USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 718 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 415 SER OG : rot -125:sc= -0.231 USER MOD Set 1.2: A 436 LYS NZ :NH3+ 159:sc= 0.658 (180deg=0.00925) USER MOD Set 2.1: A 379 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 395 GLN : amide:sc= -0.0803 K(o=-0.08,f=-0.95) USER MOD Set 3.1: A 374 TYR OH : rot -97:sc= -0.486 USER MOD Set 3.2: A 384 GLN :FLIP amide:sc= -0.057 F(o=-1.2,f=-0.54) USER MOD Set 4.1: A 381 ASN : amide:sc= 0.247 K(o=-0.97,f=-3.7) USER MOD Set 4.2: A 391 ASN : amide:sc= -1.22! K(o=-0.97!,f=-3.7) USER MOD Set 5.1: A 365 THR OG1 : rot -90:sc= -0.0305 USER MOD Set 5.2: A 443 MET CE :methyl 170:sc= -0.533 (180deg=-1.15) USER MOD Single : A 357 TYR OH : rot 180:sc= 0 USER MOD Single : A 361 LYS NZ :NH3+ 176:sc= 1.19 (180deg=1.05) USER MOD Single : A 363 MET CE :methyl -172:sc= 0 (180deg=-0.125) USER MOD Single : A 366 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 372 TYR OH : rot 180:sc= 0 USER MOD Single : A 373 THR OG1 : rot 108:sc= 0.024 USER MOD Single : A 375 LYS NZ :NH3+ -119:sc= -0.0199 (180deg=-0.05) USER MOD Single : A 386 SER OG : rot 180:sc= 0 USER MOD Single : A 394 SER OG : rot -11:sc= 0.912 USER MOD Single : A 398 ASN : amide:sc= -3.55! C(o=-3.5!,f=-7.4!) USER MOD Single : A 401 LYS NZ :NH3+ -151:sc= 1.17 (180deg=-0.309) USER MOD Single : A 402 TYR OH : rot 62:sc= 0.861 USER MOD Single : A 404 ASN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD Single : A 406 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.46) USER MOD Single : A 407 SER OG : rot 180:sc= 0 USER MOD Single : A 410 ASN : amide:sc= -0.145 X(o=-0.14,f=-0.14) USER MOD Single : A 413 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 419 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 ASN : amide:sc= -0.0508 K(o=-0.051,f=-0.62) USER MOD Single : A 430 SER OG : rot 180:sc= -0.0198 USER MOD Single : A 435 GLN : amide:sc= -0.39 X(o=-0.39,f=0) USER MOD Single : A 439 TYR OH : rot -122:sc= 1.31 USER MOD Single : A 442 LYS NZ :NH3+ 161:sc= 1.15 (180deg=0.694) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 SER OG : rot 180:sc= -0.114 USER MOD Single : A 450 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 357 -0.235 8.106 -2.218 1.00 72.12 N ATOM 2 CA TYR A 357 1.214 8.212 -2.285 1.00 71.41 C ATOM 3 C TYR A 357 1.775 7.469 -3.464 1.00 71.12 C ATOM 4 O TYR A 357 1.274 6.407 -3.847 1.00 33.44 O ATOM 5 CB TYR A 357 1.893 7.744 -0.989 1.00 32.22 C ATOM 6 CG TYR A 357 1.800 8.719 0.163 1.00 43.34 C ATOM 7 CD1 TYR A 357 0.745 8.693 1.065 1.00 23.23 C ATOM 8 CD2 TYR A 357 2.794 9.669 0.347 1.00 32.51 C ATOM 9 CE1 TYR A 357 0.689 9.594 2.116 1.00 20.22 C ATOM 10 CE2 TYR A 357 2.746 10.567 1.386 1.00 3.31 C ATOM 11 CZ TYR A 357 1.697 10.530 2.268 1.00 14.31 C ATOM 12 OH TYR A 357 1.654 11.432 3.316 1.00 21.54 O ATOM 0 HA TYR A 357 1.434 9.272 -2.413 1.00 71.41 H new ATOM 0 HB2 TYR A 357 1.447 6.798 -0.683 1.00 32.22 H new ATOM 0 HB3 TYR A 357 2.945 7.548 -1.197 1.00 32.22 H new ATOM 0 HD1 TYR A 357 -0.041 7.962 0.946 1.00 23.23 H new ATOM 0 HD2 TYR A 357 3.625 9.704 -0.342 1.00 32.51 H new ATOM 0 HE1 TYR A 357 -0.136 9.566 2.812 1.00 20.22 H new ATOM 0 HE2 TYR A 357 3.531 11.299 1.507 1.00 3.31 H new ATOM 0 HH TYR A 357 2.439 12.018 3.276 1.00 21.54 H new ATOM 24 N ARG A 358 2.791 8.042 -4.065 1.00 71.45 N ATOM 25 CA ARG A 358 3.498 7.413 -5.154 1.00 35.55 C ATOM 26 C ARG A 358 4.709 6.713 -4.575 1.00 10.12 C ATOM 27 O ARG A 358 5.722 7.361 -4.318 1.00 53.44 O ATOM 28 CB ARG A 358 3.967 8.456 -6.176 1.00 71.20 C ATOM 29 CG ARG A 358 2.880 9.322 -6.819 1.00 51.24 C ATOM 30 CD ARG A 358 1.912 8.536 -7.704 1.00 21.43 C ATOM 31 NE ARG A 358 1.034 7.623 -6.971 1.00 55.24 N ATOM 32 CZ ARG A 358 0.250 6.710 -7.554 1.00 20.43 C ATOM 33 NH1 ARG A 358 0.264 6.562 -8.883 1.00 75.52 N ATOM 34 NH2 ARG A 358 -0.549 5.953 -6.817 1.00 24.40 N ATOM 0 H ARG A 358 3.152 8.962 -3.811 1.00 71.45 H new ATOM 0 HA ARG A 358 2.836 6.710 -5.660 1.00 35.55 H new ATOM 0 HB2 ARG A 358 4.683 9.116 -5.686 1.00 71.20 H new ATOM 0 HB3 ARG A 358 4.504 7.937 -6.970 1.00 71.20 H new ATOM 0 HG2 ARG A 358 2.315 9.823 -6.033 1.00 51.24 H new ATOM 0 HG3 ARG A 358 3.354 10.101 -7.416 1.00 51.24 H new ATOM 0 HD2 ARG A 358 1.298 9.240 -8.265 1.00 21.43 H new ATOM 0 HD3 ARG A 358 2.487 7.963 -8.432 1.00 21.43 H new ATOM 0 HE ARG A 358 1.019 7.687 -5.953 1.00 55.24 H new ATOM 0 HH11 ARG A 358 0.874 7.146 -9.455 1.00 75.52 H new ATOM 0 HH12 ARG A 358 -0.335 5.865 -9.325 1.00 75.52 H new ATOM 0 HH21 ARG A 358 -0.567 6.066 -5.803 1.00 24.40 H new ATOM 0 HH22 ARG A 358 -1.147 5.257 -7.263 1.00 24.40 H new ATOM 48 N ALA A 359 4.569 5.406 -4.305 1.00 14.42 N ATOM 49 CA ALA A 359 5.635 4.593 -3.703 1.00 22.42 C ATOM 50 C ALA A 359 6.080 5.196 -2.353 1.00 13.12 C ATOM 51 O ALA A 359 5.352 6.017 -1.742 1.00 21.10 O ATOM 52 CB ALA A 359 6.815 4.470 -4.673 1.00 13.41 C ATOM 0 H ALA A 359 3.714 4.884 -4.498 1.00 14.42 H new ATOM 0 HA ALA A 359 5.249 3.592 -3.508 1.00 22.42 H new ATOM 0 HB1 ALA A 359 7.599 3.866 -4.217 1.00 13.41 H new ATOM 0 HB2 ALA A 359 6.480 3.994 -5.595 1.00 13.41 H new ATOM 0 HB3 ALA A 359 7.206 5.462 -4.898 1.00 13.41 H new ATOM 58 N ILE A 360 7.204 4.757 -1.847 1.00 32.44 N ATOM 59 CA ILE A 360 7.753 5.356 -0.652 1.00 53.51 C ATOM 60 C ILE A 360 8.684 6.473 -1.078 1.00 70.03 C ATOM 61 O ILE A 360 9.704 6.229 -1.742 1.00 71.00 O ATOM 62 CB ILE A 360 8.501 4.330 0.289 1.00 52.21 C ATOM 63 CG1 ILE A 360 7.527 3.306 0.938 1.00 43.10 C ATOM 64 CG2 ILE A 360 9.289 5.054 1.382 1.00 55.01 C ATOM 65 CD1 ILE A 360 6.832 2.353 -0.015 1.00 30.00 C ATOM 0 H ILE A 360 7.755 3.993 -2.238 1.00 32.44 H new ATOM 0 HA ILE A 360 6.926 5.737 -0.053 1.00 53.51 H new ATOM 0 HB ILE A 360 9.194 3.780 -0.347 1.00 52.21 H new ATOM 0 HG12 ILE A 360 8.083 2.717 1.667 1.00 43.10 H new ATOM 0 HG13 ILE A 360 6.765 3.858 1.488 1.00 43.10 H new ATOM 0 HG21 ILE A 360 9.793 4.322 2.013 1.00 55.01 H new ATOM 0 HG22 ILE A 360 10.030 5.708 0.923 1.00 55.01 H new ATOM 0 HG23 ILE A 360 8.607 5.648 1.989 1.00 55.01 H new ATOM 0 HD11 ILE A 360 6.179 1.687 0.549 1.00 30.00 H new ATOM 0 HD12 ILE A 360 6.239 2.922 -0.731 1.00 30.00 H new ATOM 0 HD13 ILE A 360 7.578 1.764 -0.549 1.00 30.00 H new ATOM 77 N LYS A 361 8.342 7.685 -0.717 1.00 43.21 N ATOM 78 CA LYS A 361 9.107 8.820 -1.135 1.00 41.45 C ATOM 79 C LYS A 361 9.687 9.535 0.061 1.00 51.43 C ATOM 80 O LYS A 361 9.160 9.433 1.175 1.00 21.33 O ATOM 81 CB LYS A 361 8.249 9.775 -1.978 1.00 62.54 C ATOM 82 CG LYS A 361 7.134 10.495 -1.242 1.00 4.54 C ATOM 83 CD LYS A 361 6.334 11.350 -2.207 1.00 64.31 C ATOM 84 CE LYS A 361 5.281 12.191 -1.504 1.00 63.31 C ATOM 85 NZ LYS A 361 5.869 13.243 -0.646 1.00 2.41 N ATOM 0 H LYS A 361 7.535 7.905 -0.133 1.00 43.21 H new ATOM 0 HA LYS A 361 9.930 8.469 -1.757 1.00 41.45 H new ATOM 0 HB2 LYS A 361 8.905 10.523 -2.424 1.00 62.54 H new ATOM 0 HB3 LYS A 361 7.809 9.208 -2.798 1.00 62.54 H new ATOM 0 HG2 LYS A 361 6.479 9.769 -0.760 1.00 4.54 H new ATOM 0 HG3 LYS A 361 7.553 11.120 -0.453 1.00 4.54 H new ATOM 0 HD2 LYS A 361 7.012 12.005 -2.754 1.00 64.31 H new ATOM 0 HD3 LYS A 361 5.850 10.707 -2.942 1.00 64.31 H new ATOM 0 HE2 LYS A 361 4.635 12.655 -2.250 1.00 63.31 H new ATOM 0 HE3 LYS A 361 4.651 11.542 -0.896 1.00 63.31 H new ATOM 0 HZ1 LYS A 361 5.109 13.829 -0.245 1.00 2.41 H new ATOM 0 HZ2 LYS A 361 6.409 12.801 0.125 1.00 2.41 H new ATOM 0 HZ3 LYS A 361 6.503 13.840 -1.214 1.00 2.41 H new ATOM 99 N GLY A 362 10.759 10.247 -0.160 1.00 5.32 N ATOM 100 CA GLY A 362 11.392 10.955 0.902 1.00 62.15 C ATOM 101 C GLY A 362 11.147 12.424 0.803 1.00 0.23 C ATOM 102 O GLY A 362 10.005 12.864 0.619 1.00 73.32 O ATOM 0 H GLY A 362 11.208 10.348 -1.070 1.00 5.32 H new ATOM 0 HA2 GLY A 362 11.020 10.587 1.858 1.00 62.15 H new ATOM 0 HA3 GLY A 362 12.465 10.762 0.881 1.00 62.15 H new ATOM 106 N MET A 363 12.202 13.184 0.890 1.00 12.22 N ATOM 107 CA MET A 363 12.099 14.617 0.828 1.00 43.11 C ATOM 108 C MET A 363 12.324 15.115 -0.571 1.00 22.40 C ATOM 109 O MET A 363 13.458 15.350 -1.001 1.00 41.12 O ATOM 110 CB MET A 363 13.006 15.319 1.850 1.00 55.04 C ATOM 111 CG MET A 363 12.625 15.007 3.289 1.00 74.03 C ATOM 112 SD MET A 363 13.651 15.839 4.510 1.00 71.02 S ATOM 113 CE MET A 363 12.875 15.254 6.013 1.00 41.25 C ATOM 0 H MET A 363 13.152 12.832 1.005 1.00 12.22 H new ATOM 0 HA MET A 363 11.079 14.878 1.108 1.00 43.11 H new ATOM 0 HB2 MET A 363 14.039 15.017 1.679 1.00 55.04 H new ATOM 0 HB3 MET A 363 12.958 16.396 1.692 1.00 55.04 H new ATOM 0 HG2 MET A 363 11.585 15.290 3.449 1.00 74.03 H new ATOM 0 HG3 MET A 363 12.690 13.930 3.447 1.00 74.03 H new ATOM 0 HE1 MET A 363 13.294 15.783 6.869 1.00 41.25 H new ATOM 0 HE2 MET A 363 11.802 15.437 5.964 1.00 41.25 H new ATOM 0 HE3 MET A 363 13.056 14.185 6.123 1.00 41.25 H new ATOM 123 N GLU A 364 11.230 15.206 -1.285 1.00 53.15 N ATOM 124 CA GLU A 364 11.195 15.669 -2.651 1.00 30.33 C ATOM 125 C GLU A 364 11.726 17.101 -2.776 1.00 73.42 C ATOM 126 O GLU A 364 11.126 18.057 -2.267 1.00 71.13 O ATOM 127 CB GLU A 364 9.763 15.527 -3.203 1.00 32.51 C ATOM 128 CG GLU A 364 8.689 16.168 -2.322 1.00 21.20 C ATOM 129 CD GLU A 364 7.298 16.001 -2.870 1.00 14.34 C ATOM 130 OE1 GLU A 364 6.654 14.966 -2.584 1.00 34.23 O ATOM 131 OE2 GLU A 364 6.816 16.903 -3.589 1.00 21.53 O ATOM 0 H GLU A 364 10.311 14.952 -0.921 1.00 53.15 H new ATOM 0 HA GLU A 364 11.859 15.049 -3.254 1.00 30.33 H new ATOM 0 HB2 GLU A 364 9.721 15.977 -4.195 1.00 32.51 H new ATOM 0 HB3 GLU A 364 9.535 14.468 -3.324 1.00 32.51 H new ATOM 0 HG2 GLU A 364 8.735 15.729 -1.325 1.00 21.20 H new ATOM 0 HG3 GLU A 364 8.905 17.231 -2.212 1.00 21.20 H new ATOM 138 N THR A 365 12.869 17.229 -3.392 1.00 50.21 N ATOM 139 CA THR A 365 13.484 18.514 -3.601 1.00 34.13 C ATOM 140 C THR A 365 13.694 18.728 -5.106 1.00 3.43 C ATOM 141 O THR A 365 13.963 17.762 -5.833 1.00 33.41 O ATOM 142 CB THR A 365 14.842 18.570 -2.867 1.00 44.24 C ATOM 143 OG1 THR A 365 14.657 18.109 -1.513 1.00 63.31 O ATOM 144 CG2 THR A 365 15.365 20.004 -2.817 1.00 50.15 C ATOM 0 H THR A 365 13.403 16.444 -3.765 1.00 50.21 H new ATOM 0 HA THR A 365 12.839 19.299 -3.206 1.00 34.13 H new ATOM 0 HB THR A 365 15.557 17.943 -3.400 1.00 44.24 H new ATOM 0 HG1 THR A 365 14.435 18.869 -0.936 1.00 63.31 H new ATOM 0 HG21 THR A 365 16.322 20.024 -2.296 1.00 50.15 H new ATOM 0 HG22 THR A 365 15.496 20.379 -3.832 1.00 50.15 H new ATOM 0 HG23 THR A 365 14.650 20.634 -2.287 1.00 50.15 H new ATOM 152 N LYS A 366 13.554 19.960 -5.572 1.00 61.21 N ATOM 153 CA LYS A 366 13.747 20.266 -6.967 1.00 33.44 C ATOM 154 C LYS A 366 14.740 