USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=20 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 138:sc= 1.39 USER MOD Set 1.2: A 436 LYS NZ :NH3+ 156:sc= 0.724 (180deg=0.00241) USER MOD Set 2.1: A 374 TYR OH : rot -119:sc= -0.35 USER MOD Set 2.2: A 384 GLN : amide:sc= -5.4! C(o=-5.8!,f=-4.6!) USER MOD Set 3.1: A 381 ASN : amide:sc= 0.57 K(o=-1.5,f=-4.6!) USER MOD Set 3.2: A 391 ASN : amide:sc= -2.08! K(o=-1.5!,f=-4.6) USER MOD Set 4.1: A 365 THR OG1 : rot 164:sc=-0.00675 USER MOD Set 4.2: A 443 MET CE :methyl 164:sc= -0.269 (180deg=-0.928) USER MOD Single : A 357 TYR OH : rot 180:sc= 0 USER MOD Single : A 361 LYS NZ :NH3+ -127:sc= 1.23 (180deg=0.611) USER MOD Single : A 363 MET CE :methyl 180:sc= 0 (180deg=0) 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 180:sc= 0 USER MOD Single : A 375 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 379 TYR OH : rot 180:sc= 0 USER MOD Single : A 386 SER OG : rot -31:sc= 0.333 USER MOD Single : A 394 SER OG : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= -0.131 K(o=-0.13,f=-0.82) USER MOD Single : A 398 ASN : amide:sc= -1.02 K(o=-1,f=0.59) USER MOD Single : A 401 LYS NZ :NH3+ -164:sc= 1.8 (180deg=1.11) USER MOD Single : A 402 TYR OH : rot 36:sc= 0.407 USER MOD Single : A 404 ASN : amide:sc= -0.004 X(o=-0.004,f=0) USER MOD Single : A 406 GLN : amide:sc= -0.405 K(o=-0.41,f=-2.2) USER MOD Single : A 407 SER OG : rot 180:sc= 0 USER MOD Single : A 410 ASN : amide:sc= -0.361 K(o=-0.36,f=-2.1!) USER MOD Single : A 413 HIS : no HD1:sc= 0 X(o=0,f=-0.0025) USER MOD Single : A 419 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 ASN : amide:sc= -4.12! C(o=-4.1!,f=-3.4!) USER MOD Single : A 430 SER OG : rot 180:sc= 0 USER MOD Single : A 435 GLN : amide:sc= -1.1 K(o=-1.1,f=-0.0022) USER MOD Single : A 439 TYR OH : rot 60:sc= 1.24 USER MOD Single : A 442 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 SER OG : rot 180:sc= -0.0355 USER MOD Single : A 450 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 357 1.842 3.360 -5.189 1.00 31.20 N ATOM 2 CA TYR A 357 3.062 3.530 -4.415 1.00 34.22 C ATOM 3 C TYR A 357 3.751 2.214 -4.161 1.00 74.52 C ATOM 4 O TYR A 357 3.298 1.414 -3.350 1.00 10.12 O ATOM 5 CB TYR A 357 2.814 4.253 -3.079 1.00 60.23 C ATOM 6 CG TYR A 357 2.516 5.729 -3.194 1.00 43.12 C ATOM 7 CD1 TYR A 357 3.553 6.650 -3.222 1.00 44.01 C ATOM 8 CD2 TYR A 357 1.216 6.206 -3.262 1.00 53.34 C ATOM 9 CE1 TYR A 357 3.306 8.000 -3.314 1.00 42.52 C ATOM 10 CE2 TYR A 357 0.959 7.558 -3.358 1.00 15.04 C ATOM 11 CZ TYR A 357 2.009 8.450 -3.384 1.00 21.34 C ATOM 12 OH TYR A 357 1.760 9.804 -3.473 1.00 34.14 O ATOM 0 HA TYR A 357 3.715 4.157 -5.022 1.00 34.22 H new ATOM 0 HB2 TYR A 357 1.980 3.768 -2.571 1.00 60.23 H new ATOM 0 HB3 TYR A 357 3.692 4.124 -2.446 1.00 60.23 H new ATOM 0 HD1 TYR A 357 4.574 6.300 -3.171 1.00 44.01 H new ATOM 0 HD2 TYR A 357 0.392 5.508 -3.239 1.00 53.34 H new ATOM 0 HE1 TYR A 357 4.126 8.702 -3.331 1.00 42.52 H new ATOM 0 HE2 TYR A 357 -0.059 7.915 -3.412 1.00 15.04 H new ATOM 0 HH TYR A 357 0.793 9.957 -3.515 1.00 34.14 H new ATOM 24 N ARG A 358 4.839 1.985 -4.861 1.00 32.22 N ATOM 25 CA ARG A 358 5.660 0.802 -4.647 1.00 53.43 C ATOM 26 C ARG A 358 6.549 1.035 -3.447 1.00 72.43 C ATOM 27 O ARG A 358 7.005 0.099 -2.795 1.00 32.21 O ATOM 28 CB ARG A 358 6.522 0.522 -5.868 1.00 31.15 C ATOM 29 CG ARG A 358 5.753 0.141 -7.110 1.00 60.02 C ATOM 30 CD ARG A 358 6.690 -0.068 -8.284 1.00 1.43 C ATOM 31 NE ARG A 358 7.725 -1.069 -8.006 1.00 50.14 N ATOM 32 CZ ARG A 358 8.620 -1.508 -8.891 1.00 15.33 C ATOM 33 NH1 ARG A 358 8.586 -1.074 -10.144 1.00 43.51 N ATOM 34 NH2 ARG A 358 9.552 -2.377 -8.516 1.00 63.30 N ATOM 0 H ARG A 358 5.183 2.607 -5.593 1.00 32.22 H new ATOM 0 HA ARG A 358 5.011 -0.057 -4.476 1.00 53.43 H new ATOM 0 HB2 ARG A 358 7.120 1.408 -6.085 1.00 31.15 H new ATOM 0 HB3 ARG A 358 7.218 -0.281 -5.628 1.00 31.15 H new ATOM 0 HG2 ARG A 358 5.186 -0.771 -6.926 1.00 60.02 H new ATOM 0 HG3 ARG A 358 5.032 0.922 -7.350 1.00 60.02 H new ATOM 0 HD2 ARG A 358 6.113 -0.379 -9.154 1.00 1.43 H new ATOM 0 HD3 ARG A 358 7.165 0.880 -8.539 1.00 1.43 H new ATOM 0 HE ARG A 358 7.763 -1.459 -7.064 1.00 50.14 H new ATOM 0 HH11 ARG A 358 7.874 -0.403 -10.432 1.00 43.51 H new ATOM 0 HH12 ARG A 358 9.272 -1.411 -10.819 1.00 43.51 H new ATOM 0 HH21 ARG A 358 9.582 -2.708 -7.552 1.00 63.30 H new ATOM 0 HH22 ARG A 358 10.237 -2.714 -9.192 1.00 63.30 H new ATOM 48 N ALA A 359 6.786 2.292 -3.181 1.00 3.40 N ATOM 49 CA ALA A 359 7.565 2.737 -2.067 1.00 14.02 C ATOM 50 C ALA A 359 6.924 4.003 -1.549 1.00 12.23 C ATOM 51 O ALA A 359 5.775 4.300 -1.898 1.00 70.32 O ATOM 52 CB ALA A 359 8.996 3.001 -2.502 1.00 41.23 C ATOM 0 H ALA A 359 6.428 3.055 -3.755 1.00 3.40 H new ATOM 0 HA ALA A 359 7.594 1.978 -1.285 1.00 14.02 H new ATOM 0 HB1 ALA A 359 9.580 3.339 -1.646 1.00 41.23 H new ATOM 0 HB2 ALA A 359 9.431 2.083 -2.898 1.00 41.23 H new ATOM 0 HB3 ALA A 359 9.005 3.770 -3.274 1.00 41.23 H new ATOM 58 N ILE A 360 7.611 4.724 -0.723 1.00 55.32 N ATOM 59 CA ILE A 360 7.088 5.953 -0.204 1.00 15.41 C ATOM 60 C ILE A 360 7.949 7.118 -0.687 1.00 63.14 C ATOM 61 O ILE A 360 9.182 7.020 -0.719 1.00 1.01 O ATOM 62 CB ILE A 360 6.997 5.927 1.364 1.00 65.34 C ATOM 63 CG1 ILE A 360 6.424 7.241 1.926 1.00 52.24 C ATOM 64 CG2 ILE A 360 8.346 5.605 2.006 1.00 22.45 C ATOM 65 CD1 ILE A 360 5.009 7.544 1.479 1.00 23.02 C ATOM 0 H ILE A 360 8.544 4.483 -0.389 1.00 55.32 H new ATOM 0 HA ILE A 360 6.072 6.083 -0.577 1.00 15.41 H new ATOM 0 HB ILE A 360 6.306 5.125 1.623 1.00 65.34 H new ATOM 0 HG12 ILE A 360 6.447 7.198 3.015 1.00 52.24 H new ATOM 0 HG13 ILE A 360 7.072 8.064 1.626 1.00 52.24 H new ATOM 0 HG21 ILE A 360 8.240 5.597 3.091 1.00 22.45 H new ATOM 0 HG22 ILE A 360 8.686 4.626 1.667 1.00 22.45 H new ATOM 0 HG23 ILE A 360 9.076 6.362 1.719 1.00 22.45 H new ATOM 0 HD11 ILE A 360 4.682 8.486 1.920 1.00 23.02 H new ATOM 0 HD12 ILE A 360 4.980 7.622 0.392 1.00 23.02 H new ATOM 0 HD13 ILE A 360 4.345 6.742 1.803 1.00 23.02 H new ATOM 77 N LYS A 361 7.310 8.190 -1.102 1.00 53.42 N ATOM 78 CA LYS A 361 8.032 9.361 -1.516 1.00 15.00 C ATOM 79 C LYS A 361 8.461 10.133 -0.283 1.00 42.31 C ATOM 80 O LYS A 361 7.677 10.297 0.660 1.00 63.10 O ATOM 81 CB LYS A 361 7.200 10.252 -2.471 1.00 11.24 C ATOM 82 CG LYS A 361 5.904 10.819 -1.887 1.00 51.12 C ATOM 83 CD LYS A 361 5.157 11.700 -2.900 1.00 22.24 C ATOM 84 CE LYS A 361 5.994 12.900 -3.353 1.00 51.24 C ATOM 85 NZ LYS A 361 5.269 13.756 -4.328 1.00 11.14 N ATOM 0 H LYS A 361 6.295 8.270 -1.160 1.00 53.42 H new ATOM 0 HA LYS A 361 8.911 9.048 -2.079 1.00 15.00 H new ATOM 0 HB2 LYS A 361 7.824 11.084 -2.799 1.00 11.24 H new ATOM 0 HB3 LYS A 361 6.953 9.670 -3.359 1.00 11.24 H new ATOM 0 HG2 LYS A 361 5.258 9.999 -1.573 1.00 51.12 H new ATOM 0 HG3 LYS A 361 6.133 11.404 -0.996 1.00 51.12 H new ATOM 0 HD2 LYS A 361 4.885 11.101 -3.769 1.00 22.24 H new ATOM 0 HD3 LYS A 361 4.228 12.055 -2.454 1.00 22.24 H new ATOM 0 HE2 LYS A 361 6.270 13.497 -2.484 1.00 51.24 H new ATOM 0 HE3 LYS A 361 6.921 12.545 -3.803 1.00 51.24 H new ATOM 0 HZ1 LYS A 361 5.856 13.891 -5.176 1.00 11.14 H new ATOM 0 HZ2 LYS A 361 4.375 13.297 -4.596 1.00 11.14 H new ATOM 0 HZ3 LYS A 361 5.067 14.680 -3.896 1.00 11.14 H new ATOM 99 N GLY A 362 9.689 10.572 -0.269 1.00 2.13 N ATOM 100 CA GLY A 362 10.176 11.275 0.876 1.00 62.34 C ATOM 101 C GLY A 362 10.317 12.741 0.620 1.00 2.54 C ATOM 102 O GLY A 362 9.323 13.471 0.535 1.00 14.31 O ATOM 0 H GLY A 362 10.360 10.456 -1.028 1.00 2.13 H new ATOM 0 HA2 GLY A 362 9.496 11.118 1.713 1.00 62.34 H new ATOM 0 HA3 GLY A 362 11.142 10.864 1.169 1.00 62.34 H new ATOM 106 N MET A 363 11.529 13.175 0.492 1.00 13.34 N ATOM 107 CA MET A 363 11.817 14.560 0.258 1.00 21.13 C ATOM 108 C MET A 363 11.866 14.805 -1.218 1.00 1.13 C ATOM 109 O MET A 363 12.777 14.345 -1.880 1.00 4.15 O ATOM 110 CB MET A 363 13.163 14.969 0.889 1.00 23.01 C ATOM 111 CG MET A 363 13.286 14.736 2.397 1.00 52.42 C ATOM 112 SD MET A 363 13.332 12.987 2.861 1.00 43.32 S ATOM 113 CE MET A 363 13.474 13.119 4.640 1.00 53.31 C ATOM 0 H MET A 363 12.354 12.578 0.547 1.00 13.34 H new ATOM 0 HA MET A 363 11.031 15.159 0.719 1.00 21.13 H new ATOM 0 HB2 MET A 363 13.960 14.419 0.389 1.00 23.01 H new ATOM 0 HB3 MET A 363 13.331 16.027 0.688 1.00 23.01 H new ATOM 0 HG2 MET A 363 14.192 15.223 2.758 1.00 52.42 H new ATOM 0 HG3 MET A 363 12.445 15.214 2.899 1.00 52.42 H new ATOM 0 HE1 MET A 363 13.514 12.121 5.077 1.00 53.31 H new ATOM 0 HE2 MET A 363 14.384 13.663 4.893 1.00 53.31 H new ATOM 0 HE3 MET A 363 12.610 13.654 5.035 1.00 53.31 H new ATOM 123 N GLU A 364 10.881 15.490 -1.737 1.00 32.32 N ATOM 124 CA GLU A 364 10.842 15.789 -3.139 1.00 55.40 C ATOM 125 C GLU A 364 11.367 17.202 -3.359 1.00 23.54 C ATOM 126 O GLU A 364 10.636 18.185 -3.201 1.00 21.43 O ATOM 127 CB GLU A 364 9.414 15.643 -3.692 1.00 22.30 C ATOM 128 CG GLU A 364 9.300 15.827 -5.196 1.00 35.40 C ATOM 129 CD GLU A 364 7.872 15.786 -5.677 1.00 55.10 C ATOM 130 OE1 GLU A 364 7.305 14.679 -5.837 1.00 23.40 O ATOM 131 OE2 GLU A 364 7.290 16.862 -5.904 1.00 75.24 O ATOM 0 H GLU A 364 10.091 15.852 -1.203 1.00 32.32 H new ATOM 0 HA GLU A 364 11.473 15.081 -3.676 1.00 55.40 H new ATOM 0 HB2 GLU A 364 9.035 14.655 -3.430 1.00 22.30 H new ATOM 0 HB3 GLU A 364 8.771 16.372 -3.199 1.00 22.30 H new ATOM 0 HG2 GLU A 364 9.747 16.781 -5.477 1.00 35.40 H new ATOM 0 HG3 GLU A 364 9.872 15.047 -5.698 1.00 35.40 H new ATOM 138 N THR A 365 12.633 17.298 -3.637 1.00 65.41 N ATOM 139 CA THR A 365 13.261 18.557 -3.901 1.00 62.25 C ATOM 140 C THR A 365 13.468 18.663 -5.397 1.00 63.51 C ATOM 141 O THR A 365 13.792 17.668 -6.046 1.00 74.23 O ATOM 142 CB THR A 365 14.625 18.644 -3.176 1.00 31.21 C ATOM 143 OG1 THR A 365 14.443 18.320 -1.793 1.00 60.41 O ATOM 144 CG2 THR A 365 15.196 20.056 -3.264 1.00 75.13 C ATOM 0 H THR A 365 13.264 16.498 -3.687 1.00 65.41 H new ATOM 0 HA THR A 365 12.634 19.372 -3.539 1.00 62.25 H new ATOM 0 HB THR A 365 15.313 17.946 -3.653 1.00 31.21 H new ATOM 0 HG1 THR A 365 15.312 18.121 -1.386 1.00 60.41 H new ATOM 0 HG21 THR A 365 16.155 20.093 -2.747 1.00 75.13 H new ATOM 0 HG22 THR A 365 15.337 20.327 -4.310 1.00 75.13 H new ATOM 0 HG23 THR A 365 14.505 20.758 -2.797 1.00 75.13 H new ATOM 152 N LYS A 366 13.279 19.827 -5.954 1.00 52.32 N ATOM 153 CA LYS A 366 13.415 19.983 -7.357 1.00 51.24 C ATOM 154 C LYS A 366 13.994 21.307 -7.655 1.00 33.12 C ATOM 155 O LYS A 366 13.658 22.297 -6.999 1.00 0.10 O ATOM 156 CB LYS A 366 12.100 19.744 -8.120 1.00 32.22 C ATOM 157 CG LYS A 366 10.941 20.641 -7.742 