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 401 LYS NZ :NH3+ 159:sc= 1.11 (180deg=0.768) USER MOD Set 1.2: A 415 SER OG : rot -129:sc= -1.2! USER MOD Set 2.1: A 379 TYR OH : rot -144:sc= 0.0142 USER MOD Set 2.2: A 395 GLN : amide:sc= 0.0139 K(o=0.028,f=-0.56) USER MOD Set 3.1: A 374 TYR OH : rot 61:sc= -0.535 USER MOD Set 3.2: A 384 GLN : amide:sc= -0.37 X(o=-0.91,f=-0.62) USER MOD Set 4.1: A 381 ASN : amide:sc= 0.0191 K(o=-1.3,f=-3.2!) USER MOD Set 4.2: A 391 ASN : amide:sc= -1.28! K(o=-1.3!,f=-3.2) USER MOD Set 5.1: A 365 THR OG1 : rot 150:sc= 0.187 USER MOD Set 5.2: A 426 ASN : amide:sc= 0.912 K(o=1.1,f=0.15) USER MOD Set 6.1: A 357 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 363 MET CE :methyl -165:sc= -0.161 (180deg=-0.566) USER MOD Single : A 361 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0256) 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 -62:sc= 0.505 USER MOD Single : A 375 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 386 SER OG : rot 90:sc= 1.28 USER MOD Single : A 394 SER OG : rot 180:sc= -0.115 USER MOD Single : A 398 ASN : amide:sc= -1.91 K(o=-1.9,f=-6!) USER MOD Single : A 402 TYR OH : rot -165:sc= 0.879 USER MOD Single : A 404 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 406 GLN : amide:sc= -0.126 K(o=-0.13,f=-1.9) USER MOD Single : A 407 SER OG : rot 180:sc= 0 USER MOD Single : A 410 ASN : amide:sc= 0 X(o=0,f=-0.004) USER MOD Single : A 413 HIS : no HE2:sc= 0.0965 K(o=0.097,f=-0.45) USER MOD Single : A 419 THR OG1 : rot 180:sc= 0 USER MOD Single : A 430 SER OG : rot 180:sc= -0.0236 USER MOD Single : A 435 GLN : amide:sc= -0.132 X(o=-0.13,f=0) USER MOD Single : A 436 LYS NZ :NH3+ 177:sc= 1.15 (180deg=1.02) USER MOD Single : A 439 TYR OH : rot 180:sc= 0 USER MOD Single : A 442 LYS NZ :NH3+ -152:sc= 1.2 (180deg=0.677) USER MOD Single : A 443 MET CE :methyl 156:sc= -0.529 (180deg=-1.85!) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 SER OG : rot 180:sc= -0.0837 USER MOD Single : A 450 SER OG : rot -11:sc= 1.23 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 357 6.725 4.371 -4.019 1.00 35.21 N ATOM 2 CA TYR A 357 7.076 5.087 -2.806 1.00 31.23 C ATOM 3 C TYR A 357 7.492 4.102 -1.753 1.00 25.31 C ATOM 4 O TYR A 357 6.659 3.504 -1.068 1.00 24.05 O ATOM 5 CB TYR A 357 5.939 6.009 -2.344 1.00 45.13 C ATOM 6 CG TYR A 357 5.554 7.042 -3.396 1.00 55.35 C ATOM 7 CD1 TYR A 357 6.376 8.131 -3.662 1.00 10.42 C ATOM 8 CD2 TYR A 357 4.386 6.914 -4.135 1.00 60.45 C ATOM 9 CE1 TYR A 357 6.040 9.062 -4.627 1.00 21.21 C ATOM 10 CE2 TYR A 357 4.046 7.838 -5.103 1.00 53.23 C ATOM 11 CZ TYR A 357 4.874 8.909 -5.344 1.00 74.23 C ATOM 12 OH TYR A 357 4.536 9.829 -6.314 1.00 24.01 O ATOM 0 HA TYR A 357 7.922 5.745 -3.006 1.00 31.23 H new ATOM 0 HB2 TYR A 357 5.066 5.406 -2.097 1.00 45.13 H new ATOM 0 HB3 TYR A 357 6.241 6.522 -1.431 1.00 45.13 H new ATOM 0 HD1 TYR A 357 7.293 8.252 -3.105 1.00 10.42 H new ATOM 0 HD2 TYR A 357 3.731 6.076 -3.949 1.00 60.45 H new ATOM 0 HE1 TYR A 357 6.688 9.905 -4.818 1.00 21.21 H new ATOM 0 HE2 TYR A 357 3.133 7.720 -5.669 1.00 53.23 H new ATOM 0 HH TYR A 357 3.684 9.573 -6.725 1.00 24.01 H new ATOM 24 N ARG A 358 8.781 3.888 -1.670 1.00 60.04 N ATOM 25 CA ARG A 358 9.326 2.888 -0.787 1.00 34.44 C ATOM 26 C ARG A 358 9.666 3.436 0.606 1.00 31.12 C ATOM 27 O ARG A 358 10.766 3.935 0.852 1.00 54.53 O ATOM 28 CB ARG A 358 10.508 2.156 -1.458 1.00 1.23 C ATOM 29 CG ARG A 358 11.710 3.035 -1.802 1.00 62.25 C ATOM 30 CD ARG A 358 12.703 2.285 -2.662 1.00 33.42 C ATOM 31 NE ARG A 358 12.158 2.035 -4.003 1.00 23.23 N ATOM 32 CZ ARG A 358 12.524 1.052 -4.825 1.00 51.13 C ATOM 33 NH1 ARG A 358 13.408 0.132 -4.434 1.00 51.42 N ATOM 34 NH2 ARG A 358 11.991 0.987 -6.037 1.00 62.32 N ATOM 0 H ARG A 358 9.479 4.399 -2.210 1.00 60.04 H new ATOM 0 HA ARG A 358 8.545 2.149 -0.608 1.00 34.44 H new ATOM 0 HB2 ARG A 358 10.841 1.356 -0.797 1.00 1.23 H new ATOM 0 HB3 ARG A 358 10.150 1.685 -2.373 1.00 1.23 H new ATOM 0 HG2 ARG A 358 11.373 3.929 -2.326 1.00 62.25 H new ATOM 0 HG3 ARG A 358 12.196 3.367 -0.885 1.00 62.25 H new ATOM 0 HD2 ARG A 358 13.626 2.859 -2.742 1.00 33.42 H new ATOM 0 HD3 ARG A 358 12.958 1.338 -2.187 1.00 33.42 H new ATOM 0 HE ARG A 358 11.434 2.672 -4.335 1.00 23.23 H new ATOM 0 HH11 ARG A 358 13.811 0.177 -3.498 1.00 51.42 H new ATOM 0 HH12 ARG A 358 13.681 -0.616 -5.071 1.00 51.42 H new ATOM 0 HH21 ARG A 358 11.308 1.685 -6.332 1.00 62.32 H new ATOM 0 HH22 ARG A 358 12.264 0.239 -6.675 1.00 62.32 H new ATOM 48 N ALA A 359 8.671 3.369 1.492 1.00 10.24 N ATOM 49 CA ALA A 359 8.761 3.790 2.901 1.00 42.21 C ATOM 50 C ALA A 359 8.965 5.291 3.064 1.00 11.34 C ATOM 51 O ALA A 359 8.039 6.018 3.446 1.00 14.01 O ATOM 52 CB ALA A 359 9.825 3.000 3.661 1.00 55.30 C ATOM 0 H ALA A 359 7.749 3.010 1.246 1.00 10.24 H new ATOM 0 HA ALA A 359 7.792 3.560 3.344 1.00 42.21 H new ATOM 0 HB1 ALA A 359 9.861 3.340 4.696 1.00 55.30 H new ATOM 0 HB2 ALA A 359 9.577 1.939 3.636 1.00 55.30 H new ATOM 0 HB3 ALA A 359 10.797 3.157 3.194 1.00 55.30 H new ATOM 58 N ILE A 360 10.138 5.754 2.746 1.00 11.00 N ATOM 59 CA ILE A 360 10.481 7.137 2.903 1.00 73.55 C ATOM 60 C ILE A 360 10.396 7.810 1.554 1.00 55.34 C ATOM 61 O ILE A 360 11.135 7.469 0.642 1.00 65.12 O ATOM 62 CB ILE A 360 11.936 7.285 3.434 1.00 31.13 C ATOM 63 CG1 ILE A 360 12.119 6.499 4.740 1.00 1.14 C ATOM 64 CG2 ILE A 360 12.279 8.763 3.650 1.00 0.11 C ATOM 65 CD1 ILE A 360 13.538 6.517 5.276 1.00 12.13 C ATOM 0 H ILE A 360 10.890 5.178 2.367 1.00 11.00 H new ATOM 0 HA ILE A 360 9.793 7.593 3.615 1.00 73.55 H new ATOM 0 HB ILE A 360 12.616 6.875 2.687 1.00 31.13 H new ATOM 0 HG12 ILE A 360 11.450 6.910 5.496 1.00 1.14 H new ATOM 0 HG13 ILE A 360 11.817 5.465 4.575 1.00 1.14 H new ATOM 0 HG21 ILE A 360 13.300 8.849 4.022 1.00 0.11 H new ATOM 0 HG22 ILE A 360 12.190 9.299 2.705 1.00 0.11 H new ATOM 0 HG23 ILE A 360 11.591 9.194 4.377 1.00 0.11 H new ATOM 0 HD11 ILE A 360 13.585 5.940 6.200 1.00 12.13 H new ATOM 0 HD12 ILE A 360 14.211 6.078 4.539 1.00 12.13 H new ATOM 0 HD13 ILE A 360 13.839 7.546 5.475 1.00 12.13 H new ATOM 77 N LYS A 361 9.496 8.736 1.415 1.00 14.31 N ATOM 78 CA LYS A 361 9.397 9.463 0.193 1.00 70.44 C ATOM 79 C LYS A 361 9.520 10.944 0.469 1.00 33.41 C ATOM 80 O LYS A 361 8.902 11.466 1.405 1.00 70.14 O ATOM 81 CB LYS A 361 8.137 9.047 -0.646 1.00 70.24 C ATOM 82 CG LYS A 361 6.740 9.284 -0.027 1.00 22.35 C ATOM 83 CD LYS A 361 6.321 10.745 -0.086 1.00 20.43 C ATOM 84 CE LYS A 361 4.927 10.974 0.482 1.00 12.20 C ATOM 85 NZ LYS A 361 4.836 10.676 1.932 1.00 73.30 N ATOM 0 H LYS A 361 8.822 9.003 2.133 1.00 14.31 H new ATOM 0 HA LYS A 361 10.233 9.200 -0.455 1.00 70.44 H new ATOM 0 HB2 LYS A 361 8.177 9.582 -1.595 1.00 70.24 H new ATOM 0 HB3 LYS A 361 8.225 7.985 -0.875 1.00 70.24 H new ATOM 0 HG2 LYS A 361 6.004 8.676 -0.554 1.00 22.35 H new ATOM 0 HG3 LYS A 361 6.744 8.951 1.011 1.00 22.35 H new ATOM 0 HD2 LYS A 361 7.040 11.349 0.468 1.00 20.43 H new ATOM 0 HD3 LYS A 361 6.349 11.086 -1.121 1.00 20.43 H new ATOM 0 HE2 LYS A 361 4.637 12.011 0.311 1.00 12.20 H new ATOM 0 HE3 LYS A 361 4.214 10.350 -0.057 1.00 12.20 H new ATOM 0 HZ1 LYS A 361 3.889 10.930 2.280 1.00 73.30 H new ATOM 0 HZ2 LYS A 361 5.002 9.661 2.089 1.00 73.30 H new ATOM 0 HZ3 LYS A 361 5.553 11.227 2.445 1.00 73.30 H new ATOM 99 N GLY A 362 10.356 11.601 -0.269 1.00 31.42 N ATOM 100 CA GLY A 362 10.537 13.015 -0.069 1.00 55.35 C ATOM 101 C GLY A 362 9.762 13.825 -1.066 1.00 30.42 C ATOM 102 O GLY A 362 8.616 14.172 -0.820 1.00 24.33 O ATOM 0 H GLY A 362 10.923 11.192 -1.011 1.00 31.42 H new ATOM 0 HA2 GLY A 362 10.222 13.282 0.940 1.00 55.35 H new ATOM 0 HA3 GLY A 362 11.596 13.260 -0.147 1.00 55.35 H new ATOM 106 N MET A 363 10.386 14.084 -2.204 1.00 10.31 N ATOM 107 CA MET A 363 9.814 14.902 -3.285 1.00 60.42 C ATOM 108 C MET A 363 9.511 16.309 -2.797 1.00 63.12 C ATOM 109 O MET A 363 8.385 16.625 -2.389 1.00 10.44 O ATOM 110 CB MET A 363 8.568 14.243 -3.939 1.00 62.21 C ATOM 111 CG MET A 363 7.960 15.028 -5.099 1.00 20.03 C ATOM 112 SD MET A 363 6.523 14.199 -5.840 1.00 3.32 S ATOM 113 CE MET A 363 7.248 12.658 -6.414 1.00 64.43 C ATOM 0 H MET A 363 11.319 13.731 -2.415 1.00 10.31 H new ATOM 0 HA MET A 363 10.569 14.969 -4.068 1.00 60.42 H new ATOM 0 HB2 MET A 363 8.845 13.251 -4.296 1.00 62.21 H new ATOM 0 HB3 MET A 363 7.805 14.104 -3.174 1.00 62.21 H new ATOM 0 HG2 MET A 363 7.661 16.015 -4.746 1.00 20.03 H new ATOM 0 HG3 MET A 363 8.720 15.180 -5.865 1.00 20.03 H new ATOM 0 HE1 MET A 363 6.566 12.173 -7.112 1.00 64.43 H new ATOM 0 HE2 MET A 363 8.194 12.865 -6.915 1.00 64.43 H new ATOM 0 HE3 MET A 363 7.425 12.000 -5.563 1.00 64.43 H new ATOM 123 N GLU A 364 10.532 17.122 -2.768 1.00 13.24 N ATOM 124 CA GLU A 364 10.391 18.489 -2.334 1.00 62.11 C ATOM 125 C GLU A 364 11.461 19.326 -3.026 1.00 1.01 C ATOM 126 O GLU A 364 11.195 20.431 -3.477 1.00 72.14 O ATOM 127 CB GLU A 364 10.571 18.571 -0.783 1.00 34.30 C ATOM 128 CG GLU A 364 10.008 19.836 -0.070 1.00 31.31 C ATOM 129 CD GLU A 364 10.566 21.175 -0.537 1.00 61.11 C ATOM 130 OE1 GLU A 364 11.615 21.614 -0.024 1.00 50.22 O ATOM 131 OE2 GLU A 364 9.945 21.814 -1.410 1.00 10.34 O ATOM 0 H GLU A 364 11.479 16.860 -3.042 1.00 13.24 H new ATOM 0 HA GLU A 364 9.401 18.865 -2.591 1.00 62.11 H new ATOM 0 HB2 GLU A 364 10.098 17.694 -0.341 1.00 34.30 H new ATOM 0 HB3 GLU A 364 11.636 18.504 -0.562 1.00 34.30 H new ATOM 0 HG2 GLU A 364 8.926 19.851 -0.202 1.00 31.31 H new ATOM 0 HG3 GLU A 364 10.198 19.740 0.999 1.00 31.31 H new ATOM 138 N THR A 365 12.653 18.781 -3.180 1.00 12.41 N ATOM 139 CA THR A 365 13.728 19.597 -3.634 1.00 65.41 C ATOM 140 C THR A 365 13.834 19.581 -5.144 1.00 3.54 C ATOM 141 O THR A 365 13.930 18.510 -5.765 1.00 3.35 O ATOM 142 CB THR A 365 15.057 19.185 -3.006 1.00 25.12 C ATOM 143 OG1 THR A 365 14.869 18.980 -1.598 1.00 54.03 O ATOM 144 CG2 THR A 365 16.025 20.318 -3.153 1.00 74.00 C ATOM 0 H THR A 365 12.884 17.804 -3.000 1.00 12.41 H new ATOM 0 HA THR A 365 13.506 20.615 -3.315 1.00 65.41 H new ATOM 0 HB THR A 365 15.421 18.279 -3.490 1.00 25.12 H new ATOM 0 HG1 THR A 365 15.498 18.299 -1.280 1.00 54.03 H new ATOM 0 HG21 THR A 365 16.981 20.040 -2.709 1.00 74.00 H new ATOM 0 HG22 THR A 365 16.167 20.540 -4.211 1.00 74.00 H new ATOM 0 HG23 THR A 365 15.633 21.200 -2.647 1.00 74.00 H new ATOM 152 N LYS A 366 13.805 20.763 -5.719 1.00 51.03 N ATOM 153 CA LYS A 366 13.919 20.951 -7.125 1.00 71.11 C ATOM 154 C LYS A 366 14.921 22.001 -7.384 1.00 63.23 C ATOM 155 O LYS A 366 15.049 22.949 -6.608 1.00 34.21 O ATOM 156 CB LYS A 366 12.584 21.332 -7.763 1.00 