21.355 -7.115 1.00 74.33 C ATOM 155 O LYS A 366 14.855 22.223 -6.246 1.00 4.43 O ATOM 156 CB LYS A 366 12.455 20.677 -7.660 1.00 72.43 C ATOM 157 CG LYS A 366 11.413 19.598 -7.709 1.00 12.10 C ATOM 158 CD LYS A 366 10.199 20.025 -8.524 1.00 41.32 C ATOM 159 CE LYS A 366 9.496 21.242 -7.940 1.00 42.42 C ATOM 160 NZ LYS A 366 8.326 21.631 -8.755 1.00 55.23 N ATOM 0 H LYS A 366 13.306 20.763 -4.994 1.00 61.21 H new ATOM 0 HA LYS A 366 14.106 19.353 -7.442 1.00 33.44 H new ATOM 0 HB2 LYS A 366 12.040 21.544 -7.146 1.00 72.43 H new ATOM 0 HB3 LYS A 366 12.686 20.990 -8.678 1.00 72.43 H new ATOM 0 HG2 LYS A 366 11.844 18.695 -8.143 1.00 12.10 H new ATOM 0 HG3 LYS A 366 11.101 19.347 -6.695 1.00 12.10 H new ATOM 0 HD2 LYS A 366 10.512 20.246 -9.544 1.00 41.32 H new ATOM 0 HD3 LYS A 366 9.494 19.195 -8.579 1.00 41.32 H new ATOM 0 HE2 LYS A 366 9.176 21.025 -6.921 1.00 42.42 H new ATOM 0 HE3 LYS A 366 10.196 22.076 -7.883 1.00 42.42 H new ATOM 0 HZ1 LYS A 366 7.869 22.463 -8.331 1.00 55.23 H new ATOM 0 HZ2 LYS A 366 8.637 21.861 -9.721 1.00 55.23 H new ATOM 0 HZ3 LYS A 366 7.648 20.843 -8.788 1.00 55.23 H new ATOM 174 N ARG A 367 15.468 21.313 -8.184 1.00 23.13 N ATOM 175 CA ARG A 367 16.427 22.321 -8.458 1.00 1.45 C ATOM 176 C ARG A 367 16.667 22.293 -9.953 1.00 23.43 C ATOM 177 O ARG A 367 16.756 21.224 -10.530 1.00 10.03 O ATOM 178 CB ARG A 367 17.712 21.981 -7.733 1.00 52.13 C ATOM 179 CG ARG A 367 18.593 23.153 -7.386 1.00 11.14 C ATOM 180 CD ARG A 367 17.952 23.975 -6.277 1.00 31.11 C ATOM 181 NE ARG A 367 18.843 25.035 -5.806 1.00 13.52 N ATOM 182 CZ ARG A 367 18.626 25.816 -4.737 1.00 42.11 C ATOM 183 NH1 ARG A 367 17.466 25.770 -4.085 1.00 24.44 N ATOM 184 NH2 ARG A 367 19.566 26.649 -4.336 1.00 0.35 N ATOM 0 H ARG A 367 15.411 20.577 -8.888 1.00 23.13 H new ATOM 0 HA ARG A 367 16.086 23.304 -8.133 1.00 1.45 H new ATOM 0 HB2 ARG A 367 17.460 21.453 -6.813 1.00 52.13 H new ATOM 0 HB3 ARG A 367 18.285 21.289 -8.351 1.00 52.13 H new ATOM 0 HG2 ARG A 367 19.574 22.800 -7.068 1.00 11.14 H new ATOM 0 HG3 ARG A 367 18.749 23.775 -8.267 1.00 11.14 H new ATOM 0 HD2 ARG A 367 17.023 24.415 -6.640 1.00 31.11 H new ATOM 0 HD3 ARG A 367 17.691 23.322 -5.444 1.00 31.11 H new ATOM 0 HE ARG A 367 19.701 25.194 -6.334 1.00 13.52 H new ATOM 0 HH11 ARG A 367 16.730 25.136 -4.397 1.00 24.44 H new ATOM 0 HH12 ARG A 367 17.313 26.369 -3.274 1.00 24.44 H new ATOM 0 HH21 ARG A 367 20.453 26.697 -4.838 1.00 0.35 H new ATOM 0 HH22 ARG A 367 19.407 27.245 -3.524 1.00 0.35 H new ATOM 198 N GLU A 368 16.763 23.416 -10.575 1.00 0.24 N ATOM 199 CA GLU A 368 16.942 23.443 -12.004 1.00 35.22 C ATOM 200 C GLU A 368 18.413 23.597 -12.355 1.00 30.44 C ATOM 201 O GLU A 368 19.027 24.628 -12.073 1.00 13.32 O ATOM 202 CB GLU A 368 16.102 24.557 -12.618 1.00 43.41 C ATOM 203 CG GLU A 368 16.170 24.649 -14.132 1.00 35.42 C ATOM 204 CD GLU A 368 15.310 25.760 -14.669 1.00 50.34 C ATOM 205 OE1 GLU A 368 15.802 26.897 -14.803 1.00 41.12 O ATOM 206 OE2 GLU A 368 14.122 25.523 -14.949 1.00 54.33 O ATOM 0 H GLU A 368 16.722 24.332 -10.128 1.00 0.24 H new ATOM 0 HA GLU A 368 16.601 22.495 -12.421 1.00 35.22 H new ATOM 0 HB2 GLU A 368 15.062 24.413 -12.324 1.00 43.41 H new ATOM 0 HB3 GLU A 368 16.423 25.509 -12.196 1.00 43.41 H new ATOM 0 HG2 GLU A 368 17.203 24.810 -14.439 1.00 35.42 H new ATOM 0 HG3 GLU A 368 15.852 23.702 -14.567 1.00 35.42 H new ATOM 213 N ILE A 369 18.979 22.553 -12.923 1.00 13.23 N ATOM 214 CA ILE A 369 20.357 22.571 -13.370 1.00 51.21 C ATOM 215 C ILE A 369 20.389 22.420 -14.886 1.00 1.00 C ATOM 216 O ILE A 369 19.761 21.516 -15.437 1.00 52.24 O ATOM 217 CB ILE A 369 21.270 21.452 -12.703 1.00 52.11 C ATOM 218 CG1 ILE A 369 21.430 21.624 -11.168 1.00 32.13 C ATOM 219 CG2 ILE A 369 22.647 21.392 -13.359 1.00 61.13 C ATOM 220 CD1 ILE A 369 20.197 21.335 -10.347 1.00 62.44 C ATOM 0 H ILE A 369 18.498 21.669 -13.088 1.00 13.23 H new ATOM 0 HA ILE A 369 20.775 23.528 -13.057 1.00 51.21 H new ATOM 0 HB ILE A 369 20.746 20.511 -12.872 1.00 52.11 H new ATOM 0 HG12 ILE A 369 22.232 20.969 -10.829 1.00 32.13 H new ATOM 0 HG13 ILE A 369 21.747 22.647 -10.966 1.00 32.13 H new ATOM 0 HG21 ILE A 369 23.245 20.617 -12.879 1.00 61.13 H new ATOM 0 HG22 ILE A 369 22.536 21.161 -14.418 1.00 61.13 H new ATOM 0 HG23 ILE A 369 23.145 22.355 -13.248 1.00 61.13 H new ATOM 0 HD11 ILE A 369 20.420 21.486 -9.291 1.00 62.44 H new ATOM 0 HD12 ILE A 369 19.394 22.007 -10.648 1.00 62.44 H new ATOM 0 HD13 ILE A 369 19.886 20.303 -10.508 1.00 62.44 H new ATOM 232 N GLY A 370 21.091 23.323 -15.549 1.00 33.31 N ATOM 233 CA GLY A 370 21.243 23.284 -16.994 1.00 63.11 C ATOM 234 C GLY A 370 19.938 23.437 -17.746 1.00 52.01 C ATOM 235 O GLY A 370 19.809 22.982 -18.881 1.00 50.34 O ATOM 0 H GLY A 370 21.572 24.104 -15.101 1.00 33.31 H new ATOM 0 HA2 GLY A 370 21.924 24.078 -17.301 1.00 63.11 H new ATOM 0 HA3 GLY A 370 21.707 22.339 -17.277 1.00 63.11 H new ATOM 239 N GLY A 371 18.973 24.067 -17.116 1.00 0.53 N ATOM 240 CA GLY A 371 17.701 24.292 -17.757 1.00 72.53 C ATOM 241 C GLY A 371 16.703 23.185 -17.507 1.00 32.22 C ATOM 242 O GLY A 371 15.539 23.286 -17.915 1.00 12.42 O ATOM 0 H GLY A 371 19.045 24.430 -16.166 1.00 0.53 H new ATOM 0 HA2 GLY A 371 17.284 25.235 -17.402 1.00 72.53 H new ATOM 0 HA3 GLY A 371 17.856 24.396 -18.831 1.00 72.53 H new ATOM 246 N TYR A 372 17.140 22.132 -16.863 1.00 0.24 N ATOM 247 CA TYR A 372 16.269 21.034 -16.528 1.00 60.20 C ATOM 248 C TYR A 372 16.127 20.833 -15.035 1.00 54.44 C ATOM 249 O TYR A 372 17.068 21.019 -14.262 1.00 34.42 O ATOM 250 CB TYR A 372 16.554 19.739 -17.330 1.00 3.03 C ATOM 251 CG TYR A 372 18.004 19.462 -17.606 1.00 45.43 C ATOM 252 CD1 TYR A 372 18.770 18.751 -16.730 1.00 42.34 C ATOM 253 CD2 TYR A 372 18.594 19.928 -18.769 1.00 12.23 C ATOM 254 CE1 TYR A 372 20.105 18.503 -16.991 1.00 14.03 C ATOM 255 CE2 TYR A 372 19.924 19.690 -19.043 1.00 52.23 C ATOM 256 CZ TYR A 372 20.676 18.976 -18.146 1.00 31.23 C ATOM 257 OH TYR A 372 22.009 18.728 -18.404 1.00 20.11 O ATOM 0 H TYR A 372 18.106 22.012 -16.557 1.00 0.24 H new ATOM 0 HA TYR A 372 15.276 21.329 -16.866 1.00 60.20 H new ATOM 0 HB2 TYR A 372 16.137 18.893 -16.783 1.00 3.03 H new ATOM 0 HB3 TYR A 372 16.024 19.796 -18.281 1.00 3.03 H new ATOM 0 HD1 TYR A 372 18.327 18.376 -15.819 1.00 42.34 H new ATOM 0 HD2 TYR A 372 18.000 20.489 -19.475 1.00 12.23 H new ATOM 0 HE1 TYR A 372 20.698 17.938 -16.287 1.00 14.03 H new ATOM 0 HE2 TYR A 372 20.369 20.062 -19.954 1.00 52.23 H new ATOM 0 HH TYR A 372 22.256 19.130 -19.263 1.00 20.11 H new ATOM 267 N THR A 373 14.956 20.464 -14.654 1.00 55.31 N ATOM 268 CA THR A 373 14.559 20.402 -13.288 1.00 15.24 C ATOM 269 C THR A 373 14.898 19.061 -12.682 1.00 22.00 C ATOM 270 O THR A 373 14.304 18.042 -13.029 1.00 33.22 O ATOM 271 CB THR A 373 13.040 20.634 -13.179 1.00 43.34 C ATOM 272 OG1 THR A 373 12.687 21.804 -13.941 1.00 4.42 O ATOM 273 CG2 THR A 373 12.626 20.848 -11.726 1.00 74.25 C ATOM 0 H THR A 373 14.221 20.187 -15.305 1.00 55.31 H new ATOM 0 HA THR A 373 15.098 21.177 -12.744 1.00 15.24 H new ATOM 0 HB THR A 373 12.525 19.754 -13.565 1.00 43.34 H new ATOM 0 HG1 THR A 373 12.206 21.534 -14.751 1.00 4.42 H new ATOM 0 HG21 THR A 373 11.549 21.010 -11.675 1.00 74.25 H new ATOM 0 HG22 THR A 373 12.889 19.968 -11.139 1.00 74.25 H new ATOM 0 HG23 THR A 373 13.143 21.719 -11.325 1.00 74.25 H new ATOM 281 N TYR A 374 15.828 19.065 -11.791 1.00 53.04 N ATOM 282 CA TYR A 374 16.199 17.888 -11.092 1.00 54.14 C ATOM 283 C TYR A 374 15.323 17.705 -9.903 1.00 32.34 C ATOM 284 O TYR A 374 15.140 18.619 -9.104 1.00 3.02 O ATOM 285 CB TYR A 374 17.665 17.920 -10.672 1.00 4.11 C ATOM 286 CG TYR A 374 18.628 17.595 -11.772 1.00 61.02 C ATOM 287 CD1 TYR A 374 19.074 18.556 -12.655 1.00 43.54 C ATOM 288 CD2 TYR A 374 19.102 16.300 -11.915 1.00 50.51 C ATOM 289 CE1 TYR A 374 19.962 18.233 -13.654 1.00 24.44 C ATOM 290 CE2 TYR A 374 19.987 15.972 -12.906 1.00 63.51 C ATOM 291 CZ TYR A 374 20.417 16.938 -13.773 1.00 52.52 C ATOM 292 OH TYR A 374 21.303 16.610 -14.769 1.00 42.54 O ATOM 0 H TYR A 374 16.357 19.896 -11.526 1.00 53.04 H new ATOM 0 HA TYR A 374 16.070 17.042 -11.768 1.00 54.14 H new ATOM 0 HB2 TYR A 374 17.898 18.911 -10.282 1.00 4.11 H new ATOM 0 HB3 TYR A 374 17.812 17.213 -9.855 1.00 4.11 H new ATOM 0 HD1 TYR A 374 18.722 19.573 -12.561 1.00 43.54 H new ATOM 0 HD2 TYR A 374 18.766 15.535 -11.231 1.00 50.51 H new ATOM 0 HE1 TYR A 374 20.302 18.992 -14.343 1.00 24.44 H new ATOM 0 HE2 TYR A 374 20.343 14.957 -13.003 1.00 63.51 H new ATOM 0 HH TYR A 374 20.815 16.225 -15.527 1.00 42.54 H new ATOM 302 N LYS A 375 14.764 16.551 -9.811 1.00 70.34 N ATOM 303 CA LYS A 375 13.916 16.197 -8.726 1.00 33.42 C ATOM 304 C LYS A 375 14.548 15.060 -8.001 1.00 73.13 C ATOM 305 O LYS A 375 14.828 14.030 -8.595 1.00 52.53 O ATOM 306 CB LYS A 375 12.572 15.710 -9.257 1.00 41.14 C ATOM 307 CG LYS A 375 11.588 15.277 -8.167 1.00 14.01 C ATOM 308 CD LYS A 375 10.412 14.507 -8.755 1.00 64.34 C ATOM 309 CE LYS A 375 9.653 15.318 -9.777 1.00 44.30 C ATOM 310 NZ LYS A 375 8.968 16.477 -9.172 1.00 1.54 N ATOM 0 H LYS A 375 14.885 15.810 -10.502 1.00 70.34 H new ATOM 0 HA LYS A 375 13.771 17.062 -8.078 1.00 33.42 H new ATOM 0 HB2 LYS A 375 12.117 16.506 -9.847 1.00 41.14 H new ATOM 0 HB3 LYS A 375 12.743 14.871 -9.931 1.00 41.14 H new ATOM 0 HG2 LYS A 375 12.103 14.655 -7.436 1.00 14.01 H new ATOM 0 HG3 LYS A 375 11.221 16.155 -7.636 1.00 14.01 H new ATOM 0 HD2 LYS A 375 10.776 13.590 -9.219 1.00 64.34 H new ATOM 0 HD3 LYS A 375 9.736 14.212 -7.953 1.00 64.34 H new ATOM 0 HE2 LYS A 375 10.342 15.666 -10.546 1.00 44.30 H new ATOM 0 HE3 LYS A 375 8.919 14.681 -10.271 1.00 44.30 H new ATOM 0 HZ1 LYS A 375 7.942 16.391 -9.322 1.00 1.54 H new ATOM 0 HZ2 LYS A 375 9.168 16.505 -8.152 1.00 1.54 H new ATOM 0 HZ3 LYS A 375 9.311 17.353 -9.615 1.00 1.54 H new ATOM 324 N VAL A 376 14.748 15.228 -6.752 1.00 13.11 N ATOM 325 CA VAL A 376 15.287 14.185 -5.935 1.00 21.12 C ATOM 326 C VAL A 376 14.228 13.771 -4.963 1.00 74.22 C ATOM 327 O VAL A 376 13.856 14.540 -4.075 1.00 40.42 O ATOM 328 CB VAL A 376 16.576 14.616 -5.174 1.00 61.43 C ATOM 329 CG1 VAL A 376 17.099 13.475 -4.305 1.00 31.10 C ATOM 330 CG2 VAL A 376 17.656 15.055 -6.153 1.00 1.05 C ATOM 0 H VAL A 376 14.545 16.094 -6.253 1.00 13.11 H new ATOM 0 HA VAL A 376 15.579 13.356 -6.580 1.00 21.12 H new ATOM 0 HB VAL A 376 16.319 15.458 -4.531 1.00 61.43 H new ATOM 0 HG11 VAL A 376 17.999 13.799 -3.783 1.00 31.10 H new ATOM 0 HG12 VAL A 376 16.338 13.194 -3.577 1.00 31.10 H new ATOM 0 HG13 VAL A 376 17.333 12.616 -4.934 1.00 31.10 H new ATOM 0 HG21 VAL A 376 18.548 15.352 -5.602 1.00 1.05 H new ATOM 0 HG22 VAL A 376 17.900 14.228 -6.820 1.00 1.05 H new ATOM 0 HG23 VAL A 376 17.294 15.899 -6.739 1.00 1.05 H new ATOM 340 N VAL A 377 13.694 12.584 -5.158 1.00 63.50 N ATOM 341 CA VAL A 377 12.661 12.086 -4.284 1.00 52.45 C ATOM 342 C VAL A 377 13.305 11.348 -3.096 1.00 2.40 C ATOM 343 O VAL A 377 12.627 10.906 -2.156 1.00 12.42 O ATOM 344 CB VAL A 377 11.696 11.153 -5.035 1.00 4.32 C ATOM 345 CG1 VAL A 377 10.509 10.840 -4.163 1.00 62.45 C ATOM 346 CG2 VAL A 377 11.239 11.773 -6.348 1.00 71.10 C ATOM 0 H VAL A 377 13.959 11.950 -5.912 1.00 63.50 H new ATOM 0 HA VAL A 377 12.081 12.932 -3.915 1.00 52.45 H new ATOM 0 HB VAL A 377 12.225 10.229 -5.270 1.00 4.32 H new ATOM 0 HG11 VAL A 377 9.828 10.179 -4.699 1.00 62.45 H new ATOM 0 HG12 VAL A 377 10.847 10.350 -3.250 1.00 62.45 H new ATOM 0 HG13 VAL A 377 9.991 11.765 -3.908 1.00 62.45 H new ATOM 0 HG21 VAL A 377 10.558 11.090 -6.855 1.00 71.10 H new ATOM 0 HG22 VAL A 377 10.726 12.714 -6.147 1.00 71.10 H new ATOM 0 HG23 VAL A 377 12.105 11.960 -6.983 1.00 71.10 H new ATOM 356 N PHE A 378 14.620 11.206 -3.180 1.00 34.42 N ATOM 357 CA PHE A 378 15.486 10.622 -2.143 1.00 72.33 C ATOM 358 C PHE A 378 15.327 9.085 -2.061 1.00 51.23 C ATOM 359 O PHE A 378 16.304 8.353 -2.119 1.00 73.25 O ATOM 360 CB PHE A 378 15.245 11.303 -0.773 1.00 35.44 C ATOM 361 CG PHE A 378 16.478 11.478 0.068 1.00 14.11 C ATOM 362 CD1 PHE A 378 17.392 12.470 -0.246 1.00 10.23 C ATOM 363 CD2 PHE A 378 16.714 10.687 1.170 1.00 41.53 C ATOM 364 CE1 PHE A 378 18.511 12.670 0.524 1.00 61.22 C ATOM 365 CE2 PHE A 378 17.837 10.875 1.951 1.00 31.15 C ATOM 366 CZ PHE A 378 18.738 11.871 1.629 1.00 21.33 C ATOM 0 H PHE A 378 15.143 11.504 -4.003 1.00 34.42 H new ATOM 0 HA PHE A 378 16.521 10.814 -2.428 1.00 72.33 H new ATOM 0 HB2 PHE A 378 14.796 12.282 -0.943 1.00 35.44 H new ATOM 0 HB3 PHE A 378 14.520 10.713 -0.212 1.00 35.44 H new ATOM 0 HD1 PHE A 378 17.222 13.096 -1.110 1.00 10.23 H new ATOM 0 HD2 PHE A 378 16.011 9.909 1.427 1.00 41.53 H new ATOM 0 HE1 PHE A 378 19.212 13.450 0.267 1.00 61.22 H new ATOM 0 HE2 PHE A 378 18.010 10.245 2.811 1.00 31.15 H new ATOM 0 HZ PHE A 378 19.616 12.025 2.238 1.00 21.33 H new ATOM 376 N TYR A 379 14.105 8.611 -1.960 1.00 3.31 N ATOM 377 CA TYR A 379 13.855 7.175 -1.863 1.00 22.24 C ATOM 378 C TYR A 379 13.277 6.582 -3.111 1.00 24.40 C ATOM 379 O TYR A 379 13.346 5.380 -3.309 1.00 55.34 O ATOM 380 CB TYR A 379 13.028 6.826 -0.641 1.00 0.04 C ATOM 381 CG TYR A 379 13.814 7.029 0.620 1.00 33.21 C ATOM 382 CD1 TYR A 379 13.887 8.262 1.215 1.00 24.04 C ATOM 383 CD2 TYR A 379 14.526 5.987 1.184 1.00 52.34 C ATOM 384 CE1 TYR A 379 14.635 8.463 2.341 1.00 20.34 C ATOM 385 CE2 TYR A 379 15.287 6.178 2.311 1.00 44.43 C ATOM 386 CZ TYR A 379 15.339 7.420 2.887 1.00 45.21 C ATOM 387 OH TYR A 379 16.111 7.625 4.010 1.00 45.13 O ATOM 0 H TYR A 379 13.266 9.190 -1.942 1.00 3.31 H new ATOM 0 HA TYR A 379 14.836 6.715 -1.742 1.00 22.24 H new ATOM 0 HB2 TYR A 379 12.131 7.444 -0.617 1.00 0.04 H new ATOM 0 HB3 TYR A 379 12.699 5.789 -0.705 1.00 0.04 H new ATOM 0 HD1 TYR A 379 13.343 9.090 0.786 1.00 24.04 H new ATOM 0 HD2 TYR A 379 14.483 5.007 0.731 1.00 52.34 H new ATOM 0 HE1 TYR A 379 14.672 9.440 2.800 1.00 20.34 H new ATOM 0 HE2 TYR A 379 15.840 5.356 2.740 1.00 44.43 H new ATOM 0 HH TYR A 379 16.543 6.784 4.268 1.00 45.13 H new ATOM 397 N GLU A 380 12.699 7.394 -3.945 1.00 43.23 N ATOM 398 CA GLU A 380 12.209 6.889 -5.201 1.00 54.35 C ATOM 399 C GLU A 380 13.289 6.892 -6.254 1.00 54.23 C ATOM 400 O GLU A 380 13.851 5.847 -6.600 1.00 61.14 O ATOM 401 CB GLU A 380 11.002 7.652 -5.726 1.00 71.01 C ATOM 402 CG GLU A 380 9.687 7.390 -5.058 1.00 42.35 C ATOM 403 CD GLU A 380 8.559 7.969 -5.885 1.00 63.04 C ATOM 404 OE1 GLU A 380 8.052 7.250 -6.786 1.00 22.55 O ATOM 405 OE2 GLU A 380 8.203 9.140 -5.706 1.00 22.55 O ATOM 0 H GLU A 380 12.555 8.391 -3.787 1.00 43.23 H new ATOM 0 HA GLU A 380 11.894 5.866 -4.996 1.00 54.35 H new ATOM 0 HB2 GLU A 380 11.215 8.718 -5.647 1.00 71.01 H new ATOM 0 HB3 GLU A 380 10.894 7.426 -6.787 1.00 71.01 H new ATOM 0 HG2 GLU A 380 9.542 6.317 -4.931 1.00 42.35 H new ATOM 0 HG3 GLU A 380 9.682 7.832 -4.062 1.00 42.35 H new ATOM 412 N ASN A 381 13.584 8.075 -6.751 1.00 20.32 N ATOM 413 CA ASN A 381 14.505 8.262 -7.845 1.00 42.41 C ATOM 414 C ASN A 381 14.729 9.733 -8.127 1.00 63.51 C ATOM 415 O ASN A 381 14.224 10.598 -7.387 1.00 62.24 O ATOM 416 CB ASN A 381 14.017 7.523 -9.101 1.00 51.33 C ATOM 417 CG ASN A 381 12.550 7.720 -9.408 1.00 4.41 C ATOM 418 OD1 ASN A 381 11.951 8.741 -9.093 1.00 51.31 O ATOM 419 ND2 ASN A 381 11.960 6.712 -10.000 1.00 41.33 N ATOM 0 H ASN A 381 13.183 8.944 -6.399 1.00 20.32 H new ATOM 0 HA ASN A 381 15.464 7.834 -7.554 1.00 42.41 H new ATOM 0 HB2 ASN A 381 14.603 7.858 -9.956 1.00 51.33 H new ATOM 0 HB3 ASN A 381 14.211 6.457 -8.980 1.00 51.33 H new ATOM 0 HD21 ASN A 381 10.964 6.759 -10.216 1.00 41.33 H new ATOM 0 HD22 ASN A 381 12.496 5.880 -10.245 1.00 41.33 H new ATOM 426 N VAL A 382 15.519 10.018 -9.157 1.00 62.30 N ATOM 427 CA VAL A 382 15.819 11.377 -9.558 1.00 14.24 C ATOM 428 C VAL A 382 15.444 11.584 -11.019 1.00 41.05 C ATOM 429 O VAL A 382 15.738 10.734 -11.867 1.00 50.02 O ATOM 430 CB VAL A 382 17.331 11.714 -9.362 1.00 71.44 C ATOM 431 CG1 VAL A 382 17.647 13.140 -9.804 1.00 44.33 C ATOM 432 CG2 VAL A 382 17.738 11.518 -7.915 1.00 1.02 C ATOM 0 H VAL A 382 15.968 9.307 -9.735 1.00 62.30 H new ATOM 0 HA VAL A 382 15.234 12.044 -8.925 1.00 14.24 H new ATOM 0 HB VAL A 382 17.903 11.030 -9.988 1.00 71.44 H new ATOM 0 HG11 VAL A 382 18.708 13.341 -9.654 1.00 44.33 H new ATOM 0 HG12 VAL A 382 17.402 13.257 -10.860 1.00 44.33 H new ATOM 0 HG13 VAL A 382 17.058 13.843 -9.215 1.00 44.33 H new ATOM 0 HG21 VAL A 382 18.795 11.758 -7.799 1.00 1.02 H new ATOM 0 HG22 VAL A 382 17.145 12.174 -7.278 1.00 1.02 H new ATOM 0 HG23 VAL A 382 17.567 10.481 -7.626 1.00 1.02 H new ATOM 442 N PHE A 383 14.807 12.693 -11.304 1.00 51.34 N ATOM 443 CA PHE A 383 14.414 13.032 -12.661 1.00 45.14 C ATOM 444 C PHE A 383 14.953 14.384 -13.040 1.00 34.54 C ATOM 445 O PHE A 383 15.254 15.203 -12.181 1.00 25.22 O ATOM 446 CB PHE A 383 12.892 13.117 -12.821 1.00 23.32 C ATOM 447 CG PHE A 383 12.120 11.865 -12.575 1.00 13.34 C ATOM 448 CD1 PHE A 383 11.920 10.950 -13.591 1.00 61.22 C ATOM 449 CD2 PHE A 383 11.564 11.619 -11.341 1.00 23.12 C ATOM 450 CE1 PHE A 383 11.182 9.807 -13.375 1.00 12.20 C ATOM 451 CE2 PHE A 383 10.831 10.483 -11.119 1.00 11.23 C ATOM 452 CZ PHE A 383 10.637 9.572 -12.137 1.00 72.41 C ATOM 0 H PHE A 383 14.544 13.389 -10.607 1.00 51.34 H new ATOM 0 HA PHE A 383 14.814 12.241 -13.295 1.00 45.14 H new ATOM 0 HB2 PHE A 383 12.521 13.884 -12.141 1.00 23.32 H new ATOM 0 HB3 PHE A 383 12.675 13.457 -13.834 1.00 23.32 H new ATOM 0 HD1 PHE A 383 12.347 11.133 -14.566 1.00 61.22 H new ATOM 0 HD2 PHE A 383 11.707 12.328 -10.539 1.00 23.12 H new ATOM 0 HE1 PHE A 383 11.033 9.099 -14.176 1.00 12.20 H new ATOM 0 HE2 PHE A 383 10.404 10.300 -10.144 1.00 11.23 H new ATOM 0 HZ PHE A 383 10.058 8.677 -11.961 1.00 72.41 H new ATOM 462 N GLN A 384 15.092 14.583 -14.316 1.00 51.52 N ATOM 463 CA GLN A 384 15.362 15.865 -14.904 1.00 50.10 C ATOM 464 C GLN A 384 14.187 16.202 -15.799 1.00 44.42 C ATOM 465 O GLN A 384 14.115 15.773 -16.962 1.00 2.45 O ATOM 466 CB GLN A 384 16.705 15.907 -15.658 1.00 63.24 C ATOM 467 CG GLN A 384 16.928 14.730 -16.596 1.00 3.31 C ATOM 468 CD GLN A 384 18.245 14.774 -17.366 1.00 74.51 C ATOM 469 OE1 GLN A 384 19.279 15.332 -16.775 1.00 1.03 O flip ATOM 470 NE2 GLN A 384 18.328 14.283 -18.488 1.00 2.42 N flip ATOM 0 H GLN A 384 15.018 13.832 -15.002 1.00 51.52 H new ATOM 0 HA GLN A 384 15.469 16.616 -14.121 1.00 50.10 H new ATOM 0 HB2 GLN A 384 16.758 16.831 -16.233 1.00 63.24 H new ATOM 0 HB3 GLN A 384 17.517 15.937 -14.931 1.00 63.24 H new ATOM 0 HG2 GLN A 384 16.892 13.808 -16.016 1.00 3.31 H new ATOM 0 HG3 GLN A 384 16.106 14.690 -17.310 1.00 3.31 H new ATOM 0 HE21 GLN A 384 17.508 13.857 -18.920 1.00 2.42 H new ATOM 0 HE22 GLN A 384 19.217 14.301 -18.988 1.00 2.42 H new ATOM 479 N ASP A 385 13.230 16.898 -15.210 1.00 70.43 N ATOM 480 CA ASP A 385 11.951 17.224 -15.836 1.00 51.21 C ATOM 481 C ASP A 385 11.115 15.992 -16.137 1.00 1.13 C ATOM 482 O ASP A 385 10.196 15.648 -15.377 1.00 1.43 O ATOM 483 CB ASP A 385 12.081 18.156 -17.058 1.00 21.44 C ATOM 484 CG ASP A 385 12.209 19.606 -16.671 1.00 61.03 C ATOM 485 OD1 ASP A 385 11.179 20.254 -16.384 1.00 65.31 O ATOM 486 OD2 ASP A 385 13.310 20.125 -16.652 1.00 23.50 O ATOM 0 H ASP A 385 13.318 17.263 -14.261 1.00 70.43 H new ATOM 0 HA ASP A 385 11.405 17.797 -15.087 1.00 51.21 H new ATOM 0 HB2 ASP A 385 12.952 17.862 -17.643 1.00 21.44 H new ATOM 0 HB3 ASP A 385 11.209 18.031 -17.700 1.00 21.44 H new ATOM 491 N SER A 386 11.437 15.316 -17.201 1.00 13.35 N ATOM 492 CA SER A 386 10.708 14.142 -17.593 1.00 60.11 C ATOM 493 C SER A 386 11.642 12.935 -17.774 1.00 54.51 C ATOM 494 O SER A 386 11.183 11.789 -17.838 1.00 21.24 O ATOM 495 CB SER A 386 9.934 14.429 -18.877 1.00 31.52 C ATOM 496 OG SER A 386 9.073 15.553 -18.698 1.00 71.43 O ATOM 0 H SER A 386 12.209 15.561 -17.821 1.00 13.35 H new ATOM 0 HA SER A 386 10.005 13.888 -16.800 1.00 60.11 H new ATOM 0 HB2 SER A 386 10.630 14.622 -19.693 1.00 31.52 H new ATOM 0 HB3 SER A 386 9.347 13.555 -19.159 1.00 31.52 H new ATOM 0 HG SER A 386 8.584 15.727 -19.530 1.00 71.43 H new ATOM 502 N ILE A 387 12.939 13.186 -17.830 1.00 63.31 N ATOM 503 CA ILE A 387 13.899 12.121 -18.053 1.00 61.31 C ATOM 504 C ILE A 387 14.427 11.575 -16.727 1.00 61.44 C ATOM 505 O ILE A 387 14.809 12.331 -15.837 1.00 73.21 O ATOM 506 CB ILE A 387 15.060 12.571 -18.987 1.00 21.52 C ATOM 507 CG1 ILE A 387 14.488 12.960 -20.362 1.00 15.21 C ATOM 508 CG2 ILE A 387 16.128 11.483 -19.128 1.00 71.34 C ATOM 509 CD1 ILE A 387 15.528 13.353 -21.385 1.00 51.10 C ATOM 0 H ILE A 387 13.349 14.114 -17.725 1.00 63.31 H new ATOM 0 HA ILE A 387 13.377 11.312 -18.565 1.00 61.31 H new ATOM 0 HB ILE A 387 15.547 13.438 -18.540 1.00 21.52 H new ATOM 0 HG12 ILE A 387 13.912 12.121 -20.752 1.00 15.21 H new ATOM 0 HG13 ILE A 387 13.794 13.790 -20.231 1.00 15.21 H new ATOM 0 HG21 ILE A 387 16.921 11.835 -19.788 1.00 71.34 H new ATOM 0 HG22 ILE A 387 16.546 11.254 -18.148 1.00 71.34 H new ATOM 0 HG23 ILE A 387 15.678 10.584 -19.549 1.00 71.34 H new ATOM 0 HD11 ILE A 387 15.036 13.611 -22.323 1.00 51.10 H new ATOM 0 HD12 ILE A 387 16.090 14.213 -21.021 1.00 51.10 H new ATOM 0 HD13 ILE A 387 16.209 12.518 -21.550 1.00 51.10 H new ATOM 521 N LEU A 388 14.412 10.274 -16.609 1.00 63.22 N ATOM 522 CA