1.00 42.41 C ATOM 158 CD LYS A 366 9.737 20.330 -8.603 1.00 0.43 C ATOM 159 CE LYS A 366 8.538 21.170 -8.221 1.00 14.41 C ATOM 160 NZ LYS A 366 7.373 20.864 -9.071 1.00 22.13 N ATOM 0 H LYS A 366 13.030 20.677 -5.448 1.00 52.32 H new ATOM 0 HA LYS A 366 14.097 19.211 -7.713 1.00 51.24 H new ATOM 0 HB2 LYS A 366 12.294 19.865 -9.186 1.00 32.22 H new ATOM 0 HB3 LYS A 366 11.797 18.708 -7.966 1.00 32.22 H new ATOM 0 HG2 LYS A 366 10.691 20.501 -6.690 1.00 42.41 H new ATOM 0 HG3 LYS A 366 11.225 21.686 -7.865 1.00 42.41 H new ATOM 0 HD2 LYS A 366 9.984 20.505 -9.650 1.00 0.43 H new ATOM 0 HD3 LYS A 366 9.486 19.274 -8.508 1.00 0.43 H new ATOM 0 HE2 LYS A 366 8.285 20.991 -7.176 1.00 14.41 H new ATOM 0 HE3 LYS A 366 8.789 22.227 -8.312 1.00 14.41 H new ATOM 0 HZ1 LYS A 366 6.568 21.457 -8.783 1.00 22.13 H new ATOM 0 HZ2 LYS A 366 7.608 21.058 -10.065 1.00 22.13 H new ATOM 0 HZ3 LYS A 366 7.120 19.861 -8.965 1.00 22.13 H new ATOM 174 N ARG A 367 14.882 21.346 -8.591 1.00 3.12 N ATOM 175 CA ARG A 367 15.532 22.544 -8.914 1.00 71.10 C ATOM 176 C ARG A 367 16.000 22.490 -10.342 1.00 13.03 C ATOM 177 O ARG A 367 16.482 21.470 -10.798 1.00 54.41 O ATOM 178 CB ARG A 367 16.664 22.717 -7.944 1.00 10.24 C ATOM 179 CG ARG A 367 17.338 24.037 -7.979 1.00 74.01 C ATOM 180 CD ARG A 367 18.144 24.185 -6.735 1.00 52.31 C ATOM 181 NE ARG A 367 18.829 25.467 -6.686 1.00 74.14 N ATOM 182 CZ ARG A 367 19.205 26.094 -5.576 1.00 33.35 C ATOM 183 NH1 ARG A 367 18.890 25.598 -4.380 1.00 71.44 N ATOM 184 NH2 ARG A 367 19.877 27.228 -5.667 1.00 64.31 N ATOM 0 H ARG A 367 15.169 20.540 -9.147 1.00 3.12 H new ATOM 0 HA ARG A 367 14.866 23.403 -8.833 1.00 71.10 H new ATOM 0 HB2 ARG A 367 16.285 22.549 -6.936 1.00 10.24 H new ATOM 0 HB3 ARG A 367 17.407 21.944 -8.138 1.00 10.24 H new ATOM 0 HG2 ARG A 367 17.979 24.113 -8.858 1.00 74.01 H new ATOM 0 HG3 ARG A 367 16.602 24.837 -8.052 1.00 74.01 H new ATOM 0 HD2 ARG A 367 17.493 24.087 -5.866 1.00 52.31 H new ATOM 0 HD3 ARG A 367 18.876 23.379 -6.678 1.00 52.31 H new ATOM 0 HE ARG A 367 19.038 25.922 -7.575 1.00 74.14 H new ATOM 0 HH11 ARG A 367 18.357 24.731 -4.312 1.00 71.44 H new ATOM 0 HH12 ARG A 367 19.182 26.085 -3.533 1.00 71.44 H new ATOM 0 HH21 ARG A 367 20.103 27.615 -6.583 1.00 64.31 H new ATOM 0 HH22 ARG A 367 20.170 27.717 -4.821 1.00 64.31 H new ATOM 198 N GLU A 368 15.881 23.576 -11.033 1.00 14.24 N ATOM 199 CA GLU A 368 16.172 23.614 -12.434 1.00 33.40 C ATOM 200 C GLU A 368 17.599 23.975 -12.680 1.00 52.25 C ATOM 201 O GLU A 368 18.049 25.094 -12.417 1.00 10.30 O ATOM 202 CB GLU A 368 15.189 24.535 -13.143 1.00 1.04 C ATOM 203 CG GLU A 368 15.094 25.920 -12.536 1.00 5.31 C ATOM 204 CD GLU A 368 14.007 26.738 -13.144 1.00 53.31 C ATOM 205 OE1 GLU A 368 12.866 26.670 -12.650 1.00 21.33 O ATOM 206 OE2 GLU A 368 14.261 27.463 -14.103 1.00 73.21 O ATOM 0 H GLU A 368 15.578 24.468 -10.642 1.00 14.24 H new ATOM 0 HA GLU A 368 16.042 22.618 -12.857 1.00 33.40 H new ATOM 0 HB2 GLU A 368 15.483 24.627 -14.189 1.00 1.04 H new ATOM 0 HB3 GLU A 368 14.201 24.075 -13.129 1.00 1.04 H new ATOM 0 HG2 GLU A 368 14.921 25.832 -11.463 1.00 5.31 H new ATOM 0 HG3 GLU A 368 16.046 26.435 -12.664 1.00 5.31 H new ATOM 213 N ILE A 369 18.312 22.999 -13.148 1.00 10.22 N ATOM 214 CA ILE A 369 19.709 23.101 -13.390 1.00 34.20 C ATOM 215 C ILE A 369 19.969 22.801 -14.868 1.00 64.22 C ATOM 216 O ILE A 369 19.491 21.802 -15.393 1.00 2.14 O ATOM 217 CB ILE A 369 20.416 22.070 -12.479 1.00 65.31 C ATOM 218 CG1 ILE A 369 20.005 22.342 -11.017 1.00 21.45 C ATOM 219 CG2 ILE A 369 21.925 22.148 -12.639 1.00 33.41 C ATOM 220 CD1 ILE A 369 20.299 21.227 -10.049 1.00 14.05 C ATOM 0 H ILE A 369 17.923 22.085 -13.377 1.00 10.22 H new ATOM 0 HA ILE A 369 20.089 24.099 -13.169 1.00 34.20 H new ATOM 0 HB ILE A 369 20.112 21.063 -12.764 1.00 65.31 H new ATOM 0 HG12 ILE A 369 20.515 23.242 -10.675 1.00 21.45 H new ATOM 0 HG13 ILE A 369 18.936 22.552 -10.990 1.00 21.45 H new ATOM 0 HG21 ILE A 369 22.398 21.413 -11.988 1.00 33.41 H new ATOM 0 HG22 ILE A 369 22.192 21.940 -13.675 1.00 33.41 H new ATOM 0 HG23 ILE A 369 22.268 23.147 -12.369 1.00 33.41 H new ATOM 0 HD11 ILE A 369 19.973 21.517 -9.050 1.00 14.05 H new ATOM 0 HD12 ILE A 369 19.767 20.327 -10.358 1.00 14.05 H new ATOM 0 HD13 ILE A 369 21.371 21.028 -10.037 1.00 14.05 H new ATOM 232 N GLY A 370 20.694 23.687 -15.531 1.00 32.31 N ATOM 233 CA GLY A 370 20.999 23.532 -16.955 1.00 30.50 C ATOM 234 C GLY A 370 19.764 23.550 -17.861 1.00 33.22 C ATOM 235 O GLY A 370 19.819 23.086 -19.000 1.00 52.42 O ATOM 0 H GLY A 370 21.087 24.528 -15.108 1.00 32.31 H new ATOM 0 HA2 GLY A 370 21.673 24.332 -17.261 1.00 30.50 H new ATOM 0 HA3 GLY A 370 21.531 22.592 -17.102 1.00 30.50 H new ATOM 239 N GLY A 371 18.667 24.095 -17.363 1.00 60.12 N ATOM 240 CA GLY A 371 17.445 24.171 -18.158 1.00 11.12 C ATOM 241 C GLY A 371 16.476 23.033 -17.874 1.00 65.11 C ATOM 242 O GLY A 371 15.349 23.016 -18.380 1.00 20.54 O ATOM 0 H GLY A 371 18.593 24.488 -16.425 1.00 60.12 H new ATOM 0 HA2 GLY A 371 16.948 25.121 -17.960 1.00 11.12 H new ATOM 0 HA3 GLY A 371 17.706 24.162 -19.216 1.00 11.12 H new ATOM 246 N TYR A 372 16.908 22.090 -17.080 1.00 54.52 N ATOM 247 CA TYR A 372 16.087 20.963 -16.708 1.00 74.21 C ATOM 248 C TYR A 372 15.897 20.853 -15.212 1.00 24.32 C ATOM 249 O TYR A 372 16.846 20.935 -14.438 1.00 23.25 O ATOM 250 CB TYR A 372 16.549 19.635 -17.369 1.00 3.53 C ATOM 251 CG TYR A 372 18.040 19.509 -17.602 1.00 61.22 C ATOM 252 CD1 TYR A 372 18.606 19.945 -18.795 1.00 70.04 C ATOM 253 CD2 TYR A 372 18.864 18.959 -16.665 1.00 41.31 C ATOM 254 CE1 TYR A 372 19.960 19.832 -19.029 1.00 54.12 C ATOM 255 CE2 TYR A 372 20.225 18.840 -16.890 1.00 32.30 C ATOM 256 CZ TYR A 372 20.764 19.277 -18.069 1.00 42.44 C ATOM 257 OH TYR A 372 22.125 19.160 -18.291 1.00 60.44 O ATOM 0 H TYR A 372 17.842 22.079 -16.670 1.00 54.52 H new ATOM 0 HA TYR A 372 15.096 21.159 -17.118 1.00 74.21 H new ATOM 0 HB2 TYR A 372 16.225 18.805 -16.741 1.00 3.53 H new ATOM 0 HB3 TYR A 372 16.039 19.529 -18.326 1.00 3.53 H new ATOM 0 HD1 TYR A 372 17.972 20.381 -19.553 1.00 70.04 H new ATOM 0 HD2 TYR A 372 18.448 18.610 -15.731 1.00 41.31 H new ATOM 0 HE1 TYR A 372 20.383 20.178 -19.961 1.00 54.12 H new ATOM 0 HE2 TYR A 372 20.861 18.402 -16.135 1.00 32.30 H new ATOM 0 HH TYR A 372 22.549 18.746 -17.510 1.00 60.44 H new ATOM 267 N THR A 373 14.661 20.716 -14.821 1.00 31.03 N ATOM 268 CA THR A 373 14.285 20.608 -13.436 1.00 33.33 C ATOM 269 C THR A 373 14.676 19.256 -12.865 1.00 71.13 C ATOM 270 O THR A 373 14.103 18.238 -13.207 1.00 44.45 O ATOM 271 CB THR A 373 12.763 20.835 -13.259 1.00 72.30 C ATOM 272 OG1 THR A 373 12.402 22.121 -13.812 1.00 3.11 O ATOM 273 CG2 THR A 373 12.375 20.799 -11.785 1.00 20.15 C ATOM 0 H THR A 373 13.872 20.675 -15.466 1.00 31.03 H new ATOM 0 HA THR A 373 14.822 21.383 -12.889 1.00 33.33 H new ATOM 0 HB THR A 373 12.233 20.038 -13.780 1.00 72.30 H new ATOM 0 HG1 THR A 373 11.439 22.266 -13.702 1.00 3.11 H new ATOM 0 HG21 THR A 373 11.302 20.961 -11.687 1.00 20.15 H new ATOM 0 HG22 THR A 373 12.635 19.828 -11.364 1.00 20.15 H new ATOM 0 HG23 THR A 373 12.910 21.582 -11.249 1.00 20.15 H new ATOM 281 N TYR A 374 15.630 19.262 -11.994 1.00 42.14 N ATOM 282 CA TYR A 374 16.057 18.071 -11.349 1.00 44.10 C ATOM 283 C TYR A 374 15.175 17.843 -10.183 1.00 11.42 C ATOM 284 O TYR A 374 15.051 18.702 -9.339 1.00 5.34 O ATOM 285 CB TYR A 374 17.468 18.242 -10.827 1.00 30.42 C ATOM 286 CG TYR A 374 18.586 18.095 -11.805 1.00 44.20 C ATOM 287 CD1 TYR A 374 18.849 19.047 -12.755 1.00 55.21 C ATOM 288 CD2 TYR A 374 19.419 16.999 -11.732 1.00 15.22 C ATOM 289 CE1 TYR A 374 19.910 18.916 -13.609 1.00 2.34 C ATOM 290 CE2 TYR A 374 20.486 16.865 -12.571 1.00 11.21 C ATOM 291 CZ TYR A 374 20.731 17.830 -13.509 1.00 11.43 C ATOM 292 OH TYR A 374 21.814 17.714 -14.343 1.00 11.43 O ATOM 0 H TYR A 374 16.137 20.100 -11.710 1.00 42.14 H new ATOM 0 HA TYR A 374 16.020 17.241 -12.055 1.00 44.10 H new ATOM 0 HB2 TYR A 374 17.543 19.232 -10.377 1.00 30.42 H new ATOM 0 HB3 TYR A 374 17.622 17.516 -10.028 1.00 30.42 H new ATOM 0 HD1 TYR A 374 18.209 19.914 -12.831 1.00 55.21 H new ATOM 0 HD2 TYR A 374 19.223 16.232 -10.997 1.00 15.22 H new ATOM 0 HE1 TYR A 374 20.097 19.669 -14.360 1.00 2.34 H new ATOM 0 HE2 TYR A 374 21.133 16.003 -12.495 1.00 11.21 H new ATOM 0 HH TYR A 374 21.725 16.902 -14.884 1.00 11.43 H new ATOM 302 N LYS A 375 14.575 16.711 -10.133 1.00 63.01 N ATOM 303 CA LYS A 375 13.714 16.369 -9.060 1.00 73.14 C ATOM 304 C LYS A 375 14.257 15.158 -8.382 1.00 62.24 C ATOM 305 O LYS A 375 14.468 14.127 -9.016 1.00 55.45 O ATOM 306 CB LYS A 375 12.288 16.108 -9.580 1.00 33.13 C ATOM 307 CG LYS A 375 11.306 15.641 -8.506 1.00 31.11 C ATOM 308 CD LYS A 375 9.888 15.462 -9.051 1.00 31.13 C ATOM 309 CE LYS A 375 9.820 14.473 -10.200 1.00 44.23 C ATOM 310 NZ LYS A 375 8.438 14.300 -10.696 1.00 34.41 N ATOM 0 H LYS A 375 14.668 15.986 -10.844 1.00 63.01 H new ATOM 0 HA LYS A 375 13.663 17.193 -8.348 1.00 73.14 H new ATOM 0 HB2 LYS A 375 11.906 17.022 -10.033 1.00 33.13 H new ATOM 0 HB3 LYS A 375 12.332 15.356 -10.368 1.00 33.13 H new ATOM 0 HG2 LYS A 375 11.653 14.697 -8.086 1.00 31.11 H new ATOM 0 HG3 LYS A 375 11.291 16.365 -7.692 1.00 31.11 H new ATOM 0 HD2 LYS A 375 9.235 15.123 -8.247 1.00 31.13 H new ATOM 0 HD3 LYS A 375 9.508 16.427 -9.385 1.00 31.13 H new ATOM 0 HE2 LYS A 375 10.458 14.818 -11.014 1.00 44.23 H new ATOM 0 HE3 LYS A 375 10.212 13.510 -9.874 1.00 44.23 H new ATOM 0 HZ1 LYS A 375 8.434 13.617 -11.480 1.00 34.41 H new ATOM 0 HZ2 LYS A 375 7.834 13.947 -9.926 1.00 34.41 H new ATOM 0 HZ3 LYS A 375 8.072 15.214 -11.031 1.00 34.41 H new ATOM 324 N VAL A 376 14.473 15.279 -7.121 1.00 25.04 N ATOM 325 CA VAL A 376 14.984 14.222 -6.324 1.00 74.53 C ATOM 326 C VAL A 376 13.934 13.885 -5.312 1.00 33.53 C ATOM 327 O VAL A 376 13.572 14.723 -4.507 1.00 31.21 O ATOM 328 CB VAL A 376 16.284 14.644 -5.577 1.00 13.11 C ATOM 329 CG1 VAL A 376 16.862 13.479 -4.777 1.00 21.11 C ATOM 330 CG2 VAL A 376 17.324 15.212 -6.540 1.00 45.32 C ATOM 0 H VAL A 376 14.295 16.138 -6.601 1.00 25.04 H new ATOM 0 HA VAL A 376 15.228 13.373 -6.962 1.00 74.53 H new ATOM 0 HB VAL A 376 16.015 15.435 -4.877 1.00 13.11 H new ATOM 0 HG11 VAL A 376 17.769 13.803 -4.266 1.00 21.11 H new ATOM 0 HG12 VAL A 376 16.131 13.145 -4.041 1.00 21.11 H new ATOM 0 HG13 VAL A 376 17.100 12.657 -5.452 1.00 21.11 H new ATOM 0 HG21 VAL A 376 18.218 15.496 -5.984 1.00 45.32 H new ATOM 0 HG22 VAL A 376 17.583 14.457 -7.283 1.00 45.32 H new ATOM 0 HG23 VAL A 376 16.915 16.089 -7.042 1.00 45.32 H