USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 703 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 482 TYR OH : rot 180:sc= 1.01 USER MOD Set 1.2: A 513 LYS NZ :NH3+ 129:sc= 1.19 (180deg=0) USER MOD Set 2.1: A 475 THR OG1 : rot 151:sc= 0.747 USER MOD Set 2.2: A 491 LYS NZ :NH3+ 154:sc= 0.857 (180deg=0) USER MOD Set 3.1: A 461 LYS NZ :NH3+ -129:sc= 0.462 (180deg=0) USER MOD Set 3.2: A 466 HIS : no HD1:sc= -0.06 K(o=0.4,f=-1.6) USER MOD Set 4.1: A 455 ASN : amide:sc= -0.138 X(o=-1,f=-1.5) USER MOD Set 4.2: A 458 MET CE :methyl -173:sc= -0.882 (180deg=-1.17) USER MOD Single : A 443 MET CE :methyl 179:sc= 0 (180deg=-0.00324) USER MOD Single : A 445 LYS NZ :NH3+ -165:sc= 3.15 (180deg=2.66) USER MOD Single : A 446 SER OG : rot 180:sc= 0 USER MOD Single : A 448 THR OG1 : rot 179:sc= 0.00501 USER MOD Single : A 451 LYS NZ :NH3+ -153:sc= 1.22 (180deg=0.64) USER MOD Single : A 454 LYS NZ :NH3+ -111:sc= 0.804 (180deg=-0.0034) USER MOD Single : A 462 SER OG : rot 180:sc= 0 USER MOD Single : A 467 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 468 TYR OH : rot 180:sc=-0.00584 USER MOD Single : A 469 SER OG : rot 180:sc= 0.0325 USER MOD Single : A 473 SER OG : rot 180:sc= -0.0521 USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 LYS NZ :NH3+ -166:sc= 1.88 (180deg=1.67) USER MOD Single : A 501 LYS NZ :NH3+ 168:sc= 0.00349 (180deg=0) USER MOD Single : A 504 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 TYR OH : rot 180:sc= 0 USER MOD Single : A 521 SER OG : rot 180:sc= 0 USER MOD Single : A 523 TYR OH : rot -170:sc= 0.0472 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 443 9.119 -6.930 10.659 1.00 0.00 N ATOM 2 CA MET A 443 8.355 -6.173 9.632 1.00 0.00 C ATOM 3 C MET A 443 6.894 -6.014 10.077 1.00 0.00 C ATOM 4 O MET A 443 6.229 -7.030 10.289 1.00 0.00 O ATOM 5 CB MET A 443 8.450 -6.864 8.255 1.00 0.00 C ATOM 6 CG MET A 443 7.814 -6.041 7.124 1.00 0.00 C ATOM 7 SD MET A 443 8.535 -4.395 6.853 1.00 0.00 S ATOM 8 CE MET A 443 10.139 -4.844 6.129 1.00 0.00 C ATOM 0 HA MET A 443 8.793 -5.180 9.529 1.00 0.00 H new ATOM 0 HB2 MET A 443 9.498 -7.047 8.018 1.00 0.00 H new ATOM 0 HB3 MET A 443 7.961 -7.837 8.308 1.00 0.00 H new ATOM 0 HG2 MET A 443 7.891 -6.609 6.197 1.00 0.00 H new ATOM 0 HG3 MET A 443 6.752 -5.922 7.338 1.00 0.00 H new ATOM 0 HE1 MET A 443 10.696 -3.938 5.889 1.00 0.00 H new ATOM 0 HE2 MET A 443 10.706 -5.441 6.843 1.00 0.00 H new ATOM 0 HE3 MET A 443 9.978 -5.423 5.219 1.00 0.00 H new ATOM 18 N PRO A 444 6.380 -4.778 10.264 1.00 0.00 N ATOM 19 CA PRO A 444 4.996 -4.506 10.676 1.00 0.00 C ATOM 20 C PRO A 444 3.924 -5.194 9.809 1.00 0.00 C ATOM 21 O PRO A 444 3.685 -4.803 8.663 1.00 0.00 O ATOM 22 CB PRO A 444 4.849 -2.977 10.663 1.00 0.00 C ATOM 23 CG PRO A 444 6.271 -2.491 10.921 1.00 0.00 C ATOM 24 CD PRO A 444 7.115 -3.518 10.171 1.00 0.00 C ATOM 0 HA PRO A 444 4.821 -4.929 11.665 1.00 0.00 H new ATOM 0 HB2 PRO A 444 4.467 -2.617 9.708 1.00 0.00 H new ATOM 0 HB3 PRO A 444 4.159 -2.632 11.433 1.00 0.00 H new ATOM 0 HG2 PRO A 444 6.429 -1.481 10.542 1.00 0.00 H new ATOM 0 HG3 PRO A 444 6.506 -2.472 11.985 1.00 0.00 H new ATOM 0 HD2 PRO A 444 7.257 -3.224 9.131 1.00 0.00 H new ATOM 0 HD3 PRO A 444 8.106 -3.609 10.615 1.00 0.00 H new ATOM 32 N LYS A 445 3.228 -6.199 10.362 1.00 0.00 N ATOM 33 CA LYS A 445 2.126 -6.916 9.685 1.00 0.00 C ATOM 34 C LYS A 445 0.907 -6.065 9.362 1.00 0.00 C ATOM 35 O LYS A 445 0.112 -6.441 8.503 1.00 0.00 O ATOM 36 CB LYS A 445 1.768 -8.206 10.449 1.00 0.00 C ATOM 37 CG LYS A 445 1.243 -9.283 9.488 1.00 0.00 C ATOM 38 CD LYS A 445 0.631 -10.484 10.217 1.00 0.00 C ATOM 39 CE LYS A 445 0.081 -11.523 9.229 1.00 0.00 C ATOM 40 NZ LYS A 445 -0.977 -10.953 8.362 1.00 0.00 N ATOM 0 H LYS A 445 3.414 -6.544 11.304 1.00 0.00 H new ATOM 0 HA LYS A 445 2.508 -7.191 8.702 1.00 0.00 H new ATOM 0 HB2 LYS A 445 2.648 -8.579 10.974 1.00 0.00 H new ATOM 0 HB3 LYS A 445 1.014 -7.988 11.205 1.00 0.00 H new ATOM 0 HG2 LYS A 445 0.493 -8.842 8.831 1.00 0.00 H new ATOM 0 HG3 LYS A 445 2.060 -9.627 8.854 1.00 0.00 H new ATOM 0 HD2 LYS A 445 1.385 -10.948 10.852 1.00 0.00 H new ATOM 0 HD3 LYS A 445 -0.171 -10.143 10.872 1.00 0.00 H new ATOM 0 HE2 LYS A 445 0.894 -11.901 8.609 1.00 0.00 H new ATOM 0 HE3 LYS A 445 -0.320 -12.373 9.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -1.495 -11.724 7.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -1.636 -10.394 8.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -0.543 -10.341 7.642 1.00 0.00 H new ATOM 54 N SER A 446 0.832 -4.849 9.893 1.00 0.00 N ATOM 55 CA SER A 446 -0.202 -3.900 9.487 1.00 0.00 C ATOM 56 C SER A 446 -0.032 -3.357 8.057 1.00 0.00 C ATOM 57 O SER A 446 -0.890 -2.642 7.543 1.00 0.00 O ATOM 58 CB SER A 446 -0.323 -2.741 10.486 1.00 0.00 C ATOM 59 OG SER A 446 -0.507 -3.232 11.805 1.00 0.00 O ATOM 0 H SER A 446 1.473 -4.497 10.604 1.00 0.00 H new ATOM 0 HA SER A 446 -1.128 -4.474 9.488 1.00 0.00 H new ATOM 0 HB2 SER A 446 0.574 -2.124 10.444 1.00 0.00 H new ATOM 0 HB3 SER A 446 -1.162 -2.103 10.210 1.00 0.00 H new ATOM 0 HG SER A 446 -0.580 -2.478 12.427 1.00 0.00 H new ATOM 65 N LEU A 447 1.057 -3.724 7.381 1.00 0.00 N ATOM 66 CA LEU A 447 1.302 -3.496 5.968 1.00 0.00 C ATOM 67 C LEU A 447 0.881 -4.711 5.109 1.00 0.00 C ATOM 68 O LEU A 447 0.868 -4.615 3.885 1.00 0.00 O ATOM 69 CB LEU A 447 2.802 -3.182 5.864 1.00 0.00 C ATOM 70 CG LEU A 447 3.248 -2.444 4.600 1.00 0.00 C ATOM 71 CD1 LEU A 447 2.715 -1.012 4.569 1.00 0.00 C ATOM 72 CD2 LEU A 447 4.773 -2.351 4.605 1.00 0.00 C ATOM 0 H LEU A 447 1.829 -4.214 7.834 1.00 0.00 H new ATOM 0 HA LEU A 447 0.704 -2.672 5.578 1.00 0.00 H new ATOM 0 HB2 LEU A 447 3.088 -2.585 6.729 1.00 0.00 H new ATOM 0 HB3 LEU A 447 3.354 -4.120 5.927 1.00 0.00 H new ATOM 0 HG LEU A 447 2.867 -2.993 3.739 1.00 0.00 H new ATOM 0 HD11 LEU A 447 3.051 -0.518 3.657 1.00 0.00 H new ATOM 0 HD12 LEU A 447 1.625 -1.029 4.592 1.00 0.00 H new ATOM 0 HD13 LEU A 447 3.088 -0.466 5.436 1.00 0.00 H new ATOM 0 HD21 LEU A 447 5.109 -1.827 3.710 1.00 0.00 H new ATOM 0 HD22 LEU A 447 5.101 -1.805 5.489 1.00 0.00 H new ATOM 0 HD23 LEU A 447 5.199 -3.354 4.619 1.00 0.00 H new ATOM 84 N THR A 448 0.523 -5.841 5.736 1.00 0.00 N ATOM 85 CA THR A 448 0.289 -7.165 5.125 1.00 0.00 C ATOM 86 C THR A 448 -0.830 -7.948 5.847 1.00 0.00 C ATOM 87 O THR A 448 -0.715 -9.148 6.108 1.00 0.00 O ATOM 88 CB THR A 448 1.599 -7.986 5.057 1.00 0.00 C ATOM 89 OG1 THR A 448 2.049 -8.358 6.340 1.00 0.00 O ATOM 90 CG2 THR A 448 2.763 -7.205 4.437 1.00 0.00 C ATOM 0 H THR A 448 0.379 -5.860 6.746 1.00 0.00 H new ATOM 0 HA THR A 448 -0.053 -6.993 4.104 1.00 0.00 H new ATOM 0 HB THR A 448 1.341 -8.850 4.445 1.00 0.00 H new ATOM 0 HG1 THR A 448 2.870 -8.887 6.258 1.00 0.00 H new ATOM 0 HG21 THR A 448 3.653 -7.834 4.417 1.00 0.00 H new ATOM 0 HG22 THR A 448 2.503 -6.911 3.420 1.00 0.00 H new ATOM 0 HG23 THR A 448 2.961 -6.314 5.033 1.00 0.00 H new ATOM 98 N ASP A 449 -1.925 -7.268 6.202 1.00 0.00 N ATOM 99 CA ASP A 449 -3.115 -7.805 6.885 1.00 0.00 C ATOM 100 C ASP A 449 -4.388 -7.494 6.075 1.00 0.00 C ATOM 101 O ASP A 449 -4.641 -6.318 5.819 1.00 0.00 O ATOM 102 CB ASP A 449 -3.263 -7.172 8.280 1.00 0.00 C ATOM 103 CG ASP A 449 -2.656 -7.991 9.429 1.00 0.00 C ATOM 104 OD1 ASP A 449 -2.830 -9.235 9.419 1.00 0.00 O ATOM 105 OD2 ASP A 449 -2.137 -7.405 10.403 1.00 0.00 O ATOM 0 H ASP A 449 -2.013 -6.270 6.011 1.00 0.00 H new ATOM 0 HA ASP A 449 -2.988 -8.884 6.976 1.00 0.00 H new ATOM 0 HB2 ASP A 449 -2.795 -6.188 8.268 1.00 0.00 H new ATOM 0 HB3 ASP A 449 -4.323 -7.019 8.483 1.00 0.00 H new ATOM 110 N PRO A 450 -5.248 -8.481 5.748 1.00 0.00 N ATOM 111 CA PRO A 450 -6.545 -8.288 5.072 1.00 0.00 C ATOM 112 C PRO A 450 -7.364 -7.108 5.626 1.00 0.00 C ATOM 113 O PRO A 450 -7.913 -6.302 4.874 1.00 0.00 O ATOM 114 CB PRO A 450 -7.297 -9.616 5.248 1.00 0.00 C ATOM 115 CG PRO A 450 -6.221 -10.660 5.538 1.00 0.00 C ATOM 116 CD PRO A 450 -5.035 -9.876 6.085 1.00 0.00 C ATOM 0 HA PRO A 450 -6.385 -8.031 4.025 1.00 0.00 H new ATOM 0 HB2 PRO A 450 -8.015 -9.555 6.066 1.00 0.00 H new ATOM 0 HB3 PRO A 450 -7.859 -9.871 4.349 1.00 0.00 H new ATOM 0 HG2 PRO A 450 -6.572 -11.396 6.261 1.00 0.00 H new ATOM 0 HG3 PRO A 450 -5.949 -11.205 4.634 1.00 0.00 H new ATOM 0 HD2 PRO A 450 -4.956 -10.003 7.165 1.00 0.00 H new ATOM 0 HD3 PRO A 450 -4.102 -10.238 5.652 1.00 0.00 H new ATOM 124 N LYS A 451 -7.378 -6.982 6.958 1.00 0.00 N ATOM 125 CA LYS A 451 -8.036 -5.948 7.773 1.00 0.00 C ATOM 126 C LYS A 451 -7.576 -4.515 7.452 1.00 0.00 C ATOM 127 O LYS A 451 -8.356 -3.575 7.583 1.00 0.00 O ATOM 128 CB LYS A 451 -7.761 -6.278 9.254 1.00 0.00 C ATOM 129 CG LYS A 451 -8.313 -7.650 9.705 1.00 0.00 C ATOM 130 CD LYS A 451 -7.337 -8.444 10.593 1.00 0.00 C ATOM 131 CE LYS A 451 -6.110 -8.958 9.832 1.00 0.00 C ATOM 132 NZ LYS A 451 -5.220 -9.761 10.711 1.00 0.00 N ATOM 0 H LYS A 451 -6.888 -7.657 7.545 1.00 0.00 H new ATOM 0 HA LYS A 451 -9.102 -5.965 7.545 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.685 -6.256 9.427 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -8.200 -5.499 9.877 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -9.244 -7.496 10.250 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.554 -8.243 8.823 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -7.007 -7.810 11.416 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -7.864 -9.290 11.034 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -6.433 -9.566 8.987 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -5.554 -8.114 9.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -4.243 -9.709 10.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -5.258 -9.385 11.