32.41 C ATOM 157 CG LYS A 366 11.584 20.205 -7.784 1.00 43.33 C ATOM 158 CD LYS A 366 10.231 20.631 -8.345 1.00 53.32 C ATOM 159 CE LYS A 366 10.318 21.173 -9.759 1.00 42.23 C ATOM 160 NZ LYS A 366 8.980 21.514 -10.285 1.00 25.12 N ATOM 0 H LYS A 366 13.698 21.633 -5.198 1.00 51.03 H new ATOM 0 HA LYS A 366 14.231 20.008 -7.574 1.00 71.11 H new ATOM 0 HB2 LYS A 366 12.158 22.175 -7.219 1.00 32.41 H new ATOM 0 HB3 LYS A 366 12.762 21.669 -8.784 1.00 32.41 H new ATOM 0 HG2 LYS A 366 11.979 19.385 -8.383 1.00 43.33 H new ATOM 0 HG3 LYS A 366 11.450 19.825 -6.771 1.00 43.33 H new ATOM 0 HD2 LYS A 366 9.553 19.778 -8.330 1.00 53.32 H new ATOM 0 HD3 LYS A 366 9.799 21.393 -7.696 1.00 53.32 H new ATOM 0 HE2 LYS A 366 10.953 22.058 -9.773 1.00 42.23 H new ATOM 0 HE3 LYS A 366 10.788 20.433 -10.406 1.00 42.23 H new ATOM 0 HZ1 LYS A 366 9.071 21.882 -11.253 1.00 25.12 H new ATOM 0 HZ2 LYS A 366 8.383 20.663 -10.293 1.00 25.12 H new ATOM 0 HZ3 LYS A 366 8.543 22.238 -9.679 1.00 25.12 H new ATOM 174 N ARG A 367 15.644 21.832 -8.427 1.00 43.21 N ATOM 175 CA ARG A 367 16.634 22.775 -8.799 1.00 63.04 C ATOM 176 C ARG A 367 16.751 22.682 -10.289 1.00 63.33 C ATOM 177 O ARG A 367 16.820 21.584 -10.823 1.00 54.13 O ATOM 178 CB ARG A 367 17.966 22.383 -8.177 1.00 71.31 C ATOM 179 CG ARG A 367 18.997 23.484 -8.121 1.00 2.31 C ATOM 180 CD ARG A 367 18.626 24.475 -7.044 1.00 75.32 C ATOM 181 NE ARG A 367 19.613 25.553 -6.908 1.00 13.23 N ATOM 182 CZ ARG A 367 20.064 26.015 -5.728 1.00 22.02 C ATOM 183 NH1 ARG A 367 19.570 25.522 -4.591 1.00 64.13 N ATOM 184 NH2 ARG A 367 20.999 26.967 -5.690 1.00 70.10 N ATOM 0 H ARG A 367 15.566 21.030 -9.053 1.00 43.21 H new ATOM 0 HA ARG A 367 16.374 23.781 -8.469 1.00 63.04 H new ATOM 0 HB2 ARG A 367 17.784 22.025 -7.164 1.00 71.31 H new ATOM 0 HB3 ARG A 367 18.380 21.547 -8.741 1.00 71.31 H new ATOM 0 HG2 ARG A 367 19.982 23.063 -7.918 1.00 2.31 H new ATOM 0 HG3 ARG A 367 19.058 23.987 -9.086 1.00 2.31 H new ATOM 0 HD2 ARG A 367 17.651 24.906 -7.272 1.00 75.32 H new ATOM 0 HD3 ARG A 367 18.529 23.953 -6.092 1.00 75.32 H new ATOM 0 HE ARG A 367 19.979 25.978 -7.760 1.00 13.23 H new ATOM 0 HH11 ARG A 367 18.853 24.797 -4.618 1.00 64.13 H new ATOM 0 HH12 ARG A 367 19.910 25.870 -3.694 1.00 64.13 H new ATOM 0 HH21 ARG A 367 21.375 27.348 -6.558 1.00 70.10 H new ATOM 0 HH22 ARG A 367 21.338 27.314 -4.792 1.00 70.10 H new ATOM 198 N GLU A 368 16.758 23.764 -10.971 1.00 64.51 N ATOM 199 CA GLU A 368 16.853 23.681 -12.386 1.00 20.23 C ATOM 200 C GLU A 368 18.252 23.993 -12.828 1.00 10.21 C ATOM 201 O GLU A 368 18.749 25.113 -12.663 1.00 11.11 O ATOM 202 CB GLU A 368 15.810 24.542 -13.080 1.00 31.31 C ATOM 203 CG GLU A 368 15.808 24.389 -14.586 1.00 23.40 C ATOM 204 CD GLU A 368 14.682 25.131 -15.229 1.00 62.24 C ATOM 205 OE1 GLU A 368 14.843 26.329 -15.529 1.00 51.04 O ATOM 206 OE2 GLU A 368 13.617 24.523 -15.452 1.00 52.23 O ATOM 0 H GLU A 368 16.700 24.706 -10.585 1.00 64.51 H new ATOM 0 HA GLU A 368 16.632 22.657 -12.687 1.00 20.23 H new ATOM 0 HB2 GLU A 368 14.823 24.285 -12.695 1.00 31.31 H new ATOM 0 HB3 GLU A 368 15.988 25.588 -12.829 1.00 31.31 H new ATOM 0 HG2 GLU A 368 16.755 24.751 -14.987 1.00 23.40 H new ATOM 0 HG3 GLU A 368 15.737 23.332 -14.842 1.00 23.40 H new ATOM 213 N ILE A 369 18.899 22.994 -13.343 1.00 2.31 N ATOM 214 CA ILE A 369 20.246 23.113 -13.799 1.00 42.34 C ATOM 215 C ILE A 369 20.248 23.259 -15.307 1.00 23.01 C ATOM 216 O ILE A 369 19.753 22.380 -16.019 1.00 54.30 O ATOM 217 CB ILE A 369 21.134 21.890 -13.357 1.00 61.53 C ATOM 218 CG1 ILE A 369 21.346 21.837 -11.826 1.00 22.02 C ATOM 219 CG2 ILE A 369 22.464 21.853 -14.073 1.00 25.23 C ATOM 220 CD1 ILE A 369 20.148 21.398 -11.018 1.00 41.25 C ATOM 0 H ILE A 369 18.500 22.062 -13.459 1.00 2.31 H new ATOM 0 HA ILE A 369 20.685 23.999 -13.341 1.00 42.34 H new ATOM 0 HB ILE A 369 20.573 21.002 -13.648 1.00 61.53 H new ATOM 0 HG12 ILE A 369 22.173 21.159 -11.615 1.00 22.02 H new ATOM 0 HG13 ILE A 369 21.650 22.827 -11.484 1.00 22.02 H new ATOM 0 HG21 ILE A 369 23.037 20.991 -13.732 1.00 25.23 H new ATOM 0 HG22 ILE A 369 22.297 21.775 -15.147 1.00 25.23 H new ATOM 0 HG23 ILE A 369 23.019 22.766 -13.857 1.00 25.23 H new ATOM 0 HD11 ILE A 369 20.405 21.396 -9.959 1.00 41.25 H new ATOM 0 HD12 ILE A 369 19.321 22.087 -11.190 1.00 41.25 H new ATOM 0 HD13 ILE A 369 19.852 20.394 -11.322 1.00 41.25 H new ATOM 232 N GLY A 370 20.797 24.370 -15.780 1.00 2.40 N ATOM 233 CA GLY A 370 20.846 24.672 -17.193 1.00 51.51 C ATOM 234 C GLY A 370 19.471 24.818 -17.806 1.00 13.30 C ATOM 235 O GLY A 370 18.923 25.923 -17.875 1.00 63.40 O ATOM 0 H GLY A 370 21.220 25.085 -15.188 1.00 2.40 H new ATOM 0 HA2 GLY A 370 21.407 25.594 -17.344 1.00 51.51 H new ATOM 0 HA3 GLY A 370 21.388 23.881 -17.711 1.00 51.51 H new ATOM 239 N GLY A 371 18.919 23.720 -18.237 1.00 5.24 N ATOM 240 CA GLY A 371 17.613 23.714 -18.833 1.00 72.55 C ATOM 241 C GLY A 371 16.868 22.463 -18.472 1.00 15.22 C ATOM 242 O GLY A 371 15.893 22.088 -19.127 1.00 62.02 O ATOM 0 H GLY A 371 19.362 22.803 -18.185 1.00 5.24 H new ATOM 0 HA2 GLY A 371 17.052 24.586 -18.498 1.00 72.55 H new ATOM 0 HA3 GLY A 371 17.703 23.789 -19.917 1.00 72.55 H new ATOM 246 N TYR A 372 17.336 21.798 -17.447 1.00 54.33 N ATOM 247 CA TYR A 372 16.717 20.602 -16.974 1.00 2.32 C ATOM 248 C TYR A 372 16.418 20.688 -15.488 1.00 74.52 C ATOM 249 O TYR A 372 17.279 21.045 -14.682 1.00 44.31 O ATOM 250 CB TYR A 372 17.490 19.332 -17.394 1.00 74.21 C ATOM 251 CG TYR A 372 18.998 19.330 -17.139 1.00 24.22 C ATOM 252 CD1 TYR A 372 19.525 18.928 -15.929 1.00 54.50 C ATOM 253 CD2 TYR A 372 19.888 19.700 -18.143 1.00 23.33 C ATOM 254 CE1 TYR A 372 20.901 18.898 -15.716 1.00 73.43 C ATOM 255 CE2 TYR A 372 21.254 19.664 -17.940 1.00 5.45 C ATOM 256 CZ TYR A 372 21.752 19.263 -16.724 1.00 43.13 C ATOM 257 OH TYR A 372 23.114 19.206 -16.522 1.00 35.35 O ATOM 0 H TYR A 372 18.162 22.079 -16.919 1.00 54.33 H new ATOM 0 HA TYR A 372 15.750 20.507 -17.467 1.00 2.32 H new ATOM 0 HB2 TYR A 372 17.055 18.480 -16.871 1.00 74.21 H new ATOM 0 HB3 TYR A 372 17.325 19.170 -18.459 1.00 74.21 H new ATOM 0 HD1 TYR A 372 18.859 18.631 -15.133 1.00 54.50 H new ATOM 0 HD2 TYR A 372 19.503 20.022 -19.100 1.00 23.33 H new ATOM 0 HE1 TYR A 372 21.295 18.588 -14.759 1.00 73.43 H new ATOM 0 HE2 TYR A 372 21.928 19.950 -18.734 1.00 5.45 H new ATOM 0 HH TYR A 372 23.578 19.497 -17.335 1.00 35.35 H new ATOM 267 N THR A 373 15.204 20.370 -15.139 1.00 34.32 N ATOM 268 CA THR A 373 14.719 20.558 -13.802 1.00 13.21 C ATOM 269 C THR A 373 14.943 19.304 -12.972 1.00 44.55 C ATOM 270 O THR A 373 14.347 18.262 -13.233 1.00 43.23 O ATOM 271 CB THR A 373 13.215 20.874 -13.832 1.00 53.33 C ATOM 272 OG1 THR A 373 12.950 21.887 -14.836 1.00 41.54 O ATOM 273 CG2 THR A 373 12.743 21.372 -12.468 1.00 22.40 C ATOM 0 H THR A 373 14.518 19.970 -15.779 1.00 34.32 H new ATOM 0 HA THR A 373 15.265 21.388 -13.353 1.00 13.21 H new ATOM 0 HB THR A 373 12.673 19.961 -14.078 1.00 53.33 H new ATOM 0 HG1 THR A 373 13.426 22.711 -14.602 1.00 41.54 H new ATOM 0 HG21 THR A 373 11.676 21.590 -12.510 1.00 22.40 H new ATOM 0 HG22 THR A 373 12.927 20.604 -11.717 1.00 22.40 H new ATOM 0 HG23 THR A 373 13.288 22.278 -12.203 1.00 22.40 H new ATOM 281 N TYR A 374 15.759 19.418 -11.983 1.00 41.20 N ATOM 282 CA TYR A 374 16.081 18.323 -11.121 1.00 53.25 C ATOM 283 C TYR A 374 15.080 18.200 -10.017 1.00 35.44 C ATOM 284 O TYR A 374 14.761 19.177 -9.354 1.00 64.21 O ATOM 285 CB TYR A 374 17.487 18.507 -10.548 1.00 1.11 C ATOM 286 CG TYR A 374 18.513 17.675 -11.233 1.00 25.40 C ATOM 287 CD1 TYR A 374 18.880 17.922 -12.536 1.00 60.32 C ATOM 288 CD2 TYR A 374 19.095 16.603 -10.581 1.00 43.01 C ATOM 289 CE1 TYR A 374 19.795 17.125 -13.163 1.00 23.51 C ATOM 290 CE2 TYR A 374 20.008 15.805 -11.215 1.00 65.41 C ATOM 291 CZ TYR A 374 20.349 16.077 -12.507 1.00 2.12 C ATOM 292 OH TYR A 374 21.248 15.282 -13.154 1.00 50.42 O ATOM 0 H TYR A 374 16.233 20.289 -11.742 1.00 41.20 H new ATOM 0 HA TYR A 374 16.053 17.403 -11.705 1.00 53.25 H new ATOM 0 HB2 TYR A 374 17.769 19.557 -10.625 1.00 1.11 H new ATOM 0 HB3 TYR A 374 17.475 18.257 -9.487 1.00 1.11 H new ATOM 0 HD1 TYR A 374 18.441 18.753 -13.067 1.00 60.32 H new ATOM 0 HD2 TYR A 374 18.825 16.393 -9.557 1.00 43.01 H new ATOM 0 HE1 TYR A 374 20.078 17.331 -14.185 1.00 23.51 H new ATOM 0 HE2 TYR A 374 20.454 14.968 -10.698 1.00 65.41 H new ATOM 0 HH TYR A 374 22.025 15.817 -13.421 1.00 50.42 H new ATOM 302 N LYS A 375 14.569 17.006 -9.845 1.00 11.13 N ATOM 303 CA LYS A 375 13.627 16.724 -8.795 1.00 61.40 C ATOM 304 C LYS A 375 14.209 15.618 -7.971 1.00 50.54 C ATOM 305 O LYS A 375 14.510 14.549 -8.507 1.00 42.33 O ATOM 306 CB LYS A 375 12.308 16.201 -9.387 1.00 64.02 C ATOM 307 CG LYS A 375 11.206 15.965 -8.344 1.00 13.45 C ATOM 308 CD LYS A 375 10.036 15.140 -8.898 1.00 4.21 C ATOM 309 CE LYS A 375 9.471 15.723 -10.176 1.00 23.14 C ATOM 310 NZ LYS A 375 8.311 14.946 -10.677 1.00 3.44 N ATOM 0 H LYS A 375 14.796 16.202 -10.431 1.00 11.13 H new ATOM 0 HA LYS A 375 13.437 17.628 -8.217 1.00 61.40 H new ATOM 0 HB2 LYS A 375 11.946 16.914 -10.128 1.00 64.02 H new ATOM 0 HB3 LYS A 375 12.503 15.266 -9.913 1.00 64.02 H new ATOM 0 HG2 LYS A 375 11.631 15.452 -7.481 1.00 13.45 H new ATOM 0 HG3 LYS A 375 10.833 16.926 -7.991 1.00 13.45 H new ATOM 0 HD2 LYS A 375 10.371 14.120 -9.085 1.00 4.21 H new ATOM 0 HD3 LYS A 375 9.247 15.084 -8.148 1.00 4.21 H new ATOM 0 HE2 LYS A 375 9.167 16.755 -10.000 1.00 23.14 H new ATOM 0 HE3 LYS A 375 10.249 15.745 -10.939 1.00 23.14 H new ATOM 0 HZ1 LYS A 375 7.955 15.379 -11.553 1.00 3.44 H new ATOM 0 HZ2 LYS A 375 8.606 13.967 -10.870 1.00 3.44 H new ATOM 0 HZ3 LYS A 375 7.558 14.946 -9.960 1.00 3.44 H new ATOM 324 N VAL A 376 14.357 15.834 -6.702 1.00 41.15 N ATOM 325 CA VAL A 376 14.856 14.792 -5.859 1.00 22.02 C ATOM 326 C VAL A 376 13.769 14.263 -4.978 1.00 14.23 C ATOM 327 O VAL A 376 13.261 14.966 -4.097 1.00 73.04 O ATOM 328 CB VAL A 376 16.097 15.203 -5.040 1.00 13.04 C ATOM 329 CG1 VAL A 376 16.571 14.039 -4.176 1.00 13.44 C ATOM 330 CG2 VAL A 376 17.213 15.638 -5.975 1.00 11.11 C ATOM 0 H VAL A 376 14.142 16.712 -6.230 1.00 41.15 H new ATOM 0 HA VAL A 376 15.194 13.993 -6.520 1.00 22.02 H new ATOM 0 HB VAL A 376 15.827 16.036 -4.391 1.00 13.04 H new ATOM 0 HG11 VAL A 376 17.447 14.344 -3.604 1.00 13.44 H new ATOM 0 HG12 VAL A 376 15.775 13.746 -3.492 1.00 13.44 H new ATOM 0 HG13 VAL A 376 16.830 13.194 -4.814 1.00 13.44 H new ATOM 0 HG21 VAL A 376 18.086 15.927 -5.390 1.00 11.11 H new ATOM 0 HG22 VAL A 376 17.476 14.812 -6.636 1.00 11.11 H new ATOM 0 HG23 