new ATOM 340 N VAL A 377 13.408 12.683 -5.388 1.00 22.32 N ATOM 341 CA VAL A 377 12.404 12.233 -4.435 1.00 54.45 C ATOM 342 C VAL A 377 13.116 11.502 -3.279 1.00 60.23 C ATOM 343 O VAL A 377 12.504 11.078 -2.272 1.00 42.20 O ATOM 344 CB VAL A 377 11.386 11.303 -5.118 1.00 31.24 C ATOM 345 CG1 VAL A 377 10.244 10.950 -4.174 1.00 51.52 C ATOM 346 CG2 VAL A 377 10.843 11.937 -6.393 1.00 33.54 C ATOM 0 H VAL A 377 13.656 11.995 -6.099 1.00 22.32 H new ATOM 0 HA VAL A 377 11.857 13.092 -4.046 1.00 54.45 H new ATOM 0 HB VAL A 377 11.905 10.382 -5.383 1.00 31.24 H new ATOM 0 HG11 VAL A 377 9.540 10.292 -4.684 1.00 51.52 H new ATOM 0 HG12 VAL A 377 10.642 10.444 -3.295 1.00 51.52 H new ATOM 0 HG13 VAL A 377 9.731 11.861 -3.867 1.00 51.52 H new ATOM 0 HG21 VAL A 377 10.125 11.261 -6.858 1.00 33.54 H new ATOM 0 HG22 VAL A 377 10.350 12.878 -6.150 1.00 33.54 H new ATOM 0 HG23 VAL A 377 11.665 12.126 -7.084 1.00 33.54 H new ATOM 356 N PHE A 378 14.421 11.355 -3.468 1.00 51.42 N ATOM 357 CA PHE A 378 15.372 10.778 -2.517 1.00 13.13 C ATOM 358 C PHE A 378 15.187 9.254 -2.377 1.00 65.52 C ATOM 359 O PHE A 378 16.073 8.486 -2.718 1.00 14.03 O ATOM 360 CB PHE A 378 15.309 11.504 -1.150 1.00 2.04 C ATOM 361 CG PHE A 378 16.546 11.347 -0.304 1.00 12.42 C ATOM 362 CD1 PHE A 378 17.716 12.004 -0.665 1.00 12.20 C ATOM 363 CD2 PHE A 378 16.547 10.570 0.836 1.00 62.33 C ATOM 364 CE1 PHE A 378 18.860 11.885 0.095 1.00 41.01 C ATOM 365 CE2 PHE A 378 17.689 10.447 1.606 1.00 64.30 C ATOM 366 CZ PHE A 378 18.848 11.106 1.235 1.00 61.12 C ATOM 0 H PHE A 378 14.872 11.650 -4.334 1.00 51.42 H new ATOM 0 HA PHE A 378 16.374 10.933 -2.917 1.00 13.13 H new ATOM 0 HB2 PHE A 378 15.135 12.566 -1.324 1.00 2.04 H new ATOM 0 HB3 PHE A 378 14.452 11.128 -0.592 1.00 2.04 H new ATOM 0 HD1 PHE A 378 17.729 12.617 -1.554 1.00 12.20 H new ATOM 0 HD2 PHE A 378 15.646 10.052 1.130 1.00 62.33 H new ATOM 0 HE1 PHE A 378 19.763 12.399 -0.200 1.00 41.01 H new ATOM 0 HE2 PHE A 378 17.676 9.837 2.497 1.00 64.30 H new ATOM 0 HZ PHE A 378 19.741 11.011 1.835 1.00 61.12 H new ATOM 376 N TYR A 379 14.021 8.833 -1.934 1.00 70.55 N ATOM 377 CA TYR A 379 13.742 7.411 -1.710 1.00 22.04 C ATOM 378 C TYR A 379 13.153 6.755 -2.942 1.00 44.10 C ATOM 379 O TYR A 379 12.923 5.549 -2.965 1.00 15.52 O ATOM 380 CB TYR A 379 12.806 7.225 -0.517 1.00 73.32 C ATOM 381 CG TYR A 379 13.382 7.741 0.772 1.00 60.32 C ATOM 382 CD1 TYR A 379 13.178 9.052 1.161 1.00 71.01 C ATOM 383 CD2 TYR A 379 14.144 6.921 1.590 1.00 24.55 C ATOM 384 CE1 TYR A 379 13.713 9.539 2.327 1.00 4.53 C ATOM 385 CE2 TYR A 379 14.683 7.398 2.763 1.00 43.44 C ATOM 386 CZ TYR A 379 14.466 8.708 3.128 1.00 41.43 C ATOM 387 OH TYR A 379 15.009 9.188 4.292 1.00 11.22 O ATOM 0 H TYR A 379 13.240 9.452 -1.718 1.00 70.55 H new ATOM 0 HA TYR A 379 14.693 6.924 -1.493 1.00 22.04 H new ATOM 0 HB2 TYR A 379 11.865 7.737 -0.718 1.00 73.32 H new ATOM 0 HB3 TYR A 379 12.575 6.166 -0.406 1.00 73.32 H new ATOM 0 HD1 TYR A 379 12.587 9.705 0.536 1.00 71.01 H new ATOM 0 HD2 TYR A 379 14.317 5.894 1.303 1.00 24.55 H new ATOM 0 HE1 TYR A 379 13.545 10.566 2.615 1.00 4.53 H new ATOM 0 HE2 TYR A 379 15.273 6.749 3.393 1.00 43.44 H new ATOM 0 HH TYR A 379 15.510 8.473 4.739 1.00 11.22 H new ATOM 397 N GLU A 380 12.907 7.547 -3.953 1.00 53.24 N ATOM 398 CA GLU A 380 12.373 7.037 -5.199 1.00 40.34 C ATOM 399 C GLU A 380 13.367 7.088 -6.327 1.00 31.14 C ATOM 400 O GLU A 380 13.818 6.044 -6.799 1.00 45.05 O ATOM 401 CB GLU A 380 11.066 7.731 -5.580 1.00 74.31 C ATOM 402 CG GLU A 380 9.888 7.268 -4.775 1.00 25.31 C ATOM 403 CD GLU A 380 9.407 5.908 -5.225 1.00 43.43 C ATOM 404 OE1 GLU A 380 10.130 4.904 -5.057 1.00 31.25 O ATOM 405 OE2 GLU A 380 8.311 5.835 -5.810 1.00 70.22 O ATOM 0 H GLU A 380 13.067 8.554 -3.942 1.00 53.24 H new ATOM 0 HA GLU A 380 12.155 5.983 -5.025 1.00 40.34 H new ATOM 0 HB2 GLU A 380 11.184 8.807 -5.452 1.00 74.31 H new ATOM 0 HB3 GLU A 380 10.865 7.556 -6.637 1.00 74.31 H new ATOM 0 HG2 GLU A 380 10.160 7.228 -3.720 1.00 25.31 H new ATOM 0 HG3 GLU A 380 9.077 7.990 -4.867 1.00 25.31 H new ATOM 412 N ASN A 381 13.707 8.287 -6.768 1.00 1.10 N ATOM 413 CA ASN A 381 14.587 8.478 -7.923 1.00 51.45 C ATOM 414 C ASN A 381 14.803 9.945 -8.219 1.00 4.13 C ATOM 415 O ASN A 381 14.301 10.817 -7.479 1.00 53.53 O ATOM 416 CB ASN A 381 14.017 7.763 -9.164 1.00 23.13 C ATOM 417 CG ASN A 381 12.545 8.024 -9.391 1.00 60.15 C ATOM 418 OD1 ASN A 381 12.013 9.069 -9.033 1.00 22.25 O ATOM 419 ND2 ASN A 381 11.873 7.055 -9.948 1.00 34.32 N ATOM 0 H ASN A 381 13.386 9.156 -6.342 1.00 1.10 H new ATOM 0 HA ASN A 381 15.553 8.039 -7.675 1.00 51.45 H new ATOM 0 HB2 ASN A 381 14.574 8.083 -10.045 1.00 23.13 H new ATOM 0 HB3 ASN A 381 14.175 6.690 -9.059 1.00 23.13 H new ATOM 0 HD21 ASN A 381 10.869 7.152 -10.099 1.00 34.32 H new ATOM 0 HD22 ASN A 381 12.351 6.200 -10.232 1.00 34.32 H new ATOM 426 N VAL A 382 15.577 10.214 -9.276 1.00 1.23 N ATOM 427 CA VAL A 382 15.853 11.564 -9.728 1.00 32.14 C ATOM 428 C VAL A 382 15.484 11.714 -11.197 1.00 73.14 C ATOM 429 O VAL A 382 15.803 10.845 -12.023 1.00 44.45 O ATOM 430 CB VAL A 382 17.349 11.945 -9.551 1.00 53.11 C ATOM 431 CG1 VAL A 382 17.627 13.365 -10.069 1.00 35.35 C ATOM 432 CG2 VAL A 382 17.755 11.822 -8.099 1.00 13.32 C ATOM 0 H VAL A 382 16.027 9.492 -9.838 1.00 1.23 H new ATOM 0 HA VAL A 382 15.250 12.232 -9.114 1.00 32.14 H new ATOM 0 HB VAL A 382 17.946 11.251 -10.142 1.00 53.11 H new ATOM 0 HG11 VAL A 382 18.682 13.602 -9.931 1.00 35.35 H new ATOM 0 HG12 VAL A 382 17.378 13.421 -11.129 1.00 35.35 H new ATOM 0 HG13 VAL A 382 17.019 14.080 -9.515 1.00 35.35 H new ATOM 0 HG21 VAL A 382 18.805 12.092 -7.991 1.00 13.32 H new ATOM 0 HG22 VAL A 382 17.144 12.491 -7.492 1.00 13.32 H new ATOM 0 HG23 VAL A 382 17.608 10.795 -7.766 1.00 13.32 H new ATOM 442 N PHE A 383 14.823 12.800 -11.513 1.00 21.15 N ATOM 443 CA PHE A 383 14.454 13.119 -12.873 1.00 11.51 C ATOM 444 C PHE A 383 14.966 14.481 -13.211 1.00 72.54 C ATOM 445 O PHE A 383 15.143 15.303 -12.339 1.00 60.54 O ATOM 446 CB PHE A 383 12.945 13.182 -13.048 1.00 34.21 C ATOM 447 CG PHE A 383 12.202 11.951 -12.711 1.00 44.10 C ATOM 448 CD1 PHE A 383 12.088 10.931 -13.622 1.00 41.41 C ATOM 449 CD2 PHE A 383 11.594 11.832 -11.491 1.00 62.51 C ATOM 450 CE1 PHE A 383 11.369 9.793 -13.311 1.00 0.31 C ATOM 451 CE2 PHE A 383 10.874 10.721 -11.165 1.00 13.21 C ATOM 452 CZ PHE A 383 10.757 9.688 -12.080 1.00 65.15 C ATOM 0 H PHE A 383 14.523 13.494 -10.829 1.00 21.15 H new ATOM 0 HA PHE A 383 14.873 12.341 -13.511 1.00 11.51 H new ATOM 0 HB2 PHE A 383 12.561 13.995 -12.431 1.00 34.21 H new ATOM 0 HB3 PHE A 383 12.730 13.440 -14.085 1.00 34.21 H new ATOM 0 HD1 PHE A 383 12.563 11.018 -14.588 1.00 41.41 H new ATOM 0 HD2 PHE A 383 11.686 12.633 -10.773 1.00 62.51 H new ATOM 0 HE1 PHE A 383 11.287 8.990 -14.028 1.00 0.31 H new ATOM 0 HE2 PHE A 383 10.398 10.647 -10.199 1.00 13.21 H new ATOM 0 HZ PHE A 383 10.189 8.804 -11.830 1.00 65.15 H new ATOM 462 N GLN A 384 15.213 14.707 -14.455 1.00 71.55 N ATOM 463 CA GLN A 384 15.539 16.020 -14.941 1.00 31.51 C ATOM 464 C GLN A 384 14.469 16.378 -15.934 1.00 71.15 C ATOM 465 O GLN A 384 14.510 15.925 -17.083 1.00 21.45 O ATOM 466 CB GLN A 384 16.859 16.032 -15.643 1.00 23.31 C ATOM 467 CG GLN A 384 17.952 15.359 -14.888 1.00 73.04 C ATOM 468 CD GLN A 384 19.216 15.242 -15.711 1.00 61.21 C ATOM 469 OE1 GLN A 384 20.309 15.270 -15.192 1.00 1.11 O ATOM 470 NE2 GLN A 384 19.066 15.061 -16.993 1.00 13.31 N ATOM 0 H GLN A 384 15.197 13.986 -15.176 1.00 71.55 H new ATOM 0 HA GLN A 384 15.598 16.721 -14.109 1.00 31.51 H new ATOM 0 HB2 GLN A 384 16.748 15.546 -16.612 1.00 23.31 H new ATOM 0 HB3 GLN A 384 17.147 17.065 -15.836 1.00 23.31 H new ATOM 0 HG2 GLN A 384 18.162 15.919 -13.977 1.00 73.04 H new ATOM 0 HG3 GLN A 384 17.624 14.365 -14.583 1.00 73.04 H new ATOM 0 HE21 GLN A 384 18.131 15.043 -17.399 1.00 13.31 H new ATOM 0 HE22 GLN A 384 19.884 14.938 -17.590 1.00 13.31 H new ATOM 479 N ASP A 385 13.494 17.120 -15.467 1.00 43.21 N ATOM 480 CA ASP A 385 12.299 17.521 -16.212 1.00 71.31 C ATOM 481 C ASP A 385 11.424 16.312 -16.479 1.00 1.11 C ATOM 482 O ASP A 385 10.399 16.118 -15.838 1.00 71.03 O ATOM 483 CB ASP A 385 12.630 18.239 -17.520 1.00 72.31 C ATOM 484 CG ASP A 385 11.393 18.799 -18.188 1.00 42.12 C ATOM 485 OD1 ASP A 385 10.996 19.946 -17.865 1.00 24.54 O ATOM 486 OD2 ASP A 385 10.794 18.111 -19.041 1.00 23.21 O ATOM 0 H ASP A 385 13.501 17.484 -14.514 1.00 43.21 H new ATOM 0 HA ASP A 385 11.758 18.235 -15.591 1.00 71.31 H new ATOM 0 HB2 ASP A 385 13.333 19.048 -17.322 1.00 72.31 H new ATOM 0 HB3 ASP A 385 13.126 17.545 -18.199 1.00 72.31 H new ATOM 491 N SER A 386 11.854 15.491 -17.393 1.00 43.35 N ATOM 492 CA SER A 386 11.158 14.290 -17.713 1.00 14.31 C ATOM 493 C SER A 386 12.169 13.165 -17.975 1.00 21.11 C ATOM 494 O SER A 386 11.793 12.055 -18.339 1.00 71.11 O ATOM 495 CB SER A 386 10.257 14.524 -18.938 1.00 71.42 C ATOM 496 OG SER A 386 9.435 13.395 -19.215 1.00 71.25 O ATOM 0 H SER A 386 12.703 15.642 -17.938 1.00 43.35 H new ATOM 0 HA SER A 386 10.525 13.994 -16.876 1.00 14.31 H new ATOM 0 HB2 SER A 386 9.628 15.397 -18.765 1.00 71.42 H new ATOM 0 HB3 SER A 386 10.876 14.744 -19.807 1.00 71.42 H new ATOM 0 HG SER A 386 9.903 12.576 -18.947 1.00 71.25 H new ATOM 502 N ILE A 387 13.454 13.461 -17.782 1.00 43.40 N ATOM 503 CA ILE A 387 14.512 12.478 -18.019 1.00 51.23 C ATOM 504 C ILE A 387 14.941 11.810 -16.710 1.00 62.24 C ATOM 505 O ILE A 387 15.476 12.450 -15.824 1.00 62.00 O ATOM 506 CB ILE A 387 15.751 13.129 -18.709 1.00 71.31 C ATOM 507 CG1 ILE A 387 15.359 13.748 -20.064 1.00 10.34 C ATOM 508 CG2 ILE A 387 16.886 12.117 -18.889 1.00 63.44 C ATOM 509 CD1 ILE A 387 14.786 12.756 -21.068 1.00 21.01 C ATOM 0 H ILE A 387 13.787 14.371 -17.463 1.00 43.40 H new ATOM 0 HA ILE A 387 14.104 11.720 -18.687 1.00 51.23 H new ATOM 0 HB ILE A 387 16.112 13.924 -18.057 1.00 71.31 H new ATOM 0 HG12 ILE A 387 14.626 14.536 -19.891 1.00 10.34 H new ATOM 0 HG13 ILE A 387 16.238 14.222 -20.501 1.00 10.34 H new ATOM 0 HG21 ILE A 387 17.733 12.603 -19.372 1.00 63.44 H new ATOM 0 HG22 ILE A 387 17.193 11.737 -17.914 1.00 63.44 H new ATOM 0 HG23 ILE A 387 16.541 11.289 -19.508 1.00 63.44 H new ATOM 0 HD11 ILE A 387 14.538 13.277 -21.993 1.00 21.01 H new ATOM 0 HD12 ILE A 387 15.524 11.981 -21.275 1.00 21.01 H new ATOM 0 HD13 ILE A 387 13.886 12.300 -20.656 1.00 21.01 H new ATOM 521 N LEU A 388 14.693 10.539 -16.614 1.00 72.14 N ATOM 522 CA LEU A 388 15.029 9.735 -15.452 1.00 43.22 C ATOM 523 C LEU A 388 16.538 9.439 -15.371 1.00 64.24 C ATOM 