USER MOD reduce.3.24.130724 H: found=0, std=0, add=585, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 586 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 Single : A 475 SER OG : rot 180:sc= 0 USER MOD Single : A 476 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 478 THR OG1 : rot 180:sc= 0.0216 USER MOD Single : A 481 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00519) USER MOD Single : A 485 CYS SG : rot 150:sc= 0 USER MOD Single : A 486 ASN : amide:sc= -0.285 K(o=-0.29,f=-3.5!) USER MOD Single : A 487 TYR OH : rot 180:sc= 0 USER MOD Single : A 490 GLN : amide:sc= -0.11 X(o=-0.11,f=-0.24) USER MOD Single : A 493 ASN : amide:sc= 0.814 K(o=0.81,f=-0.25) USER MOD Single : A 494 SER OG : rot 180:sc= 0 USER MOD Single : A 495 SER OG : rot 180:sc=0.000461 USER MOD Single : A 498 SER OG : rot 28:sc= 0.847 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 GLN : amide:sc= 0.0301 X(o=0.03,f=0) USER MOD Single : A 511 SER OG : rot -44:sc= 0.408 USER MOD Single : A 513 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 516 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 523 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 526 TYR OH : rot 180:sc= 0 USER MOD Single : A 529 TYR OH : rot 180:sc= 0 USER MOD Single : A 530 ASN : amide:sc= -0.0757 X(o=-0.076,f=0) USER MOD Single : A 533 THR OG1 : rot 180:sc= -0.141 USER MOD Single : A 535 TYR OH : rot 180:sc= 0 USER MOD Single : B 542 ASN : amide:sc= -0.0245 K(o=-0.025,f=-1.3!) USER MOD Single : B 545 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 474 18.135 -7.044 -8.727 1.00 0.00 N ATOM 2 CA GLY A 474 17.487 -6.069 -7.823 1.00 0.00 C ATOM 3 C GLY A 474 18.015 -4.662 -8.054 1.00 0.00 C ATOM 4 O GLY A 474 19.098 -4.322 -7.573 1.00 0.00 O ATOM 0 HA2 GLY A 474 16.409 -6.085 -7.981 1.00 0.00 H new ATOM 0 HA3 GLY A 474 17.662 -6.359 -6.787 1.00 0.00 H new ATOM 8 N SER A 475 17.282 -3.835 -8.804 1.00 0.00 N ATOM 9 CA SER A 475 17.659 -2.431 -9.099 1.00 0.00 C ATOM 10 C SER A 475 17.393 -1.464 -7.931 1.00 0.00 C ATOM 11 O SER A 475 18.164 -0.525 -7.708 1.00 0.00 O ATOM 12 CB SER A 475 16.908 -1.940 -10.342 1.00 0.00 C ATOM 13 OG SER A 475 15.501 -2.054 -10.169 1.00 0.00 O ATOM 0 H SER A 475 16.400 -4.114 -9.232 1.00 0.00 H new ATOM 0 HA SER A 475 18.735 -2.433 -9.271 1.00 0.00 H new ATOM 0 HB2 SER A 475 17.170 -0.901 -10.542 1.00 0.00 H new ATOM 0 HB3 SER A 475 17.219 -2.520 -11.211 1.00 0.00 H new ATOM 0 HG SER A 475 15.045 -1.733 -10.975 1.00 0.00 H new ATOM 19 N MET A 476 16.314 -1.692 -7.176 1.00 0.00 N ATOM 20 CA MET A 476 15.896 -0.893 -6.015 1.00 0.00 C ATOM 21 C MET A 476 16.777 -1.177 -4.781 1.00 0.00 C ATOM 22 O MET A 476 17.389 -2.243 -4.680 1.00 0.00 O ATOM 23 CB MET A 476 14.412 -1.201 -5.738 1.00 0.00 C ATOM 24 CG MET A 476 13.654 -0.042 -5.079 1.00 0.00 C ATOM 25 SD MET A 476 11.866 -0.337 -4.982 1.00 0.00 S ATOM 26 CE MET A 476 11.251 1.367 -4.976 1.00 0.00 C ATOM 0 H MET A 476 15.681 -2.469 -7.363 1.00 0.00 H new ATOM 0 HA MET A 476 16.019 0.168 -6.232 1.00 0.00 H new ATOM 0 HB2 MET A 476 13.922 -1.457 -6.677 1.00 0.00 H new ATOM 0 HB3 MET A 476 14.346 -2.079 -5.095 1.00 0.00 H new ATOM 0 HG2 MET A 476 14.046 0.118 -4.075 1.00 0.00 H new ATOM 0 HG3 MET A 476 13.837 0.873 -5.643 1.00 0.00 H new ATOM 0 HE1 MET A 476 10.162 1.361 -4.920 1.00 0.00 H new ATOM 0 HE2 MET A 476 11.656 1.897 -4.114 1.00 0.00 H new ATOM 0 HE3 MET A 476 11.564 1.870 -5.891 1.00 0.00 H new ATOM 36 N GLY A 477 16.818 -0.252 -3.816 1.00 0.00 N ATOM 37 CA GLY A 477 17.621 -0.362 -2.588 1.00 0.00 C ATOM 38 C GLY A 477 16.829 -0.081 -1.306 1.00 0.00 C ATOM 39 O GLY A 477 15.939 0.771 -1.276 1.00 0.00 O ATOM 0 H GLY A 477 16.282 0.615 -3.866 1.00 0.00 H new ATOM 0 HA2 GLY A 477 18.045 -1.365 -2.530 1.00 0.00 H new ATOM 0 HA3 GLY A 477 18.457 0.335 -2.648 1.00 0.00 H new ATOM 43 N THR A 478 17.180 -0.788 -0.229 1.00 0.00 N ATOM 44 CA THR A 478 16.550 -0.729 1.104 1.00 0.00 C ATOM 45 C THR A 478 17.174 0.365 1.986 1.00 0.00 C ATOM 46 O THR A 478 17.889 0.099 2.955 1.00 0.00 O ATOM 47 CB THR A 478 16.560 -2.115 1.787 1.00 0.00 C ATOM 48 OG1 THR A 478 17.804 -2.773 1.627 1.00 0.00 O ATOM 49 CG2 THR A 478 15.494 -3.028 1.177 1.00 0.00 C ATOM 0 H THR A 478 17.952 -1.454 -0.259 1.00 0.00 H new ATOM 0 HA THR A 478 15.506 -0.449 0.964 1.00 0.00 H new ATOM 0 HB THR A 478 16.366 -1.933 2.844 1.00 0.00 H new ATOM 0 HG1 THR A 478 17.773 -3.645 2.073 1.00 0.00 H new ATOM 0 HG21 THR A 478 15.519 -3.998 1.673 1.00 0.00 H new ATOM 0 HG22 THR A 478 14.510 -2.578 1.310 1.00 0.00 H new ATOM 0 HG23 THR A 478 15.693 -3.159 0.113 1.00 0.00 H new ATOM 57 N ALA A 479 16.923 1.626 1.621 1.00 0.00 N ATOM 58 CA ALA A 479 17.463 2.829 2.258 1.00 0.00 C ATOM 59 C ALA A 479 16.493 3.415 3.305 1.00 0.00 C ATOM 60 O ALA A 479 15.738 4.352 3.026 1.00 0.00 O ATOM 61 CB ALA A 479 17.858 3.826 1.161 1.00 0.00 C ATOM 0 H ALA A 479 16.309 1.845 0.837 1.00 0.00 H new ATOM 0 HA ALA A 479 18.357 2.577 2.828 1.00 0.00 H new ATOM 0 HB1 ALA A 479 18.263 4.729 1.618 1.00 0.00 H new ATOM 0 HB2 ALA A 479 18.613 3.377 0.516 1.00 0.00 H new ATOM 0 HB3 ALA A 479 16.980 4.082 0.568 1.00 0.00 H new ATOM 67 N GLY A 480 16.487 2.832 4.506 1.00 0.00 N ATOM 68 CA GLY A 480 15.635 3.227 5.634 1.00 0.00 C ATOM 69 C GLY A 480 15.395 2.091 6.636 1.00 0.00 C ATOM 70 O GLY A 480 15.811 0.950 6.408 1.00 0.00 O ATOM 0 H GLY A 480 17.096 2.045 4.729 1.00 0.00 H new ATOM 0 HA2 GLY A 480 16.096 4.068 6.152 1.00 0.00 H new ATOM 0 HA3 GLY A 480 14.675 3.575 5.252 1.00 0.00 H new ATOM 74 N LYS A 481 14.713 2.406 7.746 1.00 0.00 N ATOM 75 CA LYS A 481 14.298 1.456 8.800 1.00 0.00 C ATOM 76 C LYS A 481 13.217 2.054 9.701 1.00 0.00 C ATOM 77 O LYS A 481 12.900 3.245 9.628 1.00 0.00 O ATOM 78 CB LYS A 481 15.519 1.026 9.655 1.00 0.00 C ATOM 79 CG LYS A 481 15.538 -0.478 9.995 1.00 0.00 C ATOM 80 CD LYS A 481 16.012 -1.334 8.809 1.00 0.00 C ATOM 81 CE LYS A 481 16.188 -2.815 9.172 1.00 0.00 C ATOM 82 NZ LYS A 481 17.362 -3.049 10.056 1.00 0.00 N ATOM 0 H LYS A 481 14.422 3.363 7.946 1.00 0.00 H new ATOM 0 HA LYS A 481 13.880 0.580 8.305 1.00 0.00 H new ATOM 0 HB2 LYS A 481 16.434 1.280 9.120 1.00 0.00 H new ATOM 0 HB3 LYS A 481 15.522 1.599 10.582 1.00 0.00 H new ATOM 0 HG2 LYS A 481 16.194 -0.648 10.849 1.00 0.00 H new ATOM 0 HG3 LYS A 481 14.538 -0.794 10.293 1.00 0.00 H new ATOM 0 HD2 LYS A 481 15.292 -1.248 7.995 1.00 0.00 H new ATOM 0 HD3 LYS A 481 16.959 -0.941 8.440 1.00 0.00 H new ATOM 0 HE2 LYS A 481 15.286 -3.174 9.668 1.00 0.00 H new ATOM 0 HE3 LYS A 481 16.303 -3.399 8.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 481 17.467 -4.069 10.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 481 18.221 -2.686 9.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 481 17.219 -2.556 10.960 1.00 0.00 H new ATOM 96 N TRP A 482 12.674 1.207 10.567 1.00 0.00 N ATOM 97 CA TRP A 482 11.717 1.560 11.610 1.00 0.00 C ATOM 98 C TRP A 482 12.448 2.035 12.870 1.00 0.00 C ATOM 99 O TRP A 482 13.409 1.405 13.321 1.00 0.00 O ATOM 100 CB TRP A 482 10.844 0.334 11.928 1.00 0.00 C ATOM 101 CG TRP A 482 10.563 -0.586 10.777 1.00 0.00 C ATOM 102 CD1 TRP A 482 10.799 -1.917 10.774 1.00 0.00 C ATOM 103 CD2 TRP A 482 10.101 -0.259 9.426 1.00 0.00 C ATOM 104 NE1 TRP A 482 10.537 -2.434 9.520 1.00 0.00 N ATOM 105 CE2 TRP A 482 10.110 -1.456 8.646 1.00 0.00 C ATOM 106 CE3 TRP A 482 9.725 0.933 8.770 1.00 0.00 C ATOM 107 CZ2 TRP A 482 9.757 -1.470 7.287 1.00 0.00 C ATOM 108 CZ3 TRP A 482 9.389 0.933 7.401 1.00 0.00 C ATOM 109 CH2 TRP A 482 9.397 -0.264 6.663 1.00 0.00 C ATOM 0 H TRP A 482 12.898 0.212 10.562 1.00 0.00 H new ATOM 0 HA TRP A 482 11.084 2.375 11.259 1.00 0.00 H new ATOM 0 HB2 TRP A 482 11.331 -0.240 12.716 1.00 0.00 H new ATOM 0 HB3 TRP A 482 9.893 0.684 12.329 1.00 0.00 H new ATOM 0 HD1 TRP A 482 11.141 -2.490 11.624 1.00 0.00 H new ATOM 0 HE1 TRP A 482 10.646 -3.417 9.271 1.00 0.00 H new ATOM 0 HE3 TRP A 482 9.694 1.859 9.325 1.00 0.00 H new ATOM 0 HZ2 TRP A 482 9.762 -2.395 6.729 1.00 0.00 H new ATOM 0 HZ3 TRP A 482 9.123 1.860 6.915 1.00 0.00 H new ATOM 0 HH2 TRP A 482 9.127 -0.256 5.617 1.00 0.00 H new ATOM 120 N VAL A 483 11.961 3.115 13.475 1.00 0.00 N ATOM 121 CA VAL A 483 12.470 3.653 14.745 1.00 0.00 C ATOM 122 C VAL A 483 11.315 4.078 15.640 1.00 0.00 C ATOM 123 O VAL A 483 10.339 4.653 15.159 1.00 0.00 O ATOM 124 CB VAL A 483 13.433 4.841 14.546 1.00 0.00 C ATOM 125 CG1 VAL A 483 14.768 4.393 13.948 1.00 0.00 C ATOM 126 CG2 VAL A 483 12.842 5.947 13.663 1.00 0.00 C ATOM 0 H VAL A 483 11.185 3.656 13.093 1.00 0.00 H new ATOM 0 HA VAL A 483 13.034 