VAL A 376 16.878 16.487 -6.571 1.00 11.11 H new ATOM 340 N VAL A 377 13.376 13.033 -5.227 1.00 1.11 N ATOM 341 CA VAL A 377 12.343 12.442 -4.463 1.00 5.34 C ATOM 342 C VAL A 377 12.909 11.777 -3.219 1.00 45.05 C ATOM 343 O VAL A 377 12.251 11.738 -2.209 1.00 52.24 O ATOM 344 CB VAL A 377 11.526 11.428 -5.300 1.00 43.24 C ATOM 345 CG1 VAL A 377 10.360 10.871 -4.497 1.00 74.22 C ATOM 346 CG2 VAL A 377 11.029 12.067 -6.591 1.00 50.31 C ATOM 0 H VAL A 377 13.767 12.437 -5.956 1.00 1.11 H new ATOM 0 HA VAL A 377 11.665 13.237 -4.154 1.00 5.34 H new ATOM 0 HB VAL A 377 12.186 10.600 -5.559 1.00 43.24 H new ATOM 0 HG11 VAL A 377 9.803 10.161 -5.109 1.00 74.22 H new ATOM 0 HG12 VAL A 377 10.739 10.365 -3.609 1.00 74.22 H new ATOM 0 HG13 VAL A 377 9.702 11.687 -4.197 1.00 74.22 H new ATOM 0 HG21 VAL A 377 10.458 11.336 -7.163 1.00 50.31 H new ATOM 0 HG22 VAL A 377 10.393 12.919 -6.354 1.00 50.31 H new ATOM 0 HG23 VAL A 377 11.881 12.404 -7.182 1.00 50.31 H new ATOM 356 N PHE A 378 14.171 11.325 -3.294 1.00 12.24 N ATOM 357 CA PHE A 378 14.803 10.527 -2.216 1.00 2.41 C ATOM 358 C PHE A 378 14.142 9.173 -2.077 1.00 64.22 C ATOM 359 O PHE A 378 12.923 9.066 -1.960 1.00 33.11 O ATOM 360 CB PHE A 378 14.867 11.221 -0.831 1.00 73.51 C ATOM 361 CG PHE A 378 15.907 12.263 -0.643 1.00 2.12 C ATOM 362 CD1 PHE A 378 17.176 11.888 -0.269 1.00 3.43 C ATOM 363 CD2 PHE A 378 15.624 13.605 -0.793 1.00 13.14 C ATOM 364 CE1 PHE A 378 18.157 12.813 -0.055 1.00 53.11 C ATOM 365 CE2 PHE A 378 16.603 14.553 -0.573 1.00 24.12 C ATOM 366 CZ PHE A 378 17.876 14.156 -0.203 1.00 51.12 C ATOM 0 H PHE A 378 14.782 11.497 -4.093 1.00 12.24 H new ATOM 0 HA PHE A 378 15.837 10.412 -2.541 1.00 2.41 H new ATOM 0 HB2 PHE A 378 13.895 11.674 -0.635 1.00 73.51 H new ATOM 0 HB3 PHE A 378 15.019 10.452 -0.074 1.00 73.51 H new ATOM 0 HD1 PHE A 378 17.401 10.839 -0.142 1.00 3.43 H new ATOM 0 HD2 PHE A 378 14.631 13.915 -1.084 1.00 13.14 H new ATOM 0 HE1 PHE A 378 19.149 12.495 0.229 1.00 53.11 H new ATOM 0 HE2 PHE A 378 16.376 15.602 -0.689 1.00 24.12 H new ATOM 0 HZ PHE A 378 18.646 14.894 -0.031 1.00 51.12 H new ATOM 376 N TYR A 379 14.962 8.143 -2.143 1.00 62.00 N ATOM 377 CA TYR A 379 14.550 6.730 -2.004 1.00 14.12 C ATOM 378 C TYR A 379 13.796 6.219 -3.207 1.00 42.10 C ATOM 379 O TYR A 379 13.893 5.062 -3.543 1.00 63.14 O ATOM 380 CB TYR A 379 13.842 6.445 -0.676 1.00 74.11 C ATOM 381 CG TYR A 379 14.777 6.604 0.505 1.00 33.04 C ATOM 382 CD1 TYR A 379 15.123 7.861 0.976 1.00 44.12 C ATOM 383 CD2 TYR A 379 15.337 5.498 1.119 1.00 65.13 C ATOM 384 CE1 TYR A 379 16.001 8.023 2.020 1.00 1.34 C ATOM 385 CE2 TYR A 379 16.211 5.639 2.173 1.00 35.25 C ATOM 386 CZ TYR A 379 16.547 6.898 2.623 1.00 41.11 C ATOM 387 OH TYR A 379 17.438 7.027 3.667 1.00 41.50 O ATOM 0 H TYR A 379 15.964 8.252 -2.299 1.00 62.00 H new ATOM 0 HA TYR A 379 15.471 6.149 -1.971 1.00 14.12 H new ATOM 0 HB2 TYR A 379 12.995 7.122 -0.563 1.00 74.11 H new ATOM 0 HB3 TYR A 379 13.441 5.432 -0.688 1.00 74.11 H new ATOM 0 HD1 TYR A 379 14.691 8.735 0.511 1.00 44.12 H new ATOM 0 HD2 TYR A 379 15.085 4.509 0.766 1.00 65.13 H new ATOM 0 HE1 TYR A 379 16.263 9.012 2.367 1.00 1.34 H new ATOM 0 HE2 TYR A 379 16.633 4.765 2.647 1.00 35.25 H new ATOM 0 HH TYR A 379 18.116 6.321 3.608 1.00 41.50 H new ATOM 397 N GLU A 380 13.049 7.072 -3.830 1.00 42.34 N ATOM 398 CA GLU A 380 12.448 6.761 -5.087 1.00 53.34 C ATOM 399 C GLU A 380 13.488 6.869 -6.199 1.00 24.55 C ATOM 400 O GLU A 380 14.033 5.854 -6.672 1.00 14.43 O ATOM 401 CB GLU A 380 11.271 7.698 -5.350 1.00 63.24 C ATOM 402 CG GLU A 380 10.072 7.440 -4.471 1.00 70.43 C ATOM 403 CD GLU A 380 9.439 6.091 -4.716 1.00 34.32 C ATOM 404 OE1 GLU A 380 9.817 5.103 -4.058 1.00 21.11 O ATOM 405 OE2 GLU A 380 8.517 6.003 -5.567 1.00 2.15 O ATOM 0 H GLU A 380 12.838 8.007 -3.481 1.00 42.34 H new ATOM 0 HA GLU A 380 12.072 5.738 -5.064 1.00 53.34 H new ATOM 0 HB2 GLU A 380 11.600 8.727 -5.205 1.00 63.24 H new ATOM 0 HB3 GLU A 380 10.971 7.603 -6.393 1.00 63.24 H new ATOM 0 HG2 GLU A 380 10.373 7.509 -3.426 1.00 70.43 H new ATOM 0 HG3 GLU A 380 9.329 8.220 -4.641 1.00 70.43 H new ATOM 412 N ASN A 381 13.797 8.106 -6.572 1.00 0.11 N ATOM 413 CA ASN A 381 14.730 8.426 -7.647 1.00 14.44 C ATOM 414 C ASN A 381 14.849 9.932 -7.838 1.00 61.11 C ATOM 415 O ASN A 381 14.306 10.722 -7.034 1.00 11.12 O ATOM 416 CB ASN A 381 14.332 7.741 -8.977 1.00 11.54 C ATOM 417 CG ASN A 381 12.878 7.875 -9.325 1.00 11.21 C ATOM 418 OD1 ASN A 381 12.220 8.825 -8.947 1.00 32.43 O ATOM 419 ND2 ASN A 381 12.373 6.907 -10.054 1.00 51.44 N ATOM 0 H ASN A 381 13.398 8.932 -6.126 1.00 0.11 H new ATOM 0 HA ASN A 381 15.704 8.036 -7.352 1.00 14.44 H new ATOM 0 HB2 ASN A 381 14.928 8.166 -9.785 1.00 11.54 H new ATOM 0 HB3 ASN A 381 14.584 6.682 -8.917 1.00 11.54 H new ATOM 0 HD21 ASN A 381 11.390 6.933 -10.326 1.00 51.44 H new ATOM 0 HD22 ASN A 381 12.963 6.129 -10.348 1.00 51.44 H new ATOM 426 N VAL A 382 15.598 10.328 -8.865 1.00 0.34 N ATOM 427 CA VAL A 382 15.798 11.723 -9.212 1.00 21.11 C ATOM 428 C VAL A 382 15.578 11.894 -10.715 1.00 5.52 C ATOM 429 O VAL A 382 16.029 11.051 -11.515 1.00 72.11 O ATOM 430 CB VAL A 382 17.235 12.210 -8.842 1.00 64.01 C ATOM 431 CG1 VAL A 382 17.439 13.666 -9.234 1.00 23.33 C ATOM 432 CG2 VAL A 382 17.498 12.036 -7.361 1.00 54.55 C ATOM 0 H VAL A 382 16.086 9.679 -9.482 1.00 0.34 H new ATOM 0 HA VAL A 382 15.085 12.323 -8.646 1.00 21.11 H new ATOM 0 HB VAL A 382 17.943 11.597 -9.401 1.00 64.01 H new ATOM 0 HG11 VAL A 382 18.448 13.977 -8.964 1.00 23.33 H new ATOM 0 HG12 VAL A 382 17.300 13.776 -10.310 1.00 23.33 H new ATOM 0 HG13 VAL A 382 16.715 14.289 -8.709 1.00 23.33 H new ATOM 0 HG21 VAL A 382 18.505 12.382 -7.127 1.00 54.55 H new ATOM 0 HG22 VAL A 382 16.773 12.618 -6.792 1.00 54.55 H new ATOM 0 HG23 VAL A 382 17.406 10.983 -7.096 1.00 54.55 H new ATOM 442 N PHE A 383 14.895 12.952 -11.094 1.00 0.03 N ATOM 443 CA PHE A 383 14.589 13.203 -12.494 1.00 55.44 C ATOM 444 C PHE A 383 15.180 14.527 -12.927 1.00 54.00 C ATOM 445 O PHE A 383 15.503 15.378 -12.089 1.00 14.43 O ATOM 446 CB PHE A 383 13.077 13.300 -12.710 1.00 52.14 C ATOM 447 CG PHE A 383 12.284 12.157 -12.181 1.00 63.13 C ATOM 448 CD1 PHE A 383 12.111 11.006 -12.921 1.00 33.02 C ATOM 449 CD2 PHE A 383 11.704 12.241 -10.931 1.00 4.53 C ATOM 450 CE1 PHE A 383 11.370 9.956 -12.421 1.00 31.13 C ATOM 451 CE2 PHE A 383 10.966 11.208 -10.429 1.00 5.34 C ATOM 452 CZ PHE A 383 10.796 10.057 -11.176 1.00 3.41 C ATOM 0 H PHE A 383 14.537 13.659 -10.451 1.00 0.03 H new ATOM 0 HA PHE A 383 15.006 12.377 -13.071 1.00 55.44 H new ATOM 0 HB2 PHE A 383 12.718 14.217 -12.243 1.00 52.14 H new ATOM 0 HB3 PHE A 383 12.884 13.390 -13.779 1.00 52.14 H new ATOM 0 HD1 PHE A 383 12.560 10.926 -13.900 1.00 33.02 H new ATOM 0 HD2 PHE A 383 11.836 13.137 -10.342 1.00 4.53 H new ATOM 0 HE1 PHE A 383 11.241 9.057 -13.006 1.00 31.13 H new ATOM 0 HE2 PHE A 383 10.516 11.290 -9.451 1.00 5.34 H new ATOM 0 HZ PHE A 383 10.213 9.238 -10.782 1.00 3.41 H new ATOM 462 N GLN A 384 15.317 14.690 -14.219 1.00 74.44 N ATOM 463 CA GLN A 384 15.703 15.934 -14.818 1.00 75.32 C ATOM 464 C GLN A 384 14.726 16.287 -15.934 1.00 50.22 C ATOM 465 O GLN A 384 14.768 15.719 -17.035 1.00 61.42 O ATOM 466 CB GLN A 384 17.152 15.929 -15.308 1.00 74.33 C ATOM 467 CG GLN A 384 17.517 14.761 -16.197 1.00 63.51 C ATOM 468 CD GLN A 384 18.914 14.850 -16.781 1.00 61.15 C ATOM 469 OE1 GLN A 384 19.159 14.361 -17.872 1.00 22.34 O ATOM 470 NE2 GLN A 384 19.837 15.448 -16.066 1.00 20.10 N ATOM 0 H GLN A 384 15.159 13.942 -14.895 1.00 74.44 H new ATOM 0 HA GLN A 384 15.658 16.707 -14.051 1.00 75.32 H new ATOM 0 HB2 GLN A 384 17.340 16.854 -15.852 1.00 74.33 H new ATOM 0 HB3 GLN A 384 17.814 15.929 -14.442 1.00 74.33 H new ATOM 0 HG2 GLN A 384 17.431 13.839 -15.623 1.00 63.51 H new ATOM 0 HG3 GLN A 384 16.796 14.697 -17.012 1.00 63.51 H new ATOM 0 HE21 GLN A 384 19.600 15.847 -15.158 1.00 20.10 H new ATOM 0 HE22 GLN A 384 20.792 15.514 -16.418 1.00 20.10 H new ATOM 479 N ASP A 385 13.824 17.186 -15.607 1.00 51.23 N ATOM 480 CA ASP A 385 12.741 17.671 -16.473 1.00 41.33 C ATOM 481 C ASP A 385 11.709 16.587 -16.697 1.00 74.15 C ATOM 482 O ASP A 385 10.641 16.596 -16.091 1.00 52.54 O ATOM 483 CB ASP A 385 13.243 18.207 -17.824 1.00 75.41 C ATOM 484 CG ASP A 385 12.122 18.809 -18.648 1.00 75.11 C ATOM 485 OD1 ASP A 385 11.426 18.068 -19.361 1.00 0.34 O ATOM 486 OD2 ASP A 385 11.929 20.034 -18.591 1.00 34.00 O ATOM 0 H ASP A 385 13.814 17.628 -14.688 1.00 51.23 H new ATOM 0 HA ASP A 385 12.283 18.509 -15.948 1.00 41.33 H new ATOM 0 HB2 ASP A 385 14.012 18.961 -17.652 1.00 75.41 H new ATOM 0 HB3 ASP A 385 13.710 17.397 -18.384 1.00 75.41 H new ATOM 491 N SER A 386 12.048 15.662 -17.551 1.00 10.43 N ATOM 492 CA SER A 386 11.202 14.551 -17.889 1.00 70.13 C ATOM 493 C SER A 386 12.057 13.295 -18.071 1.00 11.12 C ATOM 494 O SER A 386 11.547 12.207 -18.316 1.00 45.31 O ATOM 495 CB SER A 386 10.460 14.868 -19.184 1.00 21.55 C ATOM 496 OG SER A 386 9.705 16.067 -19.056 1.00 41.21 O ATOM 0 H SER A 386 12.941 15.659 -18.043 1.00 10.43 H new ATOM 0 HA SER A 386 10.481 14.376 -17.090 1.00 70.13 H new ATOM 0 HB2 SER A 386 11.174 14.969 -20.002 1.00 21.55 H new ATOM 0 HB3 SER A 386 9.797 14.041 -19.440 1.00 21.55 H new ATOM 0 HG SER A 386 10.260 16.832 -19.316 1.00 41.21 H new ATOM 502 N ILE A 387 13.366 13.457 -17.939 1.00 10.54 N ATOM 503 CA ILE A 387 14.291 12.368 -18.129 1.00 53.20 C ATOM 504 C ILE A 387 14.701 11.797 -16.778 1.00 32.15 C ATOM 505 O ILE A 387 15.158 12.525 -15.895 1.00 15.41 O ATOM 506 CB ILE A 387 15.557 12.823 -18.911 1.00 10.41 C ATOM 507 CG1 ILE A 387 15.167 13.384 -20.290 1.00 12.13 C ATOM 508 CG2 ILE A 387 16.541 11.663 -19.066 1.00 0.40 C ATOM 509 CD1 ILE A 387 16.344 13.872 -21.115 1.00 74.44 C ATOM 0 H ILE A 387 13.807 14.345 -17.698 1.00 10.54 H new ATOM 0 HA ILE A 387 13.788 11.601 -18.718 1.00 53.20 H new ATOM 0 HB ILE A 387 16.045 13.614 -18.341 1.00 10.41 H new ATOM 0 HG12 ILE A 387 14.641 12.611 -20.849 1.00 12.13 H new ATOM 0 HG13 ILE A 387 14.468 14.209 -20.151 1.00 12.13 H new ATOM 0 HG21 ILE A 387 17.419 12.002 -19.615 1.00 0.40 H new ATOM 0 HG22 ILE A 387 16.844 11.309 -18.081 1.00 0.40 H new ATOM 0 HG23 ILE A 387 16.062 10.850 -19.613 1.00 0.40 H new ATOM 0 HD11 ILE A 387 15.985 14.252 -22.072 1.00 74.44 H new ATOM 0 HD12 ILE A 387 16.859 14.669 -20.578 1.00 74.44 H new ATOM 0 HD13 ILE A 387 17.034 13.046 -21.288 1.00 74.44 H new ATOM 521 N LEU A 388 14.510 10.522 -16.620 1.00 32.13 N ATOM 522 CA LEU A 388 14.873 9.828 -15.413 1.00 51.32 C ATOM 523 C LEU A 388 16.358 9.511 -15.384 1.00 20.41 C ATOM 524 O LEU A 388 16.898 8.919 -16.335 1.00 64.05 O ATOM 525 CB LEU A 388 14.034 8.545 -15.273 1.00 62.22 C ATOM 526 CG LEU A 388 14.421 7.573 -14.149 1.00 62.45 C ATOM 527 CD1 LEU A 388 14.408 8.262 -12.799 1.00 15.54 C ATOM 528 CD2 LEU A 388 13.464 6.399 -14.130 1.00 73.42 C ATOM 0 H LEU A 388 14.093 9.923 -17.333 1.00 32.13 H new ATOM 0 HA LEU A 388 14.663 10.480 -14.565 1.00 51.32 H new ATOM 0 HB2 LEU A 388 12.994 8.836 -15.125 1.00 62.22 H new ATOM 0 HB3 LEU A 388 14.082 8.005 -16.218 1.00 62.22 H new ATOM 0 HG LEU A 388 15.433 7.218 -14.343 1.00 62.45 H new ATOM 0 HD11 LEU A 388 14.686 7.548 -12.024 1.00 15.54 H new ATOM 0 HD12 LEU A 388 15.120 9.087 -12.805 1.00 15.54 H new ATOM 0 HD13 LEU A 388 13.408 8.647 -12.596 1.00 15.54 H new ATOM 0 HD21 LEU A 388 13.745 5.714 -13.330 1.00 73.42 H new ATOM 0 HD22 LEU A 388 12.449 6.759 -13.960 1.00 73.42 H new ATOM 0 HD23 LEU A 388 13.508 5.878 -15.086 1.00 73.42 H new ATOM 540 N LEU A 389 17.017 9.934 -14.313 1.00 73.32 N ATOM 541 CA LEU A 389 18.410 9.616 -14.115 1.00 11.40 C ATOM 542 C LEU A 389 18.569 8.141 -13.813 1.00 54.14 C ATOM 543 O LEU A 389 18.887 7.360 -14.685 1.00 72.23 O ATOM 544 CB LEU A 389 19.019 10.433 -12.981 1.00 33.35 C ATOM 545 CG LEU A 389 18.989 11.941 -13.127 1.00 74.34 C ATOM 546 CD1 LEU A 389 19.636 12.575 -11.934 1.00 72.34 C ATOM 547 CD2 LEU A 389 19.696 12.371 -14.390 1.00 72.53 C ATOM 0 H LEU A 389 16.602 10.498 -13.572 1.00 73.32 H new ATOM 0 HA LEU A 389 18.937 9.865 -15.036 1.00 11.40 H new ATOM 0 HB2 LEU A 389 18.500 10.172 -12.059 1.00 33.35 H new ATOM 0 HB3 LEU A 389 20.058 10.125 -12.861 1.00 33.35 H new ATOM 0 HG LEU A 389 17.950 12.265 -13.191 1.00 74.34 H new ATOM 0 HD11 LEU A 389 19.613 13.659 -12.041 1.00 72.34 H new ATOM 0 HD12 LEU A 389 19.096 12.288 -11.032 1.00 72.34 H new ATOM 0 HD13 LEU A 389 20.670 12.239 -11.860 1.00 72.34 H new ATOM 0 HD21 LEU A 389 19.662 13.457 -14.474 1.00 72.53 H new ATOM 0 HD22 LEU A 389 20.735 12.042 -14.356 1.00 72.53 H new ATOM 0 HD23 LEU A 389 19.202 11.925 -15.253 1.00 72.53 H new ATOM 559 N GLY A 390 18.275 7.771 -12.594 1.00 14.01 N ATOM 560 CA GLY A 390 18.425 6.414 -12.169 1.00 24.22 C ATOM 561 C GLY A 390 17.356 6.052 -11.192 1.00 65.03 C ATOM 562 O GLY A 390 16.499 6.866 -10.906 1.00 34.31 O ATOM 0 H GLY A 390 17.926 8.404 -11.874 1.00 14.01 H new ATOM 0 HA2 GLY A 390 18.378 5.749 -13.031 1.00 24.22 H new ATOM 0 HA3 GLY A 390 19.405 6.276 -11.713 1.00 24.22 H new ATOM 566 N ASN A 391 17.428 4.870 -10.647 1.00 24.01 N ATOM 567 CA ASN A 391 16.415 4.381 -9.711 1.00 62.43 C ATOM 568 C ASN A 391 17.063 3.828 -8.542 1.00 2.24 C ATOM 569 O ASN A 391 18.187 3.355 -8.634 1.00 52.13 O ATOM 570 CB ASN A 391 15.479 3.338 -10.303 1.00 40.05 C ATOM 571 CG ASN A 391 14.585 3.896 -11.340 1.00 15.20 C ATOM 572 OD1 ASN A 391 13.504 4.396 -11.042 1.00 24.44 O ATOM 573 ND2 ASN A 391 14.984 3.810 -12.550 1.00 35.32 N ATOM 0 H ASN A 391 18.183 4.208 -10.829 1.00 24.01 H new ATOM 0 HA ASN A 391 15.799 5.242 -9.452 1.00 62.43 H new ATOM 0 HB2 ASN A 391 16.069 2.530 -10.735 1.00 40.05 H new ATOM 0 HB3 ASN A 391 14.877 2.902 -9.506 1.00 40.05 H new ATOM 0 HD21 ASN A 391 14.398 4.163 -13.307 1.00 35.32 H new ATOM 0 HD22 ASN A 391 15.889 3.388 -12.760 1.00 35.32 H new ATOM 580 N PHE A 392 16.379 3.862 -7.445 1.00 1.05 N ATOM 581 CA PHE A 392 16.986 3.445 -6.166 1.00 55.34 C ATOM 582 C PHE A 392 17.570 2.042 -6.261 1.00 4.30 C ATOM 583 O PHE A 392 16.851 1.054 -6.468 1.00 13.24 O ATOM 584 CB PHE A 392 15.993 3.521 -5.017 1.00 65.35 C ATOM 585 CG PHE A 392 16.619 3.284 -3.659 1.00 34.23 C ATOM 586 CD1 PHE A 392 17.276 4.313 -3.002 1.00 61.02 C ATOM 587 CD2 PHE A 392 16.545 2.046 -3.042 1.00 2.12 C ATOM 588 CE1 PHE A 392 17.849 4.113 -1.763 1.00 51.24 C ATOM 589 CE2 PHE A 392 17.119 1.839 -1.800 1.00 53.00 C ATOM 590 CZ PHE A 392 17.771 2.875 -1.161 1.00 41.14 C ATOM 0 H PHE A 392 15.408 4.167 -7.380 1.00 1.05 H new ATOM 0 HA PHE A 392 17.796 4.145 -5.960 1.00 55.34 H new ATOM 0 HB2 PHE A 392 15.518 4.502 -5.023 1.00 65.35 H new ATOM 0 HB3 PHE A 392 15.206 2.785 -5.179 1.00 65.35 H new ATOM 0 HD1 PHE A 392 17.340 5.286 -3.467 1.00 61.02 H new ATOM 0 HD2 PHE A 392 16.034 1.233 -3.536 1.00 2.12 H new ATOM 0 HE1 PHE A 392 18.358 4.925 -1.265 1.00 51.24 H new ATOM 0 HE2 PHE A 392 17.057 0.868 -1.331 1.00 53.00 H new ATOM 0 HZ PHE A 392 18.219 2.716 -0.191 1.00 41.14 H new ATOM 600 N ALA A 393 18.860 1.968 -6.125 1.00 25.14 N ATOM 601 CA ALA A 393 19.561 0.724 -6.204 1.00 64.30 C ATOM 602 C ALA A 393 19.940 0.273 -4.821 1.00 23.21 C ATOM 603 O ALA A 393 19.654 -0.859 -4.426 1.00 42.02 O ATOM 604 CB ALA A 393 20.792 0.872 -7.089 1.00 21.11 C ATOM 0 H ALA A 393 19.459 2.776 -5.955 1.00 25.14 H new ATOM 0 HA ALA A 393 18.915 -0.032 -6.651 1.00 64.30 H new ATOM 0 HB1 ALA A 393 21.318 -0.081 -7.142 1.00 21.11 H new ATOM 0 HB2 ALA A 393 20.486 1.174 -8.091 1.00 21.11 H new ATOM 0 HB3 ALA A 393 21.454 1.629 -6.668 1.00 21.11 H new ATOM 610 N SER A 394 20.551 1.169 -4.081 1.00 5.04 N ATOM 611 CA SER A 394 20.979 0.907 -2.738 1.00 15.31 C ATOM 612 C SER A 394 21.436 2.219 -2.123 1.00 44.05 C ATOM 613 O SER A 394 21.514 3.244 -2.827 1.00 1.21 O ATOM 614 CB SER A 394 22.133 -0.124 -2.733 1.00 21.14 C ATOM 615 OG SER A 394 22.529 -0.460 -1.417 1.00 74.11 O ATOM 0 H SER A 394 20.765 2.112 -4.405 1.00 5.04 H new ATOM 0 HA SER A 394 20.157 0.489 -2.157 1.00 15.31 H new ATOM 0 HB2 SER A 394 21.818 -1.025 -3.260 1.00 21.14 H new ATOM 0 HB3 SER A 394 22.986 0.282 -3.277 1.00 21.14 H new ATOM 0 HG SER A 394 23.258 -1.114 -1.452 1.00 74.11 H new ATOM 621 N GLN A 395 21.704 2.201 -0.848 1.00 14.22 N ATOM 622 CA GLN A 395 22.214 3.344 -0.157 1.00 11.32 C ATOM 623 C GLN A 395 23.520 2.968 0.498 1.00 13.44 C ATOM 624 O GLN A 395 23.665 1.854 1.013 1.00 73.30 O ATOM 625 CB GLN A 395 21.221 3.880 0.879 1.00 44.43 C ATOM 626 CG GLN A 395 20.834 2.901 1.968 1.00 72.50 C ATOM 627 CD GLN A 395 19.917 3.513 3.001 1.00 22.11 C ATOM 628 OE1 GLN A 395 19.125 4.415 2.708 1.00 43.31 O ATOM 629 NE2 GLN A 395 20.023 3.047 4.209 1.00 52.14 N ATOM 0 H GLN A 395 21.572 1.381 -0.255 1.00 14.22 H new ATOM 0 HA GLN A 395 22.374 4.146 -0.877 1.00 11.32 H new ATOM 0 HB2 GLN A 395 21.650 4.767 1.345 1.00 44.43 H new ATOM 0 HB3 GLN A 395 20.317 4.199 0.361 1.00 44.43 H new ATOM 0 HG2 GLN A 395 20.343 2.038 1.518 1.00 72.50 H new ATOM 0 HG3 GLN A 395 21.735 2.535 2.459 1.00 72.50 H new ATOM 0 HE21 GLN A 395 20.689 2.301 4.411 1.00 52.14 H new ATOM 0 HE22 GLN A 395 19.440 3.427 4.955 1.00 52.14 H new ATOM 638 N GLU A 396 24.461 3.858 0.460 1.00 14.01 N ATOM 639 CA GLU A 396 25.751 3.623 1.033 1.00 34.43 C ATOM 640 C GLU A 396 26.058 4.750 1.994 1.00 11.14 C ATOM 641 O GLU A 396 26.467 5.854 1.587 1.00 74.01 O ATOM 642 CB GLU A 396 26.808 3.530 -0.071 1.00 61.13 C ATOM 643 CG GLU A 396 26.478 2.475 -1.119 1.00 32.24 C ATOM 644 CD GLU A 396 27.479 2.408 -2.229 1.00 10.44 C ATOM 645 OE1 GLU A 396 27.524 3.329 -3.052 1.00 14.31 O ATOM 646 OE2 GLU A 396 28.213 1.399 -2.322 1.00 31.24 O ATOM 0 H GLU A 396 24.356 4.776 0.027 1.00 14.01 H new ATOM 0 HA GLU A 396 25.760 2.677 1.575 1.00 34.43 H new ATOM 0 HB2 GLU A 396 26.905 4.501 -0.557 1.00 61.13 H new ATOM 0 HB3 GLU A 396 27.775 3.300 0.377 1.00 61.13 H new ATOM 0 HG2 GLU A 396 26.416 1.500 -0.636 1.00 32.24 H new ATOM 0 HG3 GLU A 396 25.494 2.685 -1.539 1.00 32.24 H new ATOM 653 N GLY A 397 25.810 4.489 3.253 1.00 31.35 N ATOM 654 CA GLY A 397 25.990 5.478 4.274 1.00 43.10 C ATOM 655 C GLY A 397 24.931 6.551 4.181 1.00 34.41 C ATOM 656 O GLY A 397 23.741 6.285 4.374 1.00 45.03 O ATOM 0 H GLY A 397 25.479 3.586 3.594 1.00 31.35 H new ATOM 0 HA2 GLY A 397 25.948 5.005 5.255 1.00 43.10 H new ATOM 0 HA3 GLY A 397 26.978 5.928 4.179 1.00 43.10 H new ATOM 660 N ASN A 398 25.356 7.745 3.866 1.00 73.12 N ATOM 661 CA ASN A 398 24.456 8.884 3.708 1.00 13.22 C ATOM 662 C ASN A 398 24.156 9.095 2.225 1.00 33.32 C ATOM 663 O ASN A 398 23.238 9.833 1.845 1.00 63.43 O ATOM 664 CB ASN A 398 25.150 10.142 4.279 1.00 14.34 C ATOM 665 CG ASN A 398 24.355 11.429 4.104 1.00 22.55 C ATOM 666 OD1 ASN A 398 24.474 12.106 3.097 1.00 43.52 O ATOM 667 ND2 ASN A 398 23.579 11.788 5.086 1.00 71.15 N ATOM 0 H ASN A 398 26.339 7.969 3.708 1.00 73.12 H new ATOM 0 HA ASN A 398 23.522 8.699 4.238 1.00 13.22 H new ATOM 0 HB2 ASN A 398 25.340 9.987 5.341 1.00 14.34 H new ATOM 0 HB3 ASN A 398 26.120 10.259 3.795 1.00 14.34 H new ATOM 0 HD21 ASN A 398 23.049 12.658 5.026 1.00 71.15 H new ATOM 0 HD22 ASN A 398 23.501 11.200 5.916 1.00 71.15 H new ATOM 674 N VAL A 399 24.888 8.386 1.403 1.00 2.53 N ATOM 675 CA VAL A 399 24.817 8.555 -0.018 1.00 42.23 C ATOM 676 C VAL A 399 23.867 7.531 -0.629 1.00 20.43 C ATOM 677 O VAL A 399 23.882 6.364 -0.266 1.00 51.15 O ATOM 678 CB VAL A 399 26.227 8.431 -0.639 1.00 74.55 C ATOM 679 CG1 VAL A 399 26.183 8.646 -2.125 1.00 41.12 C ATOM 680 CG2 VAL A 399 27.179 9.427 0.006 1.00 72.00 C ATOM 0 H VAL A 399 25.552 7.673 1.707 1.00 2.53 H new ATOM 0 HA VAL A 399 24.429 9.550 -0.235 1.00 42.23 H new ATOM 0 HB VAL A 399 26.590 7.421 -0.451 1.00 74.55 H new ATOM 0 HG11 VAL A 399 27.188 8.553 -2.536 1.00 41.12 H new ATOM 0 HG12 VAL A 399 25.534 7.899 -2.582 1.00 41.12 H new ATOM 0 HG13 VAL A 399 25.795 9.642 -2.337 1.00 41.12 H new ATOM 0 HG21 VAL A 399 28.168 9.328 -0.442 1.00 72.00 H new ATOM 0 HG22 VAL A 399 26.809 10.440 -0.153 1.00 72.00 H new ATOM 0 HG23 VAL A 399 27.244 9.228 1.076 1.00 72.00 H new ATOM 690 N LEU A 400 23.045 7.972 -1.540 1.00 41.13 N ATOM 691 CA LEU A 400 22.053 7.115 -2.150 1.00 14.21 C ATOM 692 C LEU A 400 22.396 6.888 -3.619 1.00 2.13 C ATOM 693 O LEU A 400 22.769 7.837 -4.319 1.00 63.14 O ATOM 694 CB LEU A 400 20.681 7.785 -2.047 1.00 63.01 C ATOM 695 CG LEU A 400 20.226 8.218 -0.638 1.00 34.22 C ATOM 696 CD1 LEU A 400 18.881 8.893 -0.698 1.00 3.40 C ATOM 697 CD2 LEU A 400 20.171 7.043 0.310 1.00 0.22 C ATOM 0 H LEU A 400 23.039 8.932 -1.884 1.00 41.13 H new ATOM 0 HA LEU A 400 22.037 6.155 -1.634 1.00 14.21 H new ATOM 0 HB2 LEU A 400 20.683 8.665 -2.690 1.00 63.01 H new ATOM 0 HB3 LEU A 400 19.936 7.099 -2.449 1.00 63.01 H new ATOM 0 HG LEU A 400 20.963 8.927 -0.260 1.00 34.22 H new ATOM 0 HD11 LEU A 400 18.578 9.191 0.306 1.00 3.40 H new ATOM 0 HD12 LEU A 400 18.945 9.776 -1.334 1.00 3.40 H new ATOM 0 HD13 LEU A 400 18.145 8.202 -1.109 1.00 3.40 H new ATOM 0 HD21 LEU A 400 19.847 7.384 1.293 1.00 0.22 H new ATOM 0 HD22 LEU A 400 19.466 6.303 -0.068 1.00 0.22 H new ATOM 0 HD23 LEU A 400 21.161 6.593 0.390 1.00 0.22 H new ATOM 709 N LYS A 401 22.286 5.653 -4.093 1.00 3.05 N ATOM 710 CA LYS A 401 22.574 5.373 -5.492 1.00 64.44 C ATOM 711 C LYS A 401 21.326 5.077 -6.295 1.00 54.41 C ATOM 712 O LYS A 401 20.483 4.249 -5.897 1.00 33.23 O ATOM 713 CB LYS A 401 23.581 4.233 -5.693 1.00 32.52 C ATOM 714 CG LYS A 401 24.860 4.680 -6.375 1.00 21.54 C ATOM 715 CD LYS A 401 24.562 5.358 -7.719 1.00 63.13 C ATOM 716 CE LYS A 401 24.062 4.395 -8.786 1.00 42.11 C ATOM 717 NZ LYS A 401 25.163 3.564 -9.317 1.00 71.30 N ATOM 0 H LYS A 401 22.005 4.843 -3.540 1.00 3.05 H new ATOM 0 HA LYS A 401 23.026 6.294 -5.861 1.00 64.44 H new ATOM 0 HB2 LYS A 401 23.826 3.798 -4.724 1.00 32.52 H new ATOM 0 HB3 LYS A 401 23.116 3.446 -6.287 1.00 32.52 H new ATOM 0 HG2 LYS A 401 25.399 5.371 -5.727 1.00 21.54 H new ATOM 0 HG3 LYS A 401 25.510 3.820 -6.534 1.00 21.54 H new ATOM 0 HD2 LYS A 401 23.816 6.138 -7.566 1.00 63.13 H new ATOM 0 HD3 LYS A 401 25.467 5.848 -8.078 1.00 63.13 H new ATOM 0 HE2 LYS A 401 23.289 3.752 -8.365 1.00 42.11 H new ATOM 0 HE3 LYS A 401 23.602 4.957 -9.599 1.00 42.11 H new ATOM 0 HZ1 LYS A 401 24.770 2.706 -9.755 1.00 71.30 H new ATOM 0 HZ2 LYS A 401 25.694 4.105 -10.029 1.00 71.30 H new ATOM 0 HZ3 LYS A 401 25.801 3.295 -8.541 1.00 71.30 H new ATOM 731 N TYR A 402 21.206 5.749 -7.418 1.00 14.23 N ATOM 732 CA TYR A 402 20.133 5.548 -8.329 1.00 0.44 C ATOM 733 C TYR A 402 20.703 5.100 -9.663 1.00 50.20 C ATOM 734 O TYR A 402 21.383 5.847 -10.302 1.00 13.23 O ATOM 735 CB TYR A 402 19.318 6.837 -8.470 1.00 0.25 C ATOM 736 CG TYR A 402 18.776 7.311 -7.153 1.00 4.44 C ATOM 737 CD1 TYR A 402 17.634 6.758 -6.622 1.00 0.41 C ATOM 738 CD2 TYR A 402 19.429 8.290 -6.424 1.00 34.23 C ATOM 739 CE1 TYR A 402 17.154 7.153 -5.404 1.00 65.11 C ATOM 740 CE2 TYR A 402 18.947 8.695 -5.205 1.00 54.11 C ATOM 741 CZ TYR A 402 17.812 8.120 -4.702 1.00 55.21 C ATOM 742 OH TYR A 402 17.340 8.501 -3.484 1.00 73.41 O ATOM 0 H TYR A 402 21.872 6.462 -7.717 1.00 14.23 H new ATOM 0 HA TYR A 402 19.461 4.774 -7.958 1.00 0.44 H new ATOM 0 HB2 TYR A 402 19.945 7.616 -8.905 1.00 0.25 H new ATOM 0 HB3 TYR A 402 18.492 6.669 -9.162 1.00 0.25 H new ATOM 0 HD1 TYR A 402 17.106 5.997 -7.178 1.00 0.41 H new ATOM 0 HD2 TYR A 402 20.328 8.740 -6.819 1.00 34.23 H new ATOM 0 HE1 TYR A 402 16.259 6.702 -5.000 1.00 65.11 H new ATOM 0 HE2 TYR A 402 19.460 9.463 -4.646 1.00 54.11 H new ATOM 0 HH TYR A 402 17.762 9.345 -3.219 1.00 73.41 H new ATOM 752 N GLU A 403 20.415 3.889 -10.055 1.00 62.24 N ATOM 753 CA GLU A 403 20.932 3.307 -11.281 1.00 43.15 C ATOM 754 C GLU A 403 19.737 2.584 -11.908 1.00 33.45 C ATOM 755 O GLU A 403 18.678 2.567 -11.287 1.00 53.40 O ATOM 756 CB GLU A 403 22.071 2.338 -10.878 1.00 62.11 C ATOM 757 CG GLU A 403 23.199 2.125 -11.900 1.00 13.41 C ATOM 758 CD GLU A 403 22.870 1.242 -13.085 1.00 24.33 C ATOM 759 OE1 GLU A 403 22.269 1.718 -14.050 1.00 5.50 O ATOM 760 OE2 GLU A 403 23.229 0.036 -13.052 1.00 31.42 O ATOM 0 H GLU A 403 19.806 3.262 -9.529 1.00 62.24 H new ATOM 0 HA GLU A 403 21.343 4.022 -11.994 1.00 43.15 H new ATOM 0 HB2 GLU A 403 22.516 2.704 -9.953 1.00 62.11 H new ATOM 0 HB3 GLU A 403 21.627 1.367 -10.656 1.00 62.11 H new ATOM 0 HG2 GLU A 403 23.510 3.100 -12.275 1.00 13.41 H new ATOM 0 HG3 GLU A 403 24.056 1.696 -11.380 1.00 13.41 H new ATOM 767 N ASN A 404 19.882 2.016 -13.094 1.00 22.21 N ATOM 768 CA ASN A 404 18.779 1.326 -13.820 1.00 63.41 C ATOM 769 C ASN A 404 17.805 2.359 -14.363 1.00 33.41 C ATOM 770 O ASN A 404 16.613 2.071 -14.558 1.00 20.23 O ATOM 771 CB ASN A 404 17.996 0.318 -12.912 1.00 62.22 C ATOM 772 CG ASN A 404 18.836 -0.798 -12.311 1.00 43.04 C ATOM 773 OD1 ASN A 404 19.816 -1.245 -12.886 1.00 12.42 O ATOM 774 ND2 ASN A 404 18.457 -1.246 -11.140 1.00 52.44 N ATOM 0 H ASN A 404 20.767 2.010 -13.601 1.00 22.21 H new ATOM 0 HA ASN A 404 19.236 0.757 -14.630 1.00 63.41 H new ATOM 0 HB2 ASN A 404 17.525 0.874 -12.101 1.00 62.22 H new ATOM 0 HB3 ASN A 404 17.194 -0.129 -13.500 1.00 62.22 H new ATOM 0 HD21 ASN A 404 18.985 -1.989 -10.683 1.00 52.44 H new ATOM 0 HD22 ASN A 404 17.633 -0.852 -10.685 1.00 52.44 H new ATOM 781 N GLY A 405 18.309 3.553 -14.646 1.00 31.52 N ATOM 782 CA GLY A 405 17.475 4.612 -15.125 1.00 0.30 C ATOM 783 C GLY A 405 17.187 4.524 -16.602 1.00 52.40 C ATOM 784 O GLY A 405 17.301 3.447 -17.227 1.00 73.03 O ATOM 0 H GLY A 405 19.294 3.798 -14.547 1.00 31.52 H new ATOM 0 HA2 GLY A 405 16.533 4.599 -14.577 1.00 0.30 H new ATOM 0 HA3 GLY A 405 17.955 5.567 -14.912 1.00 0.30 H new ATOM 788 N GLN A 406 16.830 5.643 -17.158 1.00 2.45 N ATOM 789 CA GLN A 406 16.455 5.750 -18.543 1.00 54.15 C ATOM 790 C GLN A 406 17.754 5.709 -19.361 1.00 74.21 C ATOM 791 O GLN A 406 18.802 6.163 -18.875 1.00 11.43 O ATOM 792 CB GLN A 406 15.694 7.086 -18.706 1.00 42.24 C ATOM 793 CG GLN A 406 14.704 7.195 -19.870 1.00 1.25 C ATOM 794 CD GLN A 406 15.312 7.203 -21.250 1.00 55.33 C ATOM 795 OE1 GLN A 406 15.495 6.157 -21.865 1.00 60.54 O ATOM 796 NE2 GLN A 406 15.583 8.378 -21.760 1.00 33.52 N ATOM 0 H GLN A 406 16.789 6.528 -16.653 1.00 2.45 H new ATOM 0 HA GLN A 406 15.806 4.944 -18.886 1.00 54.15 H new ATOM 0 HB2 GLN A 406 15.150 7.279 -17.782 1.00 42.24 H new ATOM 0 HB3 GLN A 406 16.430 7.882 -18.814 1.00 42.24 H new ATOM 0 HG2 GLN A 406 14.004 6.361 -19.807 1.00 1.25 H new ATOM 0 HG3 GLN A 406 14.123 8.109 -19.744 1.00 1.25 H new ATOM 0 HE21 GLN A 406 15.415 9.222 -21.213 1.00 33.52 H new ATOM 0 HE22 GLN A 406 15.962 8.449 -22.704 1.00 33.52 H new ATOM 805 N SER A 407 17.701 5.122 -20.543 1.00 53.22 N ATOM 806 CA SER A 407 18.865 4.986 -21.407 1.00 52.03 C ATOM 807 C SER A 407 19.544 6.336 -21.653 1.00 41.12 C ATOM 808 O SER A 407 18.880 7.355 -21.839 1.00 75.33 O ATOM 809 CB SER A 407 18.459 4.341 -22.730 1.00 42.45 C ATOM 810 OG SER A 407 17.902 3.049 -22.509 1.00 15.24 O ATOM 0 H SER A 407 16.847 4.724 -20.934 1.00 53.22 H new ATOM 0 HA SER A 407 19.587 4.344 -20.903 1.00 52.03 H new ATOM 0 HB2 SER A 407 17.733 4.973 -23.241 1.00 42.45 H new ATOM 0 HB3 SER A 407 19.328 4.261 -23.383 1.00 42.45 H new ATOM 0 HG SER A 407 17.646 2.652 -23.368 1.00 15.24 H new ATOM 816 N CYS A 408 20.855 6.334 -21.615 1.00 52.41 N ATOM 817 CA CYS A 408 21.618 7.535 -21.805 1.00 12.23 C ATOM 818 C CYS A 408 22.277 7.539 -23.176 1.00 30.11 C ATOM 819 O CYS A 408 22.729 8.588 -23.651 1.00 64.11 O ATOM 820 CB CYS A 408 22.671 7.659 -20.707 1.00 4.31 C ATOM 821 SG CYS A 408 23.883 6.298 -20.682 1.00 61.34 S ATOM 0 H CYS A 408 21.418 5.499 -21.452 1.00 52.41 H new ATOM 0 HA CYS A 408 20.945 8.391 -21.749 1.00 12.23 H new ATOM 0 HB2 CYS A 408 23.202 8.602 -20.833 1.00 4.31 H new ATOM 0 HB3 CYS A 408 22.169 7.702 -19.740 1.00 4.31 H new ATOM 826 N ALA A 409 22.346 6.337 -23.805 1.00 54.24 N ATOM 827 CA ALA A 409 22.936 6.151 -25.149 1.00 53.40 C ATOM 828 C ALA A 409 24.432 6.508 -25.163 1.00 75.31 C ATOM 829 O ALA A 409 25.008 6.808 -26.208 1.00 41.12 O ATOM 830 CB ALA A 409 22.162 6.960 -26.188 1.00 70.12 C ATOM 0 H ALA A 409 21.994 5.473 -23.392 1.00 54.24 H new ATOM 0 HA ALA A 409 22.856 5.096 -25.410 1.00 53.40 H new ATOM 0 HB1 ALA A 409 22.609 6.812 -27.171 1.00 70.12 H new ATOM 0 HB2 ALA A 409 21.124 6.628 -26.208 1.00 70.12 H new ATOM 0 HB3 ALA A 409 22.200 8.018 -25.928 1.00 70.12 H new ATOM 836 N ASN A 410 25.046 6.437 -24.006 1.00 75.13 N ATOM 837 CA ASN A 410 26.465 6.736 -23.852 1.00 44.22 C ATOM 838 C ASN A 410 27.152 5.599 -23.117 1.00 22.32 C ATOM 839 O ASN A 410 28.137 5.032 -23.596 1.00 22.22 O ATOM 840 CB ASN A 410 26.655 8.079 -23.116 1.00 15.00 C ATOM 841 CG ASN A 410 28.106 8.389 -22.787 1.00 73.32 C ATOM 842 OD1 ASN A 410 28.592 8.047 -21.712 1.00 44.41 O ATOM 843 ND2 ASN A 410 28.796 9.044 -23.682 1.00 44.12 N ATOM 0 H ASN A 410 24.582 6.170 -23.138 1.00 75.13 H new ATOM 0 HA ASN A 410 26.922 6.832 -24.837 1.00 44.22 H new ATOM 0 HB2 ASN A 410 26.251 8.882 -23.732 1.00 15.00 H new ATOM 0 HB3 ASN A 410 26.076 8.063 -22.192 1.00 15.00 H new ATOM 0 HD21 ASN A 410 29.770 9.287 -23.498 1.00 44.12 H new ATOM 0 HD22 ASN A 410 28.361 9.313 -24.565 1.00 44.12 H new ATOM 850 N GLY A 411 26.625 5.269 -21.972 1.00 32.13 N ATOM 851 CA GLY A 411 27.105 4.163 -21.197 1.00 22.21 C ATOM 852 C GLY A 411 25.997 3.153 -21.035 1.00 23.33 C ATOM 853 O GLY A 411 25.073 3.145 -21.849 1.00 11.45 O ATOM 0 H GLY A 411 25.842 5.766 -21.547 1.00 32.13 H new ATOM 0 HA2 GLY A 411 27.963 3.704 -21.689 1.00 22.21 H new ATOM 0 HA3 GLY A 411 27.444 4.508 -20.220 1.00 22.21 H new ATOM 857 N PRO A 412 26.030 2.309 -19.996 1.00 4.44 N ATOM 858 CA PRO A 412 25.004 1.278 -19.780 1.00 23.30 C ATOM 859 C PRO A 412 23.609 1.882 -19.586 1.00 53.13 C ATOM 860 O PRO A 412 22.731 1.754 -20.440 1.00 11.41 O ATOM 861 CB PRO A 412 25.471 0.557 -18.507 1.00 31.14 C ATOM 862 CG PRO A 412 26.916 0.904 -18.378 1.00 10.24 C ATOM 863 CD PRO A 412 27.058 2.282 -18.947 1.00 1.14 C ATOM 0 HA PRO A 412 24.907 0.614 -20.639 1.00 23.30 H new ATOM 0 HB2 PRO A 412 24.906 0.888 -17.636 1.00 31.14 H new ATOM 0 HB3 PRO A 412 25.329 -0.521 -18.589 1.00 31.14 H new ATOM 0 HG2 PRO A 412 27.233 0.877 -17.335 1.00 10.24 H new ATOM 0 HG3 PRO A 412 27.539 0.192 -18.919 1.00 10.24 H new ATOM 0 HD2 PRO A 412 26.887 3.050 -18.193 1.00 1.14 H new ATOM 0 HD3 PRO A 412 28.055 2.451 -19.354 1.00 1.14 H new ATOM 871 N HIS A 413 23.428 2.542 -18.489 1.00 30.22 N ATOM 872 CA HIS A 413 22.196 3.234 -18.151 1.00 0.21 C ATOM 873 C HIS A 413 22.553 4.476 -17.422 1.00 53.33 C ATOM 874 O HIS A 413 23.658 4.576 -16.891 1.00 54.43 O ATOM 875 CB HIS A 413 21.234 2.377 -17.281 1.00 1.32 C ATOM 876 CG HIS A 413 20.588 1.219 -17.993 1.00 34.42 C ATOM 877 ND1 HIS A 413 19.274 1.235 -18.419 1.00 54.10 N ATOM 878 CD2 HIS A 413 21.075 0.010 -18.352 1.00 21.42 C ATOM 879 CE1 HIS A 413 18.994 0.086 -19.008 1.00 25.12 C ATOM 880 NE2 HIS A 413 20.070 -0.669 -18.982 1.00 61.10 N ATOM 0 H HIS A 413 24.148 2.626 -17.771 1.00 30.22 H new ATOM 0 HA HIS A 413 21.664 3.450 -19.078 1.00 0.21 H new ATOM 0 HB2 HIS A 413 21.789 1.993 -16.425 1.00 1.32 H new ATOM 0 HB3 HIS A 413 20.450 3.025 -16.888 1.00 1.32 H new ATOM 0 HD1 HIS A 413 18.623 2.011 -18.298 1.00 54.10 H new ATOM 0 HD2 HIS A 413 22.076 -0.353 -18.173 1.00 21.42 H new ATOM 0 HE1 HIS A 413 18.042 -0.187 -19.438 1.00 25.12 H new ATOM 889 N ARG A 414 21.667 5.434 -17.427 1.00 31.52 N ATOM 890 CA ARG A 414 21.882 6.642 -16.702 1.00 11.13 C ATOM 891 C ARG A 414 21.769 6.357 -15.210 1.00 13.32 C ATOM 892 O ARG A 414 21.000 5.466 -14.782 1.00 5.44 O ATOM 893 CB ARG A 414 20.904 7.711 -17.172 1.00 4.14 C ATOM 894 CG ARG A 414 21.056 9.068 -16.529 1.00 65.12 C ATOM 895 CD ARG A 414 20.133 10.066 -17.197 1.00 41.03 C ATOM 896 NE ARG A 414 20.530 10.333 -18.583 1.00 2.31 N ATOM 897 CZ ARG A 414 19.848 9.979 -19.676 1.00 50.30 C ATOM 898 NH1 ARG A 414 18.778 9.186 -19.585 1.00 43.34 N ATOM 899 NH2 ARG A 414 20.259 10.398 -20.863 1.00 61.04 N ATOM 0 H ARG A 414 20.782 5.394 -17.933 1.00 31.52 H new ATOM 0 HA ARG A 414 22.884 7.027 -16.890 1.00 11.13 H new ATOM 0 HB2 ARG A 414 21.012 7.827 -18.250 1.00 4.14 H new ATOM 0 HB3 ARG A 414 19.890 7.355 -16.989 1.00 4.14 H new ATOM 0 HG2 ARG A 414 20.826 9.003 -15.466 1.00 65.12 H new ATOM 0 HG3 ARG A 414 22.089 9.405 -16.612 1.00 65.12 H new ATOM 0 HD2 ARG A 414 19.112 9.685 -17.178 1.00 41.03 H new ATOM 0 HD3 ARG A 414 20.136 10.998 -16.632 1.00 41.03 H new ATOM 0 HE ARG A 414 21.407 10.835 -18.726 1.00 2.31 H new ATOM 0 HH11 ARG A 414 18.473 8.844 -18.674 1.00 43.34 H new ATOM 0 HH12 ARG A 414 18.265 8.923 -20.427 1.00 43.34 H new ATOM 0 HH21 ARG A 414 21.089 10.986 -20.937 1.00 61.04 H new ATOM 0 HH22 ARG A 414 19.745 10.133 -21.703 1.00 61.04 H new ATOM 913 N SER A 415 22.528 7.073 -14.443 1.00 51.13 N ATOM 914 CA SER A 415 22.621 6.839 -13.055 1.00 53.30 C ATOM 915 C SER A 415 22.778 8.174 -12.312 1.00 75.43 C ATOM 916 O SER A 415 23.066 9.215 -12.923 1.00 5.12 O ATOM 917 CB SER A 415 23.825 5.913 -12.834 1.00 72.44 C ATOM 918 OG SER A 415 24.009 5.583 -11.486 1.00 22.35 O ATOM 0 H SER A 415 23.105 7.845 -14.777 1.00 51.13 H new ATOM 0 HA SER A 415 21.721 6.365 -12.664 1.00 53.30 H new ATOM 0 HB2 SER A 415 23.687 5.000 -13.413 1.00 72.44 H new ATOM 0 HB3 SER A 415 24.725 6.397 -13.212 1.00 72.44 H new ATOM 0 HG SER A 415 24.941 5.748 -11.233 1.00 22.35 H new ATOM 924 N ALA A 416 22.567 8.144 -11.024 1.00 71.22 N ATOM 925 CA ALA A 416 22.662 9.300 -10.181 1.00 45.31 C ATOM 926 C ALA A 416 23.169 8.896 -8.811 1.00 4.44 C ATOM 927 O ALA A 416 22.679 7.934 -8.216 1.00 65.50 O ATOM 928 CB ALA A 416 21.305 9.970 -10.052 1.00 71.33 C ATOM 0 H ALA A 416 22.318 7.292 -10.521 1.00 71.22 H new ATOM 0 HA ALA A 416 23.361 10.006 -10.629 1.00 45.31 H new ATOM 0 HB1 ALA A 416 21.391 10.846 -9.409 1.00 71.33 H new ATOM 0 HB2 ALA A 416 20.955 10.276 -11.038 1.00 71.33 H new ATOM 0 HB3 ALA A 416 20.593 9.269 -9.616 1.00 71.33 H new ATOM 934 N ILE A 417 24.138 9.609 -8.327 1.00 52.25 N ATOM 935 CA ILE A 417 24.707 9.357 -7.027 1.00 54.52 C ATOM 936 C ILE A 417 24.416 10.581 -6.123 1.00 61.21 C ATOM 937 O ILE A 417 24.966 11.663 -6.317 1.00 23.13 O ATOM 938 CB ILE A 417 26.260 9.056 -7.150 1.00 43.11 C ATOM 939 CG1 ILE A 417 26.922 8.757 -5.810 1.00 72.31 C ATOM 940 CG2 ILE A 417 27.011 10.132 -7.888 1.00 53.01 C ATOM 941 CD1 ILE A 417 26.510 7.444 -5.218 1.00 32.01 C ATOM 0 H ILE A 417 24.565 10.391 -8.823 1.00 52.25 H new ATOM 0 HA ILE A 417 24.256 8.473 -6.576 1.00 54.52 H new ATOM 0 HB ILE A 417 26.319 8.147 -7.749 1.00 43.11 H new ATOM 0 HG12 ILE A 417 28.004 8.764 -5.939 1.00 72.31 H new ATOM 0 HG13 ILE A 417 26.679 9.555 -5.108 1.00 72.31 H new ATOM 0 HG21 ILE A 417 28.067 9.869 -7.939 1.00 53.01 H new ATOM 0 HG22 ILE A 417 26.612 10.227 -8.898 1.00 53.01 H new ATOM 0 HG23 ILE A 417 26.898 11.080 -7.362 1.00 53.01 H new ATOM 0 HD11 ILE A 417 27.020 7.298 -4.266 1.00 32.01 H new ATOM 0 HD12 ILE A 417 25.432 7.440 -5.057 1.00 32.01 H new ATOM 0 HD13 ILE A 417 26.778 6.637 -5.900 1.00 32.01 H new ATOM 953 N VAL A 418 23.522 10.413 -5.170 1.00 42.02 N ATOM 954 CA VAL A 418 23.095 11.528 -4.318 1.00 71.45 C ATOM 955 C VAL A 418 23.915 11.595 -3.048 1.00 10.40 C ATOM 956 O VAL A 418 23.824 10.724 -2.183 1.00 65.32 O ATOM 957 CB VAL A 418 21.561 11.466 -3.983 1.00 53.41 C ATOM 958 CG1 VAL A 418 21.135 12.539 -2.973 1.00 5.35 C ATOM 959 CG2 VAL A 418 20.736 11.615 -5.240 1.00 74.44 C ATOM 0 H VAL A 418 23.072 9.522 -4.959 1.00 42.02 H new ATOM 0 HA VAL A 418 23.268 12.441 -4.888 1.00 71.45 H new ATOM 0 HB VAL A 418 21.383 10.490 -3.532 1.00 53.41 H new ATOM 0 HG11 VAL A 418 20.066 12.451 -2.777 1.00 5.35 H new ATOM 0 HG12 VAL A 418 21.687 12.403 -2.043 1.00 5.35 H new ATOM 0 HG13 VAL A 418 21.349 13.527 -3.380 1.00 5.35 H new ATOM 0 HG21 VAL A 418 19.677 11.569 -4.987 1.00 74.44 H new ATOM 0 HG22 VAL A 418 20.956 12.574 -5.708 1.00 74.44 H new ATOM 0 HG23 VAL A 418 20.979 10.809 -5.932 1.00 74.44 H new ATOM 969 N THR A 419 24.712 12.623 -2.957 1.00 24.03 N ATOM 970 CA THR A 419 25.536 12.875 -1.820 1.00 61.35 C ATOM 971 C THR A 419 24.936 14.015 -1.030 1.00 33.04 C ATOM 972 O THR A 419 24.809 15.137 -1.547 1.00 5.52 O ATOM 973 CB THR A 419 26.959 13.286 -2.259 1.00 4.24 C ATOM 974 OG1 THR A 419 27.510 12.260 -3.107 1.00 62.41 O ATOM 975 CG2 THR A 419 27.850 13.453 -1.036 1.00 40.43 C ATOM 0 H THR A 419 24.805 13.323 -3.693 1.00 24.03 H new ATOM 0 HA THR A 419 25.594 11.967 -1.219 1.00 61.35 H new ATOM 0 HB THR A 419 26.908 14.230 -2.801 1.00 4.24 H new ATOM 0 HG1 THR A 419 28.412 12.518 -3.389 1.00 62.41 H new ATOM 0 HG21 THR A 419 28.852 13.743 -1.353 1.00 40.43 H new ATOM 0 HG22 THR A 419 27.437 14.225 -0.387 1.00 40.43 H new ATOM 0 HG23 THR A 419 27.900 12.510 -0.491 1.00 40.43 H new ATOM 983 N VAL A 420 24.552 13.764 0.191 1.00 52.13 N ATOM 984 CA VAL A 420 24.022 14.810 0.973 1.00 72.22 C ATOM 985 C VAL A 420 25.103 15.249 1.947 1.00 42.40 C ATOM 986 O VAL A 420 25.783 14.422 2.556 1.00 22.24 O ATOM 987 CB VAL A 420 22.736 14.379 1.723 1.00 64.13 C ATOM 988 CG1 VAL A 420 22.070 15.574 2.373 1.00 43.14 C ATOM 989 CG2 VAL A 420 21.765 13.678 0.784 1.00 61.44 C ATOM 0 H VAL A 420 24.601 12.853 0.648 1.00 52.13 H new ATOM 0 HA VAL A 420 23.730 15.638 0.327 1.00 72.22 H new ATOM 0 HB VAL A 420 23.024 13.675 2.503 1.00 64.13 H new ATOM 0 HG11 VAL A 420 21.169 15.250 2.894 1.00 43.14 H new ATOM 0 HG12 VAL A 420 22.757 16.030 3.086 1.00 43.14 H new ATOM 0 HG13 VAL A 420 21.804 16.303 1.608 1.00 43.14 H new ATOM 0 HG21 VAL A 420 20.872 13.386 1.336 1.00 61.44 H new ATOM 0 HG22 VAL A 420 21.487 14.355 -0.024 1.00 61.44 H new ATOM 0 HG23 VAL A 420 22.240 12.790 0.366 1.00 61.44 H new ATOM 999 N GLU A 421 25.314 16.518 2.049 1.00 72.13 N ATOM 1000 CA GLU A 421 26.317 17.031 2.954 1.00 63.34 C ATOM 1001 C GLU A 421 25.704 17.779 4.130 1.00 32.25 C ATOM 1002 O GLU A 421 26.404 18.406 4.933 1.00 14.32 O ATOM 1003 CB GLU A 421 27.367 17.827 2.188 1.00 23.22 C ATOM 1004 CG GLU A 421 26.827 18.876 1.233 1.00 72.23 C ATOM 1005 CD GLU A 421 27.945 19.484 0.427 1.00 63.21 C ATOM 1006 OE1 GLU A 421 28.388 18.860 -0.566 1.00 63.15 O ATOM 1007 OE2 GLU A 421 28.419 20.578 0.788 1.00 40.44 O ATOM 0 H GLU A 421 24.810 17.230 1.520 1.00 72.13 H new ATOM 0 HA GLU A 421 26.838 16.189 3.410 1.00 63.34 H new ATOM 0 HB2 GLU A 421 28.021 18.319 2.908 1.00 23.22 H new ATOM 0 HB3 GLU A 421 27.984 17.129 1.622 1.00 23.22 H new ATOM 0 HG2 GLU A 421 26.094 18.424 0.565 1.00 72.23 H new ATOM 0 HG3 GLU A 421 26.310 19.655 1.794 1.00 72.23 H new ATOM 1014 N CYS A 422 24.391 17.640 4.239 1.00 24.05 N ATOM 1015 CA CYS A 422 23.567 18.223 5.303 1.00 44.12 C ATOM 1016 C CYS A 422 23.592 19.765 5.320 1.00 71.00 C ATOM 1017 O CYS A 422 24.541 20.403 4.865 1.00 20.34 O ATOM 1018 CB CYS A 422 23.901 17.623 6.689 1.00 22.10 C ATOM 1019 SG CYS A 422 22.834 18.230 8.035 1.00 71.24 S ATOM 0 H CYS A 422 23.845 17.100 3.568 1.00 24.05 H new ATOM 0 HA CYS A 422 22.539 17.946 5.068 1.00 44.12 H new ATOM 0 HB2 CYS A 422 23.817 16.538 6.634 1.00 22.10 H new ATOM 0 HB3 CYS A 422 24.939 17.850 6.931 1.00 22.10 H new ATOM 1024 N GLY A 423 22.534 20.343 5.813 1.00 2.44 N ATOM 1025 CA GLY A 423 22.416 21.770 5.863 1.00 10.04 C ATOM 1026 C GLY A 423 21.264 22.168 6.729 1.00 35.13 C ATOM 1027 O GLY A 423 20.821 21.385 7.543 1.00 12.14 O ATOM 0 H GLY A 423 21.732 19.839 6.190 1.00 2.44 H new ATOM 0 HA2 GLY A 423 23.338 22.204 6.251 1.00 10.04 H new ATOM 0 HA3 GLY A 423 22.276 22.165 4.857 1.00 10.04 H new ATOM 1031 N VAL A 424 20.776 23.363 6.547 1.00 3.32 N ATOM 1032 CA VAL A 424 19.645 23.866 7.317 1.00 53.14 C ATOM 1033 C VAL A 424 18.357 23.695 6.502 1.00 41.13 C ATOM 1034 O VAL A 424 17.252 23.697 7.036 1.00 14.53 O ATOM 1035 CB VAL A 424 19.862 25.371 7.674 1.00 65.12 C ATOM 1036 CG1 VAL A 424 18.724 25.932 8.515 1.00 71.21 C ATOM 1037 CG2 VAL A 424 21.186 25.551 8.393 1.00 32.23 C ATOM 0 H VAL A 424 21.143 24.025 5.863 1.00 3.32 H new ATOM 0 HA VAL A 424 19.561 23.300 8.245 1.00 53.14 H new ATOM 0 HB VAL A 424 19.878 25.930 6.738 1.00 65.12 H new ATOM 0 HG11 VAL A 424 18.919 26.981 8.738 1.00 71.21 H new ATOM 0 HG12 VAL A 424 17.788 25.847 7.964 1.00 71.21 H new ATOM 0 HG13 VAL A 424 18.649 25.371 9.446 1.00 71.21 H new ATOM 0 HG21 VAL A 424 21.327 26.604 8.637 1.00 32.23 H new ATOM 0 HG22 VAL A 424 21.185 24.963 9.311 1.00 32.23 H new ATOM 0 HG23 VAL A 424 21.999 25.216 7.748 1.00 32.23 H new ATOM 1047 N GLU A 425 18.530 23.490 5.224 1.00 4.31 N ATOM 1048 CA GLU A 425 17.446 23.366 4.289 1.00 51.13 C ATOM 1049 C GLU A 425 17.836 22.379 3.257 1.00 72.34 C ATOM 1050 O GLU A 425 19.028 22.082 3.086 1.00 54.11 O ATOM 1051 CB GLU A 425 17.161 24.721 3.644 1.00 33.35 C ATOM 1052 CG GLU A 425 18.343 25.302 2.876 1.00 73.32 C ATOM 1053 CD GLU A 425 18.052 26.655 2.298 1.00 54.15 C ATOM 1054 OE1 GLU A 425 17.391 26.734 1.256 1.00 3.22 O ATOM 1055 OE2 GLU A 425 18.484 27.678 2.891 1.00 33.15 O ATOM 0 H GLU A 425 19.451 23.403 4.795 1.00 4.31 H new ATOM 0 HA GLU A 425 16.542 23.033 4.799 1.00 51.13 H new ATOM 0 HB2 GLU A 425 16.315 24.618 2.965 1.00 33.35 H new ATOM 0 HB3 GLU A 425 16.863 25.426 4.420 1.00 33.35 H new ATOM 0 HG2 GLU A 425 19.203 25.374 3.542 1.00 73.32 H new ATOM 0 HG3 GLU A 425 18.618 24.620 2.072 1.00 73.32 H new ATOM 1062 N ASN A 426 16.864 21.846 2.613 1.00 32.43 N ATOM 1063 CA ASN A 426 17.076 20.913 1.569 1.00 5.01 C ATOM 1064 C ASN A 426 17.148 21.606 0.236 1.00 33.10 C ATOM 1065 O ASN A 426 16.188 22.224 -0.216 1.00 64.44 O ATOM 1066 CB ASN A 426 16.025 19.786 1.574 1.00 13.32 C ATOM 1067 CG ASN A 426 14.594 20.271 1.720 1.00 0.04 C ATOM 1068 OD1 ASN A 426 14.064 20.327 2.816 1.00 25.45 O ATOM 1069 ND2 ASN A 426 14.015 20.677 0.657 1.00 72.33 N ATOM 0 H ASN A 426 15.882 22.049 2.799 1.00 32.43 H new ATOM 0 HA ASN A 426 18.039 20.436 1.748 1.00 5.01 H new ATOM 0 HB2 ASN A 426 16.112 19.219 0.647 1.00 13.32 H new ATOM 0 HB3 ASN A 426 16.249 19.099 2.390 1.00 13.32 H new ATOM 0 HD21 ASN A 426 13.073 21.066 0.706 1.00 72.33 H new ATOM 0 HD22 ASN A 426 14.494 20.612 -0.241 1.00 72.33 H new ATOM 1076 N GLU A 427 18.286 21.530 -0.384 1.00 14.22 N ATOM 1077 CA GLU A 427 18.470 22.111 -1.670 1.00 34.51 C ATOM 1078 C GLU A 427 19.509 21.333 -2.419 1.00 0.51 C ATOM 1079 O GLU A 427 20.377 20.680 -1.808 1.00 21.50 O ATOM 1080 CB GLU A 427 18.864 23.594 -1.605 1.00 1.34 C ATOM 1081 CG GLU A 427 20.225 23.875 -1.007 1.00 43.02 C ATOM 1082 CD GLU A 427 20.579 25.331 -1.099 