524 O LEU A 388 17.099 8.777 -16.248 1.00 72.11 O ATOM 525 CB LEU A 388 14.217 8.430 -15.524 1.00 43.32 C ATOM 526 CG LEU A 388 14.559 7.323 -14.538 1.00 14.13 C ATOM 527 CD1 LEU A 388 14.325 7.761 -13.100 1.00 20.34 C ATOM 528 CD2 LEU A 388 13.758 6.078 -14.866 1.00 41.43 C ATOM 0 H LEU A 388 14.239 10.007 -17.356 1.00 72.14 H new ATOM 0 HA LEU A 388 14.778 10.289 -14.548 1.00 43.22 H new ATOM 0 HB2 LEU A 388 13.165 8.683 -15.391 1.00 43.32 H new ATOM 0 HB3 LEU A 388 14.323 8.026 -16.531 1.00 43.32 H new ATOM 0 HG LEU A 388 15.621 7.095 -14.633 1.00 14.13 H new ATOM 0 HD11 LEU A 388 14.580 6.944 -12.425 1.00 20.34 H new ATOM 0 HD12 LEU A 388 14.950 8.625 -12.877 1.00 20.34 H new ATOM 0 HD13 LEU A 388 13.277 8.028 -12.967 1.00 20.34 H new ATOM 0 HD21 LEU A 388 14.007 5.288 -14.157 1.00 41.43 H new ATOM 0 HD22 LEU A 388 12.693 6.303 -14.801 1.00 41.43 H new ATOM 0 HD23 LEU A 388 13.997 5.747 -15.877 1.00 41.43 H new ATOM 540 N LEU A 389 17.191 9.956 -14.335 1.00 51.33 N ATOM 541 CA LEU A 389 18.609 9.665 -14.109 1.00 43.01 C ATOM 542 C LEU A 389 18.840 8.243 -13.637 1.00 24.21 C ATOM 543 O LEU A 389 19.637 7.533 -14.201 1.00 40.40 O ATOM 544 CB LEU A 389 19.248 10.645 -13.134 1.00 2.44 C ATOM 545 CG LEU A 389 19.322 12.083 -13.607 1.00 35.25 C ATOM 546 CD1 LEU A 389 20.085 12.938 -12.616 1.00 70.23 C ATOM 547 CD2 LEU A 389 19.959 12.145 -14.979 1.00 41.33 C ATOM 0 H LEU A 389 16.768 10.574 -13.642 1.00 51.33 H new ATOM 0 HA LEU A 389 19.091 9.782 -15.080 1.00 43.01 H new ATOM 0 HB2 LEU A 389 18.688 10.617 -12.199 1.00 2.44 H new ATOM 0 HB3 LEU A 389 20.258 10.302 -12.911 1.00 2.44 H new ATOM 0 HG LEU A 389 18.309 12.480 -13.676 1.00 35.25 H new ATOM 0 HD11 LEU A 389 20.125 13.966 -12.977 1.00 70.23 H new ATOM 0 HD12 LEU A 389 19.581 12.912 -11.650 1.00 70.23 H new ATOM 0 HD13 LEU A 389 21.099 12.552 -12.507 1.00 70.23 H new ATOM 0 HD21 LEU A 389 20.008 13.182 -15.311 1.00 41.33 H new ATOM 0 HD22 LEU A 389 20.966 11.731 -14.932 1.00 41.33 H new ATOM 0 HD23 LEU A 389 19.362 11.566 -15.684 1.00 41.33 H new ATOM 559 N GLY A 390 18.132 7.836 -12.623 1.00 4.01 N ATOM 560 CA GLY A 390 18.300 6.504 -12.088 1.00 2.30 C ATOM 561 C GLY A 390 17.280 6.248 -11.036 1.00 0.11 C ATOM 562 O GLY A 390 16.521 7.154 -10.713 1.00 5.44 O ATOM 0 H GLY A 390 17.431 8.403 -12.146 1.00 4.01 H new ATOM 0 HA2 GLY A 390 18.205 5.768 -12.886 1.00 2.30 H new ATOM 0 HA3 GLY A 390 19.301 6.394 -11.671 1.00 2.30 H new ATOM 566 N ASN A 391 17.276 5.057 -10.454 1.00 12.33 N ATOM 567 CA ASN A 391 16.250 4.711 -9.457 1.00 14.33 C ATOM 568 C ASN A 391 16.832 4.257 -8.198 1.00 64.34 C ATOM 569 O ASN A 391 17.910 3.679 -8.183 1.00 34.22 O ATOM 570 CB ASN A 391 15.239 3.684 -9.937 1.00 32.52 C ATOM 571 CG ASN A 391 14.282 4.229 -10.929 1.00 60.14 C ATOM 572 OD1 ASN A 391 13.242 4.759 -10.573 1.00 54.11 O ATOM 573 ND2 ASN A 391 14.596 4.108 -12.163 1.00 3.21 N ATOM 0 H ASN A 391 17.955 4.320 -10.644 1.00 12.33 H new ATOM 0 HA ASN A 391 15.715 5.647 -9.294 1.00 14.33 H new ATOM 0 HB2 ASN A 391 15.769 2.840 -10.378 1.00 32.52 H new ATOM 0 HB3 ASN A 391 14.685 3.300 -9.080 1.00 32.52 H new ATOM 0 HD21 ASN A 391 13.968 4.460 -12.886 1.00 3.21 H new ATOM 0 HD22 ASN A 391 15.474 3.659 -12.424 1.00 3.21 H new ATOM 580 N PHE A 392 16.114 4.495 -7.143 1.00 64.04 N ATOM 581 CA PHE A 392 16.572 4.146 -5.804 1.00 13.25 C ATOM 582 C PHE A 392 16.845 2.658 -5.719 1.00 55.31 C ATOM 583 O PHE A 392 15.939 1.837 -5.889 1.00 10.12 O ATOM 584 CB PHE A 392 15.521 4.552 -4.773 1.00 35.11 C ATOM 585 CG PHE A 392 15.870 4.256 -3.344 1.00 33.30 C ATOM 586 CD1 PHE A 392 16.696 5.100 -2.635 1.00 34.12 C ATOM 587 CD2 PHE A 392 15.349 3.142 -2.707 1.00 25.14 C ATOM 588 CE1 PHE A 392 16.999 4.840 -1.319 1.00 3.42 C ATOM 589 CE2 PHE A 392 15.652 2.878 -1.390 1.00 32.54 C ATOM 590 CZ PHE A 392 16.477 3.728 -0.697 1.00 34.44 C ATOM 0 H PHE A 392 15.194 4.935 -7.170 1.00 64.04 H new ATOM 0 HA PHE A 392 17.497 4.682 -5.593 1.00 13.25 H new ATOM 0 HB2 PHE A 392 15.337 5.622 -4.870 1.00 35.11 H new ATOM 0 HB3 PHE A 392 14.587 4.045 -5.013 1.00 35.11 H new ATOM 0 HD1 PHE A 392 17.109 5.974 -3.117 1.00 34.12 H new ATOM 0 HD2 PHE A 392 14.698 2.473 -3.249 1.00 25.14 H new ATOM 0 HE1 PHE A 392 17.647 5.509 -0.773 1.00 3.42 H new ATOM 0 HE2 PHE A 392 15.242 2.005 -0.904 1.00 32.54 H new ATOM 0 HZ PHE A 392 16.717 3.525 0.336 1.00 34.44 H new ATOM 600 N ALA A 393 18.087 2.316 -5.501 1.00 43.22 N ATOM 601 CA ALA A 393 18.473 0.939 -5.387 1.00 21.44 C ATOM 602 C ALA A 393 18.975 0.642 -3.995 1.00 42.24 C ATOM 603 O ALA A 393 18.493 -0.277 -3.326 1.00 23.44 O ATOM 604 CB ALA A 393 19.533 0.597 -6.426 1.00 0.13 C ATOM 0 H ALA A 393 18.854 2.981 -5.398 1.00 43.22 H new ATOM 0 HA ALA A 393 17.597 0.318 -5.572 1.00 21.44 H new ATOM 0 HB1 ALA A 393 19.815 -0.451 -6.326 1.00 0.13 H new ATOM 0 HB2 ALA A 393 19.133 0.772 -7.425 1.00 0.13 H new ATOM 0 HB3 ALA A 393 20.410 1.225 -6.271 1.00 0.13 H new ATOM 610 N SER A 394 19.919 1.423 -3.541 1.00 65.02 N ATOM 611 CA SER A 394 20.493 1.191 -2.256 1.00 74.52 C ATOM 612 C SER A 394 20.856 2.507 -1.597 1.00 43.44 C ATOM 613 O SER A 394 21.273 3.471 -2.275 1.00 54.31 O ATOM 614 CB SER A 394 21.736 0.290 -2.409 1.00 12.14 C ATOM 615 OG SER A 394 22.330 -0.035 -1.161 1.00 52.31 O ATOM 0 H SER A 394 20.302 2.222 -4.046 1.00 65.02 H new ATOM 0 HA SER A 394 19.767 0.687 -1.618 1.00 74.52 H new ATOM 0 HB2 SER A 394 21.454 -0.629 -2.923 1.00 12.14 H new ATOM 0 HB3 SER A 394 22.471 0.794 -3.037 1.00 12.14 H new ATOM 0 HG SER A 394 23.111 -0.608 -1.310 1.00 52.31 H new ATOM 621 N GLN A 395 20.666 2.557 -0.303 1.00 21.14 N ATOM 622 CA GLN A 395 21.041 3.682 0.492 1.00 34.45 C ATOM 623 C GLN A 395 22.004 3.217 1.554 1.00 73.04 C ATOM 624 O GLN A 395 21.732 2.250 2.285 1.00 14.25 O ATOM 625 CB GLN A 395 19.823 4.391 1.106 1.00 4.02 C ATOM 626 CG GLN A 395 18.919 3.519 1.953 1.00 23.33 C ATOM 627 CD GLN A 395 17.804 4.309 2.607 1.00 51.44 C ATOM 628 OE1 GLN A 395 17.964 5.496 2.931 1.00 2.31 O ATOM 629 NE2 GLN A 395 16.669 3.688 2.776 1.00 30.12 N ATOM 0 H GLN A 395 20.238 1.800 0.230 1.00 21.14 H new ATOM 0 HA GLN A 395 21.525 4.422 -0.145 1.00 34.45 H new ATOM 0 HB2 GLN A 395 20.178 5.220 1.719 1.00 4.02 H new ATOM 0 HB3 GLN A 395 19.231 4.822 0.299 1.00 4.02 H new ATOM 0 HG2 GLN A 395 18.488 2.734 1.331 1.00 23.33 H new ATOM 0 HG3 GLN A 395 19.512 3.026 2.723 1.00 23.33 H new ATOM 0 HE21 GLN A 395 16.576 2.711 2.497 1.00 30.12 H new ATOM 0 HE22 GLN A 395 15.875 4.179 3.187 1.00 30.12 H new ATOM 638 N GLU A 396 23.129 3.849 1.620 1.00 45.22 N ATOM 639 CA GLU A 396 24.142 3.473 2.547 1.00 20.12 C ATOM 640 C GLU A 396 24.502 4.674 3.381 1.00 33.20 C ATOM 641 O GLU A 396 25.242 5.559 2.933 1.00 53.44 O ATOM 642 CB GLU A 396 25.364 2.929 1.795 1.00 40.25 C ATOM 643 CG GLU A 396 25.007 1.809 0.820 1.00 51.45 C ATOM 644 CD GLU A 396 26.187 1.235 0.097 1.00 54.34 C ATOM 645 OE1 GLU A 396 26.711 1.889 -0.817 1.00 33.44 O ATOM 646 OE2 GLU A 396 26.601 0.105 0.427 1.00 64.10 O ATOM 0 H GLU A 396 23.372 4.644 1.029 1.00 45.22 H new ATOM 0 HA GLU A 396 23.780 2.682 3.204 1.00 20.12 H new ATOM 0 HB2 GLU A 396 25.841 3.743 1.248 1.00 40.25 H new ATOM 0 HB3 GLU A 396 26.093 2.559 2.515 1.00 40.25 H new ATOM 0 HG2 GLU A 396 24.505 1.011 1.367 1.00 51.45 H new ATOM 0 HG3 GLU A 396 24.295 2.191 0.088 1.00 51.45 H new ATOM 653 N GLY A 397 23.923 4.736 4.561 1.00 51.33 N ATOM 654 CA GLY A 397 24.167 5.824 5.461 1.00 21.15 C ATOM 655 C GLY A 397 23.646 7.141 4.931 1.00 54.22 C ATOM 656 O GLY A 397 22.443 7.425 4.981 1.00 31.32 O ATOM 0 H GLY A 397 23.274 4.033 4.915 1.00 51.33 H new ATOM 0 HA2 GLY A 397 23.696 5.610 6.421 1.00 21.15 H new ATOM 0 HA3 GLY A 397 25.238 5.907 5.643 1.00 21.15 H new ATOM 660 N ASN A 398 24.538 7.928 4.400 1.00 62.14 N ATOM 661 CA ASN A 398 24.202 9.242 3.888 1.00 14.43 C ATOM 662 C ASN A 398 24.209 9.242 2.350 1.00 10.42 C ATOM 663 O ASN A 398 23.731 10.178 1.715 1.00 4.23 O ATOM 664 CB ASN A 398 25.240 10.252 4.427 1.00 71.15 C ATOM 665 CG ASN A 398 25.006 11.694 3.998 1.00 62.31 C ATOM 666 OD1 ASN A 398 25.494 12.130 2.952 1.00 3.04 O ATOM 667 ND2 ASN A 398 24.301 12.447 4.810 1.00 3.21 N ATOM 0 H ASN A 398 25.524 7.683 4.306 1.00 62.14 H new ATOM 0 HA ASN A 398 23.201 9.521 4.217 1.00 14.43 H new ATOM 0 HB2 ASN A 398 25.240 10.207 5.516 1.00 71.15 H new ATOM 0 HB3 ASN A 398 26.232 9.945 4.095 1.00 71.15 H new ATOM 0 HD21 ASN A 398 24.141 13.429 4.585 1.00 3.21 H new ATOM 0 HD22 ASN A 398 23.914 12.050 5.666 1.00 3.21 H new ATOM 674 N VAL A 399 24.692 8.165 1.757 1.00 53.45 N ATOM 675 CA VAL A 399 24.848 8.123 0.313 1.00 1.11 C ATOM 676 C VAL A 399 23.851 7.157 -0.334 1.00 54.43 C ATOM 677 O VAL A 399 23.681 6.026 0.112 1.00 11.55 O ATOM 678 CB VAL A 399 26.297 7.743 -0.090 1.00 72.14 C ATOM 679 CG1 VAL A 399 26.455 7.749 -1.600 1.00 54.12 C ATOM 680 CG2 VAL A 399 27.299 8.702 0.543 1.00 15.52 C ATOM 0 H VAL A 399 24.980 7.317 2.245 1.00 53.45 H new ATOM 0 HA VAL A 399 24.640 9.127 -0.056 1.00 1.11 H new ATOM 0 HB VAL A 399 26.495 6.736 0.277 1.00 72.14 H new ATOM 0 HG11 VAL A 399 27.479 7.480 -1.860 1.00 54.12 H new ATOM 0 HG12 VAL A 399 25.767 7.027 -2.041 1.00 54.12 H new ATOM 0 HG13 VAL A 399 26.233 8.744 -1.985 1.00 54.12 H new ATOM 0 HG21 VAL A 399 28.310 8.419 0.249 1.00 15.52 H new ATOM 0 HG22 VAL A 399 27.094 9.718 0.205 1.00 15.52 H new ATOM 0 HG23 VAL A 399 27.211 8.656 1.628 1.00 15.52 H new ATOM 690 N LEU A 400 23.194 7.624 -1.370 1.00 0.22 N ATOM 691 CA LEU A 400 22.206 6.847 -2.108 1.00 23.32 C ATOM 692 C LEU A 400 22.615 6.740 -3.564 1.00 43.44 C ATOM 693 O LEU A 400 23.102 7.720 -4.149 1.00 73.21 O ATOM 694 CB LEU A 400 20.803 7.500 -2.028 1.00 25.24 C ATOM 695 CG LEU A 400 20.008 7.413 -0.714 1.00 45.23 C ATOM 696 CD1 LEU A 400 20.698 8.121 0.442 1.00 55.41 C ATOM 697 CD2 LEU A 400 18.621 7.969 -0.909 1.00 61.52 C ATOM 0 H LEU A 400 23.327 8.567 -1.735 1.00 0.22 H new ATOM 0 HA LEU A 400 22.159 5.856 -1.657 1.00 23.32 H new ATOM 0 HB2 LEU A 400 20.918 8.556 -2.272 1.00 25.24 H new ATOM 0 HB3 LEU A 400 20.190 7.057 -2.812 1.00 25.24 H new ATOM 0 HG LEU A 400 19.949 6.357 -0.449 1.00 45.23 H new ATOM 0 HD11 LEU A 400 20.090 8.026 1.342 1.00 55.41 H new ATOM 0 HD12 LEU A 400 21.675 7.669 0.614 1.00 55.41 H new ATOM 0 HD13 LEU A 400 20.824 9.176 0.199 1.00 55.41 H new ATOM 0 HD21 LEU A 400 18.067 7.902 0.028 1.00 61.52 H new ATOM 0 HD22 LEU A 400 18.687 9.012 -1.218 1.00 61.52 H new ATOM 0 HD23 LEU A 400 18.104 7.395 -1.678 1.00 61.52 H new ATOM 709 N LYS A 401 22.439 5.567 -4.154 1.00 4.32 N ATOM 710 CA LYS A 401 22.755 5.406 -5.558 1.00 62.53 C ATOM 711 C LYS A 401 21.493 