LEU A 388 14.825 9.582 -15.410 1.00 14.12 C ATOM 523 C LEU A 388 16.316 9.301 -15.392 1.00 63.02 C ATOM 524 O LEU A 388 16.854 8.615 -16.274 1.00 34.54 O ATOM 525 CB LEU A 388 14.030 8.280 -15.285 1.00 54.25 C ATOM 526 CG LEU A 388 14.363 7.356 -14.114 1.00 73.52 C ATOM 527 CD1 LEU A 388 14.152 8.054 -12.790 1.00 25.41 C ATOM 528 CD2 LEU A 388 13.505 6.117 -14.188 1.00 5.30 C ATOM 0 H LEU A 388 14.107 9.650 -17.356 1.00 63.22 H new ATOM 0 HA LEU A 388 14.619 10.228 -14.556 1.00 14.12 H new ATOM 0 HB2 LEU A 388 12.973 8.537 -15.220 1.00 54.25 H new ATOM 0 HB3 LEU A 388 14.164 7.715 -16.207 1.00 54.25 H new ATOM 0 HG LEU A 388 15.415 7.078 -14.183 1.00 73.52 H new ATOM 0 HD11 LEU A 388 14.397 7.372 -11.976 1.00 25.41 H new ATOM 0 HD12 LEU A 388 14.796 8.931 -12.734 1.00 25.41 H new ATOM 0 HD13 LEU A 388 13.110 8.363 -12.703 1.00 25.41 H new ATOM 0 HD21 LEU A 388 13.743 5.459 -13.352 1.00 5.30 H new ATOM 0 HD22 LEU A 388 12.453 6.399 -14.139 1.00 5.30 H new ATOM 0 HD23 LEU A 388 13.698 5.597 -15.126 1.00 5.30 H new ATOM 540 N LEU A 389 16.962 9.860 -14.393 1.00 3.41 N ATOM 541 CA LEU A 389 18.367 9.623 -14.103 1.00 45.34 C ATOM 542 C LEU A 389 18.586 8.155 -13.770 1.00 1.40 C ATOM 543 O LEU A 389 19.214 7.441 -14.505 1.00 61.53 O ATOM 544 CB LEU A 389 18.809 10.483 -12.898 1.00 31.22 C ATOM 545 CG LEU A 389 19.045 11.997 -13.097 1.00 13.30 C ATOM 546 CD1 LEU A 389 20.316 12.249 -13.868 1.00 72.42 C ATOM 547 CD2 LEU A 389 17.891 12.671 -13.798 1.00 35.52 C ATOM 0 H LEU A 389 16.519 10.508 -13.742 1.00 3.41 H new ATOM 0 HA LEU A 389 18.955 9.892 -14.980 1.00 45.34 H new ATOM 0 HB2 LEU A 389 18.055 10.368 -12.119 1.00 31.22 H new ATOM 0 HB3 LEU A 389 19.734 10.055 -12.512 1.00 31.22 H new ATOM 0 HG LEU A 389 19.133 12.428 -12.100 1.00 13.30 H new ATOM 0 HD11 LEU A 389 20.458 13.322 -13.994 1.00 72.42 H new ATOM 0 HD12 LEU A 389 21.162 11.833 -13.321 1.00 72.42 H new ATOM 0 HD13 LEU A 389 20.248 11.775 -14.847 1.00 72.42 H new ATOM 0 HD21 LEU A 389 18.106 13.733 -13.914 1.00 35.52 H new ATOM 0 HD22 LEU A 389 17.749 12.221 -14.780 1.00 35.52 H new ATOM 0 HD23 LEU A 389 16.984 12.547 -13.207 1.00 35.52 H new ATOM 559 N GLY A 390 18.022 7.723 -12.672 1.00 55.24 N ATOM 560 CA GLY A 390 18.175 6.361 -12.234 1.00 73.13 C ATOM 561 C GLY A 390 17.189 6.071 -11.155 1.00 42.03 C ATOM 562 O GLY A 390 16.440 6.962 -10.778 1.00 33.21 O ATOM 0 H GLY A 390 17.447 8.302 -12.060 1.00 55.24 H new ATOM 0 HA2 GLY A 390 18.024 5.680 -13.071 1.00 73.13 H new ATOM 0 HA3 GLY A 390 19.189 6.197 -11.868 1.00 73.13 H new ATOM 566 N ASN A 391 17.213 4.874 -10.611 1.00 23.44 N ATOM 567 CA ASN A 391 16.233 4.474 -9.604 1.00 54.03 C ATOM 568 C ASN A 391 16.896 4.039 -8.397 1.00 73.25 C ATOM 569 O ASN A 391 18.028 3.567 -8.453 1.00 20.14 O ATOM 570 CB ASN A 391 15.283 3.374 -10.062 1.00 23.24 C ATOM 571 CG ASN A 391 14.382 3.809 -11.150 1.00 50.30 C ATOM 572 OD1 ASN A 391 13.295 4.346 -10.912 1.00 52.50 O ATOM 573 ND2 ASN A 391 14.783 3.586 -12.339 1.00 2.54 N ATOM 0 H ASN A 391 17.898 4.155 -10.844 1.00 23.44 H new ATOM 0 HA ASN A 391 15.631 5.364 -9.421 1.00 54.03 H new ATOM 0 HB2 ASN A 391 15.864 2.516 -10.400 1.00 23.24 H new ATOM 0 HB3 ASN A 391 14.685 3.040 -9.214 1.00 23.24 H new ATOM 0 HD21 ASN A 391 14.200 3.853 -13.132 1.00 2.54 H new ATOM 0 HD22 ASN A 391 15.687 3.140 -12.497 1.00 2.54 H new ATOM 580 N PHE A 392 16.210 4.188 -7.302 1.00 4.14 N ATOM 581 CA PHE A 392 16.771 3.827 -5.999 1.00 73.15 C ATOM 582 C PHE A 392 17.241 2.388 -6.020 1.00 11.45 C ATOM 583 O PHE A 392 16.440 1.460 -6.167 1.00 75.20 O ATOM 584 CB PHE A 392 15.739 4.031 -4.878 1.00 34.42 C ATOM 585 CG PHE A 392 16.230 3.666 -3.494 1.00 74.01 C ATOM 586 CD1 PHE A 392 16.947 4.575 -2.737 1.00 35.35 C ATOM 587 CD2 PHE A 392 15.968 2.411 -2.956 1.00 30.14 C ATOM 588 CE1 PHE A 392 17.395 4.241 -1.472 1.00 61.35 C ATOM 589 CE2 PHE A 392 16.411 2.075 -1.695 1.00 71.33 C ATOM 590 CZ PHE A 392 17.127 2.991 -0.951 1.00 50.33 C ATOM 0 H PHE A 392 15.259 4.556 -7.268 1.00 4.14 H new ATOM 0 HA PHE A 392 17.621 4.479 -5.799 1.00 73.15 H new ATOM 0 HB2 PHE A 392 15.428 5.076 -4.875 1.00 34.42 H new ATOM 0 HB3 PHE A 392 14.854 3.435 -5.104 1.00 34.42 H new ATOM 0 HD1 PHE A 392 17.159 5.555 -3.138 1.00 35.35 H new ATOM 0 HD2 PHE A 392 15.410 1.690 -3.534 1.00 30.14 H new ATOM 0 HE1 PHE A 392 17.955 4.959 -0.891 1.00 61.35 H new ATOM 0 HE2 PHE A 392 16.198 1.097 -1.290 1.00 71.33 H new ATOM 0 HZ PHE A 392 17.477 2.730 0.037 1.00 50.33 H new ATOM 600 N ALA A 393 18.526 2.211 -5.884 1.00 62.11 N ATOM 601 CA ALA A 393 19.100 0.904 -5.900 1.00 62.41 C ATOM 602 C ALA A 393 19.429 0.494 -4.497 1.00 33.25 C ATOM 603 O ALA A 393 19.028 -0.572 -4.034 1.00 64.13 O ATOM 604 CB ALA A 393 20.347 0.895 -6.768 1.00 3.31 C ATOM 0 H ALA A 393 19.198 2.968 -5.760 1.00 62.11 H new ATOM 0 HA ALA A 393 18.388 0.194 -6.320 1.00 62.41 H new ATOM 0 HB1 ALA A 393 20.779 -0.106 -6.775 1.00 3.31 H new ATOM 0 HB2 ALA A 393 20.084 1.183 -7.786 1.00 3.31 H new ATOM 0 HB3 ALA A 393 21.074 1.601 -6.367 1.00 3.31 H new ATOM 610 N SER A 394 20.160 1.349 -3.820 1.00 42.02 N ATOM 611 CA SER A 394 20.556 1.149 -2.442 1.00 32.11 C ATOM 612 C SER A 394 21.014 2.482 -1.875 1.00 30.43 C ATOM 613 O SER A 394 21.386 3.392 -2.643 1.00 4.25 O ATOM 614 CB SER A 394 21.726 0.134 -2.347 1.00 32.24 C ATOM 615 OG SER A 394 21.379 -1.142 -2.896 1.00 42.21 O ATOM 0 H SER A 394 20.504 2.222 -4.219 1.00 42.02 H new ATOM 0 HA SER A 394 19.708 0.757 -1.881 1.00 32.11 H new ATOM 0 HB2 SER A 394 22.593 0.531 -2.874 1.00 32.24 H new ATOM 0 HB3 SER A 394 22.016 0.012 -1.303 1.00 32.24 H new ATOM 0 HG SER A 394 20.414 -1.174 -3.064 1.00 42.21 H new ATOM 621 N GLN A 395 20.958 2.621 -0.577 1.00 13.32 N ATOM 622 CA GLN A 395 21.495 3.781 0.069 1.00 12.04 C ATOM 623 C GLN A 395 22.723 3.377 0.843 1.00 50.02 C ATOM 624 O GLN A 395 22.692 2.427 1.629 1.00 70.12 O ATOM 625 CB GLN A 395 20.467 4.500 0.965 1.00 54.45 C ATOM 626 CG GLN A 395 19.844 3.665 2.075 1.00 0.11 C ATOM 627 CD GLN A 395 18.877 4.474 2.924 1.00 11.03 C ATOM 628 OE1 GLN A 395 18.253 5.414 2.447 1.00 14.43 O ATOM 629 NE2 GLN A 395 18.746 4.117 4.172 1.00 73.22 N ATOM 0 H GLN A 395 20.542 1.937 0.055 1.00 13.32 H new ATOM 0 HA GLN A 395 21.765 4.508 -0.697 1.00 12.04 H new ATOM 0 HB2 GLN A 395 20.952 5.365 1.418 1.00 54.45 H new ATOM 0 HB3 GLN A 395 19.666 4.880 0.331 1.00 54.45 H new ATOM 0 HG2 GLN A 395 19.319 2.816 1.638 1.00 0.11 H new ATOM 0 HG3 GLN A 395 20.632 3.260 2.710 1.00 0.11 H new ATOM 0 HE21 GLN A 395 19.282 3.329 4.536 1.00 73.22 H new ATOM 0 HE22 GLN A 395 18.108 4.626 4.784 1.00 73.22 H new ATOM 638 N GLU A 396 23.794 4.047 0.597 1.00 32.40 N ATOM 639 CA GLU A 396 25.027 3.743 1.241 1.00 41.42 C ATOM 640 C GLU A 396 25.404 4.881 2.152 1.00 43.23 C ATOM 641 O GLU A 396 25.924 5.912 1.711 1.00 5.32 O ATOM 642 CB GLU A 396 26.114 3.454 0.204 1.00 5.33 C ATOM 643 CG GLU A 396 25.776 2.269 -0.696 1.00 14.33 C ATOM 644 CD GLU A 396 26.838 1.977 -1.715 1.00 70.44 C ATOM 645 OE1 GLU A 396 27.918 1.482 -1.327 1.00 2.12 O ATOM 646 OE2 GLU A 396 26.608 2.195 -2.932 1.00 25.13 O ATOM 0 H GLU A 396 23.841 4.826 -0.060 1.00 32.40 H new ATOM 0 HA GLU A 396 24.918 2.843 1.846 1.00 41.42 H new ATOM 0 HB2 GLU A 396 26.266 4.340 -0.412 1.00 5.33 H new ATOM 0 HB3 GLU A 396 27.055 3.257 0.717 1.00 5.33 H new ATOM 0 HG2 GLU A 396 25.622 1.384 -0.078 1.00 14.33 H new ATOM 0 HG3 GLU A 396 24.835 2.468 -1.209 1.00 14.33 H new ATOM 653 N GLY A 397 25.098 4.713 3.415 1.00 50.31 N ATOM 654 CA GLY A 397 25.337 5.748 4.376 1.00 20.21 C ATOM 655 C GLY A 397 24.316 6.836 4.214 1.00 75.21 C ATOM 656 O GLY A 397 23.118 6.592 4.346 1.00 72.30 O ATOM 0 H GLY A 397 24.682 3.864 3.797 1.00 50.31 H new ATOM 0 HA2 GLY A 397 25.289 5.339 5.385 1.00 20.21 H new ATOM 0 HA3 GLY A 397 26.340 6.155 4.245 1.00 20.21 H new ATOM 660 N ASN A 398 24.769 8.011 3.905 1.00 54.31 N ATOM 661 CA ASN A 398 23.878 9.135 3.674 1.00 64.14 C ATOM 662 C ASN A 398 23.846 9.428 2.163 1.00 3.40 C ATOM 663 O ASN A 398 23.329 10.441 1.701 1.00 31.45 O ATOM 664 CB ASN A 398 24.399 10.352 4.447 1.00 43.24 C ATOM 665 CG ASN A 398 23.464 11.538 4.418 1.00 33.01 C ATOM 666 OD1 ASN A 398 22.239 11.393 4.375 1.00 20.43 O ATOM 667 ND2 ASN A 398 24.027 12.712 4.434 1.00 52.12 N ATOM 0 H ASN A 398 25.760 8.231 3.803 1.00 54.31 H new ATOM 0 HA ASN A 398 22.869 8.907 4.018 1.00 64.14 H new ATOM 0 HB2 ASN A 398 24.574 10.065 5.484 1.00 43.24 H new ATOM 0 HB3 ASN A 398 25.362 10.650 4.032 1.00 43.24 H new ATOM 0 HD21 ASN A 398 23.452 13.554 4.411 1.00 52.12 H new ATOM 0 HD22 ASN A 398 25.043 12.790 4.470 1.00 52.12 H new ATOM 674 N VAL A 399 24.405 8.515 1.401 1.00 64.14 N ATOM 675 CA VAL A 399 24.502 8.670 -0.026 1.00 15.32 C ATOM 676 C VAL A 399 23.534 7.721 -0.738 1.00 31.41 C ATOM 677 O VAL A 399 23.524 6.517 -0.485 1.00 61.32 O ATOM 678 CB VAL A 399 25.950 8.426 -0.512 1.00 71.25 C ATOM 679 CG1 VAL A 399 26.049 8.602 -2.006 1.00 70.12 C ATOM 680 CG2 VAL A 399 26.910 9.372 0.189 1.00 43.51 C ATOM 0 H VAL A 399 24.804 7.646 1.756 1.00 64.14 H new ATOM 0 HA VAL A 399 24.228 9.696 -0.272 1.00 15.32 H new ATOM 0 HB VAL A 399 26.223 7.400 -0.266 1.00 71.25 H new ATOM 0 HG11 VAL A 399 27.076 8.426 -2.326 1.00 70.12 H new ATOM 0 HG12 VAL A 399 25.388 7.891 -2.501 1.00 70.12 H new ATOM 0 HG13 VAL A 399 25.755 9.617 -2.273 1.00 70.12 H new ATOM 0 HG21 VAL A 399 27.925 9.188 -0.164 1.00 43.51 H new ATOM 0 HG22 VAL A 399 26.631 10.402 -0.031 1.00 43.51 H new ATOM 0 HG23 VAL A 399 26.864 9.205 1.265 1.00 43.51 H new ATOM 690 N LEU A 400 22.737 8.270 -1.611 1.00 40.02 N ATOM 691 CA LEU A 400 21.737 7.512 -2.346 1.00 43.24 C ATOM 692 C LEU A 400 22.255 7.205 -3.733 1.00 75.33 C ATOM 693 O LEU A 400 22.791 8.093 -4.404 1.00 5.22 O ATOM 694 CB LEU A 400 20.421 8.312 -2.490 1.00 44.44 C ATOM 695 CG LEU A 400 19.632 8.696 -1.215 1.00 10.13 C ATOM 696 CD1 LEU A 400 19.241 7.478 -0.414 1.00 21.22 C ATOM 697 CD2 LEU A 400 20.380 9.698 -0.356 1.00 72.50 C ATOM 0 H LEU A 400 22.755 9.263 -1.842 1.00 40.02 H new ATOM 0 HA LEU A 400 21.540 6.595 -1.791 1.00 43.24 H new ATOM 0 HB2 LEU A 400 20.653 9.234 -3.023 1.00 44.44 H new ATOM 0 HB3 LEU A 400 19.753 7.734 -3.129 1.00 44.44 H new ATOM 0 HG LEU A 400 18.716 9.182 -1.551 1.00 10.13 H new ATOM 0 HD11 LEU A 400 18.689 7.788 0.473 1.00 21.22 H new ATOM 0 HD12 LEU A 400 18.613 6.828 -1.023 1.00 21.22 H new ATOM 0 HD13 LEU A 400 20.138 6.937 -0.113 1.00 21.22 H new ATOM 0 HD21 LEU A 400 19.786 9.936 0.526 1.00 72.50 H new ATOM 0 HD22 LEU A 400 21.334 9.271 -0.047 1.00 72.50 H new ATOM 0 HD23 LEU A 400 20.558 10.608 -0.930 1.00 72.50 H new ATOM 709 N LYS A 401 22.105 5.975 -4.178 