A 531 1.218 9.166 4.400 1.00 25.52 H new ATOM 0 HB3 ASN A 531 -0.205 8.304 3.849 1.00 25.52 H new ATOM 0 HD21 ASN A 531 -2.364 9.711 6.242 1.00 62.14 H new ATOM 0 HD22 ASN A 531 -2.159 8.622 4.866 1.00 62.14 H new ATOM 1525 N VAL A 532 2.895 6.307 4.033 1.00 73.11 N ATOM 1526 CA VAL A 532 3.562 5.649 2.895 1.00 34.44 C ATOM 1527 C VAL A 532 4.366 4.403 3.321 1.00 5.42 C ATOM 1528 O VAL A 532 5.117 4.430 4.298 1.00 73.13 O ATOM 1529 CB VAL A 532 4.511 6.636 2.159 1.00 44.25 C ATOM 1530 CG1 VAL A 532 5.170 5.966 0.949 1.00 3.45 C ATOM 1531 CG2 VAL A 532 3.757 7.898 1.738 1.00 54.24 C ATOM 0 H VAL A 532 3.533 6.683 4.735 1.00 73.11 H new ATOM 0 HA VAL A 532 2.767 5.328 2.222 1.00 34.44 H new ATOM 0 HB VAL A 532 5.300 6.926 2.853 1.00 44.25 H new ATOM 0 HG11 VAL A 532 5.829 6.679 0.452 1.00 3.45 H new ATOM 0 HG12 VAL A 532 5.751 5.106 1.281 1.00 3.45 H new ATOM 0 HG13 VAL A 532 4.400 5.637 0.251 1.00 3.45 H new ATOM 0 HG21 VAL A 532 4.439 8.575 1.225 1.00 54.24 H new ATOM 0 HG22 VAL A 532 2.941 7.628 1.067 1.00 54.24 H new ATOM 0 HG23 VAL A 532 3.352 8.392 2.621 1.00 54.24 H new ATOM 1541 N ALA A 533 4.205 3.314 2.571 1.00 63.15 N ATOM 1542 CA ALA A 533 5.000 2.094 2.768 1.00 11.41 C ATOM 1543 C ALA A 533 5.894 1.834 1.554 1.00 14.21 C ATOM 1544 O ALA A 533 5.497 2.081 0.413 1.00 54.34 O ATOM 1545 CB ALA A 533 4.095 0.894 3.021 1.00 20.55 C ATOM 0 H ALA A 533 3.525 3.248 1.813 1.00 63.15 H new ATOM 0 HA ALA A 533 5.633 2.240 3.643 1.00 11.41 H new ATOM 0 HB1 ALA A 533 4.705 0.002 3.164 1.00 20.55 H new ATOM 0 HB2 ALA A 533 3.497 1.072 3.915 1.00 20.55 H new ATOM 0 HB3 ALA A 533 3.435 0.749 2.166 1.00 20.55 H new ATOM 1551 N THR A 534 7.103 1.338 1.799 1.00 25.12 N ATOM 1552 CA THR A 534 8.073 1.093 0.722 1.00 10.43 C ATOM 1553 C THR A 534 8.587 -0.353 0.733 1.00 1.52 C ATOM 1554 O THR A 534 9.081 -0.845 1.752 1.00 1.23 O ATOM 1555 CB THR A 534 9.283 2.054 0.833 1.00 60.02 C ATOM 1556 OG1 THR A 534 8.833 3.419 0.818 1.00 51.33 O ATOM 1557 CG2 THR A 534 10.274 1.834 -0.309 1.00 53.33 C ATOM 0 H THR A 534 7.440 1.096 2.731 1.00 25.12 H new ATOM 0 HA THR A 534 7.546 1.272 -0.215 1.00 10.43 H new ATOM 0 HB THR A 534 9.789 1.843 1.775 1.00 60.02 H new ATOM 0 HG1 THR A 534 9.605 4.019 0.890 1.00 51.33 H new ATOM 0 HG21 THR A 534 11.111 2.524 -0.202 1.00 53.33 H new ATOM 0 HG22 THR A 534 10.642 0.809 -0.279 1.00 53.33 H new ATOM 0 HG23 THR A 534 9.776 2.013 -1.262 1.00 53.33 H new ATOM 1565 N PHE A 535 