5.034 -6.326 1.00 15.11 C ATOM 712 O LYS A 401 20.710 4.166 -5.893 1.00 73.25 O ATOM 713 CB LYS A 401 23.846 4.343 -5.797 1.00 4.42 C ATOM 714 CG LYS A 401 24.932 4.792 -6.792 1.00 55.25 C ATOM 715 CD LYS A 401 24.375 5.171 -8.160 1.00 34.33 C ATOM 716 CE LYS A 401 23.954 3.998 -8.997 1.00 11.01 C ATOM 717 NZ LYS A 401 25.107 3.160 -9.383 1.00 74.42 N ATOM 0 H LYS A 401 22.086 4.730 -3.690 1.00 4.32 H new ATOM 0 HA LYS A 401 23.147 6.357 -5.917 1.00 62.53 H new ATOM 0 HB2 LYS A 401 24.316 4.096 -4.845 1.00 4.42 H new ATOM 0 HB3 LYS A 401 23.379 3.431 -6.168 1.00 4.42 H new ATOM 0 HG2 LYS A 401 25.466 5.646 -6.375 1.00 55.25 H new ATOM 0 HG3 LYS A 401 25.659 3.989 -6.913 1.00 55.25 H new ATOM 0 HD2 LYS A 401 23.519 5.831 -8.022 1.00 34.33 H new ATOM 0 HD3 LYS A 401 25.130 5.739 -8.703 1.00 34.33 H new ATOM 0 HE2 LYS A 401 23.235 3.395 -8.442 1.00 11.01 H new ATOM 0 HE3 LYS A 401 23.447 4.354 -9.894 1.00 11.01 H new ATOM 0 HZ1 LYS A 401 24.833 2.531 -10.165 1.00 74.42 H new ATOM 0 HZ2 LYS A 401 25.893 3.770 -9.688 1.00 74.42 H new ATOM 0 HZ3 LYS A 401 25.409 2.588 -8.568 1.00 74.42 H new ATOM 731 N TYR A 402 21.296 5.690 -7.440 1.00 52.11 N ATOM 732 CA TYR A 402 20.182 5.459 -8.287 1.00 24.33 C ATOM 733 C TYR A 402 20.641 4.697 -9.536 1.00 41.21 C ATOM 734 O TYR A 402 21.434 5.208 -10.309 1.00 64.42 O ATOM 735 CB TYR A 402 19.553 6.793 -8.663 1.00 5.40 C ATOM 736 CG TYR A 402 19.110 7.616 -7.467 1.00 24.12 C ATOM 737 CD1 TYR A 402 17.871 7.416 -6.887 1.00 31.32 C ATOM 738 CD2 TYR A 402 19.937 8.589 -6.921 1.00 62.25 C ATOM 739 CE1 TYR A 402 17.467 8.156 -5.799 1.00 54.31 C ATOM 740 CE2 TYR A 402 19.540 9.332 -5.835 1.00 42.34 C ATOM 741 CZ TYR A 402 18.306 9.113 -5.278 1.00 1.45 C ATOM 742 OH TYR A 402 17.905 9.848 -4.200 1.00 52.12 O ATOM 0 H TYR A 402 21.928 6.415 -7.781 1.00 52.11 H new ATOM 0 HA TYR A 402 19.435 4.856 -7.771 1.00 24.33 H new ATOM 0 HB2 TYR A 402 20.270 7.371 -9.246 1.00 5.40 H new ATOM 0 HB3 TYR A 402 18.692 6.611 -9.307 1.00 5.40 H new ATOM 0 HD1 TYR A 402 17.209 6.666 -7.295 1.00 31.32 H new ATOM 0 HD2 TYR A 402 20.909 8.765 -7.357 1.00 62.25 H new ATOM 0 HE1 TYR A 402 16.496 7.986 -5.357 1.00 54.31 H new ATOM 0 HE2 TYR A 402 20.196 10.084 -5.423 1.00 42.34 H new ATOM 0 HH TYR A 402 17.374 9.284 -3.599 1.00 52.12 H new ATOM 752 N GLU A 403 20.117 3.499 -9.713 1.00 51.15 N ATOM 753 CA GLU A 403 20.508 2.563 -10.785 1.00 73.41 C ATOM 754 C GLU A 403 19.414 2.418 -11.830 1.00 44.24 C ATOM 755 O GLU A 403 18.228 2.627 -11.532 1.00 23.21 O ATOM 756 CB GLU A 403 20.726 1.175 -10.165 1.00 1.22 C ATOM 757 CG GLU A 403 22.016 0.968 -9.410 1.00 0.45 C ATOM 758 CD GLU A 403 23.191 0.709 -10.332 1.00 63.45 C ATOM 759 OE1 GLU A 403 23.644 1.632 -11.031 1.00 21.22 O ATOM 760 OE2 GLU A 403 23.673 -0.441 -10.371 1.00 52.12 O ATOM 0 H GLU A 403 19.387 3.127 -9.106 1.00 51.15 H new ATOM 0 HA GLU A 403 21.409 2.953 -11.258 1.00 73.41 H new ATOM 0 HB2 GLU A 403 19.898 0.971 -9.487 1.00 1.22 H new ATOM 0 HB3 GLU A 403 20.675 0.434 -10.962 1.00 1.22 H new ATOM 0 HG2 GLU A 403 22.223 1.848 -8.801 1.00 0.45 H new ATOM 0 HG3 GLU A 403 21.902 0.127 -8.726 1.00 0.45 H new ATOM 767 N ASN A 404 19.829 2.053 -13.046 1.00 11.34 N ATOM 768 CA ASN A 404 18.928 1.737 -14.165 1.00 24.21 C ATOM 769 C ASN A 404 18.055 2.884 -14.605 1.00 2.10 C ATOM 770 O ASN A 404 16.828 2.767 -14.647 1.00 71.23 O ATOM 771 CB ASN A 404 18.119 0.441 -13.966 1.00 1.20 C ATOM 772 CG ASN A 404 18.998 -0.787 -13.880 1.00 65.53 C ATOM 773 OD1 ASN A 404 19.337 -1.397 -14.901 1.00 40.54 O ATOM 774 ND2 ASN A 404 19.353 -1.180 -12.680 1.00 2.21 N ATOM 0 H ASN A 404 20.816 1.966 -13.288 1.00 11.34 H new ATOM 0 HA ASN A 404 19.610 1.550 -14.994 1.00 24.21 H new ATOM 0 HB2 ASN A 404 17.526 0.523 -13.055 1.00 1.20 H new ATOM 0 HB3 ASN A 404 17.418 0.324 -14.793 1.00 1.20 H new ATOM 0 HD21 ASN A 404 19.928 -2.015 -12.566 1.00 2.21 H new ATOM 0 HD22 ASN A 404 19.054 -0.651 -11.861 1.00 2.21 H new ATOM 781 N GLY A 405 18.665 4.010 -14.859 1.00 64.43 N ATOM 782 CA GLY A 405 17.929 5.148 -15.339 1.00 34.34 C ATOM 783 C GLY A 405 17.572 5.040 -16.817 1.00 54.23 C ATOM 784 O GLY A 405 17.675 3.956 -17.433 1.00 14.45 O ATOM 0 H GLY A 405 19.667 4.164 -14.742 1.00 64.43 H new ATOM 0 HA2 GLY A 405 17.014 5.256 -14.756 1.00 34.34 H new ATOM 0 HA3 GLY A 405 18.518 6.051 -15.177 1.00 34.34 H new ATOM 788 N GLN A 406 17.176 6.152 -17.378 1.00 33.33 N ATOM 789 CA GLN A 406 16.742 6.246 -18.758 1.00 63.42 C ATOM 790 C GLN A 406 17.993 6.186 -19.645 1.00 71.23 C ATOM 791 O GLN A 406 19.055 6.664 -19.229 1.00 74.11 O ATOM 792 CB GLN A 406 15.983 7.591 -18.900 1.00 34.03 C ATOM 793 CG GLN A 406 15.005 7.760 -20.070 1.00 31.13 C ATOM 794 CD GLN A 406 15.626 7.841 -21.437 1.00 32.51 C ATOM 795 OE1 GLN A 406 15.806 6.837 -22.114 1.00 10.51 O ATOM 796 NE2 GLN A 406 15.934 9.034 -21.863 1.00 75.32 N ATOM 0 H GLN A 406 17.143 7.042 -16.881 1.00 33.33 H new ATOM 0 HA GLN A 406 16.078 5.435 -19.058 1.00 63.42 H new ATOM 0 HB2 GLN A 406 15.427 7.757 -17.977 1.00 34.03 H new ATOM 0 HB3 GLN A 406 16.726 8.385 -18.972 1.00 34.03 H new ATOM 0 HG2 GLN A 406 14.306 6.923 -20.058 1.00 31.13 H new ATOM 0 HG3 GLN A 406 14.421 8.665 -19.903 1.00 31.13 H new ATOM 0 HE21 GLN A 406 15.769 9.846 -21.269 1.00 75.32 H new ATOM 0 HE22 GLN A 406 16.340 9.155 -22.791 1.00 75.32 H new ATOM 805 N SER A 407 17.867 5.568 -20.824 1.00 1.00 N ATOM 806 CA SER A 407 18.967 5.394 -21.780 1.00 24.02 C ATOM 807 C SER A 407 19.780 6.680 -21.926 1.00 43.32 C ATOM 808 O SER A 407 19.232 7.776 -22.105 1.00 14.44 O ATOM 809 CB SER A 407 18.420 4.935 -23.148 1.00 11.15 C ATOM 810 OG SER A 407 19.468 4.727 -24.093 1.00 13.40 O ATOM 0 H SER A 407 16.985 5.169 -21.146 1.00 1.00 H new ATOM 0 HA SER A 407 19.633 4.622 -21.395 1.00 24.02 H new ATOM 0 HB2 SER A 407 17.855 4.012 -23.022 1.00 11.15 H new ATOM 0 HB3 SER A 407 17.727 5.683 -23.532 1.00 11.15 H new ATOM 0 HG SER A 407 19.085 4.436 -24.947 1.00 13.40 H new ATOM 816 N CYS A 408 21.066 6.542 -21.837 1.00 74.20 N ATOM 817 CA CYS A 408 21.951 7.671 -21.848 1.00 12.30 C ATOM 818 C CYS A 408 22.406 7.994 -23.254 1.00 3.45 C ATOM 819 O CYS A 408 22.889 9.103 -23.513 1.00 43.01 O ATOM 820 CB CYS A 408 23.157 7.359 -20.966 1.00 11.41 C ATOM 821 SG CYS A 408 24.391 8.690 -20.824 1.00 42.32 S ATOM 0 H CYS A 408 21.536 5.641 -21.754 1.00 74.20 H new ATOM 0 HA CYS A 408 21.420 8.542 -21.463 1.00 12.30 H new ATOM 0 HB2 CYS A 408 22.800 7.111 -19.967 1.00 11.41 H new ATOM 0 HB3 CYS A 408 23.651 6.470 -21.358 1.00 11.41 H new ATOM 826 N ALA A 409 22.218 7.030 -24.161 1.00 51.33 N ATOM 827 CA ALA A 409 22.721 7.120 -25.523 1.00 61.22 C ATOM 828 C ALA A 409 24.229 7.264 -25.471 1.00 20.20 C ATOM 829 O ALA A 409 24.787 8.352 -25.647 1.00 74.54 O ATOM 830 CB ALA A 409 22.059 8.236 -26.335 1.00 53.25 C ATOM 0 H ALA A 409 21.711 6.167 -23.965 1.00 51.33 H new ATOM 0 HA ALA A 409 22.460 6.203 -26.052 1.00 61.22 H new ATOM 0 HB1 ALA A 409 22.477 8.251 -27.341 1.00 53.25 H new ATOM 0 HB2 ALA A 409 20.985 8.057 -26.391 1.00 53.25 H new ATOM 0 HB3 ALA A 409 22.242 9.196 -25.852 1.00 53.25 H new ATOM 836 N ASN A 410 24.864 6.166 -25.147 1.00 44.31 N ATOM 837 CA ASN A 410 26.299 6.101 -24.914 1.00 11.25 C ATOM 838 C ASN A 410 26.697 4.644 -24.813 1.00 22.44 C ATOM 839 O ASN A 410 27.696 4.212 -25.396 1.00 22.25 O ATOM 840 CB ASN A 410 26.655 6.865 -23.597 1.00 41.33 C ATOM 841 CG ASN A 410 28.152 6.881 -23.209 1.00 61.03 C ATOM 842 OD1 ASN A 410 28.914 5.947 -23.467 1.00 24.32 O ATOM 843 ND2 ASN A 410 28.574 7.955 -22.592 1.00 13.32 N ATOM 0 H ASN A 410 24.394 5.268 -25.033 1.00 44.31 H new ATOM 0 HA ASN A 410 26.842 6.571 -25.734 1.00 11.25 H new ATOM 0 HB2 ASN A 410 26.314 7.896 -23.694 1.00 41.33 H new ATOM 0 HB3 ASN A 410 26.092 6.419 -22.777 1.00 41.33 H new ATOM 0 HD21 ASN A 410 29.552 8.032 -22.314 1.00 13.32 H new ATOM 0 HD22 ASN A 410 27.925 8.715 -22.389 1.00 13.32 H new ATOM 850 N GLY A 411 25.901 3.882 -24.099 1.00 61.31 N ATOM 851 CA GLY A 411 26.183 2.484 -23.930 1.00 15.44 C ATOM 852 C GLY A 411 25.652 1.963 -22.621 1.00 55.30 C ATOM 853 O GLY A 411 24.644 1.258 -22.604 1.00 53.01 O ATOM 0 H GLY A 411 25.057 4.209 -23.629 1.00 61.31 H new ATOM 0 HA2 GLY A 411 25.740 1.922 -24.752 1.00 15.44 H new ATOM 0 HA3 GLY A 411 27.260 2.322 -23.976 1.00 15.44 H new ATOM 857 N PRO A 412 26.301 2.303 -21.484 1.00 33.45 N ATOM 858 CA PRO A 412 25.858 1.855 -20.164 1.00 61.41 C ATOM 859 C PRO A 412 24.555 2.514 -19.736 1.00 55.25 C ATOM 860 O PRO A 412 23.997 3.365 -20.450 1.00 32.14 O ATOM 861 CB PRO A 412 26.987 2.292 -19.220 1.00 74.41 C ATOM 862 CG PRO A 412 28.126 2.654 -20.105 1.00 64.30 C ATOM 863 CD PRO A 412 27.516 3.127 -21.388 1.00 65.21 C ATOM 0 HA PRO A 412 25.667 0.782 -20.157 1.00 61.41 H new ATOM 0 HB2 PRO A 412 26.681 3.140 -18.608 1.00 74.41 H new ATOM 0 HB3 PRO A 412 27.261 1.488 -18.537 1.00 74.41 H new ATOM 0 HG2 PRO A 412 28.739 3.434 -19.653 1.00 64.30 H new ATOM 0 HG3 PRO A 412 28.776 1.796 -20.275 1.00 64.30 H new ATOM 0 HD2 PRO A 412 27.283 4.192 -21.359 1.00 65.21 H new ATOM 0 HD3 PRO A 412 28.182 2.969 -22.237 1.00 65.21 H new ATOM 871 N HIS A 413 24.096 2.152 -18.572 1.00 32.45 N ATOM 872 CA HIS A 413 22.864 2.678 -18.056 1.00 0.24 C ATOM 873 C HIS A 413 23.154 3.958 -17.328 1.00 0.32 C ATOM 874 O HIS A 413 24.228 4.112 -16.723 1.00 74.22 O ATOM 875 CB HIS A 413 22.177 1.683 -17.094 1.00 11.02 C ATOM 876 CG HIS A 413 21.820 0.356 -17.705 1.00 73.53 C ATOM 877 ND1 HIS A 413 20.532 -0.003 -18.037 1.00 43.12 N ATOM 878 CD2 HIS A 413 22.593 -0.713 -18.016 1.00 22.41 C ATOM 879 CE1 HIS A 413 20.530 -1.222 -18.524 1.00 42.23 C ATOM 880 NE2 HIS A 413 21.762 -1.678 -18.523 1.00 34.31 N ATOM 0 H HIS A 413 24.563 1.487 -17.956 1.00 32.45 H new ATOM 0 HA HIS A 413 22.186 2.854 -18.891 1.00 0.24 H new ATOM 0 HB2 HIS A 413 22.836 1.509 -16.243 1.00 11.02 H new ATOM 0 HB3 HIS A 413 21.269 2.144 -16.705 1.00 11.02 H new ATOM 0 HD2 HIS A 413 23.663 -0.790 -17.888 1.00 22.41 H new ATOM 0 HE1 HIS A 413 19.660 -1.761 -18.868 1.00 42.23 H new ATOM 0 HE2 HIS A 413 22.053 -2.600 -18.847 1.00 34.31 H new ATOM 889 N ARG A 414 22.237 4.877 -17.403 1.00 42.11 N ATOM 890 CA ARG A 414 22.370 6.115 -16.700 1.00 32.12 C ATOM 891 C ARG A 414 22.080 5.884 -15.231 1.00 70.25 C ATOM 892 O ARG A 414 21.259 5.017 -14.875 1.00 52.51 O ATOM 893 CB ARG A 414 21.451 7.173 -17.319 1.00 32.52 C ATOM 894 CG ARG A 414 21.407 8.500 -16.592 1.00 13.31 C ATOM 895 CD ARG A 414 20.608 9.522 -17.371 1.00 14.31 C ATOM 896 NE ARG A 414 21.313 9.963 -18.586 1.00 0.43 N ATOM 897 CZ ARG A 414 20.730 10.264 -19.755 1.00 32.31 C ATOM 898 NH1 ARG