1.00 33.35 N ATOM 710 CA LYS A 401 22.560 5.623 -5.501 1.00 32.02 C ATOM 711 C LYS A 401 21.346 5.217 -6.339 1.00 22.33 C ATOM 712 O LYS A 401 20.522 4.387 -5.909 1.00 2.32 O ATOM 713 CB LYS A 401 23.565 4.465 -5.438 1.00 35.22 C ATOM 714 CG LYS A 401 24.673 4.519 -6.500 1.00 25.42 C ATOM 715 CD LYS A 401 24.158 4.526 -7.927 1.00 62.34 C ATOM 716 CE LYS A 401 23.502 3.218 -8.334 1.00 45.21 C ATOM 717 NZ LYS A 401 24.432 2.067 -8.180 1.00 62.53 N ATOM 0 H LYS A 401 21.678 5.214 -3.650 1.00 33.35 H new ATOM 0 HA LYS A 401 23.061 6.479 -5.954 1.00 32.02 H new ATOM 0 HB2 LYS A 401 24.027 4.456 -4.451 1.00 35.22 H new ATOM 0 HB3 LYS A 401 23.023 3.525 -5.545 1.00 35.22 H new ATOM 0 HG2 LYS A 401 25.275 5.413 -6.337 1.00 25.42 H new ATOM 0 HG3 LYS A 401 25.333 3.662 -6.367 1.00 25.42 H new ATOM 0 HD2 LYS A 401 23.439 5.337 -8.043 1.00 62.34 H new ATOM 0 HD3 LYS A 401 24.986 4.736 -8.604 1.00 62.34 H new ATOM 0 HE2 LYS A 401 22.613 3.052 -7.726 1.00 45.21 H new ATOM 0 HE3 LYS A 401 23.172 3.283 -9.371 1.00 45.21 H new ATOM 0 HZ1 LYS A 401 24.190 1.330 -8.873 1.00 62.53 H new ATOM 0 HZ2 LYS A 401 25.409 2.386 -8.341 1.00 62.53 H new ATOM 0 HZ3 LYS A 401 24.349 1.679 -7.219 1.00 62.53 H new ATOM 731 N TYR A 402 21.236 5.791 -7.510 1.00 64.54 N ATOM 732 CA TYR A 402 20.154 5.531 -8.401 1.00 73.25 C ATOM 733 C TYR A 402 20.711 4.947 -9.668 1.00 73.42 C ATOM 734 O TYR A 402 21.608 5.530 -10.266 1.00 1.20 O ATOM 735 CB TYR A 402 19.414 6.817 -8.709 1.00 41.50 C ATOM 736 CG TYR A 402 18.908 7.528 -7.488 1.00 20.21 C ATOM 737 CD1 TYR A 402 17.682 7.218 -6.935 1.00 44.04 C ATOM 738 CD2 TYR A 402 19.663 8.513 -6.889 1.00 41.33 C ATOM 739 CE1 TYR A 402 17.226 7.876 -5.817 1.00 43.20 C ATOM 740 CE2 TYR A 402 19.215 9.164 -5.780 1.00 54.10 C ATOM 741 CZ TYR A 402 18.004 8.850 -5.248 1.00 21.22 C ATOM 742 OH TYR A 402 17.567 9.521 -4.152 1.00 11.34 O ATOM 0 H TYR A 402 21.913 6.464 -7.870 1.00 64.54 H new ATOM 0 HA TYR A 402 19.455 4.832 -7.942 1.00 73.25 H new ATOM 0 HB2 TYR A 402 20.077 7.485 -9.259 1.00 41.50 H new ATOM 0 HB3 TYR A 402 18.572 6.594 -9.364 1.00 41.50 H new ATOM 0 HD1 TYR A 402 17.073 6.449 -7.386 1.00 44.04 H new ATOM 0 HD2 TYR A 402 20.625 8.773 -7.306 1.00 41.33 H new ATOM 0 HE1 TYR A 402 16.265 7.628 -5.392 1.00 43.20 H new ATOM 0 HE2 TYR A 402 19.823 9.931 -5.322 1.00 54.10 H new ATOM 0 HH TYR A 402 17.445 8.892 -3.411 1.00 11.34 H new ATOM 752 N GLU A 403 20.212 3.816 -10.073 1.00 11.15 N ATOM 753 CA GLU A 403 20.742 3.156 -11.238 1.00 62.24 C ATOM 754 C GLU A 403 19.590 2.710 -12.133 1.00 73.03 C ATOM 755 O GLU A 403 18.442 2.767 -11.707 1.00 71.12 O ATOM 756 CB GLU A 403 21.506 1.944 -10.773 1.00 62.35 C ATOM 757 CG GLU A 403 22.617 1.540 -11.679 1.00 14.22 C ATOM 758 CD GLU A 403 23.320 0.315 -11.186 1.00 55.12 C ATOM 759 OE1 GLU A 403 24.258 0.444 -10.383 1.00 1.13 O ATOM 760 OE2 GLU A 403 22.938 -0.804 -11.577 1.00 14.52 O ATOM 0 H GLU A 403 19.440 3.329 -9.617 1.00 11.15 H new ATOM 0 HA GLU A 403 21.391 3.829 -11.798 1.00 62.24 H new ATOM 0 HB2 GLU A 403 21.914 2.143 -9.782 1.00 62.35 H new ATOM 0 HB3 GLU A 403 20.813 1.109 -10.670 1.00 62.35 H new ATOM 0 HG2 GLU A 403 22.222 1.355 -12.678 1.00 14.22 H new ATOM 0 HG3 GLU A 403 23.331 2.359 -11.765 1.00 14.22 H new ATOM 767 N ASN A 404 19.901 2.277 -13.358 1.00 54.21 N ATOM 768 CA ASN A 404 18.901 1.733 -14.297 1.00 33.44 C ATOM 769 C ASN A 404 17.926 2.798 -14.755 1.00 12.34 C ATOM 770 O ASN A 404 16.708 2.598 -14.719 1.00 61.00 O ATOM 771 CB ASN A 404 18.136 0.518 -13.697 1.00 22.35 C ATOM 772 CG ASN A 404 19.026 -0.668 -13.329 1.00 25.44 C ATOM 773 OD1 ASN A 404 20.118 -0.848 -14.030 1.00 20.00 O flip ATOM 774 ND2 ASN A 404 18.719 -1.418 -12.405 1.00 24.35 N flip ATOM 0 H ASN A 404 20.850 2.291 -13.732 1.00 54.21 H new ATOM 0 HA ASN A 404 19.455 1.381 -15.167 1.00 33.44 H new ATOM 0 HB2 ASN A 404 17.601 0.845 -12.806 1.00 22.35 H new ATOM 0 HB3 ASN A 404 17.386 0.185 -14.415 1.00 22.35 H new ATOM 0 HD21 ASN A 404 17.862 -1.252 -11.877 1.00 24.35 H new ATOM 0 HD22 ASN A 404 19.321 -2.206 -12.166 1.00 24.35 H new ATOM 781 N GLY A 405 18.450 3.926 -15.186 1.00 72.22 N ATOM 782 CA GLY A 405 17.599 4.978 -15.654 1.00 32.32 C ATOM 783 C GLY A 405 17.479 4.968 -17.155 1.00 4.14 C ATOM 784 O GLY A 405 17.643 3.919 -17.798 1.00 61.33 O ATOM 0 H GLY A 405 19.449 4.129 -15.219 1.00 72.22 H new ATOM 0 HA2 GLY A 405 16.610 4.872 -15.209 1.00 32.32 H new ATOM 0 HA3 GLY A 405 17.994 5.939 -15.326 1.00 32.32 H new ATOM 788 N GLN A 406 17.220 6.119 -17.713 1.00 73.51 N ATOM 789 CA GLN A 406 17.078 6.298 -19.148 1.00 3.01 C ATOM 790 C GLN A 406 18.370 6.050 -19.896 1.00 64.42 C ATOM 791 O GLN A 406 19.459 6.263 -19.361 1.00 64.12 O ATOM 792 CB GLN A 406 16.524 7.677 -19.461 1.00 74.43 C ATOM 793 CG GLN A 406 15.057 7.824 -19.134 1.00 24.34 C ATOM 794 CD GLN A 406 14.201 7.001 -20.064 1.00 15.22 C ATOM 795 OE1 GLN A 406 13.903 5.833 -19.805 1.00 74.01 O ATOM 796 NE2 GLN A 406 13.816 7.595 -21.154 1.00 41.00 N ATOM 0 H GLN A 406 17.098 6.980 -17.180 1.00 73.51 H new ATOM 0 HA GLN A 406 16.368 5.547 -19.495 1.00 3.01 H new ATOM 0 HB2 GLN A 406 17.089 8.423 -18.902 1.00 74.43 H new ATOM 0 HB3 GLN A 406 16.676 7.889 -20.519 1.00 74.43 H new ATOM 0 HG2 GLN A 406 14.879 7.515 -18.104 1.00 24.34 H new ATOM 0 HG3 GLN A 406 14.770 8.873 -19.206 1.00 24.34 H new ATOM 0 HE21 GLN A 406 14.085 8.563 -21.329 1.00 41.00 H new ATOM 0 HE22 GLN A 406 13.245 7.093 -21.834 1.00 41.00 H new ATOM 805 N SER A 407 18.243 5.532 -21.103 1.00 14.31 N ATOM 806 CA SER A 407 19.367 5.293 -21.980 1.00 73.42 C ATOM 807 C SER A 407 20.145 6.597 -22.203 1.00 61.25 C ATOM 808 O SER A 407 19.557 7.667 -22.334 1.00 70.30 O ATOM 809 CB SER A 407 18.850 4.754 -23.303 1.00 33.11 C ATOM 810 OG SER A 407 18.051 3.599 -23.085 1.00 64.24 O ATOM 0 H SER A 407 17.345 5.263 -21.504 1.00 14.31 H new ATOM 0 HA SER A 407 20.041 4.565 -21.528 1.00 73.42 H new ATOM 0 HB2 SER A 407 18.264 5.520 -23.812 1.00 33.11 H new ATOM 0 HB3 SER A 407 19.688 4.508 -23.956 1.00 33.11 H new ATOM 0 HG SER A 407 17.722 3.262 -23.944 1.00 64.24 H new ATOM 816 N CYS A 408 21.439 6.501 -22.226 1.00 11.32 N ATOM 817 CA CYS A 408 22.276 7.663 -22.345 1.00 40.21 C ATOM 818 C CYS A 408 23.080 7.617 -23.636 1.00 5.30 C ATOM 819 O CYS A 408 23.358 8.664 -24.247 1.00 50.44 O ATOM 820 CB CYS A 408 23.202 7.723 -21.127 1.00 3.43 C ATOM 821 SG CYS A 408 24.380 9.110 -21.099 1.00 5.44 S ATOM 0 H CYS A 408 21.947 5.619 -22.163 1.00 11.32 H new ATOM 0 HA CYS A 408 21.658 8.560 -22.378 1.00 40.21 H new ATOM 0 HB2 CYS A 408 22.587 7.774 -20.228 1.00 3.43 H new ATOM 0 HB3 CYS A 408 23.765 6.791 -21.075 1.00 3.43 H new ATOM 826 N ALA A 409 23.412 6.399 -24.065 1.00 62.33 N ATOM 827 CA ALA A 409 24.244 6.130 -25.223 1.00 4.53 C ATOM 828 C ALA A 409 24.483 4.634 -25.208 1.00 43.15 C ATOM 829 O ALA A 409 23.597 3.875 -24.830 1.00 61.33 O ATOM 830 CB ALA A 409 25.581 6.865 -25.058 1.00 52.30 C ATOM 0 H ALA A 409 23.096 5.550 -23.596 1.00 62.33 H new ATOM 0 HA ALA A 409 23.781 6.458 -26.153 1.00 4.53 H new ATOM 0 HB1 ALA A 409 26.213 6.669 -25.924 1.00 52.30 H new ATOM 0 HB2 ALA A 409 25.399 7.937 -24.977 1.00 52.30 H new ATOM 0 HB3 ALA A 409 26.081 6.512 -24.156 1.00 52.30 H new ATOM 836 N ASN A 410 25.656 4.215 -25.609 1.00 34.22 N ATOM 837 CA ASN A 410 26.061 2.815 -25.503 1.00 13.24 C ATOM 838 C ASN A 410 26.426 2.479 -24.042 1.00 53.53 C ATOM 839 O ASN A 410 26.709 1.333 -23.701 1.00 63.24 O ATOM 840 CB ASN A 410 27.243 2.559 -26.462 1.00 62.41 C ATOM 841 CG ASN A 410 27.872 1.161 -26.372 1.00 2.31 C ATOM 842 OD1 ASN A 410 27.420 0.209 -27.015 1.00 14.21 O ATOM 843 ND2 ASN A 410 28.947 1.045 -25.619 1.00 52.42 N ATOM 0 H ASN A 410 26.364 4.824 -26.019 1.00 34.22 H new ATOM 0 HA ASN A 410 25.237 2.162 -25.791 1.00 13.24 H new ATOM 0 HB2 ASN A 410 26.901 2.720 -27.484 1.00 62.41 H new ATOM 0 HB3 ASN A 410 28.017 3.301 -26.264 1.00 62.41 H new ATOM 0 HD21 ASN A 410 29.431 0.149 -25.555 1.00 52.42 H new ATOM 0 HD22 ASN A 410 29.295 1.851 -25.100 1.00 52.42 H new ATOM 850 N GLY A 411 26.375 3.488 -23.176 1.00 52.31 N ATOM 851 CA GLY A 411 26.722 3.302 -21.783 1.00 41.12 C ATOM 852 C GLY A 411 25.658 2.530 -21.020 1.00 41.42 C ATOM 853 O GLY A 411 24.597 2.226 -21.573 1.00 45.54 O ATOM 0 H GLY A 411 26.096 4.438 -23.420 1.00 52.31 H new ATOM 0 HA2 GLY A 411 27.671 2.771 -21.715 1.00 41.12 H new ATOM 0 HA3 GLY A 411 26.867 4.275 -21.314 1.00 41.12 H new ATOM 857 N PRO A 412 25.898 2.218 -19.746 1.00 43.24 N ATOM 858 CA PRO A 412 24.970 1.439 -18.912 1.00 71.20 C ATOM 859 C PRO A 412 23.812 2.282 -18.369 1.00 64.05 C ATOM 860 O PRO A 412 23.455 2.161 -17.197 1.00 60.14 O ATOM 861 CB PRO A 412 25.857 0.969 -17.743 1.00 11.12 C ATOM 862 CG PRO A 412 27.249 1.411 -18.076 1.00 63.01 C ATOM 863 CD PRO A 412 27.097 2.580 -18.993 1.00 71.20 C ATOM 0 HA PRO A 412 24.502 0.634 -19.479 1.00 71.20 H new ATOM 0 HB2 PRO A 412 25.524 1.405 -16.801 1.00 11.12 H new ATOM 0 HB3 PRO A 412 25.809 -0.114 -17.628 1.00 11.12 H new ATOM 0 HG2 PRO A 412 27.797 1.689 -17.176 1.00 63.01 H new ATOM 0 HG3 PRO A 412 27.810 0.609 -18.555 1.00 63.01 H new ATOM 0 HD2 PRO A 412 26.969 3.514 -18.446 1.00 71.20 H new ATOM 0 HD3 PRO A 412 27.964 2.706 -19.641 1.00 71.20 H new ATOM 871 N HIS A 413 23.179 3.067 -19.257 1.00 71.13 N ATOM 872 CA HIS A 413 22.074 3.948 -18.933 1.00 61.01 C ATOM 873 C HIS A 413 22.533 5.078 -18.019 1.00 35.13 C ATOM 874 O HIS A 413 23.725 5.197 -17.722 1.00 52.42 O ATOM 875 CB HIS A 413 20.901 3.161 -18.332 1.00 62.02 C ATOM 876 CG HIS A 413 20.380 2.048 -19.217 1.00 70.54 C ATOM 877 ND1 HIS A 413 19.266 2.164 -20.022 1.00 2.50 N ATOM 878 CD2 HIS A 413 20.849 0.789 -19.414 1.00 1.54 C ATOM 879 CE1 HIS A 413 19.080 1.031 -20.673 1.00 1.02 C ATOM 880 NE2 HIS A 413 20.023 0.184 -20.321 1.00 5.24 N ATOM 0 H HIS A 413 23.438 3.098 -20.243 1.00 71.13 H new ATOM 0 HA HIS A 413 21.714 4.403 -19.856 1.00 61.01 H new ATOM 0 HB2 HIS A 413 21.215 2.735 -17.379 1.00 62.02 H new ATOM 0 HB3 HIS A 413 20.086 3.852 -18.119 1.00 62.02 H new ATOM 0 HD2 HIS A 413 21.714 0.347 -18.942 1.00 1.54 H new ATOM 0 HE1 HIS A 413 18.286 0.832 -21.377 1.00 1.02 H new ATOM 0 HE2 HIS A 413 20.122 -0.770 -20.668 1.00 5.24 H new ATOM 889 N ARG A 414 21.631 5.930 -17.622 1.00 40.03 N ATOM 890 CA ARG A 414 21.989 6.999 -16.729 1.00 1.11 C ATOM 891 C ARG A 414 21.949 6.484 -15.307 1.00 3.43 C ATOM 892 O ARG A 414 21.282 5.472 -15.013 1.00 15.44 O ATOM 893 CB ARG A 414 21.052 8.214 -16.881 1.00 71.14 C ATOM 894 CG ARG A 414 20.995 8.802 -18.278 1.00 61.02 C ATOM 895 CD ARG A 414 20.069 10.010 -18.341 1.00 71.34 C ATOM 896 NE ARG A 414 19.802 10.441 -19.729 