2.851 15.220 1.00 0.00 H new ATOM 0 HB VAL A 483 13.596 5.248 15.544 1.00 0.00 H new ATOM 0 HG11 VAL A 483 15.419 5.258 13.823 1.00 0.00 H new ATOM 0 HG12 VAL A 483 15.243 3.675 14.616 1.00 0.00 H new ATOM 0 HG13 VAL A 483 14.594 3.927 12.978 1.00 0.00 H new ATOM 0 HG21 VAL A 483 13.566 6.756 13.560 1.00 0.00 H new ATOM 0 HG22 VAL A 483 12.608 5.541 12.679 1.00 0.00 H new ATOM 0 HG23 VAL A 483 11.931 6.332 14.122 1.00 0.00 H new ATOM 136 N LEU A 484 11.435 3.807 16.940 1.00 0.00 N ATOM 137 CA LEU A 484 10.483 4.249 17.960 1.00 0.00 C ATOM 138 C LEU A 484 10.930 5.598 18.533 1.00 0.00 C ATOM 139 O LEU A 484 12.120 5.867 18.702 1.00 0.00 O ATOM 140 CB LEU A 484 10.316 3.128 19.005 1.00 0.00 C ATOM 141 CG LEU A 484 9.494 3.489 20.261 1.00 0.00 C ATOM 142 CD1 LEU A 484 8.726 2.274 20.780 1.00 0.00 C ATOM 143 CD2 LEU A 484 10.388 3.954 21.409 1.00 0.00 C ATOM 0 H LEU A 484 12.210 3.264 17.321 1.00 0.00 H new ATOM 0 HA LEU A 484 9.493 4.426 17.539 1.00 0.00 H new ATOM 0 HB2 LEU A 484 9.844 2.274 18.520 1.00 0.00 H new ATOM 0 HB3 LEU A 484 11.307 2.806 19.324 1.00 0.00 H new ATOM 0 HG LEU A 484 8.817 4.287 19.955 1.00 0.00 H new ATOM 0 HD11 LEU A 484 8.155 2.555 21.665 1.00 0.00 H new ATOM 0 HD12 LEU A 484 8.045 1.917 20.007 1.00 0.00 H new ATOM 0 HD13 LEU A 484 9.429 1.482 21.038 1.00 0.00 H new ATOM 0 HD21 LEU A 484 9.772 4.199 22.274 1.00 0.00 H new ATOM 0 HD22 LEU A 484 11.085 3.158 21.673 1.00 0.00 H new ATOM 0 HD23 LEU A 484 10.947 4.838 21.100 1.00 0.00 H new ATOM 155 N CYS A 485 9.945 6.439 18.832 1.00 0.00 N ATOM 156 CA CYS A 485 10.105 7.695 19.548 1.00 0.00 C ATOM 157 C CYS A 485 10.252 7.443 21.062 1.00 0.00 C ATOM 158 O CYS A 485 9.296 7.044 21.722 1.00 0.00 O ATOM 159 CB CYS A 485 8.896 8.577 19.208 1.00 0.00 C ATOM 160 SG CYS A 485 9.238 9.461 17.662 1.00 0.00 S ATOM 0 H CYS A 485 8.976 6.255 18.571 1.00 0.00 H new ATOM 0 HA CYS A 485 11.017 8.209 19.243 1.00 0.00 H new ATOM 0 HB2 CYS A 485 8.000 7.966 19.103 1.00 0.00 H new ATOM 0 HB3 CYS A 485 8.706 9.285 20.014 1.00 0.00 H new ATOM 0 HG CYS A 485 8.123 9.678 17.030 1.00 0.00 H new ATOM 166 N ASN A 486 11.436 7.675 21.632 1.00 0.00 N ATOM 167 CA ASN A 486 11.687 7.630 23.080 1.00 0.00 C ATOM 168 C ASN A 486 10.981 8.766 23.854 1.00 0.00 C ATOM 169 O ASN A 486 10.644 8.595 25.026 1.00 0.00 O ATOM 170 CB ASN A 486 13.203 7.729 23.329 1.00 0.00 C ATOM 171 CG ASN A 486 14.001 6.575 22.758 1.00 0.00 C ATOM 172 OD1 ASN A 486 14.856 6.750 21.903 1.00 0.00 O ATOM 173 ND2 ASN A 486 13.754 5.369 23.218 1.00 0.00 N ATOM 0 H ASN A 486 12.269 7.905 21.090 1.00 0.00 H new ATOM 0 HA ASN A 486 11.281 6.687 23.446 1.00 0.00 H new ATOM 0 HB2 ASN A 486 13.571 8.660 22.897 1.00 0.00 H new ATOM 0 HB3 ASN A 486 13.381 7.783 24.403 1.00 0.00 H new ATOM 0 HD21 ASN A 486 14.278 4.570 22.861 1.00 0.00 H new ATOM 0 HD22 ASN A 486 13.038 5.232 23.932 1.00 0.00 H new ATOM 180 N TYR A 487 10.758 9.912 23.194 1.00 0.00 N ATOM 181 CA TYR A 487 10.192 11.142 23.770 1.00 0.00 C ATOM 182 C TYR A 487 9.247 11.828 22.766 1.00 0.00 C ATOM 183 O TYR A 487 9.296 11.574 21.561 1.00 0.00 O ATOM 184 CB TYR A 487 11.315 12.111 24.182 1.00 0.00 C ATOM 185 CG TYR A 487 12.398 11.527 25.077 1.00 0.00 C ATOM 186 CD1 TYR A 487 12.222 11.486 26.476 1.00 0.00 C ATOM 187 CD2 TYR A 487 13.583 11.018 24.511 1.00 0.00 C ATOM 188 CE1 TYR A 487 13.224 10.936 27.301 1.00 0.00 C ATOM 189 CE2 TYR A 487 14.589 10.470 25.328 1.00 0.00 C ATOM 190 CZ TYR A 487 14.408 10.420 26.727 1.00 0.00 C ATOM 191 OH TYR A 487 15.369 9.862 27.511 1.00 0.00 O ATOM 0 H TYR A 487 10.976 10.012 22.203 1.00 0.00 H new ATOM 0 HA TYR A 487 9.620 10.869 24.657 1.00 0.00 H new ATOM 0 HB2 TYR A 487 11.786 12.497 23.278 1.00 0.00 H new ATOM 0 HB3 TYR A 487 10.866 12.961 24.695 1.00 0.00 H new ATOM 0 HD1 TYR A 487 11.317 11.877 26.916 1.00 0.00 H new ATOM 0 HD2 TYR A 487 13.721 11.049 23.440 1.00 0.00 H new ATOM 0 HE1 TYR A 487 13.087 10.909 28.372 1.00 0.00 H new ATOM 0 HE2 TYR A 487 15.497 10.089 24.886 1.00 0.00 H new ATOM 0 HH TYR A 487 16.113 9.559 26.950 1.00 0.00 H new ATOM 201 N ASP A 488 8.379 12.698 23.277 1.00 0.00 N ATOM 202 CA ASP A 488 7.495 13.559 22.482 1.00 0.00 C ATOM 203 C ASP A 488 8.263 14.737 21.842 1.00 0.00 C ATOM 204 O ASP A 488 9.293 15.180 22.362 1.00 0.00 O ATOM 205 CB ASP A 488 6.399 14.121 23.400 1.00 0.00 C ATOM 206 CG ASP A 488 5.639 13.030 24.168 1.00 0.00 C ATOM 207 OD1 ASP A 488 4.841 12.302 23.539 1.00 0.00 O ATOM 208 OD2 ASP A 488 5.860 12.888 25.397 1.00 0.00 O ATOM 0 H ASP A 488 8.265 12.830 24.282 1.00 0.00 H new ATOM 0 HA ASP A 488 7.068 12.959 21.679 1.00 0.00 H new ATOM 0 HB2 ASP A 488 6.849 14.812 24.113 1.00 0.00 H new ATOM 0 HB3 ASP A 488 5.692 14.696 22.802 1.00 0.00 H new ATOM 213 N PHE A 489 7.737 15.281 20.739 1.00 0.00 N ATOM 214 CA PHE A 489 8.281 16.447 20.033 1.00 0.00 C ATOM 215 C PHE A 489 7.204 17.174 19.196 1.00 0.00 C ATOM 216 O PHE A 489 6.267 16.554 18.694 1.00 0.00 O ATOM 217 CB PHE A 489 9.430 15.966 19.132 1.00 0.00 C ATOM 218 CG PHE A 489 10.131 17.060 18.358 1.00 0.00 C ATOM 219 CD1 PHE A 489 10.744 18.128 19.041 1.00 0.00 C ATOM 220 CD2 PHE A 489 10.128 17.039 16.950 1.00 0.00 C ATOM 221 CE1 PHE A 489 11.317 19.190 18.321 1.00 0.00 C ATOM 222 CE2 PHE A 489 10.723 18.088 16.231 1.00 0.00 C ATOM 223 CZ PHE A 489 11.314 19.163 16.915 1.00 0.00 C ATOM 0 H PHE A 489 6.895 14.911 20.299 1.00 0.00 H new ATOM 0 HA PHE A 489 8.643 17.168 20.765 1.00 0.00 H new ATOM 0 HB2 PHE A 489 10.165 15.449 19.749 1.00 0.00 H new ATOM 0 HB3 PHE A 489 9.037 15.235 18.425 1.00 0.00 H new ATOM 0 HD1 PHE A 489 10.774 18.131 20.121 1.00 0.00 H new ATOM 0 HD2 PHE A 489 9.668 16.216 16.423 1.00 0.00 H new ATOM 0 HE1 PHE A 489 11.758 20.024 18.846 1.00 0.00 H new ATOM 0 HE2 PHE A 489 10.726 18.068 15.151 1.00 0.00 H new ATOM 0 HZ PHE A 489 11.767 19.971 16.360 1.00 0.00 H new ATOM 233 N GLN A 490 7.353 18.489 18.998 1.00 0.00 N ATOM 234 CA GLN A 490 6.392 19.335 18.273 1.00 0.00 C ATOM 235 C GLN A 490 7.057 20.087 17.118 1.00 0.00 C ATOM 236 O GLN A 490 8.158 20.617 17.264 1.00 0.00 O ATOM 237 CB GLN A 490 5.732 20.350 19.222 1.00 0.00 C ATOM 238 CG GLN A 490 4.799 19.711 20.261 1.00 0.00 C ATOM 239 CD GLN A 490 5.522 19.132 21.480 1.00 0.00 C ATOM 240 OE1 GLN A 490 5.512 17.935 21.740 1.00 0.00 O ATOM 241 NE2 GLN A 490 6.168 19.950 22.284 1.00 0.00 N ATOM 0 H GLN A 490 8.161 19.007 19.344 1.00 0.00 H new ATOM 0 HA GLN A 490 5.632 18.670 17.863 1.00 0.00 H new ATOM 0 HB2 GLN A 490 6.511 20.908 19.741 1.00 0.00 H new ATOM 0 HB3 GLN A 490 5.165 21.070 18.632 1.00 0.00 H new ATOM 0 HG2 GLN A 490 4.083 20.460 20.599 1.00 0.00 H new ATOM 0 HG3 GLN A 490 4.227 18.917 19.780 1.00 0.00 H new ATOM 0 HE21 GLN A 490 6.188 20.950 22.085 1.00 0.00 H new ATOM 0 HE22 GLN A 490 6.648 19.584 23.106 1.00 0.00 H new ATOM 250 N ALA A 491 6.354 20.174 15.982 1.00 0.00 N ATOM 251 CA ALA A 491 6.847 20.859 14.790 1.00 0.00 C ATOM 252 C ALA A 491 6.758 22.381 14.963 1.00 0.00 C ATOM 253 O ALA A 491 5.680 22.971 14.849 1.00 0.00 O ATOM 254 CB ALA A 491 6.097 20.402 13.534 1.00 0.00 C ATOM 0 H ALA A 491 5.425 19.769 15.868 1.00 0.00 H new ATOM 0 HA ALA A 491 7.896 20.593 14.660 1.00 0.00 H new ATOM 0 HB1 ALA A 491 6.488 20.931 12.664 1.00 0.00 H new ATOM 0 HB2 ALA A 491 6.234 19.329 13.398 1.00 0.00 H new ATOM 0 HB3 ALA A 491 5.035 20.621 13.645 1.00 0.00 H new ATOM 260 N ARG A 492 7.888 23.025 15.253 1.00 0.00 N ATOM 261 CA ARG A 492 8.001 24.486 15.363 1.00 0.00 C ATOM 262 C ARG A 492 8.062 25.176 13.989 1.00 0.00 C ATOM 263 O ARG A 492 7.846 26.385 13.905 1.00 0.00 O ATOM 264 CB ARG A 492 9.231 24.823 16.222 1.00 0.00 C ATOM 265 CG ARG A 492 9.152 24.231 17.649 1.00 0.00 C ATOM 266 CD ARG A 492 10.377 23.401 18.044 1.00 0.00 C ATOM 267 NE ARG A 492 11.627 24.188 17.977 1.00 0.00 N ATOM 268 CZ ARG A 492 12.850 23.710 17.832 1.00 0.00 C ATOM 269 NH1 ARG A 492 13.087 22.433 17.745 1.00 0.00 N ATOM 270 NH2 ARG A 492 13.871 24.517 17.776 1.00 0.00 N ATOM 0 H ARG A 492 8.769 22.540 15.422 1.00 0.00 H new ATOM 0 HA ARG A 492 7.102 24.871 15.845 1.00 0.00 H new ATOM 0 HB2 ARG A 492 10.127 24.447 15.728 1.00 0.00 H new ATOM 0 HB3 ARG A 492 9.335 25.906 16.289 1.00 0.00 H new ATOM 0 HG2 ARG A 492 9.031 25.045 18.364 1.00 0.00 H new ATOM 0 HG3 ARG A 492 8.262 23.606 17.724 1.00 0.00 H new ATOM 0 HD2 ARG A 492 10.244 23.018 19.056 1.00 0.00 H new ATOM 0 HD3 ARG A 492 10.457 22.537 17.384 1.00 0.00 H new ATOM 0 HE ARG A 492 11.536 25.201 18.050 1.00 0.00 H new ATOM 0 HH11 ARG A 492 12.316 21.767 17.788 1.00 0.00 H new ATOM 0 HH12 ARG A 492 14.044 22.098 17.633 1.00 0.00 