A 414 19.439 10.026 -19.946 1.00 33.44 N ATOM 899 NH2 ARG A 414 21.458 10.777 -20.743 1.00 74.34 N ATOM 0 H ARG A 414 21.381 4.789 -17.950 1.00 42.11 H new ATOM 0 HA ARG A 414 23.389 6.493 -16.785 1.00 32.12 H new ATOM 0 HB2 ARG A 414 21.770 7.351 -18.346 1.00 32.52 H new ATOM 0 HB3 ARG A 414 20.440 6.769 -17.365 1.00 32.52 H new ATOM 0 HG2 ARG A 414 20.964 8.363 -15.605 1.00 13.31 H new ATOM 0 HG3 ARG A 414 22.422 8.868 -16.438 1.00 13.31 H new ATOM 0 HD2 ARG A 414 19.644 9.095 -17.646 1.00 14.31 H new ATOM 0 HD3 ARG A 414 20.405 10.384 -16.736 1.00 14.31 H new ATOM 0 HE ARG A 414 22.328 10.046 -18.534 1.00 0.43 H new ATOM 0 HH11 ARG A 414 18.881 9.611 -19.200 1.00 33.44 H new ATOM 0 HH12 ARG A 414 19.004 10.258 -20.839 1.00 33.44 H new ATOM 0 HH21 ARG A 414 22.456 10.940 -20.610 1.00 74.34 H new ATOM 0 HH22 ARG A 414 21.018 11.007 -21.634 1.00 74.34 H new ATOM 913 N SER A 415 22.761 6.602 -14.397 1.00 73.41 N ATOM 914 CA SER A 415 22.630 6.457 -12.993 1.00 21.41 C ATOM 915 C SER A 415 22.868 7.789 -12.277 1.00 24.53 C ATOM 916 O SER A 415 23.319 8.765 -12.888 1.00 71.43 O ATOM 917 CB SER A 415 23.558 5.319 -12.518 1.00 24.11 C ATOM 918 OG SER A 415 24.868 5.414 -13.076 1.00 41.35 O ATOM 0 H SER A 415 23.433 7.315 -14.682 1.00 73.41 H new ATOM 0 HA SER A 415 21.609 6.175 -12.735 1.00 21.41 H new ATOM 0 HB2 SER A 415 23.627 5.341 -11.430 1.00 24.11 H new ATOM 0 HB3 SER A 415 23.119 4.359 -12.790 1.00 24.11 H new ATOM 0 HG SER A 415 25.533 5.214 -12.385 1.00 41.35 H new ATOM 924 N ALA A 416 22.539 7.844 -11.011 1.00 13.51 N ATOM 925 CA ALA A 416 22.691 9.058 -10.238 1.00 34.52 C ATOM 926 C ALA A 416 23.224 8.728 -8.861 1.00 12.43 C ATOM 927 O ALA A 416 22.765 7.787 -8.230 1.00 4.44 O ATOM 928 CB ALA A 416 21.350 9.802 -10.139 1.00 22.25 C ATOM 0 H ALA A 416 22.160 7.055 -10.487 1.00 13.51 H new ATOM 0 HA ALA A 416 23.404 9.711 -10.740 1.00 34.52 H new ATOM 0 HB1 ALA A 416 21.481 10.713 -9.555 1.00 22.25 H new ATOM 0 HB2 ALA A 416 21.002 10.060 -11.139 1.00 22.25 H new ATOM 0 HB3 ALA A 416 20.614 9.162 -9.653 1.00 22.25 H new ATOM 934 N ILE A 417 24.187 9.478 -8.411 1.00 54.43 N ATOM 935 CA ILE A 417 24.784 9.280 -7.103 1.00 1.44 C ATOM 936 C ILE A 417 24.562 10.536 -6.266 1.00 41.12 C ATOM 937 O ILE A 417 24.930 11.633 -6.681 1.00 30.24 O ATOM 938 CB ILE A 417 26.323 8.946 -7.220 1.00 10.01 C ATOM 939 CG1 ILE A 417 26.995 8.785 -5.851 1.00 32.41 C ATOM 940 CG2 ILE A 417 27.061 9.944 -8.061 1.00 11.30 C ATOM 941 CD1 ILE A 417 26.516 7.600 -5.061 1.00 63.23 C ATOM 0 H ILE A 417 24.590 10.253 -8.938 1.00 54.43 H new ATOM 0 HA ILE A 417 24.308 8.428 -6.617 1.00 1.44 H new ATOM 0 HB ILE A 417 26.378 7.982 -7.727 1.00 10.01 H new ATOM 0 HG12 ILE A 417 28.072 8.699 -5.996 1.00 32.41 H new ATOM 0 HG13 ILE A 417 26.824 9.689 -5.267 1.00 32.41 H new ATOM 0 HG21 ILE A 417 28.115 9.670 -8.110 1.00 11.30 H new ATOM 0 HG22 ILE A 417 26.641 9.954 -9.067 1.00 11.30 H new ATOM 0 HG23 ILE A 417 26.964 10.935 -7.618 1.00 11.30 H new ATOM 0 HD11 ILE A 417 27.043 7.562 -4.107 1.00 63.23 H new ATOM 0 HD12 ILE A 417 25.445 7.692 -4.881 1.00 63.23 H new ATOM 0 HD13 ILE A 417 26.713 6.686 -5.621 1.00 63.23 H new ATOM 953 N VAL A 418 23.947 10.400 -5.116 1.00 12.43 N ATOM 954 CA VAL A 418 23.675 11.572 -4.323 1.00 31.13 C ATOM 955 C VAL A 418 24.670 11.695 -3.171 1.00 45.34 C ATOM 956 O VAL A 418 24.936 10.735 -2.439 1.00 23.40 O ATOM 957 CB VAL A 418 22.194 11.638 -3.791 1.00 22.11 C ATOM 958 CG1 VAL A 418 21.916 10.590 -2.756 1.00 2.21 C ATOM 959 CG2 VAL A 418 21.840 13.031 -3.280 1.00 3.14 C ATOM 0 H VAL A 418 23.633 9.515 -4.717 1.00 12.43 H new ATOM 0 HA VAL A 418 23.798 12.424 -4.991 1.00 31.13 H new ATOM 0 HB VAL A 418 21.547 11.425 -4.642 1.00 22.11 H new ATOM 0 HG11 VAL A 418 20.883 10.676 -2.420 1.00 2.21 H new ATOM 0 HG12 VAL A 418 22.077 9.602 -3.187 1.00 2.21 H new ATOM 0 HG13 VAL A 418 22.586 10.729 -1.908 1.00 2.21 H new ATOM 0 HG21 VAL A 418 20.811 13.036 -2.922 1.00 3.14 H new ATOM 0 HG22 VAL A 418 22.510 13.300 -2.463 1.00 3.14 H new ATOM 0 HG23 VAL A 418 21.946 13.753 -4.089 1.00 3.14 H new ATOM 969 N THR A 419 25.248 12.840 -3.066 1.00 14.20 N ATOM 970 CA THR A 419 26.113 13.176 -2.000 1.00 63.04 C ATOM 971 C THR A 419 25.453 14.311 -1.239 1.00 30.23 C ATOM 972 O THR A 419 25.259 15.406 -1.781 1.00 45.05 O ATOM 973 CB THR A 419 27.476 13.650 -2.547 1.00 14.41 C ATOM 974 OG1 THR A 419 28.028 12.628 -3.401 1.00 33.35 O ATOM 975 CG2 THR A 419 28.447 13.938 -1.410 1.00 33.50 C ATOM 0 H THR A 419 25.125 13.591 -3.745 1.00 14.20 H new ATOM 0 HA THR A 419 26.286 12.312 -1.358 1.00 63.04 H new ATOM 0 HB THR A 419 27.323 14.569 -3.113 1.00 14.41 H new ATOM 0 HG1 THR A 419 28.893 12.927 -3.752 1.00 33.35 H new ATOM 0 HG21 THR A 419 29.400 14.270 -1.821 1.00 33.50 H new ATOM 0 HG22 THR A 419 28.036 14.718 -0.769 1.00 33.50 H new ATOM 0 HG23 THR A 419 28.601 13.032 -0.824 1.00 33.50 H new ATOM 983 N VAL A 420 25.072 14.061 -0.019 1.00 64.44 N ATOM 984 CA VAL A 420 24.421 15.071 0.747 1.00 15.23 C ATOM 985 C VAL A 420 25.409 15.625 1.752 1.00 2.01 C ATOM 986 O VAL A 420 26.090 14.873 2.435 1.00 23.24 O ATOM 987 CB VAL A 420 23.160 14.525 1.466 1.00 54.43 C ATOM 988 CG1 VAL A 420 22.378 15.653 2.104 1.00 20.31 C ATOM 989 CG2 VAL A 420 22.275 13.742 0.504 1.00 70.04 C ATOM 0 H VAL A 420 25.202 13.170 0.460 1.00 64.44 H new ATOM 0 HA VAL A 420 24.084 15.861 0.076 1.00 15.23 H new ATOM 0 HB VAL A 420 23.491 13.845 2.251 1.00 54.43 H new ATOM 0 HG11 VAL A 420 21.497 15.248 2.603 1.00 20.31 H new ATOM 0 HG12 VAL A 420 23.006 16.164 2.834 1.00 20.31 H new ATOM 0 HG13 VAL A 420 22.067 16.360 1.335 1.00 20.31 H new ATOM 0 HG21 VAL A 420 21.399 13.371 1.036 1.00 70.04 H new ATOM 0 HG22 VAL A 420 21.957 14.393 -0.310 1.00 70.04 H new ATOM 0 HG23 VAL A 420 22.835 12.900 0.097 1.00 70.04 H new ATOM 999 N GLU A 421 25.523 16.920 1.816 1.00 11.22 N ATOM 1000 CA GLU A 421 26.475 17.538 2.721 1.00 11.11 C ATOM 1001 C GLU A 421 25.799 18.224 3.897 1.00 11.40 C ATOM 1002 O GLU A 421 26.452 18.902 4.694 1.00 0.54 O ATOM 1003 CB GLU A 421 27.399 18.475 1.963 1.00 3.41 C ATOM 1004 CG GLU A 421 26.706 19.540 1.142 1.00 64.20 C ATOM 1005 CD GLU A 421 27.703 20.378 0.402 1.00 60.35 C ATOM 1006 OE1 GLU A 421 28.163 19.958 -0.673 1.00 70.15 O ATOM 1007 OE2 GLU A 421 28.065 21.458 0.898 1.00 53.11 O ATOM 0 H GLU A 421 24.975 17.575 1.258 1.00 11.22 H new ATOM 0 HA GLU A 421 27.084 16.743 3.152 1.00 11.11 H new ATOM 0 HB2 GLU A 421 28.061 18.964 2.678 1.00 3.41 H new ATOM 0 HB3 GLU A 421 28.029 17.881 1.301 1.00 3.41 H new ATOM 0 HG2 GLU A 421 26.022 19.072 0.434 1.00 64.20 H new ATOM 0 HG3 GLU A 421 26.105 20.174 1.794 1.00 64.20 H new ATOM 1014 N CYS A 422 24.496 18.007 4.003 1.00 72.51 N ATOM 1015 CA CYS A 422 23.644 18.539 5.074 1.00 2.34 C ATOM 1016 C CYS A 422 23.526 20.073 5.038 1.00 52.53 C ATOM 1017 O CYS A 422 24.419 20.778 4.565 1.00 40.02 O ATOM 1018 CB CYS A 422 24.079 18.041 6.463 1.00 52.11 C ATOM 1019 SG CYS A 422 22.983 18.570 7.820 1.00 43.30 S ATOM 0 H CYS A 422 23.981 17.440 3.330 1.00 72.51 H new ATOM 0 HA CYS A 422 22.646 18.145 4.883 1.00 2.34 H new ATOM 0 HB2 CYS A 422 24.123 16.952 6.449 1.00 52.11 H new ATOM 0 HB3 CYS A 422 25.089 18.398 6.665 1.00 52.11 H new ATOM 1024 N GLY A 423 22.420 20.569 5.515 1.00 5.21 N ATOM 1025 CA GLY A 423 22.165 21.979 5.490 1.00 42.21 C ATOM 1026 C GLY A 423 21.079 22.327 6.453 1.00 21.22 C ATOM 1027 O GLY A 423 20.805 21.558 7.372 1.00 60.14 O ATOM 0 H GLY A 423 21.674 20.010 5.930 1.00 5.21 H new ATOM 0 HA2 GLY A 423 23.074 22.524 5.744 1.00 42.21 H new ATOM 0 HA3 GLY A 423 21.880 22.286 4.484 1.00 42.21 H new ATOM 1031 N VAL A 424 20.447 23.447 6.253 1.00 13.51 N ATOM 1032 CA VAL A 424 19.391 23.890 7.145 1.00 23.10 C ATOM 1033 C VAL A 424 18.029 23.540 6.540 1.00 31.51 C ATOM 1034 O VAL A 424 17.033 23.355 7.250 1.00 63.22 O ATOM 1035 CB VAL A 424 19.476 25.418 7.396 1.00 2.31 C ATOM 1036 CG1 VAL A 424 18.467 25.858 8.447 1.00 15.52 C ATOM 1037 CG2 VAL A 424 20.884 25.826 7.798 1.00 13.41 C ATOM 0 H VAL A 424 20.639 24.081 5.477 1.00 13.51 H new ATOM 0 HA VAL A 424 19.512 23.381 8.101 1.00 23.10 H new ATOM 0 HB VAL A 424 19.230 25.922 6.461 1.00 2.31 H new ATOM 0 HG11 VAL A 424 18.549 26.934 8.603 1.00 15.52 H new ATOM 0 HG12 VAL A 424 17.460 25.616 8.108 1.00 15.52 H new ATOM 0 HG13 VAL A 424 18.668 25.339 9.384 1.00 15.52 H new ATOM 0 HG21 VAL A 424 20.916 26.902 7.968 1.00 13.41 H new ATOM 0 HG22 VAL A 424 21.166 25.305 8.713 1.00 13.41 H new ATOM 0 HG23 VAL A 424 21.580 25.563 7.002 1.00 13.41 H new ATOM 1047 N GLU A 425 18.005 23.425 5.237 1.00 5.01 N ATOM 1048 CA GLU A 425 16.816 23.108 4.488 1.00 45.24 C ATOM 1049 C GLU A 425 17.204 22.167 3.371 1.00 43.25 C ATOM 1050 O GLU A 425 18.375 22.112 3.014 1.00 43.31 O ATOM 1051 CB GLU A 425 16.211 24.406 3.933 1.00 61.12 C ATOM 1052 CG GLU A 425 14.968 24.233 3.070 1.00 73.45 C ATOM 1053 CD GLU A 425 14.433 25.539 2.551 1.00 13.44 C ATOM 1054 OE1 GLU A 425 14.914 26.024 1.513 1.00 21.32 O ATOM 1055 OE2 GLU A 425 13.507 26.102 3.177 1.00 35.12 O ATOM 0 H GLU A 425 18.832 23.552 4.653 1.00 5.01 H new ATOM 0 HA GLU A 425 16.068 22.627 5.119 1.00 45.24 H new ATOM 0 HB2 GLU A 425 15.963 25.058 4.771 1.00 61.12 H new ATOM 0 HB3 GLU A 425 16.972 24.919 3.345 1.00 61.12 H new ATOM 0 HG2 GLU A 425 15.203 23.582 2.228 1.00 73.45 H new ATOM 0 HG3 GLU A 425 14.193 23.734 3.652 1.00 73.45 H new ATOM 1062 N ASN A 426 16.245 21.403 2.845 1.00 1.44 N ATOM 1063 CA ASN A 426 16.543 20.506 1.732 1.00 75.24 C ATOM 1064 C ASN A 426 16.664 21.301 0.469 1.00 4.50 C ATOM 1065 O ASN A 426 15.713 21.980 0.055 1.00 5.45 O ATOM 1066 CB ASN A 426 15.497 19.376 1.511 1.00 63.41 C ATOM 1067 CG ASN A 426 15.396 18.342 2.620 1.00 10.32 C ATOM 1068 OD1 ASN A 426 15.181 17.174 2.358 1.00 73.15 O ATOM 1069 ND2 ASN A 426 15.488 18.752 3.849 1.00 62.32 N ATOM 0 H ASN A 426 15.276 21.387 3.164 1.00 1.44 H new ATOM 0 HA ASN A 426 17.479 20.013 1.995 1.00 75.24 H new ATOM 0 HB2 ASN A 426 14.517 19.835 1.377 1.00 63.41 H new ATOM 0 HB3 ASN A 426 15.737 18.861 0.581 1.00 63.41 H new ATOM 0 HD21 ASN A 426 15.379 18.090 4.617 1.00 62.32 H new ATOM 0 HD22 ASN A 426 15.669 19.736 4.046 1.00 62.32 H new ATOM 1076 N GLU A 427 17.808 21.255 -0.129 1.00 10.41 N ATOM 1077 CA GLU A 427 18.034 21.949 -1.352 1.00 62.12 C ATOM 1078 C GLU A 427 19.104 21.258 -2.155 1.00 13.24 C ATOM 1079 O GLU A 427 20.028 20.649 -1.595 1.00 42.14 O ATOM 1080 CB GLU A 427 18.389 23.423 -1.098 1.00 4.00 C ATOM 1081 CG GLU A 427 19.605 23.632 -0.223 1.00 61.11 C ATOM 1082 CD GLU A 427 19.911 25.082 -0.002 1.00 45.55 C ATOM 1083 OE1 GLU A 427 