8.468 -1.031 -0.404 1.00 41.25 N ATOM 1566 CA PHE A 535 9.001 -2.387 -0.564 1.00 52.44 C ATOM 1567 C PHE A 535 9.685 -2.546 -1.930 1.00 22.25 C ATOM 1568 O PHE A 535 9.074 -2.328 -2.974 1.00 5.23 O ATOM 1569 CB PHE A 535 7.886 -3.429 -0.403 1.00 2.24 C ATOM 1570 CG PHE A 535 8.389 -4.853 -0.418 1.00 51.12 C ATOM 1571 CD1 PHE A 535 9.085 -5.365 0.667 1.00 14.40 C ATOM 1572 CD2 PHE A 535 8.172 -5.675 -1.513 1.00 74.11 C ATOM 1573 CE1 PHE A 535 9.555 -6.663 0.659 1.00 34.15 C ATOM 1574 CE2 PHE A 535 8.642 -6.975 -1.525 1.00 0.22 C ATOM 1575 CZ PHE A 535 9.331 -7.470 -0.438 1.00 13.25 C ATOM 0 H PHE A 535 8.005 -0.664 -1.235 1.00 41.25 H new ATOM 0 HA PHE A 535 9.745 -2.552 0.215 1.00 52.44 H new ATOM 0 HB2 PHE A 535 7.361 -3.247 0.535 1.00 2.24 H new ATOM 0 HB3 PHE A 535 7.159 -3.300 -1.205 1.00 2.24 H new ATOM 0 HD1 PHE A 535 9.262 -4.740 1.530 1.00 14.40 H new ATOM 0 HD2 PHE A 535 7.630 -5.295 -2.366 1.00 74.11 H new ATOM 0 HE1 PHE A 535 10.098 -7.047 1.510 1.00 34.15 H new ATOM 0 HE2 PHE A 535 8.469 -7.603 -2.386 1.00 0.22 H new ATOM 0 HZ PHE A 535 9.695 -8.487 -0.445 1.00 13.25 H new ATOM 1585 N ASP A 536 10.953 -2.928 -1.913 1.00 41.31 N ATOM 1586 CA ASP A 536 11.759 -3.032 -3.133 1.00 22.24 C ATOM 1587 C ASP A 536 11.725 -4.464 -3.710 1.00 54.35 C ATOM 1588 O ASP A 536 11.960 -5.438 -2.991 1.00 13.24 O ATOM 1589 CB ASP A 536 13.190 -2.598 -2.800 1.00 32.20 C ATOM 1590 CG ASP A 536 14.141 -2.708 -3.974 1.00 44.45 C ATOM 1591 OD1 ASP A 536 14.175 -1.777 -4.806 1.00 64.22 O ATOM 1592 OD2 ASP A 536 14.877 -3.713 -4.048 1.00 34.32 O ATOM 0 H ASP A 536 11.456 -3.175 -1.061 1.00 41.31 H new ATOM 0 HA ASP A 536 11.347 -2.380 -3.903 1.00 22.24 H new ATOM 0 HB2 ASP A 536 13.176 -1.566 -2.449 1.00 32.20 H new ATOM 0 HB3 ASP A 536 13.565 -3.209 -1.979 1.00 32.20 H new ATOM 1597 N VAL A 537 11.421 -4.579 -5.008 1.00 53.51 N ATOM 1598 CA VAL A 537 11.297 -5.886 -5.677 1.00 32.40 C ATOM 1599 C VAL A 537 12.232 -5.999 -6.898 1.00 24.02 C ATOM 1600 O VAL A 537 12.433 -5.036 -7.644 1.00 3.01 O ATOM 1601 CB VAL A 537 9.837 -6.144 -6.141 1.00 41.40 C ATOM 1602 CG1 VAL A 537 9.700 -7.515 -6.806 1.00 63.43 C ATOM 1603 CG2 VAL A 537 8.864 -6.010 -4.972 1.00 60.11 C ATOM 0 H VAL A 537 11.255 -3.781 -5.621 1.00 53.51 H new ATOM 0 HA VAL A 537 11.586 -6.636 -4.940 1.00 32.40 H new ATOM 0 HB VAL A 537 9.586 -5.387 -6.884 1.00 41.40 H new ATOM 0 HG11 VAL A 537 8.667 -7.666 -7.120 1.00 63.43 H new ATOM 0 HG12 VAL