USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=23 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 374 TYR OH : rot 160:sc= -0.401 USER MOD Set 1.2: A 384 GLN : amide:sc= -0.728 X(o=-1.1,f=-0.93) USER MOD Set 2.1: A 365 THR OG1 : rot -43:sc= 0.837 USER MOD Set 2.2: A 426 ASN : amide:sc= 1.05 K(o=0.71,f=-3.5) USER MOD Set 2.3: A 443 MET CE :methyl 162:sc= -1.17 (180deg=-2.81!) USER MOD Single : A 357 TYR OH : rot 180:sc= 0 USER MOD Single : A 361 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 363 MET CE :methyl 161:sc= -0.111 (180deg=-0.586) 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 381 ASN : amide:sc= -0.489 K(o=-0.49,f=-2.4) USER MOD Single : A 386 SER OG : rot 84:sc= 1.26 USER MOD Single : A 391 ASN :FLIP amide:sc= -0.515 F(o=-5.3!,f=-0.52) USER MOD Single : A 394 SER OG : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= -0.613 K(o=-0.61,f=-1.7) USER MOD Single : A 398 ASN : amide:sc= 0.0709 K(o=0.071,f=-3.1!) USER MOD Single : A 401 LYS NZ :NH3+ 126:sc= 2.42 (180deg=0.357) USER MOD Single : A 402 TYR OH : rot 180:sc= -0.399 USER MOD Single : A 404 ASN : amide:sc= -0.0396 X(o=-0.04,f=0) USER MOD Single : A 406 GLN : amide:sc= -1.2 K(o=-1.2,f=-5.8!) USER MOD Single : A 407 SER OG : rot 180:sc= 0 USER MOD Single : A 410 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 413 HIS : no HE2:sc= 0.869 K(o=0.87,f=-2.7!) USER MOD Single : A 415 SER OG : rot 133:sc= 0.5 USER MOD Single : A 419 THR OG1 : rot 180:sc= 0 USER MOD Single : A 430 SER OG : rot 180:sc= -0.0226 USER MOD Single : A 435 GLN : amide:sc= -0.823 K(o=-0.82,f=-3.6!) USER MOD Single : A 436 LYS NZ :NH3+ -166:sc= -0.0143 (180deg=-0.226) USER MOD Single : A 439 TYR OH : rot -97:sc= 1.23 USER MOD Single : A 442 LYS NZ :NH3+ -147:sc= 1.08 (180deg=0.858) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 SER OG : rot 180:sc= -1.03 USER MOD Single : A 450 SER OG : rot 36:sc= 0.937 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 357 5.069 2.139 -8.278 1.00 70.30 N ATOM 2 CA TYR A 357 5.929 1.677 -7.185 1.00 21.42 C ATOM 3 C TYR A 357 5.648 2.500 -5.935 1.00 55.54 C ATOM 4 O TYR A 357 5.944 3.702 -5.901 1.00 31.44 O ATOM 5 CB TYR A 357 7.419 1.847 -7.545 1.00 35.42 C ATOM 6 CG TYR A 357 7.889 1.131 -8.795 1.00 5.11 C ATOM 7 CD1 TYR A 357 8.321 -0.186 -8.748 1.00 4.25 C ATOM 8 CD2 TYR A 357 7.922 1.786 -10.018 1.00 70.51 C ATOM 9 CE1 TYR A 357 8.772 -0.829 -9.888 1.00 13.01 C ATOM 10 CE2 TYR A 357 8.363 1.152 -11.159 1.00 54.50 C ATOM 11 CZ TYR A 357 8.789 -0.155 -11.089 1.00 21.33 C ATOM 12 OH TYR A 357 9.245 -0.792 -12.227 1.00 44.23 O ATOM 0 HA TYR A 357 5.716 0.622 -7.012 1.00 21.42 H new ATOM 0 HB2 TYR A 357 7.624 2.911 -7.661 1.00 35.42 H new ATOM 0 HB3 TYR A 357 8.017 1.497 -6.704 1.00 35.42 H new ATOM 0 HD1 TYR A 357 8.305 -0.718 -7.808 1.00 4.25 H new ATOM 0 HD2 TYR A 357 7.595 2.814 -10.077 1.00 70.51 H new ATOM 0 HE1 TYR A 357 9.109 -1.854 -9.836 1.00 13.01 H new ATOM 0 HE2 TYR A 357 8.374 1.677 -12.103 1.00 54.50 H new ATOM 0 HH TYR A 357 9.191 -0.179 -12.989 1.00 44.23 H new ATOM 24 N ARG A 358 5.080 1.882 -4.921 1.00 2.02 N ATOM 25 CA ARG A 358 4.813 2.577 -3.675 1.00 63.43 C ATOM 26 C ARG A 358 6.079 2.464 -2.837 1.00 65.04 C ATOM 27 O ARG A 358 6.433 1.378 -2.385 1.00 13.03 O ATOM 28 CB ARG A 358 3.587 1.933 -2.952 1.00 1.12 C ATOM 29 CG ARG A 358 2.970 2.732 -1.771 1.00 63.30 C ATOM 30 CD ARG A 358 3.915 2.931 -0.585 1.00 20.01 C ATOM 31 NE ARG A 358 4.360 1.659 0.011 1.00 23.41 N ATOM 32 CZ ARG A 358 5.345 1.548 0.917 1.00 62.15 C ATOM 33 NH1 ARG A 358 5.992 2.624 1.336 1.00 21.12 N ATOM 34 NH2 ARG A 358 5.674 0.359 1.403 1.00 55.10 N ATOM 0 H ARG A 358 4.794 0.903 -4.932 1.00 2.02 H new ATOM 0 HA ARG A 358 4.563 3.624 -3.843 1.00 63.43 H new ATOM 0 HB2 ARG A 358 2.806 1.765 -3.693 1.00 1.12 H new ATOM 0 HB3 ARG A 358 3.888 0.954 -2.579 1.00 1.12 H new ATOM 0 HG2 ARG A 358 2.652 3.709 -2.135 1.00 63.30 H new ATOM 0 HG3 ARG A 358 2.075 2.214 -1.425 1.00 63.30 H new ATOM 0 HD2 ARG A 358 4.787 3.498 -0.912 1.00 20.01 H new ATOM 0 HD3 ARG A 358 3.414 3.528 0.177 1.00 20.01 H new ATOM 0 HE ARG A 358 3.888 0.805 -0.285 1.00 23.41 H new ATOM 0 HH11 ARG A 358 5.743 3.543 0.971 1.00 21.12 H new ATOM 0 HH12 ARG A 358 6.739 2.534 2.024 1.00 21.12 H new ATOM 0 HH21 ARG A 358 5.178 -0.475 1.089 1.00 55.10 H new ATOM 0 HH22 ARG A 358 6.423 0.279 2.091 1.00 55.10 H new ATOM 48 N ALA A 359 6.759 3.560 -2.656 1.00 12.34 N ATOM 49 CA ALA A 359 8.020 3.564 -1.957 1.00 35.41 C ATOM 50 C ALA A 359 8.054 4.695 -0.940 1.00 71.44 C ATOM 51 O ALA A 359 7.011 5.300 -0.635 1.00 4.43 O ATOM 52 CB ALA A 359 9.143 3.724 -2.972 1.00 15.32 C ATOM 0 H ALA A 359 6.459 4.477 -2.987 1.00 12.34 H new ATOM 0 HA ALA A 359 8.147 2.624 -1.420 1.00 35.41 H new ATOM 0 HB1 ALA A 359 10.103 3.729 -2.455 1.00 15.32 H new ATOM 0 HB2 ALA A 359 9.115 2.895 -3.679 1.00 15.32 H new ATOM 0 HB3 ALA A 359 9.016 4.664 -3.510 1.00 15.32 H new ATOM 58 N ILE A 360 9.218 4.956 -0.394 1.00 53.21 N ATOM 59 CA ILE A 360 9.406 6.049 0.530 1.00 53.22 C ATOM 60 C ILE A 360 9.773 7.262 -0.296 1.00 1.12 C ATOM 61 O ILE A 360 10.655 7.178 -1.138 1.00 21.21 O ATOM 62 CB ILE A 360 10.549 5.777 1.586 1.00 43.41 C ATOM 63 CG1 ILE A 360 10.253 4.564 2.512 1.00 15.30 C ATOM 64 CG2 ILE A 360 10.824 7.015 2.429 1.00 61.04 C ATOM 65 CD1 ILE A 360 10.288 3.203 1.840 1.00 53.34 C ATOM 0 H ILE A 360 10.063 4.415 -0.578 1.00 53.21 H new ATOM 0 HA ILE A 360 8.487 6.189 1.099 1.00 53.22 H new ATOM 0 HB ILE A 360 11.437 5.529 1.004 1.00 43.41 H new ATOM 0 HG12 ILE A 360 10.977 4.566 3.327 1.00 15.30 H new ATOM 0 HG13 ILE A 360 9.269 4.703 2.960 1.00 15.30 H new ATOM 0 HG21 ILE A 360 11.615 6.798 3.147 1.00 61.04 H new ATOM 0 HG22 ILE A 360 11.136 7.834 1.781 1.00 61.04 H new ATOM 0 HG23 ILE A 360 9.918 7.300 2.963 1.00 61.04 H new ATOM 0 HD11 ILE A 360 10.068 2.429 2.575 1.00 53.34 H new ATOM 0 HD12 ILE A 360 9.543 3.171 1.045 1.00 53.34 H new ATOM 0 HD13 ILE A 360 11.278 3.031 1.417 1.00 53.34 H new ATOM 77 N LYS A 361 9.103 8.370 -0.093 1.00 2.41 N ATOM 78 CA LYS A 361 9.394 9.521 -0.899 1.00 5.20 C ATOM 79 C LYS A 361 9.817 10.724 -0.081 1.00 43.33 C ATOM 80 O LYS A 361 9.099 11.186 0.809 1.00 50.12 O ATOM 81 CB LYS A 361 8.229 9.860 -1.846 1.00 20.30 C ATOM 82 CG LYS A 361 6.905 10.184 -1.172 1.00 73.42 C ATOM 83 CD LYS A 361 5.832 10.460 -2.203 1.00 52.54 C ATOM 84 CE LYS A 361 4.509 10.801 -1.553 1.00 63.43 C ATOM 85 NZ LYS A 361 3.447 11.025 -2.559 1.00 11.23 N ATOM 0 H LYS A 361 8.371 8.495 0.606 1.00 2.41 H new ATOM 0 HA LYS A 361 10.254 9.253 -1.513 1.00 5.20 H new ATOM 0 HB2 LYS A 361 8.521 10.711 -2.461 1.00 20.30 H new ATOM 0 HB3 LYS A 361 8.076 9.017 -2.520 1.00 20.30 H new ATOM 0 HG2 LYS A 361 6.601 9.351 -0.538 1.00 73.42 H new ATOM 0 HG3 LYS A 361 7.024 11.052 -0.523 1.00 73.42 H new ATOM 0 HD2 LYS A 361 6.146 11.284 -2.844 1.00 52.54 H new ATOM 0 HD3 LYS A 361 5.709 9.587 -2.843 1.00 52.54 H new ATOM 0 HE2 LYS A 361 4.213 9.992 -0.885 1.00 63.43 H new ATOM 0 HE3 LYS A 361 4.624 11.695 -0.940 1.00 63.43 H new ATOM 0 HZ1 LYS A 361 2.555 11.256 -2.077 1.00 11.23 H new ATOM 0 HZ2 LYS A 361 3.719 11.813 -3.181 1.00 11.23 H new ATOM 0 HZ3 LYS A 361 3.320 10.163 -3.127 1.00 11.23 H new ATOM 99 N GLY A 362 10.996 11.197 -0.370 1.00 63.32 N ATOM 100 CA GLY A 362 11.495 12.404 0.222 1.00 54.24 C ATOM 101 C GLY A 362 11.696 13.448 -0.848 1.00 2.25 C ATOM 102 O GLY A 362 12.826 13.830 -1.163 1.00 15.34 O ATOM 0 H GLY A 362 11.640 10.754 -1.025 1.00 63.32 H new ATOM 0 HA2 GLY A 362 10.794 12.769 0.973 1.00 54.24 H new ATOM 0 HA3 GLY A 362 12.437 12.207 0.734 1.00 54.24 H new ATOM 106 N MET A 363 10.602 13.862 -1.440 1.00 22.25 N ATOM 107 CA MET A 363 10.604 14.846 -2.503 1.00 64.14 C ATOM 108 C MET A 363 10.406 16.220 -1.939 1.00 25.24 C ATOM 109 O MET A 363 9.309 16.559 -1.485 1.00 74.10 O ATOM 110 CB MET A 363 9.479 14.565 -3.506 1.00 62.23 C ATOM 111 CG MET A 363 9.408 15.567 -4.654 1.00 12.22 C ATOM 112 SD MET A 363 8.074 15.211 -5.816 1.00 54.33 S ATOM 113 CE MET A 363 6.634 15.383 -4.754 1.00 45.14 C ATOM 0 H MET A 363 9.672 13.522 -1.196 1.00 22.25 H new ATOM 0 HA MET A 363 11.567 14.786 -3.010 1.00 64.14 H new ATOM 0 HB2 MET A 363 9.615 13.565 -3.918 1.00 62.23 H new ATOM 0 HB3 MET A 363 8.526 14.566 -2.977 1.00 62.23 H new ATOM 0 HG2 MET A 363 9.271 16.569 -4.247 1.00 12.22 H new ATOM 0 HG3 MET A 363 10.358 15.567 -5.188 1.00 12.22 H new ATOM 0 HE1 MET A 363 5.745 15.529 -5.367 1.00 45.14 H new ATOM 0 HE2 MET A 363 6.516 14.482 -4.152 1.00 45.14 H new ATOM 0 HE3 MET A 363 6.767 16.243 -4.097 1.00 45.14 H new ATOM 123 N GLU A 364 11.441 17.000 -1.930 1.00 0.11 N ATOM 124 CA GLU A 364 11.307 18.350 -1.475 1.00 14.33 C ATOM 125 C GLU A 364 12.268 19.271 -2.231 1.00 45.31 C ATOM 126 O GLU A 364 12.191 20.493 -2.110 1.00 71.34 O ATOM 127 CB GLU A 364 11.558 18.421 0.047 1.00 23.44 C ATOM 128 CG GLU A 364 11.178 19.746 0.693 1.00 33.22 C ATOM 129 CD GLU A 364 9.698 20.033 0.566 1.00 1.31 C ATOM 130 OE1 GLU A 364 9.271 20.599 -0.462 1.00 45.23 O ATOM 131 OE2 GLU A 364 8.942 19.689 1.482 1.00 32.23 O ATOM 0 H GLU A 364 12.378 16.731 -2.229 1.00 0.11 H new ATOM 0 HA GLU A 364 10.291 18.690 -1.675 1.00 14.33 H new ATOM 0 HB2 GLU A 364 10.997 17.622 0.532 1.00 23.44 H new ATOM 0 HB3 GLU A 364 12.614 18.229 0.237 1.00 23.44 H new ATOM 0 HG2 GLU A 364 11.455 19.728 1.747 1.00 33.22 H new ATOM 0 HG3 GLU A 364 11.745 20.552 0.228 1.00 33.22 H new ATOM 138 N THR A 365 13.157 18.709 -3.042 1.00 22.34 N ATOM 139 CA THR A 365 14.139 19.544 -3.660 1.00 2.15 C ATOM 140 C THR A 365 14.076 19.455 -5.184 1.00 74.11 C ATOM 141 O THR A 365 13.994 18.351 -5.747 1.00 71.11 O ATOM 142 CB THR A 365 15.531 19.144 -3.191 1.00 32.41 C ATOM 143 OG1 THR A 365 15.461 18.770 -1.805 1.00 63.10 O ATOM 144 CG2 THR A 365 16.429 20.344 -3.292 1.00 61.44 C ATOM 0 H THR A 365 13.207 17.716 -3.271 1.00 22.34 H new ATOM 0 HA THR A 365 13.927 20.573 -3.368 1.00 2.15 H new ATOM 0 HB THR A 365 15.907 18.320 -3.797 1.00 32.41 H new ATOM 0 HG1 THR A 365 14.896 19.409 -1.322 1.00 63.10 H new ATOM 0 HG21 THR A 365 17.432 20.077 -2.960 1.00 61.44 H new ATOM 0 HG22 THR A 365 16.468 20.683 -4.327 1.00 61.44 H new ATOM 0 HG23 THR A 365 16.039 21.144 -2.662 1.00 61.44 H new ATOM 152 N LYS A 366 14.105 20.611 -5.835 1.00 10.12 N ATOM 153 CA LYS A 366 14.126 20.711 -7.279 1.00 13.12 C ATOM 154 C LYS A 366 15.033 21.824 -7.670 1.00 21.43 C ATOM 155 O LYS A 366 15.069 22.858 -7.006 1.00 11.11 O ATOM 156 CB LYS A 366 12.730 20.941 -7.861 1.00 32.22 C ATOM 157 CG LYS A 366 11.822 19.750 -7.722 1.00 30.12 C ATOM 158 CD LYS A 366 10.432 19.999 -8.281 1.00 24.11 C ATOM 159 CE LYS A 366 9.699 21.087 -7.516 1.00 4.44 C ATOM 160 NZ LYS A 366 8.329 21.267 -8.019 1.00 23.34 N ATOM 0 H LYS A 366 14.115 21.515 -5.363 1.00 10.12 H new ATOM 0 HA LYS A 366 14.488 19.766 -7.683 1.00 13.12 H new ATOM 0 HB2 LYS A 366 12.273 21.797 -7.364 1.00 32.22 H new ATOM 0 HB3 LYS A 366 12.822 21.197 -8.916 1.00 32.22 H new ATOM 0 HG2 LYS A 366 12.267 18.898 -8.235 1.00 30.12 H new ATOM 0 HG3 LYS A 366 11.742 19.481 -6.669 1.00 30.12 H new ATOM 0 HD2 LYS A 366 10.509 20.282 -9.331 1.00 24.11 H new ATOM 0 HD3 LYS A 366 9.854 19.076 -8.241 1.00 24.11 H new ATOM 0 HE2 LYS A 366 9.669 20.832 -6.457 1.00 4.44 H new ATOM 0 HE3 LYS A 366 10.246 22.026 -7.602 1.00 4.44 H new ATOM 0 HZ1 LYS A 366 7.855 22.017 -7.476 1.00 23.34 H new ATOM 0 HZ2 LYS A 366 8.360 21.534 -9.024 1.00 23.34 H new ATOM 0 HZ3 LYS A 366 7.801 20.377 -7.914 1.00 23.34 H new ATOM 174 N ARG A 367 15.788 21.621 -8.698 1.00 31.52 N ATOM 175 CA ARG A 367 16.701 22.626 -9.146 1.00 24.30 C ATOM 176 C ARG A 367 16.866 22.429 -10.641 1.00 14.23 C ATOM 177 O ARG A 367 17.013 21.302 -11.094 1.00 21.44 O ATOM 178 CB ARG A 367 18.048 22.422 -8.450 1.00 35.20 C ATOM 179 CG ARG A 367 19.000 23.607 -8.454 1.00 62.23 C ATOM 180 CD ARG A 367 18.532 24.684 -7.483 1.00 23.52 C ATOM 181 NE ARG A 367 19.471 25.827 -7.421 1.00 12.44 N ATOM 182 CZ ARG A 367 19.393 26.857 -6.562 1.00 45.34 C ATOM 183 NH1 ARG A 367 18.351 26.977 -5.750 1.00 4.00 N ATOM 184 NH2 ARG A 367 20.352 27.774 -6.541 1.00 45.52 N ATOM 0 H ARG A 367 15.792 20.763 -9.249 1.00 31.52 H new ATOM 0 HA ARG A 367 16.337 23.628 -8.921 1.00 24.30 H new ATOM 0 HB2 ARG A 367 17.858 22.141 -7.414 1.00 35.20 H new ATOM 0 HB3 ARG A 367 18.552 21.578 -8.922 1.00 35.20 H new ATOM 0 HG2 ARG A 367 20.001 23.275 -8.180 1.00 62.23 H new ATOM 0 HG3 ARG A 367 19.066 24.022 -9.460 1.00 62.23 H new ATOM 0 HD2 ARG A 367 17.547 25.041 -7.786 1.00 23.52 H new ATOM 0 HD3 ARG A 367 18.422 24.252 -6.488 1.00 23.52 H new ATOM 0 HE ARG A 367 20.243 25.833 -8.087 1.00 12.44 H new ATOM 0 HH11 ARG A 367 17.602 26.285 -5.775 1.00 4.00 H new ATOM 0 HH12 ARG A 367 18.298 27.762 -5.100 1.00 4.00 H new ATOM 0 HH21 ARG A 367 21.146 27.696 -7.176 1.00 45.52 H new ATOM 0 HH22 ARG A 367 20.295 28.557 -5.890 1.00 45.52 H new ATOM 198 N GLU A 368 16.832 23.473 -11.400 1.00 14.42 N ATOM 199 CA GLU A 368 16.942 23.341 -12.822 1.00 35.33 C ATOM 200 C GLU A 368 18.382 23.535 -13.300 1.00 51.01 C ATOM 201 O GLU A 368 18.945 24.619 -13.209 1.00 64.20 O ATOM 202 CB GLU A 368 15.981 24.289 -13.531 1.00 71.01 C ATOM 203 CG GLU A 368 16.111 25.733 -13.106 1.00 65.41 C ATOM 204 CD GLU A 368 15.289 26.652 -13.939 1.00 31.15 C ATOM 205 OE1 GLU A 368 15.740 27.014 -15.036 1.00 12.04 O ATOM 206 OE2 GLU A 368 14.185 27.050 -13.509 1.00 52.53 O ATOM 0 H GLU A 368 16.729 24.430 -11.063 1.00 14.42 H new ATOM 0 HA GLU A 368 16.658 22.322 -13.083 1.00 35.33 H new ATOM 0 HB2 GLU A 368 16.149 24.222 -14.606 1.00 71.01 H new ATOM 0 HB3 GLU A 368 14.959 23.958 -13.346 1.00 71.01 H new ATOM 0 HG2 GLU A 368 15.811 25.829 -12.062 1.00 65.41 H new ATOM 0 HG3 GLU A 368 17.157 26.033 -13.166 1.00 65.41 H new ATOM 213 N ILE A 369 18.982 22.474 -13.769 1.00 71.34 N ATOM 214 CA ILE A 369 20.323 22.549 -14.302 1.00 62.22 C ATOM 215 C ILE A 369 20.283 22.292 -15.809 1.00 2.24 C ATOM 216 O ILE A 369 19.682 21.326 -16.258 1.00 15.40 O ATOM 217 CB ILE A 369 21.350 21.550 -13.611 1.00 23.34 C ATOM 218 CG1 ILE A 369 21.560 21.841 -12.102 1.00 52.31 C ATOM 219 CG2 ILE A 369 22.697 21.550 -14.326 1.00 63.45 C ATOM 220 CD1 ILE A 369 20.394 21.494 -11.202 1.00 62.21 C ATOM 0 H ILE A 369 18.565 21.543 -13.794 1.00 71.34 H new ATOM 0 HA ILE A 369 20.688 23.553 -14.086 1.00 62.22 H new ATOM 0 HB ILE A 369 20.898 20.562 -13.695 1.00 23.34 H new ATOM 0 HG12 ILE A 369 22.436 21.288 -11.762 1.00 52.31 H new ATOM 0 HG13 ILE A 369 21.786 22.901 -11.982 1.00 52.31 H new ATOM 0 HG21 ILE A 369 23.374 20.856 -13.827 1.00 63.45 H new ATOM 0 HG22 ILE A 369 22.559 21.240 -15.362 1.00 63.45 H new ATOM 0 HG23 ILE A 369 23.122 22.553 -14.301 1.00 63.45 H new ATOM 0 HD11 ILE A 369 20.646 21.737 -10.170 1.00 62.21 H new ATOM 0 HD12 ILE A 369 19.517 22.066 -11.506 1.00 62.21 H new ATOM 0 HD13 ILE A 369 20.177 20.429 -11.282 1.00 62.21 H new ATOM 232 N GLY A 370 20.891 23.180 -16.570 1.00 24.34 N ATOM 233 CA GLY A 370 20.988 23.045 -18.018 1.00 62.25 C ATOM 234 C GLY A 370 19.649 23.042 -18.749 1.00 33.21 C ATOM 235 O GLY A 370 19.547 22.526 -19.870 1.00 54.21 O ATOM 0 H GLY A 370 21.336 24.022 -16.204 1.00 24.34 H new ATOM 0 HA2 GLY A 370 21.596 23.862 -18.406 1.00 62.25 H new ATOM 0 HA3 GLY A 370 21.514 22.119 -18.248 1.00 62.25 H new ATOM 239 N GLY A 371 18.631 23.613 -18.135 1.00 3.25 N ATOM 240 CA GLY A 371 17.332 23.688 -18.774 1.00 50.01 C ATOM 241 C GLY A 371 16.405 22.563 -18.366 1.00 34.34 C ATOM 242 O GLY A 371 15.211 22.574 -18.697 1.00 21.45 O ATOM 0 H GLY A 371 18.677 24.028 -17.204 1.00 3.25 H new ATOM 0 HA2 GLY A 371 16.867 24.642 -18.527 1.00 50.01 H new ATOM 0 HA3 GLY A 371 17.464 23.668 -19.856 1.00 50.01 H new ATOM 246 N TYR A 372 16.938 21.596 -17.671 1.00 52.24 N ATOM 247 CA TYR A 372 16.164 20.483 -17.186 1.00 62.12 C ATOM 248 C TYR A 372 16.076 20.485 -15.676 1.00 31.10 C ATOM 249 O TYR A 372 17.034 20.815 -14.983 1.00 2.00 O ATOM 250 CB TYR A 372 16.596 19.125 -17.803 1.00 55.52 C ATOM 251 CG TYR A 372 18.084 18.957 -18.033 1.00 75.53 C ATOM 252 CD1 TYR A 372 18.915 18.463 -17.057 1.00 73.33 C ATOM 253 CD2 TYR A 372 18.652 19.305 -19.255 1.00 41.20 C ATOM 254 CE1 TYR A 372 20.274 18.321 -17.279 1.00 54.34 C ATOM 255 CE2 TYR A 372 20.004 19.163 -19.484 1.00 10.14 C ATOM 256 CZ TYR A 372 20.809 18.670 -18.490 1.00 12.35 C ATOM 257 OH TYR A 372 22.163 18.532 -18.705 1.00 34.33 O ATOM 0 H TYR A 372 17.927 21.556 -17.423 1.00 52.24 H new ATOM 0 HA TYR A 372 15.143 20.618 -17.542 1.00 62.12 H new ATOM 0 HB2 TYR A 372 16.254 18.323 -17.148 1.00 55.52 H new ATOM 0 HB3 TYR A 372 16.082 18.999 -18.756 1.00 55.52 H new ATOM 0 HD1 TYR A 372 18.501 18.181 -16.100 1.00 73.33 H new ATOM 0 HD2 TYR A 372 18.021 19.694 -20.040 1.00 41.20 H new ATOM 0 HE1 TYR A 372 20.912 17.935 -16.497 1.00 54.34 H new ATOM 0 HE2 TYR A 372 20.426 19.438 -20.439 1.00 10.14 H new ATOM 0 HH TYR A 372 22.381 18.822 -19.615 1.00 34.33 H new ATOM 267 N THR A 373 14.934 20.120 -15.178 1.00 72.53 N ATOM 268 CA THR A 373 14.645 20.248 -13.782 1.00 32.23 C ATOM 269 C THR A 373 14.994 18.988 -13.043 1.00 35.42 C ATOM 270 O THR A 373 14.403 17.943 -13.273 1.00 11.34 O ATOM 271 CB THR A 373 13.149 20.577 -13.557 1.00 3.20 C ATOM 272 OG1 THR A 373 12.794 21.743 -14.326 1.00 10.31 O ATOM 273 CG2 THR A 373 12.868 20.850 -12.079 1.00 65.04 C ATOM 0 H THR A 373 14.174 19.724 -15.730 1.00 72.53 H new ATOM 0 HA THR A 373 15.253 21.066 -13.396 1.00 32.23 H new ATOM 0 HB THR A 373 12.556 19.720 -13.875 1.00 3.20 H new ATOM 0 HG1 THR A 373 11.847 21.951 -14.186 1.00 10.31 H new ATOM 0 HG21 THR A 373 11.811 21.079 -11.946 1.00 65.04 H new ATOM 0 HG22 THR A 373 13.126 19.969 -11.491 1.00 65.04 H new ATOM 0 HG23 THR A 373 13.467 21.697 -11.745 1.00 65.04 H new ATOM 281 N TYR A 374 15.933 19.088 -12.170 1.00 61.33 N ATOM 282 CA TYR A 374 16.309 17.987 -11.363 1.00 71.24 C ATOM 283 C TYR A 374 15.426 17.942 -10.167 1.00 13.31 C ATOM 284 O TYR A 374 15.301 18.924 -9.444 1.00 71.52 O ATOM 285 CB TYR A 374 17.770 18.091 -10.937 1.00 13.05 C ATOM 286 CG TYR A 374 18.757 17.734 -12.011 1.00 53.34 C ATOM 287 CD1 TYR A 374 19.121 18.634 -12.991 1.00 33.13 C ATOM 288 CD2 TYR A 374 19.338 16.479 -12.029 1.00 54.11 C ATOM 289 CE1 TYR A 374 20.036 18.289 -13.957 1.00 44.14 C ATOM 290 CE2 TYR A 374 20.251 16.130 -12.991 1.00 21.44 C ATOM 291 CZ TYR A 374 20.595 17.035 -13.950 1.00 21.01 C ATOM 292 OH TYR A 374 21.505 16.684 -14.912 1.00 14.13 O ATOM 0 H TYR A 374 16.464 19.942 -11.996 1.00 61.33 H new ATOM 0 HA TYR A 374 16.198 17.069 -11.941 1.00 71.24 H new ATOM 0 HB2 TYR A 374 17.967 19.110 -10.604 1.00 13.05 H new ATOM 0 HB3 TYR A 374 17.933 17.438 -10.079 1.00 13.05 H new ATOM 0 HD1 TYR A 374 18.682 19.621 -12.999 1.00 33.13 H new ATOM 0 HD2 TYR A 374 19.067 15.760 -11.270 1.00 54.11 H new ATOM 0 HE1 TYR A 374 20.314 19.002 -14.719 1.00 44.14 H new ATOM 0 HE2 TYR A 374 20.694 15.145 -12.989 1.00 21.44 H new ATOM 0 HH TYR A 374 22.035 15.922 -14.598 1.00 14.13 H new ATOM 302 N LYS A 375 14.802 16.831 -9.975 1.00 50.10 N ATOM 303 CA LYS A 375 13.936 16.639 -8.858 1.00 31.24 C ATOM 304 C LYS A 375 14.494 15.523 -8.046 1.00 54.23 C ATOM 305 O LYS A 375 14.662 14.415 -8.555 1.00 42.33 O ATOM 306 CB LYS A 375 12.528 16.267 -9.356 1.00 1.21 C ATOM 307 CG LYS A 375 11.521 15.972 -8.246 1.00 35.11 C ATOM 308 CD LYS A 375 10.142 15.600 -8.794 1.00 4.05 C ATOM 309 CE LYS A 375 10.182 14.373 -9.686 1.00 63.21 C ATOM 310 NZ LYS A 375 8.836 13.987 -10.168 1.00 12.21 N ATOM 0 H LYS A 375 14.877 16.023 -10.592 1.00 50.10 H new ATOM 0 HA LYS A 375 13.865 17.549 -8.262 1.00 31.24 H new ATOM 0 HB2 LYS A 375 12.146 17.083 -9.969 1.00 1.21 H new ATOM 0 HB3 LYS A 375 12.604 15.392 -10.002 1.00 1.21 H new ATOM 0 HG2 LYS A 375 11.895 15.157 -7.627 1.00 35.11 H new ATOM 0 HG3 LYS A 375 11.429 16.846 -7.601 1.00 35.11 H new ATOM 0 HD2 LYS A 375 9.461 15.418 -7.962 1.00 4.05 H new ATOM 0 HD3 LYS A 375 9.740 16.442 -9.358 1.00 4.05 H new ATOM 0 HE2 LYS A 375 10.830 14.568 -10.541 1.00 63.21 H new ATOM 0 HE3 LYS A 375 10.622 13.541 -9.136 1.00 63.21 H new ATOM 0 HZ1 LYS A 375 8.912 13.145 -10.773 1.00 12.21 H new ATOM 0 HZ2 LYS A 375 8.224 13.775 -9.355 1.00 12.21 H new ATOM 0 HZ3 LYS A 375 8.425 14.770 -10.715 1.00 12.21 H new ATOM 324 N VAL A 376 14.756 15.781 -6.800 1.00 64.13 N ATOM 325 CA VAL A 376 15.322 14.777 -5.963 1.00 41.02 C ATOM 326 C VAL A 376 14.314 14.248 -5.001 1.00 14.53 C ATOM 327 O VAL A 376 13.885 14.952 -4.068 1.00 31.13 O ATOM 328 CB VAL A 376 16.596 15.256 -5.215 1.00 31.32 C ATOM 329 CG1 VAL A 376 17.150 14.145 -4.321 1.00 44.12 C ATOM 330 CG2 VAL A 376 17.659 15.692 -6.209 1.00 13.02 C ATOM 0 H VAL A 376 14.586 16.678 -6.345 1.00 64.13 H new ATOM 0 HA VAL A 376 15.633 13.969 -6.625 1.00 41.02 H new ATOM 0 HB VAL A 376 16.322 16.105 -4.589 1.00 31.32 H new ATOM 0 HG11 VAL A 376 18.042 14.503 -3.807 1.00 44.12 H new ATOM 0 HG12 VAL A 376 16.397 13.860 -3.586 1.00 44.12 H new ATOM 0 HG13 VAL A 376 17.406 13.280 -4.932 1.00 44.12 H new ATOM 0 HG21 VAL A 376 18.546 16.025 -5.670 1.00 13.02 H new ATOM 0 HG22 VAL A 376 17.920 14.853 -6.854 1.00 13.02 H new ATOM 0 HG23 VAL A 376 17.275 16.511 -6.817 1.00 13.02 H new ATOM 340 N VAL A 377 13.890 