H new ATOM 0 HH21 ARG A 492 13.729 25.525 17.844 1.00 0.00 H new ATOM 0 HH22 ARG A 492 14.813 24.141 17.664 1.00 0.00 H new ATOM 284 N ASN A 493 8.327 24.416 12.919 1.00 0.00 N ATOM 285 CA ASN A 493 8.507 24.903 11.537 1.00 0.00 C ATOM 286 C ASN A 493 8.051 23.857 10.493 1.00 0.00 C ATOM 287 O ASN A 493 7.843 22.689 10.816 1.00 0.00 O ATOM 288 CB ASN A 493 9.997 25.254 11.312 1.00 0.00 C ATOM 289 CG ASN A 493 10.540 26.312 12.257 1.00 0.00 C ATOM 290 OD1 ASN A 493 10.355 27.506 12.062 1.00 0.00 O ATOM 291 ND2 ASN A 493 11.251 25.916 13.289 1.00 0.00 N ATOM 0 H ASN A 493 8.427 23.403 12.991 1.00 0.00 H new ATOM 0 HA ASN A 493 7.886 25.789 11.405 1.00 0.00 H new ATOM 0 HB2 ASN A 493 10.592 24.347 11.420 1.00 0.00 H new ATOM 0 HB3 ASN A 493 10.126 25.599 10.286 1.00 0.00 H new ATOM 0 HD21 ASN A 493 11.649 26.604 13.928 1.00 0.00 H new ATOM 0 HD22 ASN A 493 11.405 24.921 13.451 1.00 0.00 H new ATOM 298 N SER A 494 7.953 24.251 9.218 1.00 0.00 N ATOM 299 CA SER A 494 7.624 23.350 8.090 1.00 0.00 C ATOM 300 C SER A 494 8.708 22.309 7.760 1.00 0.00 C ATOM 301 O SER A 494 8.414 21.274 7.160 1.00 0.00 O ATOM 302 CB SER A 494 7.351 24.154 6.809 1.00 0.00 C ATOM 303 OG SER A 494 6.387 25.170 7.037 1.00 0.00 O ATOM 0 H SER A 494 8.101 25.218 8.929 1.00 0.00 H new ATOM 0 HA SER A 494 6.738 22.812 8.428 1.00 0.00 H new ATOM 0 HB2 SER A 494 8.279 24.602 6.453 1.00 0.00 H new ATOM 0 HB3 SER A 494 6.999 23.484 6.024 1.00 0.00 H new ATOM 0 HG SER A 494 6.233 25.667 6.207 1.00 0.00 H new ATOM 309 N SER A 495 9.965 22.579 8.131 1.00 0.00 N ATOM 310 CA SER A 495 11.101 21.649 7.963 1.00 0.00 C ATOM 311 C SER A 495 11.054 20.435 8.898 1.00 0.00 C ATOM 312 O SER A 495 11.733 19.438 8.664 1.00 0.00 O ATOM 313 CB SER A 495 12.423 22.388 8.162 1.00 0.00 C ATOM 314 OG SER A 495 12.426 23.085 9.396 1.00 0.00 O ATOM 0 H SER A 495 10.232 23.463 8.564 1.00 0.00 H new ATOM 0 HA SER A 495 11.022 21.266 6.945 1.00 0.00 H new ATOM 0 HB2 SER A 495 13.250 21.678 8.138 1.00 0.00 H new ATOM 0 HB3 SER A 495 12.581 23.089 7.342 1.00 0.00 H new ATOM 0 HG SER A 495 13.281 23.551 9.507 1.00 0.00 H new ATOM 320 N GLU A 496 10.239 20.493 9.943 1.00 0.00 N ATOM 321 CA GLU A 496 10.148 19.519 11.032 1.00 0.00 C ATOM 322 C GLU A 496 8.723 18.947 11.167 1.00 0.00 C ATOM 323 O GLU A 496 7.811 19.289 10.409 1.00 0.00 O ATOM 324 CB GLU A 496 10.679 20.138 12.344 1.00 0.00 C ATOM 325 CG GLU A 496 10.080 21.506 12.661 1.00 0.00 C ATOM 326 CD GLU A 496 10.765 22.164 13.869 1.00 0.00 C ATOM 327 OE1 GLU A 496 10.441 21.776 15.011 1.00 0.00 O ATOM 328 OE2 GLU A 496 11.568 23.112 13.677 1.00 0.00 O ATOM 0 H GLU A 496 9.584 21.265 10.064 1.00 0.00 H new ATOM 0 HA GLU A 496 10.784 18.666 10.795 1.00 0.00 H new ATOM 0 HB2 GLU A 496 10.467 19.458 13.169 1.00 0.00 H new ATOM 0 HB3 GLU A 496 11.763 20.232 12.279 1.00 0.00 H new ATOM 0 HG2 GLU A 496 10.176 22.155 11.791 1.00 0.00 H new ATOM 0 HG3 GLU A 496 9.014 21.398 12.862 1.00 0.00 H new ATOM 335 N LEU A 497 8.554 18.031 12.119 1.00 0.00 N ATOM 336 CA LEU A 497 7.333 17.247 12.345 1.00 0.00 C ATOM 337 C LEU A 497 6.999 17.063 13.830 1.00 0.00 C ATOM 338 O LEU A 497 7.846 17.244 14.701 1.00 0.00 O ATOM 339 CB LEU A 497 7.474 15.867 11.676 1.00 0.00 C ATOM 340 CG LEU A 497 7.413 15.851 10.146 1.00 0.00 C ATOM 341 CD1 LEU A 497 7.668 14.419 9.683 1.00 0.00 C ATOM 342 CD2 LEU A 497 6.062 16.309 9.590 1.00 0.00 C ATOM 0 H LEU A 497 9.293 17.803 12.784 1.00 0.00 H new ATOM 0 HA LEU A 497 6.511 17.809 11.902 1.00 0.00 H new ATOM 0 HB2 LEU A 497 8.424 15.431 11.986 1.00 0.00 H new ATOM 0 HB3 LEU A 497 6.685 15.218 12.058 1.00 0.00 H new ATOM 0 HG LEU A 497 8.164 16.549 9.776 1.00 0.00 H new ATOM 0 HD11 LEU A 497 7.631 14.376 8.594 1.00 0.00 H new ATOM 0 HD12 LEU A 497 8.651 14.096 10.025 1.00 0.00 H new ATOM 0 HD13 LEU A 497 6.905 13.761 10.098 1.00 0.00 H new ATOM 0 HD21 LEU A 497 6.086 16.274 8.501 1.00 0.00 H new ATOM 0 HD22 LEU A 497 5.275 15.650 9.957 1.00 0.00 H new ATOM 0 HD23 LEU A 497 5.862 17.330 9.916 1.00 0.00 H new ATOM 354 N SER A 498 5.739 16.710 14.108 1.00 0.00 N ATOM 355 CA SER A 498 5.196 16.565 15.457 1.00 0.00 C ATOM 356 C SER A 498 4.894 15.095 15.751 1.00 0.00 C ATOM 357 O SER A 498 4.048 14.495 15.086 1.00 0.00 O ATOM 358 CB SER A 498 3.943 17.447 15.620 1.00 0.00 C ATOM 359 OG SER A 498 2.869 16.916 14.839 1.00 0.00 O ATOM 0 H SER A 498 5.053 16.513 13.379 1.00 0.00 H new ATOM 0 HA SER A 498 5.937 16.901 16.182 1.00 0.00 H new ATOM 0 HB2 SER A 498 3.653 17.492 16.670 1.00 0.00 H new ATOM 0 HB3 SER A 498 4.163 18.467 15.306 1.00 0.00 H new ATOM 0 HG SER A 498 2.979 15.947 14.748 1.00 0.00 H new ATOM 365 N VAL A 499 5.575 14.523 16.741 1.00 0.00 N ATOM 366 CA VAL A 499 5.558 13.086 17.061 1.00 0.00 C ATOM 367 C VAL A 499 5.453 12.879 18.572 1.00 0.00 C ATOM 368 O VAL A 499 5.719 13.786 19.360 1.00 0.00 O ATOM 369 CB VAL A 499 6.804 12.365 16.491 1.00 0.00 C ATOM 370 CG1 VAL A 499 6.881 12.430 14.963 1.00 0.00 C ATOM 371 CG2 VAL A 499 8.126 12.908 17.044 1.00 0.00 C ATOM 0 H VAL A 499 6.176 15.059 17.367 1.00 0.00 H new ATOM 0 HA VAL A 499 4.680 12.646 16.588 1.00 0.00 H new ATOM 0 HB VAL A 499 6.674 11.332 16.813 1.00 0.00 H new ATOM 0 HG11 VAL A 499 7.775 11.908 14.621 1.00 0.00 H new ATOM 0 HG12 VAL A 499 5.998 11.957 14.534 1.00 0.00 H new ATOM 0 HG13 VAL A 499 6.925 13.472 14.645 1.00 0.00 H new ATOM 0 HG21 VAL A 499 8.958 12.359 16.603 1.00 0.00 H new ATOM 0 HG22 VAL A 499 8.217 13.965 16.796 1.00 0.00 H new ATOM 0 HG23 VAL A 499 8.144 12.787 18.127 1.00 0.00 H new ATOM 381 N LYS A 500 5.067 11.682 19.003 1.00 0.00 N ATOM 382 CA LYS A 500 4.851 11.349 20.413 1.00 0.00 C ATOM 383 C LYS A 500 5.657 10.115 20.774 1.00 0.00 C ATOM 384 O LYS A 500 5.909 9.260 19.922 1.00 0.00 O ATOM 385 CB LYS A 500 3.350 11.156 20.686 1.00 0.00 C ATOM 386 CG LYS A 500 2.558 12.454 20.461 1.00 0.00 C ATOM 387 CD LYS A 500 1.070 12.272 20.764 1.00 0.00 C ATOM 388 CE LYS A 500 0.331 13.568 20.416 1.00 0.00 C ATOM 389 NZ LYS A 500 -1.131 13.445 20.656 1.00 0.00 N ATOM 0 H LYS A 500 4.891 10.899 18.373 1.00 0.00 H new ATOM 0 HA LYS A 500 5.194 12.169 21.044 1.00 0.00 H new ATOM 0 HB2 LYS A 500 2.960 10.374 20.034 1.00 0.00 H new ATOM 0 HB3 LYS A 500 3.208 10.816 21.712 1.00 0.00 H new ATOM 0 HG2 LYS A 500 2.964 13.242 21.095 1.00 0.00 H new ATOM 0 HG3 LYS A 500 2.681 12.781 19.428 1.00 0.00 H new ATOM 0 HD2 LYS A 500 0.666 11.441 20.186 1.00 0.00 H new ATOM 0 HD3 LYS A 500 0.927 12.027 21.816 1.00 0.00 H new ATOM 0 HE2 LYS A 500 0.731 14.387 21.013 1.00 0.00 H new ATOM 0 HE3 LYS A 500 0.509 13.820 19.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 -1.600 14.340 20.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 -1.516 12.679 20.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 -1.301 13.229 21.659 1.00 0.00 H new ATOM 403 N GLN A 501 6.081 10.015 22.031 1.00 0.00 N ATOM 404 CA GLN A 501 6.747 8.800 22.493 1.00 0.00 C ATOM 405 C GLN A 501 5.891 7.543 22.267 1.00 0.00 C ATOM 406 O GLN A 501 4.657 7.603 22.267 1.00 0.00 O ATOM 407 CB GLN A 501 7.223 8.906 23.942 1.00 0.00 C ATOM 408 CG GLN A 501 6.122 9.284 24.942 1.00 0.00 C ATOM 409 CD GLN A 501 6.576 9.129 26.390 1.00 0.00 C ATOM 410 OE1 GLN A 501 6.778 8.031 26.895 1.00 0.00 O ATOM 411 NE2 GLN A 501 6.736 10.211 27.123 1.00 0.00 N ATOM 0 H GLN A 501 5.979 10.745 22.736 1.00 0.00 H new ATOM 0 HA GLN A 501 7.640 8.694 21.876 1.00 0.00 H new ATOM 0 HB2 GLN A 501 7.657 7.952 24.240 1.00 0.00 H new ATOM 0 HB3 GLN A 501 8.019 9.649 23.997 1.00 0.00 H new ATOM 0 HG2 GLN A 501 5.815 10.315 24.768 1.00 0.00 H new ATOM 0 HG3 GLN A 501 5.247 8.658 24.769 1.00 0.00 H new ATOM 0 HE21 GLN A 501 6.571 11.132 26.716 1.00 0.00 H new ATOM 0 HE22 GLN A 501 7.025 10.129 28.098 1.00 0.00 H new ATOM 420 N ARG A 502 6.574 6.404 22.100 1.00 0.00 N ATOM 421 CA ARG A 502 6.014 5.070 21.817 1.00 0.00 C ATOM 422 C ARG A 502 5.431 4.913 20.400 1.00 0.00 C ATOM 423 O ARG A 502 4.828 3.881 20.106 1.00 0.00 O ATOM 424 CB ARG A 502 5.013 4.635 22.917 1.00 0.00 C ATOM 425 CG ARG A 502 5.430 4.910 24.377 1.00 0.00 C ATOM 426 CD ARG A 502 6.722 4.203 24.804 1.00 0.00 C ATOM 427 NE ARG A 502 6.532 2.742 24.893 1.00 0.00 N ATOM 428 CZ ARG A 502 7.430 1.850 25.269 1.00 0.00 C ATOM 429 NH1 ARG A 502 8.653 2.180 25.580 1.00 0.00 N ATOM 430 NH2 ARG A 502 7.108 0.591 25.347 1.00 0.00 N ATOM 0 H ARG A 502 7.592 6.384 22.162 1.00 0.00 H new ATOM 0 HA ARG A 502 6.861 4.384 21.841 1.00 0.00 H new ATOM 0 HB2 ARG A 502 4.064 5.139 22.733 1.00 0.00 H new ATOM 0 HB3 ARG A 502 4.832 3.565 22.810 1.00 0.00 H new ATOM 0 HG2 ARG A 502 5.555 5.984 