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -5.535 -10.752 10.712 1.00 0.00 H new ATOM 146 N LEU A 452 -6.321 -4.342 7.033 1.00 0.00 N ATOM 147 CA LEU A 452 -5.717 -3.062 6.636 1.00 0.00 C ATOM 148 C LEU A 452 -5.741 -2.929 5.114 1.00 0.00 C ATOM 149 O LEU A 452 -6.086 -1.879 4.593 1.00 0.00 O ATOM 150 CB LEU A 452 -4.252 -2.953 7.114 1.00 0.00 C ATOM 151 CG LEU A 452 -3.946 -2.901 8.627 1.00 0.00 C ATOM 152 CD1 LEU A 452 -4.103 -1.473 9.136 1.00 0.00 C ATOM 153 CD2 LEU A 452 -4.738 -3.858 9.504 1.00 0.00 C ATOM 0 H LEU A 452 -5.667 -5.121 6.957 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.299 -2.266 7.101 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -3.710 -3.803 6.700 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -3.828 -2.055 6.664 1.00 0.00 H new ATOM 0 HG LEU A 452 -2.915 -3.245 8.713 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -3.886 -1.441 10.204 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -3.410 -0.819 8.606 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -5.125 -1.135 8.963 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.438 -3.731 10.544 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.803 -3.646 9.405 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -4.542 -4.884 9.192 1.00 0.00 H new ATOM 165 N LEU A 453 -5.432 -3.998 4.379 1.00 0.00 N ATOM 166 CA LEU A 453 -5.274 -4.011 2.921 1.00 0.00 C ATOM 167 C LEU A 453 -6.550 -3.615 2.163 1.00 0.00 C ATOM 168 O LEU A 453 -6.511 -3.265 0.982 1.00 0.00 O ATOM 169 CB LEU A 453 -4.809 -5.422 2.532 1.00 0.00 C ATOM 170 CG LEU A 453 -3.351 -5.737 2.941 1.00 0.00 C ATOM 171 CD1 LEU A 453 -3.012 -7.194 2.646 1.00 0.00 C ATOM 172 CD2 LEU A 453 -2.294 -4.874 2.270 1.00 0.00 C ATOM 0 H LEU A 453 -5.279 -4.915 4.798 1.00 0.00 H new ATOM 0 HA LEU A 453 -4.540 -3.258 2.635 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -5.472 -6.153 2.995 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -4.907 -5.542 1.453 1.00 0.00 H new ATOM 0 HG LEU A 453 -3.321 -5.518 4.008 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -1.982 -7.395 2.941 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -3.683 -7.844 3.207 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -3.128 -7.386 1.579 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -1.306 -5.171 2.621 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -2.350 -5.005 1.189 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -2.468 -3.827 2.518 1.00 0.00 H new ATOM 184 N LYS A 454 -7.684 -3.629 2.863 1.00 0.00 N ATOM 185 CA LYS A 454 -9.021 -3.305 2.368 1.00 0.00 C ATOM 186 C LYS A 454 -9.572 -2.021 3.013 1.00 0.00 C ATOM 187 O LYS A 454 -10.664 -1.562 2.684 1.00 0.00 O ATOM 188 CB LYS A 454 -9.899 -4.535 2.622 1.00 0.00 C ATOM 189 CG LYS A 454 -9.308 -5.702 1.840 1.00 0.00 C ATOM 190 CD LYS A 454 -10.139 -6.953 2.031 1.00 0.00 C ATOM 191 CE LYS A 454 -9.373 -7.973 1.228 1.00 0.00 C ATOM 192 NZ LYS A 454 -10.182 -9.146 0.804 1.00 0.00 N ATOM 0 H LYS A 454 -7.694 -3.882 3.851 1.00 0.00 H new ATOM 0 HA LYS A 454 -9.002 -3.085 1.301 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -9.932 -4.767 3.687 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -10.924 -4.344 2.305 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -9.261 -5.449 0.781 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -8.285 -5.886 2.169 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -10.214 -7.235 3.081 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -11.157 -6.826 1.662 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -8.964 -7.488 0.342 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.527 -8.324 1.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.861 -9.992 1.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -11.185 -8.971 1.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -10.066 -9.296 -0.219 1.00 0.00 H new ATOM 206 N ASN A 455 -8.767 -1.427 3.898 1.00 0.00 N ATOM 207 CA ASN A 455 -8.880 -0.127 4.528 1.00 0.00 C ATOM 208 C ASN A 455 -7.606 0.672 4.244 1.00 0.00 C ATOM 209 O ASN A 455 -6.776 0.922 5.126 1.00 0.00 O ATOM 210 CB ASN A 455 -9.034 -0.241 6.032 1.00 0.00 C ATOM 211 CG ASN A 455 -10.352 -0.757 6.556 1.00 0.00 C ATOM 212 OD1 ASN A 455 -11.422 -0.512 6.019 1.00 0.00 O ATOM 213 ND2 ASN A 455 -10.313 -1.300 7.741 1.00 0.00 N ATOM 0 H ASN A 455 -7.928 -1.908 4.221 1.00 0.00 H new ATOM 0 HA ASN A 455 -9.764 0.365 4.122 1.00 0.00 H new ATOM 0 HB2 ASN A 455 -8.244 -0.894 6.403 1.00 0.00 H new ATOM 0 HB3 ASN A 455 -8.862 0.745 6.464 1.00 0.00 H new ATOM 0 HD21 ASN A 455 -11.181 -1.524 8.228 1.00 0.00 H new ATOM 0 HD22 ASN A 455 -9.415 -1.501 8.181 1.00 0.00 H new ATOM 220 N ILE A 456 -7.503 1.151 3.015 1.00 0.00 N ATOM 221 CA ILE A 456 -6.490 2.112 2.589 1.00 0.00 C ATOM 222 C ILE A 456 -6.155 3.208 3.635 1.00 0.00 C ATOM 223 O ILE A 456 -4.962 3.452 3.811 1.00 0.00 O ATOM 224 CB ILE A 456 -6.924 2.660 1.217 1.00 0.00 C ATOM 225 CG1 ILE A 456 -6.977 1.581 0.107 1.00 0.00 C ATOM 226 CG2 ILE A 456 -6.058 3.838 0.762 1.00 0.00 C ATOM 227 CD1 ILE A 456 -5.733 0.690 -0.019 1.00 0.00 C ATOM 0 H ILE A 456 -8.137 0.877 2.264 1.00 0.00 H new ATOM 0 HA ILE A 456 -5.531 1.602 2.494 1.00 0.00 H new ATOM 0 HB ILE A 456 -7.943 3.015 1.371 1.00 0.00 H new ATOM 0 HG12 ILE A 456 -7.841 0.942 0.289 1.00 0.00 H new ATOM 0 HG13 ILE A 456 -7.143 2.078 -0.849 1.00 0.00 H new ATOM 0 HG21 ILE A 456 -6.403 4.189 -0.210 1.00 0.00 H new ATOM 0 HG22 ILE A 456 -6.134 4.647 1.488 1.00 0.00 H new ATOM 0 HG23 ILE A 456 -5.019 3.517 0.684 1.00 0.00 H new ATOM 0 HD11 ILE A 456 -5.880 -0.028 -0.826 1.00 0.00 H new ATOM 0 HD12 ILE A 456 -4.863 1.309 -0.238 1.00 0.00 H new ATOM 0 HD13 ILE A 456 -5.572 0.156 0.917 1.00 0.00 H new ATOM 239 N PRO A 457 -7.094 3.835 4.388 1.00 0.00 N ATOM 240 CA PRO A 457 -6.750 4.884 5.355 1.00 0.00 C ATOM 241 C PRO A 457 -5.841 4.367 6.485 1.00 0.00 C ATOM 242 O PRO A 457 -4.765 4.920 6.713 1.00 0.00 O ATOM 243 CB PRO A 457 -8.084 5.434 5.890 1.00 0.00 C ATOM 244 CG PRO A 457 -9.136 4.907 4.912 1.00 0.00 C ATOM 245 CD PRO A 457 -8.523 3.577 4.496 1.00 0.00 C ATOM 0 HA PRO A 457 -6.170 5.672 4.875 1.00 0.00 H new ATOM 0 HB2 PRO A 457 -8.277 5.088 6.905 1.00 0.00 H new ATOM 0 HB3 PRO A 457 -8.081 6.524 5.920 1.00 0.00 H new ATOM 0 HG2 PRO A 457 -10.109 4.780 5.386 1.00 0.00 H new ATOM 0 HG3 PRO A 457 -9.279 5.576 4.064 1.00 0.00 H new ATOM 0 HD2 PRO A 457 -8.729 2.801 5.233 1.00 0.00 H new ATOM 0 HD3 PRO A 457 -8.934 3.233 3.547 1.00 0.00 H new ATOM 253 N MET A 458 -6.235 3.290 7.179 1.00 0.00 N ATOM 254 CA MET A 458 -5.427 2.686 8.252 1.00 0.00 C ATOM 255 C MET A 458 -4.233 1.881 7.717 1.00 0.00 C ATOM 256 O MET A 458 -3.252 1.716 8.440 1.00 0.00 O ATOM 257 CB MET A 458 -6.307 1.883 9.224 1.00 0.00 C ATOM 258 CG MET A 458 -7.297 0.942 8.566 1.00 0.00 C ATOM 259 SD MET A 458 -8.422 0.180 9.758 1.00 0.00 S ATOM 260 CE MET A 458 -7.482 -1.323 10.050 1.00 0.00 C ATOM 0 H MET A 458 -7.121 2.812 7.014 1.00 0.00 H new ATOM 0 HA MET A 458 -4.986 3.503 8.823 1.00 0.00 H new ATOM 0 HB2 MET A 458 -5.660 1.303 9.881 1.00 0.00 H new ATOM 0 HB3 MET A 458 -6.857 2.582 9.854 1.00 0.00 H new ATOM 0 HG2 MET A 458 -7.876 1.490 7.823 1.00 0.00 H new ATOM 0 HG3 MET A 458 -6.753 0.162 8.034 1.00 0.00 H new ATOM 0 HE1 MET A 458 -8.066 -2.002 10.672 1.00 0.00 H new ATOM 0 HE2 MET A 458 -7.259 -1.804 9.097 1.00 0.00 H new ATOM 0 HE3 MET A 458 -6.550 -1.076 10.558 1.00 0.00 H new ATOM 270 N TRP A 459 -4.235 1.457 6.446 1.00 0.00 N ATOM 271 CA TRP A 459 -3.035 0.883 5.830 1.00 0.00 C ATOM 272 C TRP A 459 -1.941 1.940 5.603 1.00 0.00 C ATOM 273 O TRP A 459 -0.819 1.802 6.096 1.00 0.00 O ATOM 274 CB TRP A 459 -3.369 0.092 4.573 1.00 0.00 C ATOM 275 CG TRP A 459 -2.217 -0.646 3.960 1.00 0.00 C ATOM 276 CD1 TRP A 459 -1.806 -1.882 4.327 1.00 0.00 C ATOM 277 CD2 TRP A 459 -1.291 -0.212 2.910 1.00 0.00 C ATOM 278 NE1 TRP A 459 -0.724 -2.254 3.555 1.00 0.00 N ATOM 279 CE2 TRP A 459 -0.385 -1.284 2.646 1.00 0.00 C ATOM 280 CE3 TRP A 459 -1.099 0.977 2.171 1.00 0.00 C ATOM 281 CZ2 TRP A 459 0.621 -1.216 1.675 1.00 0.00 C ATOM 282 CZ3 TRP A 459 -0.057 1.075 1.225 1.00 0.00 C ATOM 283 CH2 TRP A 459 0.772 -0.021 0.958 1.00 0.00 C ATOM 0 H TRP A 459 -5.047 1.501 5.830 1.00 0.00 H new ATOM 0 HA TRP A 459 -2.617 0.167 6.538 1.00 0.00 H new ATOM 0 HB2 TRP A 459 -4.154 -0.626 4.812 1.00 0.00 H new ATOM 0 HB3 TRP A 459 -3.778 0.776 3.830 1.00 0.00 H new ATOM 0 HD1 TRP A 459 -2.255 -2.484 5.103 1.00 0.00 H new ATOM 0 HE1 TRP A 459 -0.235 -3.144 3.649 1.00 0.00 H new ATOM 0 HE3 TRP A 459 -1.756 1.819 2.332 1.00 0.00 H new ATOM 0 HZ2 TRP A 459 1.264 -2.062 1.483 1.00 0.00 H new ATOM 0 HZ3 TRP A 459 0.103 2.006 0.701 1.00 0.00 H new ATOM 0 HH2 TRP A 459 1.533 0.055 0.195 1.00 0.00 H new ATOM 294 N LEU A 460 -2.291 3.059 4.953 1.00 0.00 N ATOM 295 CA LEU A 460 -1.466 4.271 4.816 1.00 0.00 C ATOM 296 C LEU A 460 -1.041 4.881 6.162 1.00 0.00 C ATOM 297 O LEU A 460 -0.058 5.621 6.223 1.00 0.00 O ATOM 298 CB LEU A 460 -2.266 5.321 4.027 1.00 0.00 C ATOM 299 CG LEU A 460 -2.539 4.998 2.556 1.00 0.00 C ATOM 300 CD1 LEU A 460 -3.584 5.982 2.020 1.00 0.00 C ATOM 301 CD2 LEU A 460 -1.288 5.181 1.709 1.00 0.00 C ATOM 0 H LEU A 460 -3.194 3.150 4.488 1.00 0.00 H new ATOM 0 HA LEU A 460 -0.552 3.980 4.298 1.00 0.00 H new ATOM 0 HB2 LEU A 460 -3.222 5.470 4.528 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.729 6.268 4.076 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.877 3.963 2.498 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -3.787 5.762 0.972 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -4.504 5.885 2.596 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -3.205 7.000 2.110 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -1.515 4.944 0.669 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -0.949 6.214 1.780 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.504 4.516 2.070 1.00 0.00 H new ATOM 313 N LYS A 461 -1.758 4.594 7.252 1.00 0.00 N ATOM 314 CA LYS A 461 -1.394 5.020 8.611 1.00 0.00 C ATOM 315 C LYS A 461 -0.151 4.344 9.154 1.00 0.00 C ATOM 316 O LYS A 461 0.604 4.979 9.889 1.00 0.00 O ATOM 317 CB LYS A 461 -2.606 4.822 9.519 1.00 0.00 C ATOM 318 CG LYS A 461 -2.393 5.508 10.861 1.00 0.00 C ATOM 319 CD LYS A 461 -3.643 5.476 11.724 1.00 0.00 C ATOM 320 CE LYS A 461 -4.606 6.578 11.260 1.00 0.00 C ATOM 321 NZ LYS A 461 -4.517 7.801 12.102 1.00 0.00 N ATOM 0 H LYS A 461 -2.621 4.051 7.217 1.00 0.00 H new ATOM 0 HA LYS A 461 -1.124 6.076 8.576 1.00 0.00 H new ATOM 0 HB2 LYS A 461 -3.497 5.224 9.037 1.00 0.00 H new ATOM 0 HB3 LYS A 461 -2.781 3.757 9.673 1.00 0.00 H new ATOM 0 HG2 LYS A 461 -1.575 5.021 11.391 1.00 0.00 H new ATOM 0 HG3 LYS A 461 -2.094 6.543 10.695 1.00 0.00 H new ATOM 0 HD2 LYS A 461 -4.125 4.501 11.651 1.00 0.00 H new ATOM 0 HD3 LYS A 461 -3.380 5.624 12.771 1.00 0.00 H new ATOM 0 HE2 LYS A 461 -4.386 6.837 10.224 1.00 0.00 H new ATOM 0 HE3 LYS A 461 -5.627 6.198 11.