20.623 25.680 -0.844 1.00 24.31 O ATOM 1084 OE2 GLU A 427 19.465 25.648 1.021 1.00 43.42 O ATOM 0 H GLU A 427 18.614 20.734 0.218 1.00 10.41 H new ATOM 0 HA GLU A 427 17.110 21.934 -1.931 1.00 62.12 H new ATOM 0 HB2 GLU A 427 18.558 23.914 -2.057 1.00 4.00 H new ATOM 0 HB3 GLU A 427 17.534 23.915 -0.634 1.00 4.00 H new ATOM 0 HG2 GLU A 427 19.443 23.147 0.740 1.00 61.11 H new ATOM 0 HG3 GLU A 427 20.467 23.148 -0.683 1.00 61.11 H new ATOM 1091 N ILE A 428 18.951 21.306 -3.448 1.00 72.22 N ATOM 1092 CA ILE A 428 19.914 20.742 -4.366 1.00 72.32 C ATOM 1093 C ILE A 428 21.007 21.773 -4.582 1.00 63.22 C ATOM 1094 O ILE A 428 20.717 22.955 -4.792 1.00 30.22 O ATOM 1095 CB ILE A 428 19.248 20.379 -5.724 1.00 23.32 C ATOM 1096 CG1 ILE A 428 17.981 19.542 -5.466 1.00 51.33 C ATOM 1097 CG2 ILE A 428 20.232 19.611 -6.612 1.00 60.43 C ATOM 1098 CD1 ILE A 428 17.255 19.075 -6.712 1.00 54.03 C ATOM 0 H ILE A 428 18.149 21.741 -3.904 1.00 72.22 H new ATOM 0 HA ILE A 428 20.326 19.823 -3.948 1.00 72.32 H new ATOM 0 HB ILE A 428 18.968 21.295 -6.244 1.00 23.32 H new ATOM 0 HG12 ILE A 428 18.256 18.668 -4.875 1.00 51.33 H new ATOM 0 HG13 ILE A 428 17.291 20.132 -4.862 1.00 51.33 H new ATOM 0 HG21 ILE A 428 19.751 19.364 -7.559 1.00 60.43 H new ATOM 0 HG22 ILE A 428 21.110 20.229 -6.801 1.00 60.43 H new ATOM 0 HG23 ILE A 428 20.536 18.693 -6.109 1.00 60.43 H new ATOM 0 HD11 ILE A 428 16.378 18.495 -6.426 1.00 54.03 H new ATOM 0 HD12 ILE A 428 16.943 19.940 -7.297 1.00 54.03 H new ATOM 0 HD13 ILE A 428 17.922 18.454 -7.310 1.00 54.03 H new ATOM 1110 N VAL A 429 22.235 21.349 -4.477 1.00 43.25 N ATOM 1111 CA VAL A 429 23.357 22.253 -4.587 1.00 10.14 C ATOM 1112 C VAL A 429 23.888 22.306 -6.020 1.00 42.44 C ATOM 1113 O VAL A 429 23.822 23.345 -6.674 1.00 34.21 O ATOM 1114 CB VAL A 429 24.507 21.849 -3.621 1.00 73.33 C ATOM 1115 CG1 VAL A 429 25.669 22.829 -3.706 1.00 62.42 C ATOM 1116 CG2 VAL A 429 23.997 21.742 -2.188 1.00 13.21 C ATOM 0 H VAL A 429 22.491 20.375 -4.314 1.00 43.25 H new ATOM 0 HA VAL A 429 22.996 23.243 -4.308 1.00 10.14 H new ATOM 0 HB VAL A 429 24.872 20.870 -3.930 1.00 73.33 H new ATOM 0 HG11 VAL A 429 26.457 22.520 -3.019 1.00 62.42 H new ATOM 0 HG12 VAL A 429 26.059 22.843 -4.724 1.00 62.42 H new ATOM 0 HG13 VAL A 429 25.324 23.827 -3.436 1.00 62.42 H new ATOM 0 HG21 VAL A 429 24.818 21.458 -1.530 1.00 13.21 H new ATOM 0 HG22 VAL A 429 23.595 22.705 -1.872 1.00 13.21 H new ATOM 0 HG23 VAL A 429 23.213 20.986 -2.136 1.00 13.21 H new ATOM 1126 N SER A 430 24.383 21.188 -6.503 1.00 24.31 N ATOM 1127 CA SER A 430 25.002 21.132 -7.808 1.00 40.13 C ATOM 1128 C SER A 430 24.981 19.692 -8.306 1.00 21.41 C ATOM 1129 O SER A 430 24.904 18.757 -7.494 1.00 14.13 O ATOM 1130 CB SER A 430 26.457 21.641 -7.685 1.00 50.41 C ATOM 1131 OG SER A 430 27.141 21.663 -8.933 1.00 30.03 O ATOM 0 H SER A 430 24.368 20.298 -6.006 1.00 24.31 H new ATOM 0 HA SER A 430 24.461 21.757 -8.518 1.00 40.13 H new ATOM 0 HB2 SER A 430 26.451 22.645 -7.261 1.00 50.41 H new ATOM 0 HB3 SER A 430 27.002 21.004 -6.988 1.00 50.41 H new ATOM 0 HG SER A 430 28.054 21.994 -8.800 1.00 30.03 H new ATOM 1137 N VAL A 431 25.013 19.510 -9.623 1.00 50.21 N ATOM 1138 CA VAL A 431 25.039 18.183 -10.222 1.00 41.24 C ATOM 1139 C VAL A 431 26.066 18.154 -11.353 1.00 61.31 C ATOM 1140 O VAL A 431 26.073 19.043 -12.214 1.00 43.15 O ATOM 1141 CB VAL A 431 23.658 17.755 -10.798 1.00 3.54 C ATOM 1142 CG1 VAL A 431 23.736 16.334 -11.341 1.00 62.32 C ATOM 1143 CG2 VAL A 431 22.548 17.873 -9.757 1.00 41.12 C ATOM 0 H VAL A 431 25.022 20.273 -10.299 1.00 50.21 H new ATOM 0 HA VAL A 431 25.303 17.483 -9.429 1.00 41.24 H new ATOM 0 HB VAL A 431 23.410 18.435 -11.613 1.00 3.54 H new ATOM 0 HG11 VAL A 431 22.765 16.044 -11.742 1.00 62.32 H new ATOM 0 HG12 VAL A 431 24.484 16.288 -12.133 1.00 62.32 H new ATOM 0 HG13 VAL A 431 24.015 15.652 -10.538 1.00 62.32 H new ATOM 0 HG21 VAL A 431 21.600 17.565 -10.199 1.00 41.12 H new ATOM 0 HG22 VAL A 431 22.777 17.231 -8.906 1.00 41.12 H new ATOM 0 HG23 VAL A 431 22.473 18.907 -9.421 1.00 41.12 H new ATOM 1153 N LEU A 432 26.924 17.158 -11.355 1.00 62.31 N ATOM 1154 CA LEU A 432 27.954 17.044 -12.387 1.00 60.35 C ATOM 1155 C LEU A 432 28.081 15.612 -12.910 1.00 12.45 C ATOM 1156 O LEU A 432 28.100 14.664 -12.133 1.00 61.12 O ATOM 1157 CB LEU A 432 29.314 17.512 -11.839 1.00 4.54 C ATOM 1158 CG LEU A 432 30.507 17.432 -12.809 1.00 62.54 C ATOM 1159 CD1 LEU A 432 30.308 18.352 -14.007 1.00 73.21 C ATOM 1160 CD2 LEU A 432 31.804 17.753 -12.092 1.00 60.33 C ATOM 0 H LEU A 432 26.937 16.412 -10.659 1.00 62.31 H new ATOM 0 HA LEU A 432 27.652 17.683 -13.217 1.00 60.35 H new ATOM 0 HB2 LEU A 432 29.212 18.545 -11.508 1.00 4.54 H new ATOM 0 HB3 LEU A 432 29.550 16.917 -10.957 1.00 4.54 H new ATOM 0 HG LEU A 432 30.566 16.410 -13.182 1.00 62.54 H new ATOM 0 HD11 LEU A 432 31.167 18.273 -14.673 1.00 73.21 H new ATOM 0 HD12 LEU A 432 29.405 18.061 -14.543 1.00 73.21 H new ATOM 0 HD13 LEU A 432 30.209 19.382 -13.663 1.00 73.21 H new ATOM 0 HD21 LEU A 432 32.634 17.691 -12.796 1.00 60.33 H new ATOM 0 HD22 LEU A 432 31.752 18.761 -11.680 1.00 60.33 H new ATOM 0 HD23 LEU A 432 31.959 17.038 -11.284 1.00 60.33 H new ATOM 1172 N GLU A 433 28.150 15.462 -14.215 1.00 55.02 N ATOM 1173 CA GLU A 433 28.413 14.170 -14.822 1.00 2.32 C ATOM 1174 C GLU A 433 29.918 13.934 -14.744 1.00 1.13 C ATOM 1175 O GLU A 433 30.697 14.648 -15.384 1.00 14.14 O ATOM 1176 CB GLU A 433 27.955 14.158 -16.296 1.00 11.41 C ATOM 1177 CG GLU A 433 28.126 12.811 -17.003 1.00 53.12 C ATOM 1178 CD GLU A 433 27.704 12.853 -18.461 1.00 21.14 C ATOM 1179 OE1 GLU A 433 26.506 12.643 -18.762 1.00 22.34 O ATOM 1180 OE2 GLU A 433 28.562 13.083 -19.329 1.00 64.15 O ATOM 0 H GLU A 433 28.027 16.223 -14.883 1.00 55.02 H new ATOM 0 HA GLU A 433 27.865 13.386 -14.299 1.00 2.32 H new ATOM 0 HB2 GLU A 433 26.905 14.446 -16.339 1.00 11.41 H new ATOM 0 HB3 GLU A 433 28.516 14.915 -16.844 1.00 11.41 H new ATOM 0 HG2 GLU A 433 29.170 12.503 -16.941 1.00 53.12 H new ATOM 0 HG3 GLU A 433 27.539 12.055 -16.481 1.00 53.12 H new ATOM 1187 N ALA A 434 30.338 12.982 -13.944 1.00 63.11 N ATOM 1188 CA ALA A 434 31.763 12.744 -13.766 1.00 53.33 C ATOM 1189 C ALA A 434 32.071 11.281 -13.836 1.00 33.33 C ATOM 1190 O ALA A 434 33.212 10.857 -13.655 1.00 51.20 O ATOM 1191 CB ALA A 434 32.217 13.306 -12.443 1.00 24.40 C ATOM 0 H ALA A 434 29.728 12.364 -13.410 1.00 63.11 H new ATOM 0 HA ALA A 434 32.299 13.245 -14.571 1.00 53.33 H new ATOM 0 HB1 ALA A 434 33.284 13.124 -12.317 1.00 24.40 H new ATOM 0 HB2 ALA A 434 32.027 14.379 -12.419 1.00 24.40 H new ATOM 0 HB3 ALA A 434 31.669 12.822 -11.635 1.00 24.40 H new ATOM 1197 N GLN A 435 31.070 10.523 -14.104 1.00 25.33 N ATOM 1198 CA GLN A 435 31.183 9.129 -14.163 1.00 31.40 C ATOM 1199 C GLN A 435 30.214 8.655 -15.231 1.00 71.51 C ATOM 1200 O GLN A 435 29.325 9.419 -15.590 1.00 4.03 O ATOM 1201 CB GLN A 435 30.838 8.573 -12.789 1.00 63.11 C ATOM 1202 CG GLN A 435 31.017 7.101 -12.666 1.00 71.24 C ATOM 1203 CD GLN A 435 30.699 6.573 -11.284 1.00 31.41 C ATOM 1204 OE1 GLN A 435 30.278 5.438 -11.133 1.00 44.33 O ATOM 1205 NE2 GLN A 435 30.906 7.376 -10.272 1.00 60.11 N ATOM 0 H GLN A 435 30.131 10.873 -14.291 1.00 25.33 H new ATOM 0 HA GLN A 435 32.187 8.791 -14.419 1.00 31.40 H new ATOM 0 HB2 GLN A 435 31.460 9.067 -12.042 1.00 63.11 H new ATOM 0 HB3 GLN A 435 29.803 8.823 -12.557 1.00 63.11 H new ATOM 0 HG2 GLN A 435 30.377 6.602 -13.394 1.00 71.24 H new ATOM 0 HG3 GLN A 435 32.046 6.845 -12.917 1.00 71.24 H new ATOM 0 HE21 GLN A 435 31.259 8.319 -10.433 1.00 60.11 H new ATOM 0 HE22 GLN A 435 30.715 7.059 -9.322 1.00 60.11 H new ATOM 1214 N LYS A 436 30.410 7.423 -15.734 1.00 24.43 N ATOM 1215 CA LYS A 436 29.597 6.789 -16.814 1.00 51.05 C ATOM 1216 C LYS A 436 28.088 7.079 -16.777 1.00 31.24 C ATOM 1217 O LYS A 436 27.312 6.320 -16.246 1.00 73.11 O ATOM 1218 CB LYS A 436 29.918 5.259 -16.947 1.00 45.31 C ATOM 1219 CG LYS A 436 30.047 4.431 -15.609 1.00 32.11 C ATOM 1220 CD LYS A 436 28.763 4.322 -14.754 1.00 5.03 C ATOM 1221 CE LYS A 436 27.632 3.587 -15.485 1.00 25.55 C ATOM 1222 NZ LYS A 436 26.395 3.487 -14.667 1.00 32.40 N ATOM 0 H LYS A 436 31.157 6.815 -15.398 1.00 24.43 H new ATOM 0 HA LYS A 436 29.918 7.288 -17.728 1.00 51.05 H new ATOM 0 HB2 LYS A 436 29.137 4.801 -17.554 1.00 45.31 H new ATOM 0 HB3 LYS A 436 30.852 5.156 -17.499 1.00 45.31 H new ATOM 0 HG2 LYS A 436 30.380 3.424 -15.859 1.00 32.11 H new ATOM 0 HG3 LYS A 436 30.829 4.883 -14.999 1.00 32.11 H new ATOM 0 HD2 LYS A 436 28.992 3.799 -13.826 1.00 5.03 H new ATOM 0 HD3 LYS A 436 28.426 5.322 -14.481 1.00 5.03 H new ATOM 0 HE2 LYS A 436 27.407 4.108 -16.416 1.00 25.55 H new ATOM 0 HE3 LYS A 436 27.968 2.585 -15.753 1.00 25.55 H new ATOM 0 HZ1 LYS A 436 25.573 3.370 -15.293 1.00 32.40 H new ATOM 0 HZ2 LYS A 436 26.465 2.667 -14.031 1.00 32.40 H new ATOM 0 HZ3 LYS A 436 26.281 4.353 -14.103 1.00 32.40 H new ATOM 1236 N CYS A 437 27.694 8.223 -17.326 1.00 63.33 N ATOM 1237 CA CYS A 437 26.299 8.654 -17.315 1.00 3.10 C ATOM 1238 C CYS A 437 25.744 8.693 -15.887 1.00 64.13 C ATOM 1239 O CYS A 437 24.530 8.660 -15.682 1.00 5.32 O ATOM 1240 CB CYS A 437 25.461 7.733 -18.190 1.00 41.22 C ATOM 1241 SG CYS A 437 25.947 7.752 -19.939 1.00 50.34 S ATOM 0 H CYS A 437 28.328 8.875 -17.789 1.00 63.33 H new ATOM 0 HA CYS A 437 26.250 9.665 -17.719 1.00 3.10 H new ATOM 0 HB2 CYS A 437 25.540 6.714 -17.811 1.00 41.22 H new ATOM 0 HB3 CYS A 437 24.413 8.023 -18.109 1.00 41.22 H new ATOM 1246 N GLU A 438 26.638 8.787 -14.916 1.00 22.53 N ATOM 1247 CA GLU A 438 26.257 8.819 -13.551 1.00 12.32 C ATOM 1248 C GLU A 438 26.503 10.206 -13.030 1.00 32.33 C ATOM 1249 O GLU A 438 27.634 10.726 -13.072 1.00 74.13 O ATOM 1250 CB GLU A 438 26.969 7.726 -12.727 1.00 33.33 C ATOM 1251 CG GLU A 438 26.440 7.615 -11.291 1.00 65.54 C ATOM 1252 CD GLU A 438 26.907 6.366 -10.572 1.00 12.32 C ATOM 1253 OE1 GLU A 438 26.375 5.264 -10.879 1.00 13.23 O ATOM 1254 OE2 GLU A 438 27.762 6.451 -9.684 1.00 1.32 O ATOM 0 H GLU A 438 27.644 8.842 -15.073 1.00 22.53 H new ATOM 0 HA GLU A 438 25.196 8.590 -13.454 1.00 12.32 H new ATOM 0 HB2 GLU A 438 26.848 6.765 -13.228 1.00 33.33 H new ATOM 0 HB3 GLU A 438 28.038 7.939 -12.699 1.00 33.33 H new ATOM 0 HG2 GLU A 438 26.758 8.491 -10.726 1.00 65.54 H new ATOM 0 HG3 GLU A 438 25.350 7.627 -11.311 1.00 65.54 H new ATOM 1261 N TYR A 439 25.450 10.807 -12.588 1.00 54.20 N ATOM 1262 CA TYR A 439 25.455 12.182 -12.202 1.00 52.50 C ATOM 1263 C TYR A 439 25.663 12.356 -10.723 1.00 33.33 C ATOM 1264 O TYR A 439 24.938 11.776 -9.908 1.00 