24.511 1.00 0.00 H new ATOM 0 HG3 ARG A 502 4.622 4.598 25.039 1.00 0.00 H new ATOM 0 HD2 ARG A 502 7.514 4.426 24.089 1.00 0.00 H new ATOM 0 HD3 ARG A 502 7.047 4.589 25.770 1.00 0.00 H new ATOM 0 HE ARG A 502 5.612 2.384 24.638 1.00 0.00 H new ATOM 0 HH11 ARG A 502 8.944 3.157 25.537 1.00 0.00 H new ATOM 0 HH12 ARG A 502 9.318 1.461 25.866 1.00 0.00 H new ATOM 0 HH21 ARG A 502 6.160 0.292 25.117 1.00 0.00 H new ATOM 0 HH22 ARG A 502 7.803 -0.096 25.638 1.00 0.00 H new ATOM 444 N ASP A 503 5.643 5.886 19.510 1.00 0.00 N ATOM 445 CA ASP A 503 5.226 5.810 18.099 1.00 0.00 C ATOM 446 C ASP A 503 6.392 5.328 17.225 1.00 0.00 C ATOM 447 O ASP A 503 7.535 5.715 17.464 1.00 0.00 O ATOM 448 CB ASP A 503 4.748 7.183 17.584 1.00 0.00 C ATOM 449 CG ASP A 503 3.364 7.626 18.095 1.00 0.00 C ATOM 450 OD1 ASP A 503 2.611 6.810 18.683 1.00 0.00 O ATOM 451 OD2 ASP A 503 2.985 8.792 17.828 1.00 0.00 O ATOM 0 H ASP A 503 6.113 6.759 19.747 1.00 0.00 H new ATOM 0 HA ASP A 503 4.400 5.102 18.038 1.00 0.00 H new ATOM 0 HB2 ASP A 503 5.482 7.937 17.870 1.00 0.00 H new ATOM 0 HB3 ASP A 503 4.725 7.157 16.495 1.00 0.00 H new ATOM 456 N VAL A 504 6.105 4.533 16.188 1.00 0.00 N ATOM 457 CA VAL A 504 7.098 4.028 15.222 1.00 0.00 C ATOM 458 C VAL A 504 6.967 4.775 13.889 1.00 0.00 C ATOM 459 O VAL A 504 5.854 4.981 13.400 1.00 0.00 O ATOM 460 CB VAL A 504 6.966 2.505 15.031 1.00 0.00 C ATOM 461 CG1 VAL A 504 7.988 1.957 14.028 1.00 0.00 C ATOM 462 CG2 VAL A 504 7.188 1.749 16.348 1.00 0.00 C ATOM 0 H VAL A 504 5.157 4.214 15.989 1.00 0.00 H new ATOM 0 HA VAL A 504 8.095 4.216 15.621 1.00 0.00 H new ATOM 0 HB VAL A 504 5.953 2.348 14.661 1.00 0.00 H new ATOM 0 HG11 VAL A 504 7.856 0.880 13.926 1.00 0.00 H new ATOM 0 HG12 VAL A 504 7.839 2.434 13.059 1.00 0.00 H new ATOM 0 HG13 VAL A 504 8.996 2.167 14.384 1.00 0.00 H new ATOM 0 HG21 VAL A 504 7.087 0.678 16.174 1.00 0.00 H new ATOM 0 HG22 VAL A 504 8.188 1.963 16.726 1.00 0.00 H new ATOM 0 HG23 VAL A 504 6.447 2.069 17.081 1.00 0.00 H new ATOM 472 N LEU A 505 8.099 5.173 13.298 1.00 0.00 N ATOM 473 CA LEU A 505 8.179 5.993 12.079 1.00 0.00 C ATOM 474 C LEU A 505 9.177 5.393 11.073 1.00 0.00 C ATOM 475 O LEU A 505 10.156 4.748 11.452 1.00 0.00 O ATOM 476 CB LEU A 505 8.567 7.442 12.442 1.00 0.00 C ATOM 477 CG LEU A 505 7.697 8.112 13.531 1.00 0.00 C ATOM 478 CD1 LEU A 505 8.403 9.352 14.061 1.00 0.00 C ATOM 479 CD2 LEU A 505 6.315 8.539 13.026 1.00 0.00 C ATOM 0 H LEU A 505 9.018 4.926 13.666 1.00 0.00 H new ATOM 0 HA LEU A 505 7.198 6.003 11.603 1.00 0.00 H new ATOM 0 HB2 LEU A 505 9.605 7.449 12.776 1.00 0.00 H new ATOM 0 HB3 LEU A 505 8.519 8.050 11.538 1.00 0.00 H new ATOM 0 HG LEU A 505 7.556 7.362 14.310 1.00 0.00 H new ATOM 0 HD11 LEU A 505 7.787 9.821 14.828 1.00 0.00 H new ATOM 0 HD12 LEU A 505 9.364 9.068 14.491 1.00 0.00 H new ATOM 0 HD13 LEU A 505 8.564 10.056 13.244 1.00 0.00 H new ATOM 0 HD21 LEU A 505 5.757 9.002 13.840 1.00 0.00 H new ATOM 0 HD22 LEU A 505 6.430 9.255 12.212 1.00 0.00 H new ATOM 0 HD23 LEU A 505 5.773 7.665 12.666 1.00 0.00 H new ATOM 491 N GLU A 506 8.926 5.615 9.782 1.00 0.00 N ATOM 492 CA GLU A 506 9.794 5.199 8.672 1.00 0.00 C ATOM 493 C GLU A 506 10.850 6.279 8.390 1.00 0.00 C ATOM 494 O GLU A 506 10.506 7.380 7.960 1.00 0.00 O ATOM 495 CB GLU A 506 8.917 4.946 7.427 1.00 0.00 C ATOM 496 CG GLU A 506 9.732 4.622 6.162 1.00 0.00 C ATOM 497 CD GLU A 506 8.849 4.232 4.952 1.00 0.00 C ATOM 498 OE1 GLU A 506 7.729 4.780 4.768 1.00 0.00 O ATOM 499 OE2 GLU A 506 9.284 3.374 4.144 1.00 0.00 O ATOM 0 H GLU A 506 8.088 6.104 9.467 1.00 0.00 H new ATOM 0 HA GLU A 506 10.321 4.281 8.934 1.00 0.00 H new ATOM 0 HB2 GLU A 506 8.236 4.120 7.633 1.00 0.00 H new ATOM 0 HB3 GLU A 506 8.303 5.827 7.239 1.00 0.00 H new ATOM 0 HG2 GLU A 506 10.339 5.488 5.897 1.00 0.00 H new ATOM 0 HG3 GLU A 506 10.420 3.805 6.380 1.00 0.00 H new ATOM 506 N VAL A 507 12.132 5.972 8.616 1.00 0.00 N ATOM 507 CA VAL A 507 13.266 6.837 8.231 1.00 0.00 C ATOM 508 C VAL A 507 13.566 6.689 6.733 1.00 0.00 C ATOM 509 O VAL A 507 13.400 5.615 6.151 1.00 0.00 O ATOM 510 CB VAL A 507 14.540 6.489 9.039 1.00 0.00 C ATOM 511 CG1 VAL A 507 15.693 7.448 8.752 1.00 0.00 C ATOM 512 CG2 VAL A 507 14.316 6.420 10.548 1.00 0.00 C ATOM 0 H VAL A 507 12.420 5.108 9.076 1.00 0.00 H new ATOM 0 HA VAL A 507 12.981 7.866 8.451 1.00 0.00 H new ATOM 0 HB VAL A 507 14.805 5.489 8.695 1.00 0.00 H new ATOM 0 HG11 VAL A 507 16.562 7.160 9.344 1.00 0.00 H new ATOM 0 HG12 VAL A 507 15.946 7.407 7.692 1.00 0.00 H new ATOM 0 HG13 VAL A 507 15.396 8.463 9.015 1.00 0.00 H new ATOM 0 HG21 VAL A 507 15.254 6.171 11.044 1.00 0.00 H new ATOM 0 HG22 VAL A 507 13.960 7.385 10.908 1.00 0.00 H new ATOM 0 HG23 VAL A 507 13.574 5.654 10.771 1.00 0.00 H new ATOM 522 N LEU A 508 14.060 7.772 6.136 1.00 0.00 N ATOM 523 CA LEU A 508 14.388 7.959 4.723 1.00 0.00 C ATOM 524 C LEU A 508 15.851 8.427 4.531 1.00 0.00 C ATOM 525 O LEU A 508 16.429 8.203 3.465 1.00 0.00 O ATOM 526 CB LEU A 508 13.445 9.023 4.125 1.00 0.00 C ATOM 527 CG LEU A 508 11.936 8.885 4.417 1.00 0.00 C ATOM 528 CD1 LEU A 508 11.174 10.087 3.847 1.00 0.00 C ATOM 529 CD2 LEU A 508 11.340 7.603 3.838 1.00 0.00 C ATOM 0 H LEU A 508 14.258 8.615 6.675 1.00 0.00 H new ATOM 0 HA LEU A 508 14.267 7.000 4.219 1.00 0.00 H new ATOM 0 HB2 LEU A 508 13.769 10.000 4.485 1.00 0.00 H new ATOM 0 HB3 LEU A 508 13.579 9.021 3.043 1.00 0.00 H new ATOM 0 HG LEU A 508 11.831 8.845 5.501 1.00 0.00 H new ATOM 0 HD11 LEU A 508 10.111 9.978 4.060 1.00 0.00 H new ATOM 0 HD12 LEU A 508 11.544 11.003 4.307 1.00 0.00 H new ATOM 0 HD13 LEU A 508 11.325 10.136 2.769 1.00 0.00 H new ATOM 0 HD21 LEU A 508 10.277 7.558 4.073 1.00 0.00 H new ATOM 0 HD22 LEU A 508 11.473 7.596 2.756 1.00 0.00 H new ATOM 0 HD23 LEU A 508 11.845 6.739 4.271 1.00 0.00 H new ATOM 541 N ASP A 509 16.464 9.054 5.549 1.00 0.00 N ATOM 542 CA ASP A 509 17.877 9.476 5.550 1.00 0.00 C ATOM 543 C ASP A 509 18.453 9.487 6.978 1.00 0.00 C ATOM 544 O ASP A 509 17.798 9.970 7.898 1.00 0.00 O ATOM 545 CB ASP A 509 18.002 10.881 4.944 1.00 0.00 C ATOM 546 CG ASP A 509 19.468 11.348 4.916 1.00 0.00 C ATOM 547 OD1 ASP A 509 20.281 10.737 4.184 1.00 0.00 O ATOM 548 OD2 ASP A 509 19.813 12.316 5.633 1.00 0.00 O ATOM 0 H ASP A 509 15.980 9.288 6.416 1.00 0.00 H new ATOM 0 HA ASP A 509 18.442 8.761 4.952 1.00 0.00 H new ATOM 0 HB2 ASP A 509 17.599 10.880 3.931 1.00 0.00 H new ATOM 0 HB3 ASP A 509 17.405 11.584 5.524 1.00 0.00 H new ATOM 553 N ASP A 510 19.676 8.972 7.153 1.00 0.00 N ATOM 554 CA ASP A 510 20.285 8.657 8.459 1.00 0.00 C ATOM 555 C ASP A 510 21.806 8.941 8.516 1.00 0.00 C ATOM 556 O ASP A 510 22.606 8.132 8.994 1.00 0.00 O ATOM 557 CB ASP A 510 19.897 7.231 8.896 1.00 0.00 C ATOM 558 CG ASP A 510 20.019 6.172 7.781 1.00 0.00 C ATOM 559 OD1 ASP A 510 21.147 5.894 7.307 1.00 0.00 O ATOM 560 OD2 ASP A 510 18.981 5.588 7.382 1.00 0.00 O ATOM 0 H ASP A 510 20.291 8.755 6.369 1.00 0.00 H new ATOM 0 HA ASP A 510 19.871 9.346 9.195 1.00 0.00 H new ATOM 0 HB2 ASP A 510 20.529 6.935 9.733 1.00 0.00 H new ATOM 0 HB3 ASP A 510 18.870 7.242 9.260 1.00 0.00 H new ATOM 565 N SER A 511 22.212 10.122 8.028 1.00 0.00 N ATOM 566 CA SER A 511 23.624 10.541 7.907 1.00 0.00 C ATOM 567 C SER A 511 23.972 11.808 8.713 1.00 0.00 C ATOM 568 O SER A 511 25.078 12.342 8.577 1.00 0.00 O ATOM 569 CB SER A 511 23.967 10.706 6.418 1.00 0.00 C ATOM 570 OG SER A 511 25.368 10.810 6.212 1.00 0.00 O ATOM 0 H SER A 511 21.557 10.831 7.698 1.00 0.00 H new ATOM 0 HA SER A 511 24.239 9.757 8.349 1.00 0.00 H new ATOM 0 HB2 SER A 511 23.579 9.855 5.858 1.00 0.00 H new ATOM 0 HB3 SER A 511 23.474 11.596 6.027 1.00 0.00 H new ATOM 0 HG SER A 511 25.752 11.420 6.876 1.00 0.00 H new ATOM 576 N ARG A 512 23.042 12.300 9.546 1.00 0.00 N ATOM 577 CA ARG A 512 23.148 13.542 10.342 1.00 0.00 C ATOM 578 C ARG A 512 22.446 13.418 11.707 1.00 0.00 C ATOM 579 O ARG A 512 21.815 12.407 12.005 1.00 0.00 O ATOM 580 CB ARG A 512 22.567 14.719 9.523 1.00 0.00 C ATOM 581 CG ARG A 512 23.432 15.080 8.305 1.00 0.00 C ATOM 582 CD ARG A 512 23.068 16.464 7.759 1.00 0.00 C ATOM 583 NE ARG A 512 23.974 16.863 6.662 1.00 0.00 N ATOM 584 CZ ARG A 512 23.794 16.698 5.361 1.00 0.00 C ATOM 585 NH1 ARG A 512 22.738 16.119 4.865 1.00 0.00 N ATOM 586 NH2 ARG A 512 24.695 17.120 4.520 1.00 0.00 N ATOM 0 H ARG A 512 22.152 11.824 9.693 1.00 0.00 H new ATOM 0 HA ARG A 512 24.201 13.728 10.553 1.00 0.00 H new ATOM 0 HB2 ARG A 512 21.563 14.461 9.186 1.00 0.00 H new ATOM 0 HB3 ARG A 512 22.472 15.593 10.168 1.00 0.00 H new ATOM 0 HG2 ARG A 512 24.485 