1.00 32.05 N ATOM 897 CZ ARG A 414 20.074 11.655 -20.249 1.00 31.42 C ATOM 898 NH1 ARG A 414 20.808 12.537 -19.578 1.00 64.45 N ATOM 899 NH2 ARG A 414 19.640 11.958 -21.464 1.00 30.44 N ATOM 0 H ARG A 414 20.650 5.908 -17.899 1.00 40.03 H new ATOM 0 HA ARG A 414 22.995 7.336 -16.980 1.00 1.11 H new ATOM 0 HB2 ARG A 414 20.046 7.918 -16.585 1.00 71.14 H new ATOM 0 HB3 ARG A 414 21.373 8.991 -16.187 1.00 71.14 H new ATOM 0 HG2 ARG A 414 21.997 9.094 -18.591 1.00 61.02 H new ATOM 0 HG3 ARG A 414 20.651 8.042 -18.979 1.00 61.02 H new ATOM 0 HD2 ARG A 414 19.126 9.768 -17.850 1.00 71.34 H new ATOM 0 HD3 ARG A 414 20.514 10.836 -17.786 1.00 71.34 H new ATOM 0 HE ARG A 414 19.372 9.757 -20.351 1.00 32.05 H new ATOM 0 HH11 ARG A 414 21.174 12.299 -18.656 1.00 64.45 H new ATOM 0 HH12 ARG A 414 21.005 13.451 -19.985 1.00 64.45 H new ATOM 0 HH21 ARG A 414 19.104 11.275 -21.999 1.00 30.44 H new ATOM 0 HH22 ARG A 414 19.842 12.874 -21.864 1.00 30.44 H new ATOM 913 N SER A 415 22.656 7.146 -14.450 1.00 55.53 N ATOM 914 CA SER A 415 22.685 6.823 -13.061 1.00 22.50 C ATOM 915 C SER A 415 22.894 8.099 -12.247 1.00 31.02 C ATOM 916 O SER A 415 23.380 9.098 -12.778 1.00 42.14 O ATOM 917 CB SER A 415 23.736 5.720 -12.786 1.00 21.20 C ATOM 918 OG SER A 415 24.969 5.991 -13.441 1.00 52.22 O ATOM 0 H SER A 415 23.241 7.943 -14.701 1.00 55.53 H new ATOM 0 HA SER A 415 21.730 6.404 -12.745 1.00 22.50 H new ATOM 0 HB2 SER A 415 23.905 5.638 -11.712 1.00 21.20 H new ATOM 0 HB3 SER A 415 23.350 4.758 -13.122 1.00 21.20 H new ATOM 0 HG SER A 415 25.218 5.226 -14.000 1.00 52.22 H new ATOM 924 N ALA A 416 22.499 8.090 -11.003 1.00 72.52 N ATOM 925 CA ALA A 416 22.602 9.270 -10.170 1.00 0.31 C ATOM 926 C ALA A 416 23.139 8.907 -8.813 1.00 43.23 C ATOM 927 O ALA A 416 22.790 7.864 -8.262 1.00 54.43 O ATOM 928 CB ALA A 416 21.242 9.964 -10.047 1.00 11.14 C ATOM 0 H ALA A 416 22.100 7.276 -10.536 1.00 72.52 H new ATOM 0 HA ALA A 416 23.297 9.966 -10.640 1.00 0.31 H new ATOM 0 HB1 ALA A 416 21.340 10.848 -9.417 1.00 11.14 H new ATOM 0 HB2 ALA A 416 20.894 10.260 -11.037 1.00 11.14 H new ATOM 0 HB3 ALA A 416 20.523 9.278 -9.600 1.00 11.14 H new ATOM 934 N ILE A 417 23.998 9.731 -8.294 1.00 61.42 N ATOM 935 CA ILE A 417 24.573 9.514 -6.994 1.00 13.23 C ATOM 936 C ILE A 417 24.343 10.774 -6.114 1.00 30.00 C ATOM 937 O ILE A 417 24.935 11.827 -6.344 1.00 73.11 O ATOM 938 CB ILE A 417 26.103 9.142 -7.118 1.00 42.23 C ATOM 939 CG1 ILE A 417 26.734 8.808 -5.774 1.00 32.42 C ATOM 940 CG2 ILE A 417 26.908 10.190 -7.850 1.00 23.33 C ATOM 941 CD1 ILE A 417 26.251 7.507 -5.194 1.00 64.14 C ATOM 0 H ILE A 417 24.324 10.578 -8.760 1.00 61.42 H new ATOM 0 HA ILE A 417 24.083 8.669 -6.510 1.00 13.23 H new ATOM 0 HB ILE A 417 26.130 8.238 -7.726 1.00 42.23 H new ATOM 0 HG12 ILE A 417 27.817 8.766 -5.890 1.00 32.42 H new ATOM 0 HG13 ILE A 417 26.520 9.613 -5.071 1.00 32.42 H new ATOM 0 HG21 ILE A 417 27.951 9.877 -7.903 1.00 23.33 H new ATOM 0 HG22 ILE A 417 26.514 10.312 -8.859 1.00 23.33 H new ATOM 0 HG23 ILE A 417 26.840 11.139 -7.317 1.00 23.33 H new ATOM 0 HD11 ILE A 417 26.741 7.331 -4.236 1.00 64.14 H new ATOM 0 HD12 ILE A 417 25.172 7.553 -5.046 1.00 64.14 H new ATOM 0 HD13 ILE A 417 26.489 6.693 -5.878 1.00 64.14 H new ATOM 953 N VAL A 418 23.468 10.675 -5.138 1.00 32.24 N ATOM 954 CA VAL A 418 23.149 11.825 -4.297 1.00 35.42 C ATOM 955 C VAL A 418 23.946 11.782 -3.021 1.00 24.11 C ATOM 956 O VAL A 418 23.758 10.906 -2.183 1.00 72.11 O ATOM 957 CB VAL A 418 21.631 11.947 -3.967 1.00 71.02 C ATOM 958 CG1 VAL A 418 21.360 13.142 -3.055 1.00 1.02 C ATOM 959 CG2 VAL A 418 20.814 12.079 -5.226 1.00 43.14 C ATOM 0 H VAL A 418 22.964 9.820 -4.902 1.00 32.24 H new ATOM 0 HA VAL A 418 23.420 12.708 -4.876 1.00 35.42 H new ATOM 0 HB VAL A 418 21.338 11.035 -3.448 1.00 71.02 H new ATOM 0 HG11 VAL A 418 20.293 13.202 -2.842 1.00 1.02 H new ATOM 0 HG12 VAL A 418 21.910 13.020 -2.122 1.00 1.02 H new ATOM 0 HG13 VAL A 418 21.683 14.058 -3.550 1.00 1.02 H new ATOM 0 HG21 VAL A 418 19.758 12.162 -4.968 1.00 43.14 H new ATOM 0 HG22 VAL A 418 21.126 12.970 -5.770 1.00 43.14 H new ATOM 0 HG23 VAL A 418 20.966 11.200 -5.852 1.00 43.14 H new ATOM 969 N THR A 419 24.834 12.712 -2.897 1.00 35.02 N ATOM 970 CA THR A 419 25.667 12.841 -1.758 1.00 72.02 C ATOM 971 C THR A 419 25.167 14.034 -0.937 1.00 11.14 C ATOM 972 O THR A 419 25.131 15.172 -1.433 1.00 71.10 O ATOM 973 CB THR A 419 27.113 13.079 -2.223 1.00 52.34 C ATOM 974 OG1 THR A 419 27.465 12.037 -3.155 1.00 44.43 O ATOM 975 CG2 THR A 419 28.083 13.055 -1.046 1.00 21.33 C ATOM 0 H THR A 419 25.001 13.422 -3.610 1.00 35.02 H new ATOM 0 HA THR A 419 25.639 11.939 -1.147 1.00 72.02 H new ATOM 0 HB THR A 419 27.179 14.060 -2.693 1.00 52.34 H new ATOM 0 HG1 THR A 419 28.385 12.172 -3.465 1.00 44.43 H new ATOM 0 HG21 THR A 419 29.097 13.226 -1.407 1.00 21.33 H new ATOM 0 HG22 THR A 419 27.813 13.837 -0.336 1.00 21.33 H new ATOM 0 HG23 THR A 419 28.032 12.084 -0.553 1.00 21.33 H new ATOM 983 N VAL A 420 24.755 13.784 0.281 1.00 35.30 N ATOM 984 CA VAL A 420 24.238 14.840 1.115 1.00 15.44 C ATOM 985 C VAL A 420 25.306 15.241 2.119 1.00 2.24 C ATOM 986 O VAL A 420 25.936 14.382 2.733 1.00 60.02 O ATOM 987 CB VAL A 420 22.945 14.407 1.848 1.00 74.15 C ATOM 988 CG1 VAL A 420 22.318 15.576 2.586 1.00 63.41 C ATOM 989 CG2 VAL A 420 21.951 13.789 0.879 1.00 50.33 C ATOM 0 H VAL A 420 24.767 12.861 0.716 1.00 35.30 H new ATOM 0 HA VAL A 420 23.981 15.690 0.484 1.00 15.44 H new ATOM 0 HB VAL A 420 23.218 13.650 2.583 1.00 74.15 H new ATOM 0 HG11 VAL A 420 21.412 15.243 3.092 1.00 63.41 H new ATOM 0 HG12 VAL A 420 23.023 15.962 3.322 1.00 63.41 H new ATOM 0 HG13 VAL A 420 22.068 16.363 1.875 1.00 63.41 H new ATOM 0 HG21 VAL A 420 21.052 13.494 1.419 1.00 50.33 H new ATOM 0 HG22 VAL A 420 21.690 14.518 0.111 1.00 50.33 H new ATOM 0 HG23 VAL A 420 22.397 12.912 0.410 1.00 50.33 H new ATOM 999 N GLU A 421 25.523 16.532 2.261 1.00 34.33 N ATOM 1000 CA GLU A 421 26.578 17.042 3.130 1.00 5.11 C ATOM 1001 C GLU A 421 26.056 17.888 4.304 1.00 65.15 C ATOM 1002 O GLU A 421 26.837 18.587 4.954 1.00 4.21 O ATOM 1003 CB GLU A 421 27.597 17.830 2.308 1.00 60.44 C ATOM 1004 CG GLU A 421 26.992 18.925 1.447 1.00 24.12 C ATOM 1005 CD GLU A 421 28.044 19.739 0.753 1.00 31.45 C ATOM 1006 OE1 GLU A 421 28.625 19.275 -0.259 1.00 14.34 O ATOM 1007 OE2 GLU A 421 28.313 20.876 1.209 1.00 2.41 O ATOM 0 H GLU A 421 24.983 17.255 1.786 1.00 34.33 H new ATOM 0 HA GLU A 421 27.058 16.173 3.580 1.00 5.11 H new ATOM 0 HB2 GLU A 421 28.325 18.277 2.985 1.00 60.44 H new ATOM 0 HB3 GLU A 421 28.142 17.138 1.666 1.00 60.44 H new ATOM 0 HG2 GLU A 421 26.330 18.479 0.705 1.00 24.12 H new ATOM 0 HG3 GLU A 421 26.379 19.578 2.068 1.00 24.12 H new ATOM 1014 N CYS A 422 24.757 17.784 4.591 1.00 34.43 N ATOM 1015 CA CYS A 422 24.113 18.508 5.715 1.00 72.43 C ATOM 1016 C CYS A 422 24.005 20.020 5.508 1.00 13.10 C ATOM 1017 O CYS A 422 24.893 20.667 4.948 1.00 10.44 O ATOM 1018 CB CYS A 422 24.757 18.140 7.074 1.00 11.43 C ATOM 1019 SG CYS A 422 24.259 19.161 8.510 1.00 54.24 S ATOM 0 H CYS A 422 24.113 17.199 4.058 1.00 34.43 H new ATOM 0 HA CYS A 422 23.080 18.160 5.735 1.00 72.43 H new ATOM 0 HB2 CYS A 422 24.519 17.100 7.295 1.00 11.43 H new ATOM 0 HB3 CYS A 422 25.840 18.204 6.968 1.00 11.43 H new ATOM 1024 N GLY A 423 22.882 20.560 5.924 1.00 42.03 N ATOM 1025 CA GLY A 423 22.620 21.962 5.799 1.00 65.34 C ATOM 1026 C GLY A 423 21.472 22.362 6.688 1.00 4.23 C ATOM 1027 O GLY A 423 21.071 21.595 7.565 1.00 21.45 O ATOM 0 H GLY A 423 22.126 20.031 6.359 1.00 42.03 H new ATOM 0 HA2 GLY A 423 23.511 22.530 6.067 1.00 65.34 H new ATOM 0 HA3 GLY A 423 22.387 22.204 4.762 1.00 65.34 H new ATOM 1031 N VAL A 424 20.940 23.530 6.463 1.00 53.00 N ATOM 1032 CA VAL A 424 19.832 24.036 7.254 1.00 50.42 C ATOM 1033 C VAL A 424 18.519 23.793 6.512 1.00 31.34 C ATOM 1034 O VAL A 424 17.462 23.638 7.112 1.00 42.41 O ATOM 1035 CB VAL A 424 20.004 25.564 7.538 1.00 4.12 C ATOM 1036 CG1 VAL A 424 18.854 26.113 8.369 1.00 33.20 C ATOM 1037 CG2 VAL A 424 21.332 25.835 8.234 1.00 41.12 C ATOM 0 H VAL A 424 21.255 24.165 5.729 1.00 53.00 H new ATOM 0 HA VAL A 424 19.817 23.508 8.208 1.00 50.42 H new ATOM 0 HB VAL A 424 19.997 26.077 6.576 1.00 4.12 H new ATOM 0 HG11 VAL A 424 19.009 27.177 8.546 1.00 33.20 H new ATOM 0 HG12 VAL A 424 17.916 25.967 7.834 1.00 33.20 H new ATOM 0 HG13 VAL A 424 18.812 25.589 9.324 1.00 33.20 H new ATOM 0 HG21 VAL A 424 21.432 26.904 8.423 1.00 41.12 H new ATOM 0 HG22 VAL A 424 21.364 25.295 9.180 1.00 41.12 H new ATOM 0 HG23 VAL A 424 22.151 25.500 7.598 1.00 41.12 H new ATOM 1047 N GLU A 425 18.620 23.714 5.223 1.00 21.50 N ATOM 1048 CA GLU A 425 17.498 23.570 4.342 1.00 4.50 C ATOM 1049 C GLU A 425 17.765 22.465 3.355 1.00 4.30 C ATOM 1050 O GLU A 425 18.910 22.049 3.202 1.00 21.34 O ATOM 1051 CB GLU A 425 17.240 24.865 3.573 1.00 33.34 C ATOM 1052 CG GLU A 425 18.380 25.320 2.629 1.00 62.43 C ATOM 1053 CD GLU A 425 19.654 25.731 3.347 1.00 10.43 C ATOM 1054 OE1 GLU A 425 20.505 24.859 3.652 1.00 13.23 O ATOM 1055 OE2 GLU A 425 19.818 26.936 3.626 1.00 4.11 O ATOM 0 H GLU A 425 19.515 23.749 4.735 1.00 21.50 H new ATOM 0 HA GLU A 425 16.622 23.333 4.945 1.00 4.50 H new ATOM 0 HB2 GLU A 425 16.332 24.742 2.983 1.00 33.34 H new ATOM 0 HB3 GLU A 425 17.048 25.661 4.292 1.00 33.34 H new ATOM 0 HG2 GLU A 425 18.611 24.509 1.938 1.00 62.43 H new ATOM 0 HG3 GLU A 425 18.027 26.159 2.029 1.00 62.43 H new ATOM 1062 N ASN A 426 16.719 21.968 2.721 1.00 33.15 N ATOM 1063 CA ASN A 426 16.871 20.952 1.689 1.00 62.50 C ATOM 1064 C ASN A 426 17.116 21.628 0.367 1.00 25.11 C ATOM 1065 O ASN A 426 16.199 22.216 -0.214 1.00 21.32 O ATOM 1066 CB ASN A 426 15.615 20.070 1.525 1.00 72.35 C ATOM 1067 CG ASN A 426 15.205 19.318 2.758 1.00 3.53 C ATOM 1068 OD1 ASN A 426 15.668 18.213 3.007 1.00 52.41 O ATOM 1069 ND2 ASN A 426 14.307 19.880 3.520 1.00 62.12 N ATOM 0 H ASN A 426 15.755 22.249 2.900 1.00 33.15 H new ATOM 0 HA ASN A 426 17.704 20.318 1.993 1.00 62.50 H new ATOM 0 HB2 ASN A 426 14.784 20.701 1.209 1.00 72.35 H new ATOM 0 HB3 ASN A 426 15.794 19.354 0.723 1.00 72.35 H new ATOM 0 HD21 ASN A 426 13.970 19.397 4.353 1.00 62.12 H new ATOM 0 HD22 ASN A 426 13.942 20.803 3.283 1.00 62.12 H new ATOM 1076 N GLU A 427 18.318 21.577 -0.116 1.00 33.42 N ATOM 1077 CA GLU A 427 18.599 22.139 -1.398 1.00 25.52 C ATOM 1078 C GLU A 427 19.559 21.273 -2.137 1.00 12.23 C ATOM 1079 O GLU A 427 20.446 20.638 -1.541 1.00 54.01 O ATOM 1080 CB GLU A 427 19.142 23.587 -1.346 1.00 5.13 C ATOM 1081 CG GLU A 427 20.481 23.749 -0.652 1.00 54.03 C ATOM 1082 CD