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 -5.470 8.078 12.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 -3.924 7.607 12.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 -4.095 8.574 11.548 1.00 0.00 H new ATOM 335 N SER A 462 0.139 3.130 8.698 1.00 0.00 N ATOM 336 CA SER A 462 1.424 2.493 8.988 1.00 0.00 C ATOM 337 C SER A 462 2.609 3.326 8.446 1.00 0.00 C ATOM 338 O SER A 462 3.694 3.334 9.028 1.00 0.00 O ATOM 339 CB SER A 462 1.438 1.072 8.410 1.00 0.00 C ATOM 340 OG SER A 462 2.557 0.352 8.898 1.00 0.00 O ATOM 0 H SER A 462 -0.493 2.568 8.129 1.00 0.00 H new ATOM 0 HA SER A 462 1.544 2.437 10.070 1.00 0.00 H new ATOM 0 HB2 SER A 462 0.518 0.554 8.680 1.00 0.00 H new ATOM 0 HB3 SER A 462 1.472 1.115 7.321 1.00 0.00 H new ATOM 0 HG SER A 462 2.553 -0.553 8.522 1.00 0.00 H new ATOM 346 N LEU A 463 2.394 4.119 7.380 1.00 0.00 N ATOM 347 CA LEU A 463 3.368 5.024 6.763 1.00 0.00 C ATOM 348 C LEU A 463 3.413 6.407 7.445 1.00 0.00 C ATOM 349 O LEU A 463 4.196 7.264 7.036 1.00 0.00 O ATOM 350 CB LEU A 463 3.060 5.200 5.255 1.00 0.00 C ATOM 351 CG LEU A 463 2.407 4.007 4.540 1.00 0.00 C ATOM 352 CD1 LEU A 463 2.231 4.298 3.055 1.00 0.00 C ATOM 353 CD2 LEU A 463 3.208 2.709 4.654 1.00 0.00 C ATOM 0 H LEU A 463 1.491 4.144 6.906 1.00 0.00 H new ATOM 0 HA LEU A 463 4.347 4.563 6.893 1.00 0.00 H new ATOM 0 HB2 LEU A 463 2.407 6.065 5.140 1.00 0.00 H new ATOM 0 HB3 LEU A 463 3.993 5.435 4.742 1.00 0.00 H new ATOM 0 HG LEU A 463 1.448 3.870 5.040 1.00 0.00 H new ATOM 0 HD11 LEU A 463 1.767 3.440 2.569 1.00 0.00 H new ATOM 0 HD12 LEU A 463 1.595 5.174 2.929 1.00 0.00 H new ATOM 0 HD13 LEU A 463 3.205 4.488 2.604 1.00 0.00 H new ATOM 0 HD21 LEU A 463 2.686 1.912 4.125 1.00 0.00 H new ATOM 0 HD22 LEU A 463 4.195 2.851 4.213 1.00 0.00 H new ATOM 0 HD23 LEU A 463 3.315 2.439 5.704 1.00 0.00 H new ATOM 365 N ARG A 464 2.544 6.646 8.446 1.00 0.00 N ATOM 366 CA ARG A 464 2.248 7.944 9.083 1.00 0.00 C ATOM 367 C ARG A 464 1.680 8.992 8.105 1.00 0.00 C ATOM 368 O ARG A 464 1.636 10.180 8.419 1.00 0.00 O ATOM 369 CB ARG A 464 3.445 8.432 9.929 1.00 0.00 C ATOM 370 CG ARG A 464 3.765 7.526 11.133 1.00 0.00 C ATOM 371 CD ARG A 464 4.612 6.284 10.818 1.00 0.00 C ATOM 372 NE ARG A 464 5.135 5.682 12.062 1.00 0.00 N ATOM 373 CZ ARG A 464 5.284 4.404 12.367 1.00 0.00 C ATOM 374 NH1 ARG A 464 4.967 3.434 11.557 1.00 0.00 N ATOM 375 NH2 ARG A 464 5.769 4.068 13.529 1.00 0.00 N ATOM 0 H ARG A 464 1.996 5.891 8.857 1.00 0.00 H new ATOM 0 HA ARG A 464 1.428 7.787 9.783 1.00 0.00 H new ATOM 0 HB2 ARG A 464 4.326 8.497 9.291 1.00 0.00 H new ATOM 0 HB3 ARG A 464 3.237 9.439 10.289 1.00 0.00 H new ATOM 0 HG2 ARG A 464 4.287 8.119 11.884 1.00 0.00 H new ATOM 0 HG3 ARG A 464 2.826 7.200 11.580 1.00 0.00 H new ATOM 0 HD2 ARG A 464 4.009 5.553 10.279 1.00 0.00 H new ATOM 0 HD3 ARG A 464 5.440 6.558 10.164 1.00 0.00 H new ATOM 0 HE ARG A 464 5.420 6.343 12.785 1.00 0.00 H new ATOM 0 HH11 ARG A 464 4.583 3.644 10.636 1.00 0.00 H new ATOM 0 HH12 ARG A 464 5.103 2.465 11.844 1.00 0.00 H new ATOM 0 HH21 ARG A 464 6.032 4.790 14.200 1.00 0.00 H new ATOM 0 HH22 ARG A 464 5.885 3.083 13.768 1.00 0.00 H new ATOM 389 N LEU A 465 1.192 8.540 6.942 1.00 0.00 N ATOM 390 CA LEU A 465 0.525 9.354 5.920 1.00 0.00 C ATOM 391 C LEU A 465 -0.989 9.402 6.144 1.00 0.00 C ATOM 392 O LEU A 465 -1.516 10.455 6.493 1.00 0.00 O ATOM 393 CB LEU A 465 0.862 8.818 4.517 1.00 0.00 C ATOM 394 CG LEU A 465 2.336 9.016 4.131 1.00 0.00 C ATOM 395 CD1 LEU A 465 2.583 8.294 2.812 1.00 0.00 C ATOM 396 CD2 LEU A 465 2.727 10.497 4.040 1.00 0.00 C ATOM 0 H LEU A 465 1.254 7.557 6.678 1.00 0.00 H new ATOM 0 HA LEU A 465 0.895 10.376 6.000 1.00 0.00 H new ATOM 0 HB2 LEU A 465 0.621 7.756 4.474 1.00 0.00 H new ATOM 0 HB3 LEU A 465 0.231 9.318 3.783 1.00 0.00 H new ATOM 0 HG LEU A 465 2.966 8.595 4.914 1.00 0.00 H new ATOM 0 HD11 LEU A 465 3.625 8.421 2.517 1.00 0.00 H new ATOM 0 HD12 LEU A 465 2.366 7.232 2.932 1.00 0.00 H new ATOM 0 HD13 LEU A 465 1.935 8.712 2.042 1.00 0.00 H new ATOM 0 HD21 LEU A 465 3.778 10.579 3.764 1.00 0.00 H new ATOM 0 HD22 LEU A 465 2.114 10.989 3.285 1.00 0.00 H new ATOM 0 HD23 LEU A 465 2.567 10.976 5.006 1.00 0.00 H new ATOM 408 N HIS A 466 -1.680 8.270 5.933 1.00 0.00 N ATOM 409 CA HIS A 466 -3.140 8.110 6.134 1.00 0.00 C ATOM 410 C HIS A 466 -4.059 9.216 5.567 1.00 0.00 C ATOM 411 O HIS A 466 -5.148 9.453 6.097 1.00 0.00 O ATOM 412 CB HIS A 466 -3.390 7.739 7.600 1.00 0.00 C ATOM 413 CG HIS A 466 -3.023 8.732 8.666 1.00 0.00 C ATOM 414 ND1 HIS A 466 -1.849 8.725 9.381 1.00 0.00 N ATOM 415 CD2 HIS A 466 -3.878 9.608 9.277 1.00 0.00 C ATOM 416 CE1 HIS A 466 -1.999 9.544 10.428 1.00 0.00 C ATOM 417 NE2 HIS A 466 -3.220 10.110 10.408 1.00 0.00 N ATOM 0 H HIS A 466 -1.231 7.413 5.609 1.00 0.00 H new ATOM 0 HA HIS A 466 -3.461 7.289 5.493 1.00 0.00 H new ATOM 0 HB2 HIS A 466 -4.451 7.514 7.708 1.00 0.00 H new ATOM 0 HB3 HIS A 466 -2.846 6.817 7.805 1.00 0.00 H new ATOM 0 HD2 HIS A 466 -4.874 9.865 8.949 1.00 0.00 H new ATOM 0 HE1 HIS A 466 -1.247 9.725 11.182 1.00 0.00 H new ATOM 0 HE2 HIS A 466 -3.594 10.775 11.085 1.00 0.00 H new ATOM 425 N LYS A 467 -3.630 9.874 4.476 1.00 0.00 N ATOM 426 CA LYS A 467 -4.295 11.058 3.893 1.00 0.00 C ATOM 427 C LYS A 467 -4.533 11.037 2.376 1.00 0.00 C ATOM 428 O LYS A 467 -5.268 11.886 1.873 1.00 0.00 O ATOM 429 CB LYS A 467 -3.579 12.324 4.409 1.00 0.00 C ATOM 430 CG LYS A 467 -2.139 12.604 3.961 1.00 0.00 C ATOM 431 CD LYS A 467 -1.971 13.177 2.556 1.00 0.00 C ATOM 432 CE LYS A 467 -2.809 14.417 2.209 1.00 0.00 C ATOM 433 NZ LYS A 467 -2.433 15.604 3.021 1.00 0.00 N ATOM 0 H LYS A 467 -2.794 9.594 3.963 1.00 0.00 H new ATOM 0 HA LYS A 467 -5.327 11.051 4.245 1.00 0.00 H new ATOM 0 HB2 LYS A 467 -4.185 13.184 4.122 1.00 0.00 H new ATOM 0 HB3 LYS A 467 -3.581 12.281 5.498 1.00 0.00 H new ATOM 0 HG2 LYS A 467 -1.688 13.298 4.670 1.00 0.00 H new ATOM 0 HG3 LYS A 467 -1.574 11.674 4.022 1.00 0.00 H new ATOM 0 HD2 LYS A 467 -0.920 13.427 2.415 1.00 0.00 H new ATOM 0 HD3 LYS A 467 -2.211 12.393 1.838 1.00 0.00 H new ATOM 0 HE2 LYS A 467 -2.686 14.650 1.151 1.00 0.00 H new ATOM 0 HE3 LYS A 467 -3.864 14.194 2.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 467 -3.027 16.413 2.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 467 -2.575 15.394 4.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 467 -1.433 15.837 2.854 1.00 0.00 H new ATOM 447 N TYR A 468 -3.978 10.063 1.645 1.00 0.00 N ATOM 448 CA TYR A 468 -4.216 9.882 0.198 1.00 0.00 C ATOM 449 C TYR A 468 -5.465 9.062 -0.121 1.00 0.00 C ATOM 450 O TYR A 468 -5.952 9.085 -1.248 1.00 0.00 O ATOM 451 CB TYR A 468 -2.979 9.306 -0.492 1.00 0.00 C ATOM 452 CG TYR A 468 -1.815 10.238 -0.241 1.00 0.00 C ATOM 453 CD1 TYR A 468 -1.836 11.503 -0.859 1.00 0.00 C ATOM 454 CD2 TYR A 468 -0.842 9.941 0.730 1.00 0.00 C ATOM 455 CE1 TYR A 468 -0.852 12.458 -0.556 1.00 0.00 C ATOM 456 CE2 TYR A 468 0.112 10.919 1.064 1.00 0.00 C ATOM 457 CZ TYR A 468 0.134 12.165 0.403 1.00 0.00 C ATOM 458 OH TYR A 468 1.043 13.113 0.762 1.00 0.00 O ATOM 0 H TYR A 468 -3.344 9.369 2.040 1.00 0.00 H new ATOM 0 HA TYR A 468 -4.408 10.877 -0.204 1.00 0.00 H new ATOM 0 HB2 TYR A 468 -2.758 8.311 -0.106 1.00 0.00 H new ATOM 0 HB3 TYR A 468 -3.156 9.200 -1.562 1.00 0.00 H new ATOM 0 HD1 TYR A 468 -2.613 11.740 -1.570 1.00 0.00 H new ATOM 0 HD2 TYR A 468 -0.828 8.975 1.213 1.00 0.00 H new ATOM 0 HE1 TYR A 468 -0.852 13.414 -1.058 1.00 0.00 H new ATOM 0 HE2 TYR A 468 0.838 10.713 1.837 1.00 0.00 H new ATOM 0 HH TYR A 468 1.651 12.744 1.436 1.00 0.00 H new ATOM 468 N SER A 469 -6.042 8.405 0.883 1.00 0.00 N ATOM 469 CA SER A 469 -7.283 7.631 0.852 1.00 0.00 C ATOM 470 C SER A 469 -8.454 8.417 0.256 1.00 0.00 C ATOM 471 O SER A 469 -9.300 7.848 -0.430 1.00 0.00 O ATOM 472 CB SER A 469 -7.638 7.253 2.300 1.00 0.00 C ATOM 473 OG SER A 469 -7.309 8.306 3.200 1.00 0.00 O ATOM 0 H SER A 469 -5.622 8.399 1.812 1.00 0.00 H new ATOM 0 HA SER A 469 -7.121 6.756 0.222 1.00 0.00 H new ATOM 0 HB2 SER A 469 -8.703 7.030 2.370 1.00 0.00 H new ATOM 0 HB3 SER A 469 -7.103 6.347 2.584 1.00 0.00 H new ATOM 0 HG SER A 469 -7.546 8.042 4.113 1.00 0.00 H new ATOM 479 N ASP A 470 -8.449 9.742 0.422 1.00 0.00 N ATOM 480 CA ASP A 470 -9.402 10.685 -0.166 1.00 0.00 C ATOM 481 C ASP A 470 -9.518 10.561 -1.700 1.00 0.00 C ATOM 482 O ASP A 470 -10.577 10.820 -2.277 1.00 0.00 O ATOM 483 CB ASP A 470 -8.955 12.100 0.215 1.00 0.00 C ATOM 484 CG ASP A 470 -9.965 13.173 -0.225 1.00 0.00 C ATOM 485 OD1 ASP A 470 -11.074 13.235 0.358 1.00 0.00 O ATOM 486 OD2 ASP A 470 -9.644 13.975 -1.135 1.00 0.00 O ATOM 0 H ASP A 470 -7.747 10.208 0.997 1.00 0.00 H new ATOM 0 HA ASP A 470 -10.393 10.458 0.227 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -8.817 12.156 1.295 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -7.987 12.307 -0.241 1.00 0.00 H new ATOM 491 N ALA A 471 -8.432 10.122 -2.344 1.00 0.00 N ATOM 492 CA ALA A 471 -8.292 9.904 -3.779 1.00 0.00 C ATOM 493 C ALA A 471 -7.877 8.464 -4.164 1.00 0.00 C ATOM 494 O ALA A 471 -7.867 8.119 -5.348 1.00 0.00 O ATOM 495 CB ALA A 471 -7.301 10.957 -4.288 1.00 0.00 C ATOM 0 H ALA A 471 -7.574 9.896 -1.840 1.00 0.00 H new ATOM 0 HA ALA A 471 -9.265 10.016 -4.258 1.00 0.00 H new ATOM 0 HB1 ALA A 471 -7.161 10.836 -5.362 1.00 0.00 H new ATOM 0 HB2 ALA A 471 -7.692 11.954 -4.083 1.00 0.00 H new ATOM 0 HB3 ALA A 471 -6.344 10.831 -3.781 1.00 0.00 H new ATOM 501 N LEU A 472 -7.565 7.613 -3.177 1.00 0.00 N ATOM 502 CA LEU A 472 -6.931 6.308 -3.334 1.00 0.00 C ATOM 503 C LEU A 472 -7.704 5.123 -2.725 1.00 0.00 C ATOM 504 O LEU A 472 -7.499 3.995 -3.164 1.00 0.00 O ATOM 505 CB LEU A 472 -5.526 6.472 -2.731 1.00 0.00 C ATOM 506 CG LEU A 472 -4.512 5.439 -3.224 1.00 0.00 C ATOM 507 CD1 LEU A 472 -3.215 6.146 -3.613 1.00 0.00 C ATOM 508 CD2 LEU A 472 -4.266 4.326 -2.210 1.00 0.00 C ATOM 0 H LEU A 472 -7.760 7.833 -2.200 1.00 0.00 H new ATOM 0 HA LEU A 472 -6.904 6.035 -4.389 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -5.156 7.470 -2.966 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -5.598 6.406 -1.645 1.00 0.00 H new ATOM 0 HG LEU A 472 -4.929 4.948 -4.103 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -2.491 5.411 -3.965 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -3.417 6.865 -4.407 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -2.810 6.667 -2.745 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -3.538 3.621 -2.612 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -3.882 4.755 -1.285 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -5.202 3.805 -2.008 1.00 0.00 H new ATOM 520 N SER A 473 -8.639 5.339 -1.789 1.00 0.00 N ATOM 521 CA SER A 473 -9.486 4.271 -1.212 1.00 0.00 C ATOM 522 C SER A 473 -10.391 3.564 -2.229 1.00 0.00 C ATOM 523 O SER A 473 -10.825 2.437 -1.987 1.00 0.00 O ATOM 524 CB SER A 473 -10.358 4.791 -0.067 1.00 0.00 C ATOM 525 OG SER A 473 -9.559 5.089 1.062 1.00 0.00 O ATOM 0 H SER A 473 -8.835 6.263 -1.405 1.00 0.00 H new ATOM 0 HA SER A 473 -8.769 3.539 -0.840 1.00 0.00 H new ATOM 0 HB2 SER A 473 -10.895 5.684 -0.387 1.00 0.00 H new ATOM 0 HB3 SER A 473 -11.108 4.045 0.196 1.00 0.00 H new ATOM 0 HG SER A 473 -10.128 5.422 1.787 1.00 0.00 H new ATOM 531 N GLY A 474 -10.630 4.177 -3.395 1.00 0.00 N ATOM 532 CA GLY A 474 -11.277 3.532 -4.543 1.00 0.00 C ATOM 533 C GLY A 474 -10.415 2.450 -5.216 1.00 0.00 C ATOM 534 O GLY A 474 -10.914 1.729 -6.083 1.00 0.00 O ATOM 0 H GLY A 474 -10.375 5.149 -3.569 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.215 3.084 -4.215 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -11.529 4.294 -5.281 1.00 0.00 H new ATOM 538 N THR A 475 -9.140 2.315 -4.823 1.00 0.00 N ATOM 539 CA THR A 475 -8.179 1.335 -5.360 1.00 0.00 C ATOM 540 C THR A 475 -7.784 0.298 -4.295 1.00 0.00 C ATOM 541 O THR A 475 -7.069 0.648 -3.352 1.00 0.00 O ATOM 542 CB THR A 475 -6.941 2.032 -5.948 1.00 0.00 C ATOM 543 OG1 THR A 475 -7.326 3.067 -6.833 1.00 0.00 O ATOM 544 CG2 THR A 475 -6.099 1.063 -6.771 1.00 0.00 C ATOM 0 H THR A 475 -8.733 2.905 -4.097 1.00 0.00 H new ATOM 0 HA THR A 475 -8.672 0.801 -6.172 1.00 0.00 H new ATOM 0 HB THR A 475 -6.373 2.418 -5.102 1.00 0.00 H new ATOM 0 HG1 THR A 475 -6.640 3.767 -6.836 1.00 0.00 H new ATOM 0 HG21 THR A 475 -5.231 1.586 -7.173 1.00 0.00 H new ATOM 0 HG22 THR A 475 -5.766 0.241 -6.137 1.00 0.00 H new ATOM 0 HG23 THR A 475 -6.697 0.668 -7.592 1.00 0.00 H new ATOM 552 N PRO A 476 -8.225 -0.975 -4.399 1.00 0.00 N ATOM 553 CA PRO A 476 -7.819 -2.033 -3.472 1.00 0.00 C ATOM 554 C PRO A 476 -6.339 -2.340 -3.615 1.00 0.00 C ATOM 555 O PRO A 476 -5.818 -2.295 -4.729 1.00 0.00 O ATOM 556 CB PRO A 476 -8.632 -3.275 -3.850 1.00 0.00 C ATOM 557 CG PRO A 476 -8.974 -3.045 -5.320 1.00 0.00 C ATOM 558 CD PRO A 476 -9.057 -1.527 -5.458 1.00 0.00 C ATOM 0 HA PRO A 476 -7.995 -1.726 -2.441 1.00 0.00 H new ATOM 0 HB2 PRO A 476 -8.056 -4.190 -3.711 1.00 0.00 H new ATOM 0 HB3 PRO A 476 -9.530 -3.368 -3.239 1.00 0.00 H new ATOM 0 HG2 PRO A 476 -8.210 -3.462 -5.976 1.00 0.00 H new ATOM 0 HG3 PRO A 476 -9.918 -3.520 -5.587 1.00 0.00 H new ATOM 0 HD2 PRO A 476 -8.704 -1.206 -6.438 1.00 0.00 H new ATOM 0 HD3 PRO A 476 -10.087 -1.184 -5.362 1.00 0.00 H new ATOM 566 N TRP A 477 -5.690 -2.767 -2.529 1.00 0.00 N ATOM 567 CA TRP A 477 -4.246 -3.039 -2.456 1.00 0.00 C ATOM 568 C TRP A 477 -3.677 -3.888 -3.600 1.00 0.00 C ATOM 569 O TRP A 477 -2.512 -3.770 -3.960 1.00 0.00 O ATOM 570 CB TRP A 477 -3.929 -3.765 -1.153 1.00 0.00 C ATOM 571 CG TRP A 477 -4.334 -5.213 -1.108 1.00 0.00 C ATOM 572 CD1 TRP A 477 -5.589 -5.713 -0.996 1.00 0.00 C ATOM 573 CD2 TRP A 477 -3.462 -6.374 -1.225 1.00 0.00 C ATOM 574 NE1 TRP A 477 -5.538 -7.084 -0.951 1.00 0.00 N ATOM 575 CE2 TRP A 477 -4.255 -7.557 -1.138 1.00 0.00 C ATOM 576 CE3 TRP A 477 -2.075 -6.539 -1.404 1.00 0.00 C ATOM 577 CZ2 TRP A 477 -3.692 -8.842 -1.233 1.00 0.00 C ATOM 578 CZ3 TRP A 477 -1.506 -7.817 -1.473 1.00 0.00 C ATOM 579 CH2 TRP A 477 -2.303 -8.971 -1.404 1.00 0.00 C ATOM 0 H TRP A 477 -6.168 -2.940 -1.645 1.00 0.00 H new ATOM 0 HA TRP A 477 -3.778 -2.057 -2.525 1.00 0.00 H new ATOM 0 HB2 TRP A 477 -2.856 -3.699 -0.972 1.00 0.00 H new ATOM 0 HB3 TRP A 477 -4.423 -3.241 -0.335 1.00 0.00 H new ATOM 0 HD1 TRP A 477 -6.492 -5.122 -0.949 1.00 0.00 H new ATOM 0 HE1 TRP A 477 -6.351 -7.681 -0.798 1.00 0.00 H new ATOM 0 HE3 TRP A 477 -1.442 -5.668 -1.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 477 -4.319 -9.719 -1.175 1.00 0.00 H new ATOM 0 HZ3 TRP A 477 -0.436 -7.917 -1.581 1.00 0.00 H new ATOM 0 HH2 TRP A 477 -1.852 -9.949 -1.482 1.00 0.00 H new ATOM 590 N ILE A 478 -4.515 -4.735 -4.183 1.00 0.00 N ATOM 591 CA ILE A 478 -4.123 -5.711 -5.197 1.00 0.00 C ATOM 592 C ILE A 478 -4.125 -5.090 -6.597 1.00 0.00 C ATOM 593 O ILE A 478 -3.317 -5.476 -7.439 1.00 0.00 O ATOM 594 CB ILE A 478 -4.969 -6.994 -5.077 1.00 0.00 C ATOM 595 CG1 ILE A 478 -4.226 -8.169 -5.747 1.00 0.00 C ATOM 596 CG2 ILE A 478 -6.391 -6.819 -5.641 1.00 0.00 C ATOM 597 CD1 ILE A 478 -4.735 -9.538 -5.289 1.00 0.00 C ATOM 0 H ILE A 478 -5.510 -4.765 -3.960 1.00 0.00 H new ATOM 0 HA ILE A 478 -3.092 -6.015 -5.018 1.00 0.00 H new ATOM 0 HB ILE A 478 -5.098 -7.217 -4.018 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -4.334 -8.091 -6.829 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -3.161 -8.091 -5.527 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -6.943 -7.752 -5.531 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -6.904 -6.027 -5.095 1.00 0.00 H new ATOM 0 HG23 ILE A 478 -6.334 -6.553 -6.697 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -4.173 -10.323 -5.795 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -4.602 -9.634 -4.211 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -5.793 -9.633 -5.534 1.00 0.00 H new ATOM 609 N GLU A 479 -4.984 -4.090 -6.839 1.00 0.00 N ATOM 610 CA GLU A 479 -4.862 -3.231 -8.028 1.00 0.00 C ATOM 611 C GLU A 479 -3.869 -2.082 -7.754 1.00 0.00 C ATOM 612 O GLU A 479 -3.368 -1.441 -8.680 1.00 0.00 O ATOM 613 CB GLU A 479 -6.234 -2.663 -8.423 1.00 0.00 C ATOM 614 CG GLU A 479 -7.186 -3.758 -8.923 1.00 0.00 C ATOM 615 CD GLU A 479 -8.474 -3.152 -9.514 1.00 0.00 C ATOM 616 OE1 GLU A 479 -8.477 -2.773 -10.710 1.00 0.00 O ATOM 617 OE2 GLU A 479 -9.498 -3.063 -8.794 1.00 0.00 O ATOM 0 H GLU A 479 -5.768 -3.856 -6.231 1.00 0.00 H new ATOM 0 HA GLU A 479 -4.485 -3.833 -8.855 1.00 0.00 H new ATOM 0 HB2 GLU A 479 -6.679 -2.160 -7.565 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -6.105 -1.911 -9.202 1.00 0.00 H new ATOM 0 HG2 GLU A 479 -6.685 -4.361 -9.680 1.00 0.00 H new ATOM 0 HG3 GLU A 479 -7.440 -4.426 -8.100 1.00 0.00 H new ATOM 624 N LEU A 480 -3.577 -1.829 -6.473 1.00 0.00 N ATOM 625 CA LEU A 480 -2.846 -0.679 -5.968 1.00 0.00 C ATOM 626 C LEU A 480 -1.343 -0.781 -6.035 1.00 0.00 C ATOM 627 O LEU A 480 -0.684 0.098 -6.577 1.00 0.00 O ATOM 628 CB LEU A 480 -3.173 -0.483 -4.486 1.00 0.00 C ATOM 629 CG LEU A 480 -2.705 0.842 -3.915 1.00 0.00 C ATOM 630 CD1 LEU A 480 -3.656 1.873 -4.463 1.00 0.00 C ATOM 631 CD2 LEU A 480 -2.771 0.801 -2.398 1.00 0.00 C ATOM 0 H LEU A 480 -3.864 -2.461 -5.726 1.00 0.00 H new ATOM 0 HA LEU A 480 -3.160 0.141 -6.614 1.00 0.00 H new ATOM 0 HB2 LEU A 480 -4.251 -0.564 -4.350 1.00 0.00 H new ATOM 0 HB3 LEU A 480 -2.718 -1.293 -3.915 1.00 0.00 H new ATOM 0 HG LEU A 480 -1.674 1.068 -4.186 1.00 0.00 H new ATOM 0 HD11 LEU A 480 -3.378 2.859 -4.091 1.00 0.00 H new ATOM 0 HD12 LEU A 480 -3.608 1.869 -5.552 1.00 0.00 H new ATOM 0 HD13 LEU A 480 -4.671 1.638 -4.143 1.00 0.00 H new ATOM 0 HD21 LEU A 480 -2.434 1.755 -1.993 1.00 0.00 H new ATOM 0 HD22 LEU A 480 -3.798 0.616 -2.083 1.00 0.00 H new ATOM 0 HD23 LEU A 480 -2.129 0.002 -2.027 1.00 0.00 H new ATOM 643 N ILE A 481 -0.789 -1.816 -5.413 1.00 0.00 N ATOM 644 CA ILE A 481 0.649 -1.923 -5.173 1.00 0.00 C ATOM 645 C ILE A 481 1.468 -1.900 -6.480 1.00 0.00 C ATOM 646 O ILE A 481 2.671 -1.662 -6.509 1.00 0.00 O ATOM 647 CB ILE A 481 0.928 -3.188 -4.334 1.00 0.00 C ATOM 648 CG1 ILE A 481 0.492 -4.437 -5.135 1.00 0.00 C ATOM 649 CG2 ILE A 481 0.296 -3.012 -2.936 1.00 0.00 C ATOM 650 CD1 ILE A 481 0.575 -5.734 -4.349 1.00 0.00 C ATOM 0 H ILE A 481 -1.325 -2.608 -5.059 1.00 0.00 H new ATOM 0 HA ILE A 481 0.975 -1.047 -4.613 1.00 0.00 H new ATOM 0 HB ILE A 481 1.990 -3.341 -4.144 1.00 0.00 H new ATOM 0 HG12 ILE A 481 -0.533 -4.297 -5.478 1.00 0.00 H new ATOM 0 HG13 ILE A 481 1.117 -4.522 -6.024 1.00 0.00 H new ATOM 0 HG21 ILE A 481 0.488 -3.901 -2.335 1.00 0.00 H new ATOM 0 HG22 ILE A 481 0.733 -2.142 -2.446 1.00 0.00 H new ATOM 0 HG23 ILE A 481 -0.780 -2.869 -3.038 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.253 -6.563 -4.979 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.604 -5.900 -4.029 1.00 0.00 H new ATOM 0 HD13 ILE A 481 -0.072 -5.671 -3.474 1.00 0.00 H new ATOM 662 N TYR A 482 0.750 -2.131 -7.575 1.00 0.00 N ATOM 663 CA TYR A 482 1.142 -2.167 -8.976 1.00 0.00 C ATOM 664 C TYR A 482 1.344 -0.785 -9.619 1.00 0.00 C ATOM 665 O TYR A 482 1.959 -0.693 -10.683 1.00 0.00 O ATOM 666 CB TYR A 482 -0.014 -2.866 -9.699 1.00 0.00 C ATOM 667 CG TYR A 482 -0.144 -4.376 -9.553 1.00 0.00 C ATOM 668 CD1 TYR A 482 0.795 -5.159 -8.845 1.00 0.00 C ATOM 669 CD2 TYR A 482 -1.263 -4.996 -10.142 1.00 0.00 C ATOM 670 CE1 TYR A 482 0.617 -6.551 -8.732 1.00 0.00 C ATOM 671 CE2 TYR A 482 -1.444 -6.386 -10.038 1.00 0.00 C ATOM 672 CZ TYR A 482 -0.498 -7.167 -9.340 1.00 0.00 C ATOM 673 OH TYR A 482 -0.656 -8.515 -9.271 1.00 0.00 O ATOM 0 H TYR A 482 -0.248 -2.321 -7.486 1.00 0.00 H new ATOM 0 HA TYR A 482 2.105 -2.671 -9.054 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -0.944 -2.416 -9.352 1.00 0.00 H new ATOM 0 HB3 TYR A 482 0.072 -2.640 -10.762 1.00 0.00 H new ATOM 0 HD1 TYR A 482 1.653 -4.688 -8.389 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -1.987 -4.399 -10.677 1.00 0.00 H new ATOM 0 HE1 TYR A 482 1.331 -7.146 -8.182 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -2.305 -6.855 -10.491 1.00 0.00 H new ATOM 0 HH TYR A 482 -1.476 -8.773 -9.741 1.00 0.00 H new ATOM 683 N LEU A 483 0.809 0.272 -9.002 1.00 0.00 N ATOM 684 CA LEU A 483 0.822 1.651 -9.528 1.00 0.00 C ATOM 685 C LEU A 483 2.263 2.159 -9.712 1.00 0.00 C ATOM 686 O LEU A 483 2.772 2.291 -10.825 1.00 0.00 O ATOM 687 CB LEU A 483 0.077 2.575 -8.547 1.00 0.00 C ATOM 688 CG LEU A 483 -1.443 2.395 -8.490 1.00 0.00 C ATOM 689 CD1 LEU A 483 -1.988 3.037 -7.230 1.00 0.00 C ATOM 690 CD2 LEU A 483 -2.109 3.151 -9.620 1.00 0.00 C ATOM 0 H LEU A 483 0.341 0.197 -8.099 1.00 0.00 H new ATOM 0 HA LEU A 483 0.329 1.656 -10.500 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.481 2.415 -7.547 1.00 0.00 H new ATOM 0 HB3 LEU A 483 0.292 3.609 -8.816 1.00 0.00 H new ATOM 0 HG LEU A 483 -1.641 1.324 -8.539 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -3.070 2.907 -7.194 1.00 0.00 H new ATOM 0 HD12 LEU A 483 -1.536 2.566 -6.357 1.00 0.00 H new ATOM 0 HD13 LEU A 483 -1.751 4.101 -7.232 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -3.189 3.012 -9.564 1.00 0.00 H new ATOM 0 HD22 LEU A 483 -1.875 4.212 -9.535 1.00 0.00 H new ATOM 0 HD23 LEU A 483 -1.744 2.774 -10.575 1.00 0.00 H new ATOM 702 N ASP A 484 2.894 2.413 -8.569 1.00 0.00 N ATOM 703 CA ASP A 484 4.282 2.820 -8.362 1.00 0.00 C ATOM 704 C ASP A 484 4.603 4.218 -8.945 1.00 0.00 C ATOM 705 O ASP A 484 3.698 5.018 -9.202 1.00 0.00 O ATOM 706 CB ASP A 484 5.202 1.694 -8.861 1.00 0.00 C ATOM 707 CG ASP A 484 6.513 1.599 -8.069 1.00 0.00 C ATOM 708 OD1 ASP A 484 6.542 0.894 -7.034 1.00 0.00 O ATOM 709 OD2 ASP A 484 7.506 2.236 -8.488 1.00 0.00 O ATOM 0 H ASP A 484 2.400 2.332 -7.680 1.00 0.00 H new ATOM 0 HA ASP A 484 4.464 2.957 -7.296 1.00 0.00 H new ATOM 0 HB2 ASP A 484 4.673 0.743 -8.794 1.00 0.00 H new ATOM 0 HB3 ASP A 484 5.431 1.858 -9.914 1.00 0.00 H new ATOM 714 N ASP A 485 5.901 4.515 -9.071 1.00 0.00 N ATOM 715 CA ASP A 485 6.580 5.778 -9.377 1.00 0.00 C ATOM 716 C ASP A 485 5.662 6.998 -9.592 1.00 0.00 C ATOM 717 O ASP A 485 5.269 7.656 -8.625 1.00 0.00 O ATOM 718 CB ASP A 485 7.591 5.548 -10.517 1.00 0.00 C ATOM 719 CG ASP A 485 8.452 6.786 -10.838 1.00 0.00 C ATOM 720 OD1 ASP A 485 8.814 7.544 -9.905 1.00 0.00 O ATOM 721 OD2 ASP A 485 8.771 6.998 -12.030 1.00 0.00 O ATOM 0 H ASP A 485 6.591 3.775 -8.943 1.00 0.00 H new ATOM 0 HA ASP A 485 7.120 6.072 -8.477 1.00 0.00 H new ATOM 0 HB2 ASP A 485 8.247 4.720 -10.248 1.00 0.00 H new ATOM 0 HB3 ASP A 485 7.051 5.249 -11.415 1.00 0.00 H new ATOM 726 N GLU A 486 5.328 7.327 -10.841 1.00 0.00 N ATOM 727 CA GLU A 486 4.551 8.488 -11.243 1.00 0.00 C ATOM 728 C GLU A 486 3.047 8.200 -11.307 1.00 0.00 C ATOM 729 O GLU A 486 2.259 9.089 -11.593 1.00 0.00 O ATOM 730 CB GLU A 486 5.076 8.916 -12.622 1.00 0.00 C ATOM 731 CG GLU A 486 4.836 10.408 -12.840 1.00 0.00 C ATOM 732 CD GLU A 486 5.206 10.908 -14.249 1.00 0.00 C ATOM 733 OE1 GLU A 486 6.357 10.696 -14.704 1.00 0.00 O ATOM 734 OE2 GLU A 486 4.341 11.544 -14.904 1.00 0.00 O ATOM 0 H GLU A 486 5.610 6.756 -11.638 1.00 0.00 H new ATOM 0 HA GLU A 486 4.668 9.279 -10.502 1.00 0.00 H new ATOM 0 HB2 GLU A 486 6.141 8.697 -12.697 1.00 0.00 H new ATOM 0 HB3 GLU A 486 4.577 8.342 -13.403 1.00 0.00 H new ATOM 0 HG2 GLU A 486 3.784 10.626 -12.654 1.00 0.00 H new ATOM 0 HG3 GLU A 486 5.413 10.969 -12.105 1.00 0.00 H new ATOM 741 N THR A 487 2.608 6.971 -11.060 1.00 0.00 N ATOM 742 CA THR A 487 1.193 6.592 -11.228 1.00 0.00 C ATOM 743 C THR A 487 0.348 6.785 -9.972 1.00 0.00 C ATOM 744 O THR A 487 -0.826 7.141 -10.052 1.00 0.00 O ATOM 745 CB THR A 487 1.076 5.162 -11.763 1.00 0.00 C ATOM 746 OG1 THR A 487 1.821 5.021 -12.957 1.00 0.00 O ATOM 747 CG2 THR A 487 -0.365 4.783 -12.085 1.00 0.00 C ATOM 0 H THR A 487 3.208 6.210 -10.741 1.00 0.00 H new ATOM 0 HA THR A 487 0.780 7.282 -11.964 1.00 0.00 H new ATOM 0 HB THR A 487 1.457 4.510 -10.977 1.00 0.00 H new ATOM 0 HG1 THR A 487 1.739 4.102 -13.287 1.00 0.00 H new ATOM 0 HG21 THR A 487 -0.397 3.760 -12.461 1.00 0.00 H new ATOM 0 HG22 THR A 487 -0.971 4.857 -11.182 1.00 0.00 H new ATOM 0 HG23 THR A 487 -0.759 5.461 -12.843 1.00 0.00 H new ATOM 755 N LEU A 488 0.961 6.671 -8.801 1.00 0.00 N ATOM 756 CA LEU A 488 0.419 7.057 -7.499 1.00 0.00 C ATOM 757 C LEU A 488 -0.061 8.509 -7.522 1.00 0.00 C ATOM 758 O LEU A 488 -1.072 8.905 -6.946 1.00 0.00 O ATOM 759 CB LEU A 488 1.603 6.904 -6.529 1.00 0.00 C ATOM 760 CG LEU A 488 1.891 5.427 -6.250 1.00 0.00 C ATOM 761 CD1 LEU A 488 3.253 5.247 -5.594 1.00 0.00 C ATOM 762 CD2 LEU A 488 0.792 4.881 -5.350 1.00 0.00 C ATOM 0 H LEU A 488 1.902 6.285 -8.727 1.00 0.00 H new ATOM 0 HA LEU A 488 -0.439 6.449 -7.214 1.00 0.00 H new ATOM 0 HB2 LEU A 488 2.489 7.378 -6.952 1.00 0.00 H new ATOM 0 HB3 LEU A 488 1.382 7.419 -5.594 1.00 0.00 H new ATOM 0 HG LEU A 488 1.909 4.879 -7.192 1.00 0.00 H new ATOM 0 HD11 LEU A 488 3.430 4.188 -5.408 1.00 0.00 H new ATOM 0 HD12 LEU A 488 4.029 5.634 -6.255 1.00 0.00 H new ATOM 0 HD13 LEU A 488 3.277 5.790 -4.649 1.00 0.00 H new ATOM 0 HD21 LEU A 488 0.982 3.828 -5.141 1.00 0.00 H new ATOM 0 HD22 LEU A 488 0.777 5.440 -4.414 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -0.172 4.984 -5.849 1.00 0.00 H new ATOM 774 N GLU A 489 0.682 9.324 -8.250 1.00 0.00 N ATOM 775 CA GLU A 489 0.456 10.722 -8.486 1.00 0.00 C ATOM 776 C GLU A 489 -0.768 10.959 -9.385 1.00 0.00 C ATOM 777 O GLU A 489 -1.537 11.886 -9.147 1.00 0.00 O ATOM 778 CB GLU A 489 1.787 11.160 -9.075 1.00 0.00 C ATOM 779 CG GLU A 489 1.724 12.512 -9.766 1.00 0.00 C ATOM 780 CD GLU A 489 3.058 12.977 -10.365 1.00 0.00 C ATOM 781 OE1 GLU A 489 4.060 13.096 -9.620 1.00 0.00 O ATOM 782 OE2 GLU A 489 3.080 13.253 -11.591 1.00 0.00 O ATOM 0 H GLU A 489 1.521 8.991 -8.724 1.00 0.00 H new ATOM 0 HA GLU A 489 0.197 11.304 -7.601 1.00 0.00 H new ATOM 0 HB2 GLU A 489 2.532 11.200 -8.280 1.00 0.00 H new ATOM 0 HB3 GLU A 489 2.124 10.410 -9.790 1.00 0.00 H new ATOM 0 HG2 GLU A 489 0.979 12.467 -10.560 1.00 0.00 H new ATOM 0 HG3 GLU A 489 1.381 13.258 -9.049 1.00 0.00 H new ATOM 789 N LYS A 490 -1.018 10.091 -10.370 1.00 0.00 N ATOM 790 CA LYS A 490 -2.206 10.141 -11.221 1.00 0.00 C ATOM 791 C LYS A 490 -3.491 9.735 -10.478 1.00 0.00 C ATOM 792 O LYS A 490 -4.588 10.056 -10.941 1.00 0.00 O ATOM 793 CB LYS A 490 -1.939 9.304 -12.476 1.00 0.00 C ATOM 794 CG LYS A 490 -0.627 9.589 -13.211 1.00 0.00 C ATOM 795 CD LYS A 490 -0.257 11.056 -13.404 1.00 0.00 C ATOM 796 CE LYS A 490 1.191 11.082 -13.914 1.00 0.00 C ATOM 797 NZ LYS A 490 1.810 12.428 -13.973 1.00 0.00 N ATOM 0 H LYS A 490 -0.389 9.322 -10.600 1.00 0.00 H new ATOM 0 HA LYS A 490 -2.391 11.172 -11.521 1.00 0.00 H new ATOM 0 HB2 LYS A 490 -1.953 8.251 -12.195 1.00 0.00 H new ATOM 0 HB3 LYS A 490 -2.763 9.459 -13.173 1.00 0.00 H new ATOM 0 HG2 LYS A 490 0.182 9.103 -12.665 1.00 0.00 H new ATOM 0 HG3 LYS A 490 -0.677 9.118 -14.193 1.00 0.00 H new ATOM 0 HD2 LYS A 490 -0.928 11.534 -14.118 1.00 0.00 H new ATOM 0 HD3 LYS A 490 -0.347 11.605 -12.466 1.00 0.00 H new ATOM 0 HE2 LYS A 490 1.799 10.447 -13.270 1.00 0.00 H new ATOM 0 HE3 LYS A 490 1.217 10.642 -14.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 2.681 12.385 -14.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 1.145 13.097 -14.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 2.039 12.747 -13.010 1.00 0.00 H new ATOM 811 N LYS A 491 -3.364 9.085 -9.309 1.00 0.00 N ATOM 812 CA LYS A 491 -4.437 8.855 -8.330 1.00 0.00 C ATOM 813 C LYS A 491 -4.644 10.115 -7.510 1.00 0.00 C ATOM 814 O LYS A 491 -5.724 10.705 -7.512 1.00 0.00 O ATOM 815 CB LYS A 491 -4.140 7.602 -7.479 1.00 0.00 C ATOM 816 CG LYS A 491 -4.086 6.271 -8.246 1.00 0.00 C ATOM 817 CD LYS A 491 -5.437 5.883 -8.852 1.00 0.00 C ATOM 818 CE LYS A 491 -5.412 4.430 -9.340 1.00 0.00 C ATOM 819 NZ LYS A 491 -6.779 3.892 -9.556 1.00 0.00 N ATOM 0 H LYS A 491 -2.473 8.689 -9.009 1.00 0.00 H new ATOM 0 HA LYS A 491 -5.377 8.646 -8.840 1.00 0.00 H new ATOM 0 HB2 LYS A 491 -3.186 7.747 -6.973 1.00 0.00 H new ATOM 0 HB3 LYS A 491 -4.903 7.523 -6.704 1.00 0.00 H new ATOM 0 HG2 LYS A 491 -3.344 6.344 -9.041 1.00 0.00 H new ATOM 0 HG3 LYS A 491 -3.755 5.481 -7.572 1.00 0.00 H new ATOM 0 HD2 LYS A 491 -6.225 6.009 -8.109 1.00 0.00 H new ATOM 0 HD3 LYS A 491 -5.673 6.547 -9.683 1.00 0.00 H new ATOM 0 HE2 LYS A 491 -4.848 4.370 -10.271 1.00 0.00 H new ATOM 0 HE3 LYS A 491 -4.890 3.811 -8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 491 -6.745 3.131 -10.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 491 -7.149 3.515 -8.