13.030 -5.239 1.00 0.41 N ATOM 341 CA VAL A 377 13.033 12.380 -4.341 1.00 30.11 C ATOM 342 C VAL A 377 13.844 11.344 -3.634 1.00 31.21 C ATOM 343 O VAL A 377 14.170 10.302 -4.216 1.00 0.10 O ATOM 344 CB VAL A 377 11.851 11.682 -5.033 1.00 43.20 C ATOM 345 CG1 VAL A 377 10.872 11.179 -3.996 1.00 64.03 C ATOM 346 CG2 VAL A 377 11.179 12.586 -6.055 1.00 65.45 C ATOM 0 H VAL A 377 14.141 12.483 -6.063 1.00 0.41 H new ATOM 0 HA VAL A 377 12.612 13.126 -3.667 1.00 30.11 H new ATOM 0 HB VAL A 377 12.234 10.826 -5.588 1.00 43.20 H new ATOM 0 HG11 VAL A 377 10.037 10.686 -4.493 1.00 64.03 H new ATOM 0 HG12 VAL A 377 11.373 10.470 -3.337 1.00 64.03 H new ATOM 0 HG13 VAL A 377 10.500 12.019 -3.409 1.00 64.03 H new ATOM 0 HG21 VAL A 377 10.349 12.055 -6.521 1.00 65.45 H new ATOM 0 HG22 VAL A 377 10.804 13.481 -5.558 1.00 65.45 H new ATOM 0 HG23 VAL A 377 11.902 12.871 -6.819 1.00 65.45 H new ATOM 356 N PHE A 378 14.235 11.649 -2.424 1.00 75.23 N ATOM 357 CA PHE A 378 14.963 10.715 -1.609 1.00 73.33 C ATOM 358 C PHE A 378 14.201 9.423 -1.479 1.00 53.14 C ATOM 359 O PHE A 378 12.990 9.436 -1.257 1.00 45.20 O ATOM 360 CB PHE A 378 15.248 11.290 -0.222 1.00 50.02 C ATOM 361 CG PHE A 378 16.398 12.227 -0.120 1.00 70.00 C ATOM 362 CD1 PHE A 378 16.331 13.518 -0.604 1.00 11.32 C ATOM 363 CD2 PHE A 378 17.557 11.802 0.488 1.00 71.43 C ATOM 364 CE1 PHE A 378 17.414 14.367 -0.479 1.00 73.11 C ATOM 365 CE2 PHE A 378 18.632 12.629 0.621 1.00 73.44 C ATOM 366 CZ PHE A 378 18.570 13.922 0.136 1.00 14.15 C ATOM 0 H PHE A 378 14.058 12.549 -1.978 1.00 75.23 H new ATOM 0 HA PHE A 378 15.916 10.521 -2.102 1.00 73.33 H new ATOM 0 HB2 PHE A 378 14.353 11.808 0.124 1.00 50.02 H new ATOM 0 HB3 PHE A 378 15.421 10.460 0.463 1.00 50.02 H new ATOM 0 HD1 PHE A 378 15.428 13.866 -1.083 1.00 11.32 H new ATOM 0 HD2 PHE A 378 17.616 10.793 0.867 1.00 71.43 H new ATOM 0 HE1 PHE A 378 17.358 15.376 -0.861 1.00 73.11 H new ATOM 0 HE2 PHE A 378 19.531 12.275 1.104 1.00 73.44 H new ATOM 0 HZ PHE A 378 19.420 14.581 0.237 1.00 14.15 H new ATOM 376 N TYR A 379 14.914 8.325 -1.690 1.00 15.41 N ATOM 377 CA TYR A 379 14.407 6.959 -1.534 1.00 70.23 C ATOM 378 C TYR A 379 13.577 6.482 -2.715 1.00 2.12 C ATOM 379 O TYR A 379 13.285 5.292 -2.829 1.00 12.31 O ATOM 380 CB TYR A 379 13.710 6.744 -0.185 1.00 64.04 C ATOM 381 CG TYR A 379 14.653 6.935 1.002 1.00 52.32 C ATOM 382 CD1 TYR A 379 14.859 8.193 1.562 1.00 52.41 C ATOM 383 CD2 TYR A 379 15.356 5.863 1.539 1.00 14.04 C ATOM 384 CE1 TYR A 379 15.734 8.382 2.617 1.00 45.01 C ATOM 385 CE2 TYR A 379 16.235 6.040 2.594 1.00 11.15 C ATOM 386 CZ TYR A 379 16.421 7.302 3.127 1.00 73.24 C ATOM 387 OH TYR A 379 17.295 7.483 4.179 1.00 14.04 O ATOM 0 H TYR A 379 15.890 8.356 -1.983 1.00 15.41 H new ATOM 0 HA TYR A 379 15.287 6.316 -1.529 1.00 70.23 H new ATOM 0 HB2 TYR A 379 12.876 7.440 -0.097 1.00 64.04 H new ATOM 0 HB3 TYR A 379 13.291 5.738 -0.153 1.00 64.04 H new ATOM 0 HD1 TYR A 379 14.323 9.042 1.163 1.00 52.41 H new ATOM 0 HD2 TYR A 379 15.214 4.875 1.126 1.00 14.04 H new ATOM 0 HE1 TYR A 379 15.877 9.367 3.037 1.00 45.01 H new ATOM 0 HE2 TYR A 379 16.773 5.196 2.999 1.00 11.15 H new ATOM 0 HH TYR A 379 17.698 6.623 4.421 1.00 14.04 H new ATOM 397 N GLU A 380 13.204 7.391 -3.586 1.00 40.33 N ATOM 398 CA GLU A 380 12.546 7.008 -4.805 1.00 23.42 C ATOM 399 C GLU A 380 13.505 7.039 -5.957 1.00 52.40 C ATOM 400 O GLU A 380 13.990 5.996 -6.407 1.00 45.32 O ATOM 401 CB GLU A 380 11.319 7.861 -5.151 1.00 52.33 C ATOM 402 CG GLU A 380 10.094 7.632 -4.313 1.00 21.24 C ATOM 403 CD GLU A 380 8.824 8.138 -4.991 1.00 31.21 C ATOM 404 OE1 GLU A 380 8.568 9.354 -5.020 1.00 51.34 O ATOM 405 OE2 GLU A 380 8.057 7.308 -5.518 1.00 43.43 O ATOM 0 H GLU A 380 13.346 8.395 -3.471 1.00 40.33 H new ATOM 0 HA GLU A 380 12.188 5.994 -4.630 1.00 23.42 H new ATOM 0 HB2 GLU A 380 11.598 8.911 -5.070 1.00 52.33 H new ATOM 0 HB3 GLU A 380 11.059 7.680 -6.194 1.00 52.33 H new ATOM 0 HG2 GLU A 380 9.993 6.567 -4.106 1.00 21.24 H new ATOM 0 HG3 GLU A 380 10.215 8.133 -3.353 1.00 21.24 H new ATOM 412 N ASN A 381 13.801 8.246 -6.423 1.00 3.00 N ATOM 413 CA ASN A 381 14.611 8.475 -7.606 1.00 20.35 C ATOM 414 C ASN A 381 14.747 9.954 -7.915 1.00 74.45 C ATOM 415 O ASN A 381 14.153 10.803 -7.240 1.00 52.41 O ATOM 416 CB ASN A 381 14.068 7.699 -8.829 1.00 24.12 C ATOM 417 CG ASN A 381 12.553 7.791 -9.011 1.00 21.32 C ATOM 418 OD1 ASN A 381 11.913 8.778 -8.650 1.00 61.44 O ATOM 419 ND2 ASN A 381 11.975 6.739 -9.545 1.00 32.33 N ATOM 0 H ASN A 381 13.478 9.106 -5.980 1.00 3.00 H new ATOM 0 HA ASN A 381 15.608 8.091 -7.388 1.00 20.35 H new ATOM 0 HB2 ASN A 381 14.554 8.076 -9.729 1.00 24.12 H new ATOM 0 HB3 ASN A 381 14.347 6.650 -8.732 1.00 24.12 H new ATOM 0 HD21 ASN A 381 10.963 6.723 -9.672 1.00 32.33 H new ATOM 0 HD22 ASN A 381 12.538 5.939 -9.833 1.00 32.33 H new ATOM 426 N VAL A 382 15.544 10.259 -8.922 1.00 75.23 N ATOM 427 CA VAL A 382 15.801 11.625 -9.331 1.00 31.43 C ATOM 428 C VAL A 382 15.552 11.744 -10.825 1.00 14.43 C ATOM 429 O VAL A 382 15.928 10.849 -11.598 1.00 40.22 O ATOM 430 CB VAL A 382 17.267 12.059 -9.012 1.00 64.25 C ATOM 431 CG1 VAL A 382 17.514 13.509 -9.416 1.00 43.11 C ATOM 432 CG2 VAL A 382 17.576 11.869 -7.538 1.00 74.41 C ATOM 0 H VAL A 382 16.034 9.561 -9.482 1.00 75.23 H new ATOM 0 HA VAL A 382 15.132 12.282 -8.775 1.00 31.43 H new ATOM 0 HB VAL A 382 17.933 11.423 -9.595 1.00 64.25 H new ATOM 0 HG11 VAL A 382 18.543 13.782 -9.182 1.00 43.11 H new ATOM 0 HG12 VAL A 382 17.343 13.623 -10.487 1.00 43.11 H new ATOM 0 HG13 VAL A 382 16.832 14.160 -8.869 1.00 43.11 H new ATOM 0 HG21 VAL A 382 18.602 12.178 -7.339 1.00 74.41 H new ATOM 0 HG22 VAL A 382 16.893 12.474 -6.942 1.00 74.41 H new ATOM 0 HG23 VAL A 382 17.455 10.819 -7.273 1.00 74.41 H new ATOM 442 N PHE A 383 14.925 12.821 -11.229 1.00 34.02 N ATOM 443 CA PHE A 383 14.598 13.039 -12.626 1.00 14.13 C ATOM 444 C PHE A 383 15.184 14.342 -13.101 1.00 41.13 C ATOM 445 O PHE A 383 15.482 15.221 -12.302 1.00 14.40 O ATOM 446 CB PHE A 383 13.078 13.164 -12.821 1.00 23.14 C ATOM 447 CG PHE A 383 12.251 12.009 -12.359 1.00 21.12 C ATOM 448 CD1 PHE A 383 11.902 11.894 -11.033 1.00 14.01 C ATOM 449 CD2 PHE A 383 11.801 11.056 -13.252 1.00 44.40 C ATOM 450 CE1 PHE A 383 11.131 10.857 -10.592 1.00 55.23 C ATOM 451 CE2 PHE A 383 11.020 10.005 -12.820 1.00 43.00 C ATOM 452 CZ PHE A 383 10.683 9.906 -11.486 1.00 72.14 C ATOM 0 H PHE A 383 14.626 13.571 -10.606 1.00 34.02 H new ATOM 0 HA PHE A 383 14.997 12.190 -13.181 1.00 14.13 H new ATOM 0 HB2 PHE A 383 12.739 14.058 -12.297 1.00 23.14 H new ATOM 0 HB3 PHE A 383 12.882 13.322 -13.881 1.00 23.14 H new ATOM 0 HD1 PHE A 383 12.244 12.637 -10.328 1.00 14.01 H new ATOM 0 HD2 PHE A 383 12.063 11.135 -14.297 1.00 44.40 H new ATOM 0 HE1 PHE A 383 10.872 10.781 -9.546 1.00 55.23 H new ATOM 0 HE2 PHE A 383 10.673 9.262 -13.523 1.00 43.00 H new ATOM 0 HZ PHE A 383 10.070 9.086 -11.142 1.00 72.14 H new ATOM 462 N GLN A 384 15.344 14.440 -14.390 1.00 63.22 N ATOM 463 CA GLN A 384 15.662 15.663 -15.065 1.00 5.45 C ATOM 464 C GLN A 384 14.539 15.981 -16.027 1.00 72.23 C ATOM 465 O GLN A 384 14.434 15.396 -17.113 1.00 44.34 O ATOM 466 CB GLN A 384 17.032 15.640 -15.755 1.00 61.02 C ATOM 467 CG GLN A 384 17.317 14.395 -16.580 1.00 2.54 C ATOM 468 CD GLN A 384 18.664 14.433 -17.302 1.00 61.02 C ATOM 469 OE1 GLN A 384 18.817 13.856 -18.358 1.00 44.41 O ATOM 470 NE2 GLN A 384 19.646 15.091 -16.728 1.00 12.52 N ATOM 0 H GLN A 384 15.253 13.643 -15.020 1.00 63.22 H new ATOM 0 HA GLN A 384 15.748 16.457 -14.324 1.00 5.45 H new ATOM 0 HB2 GLN A 384 17.110 16.513 -16.404 1.00 61.02 H new ATOM 0 HB3 GLN A 384 17.806 15.738 -14.994 1.00 61.02 H new ATOM 0 HG2 GLN A 384 17.289 13.523 -15.927 1.00 2.54 H new ATOM 0 HG3 GLN A 384 16.523 14.268 -17.316 1.00 2.54 H new ATOM 0 HE21 GLN A 384 19.490 15.568 -15.840 1.00 12.52 H new ATOM 0 HE22 GLN A 384 20.564 15.125 -17.171 1.00 12.52 H new ATOM 479 N ASP A 385 13.665 16.853 -15.568 1.00 42.21 N ATOM 480 CA ASP A 385 12.447 17.287 -16.259 1.00 22.33 C ATOM 481 C ASP A 385 11.437 16.152 -16.268 1.00 44.31 C ATOM 482 O ASP A 385 10.496 16.132 -15.471 1.00 2.53 O ATOM 483 CB ASP A 385 12.720 17.768 -17.698 1.00 33.30 C ATOM 484 CG ASP A 385 11.515 18.418 -18.336 1.00 72.42 C ATOM 485 OD1 ASP A 385 10.547 17.708 -18.696 1.00 11.51 O ATOM 486 OD2 ASP A 385 11.512 19.661 -18.469 1.00 61.42 O ATOM 0 H ASP A 385 13.781 17.305 -14.661 1.00 42.21 H new ATOM 0 HA ASP A 385 12.046 18.141 -15.712 1.00 22.33 H new ATOM 0 HB2 ASP A 385 13.547 18.478 -17.688 1.00 33.30 H new ATOM 0 HB3 ASP A 385 13.034 16.920 -18.306 1.00 33.30 H new ATOM 491 N SER A 386 11.667 15.202 -17.135 1.00 3.43 N ATOM 492 CA SER A 386 10.825 14.050 -17.276 1.00 4.12 C ATOM 493 C SER A 386 11.691 12.779 -17.387 1.00 52.12 C ATOM 494 O SER A 386 11.215 11.661 -17.156 1.00 14.04 O ATOM 495 CB SER A 386 9.957 14.216 -18.524 1.00 31.14 C ATOM 496 OG SER A 386 9.163 15.406 -18.445 1.00 32.32 O ATOM 0 H SER A 386 12.462 15.210 -17.775 1.00 3.43 H new ATOM 0 HA SER A 386 10.181 13.953 -16.402 1.00 4.12 H new ATOM 0 HB2 SER A 386 10.591 14.256 -19.409 1.00 31.14 H new ATOM 0 HB3 SER A 386 9.307 13.348 -18.637 1.00 31.14 H new ATOM 0 HG SER A 386 9.693 16.173 -18.746 1.00 32.32 H new ATOM 502 N ILE A 387 12.965 12.970 -17.707 1.00 60.43 N ATOM 503 CA ILE A 387 13.897 11.873 -17.884 1.00 24.42 C ATOM 504 C ILE A 387 14.461 11.406 -16.556 1.00 32.13 C ATOM 505 O ILE A 387 15.032 12.175 -15.794 1.00 3.42 O ATOM 506 CB ILE A 387 15.024 12.237 -18.903 1.00 62.34 C ATOM 507 CG1 ILE A 387 14.436 12.346 -20.323 1.00 64.32 C ATOM 508 CG2 ILE A 387 16.198 11.251 -18.866 1.00 0.12 C ATOM 509 CD1 ILE A 387 13.806 11.058 -20.843 1.00 43.13 C ATOM 0 H ILE A 387 13.377 13.892 -17.850 1.00 60.43 H new ATOM 0 HA ILE A 387 13.343 11.036 -18.309 1.00 24.42 H new ATOM 0 HB ILE A 387 15.430 13.205 -18.608 1.00 62.34 H new ATOM 0 HG12 ILE A 387 13.683 13.134 -20.332 1.00 64.32 H new ATOM 0 HG13 ILE A 387 15.226 12.652 -21.008 1.00 64.32 H new ATOM 0 HG21 ILE A 387 16.950 11.554 -19.594 1.00 0.12 H new ATOM 0 HG22 ILE A 387 16.639 11.247 -17.869 1.00 0.12 H new ATOM 0 HG23 ILE A 387 15.840 10.250 -19.108 1.00 0.12 H new ATOM 0 HD11 ILE A 387 13.417 11.223 -21.848 1.00 43.13 H new ATOM 0 HD12 ILE A 387 14.559 10.270 -20.870 1.00 43.13 H new ATOM 0 HD13 ILE A 387 12.991 10.759 -20.183 1.00 43.13 H new ATOM 521 N LEU A 388 14.266 10.154 -16.294 1.00 13.21 N ATOM 522 CA LEU A 388 14.689 9.521 -15.075 1.00 75.21 C ATOM 523 C LEU A 388 16.190 9.226 -15.090 1.00 72.22 C ATOM 524 O LEU A 388 16.679 8.497 -15.967 1.00 