GLU A 427 21.089 25.117 -0.878 1.00 60.12 C ATOM 1083 OE1 GLU A 427 20.751 26.067 -0.157 1.00 10.11 O ATOM 1084 OE2 GLU A 427 21.939 25.259 -1.775 1.00 53.14 O ATOM 0 H GLU A 427 19.117 21.154 0.356 1.00 33.42 H new ATOM 0 HA GLU A 427 17.643 22.186 -1.919 1.00 25.52 H new ATOM 0 HB2 GLU A 427 19.231 23.961 -2.366 1.00 5.13 H new ATOM 0 HB3 GLU A 427 18.409 24.215 -0.839 1.00 5.13 H new ATOM 0 HG2 GLU A 427 20.355 23.583 0.418 1.00 54.03 H new ATOM 0 HG3 GLU A 427 21.169 22.985 -1.014 1.00 54.03 H new ATOM 1091 N ILE A 428 19.356 21.203 -3.407 1.00 45.31 N ATOM 1092 CA ILE A 428 20.249 20.530 -4.282 1.00 41.30 C ATOM 1093 C ILE A 428 21.312 21.543 -4.677 1.00 45.13 C ATOM 1094 O ILE A 428 20.998 22.591 -5.243 1.00 51.42 O ATOM 1095 CB ILE A 428 19.496 20.028 -5.528 1.00 51.12 C ATOM 1096 CG1 ILE A 428 18.275 19.187 -5.095 1.00 14.14 C ATOM 1097 CG2 ILE A 428 20.424 19.237 -6.447 1.00 55.32 C ATOM 1098 CD1 ILE A 428 17.456 18.622 -6.240 1.00 43.22 C ATOM 0 H ILE A 428 18.550 21.619 -3.874 1.00 45.31 H new ATOM 0 HA ILE A 428 20.696 19.661 -3.799 1.00 41.30 H new ATOM 0 HB ILE A 428 19.139 20.887 -6.096 1.00 51.12 H new ATOM 0 HG12 ILE A 428 18.622 18.362 -4.473 1.00 14.14 H new ATOM 0 HG13 ILE A 428 17.627 19.805 -4.473 1.00 14.14 H new ATOM 0 HG21 ILE A 428 19.867 18.894 -7.319 1.00 55.32 H new ATOM 0 HG22 ILE A 428 21.247 19.875 -6.770 1.00 55.32 H new ATOM 0 HG23 ILE A 428 20.822 18.376 -5.909 1.00 55.32 H new ATOM 0 HD11 ILE A 428 16.621 18.047 -5.841 1.00 43.22 H new ATOM 0 HD12 ILE A 428 17.074 19.439 -6.852 1.00 43.22 H new ATOM 0 HD13 ILE A 428 18.084 17.974 -6.851 1.00 43.22 H new ATOM 1110 N VAL A 429 22.537 21.251 -4.356 1.00 65.32 N ATOM 1111 CA VAL A 429 23.617 22.179 -4.583 1.00 22.35 C ATOM 1112 C VAL A 429 24.069 22.128 -6.035 1.00 61.54 C ATOM 1113 O VAL A 429 23.876 23.083 -6.781 1.00 75.44 O ATOM 1114 CB VAL A 429 24.825 21.905 -3.643 1.00 63.02 C ATOM 1115 CG1 VAL A 429 25.915 22.955 -3.831 1.00 10.13 C ATOM 1116 CG2 VAL A 429 24.376 21.843 -2.185 1.00 34.01 C ATOM 0 H VAL A 429 22.821 20.368 -3.931 1.00 65.32 H new ATOM 0 HA VAL A 429 23.237 23.176 -4.358 1.00 22.35 H new ATOM 0 HB VAL A 429 25.244 20.935 -3.910 1.00 63.02 H new ATOM 0 HG11 VAL A 429 26.748 22.739 -3.161 1.00 10.13 H new ATOM 0 HG12 VAL A 429 26.265 22.935 -4.863 1.00 10.13 H new ATOM 0 HG13 VAL A 429 25.513 23.942 -3.603 1.00 10.13 H new ATOM 0 HG21 VAL A 429 25.238 21.650 -1.547 1.00 34.01 H new ATOM 0 HG22 VAL A 429 23.921 22.793 -1.904 1.00 34.01 H new ATOM 0 HG23 VAL A 429 23.648 21.041 -2.062 1.00 34.01 H new ATOM 1126 N SER A 430 24.626 21.015 -6.441 1.00 35.04 N ATOM 1127 CA SER A 430 25.145 20.884 -7.780 1.00 74.12 C ATOM 1128 C SER A 430 24.877 19.491 -8.325 1.00 11.04 C ATOM 1129 O SER A 430 24.679 18.540 -7.550 1.00 71.21 O ATOM 1130 CB SER A 430 26.659 21.161 -7.781 1.00 22.33 C ATOM 1131 OG SER A 430 26.959 22.448 -7.240 1.00 11.04 O ATOM 0 H SER A 430 24.732 20.183 -5.861 1.00 35.04 H new ATOM 0 HA SER A 430 24.642 21.610 -8.420 1.00 74.12 H new ATOM 0 HB2 SER A 430 27.170 20.393 -7.200 1.00 22.33 H new ATOM 0 HB3 SER A 430 27.041 21.096 -8.800 1.00 22.33 H new ATOM 0 HG SER A 430 27.928 22.591 -7.254 1.00 11.04 H new ATOM 1137 N VAL A 431 24.839 19.389 -9.642 1.00 14.34 N ATOM 1138 CA VAL A 431 24.695 18.127 -10.340 1.00 2.01 C ATOM 1139 C VAL A 431 25.720 18.093 -11.467 1.00 52.44 C ATOM 1140 O VAL A 431 25.653 18.898 -12.405 1.00 13.41 O ATOM 1141 CB VAL A 431 23.273 17.910 -10.937 1.00 31.34 C ATOM 1142 CG1 VAL A 431 23.204 16.557 -11.631 1.00 64.40 C ATOM 1143 CG2 VAL A 431 22.201 18.000 -9.858 1.00 74.44 C ATOM 0 H VAL A 431 24.909 20.194 -10.265 1.00 14.34 H new ATOM 0 HA VAL A 431 24.854 17.327 -9.617 1.00 2.01 H new ATOM 0 HB VAL A 431 23.085 18.700 -11.664 1.00 31.34 H new ATOM 0 HG11 VAL A 431 22.207 16.412 -12.046 1.00 64.40 H new ATOM 0 HG12 VAL A 431 23.940 16.522 -12.434 1.00 64.40 H new ATOM 0 HG13 VAL A 431 23.416 15.767 -10.910 1.00 64.40 H new ATOM 0 HG21 VAL A 431 21.220 17.844 -10.306 1.00 74.44 H new ATOM 0 HG22 VAL A 431 22.380 17.235 -9.102 1.00 74.44 H new ATOM 0 HG23 VAL A 431 22.235 18.985 -9.393 1.00 74.44 H new ATOM 1153 N LEU A 432 26.665 17.194 -11.377 1.00 42.23 N ATOM 1154 CA LEU A 432 27.734 17.137 -12.348 1.00 52.41 C ATOM 1155 C LEU A 432 27.861 15.760 -12.994 1.00 14.12 C ATOM 1156 O LEU A 432 27.916 14.740 -12.304 1.00 1.42 O ATOM 1157 CB LEU A 432 29.062 17.528 -11.685 1.00 34.14 C ATOM 1158 CG LEU A 432 30.305 17.535 -12.586 1.00 54.23 C ATOM 1159 CD1 LEU A 432 30.163 18.557 -13.708 1.00 75.14 C ATOM 1160 CD2 LEU A 432 31.551 17.810 -11.766 1.00 41.22 C ATOM 0 H LEU A 432 26.719 16.489 -10.642 1.00 42.23 H new ATOM 0 HA LEU A 432 27.491 17.845 -13.140 1.00 52.41 H new ATOM 0 HB2 LEU A 432 28.948 18.523 -11.255 1.00 34.14 H new ATOM 0 HB3 LEU A 432 29.245 16.842 -10.858 1.00 34.14 H new ATOM 0 HG LEU A 432 30.400 16.549 -13.041 1.00 54.23 H new ATOM 0 HD11 LEU A 432 31.058 18.540 -14.331 1.00 75.14 H new ATOM 0 HD12 LEU A 432 29.293 18.311 -14.316 1.00 75.14 H new ATOM 0 HD13 LEU A 432 30.037 19.552 -13.280 1.00 75.14 H new ATOM 0 HD21 LEU A 432 32.424 17.812 -12.419 1.00 41.22 H new ATOM 0 HD22 LEU A 432 31.460 18.781 -11.280 1.00 41.22 H new ATOM 0 HD23 LEU A 432 31.666 17.035 -11.008 1.00 41.22 H new ATOM 1172 N GLU A 433 27.882 15.735 -14.308 1.00 2.43 N ATOM 1173 CA GLU A 433 28.152 14.520 -15.046 1.00 1.30 C ATOM 1174 C GLU A 433 29.663 14.331 -15.090 1.00 10.23 C ATOM 1175 O GLU A 433 30.354 14.974 -15.878 1.00 14.33 O ATOM 1176 CB GLU A 433 27.586 14.616 -16.472 1.00 13.12 C ATOM 1177 CG GLU A 433 27.837 13.388 -17.354 1.00 31.24 C ATOM 1178 CD GLU A 433 27.297 13.579 -18.753 1.00 13.00 C ATOM 1179 OE1 GLU A 433 26.078 13.414 -18.962 1.00 50.24 O ATOM 1180 OE2 GLU A 433 28.081 13.921 -19.666 1.00 21.04 O ATOM 0 H GLU A 433 27.713 16.553 -14.894 1.00 2.43 H new ATOM 0 HA GLU A 433 27.675 13.670 -14.558 1.00 1.30 H new ATOM 0 HB2 GLU A 433 26.511 14.786 -16.409 1.00 13.12 H new ATOM 0 HB3 GLU A 433 28.018 15.489 -16.960 1.00 13.12 H new ATOM 0 HG2 GLU A 433 28.907 13.188 -17.402 1.00 31.24 H new ATOM 0 HG3 GLU A 433 27.370 12.514 -16.901 1.00 31.24 H new ATOM 1187 N ALA A 434 30.172 13.521 -14.199 1.00 43.25 N ATOM 1188 CA ALA A 434 31.608 13.288 -14.124 1.00 51.21 C ATOM 1189 C ALA A 434 31.944 11.836 -14.381 1.00 24.14 C ATOM 1190 O ALA A 434 33.063 11.498 -14.765 1.00 63.14 O ATOM 1191 CB ALA A 434 32.137 13.717 -12.771 1.00 62.11 C ATOM 0 H ALA A 434 29.622 13.007 -13.511 1.00 43.25 H new ATOM 0 HA ALA A 434 32.087 13.885 -14.900 1.00 51.21 H new ATOM 0 HB1 ALA A 434 33.211 13.538 -12.727 1.00 62.11 H new ATOM 0 HB2 ALA A 434 31.940 14.779 -12.623 1.00 62.11 H new ATOM 0 HB3 ALA A 434 31.641 13.143 -11.988 1.00 62.11 H new ATOM 1197 N GLN A 435 30.981 10.979 -14.168 1.00 51.13 N ATOM 1198 CA GLN A 435 31.172 9.570 -14.378 1.00 43.01 C ATOM 1199 C GLN A 435 30.246 9.097 -15.469 1.00 42.01 C ATOM 1200 O GLN A 435 29.427 9.878 -15.937 1.00 31.14 O ATOM 1201 CB GLN A 435 30.974 8.782 -13.076 1.00 42.42 C ATOM 1202 CG GLN A 435 31.998 9.115 -12.001 1.00 12.34 C ATOM 1203 CD GLN A 435 31.820 8.297 -10.735 1.00 43.51 C ATOM 1204 OE1 GLN A 435 32.387 7.205 -10.598 1.00 55.23 O ATOM 1205 NE2 GLN A 435 31.064 8.810 -9.809 1.00 12.41 N ATOM 0 H GLN A 435 30.048 11.236 -13.846 1.00 51.13 H new ATOM 0 HA GLN A 435 32.199 9.391 -14.695 1.00 43.01 H new ATOM 0 HB2 GLN A 435 29.975 8.982 -12.689 1.00 42.42 H new ATOM 0 HB3 GLN A 435 31.024 7.715 -13.295 1.00 42.42 H new ATOM 0 HG2 GLN A 435 32.999 8.947 -12.397 1.00 12.34 H new ATOM 0 HG3 GLN A 435 31.926 10.174 -11.755 1.00 12.34 H new ATOM 0 HE21 GLN A 435 30.614 9.713 -9.960 1.00 12.41 H new ATOM 0 HE22 GLN A 435 30.921 8.309 -8.932 1.00 12.41 H new ATOM 1214 N LYS A 436 30.387 7.828 -15.856 1.00 70.21 N ATOM 1215 CA LYS A 436 29.629 7.169 -16.956 1.00 63.42 C ATOM 1216 C LYS A 436 28.097 7.427 -16.980 1.00 41.31 C ATOM 1217 O LYS A 436 27.304 6.602 -16.562 1.00 52.32 O ATOM 1218 CB LYS A 436 30.007 5.650 -17.056 1.00 12.42 C ATOM 1219 CG LYS A 436 30.055 4.858 -15.696 1.00 43.10 C ATOM 1220 CD LYS A 436 28.706 4.799 -14.975 1.00 62.04 C ATOM 1221 CE LYS A 436 28.769 4.092 -13.644 1.00 44.14 C ATOM 1222 NZ LYS A 436 27.441 4.080 -12.966 1.00 5.02 N ATOM 0 H LYS A 436 31.051 7.198 -15.406 1.00 70.21 H new ATOM 0 HA LYS A 436 29.956 7.667 -17.869 1.00 63.42 H new ATOM 0 HB2 LYS A 436 29.289 5.160 -17.713 1.00 12.42 H new ATOM 0 HB3 LYS A 436 30.983 5.570 -17.534 1.00 12.42 H new ATOM 0 HG2 LYS A 436 30.400 3.842 -15.889 1.00 43.10 H new ATOM 0 HG3 LYS A 436 30.789 5.324 -15.039 1.00 43.10 H new ATOM 0 HD2 LYS A 436 28.339 5.814 -14.822 1.00 62.04 H new ATOM 0 HD3 LYS A 436 27.983 4.292 -15.614 1.00 62.04 H new ATOM 0 HE2 LYS A 436 29.112 3.068 -13.791 1.00 44.14 H new ATOM 0 HE3 LYS A 436 29.501 4.585 -13.004 1.00 44.14 H new ATOM 0 HZ1 LYS A 436 27.417 3.315 -12.262 1.00 5.02 H new ATOM 0 HZ2 LYS A 436 27.285 4.992 -12.491 1.00 5.02 H new ATOM 0 HZ3 LYS A 436 26.693 3.925 -13.671 1.00 5.02 H new ATOM 1236 N CYS A 437 27.704 8.600 -17.468 1.00 31.42 N ATOM 1237 CA CYS A 437 26.312 9.028 -17.459 1.00 4.11 C ATOM 1238 C CYS A 437 25.763 8.991 -16.027 1.00 64.31 C ATOM 1239 O CYS A 437 24.554 8.881 -15.803 1.00 2.11 O ATOM 1240 CB CYS A 437 25.471 8.171 -18.416 1.00 63.13 C ATOM 1241 SG CYS A 437 25.992 8.305 -20.168 1.00 62.12 S ATOM 0 H CYS A 437 28.343 9.280 -17.881 1.00 31.42 H new ATOM 0 HA CYS A 437 26.253 10.056 -17.816 1.00 4.11 H new ATOM 0 HB2 CYS A 437 25.532 7.128 -18.106 1.00 63.13 H new ATOM 0 HB3 CYS A 437 24.425 8.467 -18.333 1.00 63.13 H new ATOM 1246 N GLU A 438 26.673 9.119 -15.063 1.00 30.10 N ATOM 1247 CA GLU A 438 26.319 9.113 -13.685 1.00 4.05 C ATOM 1248 C GLU A 438 26.464 10.508 -13.162 1.00 2.51 C ATOM 1249 O GLU A 438 27.555 11.115 -13.222 1.00 22.51 O ATOM 1250 CB GLU A 438 27.155 8.112 -12.883 1.00 40.34 C ATOM 1251 CG GLU A 438 26.723 7.988 -11.426 1.00 20.31 C ATOM 1252 CD GLU A 438 27.473 6.910 -10.682 1.00 31.30 C ATOM 1253 OE1 GLU A 438 27.039 5.733 -10.700 1.00 34.44 O ATOM 1254 OE2 GLU A 438 28.506 7.206 -10.081 1.00 63.00 O ATOM 0 H GLU A 438 27.672 9.229 -15.238 1.00 30.10 H new ATOM 0 HA GLU A 438 25.285 8.786 -13.574 1.00 4.05 H new ATOM 0 HB2 GLU A 438 27.089 7.133 -13.358 1.00 40.34 H new ATOM 0 HB3 GLU A 438 28.202 8.414 -12.919 1.00 40.34 H new ATOM 0 HG2 GLU A 438 26.877 8.943 -10.924 1.00 20.31 H new ATOM 0 HG3 GLU A 438 25.655 7.775 -11.386 1.00 20.31 H new ATOM 1261 N TYR A 439 25.384 11.015 -12.687 1.00 62.20 N ATOM 1262 CA TYR A 439 25.288 12.370 -12.272 1.00 33.42 C ATOM 1263 C TYR A 439 25.497 12.509 -10.790 1.00 45.33 C ATOM 1264 