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 491 -7.402 4.653 -9.895 1.00 0.00 H new ATOM 833 N GLY A 492 -3.572 10.549 -6.872 1.00 0.00 N ATOM 834 CA GLY A 492 -3.428 11.862 -6.283 1.00 0.00 C ATOM 835 C GLY A 492 -2.644 11.916 -4.996 1.00 0.00 C ATOM 836 O GLY A 492 -2.893 12.733 -4.112 1.00 0.00 O ATOM 0 H GLY A 492 -2.743 9.968 -6.746 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -2.945 12.516 -7.009 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -4.422 12.269 -6.099 1.00 0.00 H new ATOM 840 N VAL A 493 -1.641 11.052 -4.945 1.00 0.00 N ATOM 841 CA VAL A 493 -0.575 11.095 -3.968 1.00 0.00 C ATOM 842 C VAL A 493 0.228 12.396 -4.123 1.00 0.00 C ATOM 843 O VAL A 493 0.604 13.053 -3.159 1.00 0.00 O ATOM 844 CB VAL A 493 0.234 9.817 -4.146 1.00 0.00 C ATOM 845 CG1 VAL A 493 1.491 9.921 -3.339 1.00 0.00 C ATOM 846 CG2 VAL A 493 -0.641 8.626 -3.730 1.00 0.00 C ATOM 0 H VAL A 493 -1.548 10.280 -5.605 1.00 0.00 H new ATOM 0 HA VAL A 493 -0.939 11.121 -2.941 1.00 0.00 H new ATOM 0 HB VAL A 493 0.527 9.668 -5.185 1.00 0.00 H new ATOM 0 HG11 VAL A 493 2.077 9.010 -3.460 1.00 0.00 H new ATOM 0 HG12 VAL A 493 2.074 10.776 -3.682 1.00 0.00 H new ATOM 0 HG13 VAL A 493 1.238 10.053 -2.287 1.00 0.00 H new ATOM 0 HG21 VAL A 493 -0.078 7.701 -3.851 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -0.935 8.738 -2.686 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -1.532 8.593 -4.357 1.00 0.00 H new ATOM 856 N LEU A 494 0.414 12.778 -5.385 1.00 0.00 N ATOM 857 CA LEU A 494 0.903 14.036 -5.958 1.00 0.00 C ATOM 858 C LEU A 494 2.167 14.676 -5.380 1.00 0.00 C ATOM 859 O LEU A 494 2.423 15.877 -5.493 1.00 0.00 O ATOM 860 CB LEU A 494 -0.267 15.005 -6.064 1.00 0.00 C ATOM 861 CG LEU A 494 -1.009 14.601 -7.338 1.00 0.00 C ATOM 862 CD1 LEU A 494 -2.473 14.771 -7.110 1.00 0.00 C ATOM 863 CD2 LEU A 494 -0.486 15.359 -8.543 1.00 0.00 C ATOM 0 H LEU A 494 0.195 12.122 -6.134 1.00 0.00 H new ATOM 0 HA LEU A 494 1.290 13.760 -6.939 1.00 0.00 H new ATOM 0 HB2 LEU A 494 -0.916 14.935 -5.191 1.00 0.00 H new ATOM 0 HB3 LEU A 494 0.080 16.037 -6.121 1.00 0.00 H new ATOM 0 HG LEU A 494 -0.828 13.551 -7.567 1.00 0.00 H new ATOM 0 HD11 LEU A 494 -3.017 14.487 -8.011 1.00 0.00 H new ATOM 0 HD12 LEU A 494 -2.788 14.138 -6.281 1.00 0.00 H new ATOM 0 HD13 LEU A 494 -2.686 15.813 -6.872 1.00 0.00 H new ATOM 0 HD21 LEU A 494 -1.034 15.050 -9.433 1.00 0.00 H new ATOM 0 HD22 LEU A 494 -0.622 16.429 -8.387 1.00 0.00 H new ATOM 0 HD23 LEU A 494 0.574 15.144 -8.676 1.00 0.00 H new ATOM 875 N ALA A 495 2.957 13.829 -4.760 1.00 0.00 N ATOM 876 CA ALA A 495 4.124 14.193 -3.967 1.00 0.00 C ATOM 877 C ALA A 495 5.136 13.074 -4.027 1.00 0.00 C ATOM 878 O ALA A 495 4.819 11.962 -3.616 1.00 0.00 O ATOM 879 CB ALA A 495 3.714 14.412 -2.507 1.00 0.00 C ATOM 0 H ALA A 495 2.802 12.821 -4.792 1.00 0.00 H new ATOM 0 HA ALA A 495 4.555 15.111 -4.366 1.00 0.00 H new ATOM 0 HB1 ALA A 495 4.591 14.684 -1.920 1.00 0.00 H new ATOM 0 HB2 ALA A 495 2.978 15.214 -2.452 1.00 0.00 H new ATOM 0 HB3 ALA A 495 3.281 13.494 -2.109 1.00 0.00 H new ATOM 885 N LEU A 496 6.355 13.367 -4.475 1.00 0.00 N ATOM 886 CA LEU A 496 7.467 12.419 -4.473 1.00 0.00 C ATOM 887 C LEU A 496 7.665 11.751 -3.132 1.00 0.00 C ATOM 888 O LEU A 496 7.696 10.526 -3.066 1.00 0.00 O ATOM 889 CB LEU A 496 8.701 13.107 -5.015 1.00 0.00 C ATOM 890 CG LEU A 496 10.050 12.387 -4.773 1.00 0.00 C ATOM 891 CD1 LEU A 496 11.027 12.796 -5.867 1.00 0.00 C ATOM 892 CD2 LEU A 496 10.742 12.755 -3.453 1.00 0.00 C ATOM 0 H LEU A 496 6.601 14.281 -4.854 1.00 0.00 H new ATOM 0 HA LEU A 496 7.234 11.587 -5.137 1.00 0.00 H new ATOM 0 HB2 LEU A 496 8.573 13.242 -6.089 1.00 0.00 H new ATOM 0 HB3 LEU A 496 8.760 14.102 -4.573 1.00 0.00 H new ATOM 0 HG LEU A 496 9.809 11.324 -4.757 1.00 0.00 H new ATOM 0 HD11 LEU A 496 11.982 12.295 -5.708 1.00 0.00 H new ATOM 0 HD12 LEU A 496 10.625 12.510 -6.839 1.00 0.00 H new ATOM 0 HD13 LEU A 496 11.174 13.876 -5.838 1.00 0.00 H new ATOM 0 HD21 LEU A 496 11.679 12.204 -3.367 1.00 0.00 H new ATOM 0 HD22 LEU A 496 10.948 13.825 -3.436 1.00 0.00 H new ATOM 0 HD23 LEU A 496 10.092 12.497 -2.617 1.00 0.00 H new ATOM 904 N GLY A 497 7.732 12.525 -2.054 1.00 0.00 N ATOM 905 CA GLY A 497 7.991 11.921 -0.756 1.00 0.00 C ATOM 906 C GLY A 497 6.793 11.233 -0.112 1.00 0.00 C ATOM 907 O GLY A 497 6.932 10.629 0.950 1.00 0.00 O ATOM 0 H GLY A 497 7.615 13.538 -2.051 1.00 0.00 H new ATOM 0 HA2 GLY A 497 8.793 11.192 -0.866 1.00 0.00 H new ATOM 0 HA3 GLY A 497 8.354 12.694 -0.079 1.00 0.00 H new ATOM 911 N ALA A 498 5.653 11.253 -0.800 1.00 0.00 N ATOM 912 CA ALA A 498 4.477 10.443 -0.482 1.00 0.00 C ATOM 913 C ALA A 498 4.462 9.178 -1.345 1.00 0.00 C ATOM 914 O ALA A 498 4.482 8.064 -0.831 1.00 0.00 O ATOM 915 CB ALA A 498 3.228 11.284 -0.701 1.00 0.00 C ATOM 0 H ALA A 498 5.517 11.849 -1.616 1.00 0.00 H new ATOM 0 HA ALA A 498 4.507 10.127 0.561 1.00 0.00 H new ATOM 0 HB1 ALA A 498 2.344 10.691 -0.467 1.00 0.00 H new ATOM 0 HB2 ALA A 498 3.260 12.159 -0.052 1.00 0.00 H new ATOM 0 HB3 ALA A 498 3.184 11.606 -1.741 1.00 0.00 H new ATOM 921 N ARG A 499 4.509 9.334 -2.672 1.00 0.00 N ATOM 922 CA ARG A 499 4.572 8.225 -3.639 1.00 0.00 C ATOM 923 C ARG A 499 5.746 7.268 -3.373 1.00 0.00 C ATOM 924 O ARG A 499 5.560 6.071 -3.478 1.00 0.00 O ATOM 925 CB ARG A 499 4.472 8.731 -5.100 1.00 0.00 C ATOM 926 CG ARG A 499 5.634 9.609 -5.566 1.00 0.00 C ATOM 927 CD ARG A 499 5.301 10.504 -6.778 1.00 0.00 C ATOM 928 NE ARG A 499 6.466 11.175 -7.396 1.00 0.00 N ATOM 929 CZ ARG A 499 7.437 10.614 -8.097 1.00 0.00 C ATOM 930 NH1 ARG A 499 7.471 9.335 -8.308 1.00 0.00 N ATOM 931 NH2 ARG A 499 8.398 11.325 -8.608 1.00 0.00 N ATOM 0 H ARG A 499 4.504 10.252 -3.116 1.00 0.00 H new ATOM 0 HA ARG A 499 3.687 7.608 -3.486 1.00 0.00 H new ATOM 0 HB2 ARG A 499 4.401 7.868 -5.762 1.00 0.00 H new ATOM 0 HB3 ARG A 499 3.545 9.294 -5.210 1.00 0.00 H new ATOM 0 HG2 ARG A 499 5.952 10.242 -4.737 1.00 0.00 H new ATOM 0 HG3 ARG A 499 6.479 8.969 -5.822 1.00 0.00 H new ATOM 0 HD2 ARG A 499 4.807 9.896 -7.535 1.00 0.00 H new ATOM 0 HD3 ARG A 499 4.586 11.265 -6.464 1.00 0.00 H new ATOM 0 HE ARG A 499 6.527 12.185 -7.267 1.00 0.00 H new ATOM 0 HH11 ARG A 499 6.737 8.736 -7.930 1.00 0.00 H new ATOM 0 HH12 ARG A 499 8.232 8.928 -8.852 1.00 0.00 H new ATOM 0 HH21 ARG A 499 8.413 12.336 -8.471 1.00 0.00 H new ATOM 0 HH22 ARG A 499 9.137 10.872 -9.145 1.00 0.00 H new ATOM 945 N ARG A 500 6.909 7.729 -2.898 1.00 0.00 N ATOM 946 CA ARG A 500 8.126 6.954 -2.586 1.00 0.00 C ATOM 947 C ARG A 500 7.978 6.270 -1.224 1.00 0.00 C ATOM 948 O ARG A 500 8.387 5.125 -1.051 1.00 0.00 O ATOM 949 CB ARG A 500 9.266 7.969 -2.591 1.00 0.00 C ATOM 950 CG ARG A 500 10.553 7.397 -2.034 1.00 0.00 C ATOM 951 CD ARG A 500 11.642 8.446 -2.217 1.00 0.00 C ATOM 952 NE ARG A 500 12.936 7.991 -1.672 1.00 0.00 N ATOM 953 CZ ARG A 500 14.072 8.666 -1.643 1.00 0.00 C ATOM 954 NH1 ARG A 500 14.171 9.874 -2.121 1.00 0.00 N ATOM 955 NH2 ARG A 500 15.142 8.135 -1.125 1.00 0.00 N ATOM 0 H ARG A 500 7.038 8.722 -2.706 1.00 0.00 H new ATOM 0 HA ARG A 500 8.312 6.159 -3.308 1.00 0.00 H new ATOM 0 HB2 ARG A 500 9.437 8.314 -3.611 1.00 0.00 H new ATOM 0 HB3 ARG A 500 8.975 8.840 -2.004 1.00 0.00 H new ATOM 0 HG2 ARG A 500 10.436 7.147 -0.980 1.00 0.00 H new ATOM 0 HG3 ARG A 500 10.818 6.476 -2.552 1.00 0.00 H new ATOM 0 HD2 ARG A 500 11.754 8.674 -3.277 1.00 0.00 H new ATOM 0 HD3 ARG A 500 11.344 9.370 -1.722 1.00 0.00 H new ATOM 0 HE ARG A 500 12.956 7.052 -1.274 1.00 0.00 H new ATOM 0 HH11 ARG A 500 13.356 10.327 -2.534 1.00 0.00 H new ATOM 0 HH12 ARG A 500 15.064 10.366 -2.082 1.00 0.00 H new ATOM 0 HH21 ARG A 500 15.107 7.192 -0.738 1.00 0.00 H new ATOM 0 HH22 ARG A 500 16.015 8.662 -1.106 1.00 0.00 H new ATOM 969 N LYS A 501 7.343 6.936 -0.253 1.00 0.00 N ATOM 970 CA LYS A 501 6.849 6.234 0.949 1.00 0.00 C ATOM 971 C LYS A 501 5.971 5.067 0.547 1.00 0.00 C ATOM 972 O LYS A 501 5.970 4.016 1.181 1.00 0.00 O ATOM 973 CB LYS A 501 5.928 7.156 1.748 1.00 0.00 C ATOM 974 CG LYS A 501 6.266 7.308 3.240 1.00 0.00 C ATOM 975 CD LYS A 501 7.113 8.550 3.546 1.00 0.00 C ATOM 976 CE LYS A 501 8.474 8.547 2.836 1.00 0.00 C ATOM 977 NZ LYS A 501 9.185 9.834 3.050 1.00 0.00 N ATOM 0 H LYS A 501 7.159 7.939 -0.268 1.00 0.00 H new ATOM 0 HA LYS A 501 7.721 5.917 1.521 1.00 0.00 H new ATOM 0 HB2 LYS A 501 5.946 8.144 1.288 1.00 0.00 H new ATOM 0 HB3 LYS A 501 4.908 6.783 1.662 1.00 0.00 H new ATOM 0 HG2 LYS A 501 5.340 7.358 3.812 1.00 0.00 H new ATOM 0 HG3 LYS A 501 6.801 6.420 3.577 1.00 0.00 H new ATOM 0 HD2 LYS A 501 6.559 9.441 3.251 1.00 0.00 H new ATOM 0 HD3 LYS A 501 7.273 8.616 4.622 1.00 0.00 H new ATOM 0 HE2 LYS A 501 9.082 7.724 3.210 1.00 0.00 H new ATOM 0 HE3 LYS A 501 8.332 8.378 1.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 10.173 9.740 2.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 8.719 10.584 2.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 9.160 10.080 4.060 1.00 0.00 H new ATOM 991 N LEU A 502 5.192 5.282 -0.506 1.00 0.00 N ATOM 992 CA LEU A 502 4.324 4.251 -0.992 1.00 0.00 C ATOM 993 C LEU A 502 5.103 3.171 -1.761 1.00 0.00 C ATOM 994 O LEU A 502 4.691 2.020 -1.735 1.00 0.00 O ATOM 995 CB LEU A 502 3.205 4.829 -1.854 1.00 0.00 C ATOM 996 CG LEU A 502 1.872 4.972 -1.094 1.00 0.00 C ATOM 997 CD1 LEU A 502 1.974 6.016 0.016 1.00 0.00 C ATOM 998 CD2 LEU A 502 0.754 5.431 -2.027 1.00 0.00 C ATOM 0 H LEU A 502 5.153 6.158 -1.027 1.00 0.00 H new ATOM 0 HA LEU A 502 3.869 3.776 -0.122 1.00 0.00 H new ATOM 0 HB2 LEU A 502 3.510 5.806 -2.228 1.00 0.00 H new ATOM 0 HB3 LEU A 502 3.055 4.188 -2.722 1.00 0.00 H new ATOM 0 HG LEU A 502 1.652 3.989 -0.678 1.00 0.00 H new ATOM 0 HD11 LEU A 502 1.017 6.093 0.533 1.00 0.00 H new ATOM 0 HD12 LEU A 502 2.747 5.719 0.725 1.00 0.00 H new ATOM 0 HD13 LEU A 502 2.231 6.983 -0.416 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -0.175 5.523 -1.464 1.00 0.00 H new ATOM 0 HD22 LEU A 502 1.014 6.397 -2.459 1.00 0.00 H new ATOM 0 HD23 LEU A 502 0.623 4.700 -2.825 1.00 0.00 H new ATOM 1010 N LEU A 503 6.243 3.492 -2.392 1.00 0.00 N ATOM 1011 CA LEU A 503 7.109 2.548 -3.075 1.00 0.00 C ATOM 1012 C LEU A 503 7.619 1.519 -2.063 1.00 0.00 C ATOM 1013 O LEU A 503 7.615 0.318 -2.339 1.00 0.00 O ATOM 1014 CB LEU A 503 8.325 3.271 -3.708 1.00 0.00 C ATOM 1015 CG LEU A 503 8.175 3.772 -5.142 1.00 0.00 C ATOM 1016 CD1 LEU A 503 6.998 4.650 -5.513 1.00 0.00 C ATOM 