1.00 1.44 C ATOM 1083 OE1 GLU A 427 20.735 25.843 -2.223 1.00 0.42 O ATOM 1084 OE2 GLU A 427 20.727 25.985 -0.069 1.00 13.33 O ATOM 0 H GLU A 427 19.111 21.062 -0.009 1.00 14.22 H new ATOM 0 HA GLU A 427 17.513 22.066 -2.190 1.00 34.51 H new ATOM 0 HB2 GLU A 427 18.837 24.005 -2.614 1.00 1.34 H new ATOM 0 HB3 GLU A 427 18.112 24.128 -1.023 1.00 1.34 H new ATOM 0 HG2 GLU A 427 20.236 23.563 0.037 1.00 43.02 H new ATOM 0 HG3 GLU A 427 20.980 23.283 -1.525 1.00 43.02 H new ATOM 1091 N ILE A 428 19.404 21.362 -3.708 1.00 42.34 N ATOM 1092 CA ILE A 428 20.358 20.725 -4.570 1.00 12.55 C ATOM 1093 C ILE A 428 21.442 21.738 -4.874 1.00 72.42 C ATOM 1094 O ILE A 428 21.160 22.807 -5.404 1.00 45.14 O ATOM 1095 CB ILE A 428 19.678 20.288 -5.881 1.00 71.33 C ATOM 1096 CG1 ILE A 428 18.414 19.481 -5.554 1.00 64.10 C ATOM 1097 CG2 ILE A 428 20.641 19.477 -6.750 1.00 11.33 C ATOM 1098 CD1 ILE A 428 17.593 19.067 -6.754 1.00 5.21 C ATOM 0 H ILE A 428 18.646 21.833 -4.202 1.00 42.34 H new ATOM 0 HA ILE A 428 20.775 19.840 -4.089 1.00 12.55 H new ATOM 0 HB ILE A 428 19.394 21.173 -6.450 1.00 71.33 H new ATOM 0 HG12 ILE A 428 18.705 18.585 -5.005 1.00 64.10 H new ATOM 0 HG13 ILE A 428 17.785 20.073 -4.889 1.00 64.10 H new ATOM 0 HG21 ILE A 428 20.138 19.180 -7.670 1.00 11.33 H new ATOM 0 HG22 ILE A 428 21.512 20.085 -6.993 1.00 11.33 H new ATOM 0 HG23 ILE A 428 20.960 18.587 -6.207 1.00 11.33 H new ATOM 0 HD11 ILE A 428 16.722 18.502 -6.422 1.00 5.21 H new ATOM 0 HD12 ILE A 428 17.265 19.955 -7.295 1.00 5.21 H new ATOM 0 HD13 ILE A 428 18.199 18.445 -7.412 1.00 5.21 H new ATOM 1110 N VAL A 429 22.654 21.411 -4.525 1.00 12.53 N ATOM 1111 CA VAL A 429 23.760 22.314 -4.700 1.00 63.53 C ATOM 1112 C VAL A 429 24.222 22.289 -6.148 1.00 45.20 C ATOM 1113 O VAL A 429 24.126 23.296 -6.867 1.00 51.22 O ATOM 1114 CB VAL A 429 24.950 21.947 -3.762 1.00 40.34 C ATOM 1115 CG1 VAL A 429 26.094 22.950 -3.905 1.00 64.55 C ATOM 1116 CG2 VAL A 429 24.489 21.859 -2.310 1.00 51.24 C ATOM 0 H VAL A 429 22.905 20.513 -4.112 1.00 12.53 H new ATOM 0 HA VAL A 429 23.420 23.316 -4.439 1.00 63.53 H new ATOM 0 HB VAL A 429 25.322 20.968 -4.063 1.00 40.34 H new ATOM 0 HG11 VAL A 429 26.910 22.669 -3.239 1.00 64.55 H new ATOM 0 HG12 VAL A 429 26.450 22.951 -4.935 1.00 64.55 H new ATOM 0 HG13 VAL A 429 25.739 23.947 -3.643 1.00 64.55 H new ATOM 0 HG21 VAL A 429 25.336 21.602 -1.674 1.00 51.24 H new ATOM 0 HG22 VAL A 429 24.081 22.821 -1.999 1.00 51.24 H new ATOM 0 HG23 VAL A 429 23.720 21.092 -2.218 1.00 51.24 H new ATOM 1126 N SER A 430 24.693 21.140 -6.581 1.00 31.55 N ATOM 1127 CA SER A 430 25.211 20.978 -7.916 1.00 41.31 C ATOM 1128 C SER A 430 25.030 19.539 -8.372 1.00 31.53 C ATOM 1129 O SER A 430 24.836 18.636 -7.546 1.00 11.41 O ATOM 1130 CB SER A 430 26.708 21.314 -7.932 1.00 22.42 C ATOM 1131 OG SER A 430 26.957 22.626 -7.453 1.00 12.50 O ATOM 0 H SER A 430 24.726 20.293 -6.014 1.00 31.55 H new ATOM 0 HA SER A 430 24.670 21.647 -8.586 1.00 41.31 H new ATOM 0 HB2 SER A 430 27.249 20.594 -7.318 1.00 22.42 H new ATOM 0 HB3 SER A 430 27.091 21.219 -8.948 1.00 22.42 H new ATOM 0 HG SER A 430 27.920 22.805 -7.476 1.00 12.50 H new ATOM 1137 N VAL A 431 25.077 19.340 -9.667 1.00 0.32 N ATOM 1138 CA VAL A 431 25.020 18.029 -10.261 1.00 75.22 C ATOM 1139 C VAL A 431 25.960 17.988 -11.469 1.00 44.01 C ATOM 1140 O VAL A 431 25.996 18.933 -12.269 1.00 65.25 O ATOM 1141 CB VAL A 431 23.579 17.608 -10.676 1.00 10.11 C ATOM 1142 CG1 VAL A 431 23.010 18.515 -11.750 1.00 12.11 C ATOM 1143 CG2 VAL A 431 23.567 16.161 -11.118 1.00 14.53 C ATOM 0 H VAL A 431 25.157 20.096 -10.347 1.00 0.32 H new ATOM 0 HA VAL A 431 25.339 17.310 -9.507 1.00 75.22 H new ATOM 0 HB VAL A 431 22.934 17.713 -9.803 1.00 10.11 H new ATOM 0 HG11 VAL A 431 22.004 18.185 -12.009 1.00 12.11 H new ATOM 0 HG12 VAL A 431 22.972 19.539 -11.379 1.00 12.11 H new ATOM 0 HG13 VAL A 431 23.645 18.474 -12.635 1.00 12.11 H new ATOM 0 HG21 VAL A 431 22.555 15.877 -11.406 1.00 14.53 H new ATOM 0 HG22 VAL A 431 24.235 16.035 -11.970 1.00 14.53 H new ATOM 0 HG23 VAL A 431 23.902 15.527 -10.297 1.00 14.53 H new ATOM 1153 N LEU A 432 26.763 16.964 -11.564 1.00 14.54 N ATOM 1154 CA LEU A 432 27.675 16.834 -12.684 1.00 44.32 C ATOM 1155 C LEU A 432 27.711 15.407 -13.210 1.00 34.22 C ATOM 1156 O LEU A 432 27.942 14.469 -12.442 1.00 73.52 O ATOM 1157 CB LEU A 432 29.089 17.282 -12.276 1.00 64.13 C ATOM 1158 CG LEU A 432 30.170 17.223 -13.368 1.00 23.11 C ATOM 1159 CD1 LEU A 432 29.829 18.148 -14.528 1.00 52.53 C ATOM 1160 CD2 LEU A 432 31.527 17.571 -12.791 1.00 53.25 C ATOM 0 H LEU A 432 26.810 16.205 -10.884 1.00 14.54 H new ATOM 0 HA LEU A 432 27.312 17.479 -13.484 1.00 44.32 H new ATOM 0 HB2 LEU A 432 29.030 18.307 -11.910 1.00 64.13 H new ATOM 0 HB3 LEU A 432 29.415 16.663 -11.440 1.00 64.13 H new ATOM 0 HG LEU A 432 30.206 16.203 -13.751 1.00 23.11 H new ATOM 0 HD11 LEU A 432 30.611 18.086 -15.285 1.00 52.53 H new ATOM 0 HD12 LEU A 432 28.876 17.848 -14.965 1.00 52.53 H new ATOM 0 HD13 LEU A 432 29.755 19.174 -14.166 1.00 52.53 H new ATOM 0 HD21 LEU A 432 32.280 17.524 -13.578 1.00 53.25 H new ATOM 0 HD22 LEU A 432 31.498 18.578 -12.376 1.00 53.25 H new ATOM 0 HD23 LEU A 432 31.781 16.861 -12.004 1.00 53.25 H new ATOM 1172 N GLU A 433 27.472 15.228 -14.493 1.00 44.12 N ATOM 1173 CA GLU A 433 27.667 13.925 -15.102 1.00 1.41 C ATOM 1174 C GLU A 433 29.148 13.751 -15.378 1.00 42.43 C ATOM 1175 O GLU A 433 29.666 14.215 -16.400 1.00 1.24 O ATOM 1176 CB GLU A 433 26.846 13.754 -16.393 1.00 0.24 C ATOM 1177 CG GLU A 433 27.082 12.431 -17.122 1.00 41.04 C ATOM 1178 CD GLU A 433 26.269 12.306 -18.393 1.00 54.34 C ATOM 1179 OE1 GLU A 433 26.410 13.167 -19.292 1.00 43.32 O ATOM 1180 OE2 GLU A 433 25.506 11.340 -18.531 1.00 3.42 O ATOM 0 H GLU A 433 27.147 15.956 -15.129 1.00 44.12 H new ATOM 0 HA GLU A 433 27.314 13.156 -14.415 1.00 1.41 H new ATOM 0 HB2 GLU A 433 25.787 13.836 -16.149 1.00 0.24 H new ATOM 0 HB3 GLU A 433 27.082 14.575 -17.070 1.00 0.24 H new ATOM 0 HG2 GLU A 433 28.141 12.339 -17.363 1.00 41.04 H new ATOM 0 HG3 GLU A 433 26.834 11.605 -16.455 1.00 41.04 H new ATOM 1187 N ALA A 434 29.833 13.175 -14.428 1.00 14.45 N ATOM 1188 CA ALA A 434 31.259 12.952 -14.544 1.00 1.13 C ATOM 1189 C ALA A 434 31.557 11.480 -14.691 1.00 43.10 C ATOM 1190 O ALA A 434 32.568 11.093 -15.281 1.00 34.21 O ATOM 1191 CB ALA A 434 31.987 13.520 -13.335 1.00 73.42 C ATOM 0 H ALA A 434 29.426 12.846 -13.553 1.00 14.45 H new ATOM 0 HA ALA A 434 31.614 13.467 -15.437 1.00 1.13 H new ATOM 0 HB1 ALA A 434 33.058 13.344 -13.439 1.00 73.42 H new ATOM 0 HB2 ALA A 434 31.801 14.592 -13.269 1.00 73.42 H new ATOM 0 HB3 ALA A 434 31.625 13.032 -12.430 1.00 73.42 H new ATOM 1197 N GLN A 435 30.676 10.657 -14.168 1.00 12.12 N ATOM 1198 CA GLN A 435 30.848 9.230 -14.233 1.00 14.20 C ATOM 1199 C GLN A 435 29.965 8.677 -15.345 1.00 61.55 C ATOM 1200 O GLN A 435 29.190 9.428 -15.918 1.00 74.33 O ATOM 1201 CB GLN A 435 30.518 8.577 -12.882 1.00 11.34 C ATOM 1202 CG GLN A 435 31.377 9.064 -11.720 1.00 13.41 C ATOM 1203 CD GLN A 435 31.172 8.244 -10.455 1.00 10.22 C ATOM 1204 OE1 GLN A 435 31.876 7.263 -10.220 1.00 12.33 O ATOM 1205 NE2 GLN A 435 30.218 8.620 -9.646 1.00 13.02 N ATOM 0 H GLN A 435 29.827 10.959 -13.690 1.00 12.12 H new ATOM 0 HA GLN A 435 31.890 8.998 -14.455 1.00 14.20 H new ATOM 0 HB2 GLN A 435 29.470 8.766 -12.647 1.00 11.34 H new ATOM 0 HB3 GLN A 435 30.634 7.497 -12.976 1.00 11.34 H new ATOM 0 HG2 GLN A 435 32.427 9.024 -12.008 1.00 13.41 H new ATOM 0 HG3 GLN A 435 31.143 10.108 -11.513 1.00 13.41 H new ATOM 0 HE21 GLN A 435 29.652 9.438 -9.870 1.00 13.02 H new ATOM 0 HE22 GLN A 435 30.039 8.095 -8.790 1.00 13.02 H new ATOM 1214 N LYS A 436 30.085 7.376 -15.628 1.00 71.32 N ATOM 1215 CA LYS A 436 29.336 6.684 -16.719 1.00 21.54 C ATOM 1216 C LYS A 436 27.801 6.941 -16.752 1.00 73.21 C ATOM 1217 O LYS A 436 27.022 6.189 -16.196 1.00 41.43 O ATOM 1218 CB LYS A 436 29.712 5.169 -16.791 1.00 11.13 C ATOM 1219 CG LYS A 436 29.846 4.422 -15.425 1.00 10.54 C ATOM 1220 CD LYS A 436 28.563 4.390 -14.598 1.00 42.33 C ATOM 1221 CE LYS A 436 28.752 3.649 -13.280 1.00 62.11 C ATOM 1222 NZ LYS A 436 29.716 4.320 -12.365 1.00 23.35 N ATOM 0 H LYS A 436 30.707 6.755 -15.110 1.00 71.32 H new ATOM 0 HA LYS A 436 29.675 7.158 -17.640 1.00 21.54 H new ATOM 0 HB2 LYS A 436 28.957 4.657 -17.388 1.00 11.13 H new ATOM 0 HB3 LYS A 436 30.657 5.076 -17.326 1.00 11.13 H new ATOM 0 HG2 LYS A 436 30.168 3.398 -15.614 1.00 10.54 H new ATOM 0 HG3 LYS A 436 30.631 4.900 -14.838 1.00 10.54 H new ATOM 0 HD2 LYS A 436 28.236 5.410 -14.397 1.00 42.33 H new ATOM 0 HD3 LYS A 436 27.772 3.909 -15.174 1.00 42.33 H new ATOM 0 HE2 LYS A 436 27.788 3.559 -12.779 1.00 62.11 H new ATOM 0 HE3 LYS A 436 29.100 2.637 -13.486 1.00 62.11 H new ATOM 0 HZ1 LYS A 436 29.764 3.797 -11.467 1.00 23.35 H new ATOM 0 HZ2 LYS A 436 30.658 4.338 -12.806 1.00 23.35 H new ATOM 0 HZ3 LYS A 436 29.401 5.294 -12.182 1.00 23.35 H new ATOM 1236 N CYS A 437 27.398 8.050 -17.402 1.00 53.04 N ATOM 1237 CA CYS A 437 25.983 8.506 -17.453 1.00 51.44 C ATOM 1238 C CYS A 437 25.465 8.726 -16.044 1.00 74.00 C ATOM 1239 O CYS A 437 24.257 8.785 -15.800 1.00 64.22 O ATOM 1240 CB CYS A 437 25.091 7.492 -18.174 1.00 41.24 C ATOM 1241 SG CYS A 437 25.546 7.164 -19.900 1.00 54.12 S ATOM 0 H CYS A 437 28.040 8.660 -17.909 1.00 53.04 H new ATOM 0 HA CYS A 437 25.952 9.441 -18.012 1.00 51.44 H new ATOM 0 HB2 CYS A 437 25.115 6.552 -17.622 1.00 41.24 H new ATOM 0 HB3 CYS A 437 24.062 7.851 -18.147 1.00 41.24 H new ATOM 1246 N GLU A 438 26.388 8.900 -15.140 1.00 70.31 N ATOM 1247 CA GLU A 438 26.097 8.962 -13.769 1.00 24.22 C ATOM 1248 C GLU A 438 26.350 10.352 -13.235 1.00 2.20 C ATOM 1249 O GLU A 438 27.473 10.896 -13.316 1.00 20.01 O ATOM 1250 CB GLU A 438 26.884 7.866 -13.061 1.00 64.25 C ATOM 1251 CG GLU A 438 26.678 7.753 -11.578 1.00 5.13 C ATOM 1252 CD GLU A 438 27.264 6.458 -11.055 1.00 21.34 C ATOM 1253 OE1 GLU A 438 28.504 6.319 -11.026 1.00 41.11 O ATOM 1254 OE2 GLU A 438 26.488 5.550 -10.683 1.00 62.21 O ATOM 0 H GLU A 438 27.379 9.003 -15.359 1.00 70.31 H new ATOM 0 HA GLU A 438 25.040 8.776 -13.580 1.00 24.22 H new ATOM 0 HB2 GLU A 438 26.625 6.910 -13.516 1.00 64.25 H new ATOM 0 HB3 GLU A 438 27.945 8.031 -13.248 1.00 64.25 H new ATOM 0 HG2 GLU A 438 27.146 8.599 -11.075 1.00 5.13 H new ATOM 0 HG3 GLU A 438 25.613 7.795 -11.349 1.00 5.13 H new ATOM 1261 N TYR A 439 25.306 10.910 -12.705 1.00 51.41 N ATOM 1262 CA TYR A 439 25.275 12.265 -12.245 1.00 14.54 C ATOM 1263 C TYR A 439 25.577 12.374 -10.773 1.00 62.34 C ATOM 1264 O TYR A 