31.01 O ATOM 525 CB LEU A 388 13.888 8.230 -14.908 1.00 22.35 C ATOM 526 CG LEU A 388 14.190 7.372 -13.692 1.00 73.15 C ATOM 527 CD1 LEU A 388 13.969 8.152 -12.416 1.00 13.50 C ATOM 528 CD2 LEU A 388 13.316 6.137 -13.711 1.00 2.13 C ATOM 0 H LEU A 388 13.794 9.520 -16.938 1.00 13.21 H new ATOM 0 HA LEU A 388 14.506 10.191 -14.235 1.00 75.21 H new ATOM 0 HB2 LEU A 388 12.830 8.491 -14.881 1.00 22.35 H new ATOM 0 HB3 LEU A 388 14.043 7.620 -15.798 1.00 22.35 H new ATOM 0 HG LEU A 388 15.237 7.072 -13.727 1.00 73.15 H new ATOM 0 HD11 LEU A 388 14.191 7.517 -11.558 1.00 13.50 H new ATOM 0 HD12 LEU A 388 14.625 9.022 -12.403 1.00 13.50 H new ATOM 0 HD13 LEU A 388 12.931 8.480 -12.365 1.00 13.50 H new ATOM 0 HD21 LEU A 388 13.535 5.523 -12.837 1.00 2.13 H new ATOM 0 HD22 LEU A 388 12.267 6.433 -13.693 1.00 2.13 H new ATOM 0 HD23 LEU A 388 13.516 5.564 -14.616 1.00 2.13 H new ATOM 540 N LEU A 389 16.914 9.811 -14.131 1.00 42.33 N ATOM 541 CA LEU A 389 18.339 9.561 -13.983 1.00 73.21 C ATOM 542 C LEU A 389 18.590 8.116 -13.596 1.00 74.44 C ATOM 543 O LEU A 389 19.099 7.345 -14.380 1.00 1.00 O ATOM 544 CB LEU A 389 18.965 10.482 -12.931 1.00 43.41 C ATOM 545 CG LEU A 389 18.862 11.984 -13.183 1.00 14.33 C ATOM 546 CD1 LEU A 389 19.592 12.743 -12.100 1.00 1.34 C ATOM 547 CD2 LEU A 389 19.427 12.340 -14.537 1.00 64.30 C ATOM 0 H LEU A 389 16.529 10.462 -13.447 1.00 42.33 H new ATOM 0 HA LEU A 389 18.805 9.767 -14.947 1.00 73.21 H new ATOM 0 HB2 LEU A 389 18.499 10.266 -11.970 1.00 43.41 H new ATOM 0 HB3 LEU A 389 20.020 10.225 -12.839 1.00 43.41 H new ATOM 0 HG LEU A 389 17.809 12.264 -13.166 1.00 14.33 H new ATOM 0 HD11 LEU A 389 19.512 13.814 -12.289 1.00 1.34 H new ATOM 0 HD12 LEU A 389 19.149 12.512 -11.132 1.00 1.34 H new ATOM 0 HD13 LEU A 389 20.642 12.452 -12.097 1.00 1.34 H new ATOM 0 HD21 LEU A 389 19.343 13.415 -14.695 1.00 64.30 H new ATOM 0 HD22 LEU A 389 20.476 12.047 -14.582 1.00 64.30 H new ATOM 0 HD23 LEU A 389 18.870 11.815 -15.313 1.00 64.30 H new ATOM 559 N GLY A 390 18.184 7.749 -12.404 1.00 2.41 N ATOM 560 CA GLY A 390 18.429 6.414 -11.933 1.00 24.15 C ATOM 561 C GLY A 390 17.308 5.905 -11.073 1.00 30.21 C ATOM 562 O GLY A 390 16.323 6.592 -10.877 1.00 2.32 O ATOM 0 H GLY A 390 17.687 8.353 -11.750 1.00 2.41 H new ATOM 0 HA2 GLY A 390 18.563 5.748 -12.785 1.00 24.15 H new ATOM 0 HA3 GLY A 390 19.359 6.395 -11.365 1.00 24.15 H new ATOM 566 N ASN A 391 17.472 4.712 -10.548 1.00 63.54 N ATOM 567 CA ASN A 391 16.445 4.041 -9.700 1.00 41.22 C ATOM 568 C ASN A 391 17.046 3.739 -8.386 1.00 61.51 C ATOM 569 O ASN A 391 18.212 3.371 -8.339 1.00 70.24 O ATOM 570 CB ASN A 391 15.950 2.711 -10.318 1.00 15.31 C ATOM 571 CG ASN A 391 15.023 2.852 -11.509 1.00 31.10 C ATOM 572 OD1 ASN A 391 15.114 3.927 -12.217 1.00 54.13 O flip ATOM 573 ND2 ASN A 391 14.202 1.983 -11.762 1.00 11.25 N flip ATOM 0 H ASN A 391 18.317 4.156 -10.683 1.00 63.54 H new ATOM 0 HA ASN A 391 15.593 4.715 -9.615 1.00 41.22 H new ATOM 0 HB2 ASN A 391 16.818 2.126 -10.622 1.00 15.31 H new ATOM 0 HB3 ASN A 391 15.436 2.140 -9.545 1.00 15.31 H new ATOM 0 HD21 ASN A 391 14.153 1.144 -11.184 1.00 11.25 H new ATOM 0 HD22 ASN A 391 13.565 2.097 -12.551 1.00 11.25 H new ATOM 580 N PHE A 392 16.285 3.877 -7.322 1.00 22.21 N ATOM 581 CA PHE A 392 16.833 3.655 -5.976 1.00 63.03 C ATOM 582 C PHE A 392 17.412 2.256 -5.860 1.00 11.21 C ATOM 583 O PHE A 392 16.694 1.251 -5.959 1.00 44.12 O ATOM 584 CB PHE A 392 15.767 3.895 -4.897 1.00 53.24 C ATOM 585 CG PHE A 392 16.270 3.740 -3.483 1.00 2.12 C ATOM 586 CD1 PHE A 392 17.116 4.688 -2.925 1.00 35.34 C ATOM 587 CD2 PHE A 392 15.885 2.659 -2.708 1.00 55.31 C ATOM 588 CE1 PHE A 392 17.569 4.557 -1.629 1.00 13.52 C ATOM 589 CE2 PHE A 392 16.337 2.523 -1.410 1.00 52.11 C ATOM 590 CZ PHE A 392 17.178 3.473 -0.871 1.00 63.24 C ATOM 0 H PHE A 392 15.299 4.137 -7.347 1.00 22.21 H new ATOM 0 HA PHE A 392 17.636 4.374 -5.816 1.00 63.03 H new ATOM 0 HB2 PHE A 392 15.363 4.900 -5.019 1.00 53.24 H new ATOM 0 HB3 PHE A 392 14.943 3.199 -5.056 1.00 53.24 H new ATOM 0 HD1 PHE A 392 17.424 5.540 -3.513 1.00 35.34 H new ATOM 0 HD2 PHE A 392 15.223 1.913 -3.123 1.00 55.31 H new ATOM 0 HE1 PHE A 392 18.229 5.302 -1.208 1.00 13.52 H new ATOM 0 HE2 PHE A 392 16.032 1.673 -0.818 1.00 52.11 H new ATOM 0 HZ PHE A 392 17.531 3.369 0.144 1.00 63.24 H new ATOM 600 N ALA A 393 18.707 2.203 -5.685 1.00 54.13 N ATOM 601 CA ALA A 393 19.405 0.960 -5.592 1.00 42.32 C ATOM 602 C ALA A 393 20.040 0.792 -4.239 1.00 4.43 C ATOM 603 O ALA A 393 19.825 -0.211 -3.555 1.00 13.21 O ATOM 604 CB ALA A 393 20.456 0.864 -6.687 1.00 23.40 C ATOM 0 H ALA A 393 19.303 3.027 -5.603 1.00 54.13 H new ATOM 0 HA ALA A 393 18.682 0.155 -5.725 1.00 42.32 H new ATOM 0 HB1 ALA A 393 20.981 -0.088 -6.605 1.00 23.40 H new ATOM 0 HB2 ALA A 393 19.973 0.929 -7.662 1.00 23.40 H new ATOM 0 HB3 ALA A 393 21.169 1.682 -6.580 1.00 23.40 H new ATOM 610 N SER A 394 20.805 1.775 -3.834 1.00 72.31 N ATOM 611 CA SER A 394 21.562 1.658 -2.628 1.00 33.00 C ATOM 612 C SER A 394 21.434 2.887 -1.748 1.00 73.51 C ATOM 613 O SER A 394 21.143 3.995 -2.224 1.00 24.44 O ATOM 614 CB SER A 394 23.029 1.400 -2.975 1.00 41.24 C ATOM 615 OG SER A 394 23.157 0.235 -3.785 1.00 30.25 O ATOM 0 H SER A 394 20.915 2.662 -4.326 1.00 72.31 H new ATOM 0 HA SER A 394 21.162 0.819 -2.059 1.00 33.00 H new ATOM 0 HB2 SER A 394 23.441 2.262 -3.501 1.00 41.24 H new ATOM 0 HB3 SER A 394 23.608 1.278 -2.060 1.00 41.24 H new ATOM 0 HG SER A 394 24.102 0.087 -3.998 1.00 30.25 H new ATOM 621 N GLN A 395 21.637 2.668 -0.484 1.00 32.42 N ATOM 622 CA GLN A 395 21.630 3.675 0.529 1.00 24.51 C ATOM 623 C GLN A 395 22.809 3.388 1.433 1.00 71.32 C ATOM 624 O GLN A 395 22.912 2.304 2.000 1.00 63.22 O ATOM 625 CB GLN A 395 20.254 3.647 1.275 1.00 14.53 C ATOM 626 CG GLN A 395 20.094 4.566 2.503 1.00 44.23 C ATOM 627 CD GLN A 395 20.762 4.021 3.764 1.00 72.34 C ATOM 628 OE1 GLN A 395 20.863 2.814 3.956 1.00 71.44 O ATOM 629 NE2 GLN A 395 21.206 4.884 4.617 1.00 55.43 N ATOM 0 H GLN A 395 21.821 1.735 -0.115 1.00 32.42 H new ATOM 0 HA GLN A 395 21.735 4.682 0.126 1.00 24.51 H new ATOM 0 HB2 GLN A 395 19.476 3.906 0.557 1.00 14.53 H new ATOM 0 HB3 GLN A 395 20.065 2.622 1.594 1.00 14.53 H new ATOM 0 HG2 GLN A 395 20.516 5.544 2.272 1.00 44.23 H new ATOM 0 HG3 GLN A 395 19.032 4.715 2.699 1.00 44.23 H new ATOM 0 HE21 GLN A 395 21.108 5.882 4.431 1.00 55.43 H new ATOM 0 HE22 GLN A 395 21.654 4.567 5.477 1.00 55.43 H new ATOM 638 N GLU A 396 23.716 4.322 1.518 1.00 13.24 N ATOM 639 CA GLU A 396 24.908 4.164 2.312 1.00 71.13 C ATOM 640 C GLU A 396 25.101 5.394 3.156 1.00 0.42 C ATOM 641 O GLU A 396 25.479 6.450 2.642 1.00 13.23 O ATOM 642 CB GLU A 396 26.133 3.941 1.415 1.00 14.40 C ATOM 643 CG GLU A 396 26.054 2.702 0.537 1.00 45.53 C ATOM 644 CD GLU A 396 27.270 2.532 -0.320 1.00 44.13 C ATOM 645 OE1 GLU A 396 27.302 3.078 -1.434 1.00 74.33 O ATOM 646 OE2 GLU A 396 28.222 1.861 0.107 1.00 42.30 O ATOM 0 H GLU A 396 23.651 5.219 1.037 1.00 13.24 H new ATOM 0 HA GLU A 396 24.797 3.290 2.954 1.00 71.13 H new ATOM 0 HB2 GLU A 396 26.265 4.815 0.777 1.00 14.40 H new ATOM 0 HB3 GLU A 396 27.020 3.869 2.044 1.00 14.40 H new ATOM 0 HG2 GLU A 396 25.930 1.821 1.167 1.00 45.53 H new ATOM 0 HG3 GLU A 396 25.171 2.766 -0.099 1.00 45.53 H new ATOM 653 N GLY A 397 24.806 5.277 4.430 1.00 4.41 N ATOM 654 CA GLY A 397 24.913 6.409 5.319 1.00 11.14 C ATOM 655 C GLY A 397 23.920 7.479 4.943 1.00 42.43 C ATOM 656 O GLY A 397 22.719 7.242 4.950 1.00 72.30 O ATOM 0 H GLY A 397 24.491 4.413 4.872 1.00 4.41 H new ATOM 0 HA2 GLY A 397 24.738 6.089 6.346 1.00 11.14 H new ATOM 0 HA3 GLY A 397 25.924 6.814 5.279 1.00 11.14 H new ATOM 660 N ASN A 398 24.402 8.634 4.591 1.00 32.21 N ATOM 661 CA ASN A 398 23.522 9.703 4.162 1.00 74.43 C ATOM 662 C ASN A 398 23.624 9.920 2.652 1.00 43.13 C ATOM 663 O ASN A 398 23.128 10.901 2.118 1.00 34.11 O ATOM 664 CB ASN A 398 23.759 11.012 4.959 1.00 11.00 C ATOM 665 CG ASN A 398 25.128 11.653 4.774 1.00 32.43 C ATOM 666 OD1 ASN A 398 26.129 10.989 4.498 1.00 2.41 O ATOM 667 ND2 ASN A 398 25.183 12.945 4.970 1.00 51.43 N ATOM 0 H ASN A 398 25.395 8.869 4.589 1.00 32.21 H new ATOM 0 HA ASN A 398 22.500 9.396 4.382 1.00 74.43 H new ATOM 0 HB2 ASN A 398 22.996 11.735 4.671 1.00 11.00 H new ATOM 0 HB3 ASN A 398 23.615 10.803 6.019 1.00 11.00 H new ATOM 0 HD21 ASN A 398 26.075 13.435 4.896 1.00 51.43 H new ATOM 0 HD22 ASN A 398 24.334 13.463 5.197 1.00 51.43 H new ATOM 674 N VAL A 399 24.253 8.972 1.968 1.00 45.30 N ATOM 675 CA VAL A 399 24.394 9.020 0.518 1.00 14.33 C ATOM 676 C VAL A 399 23.487 7.977 -0.140 1.00 3.10 C ATOM 677 O VAL A 399 23.504 6.792 0.230 1.00 32.12 O ATOM 678 CB VAL A 399 25.867 8.787 0.072 1.00 65.40 C ATOM 679 CG1 VAL A 399 25.972 8.737 -1.448 1.00 40.23 C ATOM 680 CG2 VAL A 399 26.763 9.889 0.613 1.00 14.24 C ATOM 0 H VAL A 399 24.678 8.152 2.400 1.00 45.30 H new ATOM 0 HA VAL A 399 24.097 10.018 0.196 1.00 14.33 H new ATOM 0 HB VAL A 399 26.195 7.829 0.476 1.00 65.40 H new ATOM 0 HG11 VAL A 399 27.011 8.573 -1.736 1.00 40.23 H new ATOM 0 HG12 VAL A 399 25.357 7.921 -1.829 1.00 40.23 H new ATOM 0 HG13 VAL A 399 25.624 9.681 -1.868 1.00 40.23 H new ATOM 0 HG21 VAL A 399 27.790 9.713 0.293 1.00 14.24 H new ATOM 0 HG22 VAL A 399 26.425 10.853 0.232 1.00 14.24 H new ATOM 0 HG23 VAL A 399 26.718 9.893 1.702 1.00 14.24 H new ATOM 690 N LEU A 400 22.700 8.412 -1.099 1.00 33.21 N ATOM 691 CA LEU A 400 21.782 7.531 -1.792 1.00 24.23 C ATOM 692 C LEU A 400 22.164 7.391 -3.256 1.00 11.41 C ATOM 693 O LEU A 400 22.532 8.372 -3.912 1.00 4.13 O ATOM 694 CB LEU A 400 20.311 7.985 -1.662 1.00 21.12 C ATOM 695 CG LEU A 400 19.636 7.905 -0.264 1.00 23.34 C ATOM 696 CD1 LEU A 400 20.247 8.869 0.745 1.00 0.05 C ATOM 697 CD2 LEU A 400 18.146 8.140 -0.381 1.00 31.44 C ATOM 0 H LEU A 400 22.677 9.380 -1.420 1.00 33.21 H new ATOM 0 HA LEU A 400 21.863 6.557 -1.310 1.00 24.23 H new ATOM 0 HB2 LEU A 400 20.251 9.019 -2.002 1.00 21.12 H new ATOM 0 HB3 LEU A 400 19.716 7.388 -2.353 1.00 21.12 H new ATOM 0 HG LEU A 400 19.815 6.898 0.113 1.00 23.34 H new ATOM 0 HD11 LEU A 400 19.735 8.767 1.702 1.00 0.05 H new ATOM 0 HD12 LEU A 400 21.305 8.639 0.874 1.00 0.05 H new ATOM 0 HD13 LEU A 400 20.139 9.891 0.383 1.00 0.05 H new ATOM 0 HD21 LEU A 400 17.690 8.080 0.607 1.00 31.44 H new ATOM 0 HD22 LEU A 400 17.966 9.128 -0.805 1.00 31.44 H new ATOM 0 HD23 LEU A 400 17.708 7.381 -1.029 1.00 31.44 H new ATOM 709 N LYS A 401 22.074 6.184 -3.757 1.00 62.42 N ATOM 710 CA LYS A 401 22.445 5.869 -5.122 1.00 1.11 C ATOM 711 C LYS A 401 21.256 5.355 -5.945 