15.062 8.585 1.00 0.00 H new ATOM 0 HG3 ARG A 512 23.297 14.331 7.525 1.00 0.00 H new ATOM 0 HD2 ARG A 512 22.039 16.456 7.399 1.00 0.00 H new ATOM 0 HD3 ARG A 512 23.120 17.199 8.562 1.00 0.00 H new ATOM 0 HE ARG A 512 24.842 17.320 6.941 1.00 0.00 H new ATOM 0 HH11 ARG A 512 22.008 15.771 5.486 1.00 0.00 H new ATOM 0 HH12 ARG A 512 22.641 16.013 3.855 1.00 0.00 H new ATOM 0 HH21 ARG A 512 25.539 17.578 4.864 1.00 0.00 H new ATOM 0 HH22 ARG A 512 24.556 16.993 3.518 1.00 0.00 H new ATOM 600 N LYS A 513 22.534 14.480 12.519 1.00 0.00 N ATOM 601 CA LYS A 513 21.868 14.646 13.834 1.00 0.00 C ATOM 602 C LYS A 513 20.334 14.647 13.781 1.00 0.00 C ATOM 603 O LYS A 513 19.680 14.474 14.806 1.00 0.00 O ATOM 604 CB LYS A 513 22.332 15.970 14.463 1.00 0.00 C ATOM 605 CG LYS A 513 23.827 16.054 14.800 1.00 0.00 C ATOM 606 CD LYS A 513 24.187 15.260 16.066 1.00 0.00 C ATOM 607 CE LYS A 513 25.623 15.556 16.513 1.00 0.00 C ATOM 608 NZ LYS A 513 26.634 14.881 15.656 1.00 0.00 N ATOM 0 H LYS A 513 23.099 15.292 12.271 1.00 0.00 H new ATOM 0 HA LYS A 513 22.156 13.778 14.427 1.00 0.00 H new ATOM 0 HB2 LYS A 513 22.085 16.783 13.780 1.00 0.00 H new ATOM 0 HB3 LYS A 513 21.762 16.137 15.377 1.00 0.00 H new ATOM 0 HG2 LYS A 513 24.408 15.675 13.959 1.00 0.00 H new ATOM 0 HG3 LYS A 513 24.108 17.098 14.937 1.00 0.00 H new ATOM 0 HD2 LYS A 513 23.494 15.514 16.868 1.00 0.00 H new ATOM 0 HD3 LYS A 513 24.075 14.193 15.874 1.00 0.00 H new ATOM 0 HE2 LYS A 513 25.793 16.632 16.491 1.00 0.00 H new ATOM 0 HE3 LYS A 513 25.753 15.234 17.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 27.589 15.112 15.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 26.491 13.852 15.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 26.530 15.207 14.674 1.00 0.00 H new ATOM 622 N TRP A 514 19.743 14.855 12.609 1.00 0.00 N ATOM 623 CA TRP A 514 18.292 14.839 12.410 1.00 0.00 C ATOM 624 C TRP A 514 17.965 13.994 11.183 1.00 0.00 C ATOM 625 O TRP A 514 18.458 14.266 10.085 1.00 0.00 O ATOM 626 CB TRP A 514 17.740 16.258 12.238 1.00 0.00 C ATOM 627 CG TRP A 514 17.745 17.145 13.452 1.00 0.00 C ATOM 628 CD1 TRP A 514 18.815 17.545 14.180 1.00 0.00 C ATOM 629 CD2 TRP A 514 16.591 17.764 14.091 1.00 0.00 C ATOM 630 NE1 TRP A 514 18.394 18.288 15.269 1.00 0.00 N ATOM 631 CE2 TRP A 514 17.025 18.435 15.271 1.00 0.00 C ATOM 632 CE3 TRP A 514 15.219 17.825 13.784 1.00 0.00 C ATOM 633 CZ2 TRP A 514 16.127 19.069 16.140 1.00 0.00 C ATOM 634 CZ3 TRP A 514 14.310 18.497 14.620 1.00 0.00 C ATOM 635 CH2 TRP A 514 14.759 19.100 15.814 1.00 0.00 C ATOM 0 H TRP A 514 20.265 15.043 11.753 1.00 0.00 H new ATOM 0 HA TRP A 514 17.822 14.406 13.293 1.00 0.00 H new ATOM 0 HB2 TRP A 514 18.315 16.752 11.455 1.00 0.00 H new ATOM 0 HB3 TRP A 514 16.714 16.181 11.879 1.00 0.00 H new ATOM 0 HD1 TRP A 514 19.844 17.318 13.945 1.00 0.00 H new ATOM 0 HE1 TRP A 514 19.017 18.676 15.978 1.00 0.00 H new ATOM 0 HE3 TRP A 514 14.856 17.345 12.887 1.00 0.00 H new ATOM 0 HZ2 TRP A 514 16.481 19.529 17.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 514 13.266 18.552 14.348 1.00 0.00 H new ATOM 0 HH2 TRP A 514 14.055 19.584 16.475 1.00 0.00 H new ATOM 646 N TRP A 515 17.153 12.956 11.370 1.00 0.00 N ATOM 647 CA TRP A 515 16.798 12.026 10.294 1.00 0.00 C ATOM 648 C TRP A 515 15.509 12.474 9.598 1.00 0.00 C ATOM 649 O TRP A 515 14.570 12.951 10.244 1.00 0.00 O ATOM 650 CB TRP A 515 16.732 10.581 10.814 1.00 0.00 C ATOM 651 CG TRP A 515 18.020 10.017 11.363 1.00 0.00 C ATOM 652 CD1 TRP A 515 19.224 10.635 11.425 1.00 0.00 C ATOM 653 CD2 TRP A 515 18.264 8.674 11.884 1.00 0.00 C ATOM 654 NE1 TRP A 515 20.172 9.782 11.957 1.00 0.00 N ATOM 655 CE2 TRP A 515 19.638 8.550 12.249 1.00 0.00 C ATOM 656 CE3 TRP A 515 17.457 7.539 12.054 1.00 0.00 C ATOM 657 CZ2 TRP A 515 20.182 7.358 12.759 1.00 0.00 C ATOM 658 CZ3 TRP A 515 17.985 6.330 12.552 1.00 0.00 C ATOM 659 CH2 TRP A 515 19.344 6.239 12.909 1.00 0.00 C ATOM 0 H TRP A 515 16.722 12.734 12.268 1.00 0.00 H new ATOM 0 HA TRP A 515 17.583 12.042 9.538 1.00 0.00 H new ATOM 0 HB2 TRP A 515 15.974 10.531 11.596 1.00 0.00 H new ATOM 0 HB3 TRP A 515 16.394 9.938 10.001 1.00 0.00 H new ATOM 0 HD1 TRP A 515 19.415 11.649 11.105 1.00 0.00 H new ATOM 0 HE1 TRP A 515 21.148 10.035 12.114 1.00 0.00 H new ATOM 0 HE3 TRP A 515 16.409 7.592 11.798 1.00 0.00 H new ATOM 0 HZ2 TRP A 515 21.226 7.303 13.031 1.00 0.00 H new ATOM 0 HZ3 TRP A 515 17.343 5.468 12.660 1.00 0.00 H new ATOM 0 HH2 TRP A 515 19.741 5.313 13.297 1.00 0.00 H new ATOM 670 N LYS A 516 15.462 12.316 8.270 1.00 0.00 N ATOM 671 CA LYS A 516 14.251 12.503 7.479 1.00 0.00 C ATOM 672 C LYS A 516 13.399 11.274 7.706 1.00 0.00 C ATOM 673 O LYS A 516 13.809 10.181 7.338 1.00 0.00 O ATOM 674 CB LYS A 516 14.605 12.724 5.999 1.00 0.00 C ATOM 675 CG LYS A 516 13.355 13.156 5.219 1.00 0.00 C ATOM 676 CD LYS A 516 13.697 13.533 3.768 1.00 0.00 C ATOM 677 CE LYS A 516 12.418 13.915 3.011 1.00 0.00 C ATOM 678 NZ LYS A 516 12.710 14.444 1.652 1.00 0.00 N ATOM 0 H LYS A 516 16.275 12.052 7.713 1.00 0.00 H new ATOM 0 HA LYS A 516 13.696 13.392 7.780 1.00 0.00 H new ATOM 0 HB2 LYS A 516 15.380 13.486 5.912 1.00 0.00 H new ATOM 0 HB3 LYS A 516 15.011 11.807 5.573 1.00 0.00 H new ATOM 0 HG2 LYS A 516 12.625 12.347 5.223 1.00 0.00 H new ATOM 0 HG3 LYS A 516 12.890 14.007 5.717 1.00 0.00 H new ATOM 0 HD2 LYS A 516 14.400 14.366 3.756 1.00 0.00 H new ATOM 0 HD3 LYS A 516 14.187 12.695 3.272 1.00 0.00 H new ATOM 0 HE2 LYS A 516 11.771 13.041 2.928 1.00 0.00 H new ATOM 0 HE3 LYS A 516 11.870 14.665 3.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 11.818 14.689 1.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 13.306 15.293 1.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 13.210 13.720 1.098 1.00 0.00 H new ATOM 692 N VAL A 517 12.258 11.441 8.354 1.00 0.00 N ATOM 693 CA VAL A 517 11.275 10.375 8.586 1.00 0.00 C ATOM 694 C VAL A 517 9.902 10.770 8.035 1.00 0.00 C ATOM 695 O VAL A 517 9.705 11.894 7.564 1.00 0.00 O ATOM 696 CB VAL A 517 11.187 9.936 10.070 1.00 0.00 C ATOM 697 CG1 VAL A 517 12.552 9.704 10.727 1.00 0.00 C ATOM 698 CG2 VAL A 517 10.424 10.932 10.942 1.00 0.00 C ATOM 0 H VAL A 517 11.975 12.339 8.746 1.00 0.00 H new ATOM 0 HA VAL A 517 11.629 9.502 8.038 1.00 0.00 H new ATOM 0 HB VAL A 517 10.647 8.991 10.019 1.00 0.00 H new ATOM 0 HG11 VAL A 517 12.410 9.399 11.764 1.00 0.00 H new ATOM 0 HG12 VAL A 517 13.086 8.921 10.189 1.00 0.00 H new ATOM 0 HG13 VAL A 517 13.132 10.626 10.696 1.00 0.00 H new ATOM 0 HG21 VAL A 517 10.396 10.569 11.970 1.00 0.00 H new ATOM 0 HG22 VAL A 517 10.925 11.900 10.912 1.00 0.00 H new ATOM 0 HG23 VAL A 517 9.406 11.038 10.567 1.00 0.00 H new ATOM 708 N ARG A 518 8.939 9.849 8.122 1.00 0.00 N ATOM 709 CA ARG A 518 7.541 10.072 7.744 1.00 0.00 C ATOM 710 C ARG A 518 6.592 9.562 8.825 1.00 0.00 C ATOM 711 O ARG A 518 6.730 8.430 9.289 1.00 0.00 O ATOM 712 CB ARG A 518 7.294 9.424 6.373 1.00 0.00 C ATOM 713 CG ARG A 518 5.870 9.663 5.848 1.00 0.00 C ATOM 714 CD ARG A 518 5.676 9.114 4.431 1.00 0.00 C ATOM 715 NE ARG A 518 5.713 7.638 4.398 1.00 0.00 N ATOM 716 CZ ARG A 518 4.725 6.803 4.667 1.00 0.00 C ATOM 717 NH1 ARG A 518 3.550 7.213 5.066 1.00 0.00 N ATOM 718 NH2 ARG A 518 4.912 5.522 4.545 1.00 0.00 N ATOM 0 H ARG A 518 9.114 8.905 8.466 1.00 0.00 H new ATOM 0 HA ARG A 518 7.339 11.140 7.657 1.00 0.00 H new ATOM 0 HB2 ARG A 518 8.012 9.820 5.655 1.00 0.00 H new ATOM 0 HB3 ARG A 518 7.474 8.351 6.446 1.00 0.00 H new ATOM 0 HG2 ARG A 518 5.153 9.191 6.520 1.00 0.00 H new ATOM 0 HG3 ARG A 518 5.657 10.732 5.854 1.00 0.00 H new ATOM 0 HD2 ARG A 518 4.722 9.461 4.035 1.00 0.00 H new ATOM 0 HD3 ARG A 518 6.454 9.511 3.779 1.00 0.00 H new ATOM 0 HE ARG A 518 6.604 7.215 4.138 1.00 0.00 H new ATOM 0 HH11 ARG A 518 3.369 8.210 5.180 1.00 0.00 H new ATOM 0 HH12 ARG A 518 2.813 6.536 5.263 1.00 0.00 H new ATOM 0 HH21 ARG A 518 5.819 5.165 4.243 1.00 0.00 H new ATOM 0 HH22 ARG A 518 4.152 4.874 4.752 1.00 0.00 H new ATOM 732 N ASP A 519 5.629 10.398 9.218 1.00 0.00 N ATOM 733 CA ASP A 519 4.566 10.015 10.149 1.00 0.00 C ATOM 734 C ASP A 519 3.525 9.101 9.476 1.00 0.00 C ATOM 735 O ASP A 519 3.321 9.185 8.259 1.00 0.00 O ATOM 736 CB ASP A 519 3.887 11.265 10.714 1.00 0.00 C ATOM 737 CG ASP A 519 4.516 11.747 12.025 1.00 0.00 C ATOM 738 OD1 ASP A 519 5.503 12.510 11.965 1.00 0.00 O ATOM 739 OD2 ASP A 519 3.985 11.378 13.102 1.00 0.00 O ATOM 0 H ASP A 519 5.564 11.364 8.898 1.00 0.00 H new ATOM 0 HA ASP A 519 5.022 9.453 10.964 1.00 0.00 H new ATOM 0 HB2 ASP A 519 3.940 12.066 9.976 1.00 0.00 H