439 24.942 11.723 -9.940 1.00 30.55 O ATOM 1265 CB TYR A 439 23.904 12.879 -12.574 1.00 72.42 C ATOM 1266 CG TYR A 439 23.671 13.082 -14.054 1.00 54.41 C ATOM 1267 CD1 TYR A 439 23.362 12.015 -14.887 1.00 11.24 C ATOM 1268 CD2 TYR A 439 23.762 14.347 -14.616 1.00 73.02 C ATOM 1269 CE1 TYR A 439 23.155 12.209 -16.239 1.00 2.10 C ATOM 1270 CE2 TYR A 439 23.553 14.548 -15.960 1.00 62.55 C ATOM 1271 CZ TYR A 439 23.252 13.481 -16.768 1.00 42.42 C ATOM 1272 OH TYR A 439 23.060 13.685 -18.119 1.00 2.20 O ATOM 0 H TYR A 439 24.422 10.418 -12.576 1.00 51.41 H new ATOM 0 HA TYR A 439 26.058 12.821 -12.761 1.00 14.54 H new ATOM 0 HB2 TYR A 439 23.121 12.233 -12.177 1.00 72.42 H new ATOM 0 HB3 TYR A 439 23.814 13.839 -12.065 1.00 72.42 H new ATOM 0 HD1 TYR A 439 23.282 11.021 -14.473 1.00 11.24 H new ATOM 0 HD2 TYR A 439 24.002 15.190 -13.986 1.00 73.02 H new ATOM 0 HE1 TYR A 439 22.919 11.371 -16.878 1.00 2.10 H new ATOM 0 HE2 TYR A 439 23.625 15.541 -16.378 1.00 62.55 H new ATOM 0 HH TYR A 439 23.163 14.638 -18.324 1.00 2.20 H new ATOM 1282 N LEU A 440 26.563 13.188 -10.468 1.00 64.41 N ATOM 1283 CA LEU A 440 26.972 13.468 -9.105 1.00 73.45 C ATOM 1284 C LEU A 440 26.013 14.482 -8.542 1.00 3.31 C ATOM 1285 O LEU A 440 26.048 15.632 -8.951 1.00 63.02 O ATOM 1286 CB LEU A 440 28.389 14.087 -9.080 1.00 20.04 C ATOM 1287 CG LEU A 440 29.517 13.317 -9.784 1.00 52.11 C ATOM 1288 CD1 LEU A 440 30.824 14.086 -9.685 1.00 55.21 C ATOM 1289 CD2 LEU A 440 29.680 11.934 -9.203 1.00 42.44 C ATOM 0 H LEU A 440 27.113 13.683 -11.170 1.00 64.41 H new ATOM 0 HA LEU A 440 26.975 12.543 -8.528 1.00 73.45 H new ATOM 0 HB2 LEU A 440 28.330 15.079 -9.528 1.00 20.04 H new ATOM 0 HB3 LEU A 440 28.677 14.225 -8.038 1.00 20.04 H new ATOM 0 HG LEU A 440 29.246 13.212 -10.835 1.00 52.11 H new ATOM 0 HD11 LEU A 440 31.614 13.528 -10.188 1.00 55.21 H new ATOM 0 HD12 LEU A 440 30.710 15.061 -10.159 1.00 55.21 H new ATOM 0 HD13 LEU A 440 31.088 14.222 -8.636 1.00 55.21 H new ATOM 0 HD21 LEU A 440 30.485 11.414 -9.722 1.00 42.44 H new ATOM 0 HD22 LEU A 440 29.921 12.011 -8.143 1.00 42.44 H new ATOM 0 HD23 LEU A 440 28.751 11.377 -9.324 1.00 42.44 H new ATOM 1301 N ILE A 441 25.153 14.078 -7.652 1.00 32.03 N ATOM 1302 CA ILE A 441 24.179 14.992 -7.121 1.00 65.14 C ATOM 1303 C ILE A 441 24.571 15.389 -5.722 1.00 61.44 C ATOM 1304 O ILE A 441 24.699 14.542 -4.846 1.00 12.12 O ATOM 1305 CB ILE A 441 22.754 14.376 -7.063 1.00 43.54 C ATOM 1306 CG1 ILE A 441 22.405 13.693 -8.384 1.00 64.01 C ATOM 1307 CG2 ILE A 441 21.724 15.461 -6.730 1.00 11.11 C ATOM 1308 CD1 ILE A 441 20.991 13.184 -8.466 1.00 23.42 C ATOM 0 H ILE A 441 25.105 13.130 -7.280 1.00 32.03 H new ATOM 0 HA ILE A 441 24.156 15.853 -7.789 1.00 65.14 H new ATOM 0 HB ILE A 441 22.735 13.621 -6.277 1.00 43.54 H new ATOM 0 HG12 ILE A 441 22.572 14.398 -9.199 1.00 64.01 H new ATOM 0 HG13 ILE A 441 23.088 12.858 -8.539 1.00 64.01 H new ATOM 0 HG21 ILE A 441 20.729 15.018 -6.692 1.00 11.11 H new ATOM 0 HG22 ILE A 441 21.962 15.904 -5.763 1.00 11.11 H new ATOM 0 HG23 ILE A 441 21.748 16.234 -7.498 1.00 11.11 H new ATOM 0 HD11 ILE A 441 20.829 12.714 -9.436 1.00 23.42 H new ATOM 0 HD12 ILE A 441 20.821 12.453 -7.676 1.00 23.42 H new ATOM 0 HD13 ILE A 441 20.297 14.016 -8.346 1.00 23.42 H new ATOM 1320 N LYS A 442 24.784 16.648 -5.518 1.00 32.33 N ATOM 1321 CA LYS A 442 25.060 17.153 -4.207 1.00 74.40 C ATOM 1322 C LYS A 442 23.898 17.899 -3.657 1.00 75.11 C ATOM 1323 O LYS A 442 23.326 18.763 -4.325 1.00 62.03 O ATOM 1324 CB LYS A 442 26.301 18.009 -4.157 1.00 23.25 C ATOM 1325 CG LYS A 442 27.584 17.230 -3.948 1.00 21.41 C ATOM 1326 CD LYS A 442 28.747 18.179 -3.816 1.00 1.02 C ATOM 1327 CE LYS A 442 30.007 17.492 -3.316 1.00 4.04 C ATOM 1328 NZ LYS A 442 29.814 16.935 -1.952 1.00 33.52 N ATOM 0 H LYS A 442 24.772 17.357 -6.252 1.00 32.33 H new ATOM 0 HA LYS A 442 25.245 16.279 -3.582 1.00 74.40 H new ATOM 0 HB2 LYS A 442 26.378 18.572 -5.087 1.00 23.25 H new ATOM 0 HB3 LYS A 442 26.195 18.736 -3.352 1.00 23.25 H new ATOM 0 HG2 LYS A 442 27.503 16.614 -3.053 1.00 21.41 H new ATOM 0 HG3 LYS A 442 27.749 16.554 -4.787 1.00 21.41 H new ATOM 0 HD2 LYS A 442 28.948 18.639 -4.784 1.00 1.02 H new ATOM 0 HD3 LYS A 442 28.479 18.983 -3.130 1.00 1.02 H new ATOM 0 HE2 LYS A 442 30.284 16.692 -4.002 1.00 4.04 H new ATOM 0 HE3 LYS A 442 30.833 18.204 -3.307 1.00 4.04 H new ATOM 0 HZ1 LYS A 442 30.727 16.909 -1.455 1.00 33.52 H new ATOM 0 HZ2 LYS A 442 29.149 17.535 -1.423 1.00 33.52 H new ATOM 0 HZ3 LYS A 442 29.430 15.971 -2.022 1.00 33.52 H new ATOM 1342 N MET A 443 23.546 17.578 -2.449 1.00 31.31 N ATOM 1343 CA MET A 443 22.448 18.192 -1.785 1.00 24.33 C ATOM 1344 C MET A 443 22.780 18.358 -0.350 1.00 43.51 C ATOM 1345 O MET A 443 23.791 17.845 0.132 1.00 53.13 O ATOM 1346 CB MET A 443 21.189 17.331 -1.857 1.00 42.25 C ATOM 1347 CG MET A 443 20.668 17.038 -3.238 1.00 21.11 C ATOM 1348 SD MET A 443 19.139 16.115 -3.180 1.00 35.34 S ATOM 1349 CE MET A 443 18.084 17.263 -2.293 1.00 64.31 C ATOM 0 H MET A 443 24.025 16.870 -1.892 1.00 31.31 H new ATOM 0 HA MET A 443 22.263 19.147 -2.276 1.00 24.33 H new ATOM 0 HB2 MET A 443 21.392 16.383 -1.358 1.00 42.25 H new ATOM 0 HB3 MET A 443 20.401 17.827 -1.291 1.00 42.25 H new ATOM 0 HG2 MET A 443 20.509 17.974 -3.774 1.00 21.11 H new ATOM 0 HG3 MET A 443 21.414 16.473 -3.797 1.00 21.11 H new ATOM 0 HE1 MET A 443 17.041 17.059 -2.534 1.00 64.31 H new ATOM 0 HE2 MET A 443 18.239 17.145 -1.221 1.00 64.31 H new ATOM 0 HE3 MET A 443 18.330 18.284 -2.585 1.00 64.31 H new ATOM 1359 N LYS A 444 21.951 19.050 0.327 1.00 62.45 N ATOM 1360 CA LYS A 444 22.059 19.201 1.725 1.00 1.23 C ATOM 1361 C LYS A 444 20.665 19.273 2.287 1.00 71.51 C ATOM 1362 O LYS A 444 19.761 19.733 1.602 1.00 54.15 O ATOM 1363 CB LYS A 444 22.896 20.428 2.088 1.00 4.11 C ATOM 1364 CG LYS A 444 22.381 21.735 1.594 1.00 30.25 C ATOM 1365 CD LYS A 444 23.379 22.802 1.910 1.00 43.41 C ATOM 1366 CE LYS A 444 22.817 24.188 1.647 1.00 3.00 C ATOM 1367 NZ LYS A 444 23.784 25.256 1.974 1.00 2.01 N ATOM 0 H LYS A 444 21.157 19.541 -0.084 1.00 62.45 H new ATOM 0 HA LYS A 444 22.581 18.349 2.161 1.00 1.23 H new ATOM 0 HB2 LYS A 444 22.979 20.479 3.174 1.00 4.11 H new ATOM 0 HB3 LYS A 444 23.904 20.285 1.697 1.00 4.11 H new ATOM 0 HG2 LYS A 444 22.207 21.689 0.519 1.00 30.25 H new ATOM 0 HG3 LYS A 444 21.424 21.964 2.063 1.00 30.25 H new ATOM 0 HD2 LYS A 444 23.679 22.723 2.955 1.00 43.41 H new ATOM 0 HD3 LYS A 444 24.276 22.652 1.309 1.00 43.41 H new ATOM 0 HE2 LYS A 444 22.531 24.269 0.598 1.00 3.00 H new ATOM 0 HE3 LYS A 444 21.911 24.328 2.236 1.00 3.00 H new ATOM 0 HZ1 LYS A 444 23.356 26.184 1.778 1.00 2.01 H new ATOM 0 HZ2 LYS A 444 24.039 25.197 2.981 1.00 2.01 H new ATOM 0 HZ3 LYS A 444 24.639 25.140 1.393 1.00 2.01 H new ATOM 1381 N SER A 445 20.477 18.748 3.473 1.00 22.20 N ATOM 1382 CA SER A 445 19.190 18.729 4.152 1.00 75.31 C ATOM 1383 C SER A 445 19.472 18.615 5.646 1.00 50.02 C ATOM 1384 O SER A 445 20.441 17.961 6.018 1.00 32.13 O ATOM 1385 CB SER A 445 18.379 17.503 3.685 1.00 12.14 C ATOM 1386 OG SER A 445 18.219 17.504 2.275 1.00 4.14 O ATOM 0 H SER A 445 21.226 18.311 4.010 1.00 22.20 H new ATOM 0 HA SER A 445 18.618 19.630 3.931 1.00 75.31 H new ATOM 0 HB2 SER A 445 18.884 16.589 3.996 1.00 12.14 H new ATOM 0 HB3 SER A 445 17.401 17.506 4.165 1.00 12.14 H new ATOM 0 HG SER A 445 17.703 16.716 2.004 1.00 4.14 H new ATOM 1392 N PRO A 446 18.681 19.259 6.520 1.00 4.03 N ATOM 1393 CA PRO A 446 18.903 19.191 7.977 1.00 2.44 C ATOM 1394 C PRO A 446 18.662 17.794 8.545 1.00 12.40 C ATOM 1395 O PRO A 446 19.327 17.376 9.499 1.00 13.04 O ATOM 1396 CB PRO A 446 17.883 20.185 8.544 1.00 60.11 C ATOM 1397 CG PRO A 446 16.837 20.304 7.490 1.00 22.34 C ATOM 1398 CD PRO A 446 17.548 20.136 6.181 1.00 44.01 C ATOM 0 HA PRO A 446 19.935 19.425 8.238 1.00 2.44 H new ATOM 0 HB2 PRO A 446 17.460 19.825 9.482 1.00 60.11 H new ATOM 0 HB3 PRO A 446 18.345 21.150 8.753 1.00 60.11 H new ATOM 0 HG2 PRO A 446 16.067 19.543 7.616 1.00 22.34 H new ATOM 0 HG3 PRO A 446 16.339 21.272 7.542 1.00 22.34 H new ATOM 0 HD2 PRO A 446 16.902 19.685 5.428 1.00 44.01 H new ATOM 0 HD3 PRO A 446 17.885 21.092 5.781 1.00 44.01 H new ATOM 1406 N ALA A 447 17.760 17.046 7.914 1.00 1.00 N ATOM 1407 CA ALA A 447 17.435 15.706 8.366 1.00 23.44 C ATOM 1408 C ALA A 447 18.582 14.752 8.115 1.00 63.24 C ATOM 1409 O ALA A 447 18.672 13.687 8.727 1.00 73.43 O ATOM 1410 CB ALA A 447 16.187 15.203 7.690 1.00 3.41 C ATOM 0 H ALA A 447 17.244 17.350 7.088 1.00 1.00 H new ATOM 0 HA ALA A 447 17.257 15.754 9.440 1.00 23.44 H new ATOM 0 HB1 ALA A 447 15.962 14.197 8.044 1.00 3.41 H new ATOM 0 HB2 ALA A 447 15.354 15.865 7.925 1.00 3.41 H new ATOM 0 HB3 ALA A 447 16.341 15.182 6.611 1.00 3.41 H new ATOM 1416 N ALA A 448 19.475 15.153 7.235 1.00 52.33 N ATOM 1417 CA ALA A 448 20.599 14.343 6.866 1.00 63.11 C ATOM 1418 C ALA A 448 21.627 14.265 7.985 1.00 1.31 C ATOM 1419 O ALA A 448 22.322 13.264 8.117 1.00 34.55 O ATOM 1420 CB ALA A 448 21.207 14.840 5.593 1.00 24.11 C ATOM 0 H ALA A 448 19.435 16.054 6.758 1.00 52.33 H new ATOM 0 HA ALA A 448 20.241 13.328 6.696 1.00 63.11 H new ATOM 0 HB1 ALA A 448 22.059 14.214 5.328 1.00 24.11 H new ATOM 0 HB2 ALA A 448 20.465 14.800 4.796 1.00 24.11 H new ATOM 0 HB3 ALA A 448 21.541 15.869 5.727 1.00 24.11 H new ATOM 1426 N CYS A 449 21.724 15.318 8.794 1.00 73.54 N ATOM 1427 CA CYS A 449 22.589 15.269 9.969 1.00 64.11 C ATOM 1428 C CYS A 449 22.022 14.291 10.992 1.00 65.01 C ATOM 1429 O CYS A 449 22.776 13.570 11.654 1.00 42.43 O ATOM 1430 CB CYS A 449 22.799 16.650 10.613 1.00 43.33 C ATOM 1431 SG CYS A 449 23.876 17.789 9.689 1.00 51.14 S ATOM 0 H CYS A 449 21.225 16.198 8.662 1.00 73.54 H new ATOM 0 HA CYS A 449 23.567 14.926 9.632 1.00 64.11 H new ATOM 0 HB2 CYS A 449 21.826 17.123 10.743 1.00 43.33 H new ATOM 0 HB3 CYS A 449 23.219 16.507 11.609 1.00 43.33 H new ATOM 1436 N SER A 450 20.683 14.277 11.095 1.00 1.34 N ATOM 1437 CA SER A 450 19.943 13.381 11.976 1.00 32.54 C ATOM 1438 C SER A 450 20.260 13.634 13.461 1.00 71.40 C ATOM 1439 O SER A 450 19.571 14.457 14.080 1.00 37.37 O ATOM 1440 CB SER A 450 20.167 11.915 11.576 1.00 42.35 C ATOM 1441 OG SER A 450 19.756 11.692 10.216 1.00 4.30 O ATOM 1442 OXT SER A 450 21.197 13.021 14.015 1.00 37.37 O ATOM 0 H SER A 450 20.082 14.901 10.557 1.00 1.34 H new ATOM 0 HA SER A 450 18.882 13.598 11.852 1.00 32.54 H new ATOM 0 HB2 SER A 450 21.220 11.658 11.690 1.00 42.35 H new ATOM 0 HB3 SER A 450 19.606 11.261 12.243 1.00 42.35 H new ATOM 0 HG SER A 450 19.262 12.473 9.891 1.00 4.30 H new TER 1448 SER A 450