1.00 24.31 C ATOM 712 O LYS A 401 20.545 4.419 -5.533 1.00 71.52 O ATOM 713 CB LYS A 401 23.624 4.873 -5.127 1.00 24.00 C ATOM 714 CG LYS A 401 23.922 4.231 -6.466 1.00 4.45 C ATOM 715 CD LYS A 401 24.132 5.246 -7.571 1.00 23.41 C ATOM 716 CE LYS A 401 24.216 4.532 -8.882 1.00 1.15 C ATOM 717 NZ LYS A 401 25.507 3.866 -9.099 1.00 30.33 N ATOM 0 H LYS A 401 21.738 5.381 -3.226 1.00 62.42 H new ATOM 0 HA LYS A 401 22.767 6.790 -5.608 1.00 1.11 H new ATOM 0 HB2 LYS A 401 24.519 5.393 -4.784 1.00 24.00 H new ATOM 0 HB3 LYS A 401 23.416 4.085 -4.403 1.00 24.00 H new ATOM 0 HG2 LYS A 401 24.813 3.610 -6.375 1.00 4.45 H new ATOM 0 HG3 LYS A 401 23.099 3.570 -6.738 1.00 4.45 H new ATOM 0 HD2 LYS A 401 23.310 5.962 -7.585 1.00 23.41 H new ATOM 0 HD3 LYS A 401 25.046 5.813 -7.392 1.00 23.41 H new ATOM 0 HE2 LYS A 401 23.419 3.790 -8.936 1.00 1.15 H new ATOM 0 HE3 LYS A 401 24.043 5.245 -9.688 1.00 1.15 H new ATOM 0 HZ1 LYS A 401 25.347 2.863 -9.323 1.00 30.33 H new ATOM 0 HZ2 LYS A 401 26.005 4.323 -9.890 1.00 30.33 H new ATOM 0 HZ3 LYS A 401 26.085 3.940 -8.238 1.00 30.33 H new ATOM 731 N TYR A 402 21.057 5.971 -7.113 1.00 74.50 N ATOM 732 CA TYR A 402 20.001 5.636 -7.998 1.00 35.01 C ATOM 733 C TYR A 402 20.631 5.188 -9.315 1.00 50.03 C ATOM 734 O TYR A 402 21.360 5.949 -9.921 1.00 65.24 O ATOM 735 CB TYR A 402 19.107 6.870 -8.216 1.00 71.23 C ATOM 736 CG TYR A 402 18.570 7.469 -6.925 1.00 22.15 C ATOM 737 CD1 TYR A 402 17.421 6.980 -6.330 1.00 70.45 C ATOM 738 CD2 TYR A 402 19.224 8.525 -6.303 1.00 41.04 C ATOM 739 CE1 TYR A 402 16.938 7.523 -5.152 1.00 33.30 C ATOM 740 CE2 TYR A 402 18.746 9.068 -5.130 1.00 60.24 C ATOM 741 CZ TYR A 402 17.606 8.564 -4.559 1.00 4.20 C ATOM 742 OH TYR A 402 17.129 9.113 -3.388 1.00 13.42 O ATOM 0 H TYR A 402 21.651 6.727 -7.453 1.00 74.50 H new ATOM 0 HA TYR A 402 19.382 4.837 -7.590 1.00 35.01 H new ATOM 0 HB2 TYR A 402 19.676 7.631 -8.750 1.00 71.23 H new ATOM 0 HB3 TYR A 402 18.268 6.592 -8.854 1.00 71.23 H new ATOM 0 HD1 TYR A 402 16.892 6.160 -6.793 1.00 70.45 H new ATOM 0 HD2 TYR A 402 20.123 8.927 -6.746 1.00 41.04 H new ATOM 0 HE1 TYR A 402 16.039 7.129 -4.702 1.00 33.30 H new ATOM 0 HE2 TYR A 402 19.268 9.889 -4.661 1.00 60.24 H new ATOM 0 HH TYR A 402 17.721 9.840 -3.102 1.00 13.42 H new ATOM 752 N GLU A 403 20.375 3.977 -9.753 1.00 12.13 N ATOM 753 CA GLU A 403 21.014 3.500 -10.965 1.00 4.12 C ATOM 754 C GLU A 403 19.999 2.862 -11.881 1.00 60.42 C ATOM 755 O GLU A 403 18.917 2.504 -11.441 1.00 5.41 O ATOM 756 CB GLU A 403 22.063 2.461 -10.620 1.00 52.32 C ATOM 757 CG GLU A 403 23.164 2.350 -11.648 1.00 1.23 C ATOM 758 CD GLU A 403 24.192 1.319 -11.292 1.00 24.02 C ATOM 759 OE1 GLU A 403 24.987 1.574 -10.367 1.00 43.31 O ATOM 760 OE2 GLU A 403 24.235 0.249 -11.927 1.00 54.31 O ATOM 0 H GLU A 403 19.744 3.314 -9.303 1.00 12.13 H new ATOM 0 HA GLU A 403 21.475 4.353 -11.464 1.00 4.12 H new ATOM 0 HB2 GLU A 403 22.503 2.708 -9.654 1.00 52.32 H new ATOM 0 HB3 GLU A 403 21.579 1.490 -10.511 1.00 52.32 H new ATOM 0 HG2 GLU A 403 22.727 2.102 -12.615 1.00 1.23 H new ATOM 0 HG3 GLU A 403 23.651 3.319 -11.757 1.00 1.23 H new ATOM 767 N ASN A 404 20.353 2.742 -13.143 1.00 65.21 N ATOM 768 CA ASN A 404 19.556 2.034 -14.135 1.00 43.33 C ATOM 769 C ASN A 404 18.284 2.747 -14.525 1.00 64.50 C ATOM 770 O ASN A 404 17.187 2.183 -14.464 1.00 35.42 O ATOM 771 CB ASN A 404 19.324 0.542 -13.805 1.00 13.32 C ATOM 772 CG ASN A 404 20.615 -0.251 -13.767 1.00 10.15 C ATOM 773 OD1 ASN A 404 21.081 -0.749 -14.803 1.00 34.51 O ATOM 774 ND2 ASN A 404 21.180 -0.415 -12.595 1.00 21.02 N ATOM 0 H ASN A 404 21.215 3.138 -13.519 1.00 65.21 H new ATOM 0 HA ASN A 404 20.181 2.044 -15.028 1.00 43.33 H new ATOM 0 HB2 ASN A 404 18.822 0.460 -12.841 1.00 13.32 H new ATOM 0 HB3 ASN A 404 18.656 0.108 -14.549 1.00 13.32 H new ATOM 0 HD21 ASN A 404 22.033 -0.968 -12.513 1.00 21.02 H new ATOM 0 HD22 ASN A 404 20.766 0.011 -11.765 1.00 21.02 H new ATOM 781 N GLY A 405 18.425 4.008 -14.862 1.00 24.23 N ATOM 782 CA GLY A 405 17.309 4.765 -15.353 1.00 55.11 C ATOM 783 C GLY A 405 17.279 4.771 -16.874 1.00 55.33 C ATOM 784 O GLY A 405 17.601 3.752 -17.518 1.00 33.15 O ATOM 0 H GLY A 405 19.302 4.526 -14.804 1.00 24.23 H new ATOM 0 HA2 GLY A 405 16.381 4.341 -14.969 1.00 55.11 H new ATOM 0 HA3 GLY A 405 17.369 5.789 -14.983 1.00 55.11 H new ATOM 788 N GLN A 406 16.939 5.912 -17.433 1.00 14.32 N ATOM 789 CA GLN A 406 16.838 6.113 -18.882 1.00 30.11 C ATOM 790 C GLN A 406 18.165 5.918 -19.592 1.00 1.12 C ATOM 791 O GLN A 406 19.225 6.172 -19.026 1.00 30.40 O ATOM 792 CB GLN A 406 16.289 7.504 -19.197 1.00 15.02 C ATOM 793 CG GLN A 406 14.831 7.714 -18.830 1.00 2.24 C ATOM 794 CD GLN A 406 13.878 6.898 -19.683 1.00 13.40 C ATOM 795 OE1 GLN A 406 14.195 5.804 -20.148 1.00 34.30 O ATOM 796 NE2 GLN A 406 12.719 7.436 -19.917 1.00 2.35 N ATOM 0 H GLN A 406 16.719 6.748 -16.892 1.00 14.32 H new ATOM 0 HA GLN A 406 16.150 5.353 -19.252 1.00 30.11 H new ATOM 0 HB2 GLN A 406 16.891 8.244 -18.670 1.00 15.02 H new ATOM 0 HB3 GLN A 406 16.411 7.694 -20.263 1.00 15.02 H new ATOM 0 HG2 GLN A 406 14.685 7.453 -17.782 1.00 2.24 H new ATOM 0 HG3 GLN A 406 14.586 8.771 -18.932 1.00 2.24 H new ATOM 0 HE21 GLN A 406 12.488 8.345 -19.516 1.00 2.35 H new ATOM 0 HE22 GLN A 406 12.040 6.950 -20.502 1.00 2.35 H new ATOM 805 N SER A 407 18.105 5.427 -20.805 1.00 23.32 N ATOM 806 CA SER A 407 19.277 5.286 -21.635 1.00 20.31 C ATOM 807 C SER A 407 19.890 6.678 -21.859 1.00 52.21 C ATOM 808 O SER A 407 19.174 7.694 -21.853 1.00 2.35 O ATOM 809 CB SER A 407 18.880 4.652 -22.956 1.00 11.45 C ATOM 810 OG SER A 407 18.184 3.431 -22.727 1.00 10.12 O ATOM 0 H SER A 407 17.241 5.113 -21.246 1.00 23.32 H new ATOM 0 HA SER A 407 20.015 4.645 -21.153 1.00 20.31 H new ATOM 0 HB2 SER A 407 18.249 5.338 -23.522 1.00 11.45 H new ATOM 0 HB3 SER A 407 19.768 4.465 -23.559 1.00 11.45 H new ATOM 0 HG SER A 407 17.932 3.032 -23.586 1.00 10.12 H new ATOM 816 N CYS A 408 21.176 6.739 -22.020 1.00 51.12 N ATOM 817 CA CYS A 408 21.849 8.014 -22.124 1.00 51.14 C ATOM 818 C CYS A 408 22.669 8.116 -23.409 1.00 63.35 C ATOM 819 O CYS A 408 23.290 9.144 -23.682 1.00 20.25 O ATOM 820 CB CYS A 408 22.732 8.183 -20.889 1.00 60.00 C ATOM 821 SG CYS A 408 23.672 9.727 -20.793 1.00 4.55 S ATOM 0 H CYS A 408 21.788 5.925 -22.083 1.00 51.12 H new ATOM 0 HA CYS A 408 21.111 8.815 -22.169 1.00 51.14 H new ATOM 0 HB2 CYS A 408 22.102 8.109 -20.003 1.00 60.00 H new ATOM 0 HB3 CYS A 408 23.434 7.350 -20.852 1.00 60.00 H new ATOM 826 N ALA A 409 22.632 7.052 -24.203 1.00 52.33 N ATOM 827 CA ALA A 409 23.440 6.931 -25.406 1.00 31.53 C ATOM 828 C ALA A 409 24.915 7.030 -25.050 1.00 1.41 C ATOM 829 O ALA A 409 25.576 8.051 -25.276 1.00 75.02 O ATOM 830 CB ALA A 409 23.039 7.919 -26.510 1.00 32.20 C ATOM 0 H ALA A 409 22.035 6.244 -24.027 1.00 52.33 H new ATOM 0 HA ALA A 409 23.250 5.946 -25.832 1.00 31.53 H new ATOM 0 HB1 ALA A 409 23.682 7.775 -27.378 1.00 32.20 H new ATOM 0 HB2 ALA A 409 22.001 7.746 -26.794 1.00 32.20 H new ATOM 0 HB3 ALA A 409 23.149 8.939 -26.143 1.00 32.20 H new ATOM 836 N ASN A 410 25.388 5.996 -24.406 1.00 15.23 N ATOM 837 CA ASN A 410 26.760 5.907 -23.959 1.00 44.33 C ATOM 838 C ASN A 410 27.152 4.457 -23.873 1.00 52.00 C ATOM 839 O ASN A 410 28.199 4.054 -24.369 1.00 50.22 O ATOM 840 CB ASN A 410 26.922 6.584 -22.580 1.00 62.11 C ATOM 841 CG ASN A 410 28.355 6.558 -22.066 1.00 70.30 C ATOM 842 OD1 ASN A 410 28.770 5.630 -21.361 1.00 44.12 O ATOM 843 ND2 ASN A 410 29.116 7.564 -22.416 1.00 52.12 N ATOM 0 H ASN A 410 24.826 5.178 -24.172 1.00 15.23 H new ATOM 0 HA ASN A 410 27.407 6.421 -24.669 1.00 44.33 H new ATOM 0 HB2 ASN A 410 26.586 7.619 -22.648 1.00 62.11 H new ATOM 0 HB3 ASN A 410 26.275 6.085 -21.859 1.00 62.11 H new ATOM 0 HD21 ASN A 410 30.087 7.601 -22.106 1.00 52.12 H new ATOM 0 HD22 ASN A 410 28.738 8.311 -22.999 1.00 52.12 H new ATOM 850 N GLY A 411 26.298 3.686 -23.251 1.00 4.13 N ATOM 851 CA GLY A 411 26.515 2.272 -23.101 1.00 64.40 C ATOM 852 C GLY A 411 25.510 1.697 -22.136 1.00 12.13 C ATOM 853 O GLY A 411 24.487 1.139 -22.559 1.00 11.33 O ATOM 0 H GLY A 411 25.430 4.023 -22.833 1.00 4.13 H new ATOM 0 HA2 GLY A 411 26.427 1.777 -24.068 1.00 64.40 H new ATOM 0 HA3 GLY A 411 27.526 2.087 -22.739 1.00 64.40 H new ATOM 857 N PRO A 412 25.736 1.842 -20.828 1.00 53.13 N ATOM 858 CA PRO A 412 24.803 1.379 -19.821 1.00 64.24 C ATOM 859 C PRO A 412 23.662 2.374 -19.625 1.00 70.33 C ATOM 860 O PRO A 412 23.453 3.282 -20.438 1.00 51.23 O ATOM 861 CB PRO A 412 25.649 1.291 -18.536 1.00 22.34 C ATOM 862 CG PRO A 412 27.036 1.713 -18.918 1.00 4.03 C ATOM 863 CD PRO A 412 26.921 2.453 -20.215 1.00 24.34 C ATOM 0 HA PRO A 412 24.341 0.431 -20.098 1.00 64.24 H new ATOM 0 HB2 PRO A 412 25.245 1.940 -17.759 1.00 22.34 H new ATOM 0 HB3 PRO A 412 25.647 0.277 -18.137 1.00 22.34 H new ATOM 0 HG2 PRO A 412 27.473 2.349 -18.148 1.00 4.03 H new ATOM 0 HG3 PRO A 412 27.688 0.846 -19.024 1.00 4.03 H new ATOM 0 HD2 PRO A 412 26.791 3.524 -20.060 1.00 24.34 H new ATOM 0 HD3 PRO A 412 27.809 2.326 -20.834 1.00 24.34 H new ATOM 871 N HIS A 413 22.927 2.201 -18.566 1.00 31.14 N ATOM 872 CA HIS A 413 21.833 3.086 -18.254 1.00 32.32 C ATOM 873 C HIS A 413 22.327 4.248 -17.423 1.00 1.05 C ATOM 874 O HIS A 413 23.440 4.213 -16.891 1.00 44.21 O ATOM 875 CB HIS A 413 20.696 2.344 -17.538 1.00 20.11 C ATOM 876 CG HIS A 413 19.988 1.329 -18.389 1.00 11.44 C ATOM 877 ND1 HIS A 413 18.641 1.391 -18.677 1.00 41.31 N ATOM 878 CD2 HIS A 413 20.446 0.208 -18.995 1.00 70.33 C ATOM 879 CE1 HIS A 413 18.309 0.357 -19.424 1.00 54.32 C ATOM 880 NE2 HIS A 413 19.386 -0.373 -19.630 1.00 31.54 N ATOM 0 H HIS A 413 23.065 1.447 -17.894 1.00 31.14 H new ATOM 0 HA HIS A 413 21.429 3.471 -19.190 1.00 32.32 H new ATOM 0 HB2 HIS A 413 21.101 1.844 -16.658 1.00 20.11 H new ATOM 0 HB3 HIS A 413 19.969 3.074 -17.183 1.00 20.11 H new ATOM 0 HD1 HIS A 413 18.003 2.121 -18.362 1.00 41.31 H new ATOM 0 HD2 HIS A 413 21.462 -0.159 -18.979 1.00 70.33 H new ATOM 0 HE1 HIS A 413 17.320 0.144 -19.803 1.00 54.32 H new ATOM 889 N ARG A 414 21.518 5.259 -17.320 1.00 52.33 N ATOM 890 CA ARG A 414 21.861 6.466 -16.605 1.00 60.03 C ATOM 891 C ARG A 414 21.760 6.206 -15.095 1.00 3.22 C ATOM 892 O ARG A 414 21.096 5.232 -14.662 1.00 12.31 O ATOM 893 CB ARG A 414 20.881 7.545 -17.054 1.00 42.44 C ATOM 894 CG ARG A 414 21.222 8.965 -16.708 1.00 24.21 C ATOM 895 CD ARG A 414 20.187 9.910 -17.313 1.00 32.03 C ATOM 896 NE ARG A 414 20.001 9.669 -18.759 1.00 1.02 N ATOM 897 CZ ARG A 414 20.076 10.598 -19.725 1.00 54.32 C ATOM 898 NH1 ARG A 414 20.517 11.814 -19.462 1.00 53.44 N ATOM 899 NH2 ARG A 414 19.746 10.283 -20.968 1.00 53.23 N ATOM 0 H ARG A 414 20.586 5.276 -17.734 1.00 52.33 H new ATOM 0 HA ARG A 414 22.881 6.787 -16.814 1.00 60.03 H new ATOM 0 HB2 ARG A 414 20.775 7.477 -18.137 1.00 42.44 H new ATOM 0 HB3 ARG A 414 19.906 7.317 -16.624 1.00 42.44 H new ATOM 0 HG2 ARG A 414 21.250 9.088 -15.625 1.00 24.21 H new ATOM 0 HG3 ARG A 414 22.215 9.211 -17.083 1.00 24.21 H new ATOM 0 HD2 ARG A 414 19.235 9.783 -16.798 1.00 32.03 H new ATOM 0 HD3 ARG A 414 20.500 10.942 -17.154 1.00 32.03 H new ATOM 0 HE ARG A 414 19.798 8.712 -19.049 1.00 1.02 H new ATOM 0 HH11 ARG A 414 20.806 12.058 -18.515 1.00 53.44 H new ATOM 0 HH12 ARG A 414 20.569 12.510 -20.206 1.00 53.44 H new ATOM 0 HH21 ARG A 414 19.436 9.337 -21.189 1.00 53.23 H new ATOM 0 HH22 ARG A 414 19.802 10.987 -21.704 1.00 53.23 H new ATOM 913 N SER A 415 22.413 7.025 -14.309 1.00 51.31 N ATOM 914 CA SER A 415 22.405 6.883 -12.881 1.00 60.22 C ATOM 915 C SER A 415 22.636 8.216 -12.184 1.00 63.31 C ATOM 916 O SER A 415 23.031 9.196 -12.811 1.00 33.22 O ATOM 917 CB SER A 415 23.413 5.800 -12.463 1.00 0.14 C ATOM 918 OG SER A 415 24.684 5.972 -13.065 1.00 63.23 O ATOM 0 H SER A 415 22.967 7.812 -14.647 1.00 51.31 H new ATOM 0 HA SER A 415 21.417 6.554 -12.559 1.00 60.22 H new ATOM 0 HB2 SER A 415 23.525 5.813 -11.379 1.00 0.14 H new ATOM 0 HB3 SER A 415 23.019 4.820 -12.731 1.00 0.14 H new ATOM 0 HG SER A 415 25.383 5.879 -12.385 1.00 63.23 H new ATOM 924 N ALA A 416 22.354 8.256 -10.908 1.00 44.11 N ATOM 925 CA ALA A 416 22.495 9.445 -10.122 1.00 55.12 C ATOM 926 C ALA A 416 22.965 9.073 -8.750 1.00 64.14 C ATOM 927 O ALA A 416 22.523 8.068 -8.185 1.00 32.33 O ATOM 928 CB ALA A 416 21.170 10.176 -10.025 1.00 75.22 C ATOM 0 H ALA A 416 22.016 7.450 -10.382 1.00 44.11 H new ATOM 0 HA ALA A 416 23.222 10.103 -10.598 1.00 55.12 H new ATOM 0 HB1 ALA A 416 21.295 11.077 -9.424 1.00 75.22 H new ATOM 0 HB2 ALA A 416 20.832 10.450 -11.024 1.00 75.22 H new ATOM 0 HB3 ALA A 416 20.430 9.527 -9.556 1.00 75.22 H new ATOM 934 N ILE A 417 23.844 9.844 -8.227 1.00 3.12 N ATOM 935 CA ILE A 417 24.366 9.612 -6.921 1.00 61.33 C ATOM 936 C ILE A 417 24.167 10.873 -6.088 1.00 20.33 C ATOM 937 O ILE A 417 24.687 11.938 -6.415 1.00 24.30 O ATOM 938 CB ILE A 417 25.872 9.184 -6.985 1.00 24.41 C ATOM 939 CG1 ILE A 417 26.454 8.902 -5.603 1.00 74.34 C ATOM 940 CG2 ILE A 417 26.719 10.185 -7.730 1.00 21.22 C ATOM 941 CD1 ILE A 417 25.814 7.739 -4.889 1.00 52.03 C ATOM 0 H ILE A 417 24.230 10.665 -8.694 1.00 3.12 H new ATOM 0 HA ILE A 417 23.832 8.787 -6.449 1.00 61.33 H new ATOM 0 HB ILE A 417 25.894 8.250 -7.547 1.00 24.41 H new ATOM 0 HG12 ILE A 417 27.522 8.709 -5.703 1.00 74.34 H new ATOM 0 HG13 ILE A 417 26.348 9.795 -4.987 1.00 74.34 H new ATOM 0 HG21 ILE A 417 27.754 9.844 -7.747 1.00 21.22 H new ATOM 0 HG22 ILE A 417 26.352 10.283 -8.752 1.00 21.22 H new ATOM 0 HG23 ILE A 417 26.664 11.152 -7.230 1.00 21.22 H new ATOM 0 HD11 ILE A 417 26.285 7.606 -3.915 1.00 52.03 H new ATOM 0 HD12 ILE A 417 24.750 7.936 -4.754 1.00 52.03 H new ATOM 0 HD13 ILE A 417 25.943 6.833 -5.481 1.00 52.03 H new ATOM 953 N VAL A 418 23.401 10.771 -5.045 1.00 5.30 N ATOM 954 CA VAL A 418 23.117 11.924 -4.249 1.00 42.53 C ATOM 955 C VAL A 418 24.080 11.967 -3.096 1.00 61.40 C ATOM 956 O VAL A 418 24.018 11.141 -2.183 1.00 22.12 O ATOM 957 CB VAL A 418 21.639 11.936 -3.748 1.00 23.54 C ATOM 958 CG1 VAL A 418 21.353 13.126 -2.844 1.00 73.04 C ATOM 959 CG2 VAL A 418 20.676 11.961 -4.912 1.00 14.01 C ATOM 0 H VAL A 418 22.964 9.906 -4.727 1.00 5.30 H new ATOM 0 HA VAL A 418 23.242 12.815 -4.864 1.00 42.53 H new ATOM 0 HB VAL A 418 21.498 11.021 -3.173 1.00 23.54 H new ATOM 0 HG11 VAL A 418 20.313 13.094 -2.519 1.00 73.04 H new ATOM 0 HG12 VAL A 418 22.007 13.087 -1.973 1.00 73.04 H new ATOM 0 HG13 VAL A 418 21.534 14.051 -3.392 1.00 73.04 H new ATOM 0 HG21 VAL A 418 19.652 11.969 -4.537 1.00 14.01 H new ATOM 0 HG22 VAL A 418 20.851 12.856 -5.510 1.00 14.01 H new ATOM 0 HG23 VAL A 418 20.829 11.076 -5.530 1.00 14.01 H new ATOM 969 N THR A 419 24.968 12.912 -3.151 1.00 4.03 N ATOM 970 CA THR A 419 25.949 13.091 -2.153 1.00 60.41 C ATOM 971 C THR A 419 25.470 14.202 -1.245 1.00 23.33 C ATOM 972 O THR A 419 25.333 15.362 -1.665 1.00 14.24 O ATOM 973 CB THR A 419 27.280 13.485 -2.805 1.00 65.42 C ATOM 974 OG1 THR A 419 27.568 12.548 -3.857 1.00 21.00 O ATOM 975 CG2 THR A 419 28.406 13.434 -1.787 1.00 45.03 C ATOM 0 H THR A 419 25.023 13.589 -3.912 1.00 4.03 H new ATOM 0 HA THR A 419 26.102 12.172 -1.587 1.00 60.41 H new ATOM 0 HB THR A 419 27.201 14.499 -3.197 1.00 65.42 H new ATOM 0 HG1 THR A 419 28.416 12.788 -4.285 1.00 21.00 H new ATOM 0 HG21 THR A 419 29.343 13.716 -2.267 1.00 45.03 H new ATOM 0 HG22 THR A 419 28.192 14.126 -0.973 1.00 45.03 H new ATOM 0 HG23 THR A 419 28.492 12.423 -1.390 1.00 45.03 H new ATOM 983 N VAL A 420 25.196 13.859 -0.031 1.00 60.41 N ATOM 984 CA VAL A 420 24.635 14.788 0.885 1.00 63.54 C ATOM 985 C VAL A 420 25.631 15.101 1.979 1.00 34.13 C ATOM 986 O VAL A 420 26.285 14.204 2.502 1.00 51.42 O ATOM 987 CB VAL A 420 23.321 14.251 1.506 1.00 3.45 C ATOM 988 CG1 VAL A 420 22.634 15.318 2.314 1.00 52.12 C ATOM 989 CG2 VAL A 420 22.388 13.713 0.444 1.00 20.11 C ATOM 0 H VAL A 420 25.355 12.927 0.352 1.00 60.41 H new ATOM 0 HA VAL A 420 24.399 15.699 0.335 1.00 63.54 H new ATOM 0 HB VAL A 420 23.586 13.429 2.171 1.00 3.45 H new ATOM 0 HG11 VAL A 420 21.714 14.917 2.739 1.00 52.12 H new ATOM 0 HG12 VAL A 420 23.293 15.646 3.118 1.00 52.12 H new ATOM 0 HG13 VAL A 420 22.397 16.165 1.671 1.00 52.12 H new ATOM 0 HG21 VAL A 420 21.476 13.344 0.914 1.00 20.11 H new ATOM 0 HG22 VAL A 420 22.139 14.509 -0.258 1.00 20.11 H new ATOM 0 HG23 VAL A 420 22.876 12.898 -0.090 1.00 20.11 H new ATOM 999 N GLU A 421 25.768 16.362 2.293 1.00 11.33 N ATOM 1000 CA GLU A 421 26.665 16.799 3.358 1.00 71.04 C ATOM 1001 C GLU A 421 25.844 17.195 4.578 1.00 73.00 C ATOM 1002 O GLU A 421 26.382 17.480 5.640 1.00 31.10 O ATOM 1003 CB GLU A 421 27.472 18.013 2.885 1.00 63.14 C ATOM 1004 CG GLU A 421 26.600 19.198 2.475 1.00 23.04 C ATOM 1005 CD GLU A 421 27.391 20.416 2.090 1.00 42.13 C ATOM 1006 OE1 GLU A 421 27.791 21.179 2.988 1.00 54.11 O ATOM 1007 OE2 GLU A 421 27.631 20.622 0.892 1.00 73.13 O ATOM 0 H GLU A 421 25.269 17.120 1.828 1.00 11.33 H new ATOM 0 HA GLU A 421 27.343 15.985 3.615 1.00 71.04 H new ATOM 0 HB2 GLU A 421 28.145 18.326 3.683 1.00 63.14 H new ATOM 0 HB3 GLU A 421 28.094 17.719 2.040 1.00 63.14 H new ATOM 0 HG2 GLU A 421 25.970 18.903 1.636 1.00 23.04 H new ATOM 0 HG3 GLU A 421 25.934 19.452 3.300 1.00 23.04 H new ATOM 1014 N CYS A 422 24.523 17.196 4.388 1.00 11.24 N ATOM 1015 CA CYS A 422 23.546 17.600 5.397 1.00 23.44 C ATOM 1016 C CYS A 422 23.627 19.117 5.651 1.00 23.35 C ATOM 1017 O CYS A 422 24.648 19.753 5.390 1.00 71.20 O ATOM 1018 CB CYS A 422 23.672 16.776 6.703 1.00 54.04 C ATOM 1019 SG CYS A 422 22.422 17.190 7.964 1.00 22.41 S ATOM 0 H CYS A 422 24.095 16.909 3.508 1.00 11.24 H new ATOM 0 HA CYS A 422 22.553 17.381 5.004 1.00 23.44 H new ATOM 0 HB2 CYS A 422 23.592 15.716 6.461 1.00 54.04 H new ATOM 0 HB3 CYS A 422 24.665 16.933 7.125 1.00 54.04 H new ATOM 1024 N GLY A 423 22.556 19.698 6.101 1.00 34.50 N ATOM 1025 CA GLY A 423 22.549 21.118 6.312 1.00 0.41 C ATOM 1026 C GLY A 423 21.395 21.545 7.148 1.00 62.04 C ATOM 1027 O GLY A 423 20.855 20.748 7.907 1.00 60.24 O ATOM 0 H GLY A 423 21.684 19.220 6.328 1.00 34.50 H new ATOM 0 HA2 GLY A 423 23.479 21.419 6.795 1.00 0.41 H new ATOM 0 HA3 GLY A 423 22.510 21.629 5.350 1.00 0.41 H new ATOM 1031 N VAL A 424 21.024 22.793 7.028 1.00 33.13 N ATOM 1032 CA VAL A 424 19.897 23.338 7.766 1.00 32.32 C ATOM 1033 C VAL A 424 18.676 23.366 6.843 1.00 75.01 C ATOM 1034 O VAL A 424 17.530 23.385 7.280 1.00 70.04 O ATOM 1035 CB VAL A 424 20.211 24.780 8.275 1.00 73.13 C ATOM 1036 CG1 VAL A 424 19.070 25.339 9.117 1.00 43.23 C ATOM 1037 CG2 VAL A 424 21.515 24.802 9.063 1.00 33.54 C ATOM 0 H VAL A 424 21.489 23.466 6.419 1.00 33.13 H new ATOM 0 HA VAL A 424 19.699 22.710 8.635 1.00 32.32 H new ATOM 0 HB VAL A 424 20.322 25.419 7.399 1.00 73.13 H new ATOM 0 HG11 VAL A 424 19.325 26.344 9.454 1.00 43.23 H new ATOM 0 HG12 VAL A 424 18.160 25.377 8.518 1.00 43.23 H new ATOM 0 HG13 VAL A 424 18.908 24.697 9.983 1.00 43.23 H new ATOM 0 HG21 VAL A 424 21.714 25.816 9.408 1.00 33.54 H new ATOM 0 HG22 VAL A 424 21.432 24.136 9.922 1.00 33.54 H new ATOM 0 HG23 VAL A 424 22.332 24.469 8.423 1.00 33.54 H new ATOM 1047 N GLU A 425 18.950 23.326 5.569 1.00 41.30 N ATOM 1048 CA GLU A 425 17.962 23.401 4.541 1.00 0.21 C ATOM 1049 C GLU A 425 18.311 22.413 3.444 1.00 41.41 C ATOM 1050 O GLU A 425 19.455 21.955 3.367 1.00 54.31 O ATOM 1051 CB GLU A 425 17.910 24.833 3.949 1.00 35.54 C ATOM 1052 CG GLU A 425 19.216 25.330 3.268 1.00 4.33 C ATOM 1053 CD GLU A 425 20.400 25.539 4.218 1.00 63.34 C ATOM 1054 OE1 GLU A 425 21.118 24.562 4.536 1.00 44.22 O ATOM 1055 OE2 GLU A 425 20.639 26.689 4.635 1.00 62.14 O ATOM 0 H GLU A 425 19.901 23.237 5.211 1.00 41.30 H new ATOM 0 HA GLU A 425 16.987 23.160 4.964 1.00 0.21 H new ATOM 0 HB2 GLU A 425 17.103 24.875 3.218 1.00 35.54 H new ATOM 0 HB3 GLU A 425 17.652 25.527 4.749 1.00 35.54 H new ATOM 0 HG2 GLU A 425 19.506 24.610 2.503 1.00 4.33 H new ATOM 0 HG3 GLU A 425 19.007 26.271 2.758 1.00 4.33 H new ATOM 1062 N ASN A 426 17.336 22.056 2.630 1.00 64.32 N ATOM 1063 CA ASN A 426 17.603 21.198 1.491 1.00 53.45 C ATOM 1064 C ASN A 426 17.671 22.019 0.235 1.00 71.42 C ATOM 1065 O ASN A 426 16.840 22.904 0.020 1.00 61.14 O ATOM 1066 CB ASN A 426 16.582 20.042 1.318 1.00 32.03 C ATOM 1067 CG ASN A 426 15.156 20.483 1.040 1.00 4.52 C ATOM 1068 OD1 ASN A 426 14.760 20.705 -0.111 1.00 11.14 O ATOM 1069 ND2 ASN A 426 14.366 20.559 2.059 1.00 43.02 N ATOM 0 H ASN A 426 16.363 22.343 2.734 1.00 64.32 H new ATOM 0 HA ASN A 426 18.564 20.724 1.687 1.00 53.45 H new ATOM 0 HB2 ASN A 426 16.915 19.403 0.500 1.00 32.03 H new ATOM 0 HB3 ASN A 426 16.589 19.433 2.222 1.00 32.03 H new ATOM 0 HD21 ASN A 426 13.386 20.808 1.927 1.00 43.02 H new ATOM 0 HD22 ASN A 426 14.722 20.370 2.996 1.00 43.02 H new ATOM 1076 N GLU A 427 18.664 21.751 -0.574 1.00 51.45 N ATOM 1077 CA GLU A 427 18.841 22.431 -1.833 1.00 64.31 C ATOM 1078 C GLU A 427 19.865 21.683 -2.661 1.00 25.45 C ATOM 1079 O GLU A 427 20.804 21.083 -2.108 1.00 54.40 O ATOM 1080 CB GLU A 427 19.274 23.898 -1.615 1.00 52.23 C ATOM 1081 CG GLU A 427 19.389 24.718 -2.894 1.00 12.34 C ATOM 1082 CD GLU A 427 19.706 26.160 -2.620 1.00 12.11 C ATOM 1083 OE1 GLU A 427 