O TYR A 439 24.810 11.874 -9.981 1.00 22.11 O ATOM 1265 CB TYR A 439 23.944 12.945 -12.725 1.00 20.11 C ATOM 1266 CG TYR A 439 23.802 12.945 -14.237 1.00 24.20 C ATOM 1267 CD1 TYR A 439 23.404 11.796 -14.928 1.00 72.31 C ATOM 1268 CD2 TYR A 439 24.085 14.078 -14.974 1.00 13.25 C ATOM 1269 CE1 TYR A 439 23.293 11.792 -16.292 1.00 62.44 C ATOM 1270 CE2 TYR A 439 23.977 14.073 -16.346 1.00 63.32 C ATOM 1271 CZ TYR A 439 23.580 12.924 -16.995 1.00 71.43 C ATOM 1272 OH TYR A 439 23.481 12.910 -18.357 1.00 23.51 O ATOM 0 H TYR A 439 24.519 10.486 -12.573 1.00 62.20 H new ATOM 0 HA TYR A 439 26.084 12.946 -12.744 1.00 33.42 H new ATOM 0 HB2 TYR A 439 23.134 12.362 -12.285 1.00 20.11 H new ATOM 0 HB3 TYR A 439 23.842 13.964 -12.352 1.00 20.11 H new ATOM 0 HD1 TYR A 439 23.180 10.896 -14.375 1.00 72.31 H new ATOM 0 HD2 TYR A 439 24.395 14.980 -14.467 1.00 13.25 H new ATOM 0 HE1 TYR A 439 22.980 10.897 -16.809 1.00 62.44 H new ATOM 0 HE2 TYR A 439 24.202 14.965 -16.911 1.00 63.32 H new ATOM 0 HH TYR A 439 24.343 13.161 -18.750 1.00 23.51 H new ATOM 1282 N LEU A 440 26.455 13.326 -10.452 1.00 11.02 N ATOM 1283 CA LEU A 440 26.822 13.602 -9.074 1.00 4.53 C ATOM 1284 C LEU A 440 25.851 14.614 -8.547 1.00 24.11 C ATOM 1285 O LEU A 440 25.781 15.715 -9.074 1.00 52.51 O ATOM 1286 CB LEU A 440 28.230 14.225 -8.998 1.00 34.14 C ATOM 1287 CG LEU A 440 29.398 13.455 -9.620 1.00 13.14 C ATOM 1288 CD1 LEU A 440 30.673 14.264 -9.477 1.00 2.32 C ATOM 1289 CD2 LEU A 440 29.570 12.095 -8.971 1.00 11.21 C ATOM 0 H LEU A 440 27.019 13.833 -11.134 1.00 11.02 H new ATOM 0 HA LEU A 440 26.809 12.674 -8.503 1.00 4.53 H new ATOM 0 HB2 LEU A 440 28.186 15.205 -9.474 1.00 34.14 H new ATOM 0 HB3 LEU A 440 28.464 14.392 -7.946 1.00 34.14 H new ATOM 0 HG LEU A 440 29.181 13.296 -10.676 1.00 13.14 H new ATOM 0 HD11 LEU A 440 31.504 13.715 -9.920 1.00 2.32 H new ATOM 0 HD12 LEU A 440 30.556 15.220 -9.987 1.00 2.32 H new ATOM 0 HD13 LEU A 440 30.876 14.439 -8.421 1.00 2.32 H new ATOM 0 HD21 LEU A 440 30.407 11.574 -9.435 1.00 11.21 H new ATOM 0 HD22 LEU A 440 29.767 12.222 -7.906 1.00 11.21 H new ATOM 0 HD23 LEU A 440 28.660 11.510 -9.104 1.00 11.21 H new ATOM 1301 N ILE A 441 25.104 14.263 -7.550 1.00 32.13 N ATOM 1302 CA ILE A 441 24.120 15.160 -7.026 1.00 73.12 C ATOM 1303 C ILE A 441 24.489 15.537 -5.608 1.00 63.23 C ATOM 1304 O ILE A 441 24.748 14.673 -4.773 1.00 31.21 O ATOM 1305 CB ILE A 441 22.712 14.517 -7.014 1.00 21.22 C ATOM 1306 CG1 ILE A 441 22.408 13.878 -8.374 1.00 45.05 C ATOM 1307 CG2 ILE A 441 21.646 15.555 -6.643 1.00 73.12 C ATOM 1308 CD1 ILE A 441 21.026 13.282 -8.504 1.00 5.42 C ATOM 0 H ILE A 441 25.155 13.359 -7.080 1.00 32.13 H new ATOM 0 HA ILE A 441 24.096 16.040 -7.668 1.00 73.12 H new ATOM 0 HB ILE A 441 22.693 13.733 -6.257 1.00 21.22 H new ATOM 0 HG12 ILE A 441 22.536 14.633 -9.150 1.00 45.05 H new ATOM 0 HG13 ILE A 441 23.144 13.097 -8.564 1.00 45.05 H new ATOM 0 HG21 ILE A 441 20.664 15.083 -6.640 1.00 73.12 H new ATOM 0 HG22 ILE A 441 21.858 15.956 -5.652 1.00 73.12 H new ATOM 0 HG23 ILE A 441 21.657 16.365 -7.373 1.00 73.12 H new ATOM 0 HD11 ILE A 441 20.906 12.855 -9.500 1.00 5.42 H new ATOM 0 HD12 ILE A 441 20.895 12.500 -7.756 1.00 5.42 H new ATOM 0 HD13 ILE A 441 20.278 14.060 -8.351 1.00 5.42 H new ATOM 1320 N LYS A 442 24.536 16.800 -5.352 1.00 73.05 N ATOM 1321 CA LYS A 442 24.785 17.301 -4.032 1.00 61.24 C ATOM 1322 C LYS A 442 23.550 17.855 -3.417 1.00 64.51 C ATOM 1323 O LYS A 442 22.801 18.582 -4.055 1.00 0.21 O ATOM 1324 CB LYS A 442 25.860 18.376 -4.021 1.00 21.43 C ATOM 1325 CG LYS A 442 27.276 17.877 -4.050 1.00 23.44 C ATOM 1326 CD LYS A 442 27.559 17.026 -2.820 1.00 21.43 C ATOM 1327 CE LYS A 442 29.033 16.750 -2.658 1.00 3.04 C ATOM 1328 NZ LYS A 442 29.782 18.000 -2.413 1.00 5.40 N ATOM 0 H LYS A 442 24.402 17.526 -6.056 1.00 73.05 H new ATOM 0 HA LYS A 442 25.132 16.448 -3.448 1.00 61.24 H new ATOM 0 HB2 LYS A 442 25.706 19.028 -4.881 1.00 21.43 H new ATOM 0 HB3 LYS A 442 25.727 18.988 -3.129 1.00 21.43 H new ATOM 0 HG2 LYS A 442 27.444 17.291 -4.953 1.00 23.44 H new ATOM 0 HG3 LYS A 442 27.966 18.720 -4.084 1.00 23.44 H new ATOM 0 HD2 LYS A 442 27.185 17.535 -1.932 1.00 21.43 H new ATOM 0 HD3 LYS A 442 27.019 16.083 -2.898 1.00 21.43 H new ATOM 0 HE2 LYS A 442 29.188 16.060 -1.828 1.00 3.04 H new ATOM 0 HE3 LYS A 442 29.416 16.262 -3.554 1.00 3.04 H new ATOM 0 HZ1 LYS A 442 30.706 17.774 -1.993 1.00 5.40 H new ATOM 0 HZ2 LYS A 442 29.923 18.502 -3.313 1.00 5.40 H new ATOM 0 HZ3 LYS A 442 29.244 18.605 -1.760 1.00 5.40 H new ATOM 1342 N MET A 443 23.336 17.511 -2.189 1.00 43.43 N ATOM 1343 CA MET A 443 22.271 18.058 -1.415 1.00 74.13 C ATOM 1344 C MET A 443 22.747 18.288 -0.038 1.00 65.21 C ATOM 1345 O MET A 443 23.786 17.768 0.375 1.00 31.14 O ATOM 1346 CB MET A 443 21.017 17.165 -1.345 1.00 30.11 C ATOM 1347 CG MET A 443 20.219 17.030 -2.620 1.00 63.33 C ATOM 1348 SD MET A 443 18.664 16.142 -2.360 1.00 25.04 S ATOM 1349 CE MET A 443 17.842 17.213 -1.155 1.00 63.43 C ATOM 0 H MET A 443 23.906 16.830 -1.687 1.00 43.43 H new ATOM 0 HA MET A 443 21.978 18.982 -1.914 1.00 74.13 H new ATOM 0 HB2 MET A 443 21.324 16.169 -1.027 1.00 30.11 H new ATOM 0 HB3 MET A 443 20.359 17.559 -0.570 1.00 30.11 H new ATOM 0 HG2 MET A 443 20.007 18.021 -3.021 1.00 63.33 H new ATOM 0 HG3 MET A 443 20.815 16.505 -3.366 1.00 63.33 H new ATOM 0 HE1 MET A 443 16.807 16.895 -1.032 1.00 63.43 H new ATOM 0 HE2 MET A 443 18.358 17.147 -0.197 1.00 63.43 H new ATOM 0 HE3 MET A 443 17.865 18.244 -1.509 1.00 63.43 H new ATOM 1359 N LYS A 444 22.026 19.056 0.658 1.00 12.34 N ATOM 1360 CA LYS A 444 22.255 19.269 2.025 1.00 65.24 C ATOM 1361 C LYS A 444 20.913 19.416 2.651 1.00 23.05 C ATOM 1362 O LYS A 444 19.977 19.850 1.975 1.00 32.31 O ATOM 1363 CB LYS A 444 23.143 20.493 2.266 1.00 51.31 C ATOM 1364 CG LYS A 444 22.603 21.802 1.788 1.00 55.24 C ATOM 1365 CD LYS A 444 23.648 22.855 1.984 1.00 41.24 C ATOM 1366 CE LYS A 444 23.089 24.247 1.750 1.00 11.12 C ATOM 1367 NZ LYS A 444 24.109 25.299 1.934 1.00 21.52 N ATOM 0 H LYS A 444 21.231 19.574 0.284 1.00 12.34 H new ATOM 0 HA LYS A 444 22.798 18.434 2.469 1.00 65.24 H new ATOM 0 HB2 LYS A 444 23.336 20.572 3.336 1.00 51.31 H new ATOM 0 HB3 LYS A 444 24.104 20.321 1.781 1.00 51.31 H new ATOM 0 HG2 LYS A 444 22.327 21.735 0.736 1.00 55.24 H new ATOM 0 HG3 LYS A 444 21.698 22.061 2.338 1.00 55.24 H new ATOM 0 HD2 LYS A 444 24.048 22.788 2.996 1.00 41.24 H new ATOM 0 HD3 LYS A 444 24.478 22.676 1.301 1.00 41.24 H new ATOM 0 HE2 LYS A 444 22.685 24.309 0.740 1.00 11.12 H new ATOM 0 HE3 LYS A 444 22.260 24.423 2.436 1.00 11.12 H new ATOM 0 HZ1 LYS A 444 23.681 26.231 1.764 1.00 21.52 H new ATOM 0 HZ2 LYS A 444 24.477 25.259 2.906 1.00 21.52 H new ATOM 0 HZ3 LYS A 444 24.888 25.148 1.262 1.00 21.52 H new ATOM 1381 N SER A 445 20.787 18.993 3.877 1.00 54.23 N ATOM 1382 CA SER A 445 19.545 19.068 4.582 1.00 63.01 C ATOM 1383 C SER A 445 19.799 18.802 6.053 1.00 60.42 C ATOM 1384 O SER A 445 20.770 18.106 6.398 1.00 34.10 O ATOM 1385 CB SER A 445 18.568 18.036 4.009 1.00 42.32 C ATOM 1386 OG SER A 445 19.098 16.724 4.090 1.00 50.31 O ATOM 0 H SER A 445 21.550 18.584 4.416 1.00 54.23 H new ATOM 0 HA SER A 445 19.107 20.060 4.468 1.00 63.01 H new ATOM 0 HB2 SER A 445 17.625 18.084 4.553 1.00 42.32 H new ATOM 0 HB3 SER A 445 18.348 18.278 2.969 1.00 42.32 H new ATOM 0 HG SER A 445 18.452 16.087 3.719 1.00 50.31 H new ATOM 1392 N PRO A 446 18.985 19.370 6.947 1.00 2.02 N ATOM 1393 CA PRO A 446 19.124 19.144 8.384 1.00 62.32 C ATOM 1394 C PRO A 446 18.734 17.714 8.793 1.00 54.43 C ATOM 1395 O PRO A 446 19.286 17.159 9.747 1.00 42.22 O ATOM 1396 CB PRO A 446 18.156 20.161 9.000 1.00 74.23 C ATOM 1397 CG PRO A 446 17.146 20.408 7.938 1.00 32.41 C ATOM 1398 CD PRO A 446 17.891 20.327 6.642 1.00 34.13 C ATOM 0 HA PRO A 446 20.155 19.262 8.716 1.00 62.32 H new ATOM 0 HB2 PRO A 446 17.692 19.769 9.905 1.00 74.23 H new ATOM 0 HB3 PRO A 446 18.671 21.080 9.279 1.00 74.23 H new ATOM 0 HG2 PRO A 446 16.348 19.667 7.977 1.00 32.41 H new ATOM 0 HG3 PRO A 446 16.680 21.386 8.061 1.00 32.41 H new ATOM 0 HD2 PRO A 446 17.255 19.969 5.832 1.00 34.13 H new ATOM 0 HD3 PRO A 446 18.278 21.299 6.337 1.00 34.13 H new ATOM 1406 N ALA A 447 17.822 17.108 8.046 1.00 1.44 N ATOM 1407 CA ALA A 447 17.347 15.779 8.372 1.00 3.43 C ATOM 1408 C ALA A 447 18.353 14.697 8.022 1.00 43.11 C ATOM 1409 O ALA A 447 18.435 13.684 8.700 1.00 11.41 O ATOM 1410 CB ALA A 447 16.021 15.497 7.710 1.00 51.30 C ATOM 0 H ALA A 447 17.400 17.518 7.213 1.00 1.44 H new ATOM 0 HA ALA A 447 17.212 15.757 9.453 1.00 3.43 H new ATOM 0 HB1 ALA A 447 15.689 14.492 7.973 1.00 51.30 H new ATOM 0 HB2 ALA A 447 15.283 16.223 8.050 1.00 51.30 H new ATOM 0 HB3 ALA A 447 16.131 15.571 6.628 1.00 51.30 H new ATOM 1416 N ALA A 448 19.154 14.920 6.997 1.00 24.35 N ATOM 1417 CA ALA A 448 20.093 13.905 6.562 1.00 53.52 C ATOM 1418 C ALA A 448 21.410 14.134 7.240 1.00 54.32 C ATOM 1419 O ALA A 448 22.367 13.392 7.062 1.00 74.44 O ATOM 1420 CB ALA A 448 20.246 13.927 5.062 1.00 64.33 C ATOM 0 H ALA A 448 19.174 15.784 6.456 1.00 24.35 H new ATOM 0 HA ALA A 448 19.716 12.920 6.837 1.00 53.52 H new ATOM 0 HB1 ALA A 448 20.955 13.157 4.757 1.00 64.33 H new ATOM 0 HB2 ALA A 448 19.280 13.736 4.595 1.00 64.33 H new ATOM 0 HB3 ALA A 448 20.614 14.904 4.748 1.00 64.33 H new ATOM 1426 N CYS A 449 21.446 15.188 8.014 1.00 32.14 N ATOM 1427 CA CYS A 449 22.612 15.572 8.755 1.00 62.13 C ATOM 1428 C CYS A 449 22.829 14.578 9.888 1.00 23.03 C ATOM 1429 O CYS A 449 23.958 14.336 10.316 1.00 74.10 O ATOM 1430 CB CYS A 449 22.398 16.974 9.301 1.00 24.43 C ATOM 1431 SG CYS A 449 23.874 17.792 9.947 1.00 60.21 S ATOM 0 H CYS A 449 20.650 15.812 8.147 1.00 32.14 H new ATOM 0 HA CYS A 449 23.495 15.570 8.116 1.00 62.13 H new ATOM 0 HB2 CYS A 449 21.978 17.593 8.508 1.00 24.43 H new ATOM 0 HB3 CYS A 449 21.654 16.926 10.096 1.00 24.43 H new ATOM 1436 N SER A 450 21.740 13.988 10.339 1.00 61.20 N ATOM 1437 CA SER A 450 21.776 13.000 11.362 1.00 23.52 C ATOM 1438 C SER A 450 21.756 11.610 10.701 1.00 25.02 C ATOM 1439 O SER A 450 20.654 11.060 10.455 1.00 38.30 O ATOM 1440 CB SER A 450 20.569 13.189 12.279 1.00 12.22 C ATOM 1441 OG SER A 450 20.516 14.532 12.778 1.00 31.22 O ATOM 1442 OXT SER A 450 22.842 11.079 10.384 1.00 38.30 O ATOM 0 H SER A 450 20.803 14.193 9.992 1.00 61.20 H new ATOM 0 HA SER A 450 22.682 13.093 11.961 1.00 23.52 H new ATOM 0 HB2 SER A 450 19.653 12.962 11.734 1.00 12.22 H new ATOM 0 HB3 SER A 450 20.626 12.488 13.112 1.00 12.22 H new ATOM 0 HG SER A 450 19.735 14.634 13.362 1.00 31.22 H new TER 1448 SER A 450