new ATOM 0 HB3 ASP A 519 2.831 11.054 10.880 1.00 0.00 H new ATOM 744 N PRO A 520 2.783 8.294 10.258 1.00 0.00 N ATOM 745 CA PRO A 520 1.782 7.366 9.740 1.00 0.00 C ATOM 746 C PRO A 520 0.573 8.067 9.079 1.00 0.00 C ATOM 747 O PRO A 520 -0.223 7.423 8.394 1.00 0.00 O ATOM 748 CB PRO A 520 1.362 6.515 10.945 1.00 0.00 C ATOM 749 CG PRO A 520 1.606 7.437 12.137 1.00 0.00 C ATOM 750 CD PRO A 520 2.840 8.220 11.707 1.00 0.00 C ATOM 0 HA PRO A 520 2.200 6.762 8.935 1.00 0.00 H new ATOM 0 HB2 PRO A 520 0.317 6.214 10.878 1.00 0.00 H new ATOM 0 HB3 PRO A 520 1.953 5.602 11.017 1.00 0.00 H new ATOM 0 HG2 PRO A 520 0.755 8.092 12.323 1.00 0.00 H new ATOM 0 HG3 PRO A 520 1.782 6.875 13.054 1.00 0.00 H new ATOM 0 HD2 PRO A 520 2.843 9.217 12.149 1.00 0.00 H new ATOM 0 HD3 PRO A 520 3.752 7.722 12.037 1.00 0.00 H new ATOM 758 N ALA A 521 0.435 9.387 9.262 1.00 0.00 N ATOM 759 CA ALA A 521 -0.595 10.240 8.670 1.00 0.00 C ATOM 760 C ALA A 521 -0.244 10.715 7.244 1.00 0.00 C ATOM 761 O ALA A 521 -1.121 11.218 6.537 1.00 0.00 O ATOM 762 CB ALA A 521 -0.775 11.448 9.598 1.00 0.00 C ATOM 0 H ALA A 521 1.074 9.912 9.859 1.00 0.00 H new ATOM 0 HA ALA A 521 -1.514 9.662 8.573 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -1.538 12.110 9.189 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -1.083 11.105 10.586 1.00 0.00 H new ATOM 0 HB3 ALA A 521 0.168 11.988 9.680 1.00 0.00 H new ATOM 768 N GLY A 522 1.022 10.577 6.821 1.00 0.00 N ATOM 769 CA GLY A 522 1.477 10.909 5.468 1.00 0.00 C ATOM 770 C GLY A 522 2.351 12.158 5.345 1.00 0.00 C ATOM 771 O GLY A 522 2.289 12.839 4.319 1.00 0.00 O ATOM 0 H GLY A 522 1.768 10.226 7.421 1.00 0.00 H new ATOM 0 HA2 GLY A 522 2.034 10.059 5.074 1.00 0.00 H new ATOM 0 HA3 GLY A 522 0.601 11.038 4.832 1.00 0.00 H new ATOM 775 N GLN A 523 3.121 12.497 6.383 1.00 0.00 N ATOM 776 CA GLN A 523 3.846 13.772 6.479 1.00 0.00 C ATOM 777 C GLN A 523 5.346 13.539 6.637 1.00 0.00 C ATOM 778 O GLN A 523 5.754 12.759 7.493 1.00 0.00 O ATOM 779 CB GLN A 523 3.330 14.560 7.690 1.00 0.00 C ATOM 780 CG GLN A 523 1.810 14.717 7.726 1.00 0.00 C ATOM 781 CD GLN A 523 1.376 15.919 8.564 1.00 0.00 C ATOM 782 OE1 GLN A 523 0.863 16.911 8.059 1.00 0.00 O ATOM 783 NE2 GLN A 523 1.577 15.901 9.867 1.00 0.00 N ATOM 0 H GLN A 523 3.261 11.889 7.190 1.00 0.00 H new ATOM 0 HA GLN A 523 3.676 14.334 5.561 1.00 0.00 H new ATOM 0 HB2 GLN A 523 3.655 14.059 8.602 1.00 0.00 H new ATOM 0 HB3 GLN A 523 3.788 15.549 7.689 1.00 0.00 H new ATOM 0 HG2 GLN A 523 1.433 14.829 6.709 1.00 0.00 H new ATOM 0 HG3 GLN A 523 1.362 13.811 8.133 1.00 0.00 H new ATOM 0 HE21 GLN A 523 2.003 15.085 10.306 1.00 0.00 H new ATOM 0 HE22 GLN A 523 1.307 16.703 10.436 1.00 0.00 H new ATOM 792 N GLU A 524 6.162 14.239 5.848 1.00 0.00 N ATOM 793 CA GLU A 524 7.629 14.129 5.840 1.00 0.00 C ATOM 794 C GLU A 524 8.292 15.448 6.267 1.00 0.00 C ATOM 795 O GLU A 524 7.786 16.550 6.028 1.00 0.00 O ATOM 796 CB GLU A 524 8.142 13.755 4.440 1.00 0.00 C ATOM 797 CG GLU A 524 7.631 12.408 3.913 1.00 0.00 C ATOM 798 CD GLU A 524 7.621 12.375 2.373 1.00 0.00 C ATOM 799 OE1 GLU A 524 8.702 12.486 1.743 1.00 0.00 O ATOM 800 OE2 GLU A 524 6.525 12.243 1.775 1.00 0.00 O ATOM 0 H GLU A 524 5.813 14.921 5.174 1.00 0.00 H new ATOM 0 HA GLU A 524 7.892 13.347 6.552 1.00 0.00 H new ATOM 0 HB2 GLU A 524 7.852 14.538 3.740 1.00 0.00 H new ATOM 0 HB3 GLU A 524 9.232 13.733 4.460 1.00 0.00 H new ATOM 0 HG2 GLU A 524 8.262 11.604 4.292 1.00 0.00 H new ATOM 0 HG3 GLU A 524 6.624 12.227 4.289 1.00 0.00 H new ATOM 807 N GLY A 525 9.461 15.308 6.896 1.00 0.00 N ATOM 808 CA GLY A 525 10.236 16.389 7.510 1.00 0.00 C ATOM 809 C GLY A 525 11.362 15.807 8.367 1.00 0.00 C ATOM 810 O GLY A 525 11.697 14.634 8.232 1.00 0.00 O ATOM 0 H GLY A 525 9.913 14.399 6.996 1.00 0.00 H new ATOM 0 HA2 GLY A 525 10.653 17.033 6.736 1.00 0.00 H new ATOM 0 HA3 GLY A 525 9.585 17.010 8.125 1.00 0.00 H new ATOM 814 N TYR A 526 11.932 16.595 9.275 1.00 0.00 N ATOM 815 CA TYR A 526 13.055 16.191 10.120 1.00 0.00 C ATOM 816 C TYR A 526 12.661 16.074 11.588 1.00 0.00 C ATOM 817 O TYR A 526 11.862 16.858 12.105 1.00 0.00 O ATOM 818 CB TYR A 526 14.216 17.164 9.929 1.00 0.00 C ATOM 819 CG TYR A 526 14.844 17.076 8.552 1.00 0.00 C ATOM 820 CD1 TYR A 526 15.680 15.990 8.224 1.00 0.00 C ATOM 821 CD2 TYR A 526 14.582 18.072 7.595 1.00 0.00 C ATOM 822 CE1 TYR A 526 16.229 15.886 6.933 1.00 0.00 C ATOM 823 CE2 TYR A 526 15.104 17.959 6.298 1.00 0.00 C ATOM 824 CZ TYR A 526 15.929 16.866 5.961 1.00 0.00 C ATOM 825 OH TYR A 526 16.441 16.782 4.703 1.00 0.00 O ATOM 0 H TYR A 526 11.621 17.551 9.448 1.00 0.00 H new ATOM 0 HA TYR A 526 13.372 15.195 9.811 1.00 0.00 H new ATOM 0 HB2 TYR A 526 13.861 18.181 10.096 1.00 0.00 H new ATOM 0 HB3 TYR A 526 14.978 16.964 10.683 1.00 0.00 H new ATOM 0 HD1 TYR A 526 15.900 15.236 8.965 1.00 0.00 H new ATOM 0 HD2 TYR A 526 13.977 18.927 7.859 1.00 0.00 H new ATOM 0 HE1 TYR A 526 16.878 15.059 6.686 1.00 0.00 H new ATOM 0 HE2 TYR A 526 14.874 18.710 5.557 1.00 0.00 H new ATOM 0 HH TYR A 526 16.127 17.542 4.171 1.00 0.00 H new ATOM 835 N VAL A 527 13.267 15.092 12.261 1.00 0.00 N ATOM 836 CA VAL A 527 13.136 14.865 13.706 1.00 0.00 C ATOM 837 C VAL A 527 14.505 14.522 14.316 1.00 0.00 C ATOM 838 O VAL A 527 15.360 13.954 13.628 1.00 0.00 O ATOM 839 CB VAL A 527 12.101 13.765 14.028 1.00 0.00 C ATOM 840 CG1 VAL A 527 10.685 14.175 13.614 1.00 0.00 C ATOM 841 CG2 VAL A 527 12.455 12.424 13.391 1.00 0.00 C ATOM 0 H VAL A 527 13.879 14.414 11.806 1.00 0.00 H new ATOM 0 HA VAL A 527 12.770 15.789 14.154 1.00 0.00 H new ATOM 0 HB VAL A 527 12.128 13.642 15.111 1.00 0.00 H new ATOM 0 HG11 VAL A 527 9.988 13.373 13.858 1.00 0.00 H new ATOM 0 HG12 VAL A 527 10.398 15.081 14.148 1.00 0.00 H new ATOM 0 HG13 VAL A 527 10.660 14.363 12.541 1.00 0.00 H new ATOM 0 HG21 VAL A 527 11.695 11.687 13.649 1.00 0.00 H new ATOM 0 HG22 VAL A 527 12.499 12.536 12.308 1.00 0.00 H new ATOM 0 HG23 VAL A 527 13.425 12.090 13.761 1.00 0.00 H new ATOM 851 N PRO A 528 14.745 14.863 15.592 1.00 0.00 N ATOM 852 CA PRO A 528 16.051 14.733 16.238 1.00 0.00 C ATOM 853 C PRO A 528 16.425 13.267 16.490 1.00 0.00 C ATOM 854 O PRO A 528 15.652 12.517 17.082 1.00 0.00 O ATOM 855 CB PRO A 528 15.912 15.510 17.548 1.00 0.00 C ATOM 856 CG PRO A 528 14.416 15.515 17.848 1.00 0.00 C ATOM 857 CD PRO A 528 13.786 15.505 16.473 1.00 0.00 C ATOM 0 HA PRO A 528 16.853 15.122 15.610 1.00 0.00 H new ATOM 0 HB2 PRO A 528 16.474 15.033 18.351 1.00 0.00 H new ATOM 0 HB3 PRO A 528 16.298 16.525 17.448 1.00 0.00 H new ATOM 0 HG2 PRO A 528 14.120 14.644 18.433 1.00 0.00 H new ATOM 0 HG3 PRO A 528 14.123 16.396 18.418 1.00 0.00 H new ATOM 0 HD2 PRO A 528 12.841 14.962 16.482 1.00 0.00 H new ATOM 0 HD3 PRO A 528 13.567 16.519 16.138 1.00 0.00 H new ATOM 865 N TYR A 529 17.638 12.848 16.117 1.00 0.00 N ATOM 866 CA TYR A 529 18.092 11.463 16.330 1.00 0.00 C ATOM 867 C TYR A 529 18.138 11.045 17.813 1.00 0.00 C ATOM 868 O TYR A 529 18.078 9.854 18.111 1.00 0.00 O ATOM 869 CB TYR A 529 19.446 11.200 15.648 1.00 0.00 C ATOM 870 CG TYR A 529 20.686 11.474 16.500 1.00 0.00 C ATOM 871 CD1 TYR A 529 20.884 12.736 17.099 1.00 0.00 C ATOM 872 CD2 TYR A 529 21.619 10.445 16.742 1.00 0.00 C ATOM 873 CE1 TYR A 529 21.986 12.973 17.943 1.00 0.00 C ATOM 874 CE2 TYR A 529 22.728 10.673 17.580 1.00 0.00 C ATOM 875 CZ TYR A 529 22.910 11.933 18.189 1.00 0.00 C ATOM 876 OH TYR A 529 23.978 12.141 19.008 1.00 0.00 O ATOM 0 H TYR A 529 18.328 13.448 15.664 1.00 0.00 H new ATOM 0 HA TYR A 529 17.335 10.836 15.859 1.00 0.00 H new ATOM 0 HB2 TYR A 529 19.473 10.159 15.326 1.00 0.00 H new ATOM 0 HB3 TYR A 529 19.504 11.814 14.749 1.00 0.00 H new ATOM 0 HD1 TYR A 529 20.180 13.532 16.907 1.00 0.00 H new ATOM 0 HD2 TYR A 529 21.483 9.477 16.283 1.00 0.00 H new ATOM 0 HE1 TYR A 529 22.124 13.942 18.399 1.00 0.00 H new ATOM 0 HE2 TYR A 529 23.441 9.881 17.757 1.00 0.00 H new ATOM 0 HH TYR A 529 24.510 11.320 19.067 1.00 0.00 H new ATOM 886 N ASN A 530 18.195 12.003 18.754 1.00 0.00 N ATOM 887 CA ASN A 530 18.195 11.706 20.189 1.00 0.00 C ATOM 888 C ASN A 530 16.916 10.973 20.636 1.00 0.00 C ATOM 889 O ASN A 530 16.991 10.084 21.485 1.00 0.00 O ATOM 890 CB ASN A 530 18.392 13.011 20.979 1.00 0.00 C ATOM 891 CG ASN A 530 18.397 12.743 22.479 1.00 0.00 C ATOM 892 OD1 ASN A 530 19.407 12.387 23.068 1.00 0.00 O ATOM 893 ND2 ASN A 530 17.259 12.853 23.132 1.00 0.00 N ATOM 0 H ASN A 530 18.242 12.999 18.539 1.00 0.00 H new ATOM 0 HA ASN A 530 19.023 11.028 20.396 1.00 0.00 H new ATOM 0 HB2 ASN A 530 19.331 13.480 20.686 