A 537 10.354 -7.564 -7.676 1.00 63.43 H new ATOM 0 HG13 VAL A 537 9.981 -8.293 -6.096 1.00 63.43 H new ATOM 0 HG21 VAL A 537 7.848 -6.195 -5.321 1.00 60.11 H new ATOM 0 HG22 VAL A 537 9.120 -6.736 -4.200 1.00 60.11 H new ATOM 0 HG23 VAL A 537 8.928 -5.003 -4.559 1.00 60.11 H new ATOM 1613 N SER A 538 12.795 -7.188 -7.103 1.00 44.35 N ATOM 1614 CA SER A 538 13.682 -7.446 -8.246 1.00 52.12 C ATOM 1615 C SER A 538 13.105 -8.539 -9.162 1.00 40.01 C ATOM 1616 O SER A 538 12.765 -9.630 -8.700 1.00 21.10 O ATOM 1617 CB SER A 538 15.076 -7.863 -7.755 1.00 15.22 C ATOM 1618 OG SER A 538 15.997 -7.968 -8.832 1.00 75.41 O ATOM 0 H SER A 538 12.655 -7.993 -6.493 1.00 44.35 H new ATOM 0 HA SER A 538 13.763 -6.523 -8.820 1.00 52.12 H new ATOM 0 HB2 SER A 538 15.442 -7.134 -7.032 1.00 15.22 H new ATOM 0 HB3 SER A 538 15.009 -8.820 -7.237 1.00 15.22 H new ATOM 0 HG SER A 538 16.276 -7.071 -9.112 1.00 75.41 H new ATOM 1624 N VAL A 539 12.992 -8.247 -10.458 1.00 62.34 N ATOM 1625 CA VAL A 539 12.471 -9.219 -11.433 1.00 52.14 C ATOM 1626 C VAL A 539 13.602 -9.812 -12.290 1.00 14.14 C ATOM 1627 O VAL A 539 14.342 -9.081 -12.954 1.00 41.43 O ATOM 1628 CB VAL A 539 11.411 -8.574 -12.362 1.00 25.12 C ATOM 1629 CG1 VAL A 539 10.872 -9.590 -13.369 1.00 14.40 C ATOM 1630 CG2 VAL A 539 10.277 -7.965 -11.541 1.00 1.21 C ATOM 0 H VAL A 539 13.253 -7.347 -10.862 1.00 62.34 H new ATOM 0 HA VAL A 539 12.001 -10.019 -10.861 1.00 52.14 H new ATOM 0 HB VAL A 539 11.894 -7.774 -12.923 1.00 25.12 H new ATOM 0 HG11 VAL A 539 10.130 -9.111 -14.008 1.00 14.40 H new ATOM 0 HG12 VAL A 539 11.692 -9.964 -13.982 1.00 14.40 H new ATOM 0 HG13 VAL A 539 10.409 -10.420 -12.836 1.00 14.40 H new ATOM 0 HG21 VAL A 539 9.543 -7.517 -12.211 1.00 1.21 H new ATOM 0 HG22 VAL A 539 9.799 -8.744 -10.947 1.00 1.21 H new ATOM 0 HG23 VAL A 539 10.679 -7.199 -10.878 1.00 1.21 H new ATOM 1640 N VAL A 540 13.720 -11.140 -12.285 1.00 22.12 N ATOM 1641 CA VAL A 540 14.803 -11.832 -13.002 1.00 43.33 C ATOM 1642 C VAL A 540 14.285 -12.733 -14.141 1.00 13.55 C ATOM 1643 O VAL A 540 13.107 -13.095 -14.184 1.00 11.32 O ATOM 1644 CB VAL A 540 15.647 -12.691 -12.025 1.00 62.43 C ATOM 1645 CG1 VAL A 540 16.336 -11.811 -10.986 1.00 32.21 C ATOM 1646 CG2 VAL A 540 14.782 -13.757 -11.349 1.00 23.44 C ATOM 0 H VAL A 540 13.080 -11.763 -11.793 1.00 22.12 H new ATOM 0 HA VAL A 540 15.420 -11.050 -13.445 1.00 43.33 H new ATOM 0 HB VAL A 540 16.419 -13.200 -12.603 1.00 