1017 CD2 LEU A 503 9.463 4.420 -5.653 1.00 0.00 C ATOM 0 H LEU A 503 6.589 4.450 -2.436 1.00 0.00 H new ATOM 0 HA LEU A 503 6.539 2.062 -3.866 1.00 0.00 H new ATOM 0 HB2 LEU A 503 8.575 4.124 -3.077 1.00 0.00 H new ATOM 0 HB3 LEU A 503 9.176 2.590 -3.676 1.00 0.00 H new ATOM 0 HG LEU A 503 7.948 2.832 -5.644 1.00 0.00 H new ATOM 0 HD11 LEU A 503 7.056 4.909 -6.570 1.00 0.00 H new ATOM 0 HD12 LEU A 503 6.069 4.113 -5.321 1.00 0.00 H new ATOM 0 HD13 LEU A 503 7.021 5.561 -4.915 1.00 0.00 H new ATOM 0 HD21 LEU A 503 9.316 4.764 -6.677 1.00 0.00 H new ATOM 0 HD22 LEU A 503 9.720 5.268 -5.019 1.00 0.00 H new ATOM 0 HD23 LEU A 503 10.272 3.690 -5.628 1.00 0.00 H new ATOM 1029 N LYS A 504 8.005 2.010 -0.870 1.00 0.00 N ATOM 1030 CA LYS A 504 8.315 1.191 0.303 1.00 0.00 C ATOM 1031 C LYS A 504 7.158 0.236 0.592 1.00 0.00 C ATOM 1032 O LYS A 504 7.299 -0.981 0.520 1.00 0.00 O ATOM 1033 CB LYS A 504 8.621 2.077 1.534 1.00 0.00 C ATOM 1034 CG LYS A 504 8.914 1.304 2.832 1.00 0.00 C ATOM 1035 CD LYS A 504 8.487 2.057 4.106 1.00 0.00 C ATOM 1036 CE LYS A 504 6.969 1.987 4.402 1.00 0.00 C ATOM 1037 NZ LYS A 504 6.714 2.169 5.858 1.00 0.00 N ATOM 0 H LYS A 504 8.110 3.010 -0.698 1.00 0.00 H new ATOM 0 HA LYS A 504 9.208 0.604 0.091 1.00 0.00 H new ATOM 0 HB2 LYS A 504 9.478 2.710 1.304 1.00 0.00 H new ATOM 0 HB3 LYS A 504 7.773 2.740 1.706 1.00 0.00 H new ATOM 0 HG2 LYS A 504 8.399 0.344 2.798 1.00 0.00 H new ATOM 0 HG3 LYS A 504 9.982 1.092 2.886 1.00 0.00 H new ATOM 0 HD2 LYS A 504 9.032 1.648 4.957 1.00 0.00 H new ATOM 0 HD3 LYS A 504 8.780 3.103 4.013 1.00 0.00 H new ATOM 0 HE2 LYS A 504 6.446 2.758 3.836 1.00 0.00 H new ATOM 0 HE3 LYS A 504 6.572 1.026 4.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 504 5.691 2.119 6.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 504 7.197 1.419 6.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 504 7.075 3.096 6.160 1.00 0.00 H new ATOM 1051 N ALA A 505 6.008 0.823 0.912 1.00 0.00 N ATOM 1052 CA ALA A 505 4.796 0.160 1.356 1.00 0.00 C ATOM 1053 C ALA A 505 4.424 -0.977 0.392 1.00 0.00 C ATOM 1054 O ALA A 505 4.280 -2.148 0.778 1.00 0.00 O ATOM 1055 CB ALA A 505 3.737 1.262 1.475 1.00 0.00 C ATOM 0 H ALA A 505 5.896 1.836 0.864 1.00 0.00 H new ATOM 0 HA ALA A 505 4.906 -0.332 2.322 1.00 0.00 H new ATOM 0 HB1 ALA A 505 2.795 0.827 1.807 1.00 0.00 H new ATOM 0 HB2 ALA A 505 4.067 2.008 2.198 1.00 0.00 H new ATOM 0 HB3 ALA A 505 3.595 1.736 0.504 1.00 0.00 H new ATOM 1061 N PHE A 506 4.388 -0.613 -0.893 1.00 0.00 N ATOM 1062 CA PHE A 506 4.121 -1.494 -2.001 1.00 0.00 C ATOM 1063 C PHE A 506 5.110 -2.622 -2.041 1.00 0.00 C ATOM 1064 O PHE A 506 4.695 -3.751 -1.827 1.00 0.00 O ATOM 1065 CB PHE A 506 4.104 -0.748 -3.333 1.00 0.00 C ATOM 1066 CG PHE A 506 2.940 0.189 -3.537 1.00 0.00 C ATOM 1067 CD1 PHE A 506 1.869 0.254 -2.624 1.00 0.00 C ATOM 1068 CD2 PHE A 506 2.918 0.973 -4.698 1.00 0.00 C ATOM 1069 CE1 PHE A 506 0.799 1.129 -2.844 1.00 0.00 C ATOM 1070 CE2 PHE A 506 1.825 1.813 -4.942 1.00 0.00 C ATOM 1071 CZ PHE A 506 0.772 1.899 -4.015 1.00 0.00 C ATOM 0 H PHE A 506 4.553 0.349 -1.188 1.00 0.00 H new ATOM 0 HA PHE A 506 3.126 -1.910 -1.846 1.00 0.00 H new ATOM 0 HB2 PHE A 506 5.028 -0.176 -3.421 1.00 0.00 H new ATOM 0 HB3 PHE A 506 4.104 -1.481 -4.140 1.00 0.00 H new ATOM 0 HD1 PHE A 506 1.874 -0.377 -1.747 1.00 0.00 H new ATOM 0 HD2 PHE A 506 3.738 0.930 -5.399 1.00 0.00 H new ATOM 0 HE1 PHE A 506 0.003 1.210 -2.119 1.00 0.00 H new ATOM 0 HE2 PHE A 506 1.791 2.399 -5.849 1.00 0.00 H new ATOM 0 HZ PHE A 506 -0.060 2.560 -4.205 1.00 0.00 H new ATOM 1081 N GLY A 507 6.396 -2.388 -2.307 1.00 0.00 N ATOM 1082 CA GLY A 507 7.229 -3.540 -2.559 1.00 0.00 C ATOM 1083 C GLY A 507 7.555 -4.428 -1.366 1.00 0.00 C ATOM 1084 O GLY A 507 8.022 -5.540 -1.588 1.00 0.00 O ATOM 0 H GLY A 507 6.850 -1.476 -2.350 1.00 0.00 H new ATOM 0 HA2 GLY A 507 6.740 -4.154 -3.315 1.00 0.00 H new ATOM 0 HA3 GLY A 507 8.168 -3.192 -2.990 1.00 0.00 H new ATOM 1088 N ILE A 508 7.259 -4.008 -0.128 1.00 0.00 N ATOM 1089 CA ILE A 508 7.244 -4.946 0.996 1.00 0.00 C ATOM 1090 C ILE A 508 6.046 -5.873 0.781 1.00 0.00 C ATOM 1091 O ILE A 508 6.246 -7.076 0.727 1.00 0.00 O ATOM 1092 CB ILE A 508 7.206 -4.268 2.386 1.00 0.00 C ATOM 1093 CG1 ILE A 508 8.611 -3.863 2.892 1.00 0.00 C ATOM 1094 CG2 ILE A 508 6.658 -5.242 3.454 1.00 0.00 C ATOM 1095 CD1 ILE A 508 9.256 -2.673 2.189 1.00 0.00 C ATOM 0 H ILE A 508 7.031 -3.044 0.115 1.00 0.00 H new ATOM 0 HA ILE A 508 8.181 -5.502 1.007 1.00 0.00 H new ATOM 0 HB ILE A 508 6.576 -3.388 2.256 1.00 0.00 H new ATOM 0 HG12 ILE A 508 8.541 -3.637 3.956 1.00 0.00 H new ATOM 0 HG13 ILE A 508 9.274 -4.722 2.791 1.00 0.00 H new ATOM 0 HG21 ILE A 508 6.640 -4.745 4.424 1.00 0.00 H new ATOM 0 HG22 ILE A 508 5.647 -5.547 3.183 1.00 0.00 H new ATOM 0 HG23 ILE A 508 7.300 -6.121 3.509 1.00 0.00 H new ATOM 0 HD11 ILE A 508 10.236 -2.480 2.625 1.00 0.00 H new ATOM 0 HD12 ILE A 508 9.369 -2.895 1.128 1.00 0.00 H new ATOM 0 HD13 ILE A 508 8.625 -1.793 2.311 1.00 0.00 H new ATOM 1107 N VAL A 509 4.816 -5.373 0.591 1.00 0.00 N ATOM 1108 CA VAL A 509 3.657 -6.252 0.395 1.00 0.00 C ATOM 1109 C VAL A 509 3.780 -7.022 -0.923 1.00 0.00 C ATOM 1110 O VAL A 509 3.379 -8.172 -0.979 1.00 0.00 O ATOM 1111 CB VAL A 509 2.334 -5.491 0.563 1.00 0.00 C ATOM 1112 CG1 VAL A 509 2.056 -4.506 -0.539 1.00 0.00 C ATOM 1113 CG2 VAL A 509 1.119 -6.407 0.660 1.00 0.00 C ATOM 0 H VAL A 509 4.601 -4.376 0.569 1.00 0.00 H new ATOM 0 HA VAL A 509 3.646 -7.006 1.182 1.00 0.00 H new ATOM 0 HB VAL A 509 2.479 -4.958 1.503 1.00 0.00 H new ATOM 0 HG11 VAL A 509 1.105 -4.008 -0.351 1.00 0.00 H new ATOM 0 HG12 VAL A 509 2.854 -3.764 -0.573 1.00 0.00 H new ATOM 0 HG13 VAL A 509 2.008 -5.031 -1.493 1.00 0.00 H new ATOM 0 HG21 VAL A 509 0.218 -5.805 0.777 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.040 -7.005 -0.248 1.00 0.00 H new ATOM 0 HG23 VAL A 509 1.229 -7.067 1.520 1.00 0.00 H new ATOM 1123 N ILE A 510 4.421 -6.474 -1.961 1.00 0.00 N ATOM 1124 CA ILE A 510 4.828 -7.201 -3.170 1.00 0.00 C ATOM 1125 C ILE A 510 5.700 -8.411 -2.848 1.00 0.00 C ATOM 1126 O ILE A 510 5.444 -9.494 -3.362 1.00 0.00 O ATOM 1127 CB ILE A 510 5.431 -6.306 -4.243 1.00 0.00 C ATOM 1128 CG1 ILE A 510 4.293 -5.374 -4.730 1.00 0.00 C ATOM 1129 CG2 ILE A 510 6.043 -7.100 -5.415 1.00 0.00 C ATOM 1130 CD1 ILE A 510 4.688 -4.418 -5.849 1.00 0.00 C ATOM 0 H ILE A 510 4.678 -5.487 -1.985 1.00 0.00 H new ATOM 0 HA ILE A 510 3.908 -7.588 -3.609 1.00 0.00 H new ATOM 0 HB ILE A 510 6.262 -5.738 -3.825 1.00 0.00 H new ATOM 0 HG12 ILE A 510 3.460 -5.988 -5.072 1.00 0.00 H new ATOM 0 HG13 ILE A 510 3.932 -4.791 -3.883 1.00 0.00 H new ATOM 0 HG21 ILE A 510 6.457 -6.407 -6.147 1.00 0.00 H new ATOM 0 HG22 ILE A 510 6.835 -7.748 -5.041 1.00 0.00 H new ATOM 0 HG23 ILE A 510 5.270 -7.707 -5.886 1.00 0.00 H new ATOM 0 HD11 ILE A 510 3.829 -3.806 -6.125 1.00 0.00 H new ATOM 0 HD12 ILE A 510 5.498 -3.774 -5.508 1.00 0.00 H new ATOM 0 HD13 ILE A 510 5.019 -4.990 -6.716 1.00 0.00 H new ATOM 1142 N ASP A 511 6.649 -8.292 -1.921 1.00 0.00 N ATOM 1143 CA ASP A 511 7.600 -9.342 -1.505 1.00 0.00 C ATOM 1144 C ASP A 511 7.044 -10.430 -0.629 1.00 0.00 C ATOM 1145 O ASP A 511 7.731 -11.209 0.029 1.00 0.00 O ATOM 1146 CB ASP A 511 8.759 -8.684 -0.785 1.00 0.00 C ATOM 1147 CG ASP A 511 10.071 -9.487 -0.791 1.00 0.00 C ATOM 1148 OD1 ASP A 511 10.429 -10.046 -1.856 1.00 0.00 O ATOM 1149 OD2 ASP A 511 10.772 -9.521 0.249 1.00 0.00 O ATOM 0 H ASP A 511 6.789 -7.421 -1.410 1.00 0.00 H new ATOM 0 HA ASP A 511 7.895 -9.843 -2.427 1.00 0.00 H new ATOM 0 HB2 ASP A 511 8.944 -7.711 -1.240 1.00 0.00 H new ATOM 0 HB3 ASP A 511 8.468 -8.501 0.249 1.00 0.00 H new ATOM 1154 N TYR A 512 5.741 -10.434 -0.675 1.00 0.00 N ATOM 1155 CA TYR A 512 4.855 -11.101 0.199 1.00 0.00 C ATOM 1156 C TYR A 512 3.627 -11.547 -0.592 1.00 0.00 C ATOM 1157 O TYR A 512 3.048 -12.580 -0.317 1.00 0.00 O ATOM 1158 CB TYR A 512 4.455 -10.070 1.243 1.00 0.00 C ATOM 1159 CG TYR A 512 5.083 -9.981 2.617 1.00 0.00 C ATOM 1160 CD1 TYR A 512 6.326 -9.336 2.747 1.00 0.00 C ATOM 1161 CD2 TYR A 512 4.372 -10.348 3.770 1.00 0.00 C ATOM 1162 CE1 TYR A 512 6.887 -9.086 4.009 1.00 0.00 C ATOM 1163 CE2 TYR A 512 4.942 -10.151 5.044 1.00 0.00 C ATOM 1164 CZ TYR A 512 6.203 -9.519 5.167 1.00 0.00 C ATOM 1165 OH TYR A 512 6.740 -9.294 6.395 1.00 0.00 O ATOM 0 H TYR A 512 5.240 -9.918 -1.398 1.00 0.00 H new ATOM 0 HA TYR A 512 5.305 -11.980 0.660 1.00 0.00 H new ATOM 0 HB2 TYR A 512 4.595 -9.094 0.779 1.00 0.00 H new ATOM 0 HB3 TYR A 512 3.384 -10.196 1.403 1.00 0.00 H new ATOM 0 HD1 TYR A 512 6.859 -9.027 1.860 1.00 0.00 H new ATOM 0 HD2 TYR A 512 3.387 -10.782 3.681 1.00 0.00 H new ATOM 0 HE1 TYR A 512 7.831 -8.568 4.094 1.00 0.00 H new ATOM 0 HE2 TYR A 512 4.416 -10.482 5.927 1.00 0.00 H new ATOM 0 HH TYR A 512 6.143 -9.653 7.084 1.00 0.00 H new ATOM 1175 N LYS A 513 3.229 -10.798 -1.619 1.00 0.00 N ATOM 1176 CA LYS A 513 2.073 -11.062 -2.458 1.00 0.00 C ATOM 1177 C LYS A 513 2.505 -11.886 -3.653 1.00 0.00 C ATOM 1178 O LYS A 513 1.934 -12.931 -3.944 1.00 0.00 O ATOM 1179 CB LYS A 513 1.528 -9.676 -2.811 1.00 0.00 C ATOM 1180 CG LYS A 513 0.368 -9.640 -3.785 1.00 0.00 C ATOM 1181 CD LYS A 513 0.817 -9.735 -5.246 1.00 0.00 C ATOM 1182 CE LYS A 513 -0.411 -10.124 -6.070 1.00 0.00 C ATOM 1183 NZ LYS A 513 -0.054 -10.577 -7.439 1.00 0.00 N ATOM 0 H LYS A 513 3.730 -9.954 -1.897 1.00 0.00 H new ATOM 0 HA LYS A 513 1.289 -11.649 -1.980 1.00 0.00 H new ATOM 0 HB2 LYS A 513 1.216 -9.186 -1.889 1.00 0.00 H new ATOM 0 HB3 LYS A 513 2.343 -9.084 -3.227 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -0.312 -10.463 -3.564 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -0.193 -8.716 -3.641 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.223 -8.783 -5.587 1.00 0.00 H new ATOM 0 HD3 LYS A 513 1.607 -10.477 -5.359 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -0.953 -10.919 -5.557 1.00 0.00 H new ATOM 0 HE3 LYS A 513 -1.086 -9.270 -6.