1.00 0.00 H new ATOM 0 HB3 ASN A 530 17.595 13.713 20.734 1.00 0.00 H new ATOM 0 HD21 ASN A 530 17.221 12.641 24.129 1.00 0.00 H new ATOM 0 HD22 ASN A 530 16.416 13.150 22.641 1.00 0.00 H new ATOM 900 N ILE A 531 15.753 11.327 20.067 1.00 0.00 N ATOM 901 CA ILE A 531 14.473 10.685 20.408 1.00 0.00 C ATOM 902 C ILE A 531 14.229 9.415 19.581 1.00 0.00 C ATOM 903 O ILE A 531 13.227 8.751 19.815 1.00 0.00 O ATOM 904 CB ILE A 531 13.266 11.661 20.350 1.00 0.00 C ATOM 905 CG1 ILE A 531 12.757 11.919 18.914 1.00 0.00 C ATOM 906 CG2 ILE A 531 13.612 12.978 21.077 1.00 0.00 C ATOM 907 CD1 ILE A 531 11.599 12.920 18.805 1.00 0.00 C ATOM 0 H ILE A 531 15.673 12.061 19.363 1.00 0.00 H new ATOM 0 HA ILE A 531 14.559 10.379 21.451 1.00 0.00 H new ATOM 0 HB ILE A 531 12.438 11.178 20.869 1.00 0.00 H new ATOM 0 HG12 ILE A 531 13.589 12.282 18.310 1.00 0.00 H new ATOM 0 HG13 ILE A 531 12.439 10.970 18.482 1.00 0.00 H new ATOM 0 HG21 ILE A 531 12.759 13.655 21.030 1.00 0.00 H new ATOM 0 HG22 ILE A 531 13.850 12.766 22.119 1.00 0.00 H new ATOM 0 HG23 ILE A 531 14.472 13.444 20.596 1.00 0.00 H new ATOM 0 HD11 ILE A 531 11.313 13.033 17.759 1.00 0.00 H new ATOM 0 HD12 ILE A 531 10.746 12.553 19.376 1.00 0.00 H new ATOM 0 HD13 ILE A 531 11.914 13.885 19.202 1.00 0.00 H new ATOM 919 N LEU A 532 15.095 9.064 18.622 1.00 0.00 N ATOM 920 CA LEU A 532 14.922 7.885 17.771 1.00 0.00 C ATOM 921 C LEU A 532 15.761 6.701 18.285 1.00 0.00 C ATOM 922 O LEU A 532 16.980 6.811 18.431 1.00 0.00 O ATOM 923 CB LEU A 532 15.303 8.248 16.326 1.00 0.00 C ATOM 924 CG LEU A 532 14.464 9.366 15.674 1.00 0.00 C ATOM 925 CD1 LEU A 532 14.915 9.524 14.218 1.00 0.00 C ATOM 926 CD2 LEU A 532 12.960 9.103 15.721 1.00 0.00 C ATOM 0 H LEU A 532 15.941 9.595 18.415 1.00 0.00 H new ATOM 0 HA LEU A 532 13.878 7.573 17.799 1.00 0.00 H new ATOM 0 HB2 LEU A 532 16.350 8.549 16.311 1.00 0.00 H new ATOM 0 HB3 LEU A 532 15.220 7.351 15.712 1.00 0.00 H new ATOM 0 HG LEU A 532 14.632 10.279 16.245 1.00 0.00 H new ATOM 0 HD11 LEU A 532 14.332 10.311 13.740 1.00 0.00 H new ATOM 0 HD12 LEU A 532 15.972 9.788 14.191 1.00 0.00 H new ATOM 0 HD13 LEU A 532 14.762 8.585 13.686 1.00 0.00 H new ATOM 0 HD21 LEU A 532 12.431 9.929 15.245 1.00 0.00 H new ATOM 0 HD22 LEU A 532 12.736 8.176 15.193 1.00 0.00 H new ATOM 0 HD23 LEU A 532 12.638 9.016 16.759 1.00 0.00 H new ATOM 938 N THR A 533 15.119 5.548 18.502 1.00 0.00 N ATOM 939 CA THR A 533 15.779 4.279 18.865 1.00 0.00 C ATOM 940 C THR A 533 15.522 3.201 17.797 1.00 0.00 C ATOM 941 O THR A 533 14.406 3.135 17.273 1.00 0.00 O ATOM 942 CB THR A 533 15.355 3.815 20.277 1.00 0.00 C ATOM 943 OG1 THR A 533 16.022 2.641 20.685 1.00 0.00 O ATOM 944 CG2 THR A 533 13.870 3.517 20.443 1.00 0.00 C ATOM 0 H THR A 533 14.105 5.464 18.430 1.00 0.00 H new ATOM 0 HA THR A 533 16.855 4.449 18.897 1.00 0.00 H new ATOM 0 HB THR A 533 15.624 4.677 20.887 1.00 0.00 H new ATOM 0 HG1 THR A 533 15.722 2.389 21.583 1.00 0.00 H new ATOM 0 HG21 THR A 533 13.675 3.199 21.467 1.00 0.00 H new ATOM 0 HG22 THR A 533 13.292 4.415 20.225 1.00 0.00 H new ATOM 0 HG23 THR A 533 13.579 2.723 19.755 1.00 0.00 H new ATOM 952 N PRO A 534 16.512 2.348 17.459 1.00 0.00 N ATOM 953 CA PRO A 534 16.364 1.269 16.479 1.00 0.00 C ATOM 954 C PRO A 534 15.358 0.214 16.969 1.00 0.00 C ATOM 955 O PRO A 534 15.645 -0.564 17.883 1.00 0.00 O ATOM 956 CB PRO A 534 17.774 0.706 16.266 1.00 0.00 C ATOM 957 CG PRO A 534 18.491 1.021 17.578 1.00 0.00 C ATOM 958 CD PRO A 534 17.868 2.348 17.997 1.00 0.00 C ATOM 0 HA PRO A 534 15.955 1.622 15.532 1.00 0.00 H new ATOM 0 HB2 PRO A 534 17.752 -0.366 16.069 1.00 0.00 H new ATOM 0 HB3 PRO A 534 18.269 1.176 15.416 1.00 0.00 H new ATOM 0 HG2 PRO A 534 18.327 0.244 18.325 1.00 0.00 H new ATOM 0 HG3 PRO A 534 19.569 1.107 17.439 1.00 0.00 H new ATOM 0 HD2 PRO A 534 17.856 2.447 19.082 1.00 0.00 H new ATOM 0 HD3 PRO A 534 18.442 3.188 17.606 1.00 0.00 H new ATOM 966 N TYR A 535 14.155 0.209 16.390 1.00 0.00 N ATOM 967 CA TYR A 535 13.062 -0.665 16.824 1.00 0.00 C ATOM 968 C TYR A 535 13.121 -2.035 16.111 1.00 0.00 C ATOM 969 O TYR A 535 13.345 -2.067 14.894 1.00 0.00 O ATOM 970 CB TYR A 535 11.720 0.041 16.583 1.00 0.00 C ATOM 971 CG TYR A 535 10.597 -0.497 17.450 1.00 0.00 C ATOM 972 CD1 TYR A 535 10.681 -0.366 18.852 1.00 0.00 C ATOM 973 CD2 TYR A 535 9.487 -1.144 16.872 1.00 0.00 C ATOM 974 CE1 TYR A 535 9.678 -0.909 19.675 1.00 0.00 C ATOM 975 CE2 TYR A 535 8.467 -1.665 17.693 1.00 0.00 C ATOM 976 CZ TYR A 535 8.565 -1.554 19.099 1.00 0.00 C ATOM 977 OH TYR A 535 7.592 -2.066 19.902 1.00 0.00 O ATOM 0 H TYR A 535 13.911 0.813 15.605 1.00 0.00 H new ATOM 0 HA TYR A 535 13.167 -0.863 17.891 1.00 0.00 H new ATOM 0 HB2 TYR A 535 11.839 1.108 16.774 1.00 0.00 H new ATOM 0 HB3 TYR A 535 11.444 -0.066 15.534 1.00 0.00 H new ATOM 0 HD1 TYR A 535 11.518 0.153 19.295 1.00 0.00 H new ATOM 0 HD2 TYR A 535 9.418 -1.241 15.799 1.00 0.00 H new ATOM 0 HE1 TYR A 535 9.761 -0.832 20.749 1.00 0.00 H new ATOM 0 HE2 TYR A 535 7.610 -2.149 17.248 1.00 0.00 H new ATOM 0 HH TYR A 535 6.894 -2.477 19.350 1.00 0.00 H new ATOM 987 N PRO A 536 12.928 -3.171 16.815 1.00 0.00 N ATOM 988 CA PRO A 536 13.073 -4.503 16.219 1.00 0.00 C ATOM 989 C PRO A 536 11.927 -4.881 15.260 1.00 0.00 C ATOM 990 O PRO A 536 12.148 -5.645 14.316 1.00 0.00 O ATOM 991 CB PRO A 536 13.156 -5.467 17.406 1.00 0.00 C ATOM 992 CG PRO A 536 12.371 -4.756 18.506 1.00 0.00 C ATOM 993 CD PRO A 536 12.667 -3.282 18.244 1.00 0.00 C ATOM 0 HA PRO A 536 13.961 -4.541 15.589 1.00 0.00 H new ATOM 0 HB2 PRO A 536 12.720 -6.437 17.166 1.00 0.00 H new ATOM 0 HB3 PRO A 536 14.189 -5.647 17.704 1.00 0.00 H new ATOM 0 HG2 PRO A 536 11.304 -4.970 18.443 1.00 0.00 H new ATOM 0 HG3 PRO A 536 12.700 -5.063 19.499 1.00 0.00 H new ATOM 0 HD2 PRO A 536 11.823 -2.657 18.536 1.00 0.00 H new ATOM 0 HD3 PRO A 536 13.527 -2.948 18.825 1.00 0.00 H new ATOM 1001 N GLY A 537 10.715 -4.344 15.479 1.00 0.00 N ATOM 1002 CA GLY A 537 9.507 -4.568 14.662 1.00 0.00 C ATOM 1003 C GLY A 537 8.259 -4.958 15.459 1.00 0.00 C ATOM 1004 O GLY A 537 8.368 -5.283 16.665 1.00 0.00 O ATOM 0 H GLY A 537 10.541 -3.715 16.263 1.00 0.00 H new ATOM 0 HA2 GLY A 537 9.293 -3.660 14.098 1.00 0.00 H new ATOM 0 HA3 GLY A 537 9.717 -5.352 13.935 1.00 0.00 H new TER 1008 GLY A 537 ATOM 1009 N PRO B 538 18.431 15.713 26.342 1.00 0.00 N ATOM 1010 CA PRO B 538 18.644 16.690 25.234 1.00 0.00 C ATOM 1011 C PRO B 538 17.817 16.326 23.978 1.00 0.00 C ATOM 1012 O PRO B 538 18.358 15.790 23.009 1.00 0.00 O ATOM 1013 CB PRO B 538 20.164 16.738 24.973 1.00 0.00 C ATOM 1014 CG PRO B 538 20.615 15.328 25.353 1.00 0.00 C ATOM 1015 CD PRO B 538 19.743 15.064 26.579 1.00 0.00 C ATOM 0 HA PRO B 538 18.288 17.683 25.510 1.00 0.00 H new ATOM 0 HB2 PRO B 538 20.389 16.968 23.932 1.00 0.00 H new ATOM 0 HB3 PRO B 538 20.655 17.498 25.581 1.00 0.00 H new ATOM 0 HG2 PRO B 538 20.434 14.608 24.555 1.00 0.00 H new ATOM 0 HG3 PRO B 538 21.679 15.284 25.586 1.00 0.00 H new ATOM 0 HD2 PRO B 538 19.618 13.993 26.737 1.00 0.00 H new ATOM 0 HD3 PRO B 538 20.213 15.466 27.477 1.00 0.00 H new ATOM 1023 N PRO B 539 16.496 16.608 23.967 1.00 0.00 N ATOM 1024 CA PRO B 539 15.598 16.210 22.877 1.00 0.00 C ATOM 1025 C PRO B 539 15.844 16.953 21.552 1.00 0.00 C ATOM 1026 O PRO B 539 15.335 16.519 20.527 1.00 0.00 O ATOM 1027 CB PRO B 539 14.178 16.439 23.408 1.00 0.00 C ATOM 1028 CG PRO B 539 14.361 17.578 24.406 1.00 0.00 C ATOM 1029 CD PRO B 539 15.736 17.289 25.009 1.00 0.00 C ATOM 0 HA PRO B 539 15.776 15.167 22.614 1.00 0.00 H new ATOM 0 HB2 PRO B 539 13.488 16.710 22.609 1.00 0.00 H new ATOM 0 HB3 PRO B 539 13.777 15.545 23.886 1.00 0.00 H new ATOM 0 HG2 PRO B 539 14.331 18.552 23.917 1.00 0.00 H new ATOM 0 HG3 PRO B 539 13.579 17.579 25.166 1.00 0.00 H new ATOM 0 HD2 PRO B 539 16.231 18.212 25.313 1.00 0.00 H new ATOM 0 HD3 PRO B 539 15.649 16.666 25.899 1.00 0.00 H new ATOM 1037 N VAL B 540 16.643 18.028 21.542 1.00 0.00 N ATOM 1038 CA VAL B 540 17.009 18.835 20.359 1.00 0.00 C ATOM 1039 C VAL B 540 18.551 18.961 20.325 1.00 0.00 C ATOM 1040 O VAL B 540 19.106 19.930 20.857 1.00 0.00 O ATOM 1041 CB VAL B 540 16.277 20.199 20.394 1.00 0.00 C ATOM 1042 CG1 VAL B 540 16.629 21.176 19.262 1.00 0.00 C ATOM 1043 CG2 VAL B 540 14.751 20.021 20.369 1.00 0.00 C ATOM 0 H VAL B 540 17.075 18.380 22.397 1.00 0.00 H new ATOM 0 HA VAL B 540 16.690 18.354 19.434 1.00 0.00 H new ATOM 0 HB VAL B 540 16.628 20.634 21.330 1.00 0.00 H new ATOM 0 HG11 VAL B 540 16.059 22.097 19.386 1.00 0.00 H new ATOM 0 HG12 VAL B 540 17.695 21.402 19.295 1.00 0.00 