21.42 O ATOM 1265 CB TYR A 439 24.157 12.847 -12.692 1.00 62.13 C ATOM 1266 CG TYR A 439 24.045 12.804 -14.191 1.00 33.41 C ATOM 1267 CD1 TYR A 439 24.560 13.819 -14.975 1.00 41.04 C ATOM 1268 CD2 TYR A 439 23.457 11.722 -14.825 1.00 52.30 C ATOM 1269 CE1 TYR A 439 24.491 13.754 -16.350 1.00 32.35 C ATOM 1270 CE2 TYR A 439 23.380 11.657 -16.193 1.00 10.32 C ATOM 1271 CZ TYR A 439 23.898 12.667 -16.950 1.00 72.44 C ATOM 1272 OH TYR A 439 23.836 12.590 -18.323 1.00 70.45 O ATOM 0 H TYR A 439 24.544 10.350 -12.482 1.00 54.20 H new ATOM 0 HA TYR A 439 26.303 12.678 -12.674 1.00 52.50 H new ATOM 0 HB2 TYR A 439 23.299 12.343 -12.248 1.00 62.13 H new ATOM 0 HB3 TYR A 439 24.128 13.883 -12.354 1.00 62.13 H new ATOM 0 HD1 TYR A 439 25.022 14.674 -14.504 1.00 41.04 H new ATOM 0 HD2 TYR A 439 23.052 10.915 -14.232 1.00 52.30 H new ATOM 0 HE1 TYR A 439 24.900 14.551 -16.953 1.00 32.35 H new ATOM 0 HE2 TYR A 439 22.911 10.809 -16.669 1.00 10.32 H new ATOM 0 HH TYR A 439 24.744 12.597 -18.692 1.00 70.45 H new ATOM 1282 N LEU A 440 26.674 13.138 -10.383 1.00 32.14 N ATOM 1283 CA LEU A 440 26.992 13.455 -9.005 1.00 23.22 C ATOM 1284 C LEU A 440 26.011 14.506 -8.551 1.00 72.25 C ATOM 1285 O LEU A 440 26.082 15.650 -9.001 1.00 12.30 O ATOM 1286 CB LEU A 440 28.407 14.070 -8.879 1.00 5.53 C ATOM 1287 CG LEU A 440 29.605 13.290 -9.433 1.00 55.34 C ATOM 1288 CD1 LEU A 440 30.878 14.095 -9.230 1.00 53.40 C ATOM 1289 CD2 LEU A 440 29.740 11.945 -8.765 1.00 70.04 C ATOM 0 H LEU A 440 27.300 13.572 -11.061 1.00 32.14 H new ATOM 0 HA LEU A 440 26.946 12.541 -8.412 1.00 23.22 H new ATOM 0 HB2 LEU A 440 28.389 15.042 -9.373 1.00 5.53 H new ATOM 0 HB3 LEU A 440 28.594 14.253 -7.821 1.00 5.53 H new ATOM 0 HG LEU A 440 29.440 13.124 -10.497 1.00 55.34 H new ATOM 0 HD11 LEU A 440 31.728 13.538 -9.625 1.00 53.40 H new ATOM 0 HD12 LEU A 440 30.794 15.047 -9.754 1.00 53.40 H new ATOM 0 HD13 LEU A 440 31.027 14.278 -8.166 1.00 53.40 H new ATOM 0 HD21 LEU A 440 30.599 11.417 -9.180 1.00 70.04 H new ATOM 0 HD22 LEU A 440 29.883 12.084 -7.693 1.00 70.04 H new ATOM 0 HD23 LEU A 440 28.836 11.361 -8.938 1.00 70.04 H new ATOM 1301 N ILE A 441 25.103 14.141 -7.719 1.00 41.22 N ATOM 1302 CA ILE A 441 24.104 15.057 -7.255 1.00 1.22 C ATOM 1303 C ILE A 441 24.414 15.472 -5.836 1.00 64.41 C ATOM 1304 O ILE A 441 24.566 14.629 -4.962 1.00 13.11 O ATOM 1305 CB ILE A 441 22.701 14.410 -7.295 1.00 50.12 C ATOM 1306 CG1 ILE A 441 22.387 13.922 -8.712 1.00 33.12 C ATOM 1307 CG2 ILE A 441 21.638 15.407 -6.827 1.00 35.13 C ATOM 1308 CD1 ILE A 441 21.075 13.197 -8.828 1.00 3.14 C ATOM 0 H ILE A 441 25.025 13.199 -7.335 1.00 41.22 H new ATOM 0 HA ILE A 441 24.110 15.928 -7.911 1.00 1.22 H new ATOM 0 HB ILE A 441 22.692 13.555 -6.619 1.00 50.12 H new ATOM 0 HG12 ILE A 441 22.380 14.778 -9.387 1.00 33.12 H new ATOM 0 HG13 ILE A 441 23.187 13.261 -9.044 1.00 33.12 H new ATOM 0 HG21 ILE A 441 20.656 14.935 -6.861 1.00 35.13 H new ATOM 0 HG22 ILE A 441 21.856 15.718 -5.805 1.00 35.13 H new ATOM 0 HG23 ILE A 441 21.644 16.279 -7.481 1.00 35.13 H new ATOM 0 HD11 ILE A 441 20.923 12.882 -9.861 1.00 3.14 H new ATOM 0 HD12 ILE A 441 21.085 12.321 -8.179 1.00 3.14 H new ATOM 0 HD13 ILE A 441 20.264 13.861 -8.528 1.00 3.14 H new ATOM 1320 N LYS A 442 24.528 16.743 -5.611 1.00 53.04 N ATOM 1321 CA LYS A 442 24.735 17.245 -4.291 1.00 72.13 C ATOM 1322 C LYS A 442 23.502 17.887 -3.761 1.00 21.01 C ATOM 1323 O LYS A 442 22.843 18.667 -4.454 1.00 64.01 O ATOM 1324 CB LYS A 442 25.869 18.246 -4.219 1.00 24.15 C ATOM 1325 CG LYS A 442 27.252 17.669 -4.395 1.00 72.14 C ATOM 1326 CD LYS A 442 28.290 18.748 -4.190 1.00 65.43 C ATOM 1327 CE LYS A 442 29.700 18.211 -4.288 1.00 65.33 C ATOM 1328 NZ LYS A 442 30.697 19.278 -4.072 1.00 31.34 N ATOM 0 H LYS A 442 24.480 17.460 -6.335 1.00 53.04 H new ATOM 0 HA LYS A 442 24.998 16.380 -3.682 1.00 72.13 H new ATOM 0 HB2 LYS A 442 25.710 19.005 -4.985 1.00 24.15 H new ATOM 0 HB3 LYS A 442 25.824 18.752 -3.254 1.00 24.15 H new ATOM 0 HG2 LYS A 442 27.411 16.859 -3.683 1.00 72.14 H new ATOM 0 HG3 LYS A 442 27.352 17.240 -5.392 1.00 72.14 H new ATOM 0 HD2 LYS A 442 28.149 19.531 -4.935 1.00 65.43 H new ATOM 0 HD3 LYS A 442 28.145 19.208 -3.212 1.00 65.43 H new ATOM 0 HE2 LYS A 442 29.843 17.422 -3.550 1.00 65.33 H new ATOM 0 HE3 LYS A 442 29.853 17.761 -5.269 1.00 65.33 H new ATOM 0 HZ1 LYS A 442 31.654 18.879 -4.145 1.00 31.34 H new ATOM 0 HZ2 LYS A 442 30.575 20.018 -4.792 1.00 31.34 H new ATOM 0 HZ3 LYS A 442 30.565 19.690 -3.126 1.00 31.34 H new ATOM 1342 N MET A 443 23.192 17.571 -2.549 1.00 42.24 N ATOM 1343 CA MET A 443 22.081 18.148 -1.861 1.00 60.13 C ATOM 1344 C MET A 443 22.483 18.416 -0.460 1.00 4.11 C ATOM 1345 O MET A 443 23.531 17.944 -0.001 1.00 22.13 O ATOM 1346 CB MET A 443 20.854 17.220 -1.835 1.00 22.14 C ATOM 1347 CG MET A 443 20.207 16.935 -3.173 1.00 10.11 C ATOM 1348 SD MET A 443 18.741 15.899 -3.008 1.00 31.55 S ATOM 1349 CE MET A 443 17.702 16.914 -1.941 1.00 61.22 C ATOM 0 H MET A 443 23.713 16.891 -1.995 1.00 42.24 H new ATOM 0 HA MET A 443 21.804 19.059 -2.391 1.00 60.13 H new ATOM 0 HB2 MET A 443 21.151 16.271 -1.388 1.00 22.14 H new ATOM 0 HB3 MET A 443 20.104 17.661 -1.178 1.00 22.14 H new ATOM 0 HG2 MET A 443 19.934 17.876 -3.651 1.00 10.11 H new ATOM 0 HG3 MET A 443 20.927 16.442 -3.826 1.00 10.11 H new ATOM 0 HE1 MET A 443 16.675 16.550 -1.980 1.00 61.22 H new ATOM 0 HE2 MET A 443 18.068 16.857 -0.916 1.00 61.22 H new ATOM 0 HE3 MET A 443 17.734 17.949 -2.281 1.00 61.22 H new ATOM 1359 N LYS A 444 21.698 19.163 0.214 1.00 43.54 N ATOM 1360 CA LYS A 444 21.894 19.385 1.590 1.00 35.33 C ATOM 1361 C LYS A 444 20.554 19.460 2.269 1.00 44.21 C ATOM 1362 O LYS A 444 19.605 19.974 1.697 1.00 72.15 O ATOM 1363 CB LYS A 444 22.786 20.610 1.860 1.00 1.11 C ATOM 1364 CG LYS A 444 22.310 21.937 1.350 1.00 61.44 C ATOM 1365 CD LYS A 444 23.410 22.943 1.579 1.00 41.11 C ATOM 1366 CE LYS A 444 22.959 24.366 1.298 1.00 14.25 C ATOM 1367 NZ LYS A 444 24.034 25.357 1.542 1.00 13.23 N ATOM 0 H LYS A 444 20.890 19.644 -0.181 1.00 43.54 H new ATOM 0 HA LYS A 444 22.443 18.546 2.018 1.00 35.33 H new ATOM 0 HB2 LYS A 444 22.925 20.694 2.938 1.00 1.11 H new ATOM 0 HB3 LYS A 444 23.767 20.415 1.426 1.00 1.11 H new ATOM 0 HG2 LYS A 444 22.066 21.873 0.290 1.00 61.44 H new ATOM 0 HG3 LYS A 444 21.401 22.241 1.868 1.00 61.44 H new ATOM 0 HD2 LYS A 444 23.756 22.871 2.610 1.00 41.11 H new ATOM 0 HD3 LYS A 444 24.259 22.701 0.940 1.00 41.11 H new ATOM 0 HE2 LYS A 444 22.627 24.441 0.263 1.00 14.25 H new ATOM 0 HE3 LYS A 444 22.100 24.603 1.926 1.00 14.25 H new ATOM 0 HZ1 LYS A 444 23.678 26.313 1.337 1.00 13.23 H new ATOM 0 HZ2 LYS A 444 24.334 25.306 2.536 1.00 13.23 H new ATOM 0 HZ3 LYS A 444 24.845 25.149 0.924 1.00 13.23 H new ATOM 1381 N SER A 445 20.468 18.871 3.435 1.00 3.23 N ATOM 1382 CA SER A 445 19.259 18.825 4.209 1.00 40.14 C ATOM 1383 C SER A 445 19.628 18.666 5.675 1.00 61.30 C ATOM 1384 O SER A 445 20.666 18.082 5.969 1.00 42.15 O ATOM 1385 CB SER A 445 18.439 17.626 3.747 1.00 43.51 C ATOM 1386 OG SER A 445 19.187 16.424 3.833 1.00 61.42 O ATOM 0 H SER A 445 21.256 18.400 3.880 1.00 3.23 H new ATOM 0 HA SER A 445 18.678 19.738 4.079 1.00 40.14 H new ATOM 0 HB2 SER A 445 17.540 17.541 4.357 1.00 43.51 H new ATOM 0 HB3 SER A 445 18.113 17.781 2.718 1.00 43.51 H new ATOM 0 HG SER A 445 18.635 15.673 3.532 1.00 61.42 H new ATOM 1392 N PRO A 446 18.828 19.196 6.619 1.00 62.25 N ATOM 1393 CA PRO A 446 19.111 19.049 8.059 1.00 41.33 C ATOM 1394 C PRO A 446 18.989 17.595 8.525 1.00 63.43 C ATOM 1395 O PRO A 446 19.668 17.168 9.471 1.00 44.34 O ATOM 1396 CB PRO A 446 18.045 19.924 8.730 1.00 41.23 C ATOM 1397 CG PRO A 446 16.951 20.033 7.725 1.00 35.33 C ATOM 1398 CD PRO A 446 17.620 20.013 6.382 1.00 72.25 C ATOM 0 HA PRO A 446 20.131 19.343 8.307 1.00 41.33 H new ATOM 0 HB2 PRO A 446 17.688 19.472 9.655 1.00 41.23 H new ATOM 0 HB3 PRO A 446 18.444 20.905 8.988 1.00 41.23 H new ATOM 0 HG2 PRO A 446 16.247 19.206 7.823 1.00 35.33 H new ATOM 0 HG3 PRO A 446 16.383 20.953 7.864 1.00 35.33 H new ATOM 0 HD2 PRO A 446 16.979 19.572 5.619 1.00 72.25 H new ATOM 0 HD3 PRO A 446 17.873 21.018 6.043 1.00 72.25 H new ATOM 1406 N ALA A 447 18.147 16.831 7.829 1.00 64.24 N ATOM 1407 CA ALA A 447 17.912 15.432 8.151 1.00 24.04 C ATOM 1408 C ALA A 447 19.142 14.574 7.852 1.00 24.25 C ATOM 1409 O ALA A 447 19.313 13.495 8.422 1.00 22.50 O ATOM 1410 CB ALA A 447 16.707 14.904 7.387 1.00 21.54 C ATOM 0 H ALA A 447 17.612 17.168 7.029 1.00 64.24 H new ATOM 0 HA ALA A 447 17.710 15.370 9.220 1.00 24.04 H new ATOM 0 HB1 ALA A 447 16.546 13.856 7.640 1.00 21.54 H new ATOM 0 HB2 ALA A 447 15.823 15.482 7.657 1.00 21.54 H new ATOM 0 HB3 ALA A 447 16.887 14.995 6.316 1.00 21.54 H new ATOM 1416 N ALA A 448 19.998 15.067 6.974 1.00 22.15 N ATOM 1417 CA ALA A 448 21.190 14.344 6.578 1.00 43.01 C ATOM 1418 C ALA A 448 22.240 14.352 7.669 1.00 75.42 C ATOM 1419 O ALA A 448 23.060 13.436 7.751 1.00 63.41 O ATOM 1420 CB ALA A 448 21.746 14.915 5.310 1.00 32.52 C ATOM 0 H ALA A 448 19.886 15.973 6.519 1.00 22.15 H new ATOM 0 HA ALA A 448 20.906 13.306 6.406 1.00 43.01 H new ATOM 0 HB1 ALA A 448 22.641 14.363 5.024 1.00 32.52 H new ATOM 0 HB2 ALA A 448 21.002 14.835 4.518 1.00 32.52 H new ATOM 0 HB3 ALA A 448 22.001 15.964 5.464 1.00 32.52 H new ATOM 1426 N CYS A 449 22.226 15.391 8.490 1.00 64.54 N ATOM 1427 CA CYS A 449 23.129 15.467 9.618 1.00 41.33 C ATOM 1428 C CYS A 449 22.837 14.380 10.620 1.00 51.24 C ATOM 1429 O CYS A 449 21.796 14.381 11.278 1.00 53.44 O ATOM 1430 CB CYS A 449 23.107 16.839 10.304 1.00 54.21 C ATOM 1431 SG CYS A 449 24.047 18.157 9.462 1.00 63.42 S ATOM 0 H CYS A 449 21.599 16.190 8.393 1.00 64.54 H new ATOM 0 HA CYS A 449 24.132 15.322 9.217 1.00 41.33 H new ATOM 0 HB2 CYS A 449 22.070 17.161 10.399 1.00 54.21 H new ATOM 0 HB3 CYS A 449 23.500 16.726 11.315 1.00 54.21 H new ATOM 1436 N SER A 450 23.720 13.432 10.682 1.00 52.14 N ATOM 1437 CA SER A 450 23.654 12.363 11.620 1.00 20.25 C ATOM 1438 C SER A 450 25.078 12.011 12.006 1.00 73.00 C ATOM 1439 O SER A 450 25.604 12.618 12.966 1.00 37.67 O ATOM 1440 CB SER A 450 22.927 11.159 11.006 1.00 21.41 C ATOM 1441 OG SER A 450 21.601 11.526 10.600 1.00 52.13 O ATOM 1442 OXT SER A 450 25.701 11.201 11.318 1.00 37.67 O ATOM 0 H SER A 450 24.528 13.382 10.062 1.00 52.14 H new ATOM 0 HA SER A 450 23.091 12.656 12.506 1.00 20.25 H new ATOM 0 HB2 SER A 450 23.487 10.788 10.148 1.00 21.41 H new ATOM 0 HB3 SER A 450 22.880 10.347 11.731 1.00 21.41 H new ATOM 0 HG SER A 450 21.151 10.748 10.209 1.00 52.13 H new TER 1448 SER A 450