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -0.510 -11.492 -7.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 -0.380 -9.874 -8.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 0.978 -10.682 -7.512 1.00 0.00 H new ATOM 1197 N GLU A 514 3.568 -11.420 -4.314 1.00 0.00 N ATOM 1198 CA GLU A 514 4.307 -12.132 -5.350 1.00 0.00 C ATOM 1199 C GLU A 514 5.015 -13.376 -4.765 1.00 0.00 C ATOM 1200 O GLU A 514 5.596 -14.170 -5.507 1.00 0.00 O ATOM 1201 CB GLU A 514 5.301 -11.117 -5.948 1.00 0.00 C ATOM 1202 CG GLU A 514 5.712 -11.443 -7.387 1.00 0.00 C ATOM 1203 CD GLU A 514 6.652 -10.371 -7.979 1.00 0.00 C ATOM 1204 OE1 GLU A 514 7.894 -10.489 -7.824 1.00 0.00 O ATOM 1205 OE2 GLU A 514 6.157 -9.420 -8.630 1.00 0.00 O ATOM 0 H GLU A 514 3.951 -10.493 -4.130 1.00 0.00 H new ATOM 0 HA GLU A 514 3.645 -12.512 -6.128 1.00 0.00 H new ATOM 0 HB2 GLU A 514 4.854 -10.123 -5.922 1.00 0.00 H new ATOM 0 HB3 GLU A 514 6.193 -11.082 -5.322 1.00 0.00 H new ATOM 0 HG2 GLU A 514 6.208 -12.413 -7.411 1.00 0.00 H new ATOM 0 HG3 GLU A 514 4.820 -11.526 -8.008 1.00 0.00 H new ATOM 1212 N ARG A 515 4.976 -13.536 -3.426 1.00 0.00 N ATOM 1213 CA ARG A 515 5.614 -14.653 -2.679 1.00 0.00 C ATOM 1214 C ARG A 515 4.600 -15.623 -2.105 1.00 0.00 C ATOM 1215 O ARG A 515 4.751 -16.825 -2.314 1.00 0.00 O ATOM 1216 CB ARG A 515 6.557 -14.173 -1.560 1.00 0.00 C ATOM 1217 CG ARG A 515 7.954 -13.747 -2.039 1.00 0.00 C ATOM 1218 CD ARG A 515 7.812 -12.684 -3.118 1.00 0.00 C ATOM 1219 NE ARG A 515 9.052 -11.948 -3.395 1.00 0.00 N ATOM 1220 CZ ARG A 515 9.413 -11.459 -4.564 1.00 0.00 C ATOM 1221 NH1 ARG A 515 8.894 -11.885 -5.679 1.00 0.00 N ATOM 1222 NH2 ARG A 515 10.286 -10.502 -4.606 1.00 0.00 N ATOM 0 H ARG A 515 4.490 -12.880 -2.815 1.00 0.00 H new ATOM 0 HA ARG A 515 6.214 -15.175 -3.424 1.00 0.00 H new ATOM 0 HB2 ARG A 515 6.091 -13.332 -1.046 1.00 0.00 H new ATOM 0 HB3 ARG A 515 6.667 -14.973 -0.827 1.00 0.00 H new ATOM 0 HG2 ARG A 515 8.535 -13.358 -1.203 1.00 0.00 H new ATOM 0 HG3 ARG A 515 8.496 -14.608 -2.430 1.00 0.00 H new ATOM 0 HD2 ARG A 515 7.469 -13.158 -4.038 1.00 0.00 H new ATOM 0 HD3 ARG A 515 7.040 -11.976 -2.817 1.00 0.00 H new ATOM 0 HE ARG A 515 9.691 -11.802 -2.613 1.00 0.00 H new ATOM 0 HH11 ARG A 515 8.186 -12.619 -5.664 1.00 0.00 H new ATOM 0 HH12 ARG A 515 9.196 -11.485 -6.568 1.00 0.00 H new ATOM 0 HH21 ARG A 515 10.684 -10.137 -3.741 1.00 0.00 H new ATOM 0 HH22 ARG A 515 10.575 -10.114 -5.504 1.00 0.00 H new ATOM 1236 N ASP A 516 3.614 -15.078 -1.392 1.00 0.00 N ATOM 1237 CA ASP A 516 2.387 -15.705 -0.863 1.00 0.00 C ATOM 1238 C ASP A 516 2.475 -15.865 0.668 1.00 0.00 C ATOM 1239 O ASP A 516 2.480 -16.957 1.245 1.00 0.00 O ATOM 1240 CB ASP A 516 1.979 -16.983 -1.614 1.00 0.00 C ATOM 1241 CG ASP A 516 0.561 -17.475 -1.281 1.00 0.00 C ATOM 1242 OD1 ASP A 516 -0.195 -16.763 -0.581 1.00 0.00 O ATOM 1243 OD2 ASP A 516 0.200 -18.594 -1.720 1.00 0.00 O ATOM 0 H ASP A 516 3.652 -14.090 -1.142 1.00 0.00 H new ATOM 0 HA ASP A 516 1.557 -15.025 -1.058 1.00 0.00 H new ATOM 0 HB2 ASP A 516 2.047 -16.800 -2.686 1.00 0.00 H new ATOM 0 HB3 ASP A 516 2.692 -17.774 -1.380 1.00 0.00 H new ATOM 1248 N LEU A 517 2.606 -14.706 1.306 1.00 0.00 N ATOM 1249 CA LEU A 517 2.918 -14.414 2.707 1.00 0.00 C ATOM 1250 C LEU A 517 1.716 -13.771 3.420 1.00 0.00 C ATOM 1251 O LEU A 517 1.540 -13.947 4.627 1.00 0.00 O ATOM 1252 CB LEU A 517 4.151 -13.479 2.673 1.00 0.00 C ATOM 1253 CG LEU A 517 5.438 -14.122 2.109 1.00 0.00 C ATOM 1254 CD1 LEU A 517 6.689 -13.352 2.538 1.00 0.00 C ATOM 1255 CD2 LEU A 517 5.689 -15.575 2.521 1.00 0.00 C ATOM 0 H LEU A 517 2.480 -13.836 0.788 1.00 0.00 H new ATOM 0 HA LEU A 517 3.136 -15.319 3.274 1.00 0.00 H new ATOM 0 HB2 LEU A 517 3.907 -12.602 2.074 1.00 0.00 H new ATOM 0 HB3 LEU A 517 4.351 -13.128 3.685 1.00 0.00 H new ATOM 0 HG LEU A 517 5.263 -14.087 1.034 1.00 0.00 H new ATOM 0 HD11 LEU A 517 7.574 -13.834 2.122 1.00 0.00 H new ATOM 0 HD12 LEU A 517 6.629 -12.327 2.172 1.00 0.00 H new ATOM 0 HD13 LEU A 517 6.757 -13.345 3.626 1.00 0.00 H new ATOM 0 HD21 LEU A 517 6.617 -15.926 2.070 1.00 0.00 H new ATOM 0 HD22 LEU A 517 5.767 -15.637 3.606 1.00 0.00 H new ATOM 0 HD23 LEU A 517 4.862 -16.198 2.180 1.00 0.00 H new ATOM 1267 N ILE A 518 0.866 -13.063 2.667 1.00 0.00 N ATOM 1268 CA ILE A 518 -0.449 -12.573 3.103 1.00 0.00 C ATOM 1269 C ILE A 518 -1.441 -13.747 3.310 1.00 0.00 C ATOM 1270 O ILE A 518 -1.327 -14.803 2.691 1.00 0.00 O ATOM 1271 CB ILE A 518 -1.027 -11.572 2.073 1.00 0.00 C ATOM 1272 CG1 ILE A 518 -0.049 -10.744 1.216 1.00 0.00 C ATOM 1273 CG2 ILE A 518 -2.026 -10.633 2.766 1.00 0.00 C ATOM 1274 CD1 ILE A 518 0.795 -9.741 1.990 1.00 0.00 C ATOM 0 H ILE A 518 1.081 -12.806 1.704 1.00 0.00 H new ATOM 0 HA ILE A 518 -0.313 -12.062 4.056 1.00 0.00 H new ATOM 0 HB ILE A 518 -1.495 -12.229 1.340 1.00 0.00 H new ATOM 0 HG12 ILE A 518 0.618 -11.427 0.690 1.00 0.00 H new ATOM 0 HG13 ILE A 518 -0.619 -10.208 0.457 1.00 0.00 H new ATOM 0 HG21 ILE A 518 -2.430 -9.930 2.037 1.00 0.00 H new ATOM 0 HG22 ILE A 518 -2.839 -11.219 3.195 1.00 0.00 H new ATOM 0 HG23 ILE A 518 -1.519 -10.083 3.558 1.00 0.00 H new ATOM 0 HD11 ILE A 518 1.450 -9.208 1.301 1.00 0.00 H new ATOM 0 HD12 ILE A 518 0.142 -9.028 2.494 1.00 0.00 H new ATOM 0 HD13 ILE A 518 1.398 -10.267 2.730 1.00 0.00 H new ATOM 1286 N ASP A 519 -2.465 -13.549 4.141 1.00 0.00 N ATOM 1287 CA ASP A 519 -3.409 -14.544 4.692 1.00 0.00 C ATOM 1288 C ASP A 519 -4.434 -15.211 3.753 1.00 0.00 C ATOM 1289 O ASP A 519 -5.376 -15.838 4.242 1.00 0.00 O ATOM 1290 CB ASP A 519 -4.143 -13.889 5.875 1.00 0.00 C ATOM 1291 CG ASP A 519 -3.181 -13.324 6.919 1.00 0.00 C ATOM 1292 OD1 ASP A 519 -2.640 -12.225 6.669 1.00 0.00 O ATOM 1293 OD2 ASP A 519 -2.954 -13.960 7.975 1.00 0.00 O ATOM 0 H ASP A 519 -2.681 -12.611 4.480 1.00 0.00 H new ATOM 0 HA ASP A 519 -2.772 -15.387 4.961 1.00 0.00 H new ATOM 0 HB2 ASP A 519 -4.782 -13.088 5.503 1.00 0.00 H new ATOM 0 HB3 ASP A 519 -4.795 -14.625 6.346 1.00 0.00 H new ATOM 1298 N ARG A 520 -4.312 -15.081 2.424 1.00 0.00 N ATOM 1299 CA ARG A 520 -5.215 -15.575 1.362 1.00 0.00 C ATOM 1300 C ARG A 520 -6.599 -14.916 1.343 1.00 0.00 C ATOM 1301 O ARG A 520 -7.186 -14.758 0.276 1.00 0.00 O ATOM 1302 CB ARG A 520 -5.304 -17.107 1.395 1.00 0.00 C ATOM 1303 CG ARG A 520 -4.292 -17.802 0.478 1.00 0.00 C ATOM 1304 CD ARG A 520 -2.822 -17.582 0.844 1.00 0.00 C ATOM 1305 NE ARG A 520 -2.481 -18.057 2.199 1.00 0.00 N ATOM 1306 CZ ARG A 520 -1.262 -18.096 2.708 1.00 0.00 C ATOM 1307 NH1 ARG A 520 -0.228 -17.714 2.022 1.00 0.00 N ATOM 1308 NH2 ARG A 520 -1.057 -18.533 3.919 1.00 0.00 N ATOM 0 H ARG A 520 -3.514 -14.587 2.026 1.00 0.00 H new ATOM 0 HA ARG A 520 -4.761 -15.271 0.419 1.00 0.00 H new ATOM 0 HB2 ARG A 520 -5.149 -17.449 2.418 1.00 0.00 H new ATOM 0 HB3 ARG A 520 -6.311 -17.410 1.107 1.00 0.00 H new ATOM 0 HG2 ARG A 520 -4.495 -18.873 0.485 1.00 0.00 H new ATOM 0 HG3 ARG A 520 -4.452 -17.454 -0.543 1.00 0.00 H new ATOM 0 HD2 ARG A 520 -2.193 -18.096 0.117 1.00 0.00 H new ATOM 0 HD3 ARG A 520 -2.591 -16.519 0.770 1.00 0.00 H new ATOM 0 HE ARG A 520 -3.247 -18.381 2.790 1.00 0.00 H new ATOM 0 HH11 ARG A 520 -0.346 -17.374 1.068 1.00 0.00 H new ATOM 0 HH12 ARG A 520 0.703 -17.754 2.437 1.00 0.00 H new ATOM 0 HH21 ARG A 520 -1.843 -18.850 4.486 1.00 0.00 H new ATOM 0 HH22 ARG A 520 -0.111 -18.558 4.299 1.00 0.00 H new ATOM 1322 N SER A 521 -7.065 -14.424 2.486 1.00 0.00 N ATOM 1323 CA SER A 521 -8.274 -13.607 2.649 1.00 0.00 C ATOM 1324 C SER A 521 -8.081 -12.118 2.311 1.00 0.00 C ATOM 1325 O SER A 521 -9.039 -11.344 2.373 1.00 0.00 O ATOM 1326 CB SER A 521 -8.809 -13.734 4.083 1.00 0.00 C ATOM 1327 OG SER A 521 -9.146 -15.081 4.388 1.00 0.00 O ATOM 0 H SER A 521 -6.589 -14.590 3.373 1.00 0.00 H new ATOM 0 HA SER A 521 -8.992 -13.999 1.928 1.00 0.00 H new ATOM 0 HB2 SER A 521 -8.058 -13.376 4.787 1.00 0.00 H new ATOM 0 HB3 SER A 521 -9.687 -13.100 4.204 1.00 0.00 H new ATOM 0 HG SER A 521 -9.482 -15.134 5.307 1.00 0.00 H new ATOM 1333 N ALA A 522 -6.862 -11.687 1.958 1.00 0.00 N ATOM 1334 CA ALA A 522 -6.589 -10.300 1.551 1.00 0.00 C ATOM 1335 C ALA A 522 -6.871 -10.105 0.062 1.00 0.00 C ATOM 1336 O ALA A 522 -7.354 -9.064 -0.375 1.00 0.00 O ATOM 1337 CB ALA A 522 -5.128 -9.979 1.838 1.00 0.00 C ATOM 0 H ALA A 522 -6.038 -12.288 1.946 1.00 0.00 H new ATOM 0 HA ALA A 522 -7.240 -9.632 2.114 1.00 0.00 H new ATOM 0 HB1 ALA A 522 -4.916 -8.952 1.540 1.00 0.00 H new ATOM 0 HB2 ALA A 522 -4.933 -10.095 2.904 1.00 0.00 H new ATOM 0 HB3 ALA A 522 -4.489 -10.660 1.276 1.00 0.00 H new ATOM 1343 N TYR A 523 -6.562 -11.137 -0.706 1.00 0.00 N ATOM 1344 CA TYR A 523 -6.763 -11.268 -2.133 1.00 0.00 C ATOM 1345 C TYR A 523 -8.250 -11.169 -2.552 1.00 0.00 C ATOM 1346 O TYR A 523 -9.154 -11.355 -1.701 1.00 0.00 O ATOM 1347 CB TYR A 523 -6.159 -12.638 -2.466 1.00 0.00 C ATOM 1348 CG TYR A 523 -4.647 -12.778 -2.350 1.00 0.00 C ATOM 1349 CD1 TYR A 523 -4.068 -13.177 -1.129 1.00 0.00 C ATOM 1350 CD2 TYR A 523 -3.824 -12.597 -3.478 1.00 0.00 C ATOM 1351 CE1 TYR A 523 -2.684 -13.421 -1.037 1.00 0.00 C ATOM 1352 CE2 TYR A 523 -2.432 -12.813 -3.388 1.00 0.00 C ATOM 1353 CZ TYR A 523 -1.859 -13.229 -2.166 1.00 0.00 C ATOM 1354 OH TYR A 523 -0.522 -13.462 -2.071 1.00 0.00 O ATOM 1355 OXT TYR A 523 -8.506 -10.898 -3.748 1.00 0.00 O ATOM 0 H TYR A 523 -6.129 -11.971 -0.311 1.00 0.00 H new ATOM 0 HA TYR A 523 -6.291 -10.453 -2.683 1.00 0.00 H new ATOM 0 HB2 TYR A 523 -6.618 -13.378 -1.811 1.00 0.00 H new ATOM 0 HB3 TYR A 523 -6.445 -12.894 -3.486 1.00 0.00 H new ATOM 0 HD1 TYR A 523 -4.691 -13.297 -0.255 1.00 0.00 H new ATOM 0 HD2 TYR A 523 -4.260 -12.291 -4.417 1.00 0.00 H new ATOM 0 HE1 TYR A 523 -2.255 -13.755 -0.104 1.00 0.00 H new ATOM 0 HE2 TYR A 523 -1.805 -12.660 -4.254 1.00 0.00 H new ATOM 0 HH TYR A 523 -0.074 -13.131 -2.877 1.00 0.00 H new TER 1365 TYR A 523