H new ATOM 0 HG13 VAL B 540 16.383 20.724 18.301 1.00 0.00 H new ATOM 0 HG21 VAL B 540 14.270 20.999 20.395 1.00 0.00 H new ATOM 0 HG22 VAL B 540 14.461 19.498 19.458 1.00 0.00 H new ATOM 0 HG23 VAL B 540 14.438 19.440 21.237 1.00 0.00 H new ATOM 1053 N PRO B 541 19.268 17.956 19.776 1.00 0.00 N ATOM 1054 CA PRO B 541 20.715 17.991 19.534 1.00 0.00 C ATOM 1055 C PRO B 541 21.117 19.051 18.486 1.00 0.00 C ATOM 1056 O PRO B 541 20.268 19.730 17.903 1.00 0.00 O ATOM 1057 CB PRO B 541 21.086 16.568 19.095 1.00 0.00 C ATOM 1058 CG PRO B 541 19.809 16.052 18.446 1.00 0.00 C ATOM 1059 CD PRO B 541 18.726 16.694 19.301 1.00 0.00 C ATOM 0 HA PRO B 541 21.258 18.288 20.431 1.00 0.00 H new ATOM 0 HB2 PRO B 541 21.921 16.569 18.394 1.00 0.00 H new ATOM 0 HB3 PRO B 541 21.383 15.951 19.943 1.00 0.00 H new ATOM 0 HG2 PRO B 541 19.734 16.353 17.401 1.00 0.00 H new ATOM 0 HG3 PRO B 541 19.753 14.964 18.469 1.00 0.00 H new ATOM 0 HD2 PRO B 541 17.818 16.856 18.720 1.00 0.00 H new ATOM 0 HD3 PRO B 541 18.458 16.048 20.137 1.00 0.00 H new ATOM 1067 N ASN B 542 22.429 19.164 18.231 1.00 0.00 N ATOM 1068 CA ASN B 542 23.047 20.009 17.197 1.00 0.00 C ATOM 1069 C ASN B 542 22.236 20.021 15.871 1.00 0.00 C ATOM 1070 O ASN B 542 21.880 18.944 15.380 1.00 0.00 O ATOM 1071 CB ASN B 542 24.494 19.510 17.002 1.00 0.00 C ATOM 1072 CG ASN B 542 25.206 20.134 15.811 1.00 0.00 C ATOM 1073 OD1 ASN B 542 25.328 19.542 14.748 1.00 0.00 O ATOM 1074 ND2 ASN B 542 25.709 21.341 15.944 1.00 0.00 N ATOM 0 H ASN B 542 23.123 18.643 18.767 1.00 0.00 H new ATOM 0 HA ASN B 542 23.052 21.050 17.521 1.00 0.00 H new ATOM 0 HB2 ASN B 542 25.066 19.721 17.906 1.00 0.00 H new ATOM 0 HB3 ASN B 542 24.481 18.427 16.879 1.00 0.00 H new ATOM 0 HD21 ASN B 542 26.198 21.779 15.163 1.00 0.00 H new ATOM 0 HD22 ASN B 542 25.611 21.840 16.828 1.00 0.00 H new ATOM 1081 N PRO B 543 21.923 21.195 15.286 1.00 0.00 N ATOM 1082 CA PRO B 543 21.092 21.279 14.085 1.00 0.00 C ATOM 1083 C PRO B 543 21.778 20.650 12.861 1.00 0.00 C ATOM 1084 O PRO B 543 22.985 20.797 12.647 1.00 0.00 O ATOM 1085 CB PRO B 543 20.807 22.769 13.875 1.00 0.00 C ATOM 1086 CG PRO B 543 21.980 23.463 14.565 1.00 0.00 C ATOM 1087 CD PRO B 543 22.286 22.532 15.735 1.00 0.00 C ATOM 0 HA PRO B 543 20.168 20.714 14.210 1.00 0.00 H new ATOM 0 HB2 PRO B 543 20.759 23.022 12.816 1.00 0.00 H new ATOM 0 HB3 PRO B 543 19.854 23.060 14.316 1.00 0.00 H new ATOM 0 HG2 PRO B 543 22.836 23.569 13.898 1.00 0.00 H new ATOM 0 HG3 PRO B 543 21.714 24.464 14.904 1.00 0.00 H new ATOM 0 HD2 PRO B 543 23.340 22.580 16.007 1.00 0.00 H new ATOM 0 HD3 PRO B 543 21.715 22.815 16.619 1.00 0.00 H new ATOM 1095 N ASP B 544 20.988 19.966 12.033 1.00 0.00 N ATOM 1096 CA ASP B 544 21.409 19.423 10.734 1.00 0.00 C ATOM 1097 C ASP B 544 21.734 20.517 9.684 1.00 0.00 C ATOM 1098 O ASP B 544 21.617 21.719 9.945 1.00 0.00 O ATOM 1099 CB ASP B 544 20.333 18.459 10.225 1.00 0.00 C ATOM 1100 CG ASP B 544 19.093 19.211 9.708 1.00 0.00 C ATOM 1101 OD1 ASP B 544 18.212 19.574 10.526 1.00 0.00 O ATOM 1102 OD2 ASP B 544 19.026 19.461 8.482 1.00 0.00 O ATOM 0 H ASP B 544 20.011 19.767 12.250 1.00 0.00 H new ATOM 0 HA ASP B 544 22.346 18.887 10.885 1.00 0.00 H new ATOM 0 HB2 ASP B 544 20.745 17.843 9.425 1.00 0.00 H new ATOM 0 HB3 ASP B 544 20.040 17.783 11.029 1.00 0.00 H new ATOM 1107 N TYR B 545 22.119 20.093 8.473 1.00 0.00 N ATOM 1108 CA TYR B 545 22.630 20.960 7.403 1.00 0.00 C ATOM 1109 C TYR B 545 21.826 20.850 6.084 1.00 0.00 C ATOM 1110 O TYR B 545 22.340 21.152 5.007 1.00 0.00 O ATOM 1111 CB TYR B 545 24.136 20.677 7.241 1.00 0.00 C ATOM 1112 CG TYR B 545 24.936 21.833 6.671 1.00 0.00 C ATOM 1113 CD1 TYR B 545 25.068 23.020 7.419 1.00 0.00 C ATOM 1114 CD2 TYR B 545 25.553 21.724 5.408 1.00 0.00 C ATOM 1115 CE1 TYR B 545 25.803 24.104 6.903 1.00 0.00 C ATOM 1116 CE2 TYR B 545 26.294 22.804 4.893 1.00 0.00 C ATOM 1117 CZ TYR B 545 26.414 23.999 5.635 1.00 0.00 C ATOM 1118 OH TYR B 545 27.112 25.048 5.118 1.00 0.00 O ATOM 0 H TYR B 545 22.083 19.110 8.203 1.00 0.00 H new ATOM 0 HA TYR B 545 22.494 22.004 7.685 1.00 0.00 H new ATOM 0 HB2 TYR B 545 24.549 20.410 8.214 1.00 0.00 H new ATOM 0 HB3 TYR B 545 24.262 19.810 6.593 1.00 0.00 H new ATOM 0 HD1 TYR B 545 24.604 23.098 8.391 1.00 0.00 H new ATOM 0 HD2 TYR B 545 25.457 20.813 4.836 1.00 0.00 H new ATOM 0 HE1 TYR B 545 25.899 25.014 7.476 1.00 0.00 H new ATOM 0 HE2 TYR B 545 26.772 22.718 3.928 1.00 0.00 H new ATOM 0 HH TYR B 545 27.467 24.803 4.238 1.00 0.00 H new ATOM 1128 N GLU B 546 20.557 20.425 6.147 1.00 0.00 N ATOM 1129 CA GLU B 546 19.669 20.265 4.983 1.00 0.00 C ATOM 1130 C GLU B 546 18.220 20.755 5.269 1.00 0.00 C ATOM 1131 O GLU B 546 17.275 19.960 5.223 1.00 0.00 O ATOM 1132 CB GLU B 546 19.766 18.806 4.488 1.00 0.00 C ATOM 1133 CG GLU B 546 19.222 18.618 3.063 1.00 0.00 C ATOM 1134 CD GLU B 546 19.599 17.228 2.509 1.00 0.00 C ATOM 1135 OE1 GLU B 546 20.771 17.027 2.099 1.00 0.00 O ATOM 1136 OE2 GLU B 546 18.732 16.321 2.467 1.00 0.00 O ATOM 0 H GLU B 546 20.107 20.177 7.028 1.00 0.00 H new ATOM 0 HA GLU B 546 19.999 20.913 4.171 1.00 0.00 H new ATOM 0 HB2 GLU B 546 20.808 18.486 4.518 1.00 0.00 H new ATOM 0 HB3 GLU B 546 19.214 18.159 5.170 1.00 0.00 H new ATOM 0 HG2 GLU B 546 18.138 18.731 3.065 1.00 0.00 H new ATOM 0 HG3 GLU B 546 19.622 19.395 2.411 1.00 0.00 H new ATOM 1143 N PRO B 547 18.008 22.053 5.586 1.00 0.00 N ATOM 1144 CA PRO B 547 16.683 22.617 5.883 1.00 0.00 C ATOM 1145 C PRO B 547 15.744 22.652 4.658 1.00 0.00 C ATOM 1146 O PRO B 547 16.176 22.525 3.509 1.00 0.00 O ATOM 1147 CB PRO B 547 16.963 24.021 6.427 1.00 0.00 C ATOM 1148 CG PRO B 547 18.261 24.413 5.728 1.00 0.00 C ATOM 1149 CD PRO B 547 19.023 23.095 5.650 1.00 0.00 C ATOM 0 HA PRO B 547 16.150 21.994 6.601 1.00 0.00 H new ATOM 0 HB2 PRO B 547 16.154 24.713 6.192 1.00 0.00 H new ATOM 0 HB3 PRO B 547 17.075 24.018 7.511 1.00 0.00 H new ATOM 0 HG2 PRO B 547 18.076 24.831 4.738 1.00 0.00 H new ATOM 0 HG3 PRO B 547 18.812 25.165 6.293 1.00 0.00 H new ATOM 0 HD2 PRO B 547 19.668 23.067 4.771 1.00 0.00 H new ATOM 0 HD3 PRO B 547 19.665 22.962 6.521 1.00 0.00 H new ATOM 1157 N ILE B 548 14.445 22.869 4.912 1.00 0.00 N ATOM 1158 CA ILE B 548 13.357 22.870 3.903 1.00 0.00 C ATOM 1159 C ILE B 548 12.789 24.285 3.632 1.00 0.00 C ATOM 1160 O ILE B 548 12.055 24.521 2.669 1.00 0.00 O ATOM 1161 CB ILE B 548 12.254 21.844 4.293 1.00 0.00 C ATOM 1162 CG1 ILE B 548 12.849 20.529 4.851 1.00 0.00 C ATOM 1163 CG2 ILE B 548 11.314 21.522 3.122 1.00 0.00 C ATOM 1164 CD1 ILE B 548 11.896 19.336 5.024 1.00 0.00 C ATOM 0 H ILE B 548 14.104 23.056 5.855 1.00 0.00 H new ATOM 0 HA ILE B 548 13.787 22.551 2.954 1.00 0.00 H new ATOM 0 HB ILE B 548 11.674 22.326 5.080 1.00 0.00 H new ATOM 0 HG12 ILE B 548 13.659 20.219 4.190 1.00 0.00 H new ATOM 0 HG13 ILE B 548 13.295 20.747 5.822 1.00 0.00 H new ATOM 0 HG21 ILE B 548 10.563 20.802 3.446 1.00 0.00 H new ATOM 0 HG22 ILE B 548 10.821 22.436 2.789 1.00 0.00 H new ATOM 0 HG23 ILE B 548 11.890 21.100 2.299 1.00 0.00 H new ATOM 0 HD11 ILE B 548 12.448 18.484 5.422 1.00 0.00 H new ATOM 0 HD12 ILE B 548 11.097 19.606 5.714 1.00 0.00 H new ATOM 0 HD13 ILE B 548 11.467 19.070 4.058 1.00 0.00 H new ATOM 1176 N ARG B 549 13.181 25.258 4.453 1.00 0.00 N ATOM 1177 CA ARG B 549 12.765 26.674 4.433 1.00 0.00 C ATOM 1178 C ARG B 549 13.833 27.606 5.023 1.00 0.00 C ATOM 1179 O ARG B 549 14.191 27.458 6.215 1.00 0.00 O ATOM 1180 CB ARG B 549 11.398 26.865 5.123 1.00 0.00 C ATOM 1181 CG ARG B 549 11.196 26.090 6.442 1.00 0.00 C ATOM 1182 CD ARG B 549 10.178 26.783 7.355 1.00 0.00 C ATOM 1183 NE ARG B 549 10.744 28.008 7.949 1.00 0.00 N ATOM 1184 CZ ARG B 549 10.091 28.978 8.561 1.00 0.00 C ATOM 1185 NH1 ARG B 549 8.802 28.949 8.748 1.00 0.00 N ATOM 1186 NH2 ARG B 549 10.738 30.021 8.994 1.00 0.00 N ATOM 0 H ARG B 549 13.844 25.073 5.205 1.00 0.00 H new ATOM 0 HA ARG B 549 12.652 26.957 3.387 1.00 0.00 H new ATOM 0 HB2 ARG B 549 11.259 27.927 5.323 1.00 0.00 H new ATOM 0 HB3 ARG B 549 10.615 26.567 4.425 1.00 0.00 H new ATOM 0 HG2 ARG B 549 10.857 25.078 6.221 1.00 0.00 H new ATOM 0 HG3 ARG B 549 12.150 26.001 6.962 1.00 0.00 H new ATOM 0 HD2 ARG B 549 9.283 27.032 6.784 1.00 0.00 H new ATOM 0 HD3 ARG B 549 9.871 26.100 8.147 1.00 0.00 H new ATOM 0 HE ARG B 549 11.756 28.118 7.879 1.00 0.00 H new ATOM 0 HH11 ARG B 549 8.256 28.154 8.416 1.00 0.00 H new ATOM 0 HH12 ARG B 549 8.339 29.721 9.227 1.00 0.00 H new ATOM 0 HH21 ARG B 549 11.747 30.087 8.860 1.00 0.00 H new ATOM 0 HH22 ARG B 549 10.236 30.772 9.467 1.00 0.00 H new TER 1200 ARG B 549