18.761 26.950 -2.404 1.00 13.00 O ATOM 1084 OE2 GLU A 427 20.890 26.529 -2.600 1.00 52.51 O ATOM 0 H GLU A 427 19.378 21.050 -0.377 1.00 51.45 H new ATOM 0 HA GLU A 427 17.890 22.449 -2.366 1.00 64.31 H new ATOM 0 HB2 GLU A 427 18.556 24.381 -0.952 1.00 52.23 H new ATOM 0 HB3 GLU A 427 20.237 23.908 -1.104 1.00 52.23 H new ATOM 0 HG2 GLU A 427 20.167 24.291 -3.528 1.00 12.34 H new ATOM 0 HG3 GLU A 427 18.454 24.653 -3.450 1.00 12.34 H new ATOM 1091 N ILE A 428 19.656 21.662 -3.957 1.00 21.14 N ATOM 1092 CA ILE A 428 20.588 21.051 -4.870 1.00 22.42 C ATOM 1093 C ILE A 428 21.617 22.093 -5.241 1.00 53.33 C ATOM 1094 O ILE A 428 21.293 23.097 -5.872 1.00 34.51 O ATOM 1095 CB ILE A 428 19.881 20.557 -6.151 1.00 31.43 C ATOM 1096 CG1 ILE A 428 18.719 19.629 -5.790 1.00 30.13 C ATOM 1097 CG2 ILE A 428 20.875 19.846 -7.070 1.00 51.22 C ATOM 1098 CD1 ILE A 428 17.872 19.204 -6.963 1.00 44.44 C ATOM 0 H ILE A 428 18.835 22.068 -4.406 1.00 21.14 H new ATOM 0 HA ILE A 428 21.049 20.188 -4.390 1.00 22.42 H new ATOM 0 HB ILE A 428 19.481 21.420 -6.684 1.00 31.43 H new ATOM 0 HG12 ILE A 428 19.119 18.739 -5.305 1.00 30.13 H new ATOM 0 HG13 ILE A 428 18.083 20.131 -5.061 1.00 30.13 H new ATOM 0 HG21 ILE A 428 20.360 19.504 -7.968 1.00 51.22 H new ATOM 0 HG22 ILE A 428 21.671 20.537 -7.349 1.00 51.22 H new ATOM 0 HG23 ILE A 428 21.303 18.990 -6.549 1.00 51.22 H new ATOM 0 HD11 ILE A 428 17.073 18.549 -6.616 1.00 44.44 H new ATOM 0 HD12 ILE A 428 17.439 20.085 -7.437 1.00 44.44 H new ATOM 0 HD13 ILE A 428 18.491 18.671 -7.685 1.00 44.44 H new ATOM 1110 N VAL A 429 22.836 21.863 -4.845 1.00 54.14 N ATOM 1111 CA VAL A 429 23.891 22.808 -5.087 1.00 13.11 C ATOM 1112 C VAL A 429 24.340 22.694 -6.530 1.00 32.34 C ATOM 1113 O VAL A 429 24.220 23.641 -7.314 1.00 72.21 O ATOM 1114 CB VAL A 429 25.104 22.557 -4.144 1.00 14.20 C ATOM 1115 CG1 VAL A 429 26.190 23.607 -4.352 1.00 64.20 C ATOM 1116 CG2 VAL A 429 24.663 22.516 -2.684 1.00 72.23 C ATOM 0 H VAL A 429 23.127 21.021 -4.348 1.00 54.14 H new ATOM 0 HA VAL A 429 23.509 23.809 -4.888 1.00 13.11 H new ATOM 0 HB VAL A 429 25.525 21.584 -4.398 1.00 14.20 H new ATOM 0 HG11 VAL A 429 27.024 23.406 -3.680 1.00 64.20 H new ATOM 0 HG12 VAL A 429 26.539 23.570 -5.384 1.00 64.20 H new ATOM 0 HG13 VAL A 429 25.785 24.597 -4.141 1.00 64.20 H new ATOM 0 HG21 VAL A 429 25.530 22.339 -2.047 1.00 72.23 H new ATOM 0 HG22 VAL A 429 24.203 23.467 -2.416 1.00 72.23 H new ATOM 0 HG23 VAL A 429 23.940 21.712 -2.545 1.00 72.23 H new ATOM 1126 N SER A 430 24.820 21.532 -6.894 1.00 33.34 N ATOM 1127 CA SER A 430 25.300 21.300 -8.228 1.00 40.13 C ATOM 1128 C SER A 430 25.079 19.850 -8.626 1.00 53.00 C ATOM 1129 O SER A 430 24.905 18.978 -7.762 1.00 53.31 O ATOM 1130 CB SER A 430 26.794 21.655 -8.315 1.00 53.31 C ATOM 1131 OG SER A 430 27.012 23.019 -7.970 1.00 62.33 O ATOM 0 H SER A 430 24.888 20.724 -6.275 1.00 33.34 H new ATOM 0 HA SER A 430 24.744 21.935 -8.918 1.00 40.13 H new ATOM 0 HB2 SER A 430 27.365 21.011 -7.646 1.00 53.31 H new ATOM 0 HB3 SER A 430 27.158 21.468 -9.325 1.00 53.31 H new ATOM 0 HG SER A 430 27.969 23.223 -8.030 1.00 62.33 H new ATOM 1137 N VAL A 431 25.044 19.613 -9.921 1.00 63.10 N ATOM 1138 CA VAL A 431 24.933 18.286 -10.480 1.00 73.35 C ATOM 1139 C VAL A 431 25.982 18.186 -11.565 1.00 42.34 C ATOM 1140 O VAL A 431 26.103 19.101 -12.381 1.00 25.22 O ATOM 1141 CB VAL A 431 23.531 18.014 -11.107 1.00 73.25 C ATOM 1142 CG1 VAL A 431 23.456 16.595 -11.641 1.00 22.12 C ATOM 1143 CG2 VAL A 431 22.417 18.253 -10.097 1.00 71.13 C ATOM 0 H VAL A 431 25.093 20.350 -10.624 1.00 63.10 H new ATOM 0 HA VAL A 431 25.072 17.551 -9.687 1.00 73.35 H new ATOM 0 HB VAL A 431 23.395 18.712 -11.933 1.00 73.25 H new ATOM 0 HG11 VAL A 431 22.471 16.421 -12.075 1.00 22.12 H new ATOM 0 HG12 VAL A 431 24.220 16.453 -12.405 1.00 22.12 H new ATOM 0 HG13 VAL A 431 23.623 15.890 -10.826 1.00 22.12 H new ATOM 0 HG21 VAL A 431 21.453 18.055 -10.565 1.00 71.13 H new ATOM 0 HG22 VAL A 431 22.550 17.587 -9.244 1.00 71.13 H new ATOM 0 HG23 VAL A 431 22.450 19.288 -9.758 1.00 71.13 H new ATOM 1153 N LEU A 432 26.752 17.131 -11.568 1.00 30.11 N ATOM 1154 CA LEU A 432 27.810 16.995 -12.545 1.00 14.43 C ATOM 1155 C LEU A 432 27.843 15.593 -13.134 1.00 41.31 C ATOM 1156 O LEU A 432 27.807 14.604 -12.403 1.00 5.21 O ATOM 1157 CB LEU A 432 29.164 17.325 -11.891 1.00 41.32 C ATOM 1158 CG LEU A 432 30.401 17.259 -12.798 1.00 3.33 C ATOM 1159 CD1 LEU A 432 30.322 18.292 -13.912 1.00 12.13 C ATOM 1160 CD2 LEU A 432 31.670 17.436 -11.982 1.00 32.14 C ATOM 0 H LEU A 432 26.671 16.355 -10.911 1.00 30.11 H new ATOM 0 HA LEU A 432 27.616 17.695 -13.358 1.00 14.43 H new ATOM 0 HB2 LEU A 432 29.103 18.329 -11.470 1.00 41.32 H new ATOM 0 HB3 LEU A 432 29.316 16.639 -11.058 1.00 41.32 H new ATOM 0 HG LEU A 432 30.427 16.274 -13.263 1.00 3.33 H new ATOM 0 HD11 LEU A 432 31.212 18.221 -14.538 1.00 12.13 H new ATOM 0 HD12 LEU A 432 29.436 18.106 -14.519 1.00 12.13 H new ATOM 0 HD13 LEU A 432 30.262 19.290 -13.479 1.00 12.13 H new ATOM 0 HD21 LEU A 432 32.536 17.386 -12.641 1.00 32.14 H new ATOM 0 HD22 LEU A 432 31.649 18.405 -11.482 1.00 32.14 H new ATOM 0 HD23 LEU A 432 31.736 16.644 -11.236 1.00 32.14 H new ATOM 1172 N GLU A 433 27.893 15.514 -14.445 1.00 54.34 N ATOM 1173 CA GLU A 433 28.040 14.247 -15.127 1.00 61.44 C ATOM 1174 C GLU A 433 29.545 14.011 -15.286 1.00 64.12 C ATOM 1175 O GLU A 433 30.170 14.588 -16.164 1.00 70.23 O ATOM 1176 CB GLU A 433 27.347 14.308 -16.514 1.00 41.15 C ATOM 1177 CG GLU A 433 27.321 12.991 -17.294 1.00 1.25 C ATOM 1178 CD GLU A 433 26.720 13.146 -18.687 1.00 73.50 C ATOM 1179 OE1 GLU A 433 25.481 13.295 -18.817 1.00 64.41 O ATOM 1180 OE2 GLU A 433 27.483 13.145 -19.678 1.00 3.04 O ATOM 0 H GLU A 433 27.833 16.321 -15.066 1.00 54.34 H new ATOM 0 HA GLU A 433 27.577 13.435 -14.566 1.00 61.44 H new ATOM 0 HB2 GLU A 433 26.321 14.648 -16.374 1.00 41.15 H new ATOM 0 HB3 GLU A 433 27.852 15.060 -17.121 1.00 41.15 H new ATOM 0 HG2 GLU A 433 28.337 12.605 -17.381 1.00 1.25 H new ATOM 0 HG3 GLU A 433 26.746 12.253 -16.734 1.00 1.25 H new ATOM 1187 N ALA A 434 30.134 13.225 -14.403 1.00 30.42 N ATOM 1188 CA ALA A 434 31.589 13.046 -14.422 1.00 2.51 C ATOM 1189 C ALA A 434 31.935 11.590 -14.484 1.00 44.10 C ATOM 1190 O ALA A 434 33.100 11.199 -14.458 1.00 23.41 O ATOM 1191 CB ALA A 434 32.215 13.686 -13.196 1.00 54.11 C ATOM 0 H ALA A 434 29.645 12.706 -13.673 1.00 30.42 H new ATOM 0 HA ALA A 434 31.987 13.535 -15.311 1.00 2.51 H new ATOM 0 HB1 ALA A 434 33.296 13.545 -13.224 1.00 54.11 H new ATOM 0 HB2 ALA A 434 31.988 14.752 -13.186 1.00 54.11 H new ATOM 0 HB3 ALA A 434 31.811 13.221 -12.297 1.00 54.11 H new ATOM 1197 N GLN A 435 30.926 10.808 -14.576 1.00 1.05 N ATOM 1198 CA GLN A 435 31.021 9.403 -14.640 1.00 42.42 C ATOM 1199 C GLN A 435 29.983 8.993 -15.666 1.00 45.21 C ATOM 1200 O GLN A 435 29.161 9.830 -15.999 1.00 23.54 O ATOM 1201 CB GLN A 435 30.691 8.836 -13.262 1.00 20.50 C ATOM 1202 CG GLN A 435 30.842 7.352 -13.168 1.00 42.21 C ATOM 1203 CD GLN A 435 30.399 6.767 -11.842 1.00 10.30 C ATOM 1204 OE1 GLN A 435 29.953 5.626 -11.788 1.00 61.34 O ATOM 1205 NE2 GLN A 435 30.526 7.515 -10.777 1.00 72.32 N ATOM 0 H GLN A 435 29.965 11.149 -14.610 1.00 1.05 H new ATOM 0 HA GLN A 435 32.011 9.040 -14.918 1.00 42.42 H new ATOM 0 HB2 GLN A 435 31.339 9.305 -12.522 1.00 20.50 H new ATOM 0 HB3 GLN A 435 29.666 9.105 -13.005 1.00 20.50 H new ATOM 0 HG2 GLN A 435 30.266 6.888 -13.968 1.00 42.21 H new ATOM 0 HG3 GLN A 435 31.887 7.093 -13.336 1.00 42.21 H new ATOM 0 HE21 GLN A 435 30.901 8.460 -10.859 1.00 72.32 H new ATOM 0 HE22 GLN A 435 30.250 7.153 -9.864 1.00 72.32 H new ATOM 1214 N LYS A 436 30.028 7.735 -16.152 1.00 0.43 N ATOM 1215 CA LYS A 436 29.114 7.185 -17.210 1.00 13.23 C ATOM 1216 C LYS A 436 27.616 7.572 -17.108 1.00 45.24 C ATOM 1217 O LYS A 436 26.775 6.768 -16.721 1.00 31.13 O ATOM 1218 CB LYS A 436 29.314 5.651 -17.419 1.00 52.00 C ATOM 1219 CG LYS A 436 29.422 4.767 -16.127 1.00 33.24 C ATOM 1220 CD LYS A 436 28.221 4.887 -15.184 1.00 61.42 C ATOM 1221 CE LYS A 436 28.296 3.918 -14.023 1.00 42.11 C ATOM 1222 NZ LYS A 436 28.222 2.512 -14.465 1.00 63.42 N ATOM 0 H LYS A 436 30.708 7.050 -15.823 1.00 0.43 H new ATOM 0 HA LYS A 436 29.439 7.705 -18.111 1.00 13.23 H new ATOM 0 HB2 LYS A 436 28.482 5.279 -18.016 1.00 52.00 H new ATOM 0 HB3 LYS A 436 30.220 5.504 -18.007 1.00 52.00 H new ATOM 0 HG2 LYS A 436 29.536 3.724 -16.422 1.00 33.24 H new ATOM 0 HG3 LYS A 436 30.325 5.045 -15.584 1.00 33.24 H new ATOM 0 HD2 LYS A 436 28.165 5.906 -14.800 1.00 61.42 H new ATOM 0 HD3 LYS A 436 27.304 4.707 -15.745 1.00 61.42 H new ATOM 0 HE2 LYS A 436 29.227 4.077 -13.478 1.00 42.11 H new ATOM 0 HE3 LYS A 436 27.481 4.122 -13.328 1.00 42.11 H new ATOM 0 HZ1 LYS A 436 28.039 1.899 -13.645 1.00 63.42 H new ATOM 0 HZ2 LYS A 436 27.452 2.405 -15.156 1.00 63.42 H new ATOM 0 HZ3 LYS A 436 29.123 2.239 -14.906 1.00 63.42 H new ATOM 1236 N CYS A 437 27.306 8.815 -17.463 1.00 4.34 N ATOM 1237 CA CYS A 437 25.964 9.356 -17.340 1.00 71.44 C ATOM 1238 C CYS A 437 25.454 9.246 -15.911 1.00 62.11 C ATOM 1239 O CYS A 437 24.248 9.212 -15.665 1.00 62.23 O ATOM 1240 CB CYS A 437 25.029 8.705 -18.333 1.00 33.12 C ATOM 1241 SG CYS A 437 25.446 9.100 -20.057 1.00 5.31 S ATOM 0 H CYS A 437 27.984 9.475 -17.845 1.00 4.34 H new ATOM 0 HA CYS A 437 26.000 10.419 -17.580 1.00 71.44 H new ATOM 0 HB2 CYS A 437 25.056 7.624 -18.196 1.00 33.12 H new ATOM 0 HB3 CYS A 437 24.008 9.027 -18.128 1.00 33.12 H new ATOM 1246 N GLU A 438 26.386 9.224 -14.968 1.00 42.34 N ATOM 1247 CA GLU A 438 26.037 9.214 -13.595 1.00 34.11 C ATOM 1248 C GLU A 438 26.183 10.607 -13.077 1.00 34.22 C ATOM 1249 O GLU A 438 27.269 11.216 -13.156 1.00 1.41 O ATOM 1250 CB GLU A 438 26.849 8.205 -12.776 1.00 43.24 C ATOM 1251 CG GLU A 438 26.376 8.129 -11.318 1.00 63.50 C ATOM 1252 CD GLU A 438 26.935 6.963 -10.546 1.00 63.20 C ATOM 1253 OE1 GLU A 438 26.459 5.827 -10.773 1.00 31.40 O ATOM 1254 OE2 GLU A 438 27.809 7.157 -9.668 1.00 5.30 O ATOM 0 H GLU A 438 27.389 9.213 -15.153 1.00 42.34 H new ATOM 0 HA GLU A 438 25.004 8.881 -13.491 1.00 34.11 H new ATOM 0 HB2 GLU A 438 26.769 7.219 -13.234 1.00 43.24 H new ATOM 0 HB3 GLU A 438 27.903 8.483 -12.801 1.00 43.24 H new ATOM 0 HG2 GLU A 438 26.653 9.053 -10.810 1.00 63.50 H new ATOM 0 HG3 GLU A 438 25.288 8.071 -11.304 1.00 63.50 H new ATOM 1261 N TYR A 439 25.109 11.116 -12.582 1.00 53.11 N ATOM 1262 CA TYR A 439 25.036 12.469 -12.163 1.00 23.11 C ATOM 1263 C TYR A 439 25.316 12.603 -10.698 1.00 54.12 C ATOM 1264 O TYR A 439 24.584 12.074 -9.851 1.00 11.50 O ATOM 1265 CB TYR A 439 23.676 13.063 -12.545 1.00 31.25 C ATOM 1266 CG TYR A 439 23.468 13.105 -14.033 1.00 61.00 C ATOM 1267 CD1 TYR A 439 22.936 12.021 -14.695 1.00 10.23 C ATOM 1268 CD2 TYR A 439 23.822 14.215 -14.778 1.00 21.25 C ATOM 1269 CE1 TYR A 439 22.758 12.036 -16.051 1.00 4.32 C ATOM 1270 CE2 TYR A 439 23.642 14.233 -16.146 1.00 74.42 C ATOM 1271 CZ TYR A 439 23.110 13.131 -16.770 1.00 54.14 C ATOM 1272 OH TYR A 439 22.921 13.131 -18.123 1.00 2.31 O ATOM 0 H TYR A 439 24.242 10.593 -12.455 1.00 53.11 H new ATOM 0 HA TYR A 439 25.809 13.037 -12.680 1.00 23.11 H new ATOM 0 HB2 TYR A 439 22.883 12.473 -12.086 1.00 31.25 H new ATOM 0 HB3 TYR A 439 23.597 14.072 -12.141 1.00 31.25 H new ATOM 0 HD1 TYR A 439 22.654 11.143 -14.133 1.00 10.23 H new ATOM 0 HD2 TYR A 439 24.244 15.077 -14.284 1.00 21.25 H new ATOM 0 HE1 TYR A 439 22.337 11.175 -16.550 1.00 4.32 H new ATOM 0 HE2 TYR A 439 23.917 15.105 -16.721 1.00 74.42 H new ATOM 0 HH TYR A 439 23.758 12.886 -18.570 1.00 2.31 H new ATOM 1282 N LEU A 440 26.398 13.284 -10.415 1.00 62.42 N ATOM 1283 CA LEU A 440 26.831 13.555 -9.069 1.00 64.01 C ATOM 1284 C LEU A 440 25.964 14.680 -8.539 1.00 12.32 C ATOM 1285 O LEU A 440 26.068 15.819 -9.016 1.00 64.33 O ATOM 1286 CB LEU A 440 28.300 14.032 -9.064 1.00 21.33 C ATOM 1287 CG LEU A 440 29.353 13.149 -9.760 1.00 45.24 C ATOM 1288 CD1 LEU A 440 30.719 13.803 -9.673 1.00 40.13 C ATOM 1289 CD2 LEU A 440 29.404 11.764 -9.154 1.00 23.04 C ATOM 0 H LEU A 440 27.014 13.673 -11.129 1.00 62.42 H new ATOM 0 HA LEU A 440 26.749 12.654 -8.461 1.00 64.01 H new ATOM 0 HB2 LEU A 440 28.332 15.018 -9.529 1.00 21.33 H new ATOM 0 HB3 LEU A 440 28.606 14.159 -8.025 1.00 21.33 H new ATOM 0 HG LEU A 440 29.065 13.047 -10.806 1.00 45.24 H new ATOM 0 HD11 LEU A 440 31.457 13.171 -10.168 1.00 40.13 H new ATOM 0 HD12 LEU A 440 30.688 14.777 -10.162 1.00 40.13 H new ATOM 0 HD13 LEU A 440 30.995 13.932 -8.626 1.00 40.13 H new ATOM 0 HD21 LEU A 440 30.158 11.169 -9.670 1.00 23.04 H new ATOM 0 HD22 LEU A 440 29.661 11.838 -8.097 1.00 23.04 H new ATOM 0 HD23 LEU A 440 28.430 11.285 -9.258 1.00 23.04 H new ATOM 1301 N ILE A 441 25.104 14.382 -7.615 1.00 33.44 N ATOM 1302 CA ILE A 441 24.212 15.378 -7.085 1.00 75.35 C ATOM 1303 C ILE A 441 24.748 15.831 -5.743 1.00 4.30 C ATOM 1304 O ILE A 441 24.990 15.012 -4.863 1.00 62.42 O ATOM 1305 CB ILE A 441 22.772 14.817 -6.903 1.00 23.34 C ATOM 1306 CG1 ILE A 441 22.347 14.055 -8.169 1.00 3.24 C ATOM 1307 CG2 ILE A 441 21.796 15.959 -6.609 1.00 10.02 C ATOM 1308 CD1 ILE A 441 20.935 13.527 -8.155 1.00 64.23 C ATOM 0 H ILE A 441 24.997 13.453 -7.207 1.00 33.44 H new ATOM 0 HA ILE A 441 24.158 16.211 -7.786 1.00 75.35 H new ATOM 0 HB ILE A 441 22.759 14.128 -6.059 1.00 23.34 H new ATOM 0 HG12 ILE A 441 22.462 14.716 -9.028 1.00 3.24 H new ATOM 0 HG13 ILE A 441 23.030 13.218 -8.317 1.00 3.24 H new ATOM 0 HG21 ILE A 441 20.791 15.556 -6.483 1.00 10.02 H new ATOM 0 HG22 ILE A 441 22.099 16.470 -5.695 1.00 10.02 H new ATOM 0 HG23 ILE A 441 21.802 16.666 -7.439 1.00 10.02 H new ATOM 0 HD11 ILE A 441 20.732 13.006 -9.091 1.00 64.23 H new ATOM 0 HD12 ILE A 441 20.813 12.836 -7.321 1.00 64.23 H new ATOM 0 HD13 ILE A 441 20.237 14.357 -8.043 1.00 64.23 H new ATOM 1320 N LYS A 442 24.939 17.107 -5.590 1.00 42.02 N ATOM 1321 CA LYS A 442 25.485 17.643 -4.369 1.00 63.21 C ATOM 1322 C LYS A 442 24.350 18.320 -3.611 1.00 23.13 C ATOM 1323 O LYS A 442 23.758 19.287 -4.113 1.00 30.00 O ATOM 1324 CB LYS A 442 26.554 18.682 -4.725 1.00 2.44 C ATOM 1325 CG LYS A 442 27.860 18.589 -3.942 1.00 73.31 C ATOM 1326 CD LYS A 442 27.687 18.716 -2.441 1.00 73.33 C ATOM 1327 CE LYS A 442 29.048 18.684 -1.772 1.00 25.51 C ATOM 1328 NZ LYS A 442 28.971 18.746 -0.309 1.00 14.14 N ATOM 0 H LYS A 442 24.724 17.806 -6.301 1.00 42.02 H new ATOM 0 HA LYS A 442 25.932 16.857 -3.759 1.00 63.21 H new ATOM 0 HB2 LYS A 442 26.782 18.591 -5.787 1.00 2.44 H new ATOM 0 HB3 LYS A 442 26.132 19.676 -4.574 1.00 2.44 H new ATOM 0 HG2 LYS A 442 28.338 17.635 -4.163 1.00 73.31 H new ATOM 0 HG3 LYS A 442 28.536 19.371 -4.287 1.00 73.31 H new ATOM 0 HD2 LYS A 442 27.173 19.647 -2.201 1.00 73.33 H new ATOM 0 HD3 LYS A 442 27.066 17.903 -2.065 1.00 73.33 H new ATOM 0 HE2 LYS A 442 29.569 17.772 -2.064 1.00 25.51 H new ATOM 0 HE3 LYS A 442 29.644 19.521 -2.134 1.00 25.51 H new ATOM 0 HZ1 LYS A 442 29.796 19.260 0.061 1.00 14.14 H new ATOM 0 HZ2 LYS A 442 28.100 19.241 -0.028 1.00 14.14 H new ATOM 0 HZ3 LYS A 442 28.962 17.781 0.079 1.00 14.14 H new ATOM 1342 N MET A 443 24.029 17.819 -2.433 1.00 70.20 N ATOM 1343 CA MET A 443 22.933 18.351 -1.661 1.00 2.14 C ATOM 1344 C MET A 443 23.236 18.387 -0.206 1.00 20.44 C ATOM 1345 O MET A 443 24.258 17.871 0.272 1.00 72.42 O ATOM 1346 CB MET A 443 21.636 17.541 -1.825 1.00 10.21 C ATOM 1347 CG MET A 443 20.938 17.653 -3.150 1.00 43.41 C ATOM 1348 SD MET A 443 19.352 16.795 -3.149 1.00 11.42 S ATOM 1349 CE MET A 443 18.502 17.647 -1.806 1.00 2.22 C ATOM 0 H MET A 443 24.518 17.040 -1.992 1.00 70.20 H new ATOM 0 HA MET A 443 22.794 19.359 -2.051 1.00 2.14 H new ATOM 0 HB2 MET A 443 21.866 16.490 -1.648 1.00 10.21 H new ATOM 0 HB3 MET A 443 20.940 17.851 -1.046 1.00 10.21 H new ATOM 0 HG2 MET A 443 20.782 18.705 -3.390 1.00 43.41 H new ATOM 0 HG3 MET A 443 21.574 17.239 -3.932 1.00 43.41 H new ATOM 0 HE1 MET A 443 17.430 17.468 -1.882 1.00 2.22 H new ATOM 0 HE2 MET A 443 18.865 17.272 -0.849 1.00 2.22 H new ATOM 0 HE3 MET A 443 18.696 18.717 -1.873 1.00 2.22 H new ATOM 1359 N LYS A 444 22.329 18.976 0.489 1.00 31.05 N ATOM 1360 CA LYS A 444 22.322 19.045 1.887 1.00 33.43 C ATOM 1361 C LYS A 444 20.893 19.196 2.305 1.00 72.15 C ATOM 1362 O LYS A 444 20.083 19.683 1.520 1.00 71.20 O ATOM 1363 CB LYS A 444 23.180 20.202 2.388 1.00 51.04 C ATOM 1364 CG LYS A 444 22.766 21.579 1.944 1.00 33.05 C ATOM 1365 CD LYS A 444 23.817 22.550 2.384 1.00 51.52 C ATOM 1366 CE LYS A 444 23.378 23.996 2.206 1.00 44.24 C ATOM 1367 NZ LYS A 444 24.422 24.943 2.663 1.00 43.23 N ATOM 0 H LYS A 444 21.531 19.446 0.062 1.00 31.05 H new ATOM 0 HA LYS A 444 22.753 18.143 2.322 1.00 33.43 H new ATOM 0 HB2 LYS A 444 23.182 20.180 3.478 1.00 51.04 H new ATOM 0 HB3 LYS A 444 24.207 20.032 2.064 1.00 51.04 H new ATOM 0 HG2 LYS A 444 22.650 21.610 0.861 1.00 33.05 H new ATOM 0 HG3 LYS A 444 21.800 21.843 2.376 1.00 33.05 H new ATOM 0 HD2 LYS A 444 24.057 22.372 3.432 1.00 51.52 H new ATOM 0 HD3 LYS A 444 24.730 22.377 1.814 1.00 51.52 H new ATOM 0 HE2 LYS A 444 23.152 24.182 1.156 1.00 44.24 H new ATOM 0 HE3 LYS A 444 22.459 24.169 2.765 1.00 44.24 H new ATOM 0 HZ1 LYS A 444 24.089 25.919 2.527 1.00 43.23 H new ATOM 0 HZ2 LYS A 444 24.620 24.782 3.671 1.00 43.23 H new ATOM 0 HZ3 LYS A 444 25.291 24.794 2.112 1.00 43.23 H new ATOM 1381 N SER A 445 20.579 18.725 3.478 1.00 40.24 N ATOM 1382 CA SER A 445 19.259 18.803 4.040 1.00 71.53 C ATOM 1383 C SER A 445 19.365 18.487 5.522 1.00 74.22 C ATOM 1384 O SER A 445 20.251 17.722 5.911 1.00 22.40 O ATOM 1385 CB SER A 445 18.325 17.802 3.327 1.00 63.42 C ATOM 1386 OG SER A 445 18.867 16.493 3.329 1.00 22.35 O ATOM 0 H SER A 445 21.253 18.263 4.088 1.00 40.24 H new ATOM 0 HA SER A 445 18.839 19.800 3.906 1.00 71.53 H new ATOM 0 HB2 SER A 445 17.353 17.795 3.820 1.00 63.42 H new ATOM 0 HB3 SER A 445 18.159 18.126 2.300 1.00 63.42 H new ATOM 0 HG SER A 445 18.251 15.883 2.872 1.00 22.35 H new ATOM 1392 N PRO A 446 18.522 19.084 6.376 1.00 21.44 N ATOM 1393 CA PRO A 446 18.542 18.819 7.823 1.00 33.14 C ATOM 1394 C PRO A 446 18.125 17.388 8.143 1.00 33.31 C ATOM 1395 O PRO A 446 18.592 16.795 9.114 1.00 22.13 O ATOM 1396 CB PRO A 446 17.514 19.809 8.386 1.00 74.25 C ATOM 1397 CG PRO A 446 16.626 20.122 7.235 1.00 1.54 C ATOM 1398 CD PRO A 446 17.505 20.086 6.024 1.00 34.31 C ATOM 0 HA PRO A 446 19.539 18.937 8.247 1.00 33.14 H new ATOM 0 HB2 PRO A 446 16.953 19.371 9.212 1.00 74.25 H new ATOM 0 HB3 PRO A 446 17.998 20.707 8.770 1.00 74.25 H new ATOM 0 HG2 PRO A 446 15.818 19.394 7.154 1.00 1.54 H new ATOM 0 HG3 PRO A 446 16.162 21.101 7.353 1.00 1.54 H new ATOM 0 HD2 PRO A 446 16.949 19.799 5.131 1.00 34.31 H new ATOM 0 HD3 PRO A 446 17.952 21.059 5.822 1.00 34.31 H new ATOM 1406 N ALA A 447 17.287 16.828 7.285 1.00 1.03 N ATOM 1407 CA ALA A 447 16.757 15.492 7.475 1.00 62.52 C ATOM 1408 C ALA A 447 17.769 14.416 7.078 1.00 3.14 C ATOM 1409 O ALA A 447 17.568 13.224 7.349 1.00 75.12 O ATOM 1410 CB ALA A 447 15.464 15.325 6.689 1.00 23.15 C ATOM 0 H ALA A 447 16.956 17.289 6.437 1.00 1.03 H new ATOM 0 HA ALA A 447 16.549 15.365 8.537 1.00 62.52 H new ATOM 0 HB1 ALA A 447 15.075 14.318 6.839 1.00 23.15 H new ATOM 0 HB2 ALA A 447 14.731 16.053 7.036 1.00 23.15 H new ATOM 0 HB3 ALA A 447 15.660 15.484 5.629 1.00 23.15 H new ATOM 1416 N ALA A 448 18.848 14.833 6.439 1.00 72.21 N ATOM 1417 CA ALA A 448 19.869 13.908 5.994 1.00 22.14 C ATOM 1418 C ALA A 448 20.735 13.454 7.137 1.00 34.03 C ATOM 1419 O ALA A 448 21.218 12.326 7.133 1.00 64.53 O ATOM 1420 CB ALA A 448 20.714 14.524 4.927 1.00 34.01 C ATOM 0 H ALA A 448 19.038 15.810 6.217 1.00 72.21 H new ATOM 0 HA ALA A 448 19.361 13.035 5.583 1.00 22.14 H new ATOM 0 HB1 ALA A 448 21.474 13.811 4.608 1.00 34.01 H new ATOM 0 HB2 ALA A 448 20.088 14.792 4.076 1.00 34.01 H new ATOM 0 HB3 ALA A 448 21.198 15.419 5.317 1.00 34.01 H new ATOM 1426 N CYS A 449 20.960 14.339 8.092 1.00 32.34 N ATOM 1427 CA CYS A 449 21.717 13.990 9.283 1.00 15.51 C ATOM 1428 C CYS A 449 21.035 12.867 10.067 1.00 21.10 C ATOM 1429 O CYS A 449 19.953 13.054 10.644 1.00 1.41 O ATOM 1430 CB CYS A 449 21.936 15.205 10.203 1.00 54.33 C ATOM 1431 SG CYS A 449 23.184 16.406 9.644 1.00 13.53 S ATOM 0 H CYS A 449 20.630 15.304 8.067 1.00 32.34 H new ATOM 0 HA CYS A 449 22.691 13.641 8.940 1.00 15.51 H new ATOM 0 HB2 CYS A 449 20.985 15.725 10.319 1.00 54.33 H new ATOM 0 HB3 CYS A 449 22.224 14.843 11.190 1.00 54.33 H new ATOM 1436 N SER A 450 21.632 11.713 10.054 1.00 65.22 N ATOM 1437 CA SER A 450 21.137 10.601 10.794 1.00 71.01 C ATOM 1438 C SER A 450 22.308 9.816 11.323 1.00 71.14 C ATOM 1439 O SER A 450 22.879 9.017 10.557 1.00 37.38 O ATOM 1440 CB SER A 450 20.201 9.722 9.936 1.00 41.44 C ATOM 1441 OG SER A 450 20.878 9.182 8.802 1.00 75.04 O ATOM 1442 OXT SER A 450 22.678 10.014 12.493 1.00 37.38 O ATOM 0 H SER A 450 22.482 11.520 9.524 1.00 65.22 H new ATOM 0 HA SER A 450 20.537 10.959 11.631 1.00 71.01 H new ATOM 0 HB2 SER A 450 19.805 8.909 10.545 1.00 41.44 H new ATOM 0 HB3 SER A 450 19.349 10.315 9.603 1.00 41.44 H new ATOM 0 HG SER A 450 21.802 8.966 9.045 1.00 75.04 H new TER 1448 SER A 450