62.43 H new ATOM 0 HG11 VAL A 540 16.922 -12.435 -10.312 1.00 32.21 H new ATOM 0 HG12 VAL A 540 16.994 -11.102 -11.488 1.00 32.21 H new ATOM 0 HG13 VAL A 540 15.584 -11.266 -10.415 1.00 32.21 H new ATOM 0 HG21 VAL A 540 15.397 -14.347 -10.669 1.00 23.44 H new ATOM 0 HG22 VAL A 540 13.981 -13.274 -10.789 1.00 23.44 H new ATOM 0 HG23 VAL A 540 14.351 -14.411 -12.107 1.00 23.44 H new ATOM 1656 N LEU A 541 15.185 -13.089 -15.063 1.00 1.31 N ATOM 1657 CA LEU A 541 14.859 -13.998 -16.176 1.00 2.40 C ATOM 1658 C LEU A 541 14.947 -15.473 -15.751 1.00 74.31 C ATOM 1659 O LEU A 541 14.434 -16.362 -16.439 1.00 14.13 O ATOM 1660 CB LEU A 541 15.803 -13.746 -17.361 1.00 13.11 C ATOM 1661 CG LEU A 541 15.674 -12.364 -18.019 1.00 43.02 C ATOM 1662 CD1 LEU A 541 16.699 -12.200 -19.141 1.00 11.04 C ATOM 1663 CD2 LEU A 541 14.257 -12.151 -18.550 1.00 35.44 C ATOM 0 H LEU A 541 16.151 -12.762 -15.063 1.00 1.31 H new ATOM 0 HA LEU A 541 13.831 -13.793 -16.475 1.00 2.40 H new ATOM 0 HB2 LEU A 541 16.830 -13.873 -17.020 1.00 13.11 H new ATOM 0 HB3 LEU A 541 15.622 -14.509 -18.118 1.00 13.11 H new ATOM 0 HG LEU A 541 15.874 -11.606 -17.261 1.00 43.02 H new ATOM 0 HD11 LEU A 541 16.589 -11.214 -19.593 1.00 11.04 H new ATOM 0 HD12 LEU A 541 17.705 -12.302 -18.733 1.00 11.04 H new ATOM 0 HD13 LEU A 541 16.535 -12.966 -19.898 1.00 11.04 H new ATOM 0 HD21 LEU A 541 14.186 -11.166 -19.012 1.00 35.44 H new ATOM 0 HD22 LEU A 541 14.027 -12.917 -19.290 1.00 35.44 H new ATOM 0 HD23 LEU A 541 13.546 -12.217 -17.726 1.00 35.44 H new ATOM 1675 N GLU A 542 15.623 -15.719 -14.630 1.00 23.42 N ATOM 1676 CA GLU A 542 15.770 -17.075 -14.073 1.00 32.23 C ATOM 1677 C GLU A 542 14.627 -17.430 -13.088 1.00 24.30 C ATOM 1678 O GLU A 542 14.738 -17.116 -11.880 1.00 37.04 O ATOM 1679 CB GLU A 542 17.145 -17.209 -13.391 1.00 22.23 C ATOM 1680 CG GLU A 542 17.504 -16.030 -12.491 1.00 33.14 C ATOM 1681 CD GLU A 542 18.835 -16.204 -11.783 1.00 73.20 C ATOM 1682 OE1 GLU A 542 19.886 -15.954 -12.414 1.00 0.10 O ATOM 1683 OE2 GLU A 542 18.836 -16.576 -10.591 1.00 1.23 O ATOM 0 H GLU A 542 16.084 -14.994 -14.081 1.00 23.42 H new ATOM 0 HA GLU A 542 15.705 -17.786 -14.897 1.00 32.23 H new ATOM 0 HB2 GLU A 542 17.159 -18.124 -12.798 1.00 22.23 H new ATOM 0 HB3 GLU A 542 17.912 -17.315 -14.158 1.00 22.23 H new ATOM 0 HG2 GLU A 542 17.534 -15.120 -13.090 1.00 33.14 H new ATOM 0 HG3 GLU A 542 16.719 -15.896 -11.747 1.00 33.14 H new TER 1690 GLU A 542